A0A3Q0KRS1_SCHMA Loading...

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AlphaFold DB (A0A5K4EUW8), UniProt , Accession A0A3Q0KRS1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,369 aa.

						>A0A3Q0KRS1_SCHMA|A0A3Q0KRS1
MTLRAGASNISVRAWRRYFTLSSVDAVIELMREVFVSCGVVFSDEQTGMKHLKANTINNSDICDIGVDSSIKEPNLAFISIVLGYIENHLTSSTSEDFDSIKIKNTLHRKLVSKRKENLLQNYPRSRSSSLTKSQSPLSVHLETPEEHSEGSNDHLELSNKLSSIPRSLSSNAFLQETIHESPVCRRRARRFGSARRVRQRNESEVSASAATAIESPLTIAAKNEPLQIFTDIPVRKRRRFSDSTIPNSAFPCLTFDELERLYLDFYNLITNSPKLKPFVADTSSFTNGSESKTQKFHCTSTITPAKKYACRALICVICEVLWSQMTASRVKERLTHTQSVYSFLTTGILDSFGLAYTVVAACQLLGYSDVDLALSEDHGWVEFGPPESRQTADVASWVQESHTSASSHNSEFSNFHDDSVQQTEHSRTRKASSSTEDEHNPPSIRIPPLEHSWLYVSGYPVVCRPRIMAVAAAIAAIQPGASLSAVTQAPTSEPFAYGTLSPNPSVSSGGDLITPTGLVKHLSSASVISMQLVTLKHQLLWLCFDAGCLSRYPLGLTNLGDLEDAFPTMGRLATYLNSLHSSVKTNLKCTNDLTNELNVLVDQSNYSSSVSPSTTTTSIVNSHMKLSDWPNSQLPETVSLALALYNRAILVNQYYYSNHHVYPYTCLAGCLYRHGDNRSALRYWAEASKVIGHYNHTSEDWEIYRELLEIATHLMPQMFRSASENSHFCSEGSVDTDPDGCLYQPDNILDDPHCLSYLLSFYDHLCLWEEGSPVPVLHVGWVDKLMVNLTRFTQRARRHLCLSVASDKEDNKSDIVNSPSLTHSTCRSSRWTTESTDTTSETGVLNMNNIKRTRRHRSNQIDSTSNLSTPIAKNDLPKPSDDVDDVNTKLELINDYYTEGNIQSPSSVITNQDITCEMSTVVTKAQNKKSDMETDSLVEANKVSNPYIVKSCRTSVTVEIPEETSNTKISIKESYSPNEKSVPSSTHTNSMFDDVQSDADQILLDTEEQDGSPSPLMDFPNHDDLLASLVEACDHRLLNPAFLWGMEPHSPFLPANVAPEEALNRLMTVLEESKPPTSIIRNSNDIISTETIVHHIFPTPPNSGSFTGSSENIIHEESTSSTTLSHTTLCTSPRVPESSVPEIEKLTSTAITTPIRLENQKHSTNYPVDKNNNLEITLKTSSVLPTEKHTLFPDNFDTVDGGCNNNINNDNNNSDGVLSEDFDLLTNIPNELMDSVASLVVDNHHHHQTDHQINSNSPPTDFFDLLLESGNNLNTTLCNQHQCETENQGQNININDDNNVINQSSTNHRTVKTMEELTVHLPLYSVKMASIIELLRAPRLNSSAIKLALTAQSQVCVRRSSSVHSNYF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	28.8	Very low	41.4	Very low	241 Å²	241	95.4 Å²	95.4	100%	1.187	54%	0.537	S	S	*	.				0	128.5	0	-65.5	168.9	178.7	0	0	106.3
2	T	31.3	Very low	44.1	Very low	129 Å²	129	88.1 Å²	88.1	79%	0.791	50%	0.496	S	S	*	.			cis	-137.7	120.4	4.6	43	0	0	0	0	111.1
3	L	33	Very low	46.4	Very low	46 Å²	46	91.2 Å²	91.2	24%	0.241	50%	0.495	C	S	.	.			trans	-127.9	97.9	156.4	-75	171.9	0	0	0	106.2	R13 L264	L3-R13 PolarHBondContact O-NH1 3.3Å; L3-L264 HydrophobicContact CD1-CD2 4.39Å; L3-L264 HydrophobicContact CD2-CD2 4.16Å
4	R	33.8	Very low	48.7	Very low	242 Å²	242	88.4 Å²	88.4	91%	0.913	49%	0.491	S	S	*	.			trans	-147.8	151.1	173.3	-89.4	-168.1	174.4	-167.1	-1.4	106.4
5	A	31.9	Very low	51.2	Low	84 Å²	84	82.7 Å²	82.7	69%	0.694	46%	0.459	S	S	*	.	S	Bend	trans	69.3	142	-159	0	0	0	0	0	113.2
6	G	39.4	Very low	53.6	Low	23 Å²	23	85.5 Å²	85.5	24%	0.237	46%	0.46	C	S	.	.			trans	90.1	100.3	-168.6	0	0	0	0	0	112.9	S8 N9	G6-S8 VanDerWaalsContact C-N 3.3Å; G6-S8 PolarHBondContact O-N 3.31Å; G6-N9 PolarHBondContact O-N 2.93Å
7	A	41.8	Very low	55.7	Low	80 Å²	80	89.8 Å²	89.8	66%	0.661	47%	0.468	S	S	*	.	G	3₁₀ helix	trans	-65.6	-29.8	-176.6	0	0	0	0	0	113.6	N9	A7-N9 VanDerWaalsContact C-N 3.28Å; A7-N9 PolarHBondContact O-N 3.19Å
8	S	48.9	Very low	57.7	Low	54 Å²	54	87.2 Å²	87.2	38%	0.378	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-62.9	-27.6	176.7	49.5	0	0	0	0	113.9	G6 I10 S11	G6-S8 VanDerWaalsContact C-N 3.3Å; G6-S8 PolarHBondContact O-N 3.31Å; S8-I10 PolarHBondContact O-N 3.04Å; S8-I10 VanDerWaalsContact O-N 3.11Å; S8-S11 PolarHBondContact O-OG 2.8Å; S8-S11 VanDerWaalsContact O-OG 3.05Å
9	N	51.1	Low	59.6	Low	18 Å²	18	84.6 Å²	84.6	10%	0.096	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-74	1.6	-176.1	-74.8	-46.9	0	0	0	114.6	G6 A7 Y263	G6-N9 PolarHBondContact O-N 2.93Å; A7-N9 VanDerWaalsContact C-N 3.28Å; A7-N9 PolarHBondContact O-N 3.19Å; N9-Y263 PolarHBondContact OD1-OH 2.83Å
10	I	52.5	Low	61.3	Low	117 Å²	117	83.8 Å²	83.8	60%	0.6	44%	0.436	S	S	*	.	H	α-helix	trans	-75.3	-32.7	176.9	-62	175.5	0	0	0	111.3	S8 A14	S8-I10 PolarHBondContact O-N 3.04Å; S8-I10 VanDerWaalsContact O-N 3.11Å; I10-A14 PolarHBondContact O-N 3.19Å
11	S	63	Low	62.9	Low	15 Å²	15	79.8 Å²	79.8	11%	0.105	42%	0.415	C	S	.	.	H	α-helix	trans	-65.2	-51.1	-175.6	55.5	0	0	0	0	113.2	S8 R13 A14 W15	S8-S11 PolarHBondContact O-OG 2.8Å; S8-S11 VanDerWaalsContact O-OG 3.05Å; S11-R13 PolarHBondContact O-N 3.4Å; S11-A14 WeakPolarHBondContact O-CA 3.26Å; S11-A14 WeakPolarHBondContact O-CB 3.06Å; S11-A14 PolarHBondContact O-N 3.47Å; S11-W15 PolarHBondContact O-N 3.33Å
12	V	73.2	Confident	66	Low	8 Å²	8	71.3 Å²	71.3	5%	0.048	38%	0.379	C	S	.	.	H	α-helix	trans	-49.6	-39.4	179.9	178	0	0	0	0	112	F78 F256 Y263	V12-F78 HydrophobicContact CB-CD2 4.26Å; V12-F78 HydrophobicContact CG1-CD2 3.81Å; V12-F78 HydrophobicContact CG1-CE2 3.96Å; V12-F78 HydrophobicContact CG2-CB 4.26Å; V12-F78 HydrophobicContact CG2-CD2 3.84Å; V12-F78 HydrophobicContact CG2-CG 4.26Å; V12-F256 HydrophobicContact CG1-CE2 4.39Å; V12-F256 HydrophobicContact CG1-CZ 4.39Å; V12-F256 WeakPolarHBondContact O-CE2 3.41Å; V12-Y263 HydrophobicContact CG2-CE1 4.48Å; V12-Y263 HydrophobicContact CG2-CE2 4.38Å
13	R	74.8	Confident	69	Low	129 Å²	129	67 Å²	67	49%	0.487	35%	0.354	S	S	.	.	H	α-helix	trans	-76.8	-33.3	177.6	-77.7	-176.3	167.8	150.9	0.6	114.5	L3 S11 W15 R16	L3-R13 PolarHBondContact O-NH1 3.3Å; S11-R13 PolarHBondContact O-N 3.4Å; R13-W15 VanDerWaalsContact C-N 3.28Å; R13-R16 WeakPolarHBondContact O-CB 3.49Å; R13-R16 PolarHBondContact O-N 3.35Å
14	A	78.4	Confident	71.9	Confident	52 Å²	52	65.7 Å²	65.7	43%	0.43	35%	0.348	S	S	.	.	H	α-helix	trans	-64.6	-38.5	174.3	0	0	0	0	0	110.8	I10 S11 R16	I10-A14 PolarHBondContact O-N 3.19Å; S11-A14 WeakPolarHBondContact O-CA 3.26Å; S11-A14 WeakPolarHBondContact O-CB 3.06Å; S11-A14 PolarHBondContact O-N 3.47Å; A14-R16 PolarHBondContact O-N 3.32Å
15	W	85.8	Confident	74.9	Confident	3 Å²	3	59 Å²	59	1%	0.011	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-72	-8.5	178.7	-59.6	-33	0	0	0	114.6	S11 R13 R17 Y18 F19 L30 V34 N75 F78	S11-W15 PolarHBondContact O-N 3.33Å; R13-W15 VanDerWaalsContact C-N 3.28Å; W15-R17 PolarHBondContact O-N 3.38Å; W15-Y18 PolarHBondContact O-N 3.13Å; W15-Y18 VanDerWaalsContact O-N 3.07Å; W15-F19 WeakPolarHBondContact O-CD2 3.37Å; W15-L30 HydrophobicContact CB-CD1 3.72Å; W15-L30 HydrophobicContact CD2-CD1 4.44Å; W15-L30 HydrophobicContact CG-CD1 3.87Å; W15-V34 HydrophobicContact CD2-CG2 4.1Å; W15-V34 HydrophobicContact CE3-CG2 4.37Å; W15-V34 HydrophobicContact CH2-CB 4.5Å; W15-V34 HydrophobicContact CH2-CG1 4.2Å; W15-V34 HydrophobicContact CH2-CG2 3.89Å; W15-V34 HydrophobicContact CZ2-CB 4.06Å; W15-V34 HydrophobicContact CZ2-CG1 4.13Å; W15-V34 HydrophobicContact CZ2-CG2 3.59Å; W15-V34 HydrophobicContact CZ3-CG2 4.27Å; W15-N75 HydrophobicContact CH2-CB 4.44Å; W15-N75 HydrophobicContact CZ3-CB 4.18Å; W15-F78 HydrophobicContact CB-CZ 4.17Å; W15-F78 HydrophobicContact CD2-CE1 4.29Å; W15-F78 HydrophobicContact CD2-CZ 4.44Å; W15-F78 AromaticContact CE3-CD1 3.69Å; W15-F78 HydrophobicContact CE3-CD1 3.69Å; W15-F78 HydrophobicContact CE3-CD2 4.41Å; W15-F78 AromaticContact CE3-CE1 3.42Å; W15-F78 HydrophobicContact CE3-CE1 3.42Å; W15-F78 VanDerWaalsContact CE3-CE1 3.42Å; W15-F78 HydrophobicContact CE3-CE2 4.15Å; W15-F78 HydrophobicContact CE3-CG 4.19Å; W15-F78 AromaticContact CE3-CZ 3.68Å; W15-F78 HydrophobicContact CE3-CZ 3.68Å; W15-F78 AromaticContact CZ3-CD1 3.63Å; W15-F78 HydrophobicContact CZ3-CD1 3.63Å; W15-F78 AromaticContact CZ3-CE1 3.85Å; W15-F78 HydrophobicContact CZ3-CE1 3.85Å; W15-F78 HydrophobicContact CZ3-CG 4.1Å; W15-F78 HydrophobicContact CZ3-CZ 4.46Å
16	R	89.3	Confident	77.9	Confident	127 Å²	127	56.1 Å²	56.1	48%	0.479	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-53.9	-26.6	174.5	-173.1	168.2	-160.6	-172.7	12.4	113.2	R13 A14 Y18 F19 F256 D257	R13-R16 WeakPolarHBondContact O-CB 3.49Å; R13-R16 PolarHBondContact O-N 3.35Å; A14-R16 PolarHBondContact O-N 3.32Å; R16-Y18 PolarHBondContact O-N 2.95Å; R16-F19 PolarHBondContact O-N 2.78Å; R16-F256 HydrophobicContact CB-CD2 3.76Å; R16-F256 HydrophobicContact CB-CE1 4.49Å; R16-F256 HydrophobicContact CB-CE2 3.66Å; R16-F256 HydrophobicContact CB-CG 4.22Å; R16-F256 HydrophobicContact CB-CZ 4.05Å; R16-F256 HydrophobicContact CG-CB 4.17Å; R16-F256 HydrophobicContact CG-CD1 3.87Å; R16-F256 HydrophobicContact CG-CD2 3.67Å; R16-F256 HydrophobicContact CG-CE1 4.15Å; R16-F256 HydrophobicContact CG-CE2 3.98Å; R16-F256 HydrophobicContact CG-CG 3.6Å; R16-F256 HydrophobicContact CG-CZ 4.2Å; R16-D257 IonicContact CZ-OD1 3.47Å; R16-D257 IonicContact NH2-OD1 3.96Å; R16-D257 PolarHBondContact NH2-OD1 3.25Å; R16-D257 IonicContact NH2-OD2 3.92Å
17	R	90.5	Very high	80.6	Confident	158 Å²	158	55 Å²	55	60%	0.596	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-64.7	-16.3	179.1	77.4	-177.1	-164.9	-131.4	5.7	115	W15 E33	W15-R17 PolarHBondContact O-N 3.38Å; R17-E33 IonicContact CZ-OE1 3.24Å; R17-E33 IonicContact CZ-OE2 3Å; R17-E33 IonicContact NH1-OE1 3.7Å; R17-E33 PolarHBondContact NH1-OE1 2.9Å; R17-E33 IonicContact NH2-OE1 2.72Å; R17-E33 PolarHBondContact NH2-OE1 3.34Å; R17-E33 IonicContact NH2-OE2 2.67Å; R17-E33 PolarHBondContact NH2-OE2 3.06Å
18	Y	91.7	Very high	83.3	Confident	44 Å²	44	51.9 Å²	51.9	17%	0.173	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-90.6	-5.1	178.8	-67.2	-90.6	0	0	0	113.6	W15 R16 L21 E29 L30 E33	W15-Y18 PolarHBondContact O-N 3.13Å; W15-Y18 VanDerWaalsContact O-N 3.07Å; R16-Y18 PolarHBondContact O-N 2.95Å; Y18-L21 WeakPolarHBondContact O-CD2 3.37Å; Y18-E29 HydrophobicContact CD1-CB 4.22Å; Y18-E29 HydrophobicContact CE1-CB 4.06Å; Y18-E29 WeakPolarHBondContact CE1-O 3.42Å; Y18-L30 HydrophobicContact CD1-CB 4.33Å; Y18-L30 HydrophobicContact CD2-CD1 4.18Å; Y18-L30 HydrophobicContact CG-CB 4.23Å; Y18-L30 HydrophobicContact CG-CD1 4.23Å; Y18-E33 HydrophobicContact CE1-CB 4.43Å; Y18-E33 HydrophobicContact CE2-CB 3.85Å; Y18-E33 HydrophobicContact CE2-CG 3.72Å; Y18-E33 WeakPolarHBondContact OH-CB 3.36Å; Y18-E33 PolarHBondContact OH-OE2 2.97Å
19	F	92.9	Very high	85.5	Confident	37 Å²	37	53.4 Å²	53.4	16%	0.162	27%	0.269	C	S	.	.			trans	-95	143.6	-176.4	-70.4	-98.6	0	0	0	111.2	W15 R16 L21 L30 F78 L254 F256 L259	W15-F19 WeakPolarHBondContact O-CD2 3.37Å; R16-F19 PolarHBondContact O-N 2.78Å; F19-L21 HydrophobicContact CD1-CD1 4.25Å; F19-L21 HydrophobicContact CD1-CG 3.92Å; F19-L21 HydrophobicContact CE1-CD1 3.49Å; F19-L21 VanDerWaalsContact CE1-CD1 3.49Å; F19-L21 HydrophobicContact CE1-CG 3.67Å; F19-L21 HydrophobicContact CG-CG 4.47Å; F19-L21 HydrophobicContact CZ-CD1 3.63Å; F19-L21 HydrophobicContact CZ-CG 4.01Å; F19-L30 HydrophobicContact CE2-CD2 4.22Å; F19-L30 HydrophobicContact CZ-CD2 4.07Å; F19-F78 HydrophobicContact CE2-CZ 4.16Å; F19-F78 HydrophobicContact CZ-CE2 4.44Å; F19-F78 HydrophobicContact CZ-CZ 4.05Å; F19-L254 HydrophobicContact CE1-CD2 4.38Å; F19-L254 HydrophobicContact CE1-CG 4.27Å; F19-F256 HydrophobicContact CB-CB 3.78Å; F19-F256 HydrophobicContact CD1-CB 4.1Å; F19-F256 HydrophobicContact CD2-CB 4.36Å; F19-F256 AromaticContact CD2-CD2 3.85Å; F19-F256 HydrophobicContact CD2-CD2 3.85Å; F19-F256 HydrophobicContact CE2-CD2 4.14Å; F19-F256 HydrophobicContact CG-CB 3.8Å; F19-F256 HydrophobicContact CG-CD2 4.13Å; F19-F256 HydrophobicContact CG-CG 4.49Å; F19-L259 HydrophobicContact CE1-CB 4.41Å; F19-L259 HydrophobicContact CE1-CD2 3.5Å; F19-L259 HydrophobicContact CE2-CD2 4.29Å; F19-L259 HydrophobicContact CZ-CD2 3.26Å
20	T	93.8	Very high	87.6	Confident	69 Å²	69	52.6 Å²	52.6	42%	0.423	26%	0.264	S	S	.	.	S	Bend	cis	-75.8	135.9	6.4	53.4	0	0	0	0	114.2	S22 T255	T20-S22 PolarHBondContact O-N 2.96Å; T20-T255 HydrophobicContact CG2-CG2 3.97Å
21	L	95.1	Very high	89.6	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-78.4	105.9	170.2	-60.9	174.3	0	0	0	108.1	Y18 F19 A26 V27 L30 V82 P252 C253 L254	Y18-L21 WeakPolarHBondContact O-CD2 3.37Å; F19-L21 HydrophobicContact CD1-CD1 4.25Å; F19-L21 HydrophobicContact CD1-CG 3.92Å; F19-L21 HydrophobicContact CE1-CD1 3.49Å; F19-L21 VanDerWaalsContact CE1-CD1 3.49Å; F19-L21 HydrophobicContact CE1-CG 3.67Å; F19-L21 HydrophobicContact CG-CG 4.47Å; F19-L21 HydrophobicContact CZ-CD1 3.63Å; F19-L21 HydrophobicContact CZ-CG 4.01Å; L21-A26 HydrophobicContact CD2-CB 4.14Å; L21-A26 WeakPolarHBondContact CD2-O 3.39Å; L21-V27 HydrophobicContact CB-CG2 4.27Å; L21-V27 HydrophobicContact CD1-CG2 4.4Å; L21-V27 HydrophobicContact CD2-CG2 4.38Å; L21-L30 HydrophobicContact CD1-CD2 3.7Å; L21-L30 HydrophobicContact CD2-CB 4.22Å; L21-L30 HydrophobicContact CD2-CD2 4Å; L21-L30 HydrophobicContact CG-CD2 4.43Å; L21-V82 HydrophobicContact CD1-CG1 3.82Å; L21-V82 HydrophobicContact CD1-CG2 4.48Å; L21-P252 VanDerWaalsContact O-O 3.13Å; L21-C253 CarbonylContact O-C 3.56Å; L21-C253 WeakPolarHBondContact O-CA 3.03Å; L21-L254 HydrophobicContact CB-CB 4.38Å; L21-L254 HydrophobicContact CD1-CD2 4.45Å; L21-L254 PolarHBondContact N-O 3.41Å; L21-L254 PolarHBondContact O-N 2.93Å
22	S	93.8	Very high	91.1	Very high	62 Å²	62	50.5 Å²	50.5	43%	0.434	25%	0.246	S	C	.	.			trans	-133.1	8.3	-172.8	57.9	0	0	0	0	114.6	T20 F251	T20-S22 PolarHBondContact O-N 2.96Å; S22-F251 VanDerWaalsContact C-CD1 3.42Å
23	S	94.9	Very high	92	Very high	38 Å²	38	52 Å²	52	27%	0.266	25%	0.253	S	S	.	.	S	Bend	trans	-146.4	167.9	168.3	78.8	0	0	0	0	110.4	D25 A26	S23-D25 VanDerWaalsContact C-N 3.31Å; S23-D25 PolarHBondContact O-N 3.31Å; S23-D25 PolarHBondContact OG-N 3.19Å; S23-D25 PolarHBondContact OG-OD2 2.89Å; S23-A26 PolarHBondContact O-N 2.8Å; S23-A26 PolarHBondContact OG-N 3.47Å
24	V	94.5	Very high	92.8	Very high	19 Å²	19	45.8 Å²	45.8	12%	0.115	23%	0.229	C	C	.	.	H	α-helix	trans	-54.6	-49.4	169.5	175.3	0	0	0	0	110.1	A26 V27 I28 F251 T535 L536 Q539	V24-A26 VanDerWaalsContact C-N 3.3Å; V24-A26 PolarHBondContact O-N 2.94Å; V24-V27 WeakPolarHBondContact O-CA 3.32Å; V24-V27 WeakPolarHBondContact O-CB 3.42Å; V24-V27 PolarHBondContact O-N 3.28Å; V24-I28 HydrophobicContact CG1-CD1 4.4Å; V24-I28 HydrophobicContact CG1-CG1 4.17Å; V24-I28 WeakPolarHBondContact O-CG1 3.42Å; V24-I28 PolarHBondContact O-N 2.61Å; V24-F251 HydrophobicContact CG2-CD2 4.02Å; V24-F251 HydrophobicContact CG2-CE2 3.73Å; V24-T535 HydrophobicContact CG1-CG2 4.48Å; V24-L536 HydrophobicContact CG1-CB 4.11Å; V24-L536 HydrophobicContact CG1-CD1 3.9Å; V24-L536 HydrophobicContact CG2-CB 4.32Å; V24-Q539 VanDerWaalsContact CG1-OE1 3.31Å
25	D	95.4	Very high	93.4	Very high	102 Å²	102	43.3 Å²	43.3	55%	0.545	21%	0.209	S	C	.	.	H	α-helix	trans	-58.6	-38.9	-176.3	-30.1	-79.4	0	0	0	112.5	S23 V27 I28 E29	S23-D25 VanDerWaalsContact C-N 3.31Å; S23-D25 PolarHBondContact O-N 3.31Å; S23-D25 PolarHBondContact OG-N 3.19Å; S23-D25 PolarHBondContact OG-OD2 2.89Å; D25-V27 PolarHBondContact O-N 2.73Å; D25-I28 PolarHBondContact O-N 3.31Å; D25-E29 WeakPolarHBondContact O-CB 3.41Å; D25-E29 PolarHBondContact O-N 3.49Å
26	A	95.7	Very high	93.7	Very high	23 Å²	23	46.6 Å²	46.6	19%	0.19	23%	0.229	C	C	.	.	H	α-helix	trans	-62.2	-31.7	176.9	0	0	0	0	0	112.4	L21 S23 V24 L30	L21-A26 HydrophobicContact CD2-CB 4.14Å; L21-A26 WeakPolarHBondContact CD2-O 3.39Å; S23-A26 PolarHBondContact O-N 2.8Å; S23-A26 PolarHBondContact OG-N 3.47Å; V24-A26 VanDerWaalsContact C-N 3.3Å; V24-A26 PolarHBondContact O-N 2.94Å; A26-L30 WeakPolarHBondContact O-CB 3.19Å; A26-L30 PolarHBondContact O-N 3.01Å; A26-L30 VanDerWaalsContact O-N 3.15Å
27	V	96.5	Very high	93.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-79.8	-38.4	176.5	-175.1	0	0	0	0	110.8	L21 V24 D25 L30 M31 I86 F251 L536	L21-V27 HydrophobicContact CB-CG2 4.27Å; L21-V27 HydrophobicContact CD1-CG2 4.4Å; L21-V27 HydrophobicContact CD2-CG2 4.38Å; V24-V27 WeakPolarHBondContact O-CA 3.32Å; V24-V27 WeakPolarHBondContact O-CB 3.42Å; V24-V27 PolarHBondContact O-N 3.28Å; D25-V27 PolarHBondContact O-N 2.73Å; V27-L30 PolarHBondContact O-N 3.49Å; V27-M31 WeakPolarHBondContact O-CG 3.39Å; V27-M31 PolarHBondContact O-N 2.89Å; V27-I86 HydrophobicContact CB-CD1 4.45Å; V27-I86 HydrophobicContact CG1-CD1 4.01Å; V27-I86 HydrophobicContact CG2-CD1 3.58Å; V27-F251 HydrophobicContact CG2-CE1 4.27Å; V27-F251 HydrophobicContact CG2-CZ 4.01Å; V27-L536 HydrophobicContact CB-CD1 3.93Å; V27-L536 HydrophobicContact CG1-CD1 3.88Å
28	I	96.9	Very high	93.4	Very high	15 Å²	15	35 Å²	35	8%	0.077	19%	0.192	C	C	.	.	H	α-helix	trans	-59.5	-46.8	171.9	-55.8	-50.1	0	0	0	110.6	V24 D25 L30 M31 R32 L536 Q539 L540 L543	V24-I28 HydrophobicContact CG1-CD1 4.4Å; V24-I28 HydrophobicContact CG1-CG1 4.17Å; V24-I28 WeakPolarHBondContact O-CG1 3.42Å; V24-I28 PolarHBondContact O-N 2.61Å; D25-I28 PolarHBondContact O-N 3.31Å; I28-L30 PolarHBondContact O-N 2.98Å; I28-M31 PolarHBondContact O-N 3.05Å; I28-R32 WeakPolarHBondContact O-CB 3.44Å; I28-R32 PolarHBondContact O-N 3.31Å; I28-L536 HydrophobicContact CD1-CD1 3.98Å; I28-Q539 HydrophobicContact CD1-CB 3.65Å; I28-Q539 HydrophobicContact CG1-CB 4.17Å; I28-L540 HydrophobicContact CD1-CD2 3.55Å; I28-L540 HydrophobicContact CD1-CG 3.62Å; I28-L543 HydrophobicContact CG2-CD2 4.34Å
29	E	95.2	Very high	93.1	Very high	86 Å²	86	34.6 Å²	34.6	40%	0.402	20%	0.201	S	C	.	.	H	α-helix	trans	-66.2	-36.7	179.5	-79.8	-64	105.9	0	0	113	Y18 D25 R32 E33	Y18-E29 HydrophobicContact CD1-CB 4.22Å; Y18-E29 HydrophobicContact CE1-CB 4.06Å; Y18-E29 WeakPolarHBondContact CE1-O 3.42Å; D25-E29 WeakPolarHBondContact O-CB 3.41Å; D25-E29 PolarHBondContact O-N 3.49Å; E29-R32 PolarHBondContact O-N 2.98Å; E29-R32 IonicContact OE1-CZ 3.78Å; E29-R32 IonicContact OE1-NE 2.92Å; E29-R32 PolarHBondContact OE1-NE 3.36Å; E29-E33 PolarHBondContact O-N 3.29Å; E29-E33 VanDerWaalsContact O-N 3.09Å
30	L	95.2	Very high	92.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.7	-49.2	169.7	172	60	0	0	0	111.1	W15 Y18 F19 L21 A26 V27 I28 R32 E33 V34 F78	W15-L30 HydrophobicContact CB-CD1 3.72Å; W15-L30 HydrophobicContact CD2-CD1 4.44Å; W15-L30 HydrophobicContact CG-CD1 3.87Å; Y18-L30 HydrophobicContact CD1-CB 4.33Å; Y18-L30 HydrophobicContact CD2-CD1 4.18Å; Y18-L30 HydrophobicContact CG-CB 4.23Å; Y18-L30 HydrophobicContact CG-CD1 4.23Å; F19-L30 HydrophobicContact CE2-CD2 4.22Å; F19-L30 HydrophobicContact CZ-CD2 4.07Å; L21-L30 HydrophobicContact CD1-CD2 3.7Å; L21-L30 HydrophobicContact CD2-CB 4.22Å; L21-L30 HydrophobicContact CD2-CD2 4Å; L21-L30 HydrophobicContact CG-CD2 4.43Å; A26-L30 WeakPolarHBondContact O-CB 3.19Å; A26-L30 PolarHBondContact O-N 3.01Å; A26-L30 VanDerWaalsContact O-N 3.15Å; V27-L30 PolarHBondContact O-N 3.49Å; I28-L30 PolarHBondContact O-N 2.98Å; L30-R32 VanDerWaalsContact C-N 3.3Å; L30-R32 PolarHBondContact O-N 3.39Å; L30-E33 PolarHBondContact O-N 3.03Å; L30-V34 HydrophobicContact CD1-CG2 4.28Å; L30-V34 VanDerWaalsContact O-CG2 3.28Å; L30-V34 WeakPolarHBondContact O-CG2 3.49Å; L30-V34 PolarHBondContact O-N 3.26Å; L30-F78 HydrophobicContact CD1-CE1 4.36Å; L30-F78 HydrophobicContact CD1-CZ 4.42Å; L30-F78 HydrophobicContact CD2-CE1 4.14Å; L30-F78 HydrophobicContact CD2-CZ 4.24Å
31	M	95.1	Very high	92.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67.3	-31.1	-179.4	-65.9	-58.1	-177.7	0	0	112.3	V27 I28 V34 F35 I79 V82 L83 L540 L543	V27-M31 WeakPolarHBondContact O-CG 3.39Å; V27-M31 PolarHBondContact O-N 2.89Å; I28-M31 PolarHBondContact O-N 3.05Å; M31-V34 WeakPolarHBondContact O-CB 3.44Å; M31-V34 PolarHBondContact O-N 3Å; M31-V34 HydrophobicContact SD-CG2 4.38Å; M31-F35 VanDerWaalsContact O-CD2 3.26Å; M31-F35 WeakPolarHBondContact O-CD2 3.38Å; M31-F35 WeakPolarHBondContact O-CG 3.47Å; M31-F35 PolarHBondContact O-N 3.29Å; M31-I79 HydrophobicContact CE-CG2 4.02Å; M31-I79 HydrophobicContact SD-CG1 4.5Å; M31-V82 HydrophobicContact CE-CG1 4.4Å; M31-L83 HydrophobicContact CE-CD1 4.5Å; M31-L83 HydrophobicContact CE-CD2 3.87Å; M31-L83 HydrophobicContact CE-CG 4.02Å; M31-L540 HydrophobicContact CB-CD2 3.78Å; M31-L540 HydrophobicContact CG-CD2 3.68Å; M31-L543 HydrophobicContact CB-CD2 3.89Å
32	R	94.5	Very high	91.8	Very high	89 Å²	89	36.4 Å²	36.4	34%	0.336	21%	0.211	S	C	.	.	H	α-helix	trans	-61	-48.7	170.8	-172.4	-173	-60.1	-72.4	1.7	111	I28 E29 L30 V34 F35 V36 F42 L543	I28-R32 WeakPolarHBondContact O-CB 3.44Å; I28-R32 PolarHBondContact O-N 3.31Å; E29-R32 PolarHBondContact O-N 2.98Å; E29-R32 IonicContact OE1-CZ 3.78Å; E29-R32 IonicContact OE1-NE 2.92Å; E29-R32 PolarHBondContact OE1-NE 3.36Å; L30-R32 VanDerWaalsContact C-N 3.3Å; L30-R32 PolarHBondContact O-N 3.39Å; R32-V34 VanDerWaalsContact C-N 3.33Å; R32-V34 PolarHBondContact O-N 2.7Å; R32-F35 PolarHBondContact O-N 2.81Å; R32-V36 WeakPolarHBondContact O-CG2 3.45Å; R32-V36 PolarHBondContact O-N 2.94Å; R32-F42 HydrophobicContact CG-CD2 4.04Å; R32-F42 HydrophobicContact CG-CE2 3.78Å; R32-L543 HydrophobicContact CB-CD1 4.4Å; R32-L543 HydrophobicContact CB-CD2 4.39Å; R32-L543 HydrophobicContact CG-CD1 4.5Å
33	E	92.3	Very high	90.4	Very high	38 Å²	38	36.6 Å²	36.6	18%	0.178	21%	0.213	C	C	.	.	H	α-helix	trans	-64.4	-35.1	174.7	177.8	76.8	169.5	0	0	112.3	R17 Y18 E29 L30 S37	R17-E33 IonicContact CZ-OE1 3.24Å; R17-E33 IonicContact CZ-OE2 3Å; R17-E33 IonicContact NH1-OE1 3.7Å; R17-E33 PolarHBondContact NH1-OE1 2.9Å; R17-E33 IonicContact NH2-OE1 2.72Å; R17-E33 PolarHBondContact NH2-OE1 3.34Å; R17-E33 IonicContact NH2-OE2 2.67Å; R17-E33 PolarHBondContact NH2-OE2 3.06Å; Y18-E33 HydrophobicContact CE1-CB 4.43Å; Y18-E33 HydrophobicContact CE2-CB 3.85Å; Y18-E33 HydrophobicContact CE2-CG 3.72Å; Y18-E33 WeakPolarHBondContact OH-CB 3.36Å; Y18-E33 PolarHBondContact OH-OE2 2.97Å; E29-E33 PolarHBondContact O-N 3.29Å; E29-E33 VanDerWaalsContact O-N 3.09Å; L30-E33 PolarHBondContact O-N 3.03Å; E33-S37 WeakPolarHBondContact O-CB 3.48Å; E33-S37 PolarHBondContact O-N 2.96Å; E33-S37 PolarHBondContact O-OG 2.8Å
34	V	91	Very high	88.3	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-49.4	173.1	170.6	0	0	0	0	109.8	W15 L30 M31 R32 S37 C38 P74 I79	W15-V34 HydrophobicContact CD2-CG2 4.1Å; W15-V34 HydrophobicContact CE3-CG2 4.37Å; W15-V34 HydrophobicContact CH2-CB 4.5Å; W15-V34 HydrophobicContact CH2-CG1 4.2Å; W15-V34 HydrophobicContact CH2-CG2 3.89Å; W15-V34 HydrophobicContact CZ2-CB 4.06Å; W15-V34 HydrophobicContact CZ2-CG1 4.13Å; W15-V34 HydrophobicContact CZ2-CG2 3.59Å; W15-V34 HydrophobicContact CZ3-CG2 4.27Å; L30-V34 HydrophobicContact CD1-CG2 4.28Å; L30-V34 VanDerWaalsContact O-CG2 3.28Å; L30-V34 WeakPolarHBondContact O-CG2 3.49Å; L30-V34 PolarHBondContact O-N 3.26Å; M31-V34 WeakPolarHBondContact O-CB 3.44Å; M31-V34 PolarHBondContact O-N 3Å; M31-V34 HydrophobicContact SD-CG2 4.38Å; R32-V34 VanDerWaalsContact C-N 3.33Å; R32-V34 PolarHBondContact O-N 2.7Å; V34-S37 WeakPolarHBondContact O-CB 3.49Å; V34-S37 PolarHBondContact O-N 2.88Å; V34-C38 PolarHBondContact O-N 2.95Å; V34-C38 VanDerWaalsContact O-N 3.1Å; V34-C38 PolarHBondContact O-SG 3.17Å; V34-P74 HydrophobicContact CG1-CB 4.24Å; V34-I79 HydrophobicContact CG1-CD1 3.92Å
35	F	92	Very high	85.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.5	-42.9	178.8	-64.7	-35.2	0	0	0	112.8	M31 R32 S37 C38 G39 V40 F42 I468 V471 I475 L543 A547	M31-F35 VanDerWaalsContact O-CD2 3.26Å; M31-F35 WeakPolarHBondContact O-CD2 3.38Å; M31-F35 WeakPolarHBondContact O-CG 3.47Å; M31-F35 PolarHBondContact O-N 3.29Å; R32-F35 PolarHBondContact O-N 2.81Å; F35-S37 VanDerWaalsContact C-N 3.3Å; F35-S37 PolarHBondContact O-N 3.24Å; F35-C38 CarbonylContact O-C 3.43Å; F35-C38 WeakPolarHBondContact O-CA 3.32Å; F35-C38 WeakPolarHBondContact O-CB 3.49Å; F35-C38 PolarHBondContact O-N 3.38Å; F35-G39 PolarHBondContact O-N 3.05Å; F35-V40 HydrophobicContact CB-CB 4.05Å; F35-V40 HydrophobicContact CB-CG1 4.49Å; F35-V40 HydrophobicContact CB-CG2 3.99Å; F35-V40 VanDerWaalsContact O-CB 3.32Å; F35-V40 WeakPolarHBondContact O-CB 3.31Å; F35-V40 WeakPolarHBondContact O-CG2 3.09Å; F35-V40 PolarHBondContact O-N 3.11Å; F35-F42 HydrophobicContact CB-CE2 4.09Å; F35-F42 HydrophobicContact CB-CZ 3.99Å; F35-F42 HydrophobicContact CD2-CZ 4.12Å; F35-I468 HydrophobicContact CD1-CD1 3.65Å; F35-I468 HydrophobicContact CD1-CG1 3.81Å; F35-I468 HydrophobicContact CE1-CD1 4.17Å; F35-I468 HydrophobicContact CE1-CG1 3.85Å; F35-I468 HydrophobicContact CG-CD1 4.46Å; F35-V471 HydrophobicContact CE1-CB 4.08Å; F35-V471 HydrophobicContact CE1-CG1 3.68Å; F35-V471 HydrophobicContact CZ-CG1 3.81Å; F35-I475 HydrophobicContact CZ-CD1 4.47Å; F35-L543 HydrophobicContact CD2-CD2 3.84Å; F35-L543 HydrophobicContact CD2-CG 3.87Å; F35-L543 HydrophobicContact CE2-CD2 3.77Å; F35-L543 HydrophobicContact CE2-CG 3.86Å; F35-A547 HydrophobicContact CD2-CB 4.29Å; F35-A547 HydrophobicContact CG-CB 4.49Å
36	V	91.2	Very high	83	Confident	71 Å²	71	53.6 Å²	53.6	43%	0.43	29%	0.288	S	S	.	.	H	α-helix	trans	-60.8	-38.8	172.7	172.3	0	0	0	0	111.4	R32 C38 G39 F42	R32-V36 WeakPolarHBondContact O-CG2 3.45Å; R32-V36 PolarHBondContact O-N 2.94Å; V36-C38 PolarHBondContact O-N 2.95Å; V36-G39 PolarHBondContact O-N 3.04Å; V36-F42 HydrophobicContact CG2-CD2 3.87Å; V36-F42 HydrophobicContact CG2-CE2 3.95Å
37	S	87.2	Confident	80	Confident	28 Å²	28	57.7 Å²	57.7	20%	0.196	31%	0.311	C	S	.	.	H	α-helix	trans	-63.6	-25	173.8	-63	0	0	0	0	113	E33 V34 F35 G39	E33-S37 WeakPolarHBondContact O-CB 3.48Å; E33-S37 PolarHBondContact O-N 2.96Å; E33-S37 PolarHBondContact O-OG 2.8Å; V34-S37 WeakPolarHBondContact O-CB 3.49Å; V34-S37 PolarHBondContact O-N 2.88Å; F35-S37 VanDerWaalsContact C-N 3.3Å; F35-S37 PolarHBondContact O-N 3.24Å; S37-G39 VanDerWaalsContact C-N 3.32Å
38	C	86.4	Confident	76.8	Confident	15 Å²	15	61.3 Å²	61.3	10%	0.101	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	9.1	173.7	-57.8	0	0	0	0	113.2	V34 F35 V36 K72 I468	V34-C38 PolarHBondContact O-N 2.95Å; V34-C38 VanDerWaalsContact O-N 3.1Å; V34-C38 PolarHBondContact O-SG 3.17Å; F35-C38 CarbonylContact O-C 3.43Å; F35-C38 WeakPolarHBondContact O-CA 3.32Å; F35-C38 WeakPolarHBondContact O-CB 3.49Å; F35-C38 PolarHBondContact O-N 3.38Å; V36-C38 PolarHBondContact O-N 2.95Å; C38-K72 WeakPolarHBondContact CA-O 3.41Å; C38-K72 PolarHBondContact SG-O 3.48Å; C38-K72 VanDerWaalsContact SG-O 3.38Å; C38-I468 HydrophobicContact CB-CD1 4.19Å
39	G	85.8	Confident	73.6	Confident	35 Å²	35	63.2 Å²	63.2	36%	0.361	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	7.4	177.1	0	0	0	0	0	115.4	F35 V36 S37 L52	F35-G39 PolarHBondContact O-N 3.05Å; V36-G39 PolarHBondContact O-N 3.04Å; S37-G39 VanDerWaalsContact C-N 3.32Å; G39-L52 WeakPolarHBondContact O-CD1 3.28Å
40	V	86.2	Confident	70.5	Confident	14 Å²	14	68 Å²	68	9%	0.085	38%	0.376	C	S	.	.			trans	-68.7	130.6	173.6	178.5	0	0	0	0	109.9	F35 F42 I468 A547	F35-V40 HydrophobicContact CB-CB 4.05Å; F35-V40 HydrophobicContact CB-CG1 4.49Å; F35-V40 HydrophobicContact CB-CG2 3.99Å; F35-V40 VanDerWaalsContact O-CB 3.32Å; F35-V40 WeakPolarHBondContact O-CB 3.31Å; F35-V40 WeakPolarHBondContact O-CG2 3.09Å; F35-V40 PolarHBondContact O-N 3.11Å; V40-F42 HydrophobicContact CG1-CD1 4.48Å; V40-F42 HydrophobicContact CG1-CD2 4.33Å; V40-F42 HydrophobicContact CG1-CE1 4.13Å; V40-F42 HydrophobicContact CG1-CE2 3.95Å; V40-F42 HydrophobicContact CG1-CZ 3.84Å; V40-I468 HydrophobicContact CG2-CD1 3.6Å; V40-A547 HydrophobicContact CG1-CB 3.75Å; V40-A547 HydrophobicContact CG2-CB 4.29Å
41	V	85.1	Confident	67.6	Low	95 Å²	95	73.1 Å²	73.1	58%	0.576	40%	0.4	S	S	*	.			trans	-108.9	103.3	174.3	-178.4	0	0	0	0	108.4	L52	V41-L52 HydrophobicContact CG2-CD2 4.34Å; V41-L52 HydrophobicContact CG2-CG 4.45Å
42	F	82.4	Confident	64.6	Low	34 Å²	34	76.6 Å²	76.6	15%	0.149	42%	0.418	C	S	.	.			trans	-70.1	144.4	167.8	-62.4	-75.9	0	0	0	109.5	R32 F35 V36 V40 L543 D546 A547	R32-F42 HydrophobicContact CG-CD2 4.04Å; R32-F42 HydrophobicContact CG-CE2 3.78Å; F35-F42 HydrophobicContact CB-CE2 4.09Å; F35-F42 HydrophobicContact CB-CZ 3.99Å; F35-F42 HydrophobicContact CD2-CZ 4.12Å; V36-F42 HydrophobicContact CG2-CD2 3.87Å; V36-F42 HydrophobicContact CG2-CE2 3.95Å; V40-F42 HydrophobicContact CG1-CD1 4.48Å; V40-F42 HydrophobicContact CG1-CD2 4.33Å; V40-F42 HydrophobicContact CG1-CE1 4.13Å; V40-F42 HydrophobicContact CG1-CE2 3.95Å; V40-F42 HydrophobicContact CG1-CZ 3.84Å; F42-L543 HydrophobicContact CE1-CD1 3.65Å; F42-L543 HydrophobicContact CE1-CG 4.42Å; F42-L543 HydrophobicContact CE2-CD1 4.41Å; F42-L543 HydrophobicContact CZ-CD1 3.6Å; F42-L543 HydrophobicContact CZ-CG 4.21Å; F42-D546 HydrophobicContact CD1-CB 4.14Å; F42-D546 HydrophobicContact CE1-CB 4.11Å; F42-A547 HydrophobicContact CE1-CB 3.98Å; F42-A547 HydrophobicContact CZ-CB 4.06Å
43	S	64.1	Low	61.5	Low	67 Å²	67	79.9 Å²	79.9	47%	0.469	44%	0.435	S	S	.	.			trans	-89	112.8	173.3	-62	0	0	0	0	109.2
44	D	50.9	Low	58.7	Low	133 Å²	133	79.6 Å²	79.6	71%	0.711	44%	0.439	S	S	*	.			trans	-62.3	144.3	170.5	-69.8	-33.5	0	0	0	110.3	Q46 T47	D44-Q46 PolarHBondContact O-N 2.88Å; D44-T47 PolarHBondContact O-N 3.49Å
45	E	42.8	Very low	55.8	Low	193 Å²	193	84.7 Å²	84.7	90%	0.902	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	21	-168.7	-60	-173.7	123.7	0	0	115.9
46	Q	35.8	Very low	53.1	Low	190 Å²	190	88.7 Å²	88.7	89%	0.888	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.2	-2.8	-179.6	-62.6	-171.5	0.7	0	0	114.7	D44	D44-Q46 PolarHBondContact O-N 2.88Å
47	T	34.4	Very low	50.8	Low	109 Å²	109	87.7 Å²	87.7	67%	0.669	48%	0.483	S	S	*	.	S	Bend	trans	-137.9	129.7	175.8	50.5	0	0	0	0	113	D44	D44-T47 PolarHBondContact O-N 3.49Å
48	G	28.4	Very low	48.1	Very low	75 Å²	75	89.7 Å²	89.7	77%	0.773	49%	0.491	S	S	*	.			trans	-62.4	153.7	-174.1	0	0	0	0	0	115.3	K50	G48-K50 PolarHBondContact O-N 3.22Å
49	M	30.7	Very low	45.6	Very low	56 Å²	56	92.7 Å²	92.7	28%	0.276	51%	0.506	S	S	.	.			trans	-50	121	-167.3	-79.3	168.3	59.8	0	0	115	S582	M49-S582 VanDerWaalsContact SD-CB 3.57Å
50	K	28.4	Very low	43.1	Very low	185 Å²	185	92.8 Å²	92.8	80%	0.804	50%	0.501	S	S	*	.			trans	-112	85.8	149.4	-74	-178.2	179.5	174.5	0	107.9	G48 L52	G48-K50 PolarHBondContact O-N 3.22Å; K50-L52 PolarHBondContact O-N 3.16Å
51	H	34.8	Very low	40.6	Very low	108 Å²	108	97.1 Å²	97.1	50%	0.5	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-52	139.4	170.1	-155.1	-73.8	0	0	0	109.1	K53	H51-K53 PolarHBondContact O-N 3.25Å
52	L	32.9	Very low	38	Very low	73 Å²	73	99 Å²	99	38%	0.382	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-53.5	132.3	166.4	-83.7	160.1	0	0	0	108.2	G39 V41 K50 A54	G39-L52 WeakPolarHBondContact O-CD1 3.28Å; V41-L52 HydrophobicContact CG2-CD2 4.34Å; V41-L52 HydrophobicContact CG2-CG 4.45Å; K50-L52 PolarHBondContact O-N 3.16Å; L52-A54 PolarHBondContact O-N 3.2Å
53	K	29.1	Very low	35.5	Very low	159 Å²	159	101.7 Å²	101.7	69%	0.691	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-50.7	129.4	-179.5	-79.8	-176	173.5	-178.7	0	109.2	H51 N55 T56	H51-K53 PolarHBondContact O-N 3.25Å; K53-N55 HydrophobicContact CB-CB 4.23Å; K53-N55 PolarHBondContact O-N 3.19Å; K53-T56 PolarHBondContact O-N 3.17Å
54	A	33.9	Very low	33.9	Very low	32 Å²	32	105.2 Å²	105.2	26%	0.264	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-52	-27.9	175.9	0	0	0	0	0	112.3	L52 T56 I57 N58	L52-A54 PolarHBondContact O-N 3.2Å; A54-T56 PolarHBondContact O-N 3Å; A54-I57 PolarHBondContact O-N 3.26Å; A54-N58 WeakPolarHBondContact O-CB 3.37Å; A54-N58 VanDerWaalsContact O-CG 3.23Å; A54-N58 PolarHBondContact O-N 2.9Å
55	N	30.3	Very low	32.9	Very low	107 Å²	107	105.5 Å²	105.5	57%	0.572	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-52.2	-12.1	172.9	-54.2	50.3	0	0	0	116.2	K53	K53-N55 HydrophobicContact CB-CB 4.23Å; K53-N55 PolarHBondContact O-N 3.19Å
56	T	34.4	Very low	32.1	Very low	84 Å²	84	100.5 Å²	100.5	52%	0.515	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-104.2	-8.3	175	-46.8	0	0	0	0	113.3	K53 A54 I71	K53-T56 PolarHBondContact O-N 3.17Å; A54-T56 PolarHBondContact O-N 3Å; T56-I71 HydrophobicContact CG2-CD1 4.19Å
57	I	42.5	Very low	31.9	Very low	50 Å²	50	97.2 Å²	97.2	26%	0.256	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.3	-10.7	175.4	-64.1	168.5	0	0	0	111.2	A54 N59	A54-I57 PolarHBondContact O-N 3.26Å; I57-N59 VanDerWaalsContact C-N 3.26Å; I57-N59 PolarHBondContact O-N 3.13Å
58	N	30.8	Very low	31.6	Very low	70 Å²	70	98.2 Å²	98.2	37%	0.374	56%	0.559	S	S	.	*			trans	-73	75.8	169.6	-72.6	-9.2	0	0	0	111.7	A54 S60 R552	A54-N58 WeakPolarHBondContact O-CB 3.37Å; A54-N58 VanDerWaalsContact O-CG 3.23Å; A54-N58 PolarHBondContact O-N 2.9Å; N58-S60 PolarHBondContact O-N 3.11Å; N58-R552 PolarHBondContact OD1-NH2 2.8Å
59	N	34.1	Very low	31.8	Very low	78 Å²	78	101.2 Å²	101.2	42%	0.417	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.8	41	174.1	-72.6	-35.4	0	0	0	113.7	I57 R465	I57-N59 VanDerWaalsContact C-N 3.26Å; I57-N59 PolarHBondContact O-N 3.13Å; N59-R465 VanDerWaalsContact ND2-C 3.33Å; N59-R465 PolarHBondContact ND2-O 3.04Å; N59-R465 VanDerWaalsContact ND2-O 3.09Å
60	S	33.6	Very low	32.3	Very low	36 Å²	36	102.4 Å²	102.4	25%	0.252	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.4	-46.4	179.5	57.1	0	0	0	0	113.4	N58	N58-S60 PolarHBondContact O-N 3.11Å
61	D	32.4	Very low	33.7	Very low	106 Å²	106	98.9 Å²	98.9	57%	0.567	57%	0.571	S	S	*	*	S	Bend	trans	-136.3	7.4	-162.4	-56.8	-83.9	0	0	0	115.7	C63	D61-C63 VanDerWaalsContact C-N 3.3Å; D61-C63 PolarHBondContact O-N 2.93Å
62	I	30.5	Very low	35.6	Very low	133 Å²	133	99.4 Å²	99.4	68%	0.682	57%	0.572	S	S	*	*			trans	-82.8	77.5	179.5	-51.8	-175.5	0	0	0	110.7
63	C	31	Very low	38	Very low	92 Å²	92	100 Å²	100	62%	0.622	57%	0.572	S	S	*	*			trans	-62.3	162.8	157.1	-63.5	0	0	0	0	111	D61 I65	D61-C63 VanDerWaalsContact C-N 3.3Å; D61-C63 PolarHBondContact O-N 2.93Å; C63-I65 PolarHBondContact O-N 3.24Å
64	D	29.6	Very low	40.9	Very low	140 Å²	140	92.6 Å²	92.6	75%	0.749	54%	0.541	S	S	*	.	S	Bend	trans	-58.3	90.1	-169.1	-68.6	-73.6	0	0	0	114.9
65	I	30.2	Very low	43.7	Very low	140 Å²	140	91.2 Å²	91.2	72%	0.718	53%	0.529	S	S	*	.			trans	-121.8	119.1	164.5	-58.1	-179.5	0	0	0	107.7	C63 V67	C63-I65 PolarHBondContact O-N 3.24Å; I65-V67 PolarHBondContact O-N 3.22Å
66	G	26.8	Very low	46.8	Very low	87 Å²	87	86.2 Å²	86.2	90%	0.897	50%	0.502	S	S	*	.			trans	-70	99.9	-166.2	0	0	0	0	0	114.5
67	V	30.5	Very low	49.8	Very low	121 Å²	121	82.2 Å²	82.2	73%	0.733	48%	0.478	S	S	*	.			trans	-118.8	121.3	173.3	-179.1	0	0	0	0	110.1	I65	I65-V67 PolarHBondContact O-N 3.22Å
68	D	28.8	Very low	52.3	Low	130 Å²	130	79.8 Å²	79.8	70%	0.695	47%	0.466	S	S	*	.			trans	35	103.5	169	-66.3	-11.4	0	0	0	119.6	S70	D68-S70 PolarHBondContact O-N 3.07Å
69	S	32.2	Very low	55.4	Low	138 Å²	138	76.5 Å²	76.5	97%	0.965	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	44.3	173.7	65.2	0	0	0	0	114.3
70	S	42.2	Very low	58.4	Low	82 Å²	82	73 Å²	73	57%	0.573	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.3	-30.2	-169	64.9	0	0	0	0	114.8	D68 K72	D68-S70 PolarHBondContact O-N 3.07Å; S70-K72 PolarHBondContact O-N 2.86Å
71	I	56.4	Low	61.4	Low	110 Å²	110	71.2 Å²	71.2	56%	0.564	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-71.7	126.1	-179.9	-57.3	179	0	0	0	109.6	T56	T56-I71 HydrophobicContact CG2-CD1 4.19Å
72	K	75.5	Confident	64.5	Low	120 Å²	120	66.2 Å²	66.2	52%	0.522	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-100.1	140.4	177.5	-61	167.1	-171.7	157.6	0	110	C38 S70	C38-K72 WeakPolarHBondContact CA-O 3.41Å; C38-K72 PolarHBondContact SG-O 3.48Å; C38-K72 VanDerWaalsContact SG-O 3.38Å; S70-K72 PolarHBondContact O-N 2.86Å
73	E	83.2	Confident	67.7	Low	84 Å²	84	60.3 Å²	60.3	39%	0.393	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-71.2	149.2	168.1	-66.3	-178.1	-170.6	0	0	111.8	Q364 S369 R467	E73-Q364 PolarHBondContact OE2-NE2 3.48Å; E73-S369 VanDerWaalsContact OE1-CB 3.32Å; E73-S369 WeakPolarHBondContact OE1-CB 3.44Å; E73-R467 IonicContact OE1-NH1 2.72Å; E73-R467 PolarHBondContact OE1-NH1 3.19Å; E73-R467 WeakPolarHBondContact OE2-CD 3.45Å; E73-R467 IonicContact OE2-CZ 2.61Å; E73-R467 IonicContact OE2-NE 2.89Å; E73-R467 IonicContact OE2-NH1 3.79Å; E73-R467 PolarHBondContact OE2-NH1 3.24Å
74	P	90	Very high	70.7	Confident	5 Å²	5	56 Å²	56	3%	0.032	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-68.8	140.4	168	29.3	-32.9	0	0	0	110	V34 L76 I79 Q364 V471	V34-P74 HydrophobicContact CG1-CB 4.24Å; P74-L76 HydrophobicContact CG-CD2 4.38Å; P74-L76 PolarHBondContact O-N 3.09Å; P74-I79 HydrophobicContact CB-CD1 3.79Å; P74-Q364 PolarHBondContact O-NE2 2.99Å; P74-Q364 PolarHBondContact O-OE1 3.47Å; P74-V471 HydrophobicContact CB-CG2 3.76Å; P74-V471 HydrophobicContact CG-CG2 3.81Å
75	N	93.1	Very high	73.9	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.016	30%	0.3	C	S	.	.			trans	-83.6	101.4	177.8	-174.8	-46.5	0	0	0	109.6	W15 A77 F78 I79 Y263	W15-N75 HydrophobicContact CH2-CB 4.44Å; W15-N75 HydrophobicContact CZ3-CB 4.18Å; N75-A77 PolarHBondContact O-N 3.42Å; N75-A77 PolarHBondContact OD1-N 2.9Å; N75-F78 HydrophobicContact CB-CB 4.01Å; N75-F78 PolarHBondContact O-N 3.5Å; N75-F78 WeakPolarHBondContact OD1-CB 3.41Å; N75-F78 PolarHBondContact OD1-N 3.49Å; N75-I79 VanDerWaalsContact O-CG1 3.32Å; N75-I79 WeakPolarHBondContact O-CG1 3.34Å; N75-I79 PolarHBondContact O-N 2.96Å; N75-I79 VanDerWaalsContact O-N 3.12Å; N75-Y263 PolarHBondContact ND2-OH 2.8Å; N75-Y263 WeakPolarHBondContact OD1-CE2 3.35Å
76	L	95.5	Very high	77	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-65.1	-38.7	-171.1	-61.1	-179	0	0	0	112.3	P74 I79 S80 Y357 V360 A361 R467 A470 V471	P74-L76 HydrophobicContact CG-CD2 4.38Å; P74-L76 PolarHBondContact O-N 3.09Å; L76-I79 PolarHBondContact O-N 3.02Å; L76-S80 VanDerWaalsContact O-CB 3.3Å; L76-S80 WeakPolarHBondContact O-CB 3.48Å; L76-S80 PolarHBondContact O-N 3.4Å; L76-Y357 HydrophobicContact CB-CE1 3.94Å; L76-Y357 WeakPolarHBondContact CB-OH 3.4Å; L76-Y357 PolarHBondContact O-OH 2.78Å; L76-V360 HydrophobicContact CD1-CG1 3.74Å; L76-A361 HydrophobicContact CB-CB 4.05Å; L76-R467 HydrophobicContact CD1-CG 4.03Å; L76-A470 HydrophobicContact CD1-CB 4.37Å; L76-A470 HydrophobicContact CD2-CB 4.05Å; L76-V471 HydrophobicContact CD2-CG2 4.04Å
77	A	96.4	Very high	80.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.7	-43.8	176.9	0	0	0	0	0	112.1	N75 I81 Y263 F266 A361 L365	N75-A77 PolarHBondContact O-N 3.42Å; N75-A77 PolarHBondContact OD1-N 2.9Å; A77-I81 WeakPolarHBondContact O-CD1 3.26Å; A77-I81 WeakPolarHBondContact O-CG1 3.18Å; A77-I81 PolarHBondContact O-N 3.32Å; A77-I81 VanDerWaalsContact O-N 3.09Å; A77-Y263 HydrophobicContact CB-CD2 4.35Å; A77-Y263 HydrophobicContact CB-CE2 4.12Å; A77-F266 HydrophobicContact CB-CD1 3.91Å; A77-F266 HydrophobicContact CB-CE1 3.97Å; A77-A361 HydrophobicContact CB-CB 4.3Å; A77-L365 HydrophobicContact CB-CD1 4.4Å
78	F	95.7	Very high	83	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.1	-48.5	175.8	173.3	-87.2	0	0	0	111.6	V12 W15 F19 L30 N75 I81 V82 L259 Y263	V12-F78 HydrophobicContact CB-CD2 4.26Å; V12-F78 HydrophobicContact CG1-CD2 3.81Å; V12-F78 HydrophobicContact CG1-CE2 3.96Å; V12-F78 HydrophobicContact CG2-CB 4.26Å; V12-F78 HydrophobicContact CG2-CD2 3.84Å; V12-F78 HydrophobicContact CG2-CG 4.26Å; W15-F78 HydrophobicContact CB-CZ 4.17Å; W15-F78 HydrophobicContact CD2-CE1 4.29Å; W15-F78 HydrophobicContact CD2-CZ 4.44Å; W15-F78 AromaticContact CE3-CD1 3.69Å; W15-F78 HydrophobicContact CE3-CD1 3.69Å; W15-F78 HydrophobicContact CE3-CD2 4.41Å; W15-F78 AromaticContact CE3-CE1 3.42Å; W15-F78 HydrophobicContact CE3-CE1 3.42Å; W15-F78 VanDerWaalsContact CE3-CE1 3.42Å; W15-F78 HydrophobicContact CE3-CE2 4.15Å; W15-F78 HydrophobicContact CE3-CG 4.19Å; W15-F78 AromaticContact CE3-CZ 3.68Å; W15-F78 HydrophobicContact CE3-CZ 3.68Å; W15-F78 AromaticContact CZ3-CD1 3.63Å; W15-F78 HydrophobicContact CZ3-CD1 3.63Å; W15-F78 AromaticContact CZ3-CE1 3.85Å; W15-F78 HydrophobicContact CZ3-CE1 3.85Å; W15-F78 HydrophobicContact CZ3-CG 4.1Å; W15-F78 HydrophobicContact CZ3-CZ 4.46Å; F19-F78 HydrophobicContact CE2-CZ 4.16Å; F19-F78 HydrophobicContact CZ-CE2 4.44Å; F19-F78 HydrophobicContact CZ-CZ 4.05Å; L30-F78 HydrophobicContact CD1-CE1 4.36Å; L30-F78 HydrophobicContact CD1-CZ 4.42Å; L30-F78 HydrophobicContact CD2-CE1 4.14Å; L30-F78 HydrophobicContact CD2-CZ 4.24Å; N75-F78 HydrophobicContact CB-CB 4.01Å; N75-F78 PolarHBondContact O-N 3.5Å; N75-F78 WeakPolarHBondContact OD1-CB 3.41Å; N75-F78 PolarHBondContact OD1-N 3.49Å; F78-I81 PolarHBondContact O-N 2.72Å; F78-V82 HydrophobicContact CE1-CG2 4.24Å; F78-V82 HydrophobicContact CZ-CG2 4.38Å; F78-V82 WeakPolarHBondContact O-CG2 3.47Å; F78-V82 PolarHBondContact O-N 3.39Å; F78-V82 VanDerWaalsContact O-N 3.09Å; F78-L259 HydrophobicContact CD2-CD2 3.92Å; F78-L259 HydrophobicContact CD2-CG 4.37Å; F78-L259 HydrophobicContact CE2-CD2 3.36Å; F78-L259 HydrophobicContact CE2-CG 4.21Å; F78-L259 HydrophobicContact CZ-CD2 3.83Å; F78-Y263 HydrophobicContact CB-CD2 4.29Å; F78-Y263 HydrophobicContact CB-CE2 4.35Å
79	I	95.9	Very high	85.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.4	-48.6	-178.1	-69	169.2	0	0	0	110.8	M31 V34 P74 N75 L76 I81 V82 L83 V471	M31-I79 HydrophobicContact CE-CG2 4.02Å; M31-I79 HydrophobicContact SD-CG1 4.5Å; V34-I79 HydrophobicContact CG1-CD1 3.92Å; P74-I79 HydrophobicContact CB-CD1 3.79Å; N75-I79 VanDerWaalsContact O-CG1 3.32Å; N75-I79 WeakPolarHBondContact O-CG1 3.34Å; N75-I79 PolarHBondContact O-N 2.96Å; N75-I79 VanDerWaalsContact O-N 3.12Å; L76-I79 PolarHBondContact O-N 3.02Å; I79-I81 VanDerWaalsContact C-N 3.33Å; I79-I81 PolarHBondContact O-N 3.4Å; I79-V82 PolarHBondContact O-N 3.49Å; I79-L83 HydrophobicContact CG2-CD1 4.02Å; I79-L83 HydrophobicContact CG2-CG 4.49Å; I79-L83 WeakPolarHBondContact O-CG 3.45Å; I79-L83 PolarHBondContact O-N 3.46Å; I79-V471 HydrophobicContact CD1-CB 4.48Å; I79-V471 HydrophobicContact CD1-CG1 4.09Å; I79-V471 HydrophobicContact CD1-CG2 3.56Å; I79-V471 HydrophobicContact CG2-CG1 4.04Å
80	S	97.2	Very high	88.6	Confident	4 Å²	4	27.7 Å²	27.7	3%	0.028	14%	0.141	C	C	.	.	H	α-helix	trans	-65.3	-33.7	-179.2	-172.6	0	0	0	0	112.9	L76 G84 S340 V341 Y357	L76-S80 VanDerWaalsContact O-CB 3.3Å; L76-S80 WeakPolarHBondContact O-CB 3.48Å; L76-S80 PolarHBondContact O-N 3.4Å; S80-G84 PolarHBondContact O-N 3.1Å; S80-S340 WeakPolarHBondContact OG-CA 3.45Å; S80-V341 PolarHBondContact OG-N 3.19Å; S80-Y357 VanDerWaalsContact CB-CE1 3.5Å
81	I	97.5	Very high	90.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-68.6	-41.3	173.3	-65	166.5	0	0	0	111.2	A77 F78 I79 Y85 L259 L262 V341 Y342 L345	A77-I81 WeakPolarHBondContact O-CD1 3.26Å; A77-I81 WeakPolarHBondContact O-CG1 3.18Å; A77-I81 PolarHBondContact O-N 3.32Å; A77-I81 VanDerWaalsContact O-N 3.09Å; F78-I81 PolarHBondContact O-N 2.72Å; I79-I81 VanDerWaalsContact C-N 3.33Å; I79-I81 PolarHBondContact O-N 3.4Å; I81-Y85 WeakPolarHBondContact O-CB 3.1Å; I81-Y85 PolarHBondContact O-N 3.37Å; I81-L259 HydrophobicContact CB-CD1 3.95Å; I81-L259 HydrophobicContact CG2-CD1 3.44Å; I81-L259 VanDerWaalsContact CG2-CD1 3.44Å; I81-L262 HydrophobicContact CD1-CB 4.42Å; I81-L262 HydrophobicContact CG2-CB 3.79Å; I81-L262 HydrophobicContact CG2-CD1 3.9Å; I81-L262 HydrophobicContact CG2-CG 4.48Å; I81-V341 HydrophobicContact CD1-CG1 3.96Å; I81-V341 HydrophobicContact CG1-CB 3.94Å; I81-V341 HydrophobicContact CG1-CG1 3.73Å; I81-Y342 HydrophobicContact CG2-CD2 4.46Å; I81-L345 HydrophobicContact CD1-CD1 3.93Å; I81-L345 HydrophobicContact CG1-CD1 4.23Å
82	V	97	Very high	91.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.9	-51.9	176.9	170.3	0	0	0	0	111.2	L21 M31 F78 I79 I86 L254 L259	L21-V82 HydrophobicContact CD1-CG1 3.82Å; L21-V82 HydrophobicContact CD1-CG2 4.48Å; M31-V82 HydrophobicContact CE-CG1 4.4Å; F78-V82 HydrophobicContact CE1-CG2 4.24Å; F78-V82 HydrophobicContact CZ-CG2 4.38Å; F78-V82 WeakPolarHBondContact O-CG2 3.47Å; F78-V82 PolarHBondContact O-N 3.39Å; F78-V82 VanDerWaalsContact O-N 3.09Å; I79-V82 PolarHBondContact O-N 3.49Å; V82-I86 HydrophobicContact CG1-CD1 3.83Å; V82-I86 WeakPolarHBondContact O-CD1 3.45Å; V82-I86 WeakPolarHBondContact O-CG1 3.49Å; V82-I86 PolarHBondContact O-N 3.27Å; V82-L254 HydrophobicContact CG2-CD2 4.18Å; V82-L259 HydrophobicContact CG2-CD1 3.95Å; V82-L259 HydrophobicContact CG2-CD2 3.51Å; V82-L259 HydrophobicContact CG2-CG 4.41Å
83	L	96.4	Very high	90.5	Very high	9 Å²	9	19.4 Å²	19.4	5%	0.047	11%	0.108	C	C	.	.	H	α-helix	trans	-62.9	-50.3	-178.5	-66.9	178.8	0	0	0	111.6	M31 I79 Y85 I86 E87 A474 I475 I478 L540	M31-L83 HydrophobicContact CE-CD1 4.5Å; M31-L83 HydrophobicContact CE-CD2 3.87Å; M31-L83 HydrophobicContact CE-CG 4.02Å; I79-L83 HydrophobicContact CG2-CD1 4.02Å; I79-L83 HydrophobicContact CG2-CG 4.49Å; I79-L83 WeakPolarHBondContact O-CG 3.45Å; I79-L83 PolarHBondContact O-N 3.46Å; L83-Y85 VanDerWaalsContact C-N 3.33Å; L83-Y85 PolarHBondContact O-N 2.94Å; L83-I86 PolarHBondContact O-N 3.12Å; L83-E87 WeakPolarHBondContact O-CB 3.34Å; L83-E87 PolarHBondContact O-N 2.99Å; L83-A474 HydrophobicContact CD1-CB 4.22Å; L83-I475 HydrophobicContact CD1-CG1 3.91Å; L83-I478 HydrophobicContact CD1-CD1 4.47Å; L83-I478 HydrophobicContact CD2-CD1 4.12Å; L83-L540 HydrophobicContact CD2-CD1 3.87Å
84	G	95.5	Very high	88.6	Confident	3 Å²	3	21.4 Å²	21.4	3%	0.031	13%	0.126	C	C	.	.	H	α-helix	trans	-65.2	-32.1	-178.6	0	0	0	0	0	114.1	S80 N88 Y342	S80-G84 PolarHBondContact O-N 3.1Å; G84-N88 VanDerWaalsContact O-CB 3.27Å; G84-N88 WeakPolarHBondContact O-CB 3.46Å; G84-N88 PolarHBondContact O-N 3.29Å; G84-Y342 VanDerWaalsContact C-CD1 3.43Å; G84-Y342 VanDerWaalsContact O-CD1 3.24Å; G84-Y342 WeakPolarHBondContact O-CD1 3.33Å
85	Y	95.8	Very high	85.9	Confident	23 Å²	23	24.1 Å²	24.1	9%	0.09	15%	0.146	C	C	.	.	H	α-helix	trans	-62.7	-51.1	171.9	175.8	-86.7	0	0	0	111	I81 L83 H89 P252 L254 Y342	I81-Y85 WeakPolarHBondContact O-CB 3.1Å; I81-Y85 PolarHBondContact O-N 3.37Å; L83-Y85 VanDerWaalsContact C-N 3.33Å; L83-Y85 PolarHBondContact O-N 2.94Å; Y85-H89 AromaticContact CD2-CD2 3.72Å; Y85-H89 AromaticContact CD2-NE2 3.94Å; Y85-H89 AromaticContact CE1-CD2 3.94Å; Y85-H89 AromaticContact CE2-CD2 3.52Å; Y85-H89 AromaticContact CE2-NE2 3.4Å; Y85-H89 WeakPolarHBondContact CE2-NE2 3.14Å; Y85-H89 AromaticContact CZ-CD2 3.63Å; Y85-H89 AromaticContact CZ-NE2 3.72Å; Y85-H89 WeakPolarHBondContact O-CB 3.4Å; Y85-H89 PolarHBondContact O-CD2 2.81Å; Y85-H89 VanDerWaalsContact O-CD2 3.3Å; Y85-H89 PolarHBondContact O-N 3.34Å; Y85-H89 VanDerWaalsContact O-N 3.07Å; Y85-P252 HydrophobicContact CE1-CB 4.01Å; Y85-L254 HydrophobicContact CD1-CB 3.83Å; Y85-L254 HydrophobicContact CD1-CD1 4.01Å; Y85-L254 HydrophobicContact CD1-CD2 4.01Å; Y85-L254 HydrophobicContact CD1-CG 4.15Å; Y85-L254 HydrophobicContact CD2-CD1 4.05Å; Y85-L254 HydrophobicContact CE1-CB 3.59Å; Y85-L254 HydrophobicContact CE1-CD1 3.94Å; Y85-L254 HydrophobicContact CE1-CG 4.21Å; Y85-L254 HydrophobicContact CE2-CD1 3.98Å; Y85-L254 HydrophobicContact CG-CD1 4.07Å; Y85-L254 HydrophobicContact CG-CD2 4.23Å; Y85-Y342 HydrophobicContact CD2-CD2 4.41Å; Y85-Y342 AromaticContact CD2-CE2 3.65Å; Y85-Y342 HydrophobicContact CD2-CE2 3.65Å; Y85-Y342 AromaticContact CD2-CZ 3.9Å; Y85-Y342 HydrophobicContact CG-CE2 4.31Å
86	I	95	Very high	83	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-63.1	-45.8	-178.4	-65.1	158.7	0	0	0	110.3	V27 V82 L83 H89 L90 F251 P252 L536	V27-I86 HydrophobicContact CB-CD1 4.45Å; V27-I86 HydrophobicContact CG1-CD1 4.01Å; V27-I86 HydrophobicContact CG2-CD1 3.58Å; V82-I86 HydrophobicContact CG1-CD1 3.83Å; V82-I86 WeakPolarHBondContact O-CD1 3.45Å; V82-I86 WeakPolarHBondContact O-CG1 3.49Å; V82-I86 PolarHBondContact O-N 3.27Å; L83-I86 PolarHBondContact O-N 3.12Å; I86-H89 PolarHBondContact O-N 3.27Å; I86-L90 HydrophobicContact CG2-CD1 3.69Å; I86-L90 HydrophobicContact CG2-CG 4.36Å; I86-L90 VanDerWaalsContact O-CB 3.3Å; I86-L90 WeakPolarHBondContact O-CB 3.31Å; I86-L90 VanDerWaalsContact O-CG 3.31Å; I86-L90 WeakPolarHBondContact O-CG 3.4Å; I86-L90 PolarHBondContact O-N 3.34Å; I86-F251 HydrophobicContact CD1-CZ 4.33Å; I86-F251 HydrophobicContact CG1-CZ 4.31Å; I86-F251 HydrophobicContact CG2-CE1 4.44Å; I86-F251 HydrophobicContact CG2-CE2 3.96Å; I86-F251 HydrophobicContact CG2-CZ 3.64Å; I86-P252 HydrophobicContact CG2-CG 4.26Å; I86-L536 HydrophobicContact CD1-CD2 4.49Å; I86-L536 HydrophobicContact CG2-CD2 3.68Å
87	E	92.9	Very high	80	Confident	3 Å²	3	39.3 Å²	39.3	1%	0.014	22%	0.221	C	C	.	.	H	α-helix	trans	-56.2	-61.8	177.5	169.3	162.5	176.7	0	0	111.5	L83 H89 L90 T91 H337 Q339 I478 Q479 L533	L83-E87 WeakPolarHBondContact O-CB 3.34Å; L83-E87 PolarHBondContact O-N 2.99Å; E87-H89 VanDerWaalsContact C-N 3.26Å; E87-H89 PolarHBondContact O-N 3.36Å; E87-L90 PolarHBondContact O-N 2.79Å; E87-T91 WeakPolarHBondContact O-CG2 3.24Å; E87-T91 PolarHBondContact O-N 3.27Å; E87-T91 PolarHBondContact O-OG1 3.41Å; E87-T91 VanDerWaalsContact O-OG1 3.08Å; E87-H337 HydrophobicContact CG-CB 4.41Å; E87-H337 IonicContact OE1-CE1 3.41Å; E87-H337 IonicContact OE1-CG 3.23Å; E87-H337 IonicContact OE1-ND1 3.33Å; E87-H337 PolarHBondContact OE1-ND1 2.9Å; E87-Q339 VanDerWaalsContact CD-NE2 3.33Å; E87-Q339 PolarHBondContact OE1-NE2 2.94Å; E87-Q339 PolarHBondContact OE2-NE2 3.04Å; E87-I478 WeakPolarHBondContact OE2-CA 3.48Å; E87-Q479 WeakPolarHBondContact OE1-CB 3.15Å; E87-Q479 PolarHBondContact OE1-N 3.39Å; E87-L533 HydrophobicContact CB-CD1 4.38Å; E87-L533 HydrophobicContact CB-CD2 4.07Å; E87-L533 HydrophobicContact CG-CD2 3.92Å
88	N	90.6	Very high	77.1	Confident	39 Å²	39	45.1 Å²	45.1	21%	0.209	25%	0.247	C	C	.	.	H	α-helix	trans	-57.6	-37.9	-177.2	176	99.1	0	0	0	112.4	G84 S92 Y342	G84-N88 VanDerWaalsContact O-CB 3.27Å; G84-N88 WeakPolarHBondContact O-CB 3.46Å; G84-N88 PolarHBondContact O-N 3.29Å; N88-S92 WeakPolarHBondContact O-CB 3.44Å; N88-S92 PolarHBondContact O-N 2.88Å; N88-S92 PolarHBondContact O-OG 2.86Å; N88-Y342 HydrophobicContact CB-CD1 4.14Å; N88-Y342 HydrophobicContact CB-CE1 3.74Å
89	H	90.9	Very high	74	Confident	83 Å²	83	50.8 Å²	50.8	38%	0.384	28%	0.277	S	S	.	.	H	α-helix	trans	-73.9	-23.2	177.5	-87.5	-81.7	0	0	0	114.2	Y85 I86 E87 P252	Y85-H89 AromaticContact CD2-CD2 3.72Å; Y85-H89 AromaticContact CD2-NE2 3.94Å; Y85-H89 AromaticContact CE1-CD2 3.94Å; Y85-H89 AromaticContact CE2-CD2 3.52Å; Y85-H89 AromaticContact CE2-NE2 3.4Å; Y85-H89 WeakPolarHBondContact CE2-NE2 3.14Å; Y85-H89 AromaticContact CZ-CD2 3.63Å; Y85-H89 AromaticContact CZ-NE2 3.72Å; Y85-H89 WeakPolarHBondContact O-CB 3.4Å; Y85-H89 PolarHBondContact O-CD2 2.81Å; Y85-H89 VanDerWaalsContact O-CD2 3.3Å; Y85-H89 PolarHBondContact O-N 3.34Å; Y85-H89 VanDerWaalsContact O-N 3.07Å; I86-H89 PolarHBondContact O-N 3.27Å; E87-H89 VanDerWaalsContact C-N 3.26Å; E87-H89 PolarHBondContact O-N 3.36Å; H89-P252 HydrophobicContact CB-CB 3.6Å; H89-P252 HydrophobicContact CB-CG 3.81Å
90	L	89	Confident	71	Confident	11 Å²	11	56.4 Å²	56.4	6%	0.058	32%	0.316	C	S	.	.	H	α-helix	trans	-89	-21.2	176.4	-78	179.9	0	0	0	113.5	I86 E87 F251 P252 S530 Q532 L533	I86-L90 HydrophobicContact CG2-CD1 3.69Å; I86-L90 HydrophobicContact CG2-CG 4.36Å; I86-L90 VanDerWaalsContact O-CB 3.3Å; I86-L90 WeakPolarHBondContact O-CB 3.31Å; I86-L90 VanDerWaalsContact O-CG 3.31Å; I86-L90 WeakPolarHBondContact O-CG 3.4Å; I86-L90 PolarHBondContact O-N 3.34Å; E87-L90 PolarHBondContact O-N 2.79Å; L90-F251 HydrophobicContact CD1-CD2 4.23Å; L90-F251 HydrophobicContact CD1-CE2 4.05Å; L90-P252 HydrophobicContact CD2-CG 4.41Å; L90-P252 HydrophobicContact CG-CG 4.1Å; L90-S530 WeakPolarHBondContact O-CB 3.42Å; L90-Q532 HydrophobicContact CD1-CB 4.08Å; L90-Q532 HydrophobicContact CD2-CB 4.27Å; L90-L533 HydrophobicContact CB-CB 4.44Å; L90-L533 HydrophobicContact CB-CD2 4.43Å; L90-L533 HydrophobicContact CD1-CB 4Å; L90-L533 HydrophobicContact CD1-CD1 4.33Å
91	T	83.9	Confident	68	Low	2 Å²	2	61.1 Å²	61.1	1%	0.012	34%	0.34	C	S	.	.	H	α-helix	trans	-104.5	-20.3	-178.2	61.6	0	0	0	0	113.9	E87 S93 H337 G481 A482 L533	E87-T91 WeakPolarHBondContact O-CG2 3.24Å; E87-T91 PolarHBondContact O-N 3.27Å; E87-T91 PolarHBondContact O-OG1 3.41Å; E87-T91 VanDerWaalsContact O-OG1 3.08Å; T91-S93 PolarHBondContact O-N 3.33Å; T91-H337 VanDerWaalsContact CB-NE2 3.33Å; T91-H337 WeakPolarHBondContact CB-NE2 3.49Å; T91-H337 PolarHBondContact OG1-CD2 2.88Å; T91-H337 VanDerWaalsContact OG1-CD2 3.26Å; T91-H337 PolarHBondContact OG1-CE1 3.23Å; T91-H337 VanDerWaalsContact OG1-CE1 3.28Å; T91-H337 PolarHBondContact OG1-NE2 2.75Å; T91-G481 WeakPolarHBondContact CG2-O 3.17Å; T91-A482 VanDerWaalsContact O-CB 3.32Å; T91-A482 WeakPolarHBondContact O-CB 3.4Å; T91-L533 HydrophobicContact CG2-CD2 3.59Å
92	S	75.4	Confident	64.8	Low	54 Å²	54	67.8 Å²	67.8	38%	0.378	37%	0.369	S	S	.	.	S	Bend	trans	-71.1	119.8	172.6	-65.2	0	0	0	0	111.5	N88 T94	N88-S92 WeakPolarHBondContact O-CB 3.44Å; N88-S92 PolarHBondContact O-N 2.88Å; N88-S92 PolarHBondContact O-OG 2.86Å; S92-T94 PolarHBondContact O-N 2.88Å
93	S	53.1	Low	61.8	Low	82 Å²	82	74.3 Å²	74.3	57%	0.573	40%	0.402	S	S	*	.			trans	-71.8	122.8	172.9	53.4	0	0	0	0	111.4	T91 S95	T91-S93 PolarHBondContact O-N 3.33Å; S93-S95 VanDerWaalsContact C-N 3.33Å; S93-S95 PolarHBondContact O-N 3.09Å
94	T	43.1	Very low	58.7	Low	126 Å²	126	82.8 Å²	82.8	77%	0.773	44%	0.439	S	S	*	.			trans	-75.8	80.8	179.5	53.4	0	0	0	0	111.4	S92	S92-T94 PolarHBondContact O-N 2.88Å
95	S	33.3	Very low	55.8	Low	63 Å²	63	88.5 Å²	88.5	44%	0.441	47%	0.468	S	S	.	.			trans	-74.9	117.2	162.5	-179.9	0	0	0	0	109.6	S93 D97	S93-S95 VanDerWaalsContact C-N 3.33Å; S93-S95 PolarHBondContact O-N 3.09Å; S95-D97 PolarHBondContact O-N 2.67Å
96	E	33	Very low	52.9	Low	186 Å²	186	91.9 Å²	91.9	87%	0.869	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-70.3	-9.7	-174.3	-62.3	-167.7	128.8	0	0	114	F98	E96-F98 VanDerWaalsContact C-N 3.27Å; E96-F98 PolarHBondContact O-N 3.4Å
97	D	32.4	Very low	50.2	Low	137 Å²	137	97.6 Å²	97.6	73%	0.733	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-72.7	-13.2	178.3	-75.8	-47	0	0	0	114.4	S95 D99	S95-D97 PolarHBondContact O-N 2.67Å; D97-D99 PolarHBondContact O-N 2.93Å; D97-D99 VanDerWaalsContact O-N 3.12Å
98	F	36.2	Very low	47.6	Very low	122 Å²	122	101.3 Å²	101.3	54%	0.535	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-70.5	-6.6	-175.1	-98.3	-81.3	0	0	0	115.4	E96 S100 I101	E96-F98 VanDerWaalsContact C-N 3.27Å; E96-F98 PolarHBondContact O-N 3.4Å; F98-S100 PolarHBondContact O-N 2.94Å; F98-S100 VanDerWaalsContact O-N 3.14Å; F98-I101 HydrophobicContact CD1-CB 4.03Å; F98-I101 HydrophobicContact CE1-CB 4.31Å; F98-I101 HydrophobicContact CE1-CD1 4.28Å; F98-I101 CarbonylContact O-C 3.34Å; F98-I101 PolarHBondContact O-N 3.48Å
99	D	30.8	Very low	44.8	Very low	119 Å²	119	108.7 Å²	108.7	64%	0.636	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-66.6	-16.5	178.7	-122.7	24.2	0	0	0	113.7	D97 K102	D97-D99 PolarHBondContact O-N 2.93Å; D97-D99 VanDerWaalsContact O-N 3.12Å; D99-K102 VanDerWaalsContact CG-NZ 3.35Å; D99-K102 IonicContact OD1-NZ 2.75Å; D99-K102 PolarHBondContact OD1-NZ 2.7Å; D99-K102 IonicContact OD2-NZ 3.77Å; D99-K102 PolarHBondContact OD2-NZ 3.26Å
100	S	32.3	Very low	42.1	Very low	117 Å²	117	111.5 Å²	111.5	82%	0.818	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-78.3	-18	169	-62.9	0	0	0	0	114	F98	F98-S100 PolarHBondContact O-N 2.94Å; F98-S100 VanDerWaalsContact O-N 3.14Å
101	I	33.6	Very low	39.7	Very low	103 Å²	103	115.7 Å²	115.7	53%	0.528	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-115.1	39	-178.3	-45.3	-177.6	0	0	0	110.5	F98 I103	F98-I101 HydrophobicContact CD1-CB 4.03Å; F98-I101 HydrophobicContact CE1-CB 4.31Å; F98-I101 HydrophobicContact CE1-CD1 4.28Å; F98-I101 CarbonylContact O-C 3.34Å; F98-I101 PolarHBondContact O-N 3.48Å; I101-I103 HydrophobicContact CG2-CD1 4.33Å; I101-I103 HydrophobicContact CG2-CG1 3.94Å; I101-I103 PolarHBondContact O-N 3.37Å
102	K	31.8	Very low	37.5	Very low	141 Å²	141	121.2 Å²	121.2	61%	0.613	63%	0.63	S	S	*	*			trans	-64.5	82.6	154.6	-79.3	-169.6	167.5	87.2	0	109.7	D99 K104	D99-K102 VanDerWaalsContact CG-NZ 3.35Å; D99-K102 IonicContact OD1-NZ 2.75Å; D99-K102 PolarHBondContact OD1-NZ 2.7Å; D99-K102 IonicContact OD2-NZ 3.77Å; D99-K102 PolarHBondContact OD2-NZ 3.26Å; K102-K104 PolarHBondContact O-N 3.09Å
103	I	33.5	Very low	35.6	Very low	136 Å²	136	123.2 Å²	123.2	70%	0.697	64%	0.644	S	S	*	*			trans	-58.2	108.4	171.7	-63	178.4	0	0	0	108	I101 N105	I101-I103 HydrophobicContact CG2-CD1 4.33Å; I101-I103 HydrophobicContact CG2-CG1 3.94Å; I101-I103 PolarHBondContact O-N 3.37Å; I103-N105 VanDerWaalsContact C-N 3.34Å; I103-N105 PolarHBondContact O-N 3.44Å
104	K	31.4	Very low	34.7	Very low	188 Å²	188	128.7 Å²	128.7	82%	0.817	66%	0.658	S	S	*	*			trans	-71.2	79.1	-169.5	-76.8	178.7	175.3	168.3	0	113.6	K102 T106	K102-K104 PolarHBondContact O-N 3.09Å; K104-T106 VanDerWaalsContact C-N 3.32Å; K104-T106 PolarHBondContact O-N 3.1Å
105	N	33.8	Very low	34.2	Very low	122 Å²	122	131.9 Å²	131.9	65%	0.652	66%	0.656	S	S	*	*			trans	45.3	43.5	149.9	-71.4	-23.9	0	0	0	116.7	I103 L107 H108 R109	I103-N105 VanDerWaalsContact C-N 3.34Å; I103-N105 PolarHBondContact O-N 3.44Å; N105-L107 PolarHBondContact O-N 3.14Å; N105-H108 HydrophobicContact CB-CB 4.4Å; N105-R109 PolarHBondContact O-N 3.23Å
106	T	34.3	Very low	34	Very low	94 Å²	94	138.3 Å²	138.3	58%	0.577	68%	0.675	S	S	*	*	H	α-helix	trans	-67.4	-26.3	175.7	-37.6	0	0	0	0	112.2	K104 K110	K104-T106 VanDerWaalsContact C-N 3.32Å; K104-T106 PolarHBondContact O-N 3.1Å; T106-K110 WeakPolarHBondContact O-CG 3.4Å; T106-K110 PolarHBondContact O-N 3.38Å
107	L	39.7	Very low	33.9	Very low	122 Å²	122	138.3 Å²	138.3	64%	0.639	68%	0.676	S	S	*	*	H	α-helix	trans	-75	-49.1	175.8	-67.9	173.5	0	0	0	112.2	N105 R109 K110	N105-L107 PolarHBondContact O-N 3.14Å; L107-R109 PolarHBondContact O-N 3.42Å; L107-R109 VanDerWaalsContact O-N 3.11Å; L107-K110 PolarHBondContact O-N 2.87Å
108	H	37.8	Very low	33.8	Very low	80 Å²	80	139.5 Å²	139.5	37%	0.37	68%	0.682	S	S	.	*	H	α-helix	trans	-63.1	-19.7	179	-113.1	-88.6	0	0	0	113.7	N105 R261 D265	N105-H108 HydrophobicContact CB-CB 4.4Å; H108-R261 PolarHBondContact CE1-NH1 3.15Å; H108-R261 PolarHBondContact NE2-NH1 3.05Å; H108-D265 IonicContact CD2-OD2 3.48Å; H108-D265 IonicContact CE1-OD1 3.63Å; H108-D265 IonicContact CE1-OD2 3.12Å; H108-D265 PolarHBondContact CE1-OD2 3.12Å; H108-D265 IonicContact NE2-OD1 3.9Å; H108-D265 IonicContact NE2-OD2 2.68Å; H108-D265 PolarHBondContact NE2-OD2 3.05Å
109	R	31.2	Very low	33.5	Very low	194 Å²	194	141.1 Å²	141.1	73%	0.732	70%	0.695	S	S	*	*	H	α-helix	trans	-82.4	-28.3	168.8	-168	173.6	-73.9	-156.9	-2	113.9	N105 L107 S113	N105-R109 PolarHBondContact O-N 3.23Å; L107-R109 PolarHBondContact O-N 3.42Å; L107-R109 VanDerWaalsContact O-N 3.11Å; R109-S113 WeakPolarHBondContact O-CB 3.48Å; R109-S113 PolarHBondContact O-N 3.17Å; R109-S113 VanDerWaalsContact O-N 3.15Å
110	K	35.2	Very low	33.6	Very low	143 Å²	143	142.2 Å²	142.2	62%	0.622	70%	0.701	S	S	*	*	H	α-helix	trans	-69.1	-40.1	-176.7	-86.9	179.4	175.8	-178.3	0	113.5	T106 L107	T106-K110 WeakPolarHBondContact O-CG 3.4Å; T106-K110 PolarHBondContact O-N 3.38Å; L107-K110 PolarHBondContact O-N 2.87Å
111	L	39	Very low	33.6	Very low	99 Å²	99	143.7 Å²	143.7	52%	0.518	69%	0.694	S	S	.	*	H	α-helix	trans	-67.6	-37.2	179.1	-88.3	79.4	0	0	0	112.8
112	V	36.5	Very low	33.5	Very low	117 Å²	117	144 Å²	144	71%	0.709	70%	0.697	S	S	*	*	H	α-helix	trans	-83.8	-33.2	-174.8	-175.4	0	0	0	0	112.4	K114	V112-K114 VanDerWaalsContact C-N 3.27Å; V112-K114 PolarHBondContact O-N 3.49Å
113	S	34.9	Very low	33.4	Very low	96 Å²	96	147.5 Å²	147.5	67%	0.671	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	0.1	-170.9	-164.8	0	0	0	0	115.6	R109	R109-S113 WeakPolarHBondContact O-CB 3.48Å; R109-S113 PolarHBondContact O-N 3.17Å; R109-S113 VanDerWaalsContact O-N 3.15Å
114	K	35.9	Very low	33.5	Very low	197 Å²	197	146.1 Å²	146.1	86%	0.857	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	11	-175	-119.4	-176.3	-177.4	-176.5	0	115	V112	V112-K114 VanDerWaalsContact C-N 3.27Å; V112-K114 PolarHBondContact O-N 3.49Å
115	R	31.9	Very low	33.3	Very low	194 Å²	194	148.4 Å²	148.4	73%	0.732	71%	0.711	S	S	*	*	S	Bend	trans	-134.9	34.5	-166.4	-149.1	171.1	-173.4	168.7	-1.3	115.4
116	K	29.9	Very low	33.2	Very low	197 Å²	197	146.7 Å²	146.7	86%	0.857	71%	0.709	S	S	*	*			trans	-158.5	77.5	176.6	-149.3	-178.3	-169.1	-174.9	0	115.2
117	E	30.5	Very low	33.1	Very low	187 Å²	187	153 Å²	153	87%	0.874	72%	0.722	S	S	*	*			trans	-171.8	165.2	151.2	-111	156.6	-147.5	0	0	111.7
118	N	29.2	Very low	32.6	Very low	162 Å²	162	152.3 Å²	152.3	87%	0.866	73%	0.727	S	S	*	*			trans	74.8	93.5	-177.9	-58.9	-28.7	0	0	0	117.6
119	L	31.3	Very low	32.3	Very low	156 Å²	156	153.6 Å²	153.6	82%	0.817	75%	0.745	S	S	*	*			trans	-146.2	134	163.8	-145.5	162.4	0	0	0	107.8
120	L	33.3	Very low	32.2	Very low	142 Å²	142	149.1 Å²	149.1	74%	0.743	74%	0.744	S	S	*	*			trans	66.9	148.9	-169.2	-61.9	107.1	0	0	0	115.9
121	Q	31.1	Very low	32	Very low	147 Å²	147	149.5 Å²	149.5	69%	0.687	75%	0.752	S	S	*	*			cis	-175.5	167.9	-37.6	-124.9	175.5	-9.5	0	0	109.4
122	N	31.8	Very low	31.4	Very low	111 Å²	111	150.5 Å²	150.5	59%	0.594	76%	0.762	S	S	*	*			trans	58.9	105.6	149.3	-63.2	-6.4	0	0	0	118.7
123	Y	30.2	Very low	31	Very low	214 Å²	214	151.9 Å²	151.9	84%	0.839	76%	0.758	S	S	*	*			cis	-171.9	169.8	36.8	-98.8	-75.9	0	0	0	110.4
124	P	34.7	Very low	30.7	Very low	106 Å²	106	151.7 Å²	151.7	69%	0.688	76%	0.757	S	S	*	*			trans	-115	-166.7	-171.3	43.6	-33.1	0	0	0	114.7
125	R	28.4	Very low	30.3	Very low	237 Å²	237	151 Å²	151	89%	0.894	76%	0.757	S	S	*	*			trans	99.3	142.1	179.1	-65.9	178.7	171.1	175.3	-1.6	113.5
126	S	30.3	Very low	30.1	Very low	85 Å²	85	146 Å²	146	59%	0.594	75%	0.751	S	S	*	*			cis	-164.3	153.1	1.3	-118	0	0	0	0	112.8
127	R	31.9	Very low	30	Very low	228 Å²	228	142.9 Å²	142.9	86%	0.86	75%	0.752	S	S	*	*			trans	63.2	130.6	153.3	-63.6	174.8	177.2	-178.7	-3.7	117.9
128	S	28.9	Very low	29.9	Very low	106 Å²	106	141.2 Å²	141.2	74%	0.741	75%	0.748	S	S	*	*			cis	101.7	87.9	23.2	78.2	0	0	0	0	115.9
129	S	33.3	Very low	29.7	Very low	107 Å²	107	138.9 Å²	138.9	75%	0.748	74%	0.744	S	S	*	*			trans	-175.5	113.7	153.8	50.1	0	0	0	0	107.5
130	S	28.1	Very low	29.3	Very low	101 Å²	101	137.3 Å²	137.3	71%	0.706	74%	0.741	S	S	*	*				83.8	141.9	55.7	73.6	0	0	0	0	114
131	L	30.7	Very low	28.9	Very low	151 Å²	151	138.5 Å²	138.5	79%	0.791	74%	0.742	S	S	*	*			trans	79.4	99	-176.5	-72.6	88.5	0	0	0	114.5
132	T	27.7	Very low	28.7	Very low	119 Å²	119	138.2 Å²	138.2	73%	0.73	75%	0.745	S	S	*	*				82.7	116.7	89.8	53.7	0	0	0	0	113.2
133	K	27	Very low	28.3	Very low	146 Å²	146	140.9 Å²	140.9	64%	0.635	75%	0.754	S	S	*	*				54.3	134.1	87.7	-85.2	-147.5	180	-164.7	0	113.2	E412	K133-E412 WeakPolarHBondContact CE-OE1 3.4Å; K133-E412 IonicContact NZ-OE1 3.67Å; K133-E412 PolarHBondContact NZ-OE1 3.06Å; K133-E412 IonicContact NZ-OE2 3.39Å; K133-E412 PolarHBondContact NZ-OE2 3.45Å
134	S	28.2	Very low	28.3	Very low	92 Å²	92	136.7 Å²	136.7	64%	0.643	75%	0.751	S	S	*	*			cis	-176	-173.3	-5	42.3	0	0	0	0	109.1
135	Q	28.6	Very low	28.2	Very low	183 Å²	183	137.4 Å²	137.4	86%	0.855	76%	0.755	S	S	*	*			trans	103.2	147.1	172.7	-61.4	175.7	-8.4	0	0	115.1
136	S	27.3	Very low	28.1	Very low	88 Å²	88	134.1 Å²	134.1	62%	0.615	75%	0.75	S	S	*	*			cis	-164.6	178	-20.9	-89.9	0	0	0	0	107.8
137	P	27.9	Very low	28.2	Very low	133 Å²	133	137.7 Å²	137.7	86%	0.864	76%	0.757	S	S	*	*	S	Bend		-136.8	107.7	86.3	34.1	-18.4	0	0	0	113.7
138	L	27.8	Very low	28.2	Very low	152 Å²	152	134.5 Å²	134.5	80%	0.796	75%	0.752	S	S	*	*			trans	-150.1	119.9	159.3	-88.1	176.6	0	0	0	105.6
139	S	24.7	Very low	28.3	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	75%	0.747	S	S	*	*			trans	160.6	124.3	145.1	-78.5	0	0	0	0	114.9
140	V	23.7	Very low	28.4	Very low	123 Å²	123	137.5 Å²	137.5	75%	0.745	75%	0.753	S	S	*	*				70.2	130.6	124.4	-177.4	0	0	0	0	121.6
141	H	24.4	Very low	28.6	Very low	166 Å²	166	135.4 Å²	135.4	77%	0.769	75%	0.746	S	S	*	*			trans	69.6	114.4	158.9	-88.4	40.4	0	0	0	121.3
142	L	26.4	Very low	28.8	Very low	141 Å²	141	133.7 Å²	133.7	74%	0.738	75%	0.747	S	S	*	*				40.6	144.3	107.3	-128.9	74	0	0	0	121.3
143	E	25	Very low	28.9	Very low	168 Å²	168	134.1 Å²	134.1	79%	0.785	75%	0.745	S	S	*	*			trans	80.8	95.9	164.7	-56.5	-169.4	166.1	0	0	118.4
144	T	28.7	Very low	29.3	Very low	126 Å²	126	133 Å²	133	77%	0.773	75%	0.746	S	S	*	*				25.3	134.7	123.5	43.6	0	0	0	0	119.2
145	P	32.7	Very low	29.4	Very low	121 Å²	121	136 Å²	136	79%	0.786	75%	0.749	S	S	*	*				-138.2	170.2	59.5	38.6	-22.6	0	0	0	118.6
146	E	27.5	Very low	29.5	Very low	167 Å²	167	133.1 Å²	133.1	78%	0.78	74%	0.739	S	S	*	*			trans	-31.1	150.4	155.8	-50.7	175.8	132.8	0	0	113.4
147	E	32.5	Very low	29.5	Very low	160 Å²	160	136.6 Å²	136.6	75%	0.748	75%	0.746	S	S	*	*				-160.8	144.3	62.2	-85.5	-173.6	174.8	0	0	115.1
148	H	31.9	Very low	29.6	Very low	161 Å²	161	136.8 Å²	136.8	75%	0.745	74%	0.739	S	S	*	*			trans	57.4	129.2	141.2	-64.2	-51.4	0	0	0	125.4
149	S	30.9	Very low	29.8	Very low	93 Å²	93	133.6 Å²	133.6	65%	0.65	73%	0.73	S	S	*	*			trans	73.7	137.2	130.4	-174.2	0	0	0	0	118.5
150	E	34.2	Very low	30	Very low	184 Å²	184	135.2 Å²	135.2	86%	0.86	73%	0.729	S	S	*	*			cis	-159.7	160.8	-13.9	-109.1	151.4	-109.8	0	0	105.1
151	G	32.1	Very low	30.5	Very low	56 Å²	56	138.2 Å²	138.2	58%	0.577	73%	0.732	S	S	*	*			cis	143.8	147.2	6.6	0	0	0	0	0	109.5
152	S	34.8	Very low	30.7	Very low	116 Å²	116	137.1 Å²	137.1	81%	0.811	73%	0.731	S	S	*	*			trans	72.5	148	170.5	90.1	0	0	0	0	117.1
153	N	31.1	Very low	30.7	Very low	128 Å²	128	135.3 Å²	135.3	68%	0.684	73%	0.73	S	S	*	*			cis	-173.9	173.2	-27.2	-122.8	32.5	0	0	0	110.9
154	D	34.8	Very low	31.1	Very low	122 Å²	122	133 Å²	133	65%	0.652	73%	0.733	S	S	*	*			trans	64.7	148.7	140.3	-68.7	-19.8	0	0	0	121.6
155	H	30.8	Very low	31.3	Very low	154 Å²	154	134.8 Å²	134.8	71%	0.713	74%	0.736	S	S	*	*			cis	-168.5	176.8	-23.8	-142	-143.2	0	0	0	108.9
156	L	30.4	Very low	31.2	Very low	123 Å²	123	134.6 Å²	134.6	64%	0.644	74%	0.735	S	S	*	*			trans	66.5	100.1	150.4	-67.4	162.5	0	0	0	122.7
157	E	27.3	Very low	31.4	Very low	162 Å²	162	138.4 Å²	138.4	76%	0.757	74%	0.742	S	S	*	*				74.7	156.7	101.2	-87.6	-168.6	167.3	0	0	126.3
158	L	29.8	Very low	31.2	Very low	137 Å²	137	135.5 Å²	135.5	72%	0.717	74%	0.739	S	S	*	*			trans	86.6	93.7	149.4	-105.9	78.3	0	0	0	122.1
159	S	31.8	Very low	31.1	Very low	85 Å²	85	135.3 Å²	135.3	59%	0.594	74%	0.743	S	S	*	*				110.4	115.9	109	71	0	0	0	0	121.8
160	N	29.8	Very low	31	Very low	147 Å²	147	135.6 Å²	135.6	79%	0.786	75%	0.745	S	S	*	*				49	117.9	123.8	-48.5	-30.5	0	0	0	118.4
161	K	33.5	Very low	30.9	Very low	185 Å²	185	130.9 Å²	130.9	80%	0.804	73%	0.732	S	S	*	*				-171.4	140.3	61.5	-84.2	-170.9	172.6	-177	0	114.7
162	L	28.6	Very low	31	Very low	144 Å²	144	135.8 Å²	135.8	75%	0.754	75%	0.745	S	S	*	*			trans	51.4	114.5	136.7	-71	155.2	0	0	0	122.5
163	S	27.1	Very low	31	Very low	102 Å²	102	134 Å²	134	71%	0.713	74%	0.738	S	S	*	*				92.8	145.4	120.3	75.7	0	0	0	0	122.8
164	S	33	Very low	31.1	Very low	121 Å²	121	136.5 Å²	136.5	85%	0.846	74%	0.743	S	S	*	*			trans	78.3	126.7	170.7	65.8	0	0	0	0	119.9
165	I	32.3	Very low	31.1	Very low	163 Å²	163	137.4 Å²	137.4	84%	0.836	75%	0.747	S	S	*	*			trans	-105.4	162.5	178.9	-68.9	163.9	0	0	0	107.3
166	P	31.4	Very low	31.2	Very low	116 Å²	116	137.7 Å²	137.7	75%	0.753	75%	0.749	S	S	*	*			cis	-116.4	-176.8	-6.7	23.9	-2.5	0	0	0	113.2
167	R	30.7	Very low	31.3	Very low	247 Å²	247	140.1 Å²	140.1	93%	0.932	76%	0.756	S	S	*	*			trans	-127.3	132.2	163.3	-80.1	-172.3	178.7	163.9	1.7	113
168	S	29.4	Very low	31.5	Very low	99 Å²	99	137.4 Å²	137.4	69%	0.692	75%	0.751	S	S	*	*			trans	-94.6	-173.7	157.5	54.7	0	0	0	0	110.3
169	L	28.5	Very low	31.7	Very low	157 Å²	157	138.8 Å²	138.8	82%	0.822	76%	0.758	S	S	*	*			trans	77.2	116	173.2	-57	164.3	0	0	0	114.6
170	S	30.7	Very low	31.8	Very low	100 Å²	100	141.9 Å²	141.9	70%	0.699	76%	0.763	S	S	*	*				95.9	154.5	77.4	-163.9	0	0	0	0	110.2
171	S	31.8	Very low	31.9	Very low	84 Å²	84	142.8 Å²	142.8	59%	0.587	76%	0.762	S	S	*	*			cis	-170.1	166.2	34.5	-35.6	0	0	0	0	114.7
172	N	32.8	Very low	31.7	Very low	159 Å²	159	139 Å²	139	85%	0.85	76%	0.759	S	S	*	*			trans	71.4	154.4	145.3	-57.8	-19.8	0	0	0	119.2
173	A	35.1	Very low	32.4	Very low	79 Å²	79	137.1 Å²	137.1	65%	0.653	76%	0.755	S	S	*	*			cis	-143.6	178.2	7.2	0	0	0	0	0	110.7
174	F	33.5	Very low	32.5	Very low	181 Å²	181	138.3 Å²	138.3	79%	0.794	76%	0.758	S	S	*	*			cis	-161.3	154.4	22.5	-127.7	-56.8	0	0	0	112.5
175	L	35.4	Very low	32.2	Very low	141 Å²	141	137 Å²	137	74%	0.738	75%	0.748	S	S	*	*			trans	69.2	121.7	166.7	-53.7	175.9	0	0	0	117.3
176	Q	33.2	Very low	32	Very low	160 Å²	160	138.9 Å²	138.9	75%	0.748	74%	0.744	S	S	*	*			cis	91.1	127	31	-165.5	161.3	-4.8	0	0	111.6
177	E	32.7	Very low	31.8	Very low	173 Å²	173	143.9 Å²	143.9	81%	0.808	75%	0.748	S	S	*	*			cis	-127.7	160.7	36.1	-74.8	-178.5	129.8	0	0	119.2
178	T	30.5	Very low	31.8	Very low	106 Å²	106	143.9 Å²	143.9	65%	0.65	75%	0.748	S	S	*	*			trans	-57.9	154.9	173.1	47.8	0	0	0	0	116.4
179	I	34.4	Very low	31.7	Very low	165 Å²	165	143.3 Å²	143.3	85%	0.846	75%	0.75	S	S	*	*				178.2	156	90.9	-91.8	163.9	0	0	0	109.5
180	H	32.6	Very low	31.9	Very low	151 Å²	151	147.5 Å²	147.5	70%	0.699	76%	0.755	S	S	*	*			cis	-170	167.6	-37.1	-156	-127.1	0	0	0	110.2
181	E	33.5	Very low	31.8	Very low	166 Å²	166	149.3 Å²	149.3	78%	0.776	75%	0.746	S	S	*	*			trans	71.8	159.4	165.9	-53.3	-144.2	163.8	0	0	122.6
182	S	29.2	Very low	31.6	Very low	106 Å²	106	153.8 Å²	153.8	74%	0.741	76%	0.755	S	S	*	*			trans	-172.6	-160.1	-165.4	72.1	0	0	0	0	108.6
183	P	42.7	Very low	31.4	Very low	104 Å²	104	149.2 Å²	149.2	68%	0.675	75%	0.746	S	S	*	*			cis	-130.2	-162.7	-41.6	39.1	-21.4	0	0	0	112.2
184	V	28.4	Very low	31	Very low	126 Å²	126	151.7 Å²	151.7	76%	0.764	76%	0.758	S	S	*	*			trans	64.6	116.8	151.2	168.5	0	0	0	0	119.7
185	C	27.2	Very low	30.7	Very low	95 Å²	95	146.9 Å²	146.9	64%	0.642	75%	0.752	S	S	*	*				168.7	136.9	104.1	-126.8	0	0	0	0	116.5
186	R	29.2	Very low	30.3	Very low	201 Å²	201	150.4 Å²	150.4	76%	0.758	76%	0.755	S	S	*	*			trans	54.1	127.4	142.3	-70.8	166.3	-176.1	-174.2	1.5	123
187	R	27	Very low	30	Very low	222 Å²	222	152.5 Å²	152.5	84%	0.838	76%	0.756	S	S	*	*				51.8	137.3	128.5	-55.3	173.1	177.1	170.8	-2.4	117.9
188	R	29.9	Very low	29.8	Very low	246 Å²	246	149.7 Å²	149.7	93%	0.928	75%	0.751	S	S	*	*			cis	-174.8	160	49.1	-157.3	178.9	-165.1	178.1	4.7	110.5
189	A	28.2	Very low	29.6	Very low	88 Å²	88	154.7 Å²	154.7	73%	0.727	76%	0.758	S	S	*	*			trans	-90.2	152	-178.7	0	0	0	0	0	115.7
190	R	32.1	Very low	29.5	Very low	245 Å²	245	155.1 Å²	155.1	93%	0.925	76%	0.756	S	S	*	*			trans	166.6	155.9	151.9	-92.9	155.7	-171.6	-147.8	0.3	108.2
191	R	28.2	Very low	29.4	Very low	137 Å²	137	154.2 Å²	154.2	52%	0.517	75%	0.747	S	S	.	*			cis	164.2	144.6	-26.7	-135.4	-162.5	-164.5	-171	9.2	104.3	N1103	R191-N1103 PolarHBondContact NE-OD1 2.97Å; R191-N1103 PolarHBondContact NH2-OD1 3.21Å
192	F	28.6	Very low	29.2	Very low	179 Å²	179	153.1 Å²	153.1	79%	0.785	75%	0.746	S	S	*	*			trans	65	151	-179.4	-50.1	-72.3	0	0	0	115.1
193	G	26.8	Very low	29.3	Very low	63 Å²	63	153 Å²	153	65%	0.649	73%	0.733	S	S	*	*			cis	157.3	155	-2	0	0	0	0	0	110.8
194	S	28.5	Very low	28.8	Very low	131 Å²	131	153.3 Å²	153.3	92%	0.916	74%	0.738	S	S	*	*			trans	62.4	161.6	-173.5	-73.5	0	0	0	0	115.9
195	A	27.4	Very low	29	Very low	79 Å²	79	155.8 Å²	155.8	65%	0.653	74%	0.742	S	S	*	*			cis	174.5	161.8	-31.2	0	0	0	0	0	106.2
196	R	26.5	Very low	29.4	Very low	216 Å²	216	157.3 Å²	157.3	82%	0.815	75%	0.747	S	S	*	*			trans	66.7	147.2	169.8	-74.7	-178.7	176.2	-170.8	0.5	115.2
197	R	25.8	Very low	29.7	Very low	203 Å²	203	153 Å²	153	77%	0.766	75%	0.749	S	S	*	*			cis	-169.1	172	-17.3	-130.6	178.7	-166.3	-171.1	2.6	109.8
198	V	28.5	Very low	30.2	Very low	114 Å²	114	146.5 Å²	146.5	69%	0.691	74%	0.742	S	S	*	*			trans	80.8	109.2	150.3	168	0	0	0	0	119.1
199	R	26.9	Very low	30.5	Very low	211 Å²	211	140.4 Å²	140.4	80%	0.796	74%	0.737	S	S	*	*			trans	52	130.3	136.7	-59.9	179.9	165.7	166.4	-6.8	119.6
200	Q	32.1	Very low	30.9	Very low	174 Å²	174	140.4 Å²	140.4	81%	0.813	74%	0.737	S	S	*	*				57.4	133.7	61.6	-70.3	-171.6	-20.7	0	0	113.2
201	R	29.8	Very low	31.1	Very low	133 Å²	133	132.5 Å²	132.5	50%	0.502	72%	0.724	S	S	.	*				-169.5	160.2	58	-156.5	-177	-139.6	152.5	-4.2	113	S1126 H1127 T1128	R201-S1126 PolarHBondContact NH1-O 3.14Å; R201-H1127 WeakPolarHBondContact CD-O 3.48Å; R201-H1127 PolarHBondContact NH1-O 3.24Å; R201-H1127 VanDerWaalsContact NH1-O 3.16Å; R201-T1128 HydrophobicContact CB-CG2 4.19Å; R201-T1128 HydrophobicContact CG-CG2 4.36Å
202	N	29.8	Very low	31.5	Very low	142 Å²	142	132.4 Å²	132.4	76%	0.759	74%	0.739	S	S	*	*			trans	-88.4	156.4	172.6	-51.6	-5.3	0	0	0	111.7	T1128	N202-T1128 WeakPolarHBondContact O-CG2 3.45Å
203	E	31.4	Very low	31.8	Very low	103 Å²	103	127.8 Å²	127.8	48%	0.481	73%	0.734	S	S	.	*			trans	-134.5	159.8	150.1	-113.7	156	-161.7	0	0	111.7	H1127 T1128	E203-H1127 WeakPolarHBondContact OE1-CA 3.25Å; E203-H1127 IonicContact OE1-CE1 3.7Å; E203-H1127 IonicContact OE1-CG 3.96Å; E203-H1127 IonicContact OE1-ND1 2.79Å; E203-H1127 PolarHBondContact OE1-ND1 3.47Å; E203-H1127 IonicContact OE2-ND1 3.77Å; E203-T1128 HydrophobicContact CB-CG2 3.67Å; E203-T1128 HydrophobicContact CG-CG2 3.58Å; E203-T1128 WeakPolarHBondContact OE2-CB 3.46Å; E203-T1128 WeakPolarHBondContact OE2-CG2 3.22Å; E203-T1128 PolarHBondContact OE2-OG1 3.41Å
204	S	31.7	Very low	32.2	Very low	111 Å²	111	131.6 Å²	131.6	78%	0.776	74%	0.738	S	S	*	*			trans	-154.9	142.9	-175.4	-50.2	0	0	0	0	107.6
205	E	32.7	Very low	32.5	Very low	179 Å²	179	134 Å²	134	84%	0.836	73%	0.734	S	S	*	*			trans	-138.6	121.8	175.9	-82.7	-150.5	127.5	0	0	109.6
206	V	36.6	Very low	32.6	Very low	126 Å²	126	135 Å²	135	76%	0.764	74%	0.737	S	S	*	*				88.5	128.4	95.4	164.2	0	0	0	0	111.3
207	S	36.2	Very low	33.1	Very low	112 Å²	112	130.3 Å²	130.3	78%	0.783	73%	0.734	S	S	*	*			cis	-154	-173.2	-7.1	52.1	0	0	0	0	107.8
208	A	35.6	Very low	33.3	Very low	85 Å²	85	127.6 Å²	127.6	70%	0.702	73%	0.734	S	S	*	*			cis	-148.1	175	16.8	0	0	0	0	0	108.9
209	S	37.1	Very low	33.5	Very low	117 Å²	117	127.9 Å²	127.9	82%	0.818	74%	0.736	S	S	*	*			cis	70.9	134.1	35.8	-131	0	0	0	0	114.4
210	A	37.3	Very low	33.7	Very low	89 Å²	89	124.9 Å²	124.9	74%	0.736	74%	0.735	S	S	*	*			cis	-143.9	-170	8	0	0	0	0	0	109.9
211	A	35.9	Very low	33.6	Very low	78 Å²	78	121.3 Å²	121.3	65%	0.645	74%	0.735	S	S	*	*			cis	-160.4	133.5	12.8	0	0	0	0	0	110.4
212	T	35.9	Very low	33.7	Very low	135 Å²	135	120 Å²	120	83%	0.828	75%	0.752	S	S	*	*				72.4	144.9	95.5	64.2	0	0	0	0	117.7
213	A	34.6	Very low	33.7	Very low	82 Å²	82	122.7 Å²	122.7	68%	0.678	76%	0.757	S	S	*	*			cis	-178.9	-160.9	-13.8	0	0	0	0	0	109.5
214	I	35.8	Very low	33.9	Very low	144 Å²	144	126 Å²	126	74%	0.738	78%	0.778	S	S	*	*			trans	84.3	127	156.9	-61.6	160	0	0	0	115.4
215	E	34.4	Very low	33.8	Very low	180 Å²	180	128.1 Å²	128.1	84%	0.841	78%	0.776	S	S	*	*			cis	-158.9	174.8	-13.6	-124.1	161.8	-165.7	0	0	111.4
216	S	30.7	Very low	33.7	Very low	101 Å²	101	124.8 Å²	124.8	71%	0.706	77%	0.77	S	S	*	*			trans	-114.8	179.4	174.7	61.9	0	0	0	0	111.8
217	P	36.8	Very low	33.3	Very low	117 Å²	117	126 Å²	126	76%	0.76	77%	0.771	S	S	*	*				-153.5	-171.8	96	40.2	-20.3	0	0	0	116.7
218	L	29.5	Very low	32.9	Very low	146 Å²	146	128.1 Å²	128.1	76%	0.764	77%	0.769	S	S	*	*			trans	-75.8	-177.2	-174.2	-50.7	74.6	0	0	0	113.2
219	T	32.3	Very low	32.6	Very low	120 Å²	120	132.3 Å²	132.3	74%	0.736	78%	0.778	S	S	*	*				-180	118.1	76.7	-58.1	0	0	0	0	115
220	I	31.2	Very low	32	Very low	149 Å²	149	133.5 Å²	133.5	76%	0.764	77%	0.768	S	S	*	*			trans	53	106.6	141.2	-53.1	173	0	0	0	122.5
221	A	30.1	Very low	31.7	Very low	98 Å²	98	135.4 Å²	135.4	81%	0.81	77%	0.771	S	S	*	*				42.6	138.4	127.2	0	0	0	0	0	125.8
222	A	32.6	Very low	31.3	Very low	105 Å²	105	138.3 Å²	138.3	87%	0.868	78%	0.776	S	S	*	*			trans	-152.4	163.6	131.9	0	0	0	0	0	110.8
223	K	30	Very low	31	Very low	199 Å²	199	139 Å²	139	87%	0.865	77%	0.773	S	S	*	*			trans	-103	152	-179.4	-65.6	178.5	178	179.3	0	112.4
224	N	35.4	Very low	30.8	Very low	173 Å²	173	140.9 Å²	140.9	93%	0.925	78%	0.778	S	S	*	*				-163.8	150.7	127.4	-93.2	-23.4	0	0	0	110.2
225	E	28.1	Very low	30.6	Very low	155 Å²	155	140.2 Å²	140.2	72%	0.724	78%	0.78	S	S	*	*			trans	-121	164.4	178.4	-152	-160	-95.3	0	0	108.6	L227	E225-L227 PolarHBondContact OE2-N 2.84Å
226	P	31.6	Very low	30.6	Very low	110 Å²	110	143.1 Å²	143.1	71%	0.714	78%	0.784	S	S	*	*				-149.7	141.4	97.1	36.1	-18.5	0	0	0	117.2
227	L	29	Very low	30.6	Very low	150 Å²	150	147.6 Å²	147.6	79%	0.785	79%	0.79	S	S	*	*			trans	60.7	115.9	137.4	-58.5	175	0	0	0	120.2	E225	E225-L227 PolarHBondContact OE2-N 2.84Å
228	Q	27	Very low	30.5	Very low	157 Å²	157	151.8 Å²	151.8	73%	0.734	79%	0.791	S	S	*	*			trans	-86	159.1	161.3	-64.6	176.3	-30.4	0	0	112.1
229	I	28.7	Very low	30.6	Very low	174 Å²	174	156.2 Å²	156.2	89%	0.892	80%	0.797	S	S	*	*			trans	-121	136	150.5	-66	179.9	0	0	0	107.2
230	F	25.2	Very low	30.6	Very low	142 Å²	142	161.6 Å²	161.6	62%	0.623	80%	0.804	S	S	*	*			trans	-89.2	146.2	-176	-94	-115.3	0	0	0	112.5
231	T	30.2	Very low	30.7	Very low	128 Å²	128	162 Å²	162	79%	0.785	80%	0.801	S	S	*	*			trans	-132.8	135.4	142.1	46.6	0	0	0	0	108.5
232	D	27.3	Very low	30.9	Very low	140 Å²	140	162.5 Å²	162.5	75%	0.749	80%	0.798	S	S	*	*			trans	-93	126.5	-171.3	-77.5	-62.4	0	0	0	112.5
233	I	29.7	Very low	30.9	Very low	150 Å²	150	164.1 Å²	164.1	77%	0.769	79%	0.792	S	S	*	*			trans	-119.5	122.5	165	-59.8	-179.2	0	0	0	108.9	V235	I233-V235 PolarHBondContact O-N 2.83Å
234	P	31.8	Very low	31.2	Very low	120 Å²	120	160.1 Å²	160.1	78%	0.779	79%	0.79	S	S	*	*			trans	-78.2	92.4	-171.1	30.6	-35.5	0	0	0	112.3	R236	P234-R236 PolarHBondContact O-N 3.38Å
235	V	31.8	Very low	31.3	Very low	131 Å²	131	156.2 Å²	156.2	79%	0.794	77%	0.772	S	S	*	*			trans	-53.5	107.9	169.9	179	0	0	0	0	109.9	I233 K237	I233-V235 PolarHBondContact O-N 2.83Å; V235-K237 PolarHBondContact O-N 3.19Å
236	R	33	Very low	32	Very low	241 Å²	241	152.1 Å²	152.1	91%	0.909	76%	0.755	S	S	*	*			trans	-62.3	105.7	176.9	-81.4	-173.8	168.9	102.7	-4.6	109.3	P234 R238	P234-R236 PolarHBondContact O-N 3.38Å; R236-R238 PolarHBondContact O-N 2.95Å; R236-R238 VanDerWaalsContact O-N 3.08Å
237	K	32.4	Very low	32.4	Very low	195 Å²	195	152.1 Å²	152.1	85%	0.848	75%	0.754	S	S	*	*			trans	-55.5	114.3	178.8	-69	174.7	178.9	171.9	0	110.3	V235 R239	V235-K237 PolarHBondContact O-N 3.19Å; K237-R239 PolarHBondContact O-N 3.26Å
238	R	34.1	Very low	33.2	Very low	204 Å²	204	152 Å²	152	77%	0.77	76%	0.755	S	S	*	*			trans	-46.9	114.9	161.6	-78.7	-175.4	172.2	-171	-4.2	107.5	R236 R240	R236-R238 PolarHBondContact O-N 2.95Å; R236-R238 VanDerWaalsContact O-N 3.08Å; R238-R240 PolarHBondContact O-N 3.41Å; R238-R240 VanDerWaalsContact O-N 3.17Å
239	R	32	Very low	34.6	Very low	239 Å²	239	146.6 Å²	146.6	90%	0.902	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-63.3	118.4	169.8	-84.9	-174	173.1	-178.9	-1.1	106.6	K237 F241	K237-R239 PolarHBondContact O-N 3.26Å; R239-F241 PolarHBondContact O-N 2.76Å
240	R	31.4	Very low	36.9	Very low	234 Å²	234	142.7 Å²	142.7	88%	0.883	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-60.3	134.1	161.4	-66.8	-175.9	178.9	-168.4	-2	107	R238 S242	R238-R240 PolarHBondContact O-N 3.41Å; R238-R240 VanDerWaalsContact O-N 3.17Å; R240-S242 PolarHBondContact O-N 3.18Å; R240-S242 VanDerWaalsContact O-N 3.09Å
241	F	34.2	Very low	40	Very low	158 Å²	158	137.1 Å²	137.1	69%	0.693	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-55.9	116.8	165.4	-71.7	-88.6	0	0	0	107.6	R239	R239-F241 PolarHBondContact O-N 2.76Å
242	S	34.2	Very low	42.9	Very low	107 Å²	107	131.7 Å²	131.7	75%	0.748	67%	0.67	S	S	*	*			trans	-93.5	105.3	175.4	54.4	0	0	0	0	107.8	R240 S244	R240-S242 PolarHBondContact O-N 3.18Å; R240-S242 VanDerWaalsContact O-N 3.09Å; S242-S244 PolarHBondContact O-N 2.75Å
243	D	32.2	Very low	46	Very low	139 Å²	139	128 Å²	128	74%	0.743	66%	0.655	S	S	*	*			trans	-20.4	84.5	-179.1	-66.9	-50.8	0	0	0	116.2	T245	D243-T245 HydrophobicContact CB-CG2 3.89Å; D243-T245 PolarHBondContact O-N 3.12Å; D243-T245 VanDerWaalsContact O-N 3.17Å
244	S	35.4	Very low	49.1	Very low	116 Å²	116	120.9 Å²	120.9	81%	0.811	62%	0.618	S	S	*	*			trans	-84.4	57.3	157.3	59.4	0	0	0	0	108.3	S242 I246	S242-S244 PolarHBondContact O-N 2.75Å; S244-I246 PolarHBondContact O-N 2.76Å; S244-I246 VanDerWaalsContact O-N 3.11Å
245	T	38	Very low	52.1	Low	91 Å²	91	117.3 Å²	117.3	56%	0.558	59%	0.594	S	S	*	*			trans	-63.7	113	-174.3	45.6	0	0	0	0	110.7	D243	D243-T245 HydrophobicContact CB-CG2 3.89Å; D243-T245 PolarHBondContact O-N 3.12Å; D243-T245 VanDerWaalsContact O-N 3.17Å
246	I	43.6	Very low	55.1	Low	69 Å²	69	111.5 Å²	111.5	35%	0.354	56%	0.558	S	S	.	*			trans	-44.9	131.2	141.7	-49	141.4	0	0	0	106.1	S244 N248 V528	S244-I246 PolarHBondContact O-N 2.76Å; S244-I246 VanDerWaalsContact O-N 3.11Å; I246-N248 PolarHBondContact O-N 3.3Å; I246-V528 HydrophobicContact CD1-CG1 3.67Å; I246-V528 HydrophobicContact CG1-CG1 3.94Å; I246-V528 HydrophobicContact CG1-CG2 4.38Å
247	P	39.3	Very low	58	Low	109 Å²	109	104.8 Å²	104.8	71%	0.708	54%	0.54	S	S	*	.			trans	-58.4	113.1	178.9	24.3	-33.6	0	0	0	108.8	S249	P247-S249 PolarHBondContact O-N 3.44Å
248	N	45.7	Very low	61	Low	149 Å²	149	99.3 Å²	99.3	80%	0.797	52%	0.518	S	S	*	.			trans	-29.8	95.6	-165.8	-78.6	-13	0	0	0	113.4	I246 A250	I246-N248 PolarHBondContact O-N 3.3Å; N248-A250 PolarHBondContact O-N 3.03Å; N248-A250 VanDerWaalsContact O-N 3.16Å
249	S	56.9	Low	63.9	Low	43 Å²	43	89.6 Å²	89.6	30%	0.301	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-65	119	174.3	42	0	0	0	0	107.8	P247 F251 Q532	P247-S249 PolarHBondContact O-N 3.44Å; S249-F251 PolarHBondContact O-N 2.8Å; S249-Q532 PolarHBondContact O-NE2 3.17Å
250	A	77.2	Confident	66.8	Low	91 Å²	91	80.3 Å²	80.3	75%	0.752	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-61.1	135.3	170.6	0	0	0	0	0	108.2	N248	N248-A250 PolarHBondContact O-N 3.03Å; N248-A250 VanDerWaalsContact O-N 3.16Å
251	F	89.2	Confident	69.9	Low	25 Å²	25	75 Å²	75	11%	0.11	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-53.8	132.2	177.9	-174.3	-82.1	0	0	0	109.6	S22 V24 V27 I86 L90 S249 C253	S22-F251 VanDerWaalsContact C-CD1 3.42Å; V24-F251 HydrophobicContact CG2-CD2 4.02Å; V24-F251 HydrophobicContact CG2-CE2 3.73Å; V27-F251 HydrophobicContact CG2-CE1 4.27Å; V27-F251 HydrophobicContact CG2-CZ 4.01Å; I86-F251 HydrophobicContact CD1-CZ 4.33Å; I86-F251 HydrophobicContact CG1-CZ 4.31Å; I86-F251 HydrophobicContact CG2-CE1 4.44Å; I86-F251 HydrophobicContact CG2-CE2 3.96Å; I86-F251 HydrophobicContact CG2-CZ 3.64Å; L90-F251 HydrophobicContact CD1-CD2 4.23Å; L90-F251 HydrophobicContact CD1-CE2 4.05Å; S249-F251 PolarHBondContact O-N 2.8Å; F251-C253 PolarHBondContact O-N 2.59Å
252	P	92.1	Very high	72.9	Confident	15 Å²	15	68.2 Å²	68.2	10%	0.097	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-65.8	125.5	-169.5	25.9	-35.4	0	0	0	111.7	L21 Y85 I86 H89 L90 L254	L21-P252 VanDerWaalsContact O-O 3.13Å; Y85-P252 HydrophobicContact CE1-CB 4.01Å; I86-P252 HydrophobicContact CG2-CG 4.26Å; H89-P252 HydrophobicContact CB-CB 3.6Å; H89-P252 HydrophobicContact CB-CG 3.81Å; L90-P252 HydrophobicContact CD2-CG 4.41Å; L90-P252 HydrophobicContact CG-CG 4.1Å; P252-L254 PolarHBondContact O-N 3.01Å
253	C	91.9	Very high	75.8	Confident	62 Å²	62	63.3 Å²	63.3	42%	0.419	36%	0.364	S	S	.	.			trans	-86	87.3	-175.8	177.8	0	0	0	0	111.4	L21 F251 T255	L21-C253 CarbonylContact O-C 3.56Å; L21-C253 WeakPolarHBondContact O-CA 3.03Å; F251-C253 PolarHBondContact O-N 2.59Å; C253-T255 PolarHBondContact O-N 3.31Å
254	L	95.3	Very high	78.8	Confident	0 Å²	0	59 Å²	59	0%	0	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-74.7	119	175.4	-177.7	55.6	0	0	0	110.6	F19 L21 V82 Y85 P252 E258 L259	F19-L254 HydrophobicContact CE1-CD2 4.38Å; F19-L254 HydrophobicContact CE1-CG 4.27Å; L21-L254 HydrophobicContact CB-CB 4.38Å; L21-L254 HydrophobicContact CD1-CD2 4.45Å; L21-L254 PolarHBondContact N-O 3.41Å; L21-L254 PolarHBondContact O-N 2.93Å; V82-L254 HydrophobicContact CG2-CD2 4.18Å; Y85-L254 HydrophobicContact CD1-CB 3.83Å; Y85-L254 HydrophobicContact CD1-CD1 4.01Å; Y85-L254 HydrophobicContact CD1-CD2 4.01Å; Y85-L254 HydrophobicContact CD1-CG 4.15Å; Y85-L254 HydrophobicContact CD2-CD1 4.05Å; Y85-L254 HydrophobicContact CE1-CB 3.59Å; Y85-L254 HydrophobicContact CE1-CD1 3.94Å; Y85-L254 HydrophobicContact CE1-CG 4.21Å; Y85-L254 HydrophobicContact CE2-CD1 3.98Å; Y85-L254 HydrophobicContact CG-CD1 4.07Å; Y85-L254 HydrophobicContact CG-CD2 4.23Å; P252-L254 PolarHBondContact O-N 3.01Å; L254-E258 HydrophobicContact CD1-CB 4.07Å; L254-L259 HydrophobicContact CD1-CB 4.3Å; L254-L259 HydrophobicContact CD2-CB 4.36Å; L254-L259 HydrophobicContact CD2-CD1 4.48Å; L254-L259 HydrophobicContact CD2-CD2 4.41Å; L254-L259 HydrophobicContact CG-CB 4.39Å
255	T	95.4	Very high	81.7	Confident	45 Å²	45	55.1 Å²	55.1	28%	0.276	31%	0.311	S	S	.	.			trans	-85	154.4	171.6	73.6	0	0	0	0	111.7	T20 C253 D257 E258 L259	T20-T255 HydrophobicContact CG2-CG2 3.97Å; C253-T255 PolarHBondContact O-N 3.31Å; T255-D257 PolarHBondContact O-N 3.4Å; T255-E258 VanDerWaalsContact CB-OE2 3.27Å; T255-E258 WeakPolarHBondContact CB-OE2 3.35Å; T255-E258 VanDerWaalsContact CG2-OE2 3.31Å; T255-E258 WeakPolarHBondContact CG2-OE2 3.37Å; T255-E258 PolarHBondContact N-OE2 3.16Å; T255-E258 PolarHBondContact O-N 3.19Å; T255-E258 VanDerWaalsContact OG1-CD 3.27Å; T255-E258 VanDerWaalsContact OG1-CG 3.29Å; T255-E258 WeakPolarHBondContact OG1-CG 3.22Å; T255-E258 PolarHBondContact OG1-N 3.5Å; T255-E258 PolarHBondContact OG1-OE2 3.01Å; T255-L259 PolarHBondContact O-N 3.41Å
256	F	94.4	Very high	84.5	Confident	10 Å²	10	50.8 Å²	50.8	4%	0.044	28%	0.284	C	S	.	.	H	α-helix	trans	-61.7	-35.1	176	-176.5	-94.3	0	0	0	112.2	V12 R16 F19 L259 E260	V12-F256 HydrophobicContact CG1-CE2 4.39Å; V12-F256 HydrophobicContact CG1-CZ 4.39Å; V12-F256 WeakPolarHBondContact O-CE2 3.41Å; R16-F256 HydrophobicContact CB-CD2 3.76Å; R16-F256 HydrophobicContact CB-CE1 4.49Å; R16-F256 HydrophobicContact CB-CE2 3.66Å; R16-F256 HydrophobicContact CB-CG 4.22Å; R16-F256 HydrophobicContact CB-CZ 4.05Å; R16-F256 HydrophobicContact CG-CB 4.17Å; R16-F256 HydrophobicContact CG-CD1 3.87Å; R16-F256 HydrophobicContact CG-CD2 3.67Å; R16-F256 HydrophobicContact CG-CE1 4.15Å; R16-F256 HydrophobicContact CG-CE2 3.98Å; R16-F256 HydrophobicContact CG-CG 3.6Å; R16-F256 HydrophobicContact CG-CZ 4.2Å; F19-F256 HydrophobicContact CB-CB 3.78Å; F19-F256 HydrophobicContact CD1-CB 4.1Å; F19-F256 HydrophobicContact CD2-CB 4.36Å; F19-F256 AromaticContact CD2-CD2 3.85Å; F19-F256 HydrophobicContact CD2-CD2 3.85Å; F19-F256 HydrophobicContact CE2-CD2 4.14Å; F19-F256 HydrophobicContact CG-CB 3.8Å; F19-F256 HydrophobicContact CG-CD2 4.13Å; F19-F256 HydrophobicContact CG-CG 4.49Å; F256-L259 PolarHBondContact O-N 2.79Å; F256-E260 HydrophobicContact CD1-CB 4.28Å; F256-E260 HydrophobicContact CE1-CB 3.9Å; F256-E260 HydrophobicContact CE1-CG 4.33Å; F256-E260 HydrophobicContact CZ-CB 4.38Å; F256-E260 WeakPolarHBondContact O-CB 3.41Å; F256-E260 PolarHBondContact O-N 3.09Å
257	D	93.5	Very high	86.9	Confident	99 Å²	99	49.5 Å²	49.5	53%	0.529	28%	0.275	S	S	.	.	H	α-helix	trans	-75.3	-29.8	-173.2	-61.4	-1	0	0	0	111	R16 T255 R261	R16-D257 IonicContact CZ-OD1 3.47Å; R16-D257 IonicContact NH2-OD1 3.96Å; R16-D257 PolarHBondContact NH2-OD1 3.25Å; R16-D257 IonicContact NH2-OD2 3.92Å; T255-D257 PolarHBondContact O-N 3.4Å; D257-R261 WeakPolarHBondContact O-CB 3.33Å; D257-R261 PolarHBondContact O-N 2.94Å; D257-R261 VanDerWaalsContact O-N 3.14Å
258	E	94.7	Very high	89.6	Confident	80 Å²	80	47.6 Å²	47.6	37%	0.374	26%	0.259	S	S	.	.	H	α-helix	trans	-69.2	-42.7	168.3	-71	163.1	129.7	0	0	112.1	L254 T255 R261 L262	L254-E258 HydrophobicContact CD1-CB 4.07Å; T255-E258 VanDerWaalsContact CB-OE2 3.27Å; T255-E258 WeakPolarHBondContact CB-OE2 3.35Å; T255-E258 VanDerWaalsContact CG2-OE2 3.31Å; T255-E258 WeakPolarHBondContact CG2-OE2 3.37Å; T255-E258 PolarHBondContact N-OE2 3.16Å; T255-E258 PolarHBondContact O-N 3.19Å; T255-E258 VanDerWaalsContact OG1-CD 3.27Å; T255-E258 VanDerWaalsContact OG1-CG 3.29Å; T255-E258 WeakPolarHBondContact OG1-CG 3.22Å; T255-E258 PolarHBondContact OG1-N 3.5Å; T255-E258 PolarHBondContact OG1-OE2 3.01Å; E258-R261 WeakPolarHBondContact O-CB 3.47Å; E258-R261 PolarHBondContact O-N 3.26Å; E258-L262 WeakPolarHBondContact O-CG 3.36Å; E258-L262 PolarHBondContact O-N 3.42Å
259	L	95.3	Very high	91.9	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-67.3	-44	177.1	179.6	59.2	0	0	0	112.2	F19 F78 I81 V82 L254 T255 F256 R261 L262 Y263	F19-L259 HydrophobicContact CE1-CB 4.41Å; F19-L259 HydrophobicContact CE1-CD2 3.5Å; F19-L259 HydrophobicContact CE2-CD2 4.29Å; F19-L259 HydrophobicContact CZ-CD2 3.26Å; F78-L259 HydrophobicContact CD2-CD2 3.92Å; F78-L259 HydrophobicContact CD2-CG 4.37Å; F78-L259 HydrophobicContact CE2-CD2 3.36Å; F78-L259 HydrophobicContact CE2-CG 4.21Å; F78-L259 HydrophobicContact CZ-CD2 3.83Å; I81-L259 HydrophobicContact CB-CD1 3.95Å; I81-L259 HydrophobicContact CG2-CD1 3.44Å; I81-L259 VanDerWaalsContact CG2-CD1 3.44Å; V82-L259 HydrophobicContact CG2-CD1 3.95Å; V82-L259 HydrophobicContact CG2-CD2 3.51Å; V82-L259 HydrophobicContact CG2-CG 4.41Å; L254-L259 HydrophobicContact CD1-CB 4.3Å; L254-L259 HydrophobicContact CD2-CB 4.36Å; L254-L259 HydrophobicContact CD2-CD1 4.48Å; L254-L259 HydrophobicContact CD2-CD2 4.41Å; L254-L259 HydrophobicContact CG-CB 4.39Å; T255-L259 PolarHBondContact O-N 3.41Å; F256-L259 PolarHBondContact O-N 2.79Å; L259-R261 PolarHBondContact O-N 2.88Å; L259-L262 PolarHBondContact O-N 3.23Å; L259-Y263 VanDerWaalsContact O-CB 3.26Å; L259-Y263 WeakPolarHBondContact O-CB 3.31Å; L259-Y263 PolarHBondContact O-N 3.31Å
260	E	94	Very high	93.7	Very high	44 Å²	44	39.8 Å²	39.8	21%	0.206	21%	0.214	C	C	.	.	H	α-helix	trans	-60.8	-35.8	174.2	-172.1	171.3	-143.2	0	0	109.9	F256 L264	F256-E260 HydrophobicContact CD1-CB 4.28Å; F256-E260 HydrophobicContact CE1-CB 3.9Å; F256-E260 HydrophobicContact CE1-CG 4.33Å; F256-E260 HydrophobicContact CZ-CB 4.38Å; F256-E260 WeakPolarHBondContact O-CB 3.41Å; F256-E260 PolarHBondContact O-N 3.09Å; E260-L264 HydrophobicContact CG-CD1 3.87Å; E260-L264 HydrophobicContact CG-CG 4.28Å; E260-L264 WeakPolarHBondContact O-CB 3.29Å; E260-L264 WeakPolarHBondContact O-CD1 3.42Å; E260-L264 WeakPolarHBondContact O-CG 3.27Å; E260-L264 PolarHBondContact O-N 3.43Å
261	R	95.6	Very high	94.5	Very high	122 Å²	122	37.1 Å²	37.1	46%	0.46	19%	0.188	S	C	.	.	H	α-helix	trans	-64.1	-49.7	173.7	-163.2	-168.4	84.6	93.4	10.7	112.7	H108 D257 E258 L259 L264 D265	H108-R261 PolarHBondContact CE1-NH1 3.15Å; H108-R261 PolarHBondContact NE2-NH1 3.05Å; D257-R261 WeakPolarHBondContact O-CB 3.33Å; D257-R261 PolarHBondContact O-N 2.94Å; D257-R261 VanDerWaalsContact O-N 3.14Å; E258-R261 WeakPolarHBondContact O-CB 3.47Å; E258-R261 PolarHBondContact O-N 3.26Å; L259-R261 PolarHBondContact O-N 2.88Å; R261-L264 PolarHBondContact O-N 3.49Å; R261-D265 IonicContact CZ-OD2 3.97Å; R261-D265 IonicContact NH1-OD2 3.96Å; R261-D265 PolarHBondContact O-N 3.34Å
262	L	96.3	Very high	94.6	Very high	15 Å²	15	38.8 Å²	38.8	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-65.1	-44.8	179.4	-71.6	165.8	0	0	0	111.7	I81 E258 L259 L264 D265 F266 Y342 L345	I81-L262 HydrophobicContact CD1-CB 4.42Å; I81-L262 HydrophobicContact CG2-CB 3.79Å; I81-L262 HydrophobicContact CG2-CD1 3.9Å; I81-L262 HydrophobicContact CG2-CG 4.48Å; E258-L262 WeakPolarHBondContact O-CG 3.36Å; E258-L262 PolarHBondContact O-N 3.42Å; L259-L262 PolarHBondContact O-N 3.23Å; L262-L264 VanDerWaalsContact C-N 3.33Å; L262-L264 PolarHBondContact O-N 2.96Å; L262-D265 PolarHBondContact O-N 3.26Å; L262-F266 PolarHBondContact O-N 3.31Å; L262-F266 VanDerWaalsContact O-N 3.1Å; L262-Y342 HydrophobicContact CD1-CD2 4.06Å; L262-Y342 HydrophobicContact CD1-CE2 3.93Å; L262-L345 HydrophobicContact CB-CD1 4.12Å; L262-L345 HydrophobicContact CD2-CD1 4.21Å; L262-L345 WeakPolarHBondContact O-CD1 3.46Å
263	Y	96	Very high	94.6	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.016	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-41.6	174.7	-179.8	-95.1	0	0	0	111.5	N9 V12 N75 A77 F78 L259 F266 Y267 L365	N9-Y263 PolarHBondContact OD1-OH 2.83Å; V12-Y263 HydrophobicContact CG2-CE1 4.48Å; V12-Y263 HydrophobicContact CG2-CE2 4.38Å; N75-Y263 PolarHBondContact ND2-OH 2.8Å; N75-Y263 WeakPolarHBondContact OD1-CE2 3.35Å; A77-Y263 HydrophobicContact CB-CD2 4.35Å; A77-Y263 HydrophobicContact CB-CE2 4.12Å; F78-Y263 HydrophobicContact CB-CD2 4.29Å; F78-Y263 HydrophobicContact CB-CE2 4.35Å; L259-Y263 VanDerWaalsContact O-CB 3.26Å; L259-Y263 WeakPolarHBondContact O-CB 3.31Å; L259-Y263 PolarHBondContact O-N 3.31Å; Y263-F266 PolarHBondContact O-N 3.07Å; Y263-Y267 HydrophobicContact CE1-CD2 4.31Å; Y263-Y267 WeakPolarHBondContact O-CB 3.44Å; Y263-Y267 PolarHBondContact O-N 2.75Å; Y263-L365 HydrophobicContact CE2-CD2 4.48Å; Y263-L365 WeakPolarHBondContact OH-CD2 3.35Å
264	L	95.4	Very high	94.6	Very high	49 Å²	49	40.7 Å²	40.7	26%	0.257	21%	0.21	S	C	.	.	H	α-helix	trans	-67.9	-35.6	174.7	-76.3	172.4	0	0	0	112.7	L3 E260 R261 L262 N268	L3-L264 HydrophobicContact CD1-CD2 4.39Å; L3-L264 HydrophobicContact CD2-CD2 4.16Å; E260-L264 HydrophobicContact CG-CD1 3.87Å; E260-L264 HydrophobicContact CG-CG 4.28Å; E260-L264 WeakPolarHBondContact O-CB 3.29Å; E260-L264 WeakPolarHBondContact O-CD1 3.42Å; E260-L264 WeakPolarHBondContact O-CG 3.27Å; E260-L264 PolarHBondContact O-N 3.43Å; R261-L264 PolarHBondContact O-N 3.49Å; L262-L264 VanDerWaalsContact C-N 3.33Å; L262-L264 PolarHBondContact O-N 2.96Å; L264-N268 WeakPolarHBondContact O-CB 3.41Å; L264-N268 VanDerWaalsContact O-CG 3.29Å; L264-N268 PolarHBondContact O-N 2.93Å; L264-N268 PolarHBondContact O-ND2 3.34Å
265	D	95.8	Very high	94.4	Very high	35 Å²	35	45.3 Å²	45.3	19%	0.187	23%	0.23	C	C	.	.	H	α-helix	trans	-62.5	-45.6	175.4	-79.8	-13.8	0	0	0	110.4	H108 R261 L262 L269 L345	H108-D265 IonicContact CD2-OD2 3.48Å; H108-D265 IonicContact CE1-OD1 3.63Å; H108-D265 IonicContact CE1-OD2 3.12Å; H108-D265 PolarHBondContact CE1-OD2 3.12Å; H108-D265 IonicContact NE2-OD1 3.9Å; H108-D265 IonicContact NE2-OD2 2.68Å; H108-D265 PolarHBondContact NE2-OD2 3.05Å; R261-D265 IonicContact CZ-OD2 3.97Å; R261-D265 IonicContact NH1-OD2 3.96Å; R261-D265 PolarHBondContact O-N 3.34Å; L262-D265 PolarHBondContact O-N 3.26Å; D265-L269 PolarHBondContact O-N 3.44Å; D265-L269 VanDerWaalsContact O-N 3.11Å; D265-L345 HydrophobicContact CB-CD2 4.24Å
266	F	96.7	Very high	94.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67	-48.5	174.4	-174	-110.2	0	0	0	113	A77 L262 Y263 N268 L269 I270 L322 V341 F344 L345 T358 A361 A362 L365	A77-F266 HydrophobicContact CB-CD1 3.91Å; A77-F266 HydrophobicContact CB-CE1 3.97Å; L262-F266 PolarHBondContact O-N 3.31Å; L262-F266 VanDerWaalsContact O-N 3.1Å; Y263-F266 PolarHBondContact O-N 3.07Å; F266-N268 VanDerWaalsContact C-N 3.29Å; F266-N268 PolarHBondContact O-N 3.24Å; F266-L269 WeakPolarHBondContact O-CB 3.28Å; F266-L269 PolarHBondContact O-N 2.94Å; F266-L269 VanDerWaalsContact O-N 3.15Å; F266-I270 HydrophobicContact CE1-CG1 4.14Å; F266-I270 HydrophobicContact CE2-CD1 4.3Å; F266-I270 HydrophobicContact CE2-CG1 4.16Å; F266-I270 HydrophobicContact CZ-CD1 4.31Å; F266-I270 HydrophobicContact CZ-CG1 3.96Å; F266-I270 PolarHBondContact O-N 2.76Å; F266-I270 VanDerWaalsContact O-N 3.1Å; F266-L322 HydrophobicContact CE2-CD2 4.25Å; F266-V341 HydrophobicContact CB-CG1 4.23Å; F266-V341 HydrophobicContact CD1-CG1 4.05Å; F266-V341 HydrophobicContact CD2-CG1 3.73Å; F266-V341 HydrophobicContact CE1-CG1 4.33Å; F266-V341 HydrophobicContact CE2-CG1 4.03Å; F266-V341 HydrophobicContact CG-CG1 3.74Å; F266-V341 HydrophobicContact CZ-CG1 4.32Å; F266-F344 HydrophobicContact CD2-CD1 4.06Å; F266-F344 AromaticContact CD2-CE1 3.97Å; F266-F344 HydrophobicContact CD2-CE1 3.97Å; F266-F344 HydrophobicContact CE2-CD1 4.12Å; F266-F344 AromaticContact CE2-CE1 4Å; F266-F344 HydrophobicContact CE2-CE1 4Å; F266-L345 HydrophobicContact CB-CD1 4.16Å; F266-L345 HydrophobicContact CB-CD2 4.06Å; F266-L345 HydrophobicContact CB-CG 4.45Å; F266-T358 HydrophobicContact CE2-CG2 3.72Å; F266-T358 HydrophobicContact CZ-CG2 3.81Å; F266-A361 HydrophobicContact CE1-CB 4.48Å; F266-A362 HydrophobicContact CZ-CB 4.29Å; F266-L365 HydrophobicContact CD1-CD1 3.66Å; F266-L365 HydrophobicContact CE1-CD1 3.71Å
267	Y	95.1	Very high	93.9	Very high	42 Å²	42	49 Å²	49	17%	0.165	24%	0.242	C	C	.	.	H	α-helix	trans	-56.2	-45.3	178	-177.2	-85.4	0	0	0	110.9	Y263 L269 I270 T271 L365	Y263-Y267 HydrophobicContact CE1-CD2 4.31Å; Y263-Y267 WeakPolarHBondContact O-CB 3.44Å; Y263-Y267 PolarHBondContact O-N 2.75Å; Y267-L269 PolarHBondContact O-N 2.94Å; Y267-I270 PolarHBondContact O-N 3.29Å; Y267-T271 HydrophobicContact CD1-CG2 4.19Å; Y267-T271 HydrophobicContact CD2-CG2 4.18Å; Y267-T271 HydrophobicContact CE1-CG2 3.91Å; Y267-T271 WeakPolarHBondContact CE1-OG1 3.48Å; Y267-T271 HydrophobicContact CE2-CG2 3.9Å; Y267-T271 HydrophobicContact CG-CG2 4.31Å; Y267-T271 WeakPolarHBondContact O-CG2 3.47Å; Y267-T271 PolarHBondContact O-N 3.44Å; Y267-T271 PolarHBondContact O-OG1 3.22Å; Y267-L365 HydrophobicContact CD2-CD1 4.12Å; Y267-L365 HydrophobicContact CD2-CD2 4.05Å; Y267-L365 HydrophobicContact CE2-CD2 4.44Å
268	N	94.6	Very high	93.7	Very high	68 Å²	68	48.8 Å²	48.8	36%	0.364	25%	0.247	S	C	.	.	H	α-helix	trans	-69	-33	179.8	-77.5	-62.9	0	0	0	113	L264 F266 N272	L264-N268 WeakPolarHBondContact O-CB 3.41Å; L264-N268 VanDerWaalsContact O-CG 3.29Å; L264-N268 PolarHBondContact O-N 2.93Å; L264-N268 PolarHBondContact O-ND2 3.34Å; F266-N268 VanDerWaalsContact C-N 3.29Å; F266-N268 PolarHBondContact O-N 3.24Å; N268-N272 VanDerWaalsContact CA-ND2 3.29Å; N268-N272 WeakPolarHBondContact CA-ND2 3.47Å; N268-N272 WeakPolarHBondContact CB-ND2 3.42Å; N268-N272 VanDerWaalsContact O-CB 3.24Å; N268-N272 WeakPolarHBondContact O-CB 3.38Å; N268-N272 PolarHBondContact O-N 3.01Å; N268-N272 PolarHBondContact O-ND2 2.9Å; N268-N272 PolarHBondContact OD1-ND2 2.6Å
269	L	94.9	Very high	93.4	Very high	29 Å²	29	46.9 Å²	46.9	15%	0.152	24%	0.237	C	C	.	.	H	α-helix	trans	-59	-52.8	172.1	173.8	67.3	0	0	0	110.7	D265 F266 Y267 S273 V321 Q325 F344	D265-L269 PolarHBondContact O-N 3.44Å; D265-L269 VanDerWaalsContact O-N 3.11Å; F266-L269 WeakPolarHBondContact O-CB 3.28Å; F266-L269 PolarHBondContact O-N 2.94Å; F266-L269 VanDerWaalsContact O-N 3.15Å; Y267-L269 PolarHBondContact O-N 2.94Å; L269-S273 WeakPolarHBondContact O-CB 3.26Å; L269-S273 PolarHBondContact O-N 3.31Å; L269-V321 HydrophobicContact CD1-CG1 4.1Å; L269-V321 HydrophobicContact CG-CG1 4.11Å; L269-Q325 HydrophobicContact CD1-CG 3.62Å; L269-Q325 HydrophobicContact CD2-CG 3.79Å; L269-Q325 HydrophobicContact CG-CG 4.37Å; L269-F344 HydrophobicContact CD2-CE1 3.61Å; L269-F344 HydrophobicContact CD2-CZ 3.73Å
270	I	95.5	Very high	92.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-69.4	-58.2	-176.6	-58.7	-54.1	0	0	0	111.1	F266 Y267 N272 S273 L276 V321 L322 A362 L366	F266-I270 HydrophobicContact CE1-CG1 4.14Å; F266-I270 HydrophobicContact CE2-CD1 4.3Å; F266-I270 HydrophobicContact CE2-CG1 4.16Å; F266-I270 HydrophobicContact CZ-CD1 4.31Å; F266-I270 HydrophobicContact CZ-CG1 3.96Å; F266-I270 PolarHBondContact O-N 2.76Å; F266-I270 VanDerWaalsContact O-N 3.1Å; Y267-I270 PolarHBondContact O-N 3.29Å; I270-N272 PolarHBondContact O-N 3.02Å; I270-S273 PolarHBondContact O-N 3.18Å; I270-L276 HydrophobicContact CG2-CD1 4.13Å; I270-L276 WeakPolarHBondContact O-CD1 3.31Å; I270-V321 HydrophobicContact CD1-CG1 4.35Å; I270-L322 HydrophobicContact CD1-CD2 4.24Å; I270-A362 HydrophobicContact CD1-CB 3.77Å; I270-A362 HydrophobicContact CG1-CB 4Å; I270-A362 HydrophobicContact CG2-CB 4.18Å; I270-L366 HydrophobicContact CG2-CD1 4Å; I270-L366 HydrophobicContact CG2-CD2 3.91Å; I270-L366 HydrophobicContact CG2-CG 3.71Å
271	T	92.1	Very high	91.7	Very high	35 Å²	35	48.5 Å²	48.5	22%	0.215	25%	0.252	C	S	.	.	H	α-helix	trans	-78.7	-17.9	-168.8	75.7	0	0	0	0	114.7	Y267	Y267-T271 HydrophobicContact CD1-CG2 4.19Å; Y267-T271 HydrophobicContact CD2-CG2 4.18Å; Y267-T271 HydrophobicContact CE1-CG2 3.91Å; Y267-T271 WeakPolarHBondContact CE1-OG1 3.48Å; Y267-T271 HydrophobicContact CE2-CG2 3.9Å; Y267-T271 HydrophobicContact CG-CG2 4.31Å; Y267-T271 WeakPolarHBondContact O-CG2 3.47Å; Y267-T271 PolarHBondContact O-N 3.44Å; Y267-T271 PolarHBondContact O-OG1 3.22Å
272	N	92.1	Very high	90	Very high	60 Å²	60	49.2 Å²	49.2	32%	0.321	27%	0.265	S	S	.	.	H	α-helix	trans	-97.3	-8.3	173.2	-60.1	-88.1	0	0	0	113.7	N268 I270	N268-N272 VanDerWaalsContact CA-ND2 3.29Å; N268-N272 WeakPolarHBondContact CA-ND2 3.47Å; N268-N272 WeakPolarHBondContact CB-ND2 3.42Å; N268-N272 VanDerWaalsContact O-CB 3.24Å; N268-N272 WeakPolarHBondContact O-CB 3.38Å; N268-N272 PolarHBondContact O-N 3.01Å; N268-N272 PolarHBondContact O-ND2 2.9Å; N268-N272 PolarHBondContact OD1-ND2 2.6Å; I270-N272 PolarHBondContact O-N 3.02Å
273	S	91.9	Very high	87.9	Confident	14 Å²	14	52.5 Å²	52.5	10%	0.098	29%	0.286	C	S	.	.			trans	-53.9	126.3	-178.9	171.6	0	0	0	0	110.3	L269 I270 K275 L276 K277 V321	L269-S273 WeakPolarHBondContact O-CB 3.26Å; L269-S273 PolarHBondContact O-N 3.31Å; I270-S273 PolarHBondContact O-N 3.18Å; S273-K275 PolarHBondContact O-N 3.29Å; S273-K275 PolarHBondContact OG-N 3.19Å; S273-L276 PolarHBondContact O-N 2.97Å; S273-K277 PolarHBondContact O-N 2.92Å; S273-V321 VanDerWaalsContact OG-CG2 3.22Å; S273-V321 WeakPolarHBondContact OG-CG2 3.36Å
274	P	92.4	Very high	85.1	Confident	102 Å²	102	56.1 Å²	56.1	66%	0.662	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-28	-179	27.1	-34.3	0	0	0	112.3
275	K	90.6	Very high	82.2	Confident	98 Å²	98	58 Å²	58	43%	0.426	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-34.2	176.7	-63.3	-169.6	168.5	-171.9	0	112.7	S273 P278 V317 E320 V321	S273-K275 PolarHBondContact O-N 3.29Å; S273-K275 PolarHBondContact OG-N 3.19Å; K275-P278 WeakPolarHBondContact O-CD 3.19Å; K275-V317 HydrophobicContact CB-CG1 3.49Å; K275-V317 VanDerWaalsContact CB-CG1 3.49Å; K275-V317 HydrophobicContact CD-CG1 4.37Å; K275-E320 WeakPolarHBondContact CD-OE2 3.49Å; K275-E320 IonicContact NZ-OE1 2.75Å; K275-E320 PolarHBondContact NZ-OE1 2.84Å; K275-E320 IonicContact NZ-OE2 3.23Å; K275-E320 PolarHBondContact NZ-OE2 3.18Å; K275-V321 HydrophobicContact CB-CG2 4.44Å
276	L	91.9	Very high	79.4	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-13.3	-175.5	-70	168.4	0	0	0	114.3	I270 S273 F279 V280 L314 V317 I318 V321 L366	I270-L276 HydrophobicContact CG2-CD1 4.13Å; I270-L276 WeakPolarHBondContact O-CD1 3.31Å; S273-L276 PolarHBondContact O-N 2.97Å; L276-F279 PolarHBondContact O-N 3.23Å; L276-V280 PolarHBondContact O-N 2.88Å; L276-L314 HydrophobicContact CD2-CD1 4Å; L276-V317 HydrophobicContact CD2-CB 4.28Å; L276-V317 HydrophobicContact CD2-CG1 3.7Å; L276-V317 HydrophobicContact CG-CG1 4.11Å; L276-I318 HydrophobicContact CD1-CG1 4.41Å; L276-I318 HydrophobicContact CD2-CG1 3.61Å; L276-V321 HydrophobicContact CD1-CB 4.32Å; L276-V321 HydrophobicContact CD1-CG1 4.27Å; L276-V321 HydrophobicContact CD1-CG2 4.04Å; L276-V321 HydrophobicContact CG-CG2 4.21Å; L276-L366 HydrophobicContact CB-CD2 4.45Å; L276-L366 HydrophobicContact CD1-CD1 4.26Å; L276-L366 HydrophobicContact CD2-CD1 3.99Å
277	K	87.6	Confident	76.2	Confident	130 Å²	130	70 Å²	70	57%	0.565	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-40.8	179	-72.8	177	-176	176.4	0	115.8	S273 F279	S273-K277 PolarHBondContact O-N 2.92Å; K277-F279 PolarHBondContact O-N 3.45Å
278	P	88.5	Confident	73.2	Confident	96 Å²	96	75.4 Å²	75.4	62%	0.623	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-20.6	177.5	-20	34.2	0	0	0	113.3	K275	K275-P278 WeakPolarHBondContact O-CD 3.19Å
279	F	88.6	Confident	70.1	Confident	40 Å²	40	76.4 Å²	76.4	18%	0.175	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-20.4	-173.9	-60.7	-82.4	0	0	0	114	L276 K277 A281 K308 A313 L314 V317 Y368	L276-F279 PolarHBondContact O-N 3.23Å; K277-F279 PolarHBondContact O-N 3.45Å; F279-A281 PolarHBondContact O-N 3.41Å; F279-K308 PolarHBondContact O-NZ 3.32Å; F279-A313 HydrophobicContact CE1-CB 4.41Å; F279-A313 HydrophobicContact CZ-CB 4.3Å; F279-L314 HydrophobicContact CB-CD1 3.64Å; F279-L314 HydrophobicContact CD1-CB 3.82Å; F279-L314 HydrophobicContact CD1-CD1 4.16Å; F279-L314 HydrophobicContact CD1-CG 4.48Å; F279-L314 HydrophobicContact CD2-CD1 4.4Å; F279-L314 HydrophobicContact CE1-CB 4.1Å; F279-L314 HydrophobicContact CG-CB 4.35Å; F279-L314 HydrophobicContact CG-CD1 3.83Å; F279-V317 HydrophobicContact CE2-CB 4.31Å; F279-V317 HydrophobicContact CE2-CG1 4.4Å; F279-V317 HydrophobicContact CE2-CG2 4.17Å; F279-Y368 WeakPolarHBondContact O-CE2 3.4Å; F279-Y368 PolarHBondContact O-OH 3.09Å
280	V	82.7	Confident	67.3	Low	59 Å²	59	79.8 Å²	79.8	36%	0.358	47%	0.473	S	S	.	.			trans	-47.5	128.3	177	-179.7	0	0	0	0	110.3	L276 L366	L276-V280 PolarHBondContact O-N 2.88Å; V280-L366 HydrophobicContact CG2-CD2 4.01Å
281	A	70.9	Confident	64.2	Low	20 Å²	20	89.5 Å²	89.5	17%	0.165	52%	0.519	C	S	.	.			trans	-78.9	127.9	177	0	0	0	0	0	110.4	F279 T283 L366	F279-A281 PolarHBondContact O-N 3.41Å; A281-T283 VanDerWaalsContact C-N 3.29Å; A281-T283 PolarHBondContact O-N 3.27Å; A281-T283 PolarHBondContact O-OG1 3.35Å; A281-T283 VanDerWaalsContact O-OG1 3.13Å; A281-L366 WeakPolarHBondContact CB-O 3.34Å; A281-L366 PolarHBondContact N-O 3.36Å
282	D	60.5	Low	61.7	Low	137 Å²	137	93.6 Å²	93.6	73%	0.733	55%	0.549	S	S	*	.			trans	-67.1	82.1	178.7	-87.1	-54.3	0	0	0	111.7	S284	D282-S284 PolarHBondContact O-N 2.85Å
283	T	51.9	Low	59.1	Low	84 Å²	84	100 Å²	100	52%	0.515	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.6	11.8	178.2	1.4	0	0	0	0	113.3	A281	A281-T283 VanDerWaalsContact C-N 3.29Å; A281-T283 PolarHBondContact O-N 3.27Å; A281-T283 PolarHBondContact O-OG1 3.35Å; A281-T283 VanDerWaalsContact O-OG1 3.13Å
284	S	38.7	Very low	56.3	Low	80 Å²	80	105.5 Å²	105.5	56%	0.559	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-17	-170.9	54.9	0	0	0	0	113.9	D282 F286	D282-S284 PolarHBondContact O-N 2.85Å; S284-F286 VanDerWaalsContact C-N 3.34Å; S284-F286 PolarHBondContact O-N 2.98Å
285	S	33.5	Very low	53.7	Low	87 Å²	87	110.2 Å²	110.2	61%	0.608	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-20.9	-175.3	53.9	0	0	0	0	115
286	F	37.5	Very low	50.9	Low	178 Å²	178	114.9 Å²	114.9	78%	0.781	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-11.1	-173	-85.7	-86.2	0	0	0	115.8	S284	S284-F286 VanDerWaalsContact C-N 3.34Å; S284-F286 PolarHBondContact O-N 2.98Å
287	T	28.9	Very low	48.2	Very low	109 Å²	109	125.2 Å²	125.2	67%	0.669	69%	0.685	S	S	*	*	S	Bend	trans	-147.2	97	178.9	59.2	0	0	0	0	113
288	N	32.9	Very low	45.6	Very low	156 Å²	156	127.5 Å²	127.5	83%	0.834	70%	0.698	S	S	*	*			trans	-175.7	82.6	150.3	-94	-30.6	0	0	0	111.7
289	G	27.9	Very low	42.9	Very low	90 Å²	90	127.5 Å²	127.5	93%	0.928	70%	0.699	S	S	*	*			trans	-88.4	98.9	164.1	0	0	0	0	0	110.4
290	S	37.5	Very low	40.1	Very low	100 Å²	100	129.4 Å²	129.4	70%	0.699	71%	0.714	S	S	*	*			trans	-138.5	121.9	175.6	64	0	0	0	0	112.4
291	E	30.9	Very low	38	Very low	203 Å²	203	130.7 Å²	130.7	95%	0.949	73%	0.726	S	S	*	*			trans	-48.5	129.8	-172.3	-52.7	173.5	137.9	0	0	115.5
292	S	37.6	Very low	36.1	Very low	121 Å²	121	136.9 Å²	136.9	85%	0.846	76%	0.761	S	S	*	*			trans	-150.1	158.7	151.3	54.5	0	0	0	0	110.3
293	K	37.6	Very low	35	Very low	195 Å²	195	137.3 Å²	137.3	85%	0.848	76%	0.763	S	S	*	*			trans	-100.2	141.7	-151.6	-69.9	172.4	178.3	171.2	0	114.7
294	T	33.8	Very low	34.3	Very low	129 Å²	129	139.1 Å²	139.1	79%	0.791	77%	0.773	S	S	*	*			trans	54.5	99.8	147.5	53.8	0	0	0	0	118.9
295	Q	37.9	Very low	34.6	Very low	202 Å²	202	140 Å²	140	94%	0.944	78%	0.777	S	S	*	*				-155.8	152.2	113.5	-108.5	172.2	12.6	0	0	110.8
296	K	31.4	Very low	36	Very low	195 Å²	195	140.5 Å²	140.5	85%	0.848	79%	0.787	S	S	*	*			trans	-88.9	127.8	-177.7	-70.8	-179.1	174.5	-175.6	0	110.9
297	F	35.4	Very low	37.6	Very low	218 Å²	218	137.4 Å²	137.4	96%	0.956	77%	0.773	S	S	*	*			trans	-149.8	140.6	140.5	-94.7	-72.4	0	0	0	109.3
298	H	32.5	Very low	40.3	Very low	179 Å²	179	137.3 Å²	137.3	83%	0.829	76%	0.763	S	S	*	*			trans	-99.3	130.7	-179.9	-117.3	-78.7	0	0	0	109.5
299	C	32	Very low	43.1	Very low	95 Å²	95	133.2 Å²	133.2	64%	0.642	74%	0.737	S	S	*	*			trans	-153.1	123.7	157.9	-167.2	0	0	0	0	108.6	N912	C299-N912 PolarHBondContact SG-ND2 3.03Å
300	T	30.5	Very low	46.3	Very low	81 Å²	81	129.2 Å²	129.2	50%	0.497	70%	0.695	S	S	.	*			trans	-98.8	101.5	-176.9	31.2	0	0	0	0	110.9
301	S	38.3	Very low	48.9	Very low	86 Å²	86	127 Å²	127	60%	0.601	68%	0.679	S	S	*	*			trans	-149.6	102.5	164.4	-62.4	0	0	0	0	109	I303	S301-I303 PolarHBondContact O-N 3.3Å
302	T	31.1	Very low	51.9	Low	149 Å²	149	119.7 Å²	119.7	91%	0.914	64%	0.643	S	S	*	*			trans	-76.9	74.8	172.5	40.7	0	0	0	0	110.4	T304	T302-T304 PolarHBondContact O-N 3.14Å
303	I	38.4	Very low	54.5	Low	147 Å²	147	116.3 Å²	116.3	75%	0.754	62%	0.622	S	S	*	*			trans	-69.8	107.9	170.9	-59.2	173.7	0	0	0	107.6	S301	S301-I303 PolarHBondContact O-N 3.3Å
304	T	36.5	Very low	57.2	Low	121 Å²	121	107 Å²	107	74%	0.742	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-60.8	130.5	164.8	40.4	0	0	0	0	108.5	T302 A306	T302-T304 PolarHBondContact O-N 3.14Å; T304-A306 PolarHBondContact O-N 3.1Å
305	P	45.4	Very low	60.2	Low	98 Å²	98	100.9 Å²	100.9	64%	0.636	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-63.6	123.2	-179.5	25.7	-33.2	0	0	0	109.4	K307	P305-K307 PolarHBondContact O-N 2.73Å
306	A	62	Low	62.8	Low	98 Å²	98	91.9 Å²	91.9	81%	0.81	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-57	128.1	-176	0	0	0	0	0	111.2	T304 K308	T304-A306 PolarHBondContact O-N 3.1Å; A306-K308 PolarHBondContact O-N 3Å
307	K	71.9	Confident	65.8	Low	113 Å²	113	83.7 Å²	83.7	49%	0.491	47%	0.469	S	S	.	.			trans	-62.8	115.8	-178.8	-171.8	173.1	176.3	-176.3	0	109.6	P305 Y309	P305-K307 PolarHBondContact O-N 2.73Å; K307-Y309 HydrophobicContact CB-CE2 4.31Å; K307-Y309 HydrophobicContact CD-CE1 4.25Å; K307-Y309 HydrophobicContact CG-CE1 4.48Å; K307-Y309 HydrophobicContact CG-CE2 4.48Å; K307-Y309 VanDerWaalsContact O-CD2 3.31Å; K307-Y309 WeakPolarHBondContact O-CD2 3.27Å; K307-Y309 PolarHBondContact O-N 3.23Å
308	K	84.9	Confident	68.7	Low	107 Å²	107	73.3 Å²	73.3	47%	0.465	42%	0.424	S	S	.	.			trans	-77.4	100.9	179.9	-171	-172.2	-174.3	-172.7	0	109.8	F279 A306 Y368	F279-K308 PolarHBondContact O-NZ 3.32Å; A306-K308 PolarHBondContact O-N 3Å; K308-Y368 HydrophobicContact CD-CE1 4.39Å; K308-Y368 WeakPolarHBondContact CD-OH 3.36Å; K308-Y368 WeakPolarHBondContact CE-OH 3.25Å; K308-Y368 HydrophobicContact CG-CE1 4.26Å; K308-Y368 PolarHBondContact NZ-OH 3.08Å
309	Y	91.8	Very high	71.6	Confident	71 Å²	71	64.8 Å²	64.8	28%	0.278	38%	0.384	S	S	.	.			trans	-73.8	155.5	171.4	-65.5	-76.9	0	0	0	111.9	K307 D370 P386	K307-Y309 HydrophobicContact CB-CE2 4.31Å; K307-Y309 HydrophobicContact CD-CE1 4.25Å; K307-Y309 HydrophobicContact CG-CE1 4.48Å; K307-Y309 HydrophobicContact CG-CE2 4.48Å; K307-Y309 VanDerWaalsContact O-CD2 3.31Å; K307-Y309 WeakPolarHBondContact O-CD2 3.27Å; K307-Y309 PolarHBondContact O-N 3.23Å; Y309-D370 HydrophobicContact CD1-CB 3.74Å; Y309-D370 HydrophobicContact CE1-CB 4.25Å; Y309-P386 HydrophobicContact CD1-CB 4.27Å; Y309-P386 HydrophobicContact CD2-CB 3.99Å; Y309-P386 HydrophobicContact CE1-CB 4.23Å; Y309-P386 HydrophobicContact CE2-CB 3.93Å; Y309-P386 HydrophobicContact CG-CB 4.17Å
310	A	94	Very high	74.4	Confident	6 Å²	6	62.4 Å²	62.4	5%	0.05	36%	0.364	C	S	.	.			trans	-70.3	155.5	169.5	0	0	0	0	0	111.3	L314 Y368 D370 V371 F384	A310-L314 HydrophobicContact CB-CD2 3.92Å; A310-Y368 HydrophobicContact CB-CD1 3.7Å; A310-Y368 HydrophobicContact CB-CE1 4.21Å; A310-Y368 HydrophobicContact CB-CG 4.23Å; A310-D370 WeakPolarHBondContact CB-OD2 3.48Å; A310-D370 PolarHBondContact N-OD1 3.2Å; A310-D370 PolarHBondContact N-OD2 3.05Å; A310-V371 HydrophobicContact CB-CG2 3.44Å; A310-V371 VanDerWaalsContact CB-CG2 3.44Å; A310-F384 HydrophobicContact CB-CB 4.09Å; A310-F384 HydrophobicContact CB-CD2 4.48Å
311	C	93.2	Very high	77.4	Confident	54 Å²	54	58.9 Å²	58.9	37%	0.365	34%	0.342	S	S	.	.			trans	-134.9	162.6	179.6	65.4	0	0	0	0	110.5	A313 L314 I315	C311-A313 VanDerWaalsContact C-N 3.27Å; C311-A313 PolarHBondContact O-N 3.49Å; C311-L314 WeakPolarHBondContact O-CB 3.32Å; C311-L314 PolarHBondContact O-N 2.88Å; C311-I315 PolarHBondContact O-N 2.72Å
312	R	93.4	Very high	80.1	Confident	49 Å²	49	54.8 Å²	54.8	19%	0.185	31%	0.313	C	S	.	.	H	α-helix	trans	-55.4	-43.1	-176.1	-168.3	169.6	-59.3	-87.2	-14	111.9	L314 I315 C316 F384 T392 N441 P442	R312-L314 VanDerWaalsContact C-N 3.25Å; R312-L314 PolarHBondContact O-N 3.33Å; R312-I315 WeakPolarHBondContact O-CA 3.3Å; R312-I315 WeakPolarHBondContact O-CB 3.42Å; R312-I315 PolarHBondContact O-N 2.95Å; R312-C316 PolarHBondContact O-N 3.31Å; R312-C316 PolarHBondContact O-SG 3.38Å; R312-F384 HydrophobicContact CB-CE2 4.26Å; R312-F384 HydrophobicContact CB-CZ 3.97Å; R312-F384 HydrophobicContact CG-CZ 4.39Å; R312-F384 VanDerWaalsContact N-CE2 3.32Å; R312-T392 VanDerWaalsContact CZ-O 3.3Å; R312-T392 PolarHBondContact NH1-O 3.46Å; R312-T392 PolarHBondContact NH2-O 3.38Å; R312-N441 HydrophobicContact CG-CB 4.45Å; R312-P442 PolarHBondContact NH1-O 3.42Å
313	A	92.7	Very high	82.8	Confident	50 Å²	50	51.4 Å²	51.4	41%	0.413	28%	0.284	S	S	.	.	H	α-helix	trans	-57.1	-31.6	176.8	0	0	0	0	0	114.4	F279 C311 V317	F279-A313 HydrophobicContact CE1-CB 4.41Å; F279-A313 HydrophobicContact CZ-CB 4.3Å; C311-A313 VanDerWaalsContact C-N 3.27Å; C311-A313 PolarHBondContact O-N 3.49Å; A313-V317 WeakPolarHBondContact O-CB 3.32Å; A313-V317 VanDerWaalsContact O-CG2 3.25Å; A313-V317 WeakPolarHBondContact O-CG2 3.17Å; A313-V317 PolarHBondContact O-N 3.41Å
314	L	94.5	Very high	85.3	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.6	-47.6	170.9	169.6	56.9	0	0	0	110.7	L276 F279 A310 C311 R312 C316 V317 I318 L366 Y368	L276-L314 HydrophobicContact CD2-CD1 4Å; F279-L314 HydrophobicContact CB-CD1 3.64Å; F279-L314 HydrophobicContact CD1-CB 3.82Å; F279-L314 HydrophobicContact CD1-CD1 4.16Å; F279-L314 HydrophobicContact CD1-CG 4.48Å; F279-L314 HydrophobicContact CD2-CD1 4.4Å; F279-L314 HydrophobicContact CE1-CB 4.1Å; F279-L314 HydrophobicContact CG-CB 4.35Å; F279-L314 HydrophobicContact CG-CD1 3.83Å; A310-L314 HydrophobicContact CB-CD2 3.92Å; C311-L314 WeakPolarHBondContact O-CB 3.32Å; C311-L314 PolarHBondContact O-N 2.88Å; R312-L314 VanDerWaalsContact C-N 3.25Å; R312-L314 PolarHBondContact O-N 3.33Å; L314-C316 PolarHBondContact O-N 3.02Å; L314-V317 PolarHBondContact O-N 3.42Å; L314-I318 HydrophobicContact CD1-CD1 3.67Å; L314-I318 HydrophobicContact CD1-CG1 3.93Å; L314-I318 HydrophobicContact CG-CD1 3.93Å; L314-I318 WeakPolarHBondContact O-CG1 3.47Å; L314-I318 PolarHBondContact O-N 3.12Å; L314-L366 HydrophobicContact CD1-CD1 4Å; L314-Y368 HydrophobicContact CD2-CD1 4.09Å; L314-Y368 HydrophobicContact CD2-CD2 3.61Å; L314-Y368 HydrophobicContact CD2-CE1 3.88Å; L314-Y368 HydrophobicContact CD2-CE2 3.4Å; L314-Y368 VanDerWaalsContact CD2-CE2 3.4Å; L314-Y368 HydrophobicContact CD2-CG 3.95Å
315	I	95.5	Very high	87.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.3	-47.8	179	-53.3	-54.2	0	0	0	110.3	C311 R312 V317 I318 C319 V359 V371 V382 F384 A393 V395 P442	C311-I315 PolarHBondContact O-N 2.72Å; R312-I315 WeakPolarHBondContact O-CA 3.3Å; R312-I315 WeakPolarHBondContact O-CB 3.42Å; R312-I315 PolarHBondContact O-N 2.95Å; I315-V317 VanDerWaalsContact C-N 3.33Å; I315-V317 PolarHBondContact O-N 3.2Å; I315-I318 PolarHBondContact O-N 3.43Å; I315-C319 PolarHBondContact O-N 3.36Å; I315-C319 PolarHBondContact O-SG 3.1Å; I315-V359 HydrophobicContact CD1-CG1 4.35Å; I315-V359 HydrophobicContact CG2-CG1 4.23Å; I315-V371 HydrophobicContact CD1-CG1 4.34Å; I315-V382 HydrophobicContact CD1-CG2 4.33Å; I315-V382 HydrophobicContact CG1-CG2 4.48Å; I315-V382 HydrophobicContact CG2-CG2 3.95Å; I315-F384 HydrophobicContact CD1-CD1 4.29Å; I315-F384 HydrophobicContact CD1-CG 4.42Å; I315-F384 HydrophobicContact CG1-CD1 3.84Å; I315-F384 HydrophobicContact CG1-CD2 4.48Å; I315-F384 HydrophobicContact CG1-CE1 3.88Å; I315-F384 HydrophobicContact CG1-CG 4.17Å; I315-F384 HydrophobicContact CG1-CZ 4.21Å; I315-A393 HydrophobicContact CG2-CB 4.1Å; I315-V395 HydrophobicContact CG2-CG1 3.68Å; I315-P442 HydrophobicContact CG2-CG 4.33Å
316	C	93.6	Very high	89.8	Confident	12 Å²	12	43.6 Å²	43.6	8%	0.081	24%	0.236	C	C	.	.	H	α-helix	trans	-53.1	-50.5	175.8	-48	0	0	0	0	111.4	R312 L314 I318 C319 E320 N441 P442	R312-C316 PolarHBondContact O-N 3.31Å; R312-C316 PolarHBondContact O-SG 3.38Å; L314-C316 PolarHBondContact O-N 3.02Å; C316-I318 VanDerWaalsContact C-N 3.34Å; C316-I318 PolarHBondContact O-N 3.09Å; C316-C319 PolarHBondContact O-N 2.87Å; C316-E320 WeakPolarHBondContact O-CG 3.44Å; C316-E320 PolarHBondContact O-N 3.21Å; C316-N441 PolarHBondContact SG-OD1 3.1Å; C316-P442 WeakPolarHBondContact SG-CD 3.19Å
317	V	94.5	Very high	90.8	Very high	24 Å²	24	42.7 Å²	42.7	15%	0.145	22%	0.221	C	C	.	.	H	α-helix	trans	-71.1	-27.4	-176.1	175.8	0	0	0	0	112.5	K275 L276 F279 A313 L314 I315 V321	K275-V317 HydrophobicContact CB-CG1 3.49Å; K275-V317 VanDerWaalsContact CB-CG1 3.49Å; K275-V317 HydrophobicContact CD-CG1 4.37Å; L276-V317 HydrophobicContact CD2-CB 4.28Å; L276-V317 HydrophobicContact CD2-CG1 3.7Å; L276-V317 HydrophobicContact CG-CG1 4.11Å; F279-V317 HydrophobicContact CE2-CB 4.31Å; F279-V317 HydrophobicContact CE2-CG1 4.4Å; F279-V317 HydrophobicContact CE2-CG2 4.17Å; A313-V317 WeakPolarHBondContact O-CB 3.32Å; A313-V317 VanDerWaalsContact O-CG2 3.25Å; A313-V317 WeakPolarHBondContact O-CG2 3.17Å; A313-V317 PolarHBondContact O-N 3.41Å; L314-V317 PolarHBondContact O-N 3.42Å; I315-V317 VanDerWaalsContact C-N 3.33Å; I315-V317 PolarHBondContact O-N 3.2Å; V317-V321 VanDerWaalsContact O-CG2 3.24Å; V317-V321 WeakPolarHBondContact O-CG2 3.48Å; V317-V321 PolarHBondContact O-N 2.89Å
318	I	95.2	Very high	90.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-67	-49.7	168.3	-69.7	170.1	0	0	0	109.7	L276 L314 I315 C316 E320 V321 L322 V359 A362 C363 L366	L276-I318 HydrophobicContact CD1-CG1 4.41Å; L276-I318 HydrophobicContact CD2-CG1 3.61Å; L314-I318 HydrophobicContact CD1-CD1 3.67Å; L314-I318 HydrophobicContact CD1-CG1 3.93Å; L314-I318 HydrophobicContact CG-CD1 3.93Å; L314-I318 WeakPolarHBondContact O-CG1 3.47Å; L314-I318 PolarHBondContact O-N 3.12Å; I315-I318 PolarHBondContact O-N 3.43Å; C316-I318 VanDerWaalsContact C-N 3.34Å; C316-I318 PolarHBondContact O-N 3.09Å; I318-E320 PolarHBondContact O-N 3.45Å; I318-V321 WeakPolarHBondContact O-CA 3.4Å; I318-V321 WeakPolarHBondContact O-CB 3.17Å; I318-V321 PolarHBondContact O-N 3.38Å; I318-L322 HydrophobicContact CG2-CD1 4.05Å; I318-L322 HydrophobicContact CG2-CG 4.32Å; I318-L322 WeakPolarHBondContact O-CG 3.29Å; I318-L322 PolarHBondContact O-N 3.1Å; I318-V359 HydrophobicContact CG2-CB 4.43Å; I318-V359 HydrophobicContact CG2-CG1 4.21Å; I318-V359 HydrophobicContact CG2-CG2 4.18Å; I318-A362 HydrophobicContact CD1-CB 4.42Å; I318-A362 HydrophobicContact CG2-CB 3.76Å; I318-C363 WeakPolarHBondContact CD1-SG 3.28Å; I318-L366 HydrophobicContact CD1-CD1 3.91Å; I318-L366 HydrophobicContact CG1-CD1 4.14Å
319	C	93.4	Very high	89.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-58.3	-46	178.5	-64	0	0	0	0	111.3	I315 C316 V321 L322 W323 W398	I315-C319 PolarHBondContact O-N 3.36Å; I315-C319 PolarHBondContact O-SG 3.1Å; C316-C319 PolarHBondContact O-N 2.87Å; C319-V321 VanDerWaalsContact C-N 3.26Å; C319-V321 PolarHBondContact O-N 3.32Å; C319-L322 PolarHBondContact O-N 3.15Å; C319-L322 VanDerWaalsContact O-N 3.13Å; C319-W323 HydrophobicContact CB-CE3 4.11Å; C319-W323 HydrophobicContact CB-CZ3 4.09Å; C319-W323 WeakPolarHBondContact O-CB 3.38Å; C319-W323 PolarHBondContact O-N 3.11Å; C319-W398 HydrophobicContact CB-CE3 3.64Å; C319-W398 HydrophobicContact CB-CH2 4.29Å; C319-W398 HydrophobicContact CB-CZ3 3.34Å
320	E	91.6	Very high	87.4	Confident	45 Å²	45	47.8 Å²	47.8	21%	0.21	26%	0.263	C	S	.	.	H	α-helix	trans	-54.2	-39.4	172.5	-71.6	-164.4	108.5	0	0	113.3	K275 C316 I318 S324 W398 Q400	K275-E320 WeakPolarHBondContact CD-OE2 3.49Å; K275-E320 IonicContact NZ-OE1 2.75Å; K275-E320 PolarHBondContact NZ-OE1 2.84Å; K275-E320 IonicContact NZ-OE2 3.23Å; K275-E320 PolarHBondContact NZ-OE2 3.18Å; C316-E320 WeakPolarHBondContact O-CG 3.44Å; C316-E320 PolarHBondContact O-N 3.21Å; I318-E320 PolarHBondContact O-N 3.45Å; E320-S324 WeakPolarHBondContact O-CB 3.41Å; E320-S324 PolarHBondContact O-N 2.88Å; E320-W398 HydrophobicContact CG-CH2 3.84Å; E320-Q400 PolarHBondContact OE1-NE2 3.43Å
321	V	94.1	Very high	85.3	Confident	6 Å²	6	50.9 Å²	50.9	4%	0.036	28%	0.281	C	S	.	.	H	α-helix	trans	-71.3	-39.5	179.3	167.8	0	0	0	0	110.9	L269 I270 S273 K275 L276 V317 I318 C319 S324	L269-V321 HydrophobicContact CD1-CG1 4.1Å; L269-V321 HydrophobicContact CG-CG1 4.11Å; I270-V321 HydrophobicContact CD1-CG1 4.35Å; S273-V321 VanDerWaalsContact OG-CG2 3.22Å; S273-V321 WeakPolarHBondContact OG-CG2 3.36Å; K275-V321 HydrophobicContact CB-CG2 4.44Å; L276-V321 HydrophobicContact CD1-CB 4.32Å; L276-V321 HydrophobicContact CD1-CG1 4.27Å; L276-V321 HydrophobicContact CD1-CG2 4.04Å; L276-V321 HydrophobicContact CG-CG2 4.21Å; V317-V321 VanDerWaalsContact O-CG2 3.24Å; V317-V321 WeakPolarHBondContact O-CG2 3.48Å; V317-V321 PolarHBondContact O-N 2.89Å; I318-V321 WeakPolarHBondContact O-CA 3.4Å; I318-V321 WeakPolarHBondContact O-CB 3.17Å; I318-V321 PolarHBondContact O-N 3.38Å; C319-V321 VanDerWaalsContact C-N 3.26Å; C319-V321 PolarHBondContact O-N 3.32Å; V321-S324 PolarHBondContact O-OG 2.83Å
322	L	93.5	Very high	83.2	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-52.9	174.3	-62.9	177	0	0	0	111	F266 I270 I318 C319 S324 Q325 M326 F344 L355 T358 V359	F266-L322 HydrophobicContact CE2-CD2 4.25Å; I270-L322 HydrophobicContact CD1-CD2 4.24Å; I318-L322 HydrophobicContact CG2-CD1 4.05Å; I318-L322 HydrophobicContact CG2-CG 4.32Å; I318-L322 WeakPolarHBondContact O-CG 3.29Å; I318-L322 PolarHBondContact O-N 3.1Å; C319-L322 PolarHBondContact O-N 3.15Å; C319-L322 VanDerWaalsContact O-N 3.13Å; L322-S324 PolarHBondContact O-N 3.33Å; L322-S324 VanDerWaalsContact O-N 3.17Å; L322-Q325 PolarHBondContact O-N 3.49Å; L322-M326 WeakPolarHBondContact O-CG 3.47Å; L322-M326 PolarHBondContact O-N 2.85Å; L322-M326 VanDerWaalsContact O-N 3.09Å; L322-F344 HydrophobicContact CB-CE2 4.16Å; L322-F344 HydrophobicContact CB-CZ 4.37Å; L322-F344 HydrophobicContact CD2-CE1 3.95Å; L322-F344 HydrophobicContact CD2-CE2 3.93Å; L322-F344 HydrophobicContact CD2-CZ 3.51Å; L322-L355 HydrophobicContact CD1-CD1 4.05Å; L322-T358 HydrophobicContact CD1-CG2 3.87Å; L322-T358 HydrophobicContact CD2-CG2 3.72Å; L322-T358 HydrophobicContact CG-CG2 4.47Å; L322-V359 HydrophobicContact CD1-CG2 3.7Å
323	W	89.3	Confident	81.1	Confident	78 Å²	78	63.2 Å²	63.2	30%	0.295	33%	0.333	S	S	.	.	H	α-helix	trans	-54.2	-36.3	176.3	-106.2	-97.2	0	0	0	112.8	C319 Q325 M326 L355 V395 W398	C319-W323 HydrophobicContact CB-CE3 4.11Å; C319-W323 HydrophobicContact CB-CZ3 4.09Å; C319-W323 WeakPolarHBondContact O-CB 3.38Å; C319-W323 PolarHBondContact O-N 3.11Å; W323-Q325 PolarHBondContact O-N 3.2Å; W323-Q325 VanDerWaalsContact O-N 3.09Å; W323-M326 HydrophobicContact CD2-SD 4.24Å; W323-M326 HydrophobicContact CE3-SD 4.32Å; W323-M326 HydrophobicContact CG-SD 4.5Å; W323-M326 PolarHBondContact O-N 2.81Å; W323-M326 VanDerWaalsContact O-N 3.13Å; W323-L355 HydrophobicContact CE3-CD1 4.45Å; W323-L355 HydrophobicContact CH2-CD2 3.45Å; W323-L355 VanDerWaalsContact CH2-CD2 3.45Å; W323-L355 HydrophobicContact CZ3-CD1 3.89Å; W323-L355 HydrophobicContact CZ3-CD2 3.54Å; W323-L355 HydrophobicContact CZ3-CG 4.31Å; W323-V395 VanDerWaalsContact CH2-O 3.25Å; W323-V395 WeakPolarHBondContact CH2-O 3.21Å; W323-W398 HydrophobicContact CE3-CE3 4.36Å; W323-W398 HydrophobicContact CE3-CZ3 4.41Å; W323-W398 HydrophobicContact CH2-CE3 4.44Å; W323-W398 WeakPolarHBondContact CZ2-O 3.35Å; W323-W398 HydrophobicContact CZ3-CE3 4.14Å
324	S	89.6	Confident	79.3	Confident	77 Å²	77	67.4 Å²	67.4	54%	0.538	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.4	176.6	80.8	0	0	0	0	114.8	E320 V321 L322	E320-S324 WeakPolarHBondContact O-CB 3.41Å; E320-S324 PolarHBondContact O-N 2.88Å; V321-S324 PolarHBondContact O-OG 2.83Å; L322-S324 PolarHBondContact O-N 3.33Å; L322-S324 VanDerWaalsContact O-N 3.17Å
325	Q	89.1	Confident	77.9	Confident	81 Å²	81	71.3 Å²	71.3	38%	0.379	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-15.6	174.9	-53.2	-49.3	-70	0	0	113.1	L269 L322 W323 F344	L269-Q325 HydrophobicContact CD1-CG 3.62Å; L269-Q325 HydrophobicContact CD2-CG 3.79Å; L269-Q325 HydrophobicContact CG-CG 4.37Å; L322-Q325 PolarHBondContact O-N 3.49Å; W323-Q325 PolarHBondContact O-N 3.2Å; W323-Q325 VanDerWaalsContact O-N 3.09Å; Q325-F344 HydrophobicContact CB-CE2 4.25Å; Q325-F344 HydrophobicContact CB-CZ 3.91Å; Q325-F344 HydrophobicContact CG-CZ 4.38Å
326	M	87.3	Confident	76.9	Confident	44 Å²	44	74.1 Å²	74.1	22%	0.217	38%	0.375	C	S	.	.	S	Bend	trans	-68.5	142.9	-178.7	-72.7	172.9	72.4	0	0	111.8	L322 W323 A328 F344 G348 L350 L355	L322-M326 WeakPolarHBondContact O-CG 3.47Å; L322-M326 PolarHBondContact O-N 2.85Å; L322-M326 VanDerWaalsContact O-N 3.09Å; W323-M326 HydrophobicContact CD2-SD 4.24Å; W323-M326 HydrophobicContact CE3-SD 4.32Å; W323-M326 HydrophobicContact CG-SD 4.5Å; W323-M326 PolarHBondContact O-N 2.81Å; W323-M326 VanDerWaalsContact O-N 3.13Å; M326-A328 PolarHBondContact O-N 2.84Å; M326-F344 HydrophobicContact CG-CD2 4.19Å; M326-F344 HydrophobicContact CG-CE2 3.93Å; M326-G348 CarbonylContact C-O 3.55Å; M326-G348 WeakPolarHBondContact CA-O 3.24Å; M326-G348 WeakPolarHBondContact CB-O 3.34Å; M326-L350 HydrophobicContact CE-CB 4.2Å; M326-L355 HydrophobicContact SD-CD1 4.43Å
327	T	83.8	Confident	76.6	Confident	79 Å²	79	74 Å²	74	49%	0.485	37%	0.374	S	S	.	.			trans	-76.2	122.4	173.1	-63.5	0	0	0	0	108.3	S329 T347 G348	T327-S329 PolarHBondContact O-N 3.44Å; T327-T347 PolarHBondContact OG1-O 3.25Å; T327-G348 PolarHBondContact N-O 3.19Å
328	A	70.2	Confident	76.3	Confident	91 Å²	91	73 Å²	73	75%	0.752	37%	0.368	S	S	*	.			trans	-61.7	97.1	172.6	0	0	0	0	0	110.1	M326 R330	M326-A328 PolarHBondContact O-N 2.84Å; A328-R330 PolarHBondContact O-N 2.9Å
329	S	57.7	Low	76.1	Confident	66 Å²	66	73.6 Å²	73.6	46%	0.462	37%	0.371	S	S	.	.			trans	-70.6	122.7	-174.6	-170.6	0	0	0	0	110.7	T327 V331	T327-S329 PolarHBondContact O-N 3.44Å; S329-V331 PolarHBondContact OG-N 3.49Å; S329-V331 PolarHBondContact OG-O 3.33Å
330	R	50.1	Low	76.2	Confident	241 Å²	241	73.9 Å²	73.9	91%	0.909	37%	0.372	S	S	*	.			trans	-104.5	10.5	170.3	-60.4	-172.2	179.9	-149.6	-2.7	112.3	A328	A328-R330 PolarHBondContact O-N 2.9Å
331	V	48.3	Very low	76.5	Confident	72 Å²	72	71.7 Å²	71.7	44%	0.436	36%	0.362	S	S	.	.			trans	-138.6	97.9	-171.8	-177.9	0	0	0	0	108.5	S329 E333 R334	S329-V331 PolarHBondContact OG-N 3.49Å; S329-V331 PolarHBondContact OG-O 3.33Å; V331-E333 HydrophobicContact CG1-CB 3.95Å; V331-E333 HydrophobicContact CG1-CG 4.34Å; V331-E333 PolarHBondContact O-N 3.26Å; V331-R334 HydrophobicContact CG1-CB 4.43Å; V331-R334 PolarHBondContact O-N 3.07Å
332	K	49.8	Very low	76.6	Confident	194 Å²	194	72.4 Å²	72.4	84%	0.843	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.5	179.8	-164.7	168.8	-178.1	173.2	0	112.5	R334	K332-R334 PolarHBondContact O-N 3.37Å
333	E	49.3	Very low	76.6	Confident	168 Å²	168	72.6 Å²	72.6	79%	0.785	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-4.9	-179.3	-51.4	177.2	143.8	0	0	114.9	V331	V331-E333 HydrophobicContact CG1-CB 3.95Å; V331-E333 HydrophobicContact CG1-CG 4.34Å; V331-E333 PolarHBondContact O-N 3.26Å
334	R	55	Low	76.9	Confident	138 Å²	138	69.3 Å²	69.3	52%	0.521	35%	0.353	S	S	.	.			trans	-111.2	33.4	-168.3	-150.5	-175.2	-179.1	149.5	5.7	115.2	V331 K332	V331-R334 HydrophobicContact CG1-CB 4.43Å; V331-R334 PolarHBondContact O-N 3.07Å; K332-R334 PolarHBondContact O-N 3.37Å
335	L	65.7	Low	77.2	Confident	81 Å²	81	67.8 Å²	67.8	42%	0.424	34%	0.339	S	S	.	.			trans	-99.2	28.2	179.2	-60.3	177.7	0	0	0	113.6	T338 I349	L335-T338 HydrophobicContact CD2-CG2 4.48Å; L335-T338 PolarHBondContact O-OG1 3.24Å; L335-I349 HydrophobicContact CD2-CG2 3.93Å
336	T	74.4	Confident	77.3	Confident	59 Å²	59	67.1 Å²	67.1	36%	0.362	34%	0.34	S	S	.	.	S	Bend	trans	-92.9	136.8	167.7	38.1	0	0	0	0	109.6	T338 S483	T336-T338 VanDerWaalsContact C-N 3.33Å; T336-T338 PolarHBondContact O-N 3.36Å; T336-S483 WeakPolarHBondContact OG1-CB 3.23Å; T336-S483 PolarHBondContact OG1-OG 3.3Å
337	H	86.1	Confident	77.4	Confident	11 Å²	11	67.4 Å²	67.4	5%	0.051	35%	0.345	C	S	.	.	S	Bend	trans	58.7	36.7	-176.5	-39.9	-55.2	0	0	0	114.3	E87 T91 S343 Q479 G481	E87-H337 HydrophobicContact CG-CB 4.41Å; E87-H337 IonicContact OE1-CE1 3.41Å; E87-H337 IonicContact OE1-CG 3.23Å; E87-H337 IonicContact OE1-ND1 3.33Å; E87-H337 PolarHBondContact OE1-ND1 2.9Å; T91-H337 VanDerWaalsContact CB-NE2 3.33Å; T91-H337 WeakPolarHBondContact CB-NE2 3.49Å; T91-H337 PolarHBondContact OG1-CD2 2.88Å; T91-H337 VanDerWaalsContact OG1-CD2 3.26Å; T91-H337 PolarHBondContact OG1-CE1 3.23Å; T91-H337 VanDerWaalsContact OG1-CE1 3.28Å; T91-H337 PolarHBondContact OG1-NE2 2.75Å; H337-S343 WeakPolarHBondContact O-CB 3.28Å; H337-Q479 PolarHBondContact CE1-O 2.99Å; H337-G481 PolarHBondContact CE1-O 2.9Å; H337-G481 PolarHBondContact NE2-O 2.91Å
338	T	89.2	Confident	77.7	Confident	3 Å²	3	64 Å²	64	2%	0.018	33%	0.325	C	S	.	.			trans	-102.4	9.2	-179.7	46.7	0	0	0	0	114.2	L335 T336 S340 S343 I349 L350 D351	L335-T338 HydrophobicContact CD2-CG2 4.48Å; L335-T338 PolarHBondContact O-OG1 3.24Å; T336-T338 VanDerWaalsContact C-N 3.33Å; T336-T338 PolarHBondContact O-N 3.36Å; T338-S340 VanDerWaalsContact C-N 3.3Å; T338-S340 PolarHBondContact O-N 3.22Å; T338-S343 VanDerWaalsContact C-OG 3.31Å; T338-S343 WeakPolarHBondContact CA-OG 3.44Å; T338-S343 PolarHBondContact O-OG 3.43Å; T338-I349 HydrophobicContact CG2-CB 3.92Å; T338-I349 HydrophobicContact CG2-CG2 3.57Å; T338-L350 VanDerWaalsContact O-CA 3.28Å; T338-L350 WeakPolarHBondContact O-CA 3.42Å; T338-L350 VanDerWaalsContact O-CD2 3.28Å; T338-L350 WeakPolarHBondContact O-CD2 3.25Å; T338-D351 WeakPolarHBondContact CA-OD2 3.29Å; T338-D351 VanDerWaalsContact CB-OD2 3.3Å; T338-D351 WeakPolarHBondContact CB-OD2 3.35Å; T338-D351 PolarHBondContact O-N 2.91Å; T338-D351 PolarHBondContact OG1-OD2 2.9Å
339	Q	91.4	Very high	78.7	Confident	12 Å²	12	60.5 Å²	60.5	6%	0.056	29%	0.293	C	S	.	.	S	Bend	trans	-86	8.7	-169.8	74.4	-76.9	76.6	0	0	114.4	E87 D351 F353 A477	E87-Q339 VanDerWaalsContact CD-NE2 3.33Å; E87-Q339 PolarHBondContact OE1-NE2 2.94Å; E87-Q339 PolarHBondContact OE2-NE2 3.04Å; Q339-D351 WeakPolarHBondContact CA-OD2 3.37Å; Q339-D351 PolarHBondContact N-OD2 2.88Å; Q339-F353 HydrophobicContact CB-CD1 3.96Å; Q339-F353 HydrophobicContact CB-CE1 4.39Å; Q339-A477 HydrophobicContact CB-CB 4.33Å; Q339-A477 HydrophobicContact CG-CB 4.02Å; Q339-A477 PolarHBondContact NE2-O 3.14Å
340	S	95.8	Very high	80.3	Confident	5 Å²	5	58 Å²	58	4%	0.035	28%	0.275	C	S	.	.	S	Bend	trans	-135.4	152.7	-160.9	69	0	0	0	0	115.6	S80 T338 Y342 S343 F344 L350	S80-S340 WeakPolarHBondContact OG-CA 3.45Å; T338-S340 VanDerWaalsContact C-N 3.3Å; T338-S340 PolarHBondContact O-N 3.22Å; S340-Y342 PolarHBondContact O-N 2.71Å; S340-Y342 VanDerWaalsContact O-N 3.16Å; S340-S343 PolarHBondContact N-OG 2.79Å; S340-S343 PolarHBondContact O-N 3.14Å; S340-S343 VanDerWaalsContact O-N 3.08Å; S340-S343 PolarHBondContact O-OG 3.39Å; S340-S343 PolarHBondContact OG-N 2.82Å; S340-S343 VanDerWaalsContact OG-N 3.09Å; S340-F344 PolarHBondContact O-N 3.03Å; S340-F344 VanDerWaalsContact O-N 3.08Å; S340-L350 WeakPolarHBondContact O-CD2 3.48Å
341	V	97.2	Very high	82.1	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-24.3	169.9	-179.5	0	0	0	0	110.8	S80 I81 F266 L345 T358	S80-V341 PolarHBondContact OG-N 3.19Å; I81-V341 HydrophobicContact CD1-CG1 3.96Å; I81-V341 HydrophobicContact CG1-CB 3.94Å; I81-V341 HydrophobicContact CG1-CG1 3.73Å; F266-V341 HydrophobicContact CB-CG1 4.23Å; F266-V341 HydrophobicContact CD1-CG1 4.05Å; F266-V341 HydrophobicContact CD2-CG1 3.73Å; F266-V341 HydrophobicContact CE1-CG1 4.33Å; F266-V341 HydrophobicContact CE2-CG1 4.03Å; F266-V341 HydrophobicContact CG-CG1 3.74Å; F266-V341 HydrophobicContact CZ-CG1 4.32Å; V341-L345 HydrophobicContact CG1-CD1 4.27Å; V341-L345 HydrophobicContact CG1-CG 4.47Å; V341-L345 WeakPolarHBondContact O-CB 3.38Å; V341-L345 VanDerWaalsContact O-CG 3.23Å; V341-L345 WeakPolarHBondContact O-CG 3.46Å; V341-L345 PolarHBondContact O-N 3.41Å; V341-L345 VanDerWaalsContact O-N 3.07Å; V341-T358 HydrophobicContact CG2-CG2 4.36Å
342	Y	96.9	Very high	84	Confident	21 Å²	21	46.6 Å²	46.6	8%	0.082	23%	0.233	C	C	.	.	H	α-helix	trans	-66.6	-47.2	171	-177.1	-103	0	0	0	112.9	I81 G84 Y85 N88 L262 S340 L345 T346	I81-Y342 HydrophobicContact CG2-CD2 4.46Å; G84-Y342 VanDerWaalsContact C-CD1 3.43Å; G84-Y342 VanDerWaalsContact O-CD1 3.24Å; G84-Y342 WeakPolarHBondContact O-CD1 3.33Å; Y85-Y342 HydrophobicContact CD2-CD2 4.41Å; Y85-Y342 AromaticContact CD2-CE2 3.65Å; Y85-Y342 HydrophobicContact CD2-CE2 3.65Å; Y85-Y342 AromaticContact CD2-CZ 3.9Å; Y85-Y342 HydrophobicContact CG-CE2 4.31Å; N88-Y342 HydrophobicContact CB-CD1 4.14Å; N88-Y342 HydrophobicContact CB-CE1 3.74Å; L262-Y342 HydrophobicContact CD1-CD2 4.06Å; L262-Y342 HydrophobicContact CD1-CE2 3.93Å; S340-Y342 PolarHBondContact O-N 2.71Å; S340-Y342 VanDerWaalsContact O-N 3.16Å; Y342-L345 PolarHBondContact O-N 2.7Å; Y342-T346 HydrophobicContact CD2-CG2 4.13Å; Y342-T346 HydrophobicContact CE1-CG2 4.11Å; Y342-T346 HydrophobicContact CE2-CG2 3.66Å; Y342-T346 WeakPolarHBondContact O-CB 3.22Å; Y342-T346 WeakPolarHBondContact O-CG2 3.18Å; Y342-T346 PolarHBondContact O-N 3.36Å; Y342-T346 VanDerWaalsContact O-N 3.07Å; Y342-T346 PolarHBondContact O-OG1 3.48Å
343	S	93.3	Very high	86.1	Confident	3 Å²	3	38.7 Å²	38.7	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-64.2	-42.5	177.7	67.9	0	0	0	0	110.8	H337 T338 S340 L345 T346 T347 G348 I349	H337-S343 WeakPolarHBondContact O-CB 3.28Å; T338-S343 VanDerWaalsContact C-OG 3.31Å; T338-S343 WeakPolarHBondContact CA-OG 3.44Å; T338-S343 PolarHBondContact O-OG 3.43Å; S340-S343 PolarHBondContact N-OG 2.79Å; S340-S343 PolarHBondContact O-N 3.14Å; S340-S343 VanDerWaalsContact O-N 3.08Å; S340-S343 PolarHBondContact O-OG 3.39Å; S340-S343 PolarHBondContact OG-N 2.82Å; S340-S343 VanDerWaalsContact OG-N 3.09Å; S343-L345 VanDerWaalsContact C-N 3.32Å; S343-L345 PolarHBondContact O-N 3.21Å; S343-T346 PolarHBondContact O-N 2.96Å; S343-T346 VanDerWaalsContact O-N 3.13Å; S343-T347 PolarHBondContact O-N 2.92Å; S343-T347 PolarHBondContact O-OG1 2.94Å; S343-G348 PolarHBondContact O-N 3.37Å; S343-G348 VanDerWaalsContact O-N 3.14Å; S343-I349 PolarHBondContact OG-O 2.91Å; S343-I349 VanDerWaalsContact OG-O 3.05Å
344	F	95.2	Very high	88.2	Confident	9 Å²	9	30.7 Å²	30.7	4%	0.039	16%	0.161	C	C	.	.	H	α-helix	trans	-53.2	-45.8	171.3	176.6	-104.3	0	0	0	113.1	F266 L269 L322 Q325 M326 S340 T346 G348 L350	F266-F344 HydrophobicContact CD2-CD1 4.06Å; F266-F344 AromaticContact CD2-CE1 3.97Å; F266-F344 HydrophobicContact CD2-CE1 3.97Å; F266-F344 HydrophobicContact CE2-CD1 4.12Å; F266-F344 AromaticContact CE2-CE1 4Å; F266-F344 HydrophobicContact CE2-CE1 4Å; L269-F344 HydrophobicContact CD2-CE1 3.61Å; L269-F344 HydrophobicContact CD2-CZ 3.73Å; L322-F344 HydrophobicContact CB-CE2 4.16Å; L322-F344 HydrophobicContact CB-CZ 4.37Å; L322-F344 HydrophobicContact CD2-CE1 3.95Å; L322-F344 HydrophobicContact CD2-CE2 3.93Å; L322-F344 HydrophobicContact CD2-CZ 3.51Å; Q325-F344 HydrophobicContact CB-CE2 4.25Å; Q325-F344 HydrophobicContact CB-CZ 3.91Å; Q325-F344 HydrophobicContact CG-CZ 4.38Å; M326-F344 HydrophobicContact CG-CD2 4.19Å; M326-F344 HydrophobicContact CG-CE2 3.93Å; S340-F344 PolarHBondContact O-N 3.03Å; S340-F344 VanDerWaalsContact O-N 3.08Å; F344-T346 VanDerWaalsContact C-N 3.35Å; F344-T346 PolarHBondContact O-N 2.92Å; F344-G348 VanDerWaalsContact O-CA 3.31Å; F344-G348 WeakPolarHBondContact O-CA 3.26Å; F344-G348 PolarHBondContact O-N 2.87Å; F344-L350 HydrophobicContact CB-CD1 3.96Å; F344-L350 HydrophobicContact CB-CD2 3.87Å; F344-L350 HydrophobicContact CB-CG 3.9Å; F344-L350 HydrophobicContact CD2-CD1 3.72Å; F344-L350 HydrophobicContact CD2-CG 4.16Å; F344-L350 HydrophobicContact CG-CD1 4.1Å; F344-L350 HydrophobicContact CG-CG 4.46Å
345	L	95.4	Very high	90.1	Very high	46 Å²	46	24.5 Å²	24.5	24%	0.241	14%	0.138	C	C	.	.	H	α-helix	trans	-72.7	-20.9	179.9	-74.7	173.4	0	0	0	114.7	I81 L262 D265 F266 V341 Y342 S343	I81-L345 HydrophobicContact CD1-CD1 3.93Å; I81-L345 HydrophobicContact CG1-CD1 4.23Å; L262-L345 HydrophobicContact CB-CD1 4.12Å; L262-L345 HydrophobicContact CD2-CD1 4.21Å; L262-L345 WeakPolarHBondContact O-CD1 3.46Å; D265-L345 HydrophobicContact CB-CD2 4.24Å; F266-L345 HydrophobicContact CB-CD1 4.16Å; F266-L345 HydrophobicContact CB-CD2 4.06Å; F266-L345 HydrophobicContact CB-CG 4.45Å; V341-L345 HydrophobicContact CG1-CD1 4.27Å; V341-L345 HydrophobicContact CG1-CG 4.47Å; V341-L345 WeakPolarHBondContact O-CB 3.38Å; V341-L345 VanDerWaalsContact O-CG 3.23Å; V341-L345 WeakPolarHBondContact O-CG 3.46Å; V341-L345 PolarHBondContact O-N 3.41Å; V341-L345 VanDerWaalsContact O-N 3.07Å; Y342-L345 PolarHBondContact O-N 2.7Å; S343-L345 VanDerWaalsContact C-N 3.32Å; S343-L345 PolarHBondContact O-N 3.21Å
346	T	92.3	Very high	91.5	Very high	66 Å²	66	20.6 Å²	20.6	41%	0.405	12%	0.118	S	C	.	.	H	α-helix	trans	-114.5	-40.5	-169.6	54.8	0	0	0	0	114.4	Y342 S343 F344	Y342-T346 HydrophobicContact CD2-CG2 4.13Å; Y342-T346 HydrophobicContact CE1-CG2 4.11Å; Y342-T346 HydrophobicContact CE2-CG2 3.66Å; Y342-T346 WeakPolarHBondContact O-CB 3.22Å; Y342-T346 WeakPolarHBondContact O-CG2 3.18Å; Y342-T346 PolarHBondContact O-N 3.36Å; Y342-T346 VanDerWaalsContact O-N 3.07Å; Y342-T346 PolarHBondContact O-OG1 3.48Å; S343-T346 PolarHBondContact O-N 2.96Å; S343-T346 VanDerWaalsContact O-N 3.13Å; F344-T346 VanDerWaalsContact C-N 3.35Å; F344-T346 PolarHBondContact O-N 2.92Å
347	T	88.5	Confident	92.6	Very high	51 Å²	51	17.9 Å²	17.9	31%	0.313	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-23	176.1	69.3	0	0	0	0	112.5	T327 S343 I349	T327-T347 PolarHBondContact OG1-O 3.25Å; S343-T347 PolarHBondContact O-N 2.92Å; S343-T347 PolarHBondContact O-OG1 2.94Å; T347-I349 VanDerWaalsContact C-N 3.27Å; T347-I349 PolarHBondContact OG1-N 3.25Å; T347-I349 VanDerWaalsContact OG1-N 3.12Å
348	G	91	Very high	93.2	Very high	6 Å²	6	17.3 Å²	17.3	6%	0.062	10%	0.098	C	C	.	.			trans	72.5	19.3	-170.3	0	0	0	0	0	113	M326 T327 S343 F344	M326-G348 CarbonylContact C-O 3.55Å; M326-G348 WeakPolarHBondContact CA-O 3.24Å; M326-G348 WeakPolarHBondContact CB-O 3.34Å; T327-G348 PolarHBondContact N-O 3.19Å; S343-G348 PolarHBondContact O-N 3.37Å; S343-G348 VanDerWaalsContact O-N 3.14Å; F344-G348 VanDerWaalsContact O-CA 3.31Å; F344-G348 WeakPolarHBondContact O-CA 3.26Å; F344-G348 PolarHBondContact O-N 2.87Å
349	I	89.8	Confident	93.6	Very high	18 Å²	18	17.2 Å²	17.2	9%	0.092	10%	0.097	C	C	.	.			trans	-116.5	134.2	-178.6	-49.8	177.1	0	0	0	109.4	L335 T338 S343 T347	L335-I349 HydrophobicContact CD2-CG2 3.93Å; T338-I349 HydrophobicContact CG2-CB 3.92Å; T338-I349 HydrophobicContact CG2-CG2 3.57Å; S343-I349 PolarHBondContact OG-O 2.91Å; S343-I349 VanDerWaalsContact OG-O 3.05Å; T347-I349 VanDerWaalsContact C-N 3.27Å; T347-I349 PolarHBondContact OG1-N 3.25Å; T347-I349 VanDerWaalsContact OG1-N 3.12Å
350	L	91.2	Very high	93.8	Very high	14 Å²	14	16.7 Å²	16.7	7%	0.073	10%	0.095	C	C	.	.			trans	-130.5	146	171	-71.4	174.4	0	0	0	109.5	M326 T338 S340 F344 L355 T358	M326-L350 HydrophobicContact CE-CB 4.2Å; T338-L350 VanDerWaalsContact O-CA 3.28Å; T338-L350 WeakPolarHBondContact O-CA 3.42Å; T338-L350 VanDerWaalsContact O-CD2 3.28Å; T338-L350 WeakPolarHBondContact O-CD2 3.25Å; S340-L350 WeakPolarHBondContact O-CD2 3.48Å; F344-L350 HydrophobicContact CB-CD1 3.96Å; F344-L350 HydrophobicContact CB-CD2 3.87Å; F344-L350 HydrophobicContact CB-CG 3.9Å; F344-L350 HydrophobicContact CD2-CD1 3.72Å; F344-L350 HydrophobicContact CD2-CG 4.16Å; F344-L350 HydrophobicContact CG-CD1 4.1Å; F344-L350 HydrophobicContact CG-CG 4.46Å; L350-L355 HydrophobicContact CB-CB 4.27Å; L350-L355 HydrophobicContact CD1-CB 4.41Å; L350-L355 HydrophobicContact CD1-CD1 4.26Å; L350-T358 HydrophobicContact CD1-CG2 4.16Å
351	D	88.6	Confident	93.9	Very high	31 Å²	31	16.5 Å²	16.5	17%	0.166	9%	0.094	C	C	.	.			trans	-86.8	179.9	162.5	47.6	58.1	0	0	0	111.2	T338 Q339 F353 G354 L355	T338-D351 WeakPolarHBondContact CA-OD2 3.29Å; T338-D351 VanDerWaalsContact CB-OD2 3.3Å; T338-D351 WeakPolarHBondContact CB-OD2 3.35Å; T338-D351 PolarHBondContact O-N 2.91Å; T338-D351 PolarHBondContact OG1-OD2 2.9Å; Q339-D351 WeakPolarHBondContact CA-OD2 3.37Å; Q339-D351 PolarHBondContact N-OD2 2.88Å; D351-F353 PolarHBondContact O-N 3.34Å; D351-G354 PolarHBondContact O-N 3.04Å; D351-G354 WeakPolarHBondContact OD1-CA 3.39Å; D351-G354 PolarHBondContact OD1-N 2.95Å; D351-L355 VanDerWaalsContact O-CB 3.27Å; D351-L355 WeakPolarHBondContact O-CB 3.31Å; D351-L355 PolarHBondContact O-N 2.74Å
352	S	88.3	Confident	93.9	Very high	42 Å²	42	16.5 Å²	16.5	29%	0.294	9%	0.094	S	C	.	.	H	α-helix	trans	-56.7	-50.9	-177.8	49.3	0	0	0	0	112.2	L355 A356	S352-L355 PolarHBondContact O-N 2.84Å; S352-A356 PolarHBondContact O-N 3.11Å
353	F	93.6	Very high	93.8	Very high	29 Å²	29	15.5 Å²	15.5	13%	0.127	9%	0.09	C	C	.	.	H	α-helix	trans	-58.5	-51.9	174.3	173.7	-86	0	0	0	111.8	Q339 D351 L355 A356 Y357 L373 L375 A473 A477	Q339-F353 HydrophobicContact CB-CD1 3.96Å; Q339-F353 HydrophobicContact CB-CE1 4.39Å; D351-F353 PolarHBondContact O-N 3.34Å; F353-L355 VanDerWaalsContact C-N 3.26Å; F353-L355 PolarHBondContact O-N 2.75Å; F353-A356 PolarHBondContact O-N 3.12Å; F353-Y357 HydrophobicContact CE1-CD2 4.28Å; F353-Y357 HydrophobicContact CZ-CD2 4.09Å; F353-Y357 WeakPolarHBondContact O-CB 3.48Å; F353-Y357 PolarHBondContact O-N 3.42Å; F353-L373 HydrophobicContact CE2-CD2 3.95Å; F353-L373 HydrophobicContact CZ-CD2 4.3Å; F353-L375 HydrophobicContact CD2-CD2 3.66Å; F353-L375 HydrophobicContact CE2-CD1 4.26Å; F353-L375 HydrophobicContact CE2-CD2 3.86Å; F353-A473 HydrophobicContact CE2-CB 4.02Å; F353-A473 HydrophobicContact CZ-CB 4.15Å; F353-A477 HydrophobicContact CD1-CB 4.03Å; F353-A477 HydrophobicContact CE1-CB 3.61Å; F353-A477 HydrophobicContact CE2-CB 4.48Å; F353-A477 HydrophobicContact CZ-CB 3.87Å
354	G	94.1	Very high	93.9	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-61.6	-35.4	-176.9	0	0	0	0	0	112.5	D351 T358	D351-G354 PolarHBondContact O-N 3.04Å; D351-G354 WeakPolarHBondContact OD1-CA 3.39Å; D351-G354 PolarHBondContact OD1-N 2.95Å; G354-T358 WeakPolarHBondContact O-CB 3.45Å; G354-T358 PolarHBondContact O-N 3.27Å; G354-T358 PolarHBondContact O-OG1 3.24Å
355	L	94.1	Very high	93.7	Very high	7 Å²	7	16.3 Å²	16.3	4%	0.037	9%	0.094	C	C	.	.	H	α-helix	trans	-67.2	-52.7	172.8	179.6	65.4	0	0	0	112	L322 W323 M326 L350 D351 S352 F353 Y357 T358 V359 V395 A396	L322-L355 HydrophobicContact CD1-CD1 4.05Å; W323-L355 HydrophobicContact CE3-CD1 4.45Å; W323-L355 HydrophobicContact CH2-CD2 3.45Å; W323-L355 VanDerWaalsContact CH2-CD2 3.45Å; W323-L355 HydrophobicContact CZ3-CD1 3.89Å; W323-L355 HydrophobicContact CZ3-CD2 3.54Å; W323-L355 HydrophobicContact CZ3-CG 4.31Å; M326-L355 HydrophobicContact SD-CD1 4.43Å; L350-L355 HydrophobicContact CB-CB 4.27Å; L350-L355 HydrophobicContact CD1-CB 4.41Å; L350-L355 HydrophobicContact CD1-CD1 4.26Å; D351-L355 VanDerWaalsContact O-CB 3.27Å; D351-L355 WeakPolarHBondContact O-CB 3.31Å; D351-L355 PolarHBondContact O-N 2.74Å; S352-L355 PolarHBondContact O-N 2.84Å; F353-L355 VanDerWaalsContact C-N 3.26Å; F353-L355 PolarHBondContact O-N 2.75Å; L355-Y357 VanDerWaalsContact C-N 3.31Å; L355-Y357 PolarHBondContact O-N 3.02Å; L355-T358 PolarHBondContact O-N 2.89Å; L355-T358 VanDerWaalsContact O-N 3.1Å; L355-V359 HydrophobicContact CD1-CG2 4.46Å; L355-V359 WeakPolarHBondContact O-CG2 3.38Å; L355-V359 PolarHBondContact O-N 3.49Å; L355-V395 HydrophobicContact CD2-CB 4.41Å; L355-V395 HydrophobicContact CD2-CG2 4.16Å; L355-V395 VanDerWaalsContact CD2-O 3.32Å; L355-V395 WeakPolarHBondContact CD2-O 3.42Å; L355-V395 HydrophobicContact CG-CG2 4.01Å; L355-A396 HydrophobicContact CD2-CB 4.13Å
356	A	96.1	Very high	93.6	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-57	-45.6	177.5	0	0	0	0	0	111.5	S352 F353 T358 V359 V360 L373 V382 V395	S352-A356 PolarHBondContact O-N 3.11Å; F353-A356 PolarHBondContact O-N 3.12Å; A356-T358 PolarHBondContact O-N 3.28Å; A356-V359 PolarHBondContact O-N 3.47Å; A356-V360 WeakPolarHBondContact O-CG2 3.37Å; A356-V360 PolarHBondContact O-N 3.22Å; A356-V360 VanDerWaalsContact O-N 3.07Å; A356-L373 HydrophobicContact CB-CD1 3.66Å; A356-V382 HydrophobicContact CB-CG1 4.39Å; A356-V395 HydrophobicContact CB-CG2 4.12Å
357	Y	97.5	Very high	93.5	Very high	1 Å²	1	13.3 Å²	13.3	0%	0.004	9%	0.086	C	C	.	.	H	α-helix	trans	-58	-46.3	173.8	-169.7	-76.9	0	0	0	112.2	L76 S80 F353 L355 V359 V360 A361 L373 A470 A474	L76-Y357 HydrophobicContact CB-CE1 3.94Å; L76-Y357 WeakPolarHBondContact CB-OH 3.4Å; L76-Y357 PolarHBondContact O-OH 2.78Å; S80-Y357 VanDerWaalsContact CB-CE1 3.5Å; F353-Y357 HydrophobicContact CE1-CD2 4.28Å; F353-Y357 HydrophobicContact CZ-CD2 4.09Å; F353-Y357 WeakPolarHBondContact O-CB 3.48Å; F353-Y357 PolarHBondContact O-N 3.42Å; L355-Y357 VanDerWaalsContact C-N 3.31Å; L355-Y357 PolarHBondContact O-N 3.02Å; Y357-V359 VanDerWaalsContact C-N 3.34Å; Y357-V359 PolarHBondContact O-N 3.33Å; Y357-V360 PolarHBondContact O-N 2.98Å; Y357-A361 WeakPolarHBondContact O-CB 3.5Å; Y357-A361 PolarHBondContact O-N 3.4Å; Y357-L373 HydrophobicContact CD2-CD2 3.98Å; Y357-A470 HydrophobicContact CE2-CB 4.35Å; Y357-A470 WeakPolarHBondContact CE2-O 3.35Å; Y357-A474 HydrophobicContact CD2-CB 4.4Å; Y357-A474 HydrophobicContact CE2-CB 3.69Å
358	T	97.5	Very high	93.7	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-66.5	-34.4	-179	-62	0	0	0	0	112	F266 L322 V341 L350 G354 L355 A356 A361 A362	F266-T358 HydrophobicContact CE2-CG2 3.72Å; F266-T358 HydrophobicContact CZ-CG2 3.81Å; L322-T358 HydrophobicContact CD1-CG2 3.87Å; L322-T358 HydrophobicContact CD2-CG2 3.72Å; L322-T358 HydrophobicContact CG-CG2 4.47Å; V341-T358 HydrophobicContact CG2-CG2 4.36Å; L350-T358 HydrophobicContact CD1-CG2 4.16Å; G354-T358 WeakPolarHBondContact O-CB 3.45Å; G354-T358 PolarHBondContact O-N 3.27Å; G354-T358 PolarHBondContact O-OG1 3.24Å; L355-T358 PolarHBondContact O-N 2.89Å; L355-T358 VanDerWaalsContact O-N 3.1Å; A356-T358 PolarHBondContact O-N 3.28Å; T358-A361 PolarHBondContact O-N 2.91Å; T358-A362 WeakPolarHBondContact O-CB 3.46Å; T358-A362 PolarHBondContact O-N 3.06Å
359	V	97.2	Very high	93.6	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-64.8	-46.4	172.1	172.9	0	0	0	0	110.9	I315 I318 L322 L355 A356 Y357 A361 A362 C363 V382 V395	I315-V359 HydrophobicContact CD1-CG1 4.35Å; I315-V359 HydrophobicContact CG2-CG1 4.23Å; I318-V359 HydrophobicContact CG2-CB 4.43Å; I318-V359 HydrophobicContact CG2-CG1 4.21Å; I318-V359 HydrophobicContact CG2-CG2 4.18Å; L322-V359 HydrophobicContact CD1-CG2 3.7Å; L355-V359 HydrophobicContact CD1-CG2 4.46Å; L355-V359 WeakPolarHBondContact O-CG2 3.38Å; L355-V359 PolarHBondContact O-N 3.49Å; A356-V359 PolarHBondContact O-N 3.47Å; Y357-V359 VanDerWaalsContact C-N 3.34Å; Y357-V359 PolarHBondContact O-N 3.33Å; V359-A361 VanDerWaalsContact C-N 3.34Å; V359-A361 PolarHBondContact O-N 2.77Å; V359-A362 PolarHBondContact O-N 3.24Å; V359-C363 PolarHBondContact O-N 3.48Å; V359-C363 PolarHBondContact O-SG 3Å; V359-C363 VanDerWaalsContact O-SG 3.37Å; V359-V382 HydrophobicContact CB-CG1 4.09Å; V359-V382 HydrophobicContact CG1-CG1 3.91Å; V359-V382 HydrophobicContact CG1-CG2 4.38Å; V359-V395 HydrophobicContact CG2-CB 4.49Å; V359-V395 HydrophobicContact CG2-CG1 4.36Å; V359-V395 HydrophobicContact CG2-CG2 4.33Å
360	V	97.3	Very high	93.8	Very high	2 Å²	2	13.5 Å²	13.5	1%	0.012	9%	0.088	C	C	.	.	H	α-helix	trans	-61.6	-42.4	176.4	179.6	0	0	0	0	111.1	L76 A356 Y357 C363 Q364 V371 L373 V382	L76-V360 HydrophobicContact CD1-CG1 3.74Å; A356-V360 WeakPolarHBondContact O-CG2 3.37Å; A356-V360 PolarHBondContact O-N 3.22Å; A356-V360 VanDerWaalsContact O-N 3.07Å; Y357-V360 PolarHBondContact O-N 2.98Å; V360-C363 WeakPolarHBondContact O-CB 3.32Å; V360-C363 PolarHBondContact O-N 3.28Å; V360-Q364 PolarHBondContact O-N 3.4Å; V360-V371 HydrophobicContact CG2-CG1 4.26Å; V360-L373 HydrophobicContact CG2-CB 4.14Å; V360-V382 HydrophobicContact CG2-CB 4.44Å; V360-V382 HydrophobicContact CG2-CG1 3.71Å
361	A	97	Very high	94	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-63.2	-40.6	175.4	0	0	0	0	0	112.4	L76 A77 F266 Y357 T358 V359 Q364 L365	L76-A361 HydrophobicContact CB-CB 4.05Å; A77-A361 HydrophobicContact CB-CB 4.3Å; F266-A361 HydrophobicContact CE1-CB 4.48Å; Y357-A361 WeakPolarHBondContact O-CB 3.5Å; Y357-A361 PolarHBondContact O-N 3.4Å; T358-A361 PolarHBondContact O-N 2.91Å; V359-A361 VanDerWaalsContact C-N 3.34Å; V359-A361 PolarHBondContact O-N 2.77Å; A361-Q364 PolarHBondContact O-N 2.95Å; A361-L365 WeakPolarHBondContact O-CG 3.23Å; A361-L365 PolarHBondContact O-N 3.42Å; A361-L365 VanDerWaalsContact O-N 3.1Å
362	A	96.7	Very high	94.3	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-64.6	-42.3	174.3	0	0	0	0	0	112.2	F266 I270 I318 T358 V359 Q364 L365 L366	F266-A362 HydrophobicContact CZ-CB 4.29Å; I270-A362 HydrophobicContact CD1-CB 3.77Å; I270-A362 HydrophobicContact CG1-CB 4Å; I270-A362 HydrophobicContact CG2-CB 4.18Å; I318-A362 HydrophobicContact CD1-CB 4.42Å; I318-A362 HydrophobicContact CG2-CB 3.76Å; T358-A362 WeakPolarHBondContact O-CB 3.46Å; T358-A362 PolarHBondContact O-N 3.06Å; V359-A362 PolarHBondContact O-N 3.24Å; A362-Q364 PolarHBondContact O-N 3.38Å; A362-L365 PolarHBondContact O-N 3.4Å; A362-L366 WeakPolarHBondContact O-CG 3.42Å; A362-L366 PolarHBondContact O-N 3.45Å; A362-L366 VanDerWaalsContact O-N 3.09Å
363	C	95.8	Very high	94.7	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-58.6	-44.3	172.9	-74.4	0	0	0	0	112.1	I318 V359 V360 L365 L366 G367 Y368 V371	I318-C363 WeakPolarHBondContact CD1-SG 3.28Å; V359-C363 PolarHBondContact O-N 3.48Å; V359-C363 PolarHBondContact O-SG 3Å; V359-C363 VanDerWaalsContact O-SG 3.37Å; V360-C363 WeakPolarHBondContact O-CB 3.32Å; V360-C363 PolarHBondContact O-N 3.28Å; C363-L365 VanDerWaalsContact C-N 3.33Å; C363-L365 PolarHBondContact O-N 2.85Å; C363-L366 PolarHBondContact O-N 3.35Å; C363-L366 VanDerWaalsContact O-N 3.14Å; C363-G367 PolarHBondContact O-N 2.88Å; C363-G367 VanDerWaalsContact O-N 3.16Å; C363-Y368 PolarHBondContact O-N 3.22Å; C363-V371 HydrophobicContact CB-CB 3.84Å; C363-V371 HydrophobicContact CB-CG1 4.11Å; C363-V371 HydrophobicContact CB-CG2 3.81Å
364	Q	94	Very high	94.9	Very high	13 Å²	13	8.5 Å²	8.5	6%	0.061	6%	0.06	C	C	.	.	H	α-helix	trans	-59.8	-41.2	175.6	-173.4	-179	56.1	0	0	111.9	E73 P74 V360 A361 A362 L366 G367	E73-Q364 PolarHBondContact OE2-NE2 3.48Å; P74-Q364 PolarHBondContact O-NE2 2.99Å; P74-Q364 PolarHBondContact O-OE1 3.47Å; V360-Q364 PolarHBondContact O-N 3.4Å; A361-Q364 PolarHBondContact O-N 2.95Å; A362-Q364 PolarHBondContact O-N 3.38Å; Q364-L366 VanDerWaalsContact C-N 3.31Å; Q364-L366 PolarHBondContact O-N 3.26Å; Q364-G367 PolarHBondContact O-N 2.96Å
365	L	92.4	Very high	94.9	Very high	17 Å²	17	8.8 Å²	8.8	9%	0.089	6%	0.061	C	C	.	.	H	α-helix	trans	-68.8	-25.7	176.5	-66.7	-174.5	0	0	0	113.8	A77 Y263 F266 Y267 A361 A362 C363 G367	A77-L365 HydrophobicContact CB-CD1 4.4Å; Y263-L365 HydrophobicContact CE2-CD2 4.48Å; Y263-L365 WeakPolarHBondContact OH-CD2 3.35Å; F266-L365 HydrophobicContact CD1-CD1 3.66Å; F266-L365 HydrophobicContact CE1-CD1 3.71Å; Y267-L365 HydrophobicContact CD2-CD1 4.12Å; Y267-L365 HydrophobicContact CD2-CD2 4.05Å; Y267-L365 HydrophobicContact CE2-CD2 4.44Å; A361-L365 WeakPolarHBondContact O-CG 3.23Å; A361-L365 PolarHBondContact O-N 3.42Å; A361-L365 VanDerWaalsContact O-N 3.1Å; A362-L365 PolarHBondContact O-N 3.4Å; C363-L365 VanDerWaalsContact C-N 3.33Å; C363-L365 PolarHBondContact O-N 2.85Å; L365-G367 VanDerWaalsContact C-N 3.34Å
366	L	92.9	Very high	94.9	Very high	5 Å²	5	8.6 Å²	8.6	3%	0.026	6%	0.06	C	C	.	.	H	α-helix	trans	-84.5	-6.7	174.5	-67.3	169.4	0	0	0	113.6	I270 L276 V280 A281 L314 I318 A362 C363 Q364 Y368	I270-L366 HydrophobicContact CG2-CD1 4Å; I270-L366 HydrophobicContact CG2-CD2 3.91Å; I270-L366 HydrophobicContact CG2-CG 3.71Å; L276-L366 HydrophobicContact CB-CD2 4.45Å; L276-L366 HydrophobicContact CD1-CD1 4.26Å; L276-L366 HydrophobicContact CD2-CD1 3.99Å; V280-L366 HydrophobicContact CG2-CD2 4.01Å; A281-L366 WeakPolarHBondContact CB-O 3.34Å; A281-L366 PolarHBondContact N-O 3.36Å; L314-L366 HydrophobicContact CD1-CD1 4Å; I318-L366 HydrophobicContact CD1-CD1 3.91Å; I318-L366 HydrophobicContact CG1-CD1 4.14Å; A362-L366 WeakPolarHBondContact O-CG 3.42Å; A362-L366 PolarHBondContact O-N 3.45Å; A362-L366 VanDerWaalsContact O-N 3.09Å; C363-L366 PolarHBondContact O-N 3.35Å; C363-L366 VanDerWaalsContact O-N 3.14Å; Q364-L366 VanDerWaalsContact C-N 3.31Å; Q364-L366 PolarHBondContact O-N 3.26Å; L366-Y368 HydrophobicContact CB-CD2 3.88Å; L366-Y368 HydrophobicContact CB-CE2 4.07Å
367	G	90	Very high	94.8	Very high	44 Å²	44	9.3 Å²	9.3	45%	0.454	6%	0.064	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.1	10.6	175.8	0	0	0	0	0	115.8	C363 Q364 L365	C363-G367 PolarHBondContact O-N 2.88Å; C363-G367 VanDerWaalsContact O-N 3.16Å; Q364-G367 PolarHBondContact O-N 2.96Å; L365-G367 VanDerWaalsContact C-N 3.34Å
368	Y	92.4	Very high	94.4	Very high	5 Å²	5	12.5 Å²	12.5	2%	0.02	8%	0.081	C	C	.	.			trans	-92.3	108	-176.6	-66.9	-88.7	0	0	0	111.9	F279 K308 A310 L314 C363 L366 R467	F279-Y368 WeakPolarHBondContact O-CE2 3.4Å; F279-Y368 PolarHBondContact O-OH 3.09Å; K308-Y368 HydrophobicContact CD-CE1 4.39Å; K308-Y368 WeakPolarHBondContact CD-OH 3.36Å; K308-Y368 WeakPolarHBondContact CE-OH 3.25Å; K308-Y368 HydrophobicContact CG-CE1 4.26Å; K308-Y368 PolarHBondContact NZ-OH 3.08Å; A310-Y368 HydrophobicContact CB-CD1 3.7Å; A310-Y368 HydrophobicContact CB-CE1 4.21Å; A310-Y368 HydrophobicContact CB-CG 4.23Å; L314-Y368 HydrophobicContact CD2-CD1 4.09Å; L314-Y368 HydrophobicContact CD2-CD2 3.61Å; L314-Y368 HydrophobicContact CD2-CE1 3.88Å; L314-Y368 HydrophobicContact CD2-CE2 3.4Å; L314-Y368 VanDerWaalsContact CD2-CE2 3.4Å; L314-Y368 HydrophobicContact CD2-CG 3.95Å; C363-Y368 PolarHBondContact O-N 3.22Å; L366-Y368 HydrophobicContact CB-CD2 3.88Å; L366-Y368 HydrophobicContact CB-CE2 4.07Å; Y368-R467 PolarHBondContact O-NH1 3.43Å; Y368-R467 PolarHBondContact O-NH2 3.44Å
369	S	89.4	Confident	94.1	Very high	60 Å²	60	13.7 Å²	13.7	42%	0.42	9%	0.086	S	C	.	.	S	Bend	trans	-88.1	-4.5	175.9	53.2	0	0	0	0	114	E73 R467	E73-S369 VanDerWaalsContact OE1-CB 3.32Å; E73-S369 WeakPolarHBondContact OE1-CB 3.44Å; S369-R467 PolarHBondContact O-NH2 3.41Å
370	D	92.8	Very high	93.9	Very high	14 Å²	14	13.7 Å²	13.7	8%	0.075	9%	0.086	C	C	.	.	S	Bend	trans	-96.4	-3.4	-177.6	67.6	-59.4	0	0	0	114.7	Y309 A310 G385 R390	Y309-D370 HydrophobicContact CD1-CB 3.74Å; Y309-D370 HydrophobicContact CE1-CB 4.25Å; A310-D370 WeakPolarHBondContact CB-OD2 3.48Å; A310-D370 PolarHBondContact N-OD1 3.2Å; A310-D370 PolarHBondContact N-OD2 3.05Å; D370-G385 WeakPolarHBondContact OD2-CA 3.46Å; D370-G385 PolarHBondContact OD2-N 3.32Å; D370-R390 PolarHBondContact O-NH1 3.16Å
371	V	95.5	Very high	93.8	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	9%	0.086	C	C	.	.			trans	-94	124.4	178	-172.4	0	0	0	0	110.3	A310 I315 V360 C363 V382 E383 F384 R467	A310-V371 HydrophobicContact CB-CG2 3.44Å; A310-V371 VanDerWaalsContact CB-CG2 3.44Å; I315-V371 HydrophobicContact CD1-CG1 4.34Å; V360-V371 HydrophobicContact CG2-CG1 4.26Å; C363-V371 HydrophobicContact CB-CB 3.84Å; C363-V371 HydrophobicContact CB-CG1 4.11Å; C363-V371 HydrophobicContact CB-CG2 3.81Å; V371-V382 HydrophobicContact CG1-CB 4.28Å; V371-E383 CarbonylContact C-O 3.28Å; V371-E383 VanDerWaalsContact CA-O 3.28Å; V371-E383 WeakPolarHBondContact CA-O 3.45Å; V371-F384 HydrophobicContact CB-CB 4.38Å; V371-F384 HydrophobicContact CG1-CB 4.31Å; V371-F384 HydrophobicContact CG2-CB 3.84Å; V371-R467 PolarHBondContact O-NH2 3.14Å
372	D	96.1	Very high	93.8	Very high	9 Å²	9	13.6 Å²	13.6	5%	0.048	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	151.3	-177.2	-54.8	-71.8	0	0	0	111.9	V382 E383 R390 V463 R465	D372-V382 WeakPolarHBondContact O-CA 3.42Å; D372-E383 PolarHBondContact N-O 3.28Å; D372-E383 PolarHBondContact O-N 3.02Å; D372-R390 IonicContact OD2-CZ 3.83Å; D372-R390 VanDerWaalsContact OD2-CZ 3.23Å; D372-R390 IonicContact OD2-NH1 3.95Å; D372-R390 PolarHBondContact OD2-NH1 2.76Å; D372-R390 IonicContact OD2-NH2 2.84Å; D372-R390 PolarHBondContact OD2-NH2 3.39Å; D372-V463 HydrophobicContact CB-CG1 3.83Å; D372-R465 HydrophobicContact CB-CG 4.1Å; D372-R465 WeakPolarHBondContact OD1-CG 3.32Å; D372-R465 WeakPolarHBondContact OD2-CD 3.32Å; D372-R465 WeakPolarHBondContact OD2-CG 3.41Å; D372-R465 IonicContact OD2-NE 2.72Å; D372-R465 PolarHBondContact OD2-NE 3.3Å
373	L	97.4	Very high	93.7	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	129.7	168.8	-177.3	63.3	0	0	0	108.9	F353 A356 Y357 V360 L375 C464 A470 A473	F353-L373 HydrophobicContact CE2-CD2 3.95Å; F353-L373 HydrophobicContact CZ-CD2 4.3Å; A356-L373 HydrophobicContact CB-CD1 3.66Å; Y357-L373 HydrophobicContact CD2-CD2 3.98Å; V360-L373 HydrophobicContact CG2-CB 4.14Å; L373-L375 HydrophobicContact CD1-CD2 4Å; L373-L375 HydrophobicContact CD2-CD1 4.34Å; L373-L375 HydrophobicContact CD2-CD2 4.1Å; L373-L375 HydrophobicContact CD2-CG 4.39Å; L373-L375 HydrophobicContact CG-CD2 3.87Å; L373-L375 HydrophobicContact CG-CG 4.12Å; L373-C464 HydrophobicContact CB-CB 4.17Å; L373-C464 WeakPolarHBondContact O-CB 3.41Å; L373-C464 PolarHBondContact O-N 2.8Å; L373-A470 HydrophobicContact CB-CB 4.49Å; L373-A470 HydrophobicContact CD2-CB 4.32Å; L373-A473 HydrophobicContact CD2-CB 4.26Å
374	A	96.3	Very high	93.7	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	136.9	172	0	0	0	0	0	109.4	G380 W381 E383 V463	A374-G380 WeakPolarHBondContact O-CA 3.37Å; A374-W381 HydrophobicContact CB-CD2 4.21Å; A374-W381 HydrophobicContact CB-CG 4.24Å; A374-W381 HydrophobicContact CB-CZ2 4.29Å; A374-W381 VanDerWaalsContact CB-NE1 3.34Å; A374-W381 PolarHBondContact N-O 3.12Å; A374-W381 PolarHBondContact O-N 3.28Å; A374-E383 HydrophobicContact CB-CG 4.16Å; A374-V463 HydrophobicContact CB-CG1 4.29Å; A374-V463 HydrophobicContact CB-CG2 4.02Å
375	L	95.4	Very high	93.6	Very high	6 Å²	6	13.9 Å²	13.9	3%	0.031	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	134.4	-172	-57.1	173.3	0	0	0	110	F353 L373 H379 P461 V462 A473 Y553	F353-L375 HydrophobicContact CD2-CD2 3.66Å; F353-L375 HydrophobicContact CE2-CD1 4.26Å; F353-L375 HydrophobicContact CE2-CD2 3.86Å; L373-L375 HydrophobicContact CD1-CD2 4Å; L373-L375 HydrophobicContact CD2-CD1 4.34Å; L373-L375 HydrophobicContact CD2-CD2 4.1Å; L373-L375 HydrophobicContact CD2-CG 4.39Å; L373-L375 HydrophobicContact CG-CD2 3.87Å; L373-L375 HydrophobicContact CG-CG 4.12Å; L375-H379 WeakPolarHBondContact CA-O 3.34Å; L375-P461 CarbonylContact O-C 3.53Å; L375-P461 VanDerWaalsContact O-CA 3.32Å; L375-P461 WeakPolarHBondContact O-CA 3.3Å; L375-P461 VanDerWaalsContact O-CB 3.25Å; L375-P461 WeakPolarHBondContact O-CB 3.47Å; L375-V462 HydrophobicContact CB-CB 4.46Å; L375-V462 PolarHBondContact N-O 3.37Å; L375-V462 PolarHBondContact O-N 2.92Å; L375-A473 HydrophobicContact CD1-CB 3.73Å; L375-Y553 HydrophobicContact CD1-CE2 4.32Å
376	S	93.7	Very high	93.6	Very high	3 Å²	3	14.9 Å²	14.9	2%	0.021	10%	0.095	C	C	.	.			trans	-91	-155.8	158.6	64.1	0	0	0	0	109.9	D378 H379 L455 L555	S376-D378 PolarHBondContact OG-N 3.03Å; S376-H379 PolarHBondContact N-O 2.99Å; S376-H379 WeakPolarHBondContact OG-CA 3.22Å; S376-H379 WeakPolarHBondContact OG-CB 3.49Å; S376-H379 PolarHBondContact OG-N 3.19Å; S376-H379 PolarHBondContact OG-O 2.68Å; S376-L455 WeakPolarHBondContact CB-O 3.49Å; S376-L455 PolarHBondContact OG-O 3.24Å; S376-L555 WeakPolarHBondContact O-CD1 3.25Å
377	E	93.1	Very high	93.3	Very high	16 Å²	16	18.1 Å²	18.1	8%	0.075	12%	0.117	C	C	.	.	S	Bend	trans	-82.1	-24.6	175.5	-67.6	-158.2	112.7	0	0	113.2	W454 L555 H661 V662 Y663	E377-W454 HydrophobicContact CB-CH2 4.28Å; E377-W454 HydrophobicContact CB-CZ2 3.5Å; E377-W454 PolarHBondContact OE2-NE1 3.4Å; E377-L555 HydrophobicContact CG-CD1 4.34Å; E377-L555 HydrophobicContact CG-CD2 4.26Å; E377-H661 WeakPolarHBondContact OE1-CB 3.05Å; E377-H661 IonicContact OE1-ND1 3.76Å; E377-V662 VanDerWaalsContact CD-N 3.27Å; E377-V662 PolarHBondContact OE1-N 3.45Å; E377-V662 PolarHBondContact OE2-N 3.45Å; E377-Y663 HydrophobicContact CB-CD2 3.63Å; E377-Y663 HydrophobicContact CB-CE2 3.71Å; E377-Y663 HydrophobicContact CG-CD2 4.03Å; E377-Y663 WeakPolarHBondContact O-CE2 3.43Å; E377-Y663 WeakPolarHBondContact OE1-CB 3.37Å; E377-Y663 PolarHBondContact OE1-N 3.16Å
378	D	89.2	Confident	93.1	Very high	67 Å²	67	24.2 Å²	24.2	36%	0.358	13%	0.133	S	C	.	.	S	Bend	trans	-128.8	-14.6	179.9	-169.8	47.3	0	0	0	114	S376 W454	S376-D378 PolarHBondContact OG-N 3.03Å; D378-W454 HydrophobicContact CB-CH2 3.73Å; D378-W454 HydrophobicContact CB-CZ3 3.76Å
379	H	91.8	Very high	92.9	Very high	26 Å²	26	26.5 Å²	26.5	12%	0.12	15%	0.15	C	C	.	.			trans	-128.8	159.6	-169.5	-163.7	33.5	0	0	0	113.8	L375 S376 W381 D394 L455 Y456	L375-H379 WeakPolarHBondContact CA-O 3.34Å; S376-H379 PolarHBondContact N-O 2.99Å; S376-H379 WeakPolarHBondContact OG-CA 3.22Å; S376-H379 WeakPolarHBondContact OG-CB 3.49Å; S376-H379 PolarHBondContact OG-N 3.19Å; S376-H379 PolarHBondContact OG-O 2.68Å; H379-W381 HydrophobicContact CB-CZ3 4.45Å; H379-D394 IonicContact CD2-OD2 3.85Å; H379-D394 IonicContact CE1-OD1 3.97Å; H379-D394 IonicContact CE1-OD2 3.14Å; H379-D394 VanDerWaalsContact NE2-CG 3.27Å; H379-D394 IonicContact NE2-OD1 2.7Å; H379-D394 PolarHBondContact NE2-OD1 3.12Å; H379-D394 IonicContact NE2-OD2 2.71Å; H379-D394 PolarHBondContact NE2-OD2 3.03Å; H379-L455 HydrophobicContact CB-CD1 3.91Å; H379-L455 HydrophobicContact CB-CG 4.09Å; H379-Y456 AromaticContact CD2-CE1 3.75Å
380	G	92.7	Very high	92.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	132.6	-177.1	0	0	0	0	0	113	A374	A374-G380 WeakPolarHBondContact O-CA 3.37Å
381	W	95.4	Very high	93	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	-178.7	-178.8	64.1	91.7	0	0	0	111.8	A374 H379 A393 D394 I445 Y456 P461	A374-W381 HydrophobicContact CB-CD2 4.21Å; A374-W381 HydrophobicContact CB-CG 4.24Å; A374-W381 HydrophobicContact CB-CZ2 4.29Å; A374-W381 VanDerWaalsContact CB-NE1 3.34Å; A374-W381 PolarHBondContact N-O 3.12Å; A374-W381 PolarHBondContact O-N 3.28Å; H379-W381 HydrophobicContact CB-CZ3 4.45Å; W381-A393 WeakPolarHBondContact CB-O 3Å; W381-D394 HydrophobicContact CB-CB 4.34Å; W381-I445 HydrophobicContact CD2-CG2 3.86Å; W381-I445 HydrophobicContact CG-CG2 3.86Å; W381-I445 HydrophobicContact CH2-CD1 4.47Å; W381-I445 HydrophobicContact CZ2-CD1 3.53Å; W381-I445 HydrophobicContact CZ2-CG2 4.41Å; W381-Y456 HydrophobicContact CE3-CD1 4.07Å; W381-Y456 HydrophobicContact CE3-CE1 4.1Å; W381-Y456 AromaticContact CH2-CD1 3.74Å; W381-Y456 HydrophobicContact CH2-CD1 3.74Å; W381-Y456 HydrophobicContact CZ2-CD1 4.25Å; W381-Y456 AromaticContact CZ3-CD1 3.64Å; W381-Y456 HydrophobicContact CZ3-CD1 3.64Å; W381-Y456 HydrophobicContact CZ3-CE1 4.1Å; W381-P461 HydrophobicContact CH2-CB 3.7Å; W381-P461 HydrophobicContact CH2-CG 4.44Å; W381-P461 HydrophobicContact CZ2-CB 3.46Å; W381-P461 VanDerWaalsContact CZ2-CB 3.46Å; W381-P461 HydrophobicContact CZ2-CG 3.77Å
382	V	96.6	Very high	92.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.8	177.3	-53.4	0	0	0	0	112.2	I315 A356 V359 V360 V371 D372 F384 T392 A393 V395	I315-V382 HydrophobicContact CD1-CG2 4.33Å; I315-V382 HydrophobicContact CG1-CG2 4.48Å; I315-V382 HydrophobicContact CG2-CG2 3.95Å; A356-V382 HydrophobicContact CB-CG1 4.39Å; V359-V382 HydrophobicContact CB-CG1 4.09Å; V359-V382 HydrophobicContact CG1-CG1 3.91Å; V359-V382 HydrophobicContact CG1-CG2 4.38Å; V360-V382 HydrophobicContact CG2-CB 4.44Å; V360-V382 HydrophobicContact CG2-CG1 3.71Å; V371-V382 HydrophobicContact CG1-CB 4.28Å; D372-V382 WeakPolarHBondContact O-CA 3.42Å; V382-F384 HydrophobicContact CG2-CD1 4.27Å; V382-T392 WeakPolarHBondContact O-CA 3.26Å; V382-A393 HydrophobicContact CG2-CB 4.03Å; V382-A393 PolarHBondContact N-O 2.86Å; V382-A393 VanDerWaalsContact N-O 3.1Å; V382-A393 PolarHBondContact O-N 2.96Å; V382-V395 HydrophobicContact CG2-CG1 3.97Å
383	E	95.4	Very high	92.8	Very high	17 Å²	17	27.3 Å²	27.3	8%	0.079	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	147	163.5	-77.5	-167.4	170.5	0	0	110.5	V371 D372 A374 R390 Q391 T392 R465	V371-E383 CarbonylContact C-O 3.28Å; V371-E383 VanDerWaalsContact CA-O 3.28Å; V371-E383 WeakPolarHBondContact CA-O 3.45Å; D372-E383 PolarHBondContact N-O 3.28Å; D372-E383 PolarHBondContact O-N 3.02Å; A374-E383 HydrophobicContact CB-CG 4.16Å; E383-R390 IonicContact OE2-CZ 3.6Å; E383-R390 IonicContact OE2-NE 2.63Å; E383-R390 PolarHBondContact OE2-NE 3.12Å; E383-R390 VanDerWaalsContact OE2-NE 3.14Å; E383-R390 IonicContact OE2-NH2 2.7Å; E383-R390 PolarHBondContact OE2-NH2 3.47Å; E383-Q391 CarbonylContact C-O 3.59Å; E383-Q391 VanDerWaalsContact CA-O 3.24Å; E383-Q391 WeakPolarHBondContact CA-O 3.27Å; E383-T392 HydrophobicContact CG-CG2 3.84Å; E383-R465 IonicContact OE2-CZ 3.95Å; E383-R465 IonicContact OE2-NE 3.97Å; E383-R465 IonicContact OE2-NH2 2.93Å; E383-R465 PolarHBondContact OE2-NH2 2.86Å
384	F	95.2	Very high	92.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	174.7	-178.1	60.2	-85.5	0	0	0	112.6	A310 R312 I315 V371 V382 Q391 A393	A310-F384 HydrophobicContact CB-CB 4.09Å; A310-F384 HydrophobicContact CB-CD2 4.48Å; R312-F384 HydrophobicContact CB-CE2 4.26Å; R312-F384 HydrophobicContact CB-CZ 3.97Å; R312-F384 HydrophobicContact CG-CZ 4.39Å; R312-F384 VanDerWaalsContact N-CE2 3.32Å; I315-F384 HydrophobicContact CD1-CD1 4.29Å; I315-F384 HydrophobicContact CD1-CG 4.42Å; I315-F384 HydrophobicContact CG1-CD1 3.84Å; I315-F384 HydrophobicContact CG1-CD2 4.48Å; I315-F384 HydrophobicContact CG1-CE1 3.88Å; I315-F384 HydrophobicContact CG1-CG 4.17Å; I315-F384 HydrophobicContact CG1-CZ 4.21Å; V371-F384 HydrophobicContact CB-CB 4.38Å; V371-F384 HydrophobicContact CG1-CB 4.31Å; V371-F384 HydrophobicContact CG2-CB 3.84Å; V382-F384 HydrophobicContact CG2-CD1 4.27Å; F384-Q391 HydrophobicContact CD1-CB 4.43Å; F384-Q391 HydrophobicContact CD2-CB 4.07Å; F384-Q391 HydrophobicContact CE1-CB 3.96Å; F384-Q391 HydrophobicContact CE2-CB 3.55Å; F384-Q391 HydrophobicContact CE2-CG 4.16Å; F384-Q391 HydrophobicContact CG-CB 4.48Å; F384-Q391 HydrophobicContact CZ-CB 3.5Å; F384-Q391 VanDerWaalsContact CZ-CB 3.5Å; F384-Q391 HydrophobicContact CZ-CG 4.42Å; F384-Q391 PolarHBondContact N-O 2.99Å; F384-Q391 PolarHBondContact O-N 3.04Å; F384-A393 HydrophobicContact CE1-CB 3.7Å; F384-A393 HydrophobicContact CZ-CB 4.49Å
385	G	93	Very high	92.3	Very high	2 Å²	2	27.3 Å²	27.3	2%	0.021	15%	0.145	C	C	.	.	S	Bend	trans	93.4	-178.1	176.7	0	0	0	0	0	113.4	D370	D370-G385 WeakPolarHBondContact OD2-CA 3.46Å; D370-G385 PolarHBondContact OD2-N 3.32Å
386	P	90.5	Very high	91.8	Very high	38 Å²	38	28.5 Å²	28.5	25%	0.247	16%	0.157	C	C	.	.			trans	-65.1	152	-178.1	30	-36.7	0	0	0	111.6	Y309 E388 S389 R390	Y309-P386 HydrophobicContact CD1-CB 4.27Å; Y309-P386 HydrophobicContact CD2-CB 3.99Å; Y309-P386 HydrophobicContact CE1-CB 4.23Å; Y309-P386 HydrophobicContact CE2-CB 3.93Å; Y309-P386 HydrophobicContact CG-CB 4.17Å; P386-E388 PolarHBondContact O-N 3.46Å; P386-E388 VanDerWaalsContact O-N 3.16Å; P386-S389 WeakPolarHBondContact CG-OG 3.43Å; P386-S389 CarbonylContact O-C 3.24Å; P386-S389 VanDerWaalsContact O-C 3.28Å; P386-S389 PolarHBondContact O-N 2.93Å; P386-R390 PolarHBondContact O-N 3.3Å
387	P	86.8	Confident	91.3	Very high	73 Å²	73	31.2 Å²	31.2	47%	0.474	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-54.2	-36.4	177.5	-26.2	35	0	0	0	113.4	S389	P387-S389 VanDerWaalsContact C-N 3.33Å; P387-S389 PolarHBondContact O-N 2.97Å
388	E	87.1	Confident	90.4	Very high	171 Å²	171	31.1 Å²	31.1	80%	0.799	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-76.3	-7.3	179.4	-63.9	176.2	-156.7	0	0	115.1	P386 S825	P386-E388 PolarHBondContact O-N 3.46Å; P386-E388 VanDerWaalsContact O-N 3.16Å; E388-S825 WeakPolarHBondContact O-CB 3.49Å
389	S	87.2	Confident	89.1	Confident	53 Å²	53	33.2 Å²	33.2	37%	0.371	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-155.8	64.5	169.4	43.6	0	0	0	0	111.8	P386 P387 Q391 S825	P386-S389 WeakPolarHBondContact CG-OG 3.43Å; P386-S389 CarbonylContact O-C 3.24Å; P386-S389 VanDerWaalsContact O-C 3.28Å; P386-S389 PolarHBondContact O-N 2.93Å; P387-S389 VanDerWaalsContact C-N 3.33Å; P387-S389 PolarHBondContact O-N 2.97Å; S389-Q391 PolarHBondContact O-N 3.42Å; S389-S825 WeakPolarHBondContact CA-OG 3.4Å
390	R	90.7	Very high	87.3	Confident	22 Å²	22	35 Å²	35	8%	0.083	20%	0.198	C	C	.	.			trans	-58.5	126.6	175.6	-72.2	-73.5	-74.6	-158.2	-6.6	110.7	D370 D372 E383 P386 S825	D370-R390 PolarHBondContact O-NH1 3.16Å; D372-R390 IonicContact OD2-CZ 3.83Å; D372-R390 VanDerWaalsContact OD2-CZ 3.23Å; D372-R390 IonicContact OD2-NH1 3.95Å; D372-R390 PolarHBondContact OD2-NH1 2.76Å; D372-R390 IonicContact OD2-NH2 2.84Å; D372-R390 PolarHBondContact OD2-NH2 3.39Å; E383-R390 IonicContact OE2-CZ 3.6Å; E383-R390 IonicContact OE2-NE 2.63Å; E383-R390 PolarHBondContact OE2-NE 3.12Å; E383-R390 VanDerWaalsContact OE2-NE 3.14Å; E383-R390 IonicContact OE2-NH2 2.7Å; E383-R390 PolarHBondContact OE2-NH2 3.47Å; P386-R390 PolarHBondContact O-N 3.3Å; R390-S825 PolarHBondContact N-OG 3.27Å
391	Q	93	Very high	84.8	Confident	75 Å²	75	43.6 Å²	43.6	35%	0.35	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	148	174.2	-64.2	-170.3	36.2	0	0	110.6	E383 F384 S389	E383-Q391 CarbonylContact C-O 3.59Å; E383-Q391 VanDerWaalsContact CA-O 3.24Å; E383-Q391 WeakPolarHBondContact CA-O 3.27Å; F384-Q391 HydrophobicContact CD1-CB 4.43Å; F384-Q391 HydrophobicContact CD2-CB 4.07Å; F384-Q391 HydrophobicContact CE1-CB 3.96Å; F384-Q391 HydrophobicContact CE2-CB 3.55Å; F384-Q391 HydrophobicContact CE2-CG 4.16Å; F384-Q391 HydrophobicContact CG-CB 4.48Å; F384-Q391 HydrophobicContact CZ-CB 3.5Å; F384-Q391 VanDerWaalsContact CZ-CB 3.5Å; F384-Q391 HydrophobicContact CZ-CG 4.42Å; F384-Q391 PolarHBondContact N-O 2.99Å; F384-Q391 PolarHBondContact O-N 3.04Å; S389-Q391 PolarHBondContact O-N 3.42Å
392	T	93.9	Very high	81.8	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.018	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	141.5	171.7	46.5	0	0	0	0	109.9	R312 V382 E383 S444 I445	R312-T392 VanDerWaalsContact CZ-O 3.3Å; R312-T392 PolarHBondContact NH1-O 3.46Å; R312-T392 PolarHBondContact NH2-O 3.38Å; V382-T392 WeakPolarHBondContact O-CA 3.26Å; E383-T392 HydrophobicContact CG-CG2 3.84Å; T392-S444 PolarHBondContact OG1-OG 3.49Å; T392-I445 HydrophobicContact CG2-CD1 3.76Å; T392-I445 HydrophobicContact CG2-CG1 3.98Å
393	A	93.7	Very high	78.8	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	112.8	165.1	0	0	0	0	0	108.6	I315 W381 V382 F384 V395 P442 P443	I315-A393 HydrophobicContact CG2-CB 4.1Å; W381-A393 WeakPolarHBondContact CB-O 3Å; V382-A393 HydrophobicContact CG2-CB 4.03Å; V382-A393 PolarHBondContact N-O 2.86Å; V382-A393 VanDerWaalsContact N-O 3.1Å; V382-A393 PolarHBondContact O-N 2.96Å; F384-A393 HydrophobicContact CE1-CB 3.7Å; F384-A393 HydrophobicContact CZ-CB 4.49Å; A393-V395 HydrophobicContact CB-CG1 4.44Å; A393-V395 PolarHBondContact O-N 3.44Å; A393-P442 HydrophobicContact CB-CB 4.14Å; A393-P442 HydrophobicContact CB-CG 4.03Å; A393-P443 CarbonylContact C-O 3.34Å; A393-P443 WeakPolarHBondContact CA-O 3.42Å
394	D	92.5	Very high	75.7	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	33%	0.329	C	S	.	.			trans	-70.5	111.4	159.9	179.9	0.9	0	0	0	107.5	H379 W381 A396 S397 P442 P443 I445 Y456	H379-D394 IonicContact CD2-OD2 3.85Å; H379-D394 IonicContact CE1-OD1 3.97Å; H379-D394 IonicContact CE1-OD2 3.14Å; H379-D394 VanDerWaalsContact NE2-CG 3.27Å; H379-D394 IonicContact NE2-OD1 2.7Å; H379-D394 PolarHBondContact NE2-OD1 3.12Å; H379-D394 IonicContact NE2-OD2 2.71Å; H379-D394 PolarHBondContact NE2-OD2 3.03Å; W381-D394 HydrophobicContact CB-CB 4.34Å; D394-A396 PolarHBondContact OD1-N 3.48Å; D394-S397 PolarHBondContact OD1-N 2.96Å; D394-S397 VanDerWaalsContact OD1-N 3.16Å; D394-S397 WeakPolarHBondContact OD2-CB 3.23Å; D394-S397 PolarHBondContact OD2-OG 2.91Å; D394-P442 VanDerWaalsContact O-CB 3.23Å; D394-P442 WeakPolarHBondContact O-CB 3.45Å; D394-P443 HydrophobicContact CB-CG 4.38Å; D394-P443 PolarHBondContact N-O 3.32Å; D394-P443 WeakPolarHBondContact O-CD 3.33Å; D394-I445 HydrophobicContact CB-CG2 4.41Å; D394-Y456 PolarHBondContact OD2-OH 3.19Å
395	V	92.1	Very high	72.6	Confident	0 Å²	0	64 Å²	64	0%	0	36%	0.358	C	S	.	.	S	Bend	trans	-88.3	-14.6	-179.4	-66.6	0	0	0	0	112.2	I315 W323 L355 A356 V359 V382 A393	I315-V395 HydrophobicContact CG2-CG1 3.68Å; W323-V395 VanDerWaalsContact CH2-O 3.25Å; W323-V395 WeakPolarHBondContact CH2-O 3.21Å; L355-V395 HydrophobicContact CD2-CB 4.41Å; L355-V395 HydrophobicContact CD2-CG2 4.16Å; L355-V395 VanDerWaalsContact CD2-O 3.32Å; L355-V395 WeakPolarHBondContact CD2-O 3.42Å; L355-V395 HydrophobicContact CG-CG2 4.01Å; A356-V395 HydrophobicContact CB-CG2 4.12Å; V359-V395 HydrophobicContact CG2-CB 4.49Å; V359-V395 HydrophobicContact CG2-CG1 4.36Å; V359-V395 HydrophobicContact CG2-CG2 4.33Å; V382-V395 HydrophobicContact CG2-CG1 3.97Å; A393-V395 HydrophobicContact CB-CG1 4.44Å; A393-V395 PolarHBondContact O-N 3.44Å
396	A	85	Confident	69.5	Low	32 Å²	32	68.6 Å²	68.6	26%	0.264	40%	0.396	S	S	.	.	S	Bend	trans	-97	-30.8	-171.9	0	0	0	0	0	113.3	L355 D394 W398	L355-A396 HydrophobicContact CD2-CB 4.13Å; D394-A396 PolarHBondContact OD1-N 3.48Å; A396-W398 PolarHBondContact O-N 2.67Å
397	S	81.7	Confident	66.6	Low	60 Å²	60	71.8 Å²	71.8	42%	0.42	42%	0.42	S	S	.	.	S	Bend	trans	-77.9	-2.6	166	60.4	0	0	0	0	113.9	D394 V399 P443	D394-S397 PolarHBondContact OD1-N 2.96Å; D394-S397 VanDerWaalsContact OD1-N 3.16Å; D394-S397 WeakPolarHBondContact OD2-CB 3.23Å; D394-S397 PolarHBondContact OD2-OG 2.91Å; S397-V399 PolarHBondContact O-N 3.07Å; S397-P443 VanDerWaalsContact OG-CG 3.32Å; S397-P443 WeakPolarHBondContact OG-CG 3.34Å
398	W	75	Confident	63.9	Low	14 Å²	14	73 Å²	73	5%	0.053	43%	0.429	C	S	.	.			trans	-76.7	110	-179.2	-174.3	55.9	0	0	0	112.6	C319 E320 W323 A396 H440 N441 P442	C319-W398 HydrophobicContact CB-CE3 3.64Å; C319-W398 HydrophobicContact CB-CH2 4.29Å; C319-W398 HydrophobicContact CB-CZ3 3.34Å; E320-W398 HydrophobicContact CG-CH2 3.84Å; W323-W398 HydrophobicContact CE3-CE3 4.36Å; W323-W398 HydrophobicContact CE3-CZ3 4.41Å; W323-W398 HydrophobicContact CH2-CE3 4.44Å; W323-W398 WeakPolarHBondContact CZ2-O 3.35Å; W323-W398 HydrophobicContact CZ3-CE3 4.14Å; A396-W398 PolarHBondContact O-N 2.67Å; W398-H440 WeakPolarHBondContact CZ2-O 3.2Å; W398-H440 PolarHBondContact NE1-O 2.85Å; W398-N441 VanDerWaalsContact NE1-C 3.28Å; W398-P442 HydrophobicContact CB-CB 3.93Å; W398-P442 VanDerWaalsContact CD1-CA 3.41Å; W398-P442 VanDerWaalsContact CD1-N 3.31Å; W398-P442 HydrophobicContact CD2-CB 4.41Å; W398-P442 HydrophobicContact CG-CB 3.88Å
399	V	61.1	Low	61.1	Low	111 Å²	111	73.3 Å²	73.3	67%	0.673	43%	0.431	S	S	*	.			trans	-100.7	118.5	175.4	-178.9	0	0	0	0	110.2	S397 E401	S397-V399 PolarHBondContact O-N 3.07Å; V399-E401 HydrophobicContact CG1-CG 4.29Å; V399-E401 PolarHBondContact O-N 2.88Å
400	Q	54.1	Low	58.5	Low	64 Å²	64	78.4 Å²	78.4	30%	0.299	45%	0.454	S	S	.	.			trans	-82.5	92.2	172.6	-179.7	161.7	61.4	0	0	110.8	E320 S402	E320-Q400 PolarHBondContact OE1-NE2 3.43Å; Q400-S402 WeakPolarHBondContact CG-OG 3.31Å; Q400-S402 PolarHBondContact O-N 3.11Å
401	E	41.5	Very low	55.8	Low	179 Å²	179	82.8 Å²	82.8	84%	0.836	49%	0.488	S	S	*	.			trans	-69.8	55.7	178.3	-64.4	-161.3	140.2	0	0	114.4	V399	V399-E401 HydrophobicContact CG1-CG 4.29Å; V399-E401 PolarHBondContact O-N 2.88Å
402	S	31.8	Very low	53.1	Low	58 Å²	58	86.4 Å²	86.4	41%	0.406	51%	0.505	S	S	.	.			trans	-139.7	32.9	-172.9	77.6	0	0	0	0	116.6	Q400	Q400-S402 WeakPolarHBondContact CG-OG 3.31Å; Q400-S402 PolarHBondContact O-N 3.11Å
403	H	34.5	Very low	49.9	Very low	166 Å²	166	96.3 Å²	96.3	77%	0.769	55%	0.548	S	S	*	.	S	Bend	trans	-131	-2.4	177.8	-79	-22.3	0	0	0	117.5
404	T	30.4	Very low	47.1	Very low	134 Å²	134	101.7 Å²	101.7	82%	0.822	59%	0.586	S	S	*	*	S	Bend	trans	-99.6	-23.3	177.7	44.5	0	0	0	0	114.6	A406	T404-A406 VanDerWaalsContact C-N 3.29Å; T404-A406 PolarHBondContact O-N 3.15Å
405	S	28.3	Very low	44.1	Very low	87 Å²	87	108.3 Å²	108.3	61%	0.608	62%	0.621	S	S	*	*	S	Bend	trans	-81.8	6.6	-174.3	45.4	0	0	0	0	115.6	S407	S405-S407 PolarHBondContact O-N 3.45Å
406	A	29.4	Very low	41.4	Very low	100 Å²	100	118.3 Å²	118.3	83%	0.826	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	9.8	-169.3	0	0	0	0	0	116.3	T404	T404-A406 VanDerWaalsContact C-N 3.29Å; T404-A406 PolarHBondContact O-N 3.15Å
407	S	29.1	Very low	38.9	Very low	105 Å²	105	124.1 Å²	124.1	73%	0.734	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	-3.8	-177.4	55	0	0	0	0	115.4	S405	S405-S407 PolarHBondContact O-N 3.45Å
408	S	29.2	Very low	36.6	Very low	97 Å²	97	127.9 Å²	127.9	68%	0.678	70%	0.702	S	S	*	*			trans	-115.6	36.8	-159.5	-56.3	0	0	0	0	115.7
409	H	30	Very low	34.6	Very low	178 Å²	178	133.6 Å²	133.6	82%	0.824	73%	0.733	S	S	*	*			trans	-131.9	97.8	175.3	-79.4	-52.6	0	0	0	113.4
410	N	32.2	Very low	33.2	Very low	161 Å²	161	132.8 Å²	132.8	86%	0.861	73%	0.733	S	S	*	*			trans	-161.6	114.1	157.1	-98.6	-44	0	0	0	111.6
411	S	33.1	Very low	32.3	Very low	114 Å²	114	136.5 Å²	136.5	80%	0.797	76%	0.759	S	S	*	*			trans	60.2	150.7	168.3	64.5	0	0	0	0	119
412	E	35.7	Very low	31.8	Very low	151 Å²	151	136.3 Å²	136.3	71%	0.706	76%	0.758	S	S	*	*			cis	-150.4	149.6	-25.7	-109.3	-164.9	144.9	0	0	108.1	K133	K133-E412 WeakPolarHBondContact CE-OE1 3.4Å; K133-E412 IonicContact NZ-OE1 3.67Å; K133-E412 PolarHBondContact NZ-OE1 3.06Å; K133-E412 IonicContact NZ-OE2 3.39Å; K133-E412 PolarHBondContact NZ-OE2 3.45Å
413	F	27.8	Very low	32	Very low	210 Å²	210	143 Å²	143	92%	0.921	78%	0.783	S	S	*	*			trans	-84.8	129	177.2	-100.3	-100.2	0	0	0	111.9
414	S	34	Very low	31.7	Very low	114 Å²	114	140.1 Å²	140.1	80%	0.797	78%	0.777	S	S	*	*			trans	-166.4	120.6	142.6	59.6	0	0	0	0	114
415	N	30.7	Very low	31.7	Very low	140 Å²	140	142.6 Å²	142.6	75%	0.749	78%	0.78	S	S	*	*			trans	-26.1	148.2	167.7	-42.3	-20.9	0	0	0	118.1
416	F	33.8	Very low	31.8	Very low	210 Å²	210	146.1 Å²	146.1	92%	0.921	79%	0.786	S	S	*	*				-161.2	150.1	114.9	-109.7	-71.9	0	0	0	113
417	H	33.5	Very low	31.9	Very low	154 Å²	154	146.8 Å²	146.8	71%	0.713	79%	0.785	S	S	*	*			trans	-66.2	161.4	161.4	-83.6	-95.6	0	0	0	110.6
418	D	33.2	Very low	31.9	Very low	139 Å²	139	153.2 Å²	153.2	74%	0.743	79%	0.793	S	S	*	*			cis	-146.9	-169.6	-1.2	-104.3	-31.7	0	0	0	106.5
419	D	33.4	Very low	31.9	Very low	134 Å²	134	154.3 Å²	154.3	72%	0.717	80%	0.796	S	S	*	*			cis	-157.3	169.1	21	-166.1	1.6	0	0	0	110.9
420	S	31.1	Very low	31.8	Very low	94 Å²	94	157.5 Å²	157.5	66%	0.657	80%	0.801	S	S	*	*			trans	20.1	120	150.1	-65.7	0	0	0	0	120.9
421	V	36	Very low	31.6	Very low	142 Å²	142	159.4 Å²	159.4	86%	0.861	80%	0.801	S	S	*	*				-162.3	148.5	93.9	145.3	0	0	0	0	109.9
422	Q	30.9	Very low	31.5	Very low	174 Å²	174	157.9 Å²	157.9	81%	0.813	80%	0.796	S	S	*	*			trans	-90.1	139.7	-179.3	-62.3	165.3	-22.3	0	0	111.9
423	Q	35.3	Very low	31.1	Very low	199 Å²	199	157 Å²	157	93%	0.93	81%	0.806	S	S	*	*				-154	162.8	128.6	-113	165	15.3	0	0	110.9
424	T	29.3	Very low	31.3	Very low	105 Å²	105	151.7 Å²	151.7	64%	0.644	80%	0.795	S	S	*	*			trans	-127.8	128.3	-150.9	-52	0	0	0	0	111.3
425	E	30.8	Very low	31.2	Very low	187 Å²	187	149.9 Å²	149.9	87%	0.874	78%	0.783	S	S	*	*			trans	-151.3	161	157.3	-125.3	158.1	-134.4	0	0	113.7
426	H	29.5	Very low	31.8	Very low	161 Å²	161	148.9 Å²	148.9	75%	0.745	78%	0.781	S	S	*	*			trans	-108.5	74.1	-146.8	-74.2	-44.4	0	0	0	116.2	R428	H426-R428 PolarHBondContact O-N 3.06Å
427	S	30.5	Very low	32.2	Very low	114 Å²	114	146.3 Å²	146.3	80%	0.797	77%	0.773	S	S	*	*			trans	-70.8	89.8	165	-69.1	0	0	0	0	112.1	T429	S427-T429 VanDerWaalsContact C-N 3.31Å; S427-T429 PolarHBondContact O-N 2.82Å
428	R	29.3	Very low	33.3	Very low	239 Å²	239	143.9 Å²	143.9	90%	0.902	77%	0.765	S	S	*	*			trans	-69.3	79.2	174.6	-84.7	-176.6	167.4	168.6	-1.7	112.2	H426 R430	H426-R428 PolarHBondContact O-N 3.06Å; R428-R430 PolarHBondContact O-N 2.99Å
429	T	29.2	Very low	34.3	Very low	121 Å²	121	145.2 Å²	145.2	74%	0.742	77%	0.766	S	S	*	*			trans	-66.7	97.6	166.1	43.6	0	0	0	0	110.4	S427 K431	S427-T429 VanDerWaalsContact C-N 3.31Å; S427-T429 PolarHBondContact O-N 2.82Å; T429-K431 VanDerWaalsContact C-N 3.25Å; T429-K431 PolarHBondContact O-N 3.45Å
430	R	29.5	Very low	35.7	Very low	245 Å²	245	145.5 Å²	145.5	93%	0.925	76%	0.763	S	S	*	*			trans	-71	84	165.9	-81.3	-171.5	174.3	176.7	0.3	109.4	R428 A432	R428-R430 PolarHBondContact O-N 2.99Å; R430-A432 VanDerWaalsContact C-N 3.27Å; R430-A432 PolarHBondContact O-N 3.32Å
431	K	27.2	Very low	37.9	Very low	200 Å²	200	143.4 Å²	143.4	87%	0.87	74%	0.744	S	S	*	*			trans	-63.5	90.4	160.7	-80.5	-169.9	171.4	-173.9	0	109.2	T429	T429-K431 VanDerWaalsContact C-N 3.25Å; T429-K431 PolarHBondContact O-N 3.45Å
432	A	30.8	Very low	39.9	Very low	83 Å²	83	136.7 Å²	136.7	69%	0.686	70%	0.704	S	S	*	*			trans	-74.5	117.9	159.6	0	0	0	0	0	107.7	R430 S434	R430-A432 VanDerWaalsContact C-N 3.27Å; R430-A432 PolarHBondContact O-N 3.32Å; A432-S434 PolarHBondContact O-N 2.89Å; A432-S434 VanDerWaalsContact O-N 3.1Å
433	S	27.6	Very low	42.2	Very low	131 Å²	131	130.2 Å²	130.2	92%	0.916	68%	0.677	S	S	*	*			trans	-77.2	94.4	176.1	53.8	0	0	0	0	109.7
434	S	30.9	Very low	44.5	Very low	99 Å²	99	122.7 Å²	122.7	69%	0.692	65%	0.647	S	S	*	*			trans	-121.8	163.5	169.9	49.6	0	0	0	0	110.1	A432 T436	A432-S434 PolarHBondContact O-N 2.89Å; A432-S434 VanDerWaalsContact O-N 3.1Å; S434-T436 PolarHBondContact O-N 3.1Å
435	S	32.6	Very low	47	Very low	77 Å²	77	117.9 Å²	117.9	54%	0.538	62%	0.617	S	S	.	*			trans	-60.8	124.3	-170.1	26.8	0	0	0	0	113.2	E437 D438	S435-E437 PolarHBondContact O-N 3.45Å; S435-D438 PolarHBondContact OG-OD2 3.38Å
436	T	42.6	Very low	48.9	Very low	118 Å²	118	114.1 Å²	114.1	72%	0.724	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	13	178.5	53.5	0	0	0	0	114.4	S434	S434-T436 PolarHBondContact O-N 3.1Å
437	E	43.9	Very low	50.9	Low	157 Å²	157	110.3 Å²	110.3	73%	0.734	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	-22.2	178.1	-60.7	-147.6	146.7	0	0	113.1	S435 N441	S435-E437 PolarHBondContact O-N 3.45Å; E437-N441 PolarHBondContact O-ND2 2.94Å
438	D	54.9	Low	52.8	Low	103 Å²	103	109.3 Å²	109.3	55%	0.551	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-75.6	-32.2	-177.5	-66.6	-67.1	0	0	0	112.7	S435 H440 N441	S435-D438 PolarHBondContact OG-OD2 3.38Å; D438-H440 PolarHBondContact O-N 2.94Å; D438-N441 PolarHBondContact O-N 3.43Å
439	E	56.1	Low	54.9	Low	166 Å²	166	101.5 Å²	101.5	78%	0.776	55%	0.55	S	S	*	*	G	3₁₀ helix	trans	-61.1	-16.1	-174.3	-161.4	166.3	-127.7	0	0	114.3
440	H	62.6	Low	57.4	Low	141 Å²	141	97.6 Å²	97.6	65%	0.653	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-104.7	-1.1	-179.9	-70.1	53.4	0	0	0	113.8	W398 D438	W398-H440 WeakPolarHBondContact CZ2-O 3.2Å; W398-H440 PolarHBondContact NE1-O 2.85Å; D438-H440 PolarHBondContact O-N 2.94Å
441	N	77.4	Confident	59.8	Low	49 Å²	49	90 Å²	90	26%	0.262	50%	0.499	S	S	.	.	S	Bend	trans	-101.7	155.5	-175.5	-70.3	-55.5	0	0	0	112.1	R312 C316 W398 E437 D438	R312-N441 HydrophobicContact CG-CB 4.45Å; C316-N441 PolarHBondContact SG-OD1 3.1Å; W398-N441 VanDerWaalsContact NE1-C 3.28Å; E437-N441 PolarHBondContact O-ND2 2.94Å; D438-N441 PolarHBondContact O-N 3.43Å
442	P	77.2	Confident	62.8	Low	1 Å²	1	85 Å²	85	1%	0.006	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-61.2	128.1	171.5	25.5	-32.2	0	0	0	109.4	R312 I315 C316 A393 D394 W398	R312-P442 PolarHBondContact NH1-O 3.42Å; I315-P442 HydrophobicContact CG2-CG 4.33Å; C316-P442 WeakPolarHBondContact SG-CD 3.19Å; A393-P442 HydrophobicContact CB-CB 4.14Å; A393-P442 HydrophobicContact CB-CG 4.03Å; D394-P442 VanDerWaalsContact O-CB 3.23Å; D394-P442 WeakPolarHBondContact O-CB 3.45Å; W398-P442 HydrophobicContact CB-CB 3.93Å; W398-P442 VanDerWaalsContact CD1-CA 3.41Å; W398-P442 VanDerWaalsContact CD1-N 3.31Å; W398-P442 HydrophobicContact CD2-CB 4.41Å; W398-P442 HydrophobicContact CG-CB 3.88Å
443	P	79.6	Confident	65.8	Low	38 Å²	38	81 Å²	81	25%	0.247	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-64.6	159.6	-169.6	21.6	-31.9	0	0	0	113.6	A393 D394 S397 I447	A393-P443 CarbonylContact C-O 3.34Å; A393-P443 WeakPolarHBondContact CA-O 3.42Å; D394-P443 HydrophobicContact CB-CG 4.38Å; D394-P443 PolarHBondContact N-O 3.32Å; D394-P443 WeakPolarHBondContact O-CD 3.33Å; S397-P443 VanDerWaalsContact OG-CG 3.32Å; S397-P443 WeakPolarHBondContact OG-CG 3.34Å; P443-I447 HydrophobicContact CB-CD1 3.62Å
444	S	83.2	Confident	69	Low	42 Å²	42	74.8 Å²	74.8	29%	0.294	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-76.4	143.8	163.6	175.3	0	0	0	0	109.2	T392 R446 I447	T392-S444 PolarHBondContact OG1-OG 3.49Å; S444-R446 PolarHBondContact O-N 2.93Å; S444-R446 PolarHBondContact OG-N 3.19Å; S444-I447 WeakPolarHBondContact O-CD1 3.09Å; S444-I447 VanDerWaalsContact O-CG1 3.25Å; S444-I447 WeakPolarHBondContact O-CG1 3.16Å
445	I	81.3	Confident	71.9	Confident	4 Å²	4	71 Å²	71	2%	0.021	37%	0.374	C	S	.	.	S	Bend	trans	-64.3	-28.8	174	70.8	179	0	0	0	112.7	W381 T392 D394 I447 Y456	W381-I445 HydrophobicContact CD2-CG2 3.86Å; W381-I445 HydrophobicContact CG-CG2 3.86Å; W381-I445 HydrophobicContact CH2-CD1 4.47Å; W381-I445 HydrophobicContact CZ2-CD1 3.53Å; W381-I445 HydrophobicContact CZ2-CG2 4.41Å; T392-I445 HydrophobicContact CG2-CD1 3.76Å; T392-I445 HydrophobicContact CG2-CG1 3.98Å; D394-I445 HydrophobicContact CB-CG2 4.41Å; I445-I447 VanDerWaalsContact C-N 3.28Å; I445-I447 PolarHBondContact O-N 3.32Å; I445-Y456 HydrophobicContact CB-CD1 3.56Å; I445-Y456 HydrophobicContact CB-CE1 3.6Å; I445-Y456 HydrophobicContact CB-CG 4.09Å; I445-Y456 HydrophobicContact CD1-CD1 4.44Å; I445-Y456 HydrophobicContact CG1-CD1 4.49Å; I445-Y456 HydrophobicContact CG2-CD1 3.7Å; I445-Y456 HydrophobicContact CG2-CE1 3.41Å; I445-Y456 VanDerWaalsContact CG2-CE1 3.41Å
446	R	70.1	Confident	74.8	Confident	108 Å²	108	68 Å²	68	41%	0.408	35%	0.351	S	S	.	.			trans	-85.2	70.8	178.9	-77.3	-177	-79.9	-98.5	0.2	110.1	S444	S444-R446 PolarHBondContact O-N 2.93Å; S444-R446 PolarHBondContact OG-N 3.19Å
447	I	71.4	Confident	77.3	Confident	80 Å²	80	62.4 Å²	62.4	41%	0.41	32%	0.317	S	S	.	.			trans	-119.5	112.9	171.3	-69.5	170.5	0	0	0	107.7	P443 S444 I445 L450	P443-I447 HydrophobicContact CB-CD1 3.62Å; S444-I447 WeakPolarHBondContact O-CD1 3.09Å; S444-I447 VanDerWaalsContact O-CG1 3.25Å; S444-I447 WeakPolarHBondContact O-CG1 3.16Å; I445-I447 VanDerWaalsContact C-N 3.28Å; I445-I447 PolarHBondContact O-N 3.32Å; I447-L450 WeakPolarHBondContact O-CB 3.24Å; I447-L450 PolarHBondContact O-N 2.93Å
448	P	72.1	Confident	79.6	Confident	93 Å²	93	55.9 Å²	55.9	60%	0.604	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	131	171.9	-26.1	35.3	0	0	0	110.9
449	P	72.3	Confident	81.3	Confident	76 Å²	76	52.6 Å²	52.6	49%	0.494	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89	-7.1	18.3	35.4	-37.4	0	0	0	116.3	E451 P774	P449-E451 PolarHBondContact O-N 3.13Å; P449-E451 VanDerWaalsContact O-N 3.13Å; P449-P774 HydrophobicContact CB-CG 4.34Å
450	L	81.8	Confident	83.1	Confident	39 Å²	39	49 Å²	49	20%	0.204	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-75.2	-0.3	-168.2	-58	164.9	0	0	0	114.4	I447 H452 S453 Y456 T698 E700	I447-L450 WeakPolarHBondContact O-CB 3.24Å; I447-L450 PolarHBondContact O-N 2.93Å; L450-H452 PolarHBondContact O-N 2.69Å; L450-S453 PolarHBondContact O-N 3.02Å; L450-S453 PolarHBondContact O-OG 3.24Å; L450-Y456 HydrophobicContact CB-CD2 3.89Å; L450-Y456 HydrophobicContact CB-CE2 3.83Å; L450-Y456 HydrophobicContact CD1-CE2 4.1Å; L450-Y456 HydrophobicContact CG-CE2 4.42Å; L450-T698 HydrophobicContact CD2-CG2 4.12Å; L450-E700 HydrophobicContact CD2-CG 4.13Å
451	E	80.9	Confident	84.6	Confident	84 Å²	84	43 Å²	43	39%	0.393	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-62.5	-23.7	178.5	-174.8	160.3	-143.9	0	0	113.5	P449	P449-E451 PolarHBondContact O-N 3.13Å; P449-E451 VanDerWaalsContact O-N 3.13Å
452	H	90.3	Very high	85.5	Confident	96 Å²	96	40.7 Å²	40.7	44%	0.444	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-124.1	25.7	175.4	-59.7	-58.5	0	0	0	112.8	L450 S458 Y695 N696	L450-H452 PolarHBondContact O-N 2.69Å; H452-S458 WeakPolarHBondContact CA-OG 3.42Å; H452-Y695 WeakPolarHBondContact O-CD1 3.4Å; H452-N696 HydrophobicContact CB-CB 4.41Å; H452-N696 WeakPolarHBondContact CB-ND2 3.48Å; H452-N696 PolarHBondContact O-N 3.46Å
453	S	92.6	Very high	86.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.			trans	-86.8	156.2	174.2	74.2	0	0	0	0	111.9	L450 L455 Y456 V457 S458 Y695 D701	L450-S453 PolarHBondContact O-N 3.02Å; L450-S453 PolarHBondContact O-OG 3.24Å; S453-L455 VanDerWaalsContact C-N 3.31Å; S453-Y456 PolarHBondContact O-N 2.89Å; S453-V457 PolarHBondContact O-N 3.34Å; S453-S458 PolarHBondContact O-N 3.19Å; S453-Y695 VanDerWaalsContact C-CD1 3.44Å; S453-Y695 WeakPolarHBondContact O-CE1 3.5Å; S453-D701 WeakPolarHBondContact CB-OD2 3.29Å
454	W	95.4	Very high	87.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-67.4	-34.7	179.3	169.8	80.5	0	0	0	111.3	E377 D378 Y456 V457 Y663 I692 Y695 D701 E703 I704	E377-W454 HydrophobicContact CB-CH2 4.28Å; E377-W454 HydrophobicContact CB-CZ2 3.5Å; E377-W454 PolarHBondContact OE2-NE1 3.4Å; D378-W454 HydrophobicContact CB-CH2 3.73Å; D378-W454 HydrophobicContact CB-CZ3 3.76Å; W454-Y456 PolarHBondContact O-N 3.21Å; W454-V457 PolarHBondContact O-N 2.69Å; W454-Y663 HydrophobicContact CH2-CE2 4.14Å; W454-Y663 HydrophobicContact CZ2-CD2 4.42Å; W454-Y663 AromaticContact CZ2-CE2 3.74Å; W454-Y663 HydrophobicContact CZ2-CE2 3.74Å; W454-Y663 AromaticContact CZ2-CZ 3.99Å; W454-I692 HydrophobicContact CB-CD1 3.99Å; W454-I692 HydrophobicContact CG-CD1 3.95Å; W454-Y695 HydrophobicContact CB-CD1 4.07Å; W454-Y695 HydrophobicContact CB-CE1 4.22Å; W454-Y695 HydrophobicContact CB-CG 4.47Å; W454-D701 WeakPolarHBondContact CA-OD1 3.5Å; W454-D701 HydrophobicContact CB-CB 4.4Å; W454-D701 WeakPolarHBondContact CB-OD1 3.32Å; W454-D701 HydrophobicContact CE3-CB 4.43Å; W454-D701 PolarHBondContact N-OD1 2.7Å; W454-E703 HydrophobicContact CH2-CB 4.3Å; W454-E703 HydrophobicContact CZ3-CB 4.15Å; W454-I704 HydrophobicContact CB-CG2 4.25Å; W454-I704 HydrophobicContact CD2-CB 3.76Å; W454-I704 HydrophobicContact CD2-CG1 4.39Å; W454-I704 HydrophobicContact CD2-CG2 3.43Å; W454-I704 VanDerWaalsContact CD2-CG2 3.43Å; W454-I704 HydrophobicContact CE3-CB 3.86Å; W454-I704 HydrophobicContact CE3-CG2 3.44Å; W454-I704 VanDerWaalsContact CE3-CG2 3.44Å; W454-I704 HydrophobicContact CG-CB 4.42Å; W454-I704 HydrophobicContact CG-CG2 3.81Å; W454-I704 HydrophobicContact CH2-CB 3.86Å; W454-I704 HydrophobicContact CH2-CG2 4.39Å; W454-I704 HydrophobicContact CZ2-CB 3.79Å; W454-I704 HydrophobicContact CZ2-CD1 4.46Å; W454-I704 HydrophobicContact CZ2-CG1 4.32Å; W454-I704 HydrophobicContact CZ2-CG2 4.41Å; W454-I704 HydrophobicContact CZ3-CB 3.91Å; W454-I704 HydrophobicContact CZ3-CG2 3.95Å
455	L	92.3	Very high	87.5	Confident	18 Å²	18	40.1 Å²	40.1	9%	0.094	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-49.2	-28.9	172.6	-165.6	79	0	0	0	114.1	S376 H379 S453 E700 D701	S376-L455 WeakPolarHBondContact CB-O 3.49Å; S376-L455 PolarHBondContact OG-O 3.24Å; H379-L455 HydrophobicContact CB-CD1 3.91Å; H379-L455 HydrophobicContact CB-CG 4.09Å; S453-L455 VanDerWaalsContact C-N 3.31Å; L455-E700 HydrophobicContact CD2-CB 3.83Å; L455-E700 HydrophobicContact CD2-CG 4.42Å; L455-D701 PolarHBondContact N-OD1 3.42Å
456	Y	92.9	Very high	88	Confident	15 Å²	15	42 Å²	42	6%	0.059	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-116.4	11	177.1	-62.9	-65.9	0	0	0	114.4	H379 W381 D394 I445 L450 S453 W454 S458 G459	H379-Y456 AromaticContact CD2-CE1 3.75Å; W381-Y456 HydrophobicContact CE3-CD1 4.07Å; W381-Y456 HydrophobicContact CE3-CE1 4.1Å; W381-Y456 AromaticContact CH2-CD1 3.74Å; W381-Y456 HydrophobicContact CH2-CD1 3.74Å; W381-Y456 HydrophobicContact CZ2-CD1 4.25Å; W381-Y456 AromaticContact CZ3-CD1 3.64Å; W381-Y456 HydrophobicContact CZ3-CD1 3.64Å; W381-Y456 HydrophobicContact CZ3-CE1 4.1Å; D394-Y456 PolarHBondContact OD2-OH 3.19Å; I445-Y456 HydrophobicContact CB-CD1 3.56Å; I445-Y456 HydrophobicContact CB-CE1 3.6Å; I445-Y456 HydrophobicContact CB-CG 4.09Å; I445-Y456 HydrophobicContact CD1-CD1 4.44Å; I445-Y456 HydrophobicContact CG1-CD1 4.49Å; I445-Y456 HydrophobicContact CG2-CD1 3.7Å; I445-Y456 HydrophobicContact CG2-CE1 3.41Å; I445-Y456 VanDerWaalsContact CG2-CE1 3.41Å; L450-Y456 HydrophobicContact CB-CD2 3.89Å; L450-Y456 HydrophobicContact CB-CE2 3.83Å; L450-Y456 HydrophobicContact CD1-CE2 4.1Å; L450-Y456 HydrophobicContact CG-CE2 4.42Å; S453-Y456 PolarHBondContact O-N 2.89Å; W454-Y456 PolarHBondContact O-N 3.21Å; Y456-S458 PolarHBondContact O-N 2.91Å; Y456-S458 VanDerWaalsContact O-N 3.14Å; Y456-G459 PolarHBondContact O-N 2.72Å
457	V	94.3	Very high	88.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	52.4	34.1	177.3	-154	0	0	0	0	112.7	S453 W454 G459 Y460 H660 Y695	S453-V457 PolarHBondContact O-N 3.34Å; W454-V457 PolarHBondContact O-N 2.69Å; V457-G459 PolarHBondContact O-N 2.86Å; V457-Y460 PolarHBondContact O-N 3.43Å; V457-H660 HydrophobicContact CG1-CB 3.86Å; V457-Y695 WeakPolarHBondContact CA-OH 3.23Å; V457-Y695 VanDerWaalsContact CG1-OH 3.27Å; V457-Y695 WeakPolarHBondContact CG1-OH 3.39Å
458	S	92.4	Very high	89.8	Confident	20 Å²	20	34.9 Å²	34.9	14%	0.14	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	47.4	29.7	-173.9	-66.4	0	0	0	0	114.5	H452 S453 Y456 Y695	H452-S458 WeakPolarHBondContact CA-OG 3.42Å; S453-S458 PolarHBondContact O-N 3.19Å; Y456-S458 PolarHBondContact O-N 2.91Å; Y456-S458 VanDerWaalsContact O-N 3.14Å; S458-Y695 VanDerWaalsContact OG-CD1 3.29Å; S458-Y695 WeakPolarHBondContact OG-CD1 3.43Å; S458-Y695 WeakPolarHBondContact OG-CE1 3.42Å
459	G	90.5	Very high	90.9	Very high	35 Å²	35	30.9 Å²	30.9	36%	0.361	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	93.6	9.2	-179.1	0	0	0	0	0	116.3	Y456 V457 P461	Y456-G459 PolarHBondContact O-N 2.72Å; V457-G459 PolarHBondContact O-N 2.86Å; G459-P461 WeakPolarHBondContact O-CD 3.38Å
460	Y	93.9	Very high	92	Very high	91 Å²	91	27.3 Å²	27.3	36%	0.357	14%	0.141	S	C	.	.			trans	-108.5	53.8	175.6	-62.6	-82.3	0	0	0	114.7	V457 Y657 S658 H660 H661	V457-Y460 PolarHBondContact O-N 3.43Å; Y460-Y657 VanDerWaalsContact O-CD1 3.31Å; Y460-Y657 WeakPolarHBondContact O-CD1 3.43Å; Y460-S658 WeakPolarHBondContact CE1-OG 3.27Å; Y460-S658 PolarHBondContact OH-OG 3.43Å; Y460-H660 HydrophobicContact CD2-CB 4.1Å; Y460-H660 AromaticContact CD2-CD2 3.6Å; Y460-H660 AromaticContact CD2-CE1 3.97Å; Y460-H660 AromaticContact CD2-CG 3.55Å; Y460-H660 AromaticContact CD2-ND1 3.8Å; Y460-H660 AromaticContact CD2-NE2 3.85Å; Y460-H660 AromaticContact CE2-CD2 3.89Å; Y460-H660 AromaticContact CE2-CE1 3.6Å; Y460-H660 AromaticContact CE2-CG 4Å; Y460-H660 AromaticContact CE2-ND1 3.83Å; Y460-H660 AromaticContact CE2-NE2 3.61Å; Y460-H660 HydrophobicContact CG-CB 4.43Å; Y460-H661 PolarHBondContact O-NE2 3.25Å
461	P	95.1	Very high	92.7	Very high	14 Å²	14	25.4 Å²	25.4	9%	0.091	13%	0.131	C	C	.	.			trans	-74.5	156.5	179.9	35.4	-39.1	0	0	0	113.1	L375 W381 G459 V463 Y657	L375-P461 CarbonylContact O-C 3.53Å; L375-P461 VanDerWaalsContact O-CA 3.32Å; L375-P461 WeakPolarHBondContact O-CA 3.3Å; L375-P461 VanDerWaalsContact O-CB 3.25Å; L375-P461 WeakPolarHBondContact O-CB 3.47Å; W381-P461 HydrophobicContact CH2-CB 3.7Å; W381-P461 HydrophobicContact CH2-CG 4.44Å; W381-P461 HydrophobicContact CZ2-CB 3.46Å; W381-P461 VanDerWaalsContact CZ2-CB 3.46Å; W381-P461 HydrophobicContact CZ2-CG 3.77Å; G459-P461 WeakPolarHBondContact O-CD 3.38Å; P461-V463 HydrophobicContact CG-CG2 3.99Å; P461-V463 PolarHBondContact O-N 2.78Å; P461-Y657 WeakPolarHBondContact O-CE1 3.35Å
462	V	96.4	Very high	93.4	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.006	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	95.5	165.4	-178.2	0	0	0	0	108.7	L375 M469 Y553 Y657	L375-V462 HydrophobicContact CB-CB 4.46Å; L375-V462 PolarHBondContact N-O 3.37Å; L375-V462 PolarHBondContact O-N 2.92Å; V462-M469 HydrophobicContact CG1-CE 3.88Å; V462-Y553 HydrophobicContact CB-CD2 4.33Å; V462-Y553 HydrophobicContact CG1-CD2 3.76Å; V462-Y553 HydrophobicContact CG1-CE2 4.27Å; V462-Y553 HydrophobicContact CG1-CG 4.31Å; V462-Y553 HydrophobicContact CG2-CD2 4.09Å; V462-Y657 HydrophobicContact CG2-CE1 4.14Å; V462-Y657 HydrophobicContact CG2-CE2 4.29Å
463	V	95.9	Very high	93.8	Very high	18 Å²	18	16.9 Å²	16.9	11%	0.109	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	126.9	168.6	-163.7	0	0	0	0	109.9	D372 A374 P461 R465	D372-V463 HydrophobicContact CB-CG1 3.83Å; A374-V463 HydrophobicContact CB-CG1 4.29Å; A374-V463 HydrophobicContact CB-CG2 4.02Å; P461-V463 HydrophobicContact CG-CG2 3.99Å; P461-V463 PolarHBondContact O-N 2.78Å; V463-R465 HydrophobicContact CG1-CG 4.37Å; V463-R465 PolarHBondContact O-N 2.92Å
464	C	95.9	Very high	94	Very high	2 Å²	2	17.3 Å²	17.3	1%	0.014	10%	0.095	C	C	.	.			trans	-76	60.2	-172.1	-68.9	0	0	0	0	113.5	L373 P466 R467 M469 A470	L373-C464 HydrophobicContact CB-CB 4.17Å; L373-C464 WeakPolarHBondContact O-CB 3.41Å; L373-C464 PolarHBondContact O-N 2.8Å; C464-P466 CarbonylContact C-O 3.21Å; C464-P466 CarbonylContact O-C 3.23Å; C464-R467 VanDerWaalsContact O-CA 3.31Å; C464-R467 WeakPolarHBondContact O-CA 3.41Å; C464-R467 PolarHBondContact O-N 3.42Å; C464-M469 HydrophobicContact CB-CB 3.85Å; C464-A470 HydrophobicContact CB-CB 4Å
465	R	90.5	Very high	94	Very high	48 Å²	48	17.3 Å²	17.3	18%	0.181	10%	0.095	C	C	.	.			trans	-118.6	112.3	-180	-78.3	-176.5	-93.1	105.7	-5.6	111.1	N59 D372 E383 V463 H824	N59-R465 VanDerWaalsContact ND2-C 3.33Å; N59-R465 PolarHBondContact ND2-O 3.04Å; N59-R465 VanDerWaalsContact ND2-O 3.09Å; D372-R465 HydrophobicContact CB-CG 4.1Å; D372-R465 WeakPolarHBondContact OD1-CG 3.32Å; D372-R465 WeakPolarHBondContact OD2-CD 3.32Å; D372-R465 WeakPolarHBondContact OD2-CG 3.41Å; D372-R465 IonicContact OD2-NE 2.72Å; D372-R465 PolarHBondContact OD2-NE 3.3Å; E383-R465 IonicContact OE2-CZ 3.95Å; E383-R465 IonicContact OE2-NE 3.97Å; E383-R465 IonicContact OE2-NH2 2.93Å; E383-R465 PolarHBondContact OE2-NH2 2.86Å; V463-R465 HydrophobicContact CG1-CG 4.37Å; V463-R465 PolarHBondContact O-N 2.92Å; R465-H824 VanDerWaalsContact CZ-CE1 3.41Å; R465-H824 PolarHBondContact NH1-CE1 3.17Å; R465-H824 PolarHBondContact NH1-NE2 3.09Å; R465-H824 PolarHBondContact NH2-CE1 3.15Å; R465-H824 PolarHBondContact NH2-NE2 3.43Å
466	P	90.2	Very high	94.2	Very high	44 Å²	44	17.2 Å²	17.2	29%	0.286	10%	0.097	S	C	.	.	S	Bend	cis	-74.1	155.2	9.2	27.5	-32.5	0	0	0	114.2	C464 I468 M469	C464-P466 CarbonylContact C-O 3.21Å; C464-P466 CarbonylContact O-C 3.23Å; P466-I468 HydrophobicContact CB-CG2 4.39Å; P466-I468 HydrophobicContact CG-CG2 3.98Å; P466-I468 PolarHBondContact O-N 3.26Å; P466-M469 WeakPolarHBondContact O-CB 3.24Å; P466-M469 PolarHBondContact O-N 3.02Å
467	R	89.5	Confident	94.2	Very high	16 Å²	16	17.6 Å²	17.6	6%	0.06	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-14.8	-172.2	-168.6	173.2	-81.1	-173.6	-13.2	115.5	E73 L76 Y368 S369 V371 C464 M469 A470	E73-R467 IonicContact OE1-NH1 2.72Å; E73-R467 PolarHBondContact OE1-NH1 3.19Å; E73-R467 WeakPolarHBondContact OE2-CD 3.45Å; E73-R467 IonicContact OE2-CZ 2.61Å; E73-R467 IonicContact OE2-NE 2.89Å; E73-R467 IonicContact OE2-NH1 3.79Å; E73-R467 PolarHBondContact OE2-NH1 3.24Å; L76-R467 HydrophobicContact CD1-CG 4.03Å; Y368-R467 PolarHBondContact O-NH1 3.43Å; Y368-R467 PolarHBondContact O-NH2 3.44Å; S369-R467 PolarHBondContact O-NH2 3.41Å; V371-R467 PolarHBondContact O-NH2 3.14Å; C464-R467 VanDerWaalsContact O-CA 3.31Å; C464-R467 WeakPolarHBondContact O-CA 3.41Å; C464-R467 PolarHBondContact O-N 3.42Å; R467-M469 PolarHBondContact O-N 2.99Å; R467-A470 WeakPolarHBondContact O-CB 3.31Å; R467-A470 PolarHBondContact O-N 2.89Å
468	I	90.9	Very high	94.2	Very high	22 Å²	22	17.8 Å²	17.8	11%	0.113	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-27.4	168.7	-159.6	174.8	0	0	0	113.2	F35 C38 V40 P466 A470 V471 A472	F35-I468 HydrophobicContact CD1-CD1 3.65Å; F35-I468 HydrophobicContact CD1-CG1 3.81Å; F35-I468 HydrophobicContact CE1-CD1 4.17Å; F35-I468 HydrophobicContact CE1-CG1 3.85Å; F35-I468 HydrophobicContact CG-CD1 4.46Å; C38-I468 HydrophobicContact CB-CD1 4.19Å; V40-I468 HydrophobicContact CG2-CD1 3.6Å; P466-I468 HydrophobicContact CB-CG2 4.39Å; P466-I468 HydrophobicContact CG-CG2 3.98Å; P466-I468 PolarHBondContact O-N 3.26Å; I468-A470 PolarHBondContact O-N 2.79Å; I468-V471 VanDerWaalsContact O-CB 3.27Å; I468-V471 WeakPolarHBondContact O-CB 3.31Å; I468-V471 PolarHBondContact O-N 3.34Å; I468-A472 PolarHBondContact O-N 2.64Å
469	M	94.4	Very high	94	Very high	9 Å²	9	20 Å²	20	4%	0.044	11%	0.112	C	C	.	.	H	α-helix	trans	-62.3	-30.8	173.4	-70.2	174.3	66.6	0	0	112.4	V462 C464 P466 R467 V471 A472 A473 R552	V462-M469 HydrophobicContact CG1-CE 3.88Å; C464-M469 HydrophobicContact CB-CB 3.85Å; P466-M469 WeakPolarHBondContact O-CB 3.24Å; P466-M469 PolarHBondContact O-N 3.02Å; R467-M469 PolarHBondContact O-N 2.99Å; M469-V471 PolarHBondContact O-N 3.32Å; M469-A472 WeakPolarHBondContact O-CB 3.3Å; M469-A472 PolarHBondContact O-N 3.43Å; M469-A472 VanDerWaalsContact O-N 3.12Å; M469-A473 PolarHBondContact O-N 3.38Å; M469-R552 HydrophobicContact CE-CB 4Å; M469-R552 WeakPolarHBondContact CE-O 3.36Å
470	A	96.3	Very high	93.8	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.008	10%	0.104	C	C	.	.	H	α-helix	trans	-66.1	-26.5	174.6	0	0	0	0	0	111.9	L76 Y357 L373 C464 R467 I468 A473 A474	L76-A470 HydrophobicContact CD1-CB 4.37Å; L76-A470 HydrophobicContact CD2-CB 4.05Å; Y357-A470 HydrophobicContact CE2-CB 4.35Å; Y357-A470 WeakPolarHBondContact CE2-O 3.35Å; L373-A470 HydrophobicContact CB-CB 4.49Å; L373-A470 HydrophobicContact CD2-CB 4.32Å; C464-A470 HydrophobicContact CB-CB 4Å; R467-A470 WeakPolarHBondContact O-CB 3.31Å; R467-A470 PolarHBondContact O-N 2.89Å; I468-A470 PolarHBondContact O-N 2.79Å; A470-A473 PolarHBondContact O-N 2.92Å; A470-A474 PolarHBondContact O-N 3.48Å
471	V	96.3	Very high	92.9	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-68.2	-44	171.7	-176.7	0	0	0	0	110.3	F35 P74 L76 I79 I468 M469 A473 A474 I475	F35-V471 HydrophobicContact CE1-CB 4.08Å; F35-V471 HydrophobicContact CE1-CG1 3.68Å; F35-V471 HydrophobicContact CZ-CG1 3.81Å; P74-V471 HydrophobicContact CB-CG2 3.76Å; P74-V471 HydrophobicContact CG-CG2 3.81Å; L76-V471 HydrophobicContact CD2-CG2 4.04Å; I79-V471 HydrophobicContact CD1-CB 4.48Å; I79-V471 HydrophobicContact CD1-CG1 4.09Å; I79-V471 HydrophobicContact CD1-CG2 3.56Å; I79-V471 HydrophobicContact CG2-CG1 4.04Å; I468-V471 VanDerWaalsContact O-CB 3.27Å; I468-V471 WeakPolarHBondContact O-CB 3.31Å; I468-V471 PolarHBondContact O-N 3.34Å; M469-V471 PolarHBondContact O-N 3.32Å; V471-A473 VanDerWaalsContact C-N 3.32Å; V471-A473 PolarHBondContact O-N 2.73Å; V471-A474 PolarHBondContact O-N 3.01Å; V471-I475 HydrophobicContact CG1-CD1 3.96Å; V471-I475 WeakPolarHBondContact O-CD1 3.29Å; V471-I475 VanDerWaalsContact O-CG1 3.3Å; V471-I475 WeakPolarHBondContact O-CG1 3.36Å; V471-I475 PolarHBondContact O-N 3.48Å
472	A	96.3	Very high	91.2	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62.6	-38	174.3	0	0	0	0	0	112.1	I468 M469 I475 A476 C544 C549 L550 Y553	I468-A472 PolarHBondContact O-N 2.64Å; M469-A472 WeakPolarHBondContact O-CB 3.3Å; M469-A472 PolarHBondContact O-N 3.43Å; M469-A472 VanDerWaalsContact O-N 3.12Å; A472-I475 PolarHBondContact O-N 2.92Å; A472-A476 WeakPolarHBondContact O-CB 3.49Å; A472-A476 PolarHBondContact O-N 3.25Å; A472-C544 HydrophobicContact CB-CB 4.16Å; A472-C549 HydrophobicContact CB-CB 4.02Å; A472-L550 HydrophobicContact CB-CD2 3.93Å; A472-Y553 HydrophobicContact CB-CD1 4.4Å
473	A	96.9	Very high	89.1	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.9	-44.3	173.7	0	0	0	0	0	112.7	F353 L373 L375 M469 A470 V471 I475 A476 A477 Y553	F353-A473 HydrophobicContact CE2-CB 4.02Å; F353-A473 HydrophobicContact CZ-CB 4.15Å; L373-A473 HydrophobicContact CD2-CB 4.26Å; L375-A473 HydrophobicContact CD1-CB 3.73Å; M469-A473 PolarHBondContact O-N 3.38Å; A470-A473 PolarHBondContact O-N 2.92Å; V471-A473 VanDerWaalsContact C-N 3.32Å; V471-A473 PolarHBondContact O-N 2.73Å; A473-I475 PolarHBondContact O-N 3.3Å; A473-A476 PolarHBondContact O-N 3.4Å; A473-A477 WeakPolarHBondContact O-CB 3.39Å; A473-A477 PolarHBondContact O-N 3.11Å; A473-Y553 HydrophobicContact CB-CE1 4.13Å
474	A	97	Very high	86.3	Confident	10 Å²	10	21.6 Å²	21.6	8%	0.083	13%	0.127	C	C	.	.	H	α-helix	trans	-62.9	-30.2	174.6	0	0	0	0	0	113.1	L83 Y357 A470 V471	L83-A474 HydrophobicContact CD1-CB 4.22Å; Y357-A474 HydrophobicContact CD2-CB 4.4Å; Y357-A474 HydrophobicContact CE2-CB 3.69Å; A470-A474 PolarHBondContact O-N 3.48Å; V471-A474 PolarHBondContact O-N 3.01Å
475	I	97.1	Very high	83.4	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-74.2	-42.9	174	-69.8	161.7	0	0	0	110.7	F35 L83 V471 A472 A473 A477 I478 K537 L540 L541 C544	F35-I475 HydrophobicContact CZ-CD1 4.47Å; L83-I475 HydrophobicContact CD1-CG1 3.91Å; V471-I475 HydrophobicContact CG1-CD1 3.96Å; V471-I475 WeakPolarHBondContact O-CD1 3.29Å; V471-I475 VanDerWaalsContact O-CG1 3.3Å; V471-I475 WeakPolarHBondContact O-CG1 3.36Å; V471-I475 PolarHBondContact O-N 3.48Å; A472-I475 PolarHBondContact O-N 2.92Å; A473-I475 PolarHBondContact O-N 3.3Å; I475-A477 VanDerWaalsContact C-N 3.26Å; I475-A477 PolarHBondContact O-N 3.46Å; I475-I478 WeakPolarHBondContact O-CB 3.41Å; I475-I478 WeakPolarHBondContact O-CG1 3.06Å; I475-I478 PolarHBondContact O-N 3.44Å; I475-K537 VanDerWaalsContact O-CE 3.23Å; I475-K537 WeakPolarHBondContact O-CE 3.45Å; I475-L540 HydrophobicContact CD1-CB 4.1Å; I475-L540 HydrophobicContact CD1-CD1 4.48Å; I475-L540 HydrophobicContact CG1-CB 4.28Å; I475-L540 HydrophobicContact CG1-CD1 4.2Å; I475-L540 HydrophobicContact CG2-CB 3.56Å; I475-L540 HydrophobicContact CG2-CD1 4.5Å; I475-L541 HydrophobicContact CG2-CD2 3.9Å; I475-L541 HydrophobicContact CG2-CG 3.86Å; I475-C544 VanDerWaalsContact CD1-SG 3.55Å
476	A	95	Very high	80.4	Confident	15 Å²	15	27.3 Å²	27.3	12%	0.124	18%	0.18	C	C	.	.	H	α-helix	trans	-63	-31.5	174.9	0	0	0	0	0	112.5	A472 A473 I478 K537 L541 Y553	A472-A476 WeakPolarHBondContact O-CB 3.49Å; A472-A476 PolarHBondContact O-N 3.25Å; A473-A476 PolarHBondContact O-N 3.4Å; A476-I478 VanDerWaalsContact C-N 3.3Å; A476-I478 PolarHBondContact O-N 2.81Å; A476-K537 WeakPolarHBondContact O-CE 3.35Å; A476-K537 PolarHBondContact O-NZ 3.14Å; A476-L541 HydrophobicContact CB-CD2 4.48Å; A476-Y553 HydrophobicContact CB-CE1 4.28Å
477	A	93.8	Very high	77.6	Confident	23 Å²	23	31 Å²	31	19%	0.19	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-5.3	178.4	0	0	0	0	0	115.2	Q339 F353 A473 I475 Q479	Q339-A477 HydrophobicContact CB-CB 4.33Å; Q339-A477 HydrophobicContact CG-CB 4.02Å; Q339-A477 PolarHBondContact NE2-O 3.14Å; F353-A477 HydrophobicContact CD1-CB 4.03Å; F353-A477 HydrophobicContact CE1-CB 3.61Å; F353-A477 HydrophobicContact CE2-CB 4.48Å; F353-A477 HydrophobicContact CZ-CB 3.87Å; A473-A477 WeakPolarHBondContact O-CB 3.39Å; A473-A477 PolarHBondContact O-N 3.11Å; I475-A477 VanDerWaalsContact C-N 3.26Å; I475-A477 PolarHBondContact O-N 3.46Å; A477-Q479 PolarHBondContact O-N 3.17Å
478	I	93.4	Very high	74.7	Confident	4 Å²	4	36.1 Å²	36.1	2%	0.021	23%	0.234	C	C	.	.			trans	-63.3	130.5	177.8	-65.4	170.5	0	0	0	110.6	L83 E87 I475 A476 P480 L533 K537	L83-I478 HydrophobicContact CD1-CD1 4.47Å; L83-I478 HydrophobicContact CD2-CD1 4.12Å; E87-I478 WeakPolarHBondContact OE2-CA 3.48Å; I475-I478 WeakPolarHBondContact O-CB 3.41Å; I475-I478 WeakPolarHBondContact O-CG1 3.06Å; I475-I478 PolarHBondContact O-N 3.44Å; A476-I478 VanDerWaalsContact C-N 3.3Å; A476-I478 PolarHBondContact O-N 2.81Å; I478-P480 WeakPolarHBondContact O-CD 3.16Å; I478-L533 HydrophobicContact CG2-CD1 3.56Å; I478-L533 HydrophobicContact CG2-CD2 4.13Å; I478-L533 HydrophobicContact CG2-CG 3.73Å; I478-K537 HydrophobicContact CB-CD 4.01Å; I478-K537 HydrophobicContact CB-CG 4.23Å; I478-K537 HydrophobicContact CG2-CB 4.41Å; I478-K537 HydrophobicContact CG2-CD 4.32Å; I478-K537 WeakPolarHBondContact O-CE 3.45Å; I478-K537 PolarHBondContact O-NZ 2.95Å
479	Q	88.8	Confident	71.7	Confident	67 Å²	67	44.2 Å²	44.2	31%	0.313	27%	0.271	S	S	.	.			trans	-107.1	107.7	-179.3	-61.7	173.7	-10.5	0	0	111.5	E87 H337 A477 G481	E87-Q479 WeakPolarHBondContact OE1-CB 3.15Å; E87-Q479 PolarHBondContact OE1-N 3.39Å; H337-Q479 PolarHBondContact CE1-O 2.99Å; A477-Q479 PolarHBondContact O-N 3.17Å; Q479-G481 PolarHBondContact O-N 3.17Å
480	P	86.4	Confident	68.4	Low	27 Å²	27	47.4 Å²	47.4	18%	0.175	30%	0.299	C	S	.	.			trans	-75.4	-11.7	-176.2	-21.2	35.4	0	0	0	117.1	I478 I529 S530 V534 K537	I478-P480 WeakPolarHBondContact O-CD 3.16Å; P480-I529 HydrophobicContact CB-CG2 4.16Å; P480-S530 PolarHBondContact O-N 3.46Å; P480-V534 HydrophobicContact CB-CG2 3.61Å; P480-V534 HydrophobicContact CG-CG2 4.06Å; P480-K537 HydrophobicContact CG-CD 4.49Å
481	G	74	Confident	65.4	Low	16 Å²	16	53.4 Å²	53.4	17%	0.165	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-81.5	156.8	179.9	0	0	0	0	0	113.3	T91 H337 Q479	T91-G481 WeakPolarHBondContact CG2-O 3.17Å; H337-G481 PolarHBondContact CE1-O 2.9Å; H337-G481 PolarHBondContact NE2-O 2.91Å; Q479-G481 PolarHBondContact O-N 3.17Å
482	A	60.3	Low	62.5	Low	13 Å²	13	60.1 Å²	60.1	11%	0.107	38%	0.38	C	S	.	.			trans	-85.4	135.9	-178.6	0	0	0	0	0	115.2	T91 L484 V528	T91-A482 VanDerWaalsContact O-CB 3.32Å; T91-A482 WeakPolarHBondContact O-CB 3.4Å; A482-L484 HydrophobicContact CB-CD1 4.16Å; A482-L484 PolarHBondContact O-N 3.46Å; A482-L484 VanDerWaalsContact O-N 3.13Å; A482-V528 HydrophobicContact CB-CB 3.58Å; A482-V528 HydrophobicContact CB-CG1 3.62Å; A482-V528 VanDerWaalsContact CB-O 3.28Å; A482-V528 WeakPolarHBondContact CB-O 3.28Å; A482-V528 PolarHBondContact N-O 3.07Å
483	S	53.2	Low	59.4	Low	33 Å²	33	65.5 Å²	65.5	23%	0.231	42%	0.417	C	S	.	.			trans	-72.6	92.5	164.8	168.4	0	0	0	0	111.5	T336 S485	T336-S483 WeakPolarHBondContact OG1-CB 3.23Å; T336-S483 PolarHBondContact OG1-OG 3.3Å; S483-S485 PolarHBondContact O-N 2.9Å
484	L	37.1	Very low	56.3	Low	104 Å²	104	73 Å²	73	55%	0.545	45%	0.452	S	S	.	.			trans	-70.3	123	171.7	-88.3	76.9	0	0	0	111.4	A482 A486	A482-L484 HydrophobicContact CB-CD1 4.16Å; A482-L484 PolarHBondContact O-N 3.46Å; A482-L484 VanDerWaalsContact O-N 3.13Å; L484-A486 PolarHBondContact O-N 3.4Å
485	S	34.1	Very low	53.1	Low	77 Å²	77	78 Å²	78	54%	0.538	48%	0.483	S	S	.	.			trans	-75.4	115.7	166.1	-68.1	0	0	0	0	110.1	S483 V487	S483-S485 PolarHBondContact O-N 2.9Å; S485-V487 VanDerWaalsContact C-N 3.31Å; S485-V487 PolarHBondContact O-N 3.02Å
486	A	27.4	Very low	50	Low	93 Å²	93	86.6 Å²	86.6	77%	0.769	52%	0.521	S	S	*	.			trans	-70	80.4	177.6	0	0	0	0	0	112.1	L484 T488	L484-A486 PolarHBondContact O-N 3.4Å; A486-T488 PolarHBondContact O-N 3.34Å
487	V	31.7	Very low	47	Very low	121 Å²	121	90.1 Å²	90.1	73%	0.733	55%	0.55	S	S	*	*			trans	-81.6	103.8	173.9	-179.4	0	0	0	0	109.8	S485 Q489	S485-V487 VanDerWaalsContact C-N 3.31Å; S485-V487 PolarHBondContact O-N 3.02Å; V487-Q489 PolarHBondContact O-N 3.31Å
488	T	27.8	Very low	43.8	Very low	124 Å²	124	100.9 Å²	100.9	76%	0.761	59%	0.588	S	S	*	*			trans	-14.1	100.3	170.7	-46.8	0	0	0	0	116.7	A486 A490	A486-T488 PolarHBondContact O-N 3.34Å; T488-A490 HydrophobicContact CG2-CB 4.25Å
489	Q	28.2	Very low	40.7	Very low	191 Å²	191	104.1 Å²	104.1	89%	0.893	62%	0.623	S	S	*	*			trans	-101.1	88.5	151.5	-72.6	-164.2	-0.5	0	0	109.3	V487 P491	V487-Q489 PolarHBondContact O-N 3.31Å; Q489-P491 WeakPolarHBondContact O-CD 3.37Å
490	A	25.3	Very low	37.8	Very low	76 Å²	76	108.2 Å²	108.2	63%	0.628	65%	0.652	S	S	*	*			trans	-71.6	123.3	171	0	0	0	0	0	109.5	T488 T492	T488-A490 HydrophobicContact CG2-CB 4.25Å; A490-T492 PolarHBondContact O-N 3.32Å
491	P	34.2	Very low	35.1	Very low	127 Å²	127	115 Å²	115	83%	0.825	69%	0.686	S	S	*	*			trans	-72.6	112.8	179.5	28.3	-33	0	0	0	110.4	Q489 S493	Q489-P491 WeakPolarHBondContact O-CD 3.37Å; P491-S493 PolarHBondContact O-N 3.32Å
492	T	34.5	Very low	33.2	Very low	142 Å²	142	119.6 Å²	119.6	87%	0.871	72%	0.716	S	S	*	*			trans	-66.8	126	172.2	49.1	0	0	0	0	110.5	A490	A490-T492 PolarHBondContact O-N 3.32Å
493	S	30.4	Very low	31.8	Very low	112 Å²	112	123.9 Å²	123.9	78%	0.783	74%	0.743	S	S	*	*			trans	-65.5	132	-172.8	55.7	0	0	0	0	115.4	P491	P491-S493 PolarHBondContact O-N 3.32Å
494	E	32.7	Very low	31	Very low	159 Å²	159	130.1 Å²	130.1	74%	0.743	77%	0.773	S	S	*	*			trans	-157.4	123.8	156.5	-96.2	-72.2	134.8	0	0	108	F496	E494-F496 WeakPolarHBondContact OE2-CE2 3.46Å
495	P	30.2	Very low	30.6	Very low	113 Å²	113	129.8 Å²	129.8	73%	0.734	78%	0.777	S	S	*	*			trans	-107.5	115.9	-172.4	35.9	-29	0	0	0	114.4
496	F	32.3	Very low	30.4	Very low	182 Å²	182	128.4 Å²	128.4	80%	0.798	77%	0.768	S	S	*	*			trans	-137.7	100.7	176.3	-83.5	-74.2	0	0	0	116.5	E494	E494-F496 WeakPolarHBondContact OE2-CE2 3.46Å
497	A	30.8	Very low	30.6	Very low	89 Å²	89	130.8 Å²	130.8	74%	0.736	77%	0.772	S	S	*	*			trans	38.6	110.2	139.2	0	0	0	0	0	121.5
498	Y	27.2	Very low	30.6	Very low	248 Å²	248	129.7 Å²	129.7	97%	0.973	77%	0.77	S	S	*	*			trans	22.3	108	140.1	-77	-90.2	0	0	0	119.2
499	G	28.3	Very low	30.8	Very low	73 Å²	73	128.8 Å²	128.8	75%	0.753	77%	0.769	S	S	*	*			trans	-156.9	123.5	161.7	0	0	0	0	0	111	L501	G499-L501 PolarHBondContact O-N 3.25Å
500	T	28.3	Very low	31	Very low	153 Å²	153	121.6 Å²	121.6	94%	0.939	75%	0.746	S	S	*	*			trans	-57.7	114.2	-173.2	7.6	0	0	0	0	113.7
501	L	28.6	Very low	31.7	Very low	169 Å²	169	118.4 Å²	118.4	89%	0.885	72%	0.72	S	S	*	*			trans	-164.2	151.6	166.1	-103.8	157.9	0	0	0	109.9	G499	G499-L501 PolarHBondContact O-N 3.25Å
502	S	35.5	Very low	32.4	Very low	112 Å²	112	113.5 Å²	113.5	78%	0.783	69%	0.687	S	S	*	*			trans	-84.7	144.5	178.3	173.1	0	0	0	0	112
503	P	30.9	Very low	33.2	Very low	104 Å²	104	109.6 Å²	109.6	68%	0.675	66%	0.661	S	S	*	*				-147.5	154.3	127.4	37.8	-23.1	0	0	0	115.6
504	N	36.3	Very low	34.5	Very low	163 Å²	163	104.5 Å²	104.5	87%	0.872	62%	0.624	S	S	*	*			trans	-85.1	147.1	144.7	-94	16.6	0	0	0	108.3
505	P	28.9	Very low	35.4	Very low	98 Å²	98	97.2 Å²	97.2	64%	0.636	59%	0.591	S	S	*	*				-143.2	171.2	123.3	38.2	-25.1	0	0	0	114.6
506	S	29.8	Very low	36.1	Very low	48 Å²	48	94.8 Å²	94.8	34%	0.336	58%	0.575	S	S	.	*			trans	65.6	99.4	173.4	68.9	0	0	0	0	117.8	P1049 H1050	S506-P1049 VanDerWaalsContact O-CD 3.25Å; S506-P1049 WeakPolarHBondContact O-CD 3.41Å; S506-P1049 WeakPolarHBondContact O-CG 3.38Å; S506-H1050 PolarHBondContact OG-NE2 2.9Å
507	V	30.9	Very low	36.8	Very low	143 Å²	143	90.5 Å²	90.5	87%	0.867	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-103	140.9	133	176.1	0	0	0	0	105.4
508	S	32.4	Very low	37.9	Very low	98 Å²	98	86.2 Å²	86.2	69%	0.685	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-67.5	156.3	-176.2	35.4	0	0	0	0	112.9	G510	S508-G510 PolarHBondContact O-N 3Å
509	S	31.5	Very low	39.3	Very low	104 Å²	104	75.4 Å²	75.4	73%	0.727	49%	0.488	S	S	*	.	S	Bend	trans	-64.6	130.7	177.8	-161.4	0	0	0	0	110.7
510	G	32.8	Very low	40.3	Very low	40 Å²	40	75.5 Å²	75.5	41%	0.412	47%	0.473	S	S	.	.	S	Bend	trans	177.2	-92.4	-175	0	0	0	0	0	113.6	S508	S508-G510 PolarHBondContact O-N 3Å
511	G	40.4	Very low	41.1	Very low	9 Å²	9	73.1 Å²	73.1	9%	0.093	45%	0.45	C	S	.	.	S	Bend	trans	-95	-23.8	-158.7	0	0	0	0	0	120.2	L513	G511-L513 VanDerWaalsContact C-N 3.27Å; G511-L513 PolarHBondContact O-N 3.21Å
512	D	47.1	Very low	42.1	Very low	25 Å²	25	70 Å²	70	13%	0.134	43%	0.431	C	S	.	.			trans	-74.4	74.3	-174.5	-176.2	14.8	0	0	0	111.4	T515 G518 K521 E710	D512-T515 WeakPolarHBondContact OD1-CB 3.24Å; D512-T515 WeakPolarHBondContact OD1-CG2 3.22Å; D512-T515 PolarHBondContact OD1-N 3.38Å; D512-T515 PolarHBondContact OD1-OG1 3.07Å; D512-T515 PolarHBondContact OD2-OG1 3.01Å; D512-T515 VanDerWaalsContact OD2-OG1 3.09Å; D512-G518 CarbonylContact O-C 3.56Å; D512-G518 WeakPolarHBondContact O-CA 3.41Å; D512-G518 VanDerWaalsContact O-O 3.13Å; D512-G518 VanDerWaalsContact OD1-CA 3.26Å; D512-G518 WeakPolarHBondContact OD1-CA 3.47Å; D512-G518 WeakPolarHBondContact OD2-CA 3.35Å; D512-G518 PolarHBondContact OD2-N 3.46Å; D512-K521 IonicContact OD2-NZ 3.88Å; D512-K521 PolarHBondContact OD2-NZ 3.37Å; D512-K521 VanDerWaalsContact OD2-NZ 3.15Å; D512-E710 WeakPolarHBondContact CB-OE1 3.12Å
513	L	53.2	Low	42.9	Very low	59 Å²	59	66.7 Å²	66.7	31%	0.309	40%	0.404	S	S	.	.			trans	-86.4	-13.3	162.5	-75.7	172.8	0	0	0	111.9	G511 H522 R674	G511-L513 VanDerWaalsContact C-N 3.27Å; G511-L513 PolarHBondContact O-N 3.21Å; L513-H522 HydrophobicContact CD2-CB 3.79Å; L513-H522 VanDerWaalsContact CD2-CG 3.47Å; L513-R674 PolarHBondContact O-NH1 3.39Å
514	I	55.8	Low	43.4	Very low	5 Å²	5	64.5 Å²	64.5	3%	0.026	39%	0.391	C	S	.	.	S	Bend	trans	-92.6	-38	-160.6	-45.7	-179.1	0	0	0	111.4	Y673 W685 I711 L715	I514-Y673 HydrophobicContact CG2-CD1 4.38Å; I514-W685 HydrophobicContact CG2-CZ2 3.82Å; I514-I711 HydrophobicContact CD1-CD1 3.84Å; I514-I711 HydrophobicContact CD1-CG1 3.66Å; I514-L715 HydrophobicContact CB-CD1 3.6Å; I514-L715 HydrophobicContact CD1-CD1 4.04Å; I514-L715 HydrophobicContact CG1-CD1 4.38Å; I514-L715 HydrophobicContact CG2-CD1 3.43Å; I514-L715 VanDerWaalsContact CG2-CD1 3.43Å
515	T	52.3	Low	43.7	Very low	6 Å²	6	59.8 Å²	59.8	4%	0.037	37%	0.371	C	S	.	.	S	Bend	trans	-75.6	156.7	173.3	73.8	0	0	0	0	111.5	D512 T517 G518 L519 Y673 L715	D512-T515 WeakPolarHBondContact OD1-CB 3.24Å; D512-T515 WeakPolarHBondContact OD1-CG2 3.22Å; D512-T515 PolarHBondContact OD1-N 3.38Å; D512-T515 PolarHBondContact OD1-OG1 3.07Å; D512-T515 PolarHBondContact OD2-OG1 3.01Å; D512-T515 VanDerWaalsContact OD2-OG1 3.09Å; T515-T517 PolarHBondContact O-N 3.04Å; T515-T517 PolarHBondContact OG1-N 3.4Å; T515-G518 CarbonylContact O-C 3.47Å; T515-G518 WeakPolarHBondContact O-CA 3.27Å; T515-G518 PolarHBondContact O-N 2.86Å; T515-G518 WeakPolarHBondContact OG1-CA 3.39Å; T515-G518 PolarHBondContact OG1-N 2.97Å; T515-L519 PolarHBondContact O-N 3.42Å; T515-Y673 HydrophobicContact CG2-CE1 4.08Å; T515-L715 HydrophobicContact CG2-CD2 3.32Å
516	P	45.5	Very low	44.6	Very low	62 Å²	62	56.2 Å²	56.2	40%	0.403	35%	0.35	S	S	.	.	H	α-helix	trans	-57.3	-36.5	167.6	-24.8	32	0	0	0	112.8	G518 V520 R674	P516-G518 VanDerWaalsContact C-N 3.25Å; P516-V520 VanDerWaalsContact O-CB 3.22Å; P516-V520 WeakPolarHBondContact O-CB 3.46Å; P516-V520 WeakPolarHBondContact O-CG2 3.31Å; P516-V520 PolarHBondContact O-N 3.02Å; P516-V520 VanDerWaalsContact O-N 3.12Å; P516-R674 HydrophobicContact CG-CB 4.3Å; P516-R674 HydrophobicContact CG-CG 4.12Å
517	T	46.8	Very low	45.7	Very low	92 Å²	92	57.9 Å²	57.9	56%	0.564	36%	0.361	S	S	*	.	H	α-helix	trans	-68.2	-32.6	175.6	-41	0	0	0	0	110.6	T515 K521	T515-T517 PolarHBondContact O-N 3.04Å; T515-T517 PolarHBondContact OG1-N 3.4Å; T517-K521 HydrophobicContact CG2-CD 4.42Å; T517-K521 VanDerWaalsContact O-CB 3.22Å; T517-K521 WeakPolarHBondContact O-CB 3.32Å; T517-K521 WeakPolarHBondContact O-CD 3.32Å; T517-K521 WeakPolarHBondContact O-CG 3.5Å; T517-K521 PolarHBondContact O-N 3.07Å
518	G	53.3	Low	47.4	Very low	0 Å²	0	53.1 Å²	53.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-69.9	-61.6	179.5	0	0	0	0	0	112.8	D512 T515 P516 V520 K521 H522	D512-G518 CarbonylContact O-C 3.56Å; D512-G518 WeakPolarHBondContact O-CA 3.41Å; D512-G518 VanDerWaalsContact O-O 3.13Å; D512-G518 VanDerWaalsContact OD1-CA 3.26Å; D512-G518 WeakPolarHBondContact OD1-CA 3.47Å; D512-G518 WeakPolarHBondContact OD2-CA 3.35Å; D512-G518 PolarHBondContact OD2-N 3.46Å; T515-G518 CarbonylContact O-C 3.47Å; T515-G518 WeakPolarHBondContact O-CA 3.27Å; T515-G518 PolarHBondContact O-N 2.86Å; T515-G518 WeakPolarHBondContact OG1-CA 3.39Å; T515-G518 PolarHBondContact OG1-N 2.97Å; P516-G518 VanDerWaalsContact C-N 3.25Å; G518-V520 PolarHBondContact O-N 3.09Å; G518-K521 CarbonylContact O-C 3.55Å; G518-K521 WeakPolarHBondContact O-CA 3.17Å; G518-K521 WeakPolarHBondContact O-CB 3.44Å; G518-K521 PolarHBondContact O-N 3.2Å; G518-H522 PolarHBondContact O-N 3.03Å
519	L	56.3	Low	49.4	Very low	21 Å²	21	49.9 Å²	49.9	11%	0.11	31%	0.307	C	S	.	.	H	α-helix	trans	-55.8	-40.8	174.1	-179.3	141.8	0	0	0	111.2	T515 H522 L523 A566 R674	T515-L519 PolarHBondContact O-N 3.42Å; L519-H522 PolarHBondContact O-N 2.9Å; L519-L523 HydrophobicContact CD2-CD1 3.64Å; L519-L523 HydrophobicContact CG-CD1 4.23Å; L519-L523 WeakPolarHBondContact O-CB 3.42Å; L519-L523 VanDerWaalsContact O-CG 3.27Å; L519-L523 WeakPolarHBondContact O-CG 3.5Å; L519-L523 PolarHBondContact O-N 3.17Å; L519-A566 HydrophobicContact CD2-CB 4.43Å; L519-R674 VanDerWaalsContact CD1-CZ 3.49Å
520	V	49.7	Very low	52.1	Low	74 Å²	74	45.4 Å²	45.4	45%	0.448	28%	0.276	S	S	.	.	H	α-helix	trans	-67.2	-36.4	174.1	173.4	0	0	0	0	112.1	P516 G518 L523 S524	P516-V520 VanDerWaalsContact O-CB 3.22Å; P516-V520 WeakPolarHBondContact O-CB 3.46Å; P516-V520 WeakPolarHBondContact O-CG2 3.31Å; P516-V520 PolarHBondContact O-N 3.02Å; P516-V520 VanDerWaalsContact O-N 3.12Å; G518-V520 PolarHBondContact O-N 3.09Å; V520-L523 CarbonylContact O-C 2.87Å; V520-L523 VanDerWaalsContact O-C 3.23Å; V520-L523 PolarHBondContact O-N 3.34Å; V520-S524 WeakPolarHBondContact O-CB 3.32Å; V520-S524 PolarHBondContact O-N 3.29Å; V520-S524 PolarHBondContact O-OG 2.9Å
521	K	45.1	Very low	54.7	Low	104 Å²	104	48 Å²	48	45%	0.452	28%	0.278	S	S	.	.	H	α-helix	trans	-64.4	-49.3	170	-80.5	161	-174.4	166.5	0	110.4	D512 T517 G518 L523 S524 S525	D512-K521 IonicContact OD2-NZ 3.88Å; D512-K521 PolarHBondContact OD2-NZ 3.37Å; D512-K521 VanDerWaalsContact OD2-NZ 3.15Å; T517-K521 HydrophobicContact CG2-CD 4.42Å; T517-K521 VanDerWaalsContact O-CB 3.22Å; T517-K521 WeakPolarHBondContact O-CB 3.32Å; T517-K521 WeakPolarHBondContact O-CD 3.32Å; T517-K521 WeakPolarHBondContact O-CG 3.5Å; T517-K521 PolarHBondContact O-N 3.07Å; G518-K521 CarbonylContact O-C 3.55Å; G518-K521 WeakPolarHBondContact O-CA 3.17Å; G518-K521 WeakPolarHBondContact O-CB 3.44Å; G518-K521 PolarHBondContact O-N 3.2Å; K521-L523 PolarHBondContact O-N 3.21Å; K521-L523 VanDerWaalsContact O-N 3.12Å; K521-S524 CarbonylContact O-C 3.55Å; K521-S524 WeakPolarHBondContact O-CA 3.42Å; K521-S524 PolarHBondContact O-N 3.38Å; K521-S525 WeakPolarHBondContact O-CA 3.35Å; K521-S525 WeakPolarHBondContact O-CB 3.49Å; K521-S525 PolarHBondContact O-N 3.09Å; K521-S525 PolarHBondContact O-OG 3.08Å
522	H	50.5	Low	57.1	Low	102 Å²	102	50.5 Å²	50.5	47%	0.472	29%	0.288	S	S	.	.	H	α-helix	trans	-56.6	-32.6	176.8	-169.2	-103.3	0	0	0	111.1	L513 G518 L519	L513-H522 HydrophobicContact CD2-CB 3.79Å; L513-H522 VanDerWaalsContact CD2-CG 3.47Å; G518-H522 PolarHBondContact O-N 3.03Å; L519-H522 PolarHBondContact O-N 2.9Å
523	L	51.4	Low	59.3	Low	43 Å²	43	49.4 Å²	49.4	23%	0.225	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	10.8	170.6	-61.4	176.3	0	0	0	115.5	L519 V520 K521 I529 A566 F567	L519-L523 HydrophobicContact CD2-CD1 3.64Å; L519-L523 HydrophobicContact CG-CD1 4.23Å; L519-L523 WeakPolarHBondContact O-CB 3.42Å; L519-L523 VanDerWaalsContact O-CG 3.27Å; L519-L523 WeakPolarHBondContact O-CG 3.5Å; L519-L523 PolarHBondContact O-N 3.17Å; V520-L523 CarbonylContact O-C 2.87Å; V520-L523 VanDerWaalsContact O-C 3.23Å; V520-L523 PolarHBondContact O-N 3.34Å; K521-L523 PolarHBondContact O-N 3.21Å; K521-L523 VanDerWaalsContact O-N 3.12Å; L523-I529 VanDerWaalsContact C-CD1 3.47Å; L523-A566 HydrophobicContact CD1-CB 3.77Å; L523-F567 HydrophobicContact CD1-CE2 4.12Å; L523-F567 HydrophobicContact CD1-CZ 4.19Å; L523-F567 HydrophobicContact CD2-CE2 4.34Å
524	S	41.1	Very low	61.1	Low	59 Å²	59	46.7 Å²	46.7	41%	0.413	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.1	-2.6	-176.4	-62.5	0	0	0	0	117	V520 K521 A526	V520-S524 WeakPolarHBondContact O-CB 3.32Å; V520-S524 PolarHBondContact O-N 3.29Å; V520-S524 PolarHBondContact O-OG 2.9Å; K521-S524 CarbonylContact O-C 3.55Å; K521-S524 WeakPolarHBondContact O-CA 3.42Å; K521-S524 PolarHBondContact O-N 3.38Å; S524-A526 CarbonylContact C-O 3.51Å; S524-A526 VanDerWaalsContact C-O 3.24Å
525	S	42.9	Very low	62.8	Low	63 Å²	63	49 Å²	49	44%	0.441	28%	0.282	S	S	.	.	S	Bend	trans	-100.3	-29.1	-174.1	67.1	0	0	0	0	111.8	K521 S527	K521-S525 WeakPolarHBondContact O-CA 3.35Å; K521-S525 WeakPolarHBondContact O-CB 3.49Å; K521-S525 PolarHBondContact O-N 3.09Å; K521-S525 PolarHBondContact O-OG 3.08Å; S525-S527 VanDerWaalsContact C-N 3.25Å; S525-S527 PolarHBondContact O-N 2.72Å
526	A	47.5	Very low	64.9	Low	24 Å²	24	48.7 Å²	48.7	20%	0.198	28%	0.28	C	S	.	.	S	Bend	trans	-55.9	101.8	134	0	0	0	0	0	106.7	S524 V528 I529	S524-A526 CarbonylContact C-O 3.51Å; S524-A526 VanDerWaalsContact C-O 3.24Å; A526-V528 CarbonylContact O-C 3.59Å; A526-V528 PolarHBondContact O-N 3.08Å; A526-I529 HydrophobicContact CB-CD1 4.21Å; A526-I529 HydrophobicContact CB-CG1 4.03Å
527	S	53.9	Low	67.3	Low	82 Å²	82	46.5 Å²	46.5	57%	0.573	26%	0.264	S	S	*	.	S	Bend	trans	-67.1	3.7	-171.7	67.7	0	0	0	0	114.4	S525	S525-S527 VanDerWaalsContact C-N 3.25Å; S525-S527 PolarHBondContact O-N 2.72Å
528	V	66	Low	69.6	Low	43 Å²	43	43 Å²	43	26%	0.261	24%	0.241	S	C	.	.	S	Bend	trans	-147.8	120.4	176.4	165.3	0	0	0	0	104.5	I246 A482 A526	I246-V528 HydrophobicContact CD1-CG1 3.67Å; I246-V528 HydrophobicContact CG1-CG1 3.94Å; I246-V528 HydrophobicContact CG1-CG2 4.38Å; A482-V528 HydrophobicContact CB-CB 3.58Å; A482-V528 HydrophobicContact CB-CG1 3.62Å; A482-V528 VanDerWaalsContact CB-O 3.28Å; A482-V528 WeakPolarHBondContact CB-O 3.28Å; A482-V528 PolarHBondContact N-O 3.07Å; A526-V528 CarbonylContact O-C 3.59Å; A526-V528 PolarHBondContact O-N 3.08Å
529	I	74.7	Confident	71.6	Confident	31 Å²	31	46.5 Å²	46.5	16%	0.159	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-119.9	133.6	170.2	-66.1	-134.7	0	0	0	108.4	P480 L523 A526 M531 V534	P480-I529 HydrophobicContact CB-CG2 4.16Å; L523-I529 VanDerWaalsContact C-CD1 3.47Å; A526-I529 HydrophobicContact CB-CD1 4.21Å; A526-I529 HydrophobicContact CB-CG1 4.03Å; I529-M531 PolarHBondContact O-N 3.13Å; I529-V534 HydrophobicContact CG2-CG2 3.93Å
530	S	87.3	Confident	73.6	Confident	9 Å²	9	45.5 Å²	45.5	6%	0.063	25%	0.253	C	S	.	.			trans	-82.3	99.9	175.7	-176.4	0	0	0	0	110.8	L90 P480 Q532 L533 V534	L90-S530 WeakPolarHBondContact O-CB 3.42Å; P480-S530 PolarHBondContact O-N 3.46Å; S530-Q532 PolarHBondContact O-N 3.38Å; S530-L533 WeakPolarHBondContact O-CA 3.46Å; S530-L533 WeakPolarHBondContact O-CB 3.05Å; S530-L533 PolarHBondContact O-N 2.94Å; S530-L533 PolarHBondContact OG-N 3.28Å; S530-V534 PolarHBondContact O-N 3.5Å
531	M	88.2	Confident	75.8	Confident	95 Å²	95	42 Å²	42	47%	0.468	23%	0.231	S	C	.	.	H	α-helix	trans	-59.6	-30.3	174.7	-167.6	56.1	56.2	0	0	112.2	I529 L533 V534 T535 F567	I529-M531 PolarHBondContact O-N 3.13Å; M531-L533 VanDerWaalsContact C-N 3.3Å; M531-L533 PolarHBondContact O-N 3.22Å; M531-V534 PolarHBondContact O-N 2.98Å; M531-V534 HydrophobicContact SD-CB 4.09Å; M531-V534 HydrophobicContact SD-CG1 4.19Å; M531-V534 HydrophobicContact SD-CG2 4.47Å; M531-T535 PolarHBondContact O-N 3.38Å; M531-T535 PolarHBondContact O-OG1 3.26Å; M531-F567 HydrophobicContact CE-CE1 3.73Å; M531-F567 HydrophobicContact CE-CZ 3.98Å; M531-F567 HydrophobicContact SD-CD1 4.4Å; M531-F567 HydrophobicContact SD-CE1 3.95Å; M531-F567 HydrophobicContact SD-CZ 4.36Å
532	Q	91.1	Very high	78.2	Confident	62 Å²	62	37.8 Å²	37.8	29%	0.29	21%	0.213	S	C	.	.	H	α-helix	trans	-63	-37.4	172.7	-65.3	179.3	21.5	0	0	111.8	L90 S249 S530 L536	L90-Q532 HydrophobicContact CD1-CB 4.08Å; L90-Q532 HydrophobicContact CD2-CB 4.27Å; S249-Q532 PolarHBondContact O-NE2 3.17Å; S530-Q532 PolarHBondContact O-N 3.38Å; Q532-L536 WeakPolarHBondContact O-CB 3.31Å; Q532-L536 PolarHBondContact O-N 2.88Å
533	L	92	Very high	80.3	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-76.8	-33.4	178.1	-169	54.4	0	0	0	112.1	E87 L90 T91 I478 S530 M531 L536 K537	E87-L533 HydrophobicContact CB-CD1 4.38Å; E87-L533 HydrophobicContact CB-CD2 4.07Å; E87-L533 HydrophobicContact CG-CD2 3.92Å; L90-L533 HydrophobicContact CB-CB 4.44Å; L90-L533 HydrophobicContact CB-CD2 4.43Å; L90-L533 HydrophobicContact CD1-CB 4Å; L90-L533 HydrophobicContact CD1-CD1 4.33Å; T91-L533 HydrophobicContact CG2-CD2 3.59Å; I478-L533 HydrophobicContact CG2-CD1 3.56Å; I478-L533 HydrophobicContact CG2-CD2 4.13Å; I478-L533 HydrophobicContact CG2-CG 3.73Å; S530-L533 WeakPolarHBondContact O-CA 3.46Å; S530-L533 WeakPolarHBondContact O-CB 3.05Å; S530-L533 PolarHBondContact O-N 2.94Å; S530-L533 PolarHBondContact OG-N 3.28Å; M531-L533 VanDerWaalsContact C-N 3.3Å; M531-L533 PolarHBondContact O-N 3.22Å; L533-L536 HydrophobicContact CD1-CD2 4.12Å; L533-L536 PolarHBondContact O-N 3.08Å; L533-K537 WeakPolarHBondContact O-CB 3.37Å; L533-K537 PolarHBondContact O-N 3.29Å
534	V	91.3	Very high	82.4	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-58	-53.7	167.1	175.9	0	0	0	0	110.2	P480 I529 S530 M531 L536 K537 H538 L563 F567	P480-V534 HydrophobicContact CB-CG2 3.61Å; P480-V534 HydrophobicContact CG-CG2 4.06Å; I529-V534 HydrophobicContact CG2-CG2 3.93Å; S530-V534 PolarHBondContact O-N 3.5Å; M531-V534 PolarHBondContact O-N 2.98Å; M531-V534 HydrophobicContact SD-CB 4.09Å; M531-V534 HydrophobicContact SD-CG1 4.19Å; M531-V534 HydrophobicContact SD-CG2 4.47Å; V534-L536 VanDerWaalsContact C-N 3.33Å; V534-L536 PolarHBondContact O-N 2.88Å; V534-K537 PolarHBondContact O-N 3.05Å; V534-H538 VanDerWaalsContact O-CB 3.24Å; V534-H538 WeakPolarHBondContact O-CB 3.5Å; V534-H538 PolarHBondContact O-N 3.45Å; V534-L563 HydrophobicContact CG1-CD2 4.08Å; V534-F567 HydrophobicContact CG1-CD2 3.68Å; V534-F567 HydrophobicContact CG1-CE2 3.58Å; V534-F567 HydrophobicContact CG1-CG 4.31Å; V534-F567 HydrophobicContact CG1-CZ 4.12Å
535	T	92.9	Very high	84.9	Confident	52 Å²	52	30.1 Å²	30.1	32%	0.319	17%	0.169	S	C	.	.	H	α-helix	trans	-58.5	-42.9	178.6	-54.6	0	0	0	0	112	V24 M531 Q539	V24-T535 HydrophobicContact CG1-CG2 4.48Å; M531-T535 PolarHBondContact O-N 3.38Å; M531-T535 PolarHBondContact O-OG1 3.26Å; T535-Q539 HydrophobicContact CG2-CG 4.43Å; T535-Q539 WeakPolarHBondContact O-CB 3.25Å; T535-Q539 WeakPolarHBondContact O-CG 3.32Å; T535-Q539 PolarHBondContact O-N 3Å
536	L	95.7	Very high	87.3	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-61.2	-49.6	176.3	179	63.2	0	0	0	111.8	V24 V27 I28 I86 Q532 L533 V534 H538 L540	V24-L536 HydrophobicContact CG1-CB 4.11Å; V24-L536 HydrophobicContact CG1-CD1 3.9Å; V24-L536 HydrophobicContact CG2-CB 4.32Å; V27-L536 HydrophobicContact CB-CD1 3.93Å; V27-L536 HydrophobicContact CG1-CD1 3.88Å; I28-L536 HydrophobicContact CD1-CD1 3.98Å; I86-L536 HydrophobicContact CD1-CD2 4.49Å; I86-L536 HydrophobicContact CG2-CD2 3.68Å; Q532-L536 WeakPolarHBondContact O-CB 3.31Å; Q532-L536 PolarHBondContact O-N 2.88Å; L533-L536 HydrophobicContact CD1-CD2 4.12Å; L533-L536 PolarHBondContact O-N 3.08Å; V534-L536 VanDerWaalsContact C-N 3.33Å; V534-L536 PolarHBondContact O-N 2.88Å; L536-H538 PolarHBondContact O-N 3.32Å; L536-L540 HydrophobicContact CD1-CD1 3.75Å; L536-L540 HydrophobicContact CD1-CG 4.04Å; L536-L540 HydrophobicContact CG-CD1 3.89Å; L536-L540 HydrophobicContact CG-CG 4.49Å; L536-L540 VanDerWaalsContact O-CB 3.28Å; L536-L540 WeakPolarHBondContact O-CB 3.45Å; L536-L540 VanDerWaalsContact O-CG 3.23Å; L536-L540 WeakPolarHBondContact O-CG 3.35Å; L536-L540 PolarHBondContact O-N 3.41Å
537	K	95.7	Very high	89.3	Confident	15 Å²	15	30.1 Å²	30.1	7%	0.065	16%	0.163	C	C	.	.	H	α-helix	trans	-60.8	-45.2	179.5	-170.8	-179.7	-170.2	-179.3	0	111.5	I475 A476 I478 P480 L533 V534 L540 L541 N559 L563	I475-K537 VanDerWaalsContact O-CE 3.23Å; I475-K537 WeakPolarHBondContact O-CE 3.45Å; A476-K537 WeakPolarHBondContact O-CE 3.35Å; A476-K537 PolarHBondContact O-NZ 3.14Å; I478-K537 HydrophobicContact CB-CD 4.01Å; I478-K537 HydrophobicContact CB-CG 4.23Å; I478-K537 HydrophobicContact CG2-CB 4.41Å; I478-K537 HydrophobicContact CG2-CD 4.32Å; I478-K537 WeakPolarHBondContact O-CE 3.45Å; I478-K537 PolarHBondContact O-NZ 2.95Å; P480-K537 HydrophobicContact CG-CD 4.49Å; L533-K537 WeakPolarHBondContact O-CB 3.37Å; L533-K537 PolarHBondContact O-N 3.29Å; V534-K537 PolarHBondContact O-N 3.05Å; K537-L540 PolarHBondContact O-N 3.09Å; K537-L541 HydrophobicContact CG-CD1 4.14Å; K537-L541 WeakPolarHBondContact O-CB 3.46Å; K537-L541 WeakPolarHBondContact O-CG 3.27Å; K537-L541 PolarHBondContact O-N 3.43Å; K537-N559 WeakPolarHBondContact CE-OD1 3.45Å; K537-N559 PolarHBondContact NZ-OD1 3.13Å; K537-L563 HydrophobicContact CD-CD1 4.38Å; K537-L563 HydrophobicContact CG-CD1 4.29Å
538	H	94.5	Very high	91.1	Very high	18 Å²	18	27.1 Å²	27.1	8%	0.083	15%	0.145	C	C	.	.	H	α-helix	trans	-62.6	-48.6	-179.5	-177.3	-150.3	0	0	0	112.5	V534 L536 L541 W542 L563 E564 F567 T569	V534-H538 VanDerWaalsContact O-CB 3.24Å; V534-H538 WeakPolarHBondContact O-CB 3.5Å; V534-H538 PolarHBondContact O-N 3.45Å; L536-H538 PolarHBondContact O-N 3.32Å; H538-L541 PolarHBondContact O-N 3.05Å; H538-W542 AromaticContact CD2-CD1 3.85Å; H538-W542 AromaticContact CD2-NE1 3.96Å; H538-W542 AromaticContact NE2-CD1 3.83Å; H538-W542 AromaticContact NE2-NE1 3.57Å; H538-W542 PolarHBondContact O-N 3.11Å; H538-L563 HydrophobicContact CB-CD1 4.14Å; H538-E564 IonicContact CD2-OE1 3.3Å; H538-E564 IonicContact CE1-OE1 2.67Å; H538-E564 PolarHBondContact CE1-OE1 3.02Å; H538-E564 IonicContact NE2-OE1 3.73Å; H538-E564 PolarHBondContact NE2-OE1 3.43Å; H538-F567 PolarHBondContact CE1-O 2.86Å; H538-T569 PolarHBondContact CE1-OG1 2.86Å
539	Q	95.9	Very high	92.3	Very high	74 Å²	74	25.3 Å²	25.3	35%	0.346	13%	0.134	S	C	.	.	H	α-helix	trans	-66.9	-36.2	175.8	-71.3	-178.7	-5.4	0	0	112.7	V24 I28 T535 W542 L543	V24-Q539 VanDerWaalsContact CG1-OE1 3.31Å; I28-Q539 HydrophobicContact CD1-CB 3.65Å; I28-Q539 HydrophobicContact CG1-CB 4.17Å; T535-Q539 HydrophobicContact CG2-CG 4.43Å; T535-Q539 WeakPolarHBondContact O-CB 3.25Å; T535-Q539 WeakPolarHBondContact O-CG 3.32Å; T535-Q539 PolarHBondContact O-N 3Å; Q539-W542 PolarHBondContact O-N 2.82Å; Q539-L543 WeakPolarHBondContact O-CB 3.36Å; Q539-L543 PolarHBondContact O-N 2.91Å
540	L	97.4	Very high	93.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-69	-36.6	175.4	-75.1	177.2	0	0	0	112.7	I28 M31 L83 I475 L536 K537 L543 C544	I28-L540 HydrophobicContact CD1-CD2 3.55Å; I28-L540 HydrophobicContact CD1-CG 3.62Å; M31-L540 HydrophobicContact CB-CD2 3.78Å; M31-L540 HydrophobicContact CG-CD2 3.68Å; L83-L540 HydrophobicContact CD2-CD1 3.87Å; I475-L540 HydrophobicContact CD1-CB 4.1Å; I475-L540 HydrophobicContact CD1-CD1 4.48Å; I475-L540 HydrophobicContact CG1-CB 4.28Å; I475-L540 HydrophobicContact CG1-CD1 4.2Å; I475-L540 HydrophobicContact CG2-CB 3.56Å; I475-L540 HydrophobicContact CG2-CD1 4.5Å; L536-L540 HydrophobicContact CD1-CD1 3.75Å; L536-L540 HydrophobicContact CD1-CG 4.04Å; L536-L540 HydrophobicContact CG-CD1 3.89Å; L536-L540 HydrophobicContact CG-CG 4.49Å; L536-L540 VanDerWaalsContact O-CB 3.28Å; L536-L540 WeakPolarHBondContact O-CB 3.45Å; L536-L540 VanDerWaalsContact O-CG 3.23Å; L536-L540 WeakPolarHBondContact O-CG 3.35Å; L536-L540 PolarHBondContact O-N 3.41Å; K537-L540 PolarHBondContact O-N 3.09Å; L540-L543 HydrophobicContact CD2-CD2 4.35Å; L540-L543 PolarHBondContact O-N 3.37Å; L540-C544 PolarHBondContact O-N 2.86Å; L540-C544 PolarHBondContact O-SG 3.31Å; L540-C544 VanDerWaalsContact O-SG 3.41Å
541	L	96	Very high	93.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-68	-38.6	173.7	-75.6	171	0	0	0	111.8	I475 A476 K537 H538 C544 F545 N559 L560 L563	I475-L541 HydrophobicContact CG2-CD2 3.9Å; I475-L541 HydrophobicContact CG2-CG 3.86Å; A476-L541 HydrophobicContact CB-CD2 4.48Å; K537-L541 HydrophobicContact CG-CD1 4.14Å; K537-L541 WeakPolarHBondContact O-CB 3.46Å; K537-L541 WeakPolarHBondContact O-CG 3.27Å; K537-L541 PolarHBondContact O-N 3.43Å; H538-L541 PolarHBondContact O-N 3.05Å; L541-C544 CarbonylContact O-C 3.6Å; L541-C544 PolarHBondContact O-N 3.16Å; L541-F545 PolarHBondContact O-N 3.23Å; L541-N559 HydrophobicContact CD1-CB 4.27Å; L541-L560 HydrophobicContact CB-CB 4.38Å; L541-L560 HydrophobicContact CB-CD1 3.92Å; L541-L563 HydrophobicContact CD1-CD1 3.74Å
542	W	95.4	Very high	93.6	Very high	17 Å²	17	23.4 Å²	23.4	6%	0.064	13%	0.126	C	C	.	.	H	α-helix	trans	-61.5	-40.9	169	-88.2	121.2	0	0	0	112.6	H538 Q539 C544 F545 D546 L560 E564 R572 L641 L645	H538-W542 AromaticContact CD2-CD1 3.85Å; H538-W542 AromaticContact CD2-NE1 3.96Å; H538-W542 AromaticContact NE2-CD1 3.83Å; H538-W542 AromaticContact NE2-NE1 3.57Å; H538-W542 PolarHBondContact O-N 3.11Å; Q539-W542 PolarHBondContact O-N 2.82Å; W542-C544 VanDerWaalsContact C-N 3.32Å; W542-C544 PolarHBondContact O-N 2.93Å; W542-F545 HydrophobicContact CE3-CB 4.07Å; W542-F545 HydrophobicContact CE3-CD1 4.06Å; W542-F545 HydrophobicContact CE3-CG 4.15Å; W542-F545 HydrophobicContact CZ3-CB 4.42Å; W542-F545 AromaticContact CZ3-CD1 3.77Å; W542-F545 HydrophobicContact CZ3-CD1 3.77Å; W542-F545 HydrophobicContact CZ3-CE1 4.19Å; W542-F545 HydrophobicContact CZ3-CG 4.01Å; W542-F545 WeakPolarHBondContact O-CB 3.46Å; W542-F545 PolarHBondContact O-N 3.03Å; W542-D546 PolarHBondContact O-N 2.87Å; W542-L560 HydrophobicContact CD2-CD1 4.16Å; W542-L560 HydrophobicContact CD2-CD2 4.11Å; W542-L560 HydrophobicContact CE3-CD2 4.08Å; W542-L560 HydrophobicContact CG-CD1 4.13Å; W542-L560 HydrophobicContact CH2-CD2 4.41Å; W542-L560 HydrophobicContact CZ2-CD1 4.49Å; W542-L560 HydrophobicContact CZ2-CD2 4.45Å; W542-L560 HydrophobicContact CZ3-CD2 4.23Å; W542-E564 HydrophobicContact CZ2-CG 3.91Å; W542-E564 PolarHBondContact NE1-OE1 2.96Å; W542-R572 HydrophobicContact CD2-CG 4.47Å; W542-R572 HydrophobicContact CH2-CG 3.68Å; W542-R572 HydrophobicContact CZ2-CG 3.54Å; W542-R572 HydrophobicContact CZ3-CG 4.19Å; W542-L641 HydrophobicContact CH2-CD1 4.34Å; W542-L641 HydrophobicContact CH2-CD2 4.34Å; W542-L641 HydrophobicContact CZ2-CD2 4.03Å; W542-L645 HydrophobicContact CH2-CD1 4.39Å; W542-L645 HydrophobicContact CH2-CD2 4.48Å; W542-L645 HydrophobicContact CZ2-CD1 4.38Å
543	L	95.2	Very high	93.9	Very high	5 Å²	5	21.1 Å²	21.1	3%	0.026	12%	0.115	C	C	.	.	H	α-helix	trans	-63.9	-36.6	174.4	-172.3	69.9	0	0	0	111.9	I28 M31 R32 F35 F42 Q539 L540 A547	I28-L543 HydrophobicContact CG2-CD2 4.34Å; M31-L543 HydrophobicContact CB-CD2 3.89Å; R32-L543 HydrophobicContact CB-CD1 4.4Å; R32-L543 HydrophobicContact CB-CD2 4.39Å; R32-L543 HydrophobicContact CG-CD1 4.5Å; F35-L543 HydrophobicContact CD2-CD2 3.84Å; F35-L543 HydrophobicContact CD2-CG 3.87Å; F35-L543 HydrophobicContact CE2-CD2 3.77Å; F35-L543 HydrophobicContact CE2-CG 3.86Å; F42-L543 HydrophobicContact CE1-CD1 3.65Å; F42-L543 HydrophobicContact CE1-CG 4.42Å; F42-L543 HydrophobicContact CE2-CD1 4.41Å; F42-L543 HydrophobicContact CZ-CD1 3.6Å; F42-L543 HydrophobicContact CZ-CG 4.21Å; Q539-L543 WeakPolarHBondContact O-CB 3.36Å; Q539-L543 PolarHBondContact O-N 2.91Å; L540-L543 HydrophobicContact CD2-CD2 4.35Å; L540-L543 PolarHBondContact O-N 3.37Å; L543-A547 WeakPolarHBondContact O-CB 3.27Å; L543-A547 PolarHBondContact O-N 3.5Å
544	C	95.5	Very high	94.1	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-69.4	-32.9	172.2	-74.8	0	0	0	0	113.3	A472 I475 L540 L541 W542 G548 C549 L550	A472-C544 HydrophobicContact CB-CB 4.16Å; I475-C544 VanDerWaalsContact CD1-SG 3.55Å; L540-C544 PolarHBondContact O-N 2.86Å; L540-C544 PolarHBondContact O-SG 3.31Å; L540-C544 VanDerWaalsContact O-SG 3.41Å; L541-C544 CarbonylContact O-C 3.6Å; L541-C544 PolarHBondContact O-N 3.16Å; W542-C544 VanDerWaalsContact C-N 3.32Å; W542-C544 PolarHBondContact O-N 2.93Å; C544-G548 PolarHBondContact O-N 3.09Å; C544-C549 HydrophobicContact CB-CB 4.13Å; C544-C549 WeakPolarHBondContact O-CB 3.32Å; C544-C549 PolarHBondContact O-N 3.13Å; C544-L550 HydrophobicContact CB-CD2 4.06Å; C544-L550 HydrophobicContact CB-CG 4.05Å; C544-L550 PolarHBondContact O-N 3.09Å
545	F	93.9	Very high	94.1	Very high	37 Å²	37	22.2 Å²	22.2	16%	0.162	12%	0.121	C	C	.	.	H	α-helix	trans	-64.7	-52.1	172.1	-175.8	-87.3	0	0	0	110.4	L541 W542 A547 G548 L550 L557 L560 Y576 L645	L541-F545 PolarHBondContact O-N 3.23Å; W542-F545 HydrophobicContact CE3-CB 4.07Å; W542-F545 HydrophobicContact CE3-CD1 4.06Å; W542-F545 HydrophobicContact CE3-CG 4.15Å; W542-F545 HydrophobicContact CZ3-CB 4.42Å; W542-F545 AromaticContact CZ3-CD1 3.77Å; W542-F545 HydrophobicContact CZ3-CD1 3.77Å; W542-F545 HydrophobicContact CZ3-CE1 4.19Å; W542-F545 HydrophobicContact CZ3-CG 4.01Å; W542-F545 WeakPolarHBondContact O-CB 3.46Å; W542-F545 PolarHBondContact O-N 3.03Å; F545-A547 PolarHBondContact O-N 3.32Å; F545-G548 WeakPolarHBondContact O-CA 3.43Å; F545-G548 PolarHBondContact O-N 3.46Å; F545-L550 HydrophobicContact CB-CD1 4.05Å; F545-L550 HydrophobicContact CD2-CD1 4.47Å; F545-L557 HydrophobicContact CD2-CD2 3.87Å; F545-L557 HydrophobicContact CE2-CD2 3.99Å; F545-L560 HydrophobicContact CB-CD2 4.08Å; F545-L560 HydrophobicContact CD2-CD2 4.29Å; F545-L560 HydrophobicContact CG-CD2 4.41Å; F545-Y576 HydrophobicContact CE1-CD2 4.04Å; F545-Y576 HydrophobicContact CE1-CE2 4.35Å; F545-Y576 HydrophobicContact CE2-CD2 4.27Å; F545-Y576 AromaticContact CE2-CE2 3.83Å; F545-Y576 HydrophobicContact CE2-CE2 3.83Å; F545-Y576 AromaticContact CZ-CD2 3.57Å; F545-Y576 HydrophobicContact CZ-CD2 3.57Å; F545-Y576 AromaticContact CZ-CE2 3.44Å; F545-Y576 HydrophobicContact CZ-CE2 3.44Å; F545-Y576 VanDerWaalsContact CZ-CE2 3.44Å; F545-L645 HydrophobicContact CD2-CD2 4.45Å; F545-L645 HydrophobicContact CE2-CD2 4.2Å
546	D	92.2	Very high	94.2	Very high	72 Å²	72	19.7 Å²	19.7	39%	0.385	11%	0.105	S	C	.	.	H	α-helix	trans	-64.8	-28.2	-179.7	-67.8	-4	0	0	0	112.5	F42 W542 G548 R572	F42-D546 HydrophobicContact CD1-CB 4.14Å; F42-D546 HydrophobicContact CE1-CB 4.11Å; W542-D546 PolarHBondContact O-N 2.87Å; D546-G548 VanDerWaalsContact C-N 3.26Å; D546-G548 PolarHBondContact O-N 3.32Å; D546-R572 IonicContact OD1-CZ 3.19Å; D546-R572 IonicContact OD1-NH2 3.77Å; D546-R572 PolarHBondContact OD1-NH2 3.25Å; D546-R572 IonicContact OD2-CZ 2.94Å; D546-R572 IonicContact OD2-NH1 2.8Å; D546-R572 IonicContact OD2-NH2 3.49Å; D546-R572 PolarHBondContact OD2-NH2 3.37Å
547	A	90.9	Very high	94.2	Very high	15 Å²	15	19.8 Å²	19.8	12%	0.124	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-4.6	172.1	0	0	0	0	0	114.2	F35 V40 F42 L543 F545 C549	F35-A547 HydrophobicContact CD2-CB 4.29Å; F35-A547 HydrophobicContact CG-CB 4.49Å; V40-A547 HydrophobicContact CG1-CB 3.75Å; V40-A547 HydrophobicContact CG2-CB 4.29Å; F42-A547 HydrophobicContact CE1-CB 3.98Å; F42-A547 HydrophobicContact CZ-CB 4.06Å; L543-A547 WeakPolarHBondContact O-CB 3.27Å; L543-A547 PolarHBondContact O-N 3.5Å; F545-A547 PolarHBondContact O-N 3.32Å; A547-C549 PolarHBondContact O-N 3.17Å
548	G	90.8	Very high	94.2	Very high	20 Å²	20	19.4 Å²	19.4	21%	0.206	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	2.3	-175.7	0	0	0	0	0	115	C544 F545 D546 L550 S551	C544-G548 PolarHBondContact O-N 3.09Å; F545-G548 WeakPolarHBondContact O-CA 3.43Å; F545-G548 PolarHBondContact O-N 3.46Å; D546-G548 VanDerWaalsContact C-N 3.26Å; D546-G548 PolarHBondContact O-N 3.32Å; G548-L550 PolarHBondContact O-N 2.83Å; G548-S551 VanDerWaalsContact O-CB 3.25Å; G548-S551 WeakPolarHBondContact O-CB 3.48Å; G548-S551 PolarHBondContact O-N 3.02Å; G548-S551 VanDerWaalsContact O-N 3.08Å; G548-S551 PolarHBondContact O-OG 2.9Å
549	C	91.9	Very high	94.2	Very high	4 Å²	4	20.5 Å²	20.5	3%	0.027	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-23.4	-176.9	-58	0	0	0	0	113.4	A472 C544 A547	A472-C549 HydrophobicContact CB-CB 4.02Å; C544-C549 HydrophobicContact CB-CB 4.13Å; C544-C549 WeakPolarHBondContact O-CB 3.32Å; C544-C549 PolarHBondContact O-N 3.13Å; A547-C549 PolarHBondContact O-N 3.17Å
550	L	93.9	Very high	94.1	Very high	1 Å²	1	17 Å²	17	1%	0.005	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-4.3	176.7	-54.7	-171.6	0	0	0	113.9	A472 C544 F545 G548 R552 Y553 L557 L560	A472-L550 HydrophobicContact CB-CD2 3.93Å; C544-L550 HydrophobicContact CB-CD2 4.06Å; C544-L550 HydrophobicContact CB-CG 4.05Å; C544-L550 PolarHBondContact O-N 3.09Å; F545-L550 HydrophobicContact CB-CD1 4.05Å; F545-L550 HydrophobicContact CD2-CD1 4.47Å; G548-L550 PolarHBondContact O-N 2.83Å; L550-R552 PolarHBondContact O-N 3.35Å; L550-Y553 HydrophobicContact CD2-CD1 4.05Å; L550-Y553 PolarHBondContact O-N 2.95Å; L550-Y553 VanDerWaalsContact O-N 3.12Å; L550-L557 HydrophobicContact CB-CD2 3.81Å; L550-L557 HydrophobicContact CB-CG 4.14Å; L550-L557 HydrophobicContact CD1-CD2 4.22Å; L550-L560 HydrophobicContact CD1-CD2 4.13Å
551	S	91	Very high	93.8	Very high	51 Å²	51	17 Å²	17	36%	0.357	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-15.6	-175.3	63.3	0	0	0	0	115.2	G548	G548-S551 VanDerWaalsContact O-CB 3.25Å; G548-S551 WeakPolarHBondContact O-CB 3.48Å; G548-S551 PolarHBondContact O-N 3.02Å; G548-S551 VanDerWaalsContact O-N 3.08Å; G548-S551 PolarHBondContact O-OG 2.9Å
552	R	93.4	Very high	93.5	Very high	44 Å²	44	18.6 Å²	18.6	17%	0.166	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.6	40.5	174.6	-59.1	-171.2	-176.4	-168.3	0.1	111.3	N58 M469 L550 Y656 Y657	N58-R552 PolarHBondContact OD1-NH2 2.8Å; M469-R552 HydrophobicContact CE-CB 4Å; M469-R552 WeakPolarHBondContact CE-O 3.36Å; L550-R552 PolarHBondContact O-N 3.35Å; R552-Y656 HydrophobicContact CG-CD1 4.2Å; R552-Y656 HydrophobicContact CG-CD2 4.08Å; R552-Y656 HydrophobicContact CG-CE1 3.97Å; R552-Y656 HydrophobicContact CG-CE2 3.82Å; R552-Y656 HydrophobicContact CG-CG 4.25Å; R552-Y656 VanDerWaalsContact CZ-CE1 3.43Å; R552-Y657 PolarHBondContact O-OH 2.93Å
553	Y	96.3	Very high	93.3	Very high	14 Å²	14	18.5 Å²	18.5	6%	0.055	10%	0.104	C	C	.	.			trans	-144.1	86.5	179.7	-170.1	-164	0	0	0	111.3	L375 V462 A472 A473 A476 L550 L555 G556 L557	L375-Y553 HydrophobicContact CD1-CE2 4.32Å; V462-Y553 HydrophobicContact CB-CD2 4.33Å; V462-Y553 HydrophobicContact CG1-CD2 3.76Å; V462-Y553 HydrophobicContact CG1-CE2 4.27Å; V462-Y553 HydrophobicContact CG1-CG 4.31Å; V462-Y553 HydrophobicContact CG2-CD2 4.09Å; A472-Y553 HydrophobicContact CB-CD1 4.4Å; A473-Y553 HydrophobicContact CB-CE1 4.13Å; A476-Y553 HydrophobicContact CB-CE1 4.28Å; L550-Y553 HydrophobicContact CD2-CD1 4.05Å; L550-Y553 PolarHBondContact O-N 2.95Å; L550-Y553 VanDerWaalsContact O-N 3.12Å; Y553-L555 VanDerWaalsContact C-N 3.32Å; Y553-L555 HydrophobicContact CD2-CB 4.23Å; Y553-L555 HydrophobicContact CE2-CB 3.81Å; Y553-L555 HydrophobicContact CE2-CD1 4.45Å; Y553-L555 HydrophobicContact CE2-CG 4.48Å; Y553-L555 PolarHBondContact O-N 2.82Å; Y553-G556 PolarHBondContact O-N 2.98Å; Y553-G556 VanDerWaalsContact O-N 3.09Å; Y553-L557 PolarHBondContact O-N 3.14Å
554	P	95.8	Very high	93.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-53.5	-46.5	-177.8	-25.5	33.2	0	0	0	112.9	G556 L557 T558 A649 V652 N653 Y657 P664	P554-G556 VanDerWaalsContact C-N 3.29Å; P554-G556 PolarHBondContact O-N 3.03Å; P554-L557 WeakPolarHBondContact O-CA 3.47Å; P554-L557 WeakPolarHBondContact O-CB 3.35Å; P554-L557 PolarHBondContact O-N 3.16Å; P554-T558 PolarHBondContact O-N 2.91Å; P554-A649 HydrophobicContact CB-CB 4.48Å; P554-V652 HydrophobicContact CG-CB 4.43Å; P554-V652 HydrophobicContact CG-CG1 3.87Å; P554-N653 HydrophobicContact CG-CB 4.38Å; P554-Y657 HydrophobicContact CG-CD2 3.97Å; P554-Y657 HydrophobicContact CG-CE2 4.01Å; P554-P664 HydrophobicContact CB-CG 3.73Å
555	L	92.8	Very high	92.7	Very high	26 Å²	26	19.4 Å²	19.4	14%	0.136	11%	0.109	C	C	.	.	H	α-helix	trans	-66.5	-28.6	-179.3	-51.7	174.8	0	0	0	113.1	S376 E377 Y553 T558 N559 Y663	S376-L555 WeakPolarHBondContact O-CD1 3.25Å; E377-L555 HydrophobicContact CG-CD1 4.34Å; E377-L555 HydrophobicContact CG-CD2 4.26Å; Y553-L555 VanDerWaalsContact C-N 3.32Å; Y553-L555 HydrophobicContact CD2-CB 4.23Å; Y553-L555 HydrophobicContact CE2-CB 3.81Å; Y553-L555 HydrophobicContact CE2-CD1 4.45Å; Y553-L555 HydrophobicContact CE2-CG 4.48Å; Y553-L555 PolarHBondContact O-N 2.82Å; L555-T558 WeakPolarHBondContact CA-OG1 3.23Å; L555-T558 PolarHBondContact O-OG1 3.05Å; L555-T558 VanDerWaalsContact O-OG1 3.08Å; L555-N559 WeakPolarHBondContact O-CB 3.41Å; L555-N559 PolarHBondContact O-N 2.93Å; L555-N559 VanDerWaalsContact O-N 3.07Å; L555-Y663 HydrophobicContact CD2-CD2 3.89Å; L555-Y663 HydrophobicContact CD2-CG 4.31Å
556	G	95.1	Very high	92.3	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-71.6	-30.9	171.9	0	0	0	0	0	112.8	Y553 P554 L560	Y553-G556 PolarHBondContact O-N 2.98Å; Y553-G556 VanDerWaalsContact O-N 3.09Å; P554-G556 VanDerWaalsContact C-N 3.29Å; P554-G556 PolarHBondContact O-N 3.03Å; G556-L560 PolarHBondContact O-N 2.76Å
557	L	95.6	Very high	92.1	Very high	2 Å²	2	18.1 Å²	18.1	1%	0.01	11%	0.106	C	C	.	.	H	α-helix	trans	-76.6	-40.6	173.9	-67.8	170.4	0	0	0	112.1	F545 L550 Y553 P554 L560 G561 L645 R648 A649 V652	F545-L557 HydrophobicContact CD2-CD2 3.87Å; F545-L557 HydrophobicContact CE2-CD2 3.99Å; L550-L557 HydrophobicContact CB-CD2 3.81Å; L550-L557 HydrophobicContact CB-CG 4.14Å; L550-L557 HydrophobicContact CD1-CD2 4.22Å; Y553-L557 PolarHBondContact O-N 3.14Å; P554-L557 WeakPolarHBondContact O-CA 3.47Å; P554-L557 WeakPolarHBondContact O-CB 3.35Å; P554-L557 PolarHBondContact O-N 3.16Å; L557-L560 PolarHBondContact O-N 3.38Å; L557-G561 PolarHBondContact O-N 3.32Å; L557-L645 HydrophobicContact CD2-CD2 4.5Å; L557-R648 HydrophobicContact CD1-CG 4.06Å; L557-A649 HydrophobicContact CB-CB 3.81Å; L557-A649 HydrophobicContact CD1-CB 4.42Å; L557-V652 HydrophobicContact CD1-CB 4.41Å; L557-V652 HydrophobicContact CD1-CG2 3.92Å
558	T	94.6	Very high	91.9	Very high	7 Å²	7	19.2 Å²	19.2	4%	0.043	11%	0.112	C	C	.	.	H	α-helix	trans	-63.3	-42.9	174	60.1	0	0	0	0	111.2	P554 L555 L560 G561 D562 Y646 A649 P664 C667	P554-T558 PolarHBondContact O-N 2.91Å; L555-T558 WeakPolarHBondContact CA-OG1 3.23Å; L555-T558 PolarHBondContact O-OG1 3.05Å; L555-T558 VanDerWaalsContact O-OG1 3.08Å; T558-L560 VanDerWaalsContact C-N 3.28Å; T558-L560 PolarHBondContact O-N 3.06Å; T558-G561 CarbonylContact O-C 3.42Å; T558-G561 WeakPolarHBondContact O-CA 3.2Å; T558-G561 PolarHBondContact O-N 3.33Å; T558-D562 VanDerWaalsContact O-CG 3.31Å; T558-D562 PolarHBondContact O-N 3.06Å; T558-Y646 HydrophobicContact CG2-CD1 4.2Å; T558-A649 HydrophobicContact CG2-CB 3.87Å; T558-P664 HydrophobicContact CG2-CB 4.48Å; T558-C667 HydrophobicContact CG2-CB 4.08Å
559	N	94.1	Very high	91.6	Very high	41 Å²	41	20.8 Å²	20.8	22%	0.219	12%	0.117	C	C	.	.	H	α-helix	trans	-63.8	-32.1	178	-147.6	-106.3	0	0	0	113	K537 L541 L555 L563	K537-N559 WeakPolarHBondContact CE-OD1 3.45Å; K537-N559 PolarHBondContact NZ-OD1 3.13Å; L541-N559 HydrophobicContact CD1-CB 4.27Å; L555-N559 WeakPolarHBondContact O-CB 3.41Å; L555-N559 PolarHBondContact O-N 2.93Å; L555-N559 VanDerWaalsContact O-N 3.07Å; N559-L563 WeakPolarHBondContact O-CD1 3.46Å; N559-L563 WeakPolarHBondContact O-CG 3.25Å; N559-L563 PolarHBondContact O-N 2.96Å
560	L	93.9	Very high	90.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-73	-37.6	171.3	-176.8	56.1	0	0	0	111.7	L541 W542 F545 L550 G556 L557 T558 L563 E564 L645	L541-L560 HydrophobicContact CB-CB 4.38Å; L541-L560 HydrophobicContact CB-CD1 3.92Å; W542-L560 HydrophobicContact CD2-CD1 4.16Å; W542-L560 HydrophobicContact CD2-CD2 4.11Å; W542-L560 HydrophobicContact CE3-CD2 4.08Å; W542-L560 HydrophobicContact CG-CD1 4.13Å; W542-L560 HydrophobicContact CH2-CD2 4.41Å; W542-L560 HydrophobicContact CZ2-CD1 4.49Å; W542-L560 HydrophobicContact CZ2-CD2 4.45Å; W542-L560 HydrophobicContact CZ3-CD2 4.23Å; F545-L560 HydrophobicContact CB-CD2 4.08Å; F545-L560 HydrophobicContact CD2-CD2 4.29Å; F545-L560 HydrophobicContact CG-CD2 4.41Å; L550-L560 HydrophobicContact CD1-CD2 4.13Å; G556-L560 PolarHBondContact O-N 2.76Å; L557-L560 PolarHBondContact O-N 3.38Å; T558-L560 VanDerWaalsContact C-N 3.28Å; T558-L560 PolarHBondContact O-N 3.06Å; L560-L563 PolarHBondContact O-N 3.24Å; L560-E564 PolarHBondContact O-N 3.03Å; L560-L645 HydrophobicContact CD2-CD1 4.49Å; L560-L645 HydrophobicContact CD2-CD2 4.13Å; L560-L645 HydrophobicContact CG-CD1 4.02Å; L560-L645 HydrophobicContact CG-CD2 4.46Å
561	G	91.9	Very high	90.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.8	-44.6	172.7	0	0	0	0	0	113.1	L557 T558 L563 E564 D565	L557-G561 PolarHBondContact O-N 3.32Å; T558-G561 CarbonylContact O-C 3.42Å; T558-G561 WeakPolarHBondContact O-CA 3.2Å; T558-G561 PolarHBondContact O-N 3.33Å; G561-L563 VanDerWaalsContact C-N 3.29Å; G561-L563 PolarHBondContact O-N 3.03Å; G561-E564 PolarHBondContact O-N 2.76Å; G561-D565 WeakPolarHBondContact O-CB 3.35Å; G561-D565 PolarHBondContact O-N 3.1Å
562	D	89.8	Confident	89.9	Confident	34 Å²	34	29.4 Å²	29.4	18%	0.182	16%	0.162	C	C	.	.	H	α-helix	trans	-61.5	-37.4	176.1	-64	-34.9	0	0	0	112.1	T558 A566 Y646	T558-D562 VanDerWaalsContact O-CG 3.31Å; T558-D562 PolarHBondContact O-N 3.06Å; D562-A566 WeakPolarHBondContact O-CB 3.48Å; D562-A566 PolarHBondContact O-N 2.76Å; D562-A566 VanDerWaalsContact O-N 3.1Å; D562-Y646 WeakPolarHBondContact CA-OH 3.43Å; D562-Y646 PolarHBondContact N-OH 3.28Å; D562-Y646 PolarHBondContact OD1-OH 2.83Å
563	L	91	Very high	89.4	Confident	16 Å²	16	28.2 Å²	28.2	8%	0.084	16%	0.158	C	C	.	.	H	α-helix	trans	-74.6	-35.2	177.1	-71.4	169.3	0	0	0	112.5	V534 K537 H538 L541 N559 L560 G561 F567	V534-L563 HydrophobicContact CG1-CD2 4.08Å; K537-L563 HydrophobicContact CD-CD1 4.38Å; K537-L563 HydrophobicContact CG-CD1 4.29Å; H538-L563 HydrophobicContact CB-CD1 4.14Å; L541-L563 HydrophobicContact CD1-CD1 3.74Å; N559-L563 WeakPolarHBondContact O-CD1 3.46Å; N559-L563 WeakPolarHBondContact O-CG 3.25Å; N559-L563 PolarHBondContact O-N 2.96Å; L560-L563 PolarHBondContact O-N 3.24Å; G561-L563 VanDerWaalsContact C-N 3.29Å; G561-L563 PolarHBondContact O-N 3.03Å; L563-F567 HydrophobicContact CD2-CD2 4.23Å; L563-F567 CarbonylContact O-C 3.57Å; L563-F567 WeakPolarHBondContact O-CA 3.49Å; L563-F567 WeakPolarHBondContact O-CB 3.18Å; L563-F567 PolarHBondContact O-N 2.59Å
564	E	90.8	Very high	88.4	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-70.6	-34.4	171.1	-77.1	-62.3	138.9	0	0	112.8	H538 W542 L560 G561 P568 T569 L641 A642 L645	H538-E564 IonicContact CD2-OE1 3.3Å; H538-E564 IonicContact CE1-OE1 2.67Å; H538-E564 PolarHBondContact CE1-OE1 3.02Å; H538-E564 IonicContact NE2-OE1 3.73Å; H538-E564 PolarHBondContact NE2-OE1 3.43Å; W542-E564 HydrophobicContact CZ2-CG 3.91Å; W542-E564 PolarHBondContact NE1-OE1 2.96Å; L560-E564 PolarHBondContact O-N 3.03Å; G561-E564 PolarHBondContact O-N 2.76Å; E564-P568 VanDerWaalsContact O-CA 3.3Å; E564-P568 WeakPolarHBondContact O-CA 3.42Å; E564-P568 WeakPolarHBondContact O-CB 3.3Å; E564-P568 WeakPolarHBondContact O-CD 3.34Å; E564-P568 WeakPolarHBondContact O-CG 3.42Å; E564-T569 VanDerWaalsContact OE1-CB 3.32Å; E564-T569 WeakPolarHBondContact OE1-CB 3.49Å; E564-T569 PolarHBondContact OE1-OG1 2.91Å; E564-T569 PolarHBondContact OE2-N 3.16Å; E564-L641 HydrophobicContact CG-CD2 4.33Å; E564-L641 HydrophobicContact CG-CG 4.47Å; E564-A642 HydrophobicContact CB-CB 4.37Å; E564-L645 HydrophobicContact CB-CD1 4.24Å; E564-L645 HydrophobicContact CG-CD1 3.85Å
565	D	86.9	Confident	87.7	Confident	23 Å²	23	32.7 Å²	32.7	12%	0.123	19%	0.191	C	C	.	.	H	α-helix	trans	-65.2	-42.9	174.6	-168.4	23.7	0	0	0	111.2	G561 A642 C671 R674 H675	G561-D565 WeakPolarHBondContact O-CB 3.35Å; G561-D565 PolarHBondContact O-N 3.1Å; D565-A642 HydrophobicContact CB-CB 4.01Å; D565-C671 PolarHBondContact OD2-SG 3.48Å; D565-R674 IonicContact OD2-CZ 3.39Å; D565-R674 VanDerWaalsContact OD2-CZ 3.26Å; D565-R674 IonicContact OD2-NE 2.69Å; D565-R674 PolarHBondContact OD2-NE 3.13Å; D565-R674 IonicContact OD2-NH2 3.97Å; D565-R674 PolarHBondContact OD2-NH2 3.34Å; D565-H675 IonicContact OD1-CD2 2.76Å; D565-H675 IonicContact OD1-CE1 3.74Å; D565-H675 PolarHBondContact OD1-CE1 3.24Å; D565-H675 IonicContact OD1-NE2 3.85Å; D565-H675 PolarHBondContact OD1-NE2 3.36Å; D565-H675 IonicContact OD2-NE2 2.68Å
566	A	85.4	Confident	87.2	Confident	32 Å²	32	31.7 Å²	31.7	26%	0.264	19%	0.186	S	C	.	.	H	α-helix	trans	-80.3	-38.4	179.9	0	0	0	0	0	114.2	L519 L523 D562	L519-A566 HydrophobicContact CD2-CB 4.43Å; L523-A566 HydrophobicContact CD1-CB 3.77Å; D562-A566 WeakPolarHBondContact O-CB 3.48Å; D562-A566 PolarHBondContact O-N 2.76Å; D562-A566 VanDerWaalsContact O-N 3.1Å
567	F	87.5	Confident	86.3	Confident	50 Å²	50	32.6 Å²	32.6	22%	0.219	19%	0.19	C	C	.	.	S	Bend	trans	-137.3	67.7	-170.8	-52.1	-75.8	0	0	0	112.4	L523 M531 V534 H538 L563	L523-F567 HydrophobicContact CD1-CE2 4.12Å; L523-F567 HydrophobicContact CD1-CZ 4.19Å; L523-F567 HydrophobicContact CD2-CE2 4.34Å; M531-F567 HydrophobicContact CE-CE1 3.73Å; M531-F567 HydrophobicContact CE-CZ 3.98Å; M531-F567 HydrophobicContact SD-CD1 4.4Å; M531-F567 HydrophobicContact SD-CE1 3.95Å; M531-F567 HydrophobicContact SD-CZ 4.36Å; V534-F567 HydrophobicContact CG1-CD2 3.68Å; V534-F567 HydrophobicContact CG1-CE2 3.58Å; V534-F567 HydrophobicContact CG1-CG 4.31Å; V534-F567 HydrophobicContact CG1-CZ 4.12Å; H538-F567 PolarHBondContact CE1-O 2.86Å; L563-F567 HydrophobicContact CD2-CD2 4.23Å; L563-F567 CarbonylContact O-C 3.57Å; L563-F567 WeakPolarHBondContact O-CA 3.49Å; L563-F567 WeakPolarHBondContact O-CB 3.18Å; L563-F567 PolarHBondContact O-N 2.59Å
568	P	86.7	Confident	85.4	Confident	39 Å²	39	37.6 Å²	37.6	25%	0.253	22%	0.217	S	C	.	.			trans	-66	140.7	-166.2	-16.6	24.7	0	0	0	116.6	E564 T638	E564-P568 VanDerWaalsContact O-CA 3.3Å; E564-P568 WeakPolarHBondContact O-CA 3.42Å; E564-P568 WeakPolarHBondContact O-CB 3.3Å; E564-P568 WeakPolarHBondContact O-CD 3.34Å; E564-P568 WeakPolarHBondContact O-CG 3.42Å; P568-T638 HydrophobicContact CB-CG2 3.27Å; P568-T638 HydrophobicContact CG-CG2 3.74Å
569	T	85.4	Confident	84.3	Confident	52 Å²	52	39.3 Å²	39.3	32%	0.319	23%	0.229	S	C	.	.			trans	-91.4	102.2	175	-52.6	0	0	0	0	111.1	H538 E564 G571 R572	H538-T569 PolarHBondContact CE1-OG1 2.86Å; E564-T569 VanDerWaalsContact OE1-CB 3.32Å; E564-T569 WeakPolarHBondContact OE1-CB 3.49Å; E564-T569 PolarHBondContact OE1-OG1 2.91Å; E564-T569 PolarHBondContact OE2-N 3.16Å; T569-G571 PolarHBondContact O-N 2.86Å; T569-R572 HydrophobicContact CG2-CB 3.85Å; T569-R572 HydrophobicContact CG2-CG 4.31Å; T569-R572 VanDerWaalsContact O-CB 3.31Å; T569-R572 WeakPolarHBondContact O-CB 3.45Å; T569-R572 PolarHBondContact O-N 3.18Å
570	M	77.8	Confident	83.2	Confident	150 Å²	150	38 Å²	38	74%	0.739	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	132.3	-179.4	-65.8	-68.9	167.8	0	0	112.8	R572 T638	M570-R572 PolarHBondContact O-N 3.27Å; M570-T638 HydrophobicContact CE-CG2 4.12Å; M570-T638 HydrophobicContact SD-CG2 4.33Å
571	G	78.1	Confident	81.6	Confident	39 Å²	39	42.1 Å²	42.1	40%	0.402	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.7	-4.7	177.7	0	0	0	0	0	115.7	T569 L573 A574 E637	T569-G571 PolarHBondContact O-N 2.86Å; G571-L573 VanDerWaalsContact C-N 3.26Å; G571-L573 PolarHBondContact O-N 3.45Å; G571-A574 PolarHBondContact O-N 2.94Å; G571-E637 WeakPolarHBondContact CA-OE1 3.29Å; G571-E637 PolarHBondContact N-OE1 3Å
572	R	85.6	Confident	79.8	Confident	49 Å²	49	43.6 Å²	43.6	19%	0.185	25%	0.252	C	S	.	.	H	α-helix	trans	-69.4	-22.7	-177.5	-168.3	64	175.6	-171.1	2.8	112.9	W542 D546 T569 M570 A574 T575 Y576 L641	W542-R572 HydrophobicContact CD2-CG 4.47Å; W542-R572 HydrophobicContact CH2-CG 3.68Å; W542-R572 HydrophobicContact CZ2-CG 3.54Å; W542-R572 HydrophobicContact CZ3-CG 4.19Å; D546-R572 IonicContact OD1-CZ 3.19Å; D546-R572 IonicContact OD1-NH2 3.77Å; D546-R572 PolarHBondContact OD1-NH2 3.25Å; D546-R572 IonicContact OD2-CZ 2.94Å; D546-R572 IonicContact OD2-NH1 2.8Å; D546-R572 IonicContact OD2-NH2 3.49Å; D546-R572 PolarHBondContact OD2-NH2 3.37Å; T569-R572 HydrophobicContact CG2-CB 3.85Å; T569-R572 HydrophobicContact CG2-CG 4.31Å; T569-R572 VanDerWaalsContact O-CB 3.31Å; T569-R572 WeakPolarHBondContact O-CB 3.45Å; T569-R572 PolarHBondContact O-N 3.18Å; M570-R572 PolarHBondContact O-N 3.27Å; R572-A574 PolarHBondContact O-N 3.23Å; R572-T575 PolarHBondContact O-N 2.56Å; R572-Y576 WeakPolarHBondContact O-CB 3.49Å; R572-Y576 PolarHBondContact O-N 2.92Å; R572-L641 HydrophobicContact CB-CD2 3.76Å; R572-L641 HydrophobicContact CG-CD2 4.06Å
573	L	81.2	Confident	78	Confident	18 Å²	18	43.3 Å²	43.3	9%	0.094	25%	0.252	C	S	.	.	H	α-helix	trans	-60.2	-44	177.6	-178.8	62.4	0	0	0	112.1	G571 T575 Y576 L577 E637 L641	G571-L573 VanDerWaalsContact C-N 3.26Å; G571-L573 PolarHBondContact O-N 3.45Å; L573-T575 VanDerWaalsContact C-N 3.32Å; L573-T575 PolarHBondContact O-N 3.35Å; L573-Y576 WeakPolarHBondContact O-CB 3.43Å; L573-Y576 PolarHBondContact O-N 3.41Å; L573-L577 HydrophobicContact CD1-CD1 4.1Å; L573-L577 HydrophobicContact CD1-CG 4.07Å; L573-L577 HydrophobicContact CG-CD1 3.99Å; L573-L577 HydrophobicContact CG-CG 4.36Å; L573-L577 WeakPolarHBondContact O-CG 3.29Å; L573-L577 PolarHBondContact O-N 2.98Å; L573-E637 HydrophobicContact CB-CG 4.05Å; L573-E637 HydrophobicContact CD2-CG 3.66Å; L573-L641 HydrophobicContact CB-CB 4.34Å; L573-L641 HydrophobicContact CD1-CB 4.11Å; L573-L641 HydrophobicContact CD1-CD1 4.04Å
574	A	75.4	Confident	76.1	Confident	35 Å²	35	43.9 Å²	43.9	29%	0.289	26%	0.256	S	S	.	.	H	α-helix	trans	-61.4	-41.2	177.7	0	0	0	0	0	111.8	G571 R572 N578 L627	G571-A574 PolarHBondContact O-N 2.94Å; R572-A574 PolarHBondContact O-N 3.23Å; A574-N578 WeakPolarHBondContact O-CB 3.44Å; A574-N578 PolarHBondContact O-N 3.48Å; A574-N578 VanDerWaalsContact O-N 3.09Å; A574-N578 PolarHBondContact O-ND2 2.98Å; A574-L627 HydrophobicContact CB-CD2 4.5Å
575	T	81.3	Confident	73.6	Confident	74 Å²	74	51.8 Å²	51.8	45%	0.454	29%	0.291	S	S	.	.	H	α-helix	trans	-66.2	-41.6	176	-52.3	0	0	0	0	111.7	R572 L573 N578 S579	R572-T575 PolarHBondContact O-N 2.56Å; L573-T575 VanDerWaalsContact C-N 3.32Å; L573-T575 PolarHBondContact O-N 3.35Å; T575-N578 PolarHBondContact O-N 2.86Å; T575-S579 PolarHBondContact O-N 2.97Å
576	Y	82.4	Confident	71.5	Confident	5 Å²	5	54.6 Å²	54.6	2%	0.02	31%	0.309	C	S	.	.	H	α-helix	trans	-60.9	-50.9	176.6	176.2	-89.4	0	0	0	112.1	F545 R572 L573 N578 S579 L580 L641 A644 L645 R648	F545-Y576 HydrophobicContact CE1-CD2 4.04Å; F545-Y576 HydrophobicContact CE1-CE2 4.35Å; F545-Y576 HydrophobicContact CE2-CD2 4.27Å; F545-Y576 AromaticContact CE2-CE2 3.83Å; F545-Y576 HydrophobicContact CE2-CE2 3.83Å; F545-Y576 AromaticContact CZ-CD2 3.57Å; F545-Y576 HydrophobicContact CZ-CD2 3.57Å; F545-Y576 AromaticContact CZ-CE2 3.44Å; F545-Y576 HydrophobicContact CZ-CE2 3.44Å; F545-Y576 VanDerWaalsContact CZ-CE2 3.44Å; R572-Y576 WeakPolarHBondContact O-CB 3.49Å; R572-Y576 PolarHBondContact O-N 2.92Å; L573-Y576 WeakPolarHBondContact O-CB 3.43Å; L573-Y576 PolarHBondContact O-N 3.41Å; Y576-N578 PolarHBondContact O-N 3.26Å; Y576-S579 WeakPolarHBondContact O-CB 3.18Å; Y576-S579 PolarHBondContact O-N 3.4Å; Y576-S579 VanDerWaalsContact O-N 3.12Å; Y576-L580 HydrophobicContact CD1-CD1 4.12Å; Y576-L580 HydrophobicContact CD1-CG 4.48Å; Y576-L580 HydrophobicContact CE1-CD1 3.44Å; Y576-L580 VanDerWaalsContact CE1-CD1 3.44Å; Y576-L580 HydrophobicContact CE1-CG 4.06Å; Y576-L580 PolarHBondContact O-N 2.69Å; Y576-L641 HydrophobicContact CD1-CD1 4.16Å; Y576-L641 HydrophobicContact CD2-CD1 4.17Å; Y576-L641 HydrophobicContact CG-CD1 3.83Å; Y576-A644 HydrophobicContact CD1-CB 4.37Å; Y576-A644 HydrophobicContact CE1-CB 3.67Å; Y576-A644 PolarHBondContact OH-O 3.13Å; Y576-L645 HydrophobicContact CD2-CD2 4.38Å; Y576-L645 HydrophobicContact CE2-CD2 3.79Å; Y576-L645 HydrophobicContact CE2-CG 4.44Å; Y576-R648 WeakPolarHBondContact OH-CB 3.42Å
577	L	77.6	Confident	69.3	Low	18 Å²	18	56.1 Å²	56.1	9%	0.094	31%	0.312	C	S	.	.	H	α-helix	trans	-63.1	-39.3	179	-66.7	174.4	0	0	0	112.3	L573 S579 L580 H581 L598 L601	L573-L577 HydrophobicContact CD1-CD1 4.1Å; L573-L577 HydrophobicContact CD1-CG 4.07Å; L573-L577 HydrophobicContact CG-CD1 3.99Å; L573-L577 HydrophobicContact CG-CG 4.36Å; L573-L577 WeakPolarHBondContact O-CG 3.29Å; L573-L577 PolarHBondContact O-N 2.98Å; L577-S579 VanDerWaalsContact C-N 3.31Å; L577-S579 PolarHBondContact O-N 3.22Å; L577-L580 PolarHBondContact O-N 3.37Å; L577-H581 PolarHBondContact O-CD2 3.07Å; L577-H581 VanDerWaalsContact O-CD2 3.31Å; L577-H581 PolarHBondContact O-N 2.9Å; L577-L598 HydrophobicContact CD2-CD2 4.12Å; L577-L601 HydrophobicContact CD2-CD1 3.97Å
578	N	75.1	Confident	66.7	Low	107 Å²	107	61.2 Å²	61.2	57%	0.572	34%	0.341	S	S	*	.	H	α-helix	trans	-62.4	-37.4	173.9	-80.5	-55.5	0	0	0	112.4	A574 T575 Y576 H581 S582	A574-N578 WeakPolarHBondContact O-CB 3.44Å; A574-N578 PolarHBondContact O-N 3.48Å; A574-N578 VanDerWaalsContact O-N 3.09Å; A574-N578 PolarHBondContact O-ND2 2.98Å; T575-N578 PolarHBondContact O-N 2.86Å; Y576-N578 PolarHBondContact O-N 3.26Å; N578-H581 PolarHBondContact O-N 2.94Å; N578-S582 PolarHBondContact O-N 2.78Å
579	S	72.9	Confident	64.6	Low	43 Å²	43	67 Å²	67	30%	0.301	36%	0.363	S	S	.	.	H	α-helix	trans	-63.5	-46.9	175	-169.5	0	0	0	0	111.8	T575 Y576 L577 S582 S583	T575-S579 PolarHBondContact O-N 2.97Å; Y576-S579 WeakPolarHBondContact O-CB 3.18Å; Y576-S579 PolarHBondContact O-N 3.4Å; Y576-S579 VanDerWaalsContact O-N 3.12Å; L577-S579 VanDerWaalsContact C-N 3.31Å; L577-S579 PolarHBondContact O-N 3.22Å; S579-S582 PolarHBondContact O-N 3.19Å; S579-S583 PolarHBondContact O-N 3.35Å
580	L	69.5	Low	62.5	Low	14 Å²	14	65.9 Å²	65.9	7%	0.073	36%	0.356	C	S	.	.	H	α-helix	trans	-57.6	-51.3	173.7	-65.9	-177	0	0	0	111.6	Y576 L577 S582 S583 V584 L594	Y576-L580 HydrophobicContact CD1-CD1 4.12Å; Y576-L580 HydrophobicContact CD1-CG 4.48Å; Y576-L580 HydrophobicContact CE1-CD1 3.44Å; Y576-L580 VanDerWaalsContact CE1-CD1 3.44Å; Y576-L580 HydrophobicContact CE1-CG 4.06Å; Y576-L580 PolarHBondContact O-N 2.69Å; L577-L580 PolarHBondContact O-N 3.37Å; L580-S582 VanDerWaalsContact C-N 3.26Å; L580-S582 PolarHBondContact O-N 3.04Å; L580-S583 WeakPolarHBondContact O-CA 3.38Å; L580-S583 VanDerWaalsContact O-CB 3.28Å; L580-S583 WeakPolarHBondContact O-CB 2.99Å; L580-S583 PolarHBondContact O-N 3.41Å; L580-V584 WeakPolarHBondContact O-CG2 3.38Å; L580-V584 PolarHBondContact O-N 2.99Å; L580-L594 HydrophobicContact CB-CD2 4.05Å; L580-L594 HydrophobicContact CD2-CD2 3.8Å; L580-L594 HydrophobicContact CG-CD2 4.42Å
581	H	60.9	Low	60.6	Low	87 Å²	87	60.6 Å²	60.6	40%	0.403	33%	0.332	S	S	.	.	H	α-helix	trans	-57.3	-34.2	-178.9	-89.9	-68.8	0	0	0	114.1	L577 N578 K585 L598	L577-H581 PolarHBondContact O-CD2 3.07Å; L577-H581 VanDerWaalsContact O-CD2 3.31Å; L577-H581 PolarHBondContact O-N 2.9Å; N578-H581 PolarHBondContact O-N 2.94Å; H581-K585 WeakPolarHBondContact O-CG 3.4Å; H581-K585 PolarHBondContact O-N 2.95Å; H581-L598 VanDerWaalsContact CE1-CD1 3.42Å; H581-L598 WeakPolarHBondContact CE1-CD1 3.22Å
582	S	54.1	Low	58.9	Low	31 Å²	31	63.3 Å²	63.3	22%	0.217	34%	0.338	C	S	.	.	H	α-helix	trans	-86.5	-17.5	175.6	-167.6	0	0	0	0	113.6	M49 N578 S579 L580 T586	M49-S582 VanDerWaalsContact SD-CB 3.57Å; N578-S582 PolarHBondContact O-N 2.78Å; S579-S582 PolarHBondContact O-N 3.19Å; L580-S582 VanDerWaalsContact C-N 3.26Å; L580-S582 PolarHBondContact O-N 3.04Å; S582-T586 PolarHBondContact O-OG1 2.7Å
583	S	52.2	Low	57.1	Low	27 Å²	27	63.4 Å²	63.4	19%	0.189	34%	0.342	C	S	.	.	H	α-helix	trans	-65.2	-47.4	164.7	-170.2	0	0	0	0	110.3	S579 L580 K585 T586 N587	S579-S583 PolarHBondContact O-N 3.35Å; L580-S583 WeakPolarHBondContact O-CA 3.38Å; L580-S583 VanDerWaalsContact O-CB 3.28Å; L580-S583 WeakPolarHBondContact O-CB 2.99Å; L580-S583 PolarHBondContact O-N 3.41Å; S583-K585 VanDerWaalsContact C-N 3.29Å; S583-K585 PolarHBondContact O-N 3.49Å; S583-T586 PolarHBondContact O-N 3.39Å; S583-T586 PolarHBondContact O-OG1 2.95Å; S583-N587 PolarHBondContact O-N 3.4Å
584	V	50.7	Low	55.5	Low	28 Å²	28	63 Å²	63	17%	0.17	34%	0.34	C	S	.	.	H	α-helix	trans	-53.4	-43.9	174.5	179	0	0	0	0	111.9	L580 T586 T591 L594	L580-V584 WeakPolarHBondContact O-CG2 3.38Å; L580-V584 PolarHBondContact O-N 2.99Å; V584-T586 PolarHBondContact O-N 2.99Å; V584-T586 VanDerWaalsContact O-N 3.17Å; V584-T591 HydrophobicContact CG1-CG2 3.99Å; V584-L594 HydrophobicContact CG2-CB 3.42Å; V584-L594 VanDerWaalsContact CG2-CB 3.42Å; V584-L594 HydrophobicContact CG2-CD2 3.87Å; V584-L594 HydrophobicContact CG2-CG 4.12Å
585	K	38.7	Very low	54.1	Low	166 Å²	166	64.2 Å²	64.2	72%	0.722	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-11	178.3	-71.9	177.2	-179.7	177.6	0	115	H581 S583	H581-K585 WeakPolarHBondContact O-CG 3.4Å; H581-K585 PolarHBondContact O-N 2.95Å; S583-K585 VanDerWaalsContact C-N 3.29Å; S583-K585 PolarHBondContact O-N 3.49Å
586	T	43.3	Very low	52.7	Low	83 Å²	83	64.4 Å²	64.4	51%	0.509	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-25.2	179.6	59.9	0	0	0	0	113.7	S582 S583 V584	S582-T586 PolarHBondContact O-OG1 2.7Å; S583-T586 PolarHBondContact O-N 3.39Å; S583-T586 PolarHBondContact O-OG1 2.95Å; V584-T586 PolarHBondContact O-N 2.99Å; V584-T586 VanDerWaalsContact O-N 3.17Å
587	N	37.9	Very low	51.2	Low	63 Å²	63	64.6 Å²	64.6	34%	0.337	34%	0.343	S	S	.	.			trans	-110.9	83.1	174.1	-77.6	-62.5	0	0	0	111.6	S583 K589 C590	S583-N587 PolarHBondContact O-N 3.4Å; N587-K589 PolarHBondContact O-N 2.79Å; N587-C590 HydrophobicContact CB-CB 4.39Å; N587-C590 PolarHBondContact O-N 3.02Å
588	L	34.2	Very low	49.8	Very low	157 Å²	157	65.5 Å²	65.5	82%	0.822	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-5.7	170.1	-81.2	156.2	0	0	0	114.8
589	K	43.1	Very low	48.4	Very low	162 Å²	162	64.4 Å²	64.4	70%	0.704	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-4.1	178.9	-137.3	-178	-175.7	-173.6	0	114.6	N587	N587-K589 PolarHBondContact O-N 2.79Å
590	C	41.1	Very low	47.3	Very low	27 Å²	27	64.6 Å²	64.6	18%	0.182	34%	0.341	C	S	.	.	S	Bend	trans	-124.9	18.3	176.5	-61.9	0	0	0	0	111.9	N587 N592 L594	N587-C590 HydrophobicContact CB-CB 4.39Å; N587-C590 PolarHBondContact O-N 3.02Å; C590-N592 VanDerWaalsContact C-N 3.34Å; C590-N592 PolarHBondContact O-N 2.56Å; C590-L594 HydrophobicContact CB-CD1 3.95Å; C590-L594 WeakPolarHBondContact O-CD1 3.46Å
591	T	37.3	Very low	46.3	Very low	39 Å²	39	64.9 Å²	64.9	24%	0.239	34%	0.343	C	S	.	.	H	α-helix	trans	-61.4	-43.5	-173.7	45.4	0	0	0	0	112.2	V584 T595	V584-T591 HydrophobicContact CG1-CG2 3.99Å; T591-T595 PolarHBondContact O-N 3.31Å; T591-T595 PolarHBondContact O-OG1 2.83Å; T591-T595 VanDerWaalsContact O-OG1 3.1Å
592	N	43.2	Very low	45.3	Very low	96 Å²	96	63.8 Å²	63.8	51%	0.513	34%	0.342	S	S	.	.	H	α-helix	trans	-71	-41.4	-168.6	-59.7	8.6	0	0	0	111.2	C590 T595 N596	C590-N592 VanDerWaalsContact C-N 3.34Å; C590-N592 PolarHBondContact O-N 2.56Å; N592-T595 VanDerWaalsContact C-OG1 3.32Å; N592-T595 VanDerWaalsContact CA-OG1 3.31Å; N592-T595 WeakPolarHBondContact CA-OG1 3.38Å; N592-T595 PolarHBondContact O-N 3.18Å; N592-T595 PolarHBondContact O-OG1 3.39Å; N592-N596 VanDerWaalsContact O-CG 3.3Å; N592-N596 PolarHBondContact O-N 3.34Å; N592-N596 PolarHBondContact O-ND2 2.72Å
593	D	46.7	Very low	44.6	Very low	52 Å²	52	66 Å²	66	28%	0.278	35%	0.351	S	S	.	.	H	α-helix	trans	-69.8	-35.6	-178.6	-44.2	-50.9	0	0	0	112	N596 E597	D593-N596 WeakPolarHBondContact O-CA 3.33Å; D593-N596 WeakPolarHBondContact O-CB 3.34Å; D593-N596 PolarHBondContact O-N 2.93Å; D593-E597 PolarHBondContact O-N 2.82Å
594	L	47.8	Very low	44.2	Very low	9 Å²	9	67.6 Å²	67.6	5%	0.047	36%	0.356	C	S	.	.	H	α-helix	trans	-78.3	-26.8	174.3	-81.8	107.7	0	0	0	113.3	L580 V584 C590 E597 L598	L580-L594 HydrophobicContact CB-CD2 4.05Å; L580-L594 HydrophobicContact CD2-CD2 3.8Å; L580-L594 HydrophobicContact CG-CD2 4.42Å; V584-L594 HydrophobicContact CG2-CB 3.42Å; V584-L594 VanDerWaalsContact CG2-CB 3.42Å; V584-L594 HydrophobicContact CG2-CD2 3.87Å; V584-L594 HydrophobicContact CG2-CG 4.12Å; C590-L594 HydrophobicContact CB-CD1 3.95Å; C590-L594 WeakPolarHBondContact O-CD1 3.46Å; L594-E597 PolarHBondContact O-N 3.44Å; L594-L598 PolarHBondContact O-N 3.02Å
595	T	46.6	Very low	43.4	Very low	61 Å²	61	67.7 Å²	67.7	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-65.4	-31.2	162.7	40.2	0	0	0	0	111.4	T591 N592 L598 N599	T591-T595 PolarHBondContact O-N 3.31Å; T591-T595 PolarHBondContact O-OG1 2.83Å; T591-T595 VanDerWaalsContact O-OG1 3.1Å; N592-T595 VanDerWaalsContact C-OG1 3.32Å; N592-T595 VanDerWaalsContact CA-OG1 3.31Å; N592-T595 WeakPolarHBondContact CA-OG1 3.38Å; N592-T595 PolarHBondContact O-N 3.18Å; N592-T595 PolarHBondContact O-OG1 3.39Å; T595-L598 PolarHBondContact O-N 3.4Å; T595-N599 WeakPolarHBondContact O-CB 3.49Å; T595-N599 PolarHBondContact O-N 3.06Å; T595-N599 PolarHBondContact O-ND2 3.26Å; T595-N599 PolarHBondContact O-OD1 2.94Å
596	N	50.5	Low	43	Very low	77 Å²	77	63.9 Å²	63.9	41%	0.412	35%	0.345	S	S	.	.	H	α-helix	trans	-70.1	-34.6	173.3	-66.5	-19.6	0	0	0	112.5	N592 D593 L598 N599 V600	N592-N596 VanDerWaalsContact O-CG 3.3Å; N592-N596 PolarHBondContact O-N 3.34Å; N592-N596 PolarHBondContact O-ND2 2.72Å; D593-N596 WeakPolarHBondContact O-CA 3.33Å; D593-N596 WeakPolarHBondContact O-CB 3.34Å; D593-N596 PolarHBondContact O-N 2.93Å; N596-L598 VanDerWaalsContact C-N 3.33Å; N596-L598 PolarHBondContact O-N 3.38Å; N596-N599 PolarHBondContact O-N 3.28Å; N596-V600 VanDerWaalsContact O-CB 3.32Å; N596-V600 WeakPolarHBondContact O-CB 3.41Å; N596-V600 VanDerWaalsContact O-CG2 3.22Å; N596-V600 WeakPolarHBondContact O-CG2 3.32Å; N596-V600 PolarHBondContact O-N 2.8Å
597	E	50.9	Low	42.4	Very low	10 Å²	10	68.2 Å²	68.2	5%	0.047	35%	0.353	C	S	.	.	H	α-helix	trans	-57	-46.8	168.7	-71.7	-168	107.1	0	0	112	D593 L594 L601 R648 L651	D593-E597 PolarHBondContact O-N 2.82Å; L594-E597 PolarHBondContact O-N 3.44Å; E597-L601 WeakPolarHBondContact O-CG 3.37Å; E597-L601 PolarHBondContact O-N 2.84Å; E597-R648 WeakPolarHBondContact OE1-CD 3.49Å; E597-R648 IonicContact OE1-NH1 2.76Å; E597-R648 IonicContact OE2-CZ 3.15Å; E597-R648 IonicContact OE2-NH1 3.81Å; E597-R648 PolarHBondContact OE2-NH1 2.68Å; E597-L651 HydrophobicContact CG-CD1 3.15Å
598	L	50.1	Low	42.1	Very low	36 Å²	36	70.5 Å²	70.5	19%	0.188	38%	0.375	C	S	.	.	H	α-helix	trans	-66.5	-43.3	179.4	-70.2	163.9	0	0	0	111.8	L577 H581 L594 T595 N596 L601 V602	L577-L598 HydrophobicContact CD2-CD2 4.12Å; H581-L598 VanDerWaalsContact CE1-CD1 3.42Å; H581-L598 WeakPolarHBondContact CE1-CD1 3.22Å; L594-L598 PolarHBondContact O-N 3.02Å; T595-L598 PolarHBondContact O-N 3.4Å; N596-L598 VanDerWaalsContact C-N 3.33Å; N596-L598 PolarHBondContact O-N 3.38Å; L598-L601 PolarHBondContact O-N 2.99Å; L598-V602 WeakPolarHBondContact O-CG2 3.4Å; L598-V602 PolarHBondContact O-N 3.39Å; L598-V602 VanDerWaalsContact O-N 3.14Å
599	N	44.2	Very low	41.9	Very low	85 Å²	85	67.5 Å²	67.5	46%	0.455	37%	0.367	S	S	.	.	H	α-helix	trans	-67.4	-39.5	179.1	-66.8	-16.2	0	0	0	111.9	T595 N596 L601 V602 D603	T595-N599 WeakPolarHBondContact O-CB 3.49Å; T595-N599 PolarHBondContact O-N 3.06Å; T595-N599 PolarHBondContact O-ND2 3.26Å; T595-N599 PolarHBondContact O-OD1 2.94Å; N596-N599 PolarHBondContact O-N 3.28Å; N599-L601 VanDerWaalsContact C-N 3.34Å; N599-L601 PolarHBondContact O-N 2.79Å; N599-V602 WeakPolarHBondContact O-CB 3.3Å; N599-V602 PolarHBondContact O-N 2.77Å; N599-V602 VanDerWaalsContact O-N 3.11Å; N599-D603 PolarHBondContact O-N 3.08Å
600	V	50.8	Low	41.1	Very low	47 Å²	47	63.9 Å²	63.9	29%	0.285	36%	0.362	S	S	.	.	H	α-helix	trans	-64.2	-38.3	176	167.9	0	0	0	0	111.5	N596 V602 D603 Q604	N596-V600 VanDerWaalsContact O-CB 3.32Å; N596-V600 WeakPolarHBondContact O-CB 3.41Å; N596-V600 VanDerWaalsContact O-CG2 3.22Å; N596-V600 WeakPolarHBondContact O-CG2 3.32Å; N596-V600 PolarHBondContact O-N 2.8Å; V600-V602 VanDerWaalsContact C-N 3.28Å; V600-V602 PolarHBondContact O-N 3.26Å; V600-D603 PolarHBondContact O-N 3.45Å; V600-Q604 HydrophobicContact CG1-CG 4.35Å; V600-Q604 WeakPolarHBondContact O-CB 3.43Å; V600-Q604 VanDerWaalsContact O-CG 3.29Å; V600-Q604 WeakPolarHBondContact O-CG 3.45Å; V600-Q604 PolarHBondContact O-N 3.48Å
601	L	47.5	Very low	40.6	Very low	19 Å²	19	68.4 Å²	68.4	10%	0.099	39%	0.388	C	S	.	.	H	α-helix	trans	-66.2	-28.9	173.4	-72.3	168.6	0	0	0	112.9	L577 E597 L598 N599 A644	L577-L601 HydrophobicContact CD2-CD1 3.97Å; E597-L601 WeakPolarHBondContact O-CG 3.37Å; E597-L601 PolarHBondContact O-N 2.84Å; L598-L601 PolarHBondContact O-N 2.99Å; N599-L601 VanDerWaalsContact C-N 3.34Å; N599-L601 PolarHBondContact O-N 2.79Å; L601-A644 HydrophobicContact CD1-CB 4.17Å; L601-A644 HydrophobicContact CD2-CB 4.16Å
602	V	40.5	Very low	40.2	Very low	64 Å²	64	70.4 Å²	70.4	39%	0.388	40%	0.404	S	S	.	.	H	α-helix	trans	-75.9	-50.9	172.7	170.3	0	0	0	0	110.9	L598 N599 V600 Q604 S605 N606	L598-V602 WeakPolarHBondContact O-CG2 3.4Å; L598-V602 PolarHBondContact O-N 3.39Å; L598-V602 VanDerWaalsContact O-N 3.14Å; N599-V602 WeakPolarHBondContact O-CB 3.3Å; N599-V602 PolarHBondContact O-N 2.77Å; N599-V602 VanDerWaalsContact O-N 3.11Å; V600-V602 VanDerWaalsContact C-N 3.28Å; V600-V602 PolarHBondContact O-N 3.26Å; V602-Q604 PolarHBondContact O-N 2.89Å; V602-S605 WeakPolarHBondContact O-CB 3.47Å; V602-S605 PolarHBondContact O-N 3Å; V602-S605 PolarHBondContact O-OG 3.08Å; V602-N606 PolarHBondContact O-N 2.87Å; V602-N606 PolarHBondContact O-ND2 3.07Å
603	D	40.4	Very low	39.7	Very low	78 Å²	78	71.7 Å²	71.7	42%	0.417	42%	0.418	S	S	.	.	H	α-helix	trans	-61.5	-40.3	-177.5	-78.4	-16.4	0	0	0	112.4	N599 V600 S605 N606 Y607	N599-D603 PolarHBondContact O-N 3.08Å; V600-D603 PolarHBondContact O-N 3.45Å; D603-S605 PolarHBondContact O-N 3.03Å; D603-S605 VanDerWaalsContact O-N 3.13Å; D603-N606 PolarHBondContact O-N 3.22Å; D603-Y607 WeakPolarHBondContact O-CD2 3.28Å; D603-Y607 PolarHBondContact O-N 2.81Å
604	Q	43.4	Very low	39	Very low	60 Å²	60	74.7 Å²	74.7	28%	0.28	44%	0.442	S	S	.	.	H	α-helix	trans	-60.3	-22	174.7	-74.3	-179.8	7.5	0	0	113.2	V600 V602	V600-Q604 HydrophobicContact CG1-CG 4.35Å; V600-Q604 WeakPolarHBondContact O-CB 3.43Å; V600-Q604 VanDerWaalsContact O-CG 3.29Å; V600-Q604 WeakPolarHBondContact O-CG 3.45Å; V600-Q604 PolarHBondContact O-N 3.48Å; V602-Q604 PolarHBondContact O-N 2.89Å
605	S	32.9	Very low	38.2	Very low	31 Å²	31	78.5 Å²	78.5	22%	0.217	47%	0.466	C	S	.	.	H	α-helix	trans	-87.2	-13.1	173	75.3	0	0	0	0	114.5	V602 D603	V602-S605 WeakPolarHBondContact O-CB 3.47Å; V602-S605 PolarHBondContact O-N 3Å; V602-S605 PolarHBondContact O-OG 3.08Å; D603-S605 PolarHBondContact O-N 3.03Å; D603-S605 VanDerWaalsContact O-N 3.13Å
606	N	30.2	Very low	37.4	Very low	85 Å²	85	82.2 Å²	82.2	46%	0.455	49%	0.489	S	S	.	.	H	α-helix	trans	-96.8	-13.5	-176.6	-72.1	-37.6	0	0	0	114.3	V602 D603 S608 S609	V602-N606 PolarHBondContact O-N 2.87Å; V602-N606 PolarHBondContact O-ND2 3.07Å; D603-N606 PolarHBondContact O-N 3.22Å; N606-S608 PolarHBondContact O-N 2.62Å; N606-S609 PolarHBondContact O-N 2.79Å
607	Y	31.4	Very low	36.4	Very low	174 Å²	174	83.6 Å²	83.6	68%	0.682	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	56.4	176	-88.8	-86.7	0	0	0	113.4	D603	D603-Y607 WeakPolarHBondContact O-CD2 3.28Å; D603-Y607 PolarHBondContact O-N 2.81Å
608	S	30.9	Very low	35.4	Very low	112 Å²	112	89.1 Å²	89.1	78%	0.783	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149.5	7.9	169.5	-73.4	0	0	0	0	113.7	N606	N606-S608 PolarHBondContact O-N 2.62Å
609	S	30.6	Very low	34.3	Very low	94 Å²	94	92 Å²	92	66%	0.657	56%	0.559	S	S	*	*	S	Bend	trans	-148.7	137	168.4	72.1	0	0	0	0	112.4	N606 V611	N606-S609 PolarHBondContact O-N 2.79Å; S609-V611 PolarHBondContact O-N 3.23Å
610	S	26.4	Very low	33.5	Very low	85 Å²	85	95.3 Å²	95.3	59%	0.594	57%	0.574	S	S	*	*			trans	-88.1	94	-179.6	64.4	0	0	0	0	111.4
611	V	30.6	Very low	32.5	Very low	122 Å²	122	98.4 Å²	98.4	74%	0.739	59%	0.593	S	S	*	*			trans	-132.9	114.4	170.6	-175.3	0	0	0	0	109.6	S609	S609-V611 PolarHBondContact O-N 3.23Å
612	S	28.6	Very low	31.5	Very low	81 Å²	81	105.3 Å²	105.3	57%	0.566	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-76.6	129.5	173.8	-49	0	0	0	0	110.3	S614	S612-S614 PolarHBondContact O-N 3.26Å
613	P	33.8	Very low	31.1	Very low	124 Å²	124	107.1 Å²	107.1	81%	0.805	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-69.1	120.7	169.2	-14.2	29	0	0	0	109.8
614	S	31	Very low	30.5	Very low	114 Å²	114	112.6 Å²	112.6	80%	0.797	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-80.4	148.4	172.9	45.3	0	0	0	0	111.6	S612 T616	S612-S614 PolarHBondContact O-N 3.26Å; S614-T616 PolarHBondContact O-N 3.12Å
615	T	31.5	Very low	29.7	Very low	89 Å²	89	117 Å²	117	55%	0.546	69%	0.691	S	S	.	*	P	Polyproline II helix	trans	-65.7	125.3	-167.6	-32.6	0	0	0	0	113.1
616	T	30.2	Very low	29.5	Very low	140 Å²	140	123 Å²	123	86%	0.859	71%	0.713	S	S	*	*			trans	-145.8	116.3	155.8	-63.5	0	0	0	0	108.4	S614	S614-T616 PolarHBondContact O-N 3.12Å
617	T	29.2	Very low	29.6	Very low	106 Å²	106	124.3 Å²	124.3	65%	0.65	72%	0.719	S	S	*	*			trans	-95.2	151.6	-170	-29.3	0	0	0	0	111.7
618	T	28.4	Very low	29.7	Very low	125 Å²	125	120.1 Å²	120.1	77%	0.767	72%	0.716	S	S	*	*			trans	78.3	146.8	163.2	72.9	0	0	0	0	119.9
619	S	28.2	Very low	29.7	Very low	98 Å²	98	119.8 Å²	119.8	69%	0.685	71%	0.705	S	S	*	*			trans	78.3	135.8	167.6	85.5	0	0	0	0	118.4
620	I	26.4	Very low	29.7	Very low	154 Å²	154	120.1 Å²	120.1	79%	0.79	69%	0.692	S	S	*	*			trans	67.5	131.8	139.2	-68.4	167.3	0	0	0	116.9
621	V	31.1	Very low	29.8	Very low	111 Å²	111	120.4 Å²	120.4	67%	0.673	69%	0.692	S	S	*	*			cis	-161.5	174.9	-8.2	112.2	0	0	0	0	108	S623	V621-S623 PolarHBondContact O-N 2.79Å
622	N	26.7	Very low	29.7	Very low	165 Å²	165	122.9 Å²	122.9	88%	0.882	70%	0.701	S	S	*	*			trans	-49.5	97.1	163.6	-68.9	-55.2	0	0	0	112.8
623	S	30.7	Very low	30.1	Very low	102 Å²	102	121.7 Å²	121.7	71%	0.713	69%	0.693	S	S	*	*			trans	-109.4	121.9	169.2	54.9	0	0	0	0	110	V621 M625	V621-S623 PolarHBondContact O-N 2.79Å; S623-M625 PolarHBondContact O-N 3.39Å
624	H	28.3	Very low	30.7	Very low	192 Å²	192	125 Å²	125	89%	0.889	70%	0.697	S	S	*	*			trans	-74.4	89.7	176.5	-111.9	-81.9	0	0	0	109.3	K626	H624-K626 PolarHBondContact O-N 2.86Å
625	M	27.4	Very low	31.7	Very low	153 Å²	153	124.1 Å²	124.1	75%	0.754	68%	0.683	S	S	*	*			trans	-63.7	134.5	162.4	-71.7	-164.8	73.9	0	0	109.2	S623	S623-M625 PolarHBondContact O-N 3.39Å
626	K	27.5	Very low	33.1	Very low	156 Å²	156	123.3 Å²	123.3	68%	0.678	68%	0.679	S	S	*	*			trans	-82.9	145.8	170.2	-78.6	-179.5	172.8	177.6	0	109.4	H624 S628 D629	H624-K626 PolarHBondContact O-N 2.86Å; K626-S628 VanDerWaalsContact CB-OG 3.22Å; K626-S628 WeakPolarHBondContact CB-OG 3.21Å; K626-S628 PolarHBondContact O-N 3.08Å; K626-D629 PolarHBondContact O-N 2.84Å
627	L	32.2	Very low	34.6	Very low	114 Å²	114	121 Å²	121	60%	0.597	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-65	-3.6	173.1	-153.2	73.1	0	0	0	113.5	A574 D629 W630	A574-L627 HydrophobicContact CB-CD2 4.5Å; L627-D629 VanDerWaalsContact C-N 3.32Å; L627-W630 HydrophobicContact CD1-CE3 3.96Å; L627-W630 HydrophobicContact CD1-CZ3 3.83Å
628	S	33.7	Very low	36.1	Very low	86 Å²	86	117 Å²	117	60%	0.601	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-74.4	-19	178.2	46.9	0	0	0	0	114.3	K626	K626-S628 VanDerWaalsContact CB-OG 3.22Å; K626-S628 WeakPolarHBondContact CB-OG 3.21Å; K626-S628 PolarHBondContact O-N 3.08Å
629	D	30.7	Very low	38.3	Very low	104 Å²	104	111.2 Å²	111.2	56%	0.556	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-103.6	15.2	-161.6	-51.4	-9.9	0	0	0	112.1	K626 L627	K626-D629 PolarHBondContact O-N 2.84Å; L627-D629 VanDerWaalsContact C-N 3.32Å
630	W	30.6	Very low	40.9	Very low	102 Å²	102	107.6 Å²	107.6	39%	0.386	57%	0.573	S	S	.	*			trans	-69.4	125.6	-177.8	-148.6	-55.8	0	0	0	111.2	L627	L627-W630 HydrophobicContact CD1-CE3 3.96Å; L627-W630 HydrophobicContact CD1-CZ3 3.83Å
631	P	29.6	Very low	43.9	Very low	91 Å²	91	100.4 Å²	100.4	59%	0.591	54%	0.536	S	S	*	.			trans	-61.2	138.2	177.1	-24.9	35.2	0	0	0	112.7	S633	P631-S633 PolarHBondContact O-N 2.78Å
632	N	27.6	Very low	46.7	Very low	173 Å²	173	95.1 Å²	95.1	93%	0.925	50%	0.504	S	S	*	.			trans	-80.6	53.3	-176.1	-81.6	-89.4	0	0	0	113.2
633	S	36.9	Very low	49.7	Very low	57 Å²	57	87.5 Å²	87.5	40%	0.399	46%	0.464	S	S	.	.			trans	-104.7	70.4	177.3	48.4	0	0	0	0	113.5	P631	P631-S633 PolarHBondContact O-N 2.78Å
634	Q	46.6	Very low	52.6	Low	192 Å²	192	82.8 Å²	82.8	90%	0.897	43%	0.431	S	S	*	.	S	Bend	trans	57.9	54	144.2	-53.8	-167.2	19.1	0	0	120
635	L	53.1	Low	55.7	Low	96 Å²	96	73.6 Å²	73.6	50%	0.503	39%	0.388	S	S	.	.			trans	-137.5	137	142.5	-151.8	71.4	0	0	0	110.4	V639 L643	L635-V639 HydrophobicContact CD1-CG1 4.39Å; L635-V639 HydrophobicContact CD2-CB 4.05Å; L635-V639 HydrophobicContact CD2-CG1 3.78Å; L635-V639 HydrophobicContact CG-CB 4.04Å; L635-V639 HydrophobicContact CG-CG1 4.11Å; L635-L643 HydrophobicContact CD2-CD1 3.66Å
636	P	60.5	Low	58.9	Low	72 Å²	72	66.3 Å²	66.3	47%	0.468	35%	0.353	S	S	.	.			trans	-65.5	140.4	176.9	-21.1	33.4	0	0	0	111.8	T638 V639 S640	P636-T638 PolarHBondContact O-N 3.05Å; P636-V639 HydrophobicContact CB-CG2 4.27Å; P636-V639 HydrophobicContact CG-CG2 4.25Å; P636-V639 PolarHBondContact O-N 2.75Å; P636-S640 PolarHBondContact O-N 2.94Å
637	E	62.2	Low	62.1	Low	93 Å²	93	59.9 Å²	59.9	44%	0.435	33%	0.326	S	S	.	.	H	α-helix	trans	-45	-39.1	175.8	-171	-162.4	154.8	0	0	112.5	G571 L573 V639 S640 L641	G571-E637 WeakPolarHBondContact CA-OE1 3.29Å; G571-E637 PolarHBondContact N-OE1 3Å; L573-E637 HydrophobicContact CB-CG 4.05Å; L573-E637 HydrophobicContact CD2-CG 3.66Å; E637-V639 VanDerWaalsContact C-N 3.35Å; E637-V639 PolarHBondContact O-N 3.49Å; E637-S640 WeakPolarHBondContact O-CB 3.31Å; E637-S640 PolarHBondContact O-N 2.82Å; E637-L641 PolarHBondContact O-N 2.86Å; E637-L641 VanDerWaalsContact O-N 3.14Å
638	T	60	Low	65	Low	20 Å²	20	57 Å²	57	12%	0.123	31%	0.306	C	S	.	.	H	α-helix	trans	-59	-40.3	178.1	59.1	0	0	0	0	113.8	P568 M570 P636 A642	P568-T638 HydrophobicContact CB-CG2 3.27Å; P568-T638 HydrophobicContact CG-CG2 3.74Å; M570-T638 HydrophobicContact CE-CG2 4.12Å; M570-T638 HydrophobicContact SD-CG2 4.33Å; P636-T638 PolarHBondContact O-N 3.05Å; T638-A642 PolarHBondContact O-N 3.3Å
639	V	74.4	Confident	67.9	Low	4 Å²	4	52.9 Å²	52.9	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-76.5	-36.7	179.8	-175.6	0	0	0	0	109.9	L635 P636 E637 L641 A642 L643 H675	L635-V639 HydrophobicContact CD1-CG1 4.39Å; L635-V639 HydrophobicContact CD2-CB 4.05Å; L635-V639 HydrophobicContact CD2-CG1 3.78Å; L635-V639 HydrophobicContact CG-CB 4.04Å; L635-V639 HydrophobicContact CG-CG1 4.11Å; P636-V639 HydrophobicContact CB-CG2 4.27Å; P636-V639 HydrophobicContact CG-CG2 4.25Å; P636-V639 PolarHBondContact O-N 2.75Å; E637-V639 VanDerWaalsContact C-N 3.35Å; E637-V639 PolarHBondContact O-N 3.49Å; V639-L641 VanDerWaalsContact C-N 3.26Å; V639-L641 PolarHBondContact O-N 2.9Å; V639-A642 PolarHBondContact O-N 2.86Å; V639-L643 HydrophobicContact CG1-CD1 4Å; V639-L643 HydrophobicContact CG1-CG 4.17Å; V639-L643 WeakPolarHBondContact O-CB 3.23Å; V639-L643 VanDerWaalsContact O-CG 3.29Å; V639-L643 WeakPolarHBondContact O-CG 3.38Å; V639-L643 PolarHBondContact O-N 3.5Å; V639-H675 WeakPolarHBondContact CG1-CD2 3.5Å
640	S	82.3	Confident	71.1	Confident	22 Å²	22	48.3 Å²	48.3	15%	0.154	25%	0.254	C	S	.	.	H	α-helix	trans	-57.1	-38.7	173.4	-177.8	0	0	0	0	112	P636 E637 A644	P636-S640 PolarHBondContact O-N 2.94Å; E637-S640 WeakPolarHBondContact O-CB 3.31Å; E637-S640 PolarHBondContact O-N 2.82Å; S640-A644 VanDerWaalsContact O-CB 3.31Å; S640-A644 WeakPolarHBondContact O-CB 2.97Å; S640-A644 PolarHBondContact O-N 2.8Å
641	L	89.9	Confident	74.1	Confident	3 Å²	3	45.3 Å²	45.3	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-68	-43.8	175	-176.1	54.6	0	0	0	113.4	W542 E564 R572 L573 Y576 E637 V639 A644 L645	W542-L641 HydrophobicContact CH2-CD1 4.34Å; W542-L641 HydrophobicContact CH2-CD2 4.34Å; W542-L641 HydrophobicContact CZ2-CD2 4.03Å; E564-L641 HydrophobicContact CG-CD2 4.33Å; E564-L641 HydrophobicContact CG-CG 4.47Å; R572-L641 HydrophobicContact CB-CD2 3.76Å; R572-L641 HydrophobicContact CG-CD2 4.06Å; L573-L641 HydrophobicContact CB-CB 4.34Å; L573-L641 HydrophobicContact CD1-CB 4.11Å; L573-L641 HydrophobicContact CD1-CD1 4.04Å; Y576-L641 HydrophobicContact CD1-CD1 4.16Å; Y576-L641 HydrophobicContact CD2-CD1 4.17Å; Y576-L641 HydrophobicContact CG-CD1 3.83Å; E637-L641 PolarHBondContact O-N 2.86Å; E637-L641 VanDerWaalsContact O-N 3.14Å; V639-L641 VanDerWaalsContact C-N 3.26Å; V639-L641 PolarHBondContact O-N 2.9Å; L641-A644 PolarHBondContact O-N 3.46Å; L641-L645 HydrophobicContact CD1-CD1 4.44Å; L641-L645 HydrophobicContact CD1-CG 4.45Å; L641-L645 HydrophobicContact CG-CD1 4.3Å; L641-L645 WeakPolarHBondContact O-CG 3.37Å; L641-L645 PolarHBondContact O-N 3.25Å
642	A	89.4	Confident	77.2	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-47.4	175.4	0	0	0	0	0	111.1	E564 D565 T638 V639 A644 L645 Y646	E564-A642 HydrophobicContact CB-CB 4.37Å; D565-A642 HydrophobicContact CB-CB 4.01Å; T638-A642 PolarHBondContact O-N 3.3Å; V639-A642 PolarHBondContact O-N 2.86Å; A642-A644 VanDerWaalsContact C-N 3.33Å; A642-A644 PolarHBondContact O-N 3.39Å; A642-L645 PolarHBondContact O-N 3.17Å; A642-Y646 HydrophobicContact CB-CE2 4.18Å; A642-Y646 WeakPolarHBondContact O-CD2 3.29Å; A642-Y646 PolarHBondContact O-N 2.98Å
643	L	91.2	Very high	80.5	Confident	5 Å²	5	32.8 Å²	32.8	3%	0.026	17%	0.173	C	C	.	.	H	α-helix	trans	-58.8	-41.5	174.8	-67.4	174.7	0	0	0	112.2	L635 V639 Y646 N647 L668 L672	L635-L643 HydrophobicContact CD2-CD1 3.66Å; V639-L643 HydrophobicContact CG1-CD1 4Å; V639-L643 HydrophobicContact CG1-CG 4.17Å; V639-L643 WeakPolarHBondContact O-CB 3.23Å; V639-L643 VanDerWaalsContact O-CG 3.29Å; V639-L643 WeakPolarHBondContact O-CG 3.38Å; V639-L643 PolarHBondContact O-N 3.5Å; L643-Y646 PolarHBondContact O-N 2.67Å; L643-N647 PolarHBondContact O-N 2.82Å; L643-N647 PolarHBondContact O-ND2 3.36Å; L643-L668 HydrophobicContact CD2-CD1 3.46Å; L643-L668 VanDerWaalsContact CD2-CD1 3.46Å; L643-L672 HydrophobicContact CD1-CD2 4.47Å; L643-L672 HydrophobicContact CD2-CD2 3.74Å; L643-L672 HydrophobicContact CD2-CG 3.98Å
644	A	90.9	Very high	83.3	Confident	3 Å²	3	34.1 Å²	34.1	3%	0.025	17%	0.173	C	C	.	.	H	α-helix	trans	-62.1	-42.4	175.5	0	0	0	0	0	112	Y576 L601 S640 L641 A642 N647 R648	Y576-A644 HydrophobicContact CD1-CB 4.37Å; Y576-A644 HydrophobicContact CE1-CB 3.67Å; Y576-A644 PolarHBondContact OH-O 3.13Å; L601-A644 HydrophobicContact CD1-CB 4.17Å; L601-A644 HydrophobicContact CD2-CB 4.16Å; S640-A644 VanDerWaalsContact O-CB 3.31Å; S640-A644 WeakPolarHBondContact O-CB 2.97Å; S640-A644 PolarHBondContact O-N 2.8Å; L641-A644 PolarHBondContact O-N 3.46Å; A642-A644 VanDerWaalsContact C-N 3.33Å; A642-A644 PolarHBondContact O-N 3.39Å; A644-N647 PolarHBondContact O-N 3.32Å; A644-R648 VanDerWaalsContact O-CB 3.29Å; A644-R648 WeakPolarHBondContact O-CB 3.41Å; A644-R648 PolarHBondContact O-N 3.2Å
645	L	93.4	Very high	85.6	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.2	-40.3	176.7	-72.1	164.7	0	0	0	112.8	W542 F545 L557 L560 E564 Y576 L641 A642 R648 A649	W542-L645 HydrophobicContact CH2-CD1 4.39Å; W542-L645 HydrophobicContact CH2-CD2 4.48Å; W542-L645 HydrophobicContact CZ2-CD1 4.38Å; F545-L645 HydrophobicContact CD2-CD2 4.45Å; F545-L645 HydrophobicContact CE2-CD2 4.2Å; L557-L645 HydrophobicContact CD2-CD2 4.5Å; L560-L645 HydrophobicContact CD2-CD1 4.49Å; L560-L645 HydrophobicContact CD2-CD2 4.13Å; L560-L645 HydrophobicContact CG-CD1 4.02Å; L560-L645 HydrophobicContact CG-CD2 4.46Å; E564-L645 HydrophobicContact CB-CD1 4.24Å; E564-L645 HydrophobicContact CG-CD1 3.85Å; Y576-L645 HydrophobicContact CD2-CD2 4.38Å; Y576-L645 HydrophobicContact CE2-CD2 3.79Å; Y576-L645 HydrophobicContact CE2-CG 4.44Å; L641-L645 HydrophobicContact CD1-CD1 4.44Å; L641-L645 HydrophobicContact CD1-CG 4.45Å; L641-L645 HydrophobicContact CG-CD1 4.3Å; L641-L645 WeakPolarHBondContact O-CG 3.37Å; L641-L645 PolarHBondContact O-N 3.25Å; A642-L645 PolarHBondContact O-N 3.17Å; L645-R648 PolarHBondContact O-N 3.21Å; L645-A649 PolarHBondContact O-N 2.95Å
646	Y	94.5	Very high	87.6	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-69.9	-42.2	175.7	-62.5	-60.6	0	0	0	112.7	T558 D562 A642 L643 R648 A649 I650 C667 L668 C671 R674	T558-Y646 HydrophobicContact CG2-CD1 4.2Å; D562-Y646 WeakPolarHBondContact CA-OH 3.43Å; D562-Y646 PolarHBondContact N-OH 3.28Å; D562-Y646 PolarHBondContact OD1-OH 2.83Å; A642-Y646 HydrophobicContact CB-CE2 4.18Å; A642-Y646 WeakPolarHBondContact O-CD2 3.29Å; A642-Y646 PolarHBondContact O-N 2.98Å; L643-Y646 PolarHBondContact O-N 2.67Å; Y646-R648 VanDerWaalsContact C-N 3.27Å; Y646-R648 PolarHBondContact O-N 2.87Å; Y646-A649 WeakPolarHBondContact O-CA 3.18Å; Y646-A649 WeakPolarHBondContact O-CB 3.43Å; Y646-A649 PolarHBondContact O-N 2.91Å; Y646-A649 VanDerWaalsContact O-N 3.07Å; Y646-I650 PolarHBondContact O-N 2.57Å; Y646-C667 HydrophobicContact CD1-CB 3.85Å; Y646-C667 HydrophobicContact CE1-CB 3.64Å; Y646-L668 HydrophobicContact CD2-CD1 4.26Å; Y646-L668 HydrophobicContact CG-CB 4.41Å; Y646-L668 HydrophobicContact CG-CD1 4.48Å; Y646-C671 HydrophobicContact CD2-CB 4.06Å; Y646-C671 HydrophobicContact CE2-CB 3.44Å; Y646-C671 VanDerWaalsContact CE2-CB 3.44Å; Y646-R674 PolarHBondContact OH-NH2 3.22Å
647	N	94	Very high	89.3	Confident	21 Å²	21	28.4 Å²	28.4	11%	0.112	13%	0.129	C	C	.	.	H	α-helix	trans	-61.6	-38.6	173.7	-78.2	-77.7	0	0	0	111.1	L643 A644 A649 I650 L651 Y684	L643-N647 PolarHBondContact O-N 2.82Å; L643-N647 PolarHBondContact O-ND2 3.36Å; A644-N647 PolarHBondContact O-N 3.32Å; N647-A649 VanDerWaalsContact C-N 3.31Å; N647-A649 PolarHBondContact O-N 3.4Å; N647-I650 PolarHBondContact O-N 3.13Å; N647-L651 PolarHBondContact O-N 2.84Å; N647-Y684 PolarHBondContact OD1-OH 2.96Å
648	R	92.7	Very high	90.9	Very high	52 Å²	52	27 Å²	27	20%	0.196	13%	0.129	C	C	.	.	H	α-helix	trans	-61.5	-37.8	172.2	-168.8	71.1	-162.3	159.6	15.4	112.3	L557 Y576 E597 A644 L645 Y646 L651 V652	L557-R648 HydrophobicContact CD1-CG 4.06Å; Y576-R648 WeakPolarHBondContact OH-CB 3.42Å; E597-R648 WeakPolarHBondContact OE1-CD 3.49Å; E597-R648 IonicContact OE1-NH1 2.76Å; E597-R648 IonicContact OE2-CZ 3.15Å; E597-R648 IonicContact OE2-NH1 3.81Å; E597-R648 PolarHBondContact OE2-NH1 2.68Å; A644-R648 VanDerWaalsContact O-CB 3.29Å; A644-R648 WeakPolarHBondContact O-CB 3.41Å; A644-R648 PolarHBondContact O-N 3.2Å; L645-R648 PolarHBondContact O-N 3.21Å; Y646-R648 VanDerWaalsContact C-N 3.27Å; Y646-R648 PolarHBondContact O-N 2.87Å; R648-L651 PolarHBondContact O-N 3.16Å; R648-V652 VanDerWaalsContact O-CG2 3.27Å; R648-V652 WeakPolarHBondContact O-CG2 3.33Å; R648-V652 PolarHBondContact O-N 2.69Å
649	A	95.6	Very high	92.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.9	-41.5	174.2	0	0	0	0	0	112.2	P554 L557 T558 L645 Y646 N647 V652 N653 P664	P554-A649 HydrophobicContact CB-CB 4.48Å; L557-A649 HydrophobicContact CB-CB 3.81Å; L557-A649 HydrophobicContact CD1-CB 4.42Å; T558-A649 HydrophobicContact CG2-CB 3.87Å; L645-A649 PolarHBondContact O-N 2.95Å; Y646-A649 WeakPolarHBondContact O-CA 3.18Å; Y646-A649 WeakPolarHBondContact O-CB 3.43Å; Y646-A649 PolarHBondContact O-N 2.91Å; Y646-A649 VanDerWaalsContact O-N 3.07Å; N647-A649 VanDerWaalsContact C-N 3.31Å; N647-A649 PolarHBondContact O-N 3.4Å; A649-V652 PolarHBondContact O-N 3.33Å; A649-N653 WeakPolarHBondContact O-CB 3.46Å; A649-N653 PolarHBondContact O-N 3.34Å; A649-P664 HydrophobicContact CB-CB 4.12Å; A649-P664 HydrophobicContact CB-CG 4.49Å
650	I	96.9	Very high	93.7	Very high	9 Å²	9	29.5 Å²	29.5	5%	0.046	14%	0.141	C	C	.	.	H	α-helix	trans	-63.2	-44	175	-69.7	168	0	0	0	111.1	Y646 N647 V652 N653 Q654 P664 Y665 L668 Y684	Y646-I650 PolarHBondContact O-N 2.57Å; N647-I650 PolarHBondContact O-N 3.13Å; I650-V652 PolarHBondContact O-N 3.13Å; I650-N653 VanDerWaalsContact O-CB 3.31Å; I650-N653 WeakPolarHBondContact O-CB 3.21Å; I650-N653 PolarHBondContact O-N 3.19Å; I650-Q654 HydrophobicContact CG2-CG 4.4Å; I650-Q654 WeakPolarHBondContact O-CG 3.32Å; I650-Q654 PolarHBondContact O-N 3.33Å; I650-P664 HydrophobicContact CG1-CB 3.66Å; I650-Y665 HydrophobicContact CD1-CD1 3.92Å; I650-Y665 HydrophobicContact CD1-CE1 4.09Å; I650-Y665 HydrophobicContact CD1-CG 4.34Å; I650-Y665 HydrophobicContact CG1-CD1 4.35Å; I650-Y665 HydrophobicContact CG1-CD2 4.47Å; I650-Y665 HydrophobicContact CG1-CE1 4.38Å; I650-Y665 HydrophobicContact CG1-CE2 4.5Å; I650-Y665 HydrophobicContact CG1-CG 4.41Å; I650-Y665 HydrophobicContact CG2-CE1 4.06Å; I650-Y665 HydrophobicContact CG2-CE2 4.31Å; I650-L668 HydrophobicContact CD1-CB 4.4Å; I650-L668 HydrophobicContact CD1-CD2 3.49Å; I650-L668 VanDerWaalsContact CD1-CD2 3.49Å; I650-Y684 HydrophobicContact CD1-CD1 4.18Å; I650-Y684 HydrophobicContact CD1-CE1 4.02Å
651	L	95.1	Very high	94.4	Very high	38 Å²	38	28.5 Å²	28.5	20%	0.199	13%	0.133	C	C	.	.	H	α-helix	trans	-67	-35.1	177.4	-72.4	166.8	0	0	0	112.8	E597 N647 R648 N653 Q654 Y655	E597-L651 HydrophobicContact CG-CD1 3.15Å; N647-L651 PolarHBondContact O-N 2.84Å; R648-L651 PolarHBondContact O-N 3.16Å; L651-N653 VanDerWaalsContact C-N 3.34Å; L651-Q654 PolarHBondContact O-N 3.5Å; L651-Y655 VanDerWaalsContact O-CB 3.26Å; L651-Y655 WeakPolarHBondContact O-CB 3.47Å; L651-Y655 PolarHBondContact O-N 2.78Å
652	V	94.6	Very high	94.7	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.012	13%	0.133	C	C	.	.	H	α-helix	trans	-66.3	-37.1	172.1	172.4	0	0	0	0	111.1	P554 L557 R648 A649 I650 Y656 Y657	P554-V652 HydrophobicContact CG-CB 4.43Å; P554-V652 HydrophobicContact CG-CG1 3.87Å; L557-V652 HydrophobicContact CD1-CB 4.41Å; L557-V652 HydrophobicContact CD1-CG2 3.92Å; R648-V652 VanDerWaalsContact O-CG2 3.27Å; R648-V652 WeakPolarHBondContact O-CG2 3.33Å; R648-V652 PolarHBondContact O-N 2.69Å; A649-V652 PolarHBondContact O-N 3.33Å; I650-V652 PolarHBondContact O-N 3.13Å; V652-Y656 HydrophobicContact CG1-CD2 3.94Å; V652-Y656 WeakPolarHBondContact O-CB 3.43Å; V652-Y656 PolarHBondContact O-N 2.95Å; V652-Y657 HydrophobicContact CG1-CE2 4.34Å
653	N	96.7	Very high	95.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.1	-51.5	172	179.9	31	0	0	0	112.1	P554 A649 I650 L651 Y655 Y657 S658 N659 H660 H661 P664	P554-N653 HydrophobicContact CG-CB 4.38Å; A649-N653 WeakPolarHBondContact O-CB 3.46Å; A649-N653 PolarHBondContact O-N 3.34Å; I650-N653 VanDerWaalsContact O-CB 3.31Å; I650-N653 WeakPolarHBondContact O-CB 3.21Å; I650-N653 PolarHBondContact O-N 3.19Å; L651-N653 VanDerWaalsContact C-N 3.34Å; N653-Y655 PolarHBondContact O-N 3.48Å; N653-Y657 CarbonylContact O-C 3.49Å; N653-Y657 WeakPolarHBondContact O-CA 3.14Å; N653-Y657 WeakPolarHBondContact O-CB 3.4Å; N653-Y657 PolarHBondContact O-N 3.1Å; N653-S658 PolarHBondContact O-N 2.92Å; N653-N659 PolarHBondContact ND2-OD1 3.42Å; N653-N659 VanDerWaalsContact ND2-OD1 3.11Å; N653-N659 PolarHBondContact O-N 2.91Å; N653-N659 VanDerWaalsContact O-N 3.09Å; N653-N659 WeakPolarHBondContact OD1-CA 3.12Å; N653-H660 PolarHBondContact OD1-N 3.14Å; N653-H660 VanDerWaalsContact OD1-N 3.16Å; N653-H661 HydrophobicContact CB-CB 4.38Å; N653-H661 PolarHBondContact ND2-N 3.41Å; N653-H661 PolarHBondContact ND2-O 2.87Å; N653-H661 WeakPolarHBondContact OD1-CB 3.36Å; N653-H661 PolarHBondContact OD1-CD2 2.92Å; N653-H661 PolarHBondContact OD1-N 3.12Å; N653-P664 HydrophobicContact CB-CG 4.38Å
654	Q	96.2	Very high	95.3	Very high	85 Å²	85	29.7 Å²	29.7	40%	0.397	14%	0.137	S	C	.	.	H	α-helix	trans	-58.9	-47.4	179.3	-71.3	171.8	-4.5	0	0	112	I650 L651 N659 Y665	I650-Q654 HydrophobicContact CG2-CG 4.4Å; I650-Q654 WeakPolarHBondContact O-CG 3.32Å; I650-Q654 PolarHBondContact O-N 3.33Å; L651-Q654 PolarHBondContact O-N 3.5Å; Q654-N659 HydrophobicContact CG-CB 3.94Å; Q654-N659 WeakPolarHBondContact CG-OD1 3.39Å; Q654-Y665 PolarHBondContact NE2-OH 2.59Å
655	Y	94.8	Very high	95.7	Very high	138 Å²	138	29.9 Å²	29.9	54%	0.541	14%	0.138	S	C	.	.	H	α-helix	trans	-78.4	-35.5	-173.3	-171.5	-84.5	0	0	0	114.4	L651 N653	L651-Y655 VanDerWaalsContact O-CB 3.26Å; L651-Y655 WeakPolarHBondContact O-CB 3.47Å; L651-Y655 PolarHBondContact O-N 2.78Å; N653-Y655 PolarHBondContact O-N 3.48Å
656	Y	93.9	Very high	95.8	Very high	83 Å²	83	30.1 Å²	30.1	33%	0.325	14%	0.139	S	C	.	.	H	α-helix	trans	-108.4	-18	-173.7	-67.8	-72	0	0	0	115.1	R552 V652	R552-Y656 HydrophobicContact CG-CD1 4.2Å; R552-Y656 HydrophobicContact CG-CD2 4.08Å; R552-Y656 HydrophobicContact CG-CE1 3.97Å; R552-Y656 HydrophobicContact CG-CE2 3.82Å; R552-Y656 HydrophobicContact CG-CG 4.25Å; R552-Y656 VanDerWaalsContact CZ-CE1 3.43Å; V652-Y656 HydrophobicContact CG1-CD2 3.94Å; V652-Y656 WeakPolarHBondContact O-CB 3.43Å; V652-Y656 PolarHBondContact O-N 2.95Å
657	Y	96.2	Very high	95.7	Very high	19 Å²	19	31 Å²	31	8%	0.075	15%	0.145	C	C	.	.	S	Bend	trans	-131.2	23.3	-170.8	-56.5	-73.3	0	0	0	112.6	Y460 P461 V462 R552 P554 V652 N653 N659 H660 H661	Y460-Y657 VanDerWaalsContact O-CD1 3.31Å; Y460-Y657 WeakPolarHBondContact O-CD1 3.43Å; P461-Y657 WeakPolarHBondContact O-CE1 3.35Å; V462-Y657 HydrophobicContact CG2-CE1 4.14Å; V462-Y657 HydrophobicContact CG2-CE2 4.29Å; R552-Y657 PolarHBondContact O-OH 2.93Å; P554-Y657 HydrophobicContact CG-CD2 3.97Å; P554-Y657 HydrophobicContact CG-CE2 4.01Å; V652-Y657 HydrophobicContact CG1-CE2 4.34Å; N653-Y657 CarbonylContact O-C 3.49Å; N653-Y657 WeakPolarHBondContact O-CA 3.14Å; N653-Y657 WeakPolarHBondContact O-CB 3.4Å; N653-Y657 PolarHBondContact O-N 3.1Å; Y657-N659 PolarHBondContact O-N 3.09Å; Y657-H660 WeakPolarHBondContact O-CB 3.28Å; Y657-H660 PolarHBondContact O-N 2.93Å; Y657-H661 VanDerWaalsContact CB-CD2 3.45Å; Y657-H661 WeakPolarHBondContact CB-CD2 3.45Å; Y657-H661 AromaticContact CD1-NE2 3.68Å; Y657-H661 AromaticContact CG-CD2 3.76Å; Y657-H661 AromaticContact CG-NE2 3.52Å
658	S	95.7	Very high	95.7	Very high	63 Å²	63	30 Å²	30	44%	0.441	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	32.9	179.8	-58.4	0	0	0	0	113.4	Y460 N653 H660	Y460-S658 WeakPolarHBondContact CE1-OG 3.27Å; Y460-S658 PolarHBondContact OH-OG 3.43Å; N653-S658 PolarHBondContact O-N 2.92Å; S658-H660 VanDerWaalsContact C-N 3.32Å; S658-H660 PolarHBondContact O-N 2.73Å; S658-H660 PolarHBondContact O-ND1 3.04Å
659	N	96.6	Very high	95.8	Very high	44 Å²	44	27.5 Å²	27.5	24%	0.235	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	25.6	-174.7	-157.4	48.4	0	0	0	116.8	N653 Q654 Y657 Y665 V691	N653-N659 PolarHBondContact ND2-OD1 3.42Å; N653-N659 VanDerWaalsContact ND2-OD1 3.11Å; N653-N659 PolarHBondContact O-N 2.91Å; N653-N659 VanDerWaalsContact O-N 3.09Å; N653-N659 WeakPolarHBondContact OD1-CA 3.12Å; Q654-N659 HydrophobicContact CG-CB 3.94Å; Q654-N659 WeakPolarHBondContact CG-OD1 3.39Å; Y657-N659 PolarHBondContact O-N 3.09Å; N659-Y665 PolarHBondContact ND2-OH 2.97Å; N659-Y665 VanDerWaalsContact ND2-OH 3.08Å; N659-Y665 WeakPolarHBondContact OD1-CE2 3.36Å; N659-Y665 PolarHBondContact OD1-OH 3.16Å; N659-V691 VanDerWaalsContact O-CG1 3.31Å; N659-V691 WeakPolarHBondContact O-CG1 3.46Å; N659-V691 WeakPolarHBondContact O-CG2 3.33Å
660	H	96.7	Very high	95.6	Very high	33 Å²	33	27.6 Å²	27.6	15%	0.153	13%	0.131	C	C	.	.			trans	-83.7	-15.6	-174.3	-80	59.5	0	0	0	115.5	V457 Y460 N653 Y657 S658 V691 Y695	V457-H660 HydrophobicContact CG1-CB 3.86Å; Y460-H660 HydrophobicContact CD2-CB 4.1Å; Y460-H660 AromaticContact CD2-CD2 3.6Å; Y460-H660 AromaticContact CD2-CE1 3.97Å; Y460-H660 AromaticContact CD2-CG 3.55Å; Y460-H660 AromaticContact CD2-ND1 3.8Å; Y460-H660 AromaticContact CD2-NE2 3.85Å; Y460-H660 AromaticContact CE2-CD2 3.89Å; Y460-H660 AromaticContact CE2-CE1 3.6Å; Y460-H660 AromaticContact CE2-CG 4Å; Y460-H660 AromaticContact CE2-ND1 3.83Å; Y460-H660 AromaticContact CE2-NE2 3.61Å; Y460-H660 HydrophobicContact CG-CB 4.43Å; N653-H660 PolarHBondContact OD1-N 3.14Å; N653-H660 VanDerWaalsContact OD1-N 3.16Å; Y657-H660 WeakPolarHBondContact O-CB 3.28Å; Y657-H660 PolarHBondContact O-N 2.93Å; S658-H660 VanDerWaalsContact C-N 3.32Å; S658-H660 PolarHBondContact O-N 2.73Å; S658-H660 PolarHBondContact O-ND1 3.04Å; H660-V691 VanDerWaalsContact O-CG1 3.23Å; H660-V691 WeakPolarHBondContact O-CG1 3.35Å; H660-Y695 WeakPolarHBondContact CB-OH 3.32Å; H660-Y695 PolarHBondContact O-OH 2.97Å
661	H	97.4	Very high	95.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.129	C	C	.	.			trans	-78.4	137.2	178.3	-64.8	-118	0	0	0	111.3	E377 Y460 N653 Y657 P664	E377-H661 WeakPolarHBondContact OE1-CB 3.05Å; E377-H661 IonicContact OE1-ND1 3.76Å; Y460-H661 PolarHBondContact O-NE2 3.25Å; N653-H661 HydrophobicContact CB-CB 4.38Å; N653-H661 PolarHBondContact ND2-N 3.41Å; N653-H661 PolarHBondContact ND2-O 2.87Å; N653-H661 WeakPolarHBondContact OD1-CB 3.36Å; N653-H661 PolarHBondContact OD1-CD2 2.92Å; N653-H661 PolarHBondContact OD1-N 3.12Å; Y657-H661 VanDerWaalsContact CB-CD2 3.45Å; Y657-H661 WeakPolarHBondContact CB-CD2 3.45Å; Y657-H661 AromaticContact CD1-NE2 3.68Å; Y657-H661 AromaticContact CG-CD2 3.76Å; Y657-H661 AromaticContact CG-NE2 3.52Å; H661-P664 HydrophobicContact CB-CG 4.07Å
662	V	97.3	Very high	95.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.121	C	C	.	.	S	Bend	trans	-100	-37	-173.2	-173.2	0	0	0	0	112	E377 P664 Y665 T666 A688 V691 I692 I704	E377-V662 VanDerWaalsContact CD-N 3.27Å; E377-V662 PolarHBondContact OE1-N 3.45Å; E377-V662 PolarHBondContact OE2-N 3.45Å; V662-P664 VanDerWaalsContact C-CD 3.43Å; V662-Y665 WeakPolarHBondContact O-CB 3.38Å; V662-Y665 PolarHBondContact O-N 3.34Å; V662-T666 HydrophobicContact CG1-CG2 4.17Å; V662-T666 PolarHBondContact O-N 3.48Å; V662-A688 HydrophobicContact CG1-CB 4.17Å; V662-V691 HydrophobicContact CG2-CB 4.17Å; V662-V691 HydrophobicContact CG2-CG1 3.68Å; V662-I692 HydrophobicContact CG2-CD1 3.97Å; V662-I704 HydrophobicContact CB-CD1 4.41Å; V662-I704 HydrophobicContact CG1-CD1 3.87Å; V662-I704 HydrophobicContact CG1-CG1 4.4Å
663	Y	96.6	Very high	95	Very high	33 Å²	33	26.6 Å²	26.6	13%	0.129	13%	0.125	C	C	.	.	H	α-helix	trans	-58.5	-36.2	-179.3	-76.5	-52.9	0	0	0	114.8	E377 W454 L555 Y665 T666 C667 E707	E377-Y663 HydrophobicContact CB-CD2 3.63Å; E377-Y663 HydrophobicContact CB-CE2 3.71Å; E377-Y663 HydrophobicContact CG-CD2 4.03Å; E377-Y663 WeakPolarHBondContact O-CE2 3.43Å; E377-Y663 WeakPolarHBondContact OE1-CB 3.37Å; E377-Y663 PolarHBondContact OE1-N 3.16Å; W454-Y663 HydrophobicContact CH2-CE2 4.14Å; W454-Y663 HydrophobicContact CZ2-CD2 4.42Å; W454-Y663 AromaticContact CZ2-CE2 3.74Å; W454-Y663 HydrophobicContact CZ2-CE2 3.74Å; W454-Y663 AromaticContact CZ2-CZ 3.99Å; L555-Y663 HydrophobicContact CD2-CD2 3.89Å; L555-Y663 HydrophobicContact CD2-CG 4.31Å; Y663-Y665 PolarHBondContact O-N 2.85Å; Y663-Y665 VanDerWaalsContact O-N 3.08Å; Y663-T666 PolarHBondContact O-N 2.91Å; Y663-C667 VanDerWaalsContact O-CB 3.22Å; Y663-C667 WeakPolarHBondContact O-CB 3.4Å; Y663-C667 PolarHBondContact O-N 3.34Å; Y663-C667 PolarHBondContact O-SG 3.42Å; Y663-E707 WeakPolarHBondContact CE1-OE1 3.28Å
664	P	96.7	Very high	94.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-53.4	-31.5	174.1	-29	37.9	0	0	0	113.5	P554 T558 A649 I650 N653 H661 V662 L668	P554-P664 HydrophobicContact CB-CG 3.73Å; T558-P664 HydrophobicContact CG2-CB 4.48Å; A649-P664 HydrophobicContact CB-CB 4.12Å; A649-P664 HydrophobicContact CB-CG 4.49Å; I650-P664 HydrophobicContact CG1-CB 3.66Å; N653-P664 HydrophobicContact CB-CG 4.38Å; H661-P664 HydrophobicContact CB-CG 4.07Å; V662-P664 VanDerWaalsContact C-CD 3.43Å; P664-L668 WeakPolarHBondContact O-CB 3.42Å
665	Y	97.5	Very high	94.1	Very high	8 Å²	8	28 Å²	28	3%	0.031	13%	0.129	C	C	.	.	H	α-helix	trans	-83.7	-45.4	176.5	-70.1	-85.1	0	0	0	113.1	I650 Q654 N659 V662 Y663 L668 A669 Y684 E687 V691	I650-Y665 HydrophobicContact CD1-CD1 3.92Å; I650-Y665 HydrophobicContact CD1-CE1 4.09Å; I650-Y665 HydrophobicContact CD1-CG 4.34Å; I650-Y665 HydrophobicContact CG1-CD1 4.35Å; I650-Y665 HydrophobicContact CG1-CD2 4.47Å; I650-Y665 HydrophobicContact CG1-CE1 4.38Å; I650-Y665 HydrophobicContact CG1-CE2 4.5Å; I650-Y665 HydrophobicContact CG1-CG 4.41Å; I650-Y665 HydrophobicContact CG2-CE1 4.06Å; I650-Y665 HydrophobicContact CG2-CE2 4.31Å; Q654-Y665 PolarHBondContact NE2-OH 2.59Å; N659-Y665 PolarHBondContact ND2-OH 2.97Å; N659-Y665 VanDerWaalsContact ND2-OH 3.08Å; N659-Y665 WeakPolarHBondContact OD1-CE2 3.36Å; N659-Y665 PolarHBondContact OD1-OH 3.16Å; V662-Y665 WeakPolarHBondContact O-CB 3.38Å; V662-Y665 PolarHBondContact O-N 3.34Å; Y663-Y665 PolarHBondContact O-N 2.85Å; Y663-Y665 VanDerWaalsContact O-N 3.08Å; Y665-L668 PolarHBondContact O-N 2.98Å; Y665-A669 WeakPolarHBondContact O-CB 3.43Å; Y665-A669 PolarHBondContact O-N 3.41Å; Y665-Y684 HydrophobicContact CD1-CD1 4.04Å; Y665-Y684 HydrophobicContact CE1-CD1 4.47Å; Y665-E687 HydrophobicContact CD1-CB 3.47Å; Y665-E687 VanDerWaalsContact CD1-CB 3.47Å; Y665-E687 HydrophobicContact CD1-CG 4.48Å; Y665-E687 HydrophobicContact CE1-CB 3.46Å; Y665-E687 VanDerWaalsContact CE1-CB 3.46Å; Y665-E687 HydrophobicContact CE1-CG 4.21Å; Y665-E687 HydrophobicContact CG-CB 4.41Å; Y665-V691 HydrophobicContact CD2-CG2 3.93Å; Y665-V691 HydrophobicContact CE2-CG2 3.66Å
666	T	95.8	Very high	93.8	Very high	4 Å²	4	23.4 Å²	23.4	3%	0.025	12%	0.124	C	C	.	.	H	α-helix	trans	-69.8	-36.3	-179.3	63.9	0	0	0	0	112.5	V662 Y663 A669 G670 A688 I711	V662-T666 HydrophobicContact CG1-CG2 4.17Å; V662-T666 PolarHBondContact O-N 3.48Å; Y663-T666 PolarHBondContact O-N 2.91Å; T666-A669 PolarHBondContact O-N 3.47Å; T666-G670 PolarHBondContact O-N 3.09Å; T666-A688 HydrophobicContact CG2-CB 3.69Å; T666-I711 HydrophobicContact CG2-CD1 4.44Å
667	C	93.3	Very high	93.7	Very high	19 Å²	19	22.4 Å²	22.4	13%	0.128	13%	0.125	C	C	.	.	H	α-helix	trans	-61.2	-45.7	172.8	-69	0	0	0	0	112	T558 Y646 Y663 G670 C671	T558-C667 HydrophobicContact CG2-CB 4.08Å; Y646-C667 HydrophobicContact CD1-CB 3.85Å; Y646-C667 HydrophobicContact CE1-CB 3.64Å; Y663-C667 VanDerWaalsContact O-CB 3.22Å; Y663-C667 WeakPolarHBondContact O-CB 3.4Å; Y663-C667 PolarHBondContact O-N 3.34Å; Y663-C667 PolarHBondContact O-SG 3.42Å; C667-G670 PolarHBondContact O-N 2.94Å; C667-C671 PolarHBondContact O-N 3.21Å
668	L	94.5	Very high	93.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.9	-48.3	177	179.6	48.9	0	0	0	111.5	L643 Y646 I650 P664 Y665 G670 C671 L672 Y684	L643-L668 HydrophobicContact CD2-CD1 3.46Å; L643-L668 VanDerWaalsContact CD2-CD1 3.46Å; Y646-L668 HydrophobicContact CD2-CD1 4.26Å; Y646-L668 HydrophobicContact CG-CB 4.41Å; Y646-L668 HydrophobicContact CG-CD1 4.48Å; I650-L668 HydrophobicContact CD1-CB 4.4Å; I650-L668 HydrophobicContact CD1-CD2 3.49Å; I650-L668 VanDerWaalsContact CD1-CD2 3.49Å; P664-L668 WeakPolarHBondContact O-CB 3.42Å; Y665-L668 PolarHBondContact O-N 2.98Å; L668-G670 VanDerWaalsContact C-N 3.26Å; L668-G670 PolarHBondContact O-N 2.92Å; L668-C671 PolarHBondContact O-N 2.72Å; L668-C671 VanDerWaalsContact O-N 3.16Å; L668-L672 HydrophobicContact CD1-CD1 3.8Å; L668-L672 HydrophobicContact CD1-CG 4.07Å; L668-L672 HydrophobicContact CG-CD1 3.86Å; L668-L672 WeakPolarHBondContact O-CG 3.43Å; L668-L672 PolarHBondContact O-N 2.96Å; L668-Y684 HydrophobicContact CD2-CD1 3.69Å; L668-Y684 HydrophobicContact CD2-CD2 4.11Å; L668-Y684 HydrophobicContact CD2-CE1 3.43Å; L668-Y684 VanDerWaalsContact CD2-CE1 3.43Å; L668-Y684 HydrophobicContact CD2-CE2 3.89Å; L668-Y684 HydrophobicContact CD2-CG 4.02Å; L668-Y684 HydrophobicContact CG-CD1 4.26Å; L668-Y684 HydrophobicContact CG-CD2 4.12Å; L668-Y684 HydrophobicContact CG-CE1 4.39Å; L668-Y684 HydrophobicContact CG-CE2 4.27Å; L668-Y684 HydrophobicContact CG-CG 4.11Å
669	A	94.3	Very high	93.4	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-59	-38.6	176.3	0	0	0	0	0	112	Y665 T666 Y673 A681 W685	Y665-A669 WeakPolarHBondContact O-CB 3.43Å; Y665-A669 PolarHBondContact O-N 3.41Å; T666-A669 PolarHBondContact O-N 3.47Å; A669-Y673 VanDerWaalsContact O-CB 3.29Å; A669-Y673 WeakPolarHBondContact O-CB 3.38Å; A669-Y673 PolarHBondContact O-N 3.24Å; A669-A681 WeakPolarHBondContact O-CB 3.48Å; A669-W685 HydrophobicContact CB-CD2 4.25Å; A669-W685 HydrophobicContact CB-CG 3.82Å
670	G	90.9	Very high	93.2	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-61.8	-48.1	172.2	0	0	0	0	0	112.9	T666 C667 L668 L672 Y673 R674	T666-G670 PolarHBondContact O-N 3.09Å; C667-G670 PolarHBondContact O-N 2.94Å; L668-G670 VanDerWaalsContact C-N 3.26Å; L668-G670 PolarHBondContact O-N 2.92Å; G670-L672 PolarHBondContact O-N 3.08Å; G670-Y673 PolarHBondContact O-N 3.49Å; G670-R674 WeakPolarHBondContact O-CB 3.49Å; G670-R674 VanDerWaalsContact O-CG 3.25Å; G670-R674 WeakPolarHBondContact O-CG 3.47Å; G670-R674 PolarHBondContact O-N 3.26Å
671	C	89.6	Confident	93.1	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-59.1	-47.7	175.8	-172	0	0	0	0	111.9	D565 Y646 C667 L668 Y673 R674 H675	D565-C671 PolarHBondContact OD2-SG 3.48Å; Y646-C671 HydrophobicContact CD2-CB 4.06Å; Y646-C671 HydrophobicContact CE2-CB 3.44Å; Y646-C671 VanDerWaalsContact CE2-CB 3.44Å; C667-C671 PolarHBondContact O-N 3.21Å; L668-C671 PolarHBondContact O-N 2.72Å; L668-C671 VanDerWaalsContact O-N 3.16Å; C671-Y673 PolarHBondContact O-N 2.88Å; C671-R674 WeakPolarHBondContact O-CB 3.45Å; C671-R674 PolarHBondContact O-N 3.4Å; C671-R674 VanDerWaalsContact O-N 3.09Å; C671-H675 PolarHBondContact O-CD2 3.06Å; C671-H675 PolarHBondContact O-N 3.16Å
672	L	91.9	Very high	93.1	Very high	8 Å²	8	21.9 Å²	21.9	4%	0.042	12%	0.116	C	C	.	.	H	α-helix	trans	-59.8	-44.2	177.5	-69.2	161.4	0	0	0	111.9	L643 L668 G670 R674 H675 G676 D677 A681 Y684	L643-L672 HydrophobicContact CD1-CD2 4.47Å; L643-L672 HydrophobicContact CD2-CD2 3.74Å; L643-L672 HydrophobicContact CD2-CG 3.98Å; L668-L672 HydrophobicContact CD1-CD1 3.8Å; L668-L672 HydrophobicContact CD1-CG 4.07Å; L668-L672 HydrophobicContact CG-CD1 3.86Å; L668-L672 WeakPolarHBondContact O-CG 3.43Å; L668-L672 PolarHBondContact O-N 2.96Å; G670-L672 PolarHBondContact O-N 3.08Å; L672-R674 VanDerWaalsContact C-N 3.34Å; L672-R674 PolarHBondContact O-N 3.02Å; L672-H675 PolarHBondContact O-N 2.89Å; L672-G676 PolarHBondContact O-N 2.82Å; L672-D677 HydrophobicContact CB-CB 4.43Å; L672-D677 HydrophobicContact CD2-CB 4.24Å; L672-D677 PolarHBondContact O-N 3.04Å; L672-A681 HydrophobicContact CB-CB 4.2Å; L672-Y684 HydrophobicContact CD1-CD2 3.39Å; L672-Y684 HydrophobicContact CD1-CE2 3.76Å; L672-Y684 HydrophobicContact CD1-CG 4.36Å
673	Y	92.5	Very high	93.1	Very high	21 Å²	21	25.5 Å²	25.5	8%	0.082	13%	0.129	C	C	.	.	H	α-helix	trans	-63.4	-37.3	174.1	179.9	-127.5	0	0	0	112.4	I514 T515 A669 G670 C671 H675 G676 W685 L715 M719	I514-Y673 HydrophobicContact CG2-CD1 4.38Å; T515-Y673 HydrophobicContact CG2-CE1 4.08Å; A669-Y673 VanDerWaalsContact O-CB 3.29Å; A669-Y673 WeakPolarHBondContact O-CB 3.38Å; A669-Y673 PolarHBondContact O-N 3.24Å; G670-Y673 PolarHBondContact O-N 3.49Å; C671-Y673 PolarHBondContact O-N 2.88Å; Y673-H675 VanDerWaalsContact C-N 3.32Å; Y673-H675 PolarHBondContact O-N 3.15Å; Y673-G676 PolarHBondContact O-N 3.07Å; Y673-W685 HydrophobicContact CD1-CH2 4.16Å; Y673-W685 HydrophobicContact CD1-CZ2 4.22Å; Y673-W685 HydrophobicContact CD2-CH2 4.16Å; Y673-W685 AromaticContact CG-CH2 3.93Å; Y673-W685 HydrophobicContact CG-CH2 3.93Å; Y673-W685 HydrophobicContact CG-CZ2 4.2Å; Y673-L715 HydrophobicContact CE1-CB 4.42Å; Y673-L715 HydrophobicContact CE1-CD2 4.37Å; Y673-M719 HydrophobicContact CD2-CE 3.55Å; Y673-M719 HydrophobicContact CE2-CB 4.26Å; Y673-M719 HydrophobicContact CE2-CE 3.87Å; Y673-M719 HydrophobicContact CG-CE 4.45Å
674	R	87.4	Confident	93.1	Very high	35 Å²	35	25.3 Å²	25.3	13%	0.132	13%	0.129	C	C	.	.	H	α-helix	trans	-64.4	-34.8	176.4	-73.5	-175.5	-58.1	-105.2	7.6	112.8	L513 P516 L519 D565 Y646 G670 C671 L672	L513-R674 PolarHBondContact O-NH1 3.39Å; P516-R674 HydrophobicContact CG-CB 4.3Å; P516-R674 HydrophobicContact CG-CG 4.12Å; L519-R674 VanDerWaalsContact CD1-CZ 3.49Å; D565-R674 IonicContact OD2-CZ 3.39Å; D565-R674 VanDerWaalsContact OD2-CZ 3.26Å; D565-R674 IonicContact OD2-NE 2.69Å; D565-R674 PolarHBondContact OD2-NE 3.13Å; D565-R674 IonicContact OD2-NH2 3.97Å; D565-R674 PolarHBondContact OD2-NH2 3.34Å; Y646-R674 PolarHBondContact OH-NH2 3.22Å; G670-R674 WeakPolarHBondContact O-CB 3.49Å; G670-R674 VanDerWaalsContact O-CG 3.25Å; G670-R674 WeakPolarHBondContact O-CG 3.47Å; G670-R674 PolarHBondContact O-N 3.26Å; C671-R674 WeakPolarHBondContact O-CB 3.45Å; C671-R674 PolarHBondContact O-N 3.4Å; C671-R674 VanDerWaalsContact O-N 3.09Å; L672-R674 VanDerWaalsContact C-N 3.34Å; L672-R674 PolarHBondContact O-N 3.02Å
675	H	87.5	Confident	93.2	Very high	78 Å²	78	25.3 Å²	25.3	36%	0.361	13%	0.129	S	C	.	.	H	α-helix	trans	-88.6	-7.4	175.8	-64.9	-61.5	0	0	0	114.3	D565 V639 C671 L672 Y673	D565-H675 IonicContact OD1-CD2 2.76Å; D565-H675 IonicContact OD1-CE1 3.74Å; D565-H675 PolarHBondContact OD1-CE1 3.24Å; D565-H675 IonicContact OD1-NE2 3.85Å; D565-H675 PolarHBondContact OD1-NE2 3.36Å; D565-H675 IonicContact OD2-NE2 2.68Å; V639-H675 WeakPolarHBondContact CG1-CD2 3.5Å; C671-H675 PolarHBondContact O-CD2 3.06Å; C671-H675 PolarHBondContact O-N 3.16Å; L672-H675 PolarHBondContact O-N 2.89Å; Y673-H675 VanDerWaalsContact C-N 3.32Å; Y673-H675 PolarHBondContact O-N 3.15Å
676	G	87.8	Confident	93.2	Very high	43 Å²	43	25.1 Å²	25.1	44%	0.443	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.8	5	173	0	0	0	0	0	115.4	L672 Y673 N678	L672-G676 PolarHBondContact O-N 2.82Å; Y673-G676 PolarHBondContact O-N 3.07Å; G676-N678 PolarHBondContact O-N 2.7Å; G676-N678 PolarHBondContact O-ND2 3.07Å; G676-N678 VanDerWaalsContact O-ND2 3.08Å
677	D	90.7	Very high	93.3	Very high	62 Å²	62	27.3 Å²	27.3	33%	0.332	14%	0.139	S	C	.	.			trans	-76.2	80.7	168.8	-175	-4.1	0	0	0	110	L672 R679 S680 A681	L672-D677 HydrophobicContact CB-CB 4.43Å; L672-D677 HydrophobicContact CD2-CB 4.24Å; L672-D677 PolarHBondContact O-N 3.04Å; D677-R679 VanDerWaalsContact C-N 3.25Å; D677-R679 PolarHBondContact O-N 2.85Å; D677-R679 PolarHBondContact OD1-N 2.79Å; D677-R679 VanDerWaalsContact OD1-N 3.12Å; D677-S680 VanDerWaalsContact CG-CB 3.5Å; D677-S680 VanDerWaalsContact CG-OG 3.3Å; D677-S680 PolarHBondContact OD1-N 2.64Å; D677-S680 PolarHBondContact OD1-OG 2.89Å; D677-S680 WeakPolarHBondContact OD2-CB 3.12Å; D677-S680 PolarHBondContact OD2-OG 3.45Å; D677-A681 VanDerWaalsContact O-CB 3.24Å; D677-A681 WeakPolarHBondContact O-CB 3.41Å; D677-A681 PolarHBondContact O-N 3.04Å
678	N	92.9	Very high	93.5	Very high	49 Å²	49	26.4 Å²	26.4	26%	0.262	13%	0.133	S	C	.	.	H	α-helix	trans	-65.7	-28	178.1	-59.7	-62.1	0	0	0	112.4	G676 L682 M719 I749	G676-N678 PolarHBondContact O-N 2.7Å; G676-N678 PolarHBondContact O-ND2 3.07Å; G676-N678 VanDerWaalsContact O-ND2 3.08Å; N678-L682 WeakPolarHBondContact O-CB 3.35Å; N678-L682 WeakPolarHBondContact O-CD1 3.4Å; N678-L682 VanDerWaalsContact O-CG 3.23Å; N678-L682 WeakPolarHBondContact O-CG 3.4Å; N678-L682 PolarHBondContact O-N 3.44Å; N678-L682 VanDerWaalsContact O-N 3.13Å; N678-M719 HydrophobicContact CB-CE 3.84Å; N678-M719 HydrophobicContact CB-CG 3.94Å; N678-M719 HydrophobicContact CB-SD 3.78Å; N678-M719 WeakPolarHBondContact OD1-CE 3.43Å; N678-M719 WeakPolarHBondContact OD1-CG 3.41Å; N678-I749 HydrophobicContact CB-CD1 4.03Å; N678-I749 HydrophobicContact CB-CG2 4.2Å
679	R	93	Very high	93.6	Very high	72 Å²	72	26.4 Å²	26.4	27%	0.272	13%	0.133	S	C	.	.	H	α-helix	trans	-70	-50.9	-179.1	177.4	-172.6	-78.3	-89.5	2.6	109.8	D677 L682 R683 D752	D677-R679 VanDerWaalsContact C-N 3.25Å; D677-R679 PolarHBondContact O-N 2.85Å; D677-R679 PolarHBondContact OD1-N 2.79Å; D677-R679 VanDerWaalsContact OD1-N 3.12Å; R679-L682 PolarHBondContact O-N 3.26Å; R679-R683 PolarHBondContact O-N 3.28Å; R679-D752 VanDerWaalsContact CZ-CG 3.44Å; R679-D752 IonicContact CZ-OD1 2.72Å; R679-D752 VanDerWaalsContact CZ-OD1 3.23Å; R679-D752 IonicContact CZ-OD2 2.73Å; R679-D752 IonicContact NH1-OD1 3.98Å; R679-D752 PolarHBondContact NH1-OD1 3.34Å; R679-D752 IonicContact NH1-OD2 3.64Å; R679-D752 PolarHBondContact NH1-OD2 2.89Å; R679-D752 IonicContact NH2-OD1 3.43Å; R679-D752 PolarHBondContact NH2-OD1 2.78Å; R679-D752 IonicContact NH2-OD2 3.88Å
680	S	92.5	Very high	93.8	Very high	25 Å²	25	30 Å²	30	18%	0.175	15%	0.148	C	C	.	.	H	α-helix	trans	-73.4	-33.3	178.8	-53.6	0	0	0	0	111.9	D677 L682 R683 Y684	D677-S680 VanDerWaalsContact CG-CB 3.5Å; D677-S680 VanDerWaalsContact CG-OG 3.3Å; D677-S680 PolarHBondContact OD1-N 2.64Å; D677-S680 PolarHBondContact OD1-OG 2.89Å; D677-S680 WeakPolarHBondContact OD2-CB 3.12Å; D677-S680 PolarHBondContact OD2-OG 3.45Å; S680-L682 PolarHBondContact O-N 2.68Å; S680-R683 WeakPolarHBondContact O-CB 3.37Å; S680-R683 PolarHBondContact O-N 2.9Å; S680-R683 VanDerWaalsContact O-N 3.16Å; S680-Y684 VanDerWaalsContact O-CD2 3.28Å; S680-Y684 WeakPolarHBondContact O-CD2 3.28Å; S680-Y684 PolarHBondContact O-N 3.17Å
681	A	95	Very high	94.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-57.5	-46.2	171.8	0	0	0	0	0	112.2	A669 L672 D677 R683 Y684 W685 M719	A669-A681 WeakPolarHBondContact O-CB 3.48Å; L672-A681 HydrophobicContact CB-CB 4.2Å; D677-A681 VanDerWaalsContact O-CB 3.24Å; D677-A681 WeakPolarHBondContact O-CB 3.41Å; D677-A681 PolarHBondContact O-N 3.04Å; A681-R683 VanDerWaalsContact C-N 3.34Å; A681-R683 PolarHBondContact O-N 2.85Å; A681-Y684 PolarHBondContact O-N 3.11Å; A681-W685 HydrophobicContact CB-CH2 4.43Å; A681-W685 HydrophobicContact CB-CZ3 4.44Å; A681-W685 PolarHBondContact O-N 3.45Å; A681-M719 HydrophobicContact CB-CE 4.1Å
682	L	96.6	Very high	94.5	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-60	-42.4	173.6	-73.3	166.9	0	0	0	112.2	N678 R679 S680 W685 A686 M716 M719 F720 I749 C755 Y758	N678-L682 WeakPolarHBondContact O-CB 3.35Å; N678-L682 WeakPolarHBondContact O-CD1 3.4Å; N678-L682 VanDerWaalsContact O-CG 3.23Å; N678-L682 WeakPolarHBondContact O-CG 3.4Å; N678-L682 PolarHBondContact O-N 3.44Å; N678-L682 VanDerWaalsContact O-N 3.13Å; R679-L682 PolarHBondContact O-N 3.26Å; S680-L682 PolarHBondContact O-N 2.68Å; L682-W685 HydrophobicContact CD2-CE3 4.2Å; L682-W685 HydrophobicContact CD2-CZ3 4.36Å; L682-A686 PolarHBondContact O-N 3.09Å; L682-M716 HydrophobicContact CD2-CE 4.04Å; L682-M716 HydrophobicContact CD2-CG 4.02Å; L682-M716 HydrophobicContact CD2-SD 4.3Å; L682-M719 HydrophobicContact CD1-SD 3.79Å; L682-M719 HydrophobicContact CD2-SD 3.87Å; L682-M719 HydrophobicContact CG-CE 4.32Å; L682-M719 HydrophobicContact CG-SD 3.65Å; L682-F720 HydrophobicContact CD1-CE1 3.74Å; L682-F720 HydrophobicContact CD1-CZ 4.02Å; L682-F720 HydrophobicContact CD2-CE1 4.2Å; L682-F720 HydrophobicContact CD2-CZ 3.68Å; L682-I749 HydrophobicContact CD1-CD1 4.44Å; L682-C755 HydrophobicContact CD1-CB 4.02Å; L682-Y758 HydrophobicContact CB-CD2 4.15Å
683	R	97.3	Very high	94.7	Very high	76 Å²	76	30.1 Å²	30.1	29%	0.287	15%	0.151	S	C	.	.	H	α-helix	trans	-58.4	-53.9	175.9	-177.2	179.4	178.5	160.4	0.6	111.6	R679 S680 A681 W685 A686 E687 Y758	R679-R683 PolarHBondContact O-N 3.28Å; S680-R683 WeakPolarHBondContact O-CB 3.37Å; S680-R683 PolarHBondContact O-N 2.9Å; S680-R683 VanDerWaalsContact O-N 3.16Å; A681-R683 VanDerWaalsContact C-N 3.34Å; A681-R683 PolarHBondContact O-N 2.85Å; R683-W685 PolarHBondContact O-N 3.17Å; R683-A686 WeakPolarHBondContact O-CB 3.44Å; R683-A686 PolarHBondContact O-N 3.11Å; R683-A686 VanDerWaalsContact O-N 3.09Å; R683-E687 PolarHBondContact O-N 2.96Å; R683-Y758 HydrophobicContact CB-CD1 4.35Å; R683-Y758 HydrophobicContact CB-CD2 4.01Å; R683-Y758 HydrophobicContact CB-CE1 4.07Å; R683-Y758 HydrophobicContact CB-CE2 3.7Å; R683-Y758 HydrophobicContact CB-CG 4.35Å; R683-Y758 HydrophobicContact CG-CD1 4.42Å; R683-Y758 HydrophobicContact CG-CE1 3.85Å; R683-Y758 HydrophobicContact CG-CE2 4.28Å
684	Y	97.3	Very high	94.8	Very high	29 Å²	29	34.7 Å²	34.7	11%	0.114	17%	0.172	C	C	.	.	H	α-helix	trans	-73.5	-24.6	-175	-73.7	-77.3	0	0	0	113.1	N647 I650 Y665 L668 L672 S680 A681 A688	N647-Y684 PolarHBondContact OD1-OH 2.96Å; I650-Y684 HydrophobicContact CD1-CD1 4.18Å; I650-Y684 HydrophobicContact CD1-CE1 4.02Å; Y665-Y684 HydrophobicContact CD1-CD1 4.04Å; Y665-Y684 HydrophobicContact CE1-CD1 4.47Å; L668-Y684 HydrophobicContact CD2-CD1 3.69Å; L668-Y684 HydrophobicContact CD2-CD2 4.11Å; L668-Y684 HydrophobicContact CD2-CE1 3.43Å; L668-Y684 VanDerWaalsContact CD2-CE1 3.43Å; L668-Y684 HydrophobicContact CD2-CE2 3.89Å; L668-Y684 HydrophobicContact CD2-CG 4.02Å; L668-Y684 HydrophobicContact CG-CD1 4.26Å; L668-Y684 HydrophobicContact CG-CD2 4.12Å; L668-Y684 HydrophobicContact CG-CE1 4.39Å; L668-Y684 HydrophobicContact CG-CE2 4.27Å; L668-Y684 HydrophobicContact CG-CG 4.11Å; L672-Y684 HydrophobicContact CD1-CD2 3.39Å; L672-Y684 HydrophobicContact CD1-CE2 3.76Å; L672-Y684 HydrophobicContact CD1-CG 4.36Å; S680-Y684 VanDerWaalsContact O-CD2 3.28Å; S680-Y684 WeakPolarHBondContact O-CD2 3.28Å; S680-Y684 PolarHBondContact O-N 3.17Å; A681-Y684 PolarHBondContact O-N 3.11Å; Y684-A688 WeakPolarHBondContact O-CB 3.36Å; Y684-A688 PolarHBondContact O-N 3.33Å
685	W	98	Very high	95.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.2	-40	164.3	-71.7	-35.5	0	0	0	112.1	I514 A669 Y673 A681 L682 R683 A688 S689 I711 L715 M716 M719 F762	I514-W685 HydrophobicContact CG2-CZ2 3.82Å; A669-W685 HydrophobicContact CB-CD2 4.25Å; A669-W685 HydrophobicContact CB-CG 3.82Å; Y673-W685 HydrophobicContact CD1-CH2 4.16Å; Y673-W685 HydrophobicContact CD1-CZ2 4.22Å; Y673-W685 HydrophobicContact CD2-CH2 4.16Å; Y673-W685 AromaticContact CG-CH2 3.93Å; Y673-W685 HydrophobicContact CG-CH2 3.93Å; Y673-W685 HydrophobicContact CG-CZ2 4.2Å; A681-W685 HydrophobicContact CB-CH2 4.43Å; A681-W685 HydrophobicContact CB-CZ3 4.44Å; A681-W685 PolarHBondContact O-N 3.45Å; L682-W685 HydrophobicContact CD2-CE3 4.2Å; L682-W685 HydrophobicContact CD2-CZ3 4.36Å; R683-W685 PolarHBondContact O-N 3.17Å; W685-A688 WeakPolarHBondContact O-CB 3.09Å; W685-A688 PolarHBondContact O-N 3Å; W685-S689 PolarHBondContact O-N 2.6Å; W685-S689 PolarHBondContact O-OG 3.24Å; W685-I711 HydrophobicContact CB-CG2 4.31Å; W685-I711 HydrophobicContact CD2-CG2 3.65Å; W685-I711 HydrophobicContact CE3-CG2 3.99Å; W685-I711 HydrophobicContact CG-CD1 4.43Å; W685-I711 HydrophobicContact CG-CG2 3.79Å; W685-L715 HydrophobicContact CH2-CB 4.03Å; W685-L715 HydrophobicContact CH2-CD1 4.4Å; W685-L715 HydrophobicContact CZ2-CB 4.41Å; W685-L715 HydrophobicContact CZ2-CD1 3.96Å; W685-M716 HydrophobicContact CB-CE 4.08Å; W685-M716 HydrophobicContact CD2-CE 4.37Å; W685-M716 HydrophobicContact CE3-CE 3.74Å; W685-M716 HydrophobicContact CE3-CG 4.04Å; W685-M716 HydrophobicContact CZ3-CG 3.92Å; W685-M719 HydrophobicContact CE3-CE 4.49Å; W685-M719 HydrophobicContact CH2-CE 3.68Å; W685-M719 HydrophobicContact CZ3-CE 3.39Å; W685-M719 HydrophobicContact CZ3-SD 4.35Å; W685-F762 HydrophobicContact CB-CD2 4.27Å; W685-F762 HydrophobicContact CB-CE2 4.38Å; W685-F762 WeakPolarHBondContact O-CD2 3.32Å
686	A	98	Very high	95.5	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.033	16%	0.16	C	C	.	.	H	α-helix	trans	-64.6	-39.9	174.9	0	0	0	0	0	112.1	L682 R683 S689 K690 Y758	L682-A686 PolarHBondContact O-N 3.09Å; R683-A686 WeakPolarHBondContact O-CB 3.44Å; R683-A686 PolarHBondContact O-N 3.11Å; R683-A686 VanDerWaalsContact O-N 3.09Å; A686-S689 WeakPolarHBondContact CA-OG 3.48Å; A686-S689 PolarHBondContact O-N 3.29Å; A686-S689 PolarHBondContact O-OG 3.05Å; A686-K690 WeakPolarHBondContact O-CB 3.16Å; A686-K690 PolarHBondContact O-N 3.12Å; A686-Y758 HydrophobicContact CB-CD1 4.41Å
687	E	97.5	Very high	95.7	Very high	50 Å²	50	29.9 Å²	29.9	23%	0.234	14%	0.142	C	C	.	.	H	α-helix	trans	-65.6	-38	171.8	-60.6	-65.5	164.9	0	0	112.1	Y665 R683 S689 K690 V691	Y665-E687 HydrophobicContact CD1-CB 3.47Å; Y665-E687 VanDerWaalsContact CD1-CB 3.47Å; Y665-E687 HydrophobicContact CD1-CG 4.48Å; Y665-E687 HydrophobicContact CE1-CB 3.46Å; Y665-E687 VanDerWaalsContact CE1-CB 3.46Å; Y665-E687 HydrophobicContact CE1-CG 4.21Å; Y665-E687 HydrophobicContact CG-CB 4.41Å; R683-E687 PolarHBondContact O-N 2.96Å; E687-S689 PolarHBondContact O-N 3.03Å; E687-K690 WeakPolarHBondContact O-CB 3.22Å; E687-K690 PolarHBondContact O-N 3.24Å; E687-K690 VanDerWaalsContact O-N 3.13Å; E687-V691 PolarHBondContact O-N 3.03Å
688	A	97.7	Very high	95.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.2	-45	173.6	0	0	0	0	0	111.9	V662 T666 Y684 W685 K690 V691 I692	V662-A688 HydrophobicContact CG1-CB 4.17Å; T666-A688 HydrophobicContact CG2-CB 3.69Å; Y684-A688 WeakPolarHBondContact O-CB 3.36Å; Y684-A688 PolarHBondContact O-N 3.33Å; W685-A688 WeakPolarHBondContact O-CB 3.09Å; W685-A688 PolarHBondContact O-N 3Å; A688-K690 VanDerWaalsContact C-N 3.31Å; A688-K690 PolarHBondContact O-N 2.76Å; A688-V691 PolarHBondContact O-N 3.33Å; A688-I692 PolarHBondContact O-N 2.85Å; A688-I692 VanDerWaalsContact O-N 3.08Å
689	S	98	Very high	95.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-66.1	-34	173.6	53.2	0	0	0	0	112.3	W685 A686 E687 V691 I692 G693 F762 H765	W685-S689 PolarHBondContact O-N 2.6Å; W685-S689 PolarHBondContact O-OG 3.24Å; A686-S689 WeakPolarHBondContact CA-OG 3.48Å; A686-S689 PolarHBondContact O-N 3.29Å; A686-S689 PolarHBondContact O-OG 3.05Å; E687-S689 PolarHBondContact O-N 3.03Å; S689-V691 VanDerWaalsContact C-N 3.25Å; S689-V691 PolarHBondContact O-N 3.12Å; S689-I692 WeakPolarHBondContact O-CG2 3.44Å; S689-I692 PolarHBondContact O-N 2.99Å; S689-I692 VanDerWaalsContact O-N 3.15Å; S689-G693 PolarHBondContact O-N 3.41Å; S689-F762 WeakPolarHBondContact OG-CA 3.22Å; S689-F762 WeakPolarHBondContact OG-CD2 3.47Å; S689-H765 VanDerWaalsContact C-CB 3.49Å; S689-H765 WeakPolarHBondContact O-CB 3.24Å
690	K	97.6	Very high	95.4	Very high	77 Å²	77	28.7 Å²	28.7	34%	0.335	14%	0.142	S	C	.	.	H	α-helix	trans	-61	-36.5	174	-179.2	176	176.9	-173.3	0	111.5	A686 E687 A688 H694	A686-K690 WeakPolarHBondContact O-CB 3.16Å; A686-K690 PolarHBondContact O-N 3.12Å; E687-K690 WeakPolarHBondContact O-CB 3.22Å; E687-K690 PolarHBondContact O-N 3.24Å; E687-K690 VanDerWaalsContact O-N 3.13Å; A688-K690 VanDerWaalsContact C-N 3.31Å; A688-K690 PolarHBondContact O-N 2.76Å; K690-H694 PolarHBondContact O-CE1 2.89Å; K690-H694 PolarHBondContact O-ND1 3.22Å
691	V	97.5	Very high	95.4	Very high	3 Å²	3	27.5 Å²	27.5	2%	0.018	13%	0.134	C	C	.	.	H	α-helix	trans	-65.3	-51.2	169.7	-178.2	0	0	0	0	111.2	N659 H660 V662 Y665 E687 A688 S689 G693 H694 Y695	N659-V691 VanDerWaalsContact O-CG1 3.31Å; N659-V691 WeakPolarHBondContact O-CG1 3.46Å; N659-V691 WeakPolarHBondContact O-CG2 3.33Å; H660-V691 VanDerWaalsContact O-CG1 3.23Å; H660-V691 WeakPolarHBondContact O-CG1 3.35Å; V662-V691 HydrophobicContact CG2-CB 4.17Å; V662-V691 HydrophobicContact CG2-CG1 3.68Å; Y665-V691 HydrophobicContact CD2-CG2 3.93Å; Y665-V691 HydrophobicContact CE2-CG2 3.66Å; E687-V691 PolarHBondContact O-N 3.03Å; A688-V691 PolarHBondContact O-N 3.33Å; S689-V691 VanDerWaalsContact C-N 3.25Å; S689-V691 PolarHBondContact O-N 3.12Å; V691-G693 PolarHBondContact O-N 2.94Å; V691-G693 VanDerWaalsContact O-N 3.16Å; V691-H694 PolarHBondContact O-N 3.41Å; V691-H694 PolarHBondContact O-ND1 2.91Å; V691-Y695 HydrophobicContact CG1-CE2 4.28Å; V691-Y695 WeakPolarHBondContact O-CD2 3.25Å
692	I	97.1	Very high	95.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.1	-26.7	-177.9	-149.5	71.4	0	0	0	113.3	W454 V662 A688 S689 H694 Y695 I704 L708 L766 W769	W454-I692 HydrophobicContact CB-CD1 3.99Å; W454-I692 HydrophobicContact CG-CD1 3.95Å; V662-I692 HydrophobicContact CG2-CD1 3.97Å; A688-I692 PolarHBondContact O-N 2.85Å; A688-I692 VanDerWaalsContact O-N 3.08Å; S689-I692 WeakPolarHBondContact O-CG2 3.44Å; S689-I692 PolarHBondContact O-N 2.99Å; S689-I692 VanDerWaalsContact O-N 3.15Å; I692-H694 PolarHBondContact O-N 3.08Å; I692-Y695 HydrophobicContact CD1-CD2 4.15Å; I692-Y695 HydrophobicContact CD1-CG 4.45Å; I692-Y695 WeakPolarHBondContact O-CB 3.12Å; I692-Y695 PolarHBondContact O-N 3.24Å; I692-I704 HydrophobicContact CD1-CG1 4.04Å; I692-I704 HydrophobicContact CD1-CG2 4.14Å; I692-L708 HydrophobicContact CB-CD1 4.34Å; I692-L708 HydrophobicContact CG1-CD1 4.21Å; I692-L708 HydrophobicContact CG2-CD1 3.93Å; I692-L766 HydrophobicContact CG2-CD2 4.38Å; I692-W769 HydrophobicContact CB-CD2 4.46Å; I692-W769 HydrophobicContact CD1-CZ2 4.14Å; I692-W769 HydrophobicContact CG1-CD2 3.57Å; I692-W769 VanDerWaalsContact CG1-CE2 3.41Å; I692-W769 HydrophobicContact CG1-CE3 4.07Å; I692-W769 HydrophobicContact CG1-CG 3.9Å; I692-W769 HydrophobicContact CG1-CH2 4.27Å; I692-W769 HydrophobicContact CG1-CZ2 3.79Å; I692-W769 HydrophobicContact CG1-CZ3 4.4Å; I692-W769 HydrophobicContact CG2-CB 4.13Å; I692-W769 HydrophobicContact CG2-CD2 4Å; I692-W769 HydrophobicContact CG2-CE3 4.06Å; I692-W769 HydrophobicContact CG2-CG 4.05Å
693	G	96.4	Very high	94.9	Very high	8 Å²	8	36 Å²	36	8%	0.082	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-10.4	173.6	0	0	0	0	0	115.7	S689 V691 L768	S689-G693 PolarHBondContact O-N 3.41Å; V691-G693 PolarHBondContact O-N 2.94Å; V691-G693 VanDerWaalsContact O-N 3.16Å; G693-L768 WeakPolarHBondContact O-CD2 3.46Å; G693-L768 WeakPolarHBondContact O-CG 3.36Å
694	H	94.2	Very high	94.8	Very high	116 Å²	116	32.4 Å²	32.4	54%	0.537	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	1.9	174.1	-60.5	78.7	0	0	0	113.5	K690 V691 I692	K690-H694 PolarHBondContact O-CE1 2.89Å; K690-H694 PolarHBondContact O-ND1 3.22Å; V691-H694 PolarHBondContact O-N 3.41Å; V691-H694 PolarHBondContact O-ND1 2.91Å; I692-H694 PolarHBondContact O-N 3.08Å
695	Y	96	Very high	94.7	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.016	16%	0.155	C	C	.	.	S	Bend	trans	-109.4	165.6	-173.9	-72.1	-92	0	0	0	113.1	H452 S453 W454 V457 S458 H660 V691 I692	H452-Y695 WeakPolarHBondContact O-CD1 3.4Å; S453-Y695 VanDerWaalsContact C-CD1 3.44Å; S453-Y695 WeakPolarHBondContact O-CE1 3.5Å; W454-Y695 HydrophobicContact CB-CD1 4.07Å; W454-Y695 HydrophobicContact CB-CE1 4.22Å; W454-Y695 HydrophobicContact CB-CG 4.47Å; V457-Y695 WeakPolarHBondContact CA-OH 3.23Å; V457-Y695 VanDerWaalsContact CG1-OH 3.27Å; V457-Y695 WeakPolarHBondContact CG1-OH 3.39Å; S458-Y695 VanDerWaalsContact OG-CD1 3.29Å; S458-Y695 WeakPolarHBondContact OG-CD1 3.43Å; S458-Y695 WeakPolarHBondContact OG-CE1 3.42Å; H660-Y695 WeakPolarHBondContact CB-OH 3.32Å; H660-Y695 PolarHBondContact O-OH 2.97Å; V691-Y695 HydrophobicContact CG1-CE2 4.28Å; V691-Y695 WeakPolarHBondContact O-CD2 3.25Å; I692-Y695 HydrophobicContact CD1-CD2 4.15Å; I692-Y695 HydrophobicContact CD1-CG 4.45Å; I692-Y695 WeakPolarHBondContact O-CB 3.12Å; I692-Y695 PolarHBondContact O-N 3.24Å
696	N	93.8	Very high	94.5	Very high	42 Å²	42	35.4 Å²	35.4	23%	0.225	17%	0.165	C	C	.	.			trans	-105.2	122.5	162.6	-70.8	-104.4	0	0	0	108.9	H452 T698 G772 S773	H452-N696 HydrophobicContact CB-CB 4.41Å; H452-N696 WeakPolarHBondContact CB-ND2 3.48Å; H452-N696 PolarHBondContact O-N 3.46Å; N696-T698 PolarHBondContact O-N 2.84Å; N696-G772 PolarHBondContact OD1-O 3.33Å; N696-S773 VanDerWaalsContact CA-OG 3.28Å; N696-S773 WeakPolarHBondContact CA-OG 3.49Å
697	H	93.8	Very high	94.3	Very high	10 Å²	10	35.7 Å²	35.7	5%	0.046	17%	0.166	C	C	.	.			trans	-68.5	121.4	177.2	176.8	-127.3	0	0	0	112	Y705 W769 S773 P774 V775 P776 V777	H697-Y705 AromaticContact CE1-CD2 3.85Å; H697-Y705 AromaticContact NE2-CD2 3.51Å; H697-Y705 AromaticContact NE2-CG 3.92Å; H697-W769 HydrophobicContact CB-CD2 4.14Å; H697-W769 HydrophobicContact CB-CG 4.43Å; H697-W769 HydrophobicContact CB-CZ2 4.01Å; H697-W769 AromaticContact CD2-CH2 3.66Å; H697-W769 AromaticContact CD2-CZ2 3.43Å; H697-W769 VanDerWaalsContact CD2-CZ2 3.43Å; H697-W769 WeakPolarHBondContact CD2-CZ2 3.31Å; H697-W769 AromaticContact CG-CZ2 3.99Å; H697-S773 PolarHBondContact N-OG 2.91Å; H697-P774 WeakPolarHBondContact O-CD 3.45Å; H697-P774 WeakPolarHBondContact O-CG 3.4Å; H697-V775 PolarHBondContact ND1-O 3Å; H697-V775 PolarHBondContact O-N 3.46Å; H697-P776 PolarHBondContact CE1-O 2.98Å; H697-P776 VanDerWaalsContact CE1-O 3.27Å; H697-P776 PolarHBondContact ND1-O 3.32Å; H697-V777 HydrophobicContact CB-CG2 3.73Å
698	T	92.1	Very high	94.3	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.018	16%	0.155	C	C	.	.			trans	-119.5	167.4	177.8	73.1	0	0	0	0	111.4	L450 N696 E700 D701 P774	L450-T698 HydrophobicContact CD2-CG2 4.12Å; N696-T698 PolarHBondContact O-N 2.84Å; T698-E700 PolarHBondContact O-N 2.88Å; T698-E700 VanDerWaalsContact O-N 3.14Å; T698-D701 WeakPolarHBondContact CA-OD2 3.29Å; T698-D701 WeakPolarHBondContact CB-OD2 3.29Å; T698-D701 PolarHBondContact N-OD2 2.93Å; T698-D701 PolarHBondContact O-N 3.38Å; T698-D701 VanDerWaalsContact O-N 3.14Å; T698-D701 PolarHBondContact OG1-OD2 3.12Å; T698-P774 HydrophobicContact CG2-CG 3.93Å
699	S	88.9	Confident	94.1	Very high	62 Å²	62	35.4 Å²	35.4	43%	0.434	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.4	179	43.3	0	0	0	0	113.8
700	E	87.5	Confident	94	Very high	92 Å²	92	37.2 Å²	37.2	43%	0.43	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-15.2	-177.7	-41.6	-47.8	112.6	0	0	112.5	L450 L455 T698 W702	L450-E700 HydrophobicContact CD2-CG 4.13Å; L455-E700 HydrophobicContact CD2-CB 3.83Å; L455-E700 HydrophobicContact CD2-CG 4.42Å; T698-E700 PolarHBondContact O-N 2.88Å; T698-E700 VanDerWaalsContact O-N 3.14Å; E700-W702 PolarHBondContact O-N 2.93Å
701	D	92.9	Very high	93.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	24.8	178.7	-52.5	-58.7	0	0	0	112.3	S453 W454 L455 T698 E703 I704 Y705 W769	S453-D701 WeakPolarHBondContact CB-OD2 3.29Å; W454-D701 WeakPolarHBondContact CA-OD1 3.5Å; W454-D701 HydrophobicContact CB-CB 4.4Å; W454-D701 WeakPolarHBondContact CB-OD1 3.32Å; W454-D701 HydrophobicContact CE3-CB 4.43Å; W454-D701 PolarHBondContact N-OD1 2.7Å; L455-D701 PolarHBondContact N-OD1 3.42Å; T698-D701 WeakPolarHBondContact CA-OD2 3.29Å; T698-D701 WeakPolarHBondContact CB-OD2 3.29Å; T698-D701 PolarHBondContact N-OD2 2.93Å; T698-D701 PolarHBondContact O-N 3.38Å; T698-D701 VanDerWaalsContact O-N 3.14Å; T698-D701 PolarHBondContact OG1-OD2 3.12Å; D701-E703 VanDerWaalsContact C-N 3.26Å; D701-E703 PolarHBondContact O-N 2.77Å; D701-I704 HydrophobicContact CB-CG2 4.21Å; D701-I704 WeakPolarHBondContact O-CG2 3.27Å; D701-Y705 WeakPolarHBondContact O-CB 3.39Å; D701-Y705 PolarHBondContact O-N 3.39Å; D701-Y705 VanDerWaalsContact O-N 3.12Å; D701-W769 HydrophobicContact CB-CZ2 4.38Å
702	W	91	Very high	93.8	Very high	149 Å²	149	33.4 Å²	33.4	56%	0.564	16%	0.158	S	C	*	.	H	α-helix	trans	-62.6	-29.3	-172.4	79	-72.4	0	0	0	113.5	E700 R706	E700-W702 PolarHBondContact O-N 2.93Å; W702-R706 WeakPolarHBondContact O-CB 3.31Å; W702-R706 PolarHBondContact O-N 2.89Å
703	E	90.7	Very high	93.6	Very high	32 Å²	32	34.9 Å²	34.9	15%	0.15	17%	0.166	C	C	.	.	H	α-helix	trans	-71.9	-48.5	-175.5	-155.4	68.8	178.6	0	0	111.2	W454 D701 R706 E707	W454-E703 HydrophobicContact CH2-CB 4.3Å; W454-E703 HydrophobicContact CZ3-CB 4.15Å; D701-E703 VanDerWaalsContact C-N 3.26Å; D701-E703 PolarHBondContact O-N 2.77Å; E703-R706 WeakPolarHBondContact O-CB 3.48Å; E703-R706 PolarHBondContact O-N 3.13Å; E703-R706 IonicContact OE1-CZ 3.9Å; E703-R706 IonicContact OE1-NH1 2.56Å; E703-R706 PolarHBondContact OE1-NH1 2.78Å; E703-R706 IonicContact OE1-NH2 3.74Å; E703-R706 PolarHBondContact OE1-NH2 2.93Å; E703-R706 IonicContact OE2-CZ 2.76Å; E703-R706 VanDerWaalsContact OE2-CZ 3.26Å; E703-R706 IonicContact OE2-NH1 3.79Å; E703-R706 PolarHBondContact OE2-NH1 2.81Å; E703-R706 IonicContact OE2-NH2 3.48Å; E703-E707 PolarHBondContact O-N 3.18Å
704	I	94.6	Very high	93.5	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-70.3	-34.1	174.1	-166.9	57.2	0	0	0	112.1	W454 V662 I692 D701 R706 E707 L708 W769	W454-I704 HydrophobicContact CB-CG2 4.25Å; W454-I704 HydrophobicContact CD2-CB 3.76Å; W454-I704 HydrophobicContact CD2-CG1 4.39Å; W454-I704 HydrophobicContact CD2-CG2 3.43Å; W454-I704 VanDerWaalsContact CD2-CG2 3.43Å; W454-I704 HydrophobicContact CE3-CB 3.86Å; W454-I704 HydrophobicContact CE3-CG2 3.44Å; W454-I704 VanDerWaalsContact CE3-CG2 3.44Å; W454-I704 HydrophobicContact CG-CB 4.42Å; W454-I704 HydrophobicContact CG-CG2 3.81Å; W454-I704 HydrophobicContact CH2-CB 3.86Å; W454-I704 HydrophobicContact CH2-CG2 4.39Å; W454-I704 HydrophobicContact CZ2-CB 3.79Å; W454-I704 HydrophobicContact CZ2-CD1 4.46Å; W454-I704 HydrophobicContact CZ2-CG1 4.32Å; W454-I704 HydrophobicContact CZ2-CG2 4.41Å; W454-I704 HydrophobicContact CZ3-CB 3.91Å; W454-I704 HydrophobicContact CZ3-CG2 3.95Å; V662-I704 HydrophobicContact CB-CD1 4.41Å; V662-I704 HydrophobicContact CG1-CD1 3.87Å; V662-I704 HydrophobicContact CG1-CG1 4.4Å; I692-I704 HydrophobicContact CD1-CG1 4.04Å; I692-I704 HydrophobicContact CD1-CG2 4.14Å; D701-I704 HydrophobicContact CB-CG2 4.21Å; D701-I704 WeakPolarHBondContact O-CG2 3.27Å; I704-R706 VanDerWaalsContact C-N 3.3Å; I704-R706 PolarHBondContact O-N 3.4Å; I704-E707 PolarHBondContact O-N 3.49Å; I704-L708 HydrophobicContact CD1-CD1 4.46Å; I704-L708 HydrophobicContact CD1-CG 4.37Å; I704-L708 HydrophobicContact CG1-CD1 3.97Å; I704-L708 HydrophobicContact CG1-CG 4.37Å; I704-L708 WeakPolarHBondContact O-CB 3.45Å; I704-L708 WeakPolarHBondContact O-CG 3.28Å; I704-L708 PolarHBondContact O-N 2.77Å; I704-W769 HydrophobicContact CG2-CH2 4.08Å; I704-W769 HydrophobicContact CG2-CZ2 4.05Å
705	Y	96.2	Very high	93.5	Very high	36 Å²	36	33.2 Å²	33.2	14%	0.141	16%	0.157	C	C	.	.	H	α-helix	trans	-57.4	-44.4	171.3	177.9	-89.5	0	0	0	111.2	H697 D701 L709 W769 V777 H779 W782	H697-Y705 AromaticContact CE1-CD2 3.85Å; H697-Y705 AromaticContact NE2-CD2 3.51Å; H697-Y705 AromaticContact NE2-CG 3.92Å; D701-Y705 WeakPolarHBondContact O-CB 3.39Å; D701-Y705 PolarHBondContact O-N 3.39Å; D701-Y705 VanDerWaalsContact O-N 3.12Å; Y705-L709 HydrophobicContact CE1-CD2 4.09Å; Y705-L709 WeakPolarHBondContact O-CB 3.43Å; Y705-L709 PolarHBondContact O-N 2.65Å; Y705-W769 HydrophobicContact CD2-CH2 4.24Å; Y705-W769 HydrophobicContact CD2-CZ3 4.17Å; Y705-V777 HydrophobicContact CD2-CG1 4.4Å; Y705-V777 HydrophobicContact CE2-CG1 4.11Å; Y705-V777 PolarHBondContact OH-O 3.46Å; Y705-H779 PolarHBondContact OH-CD2 2.92Å; Y705-H779 PolarHBondContact OH-NE2 3.01Å; Y705-W782 HydrophobicContact CD2-CZ2 4.31Å; Y705-W782 AromaticContact CE2-CZ2 3.7Å; Y705-W782 HydrophobicContact CE2-CZ2 3.7Å; Y705-W782 AromaticContact CZ-CZ2 3.84Å; Y705-W782 AromaticContact CZ-NE1 3.86Å; Y705-W782 PolarHBondContact OH-NE1 2.94Å
706	R	94.1	Very high	93.4	Very high	56 Å²	56	33.1 Å²	33.1	21%	0.211	16%	0.156	C	C	.	.	H	α-helix	trans	-63.7	-42.8	178.6	-173.3	-167.8	69.8	-149.2	-2.6	112.3	W702 E703 I704 L709 E710	W702-R706 WeakPolarHBondContact O-CB 3.31Å; W702-R706 PolarHBondContact O-N 2.89Å; E703-R706 WeakPolarHBondContact O-CB 3.48Å; E703-R706 PolarHBondContact O-N 3.13Å; E703-R706 IonicContact OE1-CZ 3.9Å; E703-R706 IonicContact OE1-NH1 2.56Å; E703-R706 PolarHBondContact OE1-NH1 2.78Å; E703-R706 IonicContact OE1-NH2 3.74Å; E703-R706 PolarHBondContact OE1-NH2 2.93Å; E703-R706 IonicContact OE2-CZ 2.76Å; E703-R706 VanDerWaalsContact OE2-CZ 3.26Å; E703-R706 IonicContact OE2-NH1 3.79Å; E703-R706 PolarHBondContact OE2-NH1 2.81Å; E703-R706 IonicContact OE2-NH2 3.48Å; I704-R706 VanDerWaalsContact C-N 3.3Å; I704-R706 PolarHBondContact O-N 3.4Å; R706-L709 PolarHBondContact O-N 2.84Å; R706-E710 PolarHBondContact O-N 3.32Å
707	E	93.3	Very high	93.4	Very high	9 Å²	9	31.6 Å²	31.6	4%	0.042	15%	0.149	C	C	.	.	H	α-helix	trans	-65.5	-47.1	177.2	-72.5	-161.5	-175.6	0	0	112.5	Y663 E703 I704 L709 E710 I711	Y663-E707 WeakPolarHBondContact CE1-OE1 3.28Å; E703-E707 PolarHBondContact O-N 3.18Å; I704-E707 PolarHBondContact O-N 3.49Å; E707-L709 VanDerWaalsContact C-N 3.27Å; E707-L709 PolarHBondContact O-N 3.13Å; E707-E710 PolarHBondContact O-N 3.33Å; E707-E710 VanDerWaalsContact O-N 3.13Å; E707-I711 VanDerWaalsContact O-CG1 3.32Å; E707-I711 WeakPolarHBondContact O-CG1 3.34Å; E707-I711 PolarHBondContact O-N 3.13Å
708	L	96.4	Very high	93.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.9	-36.4	178.1	-67.8	169.1	0	0	0	111.5	I692 I704 I711 A712 F762 L766 W769 W782	I692-L708 HydrophobicContact CB-CD1 4.34Å; I692-L708 HydrophobicContact CG1-CD1 4.21Å; I692-L708 HydrophobicContact CG2-CD1 3.93Å; I704-L708 HydrophobicContact CD1-CD1 4.46Å; I704-L708 HydrophobicContact CD1-CG 4.37Å; I704-L708 HydrophobicContact CG1-CD1 3.97Å; I704-L708 HydrophobicContact CG1-CG 4.37Å; I704-L708 WeakPolarHBondContact O-CB 3.45Å; I704-L708 WeakPolarHBondContact O-CG 3.28Å; I704-L708 PolarHBondContact O-N 2.77Å; L708-I711 HydrophobicContact CD2-CD1 4.34Å; L708-A712 VanDerWaalsContact O-CB 3.3Å; L708-A712 WeakPolarHBondContact O-CB 3.29Å; L708-A712 PolarHBondContact O-N 2.83Å; L708-F762 HydrophobicContact CD2-CE2 3.98Å; L708-F762 HydrophobicContact CD2-CZ 4.22Å; L708-L766 HydrophobicContact CB-CD2 4.45Å; L708-L766 HydrophobicContact CD1-CD2 4.09Å; L708-W769 HydrophobicContact CD1-CE3 4.31Å; L708-W769 HydrophobicContact CD1-CH2 4.22Å; L708-W769 HydrophobicContact CD1-CZ3 3.78Å; L708-W782 HydrophobicContact CB-CH2 4.06Å
709	L	95.2	Very high	93.5	Very high	45 Å²	45	35.3 Å²	35.3	24%	0.236	17%	0.166	C	C	.	.	H	α-helix	trans	-63.7	-42.8	172.4	179.7	70.7	0	0	0	111.8	Y705 R706 E707 A712 T713 W782	Y705-L709 HydrophobicContact CE1-CD2 4.09Å; Y705-L709 WeakPolarHBondContact O-CB 3.43Å; Y705-L709 PolarHBondContact O-N 2.65Å; R706-L709 PolarHBondContact O-N 2.84Å; E707-L709 VanDerWaalsContact C-N 3.27Å; E707-L709 PolarHBondContact O-N 3.13Å; L709-A712 PolarHBondContact O-N 2.67Å; L709-T713 HydrophobicContact CD1-CG2 3.65Å; L709-T713 HydrophobicContact CG-CG2 4.4Å; L709-T713 VanDerWaalsContact O-CB 3.29Å; L709-T713 WeakPolarHBondContact O-CB 3.36Å; L709-T713 WeakPolarHBondContact O-CG2 3.43Å; L709-T713 PolarHBondContact O-N 3.46Å; L709-T713 PolarHBondContact O-OG1 2.68Å; L709-W782 VanDerWaalsContact CA-CH2 3.45Å; L709-W782 HydrophobicContact CB-CH2 3.96Å; L709-W782 HydrophobicContact CB-CZ2 3.78Å; L709-W782 HydrophobicContact CD1-CD2 4.02Å; L709-W782 HydrophobicContact CD1-CG 4.47Å; L709-W782 HydrophobicContact CD1-CH2 4.38Å; L709-W782 HydrophobicContact CD1-CZ2 3.72Å; L709-W782 HydrophobicContact CG-CZ2 4.36Å; L709-W782 VanDerWaalsContact N-CH2 3.34Å
710	E	93.8	Very high	93.8	Very high	38 Å²	38	32.3 Å²	32.3	18%	0.178	15%	0.145	C	C	.	.	H	α-helix	trans	-64.9	-46.2	176.5	-178	160.7	-168.2	0	0	111.3	D512 R706 E707 A712 T713 H714 L715	D512-E710 WeakPolarHBondContact CB-OE1 3.12Å; R706-E710 PolarHBondContact O-N 3.32Å; E707-E710 PolarHBondContact O-N 3.33Å; E707-E710 VanDerWaalsContact O-N 3.13Å; E710-A712 PolarHBondContact O-N 2.96Å; E710-T713 PolarHBondContact O-N 3.48Å; E710-H714 HydrophobicContact CG-CB 4.13Å; E710-H714 WeakPolarHBondContact O-CA 3.46Å; E710-H714 WeakPolarHBondContact O-CB 3.32Å; E710-H714 PolarHBondContact O-N 3.41Å; E710-H714 IonicContact OE1-CD2 2.68Å; E710-L715 HydrophobicContact CG-CD2 4.22Å; E710-L715 HydrophobicContact CG-CG 4.23Å; E710-L715 PolarHBondContact O-N 3.34Å
711	I	95.9	Very high	94.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	15%	0.149	C	C	.	.	I	π-helix	trans	-52.7	-52.3	174.4	-68.8	161	0	0	0	110.7	I514 T666 W685 E707 L708 L715 M716 F762	I514-I711 HydrophobicContact CD1-CD1 3.84Å; I514-I711 HydrophobicContact CD1-CG1 3.66Å; T666-I711 HydrophobicContact CG2-CD1 4.44Å; W685-I711 HydrophobicContact CB-CG2 4.31Å; W685-I711 HydrophobicContact CD2-CG2 3.65Å; W685-I711 HydrophobicContact CE3-CG2 3.99Å; W685-I711 HydrophobicContact CG-CD1 4.43Å; W685-I711 HydrophobicContact CG-CG2 3.79Å; E707-I711 VanDerWaalsContact O-CG1 3.32Å; E707-I711 WeakPolarHBondContact O-CG1 3.34Å; E707-I711 PolarHBondContact O-N 3.13Å; L708-I711 HydrophobicContact CD2-CD1 4.34Å; I711-L715 HydrophobicContact CB-CD1 4.48Å; I711-L715 HydrophobicContact CG1-CD1 3.94Å; I711-L715 PolarHBondContact O-N 3.3Å; I711-M716 HydrophobicContact CG2-CE 3.83Å; I711-M716 HydrophobicContact CG2-CG 4.4Å; I711-M716 HydrophobicContact CG2-SD 4.5Å; I711-M716 PolarHBondContact O-N 2.98Å; I711-F762 HydrophobicContact CB-CZ 4.41Å; I711-F762 HydrophobicContact CG2-CE2 4.01Å; I711-F762 HydrophobicContact CG2-CZ 3.89Å
712	A	95.8	Very high	94	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.165	C	C	.	.	I	π-helix	trans	-71.5	-38	-175	0	0	0	0	0	114.1	L708 L709 E710 P717 F762 W782	L708-A712 VanDerWaalsContact O-CB 3.3Å; L708-A712 WeakPolarHBondContact O-CB 3.29Å; L708-A712 PolarHBondContact O-N 2.83Å; L709-A712 PolarHBondContact O-N 2.67Å; E710-A712 PolarHBondContact O-N 2.96Å; A712-P717 WeakPolarHBondContact O-CD 3.46Å; A712-P717 VanDerWaalsContact O-CG 3.29Å; A712-P717 WeakPolarHBondContact O-CG 3.49Å; A712-F762 HydrophobicContact CB-CE1 3.79Å; A712-F762 HydrophobicContact CB-CZ 4.27Å; A712-W782 HydrophobicContact CB-CE3 3.55Å; A712-W782 HydrophobicContact CB-CZ3 3.46Å; A712-W782 VanDerWaalsContact CB-CZ3 3.46Å
713	T	93.7	Very high	94	Very high	30 Å²	30	30.2 Å²	30.2	18%	0.184	14%	0.144	C	C	.	.	I	π-helix	trans	-107.7	-16.7	-166.7	72.8	0	0	0	0	114.8	L709 E710 K785	L709-T713 HydrophobicContact CD1-CG2 3.65Å; L709-T713 HydrophobicContact CG-CG2 4.4Å; L709-T713 VanDerWaalsContact O-CB 3.29Å; L709-T713 WeakPolarHBondContact O-CB 3.36Å; L709-T713 WeakPolarHBondContact O-CG2 3.43Å; L709-T713 PolarHBondContact O-N 3.46Å; L709-T713 PolarHBondContact O-OG1 2.68Å; E710-T713 PolarHBondContact O-N 3.48Å; T713-K785 HydrophobicContact CG2-CB 4.41Å; T713-K785 HydrophobicContact CG2-CG 3.95Å; T713-K785 PolarHBondContact O-NZ 3.03Å
714	H	93.2	Very high	93.9	Very high	90 Å²	90	30.3 Å²	30.3	42%	0.417	15%	0.148	S	C	.	.	I	π-helix	trans	-116	-55.2	174.9	-167	43.3	0	0	0	112.4	E710 Q718	E710-H714 HydrophobicContact CG-CB 4.13Å; E710-H714 WeakPolarHBondContact O-CA 3.46Å; E710-H714 WeakPolarHBondContact O-CB 3.32Å; E710-H714 PolarHBondContact O-N 3.41Å; E710-H714 IonicContact OE1-CD2 2.68Å; H714-Q718 WeakPolarHBondContact O-CB 3.34Å; H714-Q718 PolarHBondContact O-N 2.81Å; H714-Q718 VanDerWaalsContact O-N 3.07Å
715	L	93.8	Very high	93.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.168	C	C	.	.	I	π-helix	trans	-74.4	-57.7	-167.2	-47.6	-172	0	0	0	113	I514 T515 Y673 W685 E710 I711 Q718 M719	I514-L715 HydrophobicContact CB-CD1 3.6Å; I514-L715 HydrophobicContact CD1-CD1 4.04Å; I514-L715 HydrophobicContact CG1-CD1 4.38Å; I514-L715 HydrophobicContact CG2-CD1 3.43Å; I514-L715 VanDerWaalsContact CG2-CD1 3.43Å; T515-L715 HydrophobicContact CG2-CD2 3.32Å; Y673-L715 HydrophobicContact CE1-CB 4.42Å; Y673-L715 HydrophobicContact CE1-CD2 4.37Å; W685-L715 HydrophobicContact CH2-CB 4.03Å; W685-L715 HydrophobicContact CH2-CD1 4.4Å; W685-L715 HydrophobicContact CZ2-CB 4.41Å; W685-L715 HydrophobicContact CZ2-CD1 3.96Å; E710-L715 HydrophobicContact CG-CD2 4.22Å; E710-L715 HydrophobicContact CG-CG 4.23Å; E710-L715 PolarHBondContact O-N 3.34Å; I711-L715 HydrophobicContact CB-CD1 4.48Å; I711-L715 HydrophobicContact CG1-CD1 3.94Å; I711-L715 PolarHBondContact O-N 3.3Å; L715-Q718 WeakPolarHBondContact O-CB 3.35Å; L715-Q718 PolarHBondContact O-N 2.67Å; L715-M719 WeakPolarHBondContact O-CB 3.34Å; L715-M719 PolarHBondContact O-N 3.22Å
716	M	95.2	Very high	92.9	Very high	1 Å²	1	38 Å²	38	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-56.8	-44.6	175.8	-69.7	179.3	-178.5	0	0	111.7	L682 W685 I711 Q718 M719 F720 L759 F762	L682-M716 HydrophobicContact CD2-CE 4.04Å; L682-M716 HydrophobicContact CD2-CG 4.02Å; L682-M716 HydrophobicContact CD2-SD 4.3Å; W685-M716 HydrophobicContact CB-CE 4.08Å; W685-M716 HydrophobicContact CD2-CE 4.37Å; W685-M716 HydrophobicContact CE3-CE 3.74Å; W685-M716 HydrophobicContact CE3-CG 4.04Å; W685-M716 HydrophobicContact CZ3-CG 3.92Å; I711-M716 HydrophobicContact CG2-CE 3.83Å; I711-M716 HydrophobicContact CG2-CG 4.4Å; I711-M716 HydrophobicContact CG2-SD 4.5Å; I711-M716 PolarHBondContact O-N 2.98Å; M716-Q718 VanDerWaalsContact C-N 3.27Å; M716-Q718 PolarHBondContact O-N 3.2Å; M716-M719 PolarHBondContact O-N 3.18Å; M716-F720 HydrophobicContact CB-CD2 4.17Å; M716-F720 HydrophobicContact CB-CE2 3.79Å; M716-F720 HydrophobicContact CG-CE2 4.39Å; M716-F720 WeakPolarHBondContact O-CD2 3.36Å; M716-F720 WeakPolarHBondContact O-CG 3.46Å; M716-F720 PolarHBondContact O-N 3.44Å; M716-L759 HydrophobicContact SD-CD1 3.87Å; M716-F762 HydrophobicContact CE-CB 4.32Å; M716-F762 HydrophobicContact CE-CD1 3.99Å; M716-F762 HydrophobicContact CE-CD2 3.91Å; M716-F762 HydrophobicContact CE-CE1 4.26Å; M716-F762 HydrophobicContact CE-CE2 4.19Å; M716-F762 HydrophobicContact CE-CG 3.8Å; M716-F762 HydrophobicContact CE-CZ 4.36Å; M716-F762 HydrophobicContact SD-CD1 4.38Å
717	P	94.2	Very high	92.1	Very high	11 Å²	11	37 Å²	37	7%	0.071	19%	0.19	C	C	.	.	H	α-helix	trans	-66	-20.6	175.4	-24.8	36.9	0	0	0	115.6	A712 R721 K785 N789 R792	A712-P717 WeakPolarHBondContact O-CD 3.46Å; A712-P717 VanDerWaalsContact O-CG 3.29Å; A712-P717 WeakPolarHBondContact O-CG 3.49Å; P717-R721 WeakPolarHBondContact O-CB 3.43Å; P717-K785 HydrophobicContact CG-CB 4.44Å; P717-K785 HydrophobicContact CG-CD 4.23Å; P717-N789 WeakPolarHBondContact CA-OD1 3.4Å; P717-R792 PolarHBondContact O-NH1 3.01Å
718	Q	92.3	Very high	90.9	Very high	85 Å²	85	43.7 Å²	43.7	40%	0.397	22%	0.221	S	C	.	.	H	α-helix	trans	-79.6	-51.4	169	177.7	173.7	-27.8	0	0	110.7	H714 L715 M716 F720 R721 S722	H714-Q718 WeakPolarHBondContact O-CB 3.34Å; H714-Q718 PolarHBondContact O-N 2.81Å; H714-Q718 VanDerWaalsContact O-N 3.07Å; L715-Q718 WeakPolarHBondContact O-CB 3.35Å; L715-Q718 PolarHBondContact O-N 2.67Å; M716-Q718 VanDerWaalsContact C-N 3.27Å; M716-Q718 PolarHBondContact O-N 3.2Å; Q718-F720 PolarHBondContact O-N 2.8Å; Q718-R721 WeakPolarHBondContact O-CA 3.39Å; Q718-R721 WeakPolarHBondContact O-CB 3.4Å; Q718-R721 PolarHBondContact O-N 3.42Å; Q718-S722 PolarHBondContact O-N 2.84Å; Q718-S722 PolarHBondContact O-OG 3.41Å
719	M	94.3	Very high	89.2	Confident	5 Å²	5	52.1 Å²	52.1	3%	0.025	26%	0.258	C	S	.	.	H	α-helix	trans	-51.1	-55.4	177.7	177.3	-168.1	-77	0	0	112	Y673 N678 A681 L682 W685 L715 M716 R721 S722 A723 I749	Y673-M719 HydrophobicContact CD2-CE 3.55Å; Y673-M719 HydrophobicContact CE2-CB 4.26Å; Y673-M719 HydrophobicContact CE2-CE 3.87Å; Y673-M719 HydrophobicContact CG-CE 4.45Å; N678-M719 HydrophobicContact CB-CE 3.84Å; N678-M719 HydrophobicContact CB-CG 3.94Å; N678-M719 HydrophobicContact CB-SD 3.78Å; N678-M719 WeakPolarHBondContact OD1-CE 3.43Å; N678-M719 WeakPolarHBondContact OD1-CG 3.41Å; A681-M719 HydrophobicContact CB-CE 4.1Å; L682-M719 HydrophobicContact CD1-SD 3.79Å; L682-M719 HydrophobicContact CD2-SD 3.87Å; L682-M719 HydrophobicContact CG-CE 4.32Å; L682-M719 HydrophobicContact CG-SD 3.65Å; W685-M719 HydrophobicContact CE3-CE 4.49Å; W685-M719 HydrophobicContact CH2-CE 3.68Å; W685-M719 HydrophobicContact CZ3-CE 3.39Å; W685-M719 HydrophobicContact CZ3-SD 4.35Å; L715-M719 WeakPolarHBondContact O-CB 3.34Å; L715-M719 PolarHBondContact O-N 3.22Å; M716-M719 PolarHBondContact O-N 3.18Å; M719-R721 PolarHBondContact O-N 3.05Å; M719-S722 PolarHBondContact O-N 3.46Å; M719-A723 PolarHBondContact O-N 2.81Å; M719-I749 HydrophobicContact CG-CD1 3.71Å; M719-I749 HydrophobicContact SD-CD1 3.99Å
720	F	95.4	Very high	87	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.6	-23.3	179.2	-61.6	-46.6	0	0	0	113.3	L682 M716 Q718 S724 I749 L750 L759 N789 F793	L682-F720 HydrophobicContact CD1-CE1 3.74Å; L682-F720 HydrophobicContact CD1-CZ 4.02Å; L682-F720 HydrophobicContact CD2-CE1 4.2Å; L682-F720 HydrophobicContact CD2-CZ 3.68Å; M716-F720 HydrophobicContact CB-CD2 4.17Å; M716-F720 HydrophobicContact CB-CE2 3.79Å; M716-F720 HydrophobicContact CG-CE2 4.39Å; M716-F720 WeakPolarHBondContact O-CD2 3.36Å; M716-F720 WeakPolarHBondContact O-CG 3.46Å; M716-F720 PolarHBondContact O-N 3.44Å; Q718-F720 PolarHBondContact O-N 2.8Å; F720-S724 WeakPolarHBondContact O-CB 3.47Å; F720-S724 PolarHBondContact O-N 3.38Å; F720-I749 HydrophobicContact CD1-CD1 3.83Å; F720-I749 HydrophobicContact CD1-CG1 4.42Å; F720-I749 HydrophobicContact CE1-CD1 4.06Å; F720-L750 HydrophobicContact CB-CD2 4.12Å; F720-L750 HydrophobicContact CD1-CD2 3.73Å; F720-L750 HydrophobicContact CG-CD2 4.22Å; F720-L759 HydrophobicContact CE2-CD1 4.21Å; F720-L759 HydrophobicContact CE2-CD2 4Å; F720-L759 HydrophobicContact CZ-CB 4.49Å; F720-L759 HydrophobicContact CZ-CD2 4.21Å; F720-N789 HydrophobicContact CD2-CB 3.8Å; F720-N789 HydrophobicContact CE2-CB 3.96Å; F720-F793 HydrophobicContact CD1-CE2 4.04Å; F720-F793 HydrophobicContact CD1-CZ 4.1Å; F720-F793 AromaticContact CE1-CE2 3.64Å; F720-F793 HydrophobicContact CE1-CE2 3.64Å; F720-F793 AromaticContact CE1-CZ 3.42Å; F720-F793 HydrophobicContact CE1-CZ 3.42Å; F720-F793 VanDerWaalsContact CE1-CZ 3.42Å; F720-F793 HydrophobicContact CE2-CE2 4.14Å; F720-F793 HydrophobicContact CG-CE2 4.48Å; F720-F793 AromaticContact CZ-CE2 3.7Å; F720-F793 HydrophobicContact CZ-CE2 3.7Å; F720-F793 AromaticContact CZ-CZ 3.71Å; F720-F793 HydrophobicContact CZ-CZ 3.71Å
721	R	93.4	Very high	85	Confident	135 Å²	135	57.2 Å²	57.2	51%	0.509	30%	0.301	S	S	.	.	H	α-helix	trans	-71	-49.7	172.5	-169.7	-163.1	-59.5	-117.6	0.7	110.1	P717 Q718 M719 A723 S724 E725	P717-R721 WeakPolarHBondContact O-CB 3.43Å; Q718-R721 WeakPolarHBondContact O-CA 3.39Å; Q718-R721 WeakPolarHBondContact O-CB 3.4Å; Q718-R721 PolarHBondContact O-N 3.42Å; M719-R721 PolarHBondContact O-N 3.05Å; R721-A723 VanDerWaalsContact C-N 3.3Å; R721-A723 PolarHBondContact O-N 2.9Å; R721-S724 PolarHBondContact O-N 3.24Å; R721-S724 VanDerWaalsContact O-N 3.16Å; R721-E725 WeakPolarHBondContact CD-OE1 3.37Å; R721-E725 HydrophobicContact CG-CG 4.4Å; R721-E725 VanDerWaalsContact CG-OE1 3.25Å; R721-E725 WeakPolarHBondContact CG-OE1 3.5Å; R721-E725 WeakPolarHBondContact O-CG 3.44Å; R721-E725 PolarHBondContact O-N 3.33Å
722	S	90.6	Very high	83	Confident	48 Å²	48	66.1 Å²	66.1	34%	0.336	34%	0.342	S	S	.	.	H	α-helix	trans	-62.8	-35.6	179.1	-61.9	0	0	0	0	112.6	Q718 M719 N726	Q718-S722 PolarHBondContact O-N 2.84Å; Q718-S722 PolarHBondContact O-OG 3.41Å; M719-S722 PolarHBondContact O-N 3.46Å; S722-N726 WeakPolarHBondContact O-CB 3.23Å; S722-N726 PolarHBondContact O-N 3.25Å; S722-N726 PolarHBondContact O-ND2 3.31Å; S722-N726 PolarHBondContact O-OD1 3.4Å
723	A	91.3	Very high	81.2	Confident	14 Å²	14	67.8 Å²	67.8	12%	0.116	36%	0.359	C	S	.	.	H	α-helix	trans	-61.7	-47.6	171.2	0	0	0	0	0	112.3	M719 R721 N726 S727 I749 L750	M719-A723 PolarHBondContact O-N 2.81Å; R721-A723 VanDerWaalsContact C-N 3.3Å; R721-A723 PolarHBondContact O-N 2.9Å; A723-N726 PolarHBondContact O-N 2.96Å; A723-S727 PolarHBondContact O-N 2.81Å; A723-S727 VanDerWaalsContact O-N 3.09Å; A723-I749 HydrophobicContact CB-CD1 3.94Å; A723-I749 HydrophobicContact CB-CG1 3.68Å; A723-L750 HydrophobicContact CB-CD1 3.95Å; A723-L750 HydrophobicContact CB-CG 3.98Å
724	S	90	Very high	79.9	Confident	34 Å²	34	69.9 Å²	69.9	24%	0.238	38%	0.375	C	S	.	.	H	α-helix	trans	-63.7	-40.7	176.8	176.5	0	0	0	0	112.5	F720 R721 S727 H728	F720-S724 WeakPolarHBondContact O-CB 3.47Å; F720-S724 PolarHBondContact O-N 3.38Å; R721-S724 PolarHBondContact O-N 3.24Å; R721-S724 VanDerWaalsContact O-N 3.16Å; S724-S727 PolarHBondContact O-OG 3.08Å; S724-H728 PolarHBondContact O-CD2 3.01Å; S724-H728 PolarHBondContact O-N 3.28Å
725	E	86.6	Confident	79	Confident	92 Å²	92	69 Å²	69	43%	0.43	38%	0.375	S	S	.	.	H	α-helix	trans	-64.4	-45.8	175.8	-72.8	168.1	-178	0	0	111.3	R721 S727 H728 F729	R721-E725 WeakPolarHBondContact CD-OE1 3.37Å; R721-E725 HydrophobicContact CG-CG 4.4Å; R721-E725 VanDerWaalsContact CG-OE1 3.25Å; R721-E725 WeakPolarHBondContact CG-OE1 3.5Å; R721-E725 WeakPolarHBondContact O-CG 3.44Å; R721-E725 PolarHBondContact O-N 3.33Å; E725-S727 PolarHBondContact O-N 3.18Å; E725-H728 PolarHBondContact O-N 3.41Å; E725-F729 VanDerWaalsContact O-CD2 3.27Å; E725-F729 WeakPolarHBondContact O-CD2 3.4Å; E725-F729 PolarHBondContact O-N 3.3Å
726	N	81.7	Confident	78.4	Confident	106 Å²	106	69.6 Å²	69.6	57%	0.567	38%	0.379	S	S	*	.	H	α-helix	trans	-60.6	-41.9	178.7	-71.8	-11	0	0	0	112.6	S722 A723 H728 F729 C730	S722-N726 WeakPolarHBondContact O-CB 3.23Å; S722-N726 PolarHBondContact O-N 3.25Å; S722-N726 PolarHBondContact O-ND2 3.31Å; S722-N726 PolarHBondContact O-OD1 3.4Å; A723-N726 PolarHBondContact O-N 2.96Å; N726-H728 VanDerWaalsContact C-N 3.25Å; N726-H728 PolarHBondContact O-N 2.89Å; N726-F729 PolarHBondContact O-N 2.89Å; N726-C730 PolarHBondContact O-N 3.24Å; N726-C730 PolarHBondContact O-SG 3.43Å
727	S	77.3	Confident	77.7	Confident	33 Å²	33	73.6 Å²	73.6	23%	0.231	40%	0.403	C	S	.	.	H	α-helix	trans	-62.8	-28.5	179	70.1	0	0	0	0	113.6	A723 S724 E725 Q745	A723-S727 PolarHBondContact O-N 2.81Å; A723-S727 VanDerWaalsContact O-N 3.09Å; S724-S727 PolarHBondContact O-OG 3.08Å; E725-S727 PolarHBondContact O-N 3.18Å; S727-Q745 VanDerWaalsContact CB-OE1 3.24Å
728	H	68.8	Low	76.8	Confident	150 Å²	150	73.4 Å²	73.4	69%	0.694	40%	0.402	S	S	*	.	H	α-helix	trans	-79.4	-27.6	178.1	-76.7	-51.9	0	0	0	114.4	S724 E725 N726	S724-H728 PolarHBondContact O-CD2 3.01Å; S724-H728 PolarHBondContact O-N 3.28Å; E725-H728 PolarHBondContact O-N 3.41Å; N726-H728 VanDerWaalsContact C-N 3.25Å; N726-H728 PolarHBondContact O-N 2.89Å
729	F	60.3	Low	76.2	Confident	178 Å²	178	72.4 Å²	72.4	78%	0.781	40%	0.403	S	S	*	.	H	α-helix	trans	-91.8	-18	-179.7	-72.6	-70.6	0	0	0	113.7	E725 N726	E725-F729 VanDerWaalsContact O-CD2 3.27Å; E725-F729 WeakPolarHBondContact O-CD2 3.4Å; E725-F729 PolarHBondContact O-N 3.3Å; N726-F729 PolarHBondContact O-N 2.89Å
730	C	49.4	Very low	75.3	Confident	66 Å²	66	76.7 Å²	76.7	45%	0.446	43%	0.426	S	S	.	.			trans	-104.3	82.7	-172.1	-58.7	0	0	0	0	113.2	N726 E732	N726-C730 PolarHBondContact O-N 3.24Å; N726-C730 PolarHBondContact O-SG 3.43Å; C730-E732 PolarHBondContact O-N 3.12Å
731	S	52.7	Low	74.3	Confident	124 Å²	124	79.1 Å²	79.1	87%	0.867	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-1	167.5	-58.1	0	0	0	0	114.1
732	E	52.3	Low	73.6	Confident	187 Å²	187	74.9 Å²	74.9	87%	0.874	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	5.2	-174.7	-60.4	-174.4	141.2	0	0	113.6	C730	C730-E732 PolarHBondContact O-N 3.12Å
733	G	57.9	Low	73.1	Confident	34 Å²	34	78.5 Å²	78.5	35%	0.351	46%	0.456	S	S	.	.	S	Bend	trans	-67.9	156.4	171.9	0	0	0	0	0	112.1	V735	G733-V735 PolarHBondContact O-N 3.14Å
734	S	66.3	Low	72.6	Confident	74 Å²	74	79.8 Å²	79.8	52%	0.517	46%	0.458	S	S	.	.			trans	-66.5	102.9	173.7	-170.6	0	0	0	0	109.5	P746	S734-P746 WeakPolarHBondContact O-CD 3.42Å
735	V	76.1	Confident	72.3	Confident	71 Å²	71	80 Å²	80	43%	0.43	46%	0.456	S	S	.	.			trans	-88.8	110.8	175.4	-178.4	0	0	0	0	108.7	G733 L743 Y744 Q745	G733-V735 PolarHBondContact O-N 3.14Å; V735-L743 HydrophobicContact CG1-CB 3.76Å; V735-L743 HydrophobicContact CG1-CD1 4.4Å; V735-L743 HydrophobicContact CG1-CD2 4.02Å; V735-L743 HydrophobicContact CG1-CG 4.27Å; V735-Y744 WeakPolarHBondContact CA-O 3.45Å; V735-Q745 HydrophobicContact CG2-CG 4.47Å
736	D	80.6	Confident	71.9	Confident	14 Å²	14	77.4 Å²	77.4	8%	0.075	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	165.8	174	-77.6	-5.8	0	0	0	110.4	L743 Y744 P746 R1310	D736-L743 WeakPolarHBondContact O-CA 3.35Å; D736-Y744 HydrophobicContact CB-CD1 3.91Å; D736-Y744 HydrophobicContact CB-CE1 3.28Å; D736-Y744 HydrophobicContact CB-CE2 4.1Å; D736-Y744 PolarHBondContact N-O 3.26Å; D736-Y744 VanDerWaalsContact O-CD1 3.25Å; D736-Y744 WeakPolarHBondContact O-CD1 3.35Å; D736-Y744 PolarHBondContact O-N 2.87Å; D736-P746 HydrophobicContact CB-CG 3.82Å; D736-P746 VanDerWaalsContact CG-CG 3.47Å; D736-P746 WeakPolarHBondContact OD2-CG 3.33Å; D736-R1310 IonicContact OD1-CZ 3.36Å; D736-R1310 IonicContact OD1-NH1 3.71Å; D736-R1310 PolarHBondContact OD1-NH1 3.46Å; D736-R1310 IonicContact OD1-NH2 3.63Å; D736-R1310 IonicContact OD2-CZ 2.82Å; D736-R1310 VanDerWaalsContact OD2-CZ 3.24Å; D736-R1310 IonicContact OD2-NH1 2.79Å; D736-R1310 PolarHBondContact OD2-NH1 3.26Å; D736-R1310 IonicContact OD2-NH2 3.7Å; D736-R1310 PolarHBondContact OD2-NH2 3.12Å
737	T	79.4	Confident	71.9	Confident	84 Å²	84	79.2 Å²	79.2	52%	0.515	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129.6	178.9	-48.1	0	0	0	0	109.7	C742 L743	T737-C742 WeakPolarHBondContact CA-O 3.49Å; T737-L743 HydrophobicContact CG2-CD2 4.24Å; T737-L743 WeakPolarHBondContact OG1-CD2 3.44Å
738	D	77	Confident	72.5	Confident	7 Å²	7	78.4 Å²	78.4	4%	0.037	45%	0.45	C	S	.	.			trans	-64.8	162.2	171.5	-112.1	-0.8	0	0	0	111.8	D740 G741 C742 R796 R799 H800 L1318	D738-D740 PolarHBondContact O-N 2.8Å; D738-D740 VanDerWaalsContact O-N 3.12Å; D738-G741 PolarHBondContact O-N 3.41Å; D738-C742 HydrophobicContact CB-CB 4.14Å; D738-C742 PolarHBondContact N-O 2.94Å; D738-R796 IonicContact OD1-CZ 2.76Å; D738-R796 VanDerWaalsContact OD1-CZ 3.23Å; D738-R796 IonicContact OD1-NH1 3.26Å; D738-R796 PolarHBondContact OD1-NH1 3.49Å; D738-R796 IonicContact OD1-NH2 3.86Å; D738-R796 PolarHBondContact OD1-NH2 2.9Å; D738-R796 IonicContact OD2-CZ 2.92Å; D738-R796 IonicContact OD2-NH1 2.73Å; D738-R796 PolarHBondContact OD2-NH1 2.92Å; D738-R796 VanDerWaalsContact OD2-NH1 3.12Å; D738-R796 IonicContact OD2-NH2 3.9Å; D738-R799 IonicContact OD2-CZ 3.23Å; D738-R799 IonicContact OD2-NH2 3.55Å; D738-R799 PolarHBondContact OD2-NH2 2.99Å; D738-H800 IonicContact OD1-NE2 2.78Å; D738-H800 PolarHBondContact OD1-NE2 2.87Å; D738-H800 IonicContact OD2-CD2 2.69Å; D738-H800 IonicContact OD2-CE1 2.68Å; D738-H800 PolarHBondContact OD2-CE1 2.94Å; D738-H800 IonicContact OD2-NE2 2.78Å; D738-H800 PolarHBondContact OD2-NE2 3.07Å; D738-L1318 WeakPolarHBondContact OD1-CD1 3.44Å
739	P	78.5	Confident	73.7	Confident	65 Å²	65	72 Å²	72	42%	0.422	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-29.3	169.1	-24.4	34.6	0	0	0	113.3	G741 V1312 K1313 M1315 L1318	P739-G741 PolarHBondContact O-N 2.91Å; P739-V1312 HydrophobicContact CG-CG1 4.34Å; P739-K1313 VanDerWaalsContact CG-O 3.3Å; P739-K1313 WeakPolarHBondContact CG-O 3.37Å; P739-M1315 HydrophobicContact CB-CE 3.98Å; P739-M1315 HydrophobicContact CG-CE 4.31Å; P739-L1318 HydrophobicContact CG-CD1 4.14Å
740	D	75.2	Confident	75.3	Confident	94 Å²	94	63.7 Å²	63.7	50%	0.503	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	2.2	174.3	-77.9	-7.1	0	0	0	114.4	D738 C742 R799 M1315	D738-D740 PolarHBondContact O-N 2.8Å; D738-D740 VanDerWaalsContact O-N 3.12Å; D740-C742 VanDerWaalsContact C-N 3.31Å; D740-C742 PolarHBondContact O-N 3.12Å; D740-R799 IonicContact OD2-CZ 2.66Å; D740-R799 VanDerWaalsContact OD2-CZ 3.3Å; D740-R799 IonicContact OD2-NE 2.9Å; D740-R799 IonicContact OD2-NH1 3.19Å; D740-R799 PolarHBondContact OD2-NH1 2.56Å; D740-M1315 HydrophobicContact CB-CE 4.28Å; D740-M1315 WeakPolarHBondContact OD1-CE 3.35Å
741	G	75.6	Confident	77.3	Confident	51 Å²	51	61.3 Å²	61.3	53%	0.526	37%	0.367	S	S	.	.	S	Bend	trans	78.4	7.3	-176.7	0	0	0	0	0	115	D738 P739	D738-G741 PolarHBondContact O-N 3.41Å; P739-G741 PolarHBondContact O-N 2.91Å
742	C	78	Confident	79.1	Confident	47 Å²	47	56.3 Å²	56.3	32%	0.318	33%	0.331	S	S	.	.			trans	-79.5	125.3	178.9	-51.2	0	0	0	0	111.3	T737 D738 D740 R799	T737-C742 WeakPolarHBondContact CA-O 3.49Å; D738-C742 HydrophobicContact CB-CB 4.14Å; D738-C742 PolarHBondContact N-O 2.94Å; D740-C742 VanDerWaalsContact C-N 3.31Å; D740-C742 PolarHBondContact O-N 3.12Å; C742-R799 PolarHBondContact SG-NH1 3.38Å; C742-R799 VanDerWaalsContact SG-NH1 3.4Å; C742-R799 PolarHBondContact SG-NH2 2.96Å
743	L	80.4	Confident	81.1	Confident	123 Å²	123	47.9 Å²	47.9	64%	0.644	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	144.9	174.2	-60.6	-179.3	0	0	0	111.6	V735 D736 T737	V735-L743 HydrophobicContact CG1-CB 3.76Å; V735-L743 HydrophobicContact CG1-CD1 4.4Å; V735-L743 HydrophobicContact CG1-CD2 4.02Å; V735-L743 HydrophobicContact CG1-CG 4.27Å; D736-L743 WeakPolarHBondContact O-CA 3.35Å; T737-L743 HydrophobicContact CG2-CD2 4.24Å; T737-L743 WeakPolarHBondContact OG1-CD2 3.44Å
744	Y	81.2	Confident	82.8	Confident	41 Å²	41	48.8 Å²	48.8	16%	0.161	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	164.7	178.1	74.6	-76.3	0	0	0	112.8	V735 D736 P746 D751	V735-Y744 WeakPolarHBondContact CA-O 3.45Å; D736-Y744 HydrophobicContact CB-CD1 3.91Å; D736-Y744 HydrophobicContact CB-CE1 3.28Å; D736-Y744 HydrophobicContact CB-CE2 4.1Å; D736-Y744 PolarHBondContact N-O 3.26Å; D736-Y744 VanDerWaalsContact O-CD1 3.25Å; D736-Y744 WeakPolarHBondContact O-CD1 3.35Å; D736-Y744 PolarHBondContact O-N 2.87Å; Y744-P746 HydrophobicContact CD2-CG 4.34Å; Y744-P746 HydrophobicContact CE2-CB 4.17Å; Y744-P746 HydrophobicContact CE2-CG 3.8Å; Y744-D751 HydrophobicContact CD2-CB 4.48Å
745	Q	82.8	Confident	84.3	Confident	39 Å²	39	45.3 Å²	45.3	18%	0.182	26%	0.262	C	S	.	.			trans	-106.4	110.8	174.8	-71.4	174.3	-16.5	0	0	109.8	S727 V735 D747 N748 D751	S727-Q745 VanDerWaalsContact CB-OE1 3.24Å; V735-Q745 HydrophobicContact CG2-CG 4.47Å; Q745-D747 VanDerWaalsContact C-N 3.27Å; Q745-D747 PolarHBondContact O-N 3.4Å; Q745-N748 HydrophobicContact CB-CB 3.71Å; Q745-N748 WeakPolarHBondContact O-CB 3.37Å; Q745-N748 PolarHBondContact O-N 3.03Å; Q745-D751 PolarHBondContact N-OD2 3.47Å
746	P	77.6	Confident	85.2	Confident	37 Å²	37	42.2 Å²	42.2	24%	0.24	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-33.9	-175.8	-25.1	34.6	0	0	0	114.7	S734 D736 Y744 N748	S734-P746 WeakPolarHBondContact O-CD 3.42Å; D736-P746 HydrophobicContact CB-CG 3.82Å; D736-P746 VanDerWaalsContact CG-CG 3.47Å; D736-P746 WeakPolarHBondContact OD2-CG 3.33Å; Y744-P746 HydrophobicContact CD2-CG 4.34Å; Y744-P746 HydrophobicContact CE2-CB 4.17Å; Y744-P746 HydrophobicContact CE2-CG 3.8Å; P746-N748 VanDerWaalsContact C-N 3.28Å; P746-N748 PolarHBondContact O-N 2.9Å
747	D	83.2	Confident	86	Confident	145 Å²	145	41.8 Å²	41.8	78%	0.775	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-8.9	-178.9	-48.5	-48.5	0	0	0	112.6	Q745 I749	Q745-D747 VanDerWaalsContact C-N 3.27Å; Q745-D747 PolarHBondContact O-N 3.4Å; D747-I749 PolarHBondContact O-N 3.16Å
748	N	89.5	Confident	86.9	Confident	16 Å²	16	39 Å²	39	9%	0.086	22%	0.222	C	C	.	.			trans	-86	111.6	-179.6	-176.9	6.8	0	0	0	110.8	Q745 P746 L750 D751	Q745-N748 HydrophobicContact CB-CB 3.71Å; Q745-N748 WeakPolarHBondContact O-CB 3.37Å; Q745-N748 PolarHBondContact O-N 3.03Å; P746-N748 VanDerWaalsContact C-N 3.28Å; P746-N748 PolarHBondContact O-N 2.9Å; N748-L750 PolarHBondContact O-N 3.36Å; N748-L750 WeakPolarHBondContact OD1-CB 3.42Å; N748-L750 PolarHBondContact OD1-N 3.23Å; N748-L750 VanDerWaalsContact OD1-N 3.09Å; N748-D751 PolarHBondContact O-N 2.89Å
749	I	93	Very high	87.9	Confident	14 Å²	14	38.7 Å²	38.7	7%	0.072	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-17.9	176.6	62.6	175.2	0	0	0	114.4	N678 L682 M719 F720 A723 D747 C755 F793	N678-I749 HydrophobicContact CB-CD1 4.03Å; N678-I749 HydrophobicContact CB-CG2 4.2Å; L682-I749 HydrophobicContact CD1-CD1 4.44Å; M719-I749 HydrophobicContact CG-CD1 3.71Å; M719-I749 HydrophobicContact SD-CD1 3.99Å; F720-I749 HydrophobicContact CD1-CD1 3.83Å; F720-I749 HydrophobicContact CD1-CG1 4.42Å; F720-I749 HydrophobicContact CE1-CD1 4.06Å; A723-I749 HydrophobicContact CB-CD1 3.94Å; A723-I749 HydrophobicContact CB-CG1 3.68Å; D747-I749 PolarHBondContact O-N 3.16Å; I749-C755 HydrophobicContact CB-CB 4.25Å; I749-C755 VanDerWaalsContact O-CB 3.26Å; I749-C755 WeakPolarHBondContact O-CB 3.08Å; I749-F793 WeakPolarHBondContact O-CE1 3.22Å
750	L	94.7	Very high	88.8	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.021	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-18	177.4	-59.5	176	0	0	0	113.8	F720 A723 N748 R792 F793 T794	F720-L750 HydrophobicContact CB-CD2 4.12Å; F720-L750 HydrophobicContact CD1-CD2 3.73Å; F720-L750 HydrophobicContact CG-CD2 4.22Å; A723-L750 HydrophobicContact CB-CD1 3.95Å; A723-L750 HydrophobicContact CB-CG 3.98Å; N748-L750 PolarHBondContact O-N 3.36Å; N748-L750 WeakPolarHBondContact OD1-CB 3.42Å; N748-L750 PolarHBondContact OD1-N 3.23Å; N748-L750 VanDerWaalsContact OD1-N 3.09Å; L750-R792 HydrophobicContact CD1-CB 4.29Å; L750-R792 HydrophobicContact CD2-CB 3.96Å; L750-F793 HydrophobicContact CD2-CD1 4.5Å; L750-F793 HydrophobicContact CD2-CD2 4.22Å; L750-F793 HydrophobicContact CD2-CE2 4.21Å; L750-F793 HydrophobicContact CD2-CG 4.37Å; L750-F793 HydrophobicContact CD2-CZ 4.39Å; L750-T794 PolarHBondContact O-N 2.62Å; L750-T794 PolarHBondContact O-OG1 3.31Å
751	D	91.3	Very high	89.8	Confident	17 Å²	17	32.2 Å²	32.2	9%	0.091	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-10.4	172.6	-85.4	-40	0	0	0	112.6	Y744 Q745 N748 T794 R796	Y744-D751 HydrophobicContact CD2-CB 4.48Å; Q745-D751 PolarHBondContact N-OD2 3.47Å; N748-D751 PolarHBondContact O-N 2.89Å; D751-T794 WeakPolarHBondContact OD1-CB 3.14Å; D751-T794 WeakPolarHBondContact OD1-CG2 3.45Å; D751-T794 PolarHBondContact OD1-OG1 2.84Å; D751-R796 WeakPolarHBondContact O-CD 3.44Å; D751-R796 PolarHBondContact O-NE 3.28Å
752	D	91.4	Very high	90.9	Very high	19 Å²	19	29.8 Å²	29.8	10%	0.102	16%	0.158	C	C	.	.			trans	-90.9	121.4	-173.3	-177.3	75.2	0	0	0	112.9	R679 H754 C755 L756	R679-D752 VanDerWaalsContact CZ-CG 3.44Å; R679-D752 IonicContact CZ-OD1 2.72Å; R679-D752 VanDerWaalsContact CZ-OD1 3.23Å; R679-D752 IonicContact CZ-OD2 2.73Å; R679-D752 IonicContact NH1-OD1 3.98Å; R679-D752 PolarHBondContact NH1-OD1 3.34Å; R679-D752 IonicContact NH1-OD2 3.64Å; R679-D752 PolarHBondContact NH1-OD2 2.89Å; R679-D752 IonicContact NH2-OD1 3.43Å; R679-D752 PolarHBondContact NH2-OD1 2.78Å; R679-D752 IonicContact NH2-OD2 3.88Å; D752-H754 VanDerWaalsContact C-N 3.31Å; D752-H754 PolarHBondContact O-N 3.23Å; D752-H754 IonicContact OD1-CD2 2.68Å; D752-H754 WeakPolarHBondContact OD2-CA 3.49Å; D752-H754 VanDerWaalsContact OD2-CB 3.27Å; D752-H754 WeakPolarHBondContact OD2-CB 3.37Å; D752-H754 PolarHBondContact OD2-N 3.46Å; D752-H754 VanDerWaalsContact OD2-N 3.1Å; D752-C755 HydrophobicContact CB-CB 4.17Å; D752-C755 PolarHBondContact O-N 3.14Å; D752-C755 PolarHBondContact OD2-N 3.03Å; D752-C755 PolarHBondContact OD2-SG 2.88Å; D752-L756 PolarHBondContact O-N 3.34Å
753	P	93.7	Very high	91.8	Very high	9 Å²	9	27.6 Å²	27.6	6%	0.058	14%	0.143	C	C	.	.	H	α-helix	trans	-69.5	-24.4	179	27.4	-33.9	0	0	0	113.4	L756 S757 H800 V1320	P753-L756 PolarHBondContact O-N 2.84Å; P753-S757 PolarHBondContact O-N 3.19Å; P753-H800 HydrophobicContact CB-CB 3.93Å; P753-H800 HydrophobicContact CG-CB 3.98Å; P753-V1320 HydrophobicContact CB-CB 4.18Å; P753-V1320 HydrophobicContact CB-CG2 3.71Å; P753-V1320 HydrophobicContact CG-CG2 3.63Å
754	H	94.3	Very high	92.7	Very high	54 Å²	54	21.8 Å²	21.8	25%	0.25	11%	0.113	C	C	.	.	H	α-helix	trans	-69.7	-45.1	175.1	-61.3	-85.9	0	0	0	111.1	D752 L756 S757 Y758	D752-H754 VanDerWaalsContact C-N 3.31Å; D752-H754 PolarHBondContact O-N 3.23Å; D752-H754 IonicContact OD1-CD2 2.68Å; D752-H754 WeakPolarHBondContact OD2-CA 3.49Å; D752-H754 VanDerWaalsContact OD2-CB 3.27Å; D752-H754 WeakPolarHBondContact OD2-CB 3.37Å; D752-H754 PolarHBondContact OD2-N 3.46Å; D752-H754 VanDerWaalsContact OD2-N 3.1Å; H754-L756 VanDerWaalsContact C-N 3.25Å; H754-L756 PolarHBondContact O-N 3.33Å; H754-S757 WeakPolarHBondContact CA-OG 3.34Å; H754-S757 CarbonylContact O-C 3.5Å; H754-S757 WeakPolarHBondContact O-CA 3.12Å; H754-S757 WeakPolarHBondContact O-CB 3.26Å; H754-S757 PolarHBondContact O-N 2.92Å; H754-S757 PolarHBondContact O-OG 2.76Å; H754-Y758 HydrophobicContact CB-CE2 4.01Å; H754-Y758 VanDerWaalsContact O-CD2 3.28Å; H754-Y758 WeakPolarHBondContact O-CD2 3.38Å; H754-Y758 VanDerWaalsContact O-CG 3.28Å; H754-Y758 PolarHBondContact O-N 3.02Å
755	C	96	Very high	93.5	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-57.5	-36.5	173.5	-74.8	0	0	0	0	112.6	L682 I749 D752 L759 F793	L682-C755 HydrophobicContact CD1-CB 4.02Å; I749-C755 HydrophobicContact CB-CB 4.25Å; I749-C755 VanDerWaalsContact O-CB 3.26Å; I749-C755 WeakPolarHBondContact O-CB 3.08Å; D752-C755 HydrophobicContact CB-CB 4.17Å; D752-C755 PolarHBondContact O-N 3.14Å; D752-C755 PolarHBondContact OD2-N 3.03Å; D752-C755 PolarHBondContact OD2-SG 2.88Å; C755-L759 PolarHBondContact O-N 3Å; C755-L759 VanDerWaalsContact O-N 3.16Å; C755-F793 HydrophobicContact CB-CE1 3.98Å; C755-F793 HydrophobicContact CB-CZ 4.34Å
756	L	96.4	Very high	94.1	Very high	6 Å²	6	18.4 Å²	18.4	3%	0.031	10%	0.099	C	C	.	.	H	α-helix	trans	-68.6	-41	171.3	-177.1	61.6	0	0	0	112.1	D752 P753 H754 Y758 L759 L760 L790 F793 A797 R798 L801	D752-L756 PolarHBondContact O-N 3.34Å; P753-L756 PolarHBondContact O-N 2.84Å; H754-L756 VanDerWaalsContact C-N 3.25Å; H754-L756 PolarHBondContact O-N 3.33Å; L756-Y758 VanDerWaalsContact C-N 3.32Å; L756-Y758 PolarHBondContact O-N 3.08Å; L756-L759 PolarHBondContact O-N 2.96Å; L756-L760 PolarHBondContact O-N 3Å; L756-L790 HydrophobicContact CD1-CD2 3.67Å; L756-F793 HydrophobicContact CB-CD1 3.73Å; L756-F793 HydrophobicContact CB-CE1 3.77Å; L756-F793 HydrophobicContact CB-CG 4.34Å; L756-F793 HydrophobicContact CB-CZ 4.43Å; L756-F793 HydrophobicContact CD1-CB 4.15Å; L756-F793 HydrophobicContact CD1-CD1 4.05Å; L756-F793 HydrophobicContact CD1-CD2 3.92Å; L756-F793 HydrophobicContact CD1-CE1 4.41Å; L756-F793 HydrophobicContact CD1-CE2 4.31Å; L756-F793 HydrophobicContact CD1-CG 3.77Å; L756-F793 HydrophobicContact CG-CD1 4.36Å; L756-F793 HydrophobicContact CG-CG 4.5Å; L756-A797 HydrophobicContact CB-CB 4.44Å; L756-A797 HydrophobicContact CD2-CB 4.26Å; L756-R798 HydrophobicContact CD2-CB 4.42Å; L756-R798 HydrophobicContact CD2-CG 3.81Å; L756-L801 HydrophobicContact CB-CD2 4.12Å; L756-L801 HydrophobicContact CD2-CB 4.33Å; L756-L801 HydrophobicContact CD2-CD2 3.67Å; L756-L801 HydrophobicContact CG-CD2 3.58Å
757	S	96.8	Very high	95.1	Very high	6 Å²	6	16.7 Å²	16.7	4%	0.042	9%	0.087	C	C	.	.	H	α-helix	trans	-63.4	-36.5	175.8	77.8	0	0	0	0	112.6	P753 H754 L760 S761	P753-S757 PolarHBondContact O-N 3.19Å; H754-S757 WeakPolarHBondContact CA-OG 3.34Å; H754-S757 CarbonylContact O-C 3.5Å; H754-S757 WeakPolarHBondContact O-CA 3.12Å; H754-S757 WeakPolarHBondContact O-CB 3.26Å; H754-S757 PolarHBondContact O-N 2.92Å; H754-S757 PolarHBondContact O-OG 2.76Å; S757-L760 PolarHBondContact O-N 2.98Å; S757-S761 WeakPolarHBondContact O-CB 3.07Å; S757-S761 PolarHBondContact O-N 2.97Å
758	Y	97.7	Very high	95.6	Very high	26 Å²	26	12.1 Å²	12.1	10%	0.102	6%	0.062	C	C	.	.	H	α-helix	trans	-67.4	-41	175.9	-59.5	-37.2	0	0	0	111.2	L682 R683 A686 H754 L756 F762	L682-Y758 HydrophobicContact CB-CD2 4.15Å; R683-Y758 HydrophobicContact CB-CD1 4.35Å; R683-Y758 HydrophobicContact CB-CD2 4.01Å; R683-Y758 HydrophobicContact CB-CE1 4.07Å; R683-Y758 HydrophobicContact CB-CE2 3.7Å; R683-Y758 HydrophobicContact CB-CG 4.35Å; R683-Y758 HydrophobicContact CG-CD1 4.42Å; R683-Y758 HydrophobicContact CG-CE1 3.85Å; R683-Y758 HydrophobicContact CG-CE2 4.28Å; A686-Y758 HydrophobicContact CB-CD1 4.41Å; H754-Y758 HydrophobicContact CB-CE2 4.01Å; H754-Y758 VanDerWaalsContact O-CD2 3.28Å; H754-Y758 WeakPolarHBondContact O-CD2 3.38Å; H754-Y758 VanDerWaalsContact O-CG 3.28Å; H754-Y758 PolarHBondContact O-N 3.02Å; L756-Y758 VanDerWaalsContact C-N 3.32Å; L756-Y758 PolarHBondContact O-N 3.08Å; Y758-F762 VanDerWaalsContact O-CB 3.29Å; Y758-F762 WeakPolarHBondContact O-CB 2.87Å; Y758-F762 PolarHBondContact O-N 3.24Å
759	L	97.8	Very high	96	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-62.1	-43.5	174	175.2	61.6	0	0	0	112.2	M716 F720 C755 L756 Y763 L786 N789 L790 F793	M716-L759 HydrophobicContact SD-CD1 3.87Å; F720-L759 HydrophobicContact CE2-CD1 4.21Å; F720-L759 HydrophobicContact CE2-CD2 4Å; F720-L759 HydrophobicContact CZ-CB 4.49Å; F720-L759 HydrophobicContact CZ-CD2 4.21Å; C755-L759 PolarHBondContact O-N 3Å; C755-L759 VanDerWaalsContact O-N 3.16Å; L756-L759 PolarHBondContact O-N 2.96Å; L759-Y763 HydrophobicContact CD1-CD2 4.03Å; L759-Y763 HydrophobicContact CD1-CE2 3.85Å; L759-Y763 WeakPolarHBondContact O-CD2 3.33Å; L759-Y763 PolarHBondContact O-N 3.02Å; L759-L786 HydrophobicContact CD1-CD1 4.22Å; L759-L786 HydrophobicContact CD2-CD1 4.44Å; L759-L786 HydrophobicContact CG-CD1 4.23Å; L759-N789 HydrophobicContact CD2-CB 3.8Å; L759-L790 HydrophobicContact CD2-CD2 3.83Å; L759-L790 HydrophobicContact CD2-CG 4.43Å; L759-L790 HydrophobicContact CG-CD2 4.48Å; L759-F793 HydrophobicContact CD2-CD2 4.21Å; L759-F793 HydrophobicContact CD2-CE2 3.59Å; L759-F793 HydrophobicContact CD2-CZ 4.38Å
760	L	97.6	Very high	96.1	Very high	6 Å²	6	10.7 Å²	10.7	3%	0.031	6%	0.055	C	C	.	.	H	α-helix	trans	-72.1	-41.6	178.8	-70.2	179.6	0	0	0	112.1	L756 S757 F762 Y763 D764 L790 L801 L803 L1322 M1329 L1336	L756-L760 PolarHBondContact O-N 3Å; S757-L760 PolarHBondContact O-N 2.98Å; L760-F762 VanDerWaalsContact C-N 3.27Å; L760-F762 PolarHBondContact O-N 3.5Å; L760-Y763 PolarHBondContact O-N 2.74Å; L760-D764 WeakPolarHBondContact O-CB 3.41Å; L760-D764 PolarHBondContact O-N 2.75Å; L760-L790 HydrophobicContact CD2-CD1 4.32Å; L760-L790 HydrophobicContact CD2-CD2 3.8Å; L760-L790 HydrophobicContact CG-CD2 4.37Å; L760-L801 HydrophobicContact CD1-CD2 3.83Å; L760-L803 HydrophobicContact CD1-CD1 4.39Å; L760-L803 HydrophobicContact CD1-CD2 3.89Å; L760-L1322 HydrophobicContact CB-CD2 3.69Å; L760-M1329 HydrophobicContact CB-CE 4.38Å; L760-M1329 HydrophobicContact CD2-CE 3.88Å; L760-L1336 HydrophobicContact CD2-CD1 4.28Å; L760-L1336 HydrophobicContact CD2-CD2 4.22Å
761	S	97.4	Very high	96	Very high	17 Å²	17	12.8 Å²	12.8	12%	0.119	7%	0.065	C	C	.	.	H	α-helix	trans	-58.1	-38.7	173.1	-179.3	0	0	0	0	111.8	S757 D764 H765	S757-S761 WeakPolarHBondContact O-CB 3.07Å; S757-S761 PolarHBondContact O-N 2.97Å; S761-D764 PolarHBondContact O-N 2.72Å; S761-H765 PolarHBondContact O-N 3.06Å; S761-H765 VanDerWaalsContact O-N 3.08Å; S761-H765 PolarHBondContact O-ND1 3.5Å; S761-H765 PolarHBondContact OG-CE1 3.48Å; S761-H765 VanDerWaalsContact OG-CE1 3.31Å; S761-H765 PolarHBondContact OG-ND1 2.72Å
762	F	98.2	Very high	95.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-61.2	-46.6	176.6	178.4	-91.7	0	0	0	112.6	W685 S689 L708 I711 A712 M716 Y758 L760 L766	W685-F762 HydrophobicContact CB-CD2 4.27Å; W685-F762 HydrophobicContact CB-CE2 4.38Å; W685-F762 WeakPolarHBondContact O-CD2 3.32Å; S689-F762 WeakPolarHBondContact OG-CA 3.22Å; S689-F762 WeakPolarHBondContact OG-CD2 3.47Å; L708-F762 HydrophobicContact CD2-CE2 3.98Å; L708-F762 HydrophobicContact CD2-CZ 4.22Å; I711-F762 HydrophobicContact CB-CZ 4.41Å; I711-F762 HydrophobicContact CG2-CE2 4.01Å; I711-F762 HydrophobicContact CG2-CZ 3.89Å; A712-F762 HydrophobicContact CB-CE1 3.79Å; A712-F762 HydrophobicContact CB-CZ 4.27Å; M716-F762 HydrophobicContact CE-CB 4.32Å; M716-F762 HydrophobicContact CE-CD1 3.99Å; M716-F762 HydrophobicContact CE-CD2 3.91Å; M716-F762 HydrophobicContact CE-CE1 4.26Å; M716-F762 HydrophobicContact CE-CE2 4.19Å; M716-F762 HydrophobicContact CE-CG 3.8Å; M716-F762 HydrophobicContact CE-CZ 4.36Å; M716-F762 HydrophobicContact SD-CD1 4.38Å; Y758-F762 VanDerWaalsContact O-CB 3.29Å; Y758-F762 WeakPolarHBondContact O-CB 2.87Å; Y758-F762 PolarHBondContact O-N 3.24Å; L760-F762 VanDerWaalsContact C-N 3.27Å; L760-F762 PolarHBondContact O-N 3.5Å; F762-L766 HydrophobicContact CD1-CD1 3.86Å; F762-L766 HydrophobicContact CE1-CD1 3.39Å; F762-L766 HydrophobicContact CE1-CG 4.4Å; F762-L766 HydrophobicContact CZ-CD1 3.89Å; F762-L766 WeakPolarHBondContact O-CG 3.3Å; F762-L766 PolarHBondContact O-N 3.49Å
763	Y	97.9	Very high	95.9	Very high	1 Å²	1	14.5 Å²	14.5	0%	0.004	9%	0.088	C	C	.	.	H	α-helix	trans	-74.7	-23.9	176.8	-82.3	-97	0	0	0	113.5	L759 L760 C767 W782 L786	L759-Y763 HydrophobicContact CD1-CD2 4.03Å; L759-Y763 HydrophobicContact CD1-CE2 3.85Å; L759-Y763 WeakPolarHBondContact O-CD2 3.33Å; L759-Y763 PolarHBondContact O-N 3.02Å; L760-Y763 PolarHBondContact O-N 2.74Å; Y763-C767 PolarHBondContact O-N 3.48Å; Y763-C767 PolarHBondContact O-SG 3.4Å; Y763-W782 HydrophobicContact CE1-CB 4.32Å; Y763-W782 HydrophobicContact CE1-CE3 4.42Å; Y763-W782 PolarHBondContact OH-O 3.09Å; Y763-W782 VanDerWaalsContact OH-O 3.07Å; Y763-L786 HydrophobicContact CD1-CB 4.33Å; Y763-L786 HydrophobicContact CD1-CD1 4.45Å; Y763-L786 HydrophobicContact CD1-CD2 3.85Å; Y763-L786 HydrophobicContact CD1-CG 4.42Å; Y763-L786 HydrophobicContact CD2-CD1 3.68Å; Y763-L786 HydrophobicContact CD2-CD2 4.47Å; Y763-L786 HydrophobicContact CD2-CG 4.48Å; Y763-L786 HydrophobicContact CE1-CB 3.78Å; Y763-L786 HydrophobicContact CE1-CD1 4.48Å; Y763-L786 HydrophobicContact CE1-CD2 4.16Å; Y763-L786 HydrophobicContact CE1-CG 4.34Å; Y763-L786 HydrophobicContact CE2-CB 4.21Å; Y763-L786 HydrophobicContact CE2-CD1 3.74Å; Y763-L786 HydrophobicContact CE2-CG 4.42Å; Y763-L786 HydrophobicContact CG-CD1 4.03Å; Y763-L786 HydrophobicContact CG-CD2 3.99Å; Y763-L786 HydrophobicContact CG-CG 4.46Å
764	D	97.7	Very high	95.7	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-67.4	-48.3	174.2	-173.1	41.7	0	0	0	112.3	L760 S761 L766 C767 L768 L1324 Y1325 S1326 M1329	L760-D764 WeakPolarHBondContact O-CB 3.41Å; L760-D764 PolarHBondContact O-N 2.75Å; S761-D764 PolarHBondContact O-N 2.72Å; D764-L766 VanDerWaalsContact C-N 3.32Å; D764-L766 PolarHBondContact O-N 3.1Å; D764-C767 WeakPolarHBondContact O-CB 3.43Å; D764-C767 PolarHBondContact O-N 2.86Å; D764-C767 VanDerWaalsContact O-N 3.12Å; D764-L768 PolarHBondContact O-N 2.92Å; D764-L1324 HydrophobicContact CB-CD2 4.2Å; D764-L1324 WeakPolarHBondContact OD2-CA 3.35Å; D764-Y1325 PolarHBondContact OD1-N 3.29Å; D764-Y1325 PolarHBondContact OD2-N 3.06Å; D764-S1326 WeakPolarHBondContact O-CB 3.3Å; D764-S1326 VanDerWaalsContact OD1-CB 3.23Å; D764-S1326 WeakPolarHBondContact OD1-CB 3.28Å; D764-S1326 PolarHBondContact OD1-N 2.91Å; D764-S1326 PolarHBondContact OD1-OG 3.47Å; D764-M1329 HydrophobicContact CB-CB 4.37Å; D764-M1329 HydrophobicContact CB-CG 3.91Å; D764-M1329 WeakPolarHBondContact OD1-CB 3.47Å
765	H	97.8	Very high	95.5	Very high	10 Å²	10	16.4 Å²	16.4	5%	0.046	11%	0.105	C	C	.	.	H	α-helix	trans	-75	-21.2	177.7	-57.5	90.7	0	0	0	113.1	S689 S761 L768 W769	S689-H765 VanDerWaalsContact C-CB 3.49Å; S689-H765 WeakPolarHBondContact O-CB 3.24Å; S761-H765 PolarHBondContact O-N 3.06Å; S761-H765 VanDerWaalsContact O-N 3.08Å; S761-H765 PolarHBondContact O-ND1 3.5Å; S761-H765 PolarHBondContact OG-CE1 3.48Å; S761-H765 VanDerWaalsContact OG-CE1 3.31Å; S761-H765 PolarHBondContact OG-ND1 2.72Å; H765-L768 PolarHBondContact O-N 3.31Å; H765-W769 WeakPolarHBondContact O-CB 3.48Å; H765-W769 PolarHBondContact O-N 3.46Å
766	L	97.3	Very high	95.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-69.6	-33.4	165.4	-74	176.1	0	0	0	113.1	I692 L708 F762 D764 W769 E770 V777 W782	I692-L766 HydrophobicContact CG2-CD2 4.38Å; L708-L766 HydrophobicContact CB-CD2 4.45Å; L708-L766 HydrophobicContact CD1-CD2 4.09Å; F762-L766 HydrophobicContact CD1-CD1 3.86Å; F762-L766 HydrophobicContact CE1-CD1 3.39Å; F762-L766 HydrophobicContact CE1-CG 4.4Å; F762-L766 HydrophobicContact CZ-CD1 3.89Å; F762-L766 WeakPolarHBondContact O-CG 3.3Å; F762-L766 PolarHBondContact O-N 3.49Å; D764-L766 VanDerWaalsContact C-N 3.32Å; D764-L766 PolarHBondContact O-N 3.1Å; L766-W769 HydrophobicContact CD2-CE3 3.85Å; L766-W769 HydrophobicContact CD2-CZ3 4.26Å; L766-E770 PolarHBondContact O-N 2.92Å; L766-V777 HydrophobicContact CD2-CG1 4.46Å; L766-W782 HydrophobicContact CD1-CE3 3.96Å; L766-W782 HydrophobicContact CD1-CH2 4.18Å; L766-W782 HydrophobicContact CD1-CZ3 3.44Å; L766-W782 VanDerWaalsContact CD1-CZ3 3.44Å; L766-W782 HydrophobicContact CD2-CH2 4.47Å
767	C	96.7	Very high	95.2	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.9	-42	169	-68.9	0	0	0	0	110.6	Y763 D764 W769 E770 E771 L778 S1326 K1328	Y763-C767 PolarHBondContact O-N 3.48Å; Y763-C767 PolarHBondContact O-SG 3.4Å; D764-C767 WeakPolarHBondContact O-CB 3.43Å; D764-C767 PolarHBondContact O-N 2.86Å; D764-C767 VanDerWaalsContact O-N 3.12Å; C767-W769 PolarHBondContact O-N 3.45Å; C767-E770 WeakPolarHBondContact O-CA 3.3Å; C767-E770 WeakPolarHBondContact O-CB 3.2Å; C767-E770 PolarHBondContact O-N 3.41Å; C767-E771 PolarHBondContact O-N 2.77Å; C767-E771 VanDerWaalsContact O-N 3.16Å; C767-L778 HydrophobicContact CB-CD1 4.42Å; C767-L778 WeakPolarHBondContact SG-CD1 3.5Å; C767-S1326 VanDerWaalsContact CB-CB 3.41Å; C767-S1326 VanDerWaalsContact CB-OG 3.27Å; C767-S1326 WeakPolarHBondContact CB-OG 3.18Å; C767-K1328 HydrophobicContact CB-CB 3.91Å; C767-K1328 HydrophobicContact CB-CD 4.37Å
768	L	95.5	Very high	95.1	Very high	49 Å²	49	19.5 Å²	19.5	26%	0.257	13%	0.125	S	C	.	.	H	α-helix	trans	-62.4	-40.1	177.3	-164.3	67.8	0	0	0	112	G693 D764 H765 E770 E771	G693-L768 WeakPolarHBondContact O-CD2 3.46Å; G693-L768 WeakPolarHBondContact O-CG 3.36Å; D764-L768 PolarHBondContact O-N 2.92Å; H765-L768 PolarHBondContact O-N 3.31Å; L768-E770 PolarHBondContact O-N 3.41Å; L768-E771 PolarHBondContact O-N 2.99Å
769	W	96.6	Very high	94.9	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.2	172.5	-174	39.4	0	0	0	113.8	I692 H697 D701 I704 Y705 L708 H765 L766 C767 S773 V777	I692-W769 HydrophobicContact CB-CD2 4.46Å; I692-W769 HydrophobicContact CD1-CZ2 4.14Å; I692-W769 HydrophobicContact CG1-CD2 3.57Å; I692-W769 VanDerWaalsContact CG1-CE2 3.41Å; I692-W769 HydrophobicContact CG1-CE3 4.07Å; I692-W769 HydrophobicContact CG1-CG 3.9Å; I692-W769 HydrophobicContact CG1-CH2 4.27Å; I692-W769 HydrophobicContact CG1-CZ2 3.79Å; I692-W769 HydrophobicContact CG1-CZ3 4.4Å; I692-W769 HydrophobicContact CG2-CB 4.13Å; I692-W769 HydrophobicContact CG2-CD2 4Å; I692-W769 HydrophobicContact CG2-CE3 4.06Å; I692-W769 HydrophobicContact CG2-CG 4.05Å; H697-W769 HydrophobicContact CB-CD2 4.14Å; H697-W769 HydrophobicContact CB-CG 4.43Å; H697-W769 HydrophobicContact CB-CZ2 4.01Å; H697-W769 AromaticContact CD2-CH2 3.66Å; H697-W769 AromaticContact CD2-CZ2 3.43Å; H697-W769 VanDerWaalsContact CD2-CZ2 3.43Å; H697-W769 WeakPolarHBondContact CD2-CZ2 3.31Å; H697-W769 AromaticContact CG-CZ2 3.99Å; D701-W769 HydrophobicContact CB-CZ2 4.38Å; I704-W769 HydrophobicContact CG2-CH2 4.08Å; I704-W769 HydrophobicContact CG2-CZ2 4.05Å; Y705-W769 HydrophobicContact CD2-CH2 4.24Å; Y705-W769 HydrophobicContact CD2-CZ3 4.17Å; L708-W769 HydrophobicContact CD1-CE3 4.31Å; L708-W769 HydrophobicContact CD1-CH2 4.22Å; L708-W769 HydrophobicContact CD1-CZ3 3.78Å; H765-W769 WeakPolarHBondContact O-CB 3.48Å; H765-W769 PolarHBondContact O-N 3.46Å; L766-W769 HydrophobicContact CD2-CE3 3.85Å; L766-W769 HydrophobicContact CD2-CZ3 4.26Å; C767-W769 PolarHBondContact O-N 3.45Å; W769-S773 PolarHBondContact O-OG 3.16Å; W769-V777 HydrophobicContact CD2-CG2 4.04Å; W769-V777 HydrophobicContact CE3-CB 4.47Å; W769-V777 HydrophobicContact CE3-CG1 3.75Å; W769-V777 HydrophobicContact CE3-CG2 3.8Å; W769-V777 HydrophobicContact CG-CG2 4.44Å; W769-V777 HydrophobicContact CZ3-CG1 3.97Å; W769-V777 HydrophobicContact CZ3-CG2 4.31Å
770	E	95	Very high	94.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-27	171.4	-161.8	172.8	-138.3	0	0	112.2	L766 C767 L768 G772 S773 P776 V777 L778 K1328 Q1353 V1356	L766-E770 PolarHBondContact O-N 2.92Å; C767-E770 WeakPolarHBondContact O-CA 3.3Å; C767-E770 WeakPolarHBondContact O-CB 3.2Å; C767-E770 PolarHBondContact O-N 3.41Å; L768-E770 PolarHBondContact O-N 3.41Å; E770-G772 PolarHBondContact O-N 3.04Å; E770-S773 WeakPolarHBondContact O-CB 3.35Å; E770-S773 PolarHBondContact O-N 2.88Å; E770-P776 WeakPolarHBondContact OE1-CA 3.4Å; E770-P776 WeakPolarHBondContact OE1-CB 3.27Å; E770-V777 HydrophobicContact CB-CB 4.09Å; E770-V777 HydrophobicContact CB-CG2 3.97Å; E770-V777 HydrophobicContact CG-CB 4.18Å; E770-V777 HydrophobicContact CG-CG2 4.22Å; E770-V777 PolarHBondContact OE1-N 3.38Å; E770-L778 PolarHBondContact OE1-N 3.44Å; E770-K1328 IonicContact OE2-NZ 3.86Å; E770-K1328 PolarHBondContact OE2-NZ 3.49Å; E770-Q1353 PolarHBondContact OE1-NE2 3.4Å; E770-V1356 HydrophobicContact CG-CG1 4.28Å; E770-V1356 HydrophobicContact CG-CG2 4.05Å; E770-V1356 WeakPolarHBondContact O-CG1 3.32Å
771	E	92.9	Very high	94.3	Very high	49 Å²	49	26.1 Å²	26.1	23%	0.229	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	110	-174.2	-75.3	174.5	-156.2	0	0	112.2	C767 L768 S1326 V1327 K1328	C767-E771 PolarHBondContact O-N 2.77Å; C767-E771 VanDerWaalsContact O-N 3.16Å; L768-E771 PolarHBondContact O-N 2.99Å; E771-S1326 WeakPolarHBondContact OE1-CB 3.45Å; E771-V1327 WeakPolarHBondContact OE1-CB 3.25Å; E771-V1327 PolarHBondContact OE1-N 3.44Å; E771-V1327 WeakPolarHBondContact OE2-CG2 3.38Å; E771-V1327 PolarHBondContact OE2-N 2.9Å; E771-K1328 PolarHBondContact OE1-N 2.95Å
772	G	88.5	Confident	94.1	Very high	55 Å²	55	25.3 Å²	25.3	57%	0.567	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	98.6	-16.7	-175	0	0	0	0	0	114.3	N696 E770	N696-G772 PolarHBondContact OD1-O 3.33Å; E770-G772 PolarHBondContact O-N 3.04Å
773	S	92.5	Very high	93.9	Very high	17 Å²	17	25.3 Å²	25.3	12%	0.119	16%	0.162	C	C	.	.			trans	-68.6	142.4	-172.2	-65.5	0	0	0	0	114.2	N696 H697 W769 E770 V775	N696-S773 VanDerWaalsContact CA-OG 3.28Å; N696-S773 WeakPolarHBondContact CA-OG 3.49Å; H697-S773 PolarHBondContact N-OG 2.91Å; W769-S773 PolarHBondContact O-OG 3.16Å; E770-S773 WeakPolarHBondContact O-CB 3.35Å; E770-S773 PolarHBondContact O-N 2.88Å; S773-V775 VanDerWaalsContact C-N 3.28Å; S773-V775 PolarHBondContact O-N 3.13Å
774	P	90	Very high	93.8	Very high	72 Å²	72	28.1 Å²	28.1	47%	0.468	18%	0.176	S	C	.	.	S	Bend	trans	-71.4	-19.7	174.6	28.9	-36.1	0	0	0	113.9	P449 H697 T698	P449-P774 HydrophobicContact CB-CG 4.34Å; H697-P774 WeakPolarHBondContact O-CD 3.45Å; H697-P774 WeakPolarHBondContact O-CG 3.4Å; T698-P774 HydrophobicContact CG2-CG 3.93Å
775	V	90.1	Very high	93.6	Very high	30 Å²	30	32.1 Å²	32.1	18%	0.182	19%	0.194	C	C	.	.	S	Bend	trans	-124.3	129.7	179.8	-174.6	0	0	0	0	109.5	H697 S773 L1038	H697-V775 PolarHBondContact ND1-O 3Å; H697-V775 PolarHBondContact O-N 3.46Å; S773-V775 VanDerWaalsContact C-N 3.28Å; S773-V775 PolarHBondContact O-N 3.13Å; V775-L1038 HydrophobicContact CG2-CD2 3.88Å
776	P	92	Very high	93.5	Very high	72 Å²	72	31.6 Å²	31.6	47%	0.468	19%	0.192	S	C	.	.			trans	-65.9	151.4	177.3	28.8	-35.8	0	0	0	112.1	H697 E770	H697-P776 PolarHBondContact CE1-O 2.98Å; H697-P776 VanDerWaalsContact CE1-O 3.27Å; H697-P776 PolarHBondContact ND1-O 3.32Å; E770-P776 WeakPolarHBondContact OE1-CA 3.4Å; E770-P776 WeakPolarHBondContact OE1-CB 3.27Å
777	V	94.4	Very high	93.4	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.012	19%	0.194	C	C	.	.			trans	-104	-47.7	178.7	179.9	0	0	0	0	110.1	H697 Y705 L766 W769 E770 H779 W782	H697-V777 HydrophobicContact CB-CG2 3.73Å; Y705-V777 HydrophobicContact CD2-CG1 4.4Å; Y705-V777 HydrophobicContact CE2-CG1 4.11Å; Y705-V777 PolarHBondContact OH-O 3.46Å; L766-V777 HydrophobicContact CD2-CG1 4.46Å; W769-V777 HydrophobicContact CD2-CG2 4.04Å; W769-V777 HydrophobicContact CE3-CB 4.47Å; W769-V777 HydrophobicContact CE3-CG1 3.75Å; W769-V777 HydrophobicContact CE3-CG2 3.8Å; W769-V777 HydrophobicContact CG-CG2 4.44Å; W769-V777 HydrophobicContact CZ3-CG1 3.97Å; W769-V777 HydrophobicContact CZ3-CG2 4.31Å; E770-V777 HydrophobicContact CB-CB 4.09Å; E770-V777 HydrophobicContact CB-CG2 3.97Å; E770-V777 HydrophobicContact CG-CB 4.18Å; E770-V777 HydrophobicContact CG-CG2 4.22Å; E770-V777 PolarHBondContact OE1-N 3.38Å; V777-H779 PolarHBondContact O-N 2.93Å; V777-W782 HydrophobicContact CG1-CZ2 4.45Å; V777-W782 PolarHBondContact O-NE1 2.91Å; V777-W782 VanDerWaalsContact O-NE1 3.13Å
778	L	94.1	Very high	93.2	Very high	4 Å²	4	35.4 Å²	35.4	2%	0.021	21%	0.214	C	C	.	.			trans	-97.6	103.9	-166.5	-68.8	176.1	0	0	0	112.2	C767 E770 W782	C767-L778 HydrophobicContact CB-CD1 4.42Å; C767-L778 WeakPolarHBondContact SG-CD1 3.5Å; E770-L778 PolarHBondContact OE1-N 3.44Å; L778-W782 HydrophobicContact CD2-CB 3.84Å; L778-W782 HydrophobicContact CD2-CD2 3.9Å; L778-W782 HydrophobicContact CD2-CE3 4.19Å; L778-W782 HydrophobicContact CD2-CG 3.79Å
779	H	92.5	Very high	93.1	Very high	88 Å²	88	33 Å²	33	41%	0.407	20%	0.202	S	C	.	.			trans	-103.2	167.7	167	68.4	98.7	0	0	0	112.2	Y705 V777 G781 W782	Y705-H779 PolarHBondContact OH-CD2 2.92Å; Y705-H779 PolarHBondContact OH-NE2 3.01Å; V777-H779 PolarHBondContact O-N 2.93Å; H779-G781 PolarHBondContact ND1-N 3.32Å; H779-G781 PolarHBondContact O-N 3.45Å; H779-W782 AromaticContact CD2-CD1 3.26Å; H779-W782 AromaticContact CD2-NE1 3.32Å; H779-W782 PolarHBondContact CD2-NE1 3.2Å; H779-W782 VanDerWaalsContact CD2-NE1 3.32Å; H779-W782 AromaticContact CG-CD1 3.88Å; H779-W782 AromaticContact NE2-CD1 3.4Å; H779-W782 AromaticContact NE2-NE1 3.36Å; H779-W782 PolarHBondContact NE2-NE1 3.04Å; H779-W782 WeakPolarHBondContact O-CB 3.27Å; H779-W782 PolarHBondContact O-N 3.38Å
780	V	91.1	Very high	93	Very high	57 Å²	57	33.4 Å²	33.4	35%	0.345	20%	0.203	S	C	.	.	H	α-helix	trans	-39.1	-45.5	-178.8	45	0	0	0	0	115	W782 V783 D784 K1347	V780-W782 VanDerWaalsContact C-N 3.29Å; V780-W782 PolarHBondContact O-N 3.49Å; V780-V783 PolarHBondContact O-N 3.26Å; V780-V783 VanDerWaalsContact O-N 3.1Å; V780-D784 WeakPolarHBondContact CG2-OD2 3.49Å; V780-D784 PolarHBondContact O-N 2.7Å; V780-K1347 VanDerWaalsContact CG2-NZ 3.26Å
781	G	91.5	Very high	92.9	Very high	26 Å²	26	38.2 Å²	38.2	27%	0.268	23%	0.233	S	C	.	.	H	α-helix	trans	-62.1	-30.2	-177	0	0	0	0	0	114.5	H779 K785	H779-G781 PolarHBondContact ND1-N 3.32Å; H779-G781 PolarHBondContact O-N 3.45Å; G781-K785 WeakPolarHBondContact O-CG 3.29Å
782	W	95	Very high	92.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-68	-43.6	173.7	-69.4	85.5	0	0	0	111.6	Y705 L708 L709 A712 Y763 L766 V777 L778 H779 V780 K785 L786	Y705-W782 HydrophobicContact CD2-CZ2 4.31Å; Y705-W782 AromaticContact CE2-CZ2 3.7Å; Y705-W782 HydrophobicContact CE2-CZ2 3.7Å; Y705-W782 AromaticContact CZ-CZ2 3.84Å; Y705-W782 AromaticContact CZ-NE1 3.86Å; Y705-W782 PolarHBondContact OH-NE1 2.94Å; L708-W782 HydrophobicContact CB-CH2 4.06Å; L709-W782 VanDerWaalsContact CA-CH2 3.45Å; L709-W782 HydrophobicContact CB-CH2 3.96Å; L709-W782 HydrophobicContact CB-CZ2 3.78Å; L709-W782 HydrophobicContact CD1-CD2 4.02Å; L709-W782 HydrophobicContact CD1-CG 4.47Å; L709-W782 HydrophobicContact CD1-CH2 4.38Å; L709-W782 HydrophobicContact CD1-CZ2 3.72Å; L709-W782 HydrophobicContact CG-CZ2 4.36Å; L709-W782 VanDerWaalsContact N-CH2 3.34Å; A712-W782 HydrophobicContact CB-CE3 3.55Å; A712-W782 HydrophobicContact CB-CZ3 3.46Å; A712-W782 VanDerWaalsContact CB-CZ3 3.46Å; Y763-W782 HydrophobicContact CE1-CB 4.32Å; Y763-W782 HydrophobicContact CE1-CE3 4.42Å; Y763-W782 PolarHBondContact OH-O 3.09Å; Y763-W782 VanDerWaalsContact OH-O 3.07Å; L766-W782 HydrophobicContact CD1-CE3 3.96Å; L766-W782 HydrophobicContact CD1-CH2 4.18Å; L766-W782 HydrophobicContact CD1-CZ3 3.44Å; L766-W782 VanDerWaalsContact CD1-CZ3 3.44Å; L766-W782 HydrophobicContact CD2-CH2 4.47Å; V777-W782 HydrophobicContact CG1-CZ2 4.45Å; V777-W782 PolarHBondContact O-NE1 2.91Å; V777-W782 VanDerWaalsContact O-NE1 3.13Å; L778-W782 HydrophobicContact CD2-CB 3.84Å; L778-W782 HydrophobicContact CD2-CD2 3.9Å; L778-W782 HydrophobicContact CD2-CE3 4.19Å; L778-W782 HydrophobicContact CD2-CG 3.79Å; H779-W782 AromaticContact CD2-CD1 3.26Å; H779-W782 AromaticContact CD2-NE1 3.32Å; H779-W782 PolarHBondContact CD2-NE1 3.2Å; H779-W782 VanDerWaalsContact CD2-NE1 3.32Å; H779-W782 AromaticContact CG-CD1 3.88Å; H779-W782 AromaticContact NE2-CD1 3.4Å; H779-W782 AromaticContact NE2-NE1 3.36Å; H779-W782 PolarHBondContact NE2-NE1 3.04Å; H779-W782 WeakPolarHBondContact O-CB 3.27Å; H779-W782 PolarHBondContact O-N 3.38Å; V780-W782 VanDerWaalsContact C-N 3.29Å; V780-W782 PolarHBondContact O-N 3.49Å; W782-K785 PolarHBondContact O-N 3.25Å; W782-L786 PolarHBondContact O-N 3.34Å
783	V	94	Very high	93.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-77.9	-35.9	-171.9	-168.1	0	0	0	0	111.3	V780 K785 L786 M787 I1346 K1347 L1350 T1351	V780-V783 PolarHBondContact O-N 3.26Å; V780-V783 VanDerWaalsContact O-N 3.1Å; V783-K785 PolarHBondContact O-N 3.14Å; V783-L786 WeakPolarHBondContact O-CB 3.39Å; V783-L786 PolarHBondContact O-N 3.06Å; V783-M787 HydrophobicContact CG1-CE 4.36Å; V783-M787 WeakPolarHBondContact O-CG 3.47Å; V783-M787 PolarHBondContact O-N 3.44Å; V783-I1346 HydrophobicContact CG1-CG2 4.39Å; V783-K1347 HydrophobicContact CG1-CB 4.33Å; V783-L1350 HydrophobicContact CG1-CD1 3.99Å; V783-L1350 HydrophobicContact CG2-CB 3.85Å; V783-L1350 HydrophobicContact CG2-CD1 4.26Å; V783-T1351 HydrophobicContact CG2-CG2 4.06Å
784	D	94.2	Very high	93	Very high	59 Å²	59	37.5 Å²	37.5	32%	0.316	21%	0.214	S	C	.	.	H	α-helix	trans	-62	-33.9	172.9	-71.6	-30.7	0	0	0	111.7	V780 V788 K1347	V780-D784 WeakPolarHBondContact CG2-OD2 3.49Å; V780-D784 PolarHBondContact O-N 2.7Å; D784-V788 WeakPolarHBondContact O-CG2 3.21Å; D784-V788 PolarHBondContact O-N 2.79Å; D784-V788 VanDerWaalsContact O-N 3.12Å; D784-K1347 WeakPolarHBondContact OD1-CD 3.34Å; D784-K1347 IonicContact OD1-NZ 2.81Å; D784-K1347 PolarHBondContact OD1-NZ 2.76Å; D784-K1347 IonicContact OD2-NZ 2.93Å; D784-K1347 PolarHBondContact OD2-NZ 3.5Å
785	K	94.7	Very high	92.8	Very high	84 Å²	84	39.4 Å²	39.4	37%	0.365	22%	0.216	S	C	.	.	H	α-helix	trans	-72.4	-40.4	173.4	-61.1	-77.9	-176.2	152.5	0	111.9	T713 P717 G781 W782 V783 M787 V788 N789	T713-K785 HydrophobicContact CG2-CB 4.41Å; T713-K785 HydrophobicContact CG2-CG 3.95Å; T713-K785 PolarHBondContact O-NZ 3.03Å; P717-K785 HydrophobicContact CG-CB 4.44Å; P717-K785 HydrophobicContact CG-CD 4.23Å; G781-K785 WeakPolarHBondContact O-CG 3.29Å; W782-K785 PolarHBondContact O-N 3.25Å; V783-K785 PolarHBondContact O-N 3.14Å; K785-M787 VanDerWaalsContact C-N 3.32Å; K785-M787 PolarHBondContact O-N 2.92Å; K785-V788 PolarHBondContact O-N 2.63Å; K785-N789 PolarHBondContact O-N 2.88Å; K785-N789 PolarHBondContact O-ND2 3.05Å
786	L	95.6	Very high	92.8	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-56.9	-45.5	171.3	179.1	59.1	0	0	0	111.2	L759 Y763 W782 V783 V788 N789 L790 L1350	L759-L786 HydrophobicContact CD1-CD1 4.22Å; L759-L786 HydrophobicContact CD2-CD1 4.44Å; L759-L786 HydrophobicContact CG-CD1 4.23Å; Y763-L786 HydrophobicContact CD1-CB 4.33Å; Y763-L786 HydrophobicContact CD1-CD1 4.45Å; Y763-L786 HydrophobicContact CD1-CD2 3.85Å; Y763-L786 HydrophobicContact CD1-CG 4.42Å; Y763-L786 HydrophobicContact CD2-CD1 3.68Å; Y763-L786 HydrophobicContact CD2-CD2 4.47Å; Y763-L786 HydrophobicContact CD2-CG 4.48Å; Y763-L786 HydrophobicContact CE1-CB 3.78Å; Y763-L786 HydrophobicContact CE1-CD1 4.48Å; Y763-L786 HydrophobicContact CE1-CD2 4.16Å; Y763-L786 HydrophobicContact CE1-CG 4.34Å; Y763-L786 HydrophobicContact CE2-CB 4.21Å; Y763-L786 HydrophobicContact CE2-CD1 3.74Å; Y763-L786 HydrophobicContact CE2-CG 4.42Å; Y763-L786 HydrophobicContact CG-CD1 4.03Å; Y763-L786 HydrophobicContact CG-CD2 3.99Å; Y763-L786 HydrophobicContact CG-CG 4.46Å; W782-L786 PolarHBondContact O-N 3.34Å; V783-L786 WeakPolarHBondContact O-CB 3.39Å; V783-L786 PolarHBondContact O-N 3.06Å; L786-V788 PolarHBondContact O-N 2.81Å; L786-N789 PolarHBondContact O-N 2.83Å; L786-N789 VanDerWaalsContact O-N 3.12Å; L786-L790 HydrophobicContact CD1-CD1 3.86Å; L786-L790 HydrophobicContact CD1-CD2 4.23Å; L786-L790 HydrophobicContact CD1-CG 3.76Å; L786-L790 HydrophobicContact CD2-CD1 4.43Å; L786-L790 HydrophobicContact CG-CD1 3.85Å; L786-L790 HydrophobicContact CG-CG 4.16Å; L786-L790 WeakPolarHBondContact O-CG 3.25Å; L786-L790 PolarHBondContact O-N 3.38Å; L786-L1350 HydrophobicContact CD2-CD1 3.91Å
787	M	94.4	Very high	92.7	Very high	12 Å²	12	35.5 Å²	35.5	6%	0.059	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-40.6	178.5	-66.7	-57.9	101.4	0	0	112	V783 K785 N789 L790 T791 I1346	V783-M787 HydrophobicContact CG1-CE 4.36Å; V783-M787 WeakPolarHBondContact O-CG 3.47Å; V783-M787 PolarHBondContact O-N 3.44Å; K785-M787 VanDerWaalsContact C-N 3.32Å; K785-M787 PolarHBondContact O-N 2.92Å; M787-N789 VanDerWaalsContact C-N 3.29Å; M787-N789 PolarHBondContact O-N 3.26Å; M787-L790 HydrophobicContact CE-CD1 3.8Å; M787-T791 WeakPolarHBondContact O-CB 3.07Å; M787-T791 VanDerWaalsContact O-CG2 3.32Å; M787-T791 WeakPolarHBondContact O-CG2 3.41Å; M787-T791 PolarHBondContact O-N 3.26Å; M787-T791 VanDerWaalsContact O-N 3.12Å; M787-T791 PolarHBondContact O-OG1 3.48Å; M787-I1346 HydrophobicContact CE-CB 4.14Å; M787-I1346 HydrophobicContact CE-CD1 4.17Å; M787-I1346 HydrophobicContact CE-CG2 3.5Å; M787-I1346 HydrophobicContact SD-CB 4.31Å; M787-I1346 HydrophobicContact SD-CD1 4.17Å; M787-I1346 HydrophobicContact SD-CG2 4.31Å
788	V	92.5	Very high	92.6	Very high	67 Å²	67	38.1 Å²	38.1	41%	0.406	20%	0.199	S	C	.	.	H	α-helix	trans	-65.1	-30.4	173.5	168.5	0	0	0	0	112.5	D784 K785 L786 T791 R792	D784-V788 WeakPolarHBondContact O-CG2 3.21Å; D784-V788 PolarHBondContact O-N 2.79Å; D784-V788 VanDerWaalsContact O-N 3.12Å; K785-V788 PolarHBondContact O-N 2.63Å; L786-V788 PolarHBondContact O-N 2.81Å; V788-T791 PolarHBondContact O-OG1 3.27Å; V788-R792 WeakPolarHBondContact O-CD 3.19Å; V788-R792 WeakPolarHBondContact O-CG 3.35Å
789	N	94.3	Very high	92.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-77.6	-51.7	176.5	-66.6	-18	0	0	0	111.2	P717 F720 L759 K785 L786 M787 T791 R792 F793	P717-N789 WeakPolarHBondContact CA-OD1 3.4Å; F720-N789 HydrophobicContact CD2-CB 3.8Å; F720-N789 HydrophobicContact CE2-CB 3.96Å; L759-N789 HydrophobicContact CD2-CB 3.8Å; K785-N789 PolarHBondContact O-N 2.88Å; K785-N789 PolarHBondContact O-ND2 3.05Å; L786-N789 PolarHBondContact O-N 2.83Å; L786-N789 VanDerWaalsContact O-N 3.12Å; M787-N789 VanDerWaalsContact C-N 3.29Å; M787-N789 PolarHBondContact O-N 3.26Å; N789-T791 VanDerWaalsContact C-N 3.26Å; N789-T791 PolarHBondContact O-N 2.95Å; N789-R792 WeakPolarHBondContact O-CB 3.38Å; N789-R792 PolarHBondContact O-N 2.98Å; N789-F793 WeakPolarHBondContact O-CD2 3.17Å
790	L	94.2	Very high	92.3	Very high	7 Å²	7	38.3 Å²	38.3	4%	0.037	20%	0.196	C	C	.	.	H	α-helix	trans	-61.2	-31	-179.2	-68	178.1	0	0	0	113.4	L756 L759 L760 L786 M787 R792 F793 L1336 L1341	L756-L790 HydrophobicContact CD1-CD2 3.67Å; L759-L790 HydrophobicContact CD2-CD2 3.83Å; L759-L790 HydrophobicContact CD2-CG 4.43Å; L759-L790 HydrophobicContact CG-CD2 4.48Å; L760-L790 HydrophobicContact CD2-CD1 4.32Å; L760-L790 HydrophobicContact CD2-CD2 3.8Å; L760-L790 HydrophobicContact CG-CD2 4.37Å; L786-L790 HydrophobicContact CD1-CD1 3.86Å; L786-L790 HydrophobicContact CD1-CD2 4.23Å; L786-L790 HydrophobicContact CD1-CG 3.76Å; L786-L790 HydrophobicContact CD2-CD1 4.43Å; L786-L790 HydrophobicContact CG-CD1 3.85Å; L786-L790 HydrophobicContact CG-CG 4.16Å; L786-L790 WeakPolarHBondContact O-CG 3.25Å; L786-L790 PolarHBondContact O-N 3.38Å; M787-L790 HydrophobicContact CE-CD1 3.8Å; L790-R792 PolarHBondContact O-N 3.35Å; L790-F793 PolarHBondContact O-N 3.31Å; L790-L1336 HydrophobicContact CD1-CD2 4.15Å; L790-L1341 HydrophobicContact CB-CD1 3.71Å; L790-L1341 HydrophobicContact CD1-CD1 4.39Å
791	T	91.9	Very high	92.5	Very high	102 Å²	102	36.4 Å²	36.4	63%	0.626	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-6.7	177.2	47.7	0	0	0	0	114.4	M787 V788 N789	M787-T791 WeakPolarHBondContact O-CB 3.07Å; M787-T791 VanDerWaalsContact O-CG2 3.32Å; M787-T791 WeakPolarHBondContact O-CG2 3.41Å; M787-T791 PolarHBondContact O-N 3.26Å; M787-T791 VanDerWaalsContact O-N 3.12Å; M787-T791 PolarHBondContact O-OG1 3.48Å; V788-T791 PolarHBondContact O-OG1 3.27Å; N789-T791 VanDerWaalsContact C-N 3.26Å; N789-T791 PolarHBondContact O-N 2.95Å
792	R	92.7	Very high	92.6	Very high	54 Å²	54	37.8 Å²	37.8	20%	0.204	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-23.1	173.9	-67.3	169	173.6	168.6	-7.2	114	P717 L750 V788 N789 L790	P717-R792 PolarHBondContact O-NH1 3.01Å; L750-R792 HydrophobicContact CD1-CB 4.29Å; L750-R792 HydrophobicContact CD2-CB 3.96Å; V788-R792 WeakPolarHBondContact O-CD 3.19Å; V788-R792 WeakPolarHBondContact O-CG 3.35Å; N789-R792 WeakPolarHBondContact O-CB 3.38Å; N789-R792 PolarHBondContact O-N 2.98Å; L790-R792 PolarHBondContact O-N 3.35Å
793	F	93.4	Very high	92.6	Very high	10 Å²	10	38.1 Å²	38.1	4%	0.044	19%	0.19	C	C	.	.	S	Bend	trans	-69.8	136.2	176.9	-80.8	-92.5	0	0	0	110.5	F720 I749 L750 C755 L756 L759 N789 L790 A797	F720-F793 HydrophobicContact CD1-CE2 4.04Å; F720-F793 HydrophobicContact CD1-CZ 4.1Å; F720-F793 AromaticContact CE1-CE2 3.64Å; F720-F793 HydrophobicContact CE1-CE2 3.64Å; F720-F793 AromaticContact CE1-CZ 3.42Å; F720-F793 HydrophobicContact CE1-CZ 3.42Å; F720-F793 VanDerWaalsContact CE1-CZ 3.42Å; F720-F793 HydrophobicContact CE2-CE2 4.14Å; F720-F793 HydrophobicContact CG-CE2 4.48Å; F720-F793 AromaticContact CZ-CE2 3.7Å; F720-F793 HydrophobicContact CZ-CE2 3.7Å; F720-F793 AromaticContact CZ-CZ 3.71Å; F720-F793 HydrophobicContact CZ-CZ 3.71Å; I749-F793 WeakPolarHBondContact O-CE1 3.22Å; L750-F793 HydrophobicContact CD2-CD1 4.5Å; L750-F793 HydrophobicContact CD2-CD2 4.22Å; L750-F793 HydrophobicContact CD2-CE2 4.21Å; L750-F793 HydrophobicContact CD2-CG 4.37Å; L750-F793 HydrophobicContact CD2-CZ 4.39Å; C755-F793 HydrophobicContact CB-CE1 3.98Å; C755-F793 HydrophobicContact CB-CZ 4.34Å; L756-F793 HydrophobicContact CB-CD1 3.73Å; L756-F793 HydrophobicContact CB-CE1 3.77Å; L756-F793 HydrophobicContact CB-CG 4.34Å; L756-F793 HydrophobicContact CB-CZ 4.43Å; L756-F793 HydrophobicContact CD1-CB 4.15Å; L756-F793 HydrophobicContact CD1-CD1 4.05Å; L756-F793 HydrophobicContact CD1-CD2 3.92Å; L756-F793 HydrophobicContact CD1-CE1 4.41Å; L756-F793 HydrophobicContact CD1-CE2 4.31Å; L756-F793 HydrophobicContact CD1-CG 3.77Å; L756-F793 HydrophobicContact CG-CD1 4.36Å; L756-F793 HydrophobicContact CG-CG 4.5Å; L759-F793 HydrophobicContact CD2-CD2 4.21Å; L759-F793 HydrophobicContact CD2-CE2 3.59Å; L759-F793 HydrophobicContact CD2-CZ 4.38Å; N789-F793 WeakPolarHBondContact O-CD2 3.17Å; L790-F793 PolarHBondContact O-N 3.31Å; F793-A797 HydrophobicContact CB-CB 4.48Å; F793-A797 HydrophobicContact CD1-CB 4.05Å
794	T	90.1	Very high	92.7	Very high	42 Å²	42	39.5 Å²	39.5	26%	0.258	20%	0.2	S	C	.	.			trans	-75.5	164.5	-172.3	73.9	0	0	0	0	111.5	L750 D751 R796 A797 R798	L750-T794 PolarHBondContact O-N 2.62Å; L750-T794 PolarHBondContact O-OG1 3.31Å; D751-T794 WeakPolarHBondContact OD1-CB 3.14Å; D751-T794 WeakPolarHBondContact OD1-CG2 3.45Å; D751-T794 PolarHBondContact OD1-OG1 2.84Å; T794-R796 PolarHBondContact O-N 2.87Å; T794-R796 VanDerWaalsContact O-N 3.14Å; T794-R796 WeakPolarHBondContact OG1-CB 3.33Å; T794-R796 PolarHBondContact OG1-N 2.81Å; T794-A797 PolarHBondContact O-N 2.93Å; T794-R798 PolarHBondContact O-N 3.26Å
795	Q	86.3	Confident	92.7	Very high	112 Å²	112	40.7 Å²	40.7	52%	0.523	21%	0.209	S	C	.	.	H	α-helix	trans	-60.8	-23.9	177.3	-171	55.7	42.3	0	0	112.5	R799	Q795-R799 WeakPolarHBondContact O-CB 3.2Å; Q795-R799 PolarHBondContact O-N 2.97Å
796	R	88.9	Confident	92.4	Very high	20 Å²	20	38.1 Å²	38.1	8%	0.075	20%	0.203	C	C	.	.	H	α-helix	trans	-62	-59	171.9	176.9	-159.8	172.5	71	28.8	111	D738 D751 T794 R798 R799 H800	D738-R796 IonicContact OD1-CZ 2.76Å; D738-R796 VanDerWaalsContact OD1-CZ 3.23Å; D738-R796 IonicContact OD1-NH1 3.26Å; D738-R796 PolarHBondContact OD1-NH1 3.49Å; D738-R796 IonicContact OD1-NH2 3.86Å; D738-R796 PolarHBondContact OD1-NH2 2.9Å; D738-R796 IonicContact OD2-CZ 2.92Å; D738-R796 IonicContact OD2-NH1 2.73Å; D738-R796 PolarHBondContact OD2-NH1 2.92Å; D738-R796 VanDerWaalsContact OD2-NH1 3.12Å; D738-R796 IonicContact OD2-NH2 3.9Å; D751-R796 WeakPolarHBondContact O-CD 3.44Å; D751-R796 PolarHBondContact O-NE 3.28Å; T794-R796 PolarHBondContact O-N 2.87Å; T794-R796 VanDerWaalsContact O-N 3.14Å; T794-R796 WeakPolarHBondContact OG1-CB 3.33Å; T794-R796 PolarHBondContact OG1-N 2.81Å; R796-R798 PolarHBondContact O-N 3.47Å; R796-R799 PolarHBondContact O-N 3.16Å; R796-H800 PolarHBondContact O-N 3.43Å
797	A	91.2	Very high	91.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57	-37.3	-178.3	0	0	0	0	0	111.6	L756 F793 T794 L801	L756-A797 HydrophobicContact CB-CB 4.44Å; L756-A797 HydrophobicContact CD2-CB 4.26Å; F793-A797 HydrophobicContact CB-CB 4.48Å; F793-A797 HydrophobicContact CD1-CB 4.05Å; T794-A797 PolarHBondContact O-N 2.93Å; A797-L801 WeakPolarHBondContact O-CB 3.26Å; A797-L801 PolarHBondContact O-N 3.39Å
798	R	91.4	Very high	89.6	Confident	57 Å²	57	47.5 Å²	47.5	22%	0.215	26%	0.259	C	S	.	.	H	α-helix	trans	-74.5	-30.5	175.8	-57.9	-160	-58.1	136	-0	114.5	L756 T794 R796 A1338 P1339	L756-R798 HydrophobicContact CD2-CB 4.42Å; L756-R798 HydrophobicContact CD2-CG 3.81Å; T794-R798 PolarHBondContact O-N 3.26Å; R796-R798 PolarHBondContact O-N 3.47Å; R798-A1338 PolarHBondContact NH1-O 3.27Å; R798-P1339 PolarHBondContact NH2-O 2.97Å
799	R	89.9	Confident	87.2	Confident	93 Å²	93	52.6 Å²	52.6	35%	0.351	28%	0.276	S	S	.	.	H	α-helix	trans	-67.9	-43.6	174	171.4	176.6	60.2	-159.6	-9.7	111.2	D738 D740 C742 Q795 R796 L801	D738-R799 IonicContact OD2-CZ 3.23Å; D738-R799 IonicContact OD2-NH2 3.55Å; D738-R799 PolarHBondContact OD2-NH2 2.99Å; D740-R799 IonicContact OD2-CZ 2.66Å; D740-R799 VanDerWaalsContact OD2-CZ 3.3Å; D740-R799 IonicContact OD2-NE 2.9Å; D740-R799 IonicContact OD2-NH1 3.19Å; D740-R799 PolarHBondContact OD2-NH1 2.56Å; C742-R799 PolarHBondContact SG-NH1 3.38Å; C742-R799 VanDerWaalsContact SG-NH1 3.4Å; C742-R799 PolarHBondContact SG-NH2 2.96Å; Q795-R799 WeakPolarHBondContact O-CB 3.2Å; Q795-R799 PolarHBondContact O-N 2.97Å; R796-R799 PolarHBondContact O-N 3.16Å; R799-L801 VanDerWaalsContact C-N 3.29Å; R799-L801 PolarHBondContact O-N 3.01Å
800	H	91.3	Very high	84.8	Confident	3 Å²	3	60.5 Å²	60.5	1%	0.014	31%	0.313	C	S	.	.	S	Bend	trans	-85.6	3.4	-172.2	-64.6	-23.1	0	0	0	113.9	D738 P753 R796 M1315 T1319 V1320	D738-H800 IonicContact OD1-NE2 2.78Å; D738-H800 PolarHBondContact OD1-NE2 2.87Å; D738-H800 IonicContact OD2-CD2 2.69Å; D738-H800 IonicContact OD2-CE1 2.68Å; D738-H800 PolarHBondContact OD2-CE1 2.94Å; D738-H800 IonicContact OD2-NE2 2.78Å; D738-H800 PolarHBondContact OD2-NE2 3.07Å; P753-H800 HydrophobicContact CB-CB 3.93Å; P753-H800 HydrophobicContact CG-CB 3.98Å; R796-H800 PolarHBondContact O-N 3.43Å; H800-M1315 PolarHBondContact CE1-SD 3.2Å; H800-T1319 WeakPolarHBondContact O-CA 3.5Å; H800-V1320 PolarHBondContact O-N 3.34Å
801	L	94.1	Very high	82.4	Confident	17 Å²	17	64.9 Å²	64.9	9%	0.089	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	105.7	176.5	-178.2	55.8	0	0	0	111.2	L756 L760 A797 R799 L803 V1320 L1322	L756-L801 HydrophobicContact CB-CD2 4.12Å; L756-L801 HydrophobicContact CD2-CB 4.33Å; L756-L801 HydrophobicContact CD2-CD2 3.67Å; L756-L801 HydrophobicContact CG-CD2 3.58Å; L760-L801 HydrophobicContact CD1-CD2 3.83Å; A797-L801 WeakPolarHBondContact O-CB 3.26Å; A797-L801 PolarHBondContact O-N 3.39Å; R799-L801 VanDerWaalsContact C-N 3.29Å; R799-L801 PolarHBondContact O-N 3.01Å; L801-L803 HydrophobicContact CD1-CD2 4.37Å; L801-L803 HydrophobicContact CD2-CD2 4.01Å; L801-L803 HydrophobicContact CG-CD2 3.9Å; L801-V1320 HydrophobicContact CD1-CB 4.11Å; L801-V1320 HydrophobicContact CD1-CG1 4.03Å; L801-L1322 HydrophobicContact CD1-CB 3.97Å
802	C	94.5	Very high	79.6	Confident	55 Å²	55	66.4 Å²	66.4	37%	0.372	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	106.2	172.2	-164.2	0	0	0	0	110	T1319 V1320 H1321 L1322	C802-T1319 HydrophobicContact CB-CG2 4.05Å; C802-V1320 PolarHBondContact N-O 3.46Å; C802-H1321 CarbonylContact O-C 3.58Å; C802-H1321 WeakPolarHBondContact O-CA 3.27Å; C802-L1322 PolarHBondContact O-N 2.98Å
803	L	95.5	Very high	76.9	Confident	7 Å²	7	71.4 Å²	71.4	4%	0.037	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	143.7	170.6	-54.8	179.8	0	0	0	110.3	L760 L801 L1322 L1324 I1333 L1336 R1337	L760-L803 HydrophobicContact CD1-CD1 4.39Å; L760-L803 HydrophobicContact CD1-CD2 3.89Å; L801-L803 HydrophobicContact CD1-CD2 4.37Å; L801-L803 HydrophobicContact CD2-CD2 4.01Å; L801-L803 HydrophobicContact CG-CD2 3.9Å; L803-L1322 CarbonylContact C-O 3.48Å; L803-L1322 WeakPolarHBondContact CA-O 3.3Å; L803-L1322 HydrophobicContact CD2-CB 4.09Å; L803-L1322 HydrophobicContact CD2-CD2 3.92Å; L803-L1322 HydrophobicContact CD2-CG 4.33Å; L803-L1324 HydrophobicContact CB-CD1 4.41Å; L803-L1324 HydrophobicContact CD1-CD1 4.38Å; L803-I1333 HydrophobicContact CB-CD1 3.83Å; L803-I1333 HydrophobicContact CB-CG1 3.75Å; L803-I1333 HydrophobicContact CD1-CG1 4.13Å; L803-L1336 HydrophobicContact CD1-CB 3.68Å; L803-L1336 HydrophobicContact CD1-CD1 4.03Å; L803-R1337 HydrophobicContact CD1-CG 4.44Å; L803-R1337 PolarHBondContact O-NH2 3.28Å
804	S	95.3	Very high	74	Confident	29 Å²	29	73.5 Å²	73.5	20%	0.203	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	172.7	162.7	83.7	0	0	0	0	111	H1321 L1322 P1323 L1324	S804-H1321 PolarHBondContact OG-CE1 2.98Å; S804-H1321 VanDerWaalsContact OG-CE1 3.26Å; S804-L1322 PolarHBondContact N-O 2.97Å; S804-P1323 WeakPolarHBondContact OG-CA 3.36Å; S804-L1324 WeakPolarHBondContact O-CB 3.45Å; S804-L1324 PolarHBondContact O-N 3.45Å
805	V	93.7	Very high	71.4	Confident	83 Å²	83	78.1 Å²	78.1	50%	0.503	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	139.3	160.9	-171.2	0	0	0	0	106.7	A1330 I1333	V805-A1330 HydrophobicContact CB-CB 4.48Å; V805-A1330 HydrophobicContact CG1-CB 3.75Å; V805-A1330 HydrophobicContact CG2-CB 3.99Å; V805-I1333 HydrophobicContact CG2-CD1 4.13Å
806	A	90.2	Very high	69	Low	31 Å²	31	79.4 Å²	79.4	26%	0.256	41%	0.412	S	S	.	.			trans	-61.8	159.4	169.1	0	0	0	0	0	110.4	P1323 L1324 Y1325	A806-P1323 HydrophobicContact CB-CB 4.41Å; A806-L1324 WeakPolarHBondContact CB-O 3.4Å; A806-L1324 PolarHBondContact N-O 3.42Å; A806-Y1325 HydrophobicContact CB-CD1 3.59Å; A806-Y1325 HydrophobicContact CB-CE1 3.78Å; A806-Y1325 HydrophobicContact CB-CG 4.12Å
807	S	74.2	Confident	66.4	Low	71 Å²	71	79.6 Å²	79.6	50%	0.497	42%	0.415	S	S	.	.			trans	-134.8	135.2	174.2	79.9	0	0	0	0	110.6	K809	S807-K809 PolarHBondContact O-N 3.15Å
808	D	57	Low	63.5	Low	137 Å²	137	83.1 Å²	83.1	73%	0.733	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	12.6	-172.1	-26.1	-36.4	0	0	0	116	N812	D808-N812 PolarHBondContact O-ND2 3.21Å
809	K	42	Very low	60.4	Low	175 Å²	175	85.8 Å²	85.8	76%	0.761	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-11	-170.5	-66.9	-173.5	176.6	-178.8	0	114.7	S807	S807-K809 PolarHBondContact O-N 3.15Å
810	E	43	Very low	57.3	Low	165 Å²	165	86.3 Å²	86.3	77%	0.771	48%	0.477	S	S	*	.	S	Bend	trans	-96.2	-41.8	-179.2	-59.8	-163	145.2	0	0	111.8	N812	E810-N812 PolarHBondContact O-N 3.29Å
811	D	44.1	Very low	54.2	Low	100 Å²	100	91 Å²	91	54%	0.535	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-67.8	-31.4	-178.2	-49	-70	0	0	0	113.5	K813 S814	D811-K813 PolarHBondContact O-N 3.36Å; D811-S814 PolarHBondContact O-N 2.86Å; D811-S814 PolarHBondContact O-OG 3.12Å; D811-S814 VanDerWaalsContact O-OG 3.06Å
812	N	33.2	Very low	51.2	Low	133 Å²	133	94.5 Å²	94.5	71%	0.711	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-68.9	22.1	-179	-80.4	-77.9	0	0	0	115.1	D808 E810	D808-N812 PolarHBondContact O-ND2 3.21Å; E810-N812 PolarHBondContact O-N 3.29Å
813	K	35.2	Very low	48.1	Very low	160 Å²	160	96 Å²	96	70%	0.696	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-126.5	-13.3	173.9	-84.5	-175.3	173.1	-178.2	0	115.2	D811	D811-K813 PolarHBondContact O-N 3.36Å
814	S	33.4	Very low	45.2	Very low	53 Å²	53	99.8 Å²	99.8	37%	0.371	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	-32.2	180	45.5	0	0	0	0	113.9	D811 I816 V817	D811-S814 PolarHBondContact O-N 2.86Å; D811-S814 PolarHBondContact O-OG 3.12Å; D811-S814 VanDerWaalsContact O-OG 3.06Å; S814-I816 PolarHBondContact O-N 2.68Å; S814-V817 PolarHBondContact O-N 3.12Å
815	D	35.3	Very low	42.2	Very low	139 Å²	139	99.6 Å²	99.6	74%	0.743	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	13.1	-160.8	-65	-2.7	0	0	0	116
816	I	35.5	Very low	39.2	Very low	140 Å²	140	101.5 Å²	101.5	72%	0.718	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	-2.6	176.8	-52.1	-176.2	0	0	0	110.8	S814 F1263	S814-I816 PolarHBondContact O-N 2.68Å; I816-F1263 HydrophobicContact CG2-CZ 4.27Å; I816-F1263 WeakPolarHBondContact O-CE1 3.32Å; I816-F1263 VanDerWaalsContact O-CZ 3.29Å; I816-F1263 WeakPolarHBondContact O-CZ 3.42Å
817	V	34.8	Very low	36.3	Very low	23 Å²	23	103.6 Å²	103.6	14%	0.139	58%	0.576	C	S	.	*	S	Bend	trans	-99	107.7	-171.7	-174.8	0	0	0	0	112.3	S814 S819 F1263 L1266	S814-V817 PolarHBondContact O-N 3.12Å; V817-S819 PolarHBondContact O-N 2.85Å; V817-F1263 HydrophobicContact CB-CE1 4.2Å; V817-F1263 HydrophobicContact CG1-CD1 4.13Å; V817-F1263 HydrophobicContact CG1-CE1 4.31Å; V817-F1263 HydrophobicContact CG2-CE1 4Å; V817-L1266 HydrophobicContact CG2-CB 3.63Å; V817-L1266 HydrophobicContact CG2-CD1 4.23Å
818	N	29.6	Very low	34.1	Very low	74 Å²	74	110.7 Å²	110.7	40%	0.396	59%	0.592	S	S	.	*			trans	43	66.5	161.4	-62	-35.1	0	0	0	116.4	P820 F1263	N818-P820 WeakPolarHBondContact O-CD 3.33Å; N818-P820 VanDerWaalsContact O-N 3.12Å; N818-F1263 PolarHBondContact ND2-O 3.25Å
819	S	26	Very low	32.7	Very low	113 Å²	113	110.1 Å²	110.1	79%	0.79	60%	0.599	S	S	*	*			trans	-54.5	117.7	148.4	-44	0	0	0	0	107.6	V817 S821	V817-S819 PolarHBondContact O-N 2.85Å; S819-S821 PolarHBondContact O-N 3.48Å
820	P	26.2	Very low	32.1	Very low	105 Å²	105	105.5 Å²	105.5	68%	0.682	59%	0.588	S	S	*	*			trans	-63.5	125.5	172.2	-15.6	30	0	0	0	106.7	N818 L822	N818-P820 WeakPolarHBondContact O-CD 3.33Å; N818-P820 VanDerWaalsContact O-N 3.12Å; P820-L822 HydrophobicContact CB-CG 4.46Å; P820-L822 PolarHBondContact O-N 3.25Å
821	S	25.8	Very low	31.3	Very low	101 Å²	101	108.5 Å²	108.5	71%	0.706	59%	0.592	S	S	*	*			trans	-74.6	51.5	174.1	63.2	0	0	0	0	111.2	S819 T823	S819-S821 PolarHBondContact O-N 3.48Å; S821-T823 PolarHBondContact O-N 2.96Å; S821-T823 VanDerWaalsContact O-N 3.12Å
822	L	31.8	Very low	30.6	Very low	91 Å²	91	114.7 Å²	114.7	48%	0.476	61%	0.608	S	S	.	*			trans	-50.6	118.2	157.1	-78.4	166.1	0	0	0	106.3	P820 H824	P820-L822 HydrophobicContact CB-CG 4.46Å; P820-L822 PolarHBondContact O-N 3.25Å; L822-H824 PolarHBondContact O-N 2.6Å
823	T	28.4	Very low	30.4	Very low	87 Å²	87	113.6 Å²	113.6	53%	0.534	61%	0.607	S	S	.	*			trans	-75.8	48.2	178.2	59.4	0	0	0	0	111.1	S821 S825	S821-T823 PolarHBondContact O-N 2.96Å; S821-T823 VanDerWaalsContact O-N 3.12Å; T823-S825 PolarHBondContact O-N 2.96Å
824	H	34.8	Very low	30.1	Very low	86 Å²	86	112.2 Å²	112.2	40%	0.398	61%	0.612	S	S	.	*			trans	-78.4	102.6	161	-96.2	-44.7	0	0	0	108.6	R465 L822 T826	R465-H824 VanDerWaalsContact CZ-CE1 3.41Å; R465-H824 PolarHBondContact NH1-CE1 3.17Å; R465-H824 PolarHBondContact NH1-NE2 3.09Å; R465-H824 PolarHBondContact NH2-CE1 3.15Å; R465-H824 PolarHBondContact NH2-NE2 3.43Å; L822-H824 PolarHBondContact O-N 2.6Å; H824-T826 PolarHBondContact O-N 3.29Å
825	S	31.6	Very low	29.8	Very low	24 Å²	24	118.2 Å²	118.2	17%	0.168	63%	0.634	C	S	.	*			trans	-43.7	102.8	-179.6	59.4	0	0	0	0	114	E388 S389 R390 T823 C827	E388-S825 WeakPolarHBondContact O-CB 3.49Å; S389-S825 WeakPolarHBondContact CA-OG 3.4Å; R390-S825 PolarHBondContact N-OG 3.27Å; T823-S825 PolarHBondContact O-N 2.96Å; S825-C827 PolarHBondContact O-N 2.93Å
826	T	31.1	Very low	29.6	Very low	124 Å²	124	116.8 Å²	116.8	76%	0.761	64%	0.635	S	S	*	*			trans	-64.4	92.7	156	51.6	0	0	0	0	107.7	H824 R828	H824-T826 PolarHBondContact O-N 3.29Å; T826-R828 PolarHBondContact O-N 3.04Å
827	C	29.8	Very low	29.4	Very low	75 Å²	75	115.9 Å²	115.9	51%	0.507	64%	0.636	S	S	.	*			trans	-64.6	80.6	172.2	-71.6	0	0	0	0	109.3	S825 S829	S825-C827 PolarHBondContact O-N 2.93Å; C827-S829 PolarHBondContact O-N 2.87Å; C827-S829 VanDerWaalsContact O-N 3.17Å
828	R	26.9	Very low	29.3	Very low	219 Å²	219	122 Å²	122	83%	0.826	67%	0.668	S	S	*	*			trans	-52.1	122.8	172.2	-83.1	-175.9	166	-173.6	-4.2	108.1	T826 S830	T826-R828 PolarHBondContact O-N 3.04Å; R828-S830 PolarHBondContact O-N 3.07Å
829	S	29	Very low	29.3	Very low	126 Å²	126	125 Å²	125	88%	0.881	69%	0.689	S	S	*	*			trans	-69.8	76.3	177.1	-170.7	0	0	0	0	110.4	C827 R831	C827-S829 PolarHBondContact O-N 2.87Å; C827-S829 VanDerWaalsContact O-N 3.17Å; S829-R831 PolarHBondContact O-N 3.28Å; S829-R831 VanDerWaalsContact O-N 3.15Å
830	S	28.8	Very low	29.7	Very low	78 Å²	78	125.5 Å²	125.5	55%	0.545	69%	0.688	S	S	.	*			trans	-64.8	108.8	168.6	-63.4	0	0	0	0	107.5	R828 W832	R828-S830 PolarHBondContact O-N 3.07Å; S830-W832 VanDerWaalsContact C-N 3.35Å; S830-W832 PolarHBondContact O-N 3.07Å
831	R	26.9	Very low	29.9	Very low	227 Å²	227	125.7 Å²	125.7	86%	0.857	69%	0.692	S	S	*	*			trans	-63.7	90.7	179	-179.6	-173.3	-70.2	170	-1.9	110.3	S829 T833	S829-R831 PolarHBondContact O-N 3.28Å; S829-R831 VanDerWaalsContact O-N 3.15Å; R831-T833 PolarHBondContact O-N 2.67Å; R831-T833 VanDerWaalsContact O-N 3.11Å
832	W	29.1	Very low	30.3	Very low	230 Å²	230	129.6 Å²	129.6	87%	0.871	70%	0.699	S	S	*	*			trans	-75.2	95.6	171.4	-70.6	97.3	0	0	0	109.8	S830	S830-W832 VanDerWaalsContact C-N 3.35Å; S830-W832 PolarHBondContact O-N 3.07Å
833	T	28.8	Very low	30.3	Very low	111 Å²	111	131.6 Å²	131.6	68%	0.681	72%	0.715	S	S	*	*			trans	-67.9	128.1	164.6	45.7	0	0	0	0	109.5	R831 E835	R831-T833 PolarHBondContact O-N 2.67Å; R831-T833 VanDerWaalsContact O-N 3.11Å; T833-E835 PolarHBondContact O-N 2.75Å; T833-E835 VanDerWaalsContact O-N 3.12Å
834	T	27.8	Very low	30.5	Very low	130 Å²	130	130.8 Å²	130.8	80%	0.798	72%	0.724	S	S	*	*			trans	-69	102.7	178.7	50	0	0	0	0	111.8
835	E	28.6	Very low	30.3	Very low	179 Å²	179	132.5 Å²	132.5	84%	0.836	74%	0.74	S	S	*	*			trans	-109.5	91.7	156.4	-73.3	-160.3	144.1	0	0	109.5	T833 T837	T833-E835 PolarHBondContact O-N 2.75Å; T833-E835 VanDerWaalsContact O-N 3.12Å; E835-T837 PolarHBondContact O-N 3.39Å
836	S	29.8	Very low	30.3	Very low	109 Å²	109	138.8 Å²	138.8	76%	0.762	77%	0.771	S	S	*	*			trans	-73.7	117	174.7	-52	0	0	0	0	110.2
837	T	31.6	Very low	30.3	Very low	122 Å²	122	139 Å²	139	75%	0.748	77%	0.768	S	S	*	*			trans	-111.2	77.6	172	46.9	0	0	0	0	111.5	E835 T839	E835-T837 PolarHBondContact O-N 3.39Å; T837-T839 PolarHBondContact O-N 2.68Å; T837-T839 VanDerWaalsContact O-N 3.11Å
838	D	32.2	Very low	30.2	Very low	150 Å²	150	142.1 Å²	142.1	80%	0.802	78%	0.776	S	S	*	*			trans	-63.4	106.7	165.1	-81.6	-54.1	0	0	0	110.2	T840	D838-T840 PolarHBondContact O-N 3.33Å; D838-T840 VanDerWaalsContact O-N 3.13Å
839	T	30.9	Very low	30.3	Very low	137 Å²	137	137.4 Å²	137.4	84%	0.84	77%	0.767	S	S	*	*			trans	-85.9	80.4	178.7	57.9	0	0	0	0	111.8	T837	T837-T839 PolarHBondContact O-N 2.68Å; T837-T839 VanDerWaalsContact O-N 3.11Å
840	T	33.6	Very low	30.3	Very low	124 Å²	124	137.7 Å²	137.7	76%	0.761	76%	0.759	S	S	*	*			trans	-107.8	130	161.4	52.3	0	0	0	0	111.1	D838	D838-T840 PolarHBondContact O-N 3.33Å; D838-T840 VanDerWaalsContact O-N 3.13Å
841	S	30.9	Very low	30.4	Very low	110 Å²	110	140.6 Å²	140.6	77%	0.769	77%	0.767	S	S	*	*			trans	-48.9	140.7	172.7	50.5	0	0	0	0	112.5
842	E	34.3	Very low	30.4	Very low	183 Å²	183	138.7 Å²	138.7	86%	0.855	77%	0.765	S	S	*	*				-163.1	168.5	73.1	-88.2	-172.1	144.3	0	0	115.2
843	T	32	Very low	30.3	Very low	133 Å²	133	138.4 Å²	138.4	82%	0.816	76%	0.764	S	S	*	*			trans	-46.8	140.3	179.7	50.5	0	0	0	0	118.8
844	G	32.6	Very low	30.2	Very low	70 Å²	70	138.8 Å²	138.8	72%	0.722	77%	0.766	S	S	*	*			trans	161.5	64.5	163.8	0	0	0	0	0	116
845	V	30.4	Very low	30.2	Very low	121 Å²	121	143 Å²	143	73%	0.733	77%	0.767	S	S	*	*				69.9	108.7	86.3	179.1	0	0	0	0	114.8
846	L	31.5	Very low	30.2	Very low	157 Å²	157	145.9 Å²	145.9	82%	0.822	77%	0.771	S	S	*	*			trans	71.4	149.6	159.7	-65.5	173	0	0	0	118.5
847	N	29.7	Very low	30.1	Very low	128 Å²	128	148.8 Å²	148.8	68%	0.684	77%	0.772	S	S	*	*			cis	-165.8	138.5	-18.1	-171.6	35.6	0	0	0	112.3
848	M	29.5	Very low	30.2	Very low	140 Å²	140	155.2 Å²	155.2	69%	0.69	78%	0.782	S	S	*	*			trans	32	131	148.5	-71.5	-73.9	-179.1	0	0	123.3
849	N	29	Very low	30.2	Very low	120 Å²	120	152.7 Å²	152.7	64%	0.642	78%	0.777	S	S	*	*				83.1	118.5	127.9	-74	-19.5	0	0	0	123.7
850	N	28.5	Very low	30.5	Very low	132 Å²	132	153.8 Å²	153.8	71%	0.706	78%	0.778	S	S	*	*				88.8	150.1	121	-80.6	-34.2	0	0	0	123.5
851	I	30.4	Very low	30.5	Very low	139 Å²	139	155.6 Å²	155.6	71%	0.713	78%	0.777	S	S	*	*			trans	78.4	104.4	154.1	-67.1	149.8	0	0	0	119
852	K	26.7	Very low	30.9	Very low	187 Å²	187	157.2 Å²	157.2	81%	0.813	78%	0.776	S	S	*	*			trans	15.2	122	131.3	-49.9	169	-178.6	175.8	0	117.6
853	R	28.1	Very low	30.9	Very low	224 Å²	224	154.5 Å²	154.5	85%	0.845	77%	0.767	S	S	*	*				177.2	118.5	117.6	-100	164.9	175.6	133.1	-3.9	116.7
854	T	26.5	Very low	31.2	Very low	119 Å²	119	152.4 Å²	152.4	73%	0.73	76%	0.758	S	S	*	*				30.9	119.4	129.1	62.4	0	0	0	0	121.9
855	R	26.6	Very low	31.3	Very low	219 Å²	219	155.3 Å²	155.3	83%	0.826	76%	0.762	S	S	*	*				65.4	115.5	117.9	-169.8	-167.8	-165.2	-177.9	7.9	119.3
856	R	28.7	Very low	31.7	Very low	239 Å²	239	153.7 Å²	153.7	90%	0.902	76%	0.756	S	S	*	*				-172.5	155.2	122.8	-106.5	162.5	-176.5	174.9	1.4	115.2
857	H	29.4	Very low	31.8	Very low	171 Å²	171	153 Å²	153	79%	0.792	75%	0.753	S	S	*	*			trans	-66.2	164	173.2	-52.6	-108.7	0	0	0	113.1
858	R	33.3	Very low	32.1	Very low	256 Å²	256	153.7 Å²	153.7	97%	0.966	76%	0.756	S	S	*	*				-136.1	160.4	127.9	-117	179.4	-179.1	-170.2	-1.5	111
859	S	31	Very low	32.3	Very low	98 Å²	98	151.7 Å²	151.7	69%	0.685	76%	0.756	S	S	*	*			trans	-121.7	163	-177	-178.9	0	0	0	0	109.2
860	N	37.3	Very low	32.7	Very low	160 Å²	160	152.1 Å²	152.1	86%	0.856	76%	0.763	S	S	*	*			trans	-169.3	90.2	144.7	-95.5	-5	0	0	0	111.2
861	Q	34.9	Very low	33.4	Very low	161 Å²	161	151 Å²	151	75%	0.752	76%	0.762	S	S	*	*			trans	26.4	159.1	131.3	-156.5	172.1	-4.5	0	0	122.7
862	I	37.8	Very low	33.5	Very low	145 Å²	145	152.5 Å²	152.5	74%	0.744	77%	0.77	S	S	*	*			trans	96.7	119.5	166.7	-54.3	172.7	0	0	0	113.6
863	D	35.8	Very low	33.8	Very low	125 Å²	125	147.3 Å²	147.3	67%	0.668	76%	0.763	S	S	*	*			cis	-160.9	164.9	-16.5	-118.1	-15.9	0	0	0	114.3
864	S	36.7	Very low	34	Very low	90 Å²	90	145.3 Å²	145.3	63%	0.629	76%	0.76	S	S	*	*			trans	63.3	112.5	148.6	-63.4	0	0	0	0	123.7
865	T	35.9	Very low	34.5	Very low	131 Å²	131	145 Å²	145	80%	0.804	75%	0.754	S	S	*	*			trans	68	141.9	131.4	58	0	0	0	0	121.8
866	S	38	Very low	34.8	Very low	86 Å²	86	141.1 Å²	141.1	60%	0.601	75%	0.75	S	S	*	*			cis	-172	143.9	-11.2	52.3	0	0	0	0	113.8
867	N	34.1	Very low	35	Very low	144 Å²	144	137.3 Å²	137.3	77%	0.77	75%	0.746	S	S	*	*			trans	68.6	152.3	144.5	-61	-9.4	0	0	0	118.1
868	L	35.3	Very low	35.3	Very low	142 Å²	142	134.1 Å²	134.1	74%	0.743	74%	0.741	S	S	*	*			cis	-155.6	135.3	-0.4	-153.5	49.2	0	0	0	112.2
869	S	34.4	Very low	35.2	Very low	97 Å²	97	131.5 Å²	131.5	68%	0.678	74%	0.736	S	S	*	*			trans	49.7	163.2	144.7	-56.1	0	0	0	0	121.5
870	T	38.3	Very low	35.4	Very low	129 Å²	129	132.2 Å²	132.2	79%	0.791	74%	0.738	S	S	*	*			cis	-148.2	139.2	13.1	-31.8	0	0	0	0	111.9
871	P	41.9	Very low	35.1	Very low	108 Å²	108	129.3 Å²	129.3	70%	0.701	73%	0.731	S	S	*	*			trans	-101.2	168.6	170.2	39.6	-34.3	0	0	0	112.6
872	I	32.7	Very low	35.1	Very low	171 Å²	171	128.9 Å²	128.9	88%	0.877	73%	0.734	S	S	*	*			trans	166.5	154.6	156.3	-95.7	152.7	0	0	0	107.8
873	A	32.9	Very low	34.8	Very low	79 Å²	79	128.6 Å²	128.6	65%	0.653	73%	0.734	S	S	*	*			cis	-175.7	179.9	-32.1	0	0	0	0	0	106.2
874	K	33	Very low	34.7	Very low	181 Å²	181	127.8 Å²	127.8	79%	0.787	73%	0.733	S	S	*	*			cis	-168.7	178.5	-1.2	-143.1	178.4	168	-169.5	0	109.9
875	N	35.6	Very low	34.6	Very low	114 Å²	114	130.1 Å²	130.1	61%	0.61	74%	0.739	S	S	*	*			trans	72.6	119.3	158.6	-61.4	9	0	0	0	116.7
876	D	34	Very low	34.4	Very low	137 Å²	137	131.1 Å²	131.1	73%	0.733	74%	0.739	S	S	*	*				88.4	143.7	72.4	-59.4	-36.4	0	0	0	111.4
877	L	32.9	Very low	34.2	Very low	159 Å²	159	132 Å²	132	83%	0.832	74%	0.741	S	S	*	*			cis	-152	154.5	20.3	-167.4	67.3	0	0	0	111.5
878	P	35.1	Very low	34	Very low	103 Å²	103	131.7 Å²	131.7	67%	0.669	74%	0.739	S	S	*	*			trans	-113.3	175.6	-177.2	41.4	-34.4	0	0	0	115.9
879	K	31.2	Very low	33.9	Very low	201 Å²	201	130 Å²	130	87%	0.874	74%	0.735	S	S	*	*			trans	70.6	169.4	162.7	-85.3	-173.6	175.9	-172.6	0	117.2
880	P	35.7	Very low	33.6	Very low	113 Å²	113	132 Å²	132	73%	0.734	73%	0.731	S	S	*	*			cis	-124.1	-167.1	-3.1	32.3	-10.8	0	0	0	114.7
881	S	30.7	Very low	33.2	Very low	99 Å²	99	131.9 Å²	131.9	69%	0.692	73%	0.725	S	S	*	*			trans	-64.7	160.8	166	50.3	0	0	0	0	114.6
882	D	34.6	Very low	32.6	Very low	153 Å²	153	132.2 Å²	132.2	82%	0.818	72%	0.717	S	S	*	*			trans	-175.5	151.2	142.1	-85.2	-18.5	0	0	0	107.7
883	D	32.5	Very low	32.5	Very low	138 Å²	138	130.6 Å²	130.6	74%	0.738	71%	0.71	S	S	*	*			cis	-165.4	173.8	-25.3	-163.5	12	0	0	0	110.1
884	V	33.3	Very low	32.2	Very low	108 Å²	108	132.7 Å²	132.7	66%	0.655	71%	0.709	S	S	*	*			trans	66.4	149.6	160.5	-102.8	0	0	0	0	124.8
885	D	35.6	Very low	31.9	Very low	140 Å²	140	129.6 Å²	129.6	75%	0.749	70%	0.701	S	S	*	*			trans	57.7	104	157.9	-56.4	-26.6	0	0	0	119.3
886	D	30.1	Very low	31.5	Very low	152 Å²	152	129 Å²	129	81%	0.813	70%	0.698	S	S	*	*			cis	85.5	167	34	-157.4	19.3	0	0	0	115.1
887	V	34.5	Very low	31.2	Very low	105 Å²	105	130.2 Å²	130.2	64%	0.636	69%	0.693	S	S	*	*			trans	94.6	92.6	170.6	-171.7	0	0	0	0	117.7
888	N	30.6	Very low	31.1	Very low	137 Å²	137	131.1 Å²	131.1	73%	0.733	69%	0.687	S	S	*	*			trans	70.7	155.3	135.2	-74.7	-4.2	0	0	0	122.1
889	T	31.8	Very low	30.7	Very low	107 Å²	107	131.9 Å²	131.9	66%	0.656	69%	0.689	S	S	*	*			cis	-161.1	136.5	-27.9	17	0	0	0	0	111.6
890	K	28.5	Very low	30.6	Very low	137 Å²	137	131.4 Å²	131.4	60%	0.596	69%	0.69	S	S	*	*				33.6	124.5	118	-167.7	-168.2	-179.6	-91.8	0	119.9	E892	K890-E892 WeakPolarHBondContact CE-OE1 3.5Å; K890-E892 VanDerWaalsContact NZ-CD 3.27Å; K890-E892 IonicContact NZ-OE1 2.81Å; K890-E892 PolarHBondContact NZ-OE1 3.2Å; K890-E892 IonicContact NZ-OE2 3.53Å; K890-E892 PolarHBondContact NZ-OE2 3.04Å
891	L	30.3	Very low	30.3	Very low	128 Å²	128	129.3 Å²	129.3	67%	0.67	69%	0.689	S	S	*	*				-170.8	132.1	112.3	-111	86.3	0	0	0	107.4
892	E	28.2	Very low	30.2	Very low	115 Å²	115	131.7 Å²	131.7	54%	0.537	69%	0.694	S	S	.	*				61	137.3	81.9	-61.2	173.8	-173.6	0	0	112.8	K890	K890-E892 WeakPolarHBondContact CE-OE1 3.5Å; K890-E892 VanDerWaalsContact NZ-CD 3.27Å; K890-E892 IonicContact NZ-OE1 2.81Å; K890-E892 PolarHBondContact NZ-OE1 3.2Å; K890-E892 IonicContact NZ-OE2 3.53Å; K890-E892 PolarHBondContact NZ-OE2 3.04Å
893	L	31	Very low	30	Very low	137 Å²	137	131 Å²	131	72%	0.717	69%	0.689	S	S	*	*			cis	-131.4	159	22.5	-84.9	92.5	0	0	0	111.6
894	I	27	Very low	29.9	Very low	123 Å²	123	132.4 Å²	132.4	63%	0.631	69%	0.691	S	S	*	*			cis	70.4	125.1	46.9	-67	167.6	0	0	0	110.1
895	N	26.4	Very low	29.6	Very low	116 Å²	116	132.6 Å²	132.6	62%	0.62	70%	0.697	S	S	*	*			cis	-170.3	-179.9	0.9	-129.9	32.5	0	0	0	110.7
896	D	27.2	Very low	29.6	Very low	102 Å²	102	131.2 Å²	131.2	55%	0.545	70%	0.696	S	S	.	*			trans	67.7	160.2	140	-71.7	-22.8	0	0	0	120.7
897	Y	28.2	Very low	29.4	Very low	162 Å²	162	128.8 Å²	128.8	64%	0.635	69%	0.691	S	S	*	*			cis	-157.2	168.1	1.5	-123	-31.3	0	0	0	113
898	Y	30.3	Very low	29	Very low	178 Å²	178	129 Å²	129	70%	0.698	70%	0.698	S	S	*	*			trans	59	118.4	165.5	-60.1	-63.6	0	0	0	118
899	T	27	Very low	29	Very low	118 Å²	118	128.3 Å²	128.3	72%	0.724	70%	0.698	S	S	*	*			cis	83.3	136.2	25.5	-36.8	0	0	0	0	114.9
900	E	28.6	Very low	28.7	Very low	191 Å²	191	130.1 Å²	130.1	89%	0.893	70%	0.702	S	S	*	*			trans	73.4	138.9	177.7	-46.4	-164.1	162.9	0	0	116.4
901	G	30.6	Very low	28.7	Very low	70 Å²	70	130.1 Å²	130.1	72%	0.722	71%	0.714	S	S	*	*			cis	-175.3	149.9	-6.6	0	0	0	0	0	115.2
902	N	27.6	Very low	28.6	Very low	148 Å²	148	128.2 Å²	128.2	79%	0.791	70%	0.704	S	S	*	*			trans	10.1	124.3	146.6	-175.9	31.5	0	0	0	119
903	I	30.7	Very low	28.8	Very low	138 Å²	138	132 Å²	132	71%	0.708	72%	0.722	S	S	*	*				-178.6	125	124.4	-93.5	154.2	0	0	0	112.8
904	Q	31.1	Very low	28.6	Very low	168 Å²	168	130.7 Å²	130.7	79%	0.785	72%	0.716	S	S	*	*			trans	42.4	125.9	147.3	-59.1	172.4	-39.4	0	0	123.3
905	S	27.3	Very low	28.8	Very low	112 Å²	112	132.4 Å²	132.4	78%	0.783	72%	0.724	S	S	*	*			trans	-48.3	176.3	147.3	-5.6	0	0	0	0	115
906	P	34.7	Very low	29	Very low	111 Å²	111	132.3 Å²	132.3	72%	0.721	73%	0.728	S	S	*	*			cis	-140.4	-174.7	-1.3	41.3	-22.8	0	0	0	116.1
907	S	26.1	Very low	28.9	Very low	101 Å²	101	132.6 Å²	132.6	71%	0.706	74%	0.737	S	S	*	*			trans	74.8	125.4	143	-66.2	0	0	0	0	123.1
908	S	25.9	Very low	28.8	Very low	111 Å²	111	133.3 Å²	133.3	78%	0.776	75%	0.746	S	S	*	*			trans	82.6	159.6	133.6	74.9	0	0	0	0	121.3
909	V	29.7	Very low	28.6	Very low	121 Å²	121	133.3 Å²	133.3	73%	0.733	75%	0.754	S	S	*	*			trans	70.2	94.5	174.1	-168.6	0	0	0	0	113.6
910	I	25.8	Very low	28.7	Very low	146 Å²	146	132.9 Å²	132.9	75%	0.749	76%	0.757	S	S	*	*				58.5	102.6	76.7	-52.8	164.3	0	0	0	113.6
911	T	30.2	Very low	28.6	Very low	137 Å²	137	130.2 Å²	130.2	84%	0.84	75%	0.753	S	S	*	*				-168.2	148.7	126.3	22.5	0	0	0	0	111.2
912	N	26.8	Very low	28.6	Very low	87 Å²	87	132.4 Å²	132.4	47%	0.465	75%	0.752	S	S	.	*			trans	-83.3	154.7	173.5	-53.7	-4.3	0	0	0	110.9	C299	C299-N912 PolarHBondContact SG-ND2 3.03Å
913	Q	33.3	Very low	28.6	Very low	195 Å²	195	131.1 Å²	131.1	91%	0.911	75%	0.75	S	S	*	*			trans	-152.2	116.2	145.6	-115.9	163	2.6	0	0	109.9
914	D	26.1	Very low	28.6	Very low	110 Å²	110	130.4 Å²	130.4	59%	0.588	75%	0.752	S	S	*	*			trans	-66.9	152.5	168.9	-49.1	-90.2	0	0	0	110.6
915	I	31.8	Very low	28.5	Very low	158 Å²	158	131.4 Å²	131.4	81%	0.81	75%	0.754	S	S	*	*			trans	-178.2	119.2	141.9	-97.6	154.7	0	0	0	112.5
916	T	30.5	Very low	28.6	Very low	114 Å²	114	130.1 Å²	130.1	70%	0.699	75%	0.749	S	S	*	*			trans	44.1	123.3	150.1	68.3	0	0	0	0	124
917	C	24.6	Very low	28.6	Very low	109 Å²	109	134.3 Å²	134.3	74%	0.736	76%	0.76	S	S	*	*				61.9	136.4	118.7	-56.5	0	0	0	0	124
918	E	26.1	Very low	28.7	Very low	176 Å²	176	136.8 Å²	136.8	82%	0.822	77%	0.765	S	S	*	*			trans	72.5	115.3	140.3	-72	176.9	175.1	0	0	122.2
919	M	25.3	Very low	29.1	Very low	178 Å²	178	141.2 Å²	141.2	88%	0.877	77%	0.77	S	S	*	*				49.3	110.1	125.1	-134.6	171.1	-163.9	0	0	118.9
920	S	29.7	Very low	29.2	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	77%	0.772	S	S	*	*			trans	-151.4	99.8	161.3	-81.9	0	0	0	0	112.5
921	T	26.3	Very low	29.7	Very low	135 Å²	135	142 Å²	142	83%	0.828	77%	0.771	S	S	*	*			trans	-70.3	124	162	-43.3	0	0	0	0	108.6
922	V	31	Very low	29.9	Very low	115 Å²	115	140.7 Å²	140.7	70%	0.697	76%	0.759	S	S	*	*			trans	-123.3	122.1	-179.8	-179.5	0	0	0	0	111.2
923	V	26.7	Very low	30.3	Very low	121 Å²	121	144 Å²	144	73%	0.733	77%	0.774	S	S	*	*			trans	-105.2	127	173.4	173.7	0	0	0	0	110
924	T	32.4	Very low	30.3	Very low	123 Å²	123	141.6 Å²	141.6	76%	0.755	76%	0.763	S	S	*	*			trans	-133.9	108.9	163.4	49.9	0	0	0	0	107.2
925	K	29.2	Very low	30.6	Very low	190 Å²	190	141.4 Å²	141.4	83%	0.826	77%	0.766	S	S	*	*				44	139.3	68.9	-75.4	-174.4	174.8	175	0	114.1
926	A	28.5	Very low	30.7	Very low	84 Å²	84	140.4 Å²	140.4	69%	0.694	76%	0.762	S	S	*	*			cis	176.4	139.4	-24.4	0	0	0	0	0	106.9
927	Q	34.4	Very low	30.6	Very low	200 Å²	200	139 Å²	139	94%	0.935	76%	0.757	S	S	*	*			trans	-144	154.8	161.3	-76.6	-152.5	-1.6	0	0	112.5
928	N	29.4	Very low	31	Very low	153 Å²	153	141.3 Å²	141.3	82%	0.818	76%	0.761	S	S	*	*			trans	-115.3	150.6	-165.9	-65.5	-66	0	0	0	113.3
929	K	33.5	Very low	31	Very low	204 Å²	204	138.9 Å²	138.9	89%	0.887	76%	0.758	S	S	*	*			trans	159.4	122.4	138.5	-86.8	155.1	-175.6	-179.3	0	107
930	K	31.1	Very low	31.3	Very low	177 Å²	177	139.5 Å²	139.5	77%	0.77	76%	0.759	S	S	*	*			cis	73	95.6	35.2	-161.2	-161	171.1	-177.6	0	115.2	D932	K930-D932 VanDerWaalsContact CE-OD1 3.26Å; K930-D932 WeakPolarHBondContact CE-OD1 3.38Å
931	S	36.1	Very low	31.3	Very low	105 Å²	105	138 Å²	138	73%	0.734	75%	0.753	S	S	*	*			trans	178.7	146.3	133.5	51.8	0	0	0	0	109.9
932	D	35.6	Very low	31.4	Very low	110 Å²	110	138.7 Å²	138.7	59%	0.588	75%	0.752	S	S	*	*			cis	-170.3	162.9	-22.7	-89.6	-41.2	0	0	0	106.8	K930	K930-D932 VanDerWaalsContact CE-OD1 3.26Å; K930-D932 WeakPolarHBondContact CE-OD1 3.38Å
933	M	33.9	Very low	31.5	Very low	156 Å²	156	142 Å²	142	77%	0.768	76%	0.757	S	S	*	*			trans	65.8	144.4	154.3	-77	168.4	149.4	0	0	120.4
934	E	33.9	Very low	31.5	Very low	145 Å²	145	143.1 Å²	143.1	68%	0.678	76%	0.763	S	S	*	*			cis	-161.8	167.2	-15.8	-133.1	167.9	-163.2	0	0	111.9
935	T	32	Very low	31.6	Very low	107 Å²	107	142.8 Å²	142.8	66%	0.656	77%	0.766	S	S	*	*			trans	2.9	153	152.5	49	0	0	0	0	121.7
936	D	33.5	Very low	31.5	Very low	136 Å²	136	141.4 Å²	141.4	73%	0.727	77%	0.767	S	S	*	*			cis	-159.3	-178.7	19.9	-136.3	-47.2	0	0	0	114.8
937	S	29.1	Very low	31.6	Very low	85 Å²	85	142.7 Å²	142.7	59%	0.594	77%	0.769	S	S	*	*			trans	-35	171.2	162.4	60.9	0	0	0	0	118.5
938	L	32.4	Very low	31.4	Very low	157 Å²	157	143.6 Å²	143.6	82%	0.822	77%	0.765	S	S	*	*			cis	-159.2	172.3	27.9	-141.3	148.2	0	0	0	112.6
939	V	27.7	Very low	31.3	Very low	125 Å²	125	143.2 Å²	143.2	76%	0.758	76%	0.762	S	S	*	*			trans	-69.7	144.5	175.8	173.1	0	0	0	0	112.9
940	E	30.3	Very low	31.1	Very low	192 Å²	192	140.4 Å²	140.4	90%	0.897	76%	0.761	S	S	*	*				178.8	171.4	117.8	-160.8	147.9	-128.5	0	0	112.6
941	A	30.1	Very low	31	Very low	77 Å²	77	140.9 Å²	140.9	64%	0.636	76%	0.763	S	S	*	*			trans	-103.4	175.8	-149.4	0	0	0	0	0	117.4
942	N	29	Very low	30.5	Very low	151 Å²	151	140.6 Å²	140.6	81%	0.807	76%	0.761	S	S	*	*			trans	98.1	136.5	143.2	-89.3	-53.9	0	0	0	122.5
943	K	32	Very low	30.1	Very low	185 Å²	185	141.4 Å²	141.4	80%	0.804	77%	0.774	S	S	*	*			trans	82.9	96.1	155.2	-70.7	174.1	-179.7	175.9	0	121.7
944	V	28	Very low	29.8	Very low	144 Å²	144	144.2 Å²	144.2	87%	0.873	78%	0.776	S	S	*	*				44	106.8	119.1	-175.7	0	0	0	0	118.7
945	S	33	Very low	29.5	Very low	116 Å²	116	143.7 Å²	143.7	81%	0.811	78%	0.783	S	S	*	*			trans	-164.3	123.1	138.1	61.8	0	0	0	0	113.5
946	N	28.3	Very low	29.3	Very low	160 Å²	160	142.5 Å²	142.5	86%	0.856	78%	0.779	S	S	*	*			trans	9.8	154.7	160.9	-88.4	-1.1	0	0	0	124.5
947	P	30.9	Very low	29	Very low	111 Å²	111	142.1 Å²	142.1	72%	0.721	78%	0.781	S	S	*	*			trans	-87.6	157.7	-166	36.3	-38	0	0	0	115.4
948	Y	30.2	Very low	29	Very low	219 Å²	219	143 Å²	143	86%	0.859	78%	0.784	S	S	*	*			trans	-132.7	105.3	166.1	-104.1	-85.6	0	0	0	113.9
949	I	26.6	Very low	28.9	Very low	146 Å²	146	141.3 Å²	141.3	75%	0.749	78%	0.779	S	S	*	*			trans	-3	116.3	149.3	-54.1	164	0	0	0	116
950	V	29.7	Very low	28.8	Very low	144 Å²	144	143.6 Å²	143.6	87%	0.873	78%	0.781	S	S	*	*			trans	-122.8	148.3	148.6	-178.7	0	0	0	0	107.9
951	K	29.2	Very low	28.9	Very low	188 Å²	188	141.4 Å²	141.4	82%	0.817	77%	0.774	S	S	*	*			trans	-86.1	149.8	-157.1	-67.6	176.6	179.1	175.4	0	114.4
952	S	25.9	Very low	29	Very low	98 Å²	98	143.5 Å²	143.5	69%	0.685	78%	0.782	S	S	*	*			trans	-62	134.4	168.9	170.4	0	0	0	0	112.2
953	C	26.1	Very low	29.1	Very low	128 Å²	128	145.5 Å²	145.5	87%	0.865	79%	0.786	S	S	*	*			trans	-89	114.1	152.3	-70.5	0	0	0	0	107.8
954	R	27.7	Very low	29.2	Very low	215 Å²	215	145.6 Å²	145.6	81%	0.811	79%	0.789	S	S	*	*			trans	-115.9	97.4	-177.5	-159.5	-177.8	-164.1	-174.8	4.7	108.7	S956	R954-S956 PolarHBondContact O-N 3.48Å
955	T	27.2	Very low	29.2	Very low	134 Å²	134	144.5 Å²	144.5	82%	0.822	78%	0.784	S	S	*	*			trans	-80.2	67.9	179.5	-45.8	0	0	0	0	110.4	V957	T955-V957 PolarHBondContact O-N 3.22Å
956	S	27.9	Very low	29.2	Very low	82 Å²	82	144.9 Å²	144.9	57%	0.573	79%	0.786	S	S	*	*			trans	-74.7	106.6	171.6	51	0	0	0	0	109.8	R954 T958	R954-S956 PolarHBondContact O-N 3.48Å; S956-T958 PolarHBondContact O-N 3.42Å
957	V	28.3	Very low	29.1	Very low	128 Å²	128	144.5 Å²	144.5	78%	0.776	78%	0.784	S	S	*	*			trans	-76.8	79	171.3	-175.9	0	0	0	0	109	T955 V959	T955-V957 PolarHBondContact O-N 3.22Å; V957-V959 HydrophobicContact CG1-CG2 4.41Å; V957-V959 PolarHBondContact O-N 2.94Å
958	T	28	Very low	29.2	Very low	104 Å²	104	146.3 Å²	146.3	64%	0.638	79%	0.793	S	S	*	*			trans	-75.1	112.3	166.6	-53.3	0	0	0	0	108.2	S956 E960	S956-T958 PolarHBondContact O-N 3.42Å; T958-E960 HydrophobicContact CG2-CG 4.04Å; T958-E960 PolarHBondContact O-N 2.95Å
959	V	30.1	Very low	29	Very low	121 Å²	121	145.1 Å²	145.1	73%	0.733	79%	0.792	S	S	*	*			trans	-82.3	95.4	167	-179.8	0	0	0	0	107.5	V957	V957-V959 HydrophobicContact CG1-CG2 4.41Å; V957-V959 PolarHBondContact O-N 2.94Å
960	E	26.3	Very low	29.1	Very low	172 Å²	172	146.2 Å²	146.2	80%	0.804	80%	0.798	S	S	*	*			trans	-68.9	129.3	171.9	-65.2	-176.3	160.9	0	0	110	T958	T958-E960 HydrophobicContact CG2-CG 4.04Å; T958-E960 PolarHBondContact O-N 2.95Å
961	I	33.3	Very low	28.8	Very low	146 Å²	146	144.3 Å²	144.3	75%	0.749	79%	0.791	S	S	*	*			trans	-110.3	132.9	165.2	-60.7	178	0	0	0	106.1
962	P	31.4	Very low	29	Very low	122 Å²	122	143.6 Å²	143.6	79%	0.792	80%	0.795	S	S	*	*			trans	-75.7	133.6	-168.3	-14.4	30.2	0	0	0	113.1
963	E	31.2	Very low	29	Very low	193 Å²	193	147.6 Å²	147.6	90%	0.902	80%	0.799	S	S	*	*			trans	-92.6	116.4	164.9	-70	-170.7	150.9	0	0	110.6	T965	E963-T965 PolarHBondContact O-N 2.92Å
964	E	33.3	Very low	29.2	Very low	186 Å²	186	150.8 Å²	150.8	87%	0.869	80%	0.802	S	S	*	*			trans	-84.2	100.1	168.5	-72.3	-153.4	143.9	0	0	111.8
965	T	29.3	Very low	29.2	Very low	122 Å²	122	145 Å²	145	75%	0.748	79%	0.794	S	S	*	*			trans	25	109.2	148.3	56.3	0	0	0	0	119.5	E963	E963-T965 PolarHBondContact O-N 2.92Å
966	S	33.3	Very low	29.3	Very low	124 Å²	124	150.1 Å²	150.1	87%	0.867	80%	0.8	S	S	*	*				-144.5	141.6	128	64.9	0	0	0	0	111.4
967	N	26.3	Very low	29.3	Very low	151 Å²	151	151.5 Å²	151.5	81%	0.807	81%	0.81	S	S	*	*			trans	-105.3	128.6	-176.1	-81	-88.7	0	0	0	110.9
968	T	31.5	Very low	29.6	Very low	149 Å²	149	151.1 Å²	151.1	91%	0.914	81%	0.81	S	S	*	*				-159.9	139.7	129	0.2	0	0	0	0	113
969	K	25.7	Very low	29.8	Very low	194 Å²	194	153.4 Å²	153.4	84%	0.843	82%	0.818	S	S	*	*			trans	-75.4	149.9	170.8	-68.2	172.6	175.3	172.7	0	110.7
970	I	29.9	Very low	29.9	Very low	170 Å²	170	155 Å²	155	87%	0.872	82%	0.818	S	S	*	*				-147.9	149.4	118	-98.4	144.5	0	0	0	108.1
971	S	23.9	Very low	30.3	Very low	104 Å²	104	155.5 Å²	155.5	73%	0.727	82%	0.817	S	S	*	*			trans	-136.1	123.2	-175	156.2	0	0	0	0	109.5
972	I	31.9	Very low	30.3	Very low	173 Å²	173	153.4 Å²	153.4	89%	0.887	82%	0.816	S	S	*	*			trans	-127.4	138.4	158.6	-60.1	-177.6	0	0	0	107.4
973	K	25.6	Very low	30.3	Very low	181 Å²	181	154.1 Å²	154.1	79%	0.787	82%	0.818	S	S	*	*			trans	-144.2	118.6	-169.5	170.2	-166.4	179.1	-177.4	0	107.4
974	E	31.4	Very low	30.5	Very low	196 Å²	196	150 Å²	150	92%	0.916	81%	0.808	S	S	*	*			trans	-155	155.3	162.3	-122	156.6	-134.1	0	0	111.6
975	S	27	Very low	30.3	Very low	92 Å²	92	146.4 Å²	146.4	64%	0.643	80%	0.803	S	S	*	*			trans	-149.6	146.9	-163.3	56.2	0	0	0	0	109.2
976	Y	30.3	Very low	30.4	Very low	242 Å²	242	146.5 Å²	146.5	95%	0.949	81%	0.808	S	S	*	*			trans	-156.5	167.1	149.9	-100.8	-63.1	0	0	0	112.6
977	S	28.3	Very low	30.2	Very low	112 Å²	112	146.4 Å²	146.4	78%	0.783	80%	0.803	S	S	*	*			trans	-105	163.8	-167.4	-92.4	0	0	0	0	114.3
978	P	34.1	Very low	30.4	Very low	119 Å²	119	147.6 Å²	147.6	77%	0.773	80%	0.803	S	S	*	*			trans	-87.8	170.3	-174	37	-38.1	0	0	0	114.2
979	N	31.6	Very low	30.2	Very low	153 Å²	153	145.6 Å²	145.6	82%	0.818	79%	0.791	S	S	*	*			trans	-157.5	169	156.1	-133.7	-37.9	0	0	0	113.7
980	E	32.1	Very low	30.4	Very low	154 Å²	154	143.9 Å²	143.9	72%	0.72	79%	0.791	S	S	*	*			trans	-87.3	160	-156.3	-51	159.9	146.8	0	0	117.8
981	K	34.1	Very low	30.4	Very low	182 Å²	182	141.1 Å²	141.1	79%	0.791	79%	0.786	S	S	*	*				171.5	142.8	111.6	-93.1	154.8	-171.3	171.5	0	117.5
982	S	34.3	Very low	30.7	Very low	103 Å²	103	144.8 Å²	144.8	72%	0.72	79%	0.794	S	S	*	*			trans	47.3	121	153.7	56.2	0	0	0	0	120.8
983	V	31.8	Very low	30.6	Very low	137 Å²	137	145 Å²	145	83%	0.83	79%	0.789	S	S	*	*			cis	70.4	134.6	41.3	-175	0	0	0	0	113.1
984	P	35.6	Very low	31	Very low	107 Å²	107	142.6 Å²	142.6	70%	0.695	79%	0.785	S	S	*	*			cis	-132.6	175.2	-1.2	37	-17.6	0	0	0	118.2
985	S	28.4	Very low	30.9	Very low	109 Å²	109	140.3 Å²	140.3	76%	0.762	78%	0.779	S	S	*	*			trans	56	118.7	140.8	66.2	0	0	0	0	123.6
986	S	32	Very low	31.4	Very low	124 Å²	124	142.6 Å²	142.6	87%	0.867	79%	0.789	S	S	*	*				-162.9	157.2	111.4	60.5	0	0	0	0	111.8
987	T	27.9	Very low	31.4	Very low	122 Å²	122	140.1 Å²	140.1	75%	0.748	79%	0.786	S	S	*	*			trans	-85.2	138.1	-177	46.2	0	0	0	0	113
988	H	31.2	Very low	31.7	Very low	176 Å²	176	139.2 Å²	139.2	82%	0.815	78%	0.78	S	S	*	*				-171.7	150.7	120.4	-107.7	-73.1	0	0	0	114.2
989	T	26.8	Very low	31.9	Very low	107 Å²	107	141.1 Å²	141.1	66%	0.656	78%	0.783	S	S	*	*			trans	-47.1	133	169.4	46.8	0	0	0	0	115.9
990	N	31.1	Very low	31.9	Very low	159 Å²	159	137.8 Å²	137.8	85%	0.85	78%	0.777	S	S	*	*				177.8	163.5	114.2	-88.9	-20.2	0	0	0	113.1
991	S	28.1	Very low	31.9	Very low	111 Å²	111	137 Å²	137	78%	0.776	78%	0.778	S	S	*	*			trans	-82.3	147.7	178.5	55.6	0	0	0	0	113.8
992	M	31.9	Very low	31.8	Very low	181 Å²	181	135.9 Å²	135.9	89%	0.892	78%	0.775	S	S	*	*			trans	-162.2	151.8	139.6	-111.3	178.8	80.4	0	0	111.8
993	F	29.9	Very low	31.7	Very low	177 Å²	177	137.5 Å²	137.5	78%	0.776	78%	0.775	S	S	*	*			trans	-80.8	153.9	162.3	-88.5	-123.3	0	0	0	109.6
994	D	32.2	Very low	31.6	Very low	131 Å²	131	138.3 Å²	138.3	70%	0.701	77%	0.773	S	S	*	*				167	168.7	100.3	-95.4	-42.6	0	0	0	113.1
995	D	31.3	Very low	31.3	Very low	149 Å²	149	140.4 Å²	140.4	80%	0.797	78%	0.778	S	S	*	*			trans	62.6	136.1	166.8	-65.7	-33.2	0	0	0	118.4
996	V	35.7	Very low	31.6	Very low	140 Å²	140	142.9 Å²	142.9	85%	0.848	78%	0.783	S	S	*	*				-144.2	148	58.3	160.2	0	0	0	0	112.5
997	Q	30.5	Very low	31.5	Very low	190 Å²	190	142.5 Å²	142.5	89%	0.888	78%	0.775	S	S	*	*			trans	-140.8	122.6	175.2	178.7	165.4	-25.5	0	0	113.3
998	S	34.7	Very low	31.6	Very low	93 Å²	93	145.4 Å²	145.4	65%	0.65	78%	0.78	S	S	*	*			trans	-165	156.9	161.6	85.1	0	0	0	0	107.5
999	D	37.8	Very low	31.7	Very low	158 Å²	158	146.4 Å²	146.4	85%	0.845	79%	0.785	S	S	*	*			cis	-141	178.1	8.6	-85.8	-66.2	0	0	0	110.5
1000	A	32.7	Very low	31.9	Very low	83 Å²	83	150.5 Å²	150.5	69%	0.686	80%	0.797	S	S	*	*			trans	-134.2	168.7	-173.7	0	0	0	0	0	114.5
1001	D	32.7	Very low	32	Very low	138 Å²	138	151.1 Å²	151.1	74%	0.738	80%	0.8	S	S	*	*			trans	58.7	123	160.2	-56.5	-29.7	0	0	0	120.1
1002	Q	32	Very low	32	Very low	159 Å²	159	149 Å²	149	74%	0.743	80%	0.796	S	S	*	*				176.6	139.1	105.8	-86.4	-37	146.9	0	0	113.9
1003	I	30.9	Very low	31.9	Very low	137 Å²	137	145.9 Å²	145.9	70%	0.703	79%	0.792	S	S	*	*			trans	88.7	124.6	134.1	-77.5	165.7	0	0	0	122.5
1004	L	30.3	Very low	31.9	Very low	154 Å²	154	143.7 Å²	143.7	81%	0.806	80%	0.795	S	S	*	*			trans	81.2	136.5	152.8	-113.5	65	0	0	0	123.3
1005	L	29.4	Very low	31.8	Very low	150 Å²	150	142.6 Å²	142.6	79%	0.785	80%	0.798	S	S	*	*			trans	-91.2	154.8	161.9	-60	148.4	0	0	0	108.1
1006	D	33.8	Very low	31.8	Very low	162 Å²	162	141.5 Å²	141.5	87%	0.866	80%	0.799	S	S	*	*			trans	-145.7	165.9	140.1	-100.8	-39.6	0	0	0	108.2
1007	T	29.7	Very low	31.7	Very low	116 Å²	116	141.7 Å²	141.7	71%	0.712	79%	0.794	S	S	*	*			trans	-133.1	162.2	-158	-37.8	0	0	0	0	111.8
1008	E	31.4	Very low	32.5	Very low	182 Å²	182	139.5 Å²	139.5	85%	0.85	79%	0.786	S	S	*	*			trans	74.2	153.7	173.1	-48	-174.2	145.5	0	0	113
1009	E	32.9	Very low	33	Very low	197 Å²	197	142 Å²	142	92%	0.921	79%	0.792	S	S	*	*			cis	-115.8	-178	13.5	-67.4	-176.1	123.3	0	0	114.4
1010	Q	31.4	Very low	33.6	Very low	194 Å²	194	138.1 Å²	138.1	91%	0.907	77%	0.768	S	S	*	*			trans	-126.9	130.8	-168	174.5	-176.2	33.2	0	0	109.6
1011	D	32.4	Very low	34.6	Very low	171 Å²	171	139.5 Å²	139.5	91%	0.914	77%	0.77	S	S	*	*			trans	-141.7	147.1	164.6	-151.1	-10.2	0	0	0	110.3
1012	G	28.4	Very low	36	Very low	66 Å²	66	135.9 Å²	135.9	68%	0.68	75%	0.751	S	S	*	*			trans	-132.8	150.6	-153.4	0	0	0	0	0	116.4
1013	S	30.8	Very low	37.1	Very low	117 Å²	117	130.2 Å²	130.2	82%	0.818	72%	0.724	S	S	*	*			trans	-146	142	160.8	47	0	0	0	0	110.4
1014	P	29.2	Very low	38.5	Very low	130 Å²	130	129.6 Å²	129.6	84%	0.844	72%	0.722	S	S	*	*			trans	-86.8	137.3	-165.3	32.8	-35	0	0	0	113.2
1015	S	31	Very low	40.1	Very low	108 Å²	108	125.1 Å²	125.1	76%	0.755	70%	0.699	S	S	*	*			trans	-87.7	134.5	162.2	-65.7	0	0	0	0	109.8	L1017	S1015-L1017 PolarHBondContact O-N 3.07Å; S1015-L1017 VanDerWaalsContact O-N 3.11Å
1016	P	31.5	Very low	41.6	Very low	126 Å²	126	119 Å²	119	82%	0.818	67%	0.667	S	S	*	*			trans	-75.5	99.7	177	30	-33.1	0	0	0	110.5	M1018	P1016-M1018 PolarHBondContact O-N 2.94Å
1017	L	32.8	Very low	42.8	Very low	144 Å²	144	114.6 Å²	114.6	75%	0.754	64%	0.643	S	S	*	*			trans	-69.6	122	165.9	-89.5	160.6	0	0	0	109.4	S1015	S1015-L1017 PolarHBondContact O-N 3.07Å; S1015-L1017 VanDerWaalsContact O-N 3.11Å
1018	M	46.2	Very low	44.2	Very low	145 Å²	145	111.6 Å²	111.6	71%	0.714	63%	0.63	S	S	*	*			trans	-89.3	113.5	166.1	-73.7	-81.8	-84.2	0	0	108	P1016 F1020	P1016-M1018 PolarHBondContact O-N 2.94Å; M1018-F1020 HydrophobicContact CB-CE2 4.18Å; M1018-F1020 HydrophobicContact CB-CZ 4.36Å; M1018-F1020 WeakPolarHBondContact O-CD2 3.08Å; M1018-F1020 PolarHBondContact O-N 2.67Å
1019	D	45.4	Very low	45.5	Very low	145 Å²	145	105.2 Å²	105.2	78%	0.775	61%	0.605	S	S	*	*			trans	-69.3	109	174	-71.2	-28.7	0	0	0	109.9	P1021	D1019-P1021 WeakPolarHBondContact O-CD 3.4Å
1020	F	51.4	Low	46.4	Very low	76 Å²	76	97.8 Å²	97.8	33%	0.333	57%	0.572	S	S	.	*			trans	-85.7	110.2	170.2	-67.4	-79.3	0	0	0	109.3	M1018 N1022 L1026 S1029	M1018-F1020 HydrophobicContact CB-CE2 4.18Å; M1018-F1020 HydrophobicContact CB-CZ 4.36Å; M1018-F1020 WeakPolarHBondContact O-CD2 3.08Å; M1018-F1020 PolarHBondContact O-N 2.67Å; F1020-N1022 VanDerWaalsContact C-N 3.28Å; F1020-N1022 PolarHBondContact O-N 2.96Å; F1020-L1026 HydrophobicContact CB-CB 4.34Å; F1020-L1026 HydrophobicContact CD2-CD1 3.9Å; F1020-L1026 HydrophobicContact CE2-CD1 4.12Å; F1020-L1026 HydrophobicContact CG-CB 4.39Å; F1020-L1026 HydrophobicContact CG-CD1 4.12Å; F1020-S1029 WeakPolarHBondContact CE1-OG 3.33Å
1021	P	54.1	Low	47.5	Very low	113 Å²	113	92 Å²	92	73%	0.734	55%	0.55	S	S	*	.			trans	-78.3	-10.1	-167.1	31.1	-34.1	0	0	0	113.7	D1019 D1025	D1019-P1021 WeakPolarHBondContact O-CD 3.4Å; P1021-D1025 WeakPolarHBondContact CD-OD2 3.41Å; P1021-D1025 VanDerWaalsContact CG-OD2 3.28Å; P1021-D1025 WeakPolarHBondContact CG-OD2 3.48Å
1022	N	61.3	Low	48.2	Very low	62 Å²	62	89.4 Å²	89.4	33%	0.332	53%	0.532	S	S	.	.	S	Bend	trans	-150.6	171	167.3	77.6	70.6	0	0	0	112.2	F1020 D1024 D1025 L1026	F1020-N1022 VanDerWaalsContact C-N 3.28Å; F1020-N1022 PolarHBondContact O-N 2.96Å; N1022-D1024 VanDerWaalsContact OD1-CA 3.3Å; N1022-D1024 WeakPolarHBondContact OD1-CA 3.12Å; N1022-D1024 VanDerWaalsContact OD1-CB 3.27Å; N1022-D1024 WeakPolarHBondContact OD1-CB 3.47Å; N1022-D1024 PolarHBondContact OD1-N 3.13Å; N1022-D1025 PolarHBondContact ND2-OD1 3.32Å; N1022-D1025 PolarHBondContact ND2-OD2 3.05Å; N1022-D1025 PolarHBondContact OD1-N 3.36Å; N1022-L1026 PolarHBondContact O-N 2.98Å
1023	H	54	Low	49.1	Very low	39 Å²	39	88 Å²	88	18%	0.181	51%	0.514	C	S	.	.	H	α-helix	trans	-77.9	-23.5	-175.4	-161.7	-45.6	0	0	0	113.4	L1027	H1023-L1027 WeakPolarHBondContact O-CB 3.22Å; H1023-L1027 PolarHBondContact O-N 3.26Å
1024	D	62.1	Low	49.9	Very low	124 Å²	124	84 Å²	84	66%	0.663	49%	0.486	S	S	*	.	H	α-helix	trans	-73.7	-36	173.5	-57.8	-43.2	0	0	0	110.7	N1022 L1027 A1028	N1022-D1024 VanDerWaalsContact OD1-CA 3.3Å; N1022-D1024 WeakPolarHBondContact OD1-CA 3.12Å; N1022-D1024 VanDerWaalsContact OD1-CB 3.27Å; N1022-D1024 WeakPolarHBondContact OD1-CB 3.47Å; N1022-D1024 PolarHBondContact OD1-N 3.13Å; D1024-L1027 PolarHBondContact O-N 3.22Å; D1024-A1028 VanDerWaalsContact O-CB 3.27Å; D1024-A1028 WeakPolarHBondContact O-CB 3.29Å; D1024-A1028 PolarHBondContact O-N 2.92Å
1025	D	62.9	Low	50.6	Low	61 Å²	61	83.8 Å²	83.8	33%	0.326	48%	0.478	S	S	.	.	H	α-helix	trans	-65.3	-38.5	173.9	-63.6	-7.4	0	0	0	111.7	P1021 N1022 S1029	P1021-D1025 WeakPolarHBondContact CD-OD2 3.41Å; P1021-D1025 VanDerWaalsContact CG-OD2 3.28Å; P1021-D1025 WeakPolarHBondContact CG-OD2 3.48Å; N1022-D1025 PolarHBondContact ND2-OD1 3.32Å; N1022-D1025 PolarHBondContact ND2-OD2 3.05Å; N1022-D1025 PolarHBondContact OD1-N 3.36Å; D1025-S1029 VanDerWaalsContact O-CB 3.3Å; D1025-S1029 WeakPolarHBondContact O-CB 3.4Å; D1025-S1029 PolarHBondContact O-N 2.96Å; D1025-S1029 PolarHBondContact O-OG 3.07Å
1026	L	62	Low	51	Low	20 Å²	20	85.3 Å²	85.3	11%	0.105	47%	0.472	C	S	.	.	H	α-helix	trans	-63.8	-45.7	172.6	179.2	67.5	0	0	0	110.9	F1020 N1022 S1029 L1030 P1060 A1063	F1020-L1026 HydrophobicContact CB-CB 4.34Å; F1020-L1026 HydrophobicContact CD2-CD1 3.9Å; F1020-L1026 HydrophobicContact CE2-CD1 4.12Å; F1020-L1026 HydrophobicContact CG-CB 4.39Å; F1020-L1026 HydrophobicContact CG-CD1 4.12Å; N1022-L1026 PolarHBondContact O-N 2.98Å; L1026-S1029 PolarHBondContact O-N 3.28Å; L1026-L1030 HydrophobicContact CD1-CD1 4.21Å; L1026-L1030 HydrophobicContact CG-CD1 3.98Å; L1026-L1030 WeakPolarHBondContact O-CB 3.29Å; L1026-L1030 VanDerWaalsContact O-CG 3.27Å; L1026-L1030 WeakPolarHBondContact O-CG 3.43Å; L1026-L1030 PolarHBondContact O-N 3.02Å; L1026-P1060 HydrophobicContact CD2-CB 4.27Å; L1026-A1063 HydrophobicContact CD2-CB 4.39Å
1027	L	58.1	Low	51	Low	71 Å²	71	89 Å²	89	37%	0.372	47%	0.47	S	S	.	.	H	α-helix	trans	-66	-41.5	177.3	-83.6	164.4	0	0	0	112.2	H1023 D1024 L1030 V1031	H1023-L1027 WeakPolarHBondContact O-CB 3.22Å; H1023-L1027 PolarHBondContact O-N 3.26Å; D1024-L1027 PolarHBondContact O-N 3.22Å; L1027-L1030 PolarHBondContact O-N 3.42Å; L1027-V1031 WeakPolarHBondContact O-CB 3.46Å; L1027-V1031 VanDerWaalsContact O-CG2 3.31Å; L1027-V1031 WeakPolarHBondContact O-CG2 3.27Å; L1027-V1031 PolarHBondContact O-N 2.68Å
1028	A	59.2	Low	51.2	Low	53 Å²	53	88.6 Å²	88.6	44%	0.438	47%	0.468	S	S	.	.	H	α-helix	trans	-61.1	-47.3	174.7	0	0	0	0	0	110.7	D1024 L1030 V1031 E1032	D1024-A1028 VanDerWaalsContact O-CB 3.27Å; D1024-A1028 WeakPolarHBondContact O-CB 3.29Å; D1024-A1028 PolarHBondContact O-N 2.92Å; A1028-L1030 VanDerWaalsContact C-N 3.32Å; A1028-L1030 PolarHBondContact O-N 3.05Å; A1028-V1031 PolarHBondContact O-N 3.12Å; A1028-E1032 VanDerWaalsContact O-CB 3.22Å; A1028-E1032 WeakPolarHBondContact O-CB 3.33Å; A1028-E1032 PolarHBondContact O-N 3.39Å
1029	S	58.7	Low	50.6	Low	47 Å²	47	85.2 Å²	85.2	33%	0.329	45%	0.452	S	S	.	.	H	α-helix	trans	-65.2	-33.4	177.7	-55.7	0	0	0	0	112.8	F1020 D1025 L1026 A1033	F1020-S1029 WeakPolarHBondContact CE1-OG 3.33Å; D1025-S1029 VanDerWaalsContact O-CB 3.3Å; D1025-S1029 WeakPolarHBondContact O-CB 3.4Å; D1025-S1029 PolarHBondContact O-N 2.96Å; D1025-S1029 PolarHBondContact O-OG 3.07Å; L1026-S1029 PolarHBondContact O-N 3.28Å; S1029-A1033 WeakPolarHBondContact O-CB 3.18Å; S1029-A1033 PolarHBondContact O-N 2.84Å
1030	L	51.7	Low	50.4	Low	41 Å²	41	82.9 Å²	82.9	22%	0.215	44%	0.44	C	S	.	.	H	α-helix	trans	-71.8	-39.5	174.3	-76.9	166	0	0	0	112.3	L1026 L1027 A1028 A1033 C1034 L1044	L1026-L1030 HydrophobicContact CD1-CD1 4.21Å; L1026-L1030 HydrophobicContact CG-CD1 3.98Å; L1026-L1030 WeakPolarHBondContact O-CB 3.29Å; L1026-L1030 VanDerWaalsContact O-CG 3.27Å; L1026-L1030 WeakPolarHBondContact O-CG 3.43Å; L1026-L1030 PolarHBondContact O-N 3.02Å; L1027-L1030 PolarHBondContact O-N 3.42Å; A1028-L1030 VanDerWaalsContact C-N 3.32Å; A1028-L1030 PolarHBondContact O-N 3.05Å; L1030-A1033 PolarHBondContact O-N 3.1Å; L1030-C1034 PolarHBondContact O-N 3.11Å; L1030-C1034 PolarHBondContact O-SG 2.81Å; L1030-L1044 HydrophobicContact CD1-CD2 4.1Å
1031	V	54.2	Low	49.7	Very low	73 Å²	73	83.1 Å²	83.1	44%	0.442	45%	0.449	S	S	.	.	H	α-helix	trans	-68.5	-45.7	175	170.1	0	0	0	0	110.6	L1027 A1028 A1033 C1034 D1035	L1027-V1031 WeakPolarHBondContact O-CB 3.46Å; L1027-V1031 VanDerWaalsContact O-CG2 3.31Å; L1027-V1031 WeakPolarHBondContact O-CG2 3.27Å; L1027-V1031 PolarHBondContact O-N 2.68Å; A1028-V1031 PolarHBondContact O-N 3.12Å; V1031-A1033 VanDerWaalsContact C-N 3.28Å; V1031-A1033 PolarHBondContact O-N 3.38Å; V1031-C1034 WeakPolarHBondContact O-CA 3.29Å; V1031-C1034 WeakPolarHBondContact O-CB 3.48Å; V1031-C1034 PolarHBondContact O-N 3.48Å; V1031-D1035 PolarHBondContact O-N 2.96Å
1032	E	48.3	Very low	49	Very low	117 Å²	117	81 Å²	81	55%	0.547	44%	0.441	S	S	.	.	H	α-helix	trans	-62.5	-33.9	174.8	-171	173.6	171.5	0	0	111.6	A1028 H1036	A1028-E1032 VanDerWaalsContact O-CB 3.22Å; A1028-E1032 WeakPolarHBondContact O-CB 3.33Å; A1028-E1032 PolarHBondContact O-N 3.39Å; E1032-H1036 VanDerWaalsContact O-CB 3.29Å; E1032-H1036 WeakPolarHBondContact O-CB 3.25Å; E1032-H1036 PolarHBondContact O-CD2 3.04Å; E1032-H1036 PolarHBondContact O-N 3.11Å; E1032-H1036 VanDerWaalsContact O-N 3.16Å
1033	A	46.4	Very low	48.1	Very low	37 Å²	37	82.3 Å²	82.3	31%	0.306	44%	0.444	S	S	.	.	H	α-helix	trans	-69	-37.5	170.1	0	0	0	0	0	113	S1029 L1030 V1031 H1036 R1037 L1039	S1029-A1033 WeakPolarHBondContact O-CB 3.18Å; S1029-A1033 PolarHBondContact O-N 2.84Å; L1030-A1033 PolarHBondContact O-N 3.1Å; V1031-A1033 VanDerWaalsContact C-N 3.28Å; V1031-A1033 PolarHBondContact O-N 3.38Å; A1033-H1036 PolarHBondContact O-N 3.47Å; A1033-R1037 CarbonylContact O-C 3.51Å; A1033-R1037 PolarHBondContact O-N 2.8Å; A1033-L1039 HydrophobicContact CB-CD1 4.48Å
1034	C	47	Very low	47.6	Very low	32 Å²	32	82.7 Å²	82.7	22%	0.216	45%	0.447	C	S	.	.	H	α-helix	trans	-67.4	-44	174.2	-65.9	0	0	0	0	111.7	L1030 V1031 H1036	L1030-C1034 PolarHBondContact O-N 3.11Å; L1030-C1034 PolarHBondContact O-SG 2.81Å; V1031-C1034 WeakPolarHBondContact O-CA 3.29Å; V1031-C1034 WeakPolarHBondContact O-CB 3.48Å; V1031-C1034 PolarHBondContact O-N 3.48Å; C1034-H1036 PolarHBondContact O-N 3.45Å
1035	D	43.5	Very low	46.5	Very low	126 Å²	126	84.4 Å²	84.4	67%	0.674	44%	0.444	S	S	*	.	H	α-helix	trans	-69.9	-11.6	178.3	-76.4	-17.7	0	0	0	113.2	V1031	V1031-D1035 PolarHBondContact O-N 2.96Å
1036	H	41	Very low	45.3	Very low	140 Å²	140	82.4 Å²	82.4	65%	0.648	44%	0.438	S	S	*	.	H	α-helix	trans	-120.5	-30	-179.5	-68.7	-25.5	0	0	0	116.1	E1032 A1033 C1034	E1032-H1036 VanDerWaalsContact O-CB 3.29Å; E1032-H1036 WeakPolarHBondContact O-CB 3.25Å; E1032-H1036 PolarHBondContact O-CD2 3.04Å; E1032-H1036 PolarHBondContact O-N 3.11Å; E1032-H1036 VanDerWaalsContact O-N 3.16Å; A1033-H1036 PolarHBondContact O-N 3.47Å; C1034-H1036 PolarHBondContact O-N 3.45Å
1037	R	31.5	Very low	44.2	Very low	204 Å²	204	90.9 Å²	90.9	77%	0.77	48%	0.48	S	S	*	.	S	Bend	trans	-153.5	107.3	-178.6	-66.6	-168.3	178.3	174.1	2.5	115.7	A1033 L1039	A1033-R1037 CarbonylContact O-C 3.51Å; A1033-R1037 PolarHBondContact O-N 2.8Å; R1037-L1039 PolarHBondContact O-N 3.26Å
1038	L	35.4	Very low	43.4	Very low	134 Å²	134	93.6 Å²	93.6	70%	0.702	49%	0.491	S	S	*	.	S	Bend	trans	59.6	7.1	145.1	-64.7	171.2	0	0	0	118.9	V775	V775-L1038 HydrophobicContact CG2-CD2 3.88Å
1039	L	35.3	Very low	42.5	Very low	75 Å²	75	93.5 Å²	93.5	39%	0.393	49%	0.486	S	S	.	.			trans	-98.8	118.2	177.7	-88.2	160.8	0	0	0	111.5	A1033 R1037 P1041	A1033-L1039 HydrophobicContact CB-CD1 4.48Å; R1037-L1039 PolarHBondContact O-N 3.26Å; L1039-P1041 WeakPolarHBondContact O-CD 3.48Å
1040	N	40	Very low	42	Very low	95 Å²	95	98.1 Å²	98.1	51%	0.508	50%	0.502	S	S	.	.			trans	-65	124.3	176.4	-179	-19.8	0	0	0	110.1	A1042 F1043	N1040-A1042 PolarHBondContact O-N 2.76Å; N1040-A1042 VanDerWaalsContact OD1-CB 3.27Å; N1040-A1042 WeakPolarHBondContact OD1-CB 3.37Å; N1040-A1042 PolarHBondContact OD1-N 2.88Å; N1040-F1043 WeakPolarHBondContact O-CB 3.41Å; N1040-F1043 PolarHBondContact O-N 3.33Å
1041	P	36.6	Very low	41.6	Very low	81 Å²	81	99 Å²	99	53%	0.526	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-55.5	-27.5	178.5	-28.5	36.5	0	0	0	114.6	L1039 F1043 L1044	L1039-P1041 WeakPolarHBondContact O-CD 3.48Å; P1041-F1043 PolarHBondContact O-N 3.46Å; P1041-L1044 PolarHBondContact O-N 3.4Å; P1041-L1044 VanDerWaalsContact O-N 3.1Å
1042	A	40.1	Very low	41.1	Very low	68 Å²	68	99 Å²	99	56%	0.562	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-63	-8.5	175.2	0	0	0	0	0	114.1	N1040 W1045	N1040-A1042 PolarHBondContact O-N 2.76Å; N1040-A1042 VanDerWaalsContact OD1-CB 3.27Å; N1040-A1042 WeakPolarHBondContact OD1-CB 3.37Å; N1040-A1042 PolarHBondContact OD1-N 2.88Å; A1042-W1045 VanDerWaalsContact O-O 3.12Å
1043	F	42	Very low	41.1	Very low	90 Å²	90	98 Å²	98	40%	0.395	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-77.7	-19	174.4	-146.3	-91.3	0	0	0	113	N1040 P1041 L1067 L1071	N1040-F1043 WeakPolarHBondContact O-CB 3.41Å; N1040-F1043 PolarHBondContact O-N 3.33Å; P1041-F1043 PolarHBondContact O-N 3.46Å; F1043-L1067 HydrophobicContact CD1-CD1 4.16Å; F1043-L1067 HydrophobicContact CE1-CD1 3.97Å; F1043-L1067 HydrophobicContact CE1-CG 4.5Å; F1043-L1071 HydrophobicContact CE1-CD1 4.45Å; F1043-L1071 HydrophobicContact CE1-CD2 4.43Å; F1043-L1071 HydrophobicContact CE2-CD2 4.29Å; F1043-L1071 HydrophobicContact CZ-CD1 4.18Å; F1043-L1071 HydrophobicContact CZ-CD2 3.63Å; F1043-L1071 HydrophobicContact CZ-CG 4.43Å
1044	L	42.9	Very low	41.1	Very low	48 Å²	48	98.1 Å²	98.1	25%	0.251	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-19.5	179	-68.7	170.3	0	0	0	113.4	L1030 P1041	L1030-L1044 HydrophobicContact CD1-CD2 4.1Å; P1041-L1044 PolarHBondContact O-N 3.4Å; P1041-L1044 VanDerWaalsContact O-N 3.1Å
1045	W	40.3	Very low	41.3	Very low	159 Å²	159	99.5 Å²	99.5	60%	0.602	51%	0.51	S	S	*	.	B	Isolated β-bridge	trans	-107.2	134.9	-177.2	-62.8	76.8	0	0	0	109.6	A1042	A1042-W1045 VanDerWaalsContact O-O 3.12Å
1046	G	36.8	Very low	41.8	Very low	20 Å²	20	98.1 Å²	98.1	21%	0.206	52%	0.517	C	S	.	.			trans	-64.9	170.3	173.8	0	0	0	0	0	111.9	E1048 S1051	G1046-E1048 PolarHBondContact O-N 3.17Å; G1046-S1051 PolarHBondContact N-O 2.71Å
1047	M	38.4	Very low	42.4	Very low	198 Å²	198	98.7 Å²	98.7	98%	0.975	52%	0.524	S	S	*	.	S	Bend	trans	-61	-4.6	172.1	-76.3	-164.9	69.6	0	0	114.3
1048	E	41.4	Very low	43.6	Very low	128 Å²	128	89.9 Å²	89.9	60%	0.598	49%	0.493	S	S	*	.	S	Bend	trans	-113.9	126.1	171.7	-63.7	-176.6	156.9	0	0	109.7	G1046 H1050 S1051	G1046-E1048 PolarHBondContact O-N 3.17Å; E1048-H1050 PolarHBondContact O-N 3.2Å; E1048-S1051 PolarHBondContact O-N 3.18Å; E1048-S1051 VanDerWaalsContact O-N 3.11Å
1049	P	41.1	Very low	44.9	Very low	51 Å²	51	85.9 Å²	85.9	33%	0.331	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	9.7	173.8	-25.4	35.8	0	0	0	116.1	S506	S506-P1049 VanDerWaalsContact O-CD 3.25Å; S506-P1049 WeakPolarHBondContact O-CD 3.41Å; S506-P1049 WeakPolarHBondContact O-CG 3.38Å
1050	H	48.1	Very low	45.6	Very low	144 Å²	144	84.1 Å²	84.1	67%	0.667	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.7	2.1	-175.5	-58.9	-18.8	0	0	0	112.5	S506 E1048	S506-H1050 PolarHBondContact OG-NE2 2.9Å; E1048-H1050 PolarHBondContact O-N 3.2Å
1051	S	43.2	Very low	46.5	Very low	58 Å²	58	86.6 Å²	86.6	41%	0.406	48%	0.481	S	S	.	.			trans	-132	99.3	-179.1	-167.9	0	0	0	0	110.7	G1046 E1048	G1046-S1051 PolarHBondContact N-O 2.71Å; E1048-S1051 PolarHBondContact O-N 3.18Å; E1048-S1051 VanDerWaalsContact O-N 3.11Å
1052	P	44	Very low	47.5	Very low	73 Å²	73	87.1 Å²	87.1	47%	0.474	48%	0.477	S	S	.	.	B	Isolated β-bridge	trans	-68.1	146.4	169.2	30.1	-33.8	0	0	0	109.7	L1054	P1052-L1054 PolarHBondContact O-N 3.23Å
1053	F	48.5	Very low	48.2	Very low	97 Å²	97	84.1 Å²	84.1	43%	0.425	45%	0.452	S	S	.	.	S	Bend	trans	-59.7	-21.3	176.4	-97.8	-75.5	0	0	0	113.3	V1070	F1053-V1070 HydrophobicContact CE1-CG1 4.1Å; F1053-V1070 HydrophobicContact CE1-CG2 4.14Å; F1053-V1070 HydrophobicContact CZ-CG1 4.33Å
1054	L	46.5	Very low	48.8	Very low	39 Å²	39	83.9 Å²	83.9	20%	0.204	45%	0.454	C	S	.	.	S	Bend	trans	-120.1	107.4	-178.7	-59.1	-179.6	0	0	0	111.1	P1052 A1063	P1052-L1054 PolarHBondContact O-N 3.23Å; L1054-A1063 HydrophobicContact CD1-CB 3.98Å; L1054-A1063 HydrophobicContact CD2-CB 3.44Å; L1054-A1063 VanDerWaalsContact CD2-CB 3.44Å; L1054-A1063 HydrophobicContact CG-CB 4.34Å
1055	P	50.7	Low	49.7	Very low	61 Å²	61	86.5 Å²	86.5	40%	0.396	47%	0.468	S	S	.	.			trans	-63.7	143	160.8	-17	30.6	0	0	0	109.9	N1057 V1058	P1055-N1057 PolarHBondContact O-N 3.06Å; P1055-V1058 HydrophobicContact CB-CG2 4.38Å; P1055-V1058 HydrophobicContact CG-CG2 4.34Å; P1055-V1058 PolarHBondContact O-N 2.92Å
1056	A	53.4	Low	50.1	Low	98 Å²	98	84.3 Å²	84.3	81%	0.81	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	27.2	179.4	0	0	0	0	0	114.9
1057	N	55.2	Low	50.5	Low	151 Å²	151	86.1 Å²	86.1	81%	0.807	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.4	-5	-170.5	-53.7	47.7	0	0	0	111.6	P1055	P1055-N1057 PolarHBondContact O-N 3.06Å
1058	V	56.6	Low	51.1	Low	19 Å²	19	81.2 Å²	81.2	12%	0.115	44%	0.44	C	S	.	.	S	Bend	trans	-103.1	139.7	-170.5	-176.3	0	0	0	0	109.6	P1055 E1062 A1063	P1055-V1058 HydrophobicContact CB-CG2 4.38Å; P1055-V1058 HydrophobicContact CG-CG2 4.34Å; P1055-V1058 PolarHBondContact O-N 2.92Å; V1058-E1062 HydrophobicContact CG1-CB 3.75Å; V1058-E1062 HydrophobicContact CG1-CG 4.09Å; V1058-A1063 HydrophobicContact CG1-CB 4.35Å
1059	A	62.2	Low	51.5	Low	51 Å²	51	79.4 Å²	79.4	42%	0.421	44%	0.438	S	S	.	.			trans	-69.7	148.3	176.3	0	0	0	0	0	111.1	E1061 E1062 A1063	A1059-E1061 PolarHBondContact O-N 2.92Å; A1059-E1061 VanDerWaalsContact O-N 3.16Å; A1059-E1062 PolarHBondContact O-N 3.29Å; A1059-A1063 PolarHBondContact O-N 3.25Å
1060	P	49.8	Very low	51.8	Low	38 Å²	38	81.1 Å²	81.1	25%	0.247	45%	0.447	C	S	.	.	H	α-helix	trans	-53.3	-38	-179.9	-29.1	36.7	0	0	0	114.1	L1026 A1063 L1064	L1026-P1060 HydrophobicContact CD2-CB 4.27Å; P1060-A1063 WeakPolarHBondContact O-CB 3.41Å; P1060-A1063 PolarHBondContact O-N 3.25Å; P1060-L1064 WeakPolarHBondContact O-CB 3.46Å; P1060-L1064 PolarHBondContact O-N 3.25Å
1061	E	57.9	Low	51.4	Low	146 Å²	146	78.9 Å²	78.9	68%	0.682	44%	0.44	S	S	*	.	H	α-helix	trans	-63.2	-41.6	174.8	-59.1	173.9	159.1	0	0	112.4	A1059 L1064 N1065	A1059-E1061 PolarHBondContact O-N 2.92Å; A1059-E1061 VanDerWaalsContact O-N 3.16Å; E1061-L1064 PolarHBondContact O-N 3.26Å; E1061-N1065 WeakPolarHBondContact O-CB 3.31Å; E1061-N1065 PolarHBondContact O-N 3.29Å; E1061-N1065 PolarHBondContact O-ND2 3.39Å
1062	E	57.7	Low	51.1	Low	93 Å²	93	82.3 Å²	82.3	44%	0.435	45%	0.45	S	S	.	.	H	α-helix	trans	-78.4	-30.7	179.4	-165.3	-175	153.5	0	0	111.4	V1058 A1059 L1064 N1065 R1066	V1058-E1062 HydrophobicContact CG1-CB 3.75Å; V1058-E1062 HydrophobicContact CG1-CG 4.09Å; A1059-E1062 PolarHBondContact O-N 3.29Å; E1062-L1064 VanDerWaalsContact C-N 3.35Å; E1062-N1065 PolarHBondContact O-N 2.96Å; E1062-R1066 HydrophobicContact CG-CG 4.43Å; E1062-R1066 VanDerWaalsContact O-CB 3.27Å; E1062-R1066 WeakPolarHBondContact O-CB 3.46Å; E1062-R1066 WeakPolarHBondContact O-CD 3.27Å; E1062-R1066 WeakPolarHBondContact O-CG 3.22Å; E1062-R1066 PolarHBondContact O-N 3.3Å; E1062-R1066 IonicContact OE1-CZ 3.13Å; E1062-R1066 IonicContact OE1-NE 2.68Å; E1062-R1066 PolarHBondContact OE1-NE 3.41Å; E1062-R1066 IonicContact OE1-NH2 3.26Å; E1062-R1066 PolarHBondContact OE1-NH2 3.42Å
1063	A	54.8	Low	50.6	Low	4 Å²	4	86.9 Å²	86.9	3%	0.033	47%	0.465	C	S	.	.	H	α-helix	trans	-58.5	-47.1	168.4	0	0	0	0	0	111	L1026 L1054 V1058 A1059 P1060 R1066 L1067	L1026-A1063 HydrophobicContact CD2-CB 4.39Å; L1054-A1063 HydrophobicContact CD1-CB 3.98Å; L1054-A1063 HydrophobicContact CD2-CB 3.44Å; L1054-A1063 VanDerWaalsContact CD2-CB 3.44Å; L1054-A1063 HydrophobicContact CG-CB 4.34Å; V1058-A1063 HydrophobicContact CG1-CB 4.35Å; A1059-A1063 PolarHBondContact O-N 3.25Å; P1060-A1063 WeakPolarHBondContact O-CB 3.41Å; P1060-A1063 PolarHBondContact O-N 3.25Å; A1063-R1066 PolarHBondContact O-N 3.45Å; A1063-L1067 PolarHBondContact O-N 3.46Å
1064	L	56.4	Low	49.8	Very low	86 Å²	86	87.5 Å²	87.5	45%	0.45	48%	0.481	S	S	.	.	H	α-helix	trans	-66.9	-43.7	176.7	-173.6	62.9	0	0	0	112.3	P1060 E1061 E1062 R1066 L1067 M1068	P1060-L1064 WeakPolarHBondContact O-CB 3.46Å; P1060-L1064 PolarHBondContact O-N 3.25Å; E1061-L1064 PolarHBondContact O-N 3.26Å; E1062-L1064 VanDerWaalsContact C-N 3.35Å; L1064-R1066 VanDerWaalsContact C-N 3.31Å; L1064-R1066 PolarHBondContact O-N 3.22Å; L1064-L1067 HydrophobicContact CD1-CD2 4.42Å; L1064-L1067 WeakPolarHBondContact O-CB 3.33Å; L1064-L1067 PolarHBondContact O-N 2.82Å; L1064-M1068 WeakPolarHBondContact O-CG 3.15Å; L1064-M1068 PolarHBondContact O-N 3.39Å
1065	N	60.4	Low	49	Very low	103 Å²	103	95.1 Å²	95.1	55%	0.551	51%	0.512	S	S	*	.	H	α-helix	trans	-65.3	-32.6	176.5	-78.1	-59.7	0	0	0	112.9	E1061 E1062 M1068 T1069	E1061-N1065 WeakPolarHBondContact O-CB 3.31Å; E1061-N1065 PolarHBondContact O-N 3.29Å; E1061-N1065 PolarHBondContact O-ND2 3.39Å; E1062-N1065 PolarHBondContact O-N 2.96Å; N1065-M1068 PolarHBondContact O-N 2.94Å; N1065-T1069 PolarHBondContact O-N 3.19Å; N1065-T1069 PolarHBondContact O-OG1 3.16Å
1066	R	49.9	Very low	48.2	Very low	113 Å²	113	98 Å²	98	43%	0.426	53%	0.531	S	S	.	.	H	α-helix	trans	-69.4	-38.4	171.7	-74.3	167.6	179.6	-131.6	5.4	111.9	E1062 A1063 L1064 T1069 V1070	E1062-R1066 HydrophobicContact CG-CG 4.43Å; E1062-R1066 VanDerWaalsContact O-CB 3.27Å; E1062-R1066 WeakPolarHBondContact O-CB 3.46Å; E1062-R1066 WeakPolarHBondContact O-CD 3.27Å; E1062-R1066 WeakPolarHBondContact O-CG 3.22Å; E1062-R1066 PolarHBondContact O-N 3.3Å; E1062-R1066 IonicContact OE1-CZ 3.13Å; E1062-R1066 IonicContact OE1-NE 2.68Å; E1062-R1066 PolarHBondContact OE1-NE 3.41Å; E1062-R1066 IonicContact OE1-NH2 3.26Å; E1062-R1066 PolarHBondContact OE1-NH2 3.42Å; A1063-R1066 PolarHBondContact O-N 3.45Å; L1064-R1066 VanDerWaalsContact C-N 3.31Å; L1064-R1066 PolarHBondContact O-N 3.22Å; R1066-T1069 WeakPolarHBondContact CA-OG1 3.34Å; R1066-T1069 PolarHBondContact O-N 3.21Å; R1066-T1069 PolarHBondContact O-OG1 2.84Å; R1066-V1070 VanDerWaalsContact O-CG2 3.29Å; R1066-V1070 WeakPolarHBondContact O-CG2 3.27Å; R1066-V1070 PolarHBondContact O-N 3.21Å
1067	L	45.4	Very low	47.2	Very low	57 Å²	57	99.4 Å²	99.4	30%	0.298	53%	0.532	S	S	.	.	H	α-helix	trans	-59.3	-47.1	171.9	-168.9	73.2	0	0	0	110.8	F1043 A1063 L1064 V1070 L1071	F1043-L1067 HydrophobicContact CD1-CD1 4.16Å; F1043-L1067 HydrophobicContact CE1-CD1 3.97Å; F1043-L1067 HydrophobicContact CE1-CG 4.5Å; A1063-L1067 PolarHBondContact O-N 3.46Å; L1064-L1067 HydrophobicContact CD1-CD2 4.42Å; L1064-L1067 WeakPolarHBondContact O-CB 3.33Å; L1064-L1067 PolarHBondContact O-N 2.82Å; L1067-V1070 PolarHBondContact O-N 3.09Å; L1067-L1071 WeakPolarHBondContact O-CG 3.46Å; L1067-L1071 PolarHBondContact O-N 3.21Å
1068	M	49.3	Very low	46	Very low	95 Å²	95	99 Å²	99	47%	0.468	54%	0.535	S	S	.	.	H	α-helix	trans	-65.9	-42.4	178.7	-65.5	-56.1	-61.8	0	0	112.9	L1064 N1065 V1070 L1071 E1072	L1064-M1068 WeakPolarHBondContact O-CG 3.15Å; L1064-M1068 PolarHBondContact O-N 3.39Å; N1065-M1068 PolarHBondContact O-N 2.94Å; M1068-V1070 VanDerWaalsContact C-N 3.3Å; M1068-V1070 PolarHBondContact O-N 2.97Å; M1068-L1071 WeakPolarHBondContact O-CA 3.41Å; M1068-L1071 WeakPolarHBondContact O-CB 3.49Å; M1068-L1071 PolarHBondContact O-N 3.44Å; M1068-L1071 HydrophobicContact SD-CD1 4.44Å; M1068-E1072 PolarHBondContact O-N 2.84Å
1069	T	51	Low	44.9	Very low	91 Å²	91	103.5 Å²	103.5	56%	0.558	57%	0.568	S	S	*	*	H	α-helix	trans	-72.3	-18.9	178.4	42.4	0	0	0	0	114.1	N1065 R1066 L1071	N1065-T1069 PolarHBondContact O-N 3.19Å; N1065-T1069 PolarHBondContact O-OG1 3.16Å; R1066-T1069 WeakPolarHBondContact CA-OG1 3.34Å; R1066-T1069 PolarHBondContact O-N 3.21Å; R1066-T1069 PolarHBondContact O-OG1 2.84Å; T1069-L1071 VanDerWaalsContact C-N 3.31Å
1070	V	46	Very low	43.4	Very low	86 Å²	86	108.9 Å²	108.9	52%	0.521	59%	0.588	S	S	.	*	H	α-helix	trans	-74.9	-22.6	167.2	167.9	0	0	0	0	111.9	F1053 R1066 L1067 M1068	F1053-V1070 HydrophobicContact CE1-CG1 4.1Å; F1053-V1070 HydrophobicContact CE1-CG2 4.14Å; F1053-V1070 HydrophobicContact CZ-CG1 4.33Å; R1066-V1070 VanDerWaalsContact O-CG2 3.29Å; R1066-V1070 WeakPolarHBondContact O-CG2 3.27Å; R1066-V1070 PolarHBondContact O-N 3.21Å; L1067-V1070 PolarHBondContact O-N 3.09Å; M1068-V1070 VanDerWaalsContact C-N 3.3Å; M1068-V1070 PolarHBondContact O-N 2.97Å
1071	L	39.8	Very low	42.3	Very low	97 Å²	97	113.5 Å²	113.5	51%	0.508	61%	0.609	S	S	.	*	H	α-helix	trans	-86.6	-10	176.2	-63.8	166.6	0	0	0	113.4	F1043 L1067 M1068 T1069	F1043-L1071 HydrophobicContact CE1-CD1 4.45Å; F1043-L1071 HydrophobicContact CE1-CD2 4.43Å; F1043-L1071 HydrophobicContact CE2-CD2 4.29Å; F1043-L1071 HydrophobicContact CZ-CD1 4.18Å; F1043-L1071 HydrophobicContact CZ-CD2 3.63Å; F1043-L1071 HydrophobicContact CZ-CG 4.43Å; L1067-L1071 WeakPolarHBondContact O-CG 3.46Å; L1067-L1071 PolarHBondContact O-N 3.21Å; M1068-L1071 WeakPolarHBondContact O-CA 3.41Å; M1068-L1071 WeakPolarHBondContact O-CB 3.49Å; M1068-L1071 PolarHBondContact O-N 3.44Å; M1068-L1071 HydrophobicContact SD-CD1 4.44Å; T1069-L1071 VanDerWaalsContact C-N 3.31Å
1072	E	38.3	Very low	41.1	Very low	131 Å²	131	118 Å²	118	61%	0.612	62%	0.619	S	S	*	*	S	Bend	trans	-110.6	77	178.5	-66.2	-172.6	154.5	0	0	111.8	M1068 S1074	M1068-E1072 PolarHBondContact O-N 2.84Å; E1072-S1074 PolarHBondContact O-N 3.4Å; E1072-S1074 PolarHBondContact O-OG 3.47Å
1073	E	33.2	Very low	39.7	Very low	169 Å²	169	119.9 Å²	119.9	79%	0.79	63%	0.632	S	S	*	*			trans	-53.3	113.1	177.7	-78.2	-162.2	131.8	0	0	112.6
1074	S	30.5	Very low	38.7	Very low	109 Å²	109	125.6 Å²	125.6	76%	0.762	67%	0.672	S	S	*	*			trans	-128.1	105.4	178	46.8	0	0	0	0	113.2	E1072	E1072-S1074 PolarHBondContact O-N 3.4Å; E1072-S1074 PolarHBondContact O-OG 3.47Å
1075	K	30.8	Very low	37.4	Very low	199 Å²	199	128 Å²	128	87%	0.865	69%	0.686	S	S	*	*			trans	27.4	125	159.2	-65.4	175.2	-179.1	171.1	0	119.4
1076	P	33.3	Very low	36.1	Very low	123 Å²	123	131.3 Å²	131.3	80%	0.799	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-67.1	145.1	171.3	30.6	-35.4	0	0	0	112.3
1077	P	32.3	Very low	35.1	Very low	127 Å²	127	132.9 Å²	132.9	83%	0.825	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-77.4	138.7	-178.3	30.7	-34.9	0	0	0	112.8
1078	T	30	Very low	34.4	Very low	142 Å²	142	137.7 Å²	137.7	87%	0.871	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-71	127.6	174	33.7	0	0	0	0	111.7
1079	S	33.5	Very low	33.4	Very low	114 Å²	114	137.5 Å²	137.5	80%	0.797	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-90.1	142	174.9	60.1	0	0	0	0	111.6
1080	I	31.1	Very low	32.2	Very low	164 Å²	164	139.4 Å²	139.4	84%	0.841	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-82.6	130.2	-168.5	-63.8	174.9	0	0	0	111.5
1081	I	27.4	Very low	31.4	Very low	134 Å²	134	143.9 Å²	143.9	69%	0.687	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-68.5	137.4	175.1	-61.9	170.3	0	0	0	111.2	N1083	I1081-N1083 WeakPolarHBondContact CG2-OD1 3.4Å
1082	R	31.9	Very low	30.8	Very low	241 Å²	241	146.2 Å²	146.2	91%	0.909	80%	0.796	S	S	*	*			trans	-135.7	114.9	152.3	-84.8	-167.4	169.9	174.6	-1.4	110.8
1083	N	28	Very low	30.3	Very low	132 Å²	132	146.1 Å²	146.1	71%	0.706	80%	0.799	S	S	*	*			trans	-73.2	143.9	177.9	-61.6	-9.4	0	0	0	111.5	I1081	I1081-N1083 WeakPolarHBondContact CG2-OD1 3.4Å
1084	S	34.4	Very low	30	Very low	124 Å²	124	144.2 Å²	144.2	87%	0.867	80%	0.798	S	S	*	*			trans	-149.2	111.6	150.7	-77.8	0	0	0	0	107.4
1085	N	28.8	Very low	29.9	Very low	138 Å²	138	146.5 Å²	146.5	74%	0.738	80%	0.797	S	S	*	*			trans	-77	148.4	176.9	-56.8	-18.8	0	0	0	109.8
1086	D	33.2	Very low	29.8	Very low	172 Å²	172	144.9 Å²	144.9	92%	0.92	79%	0.792	S	S	*	*				-160	155.8	125.4	-104.8	-28.8	0	0	0	111.1
1087	I	28.2	Very low	29.5	Very low	145 Å²	145	146.3 Å²	146.3	74%	0.744	79%	0.791	S	S	*	*			trans	-118.7	142.3	-169.7	-62.8	165	0	0	0	108.6
1088	I	32.1	Very low	29.2	Very low	159 Å²	159	148.8 Å²	148.8	82%	0.815	79%	0.789	S	S	*	*			trans	-178.1	119.9	137.2	-93.8	151	0	0	0	112.5
1089	S	27	Very low	29.2	Very low	91 Å²	91	148.2 Å²	148.2	64%	0.636	79%	0.788	S	S	*	*			trans	21.5	127	145.5	-44.2	0	0	0	0	123.9
1090	T	26.8	Very low	29.2	Very low	130 Å²	130	148.3 Å²	148.3	80%	0.798	78%	0.784	S	S	*	*				57.4	110.4	129.6	61.5	0	0	0	0	121.4
1091	E	28.9	Very low	29.1	Very low	181 Å²	181	146.2 Å²	146.2	85%	0.846	78%	0.781	S	S	*	*				-161.5	157.1	121.3	-118.6	175.1	-152.7	0	0	111.6
1092	T	26.4	Very low	29.4	Very low	145 Å²	145	145.1 Å²	145.1	89%	0.89	78%	0.783	S	S	*	*			trans	-101.9	100.9	-172.2	-55.3	0	0	0	0	111.7
1093	I	29.3	Very low	29.5	Very low	130 Å²	130	139 Å²	139	67%	0.667	77%	0.768	S	S	*	*			trans	-136.9	127.4	176.4	-58.2	-177.9	0	0	0	111.1
1094	V	26.2	Very low	29.9	Very low	128 Å²	128	136.2 Å²	136.2	78%	0.776	76%	0.758	S	S	*	*			trans	-82.1	132	171.5	175.1	0	0	0	0	109.9
1095	H	28.9	Very low	29.6	Very low	158 Å²	158	133.8 Å²	133.8	73%	0.731	75%	0.753	S	S	*	*			trans	-150.1	113.8	167.5	-112.1	-71.8	0	0	0	114.2
1096	H	27.9	Very low	29.7	Very low	165 Å²	165	132.6 Å²	132.6	76%	0.764	76%	0.756	S	S	*	*			trans	-66.9	155.4	153.3	-62.9	-89	0	0	0	110.2
1097	I	27.7	Very low	29.5	Very low	152 Å²	152	133 Å²	133	78%	0.779	75%	0.75	S	S	*	*			trans	-158.6	129.4	146.4	-104.9	144.9	0	0	0	111.5
1098	F	25.6	Very low	29.6	Very low	179 Å²	179	132.2 Å²	132.2	79%	0.785	75%	0.752	S	S	*	*			trans	-92.2	150.6	162.3	-86.5	-106.2	0	0	0	109.4	T1100	F1098-T1100 PolarHBondContact O-N 3.49Å; F1098-T1100 VanDerWaalsContact O-N 3.15Å
1099	P	30.3	Very low	29.4	Very low	130 Å²	130	128.3 Å²	128.3	84%	0.844	75%	0.751	S	S	*	*			trans	-78.3	94	168.6	31.8	-33	0	0	0	111.6
1100	T	32.7	Very low	29.4	Very low	116 Å²	116	129.5 Å²	129.5	71%	0.712	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-85.4	141.7	171	54.5	0	0	0	0	112.4	F1098	F1098-T1100 PolarHBondContact O-N 3.49Å; F1098-T1100 VanDerWaalsContact O-N 3.15Å
1101	P	29.3	Very low	29.4	Very low	121 Å²	121	128.6 Å²	128.6	79%	0.786	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-69.6	146.8	168.1	30.4	-34.1	0	0	0	111.5
1102	P	34.8	Very low	29.4	Very low	111 Å²	111	127.8 Å²	127.8	72%	0.721	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-98.8	142.7	-162.6	35.2	-35.3	0	0	0	115.6
1103	N	33.9	Very low	29.4	Very low	112 Å²	112	126.7 Å²	126.7	60%	0.599	74%	0.743	S	S	*	*				-178.7	123.2	113.6	-106.9	-86.6	0	0	0	115.5	R191	R191-N1103 PolarHBondContact NE-OD1 2.97Å; R191-N1103 PolarHBondContact NH2-OD1 3.21Å
1104	S	34.8	Very low	29.4	Very low	73 Å²	73	126.9 Å²	126.9	51%	0.51	74%	0.744	S	S	.	*			trans	54.1	133.2	148	53.5	0	0	0	0	121.5
1105	G	29.6	Very low	29.4	Very low	74 Å²	74	127 Å²	127	76%	0.763	74%	0.739	S	S	*	*			cis	150.6	172.2	-3.7	0	0	0	0	0	113.7
1106	S	30.7	Very low	29.4	Very low	112 Å²	112	127 Å²	127	78%	0.783	74%	0.739	S	S	*	*			trans	77.7	113.7	-173.6	-159.3	0	0	0	0	113.6
1107	F	29.3	Very low	29.5	Very low	181 Å²	181	126.3 Å²	126.3	79%	0.794	74%	0.736	S	S	*	*				62.4	129.7	68.2	-82.3	-116.3	0	0	0	113
1108	T	29.1	Very low	29.6	Very low	128 Å²	128	127.3 Å²	127.3	79%	0.785	74%	0.737	S	S	*	*			cis	-167.9	169.2	-3.6	6.1	0	0	0	0	109.5
1109	G	29.3	Very low	29.9	Very low	77 Å²	77	123.4 Å²	123.4	79%	0.794	73%	0.732	S	S	*	*			trans	129	96.6	149.3	0	0	0	0	0	115.9
1110	S	25.5	Very low	29.8	Very low	116 Å²	116	123.1 Å²	123.1	81%	0.811	73%	0.728	S	S	*	*			trans	-91.7	125.2	163.1	52.5	0	0	0	0	110.4
1111	S	28.1	Very low	29.6	Very low	111 Å²	111	122.1 Å²	122.1	78%	0.776	73%	0.726	S	S	*	*			trans	-165.2	126.1	150	11.4	0	0	0	0	110.8
1112	E	27.4	Very low	29.5	Very low	165 Å²	165	120.7 Å²	120.7	77%	0.771	72%	0.719	S	S	*	*			trans	56.7	121.2	131.8	-69.1	-170.4	-152.3	0	0	122
1113	N	27.1	Very low	29.1	Very low	121 Å²	121	121.3 Å²	121.3	65%	0.647	72%	0.721	S	S	*	*				84.1	135.8	122.4	-74.7	-33.1	0	0	0	121.8
1114	I	28.2	Very low	28.8	Very low	134 Å²	134	121.6 Å²	121.6	69%	0.687	73%	0.727	S	S	*	*			trans	75.3	91.4	138	-66.9	169.5	0	0	0	117.1
1115	I	26.7	Very low	28.4	Very low	130 Å²	130	125.3 Å²	125.3	67%	0.667	74%	0.74	S	S	*	*				67.8	141	108.1	-72.9	167.2	0	0	0	119.4
1116	H	29.7	Very low	28.3	Very low	158 Å²	158	124.7 Å²	124.7	73%	0.731	72%	0.724	S	S	*	*			trans	65.4	146.2	172.3	-66.3	-59.5	0	0	0	114.8
1117	E	30.2	Very low	28.4	Very low	151 Å²	151	125.8 Å²	125.8	71%	0.706	72%	0.717	S	S	*	*			cis	-154.2	-166.6	-5.8	-133.6	155.1	-152.6	0	0	113.2
1118	E	29	Very low	28.5	Very low	173 Å²	173	118.9 Å²	118.9	81%	0.808	69%	0.69	S	S	*	*			trans	-39.3	158.2	169.5	-57.2	175.5	138.6	0	0	114
1119	S	32.4	Very low	28.6	Very low	98 Å²	98	119.4 Å²	119.4	69%	0.685	69%	0.693	S	S	*	*				-177.8	163.8	53.8	62.1	0	0	0	0	114.2
1120	T	27.9	Very low	28.7	Very low	123 Å²	123	123 Å²	123	76%	0.755	69%	0.693	S	S	*	*			trans	10.9	145.8	143	56.8	0	0	0	0	120.9
1121	S	28.8	Very low	29	Very low	96 Å²	96	123.4 Å²	123.4	67%	0.671	69%	0.694	S	S	*	*			cis	-178.6	-179.7	1	49.5	0	0	0	0	112.4
1122	S	27.9	Very low	29.1	Very low	91 Å²	91	123.7 Å²	123.7	64%	0.636	69%	0.691	S	S	*	*			trans	69.9	108.3	135.9	60.2	0	0	0	0	123.4
1123	T	26.1	Very low	29.4	Very low	124 Å²	124	120.6 Å²	120.6	76%	0.761	69%	0.688	S	S	*	*				88.3	145.2	110.2	-52.5	0	0	0	0	122.3
1124	T	27.2	Very low	30	Very low	118 Å²	118	121.1 Å²	121.1	72%	0.724	70%	0.698	S	S	*	*			trans	76.9	104.3	157.4	34.3	0	0	0	0	124
1125	L	26.2	Very low	30.2	Very low	150 Å²	150	124.8 Å²	124.8	79%	0.785	70%	0.703	S	S	*	*				61.1	135.5	115.8	-95	87.3	0	0	0	125.7
1126	S	27.5	Very low	30.7	Very low	61 Å²	61	124.2 Å²	124.2	43%	0.427	71%	0.705	S	S	.	*				91.1	142.9	127.3	76.8	0	0	0	0	124.4	R201	R201-S1126 PolarHBondContact NH1-O 3.14Å
1127	H	33.3	Very low	31.1	Very low	135 Å²	135	122.2 Å²	122.2	63%	0.625	71%	0.707	S	S	*	*			trans	74.6	162.7	151.5	-59.5	-42.1	0	0	0	123.7	R201 E203	R201-H1127 WeakPolarHBondContact CD-O 3.48Å; R201-H1127 PolarHBondContact NH1-O 3.24Å; R201-H1127 VanDerWaalsContact NH1-O 3.16Å; E203-H1127 WeakPolarHBondContact OE1-CA 3.25Å; E203-H1127 IonicContact OE1-CE1 3.7Å; E203-H1127 IonicContact OE1-CG 3.96Å; E203-H1127 IonicContact OE1-ND1 2.79Å; E203-H1127 PolarHBondContact OE1-ND1 3.47Å; E203-H1127 IonicContact OE2-ND1 3.77Å
1128	T	30.4	Very low	31.2	Very low	37 Å²	37	123.3 Å²	123.3	23%	0.227	71%	0.712	C	S	.	*			trans	-150.7	179.7	-152.2	72.1	0	0	0	0	114.1	R201 N202 E203	R201-T1128 HydrophobicContact CB-CG2 4.19Å; R201-T1128 HydrophobicContact CG-CG2 4.36Å; N202-T1128 WeakPolarHBondContact O-CG2 3.45Å; E203-T1128 HydrophobicContact CB-CG2 3.67Å; E203-T1128 HydrophobicContact CG-CG2 3.58Å; E203-T1128 WeakPolarHBondContact OE2-CB 3.46Å; E203-T1128 WeakPolarHBondContact OE2-CG2 3.22Å; E203-T1128 PolarHBondContact OE2-OG1 3.41Å
1129	T	31.7	Very low	31.5	Very low	139 Å²	139	121 Å²	121	85%	0.853	72%	0.715	S	S	*	*			trans	-172.8	167	135.2	11.5	0	0	0	0	113.2
1130	L	31.9	Very low	31.4	Very low	153 Å²	153	121.6 Å²	121.6	80%	0.801	72%	0.719	S	S	*	*			trans	-109.2	164.3	-179.4	-72	88.1	0	0	0	113.7
1131	C	30.5	Very low	31.7	Very low	123 Å²	123	122.3 Å²	122.3	83%	0.831	72%	0.723	S	S	*	*			trans	-162	114.1	149.4	-93.4	0	0	0	0	107.9
1132	T	31.2	Very low	32	Very low	117 Å²	117	123 Å²	123	72%	0.718	73%	0.725	S	S	*	*				80.5	96	57.1	65	0	0	0	0	117.2
1133	S	32.9	Very low	32	Very low	101 Å²	101	126.9 Å²	126.9	71%	0.706	73%	0.733	S	S	*	*				38.5	142	128.2	165.9	0	0	0	0	122.7
1134	P	39.3	Very low	32.2	Very low	132 Å²	132	126.8 Å²	126.8	86%	0.857	73%	0.727	S	S	*	*			trans	-101	169	137.9	36.2	-30.8	0	0	0	112.8
1135	R	32.9	Very low	32.4	Very low	210 Å²	210	128 Å²	128	79%	0.792	72%	0.724	S	S	*	*			trans	-154.1	-179.4	-154.3	-174.8	-172	172	-167.1	-1.8	110.9
1136	V	37.1	Very low	32.7	Very low	118 Å²	118	127.8 Å²	127.8	72%	0.715	72%	0.717	S	S	*	*			trans	87.7	145.8	159.8	-178.5	0	0	0	0	114.6
1137	P	39.4	Very low	33.1	Very low	116 Å²	116	132 Å²	132	75%	0.753	73%	0.734	S	S	*	*			cis	-119.4	170.7	5.9	17.2	7.2	0	0	0	117.6
1138	E	31.2	Very low	33.2	Very low	174 Å²	174	131 Å²	131	81%	0.813	74%	0.737	S	S	*	*			trans	-96	157.1	166.8	-55.2	139.3	135.7	0	0	111.2
1139	S	35.8	Very low	33.4	Very low	126 Å²	126	134 Å²	134	88%	0.881	76%	0.76	S	S	*	*			trans	-161.9	159.9	141.1	66.7	0	0	0	0	111.9
1140	S	29.7	Very low	33.5	Very low	109 Å²	109	133.4 Å²	133.4	76%	0.762	76%	0.756	S	S	*	*			trans	-125.5	162.8	-172.7	56.8	0	0	0	0	111.8
1141	V	33.8	Very low	33.6	Very low	139 Å²	139	130 Å²	130	84%	0.842	75%	0.751	S	S	*	*			trans	157.4	152.7	149.2	154.1	0	0	0	0	109.6
1142	P	35	Very low	33.9	Very low	110 Å²	110	131.9 Å²	131.9	71%	0.714	75%	0.751	S	S	*	*			trans	-115.7	-157	-158	39.7	-24.6	0	0	0	115
1143	E	29.6	Very low	33.9	Very low	172 Å²	172	131.9 Å²	131.9	80%	0.804	75%	0.75	S	S	*	*			trans	78.3	150.2	174.9	-59.4	-163.2	135.9	0	0	115.6
1144	I	30.7	Very low	33.9	Very low	123 Å²	123	132.4 Å²	132.4	63%	0.631	75%	0.75	S	S	*	*			cis	-160.1	147	-8.2	-120.8	170.2	0	0	0	110.8
1145	E	30	Very low	33.9	Very low	144 Å²	144	131.2 Å²	131.2	67%	0.673	74%	0.742	S	S	*	*			trans	61	165.4	158	-74.6	-170.6	144.4	0	0	119.9
1146	K	33.9	Very low	33.8	Very low	145 Å²	145	127.5 Å²	127.5	63%	0.63	74%	0.736	S	S	*	*			cis	-159.4	151.8	0.7	-129.2	166.8	-175.6	136	0	112.4
1147	L	34.5	Very low	33.5	Very low	148 Å²	148	132.5 Å²	132.5	78%	0.775	74%	0.742	S	S	*	*			trans	64.3	147.2	158.3	-53	172.5	0	0	0	117
1148	T	34.8	Very low	33.2	Very low	115 Å²	115	132.4 Å²	132.4	71%	0.706	74%	0.735	S	S	*	*			cis	-174.4	158.1	-4.7	28.1	0	0	0	0	105.3
1149	S	34.6	Very low	33.3	Very low	101 Å²	101	131.5 Å²	131.5	71%	0.706	73%	0.731	S	S	*	*			cis	-174.7	163.2	-6	-94.3	0	0	0	0	106.9
1150	T	35	Very low	33	Very low	126 Å²	126	131.8 Å²	131.8	77%	0.773	72%	0.722	S	S	*	*			cis	-156.9	162.6	4.6	-0	0	0	0	0	111.4
1151	A	34.6	Very low	33.1	Very low	82 Å²	82	135.9 Å²	135.9	68%	0.678	73%	0.729	S	S	*	*			trans	8.4	150.6	136.3	0	0	0	0	0	120.7
1152	I	35.1	Very low	32.8	Very low	162 Å²	162	138.3 Å²	138.3	83%	0.831	73%	0.728	S	S	*	*			cis	-151.1	152.1	33.1	-72.3	174.8	0	0	0	108.6
1153	T	32.7	Very low	32.8	Very low	116 Å²	116	142.5 Å²	142.5	71%	0.712	74%	0.738	S	S	*	*			cis	-168.7	167.8	-20.8	-78.7	0	0	0	0	107.6
1154	T	33.1	Very low	32.6	Very low	113 Å²	113	139.5 Å²	139.5	69%	0.693	74%	0.736	S	S	*	*			trans	-98.8	-148.8	-177.7	58.4	0	0	0	0	111
1155	P	38	Very low	32.7	Very low	107 Å²	107	140.1 Å²	140.1	70%	0.695	75%	0.746	S	S	*	*			cis	-128.5	152.7	-10.7	16.8	10.7	0	0	0	116
1156	I	31.2	Very low	32.9	Very low	132 Å²	132	140 Å²	140	68%	0.677	75%	0.75	S	S	*	*				70.8	118.3	76.8	-54.2	163	0	0	0	116.8	L1158	I1156-L1158 HydrophobicContact CG2-CD1 3.81Å
1157	R	31.8	Very low	32.5	Very low	223 Å²	223	143.6 Å²	143.6	84%	0.842	76%	0.761	S	S	*	*				-169.9	130.2	124.4	-96.3	-154.4	154.6	99.2	-2.2	109.8
1158	L	32.2	Very low	32.5	Very low	114 Å²	114	142.4 Å²	142.4	60%	0.597	76%	0.763	S	S	*	*				72.9	136.3	71.5	-93.4	70.3	0	0	0	113.5	I1156	I1156-L1158 HydrophobicContact CG2-CD1 3.81Å
1159	E	32.3	Very low	32.1	Very low	155 Å²	155	143.1 Å²	143.1	72%	0.724	77%	0.766	S	S	*	*			cis	-159.4	166.1	-0.9	-157.6	160.9	-177.9	0	0	114.2
1160	N	29.9	Very low	32	Very low	131 Å²	131	145.1 Å²	145.1	70%	0.701	77%	0.769	S	S	*	*			trans	-33.9	147.3	172.5	-53.1	-59.5	0	0	0	118.7
1161	Q	32	Very low	31.7	Very low	195 Å²	195	147.3 Å²	147.3	91%	0.911	77%	0.768	S	S	*	*				-171.2	173.2	95.9	-98.8	-174.9	14.3	0	0	114
1162	K	28.4	Very low	31.5	Very low	190 Å²	190	150.2 Å²	150.2	83%	0.826	77%	0.772	S	S	*	*			trans	-104.4	158.5	-167.2	-55.2	173.4	179.4	178.5	0	112.4
1163	H	33.5	Very low	31.4	Very low	198 Å²	198	149.1 Å²	149.1	92%	0.917	77%	0.768	S	S	*	*				-167.8	160.5	123.4	-94.8	-56.7	0	0	0	111.2
1164	S	27.2	Very low	31.2	Very low	110 Å²	110	150.1 Å²	150.1	77%	0.769	77%	0.769	S	S	*	*			trans	-122.7	146.5	-171.5	-42.6	0	0	0	0	111.8
1165	T	32.8	Very low	31	Very low	135 Å²	135	152 Å²	152	83%	0.828	77%	0.774	S	S	*	*			trans	-163.3	123.2	152.2	20.3	0	0	0	0	113
1166	N	33.3	Very low	30.4	Very low	143 Å²	143	153.8 Å²	153.8	77%	0.765	77%	0.773	S	S	*	*			trans	25.1	130.9	144.7	-53.4	-5.8	0	0	0	123.1
1167	Y	26.6	Very low	30.3	Very low	219 Å²	219	155.2 Å²	155.2	86%	0.859	78%	0.78	S	S	*	*				13.6	157.1	125.6	-62.4	-75	0	0	0	121.6
1168	P	33.2	Very low	30.1	Very low	124 Å²	124	148.4 Å²	148.4	81%	0.805	76%	0.763	S	S	*	*			cis	-135	-168.3	17.7	40.1	-20.1	0	0	0	116.6
1169	V	27.9	Very low	30	Very low	129 Å²	129	150.6 Å²	150.6	78%	0.782	78%	0.775	S	S	*	*			trans	-76.9	141.2	-179.8	169.1	0	0	0	0	113.5
1170	D	31.6	Very low	29.8	Very low	144 Å²	144	151.3 Å²	151.3	77%	0.77	78%	0.776	S	S	*	*				-160.7	177.9	127.7	-136.9	-34	0	0	0	113.1
1171	K	29.2	Very low	29.8	Very low	172 Å²	172	151.4 Å²	151.4	75%	0.748	78%	0.781	S	S	*	*			trans	-89.7	169.2	-157.1	-65.6	160.4	-177.8	170.1	0	117
1172	N	29.4	Very low	29.6	Very low	143 Å²	143	147.3 Å²	147.3	77%	0.765	77%	0.774	S	S	*	*			trans	85.9	150.4	159.7	-61.3	-22.2	0	0	0	119.1
1173	N	33	Very low	29.8	Very low	139 Å²	139	143.7 Å²	143.7	74%	0.743	77%	0.773	S	S	*	*			trans	87.5	116.4	-171.4	-56	-59.2	0	0	0	114.1
1174	N	28.7	Very low	29.7	Very low	137 Å²	137	140.3 Å²	140.3	73%	0.733	77%	0.766	S	S	*	*				82.2	128.6	54.7	-70.5	-40.4	0	0	0	112.9
1175	L	29.7	Very low	29.7	Very low	152 Å²	152	141.4 Å²	141.4	80%	0.796	76%	0.762	S	S	*	*			trans	67.6	114.1	169.6	-60.6	152.3	0	0	0	114.5
1176	E	25	Very low	29.7	Very low	145 Å²	145	141 Å²	141	68%	0.678	76%	0.762	S	S	*	*				77.5	96.9	68.9	-167.8	-166.1	-171.9	0	0	114.2
1177	I	29.8	Very low	29.5	Very low	161 Å²	161	139.2 Å²	139.2	83%	0.826	76%	0.756	S	S	*	*			trans	-154.9	119.4	149	-80.4	117	0	0	0	104.3
1178	T	27.5	Very low	29.8	Very low	80 Å²	80	138 Å²	138	49%	0.491	76%	0.759	S	S	.	*			cis	83.4	74.6	19.6	-50.4	0	0	0	0	116.1	K1180	T1178-K1180 HydrophobicContact CG2-CG 4.27Å
1179	L	29.7	Very low	29.6	Very low	160 Å²	160	140.6 Å²	140.6	84%	0.838	76%	0.757	S	S	*	*			trans	-142.4	98.1	150.7	-69.5	179.5	0	0	0	108.3
1180	K	26.6	Very low	29.9	Very low	171 Å²	171	143.6 Å²	143.6	74%	0.743	76%	0.762	S	S	*	*				75.3	101.2	64.7	-71.7	-174.5	172.8	174.9	0	116	T1178	T1178-K1180 HydrophobicContact CG2-CG 4.27Å
1181	T	30.5	Very low	29.7	Very low	132 Å²	132	141.8 Å²	141.8	81%	0.81	76%	0.756	S	S	*	*			trans	-167.9	99.7	134.7	30.7	0	0	0	0	107.6
1182	S	29	Very low	29.7	Very low	110 Å²	110	140.1 Å²	140.1	77%	0.769	76%	0.755	S	S	*	*				54.6	118.3	95.1	67.2	0	0	0	0	113.4
1183	S	30.8	Very low	29.8	Very low	114 Å²	114	142 Å²	142	80%	0.797	76%	0.757	S	S	*	*			cis	-157.7	179.9	34.4	69.8	0	0	0	0	110.1
1184	V	32.3	Very low	30	Very low	127 Å²	127	140 Å²	140	77%	0.77	75%	0.752	S	S	*	*			cis	-157.2	177.8	-5.1	98.6	0	0	0	0	109.3
1185	L	26.5	Very low	30.2	Very low	133 Å²	133	140.4 Å²	140.4	70%	0.696	75%	0.754	S	S	*	*			trans	-121.2	166.7	170.1	-110.8	87.7	0	0	0	112	T1187	L1185-T1187 WeakPolarHBondContact CD2-OG1 3.47Å
1186	P	34.4	Very low	30.2	Very low	127 Å²	127	139.5 Å²	139.5	83%	0.825	75%	0.749	S	S	*	*				-124.1	148.4	121.1	35.9	-32	0	0	0	113.4
1187	T	28.1	Very low	30.6	Very low	104 Å²	104	141.1 Å²	141.1	64%	0.638	76%	0.755	S	S	*	*			trans	-113.2	135.6	171.3	-50.2	0	0	0	0	108.6	L1185	L1185-T1187 WeakPolarHBondContact CD2-OG1 3.47Å
1188	E	32.2	Very low	30.7	Very low	195 Å²	195	139.6 Å²	139.6	91%	0.911	75%	0.748	S	S	*	*			trans	-127	150.6	156.7	-72.5	-158.2	142.4	0	0	110.9
1189	K	28.8	Very low	30.8	Very low	177 Å²	177	142.1 Å²	142.1	77%	0.77	76%	0.764	S	S	*	*			trans	-116.6	147.7	177.7	-55.7	171.7	180	177.3	0	107.9
1190	H	34.3	Very low	31	Very low	193 Å²	193	141.9 Å²	141.9	89%	0.894	77%	0.768	S	S	*	*			trans	-152.3	167.6	142.5	-103.1	-69.5	0	0	0	110.4
1191	T	28.1	Very low	31.2	Very low	105 Å²	105	141.6 Å²	141.6	64%	0.644	78%	0.775	S	S	*	*			trans	-153.6	154.9	-152	54.5	0	0	0	0	112.5
1192	L	29.7	Very low	31.3	Very low	138 Å²	138	138.8 Å²	138.8	72%	0.723	77%	0.773	S	S	*	*			trans	75.3	154.6	169.6	-47.5	161.3	0	0	0	114
1193	F	30.4	Very low	31.4	Very low	181 Å²	181	136.9 Å²	136.9	79%	0.794	77%	0.77	S	S	*	*			cis	-141.7	175.3	4.4	-95.5	-61.6	0	0	0	110.2
1194	P	38	Very low	31.4	Very low	99 Å²	99	137.5 Å²	137.5	64%	0.643	77%	0.773	S	S	*	*			trans	-109.2	-175.9	-175.8	42.2	-34.2	0	0	0	114.7
1195	D	32.4	Very low	31.3	Very low	145 Å²	145	138.2 Å²	138.2	78%	0.775	77%	0.773	S	S	*	*				176.1	174.8	125.3	-90.2	-24.8	0	0	0	114
1196	N	30.2	Very low	31.6	Very low	132 Å²	132	138.6 Å²	138.6	71%	0.706	78%	0.775	S	S	*	*			trans	-93.7	175.6	-165.7	-48.3	-78.3	0	0	0	115.3
1197	F	32.9	Very low	31.4	Very low	180 Å²	180	139 Å²	139	79%	0.789	77%	0.771	S	S	*	*				174.3	146.4	110.3	-95.2	-69.1	0	0	0	114.8
1198	D	33.1	Very low	31.8	Very low	129 Å²	129	140.5 Å²	140.5	69%	0.69	77%	0.774	S	S	*	*			trans	32.2	137.7	157.5	-50.8	-25.6	0	0	0	122.3
1199	T	28.6	Very low	31.8	Very low	133 Å²	133	137.2 Å²	137.2	82%	0.816	76%	0.762	S	S	*	*			cis	83.4	99.8	23.2	-47.2	0	0	0	0	116.8
1200	V	34.7	Very low	32.1	Very low	154 Å²	154	134.9 Å²	134.9	93%	0.933	76%	0.758	S	S	*	*			trans	-145.2	154.7	161.4	-175.5	0	0	0	0	109.8
1201	D	29.7	Very low	32.2	Very low	165 Å²	165	131 Å²	131	88%	0.882	74%	0.744	S	S	*	*			trans	-122.1	165.7	-159.1	-144.7	-25.1	0	0	0	114.9
1202	G	33.3	Very low	32.6	Very low	74 Å²	74	132.1 Å²	132.1	76%	0.763	75%	0.746	S	S	*	*			trans	90.7	153.8	161.9	0	0	0	0	0	119
1203	G	30.1	Very low	32.8	Very low	70 Å²	70	131.9 Å²	131.9	72%	0.722	75%	0.745	S	S	*	*			cis	165.8	168.5	-7	0	0	0	0	0	114.4
1204	C	31.3	Very low	32.9	Very low	126 Å²	126	129.9 Å²	129.9	85%	0.851	74%	0.743	S	S	*	*			trans	68	156.2	176.3	-62.8	0	0	0	0	117.6
1205	N	30.2	Very low	32.7	Very low	143 Å²	143	130.3 Å²	130.3	77%	0.765	75%	0.748	S	S	*	*			cis	158.6	139.9	-30.5	-103.1	-4.7	0	0	0	107.8
1206	N	33.1	Very low	32.7	Very low	140 Å²	140	131.2 Å²	131.2	75%	0.749	75%	0.753	S	S	*	*			trans	143.6	112.3	154.7	-78.6	-39.8	0	0	0	110.1
1207	N	31.1	Very low	32.8	Very low	136 Å²	136	128 Å²	128	73%	0.727	75%	0.751	S	S	*	*				72.8	135.4	85.6	-69.6	-32.3	0	0	0	112.3
1208	I	34.8	Very low	32.8	Very low	136 Å²	136	126.1 Å²	126.1	70%	0.697	75%	0.754	S	S	*	*			cis	-164.5	148.9	42.8	-134.8	146.9	0	0	0	112.7
1209	N	34.1	Very low	32.7	Very low	125 Å²	125	126.8 Å²	126.8	67%	0.668	76%	0.757	S	S	*	*			trans	47.2	125.4	149.4	-54.7	5.4	0	0	0	121.4
1210	N	33.8	Very low	32.6	Very low	128 Å²	128	125.3 Å²	125.3	68%	0.684	75%	0.752	S	S	*	*				116.8	159.7	76.2	-91.2	35.5	0	0	0	109.7
1211	D	37.2	Very low	32.4	Very low	112 Å²	112	127.1 Å²	127.1	60%	0.599	75%	0.75	S	S	*	*			cis	-156.6	149.4	4.4	-107.6	-41.8	0	0	0	110.2
1212	N	35.8	Very low	32.4	Very low	129 Å²	129	126.2 Å²	126.2	69%	0.69	75%	0.746	S	S	*	*			trans	39.8	153.6	141	-45.6	-39.8	0	0	0	122.1
1213	N	35.2	Very low	32.3	Very low	132 Å²	132	132.5 Å²	132.5	71%	0.706	75%	0.752	S	S	*	*			cis	-162	139.4	18.9	-106.1	-37.3	0	0	0	108.2
1214	N	31.8	Very low	32.1	Very low	139 Å²	139	136.4 Å²	136.4	74%	0.743	76%	0.757	S	S	*	*				87.7	154.3	77.3	-92.3	-34.6	0	0	0	118.4
1215	S	33.8	Very low	32.1	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	75%	0.754	S	S	*	*			trans	73.1	128.9	-174.3	59.6	0	0	0	0	116.7
1216	D	32.6	Very low	32	Very low	164 Å²	164	138.1 Å²	138.1	88%	0.877	76%	0.756	S	S	*	*			cis	87.3	130.6	34.8	-64.4	-46.4	0	0	0	113.6
1217	G	32.8	Very low	31.7	Very low	65 Å²	65	137.1 Å²	137.1	67%	0.67	76%	0.755	S	S	*	*			cis	172.2	-165.5	-0.7	0	0	0	0	0	111.2
1218	V	31.8	Very low	31.7	Very low	141 Å²	141	136.9 Å²	136.9	86%	0.855	75%	0.754	S	S	*	*			trans	68	153.8	168.2	155.5	0	0	0	0	116.5
1219	L	30.4	Very low	31.6	Very low	142 Å²	142	137.4 Å²	137.4	74%	0.743	76%	0.757	S	S	*	*			cis	-154.4	159.6	-37.5	-84.1	170.5	0	0	0	105.5
1220	S	26.4	Very low	31.5	Very low	102 Å²	102	137 Å²	137	71%	0.713	76%	0.761	S	S	*	*			cis	94.5	83.6	12.2	-174.8	0	0	0	0	117.7
1221	E	32.5	Very low	31.1	Very low	192 Å²	192	138.6 Å²	138.6	90%	0.897	77%	0.769	S	S	*	*			trans	-157.4	161.5	160.9	-116.7	167.3	-139.1	0	0	113
1222	D	29	Very low	30.9	Very low	147 Å²	147	141.8 Å²	141.8	79%	0.786	78%	0.781	S	S	*	*			trans	-97.8	173.5	-162.4	-45	-83.8	0	0	0	116.2
1223	F	29.9	Very low	30.5	Very low	205 Å²	205	142.8 Å²	142.8	90%	0.899	79%	0.785	S	S	*	*				-173.4	120.1	127.8	-111.4	-72.4	0	0	0	114.3
1224	D	26.4	Very low	30	Very low	152 Å²	152	144.1 Å²	144.1	81%	0.813	79%	0.789	S	S	*	*			trans	-79.9	156.2	161.6	-87.7	-50.5	0	0	0	111.7
1225	L	31.4	Very low	29.9	Very low	153 Å²	153	144.8 Å²	144.8	80%	0.801	79%	0.792	S	S	*	*			trans	-177.4	152.7	136.8	-103.6	162.2	0	0	0	116
1226	L	28.9	Very low	29.8	Very low	152 Å²	152	145.1 Å²	145.1	80%	0.796	80%	0.795	S	S	*	*			trans	78.7	82	159.4	-66.9	167.6	0	0	0	120.8
1227	T	25.7	Very low	29.6	Very low	120 Å²	120	144 Å²	144	74%	0.736	79%	0.793	S	S	*	*			trans	-60.1	153.9	148.2	52.9	0	0	0	0	113.9
1228	N	31.1	Very low	29.3	Very low	131 Å²	131	145.1 Å²	145.1	70%	0.701	80%	0.797	S	S	*	*			trans	177.5	130.9	131.9	-96.4	-33.8	0	0	0	117.1
1229	I	32.6	Very low	29.3	Very low	147 Å²	147	143.5 Å²	143.5	75%	0.754	79%	0.792	S	S	*	*			trans	76.3	134.4	131.5	-69.8	170.1	0	0	0	119.8
1230	P	31.7	Very low	29.2	Very low	117 Å²	117	144.6 Å²	144.6	76%	0.76	80%	0.797	S	S	*	*				-137.6	-164.9	-67.8	36.8	-12.9	0	0	0	113.4
1231	N	26.6	Very low	29.2	Very low	160 Å²	160	145 Å²	145	86%	0.856	80%	0.795	S	S	*	*			trans	-91.5	141.4	179.9	-53.3	-55.6	0	0	0	114.9
1232	E	31.6	Very low	29.2	Very low	180 Å²	180	142.4 Å²	142.4	84%	0.841	79%	0.792	S	S	*	*			trans	-139.7	148.7	137.7	-75.4	-167.7	-153.7	0	0	106.5
1233	L	27.5	Very low	29.1	Very low	149 Å²	149	141 Å²	141	78%	0.78	79%	0.785	S	S	*	*			cis	-148.5	-174	3.1	-128.7	169	0	0	0	109.1
1234	M	26.1	Very low	29.1	Very low	161 Å²	161	138.5 Å²	138.5	79%	0.793	78%	0.781	S	S	*	*			trans	-124.6	154.8	168.2	-67.2	-170.3	-174	0	0	110.4
1235	D	29.9	Very low	29.3	Very low	152 Å²	152	138.3 Å²	138.3	81%	0.813	78%	0.775	S	S	*	*				177.1	159.5	110.7	-99	-23.4	0	0	0	113.9
1236	S	30.2	Very low	29.3	Very low	115 Å²	115	139.8 Å²	139.8	80%	0.804	78%	0.777	S	S	*	*			trans	67.3	128.5	171	-66	0	0	0	0	117.3
1237	V	29.8	Very low	29.4	Very low	140 Å²	140	140.5 Å²	140.5	85%	0.848	78%	0.776	S	S	*	*			cis	-135.9	152.2	-2.4	-177.9	0	0	0	0	108.9
1238	A	26.3	Very low	29.8	Very low	90 Å²	90	144 Å²	144	74%	0.744	78%	0.783	S	S	*	*			trans	-128.1	-174.5	177.8	0	0	0	0	0	112
1239	S	31.9	Very low	29.6	Very low	107 Å²	107	145.1 Å²	145.1	75%	0.748	79%	0.785	S	S	*	*			trans	85.2	136.3	-176	-146.5	0	0	0	0	113.5
1240	L	28.2	Very low	29.5	Very low	164 Å²	164	144.3 Å²	144.3	86%	0.859	79%	0.787	S	S	*	*			cis	-115.4	149.6	14.5	-79.6	157.8	0	0	0	114.2
1241	V	26.6	Very low	29.4	Very low	110 Å²	110	145 Å²	145	67%	0.667	78%	0.784	S	S	*	*			trans	-120.5	145.3	169.6	169.6	0	0	0	0	108.3	D1243	V1241-D1243 WeakPolarHBondContact CG1-OD2 3.46Å
1242	V	30.9	Very low	29.7	Very low	139 Å²	139	146 Å²	146	84%	0.842	78%	0.783	S	S	*	*			trans	-131.7	100.2	157.9	-178.6	0	0	0	0	108.8
1243	D	27.9	Very low	29.6	Very low	116 Å²	116	146.3 Å²	146.3	62%	0.62	79%	0.785	S	S	*	*			trans	-66.9	153.1	168.4	-75	-71.9	0	0	0	111.7	V1241	V1241-D1243 WeakPolarHBondContact CG1-OD2 3.46Å
1244	N	30	Very low	29.8	Very low	153 Å²	153	146.6 Å²	146.6	82%	0.818	79%	0.785	S	S	*	*			trans	-156.7	100.5	137	-104.2	-71	0	0	0	110
1245	H	30.9	Very low	29.9	Very low	148 Å²	148	146.3 Å²	146.3	69%	0.685	79%	0.787	S	S	*	*			trans	-61.9	148.5	159	-78.9	26.7	0	0	0	110.1
1246	H	31.8	Very low	30	Very low	184 Å²	184	144 Å²	144	85%	0.852	78%	0.783	S	S	*	*			trans	-152.3	132.2	136.8	-105	74.9	0	0	0	108.8
1247	H	31.2	Very low	30	Very low	167 Å²	167	146.4 Å²	146.4	77%	0.773	79%	0.787	S	S	*	*			trans	-72.2	149.9	170.6	-72.4	-13.2	0	0	0	110.7
1248	H	32.5	Very low	30	Very low	193 Å²	193	144.8 Å²	144.8	89%	0.894	78%	0.782	S	S	*	*				-151.2	141.6	121.8	-117.3	-74.7	0	0	0	111.6
1249	Q	28.1	Very low	30.3	Very low	156 Å²	156	145.6 Å²	145.6	73%	0.729	78%	0.78	S	S	*	*			trans	-109.7	130.6	-176.6	175.8	-174.7	6.3	0	0	109.4
1250	T	31	Very low	30.2	Very low	130 Å²	130	145.7 Å²	145.7	80%	0.798	78%	0.778	S	S	*	*			trans	-151	105.1	164.8	49.6	0	0	0	0	110.1
1251	D	28.2	Very low	30.2	Very low	131 Å²	131	143.7 Å²	143.7	70%	0.701	77%	0.772	S	S	*	*			trans	-73.9	136.2	167.4	-61	-79.4	0	0	0	110.6
1252	H	33.6	Very low	30.2	Very low	180 Å²	180	145.3 Å²	145.3	83%	0.833	78%	0.777	S	S	*	*			trans	-147.8	116	159.1	-95.2	-62.8	0	0	0	111
1253	Q	28.4	Very low	30	Very low	188 Å²	188	143.1 Å²	143.1	88%	0.879	76%	0.757	S	S	*	*			trans	-67.8	134.5	169.6	-65.8	173.3	-38.9	0	0	110.5
1254	I	32.6	Very low	29.9	Very low	154 Å²	154	144.7 Å²	144.7	79%	0.79	76%	0.758	S	S	*	*			trans	-133.4	115.5	155	-62.4	-176.4	0	0	0	107.6
1255	N	27.7	Very low	29.7	Very low	155 Å²	155	145.2 Å²	145.2	83%	0.829	76%	0.761	S	S	*	*			trans	-76.2	132.9	167.2	-84.5	-12.8	0	0	0	109.6
1256	S	31.9	Very low	29.4	Very low	105 Å²	105	141.9 Å²	141.9	73%	0.734	75%	0.748	S	S	*	*			trans	-145.9	115	161.1	58.1	0	0	0	0	109.2
1257	N	29.9	Very low	29.1	Very low	164 Å²	164	139.8 Å²	139.8	88%	0.877	74%	0.742	S	S	*	*			trans	-72.8	135.3	-174	-58.1	-33.3	0	0	0	111.7
1258	S	30.7	Very low	29	Very low	107 Å²	107	136.9 Å²	136.9	75%	0.748	73%	0.732	S	S	*	*			trans	-125	148.3	160.9	53.5	0	0	0	0	109.1
1259	P	32.8	Very low	28.7	Very low	107 Å²	107	134.4 Å²	134.4	70%	0.695	72%	0.72	S	S	*	*			trans	-67.5	157.8	-174.6	28.8	-35.8	0	0	0	112.6	T1261	P1259-T1261 PolarHBondContact O-N 3.05Å
1260	P	29.4	Very low	28.7	Very low	109 Å²	109	132.4 Å²	132.4	71%	0.708	72%	0.723	S	S	*	*			trans	-67.4	127.6	179.9	28.2	-34.4	0	0	0	111.2
1261	T	27.8	Very low	28.6	Very low	121 Å²	121	129 Å²	129	74%	0.742	72%	0.715	S	S	*	*			trans	-100.1	81.9	167.9	52	0	0	0	0	109.3	P1259 F1263	P1259-T1261 PolarHBondContact O-N 3.05Å; T1261-F1263 PolarHBondContact O-N 3.33Å
1262	D	27.9	Very low	28.7	Very low	144 Å²	144	126.7 Å²	126.7	77%	0.77	70%	0.702	S	S	*	*			trans	-69.5	78.9	170.8	-65.3	-38.7	0	0	0	109.7
1263	F	25	Very low	28.5	Very low	94 Å²	94	124 Å²	124	41%	0.412	69%	0.694	S	S	.	*			trans	-158.2	51.6	179.5	-118.4	-59.4	0	0	0	115.4	I816 V817 N818 T1261	I816-F1263 HydrophobicContact CG2-CZ 4.27Å; I816-F1263 WeakPolarHBondContact O-CE1 3.32Å; I816-F1263 VanDerWaalsContact O-CZ 3.29Å; I816-F1263 WeakPolarHBondContact O-CZ 3.42Å; V817-F1263 HydrophobicContact CB-CE1 4.2Å; V817-F1263 HydrophobicContact CG1-CD1 4.13Å; V817-F1263 HydrophobicContact CG1-CE1 4.31Å; V817-F1263 HydrophobicContact CG2-CE1 4Å; N818-F1263 PolarHBondContact ND2-O 3.25Å; T1261-F1263 PolarHBondContact O-N 3.33Å
1264	F	26.1	Very low	28.7	Very low	149 Å²	149	118.4 Å²	118.4	65%	0.654	67%	0.67	S	S	*	*			trans	-147	88.3	170.6	-87.2	-79.3	0	0	0	111.8
1265	D	26.7	Very low	28.5	Very low	163 Å²	163	115.9 Å²	115.9	87%	0.872	66%	0.658	S	S	*	*	S	Bend	trans	-157.4	7.9	168.7	-103.3	-29	0	0	0	114.7
1266	L	25	Very low	28.6	Very low	79 Å²	79	112.1 Å²	112.1	41%	0.414	64%	0.64	S	S	.	*	S	Bend	trans	-142.4	79.1	-173.4	-89.3	168.1	0	0	0	112	V817	V817-L1266 HydrophobicContact CG2-CB 3.63Å; V817-L1266 HydrophobicContact CG2-CD1 4.23Å
1267	L	25.6	Very low	28.3	Very low	140 Å²	140	112.5 Å²	112.5	73%	0.733	64%	0.638	S	S	*	*	S	Bend	trans	-167.5	30.9	160.3	-115.7	164.4	0	0	0	114.8
1268	L	28.6	Very low	28.1	Very low	106 Å²	106	109 Å²	109	56%	0.555	62%	0.619	S	S	*	*	S	Bend	trans	-134.9	14.9	-179.1	-139.3	81.2	0	0	0	115.4	N1272	L1268-N1272 PolarHBondContact O-ND2 2.94Å; L1268-N1272 VanDerWaalsContact O-ND2 3.13Å
1269	E	26.2	Very low	27.8	Very low	141 Å²	141	107.5 Å²	107.5	66%	0.659	61%	0.608	S	S	*	*	S	Bend	trans	-104.2	-17.9	-170.4	-64.4	-166.2	120.1	0	0	115.5	G1271	E1269-G1271 PolarHBondContact O-N 3.44Å
1270	S	28.1	Very low	27.5	Very low	113 Å²	113	108.4 Å²	108.4	79%	0.79	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-0.9	-176	57.9	0	0	0	0	115.5
1271	G	29.3	Very low	27.2	Very low	60 Å²	60	112.4 Å²	112.4	62%	0.619	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	-14.4	-178.4	0	0	0	0	0	116.3	E1269	E1269-G1271 PolarHBondContact O-N 3.44Å
1272	N	29.5	Very low	27.2	Very low	82 Å²	82	115.6 Å²	115.6	44%	0.439	62%	0.623	S	S	.	*			trans	-104.7	-13.3	-162	-71.6	-43.7	0	0	0	115.6	L1268 L1274 N1275 T1276	L1268-N1272 PolarHBondContact O-ND2 2.94Å; L1268-N1272 VanDerWaalsContact O-ND2 3.13Å; N1272-L1274 PolarHBondContact O-N 3.12Å; N1272-N1275 PolarHBondContact O-N 3.37Å; N1272-T1276 HydrophobicContact CB-CG2 4.43Å; N1272-T1276 PolarHBondContact O-OG1 3.11Å
1273	N	28.6	Very low	27.1	Very low	123 Å²	123	117.4 Å²	117.4	66%	0.658	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	21.9	-168.9	-69.3	-19	0	0	0	116.4
1274	L	32.4	Very low	27.1	Very low	71 Å²	71	119 Å²	119	37%	0.372	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121	-7	166.4	-83.3	163.9	0	0	0	113.4	N1272 V1320	N1272-L1274 PolarHBondContact O-N 3.12Å; L1274-V1320 HydrophobicContact CD2-CG1 4.35Å
1275	N	29.6	Very low	27.2	Very low	101 Å²	101	120.9 Å²	120.9	54%	0.54	66%	0.658	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.4	-8.6	174.8	-75.4	16	0	0	0	112.8	N1272	N1272-N1275 PolarHBondContact O-N 3.37Å
1276	T	28.8	Very low	27.3	Very low	75 Å²	75	119.4 Å²	119.4	46%	0.46	66%	0.656	S	S	.	*	S	Bend	trans	-95.9	-14.1	-172.7	46.2	0	0	0	0	115.3	N1272 L1278 C1279	N1272-T1276 HydrophobicContact CB-CG2 4.43Å; N1272-T1276 PolarHBondContact O-OG1 3.11Å; T1276-L1278 PolarHBondContact O-N 2.77Å; T1276-C1279 PolarHBondContact O-N 2.93Å
1277	T	27	Very low	27.5	Very low	113 Å²	113	125.2 Å²	125.2	69%	0.693	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	11.3	179.5	36.8	0	0	0	0	115.2
1278	L	25.6	Very low	27.6	Very low	91 Å²	91	125.3 Å²	125.3	48%	0.476	68%	0.682	S	S	.	*	T	Hydrogen-bonded Turn	trans	-128.4	24.5	179	-111.9	160	0	0	0	113.9	T1276 E1317	T1276-L1278 PolarHBondContact O-N 2.77Å; L1278-E1317 HydrophobicContact CD2-CG 4.27Å; L1278-E1317 HydrophobicContact CG-CG 4.35Å
1279	C	23.9	Very low	27.8	Very low	76 Å²	76	130 Å²	130	51%	0.514	70%	0.701	S	S	.	*	S	Bend	trans	-150.7	135.9	161.4	-144.6	0	0	0	0	113.4	T1276	T1276-C1279 PolarHBondContact O-N 2.93Å
1280	N	25.7	Very low	27.9	Very low	126 Å²	126	126.9 Å²	126.9	67%	0.674	71%	0.706	S	S	*	*			trans	59.9	81.5	162.1	-53.7	-32.2	0	0	0	119.1
1281	Q	24.6	Very low	28.1	Very low	192 Å²	192	130.9 Å²	130.9	90%	0.897	71%	0.713	S	S	*	*			trans	-101.5	103.8	140.4	-80.7	-165.6	6.3	0	0	110
1282	H	27.6	Very low	28.2	Very low	189 Å²	189	135.1 Å²	135.1	88%	0.875	72%	0.721	S	S	*	*			trans	-167.4	149.1	153.8	-109.8	-69.4	0	0	0	111.4
1283	Q	24.8	Very low	28.5	Very low	182 Å²	182	138.5 Å²	138.5	85%	0.85	74%	0.738	S	S	*	*			trans	70.9	74.7	167.4	-64.8	-173.7	-37.1	0	0	119
1284	C	24.4	Very low	28.8	Very low	127 Å²	127	139.9 Å²	139.9	86%	0.858	75%	0.745	S	S	*	*				-132.6	146.6	119.1	-93.6	0	0	0	0	106.4
1285	E	29.9	Very low	28.7	Very low	188 Å²	188	143.8 Å²	143.8	88%	0.879	77%	0.765	S	S	*	*			cis	-130.3	178.1	6.7	-60.9	-179.7	124.6	0	0	111.6
1286	T	27.3	Very low	28.9	Very low	133 Å²	133	145.4 Å²	145.4	82%	0.816	77%	0.774	S	S	*	*			trans	-80.3	141.4	-179.7	46.9	0	0	0	0	114.7
1287	E	30	Very low	29.1	Very low	200 Å²	200	147.7 Å²	147.7	94%	0.935	78%	0.783	S	S	*	*			trans	-151.2	151.9	134.3	-128.9	179.1	-149.9	0	0	112.4
1288	N	27	Very low	29.6	Very low	142 Å²	142	150.3 Å²	150.3	76%	0.759	79%	0.792	S	S	*	*			trans	-100.1	129.6	-167.1	-82.1	-68	0	0	0	113.8
1289	Q	33.3	Very low	29.9	Very low	205 Å²	205	152.4 Å²	152.4	96%	0.958	80%	0.804	S	S	*	*			trans	-171.3	132.5	137.1	-105.6	148.2	102.2	0	0	110.8
1290	G	27.5	Very low	30.5	Very low	75 Å²	75	156.9 Å²	156.9	77%	0.773	82%	0.823	S	S	*	*			trans	-129.4	157.7	-178.4	0	0	0	0	0	113.3
1291	Q	34.3	Very low	30.8	Very low	197 Å²	197	156.3 Å²	156.3	92%	0.921	82%	0.824	S	S	*	*			trans	-151.5	144.7	164.4	-111	168.1	12.8	0	0	110.8
1292	N	29.9	Very low	31.3	Very low	150 Å²	150	154.8 Å²	154.8	80%	0.802	82%	0.82	S	S	*	*			trans	-82.5	161.8	-172.1	-57.5	-62.6	0	0	0	112.8
1293	I	35.7	Very low	31.4	Very low	152 Å²	152	152.2 Å²	152.2	78%	0.779	81%	0.813	S	S	*	*				175.5	119.1	109.5	-86.9	155.2	0	0	0	112.3
1294	N	34.5	Very low	31.8	Very low	153 Å²	153	152 Å²	152	82%	0.818	81%	0.812	S	S	*	*			trans	52.5	153.8	147.7	-63	7.9	0	0	0	124.7
1295	I	31.1	Very low	32.2	Very low	152 Å²	152	150.7 Å²	150.7	78%	0.779	80%	0.804	S	S	*	*			trans	-115.9	164.3	-177.8	-60.1	158.3	0	0	0	108.4
1296	N	34	Very low	32.1	Very low	136 Å²	136	147.7 Å²	147.7	73%	0.727	80%	0.804	S	S	*	*			trans	154.5	109.2	143.2	-84.7	32	0	0	0	108.2
1297	D	33.1	Very low	32.4	Very low	122 Å²	122	146 Å²	146	65%	0.652	79%	0.794	S	S	*	*				82.8	112.4	85.4	-77.7	-32.7	0	0	0	113.3
1298	D	36.7	Very low	32.6	Very low	168 Å²	168	144.4 Å²	144.4	90%	0.898	79%	0.792	S	S	*	*				-164.8	143.7	123.3	-120.4	-27.5	0	0	0	111.5
1299	N	32.5	Very low	32.9	Very low	136 Å²	136	146 Å²	146	73%	0.727	79%	0.794	S	S	*	*			trans	-104.3	148.5	-176.1	-78.6	-87.5	0	0	0	112.2
1300	N	35.6	Very low	33.3	Very low	169 Å²	169	143.1 Å²	143.1	90%	0.904	78%	0.775	S	S	*	*			trans	-157.8	152.7	151.1	-116	-63.2	0	0	0	114.2
1301	V	32.5	Very low	34.2	Very low	115 Å²	115	145.5 Å²	145.5	70%	0.697	77%	0.774	S	S	*	*			trans	-112.7	130.2	-160.7	176.7	0	0	0	0	112.7
1302	I	35.1	Very low	34.9	Very low	160 Å²	160	141.5 Å²	141.5	82%	0.821	76%	0.763	S	S	*	*			trans	-139	133	156.8	-60.6	-175.3	0	0	0	109.5
1303	N	30.2	Very low	36.4	Very low	134 Å²	134	138.9 Å²	138.9	72%	0.717	74%	0.744	S	S	*	*			trans	-76.5	142.4	-179.7	-56.5	-50.4	0	0	0	113
1304	Q	33	Very low	37.6	Very low	178 Å²	178	135 Å²	135	83%	0.832	73%	0.728	S	S	*	*			trans	-167.4	144.9	138.4	-109.5	144	106.5	0	0	113.5
1305	S	32.3	Very low	38.9	Very low	100 Å²	100	130.6 Å²	130.6	70%	0.699	70%	0.703	S	S	*	*			trans	34.4	100.3	162.4	56.5	0	0	0	0	119.1	T1307	S1305-T1307 PolarHBondContact O-N 2.8Å; S1305-T1307 VanDerWaalsContact O-N 3.11Å
1306	S	28.3	Very low	40.5	Very low	125 Å²	125	131.4 Å²	131.4	87%	0.874	70%	0.704	S	S	*	*			trans	-74.5	90.2	162.8	54.4	0	0	0	0	111.5
1307	T	33.7	Very low	42.3	Very low	97 Å²	97	128.1 Å²	128.1	60%	0.595	68%	0.684	S	S	*	*			trans	-88.8	131.9	165.5	44.9	0	0	0	0	110.3	S1305 H1309	S1305-T1307 PolarHBondContact O-N 2.8Å; S1305-T1307 VanDerWaalsContact O-N 3.11Å; T1307-H1309 PolarHBondContact O-N 2.95Å
1308	N	33.6	Very low	44.5	Very low	167 Å²	167	123.3 Å²	123.3	89%	0.893	66%	0.658	S	S	*	*			trans	-63.7	102.5	176.3	-72.5	-12.4	0	0	0	110.4	R1310	N1308-R1310 PolarHBondContact O-N 3.12Å
1309	H	34	Very low	47	Very low	175 Å²	175	118.3 Å²	118.3	81%	0.81	63%	0.634	S	S	*	*			trans	-71.9	91.8	171.1	-84.8	-82.7	0	0	0	109.9	T1307 T1311	T1307-H1309 PolarHBondContact O-N 2.95Å; H1309-T1311 PolarHBondContact O-N 2.83Å
1310	R	41.3	Very low	49.9	Very low	145 Å²	145	112.1 Å²	112.1	55%	0.547	60%	0.601	S	S	.	*			trans	-59.2	122.3	166.3	-168.9	176	-175.3	-161.1	-4.3	108.4	D736 N1308 V1312	D736-R1310 IonicContact OD1-CZ 3.36Å; D736-R1310 IonicContact OD1-NH1 3.71Å; D736-R1310 PolarHBondContact OD1-NH1 3.46Å; D736-R1310 IonicContact OD1-NH2 3.63Å; D736-R1310 IonicContact OD2-CZ 2.82Å; D736-R1310 VanDerWaalsContact OD2-CZ 3.24Å; D736-R1310 IonicContact OD2-NH1 2.79Å; D736-R1310 PolarHBondContact OD2-NH1 3.26Å; D736-R1310 IonicContact OD2-NH2 3.7Å; D736-R1310 PolarHBondContact OD2-NH2 3.12Å; N1308-R1310 PolarHBondContact O-N 3.12Å; R1310-V1312 PolarHBondContact O-N 2.87Å
1311	T	46.5	Very low	52.7	Low	125 Å²	125	109.2 Å²	109.2	77%	0.767	58%	0.582	S	S	*	*			trans	-57.6	123.8	-177.5	-41.7	0	0	0	0	109.9	H1309 K1313	H1309-T1311 PolarHBondContact O-N 2.83Å; T1311-K1313 PolarHBondContact O-N 2.7Å
1312	V	49.9	Very low	55.7	Low	113 Å²	113	104.4 Å²	104.4	69%	0.685	55%	0.552	S	S	*	*			trans	-73.6	111.3	177.7	-179.8	0	0	0	0	107.7	P739 R1310 T1314	P739-V1312 HydrophobicContact CG-CG1 4.34Å; R1310-V1312 PolarHBondContact O-N 2.87Å; V1312-T1314 PolarHBondContact O-N 3.44Å
1313	K	61	Low	58.6	Low	94 Å²	94	98.4 Å²	98.4	41%	0.409	52%	0.524	S	S	.	.			trans	-57.6	134.3	170.7	-67.5	-168.1	170.9	-164.3	0	109.5	P739 T1311 E1317 L1318	P739-K1313 VanDerWaalsContact CG-O 3.3Å; P739-K1313 WeakPolarHBondContact CG-O 3.37Å; T1311-K1313 PolarHBondContact O-N 2.7Å; K1313-E1317 WeakPolarHBondContact CA-OE2 3.38Å; K1313-E1317 HydrophobicContact CB-CB 4.31Å; K1313-L1318 HydrophobicContact CB-CD2 4.27Å; K1313-L1318 HydrophobicContact CB-CG 4.29Å; K1313-L1318 HydrophobicContact CD-CD2 3.87Å
1314	T	60.8	Low	61.8	Low	71 Å²	71	92 Å²	92	44%	0.436	49%	0.489	S	S	.	.			trans	-65.7	163.7	171.5	60.8	0	0	0	0	111.2	V1312 E1316 E1317 L1318	V1312-T1314 PolarHBondContact O-N 3.44Å; T1314-E1316 PolarHBondContact O-N 3.17Å; T1314-E1317 VanDerWaalsContact CB-OE1 3.29Å; T1314-E1317 WeakPolarHBondContact CB-OE1 3.43Å; T1314-E1317 VanDerWaalsContact CG2-OE1 3.29Å; T1314-E1317 WeakPolarHBondContact CG2-OE1 3.27Å; T1314-E1317 PolarHBondContact N-OE1 3.15Å; T1314-E1317 PolarHBondContact O-N 3Å; T1314-E1317 VanDerWaalsContact OG1-CG 3.31Å; T1314-E1317 WeakPolarHBondContact OG1-CG 3.47Å; T1314-E1317 PolarHBondContact OG1-N 3.41Å; T1314-E1317 PolarHBondContact OG1-OE1 3.35Å; T1314-L1318 WeakPolarHBondContact O-CG 3.12Å; T1314-L1318 PolarHBondContact O-N 3.33Å
1315	M	62	Low	64.8	Low	60 Å²	60	89 Å²	89	30%	0.296	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-29.9	176	-162.8	62.2	70.2	0	0	112.3	P739 D740 H800 L1318 T1319	P739-M1315 HydrophobicContact CB-CE 3.98Å; P739-M1315 HydrophobicContact CG-CE 4.31Å; D740-M1315 HydrophobicContact CB-CE 4.28Å; D740-M1315 WeakPolarHBondContact OD1-CE 3.35Å; H800-M1315 PolarHBondContact CE1-SD 3.2Å; M1315-L1318 PolarHBondContact O-N 3.17Å; M1315-T1319 PolarHBondContact O-N 3.1Å; M1315-T1319 PolarHBondContact O-OG1 2.86Å
1316	E	64.8	Low	67.8	Low	170 Å²	170	84.2 Å²	84.2	79%	0.794	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-42	-179.6	-63.3	175.3	170.4	0	0	110.6	T1314 L1318 T1319	T1314-E1316 PolarHBondContact O-N 3.17Å; E1316-L1318 PolarHBondContact O-N 3.02Å; E1316-L1318 VanDerWaalsContact O-N 3.13Å; E1316-T1319 PolarHBondContact O-N 3.49Å
1317	E	72.1	Confident	70.8	Confident	66 Å²	66	82.6 Å²	82.6	31%	0.308	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.2	170.8	-74.7	162.4	-108.3	0	0	114.8	L1278 K1313 T1314	L1278-E1317 HydrophobicContact CD2-CG 4.27Å; L1278-E1317 HydrophobicContact CG-CG 4.35Å; K1313-E1317 WeakPolarHBondContact CA-OE2 3.38Å; K1313-E1317 HydrophobicContact CB-CB 4.31Å; T1314-E1317 VanDerWaalsContact CB-OE1 3.29Å; T1314-E1317 WeakPolarHBondContact CB-OE1 3.43Å; T1314-E1317 VanDerWaalsContact CG2-OE1 3.29Å; T1314-E1317 WeakPolarHBondContact CG2-OE1 3.27Å; T1314-E1317 PolarHBondContact N-OE1 3.15Å; T1314-E1317 PolarHBondContact O-N 3Å; T1314-E1317 VanDerWaalsContact OG1-CG 3.31Å; T1314-E1317 WeakPolarHBondContact OG1-CG 3.47Å; T1314-E1317 PolarHBondContact OG1-N 3.41Å; T1314-E1317 PolarHBondContact OG1-OE1 3.35Å
1318	L	79.7	Confident	73.7	Confident	21 Å²	21	78 Å²	78	11%	0.11	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-11.8	177.9	-66.1	172.3	0	0	0	112.9	D738 P739 K1313 T1314 M1315 E1316	D738-L1318 WeakPolarHBondContact OD1-CD1 3.44Å; P739-L1318 HydrophobicContact CG-CD1 4.14Å; K1313-L1318 HydrophobicContact CB-CD2 4.27Å; K1313-L1318 HydrophobicContact CB-CG 4.29Å; K1313-L1318 HydrophobicContact CD-CD2 3.87Å; T1314-L1318 WeakPolarHBondContact O-CG 3.12Å; T1314-L1318 PolarHBondContact O-N 3.33Å; M1315-L1318 PolarHBondContact O-N 3.17Å; E1316-L1318 PolarHBondContact O-N 3.02Å; E1316-L1318 VanDerWaalsContact O-N 3.13Å
1319	T	88.7	Confident	76.6	Confident	64 Å²	64	70.1 Å²	70.1	39%	0.393	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-87	119.6	-172.2	-60.8	0	0	0	0	111.1	H800 C802 M1315 E1316	H800-T1319 WeakPolarHBondContact O-CA 3.5Å; C802-T1319 HydrophobicContact CB-CG2 4.05Å; M1315-T1319 PolarHBondContact O-N 3.1Å; M1315-T1319 PolarHBondContact O-OG1 2.86Å; E1316-T1319 PolarHBondContact O-N 3.49Å
1320	V	92.1	Very high	79.5	Confident	5 Å²	5	62.7 Å²	62.7	3%	0.03	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	131.1	174.2	-178.5	0	0	0	0	108.8	P753 H800 L801 C802 L1274	P753-V1320 HydrophobicContact CB-CB 4.18Å; P753-V1320 HydrophobicContact CB-CG2 3.71Å; P753-V1320 HydrophobicContact CG-CG2 3.63Å; H800-V1320 PolarHBondContact O-N 3.34Å; L801-V1320 HydrophobicContact CD1-CB 4.11Å; L801-V1320 HydrophobicContact CD1-CG1 4.03Å; C802-V1320 PolarHBondContact N-O 3.46Å; L1274-V1320 HydrophobicContact CD2-CG1 4.35Å
1321	H	94.4	Very high	81.9	Confident	108 Å²	108	59 Å²	59	50%	0.5	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	129.4	175.6	-168.8	-95.6	0	0	0	110.5	C802 S804	C802-H1321 CarbonylContact O-C 3.58Å; C802-H1321 WeakPolarHBondContact O-CA 3.27Å; S804-H1321 PolarHBondContact OG-CE1 2.98Å; S804-H1321 VanDerWaalsContact OG-CE1 3.26Å
1322	L	95.8	Very high	84.2	Confident	15 Å²	15	53.1 Å²	53.1	8%	0.079	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	106.3	176.6	175.1	63.2	0	0	0	110	L760 L801 C802 L803 S804 L1324	L760-L1322 HydrophobicContact CB-CD2 3.69Å; L801-L1322 HydrophobicContact CD1-CB 3.97Å; C802-L1322 PolarHBondContact O-N 2.98Å; L803-L1322 CarbonylContact C-O 3.48Å; L803-L1322 WeakPolarHBondContact CA-O 3.3Å; L803-L1322 HydrophobicContact CD2-CB 4.09Å; L803-L1322 HydrophobicContact CD2-CD2 3.92Å; L803-L1322 HydrophobicContact CD2-CG 4.33Å; S804-L1322 PolarHBondContact N-O 2.97Å; L1322-L1324 HydrophobicContact CD2-CD2 4.02Å; L1322-L1324 HydrophobicContact CG-CD2 4.19Å
1323	P	96.3	Very high	86.3	Confident	34 Å²	34	48.6 Å²	48.6	22%	0.221	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	136.1	163.1	30	-32.3	0	0	0	109.9	S804 A806 Y1325	S804-P1323 WeakPolarHBondContact OG-CA 3.36Å; A806-P1323 HydrophobicContact CB-CB 4.41Å; P1323-Y1325 HydrophobicContact CB-CE2 4.24Å; P1323-Y1325 HydrophobicContact CG-CE2 3.92Å
1324	L	96.8	Very high	87.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	129.9	172	-60.5	171.1	0	0	0	109.2	D764 L803 S804 A806 L1322 M1329 I1333	D764-L1324 HydrophobicContact CB-CD2 4.2Å; D764-L1324 WeakPolarHBondContact OD2-CA 3.35Å; L803-L1324 HydrophobicContact CB-CD1 4.41Å; L803-L1324 HydrophobicContact CD1-CD1 4.38Å; S804-L1324 WeakPolarHBondContact O-CB 3.45Å; S804-L1324 PolarHBondContact O-N 3.45Å; A806-L1324 WeakPolarHBondContact CB-O 3.4Å; A806-L1324 PolarHBondContact N-O 3.42Å; L1322-L1324 HydrophobicContact CD2-CD2 4.02Å; L1322-L1324 HydrophobicContact CG-CD2 4.19Å; L1324-M1329 HydrophobicContact CB-CB 4.37Å; L1324-M1329 HydrophobicContact CD1-CB 4.21Å; L1324-M1329 HydrophobicContact CD2-CB 4.2Å; L1324-M1329 HydrophobicContact CG-CB 4.5Å; L1324-I1333 HydrophobicContact CD1-CB 4.38Å; L1324-I1333 HydrophobicContact CD1-CD1 4.31Å; L1324-I1333 HydrophobicContact CD1-CG1 4.13Å
1325	Y	96	Very high	89.4	Confident	114 Å²	114	48.8 Å²	48.8	45%	0.447	25%	0.251	S	S	.	.			trans	-100.9	-35.8	-173.2	-64.8	-93.2	0	0	0	112.9	D764 A806 P1323	D764-Y1325 PolarHBondContact OD1-N 3.29Å; D764-Y1325 PolarHBondContact OD2-N 3.06Å; A806-Y1325 HydrophobicContact CB-CD1 3.59Å; A806-Y1325 HydrophobicContact CB-CE1 3.78Å; A806-Y1325 HydrophobicContact CB-CG 4.12Å; P1323-Y1325 HydrophobicContact CB-CE2 4.24Å; P1323-Y1325 HydrophobicContact CG-CE2 3.92Å
1326	S	95.1	Very high	90.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.241	C	C	.	.	S	Bend	trans	-72.6	143.2	180	68.6	0	0	0	0	112.1	D764 C767 E771 K1328 M1329 A1330	D764-S1326 WeakPolarHBondContact O-CB 3.3Å; D764-S1326 VanDerWaalsContact OD1-CB 3.23Å; D764-S1326 WeakPolarHBondContact OD1-CB 3.28Å; D764-S1326 PolarHBondContact OD1-N 2.91Å; D764-S1326 PolarHBondContact OD1-OG 3.47Å; C767-S1326 VanDerWaalsContact CB-CB 3.41Å; C767-S1326 VanDerWaalsContact CB-OG 3.27Å; C767-S1326 WeakPolarHBondContact CB-OG 3.18Å; E771-S1326 WeakPolarHBondContact OE1-CB 3.45Å; S1326-K1328 PolarHBondContact O-N 2.78Å; S1326-M1329 PolarHBondContact O-N 3Å; S1326-M1329 WeakPolarHBondContact OG-CB 3.47Å; S1326-M1329 WeakPolarHBondContact OG-CG 3.42Å; S1326-M1329 PolarHBondContact OG-N 2.73Å; S1326-A1330 WeakPolarHBondContact O-CB 3.26Å; S1326-A1330 PolarHBondContact O-N 3.4Å
1327	V	93.1	Very high	92.1	Very high	91 Å²	91	44.6 Å²	44.6	55%	0.552	23%	0.226	S	C	*	.	H	α-helix	trans	-58.8	-38.2	173.6	178.1	0	0	0	0	110	E771 S1331	E771-V1327 WeakPolarHBondContact OE1-CB 3.25Å; E771-V1327 PolarHBondContact OE1-N 3.44Å; E771-V1327 WeakPolarHBondContact OE2-CG2 3.38Å; E771-V1327 PolarHBondContact OE2-N 2.9Å; V1327-S1331 WeakPolarHBondContact O-CB 3.44Å; V1327-S1331 PolarHBondContact O-N 3.45Å
1328	K	93.1	Very high	92.9	Very high	1 Å²	1	42.6 Å²	42.6	0%	0.004	22%	0.221	C	C	.	.	H	α-helix	trans	-61.3	-55.8	177.6	-76.8	-171.4	169.2	-173	0	113.2	C767 E770 E771 S1326 S1331 I1332 L1350	C767-K1328 HydrophobicContact CB-CB 3.91Å; C767-K1328 HydrophobicContact CB-CD 4.37Å; E770-K1328 IonicContact OE2-NZ 3.86Å; E770-K1328 PolarHBondContact OE2-NZ 3.49Å; E771-K1328 PolarHBondContact OE1-N 2.95Å; S1326-K1328 PolarHBondContact O-N 2.78Å; K1328-S1331 PolarHBondContact O-N 3.19Å; K1328-S1331 PolarHBondContact O-OG 2.78Å; K1328-I1332 PolarHBondContact O-N 2.76Å; K1328-L1350 HydrophobicContact CB-CD2 4.11Å; K1328-L1350 PolarHBondContact NZ-O 3.41Å
1329	M	94.9	Very high	93.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-68.2	-38.5	-178.6	-68.6	-68.1	-83.4	0	0	112.1	L760 D764 L1324 S1326 S1331 I1332 I1333 L1336 L1350	L760-M1329 HydrophobicContact CB-CE 4.38Å; L760-M1329 HydrophobicContact CD2-CE 3.88Å; D764-M1329 HydrophobicContact CB-CB 4.37Å; D764-M1329 HydrophobicContact CB-CG 3.91Å; D764-M1329 WeakPolarHBondContact OD1-CB 3.47Å; L1324-M1329 HydrophobicContact CB-CB 4.37Å; L1324-M1329 HydrophobicContact CD1-CB 4.21Å; L1324-M1329 HydrophobicContact CD2-CB 4.2Å; L1324-M1329 HydrophobicContact CG-CB 4.5Å; S1326-M1329 PolarHBondContact O-N 3Å; S1326-M1329 WeakPolarHBondContact OG-CB 3.47Å; S1326-M1329 WeakPolarHBondContact OG-CG 3.42Å; S1326-M1329 PolarHBondContact OG-N 2.73Å; M1329-S1331 VanDerWaalsContact C-N 3.26Å; M1329-S1331 PolarHBondContact O-N 3.4Å; M1329-I1332 VanDerWaalsContact O-CG1 3.31Å; M1329-I1332 WeakPolarHBondContact O-CG1 3.2Å; M1329-I1332 PolarHBondContact O-N 2.86Å; M1329-I1332 VanDerWaalsContact O-N 3.14Å; M1329-I1332 HydrophobicContact SD-CD1 3.91Å; M1329-I1332 HydrophobicContact SD-CG1 4.42Å; M1329-I1333 PolarHBondContact O-N 2.92Å; M1329-L1336 HydrophobicContact CE-CD1 3.96Å; M1329-L1350 HydrophobicContact SD-CD1 4.5Å; M1329-L1350 HydrophobicContact SD-CD2 3.97Å
1330	A	94.5	Very high	93	Very high	19 Å²	19	54.1 Å²	54.1	16%	0.157	27%	0.27	C	S	.	.	H	α-helix	trans	-57.9	-38.9	173.7	0	0	0	0	0	111.9	V805 S1326 I1332 I1333	V805-A1330 HydrophobicContact CB-CB 4.48Å; V805-A1330 HydrophobicContact CG1-CB 3.75Å; V805-A1330 HydrophobicContact CG2-CB 3.99Å; S1326-A1330 WeakPolarHBondContact O-CB 3.26Å; S1326-A1330 PolarHBondContact O-N 3.4Å; A1330-I1332 VanDerWaalsContact C-N 3.28Å; A1330-I1332 PolarHBondContact O-N 3.07Å; A1330-I1333 WeakPolarHBondContact O-CB 3.44Å; A1330-I1333 VanDerWaalsContact O-CG2 3.27Å; A1330-I1333 WeakPolarHBondContact O-CG2 3.39Å; A1330-I1333 PolarHBondContact O-N 3.15Å
1331	S	93	Very high	92.9	Very high	67 Å²	67	55.7 Å²	55.7	47%	0.469	28%	0.278	S	S	.	.	H	α-helix	trans	-64.9	-28.4	178	81.2	0	0	0	0	114	V1327 K1328 M1329	V1327-S1331 WeakPolarHBondContact O-CB 3.44Å; V1327-S1331 PolarHBondContact O-N 3.45Å; K1328-S1331 PolarHBondContact O-N 3.19Å; K1328-S1331 PolarHBondContact O-OG 2.78Å; M1329-S1331 VanDerWaalsContact C-N 3.26Å; M1329-S1331 PolarHBondContact O-N 3.4Å
1332	I	94.1	Very high	92.8	Very high	3 Å²	3	54.1 Å²	54.1	2%	0.015	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	8.5	-178.8	66.4	163.9	0	0	0	114	K1328 M1329 A1330 E1334 L1335 L1336 I1346 A1349 L1350	K1328-I1332 PolarHBondContact O-N 2.76Å; M1329-I1332 VanDerWaalsContact O-CG1 3.31Å; M1329-I1332 WeakPolarHBondContact O-CG1 3.2Å; M1329-I1332 PolarHBondContact O-N 2.86Å; M1329-I1332 VanDerWaalsContact O-N 3.14Å; M1329-I1332 HydrophobicContact SD-CD1 3.91Å; M1329-I1332 HydrophobicContact SD-CG1 4.42Å; A1330-I1332 VanDerWaalsContact C-N 3.28Å; A1330-I1332 PolarHBondContact O-N 3.07Å; I1332-E1334 PolarHBondContact O-N 3.02Å; I1332-E1334 VanDerWaalsContact O-N 3.12Å; I1332-L1335 HydrophobicContact CB-CB 4.37Å; I1332-L1335 HydrophobicContact CB-CD1 4.16Å; I1332-L1335 HydrophobicContact CG2-CD1 4.07Å; I1332-L1335 WeakPolarHBondContact O-CA 3.17Å; I1332-L1335 WeakPolarHBondContact O-CB 3.39Å; I1332-L1335 PolarHBondContact O-N 3.21Å; I1332-L1336 HydrophobicContact CD1-CD1 4.04Å; I1332-L1336 HydrophobicContact CD1-CD2 4.16Å; I1332-L1336 HydrophobicContact CD1-CG 4.05Å; I1332-L1336 HydrophobicContact CG1-CD1 4.02Å; I1332-L1336 HydrophobicContact CG1-CG 4.17Å; I1332-L1336 PolarHBondContact O-N 3.45Å; I1332-I1346 HydrophobicContact CD1-CG1 4.49Å; I1332-I1346 HydrophobicContact CD1-CG2 3.79Å; I1332-A1349 HydrophobicContact CG2-CB 3.45Å; I1332-A1349 VanDerWaalsContact CG2-CB 3.45Å; I1332-L1350 HydrophobicContact CD1-CD1 4.16Å; I1332-L1350 HydrophobicContact CD1-CD2 3.88Å; I1332-L1350 HydrophobicContact CD1-CG 4.07Å
1333	I	94.3	Very high	92.5	Very high	17 Å²	17	56 Å²	56	9%	0.087	29%	0.287	C	S	.	.	H	α-helix	trans	-51.9	-39.4	-175.8	-165.3	173.3	0	0	0	113.1	L803 V805 L1324 M1329 A1330 L1336 R1337	L803-I1333 HydrophobicContact CB-CD1 3.83Å; L803-I1333 HydrophobicContact CB-CG1 3.75Å; L803-I1333 HydrophobicContact CD1-CG1 4.13Å; V805-I1333 HydrophobicContact CG2-CD1 4.13Å; L1324-I1333 HydrophobicContact CD1-CB 4.38Å; L1324-I1333 HydrophobicContact CD1-CD1 4.31Å; L1324-I1333 HydrophobicContact CD1-CG1 4.13Å; M1329-I1333 PolarHBondContact O-N 2.92Å; A1330-I1333 WeakPolarHBondContact O-CB 3.44Å; A1330-I1333 VanDerWaalsContact O-CG2 3.27Å; A1330-I1333 WeakPolarHBondContact O-CG2 3.39Å; A1330-I1333 PolarHBondContact O-N 3.15Å; I1333-L1336 PolarHBondContact O-N 3.28Å; I1333-R1337 WeakPolarHBondContact O-CB 3.49Å; I1333-R1337 WeakPolarHBondContact O-CD 3.44Å; I1333-R1337 VanDerWaalsContact O-CG 3.25Å; I1333-R1337 WeakPolarHBondContact O-CG 3.36Å; I1333-R1337 PolarHBondContact O-N 3.37Å
1334	E	93.4	Very high	92.3	Very high	120 Å²	120	58 Å²	58	56%	0.561	30%	0.302	S	S	*	.	H	α-helix	trans	-71.6	-28.5	176.6	-63.8	-57.2	105.5	0	0	113.4	I1332 R1337 A1338	I1332-E1334 PolarHBondContact O-N 3.02Å; I1332-E1334 VanDerWaalsContact O-N 3.12Å; E1334-R1337 VanDerWaalsContact OE1-CD 3.29Å; E1334-R1337 WeakPolarHBondContact OE1-CD 3.34Å; E1334-R1337 IonicContact OE1-CZ 3.33Å; E1334-R1337 IonicContact OE1-NE 3.7Å; E1334-R1337 IonicContact OE1-NH1 2.78Å; E1334-R1337 PolarHBondContact OE1-NH1 3.4Å; E1334-A1338 PolarHBondContact O-N 3.19Å
1335	L	93.4	Very high	92.1	Very high	49 Å²	49	59.3 Å²	59.3	26%	0.257	31%	0.313	S	S	.	.	H	α-helix	trans	-75	-30.9	174.6	-56.9	179.8	0	0	0	111.9	I1332 A1338 N1342 A1345 I1346	I1332-L1335 HydrophobicContact CB-CB 4.37Å; I1332-L1335 HydrophobicContact CB-CD1 4.16Å; I1332-L1335 HydrophobicContact CG2-CD1 4.07Å; I1332-L1335 WeakPolarHBondContact O-CA 3.17Å; I1332-L1335 WeakPolarHBondContact O-CB 3.39Å; I1332-L1335 PolarHBondContact O-N 3.21Å; L1335-A1338 WeakPolarHBondContact O-CB 3.38Å; L1335-N1342 HydrophobicContact CD2-CB 4.47Å; L1335-A1345 HydrophobicContact CD1-CB 3.78Å; L1335-A1345 HydrophobicContact CD2-CB 4.48Å; L1335-I1346 HydrophobicContact CB-CD1 4.15Å; L1335-I1346 HydrophobicContact CB-CG1 3.79Å; L1335-I1346 HydrophobicContact CD1-CG1 3.96Å
1336	L	92.4	Very high	92	Very high	16 Å²	16	53.9 Å²	53.9	8%	0.084	29%	0.291	C	S	.	.	H	α-helix	trans	-75.4	-41.2	174.4	-63.9	175	0	0	0	111.6	L760 L790 L803 M1329 I1332 I1333 A1338 I1346	L760-L1336 HydrophobicContact CD2-CD1 4.28Å; L760-L1336 HydrophobicContact CD2-CD2 4.22Å; L790-L1336 HydrophobicContact CD1-CD2 4.15Å; L803-L1336 HydrophobicContact CD1-CB 3.68Å; L803-L1336 HydrophobicContact CD1-CD1 4.03Å; M1329-L1336 HydrophobicContact CE-CD1 3.96Å; I1332-L1336 HydrophobicContact CD1-CD1 4.04Å; I1332-L1336 HydrophobicContact CD1-CD2 4.16Å; I1332-L1336 HydrophobicContact CD1-CG 4.05Å; I1332-L1336 HydrophobicContact CG1-CD1 4.02Å; I1332-L1336 HydrophobicContact CG1-CG 4.17Å; I1332-L1336 PolarHBondContact O-N 3.45Å; I1333-L1336 PolarHBondContact O-N 3.28Å; L1336-A1338 PolarHBondContact O-N 3.11Å; L1336-I1346 HydrophobicContact CD2-CD1 4.27Å
1337	R	90.4	Very high	91.9	Very high	126 Å²	126	56.4 Å²	56.4	48%	0.475	30%	0.302	S	S	.	.	H	α-helix	trans	-65.8	-19.4	172.8	-73.6	166.4	168.9	-177.7	-5.7	113.6	L803 I1333 E1334	L803-R1337 HydrophobicContact CD1-CG 4.44Å; L803-R1337 PolarHBondContact O-NH2 3.28Å; I1333-R1337 WeakPolarHBondContact O-CB 3.49Å; I1333-R1337 WeakPolarHBondContact O-CD 3.44Å; I1333-R1337 VanDerWaalsContact O-CG 3.25Å; I1333-R1337 WeakPolarHBondContact O-CG 3.36Å; I1333-R1337 PolarHBondContact O-N 3.37Å; E1334-R1337 VanDerWaalsContact OE1-CD 3.29Å; E1334-R1337 WeakPolarHBondContact OE1-CD 3.34Å; E1334-R1337 IonicContact OE1-CZ 3.33Å; E1334-R1337 IonicContact OE1-NE 3.7Å; E1334-R1337 IonicContact OE1-NH1 2.78Å; E1334-R1337 PolarHBondContact OE1-NH1 3.4Å
1338	A	89.4	Confident	91.8	Very high	24 Å²	24	58 Å²	58	20%	0.198	31%	0.307	C	S	.	.	S	Bend	trans	-61.7	139.9	-174.7	0	0	0	0	0	113	R798 E1334 L1335 L1336 R1340	R798-A1338 PolarHBondContact NH1-O 3.27Å; E1334-A1338 PolarHBondContact O-N 3.19Å; L1335-A1338 WeakPolarHBondContact O-CB 3.38Å; L1336-A1338 PolarHBondContact O-N 3.11Å; A1338-R1340 WeakPolarHBondContact CB-O 3.29Å; A1338-R1340 PolarHBondContact O-N 3.44Å; A1338-R1340 VanDerWaalsContact O-N 3.15Å
1339	P	83.9	Confident	91.7	Very high	106 Å²	106	58.8 Å²	58.8	69%	0.688	31%	0.314	S	S	*	.	S	Bend	trans	-62.1	-27.1	179.6	25.2	-34.5	0	0	0	112.4	R798	R798-P1339 PolarHBondContact NH2-O 2.97Å
1340	R	87.3	Confident	91.5	Very high	222 Å²	222	58.8 Å²	58.8	84%	0.838	31%	0.314	S	S	*	.	S	Bend	trans	-121.5	122	167.6	-61.8	-178.9	69.5	-177.3	1.7	108.5	A1338 N1342	A1338-R1340 WeakPolarHBondContact CB-O 3.29Å; A1338-R1340 PolarHBondContact O-N 3.44Å; A1338-R1340 VanDerWaalsContact O-N 3.15Å; R1340-N1342 PolarHBondContact O-N 3.15Å
1341	L	89.5	Confident	91.3	Very high	38 Å²	38	59.9 Å²	59.9	20%	0.199	32%	0.319	C	S	.	.			trans	-67.1	127.1	179.5	-62.2	173.9	0	0	0	110.5	L790 S1343 I1346	L790-L1341 HydrophobicContact CB-CD1 3.71Å; L790-L1341 HydrophobicContact CD1-CD1 4.39Å; L1341-S1343 PolarHBondContact O-N 3.32Å; L1341-I1346 HydrophobicContact CB-CD1 4.49Å
1342	N	91.4	Very high	91	Very high	74 Å²	74	57.7 Å²	57.7	40%	0.396	30%	0.304	S	S	.	.			trans	-87.9	82.9	176.4	-171.5	-7.2	0	0	0	110.4	L1335 R1340 S1344 A1345 I1346	L1335-N1342 HydrophobicContact CD2-CB 4.47Å; R1340-N1342 PolarHBondContact O-N 3.15Å; N1342-S1344 VanDerWaalsContact C-N 3.33Å; N1342-S1344 PolarHBondContact O-N 3.35Å; N1342-S1344 PolarHBondContact OD1-OG 3.06Å; N1342-A1345 HydrophobicContact CB-CB 4.08Å; N1342-A1345 WeakPolarHBondContact ND2-CB 3.42Å; N1342-A1345 PolarHBondContact O-N 2.73Å; N1342-A1345 VanDerWaalsContact O-N 3.15Å; N1342-A1345 PolarHBondContact OD1-N 3.46Å; N1342-I1346 WeakPolarHBondContact O-CG1 3.47Å; N1342-I1346 PolarHBondContact O-N 3.39Å
1343	S	91	Very high	90.1	Very high	55 Å²	55	60.7 Å²	60.7	39%	0.385	32%	0.319	S	S	.	.	H	α-helix	trans	-51.4	-44.8	-175.3	173.2	0	0	0	0	113.6	L1341 I1346 K1347	L1341-S1343 PolarHBondContact O-N 3.32Å; S1343-I1346 PolarHBondContact O-N 3.06Å; S1343-K1347 WeakPolarHBondContact O-CB 3.43Å; S1343-K1347 PolarHBondContact O-N 2.96Å
1344	S	92	Very high	88.7	Confident	75 Å²	75	65 Å²	65	52%	0.524	35%	0.35	S	S	.	.	H	α-helix	trans	-68.9	-37.9	-179.5	52.9	0	0	0	0	112.9	N1342 L1348	N1342-S1344 VanDerWaalsContact C-N 3.33Å; N1342-S1344 PolarHBondContact O-N 3.35Å; N1342-S1344 PolarHBondContact OD1-OG 3.06Å; S1344-L1348 WeakPolarHBondContact O-CB 3.27Å; S1344-L1348 VanDerWaalsContact O-CG 3.26Å; S1344-L1348 WeakPolarHBondContact O-CG 3.16Å; S1344-L1348 PolarHBondContact O-N 2.97Å
1345	A	92.6	Very high	87	Confident	28 Å²	28	63 Å²	63	23%	0.231	34%	0.341	C	S	.	.	H	α-helix	trans	-68.6	-41.1	175.8	0	0	0	0	0	112.2	L1335 N1342 A1349	L1335-A1345 HydrophobicContact CD1-CB 3.78Å; L1335-A1345 HydrophobicContact CD2-CB 4.48Å; N1342-A1345 HydrophobicContact CB-CB 4.08Å; N1342-A1345 WeakPolarHBondContact ND2-CB 3.42Å; N1342-A1345 PolarHBondContact O-N 2.73Å; N1342-A1345 VanDerWaalsContact O-N 3.15Å; N1342-A1345 PolarHBondContact OD1-N 3.46Å; A1345-A1349 WeakPolarHBondContact O-CB 3.42Å; A1345-A1349 PolarHBondContact O-N 3.19Å
1346	I	92.8	Very high	85.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-65.8	-43.8	175.9	-63.5	165.6	0	0	0	110.4	V783 M787 I1332 L1335 L1336 L1341 N1342 S1343 A1349 L1350	V783-I1346 HydrophobicContact CG1-CG2 4.39Å; M787-I1346 HydrophobicContact CE-CB 4.14Å; M787-I1346 HydrophobicContact CE-CD1 4.17Å; M787-I1346 HydrophobicContact CE-CG2 3.5Å; M787-I1346 HydrophobicContact SD-CB 4.31Å; M787-I1346 HydrophobicContact SD-CD1 4.17Å; M787-I1346 HydrophobicContact SD-CG2 4.31Å; I1332-I1346 HydrophobicContact CD1-CG1 4.49Å; I1332-I1346 HydrophobicContact CD1-CG2 3.79Å; L1335-I1346 HydrophobicContact CB-CD1 4.15Å; L1335-I1346 HydrophobicContact CB-CG1 3.79Å; L1335-I1346 HydrophobicContact CD1-CG1 3.96Å; L1336-I1346 HydrophobicContact CD2-CD1 4.27Å; L1341-I1346 HydrophobicContact CB-CD1 4.49Å; N1342-I1346 WeakPolarHBondContact O-CG1 3.47Å; N1342-I1346 PolarHBondContact O-N 3.39Å; S1343-I1346 PolarHBondContact O-N 3.06Å; I1346-A1349 PolarHBondContact O-N 3.49Å; I1346-L1350 HydrophobicContact CG2-CD1 3.78Å; I1346-L1350 HydrophobicContact CG2-CG 4.2Å; I1346-L1350 WeakPolarHBondContact O-CG 3.39Å; I1346-L1350 PolarHBondContact O-N 2.99Å
1347	K	92.4	Very high	83.1	Confident	53 Å²	53	65.2 Å²	65.2	23%	0.23	36%	0.36	C	S	.	.	H	α-helix	trans	-55.7	-53.5	174.7	-176.5	166.8	179.4	157.7	0	111.4	V780 V783 D784 S1343 A1349 T1351	V780-K1347 VanDerWaalsContact CG2-NZ 3.26Å; V783-K1347 HydrophobicContact CG1-CB 4.33Å; D784-K1347 WeakPolarHBondContact OD1-CD 3.34Å; D784-K1347 IonicContact OD1-NZ 2.81Å; D784-K1347 PolarHBondContact OD1-NZ 2.76Å; D784-K1347 IonicContact OD2-NZ 2.93Å; D784-K1347 PolarHBondContact OD2-NZ 3.5Å; S1343-K1347 WeakPolarHBondContact O-CB 3.43Å; S1343-K1347 PolarHBondContact O-N 2.96Å; K1347-A1349 PolarHBondContact O-N 3.39Å; K1347-T1351 PolarHBondContact O-N 2.87Å; K1347-T1351 VanDerWaalsContact O-N 3.11Å; K1347-T1351 PolarHBondContact O-OG1 2.97Å
1348	L	91	Very high	81	Confident	125 Å²	125	65.4 Å²	65.4	65%	0.654	38%	0.375	S	S	*	.	H	α-helix	trans	-59	-43.4	178.1	-75.1	168.7	0	0	0	112.8	S1344 A1352	S1344-L1348 WeakPolarHBondContact O-CB 3.27Å; S1344-L1348 VanDerWaalsContact O-CG 3.26Å; S1344-L1348 WeakPolarHBondContact O-CG 3.16Å; S1344-L1348 PolarHBondContact O-N 2.97Å; L1348-A1352 WeakPolarHBondContact O-CB 3.12Å; L1348-A1352 PolarHBondContact O-N 3.44Å
1349	A	91.4	Very high	78.4	Confident	17 Å²	17	75.5 Å²	75.5	14%	0.14	41%	0.408	C	S	.	.	H	α-helix	trans	-68	-48.4	-178.6	0	0	0	0	0	112.5	I1332 A1345 I1346 K1347 T1351 A1352	I1332-A1349 HydrophobicContact CG2-CB 3.45Å; I1332-A1349 VanDerWaalsContact CG2-CB 3.45Å; A1345-A1349 WeakPolarHBondContact O-CB 3.42Å; A1345-A1349 PolarHBondContact O-N 3.19Å; I1346-A1349 PolarHBondContact O-N 3.49Å; K1347-A1349 PolarHBondContact O-N 3.39Å; A1349-T1351 PolarHBondContact O-N 3.5Å; A1349-A1352 WeakPolarHBondContact O-CB 3.43Å; A1349-A1352 PolarHBondContact O-N 2.85Å
1350	L	91.1	Very high	76	Confident	0 Å²	0	82.1 Å²	82.1	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-68.7	-34.9	-177.7	-66	-178	0	0	0	112.3	V783 L786 K1328 M1329 I1332 I1346 A1352	V783-L1350 HydrophobicContact CG1-CD1 3.99Å; V783-L1350 HydrophobicContact CG2-CB 3.85Å; V783-L1350 HydrophobicContact CG2-CD1 4.26Å; L786-L1350 HydrophobicContact CD2-CD1 3.91Å; K1328-L1350 HydrophobicContact CB-CD2 4.11Å; K1328-L1350 PolarHBondContact NZ-O 3.41Å; M1329-L1350 HydrophobicContact SD-CD1 4.5Å; M1329-L1350 HydrophobicContact SD-CD2 3.97Å; I1332-L1350 HydrophobicContact CD1-CD1 4.16Å; I1332-L1350 HydrophobicContact CD1-CD2 3.88Å; I1332-L1350 HydrophobicContact CD1-CG 4.07Å; I1346-L1350 HydrophobicContact CG2-CD1 3.78Å; I1346-L1350 HydrophobicContact CG2-CG 4.2Å; I1346-L1350 WeakPolarHBondContact O-CG 3.39Å; I1346-L1350 PolarHBondContact O-N 2.99Å; L1350-A1352 VanDerWaalsContact C-N 3.3Å; L1350-A1352 PolarHBondContact O-N 3.44Å
1351	T	90.3	Very high	73.2	Confident	43 Å²	43	77.1 Å²	77.1	26%	0.264	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	2.3	174.5	65.6	0	0	0	0	114	V783 K1347 A1349 Q1353	V783-T1351 HydrophobicContact CG2-CG2 4.06Å; K1347-T1351 PolarHBondContact O-N 2.87Å; K1347-T1351 VanDerWaalsContact O-N 3.11Å; K1347-T1351 PolarHBondContact O-OG1 2.97Å; A1349-T1351 PolarHBondContact O-N 3.5Å; T1351-Q1353 PolarHBondContact O-N 2.94Å
1352	A	87	Confident	70.2	Confident	20 Å²	20	80 Å²	80	17%	0.165	44%	0.442	C	S	.	.			trans	-75.4	96	-178.6	0	0	0	0	0	112.1	L1348 A1349 L1350 S1354 Q1355	L1348-A1352 WeakPolarHBondContact O-CB 3.12Å; L1348-A1352 PolarHBondContact O-N 3.44Å; A1349-A1352 WeakPolarHBondContact O-CB 3.43Å; A1349-A1352 PolarHBondContact O-N 2.85Å; L1350-A1352 VanDerWaalsContact C-N 3.3Å; L1350-A1352 PolarHBondContact O-N 3.44Å; A1352-S1354 PolarHBondContact O-N 3.46Å; A1352-Q1355 HydrophobicContact CB-CG 4.1Å; A1352-Q1355 PolarHBondContact O-N 3.16Å; A1352-Q1355 VanDerWaalsContact O-N 3.17Å
1353	Q	75	Confident	67.1	Low	67 Å²	67	81.7 Å²	81.7	31%	0.313	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-68	-13.3	177.1	-62.9	-58.1	-24.4	0	0	114	E770 T1351 Q1355 V1356 C1357	E770-Q1353 PolarHBondContact OE1-NE2 3.4Å; T1351-Q1353 PolarHBondContact O-N 2.94Å; Q1353-Q1355 PolarHBondContact O-N 2.93Å; Q1353-V1356 PolarHBondContact O-N 2.8Å; Q1353-C1357 PolarHBondContact O-N 2.79Å
1354	S	65.3	Low	64.2	Low	107 Å²	107	85.4 Å²	85.4	75%	0.748	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-65.9	-17.2	170.8	52.7	0	0	0	0	114.1	A1352	A1352-S1354 PolarHBondContact O-N 3.46Å
1355	Q	57	Low	61.2	Low	78 Å²	78	91.2 Å²	91.2	36%	0.364	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-85.2	-23.7	176.4	-57.9	-173.5	6	0	0	112.7	A1352 Q1353	A1352-Q1355 HydrophobicContact CB-CG 4.1Å; A1352-Q1355 PolarHBondContact O-N 3.16Å; A1352-Q1355 VanDerWaalsContact O-N 3.17Å; Q1353-Q1355 PolarHBondContact O-N 2.93Å
1356	V	55.7	Low	58.1	Low	12 Å²	12	94.1 Å²	94.1	7%	0.073	52%	0.516	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-40.1	-174.7	-178.8	0	0	0	0	111.8	E770 Q1353 V1358	E770-V1356 HydrophobicContact CG-CG1 4.28Å; E770-V1356 HydrophobicContact CG-CG2 4.05Å; E770-V1356 WeakPolarHBondContact O-CG1 3.32Å; Q1353-V1356 PolarHBondContact O-N 2.8Å; V1356-V1358 PolarHBondContact O-N 3.32Å
1357	C	49.7	Very low	54.9	Low	99 Å²	99	100.8 Å²	100.8	67%	0.669	55%	0.552	S	S	*	*			trans	-75.7	83.5	-175.7	-86.7	0	0	0	0	113.1	Q1353 R1359	Q1353-C1357 PolarHBondContact O-N 2.79Å; C1357-R1359 PolarHBondContact O-N 3.25Å
1358	V	45	Very low	51.9	Low	130 Å²	130	108.7 Å²	108.7	79%	0.788	58%	0.582	S	S	*	*			trans	-57.9	102.4	163.3	-178.5	0	0	0	0	108.9	V1356 R1360	V1356-V1358 PolarHBondContact O-N 3.32Å; V1358-R1360 PolarHBondContact O-N 3.24Å
1359	R	34.6	Very low	48.9	Very low	236 Å²	236	116.1 Å²	116.1	89%	0.891	61%	0.609	S	S	*	*			trans	-57	106.9	178.8	-78.2	-180	170.3	161.1	-2.6	109.6	C1357 S1361	C1357-R1359 PolarHBondContact O-N 3.25Å; R1359-S1361 VanDerWaalsContact C-N 3.26Å; R1359-S1361 PolarHBondContact O-N 2.9Å
1360	R	33.1	Very low	46.7	Very low	245 Å²	245	121.1 Å²	121.1	93%	0.925	63%	0.633	S	S	*	*			trans	-62	86.2	171.4	-74.9	-174.8	175	177.7	-0.6	110.1	V1358 S1362	V1358-R1360 PolarHBondContact O-N 3.24Å; R1360-S1362 PolarHBondContact O-N 2.66Å
1361	S	29.2	Very low	44.4	Very low	117 Å²	117	127.5 Å²	127.5	82%	0.818	67%	0.666	S	S	*	*			trans	-65.9	101.1	178.3	-169.7	0	0	0	0	109.5	R1359	R1359-S1361 VanDerWaalsContact C-N 3.26Å; R1359-S1361 PolarHBondContact O-N 2.9Å
1362	S	26.5	Very low	41.9	Very low	100 Å²	100	132.2 Å²	132.2	70%	0.699	69%	0.688	S	S	*	*			trans	-69.2	140.6	176.3	57.7	0	0	0	0	110.9	R1360	R1360-S1362 PolarHBondContact O-N 2.66Å
1363	S	26.1	Very low	39.2	Very low	108 Å²	108	138.8 Å²	138.8	76%	0.755	72%	0.719	S	S	*	*			trans	74.2	78.7	174.6	79.2	0	0	0	0	118.4
1364	V	31.5	Very low	37	Very low	133 Å²	133	143.3 Å²	143.3	81%	0.806	75%	0.745	S	S	*	*				-127	107.9	129	-177.1	0	0	0	0	108.7
1365	H	27.6	Very low	35.1	Very low	198 Å²	198	145.7 Å²	145.7	92%	0.917	74%	0.744	S	S	*	*			trans	-94.9	109.2	157.5	-90.8	36.4	0	0	0	107
1366	S	28.9	Very low	33.5	Very low	88 Å²	88	150.5 Å²	150.5	62%	0.615	77%	0.771	S	S	*	*			trans	-168.1	116.9	156.5	-165.4	0	0	0	0	111.4
1367	N	25.6	Very low	31.8	Very low	141 Å²	141	161.2 Å²	161.2	75%	0.754	83%	0.825	S	S	*	*			trans	34.6	100.9	146.3	-49.7	-15.1	0	0	0	118.5
1368	Y	28	Very low	30.3	Very low	219 Å²	219	166.3 Å²	166.3	86%	0.859	84%	0.838	S	S	*	*				-173.5	129.4	106.6	-102.7	-69.9	0	0	0	111
1369	F	27.9	Very low	29	Very low	281 Å²	281	169.6 Å²	169.6	100%	1.232	84%	0.843	S	S	*	*			trans	62.9	0	-176	-76.2	-84.7	0	0	0	116.7

Retrieved 1,369 of 1,369 residues in 1536.7 ms (Link to these results)

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