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Anaphase-promoting complex subunit 2

Together with the RING-H2 protein ANAPC11, constitutes the catalytic component of the anaphase promoting complex/cyclosome (APC/C), a cell cycle-regulated E3 ubiquitin ligase that controls progression through mitosis and the G1 phase of the cell cycle. The APC/C complex acts by mediating ubiquitination and subsequent degradation of target proteins: it mainly mediates the formation of 'Lys-11'-linked polyubiquitin chains and, to a lower extent, the formation of 'Lys-48'- and 'Lys-63'-linked polyubiquitin chains. The APC/C complex catalyzes assembly of branched 'Lys-11'-/'Lys-48'-linked branched ubiquitin chains on target proteins. The CDC20-APC/C complex positively regulates the formation of synaptic vesicle clustering at active zone to the presynaptic membrane in postmitotic neurons. CDC20-APC/C-induced degradation of NEUROD2 drives presynaptic differentiation.

AlphaFold DB , UniProt , Accession A0A060WHW1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene anapc2, Length 812 aa.

						>A0A060WHW1_ONCMY|A0A060WHW1|anapc2
MMDSTEMFFSVPQGLPSAWDTVTAALVSPVSNDITMSDESLSEGLSLLCSNSLGQFLEGWLMETLQVRLTTAIAPEFWAGMKQPENELEEKDRARILLMAFRTLLDRLQPFLGGLERLGTWQDEGRGGLCGPGARGLRERAFSVIRAILLFSPSAVLQERILEFYSRTFSVHMTQEGEAGEAEEGGGGPEGGVCQGCTVPTQRCWCQQALEQLQELSQVLSRLQLLERVSSEAVTSILHKLIEQRMEQHCRGEYESSFLFDFQEWLELVLGWLSRVFASDVGGVSGLGTVPNGTGSGAGVVGQPANAVLQRWRCHMHQFFCRIYVNMRIEELFSIIRDFPESKPAIDDLKFCLERTNQRQQLLTSLKTAFDTRLLHPGVHTSDIITVYISAIKALRELDPSMVILQVACQPIRKYLRTREDTVRQIVASLTGDAEGCSDLANELSRADPVTLETQDSEDEGSDPEEWTPDPKDAVTDKTGSKRRSSDIITLLVSIYGSKEIFIDEYRTVLADRLLHQFNYNTAREIRNVELLKLRFGESHMHYCEVMLKDVADSRRINTNIREEESRLAEEEQPPLALSAMILSSEFWPTLKEEKMELPPLASQAMEAYTHRYEKLKAMRTLSWKPHLGLVTLDVELEDRTLTNLTVSPIHAAIILHFQDKSSWTLEELSGVLGVPQEMVRRKLALWQQQGVLKEEAGGHYSVLETGSSRERPERGVMLIDSDEEGDSNTTTQSEQREEKLQLFWAYIQAMLTNLETMTLERIHSMLRMFVATGPIVTEMDVNELQAFLQRKVRDHQLIMSAGIYRLPKSTN
					

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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	40.6	Very low	39.5	Very low	245 Å²	245	155.8 Å²	155.8	100%	1.207	82%	0.819	S	S	*	*				0	105	0	-84.6	-174.5	-175.7	0	0	107.9
2	M	33.5	Very low	41.3	Very low	189 Å²	189	147.5 Å²	147.5	93%	0.931	78%	0.781	S	S	*	*			trans	150.9	113.4	151.8	-86.3	-174	175.8	0	0	106.7
3	D	35.5	Very low	42.8	Very low	153 Å²	153	151.5 Å²	151.5	82%	0.818	79%	0.793	S	S	*	*			trans	-60.2	144.7	-166	-66.7	-54.9	0	0	0	113.8
4	S	33.1	Very low	44.7	Very low	121 Å²	121	143 Å²	143	85%	0.846	76%	0.76	S	S	*	*			trans	-133.7	88.6	154.1	-65.6	0	0	0	0	106.4	E6	S4-E6 PolarHBondContact O-N 3.18Å
5	T	36.5	Very low	46.9	Very low	123 Å²	123	135.1 Å²	135.1	76%	0.755	72%	0.717	S	S	*	*			trans	-53.6	119.7	177.3	-18	0	0	0	0	109.7	M7	T5-M7 PolarHBondContact O-N 2.99Å
6	E	38.1	Very low	48.9	Very low	162 Å²	162	131.3 Å²	131.3	76%	0.757	70%	0.703	S	S	*	*			trans	-60.5	98.8	163.7	-71.5	-179.9	156.9	0	0	108.5	S4 F8	S4-E6 PolarHBondContact O-N 3.18Å; E6-F8 HydrophobicContact CB-CD2 4.44Å; E6-F8 HydrophobicContact CB-CE2 4.44Å; E6-F8 PolarHBondContact O-N 3.07Å; E6-F8 VanDerWaalsContact O-N 3.11Å
7	M	35.9	Very low	50.7	Low	156 Å²	156	127.5 Å²	127.5	77%	0.768	69%	0.689	S	S	*	*			trans	-73.8	94.3	163.3	-80	-153.7	-80.9	0	0	108.2	T5 F9	T5-M7 PolarHBondContact O-N 2.99Å; M7-F9 PolarHBondContact O-N 3.35Å
8	F	37.6	Very low	52.2	Low	182 Å²	182	120.9 Å²	120.9	80%	0.798	66%	0.655	S	S	*	*			trans	-60.6	100.2	157.3	-83.5	-91.6	0	0	0	108	E6 S10	E6-F8 HydrophobicContact CB-CD2 4.44Å; E6-F8 HydrophobicContact CB-CE2 4.44Å; E6-F8 PolarHBondContact O-N 3.07Å; E6-F8 VanDerWaalsContact O-N 3.11Å; F8-S10 PolarHBondContact O-N 3.22Å
9	F	41.8	Very low	53.8	Low	179 Å²	179	117.8 Å²	117.8	79%	0.785	63%	0.633	S	S	*	*			trans	-61.9	107.1	164.1	-83.1	-89.8	0	0	0	107.8	M7 V11	M7-F9 PolarHBondContact O-N 3.35Å; F9-V11 PolarHBondContact O-N 2.78Å
10	S	47.8	Very low	55.2	Low	112 Å²	112	116.9 Å²	116.9	78%	0.783	63%	0.627	S	S	*	*			trans	-65.3	105.6	165.6	58.5	0	0	0	0	107.6	F8 P12	F8-S10 PolarHBondContact O-N 3.22Å; S10-P12 WeakPolarHBondContact O-CD 3.1Å
11	V	54.7	Low	56.5	Low	92 Å²	92	113.5 Å²	113.5	56%	0.558	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-55.4	125.6	170.8	179.8	0	0	0	0	107.5	F9 Q13 L15 P16	F9-V11 PolarHBondContact O-N 2.78Å; V11-Q13 PolarHBondContact O-N 3.24Å; V11-L15 HydrophobicContact CG1-CB 4.12Å; V11-L15 HydrophobicContact CG1-CD2 4.34Å; V11-P16 HydrophobicContact CG1-CG 4.07Å
12	P	60.8	Low	58.4	Low	56 Å²	56	101.8 Å²	101.8	36%	0.364	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-51.9	129.3	175	-22.4	29.6	0	0	0	110	S10 G14 L15	S10-P12 WeakPolarHBondContact O-CD 3.1Å; P12-G14 PolarHBondContact O-N 2.83Å; P12-G14 VanDerWaalsContact O-N 3.15Å; P12-L15 HydrophobicContact CB-CB 4.39Å; P12-L15 HydrophobicContact CG-CD2 4.25Å; P12-L15 WeakPolarHBondContact O-CB 3.13Å; P12-L15 PolarHBondContact O-N 3.39Å; P12-L15 VanDerWaalsContact O-N 3.11Å
13	Q	61.2	Low	60.7	Low	200 Å²	200	93.5 Å²	93.5	94%	0.935	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	123.2	176.7	-74.5	-176.2	-10.9	0	0	109.1	V11	V11-Q13 PolarHBondContact O-N 3.24Å
14	G	68.2	Low	62.9	Low	32 Å²	32	89.1 Å²	89.1	33%	0.33	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.2	-8.2	179.9	0	0	0	0	0	116.2	P12 S17 A18	P12-G14 PolarHBondContact O-N 2.83Å; P12-G14 VanDerWaalsContact O-N 3.15Å; G14-S17 VanDerWaalsContact CA-OG 3.32Å; G14-S17 WeakPolarHBondContact CA-OG 3.24Å; G14-S17 PolarHBondContact O-OG 3.34Å; G14-A18 WeakPolarHBondContact O-CB 3.35Å; G14-A18 PolarHBondContact O-N 2.96Å
15	L	77.9	Confident	65.1	Low	24 Å²	24	83.8 Å²	83.8	13%	0.126	46%	0.462	C	S	.	.	H	α-helix	trans	-66.5	-42.8	178.8	-165	69.6	0	0	0	113.9	V11 P12 A18 W19 L47 L48 N51 L53	V11-L15 HydrophobicContact CG1-CB 4.12Å; V11-L15 HydrophobicContact CG1-CD2 4.34Å; P12-L15 HydrophobicContact CB-CB 4.39Å; P12-L15 HydrophobicContact CG-CD2 4.25Å; P12-L15 WeakPolarHBondContact O-CB 3.13Å; P12-L15 PolarHBondContact O-N 3.39Å; P12-L15 VanDerWaalsContact O-N 3.11Å; L15-A18 PolarHBondContact O-N 3.34Å; L15-W19 PolarHBondContact O-N 3Å; L15-L47 HydrophobicContact CB-CD2 4.43Å; L15-L47 HydrophobicContact CD1-CD2 3.79Å; L15-L47 HydrophobicContact CD1-CG 4.45Å; L15-L48 HydrophobicContact CD1-CD2 3.95Å; L15-N51 HydrophobicContact CD1-CB 4.46Å; L15-L53 HydrophobicContact CD1-CD1 3.99Å; L15-L53 HydrophobicContact CD2-CD1 3.71Å; L15-L53 HydrophobicContact CG-CD1 4.07Å
16	P	79.4	Confident	67.2	Low	74 Å²	74	78 Å²	78	48%	0.481	43%	0.426	S	S	.	.	H	α-helix	trans	-63.6	-43.1	174.9	-21.9	34.7	0	0	0	112.1	V11 A18 W19 D20	V11-P16 HydrophobicContact CG1-CG 4.07Å; P16-A18 VanDerWaalsContact C-N 3.33Å; P16-A18 PolarHBondContact O-N 2.94Å; P16-W19 PolarHBondContact O-N 3.48Å; P16-D20 WeakPolarHBondContact O-CB 3.33Å; P16-D20 VanDerWaalsContact O-CG 3.24Å; P16-D20 PolarHBondContact O-N 2.71Å
17	S	78.9	Confident	69.1	Low	67 Å²	67	72.5 Å²	72.5	47%	0.469	40%	0.403	S	S	.	.	H	α-helix	trans	-65.3	-34.8	177	49.1	0	0	0	0	112.7	G14 T21	G14-S17 VanDerWaalsContact CA-OG 3.32Å; G14-S17 WeakPolarHBondContact CA-OG 3.24Å; G14-S17 PolarHBondContact O-OG 3.34Å; S17-T21 VanDerWaalsContact O-CB 3.28Å; S17-T21 WeakPolarHBondContact O-CB 3.42Å; S17-T21 PolarHBondContact O-N 3.5Å; S17-T21 PolarHBondContact O-OG1 2.62Å
18	A	77.6	Confident	70.7	Confident	9 Å²	9	66.5 Å²	66.5	7%	0.074	38%	0.377	C	S	.	.	H	α-helix	trans	-68.5	-42.1	174.7	0	0	0	0	0	111.7	G14 L15 P16 T21 V22 L47	G14-A18 WeakPolarHBondContact O-CB 3.35Å; G14-A18 PolarHBondContact O-N 2.96Å; L15-A18 PolarHBondContact O-N 3.34Å; P16-A18 VanDerWaalsContact C-N 3.33Å; P16-A18 PolarHBondContact O-N 2.94Å; A18-T21 PolarHBondContact O-N 2.98Å; A18-V22 WeakPolarHBondContact O-CB 2.99Å; A18-V22 VanDerWaalsContact O-CG2 3.29Å; A18-V22 WeakPolarHBondContact O-CG2 3.22Å; A18-V22 PolarHBondContact O-N 3.31Å; A18-L47 HydrophobicContact CB-CD2 3.6Å
19	W	82.7	Confident	71.7	Confident	62 Å²	62	60.6 Å²	60.6	24%	0.235	36%	0.357	C	S	.	.	H	α-helix	trans	-61.7	-47	173.7	-176.6	-95.5	0	0	0	111.6	L15 P16 T21 V22 T23 L48 F56 L57 W60	L15-W19 PolarHBondContact O-N 3Å; P16-W19 PolarHBondContact O-N 3.48Å; W19-T21 PolarHBondContact O-N 3.44Å; W19-V22 PolarHBondContact O-N 3.28Å; W19-T23 HydrophobicContact CD2-CG2 4.09Å; W19-T23 HydrophobicContact CG-CG2 4.31Å; W19-T23 HydrophobicContact CZ2-CG2 4.06Å; W19-T23 WeakPolarHBondContact O-CB 3.13Å; W19-T23 VanDerWaalsContact O-CG2 3.26Å; W19-T23 WeakPolarHBondContact O-CG2 3.41Å; W19-T23 PolarHBondContact O-N 2.94Å; W19-T23 PolarHBondContact O-OG1 3.06Å; W19-L48 HydrophobicContact CB-CD2 4.33Å; W19-L48 HydrophobicContact CE3-CD1 4.18Å; W19-L48 HydrophobicContact CE3-CD2 3.94Å; W19-F56 HydrophobicContact CH2-CB 4.38Å; W19-L57 HydrophobicContact CE3-CD2 4.03Å; W19-L57 HydrophobicContact CH2-CD2 3.76Å; W19-L57 HydrophobicContact CH2-CG 4.4Å; W19-L57 HydrophobicContact CZ2-CD2 4.47Å; W19-L57 HydrophobicContact CZ3-CD2 3.51Å; W19-L57 HydrophobicContact CZ3-CG 4.05Å; W19-W60 HydrophobicContact CH2-CB 4.35Å; W19-W60 HydrophobicContact CZ2-CB 4.22Å; W19-W60 HydrophobicContact CZ2-CD2 4.37Å; W19-W60 AromaticContact CZ2-CG 3.92Å; W19-W60 HydrophobicContact CZ2-CG 3.92Å
20	D	82.6	Confident	72.2	Confident	99 Å²	99	57.1 Å²	57.1	53%	0.529	35%	0.35	S	S	.	.	H	α-helix	trans	-64	-39.7	178.8	-68.6	-22.4	0	0	0	111.9	P16 T23 A24	P16-D20 WeakPolarHBondContact O-CB 3.33Å; P16-D20 VanDerWaalsContact O-CG 3.24Å; P16-D20 PolarHBondContact O-N 2.71Å; D20-T23 WeakPolarHBondContact CA-OG1 3.33Å; D20-T23 PolarHBondContact O-OG1 2.94Å; D20-A24 WeakPolarHBondContact O-CB 3.5Å; D20-A24 PolarHBondContact O-N 3.23Å
21	T	81.2	Confident	72	Confident	46 Å²	46	56.6 Å²	56.6	28%	0.282	35%	0.346	S	S	.	.	H	α-helix	trans	-65.8	-44.6	178.2	-57	0	0	0	0	111.5	S17 A18 W19 A25 M36 L41	S17-T21 VanDerWaalsContact O-CB 3.28Å; S17-T21 WeakPolarHBondContact O-CB 3.42Å; S17-T21 PolarHBondContact O-N 3.5Å; S17-T21 PolarHBondContact O-OG1 2.62Å; A18-T21 PolarHBondContact O-N 2.98Å; W19-T21 PolarHBondContact O-N 3.44Å; T21-A25 WeakPolarHBondContact O-CB 3.44Å; T21-A25 PolarHBondContact O-N 3.21Å; T21-A25 VanDerWaalsContact O-N 3.11Å; T21-M36 HydrophobicContact CG2-SD 4.31Å; T21-L41 HydrophobicContact CG2-CD2 4.1Å
22	V	80.8	Confident	71.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-71	-42.5	-179.9	172.4	0	0	0	0	111.3	A18 W19 A25 L26 L45 L48 L57 W121	A18-V22 WeakPolarHBondContact O-CB 2.99Å; A18-V22 VanDerWaalsContact O-CG2 3.29Å; A18-V22 WeakPolarHBondContact O-CG2 3.22Å; A18-V22 PolarHBondContact O-N 3.31Å; W19-V22 PolarHBondContact O-N 3.28Å; V22-A25 PolarHBondContact O-N 3.48Å; V22-L26 HydrophobicContact CG1-CD1 4.21Å; V22-L26 WeakPolarHBondContact O-CG 3.44Å; V22-L26 PolarHBondContact O-N 3.37Å; V22-L26 VanDerWaalsContact O-N 3.1Å; V22-L45 HydrophobicContact CG1-CD2 3.7Å; V22-L45 HydrophobicContact CG1-CG 4.49Å; V22-L45 HydrophobicContact CG2-CD2 4.03Å; V22-L45 HydrophobicContact CG2-CG 4.04Å; V22-L48 HydrophobicContact CB-CD1 3.95Å; V22-L48 HydrophobicContact CG1-CD1 4.16Å; V22-L48 HydrophobicContact CG2-CD1 3.83Å; V22-L57 HydrophobicContact CG1-CD1 3.93Å; V22-L57 HydrophobicContact CG1-CD2 3.97Å; V22-W121 HydrophobicContact CG1-CZ3 4.24Å
23	T	83.1	Confident	70.3	Confident	14 Å²	14	62.3 Å²	62.3	9%	0.086	37%	0.371	C	S	.	.	H	α-helix	trans	-70.1	-37	178.6	54.2	0	0	0	0	112.6	W19 D20 A25 L26 V27 L57 W60	W19-T23 HydrophobicContact CD2-CG2 4.09Å; W19-T23 HydrophobicContact CG-CG2 4.31Å; W19-T23 HydrophobicContact CZ2-CG2 4.06Å; W19-T23 WeakPolarHBondContact O-CB 3.13Å; W19-T23 VanDerWaalsContact O-CG2 3.26Å; W19-T23 WeakPolarHBondContact O-CG2 3.41Å; W19-T23 PolarHBondContact O-N 2.94Å; W19-T23 PolarHBondContact O-OG1 3.06Å; D20-T23 WeakPolarHBondContact CA-OG1 3.33Å; D20-T23 PolarHBondContact O-OG1 2.94Å; T23-A25 VanDerWaalsContact C-N 3.33Å; T23-A25 PolarHBondContact O-N 3.46Å; T23-L26 PolarHBondContact O-N 3.01Å; T23-V27 PolarHBondContact O-N 2.94Å; T23-V27 VanDerWaalsContact O-N 3.13Å; T23-L57 HydrophobicContact CG2-CD2 4.31Å; T23-W60 VanDerWaalsContact CB-CH2 3.48Å; T23-W60 HydrophobicContact CG2-CD2 4.13Å; T23-W60 HydrophobicContact CG2-CE3 3.91Å; T23-W60 HydrophobicContact CG2-CH2 3.74Å; T23-W60 HydrophobicContact CG2-CZ2 3.94Å; T23-W60 HydrophobicContact CG2-CZ3 3.72Å
24	A	81.7	Confident	69.4	Low	61 Å²	61	57.5 Å²	57.5	50%	0.504	35%	0.35	S	S	.	.	H	α-helix	trans	-62.9	-40	172.1	0	0	0	0	0	111.8	D20 L26 V27 S28	D20-A24 WeakPolarHBondContact O-CB 3.5Å; D20-A24 PolarHBondContact O-N 3.23Å; A24-L26 VanDerWaalsContact C-N 3.31Å; A24-L26 PolarHBondContact O-N 2.97Å; A24-V27 PolarHBondContact O-N 3.05Å; A24-S28 VanDerWaalsContact O-CB 3.25Å; A24-S28 WeakPolarHBondContact O-CB 3.49Å; A24-S28 PolarHBondContact O-N 3.08Å
25	A	78.8	Confident	68.2	Low	9 Å²	9	62.4 Å²	62.4	7%	0.074	37%	0.374	C	S	.	.	H	α-helix	trans	-66	-31.7	175.5	0	0	0	0	0	113.1	T21 V22 T23 L41 R117	T21-A25 WeakPolarHBondContact O-CB 3.44Å; T21-A25 PolarHBondContact O-N 3.21Å; T21-A25 VanDerWaalsContact O-N 3.11Å; V22-A25 PolarHBondContact O-N 3.48Å; T23-A25 VanDerWaalsContact C-N 3.33Å; T23-A25 PolarHBondContact O-N 3.46Å; A25-L41 HydrophobicContact CB-CD1 4.37Å; A25-L41 HydrophobicContact CB-CD2 3.51Å; A25-R117 PolarHBondContact O-NH1 3.24Å
26	L	80.3	Confident	67.1	Low	1 Å²	1	65.6 Å²	65.6	1%	0.005	39%	0.39	C	S	.	.	H	α-helix	trans	-78.9	-24.1	178.3	-70.9	172.8	0	0	0	113.9	V22 T23 A24 L57 L61 G114 L118 W121	V22-L26 HydrophobicContact CG1-CD1 4.21Å; V22-L26 WeakPolarHBondContact O-CG 3.44Å; V22-L26 PolarHBondContact O-N 3.37Å; V22-L26 VanDerWaalsContact O-N 3.1Å; T23-L26 PolarHBondContact O-N 3.01Å; A24-L26 VanDerWaalsContact C-N 3.31Å; A24-L26 PolarHBondContact O-N 2.97Å; L26-L57 HydrophobicContact CD1-CD2 4.42Å; L26-L61 HydrophobicContact CB-CD2 4.43Å; L26-G114 WeakPolarHBondContact CD2-O 3.39Å; L26-G114 WeakPolarHBondContact O-CA 3.36Å; L26-L118 HydrophobicContact CD2-CB 3.89Å; L26-W121 HydrophobicContact CD1-CZ3 4.37Å; L26-W121 HydrophobicContact CD2-CE3 4.3Å; L26-W121 HydrophobicContact CD2-CH2 4.01Å; L26-W121 HydrophobicContact CD2-CZ3 3.64Å; L26-W121 HydrophobicContact CG-CH2 4.35Å; L26-W121 HydrophobicContact CG-CZ3 4.02Å
27	V	77.7	Confident	66.1	Low	47 Å²	47	65 Å²	65	29%	0.285	39%	0.387	S	S	.	.	H	α-helix	trans	-107.2	-8	-178.2	-177.7	0	0	0	0	112.8	T23 A24 W60 L61 P110 F111	T23-V27 PolarHBondContact O-N 2.94Å; T23-V27 VanDerWaalsContact O-N 3.13Å; A24-V27 PolarHBondContact O-N 3.05Å; V27-W60 HydrophobicContact CG2-CH2 3.59Å; V27-W60 HydrophobicContact CG2-CZ3 3.9Å; V27-L61 HydrophobicContact CG2-CD1 4.03Å; V27-P110 WeakPolarHBondContact O-CB 3.25Å; V27-F111 HydrophobicContact CG1-CE1 3.92Å; V27-F111 HydrophobicContact CG1-CZ 4.24Å; V27-F111 HydrophobicContact CG2-CE1 4.37Å
28	S	69.2	Low	65.3	Low	31 Å²	31	66.3 Å²	66.3	22%	0.217	39%	0.389	C	S	.	.	S	Bend	trans	-69.3	139	177.4	-177.8	0	0	0	0	112.5	A24 V30	A24-S28 VanDerWaalsContact O-CB 3.25Å; A24-S28 WeakPolarHBondContact O-CB 3.49Å; A24-S28 PolarHBondContact O-N 3.08Å; S28-V30 PolarHBondContact O-N 3.08Å
29	P	58.9	Low	64.6	Low	57 Å²	57	72.7 Å²	72.7	37%	0.37	42%	0.417	S	S	.	.			trans	-60.9	137.3	169	26.4	-33.1	0	0	0	110.3	S31 N32	P29-S31 PolarHBondContact O-N 2.9Å; P29-N32 PolarHBondContact O-N 3.45Å
30	V	52	Low	64	Low	106 Å²	106	71.5 Å²	71.5	64%	0.642	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-14	-177.7	-179.9	0	0	0	0	112.8	S28	S28-V30 PolarHBondContact O-N 3.08Å
31	S	45.2	Very low	63.6	Low	101 Å²	101	67.2 Å²	67.2	71%	0.706	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-1.6	-176.2	44.1	0	0	0	0	115.7	P29	P29-S31 PolarHBondContact O-N 2.9Å
32	N	38.9	Very low	63.3	Low	105 Å²	105	67.5 Å²	67.5	56%	0.561	40%	0.399	S	S	*	.			trans	-99.4	108.8	168.1	-82.7	-9.2	0	0	0	109	P29 I34	P29-N32 PolarHBondContact O-N 3.45Å; N32-I34 HydrophobicContact CB-CD1 4.48Å; N32-I34 HydrophobicContact CB-CG1 4.1Å; N32-I34 PolarHBondContact O-N 3.42Å
33	D	39.2	Very low	63	Low	164 Å²	164	73.8 Å²	73.8	88%	0.877	43%	0.428	S	S	*	.			trans	-57.6	66.8	154.7	-76.2	-38	0	0	0	109.5	T35	D33-T35 PolarHBondContact O-N 3.13Å
34	I	42.9	Very low	62.7	Low	98 Å²	98	73.4 Å²	73.4	50%	0.503	43%	0.428	S	S	.	.			trans	-80.1	105.6	155.5	-57.7	174.1	0	0	0	103.4	N32 M36	N32-I34 HydrophobicContact CB-CD1 4.48Å; N32-I34 HydrophobicContact CB-CG1 4.1Å; N32-I34 PolarHBondContact O-N 3.42Å; I34-M36 HydrophobicContact CG2-CE 3.59Å; I34-M36 HydrophobicContact CG2-CG 3.82Å; I34-M36 HydrophobicContact CG2-SD 4.35Å; I34-M36 PolarHBondContact O-N 3.48Å
35	T	43.9	Very low	62.6	Low	135 Å²	135	70.7 Å²	70.7	83%	0.828	41%	0.405	S	S	*	.			trans	-57.4	63.1	161.3	45.7	0	0	0	0	110.3	D33 S37	D33-T35 PolarHBondContact O-N 3.13Å; T35-S37 PolarHBondContact O-N 3.16Å
36	M	53.5	Low	62.6	Low	92 Å²	92	73.1 Å²	73.1	45%	0.453	42%	0.421	S	S	.	.			trans	-68.5	113.9	152.2	-67.5	-67.2	91.1	0	0	104.5	T21 I34 D38 L41	T21-M36 HydrophobicContact CG2-SD 4.31Å; I34-M36 HydrophobicContact CG2-CE 3.59Å; I34-M36 HydrophobicContact CG2-CG 3.82Å; I34-M36 HydrophobicContact CG2-SD 4.35Å; I34-M36 PolarHBondContact O-N 3.48Å; M36-D38 PolarHBondContact O-N 2.95Å; M36-L41 HydrophobicContact CB-CD1 3.82Å; M36-L41 HydrophobicContact CB-CG 4.24Å
37	S	58.5	Low	62.6	Low	61 Å²	61	76 Å²	76	43%	0.427	44%	0.436	S	S	.	.			trans	-56.5	128.6	173.6	52.8	0	0	0	0	107.3	T35 E39 S40 L41	T35-S37 PolarHBondContact O-N 3.16Å; S37-E39 CarbonylContact O-C 3.55Å; S37-E39 PolarHBondContact O-N 3.03Å; S37-S40 PolarHBondContact O-N 3.47Å; S37-S40 PolarHBondContact O-OG 3.19Å; S37-S40 WeakPolarHBondContact OG-CB 3.25Å; S37-S40 PolarHBondContact OG-N 2.91Å; S37-S40 PolarHBondContact OG-OG 3.46Å; S37-L41 PolarHBondContact O-N 2.89Å
38	D	62.9	Low	62.7	Low	94 Å²	94	73.8 Å²	73.8	50%	0.503	42%	0.423	S	S	.	.	H	α-helix	trans	-53.4	-24.6	175.3	-160	13.7	0	0	0	110.5	M36 S42 R126	M36-D38 PolarHBondContact O-N 2.95Å; D38-S42 VanDerWaalsContact O-CB 3.3Å; D38-S42 WeakPolarHBondContact O-CB 3.33Å; D38-S42 PolarHBondContact O-N 3.07Å; D38-S42 PolarHBondContact O-OG 2.92Å; D38-R126 IonicContact OD1-NH1 3Å; D38-R126 PolarHBondContact OD1-NH1 3.49Å; D38-R126 IonicContact OD2-NH1 3.15Å; D38-R126 PolarHBondContact OD2-NH1 3.17Å; D38-R126 VanDerWaalsContact OD2-NH1 3.15Å
39	E	63.3	Low	63.3	Low	143 Å²	143	73.6 Å²	73.6	67%	0.668	42%	0.421	S	S	*	.	H	α-helix	trans	-60	-50.5	167.5	-64.7	179.6	166.8	0	0	113.4	S37 L41 S42 E43	S37-E39 CarbonylContact O-C 3.55Å; S37-E39 PolarHBondContact O-N 3.03Å; E39-L41 VanDerWaalsContact C-N 3.31Å; E39-L41 PolarHBondContact O-N 2.98Å; E39-S42 WeakPolarHBondContact CA-OG 3.34Å; E39-S42 PolarHBondContact O-N 2.91Å; E39-S42 PolarHBondContact O-OG 3.09Å; E39-E43 WeakPolarHBondContact O-CB 3.11Å; E39-E43 VanDerWaalsContact O-CG 3.3Å; E39-E43 WeakPolarHBondContact O-CG 3.36Å; E39-E43 PolarHBondContact O-N 2.84Å
40	S	69.4	Low	64.3	Low	38 Å²	38	75 Å²	75	27%	0.266	43%	0.433	S	S	.	.	H	α-helix	trans	-64.8	-33.3	178.6	65.6	0	0	0	0	113.5	S37 G44	S37-S40 PolarHBondContact O-N 3.47Å; S37-S40 PolarHBondContact O-OG 3.19Å; S37-S40 WeakPolarHBondContact OG-CB 3.25Å; S37-S40 PolarHBondContact OG-N 2.91Å; S37-S40 PolarHBondContact OG-OG 3.46Å; S40-G44 PolarHBondContact O-N 2.64Å
41	L	74.8	Confident	65.6	Low	8 Å²	8	73.4 Å²	73.4	4%	0.042	42%	0.421	C	S	.	.	H	α-helix	trans	-74.9	-41.4	177.2	-77.1	164.9	0	0	0	111.7	T21 A25 M36 S37 E39 G44 L45	T21-L41 HydrophobicContact CG2-CD2 4.1Å; A25-L41 HydrophobicContact CB-CD1 4.37Å; A25-L41 HydrophobicContact CB-CD2 3.51Å; M36-L41 HydrophobicContact CB-CD1 3.82Å; M36-L41 HydrophobicContact CB-CG 4.24Å; S37-L41 PolarHBondContact O-N 2.89Å; E39-L41 VanDerWaalsContact C-N 3.31Å; E39-L41 PolarHBondContact O-N 2.98Å; L41-G44 PolarHBondContact O-N 3.41Å; L41-L45 WeakPolarHBondContact O-CB 3.45Å; L41-L45 VanDerWaalsContact O-CG 3.25Å; L41-L45 WeakPolarHBondContact O-CG 3.37Å; L41-L45 PolarHBondContact O-N 3.48Å
42	S	74.3	Confident	67.2	Low	52 Å²	52	72.4 Å²	72.4	36%	0.364	41%	0.413	S	S	.	.	H	α-helix	trans	-68.2	-39.1	175.8	56.2	0	0	0	0	112.2	D38 E39 L45 S46	D38-S42 VanDerWaalsContact O-CB 3.3Å; D38-S42 WeakPolarHBondContact O-CB 3.33Å; D38-S42 PolarHBondContact O-N 3.07Å; D38-S42 PolarHBondContact O-OG 2.92Å; E39-S42 WeakPolarHBondContact CA-OG 3.34Å; E39-S42 PolarHBondContact O-N 2.91Å; E39-S42 PolarHBondContact O-OG 3.09Å; S42-L45 PolarHBondContact O-N 2.83Å; S42-S46 WeakPolarHBondContact O-CB 3.49Å; S42-S46 PolarHBondContact O-N 3.09Å; S42-S46 PolarHBondContact O-OG 3.43Å
43	E	75	Confident	69.1	Low	132 Å²	132	69.9 Å²	69.9	62%	0.617	40%	0.399	S	S	*	.	H	α-helix	trans	-61.1	-48.5	170.9	-76.1	179.5	-179.4	0	0	111.2	E39 L45 S46 L47	E39-E43 WeakPolarHBondContact O-CB 3.11Å; E39-E43 VanDerWaalsContact O-CG 3.3Å; E39-E43 WeakPolarHBondContact O-CG 3.36Å; E39-E43 PolarHBondContact O-N 2.84Å; E43-L45 PolarHBondContact O-N 3.04Å; E43-S46 PolarHBondContact O-N 3.3Å; E43-S46 PolarHBondContact O-OG 3.47Å; E43-L47 WeakPolarHBondContact O-CB 3.25Å; E43-L47 PolarHBondContact O-N 2.91Å
44	G	76.9	Confident	70.8	Confident	7 Å²	7	62.3 Å²	62.3	7%	0.072	36%	0.361	C	S	.	.	H	α-helix	trans	-59.6	-43.7	176	0	0	0	0	0	113.2	S40 L41 L47 L48	S40-G44 PolarHBondContact O-N 2.64Å; L41-G44 PolarHBondContact O-N 3.41Å; G44-L47 PolarHBondContact O-N 2.74Å; G44-L48 VanDerWaalsContact O-CG 3.32Å; G44-L48 WeakPolarHBondContact O-CG 3.14Å; G44-L48 PolarHBondContact O-N 3.02Å
45	L	79.4	Confident	72.5	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-65.1	-41	176.2	-76.4	170.9	0	0	0	112.2	V22 L41 S42 E43 L47 L48 C49 L57 W121 L129	V22-L45 HydrophobicContact CG1-CD2 3.7Å; V22-L45 HydrophobicContact CG1-CG 4.49Å; V22-L45 HydrophobicContact CG2-CD2 4.03Å; V22-L45 HydrophobicContact CG2-CG 4.04Å; L41-L45 WeakPolarHBondContact O-CB 3.45Å; L41-L45 VanDerWaalsContact O-CG 3.25Å; L41-L45 WeakPolarHBondContact O-CG 3.37Å; L41-L45 PolarHBondContact O-N 3.48Å; S42-L45 PolarHBondContact O-N 2.83Å; E43-L45 PolarHBondContact O-N 3.04Å; L45-L47 VanDerWaalsContact C-N 3.33Å; L45-L47 PolarHBondContact O-N 3.37Å; L45-L48 PolarHBondContact O-N 3.48Å; L45-C49 WeakPolarHBondContact O-CB 3.3Å; L45-C49 PolarHBondContact O-N 3.29Å; L45-C49 PolarHBondContact O-SG 3.39Å; L45-L57 HydrophobicContact CD2-CD1 4.1Å; L45-W121 HydrophobicContact CD1-CD2 3.91Å; L45-W121 HydrophobicContact CD1-CE3 3.75Å; L45-W121 HydrophobicContact CD1-CG 4.49Å; L45-W121 HydrophobicContact CD1-CH2 4.29Å; L45-W121 HydrophobicContact CD1-CZ2 4.44Å; L45-W121 HydrophobicContact CD1-CZ3 3.96Å; L45-W121 HydrophobicContact CD2-CE3 4.09Å; L45-W121 HydrophobicContact CD2-CZ3 4.06Å; L45-W121 HydrophobicContact CG-CZ3 4.48Å; L45-L129 HydrophobicContact CD2-CD1 4.17Å
46	S	78.3	Confident	74.3	Confident	61 Å²	61	63.2 Å²	63.2	43%	0.427	35%	0.352	S	S	.	.	H	α-helix	trans	-64.9	-37.2	176.5	77.2	0	0	0	0	112.2	S42 E43 S50	S42-S46 WeakPolarHBondContact O-CB 3.49Å; S42-S46 PolarHBondContact O-N 3.09Å; S42-S46 PolarHBondContact O-OG 3.43Å; E43-S46 PolarHBondContact O-N 3.3Å; E43-S46 PolarHBondContact O-OG 3.47Å; S46-S50 WeakPolarHBondContact O-CB 3Å; S46-S50 PolarHBondContact O-N 3.21Å; S46-S50 PolarHBondContact O-OG 3.42Å
47	L	80.1	Confident	75.7	Confident	61 Å²	61	58.8 Å²	58.8	32%	0.319	33%	0.33	S	S	.	.	H	α-helix	trans	-67.4	-39.7	175.4	-165.2	103.6	0	0	0	111.4	L15 A18 E43 G44 L45 S50 N51	L15-L47 HydrophobicContact CB-CD2 4.43Å; L15-L47 HydrophobicContact CD1-CD2 3.79Å; L15-L47 HydrophobicContact CD1-CG 4.45Å; A18-L47 HydrophobicContact CB-CD2 3.6Å; E43-L47 WeakPolarHBondContact O-CB 3.25Å; E43-L47 PolarHBondContact O-N 2.91Å; G44-L47 PolarHBondContact O-N 2.74Å; L45-L47 VanDerWaalsContact C-N 3.33Å; L45-L47 PolarHBondContact O-N 3.37Å; L47-S50 WeakPolarHBondContact CA-OG 3.37Å; L47-S50 PolarHBondContact O-OG 3.34Å; L47-N51 PolarHBondContact O-N 2.89Å; L47-N51 PolarHBondContact O-ND2 3.24Å
48	L	80.7	Confident	77	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-70.1	-40.4	176.5	-70.1	176.2	0	0	0	112.4	L15 W19 V22 G44 L45 N51 S52 L53 G54 L57	L15-L48 HydrophobicContact CD1-CD2 3.95Å; W19-L48 HydrophobicContact CB-CD2 4.33Å; W19-L48 HydrophobicContact CE3-CD1 4.18Å; W19-L48 HydrophobicContact CE3-CD2 3.94Å; V22-L48 HydrophobicContact CB-CD1 3.95Å; V22-L48 HydrophobicContact CG1-CD1 4.16Å; V22-L48 HydrophobicContact CG2-CD1 3.83Å; G44-L48 VanDerWaalsContact O-CG 3.32Å; G44-L48 WeakPolarHBondContact O-CG 3.14Å; G44-L48 PolarHBondContact O-N 3.02Å; L45-L48 PolarHBondContact O-N 3.48Å; L48-N51 CarbonylContact O-C 3.31Å; L48-N51 PolarHBondContact O-N 3.26Å; L48-S52 PolarHBondContact O-N 3.15Å; L48-L53 HydrophobicContact CB-CB 4.46Å; L48-L53 HydrophobicContact CD2-CB 4.14Å; L48-L53 HydrophobicContact CD2-CD1 4.28Å; L48-L53 PolarHBondContact O-N 3.33Å; L48-G54 PolarHBondContact O-N 2.99Å; L48-L57 HydrophobicContact CD1-CD1 4.41Å
49	C	81	Confident	78	Confident	27 Å²	27	54.7 Å²	54.7	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-73.2	-36.7	-178.6	-65.4	0	0	0	0	112.5	L45 N51 S52 G127 L129	L45-C49 WeakPolarHBondContact O-CB 3.3Å; L45-C49 PolarHBondContact O-N 3.29Å; L45-C49 PolarHBondContact O-SG 3.39Å; C49-N51 PolarHBondContact O-N 3.05Å; C49-S52 PolarHBondContact O-N 3.49Å; C49-G127 WeakPolarHBondContact CB-O 3.48Å; C49-G127 PolarHBondContact SG-O 3.15Å; C49-L129 VanDerWaalsContact SG-CD2 3.6Å
50	S	79.4	Confident	79.2	Confident	88 Å²	88	51.3 Å²	51.3	62%	0.615	29%	0.291	S	S	*	.	H	α-helix	trans	-62.3	-23.9	173	54.7	0	0	0	0	113.4	S46 L47	S46-S50 WeakPolarHBondContact O-CB 3Å; S46-S50 PolarHBondContact O-N 3.21Å; S46-S50 PolarHBondContact O-OG 3.42Å; L47-S50 WeakPolarHBondContact CA-OG 3.37Å; L47-S50 PolarHBondContact O-OG 3.34Å
51	N	80.2	Confident	80.1	Confident	72 Å²	72	49.5 Å²	49.5	39%	0.385	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	14.1	174.6	-69.4	-83.5	0	0	0	113.5	L15 L47 L48 C49 L53	L15-N51 HydrophobicContact CD1-CB 4.46Å; L47-N51 PolarHBondContact O-N 2.89Å; L47-N51 PolarHBondContact O-ND2 3.24Å; L48-N51 CarbonylContact O-C 3.31Å; L48-N51 PolarHBondContact O-N 3.26Å; C49-N51 PolarHBondContact O-N 3.05Å; N51-L53 HydrophobicContact CB-CD1 4.42Å; N51-L53 PolarHBondContact O-N 2.87Å; N51-L53 VanDerWaalsContact O-N 3.14Å
52	S	78.8	Confident	80.6	Confident	79 Å²	79	50.5 Å²	50.5	55%	0.552	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	21.3	-179	-49.1	0	0	0	0	115.3	L48 C49 Q55	L48-S52 PolarHBondContact O-N 3.15Å; C49-S52 PolarHBondContact O-N 3.49Å; S52-Q55 WeakPolarHBondContact O-CG 3.5Å; S52-Q55 PolarHBondContact O-NE2 3.47Å; S52-Q55 VanDerWaalsContact O-NE2 3.07Å
53	L	79.3	Confident	81.3	Confident	52 Å²	52	54.1 Å²	54.1	27%	0.272	29%	0.294	S	S	.	.			trans	-90.7	-15.9	178.7	-70.4	171.9	0	0	0	113.5	L15 L48 N51 Q55 F56	L15-L53 HydrophobicContact CD1-CD1 3.99Å; L15-L53 HydrophobicContact CD2-CD1 3.71Å; L15-L53 HydrophobicContact CG-CD1 4.07Å; L48-L53 HydrophobicContact CB-CB 4.46Å; L48-L53 HydrophobicContact CD2-CB 4.14Å; L48-L53 HydrophobicContact CD2-CD1 4.28Å; L48-L53 PolarHBondContact O-N 3.33Å; N51-L53 HydrophobicContact CB-CD1 4.42Å; N51-L53 PolarHBondContact O-N 2.87Å; N51-L53 VanDerWaalsContact O-N 3.14Å; L53-Q55 VanDerWaalsContact C-N 3.26Å; L53-Q55 PolarHBondContact O-N 3.43Å; L53-F56 HydrophobicContact CD2-CD2 4.09Å; L53-F56 HydrophobicContact CD2-CE2 4.4Å; L53-F56 PolarHBondContact O-N 3.36Å; L53-F56 VanDerWaalsContact O-N 3.14Å
54	G	74.9	Confident	81.9	Confident	6 Å²	6	49.5 Å²	49.5	6%	0.062	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-31.7	178.1	0	0	0	0	0	114.3	L48 F56 L57	L48-G54 PolarHBondContact O-N 2.99Å; G54-F56 VanDerWaalsContact C-N 3.25Å; G54-F56 PolarHBondContact O-N 3.32Å; G54-L57 WeakPolarHBondContact O-CB 3.44Å; G54-L57 PolarHBondContact O-N 3.05Å
55	Q	77.4	Confident	82.4	Confident	137 Å²	137	49.2 Å²	49.2	64%	0.64	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-20.4	178.1	66.9	-170.5	-14.4	0	0	114	S52 L53	S52-Q55 WeakPolarHBondContact O-CG 3.5Å; S52-Q55 PolarHBondContact O-NE2 3.47Å; S52-Q55 VanDerWaalsContact O-NE2 3.07Å; L53-Q55 VanDerWaalsContact C-N 3.26Å; L53-Q55 PolarHBondContact O-N 3.43Å
56	F	83.1	Confident	83	Confident	114 Å²	114	53.6 Å²	53.6	50%	0.5	29%	0.292	S	S	.	.	H	α-helix	trans	-87.8	-11.7	179.4	-63.1	-74.8	0	0	0	113.2	W19 L53 G54 E58 G59 W60	W19-F56 HydrophobicContact CH2-CB 4.38Å; L53-F56 HydrophobicContact CD2-CD2 4.09Å; L53-F56 HydrophobicContact CD2-CE2 4.4Å; L53-F56 PolarHBondContact O-N 3.36Å; L53-F56 VanDerWaalsContact O-N 3.14Å; G54-F56 VanDerWaalsContact C-N 3.25Å; G54-F56 PolarHBondContact O-N 3.32Å; F56-E58 VanDerWaalsContact C-N 3.32Å; F56-E58 PolarHBondContact O-N 3.33Å; F56-G59 PolarHBondContact O-N 3.19Å; F56-W60 VanDerWaalsContact O-CB 3.23Å; F56-W60 WeakPolarHBondContact O-CB 3.45Å; F56-W60 PolarHBondContact O-N 3.46Å
57	L	83.3	Confident	83.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63	-38.6	179	-69.8	170.6	0	0	0	112	W19 V22 T23 L26 L45 L48 G54 L61 L118	W19-L57 HydrophobicContact CE3-CD2 4.03Å; W19-L57 HydrophobicContact CH2-CD2 3.76Å; W19-L57 HydrophobicContact CH2-CG 4.4Å; W19-L57 HydrophobicContact CZ2-CD2 4.47Å; W19-L57 HydrophobicContact CZ3-CD2 3.51Å; W19-L57 HydrophobicContact CZ3-CG 4.05Å; V22-L57 HydrophobicContact CG1-CD1 3.93Å; V22-L57 HydrophobicContact CG1-CD2 3.97Å; T23-L57 HydrophobicContact CG2-CD2 4.31Å; L26-L57 HydrophobicContact CD1-CD2 4.42Å; L45-L57 HydrophobicContact CD2-CD1 4.1Å; L48-L57 HydrophobicContact CD1-CD1 4.41Å; G54-L57 WeakPolarHBondContact O-CB 3.44Å; G54-L57 PolarHBondContact O-N 3.05Å; L57-L61 VanDerWaalsContact O-CB 3.31Å; L57-L61 WeakPolarHBondContact O-CB 3.23Å; L57-L61 PolarHBondContact O-N 3.09Å; L57-L118 HydrophobicContact CB-CD1 4.35Å
58	E	84.7	Confident	84	Confident	36 Å²	36	58.1 Å²	58.1	17%	0.168	31%	0.305	C	S	.	.	H	α-helix	trans	-62.5	-52.4	175	173.5	176.3	160.9	0	0	111.4	F56 L61 M62 L118 P132 L137 R140	F56-E58 VanDerWaalsContact C-N 3.32Å; F56-E58 PolarHBondContact O-N 3.33Å; E58-L61 PolarHBondContact O-N 3.23Å; E58-M62 WeakPolarHBondContact O-CB 3.19Å; E58-M62 WeakPolarHBondContact O-CG 3.29Å; E58-M62 PolarHBondContact O-N 3.21Å; E58-L118 HydrophobicContact CB-CD2 4.36Å; E58-P132 WeakPolarHBondContact OE2-CD 3.44Å; E58-L137 VanDerWaalsContact CD-CD2 3.45Å; E58-L137 HydrophobicContact CG-CD2 3.57Å; E58-R140 IonicContact OE1-CZ 2.6Å; E58-R140 IonicContact OE1-NH1 3.61Å; E58-R140 PolarHBondContact OE1-NH1 2.62Å; E58-R140 IonicContact OE1-NH2 3.46Å
59	G	84.1	Confident	84.4	Confident	33 Å²	33	58.1 Å²	58.1	34%	0.34	31%	0.305	S	S	.	.	H	α-helix	trans	-60.2	-46.9	178.9	0	0	0	0	0	111.7	F56 L61 M62 E63	F56-G59 PolarHBondContact O-N 3.19Å; G59-L61 PolarHBondContact O-N 3.38Å; G59-M62 PolarHBondContact O-N 3.31Å; G59-E63 VanDerWaalsContact O-CB 3.31Å; G59-E63 WeakPolarHBondContact O-CB 3.44Å; G59-E63 VanDerWaalsContact O-CG 3.3Å; G59-E63 WeakPolarHBondContact O-CG 3.23Å; G59-E63 PolarHBondContact O-N 3.27Å
60	W	89.3	Confident	84.8	Confident	72 Å²	72	60 Å²	60	27%	0.273	32%	0.316	S	S	.	.	H	α-helix	trans	-59.2	-46.6	178.1	175.5	83.2	0	0	0	112.4	W19 T23 V27 F56 T64	W19-W60 HydrophobicContact CH2-CB 4.35Å; W19-W60 HydrophobicContact CZ2-CB 4.22Å; W19-W60 HydrophobicContact CZ2-CD2 4.37Å; W19-W60 AromaticContact CZ2-CG 3.92Å; W19-W60 HydrophobicContact CZ2-CG 3.92Å; T23-W60 VanDerWaalsContact CB-CH2 3.48Å; T23-W60 HydrophobicContact CG2-CD2 4.13Å; T23-W60 HydrophobicContact CG2-CE3 3.91Å; T23-W60 HydrophobicContact CG2-CH2 3.74Å; T23-W60 HydrophobicContact CG2-CZ2 3.94Å; T23-W60 HydrophobicContact CG2-CZ3 3.72Å; V27-W60 HydrophobicContact CG2-CH2 3.59Å; V27-W60 HydrophobicContact CG2-CZ3 3.9Å; F56-W60 VanDerWaalsContact O-CB 3.23Å; F56-W60 WeakPolarHBondContact O-CB 3.45Å; F56-W60 PolarHBondContact O-N 3.46Å; W60-T64 WeakPolarHBondContact O-CB 3.36Å; W60-T64 PolarHBondContact O-N 3.47Å; W60-T64 PolarHBondContact O-OG1 3.09Å
61	L	86.6	Confident	85.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-69.1	-39.3	-177.7	-174.2	57.8	0	0	0	111.5	L26 V27 L57 E58 G59 L65 F111 L115 L118	L26-L61 HydrophobicContact CB-CD2 4.43Å; V27-L61 HydrophobicContact CG2-CD1 4.03Å; L57-L61 VanDerWaalsContact O-CB 3.31Å; L57-L61 WeakPolarHBondContact O-CB 3.23Å; L57-L61 PolarHBondContact O-N 3.09Å; E58-L61 PolarHBondContact O-N 3.23Å; G59-L61 PolarHBondContact O-N 3.38Å; L61-L65 WeakPolarHBondContact O-CB 3.4Å; L61-L65 PolarHBondContact O-N 3.02Å; L61-F111 HydrophobicContact CD1-CD1 4.25Å; L61-L115 HydrophobicContact CB-CD2 4.47Å; L61-L115 HydrophobicContact CD2-CB 4.45Å; L61-L115 HydrophobicContact CD2-CD2 3.62Å; L61-L115 HydrophobicContact CD2-CG 3.71Å; L61-L115 HydrophobicContact CG-CD2 3.91Å; L61-L115 HydrophobicContact CG-CG 4.09Å; L61-L118 HydrophobicContact CD2-CD2 4.28Å
62	M	85.8	Confident	85.8	Confident	28 Å²	28	58.5 Å²	58.5	14%	0.138	31%	0.309	C	S	.	.	H	α-helix	trans	-67.5	-43.8	175.8	-74.1	-65.7	-62.3	0	0	112.5	E58 G59 L65 Q66 L115 R140 A141 V144	E58-M62 WeakPolarHBondContact O-CB 3.19Å; E58-M62 WeakPolarHBondContact O-CG 3.29Å; E58-M62 PolarHBondContact O-N 3.21Å; G59-M62 PolarHBondContact O-N 3.31Å; M62-L65 PolarHBondContact O-N 3.43Å; M62-Q66 WeakPolarHBondContact O-CB 3.34Å; M62-Q66 PolarHBondContact O-N 2.98Å; M62-L115 HydrophobicContact CG-CD2 4.31Å; M62-L115 HydrophobicContact SD-CD1 4.23Å; M62-L115 HydrophobicContact SD-CD2 3.91Å; M62-R140 HydrophobicContact CE-CB 3.91Å; M62-A141 HydrophobicContact CE-CB 4.49Å; M62-A141 HydrophobicContact SD-CB 4.12Å; M62-V144 HydrophobicContact CE-CG2 3.93Å
63	E	88.9	Confident	86.3	Confident	128 Å²	128	55.2 Å²	55.2	60%	0.598	29%	0.285	S	S	*	.	H	α-helix	trans	-65.1	-41.6	174.8	-75.4	178.8	-178	0	0	111.2	G59 L65 Q66 V67	G59-E63 VanDerWaalsContact O-CB 3.31Å; G59-E63 WeakPolarHBondContact O-CB 3.44Å; G59-E63 VanDerWaalsContact O-CG 3.3Å; G59-E63 WeakPolarHBondContact O-CG 3.23Å; G59-E63 PolarHBondContact O-N 3.27Å; E63-L65 PolarHBondContact O-N 2.95Å; E63-Q66 PolarHBondContact O-N 3.07Å; E63-V67 WeakPolarHBondContact O-CB 3.39Å; E63-V67 VanDerWaalsContact O-CG2 3.31Å; E63-V67 WeakPolarHBondContact O-CG2 3.32Å; E63-V67 PolarHBondContact O-N 3.37Å
64	T	87.6	Confident	86.7	Confident	36 Å²	36	53 Å²	53	22%	0.221	27%	0.274	C	S	.	.	H	α-helix	trans	-62.8	-43.9	176.4	-59.3	0	0	0	0	110.8	W60 R68 F111	W60-T64 WeakPolarHBondContact O-CB 3.36Å; W60-T64 PolarHBondContact O-N 3.47Å; W60-T64 PolarHBondContact O-OG1 3.09Å; T64-R68 HydrophobicContact CG2-CG 4.33Å; T64-R68 WeakPolarHBondContact O-CB 3.5Å; T64-R68 WeakPolarHBondContact O-CG 3.05Å; T64-R68 PolarHBondContact O-N 3.31Å; T64-F111 HydrophobicContact CG2-CE1 4Å
65	L	88.4	Confident	87.4	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-58.4	-48.4	172.5	172.3	63.4	0	0	0	111	L61 M62 E63 R68 L69 L108 F111 L115 A141	L61-L65 WeakPolarHBondContact O-CB 3.4Å; L61-L65 PolarHBondContact O-N 3.02Å; M62-L65 PolarHBondContact O-N 3.43Å; E63-L65 PolarHBondContact O-N 2.95Å; L65-R68 PolarHBondContact O-N 3.06Å; L65-L69 WeakPolarHBondContact O-CB 3.44Å; L65-L69 PolarHBondContact O-N 2.96Å; L65-L108 HydrophobicContact CD1-CD2 3.86Å; L65-F111 HydrophobicContact CB-CD1 4.48Å; L65-F111 HydrophobicContact CD1-CB 3.85Å; L65-F111 HydrophobicContact CD1-CD2 4.25Å; L65-F111 HydrophobicContact CD1-CG 4Å; L65-L115 HydrophobicContact CD2-CD1 4.12Å; L65-A141 HydrophobicContact CD2-CB 3.92Å
66	Q	90.8	Very high	88	Confident	96 Å²	96	53.2 Å²	53.2	45%	0.449	28%	0.279	S	S	.	.	H	α-helix	trans	-62	-46	-179	-175	179	-6.1	0	0	112.3	M62 E63 L69 T70 V144 I148	M62-Q66 WeakPolarHBondContact O-CB 3.34Å; M62-Q66 PolarHBondContact O-N 2.98Å; E63-Q66 PolarHBondContact O-N 3.07Å; Q66-L69 PolarHBondContact O-N 3.3Å; Q66-T70 WeakPolarHBondContact O-CB 3.45Å; Q66-T70 WeakPolarHBondContact O-CG2 3.41Å; Q66-T70 PolarHBondContact O-N 2.88Å; Q66-T70 PolarHBondContact O-OG1 3.46Å; Q66-V144 HydrophobicContact CB-CG1 4.31Å; Q66-V144 HydrophobicContact CG-CG1 4.29Å; Q66-I148 HydrophobicContact CG-CD1 3.98Å
67	V	90.8	Very high	88.3	Confident	83 Å²	83	48.4 Å²	48.4	50%	0.503	26%	0.258	S	S	.	.	H	α-helix	trans	-63.2	-49.3	177.9	171.7	0	0	0	0	110	E63 L69 T70 T71	E63-V67 WeakPolarHBondContact O-CB 3.39Å; E63-V67 VanDerWaalsContact O-CG2 3.31Å; E63-V67 WeakPolarHBondContact O-CG2 3.32Å; E63-V67 PolarHBondContact O-N 3.37Å; V67-L69 VanDerWaalsContact C-N 3.32Å; V67-L69 PolarHBondContact O-N 3.3Å; V67-T70 PolarHBondContact O-N 3.12Å; V67-T70 PolarHBondContact O-OG1 3.23Å; V67-T71 HydrophobicContact CG1-CG2 4.21Å; V67-T71 WeakPolarHBondContact O-CB 3.37Å; V67-T71 WeakPolarHBondContact O-CG2 3.41Å; V67-T71 PolarHBondContact O-N 3.02Å; V67-T71 PolarHBondContact O-OG1 3.43Å
68	R	88.9	Confident	88.5	Confident	133 Å²	133	50.5 Å²	50.5	50%	0.502	27%	0.266	S	S	.	.	H	α-helix	trans	-64.4	-37.8	179.8	-66.4	-69	-71.7	179.2	-5.1	112.3	T64 L65 A72 I73 F111	T64-R68 HydrophobicContact CG2-CG 4.33Å; T64-R68 WeakPolarHBondContact O-CB 3.5Å; T64-R68 WeakPolarHBondContact O-CG 3.05Å; T64-R68 PolarHBondContact O-N 3.31Å; L65-R68 PolarHBondContact O-N 3.06Å; R68-A72 PolarHBondContact O-N 3.33Å; R68-A72 VanDerWaalsContact O-N 3.1Å; R68-I73 HydrophobicContact CB-CD1 4.47Å; R68-I73 PolarHBondContact O-N 3.07Å; R68-I73 VanDerWaalsContact O-N 3.1Å; R68-F111 HydrophobicContact CB-CZ 4.29Å; R68-F111 HydrophobicContact CG-CZ 4.08Å
69	L	89.2	Confident	88.6	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.284	C	S	.	.	I	π-helix	trans	-64.1	-43	177	-175	68.4	0	0	0	111.4	L65 Q66 V67 I73 A74 L108 I145 I148 L149	L65-L69 WeakPolarHBondContact O-CB 3.44Å; L65-L69 PolarHBondContact O-N 2.96Å; Q66-L69 PolarHBondContact O-N 3.3Å; V67-L69 VanDerWaalsContact C-N 3.32Å; V67-L69 PolarHBondContact O-N 3.3Å; L69-I73 HydrophobicContact CD1-CB 4.05Å; L69-I73 HydrophobicContact CD1-CG2 3.99Å; L69-A74 WeakPolarHBondContact O-CB 3.47Å; L69-A74 PolarHBondContact O-N 3.09Å; L69-L108 HydrophobicContact CD1-CD2 4.08Å; L69-I145 HydrophobicContact CD2-CB 4.37Å; L69-I145 HydrophobicContact CD2-CG1 4.02Å; L69-I148 HydrophobicContact CD2-CB 3.81Å; L69-I148 HydrophobicContact CD2-CD1 3.72Å; L69-I148 HydrophobicContact CD2-CG1 4.35Å; L69-I148 HydrophobicContact CD2-CG2 3.96Å; L69-I148 HydrophobicContact CG-CB 4.4Å; L69-I148 HydrophobicContact CG-CD1 4.38Å; L69-I148 HydrophobicContact CG-CG2 3.97Å; L69-L149 HydrophobicContact CD1-CD1 4.48Å
70	T	89.7	Confident	88.5	Confident	67 Å²	67	51.6 Å²	51.6	41%	0.411	28%	0.281	S	S	.	.	I	π-helix	trans	-74.8	-40.5	179.6	49.7	0	0	0	0	113.6	Q66 V67 P75 I148	Q66-T70 WeakPolarHBondContact O-CB 3.45Å; Q66-T70 WeakPolarHBondContact O-CG2 3.41Å; Q66-T70 PolarHBondContact O-N 2.88Å; Q66-T70 PolarHBondContact O-OG1 3.46Å; V67-T70 PolarHBondContact O-N 3.12Å; V67-T70 PolarHBondContact O-OG1 3.23Å; T70-P75 WeakPolarHBondContact O-CD 3.39Å; T70-I148 HydrophobicContact CG2-CD1 3.75Å; T70-I148 HydrophobicContact CG2-CG1 4.19Å; T70-I148 HydrophobicContact CG2-CG2 4.08Å
71	T	90.8	Very high	88	Confident	94 Å²	94	48.5 Å²	48.5	58%	0.577	27%	0.269	S	S	*	.	I	π-helix	trans	-85.6	-28.7	-173	62.9	0	0	0	0	114.4	V67	V67-T71 HydrophobicContact CG1-CG2 4.21Å; V67-T71 WeakPolarHBondContact O-CB 3.37Å; V67-T71 WeakPolarHBondContact O-CG2 3.41Å; V67-T71 PolarHBondContact O-N 3.02Å; V67-T71 PolarHBondContact O-OG1 3.43Å
72	A	88.9	Confident	87.5	Confident	34 Å²	34	55.3 Å²	55.3	28%	0.281	30%	0.299	S	S	.	.	I	π-helix	trans	-130.1	-55.7	-170	0	0	0	0	0	113.3	R68 P75 E76	R68-A72 PolarHBondContact O-N 3.33Å; R68-A72 VanDerWaalsContact O-N 3.1Å; A72-P75 WeakPolarHBondContact O-CD 3.29Å; A72-E76 VanDerWaalsContact O-CB 3.23Å; A72-E76 WeakPolarHBondContact O-CB 3.46Å; A72-E76 PolarHBondContact O-N 3.3Å
73	I	89.5	Confident	86.7	Confident	10 Å²	10	58.2 Å²	58.2	5%	0.051	31%	0.312	C	S	.	.	I	π-helix	trans	-70.8	-47.4	-168	-55.3	171.9	0	0	0	111.8	R68 L69 E76 F77 L104 R107 L108	R68-I73 HydrophobicContact CB-CD1 4.47Å; R68-I73 PolarHBondContact O-N 3.07Å; R68-I73 VanDerWaalsContact O-N 3.1Å; L69-I73 HydrophobicContact CD1-CB 4.05Å; L69-I73 HydrophobicContact CD1-CG2 3.99Å; I73-E76 PolarHBondContact O-N 2.87Å; I73-F77 WeakPolarHBondContact O-CB 3.38Å; I73-F77 PolarHBondContact O-N 3.28Å; I73-L104 HydrophobicContact CG2-CD1 3.52Å; I73-R107 HydrophobicContact CD1-CB 4.17Å; I73-R107 HydrophobicContact CG1-CB 4.17Å; I73-R107 HydrophobicContact CG2-CB 4.09Å; I73-L108 HydrophobicContact CD1-CD2 4.09Å
74	A	88.2	Confident	85.5	Confident	6 Å²	6	56.1 Å²	56.1	5%	0.05	31%	0.309	C	S	.	.	H	α-helix	trans	-65.9	-45.8	178.9	0	0	0	0	0	112.4	L69 E76 F77 W78 I148 L149	L69-A74 WeakPolarHBondContact O-CB 3.47Å; L69-A74 PolarHBondContact O-N 3.09Å; A74-E76 PolarHBondContact O-N 3.35Å; A74-F77 PolarHBondContact O-N 2.94Å; A74-W78 PolarHBondContact O-N 3.49Å; A74-I148 HydrophobicContact CB-CG2 4.27Å; A74-L149 HydrophobicContact CB-CD2 3.57Å
75	P	89.4	Confident	84	Confident	66 Å²	66	59 Å²	59	43%	0.429	32%	0.32	S	S	.	.	H	α-helix	trans	-58.6	-41.9	173.1	-26.4	35.4	0	0	0	114	T70 A72 W78 A79	T70-P75 WeakPolarHBondContact O-CD 3.39Å; A72-P75 WeakPolarHBondContact O-CD 3.29Å; P75-W78 PolarHBondContact O-N 2.8Å; P75-A79 WeakPolarHBondContact O-CB 3.33Å; P75-A79 PolarHBondContact O-N 3.26Å
76	E	89.4	Confident	82.6	Confident	81 Å²	81	66.8 Å²	66.8	38%	0.379	36%	0.362	S	S	.	.	H	α-helix	trans	-60.6	-46.1	176.2	-174.7	179.9	-168.4	0	0	110.8	A72 I73 A74 A79 G80 R107	A72-E76 VanDerWaalsContact O-CB 3.23Å; A72-E76 WeakPolarHBondContact O-CB 3.46Å; A72-E76 PolarHBondContact O-N 3.3Å; I73-E76 PolarHBondContact O-N 2.87Å; A74-E76 PolarHBondContact O-N 3.35Å; E76-A79 PolarHBondContact O-N 3.46Å; E76-G80 PolarHBondContact O-N 2.98Å; E76-R107 IonicContact OE1-CZ 3.12Å; E76-R107 IonicContact OE1-NE 2.98Å; E76-R107 IonicContact OE1-NH2 3.49Å; E76-R107 PolarHBondContact OE1-NH2 2.94Å; E76-R107 IonicContact OE2-NE 3.23Å; E76-R107 PolarHBondContact OE2-NE 2.76Å; E76-R107 IonicContact OE2-NH2 2.64Å
77	F	89.7	Confident	81.2	Confident	13 Å²	13	70.2 Å²	70.2	6%	0.057	38%	0.378	C	S	.	.	H	α-helix	trans	-59.1	-51.1	176.2	174.2	-100.9	0	0	0	112.3	I73 A74 A79 G80 M81 A100 F101 L104 L149 L157	I73-F77 WeakPolarHBondContact O-CB 3.38Å; I73-F77 PolarHBondContact O-N 3.28Å; A74-F77 PolarHBondContact O-N 2.94Å; F77-A79 PolarHBondContact O-N 2.85Å; F77-G80 PolarHBondContact O-N 3.06Å; F77-M81 PolarHBondContact O-N 3.48Å; F77-A100 HydrophobicContact CD2-CB 4.08Å; F77-A100 HydrophobicContact CE2-CB 3.97Å; F77-F101 HydrophobicContact CE2-CD1 4.15Å; F77-F101 HydrophobicContact CE2-CE1 4.14Å; F77-F101 HydrophobicContact CE2-CG 4.36Å; F77-F101 HydrophobicContact CE2-CZ 4.35Å; F77-F101 HydrophobicContact CZ-CD1 4.48Å; F77-F101 HydrophobicContact CZ-CE1 4.01Å; F77-F101 HydrophobicContact CZ-CE2 4.39Å; F77-F101 AromaticContact CZ-CZ 3.96Å; F77-F101 HydrophobicContact CZ-CZ 3.96Å; F77-L104 HydrophobicContact CD2-CB 4.07Å; F77-L104 HydrophobicContact CD2-CD2 4.08Å; F77-L104 HydrophobicContact CE2-CD2 4.11Å; F77-L149 HydrophobicContact CD1-CD2 4.42Å; F77-L157 HydrophobicContact CZ-CD1 4.47Å
78	W	88.3	Confident	80.4	Confident	45 Å²	45	68.7 Å²	68.7	17%	0.17	37%	0.367	C	S	.	.	H	α-helix	trans	-69.9	-31.9	-178.9	-66.2	118.9	0	0	0	113.3	A74 P75 M81 K82 L149 L157	A74-W78 PolarHBondContact O-N 3.49Å; P75-W78 PolarHBondContact O-N 2.8Å; W78-M81 PolarHBondContact O-N 3.22Å; W78-K82 WeakPolarHBondContact O-CG 3.46Å; W78-K82 PolarHBondContact O-N 2.8Å; W78-L149 VanDerWaalsContact CZ2-O 3.28Å; W78-L149 WeakPolarHBondContact CZ2-O 3.43Å; W78-L157 HydrophobicContact CH2-CB 4.34Å; W78-L157 HydrophobicContact CH2-CD2 3.64Å; W78-L157 HydrophobicContact CZ3-CB 3.86Å; W78-L157 HydrophobicContact CZ3-CD2 3.94Å; W78-L157 HydrophobicContact CZ3-CG 4.46Å
79	A	86.1	Confident	80	Confident	65 Å²	65	67.7 Å²	67.7	54%	0.537	37%	0.368	S	S	.	.	H	α-helix	trans	-66.4	-40.5	173.8	0	0	0	0	0	111.4	P75 E76 F77 M81 K82	P75-A79 WeakPolarHBondContact O-CB 3.33Å; P75-A79 PolarHBondContact O-N 3.26Å; E76-A79 PolarHBondContact O-N 3.46Å; F77-A79 PolarHBondContact O-N 2.85Å; A79-M81 PolarHBondContact O-N 3.03Å; A79-K82 PolarHBondContact O-N 2.83Å
80	G	81.3	Confident	79.7	Confident	26 Å²	26	69.2 Å²	69.2	27%	0.268	38%	0.375	S	S	.	.	H	α-helix	trans	-59.8	-31.5	175.3	0	0	0	0	0	113.6	E76 F77 I96	E76-G80 PolarHBondContact O-N 2.98Å; F77-G80 PolarHBondContact O-N 3.06Å; G80-I96 WeakPolarHBondContact O-CG2 3.38Å
81	M	80.6	Confident	79.4	Confident	7 Å²	7	69.5 Å²	69.5	3%	0.034	37%	0.371	C	S	.	.	H	α-helix	trans	-82.1	-19.6	-179.8	-69.2	-63.1	-69.4	0	0	114.6	F77 W78 A79 Q83 L97 A100 L157 R160	F77-M81 PolarHBondContact O-N 3.48Å; W78-M81 PolarHBondContact O-N 3.22Å; A79-M81 PolarHBondContact O-N 3.03Å; M81-Q83 PolarHBondContact O-N 3.27Å; M81-L97 HydrophobicContact CE-CD1 3.48Å; M81-L97 VanDerWaalsContact CE-CD1 3.48Å; M81-L97 HydrophobicContact SD-CD1 4.13Å; M81-A100 HydrophobicContact CG-CB 4.2Å; M81-A100 HydrophobicContact SD-CB 3.73Å; M81-L157 HydrophobicContact CE-CD1 3.81Å; M81-R160 HydrophobicContact CE-CB 4.11Å; M81-R160 HydrophobicContact CE-CG 4.13Å
82	K	74.4	Confident	79.1	Confident	144 Å²	144	68.1 Å²	68.1	63%	0.626	36%	0.36	S	S	*	.			trans	-89.2	19	-173.4	-75.2	177.9	-178.7	-176.1	0	115	W78 A79	W78-K82 WeakPolarHBondContact O-CG 3.46Å; W78-K82 PolarHBondContact O-N 2.8Å; A79-K82 PolarHBondContact O-N 2.83Å
83	Q	69.1	Low	79	Confident	89 Å²	89	68.5 Å²	68.5	42%	0.416	35%	0.354	S	S	.	.			trans	-63.4	148.3	178.2	-65.4	-173.5	7.4	0	0	111.7	M81 E85 L88	M81-Q83 PolarHBondContact O-N 3.27Å; Q83-E85 PolarHBondContact O-N 2.74Å; Q83-L88 HydrophobicContact CB-CD1 4.3Å
84	P	63.9	Low	78.9	Confident	83 Å²	83	68.4 Å²	68.4	54%	0.539	35%	0.354	S	S	.	.			trans	-62.2	126.7	-170.7	23.4	-32.8	0	0	0	112.9	N86	P84-N86 PolarHBondContact O-N 3.2Å
85	E	56.4	Low	78.8	Confident	96 Å²	96	75.2 Å²	75.2	45%	0.449	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-31.5	-172.2	-84.4	160.6	-166.8	0	0	115.3	Q83 E87 R160	Q83-E85 PolarHBondContact O-N 2.74Å; E85-E87 PolarHBondContact O-N 2.79Å; E85-R160 IonicContact OE1-NH2 3.45Å
86	N	58.5	Low	78.8	Confident	164 Å²	164	73.8 Å²	73.8	88%	0.877	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-8	-165.5	-68.8	-22.3	0	0	0	114.6	P84	P84-N86 PolarHBondContact O-N 3.2Å
87	E	62.1	Low	78.8	Confident	168 Å²	168	70 Å²	70	79%	0.785	35%	0.35	S	S	*	.	S	Bend	trans	-112.4	-11	-171.9	-65.3	-176.2	175.7	0	0	114.2	E85	E85-E87 PolarHBondContact O-N 2.79Å
88	L	74.4	Confident	78.7	Confident	51 Å²	51	69.7 Å²	69.7	27%	0.267	35%	0.348	S	S	.	.			trans	-101.9	143.8	-174	-66.5	169	0	0	0	111.4	Q83 D92 R93 I96	Q83-L88 HydrophobicContact CB-CD1 4.3Å; L88-D92 HydrophobicContact CB-CB 4.42Å; L88-D92 HydrophobicContact CD2-CB 4.17Å; L88-R93 HydrophobicContact CB-CG 4.06Å; L88-R93 PolarHBondContact O-NH1 3.39Å; L88-I96 HydrophobicContact CD1-CD1 3.55Å
89	E	80.8	Confident	78.8	Confident	113 Å²	113	70.7 Å²	70.7	53%	0.528	36%	0.356	S	S	.	.			trans	-75	157.9	167	-66.8	-172.1	172.2	0	0	110.1	K91 D92 R93 R203	E89-K91 PolarHBondContact O-N 2.94Å; E89-D92 PolarHBondContact O-N 3.32Å; E89-R93 PolarHBondContact O-N 2.98Å; E89-R93 VanDerWaalsContact O-N 3.1Å; E89-R203 IonicContact OE1-NH1 2.71Å
90	E	81.7	Confident	79	Confident	32 Å²	32	68.1 Å²	68.1	15%	0.15	34%	0.335	C	S	.	.	H	α-helix	trans	-55.2	-39.4	179.5	-174.1	-175.6	166.5	0	0	112.8	D92 R93 A94 E163 R167 W205	E90-D92 VanDerWaalsContact C-N 3.3Å; E90-D92 PolarHBondContact O-N 3.43Å; E90-R93 PolarHBondContact O-N 3.42Å; E90-A94 PolarHBondContact O-N 3.12Å; E90-E163 HydrophobicContact CG-CG 4.41Å; E90-R167 VanDerWaalsContact CD-NE 3.32Å; E90-R167 VanDerWaalsContact OE1-CB 3.23Å; E90-R167 WeakPolarHBondContact OE1-CB 3.34Å; E90-R167 WeakPolarHBondContact OE1-CG 3.08Å; E90-R167 IonicContact OE1-CZ 2.88Å; E90-R167 IonicContact OE1-NE 2.7Å; E90-R167 PolarHBondContact OE1-NE 3.48Å; E90-R167 IonicContact OE1-NH2 3.24Å; E90-R167 IonicContact OE2-CZ 3.79Å; E90-R167 IonicContact OE2-NE 3.74Å; E90-R167 PolarHBondContact OE2-NE 3.32Å; E90-R167 VanDerWaalsContact OE2-NE 3.13Å; E90-R167 IonicContact OE2-NH2 2.95Å; E90-R167 PolarHBondContact OE2-NH2 2.98Å; E90-W205 HydrophobicContact CG-CZ2 4.06Å
91	K	83.9	Confident	79.5	Confident	73 Å²	73	67 Å²	67	32%	0.317	32%	0.323	S	S	.	.	H	α-helix	trans	-58.6	-40.3	175.6	176.4	177.2	173.7	164.7	0	112.4	E89 R95 W205	E89-K91 PolarHBondContact O-N 2.94Å; K91-R95 PolarHBondContact O-N 2.88Å; K91-R95 VanDerWaalsContact O-N 3.09Å; K91-W205 HydrophobicContact CB-CD2 4.09Å; K91-W205 HydrophobicContact CB-CE3 4.45Å; K91-W205 HydrophobicContact CB-CG 4.38Å; K91-W205 HydrophobicContact CB-CZ2 4.5Å; K91-W205 HydrophobicContact CD-CB 4.16Å; K91-W205 HydrophobicContact CD-CG 4.22Å; K91-W205 HydrophobicContact CG-CD2 4.22Å; K91-W205 HydrophobicContact CG-CE3 4.28Å; K91-W205 HydrophobicContact CG-CG 4.41Å
92	D	85	Confident	80	Confident	65 Å²	65	70.6 Å²	70.6	35%	0.348	34%	0.335	S	S	.	.	H	α-helix	trans	-73.1	-38.2	-179.9	-63.6	-43.8	0	0	0	110.8	L88 E89 E90 R95 I96	L88-D92 HydrophobicContact CB-CB 4.42Å; L88-D92 HydrophobicContact CD2-CB 4.17Å; E89-D92 PolarHBondContact O-N 3.32Å; E90-D92 VanDerWaalsContact C-N 3.3Å; E90-D92 PolarHBondContact O-N 3.43Å; D92-R95 WeakPolarHBondContact O-CB 3.3Å; D92-R95 PolarHBondContact O-N 2.98Å; D92-I96 WeakPolarHBondContact O-CD1 3.34Å; D92-I96 VanDerWaalsContact O-CG1 3.29Å; D92-I96 WeakPolarHBondContact O-CG1 3.44Å; D92-I96 PolarHBondContact O-N 3.39Å
93	R	86.4	Confident	80.7	Confident	42 Å²	42	66.4 Å²	66.4	16%	0.158	32%	0.322	C	S	.	.	H	α-helix	trans	-60.5	-45.4	172.6	-67	-166.5	-71.1	-82.8	-0.3	112.3	L88 E89 E90 R95 I96 L97 E163	L88-R93 HydrophobicContact CB-CG 4.06Å; L88-R93 PolarHBondContact O-NH1 3.39Å; E89-R93 PolarHBondContact O-N 2.98Å; E89-R93 VanDerWaalsContact O-N 3.1Å; E90-R93 PolarHBondContact O-N 3.42Å; R93-R95 VanDerWaalsContact C-N 3.3Å; R93-R95 PolarHBondContact O-N 2.94Å; R93-I96 PolarHBondContact O-N 3.37Å; R93-L97 PolarHBondContact O-N 2.88Å; R93-E163 IonicContact CZ-OE1 2.9Å; R93-E163 IonicContact NE-OE1 2.73Å; R93-E163 PolarHBondContact NE-OE1 3.05Å; R93-E163 VanDerWaalsContact NE-OE1 3.16Å; R93-E163 IonicContact NE-OE2 2.67Å; R93-E163 PolarHBondContact NE-OE2 3.28Å; R93-E163 VanDerWaalsContact NE-OE2 3.1Å; R93-E163 IonicContact NH2-OE1 3.34Å; R93-E163 PolarHBondContact NH2-OE1 3.23Å
94	A	86.5	Confident	81.7	Confident	7 Å²	7	62.3 Å²	62.3	6%	0.058	30%	0.303	C	S	.	.	H	α-helix	trans	-60.1	-40.4	175.3	0	0	0	0	0	111.9	E90 L97 L98 F164 W205	E90-A94 PolarHBondContact O-N 3.12Å; A94-L97 PolarHBondContact O-N 2.63Å; A94-L98 PolarHBondContact O-N 2.77Å; A94-L98 VanDerWaalsContact O-N 3.12Å; A94-F164 HydrophobicContact CB-CD2 3.64Å; A94-F164 HydrophobicContact CB-CE2 3.97Å; A94-W205 HydrophobicContact CB-CH2 3.9Å; A94-W205 HydrophobicContact CB-CZ3 4.11Å
95	R	86.8	Confident	83	Confident	149 Å²	149	58.7 Å²	58.7	56%	0.562	28%	0.279	S	S	*	.	H	α-helix	trans	-65.2	-42.6	175.5	-170.5	178.8	-178.4	172.5	1.2	112.2	K91 D92 R93 L98 M99	K91-R95 PolarHBondContact O-N 2.88Å; K91-R95 VanDerWaalsContact O-N 3.09Å; D92-R95 WeakPolarHBondContact O-CB 3.3Å; D92-R95 PolarHBondContact O-N 2.98Å; R93-R95 VanDerWaalsContact C-N 3.3Å; R93-R95 PolarHBondContact O-N 2.94Å; R95-L98 PolarHBondContact O-N 2.97Å; R95-M99 HydrophobicContact CG-CG 4.44Å; R95-M99 VanDerWaalsContact O-CG 3.29Å; R95-M99 WeakPolarHBondContact O-CG 3.4Å; R95-M99 PolarHBondContact O-N 3.13Å
96	I	88.6	Confident	84.5	Confident	37 Å²	37	59.5 Å²	59.5	19%	0.19	29%	0.286	C	S	.	.	H	α-helix	trans	-61.9	-44.4	177.4	-69.3	158	0	0	0	110.7	G80 L88 D92 R93 L98 M99 A100	G80-I96 WeakPolarHBondContact O-CG2 3.38Å; L88-I96 HydrophobicContact CD1-CD1 3.55Å; D92-I96 WeakPolarHBondContact O-CD1 3.34Å; D92-I96 VanDerWaalsContact O-CG1 3.29Å; D92-I96 WeakPolarHBondContact O-CG1 3.44Å; D92-I96 PolarHBondContact O-N 3.39Å; R93-I96 PolarHBondContact O-N 3.37Å; I96-L98 VanDerWaalsContact C-N 3.34Å; I96-L98 PolarHBondContact O-N 3.18Å; I96-M99 PolarHBondContact O-N 3.49Å; I96-A100 WeakPolarHBondContact O-CB 3.45Å; I96-A100 PolarHBondContact O-N 2.71Å
97	L	89.6	Confident	85.9	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-54.9	-50.2	175.2	178	69.9	0	0	0	111.1	M81 R93 A94 A100 F101 L157 R160 I161 F164 L216	M81-L97 HydrophobicContact CE-CD1 3.48Å; M81-L97 VanDerWaalsContact CE-CD1 3.48Å; M81-L97 HydrophobicContact SD-CD1 4.13Å; R93-L97 PolarHBondContact O-N 2.88Å; A94-L97 PolarHBondContact O-N 2.63Å; L97-A100 PolarHBondContact O-N 3.3Å; L97-F101 HydrophobicContact CD1-CD2 4.13Å; L97-F101 HydrophobicContact CD1-CE2 3.79Å; L97-F101 HydrophobicContact CG-CD2 4.44Å; L97-F101 HydrophobicContact CG-CE2 4.49Å; L97-F101 WeakPolarHBondContact O-CD2 3.48Å; L97-F101 PolarHBondContact O-N 3.48Å; L97-L157 HydrophobicContact CD1-CD1 4.07Å; L97-R160 HydrophobicContact CD1-CB 4.36Å; L97-I161 HydrophobicContact CD1-CG1 4.17Å; L97-I161 HydrophobicContact CD2-CG1 4.36Å; L97-F164 HydrophobicContact CD2-CB 4Å; L97-F164 HydrophobicContact CD2-CD1 4.36Å; L97-F164 HydrophobicContact CD2-CG 4.17Å; L97-L216 HydrophobicContact CD2-CD2 4.23Å
98	L	89.1	Confident	87.1	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.026	23%	0.23	C	C	.	.	H	α-helix	trans	-63.4	-44.3	178.7	-179	62.2	0	0	0	112.1	A94 R95 I96 A100 F101 R102 Q212 E215 L216	A94-L98 PolarHBondContact O-N 2.77Å; A94-L98 VanDerWaalsContact O-N 3.12Å; R95-L98 PolarHBondContact O-N 2.97Å; I96-L98 VanDerWaalsContact C-N 3.34Å; I96-L98 PolarHBondContact O-N 3.18Å; L98-A100 VanDerWaalsContact C-N 3.35Å; L98-A100 PolarHBondContact O-N 3.35Å; L98-F101 PolarHBondContact O-N 3.14Å; L98-R102 WeakPolarHBondContact O-CG 3.43Å; L98-R102 PolarHBondContact O-N 3.28Å; L98-Q212 HydrophobicContact CD2-CB 4.25Å; L98-Q212 HydrophobicContact CD2-CG 3.96Å; L98-E215 HydrophobicContact CD1-CB 4.34Å; L98-E215 HydrophobicContact CD1-CG 4.19Å; L98-E215 WeakPolarHBondContact CD2-OE2 3.22Å; L98-L216 HydrophobicContact CD1-CB 3.98Å; L98-L216 HydrophobicContact CD1-CD1 4.14Å
99	M	89.3	Confident	87.8	Confident	66 Å²	66	50.9 Å²	50.9	33%	0.325	23%	0.234	S	C	.	.	H	α-helix	trans	-61.6	-41.7	177.4	-70	-55.9	92.3	0	0	112.1	R95 I96 F101 R102 T103	R95-M99 HydrophobicContact CG-CG 4.44Å; R95-M99 VanDerWaalsContact O-CG 3.29Å; R95-M99 WeakPolarHBondContact O-CG 3.4Å; R95-M99 PolarHBondContact O-N 3.13Å; I96-M99 PolarHBondContact O-N 3.49Å; M99-F101 VanDerWaalsContact C-N 3.34Å; M99-F101 PolarHBondContact O-N 3.2Å; M99-R102 HydrophobicContact CE-CG 4.48Å; M99-R102 PolarHBondContact O-N 2.92Å; M99-T103 WeakPolarHBondContact O-CB 3.41Å; M99-T103 PolarHBondContact O-N 3.47Å; M99-T103 PolarHBondContact O-OG1 3.44Å; M99-T103 VanDerWaalsContact O-OG1 3.07Å
100	A	90.8	Very high	88	Confident	11 Å²	11	46.8 Å²	46.8	9%	0.091	22%	0.217	C	C	.	.	H	α-helix	trans	-59.5	-44.8	178.3	0	0	0	0	0	111.5	F77 M81 I96 L97 L98 L104	F77-A100 HydrophobicContact CD2-CB 4.08Å; F77-A100 HydrophobicContact CE2-CB 3.97Å; M81-A100 HydrophobicContact CG-CB 4.2Å; M81-A100 HydrophobicContact SD-CB 3.73Å; I96-A100 WeakPolarHBondContact O-CB 3.45Å; I96-A100 PolarHBondContact O-N 2.71Å; L97-A100 PolarHBondContact O-N 3.3Å; L98-A100 VanDerWaalsContact C-N 3.35Å; L98-A100 PolarHBondContact O-N 3.35Å; A100-L104 WeakPolarHBondContact O-CB 3.27Å; A100-L104 PolarHBondContact O-N 2.75Å
101	F	91.1	Very high	88.2	Confident	4 Å²	4	46 Å²	46	2%	0.018	21%	0.213	C	C	.	.	H	α-helix	trans	-70	-35.6	176.1	-82.3	-70.2	0	0	0	113.4	F77 L97 L98 M99 L104 L105 L157 L216 V219 L220 L223 V229	F77-F101 HydrophobicContact CE2-CD1 4.15Å; F77-F101 HydrophobicContact CE2-CE1 4.14Å; F77-F101 HydrophobicContact CE2-CG 4.36Å; F77-F101 HydrophobicContact CE2-CZ 4.35Å; F77-F101 HydrophobicContact CZ-CD1 4.48Å; F77-F101 HydrophobicContact CZ-CE1 4.01Å; F77-F101 HydrophobicContact CZ-CE2 4.39Å; F77-F101 AromaticContact CZ-CZ 3.96Å; F77-F101 HydrophobicContact CZ-CZ 3.96Å; L97-F101 HydrophobicContact CD1-CD2 4.13Å; L97-F101 HydrophobicContact CD1-CE2 3.79Å; L97-F101 HydrophobicContact CG-CD2 4.44Å; L97-F101 HydrophobicContact CG-CE2 4.49Å; L97-F101 WeakPolarHBondContact O-CD2 3.48Å; L97-F101 PolarHBondContact O-N 3.48Å; L98-F101 PolarHBondContact O-N 3.14Å; M99-F101 VanDerWaalsContact C-N 3.34Å; M99-F101 PolarHBondContact O-N 3.2Å; F101-L104 HydrophobicContact CD1-CD2 4.25Å; F101-L104 PolarHBondContact O-N 2.84Å; F101-L105 PolarHBondContact O-N 2.69Å; F101-L157 HydrophobicContact CE2-CD1 3.98Å; F101-L157 HydrophobicContact CZ-CD1 4.01Å; F101-L216 HydrophobicContact CB-CD1 4.28Å; F101-L216 HydrophobicContact CD2-CD1 3.83Å; F101-L216 HydrophobicContact CG-CD1 4.27Å; F101-V219 HydrophobicContact CB-CG1 3.84Å; F101-V219 WeakPolarHBondContact O-CG1 3.45Å; F101-L220 HydrophobicContact CD1-CD2 3.6Å; F101-L220 HydrophobicContact CD2-CD2 4.44Å; F101-L220 HydrophobicContact CE1-CD2 3.46Å; F101-L220 VanDerWaalsContact CE1-CD2 3.46Å; F101-L220 HydrophobicContact CE2-CD2 4.31Å; F101-L220 HydrophobicContact CG-CD2 4.11Å; F101-L220 HydrophobicContact CZ-CD2 3.84Å; F101-L223 HydrophobicContact CD1-CD1 4.11Å; F101-V229 HydrophobicContact CZ-CG1 4.07Å
102	R	90.7	Very high	88.2	Confident	81 Å²	81	42.9 Å²	42.9	31%	0.306	20%	0.2	S	C	.	.	H	α-helix	trans	-64.1	-48.1	173	-72.6	-166.7	-157	171.1	9.6	111.7	L98 M99 L104 L105 D106 E215 V219	L98-R102 WeakPolarHBondContact O-CG 3.43Å; L98-R102 PolarHBondContact O-N 3.28Å; M99-R102 HydrophobicContact CE-CG 4.48Å; M99-R102 PolarHBondContact O-N 2.92Å; R102-L104 VanDerWaalsContact C-N 3.28Å; R102-L104 PolarHBondContact O-N 2.92Å; R102-L105 WeakPolarHBondContact O-CB 3.28Å; R102-L105 PolarHBondContact O-N 3.44Å; R102-L105 VanDerWaalsContact O-N 3.11Å; R102-D106 VanDerWaalsContact O-CG 3.32Å; R102-D106 PolarHBondContact O-N 2.92Å; R102-E215 IonicContact CZ-OE1 3.02Å; R102-E215 IonicContact CZ-OE2 2.88Å; R102-E215 IonicContact NE-OE1 3.44Å; R102-E215 PolarHBondContact NE-OE1 3.38Å; R102-E215 IonicContact NE-OE2 2.78Å; R102-E215 IonicContact NH1-OE1 3.15Å; R102-E215 IonicContact NH2-OE1 3.67Å; R102-E215 PolarHBondContact NH2-OE1 3.16Å; R102-E215 IonicContact NH2-OE2 3.89Å; R102-E215 PolarHBondContact NH2-OE2 3.03Å; R102-V219 HydrophobicContact CG-CG2 4.03Å
103	T	90.2	Very high	88.2	Confident	56 Å²	56	40.1 Å²	40.1	34%	0.344	19%	0.187	S	C	.	.	H	α-helix	trans	-60.3	-40.6	176.7	-59.7	0	0	0	0	110.8	M99 L105 D106 R107	M99-T103 WeakPolarHBondContact O-CB 3.41Å; M99-T103 PolarHBondContact O-N 3.47Å; M99-T103 PolarHBondContact O-OG1 3.44Å; M99-T103 VanDerWaalsContact O-OG1 3.07Å; T103-L105 PolarHBondContact O-N 3.22Å; T103-D106 PolarHBondContact O-N 2.96Å; T103-R107 HydrophobicContact CG2-CG 4.28Å; T103-R107 WeakPolarHBondContact O-CB 3.48Å; T103-R107 WeakPolarHBondContact O-CG 3.13Å; T103-R107 PolarHBondContact O-N 3.49Å
104	L	90.8	Very high	88.1	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-58.5	-46.7	173.8	179.1	62.5	0	0	0	111.9	I73 F77 A100 F101 R102 R107 L108 L149 L223	I73-L104 HydrophobicContact CG2-CD1 3.52Å; F77-L104 HydrophobicContact CD2-CB 4.07Å; F77-L104 HydrophobicContact CD2-CD2 4.08Å; F77-L104 HydrophobicContact CE2-CD2 4.11Å; A100-L104 WeakPolarHBondContact O-CB 3.27Å; A100-L104 PolarHBondContact O-N 2.75Å; F101-L104 HydrophobicContact CD1-CD2 4.25Å; F101-L104 PolarHBondContact O-N 2.84Å; R102-L104 VanDerWaalsContact C-N 3.28Å; R102-L104 PolarHBondContact O-N 2.92Å; L104-R107 PolarHBondContact O-N 3.03Å; L104-L108 HydrophobicContact CD1-CD1 3.74Å; L104-L108 HydrophobicContact CD1-CG 4.24Å; L104-L108 HydrophobicContact CG-CD1 3.91Å; L104-L108 WeakPolarHBondContact O-CB 3.39Å; L104-L108 VanDerWaalsContact O-CG 3.25Å; L104-L108 WeakPolarHBondContact O-CG 3.4Å; L104-L108 PolarHBondContact O-N 3.06Å; L104-L108 VanDerWaalsContact O-N 3.1Å; L104-L149 HydrophobicContact CD1-CD1 4.03Å; L104-L149 HydrophobicContact CD2-CD1 3.76Å; L104-L149 HydrophobicContact CG-CD1 4.5Å; L104-L223 HydrophobicContact CD2-CD1 4.09Å; L104-L223 HydrophobicContact CG-CD1 4.38Å
105	L	89.6	Confident	88	Confident	6 Å²	6	38 Å²	38	3%	0.031	18%	0.178	C	C	.	.	H	α-helix	trans	-62.3	-46.6	176.7	179	61.5	0	0	0	111.9	F101 R102 T103 R107 L108 Q109 V219 R222 L223	F101-L105 PolarHBondContact O-N 2.69Å; R102-L105 WeakPolarHBondContact O-CB 3.28Å; R102-L105 PolarHBondContact O-N 3.44Å; R102-L105 VanDerWaalsContact O-N 3.11Å; T103-L105 PolarHBondContact O-N 3.22Å; L105-R107 VanDerWaalsContact C-N 3.3Å; L105-R107 PolarHBondContact O-N 3.14Å; L105-L108 PolarHBondContact O-N 2.9Å; L105-L108 VanDerWaalsContact O-N 3.16Å; L105-Q109 WeakPolarHBondContact O-CB 3.34Å; L105-Q109 PolarHBondContact O-N 2.95Å; L105-V219 HydrophobicContact CB-CG1 4.27Å; L105-V219 HydrophobicContact CD2-CG1 4.11Å; L105-V219 HydrophobicContact CD2-CG2 4.45Å; L105-R222 HydrophobicContact CD1-CB 4.23Å; L105-R222 HydrophobicContact CD2-CB 4.24Å; L105-L223 HydrophobicContact CB-CD1 4.36Å; L105-L223 HydrophobicContact CB-CD2 4.12Å; L105-L223 HydrophobicContact CB-CG 4.29Å; L105-L223 HydrophobicContact CD1-CD2 3.68Å; L105-L223 HydrophobicContact CD1-CG 4.03Å
106	D	88.7	Confident	88	Confident	113 Å²	113	34.4 Å²	34.4	60%	0.604	17%	0.168	S	C	*	.	H	α-helix	trans	-61.7	-37.6	179.8	-68.2	-24.7	0	0	0	112.3	R102 T103 P110	R102-D106 VanDerWaalsContact O-CG 3.32Å; R102-D106 PolarHBondContact O-N 2.92Å; T103-D106 PolarHBondContact O-N 2.96Å; D106-P110 WeakPolarHBondContact O-CD 3.48Å
107	R	88.4	Confident	87.7	Confident	127 Å²	127	36.6 Å²	36.6	48%	0.479	17%	0.174	S	C	.	.	H	α-helix	trans	-72.4	-30	176.8	-66.9	-64.4	-165.6	-152.1	-4.4	113.1	I73 E76 T103 L104 L105	I73-R107 HydrophobicContact CD1-CB 4.17Å; I73-R107 HydrophobicContact CG1-CB 4.17Å; I73-R107 HydrophobicContact CG2-CB 4.09Å; E76-R107 IonicContact OE1-CZ 3.12Å; E76-R107 IonicContact OE1-NE 2.98Å; E76-R107 IonicContact OE1-NH2 3.49Å; E76-R107 PolarHBondContact OE1-NH2 2.94Å; E76-R107 IonicContact OE2-NE 3.23Å; E76-R107 PolarHBondContact OE2-NE 2.76Å; E76-R107 IonicContact OE2-NH2 2.64Å; T103-R107 HydrophobicContact CG2-CG 4.28Å; T103-R107 WeakPolarHBondContact O-CB 3.48Å; T103-R107 WeakPolarHBondContact O-CG 3.13Å; T103-R107 PolarHBondContact O-N 3.49Å; L104-R107 PolarHBondContact O-N 3.03Å; L105-R107 VanDerWaalsContact C-N 3.3Å; L105-R107 PolarHBondContact O-N 3.14Å
108	L	87.7	Confident	87.4	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-87	-26.8	179.5	-70	173.1	0	0	0	113	L65 L69 I73 L104 L105 P110 F111 L112 I145 L223	L65-L108 HydrophobicContact CD1-CD2 3.86Å; L69-L108 HydrophobicContact CD1-CD2 4.08Å; I73-L108 HydrophobicContact CD1-CD2 4.09Å; L104-L108 HydrophobicContact CD1-CD1 3.74Å; L104-L108 HydrophobicContact CD1-CG 4.24Å; L104-L108 HydrophobicContact CG-CD1 3.91Å; L104-L108 WeakPolarHBondContact O-CB 3.39Å; L104-L108 VanDerWaalsContact O-CG 3.25Å; L104-L108 WeakPolarHBondContact O-CG 3.4Å; L104-L108 PolarHBondContact O-N 3.06Å; L104-L108 VanDerWaalsContact O-N 3.1Å; L105-L108 PolarHBondContact O-N 2.9Å; L105-L108 VanDerWaalsContact O-N 3.16Å; L108-P110 VanDerWaalsContact C-CD 3.46Å; L108-F111 PolarHBondContact O-N 2.97Å; L108-F111 VanDerWaalsContact O-N 3.08Å; L108-L112 HydrophobicContact CB-CD1 4.11Å; L108-L112 HydrophobicContact CB-CG 4.42Å; L108-L112 WeakPolarHBondContact O-CG 3.41Å; L108-L112 PolarHBondContact O-N 3.35Å; L108-I145 HydrophobicContact CD1-CD1 4.15Å; L108-I145 HydrophobicContact CD1-CG2 4.35Å; L108-I145 HydrophobicContact CD2-CD1 4.28Å; L108-I145 HydrophobicContact CD2-CG1 4.46Å; L108-L223 HydrophobicContact CD1-CD2 3.9Å
109	Q	87.2	Confident	87.2	Confident	76 Å²	76	36.3 Å²	36.3	36%	0.355	17%	0.172	S	C	.	.	H	α-helix	trans	-53.8	-41	-174.7	-170.4	68.9	9.1	0	0	114.4	L105 F111 L112 G113	L105-Q109 WeakPolarHBondContact O-CB 3.34Å; L105-Q109 PolarHBondContact O-N 2.95Å; Q109-F111 VanDerWaalsContact C-N 3.35Å; Q109-F111 PolarHBondContact O-N 3.05Å; Q109-L112 PolarHBondContact O-N 2.63Å; Q109-G113 PolarHBondContact O-N 3.38Å
110	P	85.5	Confident	87	Confident	26 Å²	26	35.9 Å²	35.9	17%	0.169	17%	0.173	C	C	.	.	H	α-helix	trans	-63.4	-38.8	177.7	-22.1	33.9	0	0	0	112.8	V27 D106 L108 G114	V27-P110 WeakPolarHBondContact O-CB 3.25Å; D106-P110 WeakPolarHBondContact O-CD 3.48Å; L108-P110 VanDerWaalsContact C-CD 3.46Å; P110-G114 PolarHBondContact O-N 2.85Å
111	F	85.7	Confident	86.7	Confident	16 Å²	16	36 Å²	36	7%	0.07	17%	0.172	C	C	.	.	H	α-helix	trans	-75.1	-40.2	178.5	-60.5	-79.1	0	0	0	112.1	V27 L61 T64 L65 R68 L108 Q109 G114 L115	V27-F111 HydrophobicContact CG1-CE1 3.92Å; V27-F111 HydrophobicContact CG1-CZ 4.24Å; V27-F111 HydrophobicContact CG2-CE1 4.37Å; L61-F111 HydrophobicContact CD1-CD1 4.25Å; T64-F111 HydrophobicContact CG2-CE1 4Å; L65-F111 HydrophobicContact CB-CD1 4.48Å; L65-F111 HydrophobicContact CD1-CB 3.85Å; L65-F111 HydrophobicContact CD1-CD2 4.25Å; L65-F111 HydrophobicContact CD1-CG 4Å; R68-F111 HydrophobicContact CB-CZ 4.29Å; R68-F111 HydrophobicContact CG-CZ 4.08Å; L108-F111 PolarHBondContact O-N 2.97Å; L108-F111 VanDerWaalsContact O-N 3.08Å; Q109-F111 VanDerWaalsContact C-N 3.35Å; Q109-F111 PolarHBondContact O-N 3.05Å; F111-G114 PolarHBondContact O-N 2.97Å; F111-L115 WeakPolarHBondContact O-CB 3.5Å; F111-L115 VanDerWaalsContact O-CG 3.31Å; F111-L115 WeakPolarHBondContact O-CG 3.4Å; F111-L115 PolarHBondContact O-N 2.89Å
112	L	85.3	Confident	86.3	Confident	8 Å²	8	36.8 Å²	36.8	4%	0.042	18%	0.175	C	C	.	.	H	α-helix	trans	-64.6	-44.4	175.5	-66.1	176.8	0	0	0	111	L108 Q109 G114 L115 E116 A141 F142 I145	L108-L112 HydrophobicContact CB-CD1 4.11Å; L108-L112 HydrophobicContact CB-CG 4.42Å; L108-L112 WeakPolarHBondContact O-CG 3.41Å; L108-L112 PolarHBondContact O-N 3.35Å; Q109-L112 PolarHBondContact O-N 2.63Å; L112-G114 VanDerWaalsContact C-N 3.33Å; L112-G114 PolarHBondContact O-N 2.85Å; L112-L115 PolarHBondContact O-N 3.24Å; L112-E116 VanDerWaalsContact O-CG 3.32Å; L112-E116 WeakPolarHBondContact O-CG 3.38Å; L112-E116 PolarHBondContact O-N 3.47Å; L112-A141 HydrophobicContact CD2-CB 4.41Å; L112-F142 HydrophobicContact CD1-CE1 4.1Å; L112-F142 HydrophobicContact CD1-CZ 3.99Å; L112-F142 HydrophobicContact CD2-CE1 4.2Å; L112-F142 HydrophobicContact CD2-CE2 4.48Å; L112-F142 HydrophobicContact CD2-CZ 4.03Å; L112-I145 HydrophobicContact CD2-CD1 4.21Å
113	G	84.6	Confident	86	Confident	6 Å²	6	38 Å²	38	6%	0.062	19%	0.188	C	C	.	.	H	α-helix	trans	-62.7	-38.2	172.9	0	0	0	0	0	112.6	Q109 E116 R117	Q109-G113 PolarHBondContact O-N 3.38Å; G113-E116 PolarHBondContact O-N 3.12Å; G113-R117 WeakPolarHBondContact O-CB 3.22Å; G113-R117 VanDerWaalsContact O-CG 3.24Å; G113-R117 WeakPolarHBondContact O-CG 3.48Å; G113-R117 PolarHBondContact O-N 2.87Å
114	G	84.2	Confident	85.6	Confident	2 Å²	2	40.9 Å²	40.9	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-59.5	-47.9	171.7	0	0	0	0	0	113.9	L26 P110 F111 L112 R117 L118	L26-G114 WeakPolarHBondContact CD2-O 3.39Å; L26-G114 WeakPolarHBondContact O-CA 3.36Å; P110-G114 PolarHBondContact O-N 2.85Å; F111-G114 PolarHBondContact O-N 2.97Å; L112-G114 VanDerWaalsContact C-N 3.33Å; L112-G114 PolarHBondContact O-N 2.85Å; G114-R117 PolarHBondContact O-N 3.24Å; G114-L118 WeakPolarHBondContact O-CB 3.4Å; G114-L118 PolarHBondContact O-N 2.91Å
115	L	85.4	Confident	84.8	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.016	22%	0.217	C	C	.	.	H	α-helix	trans	-66.7	-36.7	178.3	-73.3	163.1	0	0	0	112.2	L61 M62 L65 F111 L112 G119 L137 A141	L61-L115 HydrophobicContact CB-CD2 4.47Å; L61-L115 HydrophobicContact CD2-CB 4.45Å; L61-L115 HydrophobicContact CD2-CD2 3.62Å; L61-L115 HydrophobicContact CD2-CG 3.71Å; L61-L115 HydrophobicContact CG-CD2 3.91Å; L61-L115 HydrophobicContact CG-CG 4.09Å; M62-L115 HydrophobicContact CG-CD2 4.31Å; M62-L115 HydrophobicContact SD-CD1 4.23Å; M62-L115 HydrophobicContact SD-CD2 3.91Å; L65-L115 HydrophobicContact CD2-CD1 4.12Å; F111-L115 WeakPolarHBondContact O-CB 3.5Å; F111-L115 VanDerWaalsContact O-CG 3.31Å; F111-L115 WeakPolarHBondContact O-CG 3.4Å; F111-L115 PolarHBondContact O-N 2.89Å; L112-L115 PolarHBondContact O-N 3.24Å; L115-G119 PolarHBondContact O-N 3.39Å; L115-L137 HydrophobicContact CD2-CB 4.31Å; L115-A141 HydrophobicContact CD1-CB 3.46Å; L115-A141 VanDerWaalsContact CD1-CB 3.46Å
116	E	85.4	Confident	84.1	Confident	74 Å²	74	46.2 Å²	46.2	35%	0.346	23%	0.23	S	C	.	.	H	α-helix	trans	-63.1	-47.4	172.3	-74.4	177.5	-169.4	0	0	111.3	L112 G113 G119 T120 R138	L112-E116 VanDerWaalsContact O-CG 3.32Å; L112-E116 WeakPolarHBondContact O-CG 3.38Å; L112-E116 PolarHBondContact O-N 3.47Å; G113-E116 PolarHBondContact O-N 3.12Å; E116-G119 PolarHBondContact O-N 3.35Å; E116-T120 WeakPolarHBondContact O-CG2 3.4Å; E116-T120 PolarHBondContact O-N 3.46Å; E116-T120 PolarHBondContact O-OG1 2.99Å; E116-R138 VanDerWaalsContact CG-NH2 3.3Å; E116-R138 IonicContact OE1-CZ 3.96Å; E116-R138 IonicContact OE1-NE 3.64Å; E116-R138 PolarHBondContact OE1-NE 3.08Å; E116-R138 IonicContact OE1-NH1 2.75Å; E116-R138 IonicContact OE1-NH2 2.69Å; E116-R138 PolarHBondContact OE1-NH2 2.91Å; E116-R138 IonicContact OE2-NH2 3.51Å
117	R	83.6	Confident	82.9	Confident	82 Å²	82	42.6 Å²	42.6	31%	0.309	22%	0.219	S	C	.	.	H	α-helix	trans	-61.5	-46.4	176.6	-72.4	174.5	69.6	-179.9	4.2	111.9	A25 G113 G114 G119 T120 W121	A25-R117 PolarHBondContact O-NH1 3.24Å; G113-R117 WeakPolarHBondContact O-CB 3.22Å; G113-R117 VanDerWaalsContact O-CG 3.24Å; G113-R117 WeakPolarHBondContact O-CG 3.48Å; G113-R117 PolarHBondContact O-N 2.87Å; G114-R117 PolarHBondContact O-N 3.24Å; R117-G119 VanDerWaalsContact C-N 3.28Å; R117-G119 PolarHBondContact O-N 2.88Å; R117-T120 WeakPolarHBondContact CA-OG1 3.46Å; R117-T120 PolarHBondContact O-N 3.46Å; R117-T120 PolarHBondContact O-OG1 3.22Å; R117-W121 VanDerWaalsContact O-CG 3.25Å; R117-W121 PolarHBondContact O-N 3.49Å
118	L	83.5	Confident	82	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-59.3	-42.2	175.2	-177.7	61.7	0	0	0	111.4	L26 L57 E58 L61 G114 W121 Q122 L129 L137	L26-L118 HydrophobicContact CD2-CB 3.89Å; L57-L118 HydrophobicContact CB-CD1 4.35Å; E58-L118 HydrophobicContact CB-CD2 4.36Å; L61-L118 HydrophobicContact CD2-CD2 4.28Å; G114-L118 WeakPolarHBondContact O-CB 3.4Å; G114-L118 PolarHBondContact O-N 2.91Å; L118-W121 HydrophobicContact CD1-CE3 4.17Å; L118-W121 WeakPolarHBondContact O-CB 3.47Å; L118-W121 PolarHBondContact O-N 3.44Å; L118-Q122 WeakPolarHBondContact O-CG 3.32Å; L118-Q122 PolarHBondContact O-N 3.33Å; L118-L129 HydrophobicContact CD1-CD1 4.39Å; L118-L137 HydrophobicContact CB-CD1 4.21Å; L118-L137 HydrophobicContact CD2-CD1 4.03Å; L118-L137 HydrophobicContact CG-CD1 4.01Å
119	G	84	Confident	81.5	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-45	174.9	0	0	0	0	0	113.3	L115 E116 R117 W121 Q122 D123	L115-G119 PolarHBondContact O-N 3.39Å; E116-G119 PolarHBondContact O-N 3.35Å; R117-G119 VanDerWaalsContact C-N 3.28Å; R117-G119 PolarHBondContact O-N 2.88Å; G119-W121 VanDerWaalsContact C-N 3.28Å; G119-W121 PolarHBondContact O-N 2.88Å; G119-Q122 WeakPolarHBondContact O-CB 3.4Å; G119-Q122 PolarHBondContact O-N 2.9Å; G119-Q122 VanDerWaalsContact O-N 3.14Å; G119-D123 VanDerWaalsContact O-CG 3.25Å; G119-D123 PolarHBondContact O-N 2.92Å
120	T	84.5	Confident	80.7	Confident	57 Å²	57	42.7 Å²	42.7	35%	0.35	26%	0.255	S	S	.	.	H	α-helix	trans	-62.2	-36.1	174.3	55.3	0	0	0	0	112	E116 R117 Q122 D123 E124	E116-T120 WeakPolarHBondContact O-CG2 3.4Å; E116-T120 PolarHBondContact O-N 3.46Å; E116-T120 PolarHBondContact O-OG1 2.99Å; R117-T120 WeakPolarHBondContact CA-OG1 3.46Å; R117-T120 PolarHBondContact O-N 3.46Å; R117-T120 PolarHBondContact O-OG1 3.22Å; T120-Q122 VanDerWaalsContact C-N 3.34Å; T120-Q122 PolarHBondContact O-N 2.85Å; T120-D123 PolarHBondContact O-N 3.4Å; T120-E124 VanDerWaalsContact O-CB 3.28Å; T120-E124 WeakPolarHBondContact O-CB 3.27Å; T120-E124 VanDerWaalsContact O-CG 3.26Å; T120-E124 WeakPolarHBondContact O-CG 3.24Å; T120-E124 PolarHBondContact O-N 3.44Å
121	W	85.1	Confident	80.4	Confident	15 Å²	15	43.3 Å²	43.3	6%	0.057	27%	0.266	C	S	.	.	H	α-helix	trans	-67.3	-34.7	174.9	-62.5	-16.1	0	0	0	112.6	V22 L26 L45 R117 L118 G119 G125 R126 L129	V22-W121 HydrophobicContact CG1-CZ3 4.24Å; L26-W121 HydrophobicContact CD1-CZ3 4.37Å; L26-W121 HydrophobicContact CD2-CE3 4.3Å; L26-W121 HydrophobicContact CD2-CH2 4.01Å; L26-W121 HydrophobicContact CD2-CZ3 3.64Å; L26-W121 HydrophobicContact CG-CH2 4.35Å; L26-W121 HydrophobicContact CG-CZ3 4.02Å; L45-W121 HydrophobicContact CD1-CD2 3.91Å; L45-W121 HydrophobicContact CD1-CE3 3.75Å; L45-W121 HydrophobicContact CD1-CG 4.49Å; L45-W121 HydrophobicContact CD1-CH2 4.29Å; L45-W121 HydrophobicContact CD1-CZ2 4.44Å; L45-W121 HydrophobicContact CD1-CZ3 3.96Å; L45-W121 HydrophobicContact CD2-CE3 4.09Å; L45-W121 HydrophobicContact CD2-CZ3 4.06Å; L45-W121 HydrophobicContact CG-CZ3 4.48Å; R117-W121 VanDerWaalsContact O-CG 3.25Å; R117-W121 PolarHBondContact O-N 3.49Å; L118-W121 HydrophobicContact CD1-CE3 4.17Å; L118-W121 WeakPolarHBondContact O-CB 3.47Å; L118-W121 PolarHBondContact O-N 3.44Å; G119-W121 VanDerWaalsContact C-N 3.28Å; G119-W121 PolarHBondContact O-N 2.88Å; W121-G125 PolarHBondContact O-N 3.09Å; W121-G125 VanDerWaalsContact O-N 3.1Å; W121-R126 HydrophobicContact CB-CB 4.3Å; W121-R126 PolarHBondContact O-N 2.9Å; W121-L129 HydrophobicContact CB-CD1 4.03Å
122	Q	83.5	Confident	80	Confident	19 Å²	19	44.8 Å²	44.8	9%	0.089	28%	0.277	C	S	.	.	H	α-helix	trans	-68.3	-44.2	172.6	-69.8	175.3	-9.9	0	0	111.5	L118 G119 T120 E124 G125 L129	L118-Q122 WeakPolarHBondContact O-CG 3.32Å; L118-Q122 PolarHBondContact O-N 3.33Å; G119-Q122 WeakPolarHBondContact O-CB 3.4Å; G119-Q122 PolarHBondContact O-N 2.9Å; G119-Q122 VanDerWaalsContact O-N 3.14Å; T120-Q122 VanDerWaalsContact C-N 3.34Å; T120-Q122 PolarHBondContact O-N 2.85Å; Q122-E124 VanDerWaalsContact C-N 3.34Å; Q122-E124 PolarHBondContact O-N 3.35Å; Q122-G125 PolarHBondContact O-N 3.18Å; Q122-L129 HydrophobicContact CG-CB 4.35Å
123	D	82.6	Confident	79.8	Confident	107 Å²	107	44.5 Å²	44.5	57%	0.572	28%	0.277	S	S	*	.	H	α-helix	trans	-66.9	-35.4	179.7	-65.9	-32.1	0	0	0	111.7	G119 T120 G133 A134	G119-D123 VanDerWaalsContact O-CG 3.25Å; G119-D123 PolarHBondContact O-N 2.92Å; T120-D123 PolarHBondContact O-N 3.4Å; D123-G133 WeakPolarHBondContact OD1-CA 3.47Å; D123-A134 PolarHBondContact OD2-N 3.01Å
124	E	81.9	Confident	79.7	Confident	117 Å²	117	45.1 Å²	45.1	55%	0.547	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-8.3	175.6	-69.4	175.7	-172.3	0	0	113.7	T120 Q122 R126	T120-E124 VanDerWaalsContact O-CB 3.28Å; T120-E124 WeakPolarHBondContact O-CB 3.27Å; T120-E124 VanDerWaalsContact O-CG 3.26Å; T120-E124 WeakPolarHBondContact O-CG 3.24Å; T120-E124 PolarHBondContact O-N 3.44Å; Q122-E124 VanDerWaalsContact C-N 3.34Å; Q122-E124 PolarHBondContact O-N 3.35Å; E124-R126 VanDerWaalsContact C-N 3.26Å; E124-R126 HydrophobicContact CB-CG 4.06Å; E124-R126 PolarHBondContact O-N 2.82Å; E124-R126 IonicContact OE2-CZ 3.24Å; E124-R126 VanDerWaalsContact OE2-CZ 3.24Å; E124-R126 IonicContact OE2-NE 2.69Å; E124-R126 PolarHBondContact OE2-NE 3.02Å; E124-R126 IonicContact OE2-NH2 2.88Å; E124-R126 PolarHBondContact OE2-NH2 3.29Å
125	G	75.2	Confident	79.6	Confident	41 Å²	41	54.2 Å²	54.2	42%	0.423	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	24.2	-177.2	0	0	0	0	0	114.5	W121 Q122 G127 G128	W121-G125 PolarHBondContact O-N 3.09Å; W121-G125 VanDerWaalsContact O-N 3.1Å; Q122-G125 PolarHBondContact O-N 3.18Å; G125-G127 PolarHBondContact O-N 3.17Å; G125-G128 PolarHBondContact O-N 3.06Å
126	R	74.4	Confident	79.5	Confident	81 Å²	81	54.8 Å²	54.8	31%	0.306	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-59.7	128.2	-178	-69.4	-161.8	-171.9	-152.4	0.3	110.6	D38 W121 E124 G128 L129	D38-R126 IonicContact OD1-NH1 3Å; D38-R126 PolarHBondContact OD1-NH1 3.49Å; D38-R126 IonicContact OD2-NH1 3.15Å; D38-R126 PolarHBondContact OD2-NH1 3.17Å; D38-R126 VanDerWaalsContact OD2-NH1 3.15Å; W121-R126 HydrophobicContact CB-CB 4.3Å; W121-R126 PolarHBondContact O-N 2.9Å; E124-R126 VanDerWaalsContact C-N 3.26Å; E124-R126 HydrophobicContact CB-CG 4.06Å; E124-R126 PolarHBondContact O-N 2.82Å; E124-R126 IonicContact OE2-CZ 3.24Å; E124-R126 VanDerWaalsContact OE2-CZ 3.24Å; E124-R126 IonicContact OE2-NE 2.69Å; E124-R126 PolarHBondContact OE2-NE 3.02Å; E124-R126 IonicContact OE2-NH2 2.88Å; E124-R126 PolarHBondContact OE2-NH2 3.29Å; R126-G128 PolarHBondContact O-N 2.94Å; R126-G128 VanDerWaalsContact O-N 3.11Å; R126-L129 WeakPolarHBondContact O-CG 3.4Å; R126-L129 PolarHBondContact O-N 3.33Å
127	G	64.1	Low	79.4	Confident	37 Å²	37	51.3 Å²	51.3	38%	0.381	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	67.7	3.2	178	0	0	0	0	0	115.4	C49 G125	C49-G127 WeakPolarHBondContact CB-O 3.48Å; C49-G127 PolarHBondContact SG-O 3.15Å; G125-G127 PolarHBondContact O-N 3.17Å
128	G	68.3	Low	79.5	Confident	65 Å²	65	51.8 Å²	51.8	67%	0.67	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	87.7	17	-174.1	0	0	0	0	0	114.4	G125 R126	G125-G128 PolarHBondContact O-N 3.06Å; R126-G128 PolarHBondContact O-N 2.94Å; R126-G128 VanDerWaalsContact O-N 3.11Å
129	L	77.1	Confident	79.6	Confident	15 Å²	15	56.1 Å²	56.1	8%	0.079	33%	0.327	C	S	.	.			trans	-64.6	138.3	171.5	-70.5	172.8	0	0	0	111	L45 C49 L118 W121 Q122 R126	L45-L129 HydrophobicContact CD2-CD1 4.17Å; C49-L129 VanDerWaalsContact SG-CD2 3.6Å; L118-L129 HydrophobicContact CD1-CD1 4.39Å; W121-L129 HydrophobicContact CB-CD1 4.03Å; Q122-L129 HydrophobicContact CG-CB 4.35Å; R126-L129 WeakPolarHBondContact O-CG 3.4Å; R126-L129 PolarHBondContact O-N 3.33Å
130	C	71.9	Confident	79.8	Confident	124 Å²	124	61.9 Å²	61.9	84%	0.838	35%	0.349	S	S	*	.			trans	-134.2	136.2	172.8	-175.7	0	0	0	0	108.3
131	G	78.6	Confident	79.9	Confident	39 Å²	39	59.2 Å²	59.2	40%	0.402	33%	0.332	S	S	.	.	S	Bend	trans	-176.5	-172.5	-176.1	0	0	0	0	0	113.4	G133	G131-G133 PolarHBondContact O-N 2.89Å
132	P	77.2	Confident	80.1	Confident	47 Å²	47	58.8 Å²	58.8	31%	0.305	33%	0.331	S	S	.	.	S	Bend	trans	-73.8	-0.7	-173.8	32.5	-37.6	0	0	0	114.6	E58 G136 L137	E58-P132 WeakPolarHBondContact OE2-CD 3.44Å; P132-G136 PolarHBondContact O-N 2.9Å; P132-L137 HydrophobicContact CG-CD2 3.56Å; P132-L137 HydrophobicContact CG-CG 3.91Å
133	G	81.6	Confident	80.3	Confident	3 Å²	3	61 Å²	61	3%	0.031	35%	0.348	C	S	.	.	H	α-helix	trans	74.9	175.2	178.7	0	0	0	0	0	113.2	D123 G131 R135 G136 L137	D123-G133 WeakPolarHBondContact OD1-CA 3.47Å; G131-G133 PolarHBondContact O-N 2.89Å; G133-R135 VanDerWaalsContact C-N 3.28Å; G133-R135 PolarHBondContact O-N 3.2Å; G133-G136 PolarHBondContact O-N 2.85Å; G133-L137 WeakPolarHBondContact O-CG 3.38Å; G133-L137 PolarHBondContact O-N 2.9Å; G133-L137 VanDerWaalsContact O-N 3.07Å
134	A	81.4	Confident	80.6	Confident	18 Å²	18	57.4 Å²	57.4	15%	0.149	33%	0.33	C	S	.	.	H	α-helix	trans	-59.2	-37.3	-175	0	0	0	0	0	113.6	D123 R138	D123-A134 PolarHBondContact OD2-N 3.01Å; A134-R138 WeakPolarHBondContact O-CB 3.28Å; A134-R138 PolarHBondContact O-N 2.99Å
135	R	81.6	Confident	80.9	Confident	194 Å²	194	51.9 Å²	51.9	73%	0.732	30%	0.304	S	S	*	.	H	α-helix	trans	-68.7	-46.2	178.5	-175.8	177.5	173.6	174.5	2.4	112.1	G133 R138 E139	G133-R135 VanDerWaalsContact C-N 3.28Å; G133-R135 PolarHBondContact O-N 3.2Å; R135-R138 PolarHBondContact O-N 2.85Å; R135-E139 WeakPolarHBondContact CG-OE1 3.44Å; R135-E139 IonicContact CZ-OE1 3.83Å; R135-E139 IonicContact NE-OE1 2.72Å; R135-E139 PolarHBondContact NE-OE1 3.39Å; R135-E139 IonicContact NH2-OE1 2.73Å; R135-E139 WeakPolarHBondContact O-CG 3.33Å; R135-E139 PolarHBondContact O-N 3.35Å
136	G	83.6	Confident	81.5	Confident	15 Å²	15	53.9 Å²	53.9	16%	0.155	30%	0.299	C	S	.	.	H	α-helix	trans	-67.9	-39.6	-177.6	0	0	0	0	0	112.8	P132 G133 E139 R140	P132-G136 PolarHBondContact O-N 2.9Å; G133-G136 PolarHBondContact O-N 2.85Å; G136-E139 PolarHBondContact O-N 3.21Å; G136-R140 WeakPolarHBondContact O-CG 3.22Å; G136-R140 PolarHBondContact O-N 2.97Å; G136-R140 VanDerWaalsContact O-N 3.15Å
137	L	84.9	Confident	82.1	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.4	-43.3	174.1	-67.9	-179.4	0	0	0	111.9	E58 L115 L118 P132 G133 R140 A141	E58-L137 VanDerWaalsContact CD-CD2 3.45Å; E58-L137 HydrophobicContact CG-CD2 3.57Å; L115-L137 HydrophobicContact CD2-CB 4.31Å; L118-L137 HydrophobicContact CB-CD1 4.21Å; L118-L137 HydrophobicContact CD2-CD1 4.03Å; L118-L137 HydrophobicContact CG-CD1 4.01Å; P132-L137 HydrophobicContact CG-CD2 3.56Å; P132-L137 HydrophobicContact CG-CG 3.91Å; G133-L137 WeakPolarHBondContact O-CG 3.38Å; G133-L137 PolarHBondContact O-N 2.9Å; G133-L137 VanDerWaalsContact O-N 3.07Å; L137-R140 PolarHBondContact O-N 3.41Å; L137-A141 WeakPolarHBondContact O-CB 3.37Å; L137-A141 PolarHBondContact O-N 3.33Å
138	R	84.5	Confident	83.2	Confident	93 Å²	93	53.5 Å²	53.5	35%	0.351	30%	0.302	S	S	.	.	H	α-helix	trans	-61.7	-46	177.8	-174.3	-175.3	-65.7	-159.9	7.6	111.9	E116 A134 R135 R140 A141 F142	E116-R138 VanDerWaalsContact CG-NH2 3.3Å; E116-R138 IonicContact OE1-CZ 3.96Å; E116-R138 IonicContact OE1-NE 3.64Å; E116-R138 PolarHBondContact OE1-NE 3.08Å; E116-R138 IonicContact OE1-NH1 2.75Å; E116-R138 IonicContact OE1-NH2 2.69Å; E116-R138 PolarHBondContact OE1-NH2 2.91Å; E116-R138 IonicContact OE2-NH2 3.51Å; A134-R138 WeakPolarHBondContact O-CB 3.28Å; A134-R138 PolarHBondContact O-N 2.99Å; R135-R138 PolarHBondContact O-N 2.85Å; R138-R140 VanDerWaalsContact C-N 3.34Å; R138-R140 PolarHBondContact O-N 3.49Å; R138-A141 PolarHBondContact O-N 3.24Å; R138-F142 HydrophobicContact CG-CD2 3.63Å; R138-F142 HydrophobicContact CG-CE2 3.38Å; R138-F142 WeakPolarHBondContact O-CD2 3.4Å; R138-F142 PolarHBondContact O-N 2.88Å
139	E	85.4	Confident	83.9	Confident	92 Å²	92	50.7 Å²	50.7	43%	0.43	27%	0.271	S	S	.	.	H	α-helix	trans	-61.9	-39.9	178.1	-74.7	173.7	-171.2	0	0	112.2	R135 G136 S143	R135-E139 WeakPolarHBondContact CG-OE1 3.44Å; R135-E139 IonicContact CZ-OE1 3.83Å; R135-E139 IonicContact NE-OE1 2.72Å; R135-E139 PolarHBondContact NE-OE1 3.39Å; R135-E139 IonicContact NH2-OE1 2.73Å; R135-E139 WeakPolarHBondContact O-CG 3.33Å; R135-E139 PolarHBondContact O-N 3.35Å; G136-E139 PolarHBondContact O-N 3.21Å; E139-S143 WeakPolarHBondContact O-CB 3.29Å; E139-S143 PolarHBondContact O-N 3.23Å; E139-S143 PolarHBondContact O-OG 3.11Å
140	R	87.5	Confident	84.2	Confident	121 Å²	121	50.6 Å²	50.6	46%	0.457	27%	0.271	S	S	.	.	H	α-helix	trans	-65.9	-45.1	174.9	-69.3	-178.3	-159.5	-179.9	12.7	112	E58 M62 G136 L137 R138 S143 V144	E58-R140 IonicContact OE1-CZ 2.6Å; E58-R140 IonicContact OE1-NH1 3.61Å; E58-R140 PolarHBondContact OE1-NH1 2.62Å; E58-R140 IonicContact OE1-NH2 3.46Å; M62-R140 HydrophobicContact CE-CB 3.91Å; G136-R140 WeakPolarHBondContact O-CG 3.22Å; G136-R140 PolarHBondContact O-N 2.97Å; G136-R140 VanDerWaalsContact O-N 3.15Å; L137-R140 PolarHBondContact O-N 3.41Å; R138-R140 VanDerWaalsContact C-N 3.34Å; R138-R140 PolarHBondContact O-N 3.49Å; R140-S143 WeakPolarHBondContact O-CB 3.36Å; R140-S143 PolarHBondContact O-N 3.47Å; R140-V144 WeakPolarHBondContact O-CG2 3.17Å; R140-V144 PolarHBondContact O-N 3.49Å
141	A	87.7	Confident	84.7	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.8	-46.9	178.5	0	0	0	0	0	112	M62 L65 L112 L115 L137 R138 S143 V144 I145	M62-A141 HydrophobicContact CE-CB 4.49Å; M62-A141 HydrophobicContact SD-CB 4.12Å; L65-A141 HydrophobicContact CD2-CB 3.92Å; L112-A141 HydrophobicContact CD2-CB 4.41Å; L115-A141 HydrophobicContact CD1-CB 3.46Å; L115-A141 VanDerWaalsContact CD1-CB 3.46Å; L137-A141 WeakPolarHBondContact O-CB 3.37Å; L137-A141 PolarHBondContact O-N 3.33Å; R138-A141 PolarHBondContact O-N 3.24Å; A141-S143 VanDerWaalsContact C-N 3.29Å; A141-S143 PolarHBondContact O-N 3.43Å; A141-V144 PolarHBondContact O-N 3.14Å; A141-I145 VanDerWaalsContact O-CG1 3.27Å; A141-I145 WeakPolarHBondContact O-CG1 3.41Å; A141-I145 PolarHBondContact O-N 3.27Å
142	F	89.1	Confident	84.6	Confident	6 Å²	6	55.9 Å²	55.9	3%	0.026	28%	0.281	C	S	.	.	H	α-helix	trans	-66.4	-30.1	176	-74.5	-60	0	0	0	113.2	L112 R138 I145 R146 L223 Q224	L112-F142 HydrophobicContact CD1-CE1 4.1Å; L112-F142 HydrophobicContact CD1-CZ 3.99Å; L112-F142 HydrophobicContact CD2-CE1 4.2Å; L112-F142 HydrophobicContact CD2-CE2 4.48Å; L112-F142 HydrophobicContact CD2-CZ 4.03Å; R138-F142 HydrophobicContact CG-CD2 3.63Å; R138-F142 HydrophobicContact CG-CE2 3.38Å; R138-F142 WeakPolarHBondContact O-CD2 3.4Å; R138-F142 PolarHBondContact O-N 2.88Å; F142-I145 HydrophobicContact CD1-CD1 3.97Å; F142-I145 HydrophobicContact CE1-CD1 4.32Å; F142-I145 PolarHBondContact O-N 2.9Å; F142-R146 WeakPolarHBondContact O-CB 3.38Å; F142-R146 WeakPolarHBondContact O-CG 3.46Å; F142-R146 PolarHBondContact O-N 2.82Å; F142-L223 WeakPolarHBondContact CD1-O 3.45Å; F142-L223 VanDerWaalsContact CE1-C 3.5Å; F142-L223 WeakPolarHBondContact CE1-O 3.28Å; F142-Q224 HydrophobicContact CD1-CB 4.22Å; F142-Q224 HydrophobicContact CD1-CG 4.47Å; F142-Q224 HydrophobicContact CD2-CB 4.35Å; F142-Q224 VanDerWaalsContact CD2-CD 3.44Å; F142-Q224 HydrophobicContact CD2-CG 3.93Å; F142-Q224 HydrophobicContact CE1-CB 4.42Å; F142-Q224 HydrophobicContact CE1-CG 4.36Å; F142-Q224 HydrophobicContact CE2-CG 3.77Å; F142-Q224 HydrophobicContact CG-CB 4.21Å; F142-Q224 HydrophobicContact CG-CG 4.28Å; F142-Q224 HydrophobicContact CZ-CG 4.01Å
143	S	87.9	Confident	84.6	Confident	65 Å²	65	56 Å²	56	46%	0.455	28%	0.281	S	S	.	.	H	α-helix	trans	-65.3	-42.2	172.7	-60.1	0	0	0	0	111.9	E139 R140 A141 R146 A147	E139-S143 WeakPolarHBondContact O-CB 3.29Å; E139-S143 PolarHBondContact O-N 3.23Å; E139-S143 PolarHBondContact O-OG 3.11Å; R140-S143 WeakPolarHBondContact O-CB 3.36Å; R140-S143 PolarHBondContact O-N 3.47Å; A141-S143 VanDerWaalsContact C-N 3.29Å; A141-S143 PolarHBondContact O-N 3.43Å; S143-R146 PolarHBondContact O-N 3.29Å; S143-A147 WeakPolarHBondContact O-CB 3.37Å; S143-A147 PolarHBondContact O-N 2.96Å
144	V	88.6	Confident	84.6	Confident	33 Å²	33	57.6 Å²	57.6	20%	0.2	29%	0.293	C	S	.	.	H	α-helix	trans	-64.6	-44.3	174.2	172.7	0	0	0	0	111.2	M62 Q66 R140 A141 R146 A147 I148	M62-V144 HydrophobicContact CE-CG2 3.93Å; Q66-V144 HydrophobicContact CB-CG1 4.31Å; Q66-V144 HydrophobicContact CG-CG1 4.29Å; R140-V144 WeakPolarHBondContact O-CG2 3.17Å; R140-V144 PolarHBondContact O-N 3.49Å; A141-V144 PolarHBondContact O-N 3.14Å; V144-R146 PolarHBondContact O-N 3.44Å; V144-A147 PolarHBondContact O-N 2.91Å; V144-I148 HydrophobicContact CG1-CD1 3.69Å; V144-I148 PolarHBondContact O-N 3.38Å
145	I	88.3	Confident	84.6	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.8	-47.6	176.7	-67.6	162	0	0	0	110.8	L69 L108 L112 A141 F142 A147 I148 L149	L69-I145 HydrophobicContact CD2-CB 4.37Å; L69-I145 HydrophobicContact CD2-CG1 4.02Å; L108-I145 HydrophobicContact CD1-CD1 4.15Å; L108-I145 HydrophobicContact CD1-CG2 4.35Å; L108-I145 HydrophobicContact CD2-CD1 4.28Å; L108-I145 HydrophobicContact CD2-CG1 4.46Å; L112-I145 HydrophobicContact CD2-CD1 4.21Å; A141-I145 VanDerWaalsContact O-CG1 3.27Å; A141-I145 WeakPolarHBondContact O-CG1 3.41Å; A141-I145 PolarHBondContact O-N 3.27Å; F142-I145 HydrophobicContact CD1-CD1 3.97Å; F142-I145 HydrophobicContact CE1-CD1 4.32Å; F142-I145 PolarHBondContact O-N 2.9Å; I145-A147 PolarHBondContact O-N 2.91Å; I145-I148 PolarHBondContact O-N 3.19Å; I145-L149 HydrophobicContact CG2-CD1 3.75Å; I145-L149 WeakPolarHBondContact O-CB 3.49Å; I145-L149 PolarHBondContact O-N 3.48Å
146	R	88.4	Confident	84.8	Confident	84 Å²	84	51.5 Å²	51.5	32%	0.317	28%	0.28	S	S	.	.	H	α-helix	trans	-62.4	-41.1	176.5	-72.8	170.7	-167	139.5	4.5	112.1	F142 S143 V144 L150 F151 Q224 L225	F142-R146 WeakPolarHBondContact O-CB 3.38Å; F142-R146 WeakPolarHBondContact O-CG 3.46Å; F142-R146 PolarHBondContact O-N 2.82Å; S143-R146 PolarHBondContact O-N 3.29Å; V144-R146 PolarHBondContact O-N 3.44Å; R146-L150 CarbonylContact O-C 3.57Å; R146-L150 WeakPolarHBondContact O-CA 3.28Å; R146-L150 WeakPolarHBondContact O-CB 3.42Å; R146-L150 PolarHBondContact O-N 3.14Å; R146-F151 PolarHBondContact O-N 2.84Å; R146-Q224 PolarHBondContact NE-O 3.43Å; R146-Q224 PolarHBondContact NH2-O 2.94Å; R146-L225 HydrophobicContact CG-CD2 3.5Å; R146-L225 VanDerWaalsContact CG-CD2 3.5Å
147	A	87.3	Confident	85	Confident	59 Å²	59	51 Å²	51	49%	0.488	27%	0.274	S	S	.	.	H	α-helix	trans	-66	-39.3	179.5	0	0	0	0	0	112.3	S143 V144 I145 F151	S143-A147 WeakPolarHBondContact O-CB 3.37Å; S143-A147 PolarHBondContact O-N 2.96Å; V144-A147 PolarHBondContact O-N 2.91Å; I145-A147 PolarHBondContact O-N 2.91Å; A147-F151 WeakPolarHBondContact O-CB 3.34Å
148	I	86.5	Confident	85.2	Confident	51 Å²	51	54.2 Å²	54.2	26%	0.262	29%	0.289	S	S	.	.	H	α-helix	trans	-80.4	-37.6	-177.8	-70	163.4	0	0	0	111.9	Q66 L69 T70 A74 V144 I145	Q66-I148 HydrophobicContact CG-CD1 3.98Å; L69-I148 HydrophobicContact CD2-CB 3.81Å; L69-I148 HydrophobicContact CD2-CD1 3.72Å; L69-I148 HydrophobicContact CD2-CG1 4.35Å; L69-I148 HydrophobicContact CD2-CG2 3.96Å; L69-I148 HydrophobicContact CG-CB 4.4Å; L69-I148 HydrophobicContact CG-CD1 4.38Å; L69-I148 HydrophobicContact CG-CG2 3.97Å; T70-I148 HydrophobicContact CG2-CD1 3.75Å; T70-I148 HydrophobicContact CG2-CG1 4.19Å; T70-I148 HydrophobicContact CG2-CG2 4.08Å; A74-I148 HydrophobicContact CB-CG2 4.27Å; V144-I148 HydrophobicContact CG1-CD1 3.69Å; V144-I148 PolarHBondContact O-N 3.38Å; I145-I148 PolarHBondContact O-N 3.19Å
149	L	83.8	Confident	85.3	Confident	5 Å²	5	55 Å²	55	3%	0.026	30%	0.297	C	S	.	.	H	α-helix	trans	-89.1	-41.3	-178.3	-65.1	175.9	0	0	0	113.2	L69 A74 F77 W78 L104 I145	L69-L149 HydrophobicContact CD1-CD1 4.48Å; A74-L149 HydrophobicContact CB-CD2 3.57Å; F77-L149 HydrophobicContact CD1-CD2 4.42Å; W78-L149 VanDerWaalsContact CZ2-O 3.28Å; W78-L149 WeakPolarHBondContact CZ2-O 3.43Å; L104-L149 HydrophobicContact CD1-CD1 4.03Å; L104-L149 HydrophobicContact CD2-CD1 3.76Å; L104-L149 HydrophobicContact CG-CD1 4.5Å; I145-L149 HydrophobicContact CG2-CD1 3.75Å; I145-L149 WeakPolarHBondContact O-CB 3.49Å; I145-L149 PolarHBondContact O-N 3.48Å
150	L	82.1	Confident	85.4	Confident	14 Å²	14	51.9 Å²	51.9	7%	0.073	28%	0.281	C	S	.	.	H	α-helix	trans	-118.5	11.8	-164.4	-57.4	179.7	0	0	0	114.3	R146 S152 L157 L225 R228 V229	R146-L150 CarbonylContact O-C 3.57Å; R146-L150 WeakPolarHBondContact O-CA 3.28Å; R146-L150 WeakPolarHBondContact O-CB 3.42Å; R146-L150 PolarHBondContact O-N 3.14Å; L150-S152 VanDerWaalsContact C-N 3.35Å; L150-L157 HydrophobicContact CD2-CD2 4.3Å; L150-L225 HydrophobicContact CD1-CB 4.47Å; L150-L225 HydrophobicContact CD1-CD1 4.31Å; L150-L225 HydrophobicContact CD1-CD2 3.75Å; L150-L225 HydrophobicContact CD1-CG 4.38Å; L150-R228 HydrophobicContact CB-CG 4.48Å; L150-R228 HydrophobicContact CD1-CB 4.17Å; L150-R228 HydrophobicContact CD1-CG 3.77Å; L150-V229 HydrophobicContact CD1-CG2 3.65Å; L150-V229 HydrophobicContact CD2-CG2 4.12Å
151	F	82.7	Confident	85.5	Confident	180 Å²	180	46.4 Å²	46.4	79%	0.789	26%	0.261	S	S	*	.	S	Bend	trans	-66.8	-39.2	171.3	-178.4	-101.6	0	0	0	111.6	R146 A147	R146-F151 PolarHBondContact O-N 2.84Å; A147-F151 WeakPolarHBondContact O-CB 3.34Å
152	S	77.2	Confident	85.6	Confident	94 Å²	94	49.3 Å²	49.3	66%	0.657	28%	0.276	S	S	*	.	S	Bend	trans	-134.5	82.1	171.8	60.4	0	0	0	0	109.5	L150 S154	L150-S152 VanDerWaalsContact C-N 3.35Å; S152-S154 PolarHBondContact O-N 2.95Å
153	P	75.9	Confident	85.6	Confident	48 Å²	48	51.7 Å²	51.7	31%	0.312	29%	0.287	S	S	.	.			trans	-60.2	139.1	179	26.5	-33.1	0	0	0	110
154	S	81.4	Confident	85.7	Confident	38 Å²	38	49 Å²	49	27%	0.266	27%	0.267	S	S	.	.			trans	-66.8	138.8	173.7	-176.2	0	0	0	0	110	S152 V156 L157 Q158	S152-S154 PolarHBondContact O-N 2.95Å; S154-V156 PolarHBondContact O-N 3.45Å; S154-V156 VanDerWaalsContact O-N 3.13Å; S154-L157 WeakPolarHBondContact O-CB 3.37Å; S154-L157 PolarHBondContact O-N 3.49Å; S154-Q158 PolarHBondContact O-N 2.98Å
155	A	83.2	Confident	85.9	Confident	55 Å²	55	47.4 Å²	47.4	46%	0.455	26%	0.258	S	S	.	.	H	α-helix	trans	-51.8	-35.5	174.2	0	0	0	0	0	112.3	L157 Q158 E159	A155-L157 VanDerWaalsContact C-N 3.28Å; A155-L157 PolarHBondContact O-N 2.94Å; A155-Q158 PolarHBondContact O-N 3.25Å; A155-Q158 VanDerWaalsContact O-N 3.14Å; A155-E159 WeakPolarHBondContact O-CG 3.38Å; A155-E159 PolarHBondContact O-N 3.4Å
156	V	85.8	Confident	86	Confident	28 Å²	28	49.6 Å²	49.6	17%	0.17	27%	0.273	C	S	.	.	H	α-helix	trans	-57.8	-39.4	176.4	-177.3	0	0	0	0	112	S154 R160	S154-V156 PolarHBondContact O-N 3.45Å; S154-V156 VanDerWaalsContact O-N 3.13Å; V156-R160 HydrophobicContact CG1-CG 4.37Å; V156-R160 WeakPolarHBondContact O-CB 3.31Å; V156-R160 WeakPolarHBondContact O-CG 3.12Å; V156-R160 PolarHBondContact O-N 2.73Å
157	L	87.5	Confident	86	Confident	4 Å²	4	47.4 Å²	47.4	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-68.7	-44	177.9	175.8	66.3	0	0	0	110.9	F77 W78 M81 L97 F101 L150 S154 A155 R160 I161	F77-L157 HydrophobicContact CZ-CD1 4.47Å; W78-L157 HydrophobicContact CH2-CB 4.34Å; W78-L157 HydrophobicContact CH2-CD2 3.64Å; W78-L157 HydrophobicContact CZ3-CB 3.86Å; W78-L157 HydrophobicContact CZ3-CD2 3.94Å; W78-L157 HydrophobicContact CZ3-CG 4.46Å; M81-L157 HydrophobicContact CE-CD1 3.81Å; L97-L157 HydrophobicContact CD1-CD1 4.07Å; F101-L157 HydrophobicContact CE2-CD1 3.98Å; F101-L157 HydrophobicContact CZ-CD1 4.01Å; L150-L157 HydrophobicContact CD2-CD2 4.3Å; S154-L157 WeakPolarHBondContact O-CB 3.37Å; S154-L157 PolarHBondContact O-N 3.49Å; A155-L157 VanDerWaalsContact C-N 3.28Å; A155-L157 PolarHBondContact O-N 2.94Å; L157-R160 PolarHBondContact O-N 3.39Å; L157-I161 HydrophobicContact CD1-CD1 3.54Å; L157-I161 HydrophobicContact CD1-CG1 4.07Å; L157-I161 HydrophobicContact CD2-CD1 4.42Å; L157-I161 HydrophobicContact CG-CD1 3.61Å; L157-I161 HydrophobicContact CG-CG1 4.48Å; L157-I161 WeakPolarHBondContact O-CB 3.45Å; L157-I161 VanDerWaalsContact O-CD1 3.32Å; L157-I161 WeakPolarHBondContact O-CD1 3.44Å; L157-I161 WeakPolarHBondContact O-CG1 3.34Å; L157-I161 PolarHBondContact O-N 3.38Å
158	Q	87.6	Confident	86	Confident	69 Å²	69	44.6 Å²	44.6	32%	0.322	24%	0.242	S	C	.	.	H	α-helix	trans	-62	-45.5	178.3	-70.9	174.4	-45	0	0	111.4	S154 A155 I161 L162 E232	S154-Q158 PolarHBondContact O-N 2.98Å; A155-Q158 PolarHBondContact O-N 3.25Å; A155-Q158 VanDerWaalsContact O-N 3.14Å; Q158-I161 PolarHBondContact O-N 2.93Å; Q158-L162 VanDerWaalsContact O-CB 3.23Å; Q158-L162 WeakPolarHBondContact O-CB 3.38Å; Q158-L162 PolarHBondContact O-N 3.35Å; Q158-E232 PolarHBondContact NE2-OE1 3.27Å; Q158-E232 PolarHBondContact NE2-OE2 3.48Å
159	E	87.4	Confident	86.1	Confident	108 Å²	108	42.6 Å²	42.6	51%	0.505	23%	0.231	S	C	.	.	H	α-helix	trans	-63.2	-44.7	177.7	-72.6	176.1	-172.6	0	0	112.3	A155 I161 L162 E163	A155-E159 WeakPolarHBondContact O-CG 3.38Å; A155-E159 PolarHBondContact O-N 3.4Å; E159-I161 PolarHBondContact O-N 2.91Å; E159-L162 PolarHBondContact O-N 3.43Å; E159-E163 WeakPolarHBondContact O-CB 3.42Å; E159-E163 PolarHBondContact O-N 3Å
160	R	87.6	Confident	86.2	Confident	27 Å²	27	44.6 Å²	44.6	10%	0.102	25%	0.245	C	C	.	.	H	α-helix	trans	-64.7	-40.9	178.8	-70.8	-73.9	-173.8	-95.2	-18.2	112.6	M81 E85 L97 V156 L157 E163 F164	M81-R160 HydrophobicContact CE-CB 4.11Å; M81-R160 HydrophobicContact CE-CG 4.13Å; E85-R160 IonicContact OE1-NH2 3.45Å; L97-R160 HydrophobicContact CD1-CB 4.36Å; V156-R160 HydrophobicContact CG1-CG 4.37Å; V156-R160 WeakPolarHBondContact O-CB 3.31Å; V156-R160 WeakPolarHBondContact O-CG 3.12Å; V156-R160 PolarHBondContact O-N 2.73Å; L157-R160 PolarHBondContact O-N 3.39Å; R160-E163 IonicContact NH1-OE2 3.05Å; R160-F164 VanDerWaalsContact O-CB 3.3Å; R160-F164 WeakPolarHBondContact O-CB 3.33Å; R160-F164 PolarHBondContact O-N 3.34Å
161	I	90.1	Very high	86.5	Confident	6 Å²	6	44 Å²	44	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-67	-43	176.4	-70.5	164.8	0	0	0	110.3	L97 L157 Q158 E159 F164 Y165 V229 A233	L97-I161 HydrophobicContact CD1-CG1 4.17Å; L97-I161 HydrophobicContact CD2-CG1 4.36Å; L157-I161 HydrophobicContact CD1-CD1 3.54Å; L157-I161 HydrophobicContact CD1-CG1 4.07Å; L157-I161 HydrophobicContact CD2-CD1 4.42Å; L157-I161 HydrophobicContact CG-CD1 3.61Å; L157-I161 HydrophobicContact CG-CG1 4.48Å; L157-I161 WeakPolarHBondContact O-CB 3.45Å; L157-I161 VanDerWaalsContact O-CD1 3.32Å; L157-I161 WeakPolarHBondContact O-CD1 3.44Å; L157-I161 WeakPolarHBondContact O-CG1 3.34Å; L157-I161 PolarHBondContact O-N 3.38Å; Q158-I161 PolarHBondContact O-N 2.93Å; E159-I161 PolarHBondContact O-N 2.91Å; I161-F164 PolarHBondContact O-N 3.16Å; I161-Y165 HydrophobicContact CG2-CD2 3.33Å; I161-Y165 HydrophobicContact CG2-CE2 3.28Å; I161-Y165 WeakPolarHBondContact O-CB 3.46Å; I161-Y165 WeakPolarHBondContact O-CD2 3.14Å; I161-Y165 PolarHBondContact O-N 3.2Å; I161-V229 HydrophobicContact CD1-CG1 3.23Å; I161-V229 HydrophobicContact CG1-CG1 4.31Å; I161-A233 HydrophobicContact CG2-CB 3.65Å
162	L	90	Very high	86.7	Confident	61 Å²	61	35.5 Å²	35.5	32%	0.319	21%	0.205	S	C	.	.	H	α-helix	trans	-62.4	-46	177.5	-175.7	70.1	0	0	0	111.4	Q158 E159 S166 A233 I237	Q158-L162 VanDerWaalsContact O-CB 3.23Å; Q158-L162 WeakPolarHBondContact O-CB 3.38Å; Q158-L162 PolarHBondContact O-N 3.35Å; E159-L162 PolarHBondContact O-N 3.43Å; L162-S166 WeakPolarHBondContact O-CB 3.49Å; L162-S166 PolarHBondContact O-N 3.42Å; L162-S166 PolarHBondContact O-OG 3.37Å; L162-A233 HydrophobicContact CB-CB 4.41Å; L162-A233 HydrophobicContact CD1-CB 4.19Å; L162-I237 HydrophobicContact CD1-CD1 3.99Å; L162-I237 HydrophobicContact CD1-CG1 3.64Å
163	E	88.9	Confident	87	Confident	56 Å²	56	32.5 Å²	32.5	26%	0.262	18%	0.181	S	C	.	.	H	α-helix	trans	-57.5	-51	175.2	-175.2	-179.7	-162	0	0	110.5	E90 R93 E159 R160 S166 R167	E90-E163 HydrophobicContact CG-CG 4.41Å; R93-E163 IonicContact CZ-OE1 2.9Å; R93-E163 IonicContact NE-OE1 2.73Å; R93-E163 PolarHBondContact NE-OE1 3.05Å; R93-E163 VanDerWaalsContact NE-OE1 3.16Å; R93-E163 IonicContact NE-OE2 2.67Å; R93-E163 PolarHBondContact NE-OE2 3.28Å; R93-E163 VanDerWaalsContact NE-OE2 3.1Å; R93-E163 IonicContact NH2-OE1 3.34Å; R93-E163 PolarHBondContact NH2-OE1 3.23Å; E159-E163 WeakPolarHBondContact O-CB 3.42Å; E159-E163 PolarHBondContact O-N 3Å; R160-E163 IonicContact NH1-OE2 3.05Å; E163-S166 PolarHBondContact O-N 2.9Å; E163-R167 PolarHBondContact O-N 3.49Å
164	F	90.4	Very high	87.4	Confident	8 Å²	8	32 Å²	32	4%	0.035	18%	0.177	C	C	.	.	H	α-helix	trans	-62.4	-47.9	-179.6	-180	-106.8	0	0	0	113.2	A94 L97 R160 I161 R167 T168 Q212 L213 L216	A94-F164 HydrophobicContact CB-CD2 3.64Å; A94-F164 HydrophobicContact CB-CE2 3.97Å; L97-F164 HydrophobicContact CD2-CB 4Å; L97-F164 HydrophobicContact CD2-CD1 4.36Å; L97-F164 HydrophobicContact CD2-CG 4.17Å; R160-F164 VanDerWaalsContact O-CB 3.3Å; R160-F164 WeakPolarHBondContact O-CB 3.33Å; R160-F164 PolarHBondContact O-N 3.34Å; I161-F164 PolarHBondContact O-N 3.16Å; F164-R167 PolarHBondContact O-N 3.33Å; F164-T168 HydrophobicContact CD1-CG2 4.42Å; F164-T168 HydrophobicContact CD2-CG2 4.28Å; F164-T168 HydrophobicContact CE1-CG2 4.02Å; F164-T168 HydrophobicContact CE2-CG2 3.87Å; F164-T168 HydrophobicContact CZ-CG2 3.74Å; F164-T168 VanDerWaalsContact O-CG2 3.27Å; F164-T168 WeakPolarHBondContact O-CG2 3.48Å; F164-T168 PolarHBondContact O-N 2.82Å; F164-T168 PolarHBondContact O-OG1 3.39Å; F164-Q212 HydrophobicContact CE2-CB 4.2Å; F164-Q212 HydrophobicContact CZ-CB 4.09Å; F164-L213 HydrophobicContact CE1-CB 4.34Å; F164-L213 HydrophobicContact CE1-CD1 3.92Å; F164-L213 HydrophobicContact CZ-CB 4.17Å; F164-L216 HydrophobicContact CD1-CD2 3.7Å; F164-L216 HydrophobicContact CE1-CB 4.44Å; F164-L216 HydrophobicContact CE1-CD2 3.47Å; F164-L216 VanDerWaalsContact CE1-CD2 3.47Å; F164-L216 HydrophobicContact CZ-CD2 4.37Å
165	Y	92.1	Very high	87.4	Confident	1 Å²	1	34.3 Å²	34.3	0%	0.004	18%	0.184	C	C	.	.	H	α-helix	trans	-68.6	-36.6	178.7	-76	-44.9	0	0	0	112.3	I161 R167 T168 F169 L213 S230 A233 V234 W272 V276	I161-Y165 HydrophobicContact CG2-CD2 3.33Å; I161-Y165 HydrophobicContact CG2-CE2 3.28Å; I161-Y165 WeakPolarHBondContact O-CB 3.46Å; I161-Y165 WeakPolarHBondContact O-CD2 3.14Å; I161-Y165 PolarHBondContact O-N 3.2Å; Y165-R167 VanDerWaalsContact C-N 3.29Å; Y165-R167 PolarHBondContact O-N 2.88Å; Y165-T168 WeakPolarHBondContact CA-OG1 3.5Å; Y165-T168 PolarHBondContact O-N 2.7Å; Y165-T168 PolarHBondContact O-OG1 2.85Å; Y165-T168 VanDerWaalsContact O-OG1 3.1Å; Y165-F169 WeakPolarHBondContact O-CB 3.18Å; Y165-F169 PolarHBondContact O-N 2.99Å; Y165-L213 HydrophobicContact CD1-CD1 3.8Å; Y165-L213 HydrophobicContact CE1-CD1 3.49Å; Y165-L213 VanDerWaalsContact CE1-CD1 3.49Å; Y165-S230 VanDerWaalsContact OH-CB 3.29Å; Y165-S230 WeakPolarHBondContact OH-CB 3.43Å; Y165-A233 HydrophobicContact CD2-CB 3.97Å; Y165-V234 HydrophobicContact CD2-CG2 4.36Å; Y165-W272 HydrophobicContact CD1-CZ2 4.06Å; Y165-W272 HydrophobicContact CG-CZ2 4.36Å; Y165-V276 HydrophobicContact CD1-CG2 4.46Å; Y165-V276 HydrophobicContact CE1-CG1 3.89Å; Y165-V276 HydrophobicContact CE1-CG2 4.37Å
166	S	89.5	Confident	86.8	Confident	45 Å²	45	35.3 Å²	35.3	32%	0.315	18%	0.179	S	C	.	.	H	α-helix	trans	-59.6	-44.4	175.3	-60.7	0	0	0	0	110.5	L162 E163 S170 I237	L162-S166 WeakPolarHBondContact O-CB 3.49Å; L162-S166 PolarHBondContact O-N 3.42Å; L162-S166 PolarHBondContact O-OG 3.37Å; E163-S166 PolarHBondContact O-N 2.9Å; S166-S170 PolarHBondContact O-N 2.9Å; S166-S170 PolarHBondContact O-OG 3.44Å; S166-I237 WeakPolarHBondContact OG-CG1 3.4Å
167	R	88.3	Confident	85.5	Confident	39 Å²	39	35.2 Å²	35.2	15%	0.147	18%	0.184	C	C	.	.	H	α-helix	trans	-67.1	-47.4	179.3	-176	61.9	73.1	-172.6	12	112.6	E90 E163 F164 Y165 F169 S170 V171 G196 C197 T198 W205	E90-R167 VanDerWaalsContact CD-NE 3.32Å; E90-R167 VanDerWaalsContact OE1-CB 3.23Å; E90-R167 WeakPolarHBondContact OE1-CB 3.34Å; E90-R167 WeakPolarHBondContact OE1-CG 3.08Å; E90-R167 IonicContact OE1-CZ 2.88Å; E90-R167 IonicContact OE1-NE 2.7Å; E90-R167 PolarHBondContact OE1-NE 3.48Å; E90-R167 IonicContact OE1-NH2 3.24Å; E90-R167 IonicContact OE2-CZ 3.79Å; E90-R167 IonicContact OE2-NE 3.74Å; E90-R167 PolarHBondContact OE2-NE 3.32Å; E90-R167 VanDerWaalsContact OE2-NE 3.13Å; E90-R167 IonicContact OE2-NH2 2.95Å; E90-R167 PolarHBondContact OE2-NH2 2.98Å; E163-R167 PolarHBondContact O-N 3.49Å; F164-R167 PolarHBondContact O-N 3.33Å; Y165-R167 VanDerWaalsContact C-N 3.29Å; Y165-R167 PolarHBondContact O-N 2.88Å; R167-F169 VanDerWaalsContact C-N 3.26Å; R167-F169 PolarHBondContact O-N 3.45Å; R167-S170 PolarHBondContact O-N 3.37Å; R167-V171 VanDerWaalsContact O-CG2 3.31Å; R167-V171 WeakPolarHBondContact O-CG2 3.47Å; R167-V171 PolarHBondContact O-N 3.19Å; R167-G196 PolarHBondContact NH1-O 3.47Å; R167-C197 VanDerWaalsContact CZ-O 3.26Å; R167-C197 VanDerWaalsContact NH1-C 3.26Å; R167-C197 PolarHBondContact NH1-O 3.47Å; R167-C197 PolarHBondContact NH2-O 3.4Å; R167-T198 PolarHBondContact NH1-OG1 2.79Å; R167-T198 PolarHBondContact NH2-OG1 2.79Å; R167-W205 HydrophobicContact CG-CH2 4.3Å; R167-W205 HydrophobicContact CG-CZ2 3.94Å
168	T	88.8	Confident	83.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.7	-32.6	179.8	59.8	0	0	0	0	112.1	F164 Y165 H172 A209 L213	F164-T168 HydrophobicContact CD1-CG2 4.42Å; F164-T168 HydrophobicContact CD2-CG2 4.28Å; F164-T168 HydrophobicContact CE1-CG2 4.02Å; F164-T168 HydrophobicContact CE2-CG2 3.87Å; F164-T168 HydrophobicContact CZ-CG2 3.74Å; F164-T168 VanDerWaalsContact O-CG2 3.27Å; F164-T168 WeakPolarHBondContact O-CG2 3.48Å; F164-T168 PolarHBondContact O-N 2.82Å; F164-T168 PolarHBondContact O-OG1 3.39Å; Y165-T168 WeakPolarHBondContact CA-OG1 3.5Å; Y165-T168 PolarHBondContact O-N 2.7Å; Y165-T168 PolarHBondContact O-OG1 2.85Å; Y165-T168 VanDerWaalsContact O-OG1 3.1Å; T168-H172 WeakPolarHBondContact O-CB 3.41Å; T168-H172 PolarHBondContact O-N 3.35Å; T168-A209 HydrophobicContact CG2-CB 4.27Å; T168-L213 HydrophobicContact CG2-CB 4.03Å; T168-L213 HydrophobicContact CG2-CD1 4.44Å; T168-L213 HydrophobicContact CG2-CD2 4.49Å
169	F	88.3	Confident	81.5	Confident	8 Å²	8	41.8 Å²	41.8	4%	0.035	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-52.8	170.6	176.7	-91.4	0	0	0	111.5	Y165 R167 V171 H172 M173 I237 L241 V269 W272	Y165-F169 WeakPolarHBondContact O-CB 3.18Å; Y165-F169 PolarHBondContact O-N 2.99Å; R167-F169 VanDerWaalsContact C-N 3.26Å; R167-F169 PolarHBondContact O-N 3.45Å; F169-V171 VanDerWaalsContact C-N 3.27Å; F169-V171 PolarHBondContact O-N 2.91Å; F169-H172 WeakPolarHBondContact O-CB 3.34Å; F169-H172 PolarHBondContact O-N 2.71Å; F169-M173 HydrophobicContact CD1-CG 4Å; F169-M173 HydrophobicContact CD2-CG 4.29Å; F169-M173 HydrophobicContact CE1-CB 4.44Å; F169-M173 HydrophobicContact CE1-CG 3.35Å; F169-M173 HydrophobicContact CE1-SD 4.39Å; F169-M173 HydrophobicContact CE2-CG 3.72Å; F169-M173 HydrophobicContact CE2-SD 3.85Å; F169-M173 HydrophobicContact CG-CG 4.42Å; F169-M173 HydrophobicContact CZ-CE 4.44Å; F169-M173 HydrophobicContact CZ-CG 3.2Å; F169-M173 HydrophobicContact CZ-SD 3.64Å; F169-M173 WeakPolarHBondContact O-CG 3.44Å; F169-M173 PolarHBondContact O-N 3.13Å; F169-I237 HydrophobicContact CB-CG2 4.48Å; F169-I237 HydrophobicContact CD1-CG2 4.48Å; F169-I237 HydrophobicContact CG-CG2 4.28Å; F169-L241 HydrophobicContact CD1-CD1 3.48Å; F169-L241 VanDerWaalsContact CD1-CD1 3.48Å; F169-L241 HydrophobicContact CD1-CD2 4.36Å; F169-L241 HydrophobicContact CD2-CD1 4.35Å; F169-L241 HydrophobicContact CE1-CD1 3.07Å; F169-L241 HydrophobicContact CE1-CD2 3.83Å; F169-L241 HydrophobicContact CE1-CG 4.05Å; F169-L241 HydrophobicContact CE2-CD1 4.01Å; F169-L241 HydrophobicContact CG-CD1 4.12Å; F169-L241 HydrophobicContact CZ-CD1 3.36Å; F169-V269 HydrophobicContact CE2-CB 4.45Å; F169-V269 HydrophobicContact CE2-CG1 4.06Å; F169-V269 HydrophobicContact CE2-CG2 4.06Å; F169-V269 HydrophobicContact CZ-CG2 4.07Å; F169-W272 HydrophobicContact CB-CD2 4.21Å; F169-W272 HydrophobicContact CB-CH2 4.32Å; F169-W272 HydrophobicContact CB-CZ2 3.81Å; F169-W272 HydrophobicContact CD2-CB 4.31Å; F169-W272 AromaticContact CD2-CD2 3.6Å; F169-W272 HydrophobicContact CD2-CD2 3.6Å; F169-W272 AromaticContact CD2-CE3 3.66Å; F169-W272 HydrophobicContact CD2-CE3 3.66Å; F169-W272 AromaticContact CD2-CG 3.89Å; F169-W272 HydrophobicContact CD2-CG 3.89Å; F169-W272 HydrophobicContact CD2-CZ2 4.49Å; F169-W272 HydrophobicContact CD2-CZ3 4.12Å; F169-W272 HydrophobicContact CE2-CE3 4.37Å; F169-W272 HydrophobicContact CG-CD2 4.4Å
170	S	85.9	Confident	79.3	Confident	48 Å²	48	40 Å²	40	34%	0.336	24%	0.238	S	C	.	.	H	α-helix	trans	-55.6	-44.2	178.3	-64.3	0	0	0	0	111.6	S166 R167 H172 M173 T174	S166-S170 PolarHBondContact O-N 2.9Å; S166-S170 PolarHBondContact O-OG 3.44Å; R167-S170 PolarHBondContact O-N 3.37Å; S170-H172 PolarHBondContact O-N 3.5Å; S170-M173 PolarHBondContact O-N 2.88Å; S170-T174 PolarHBondContact O-N 3.42Å; S170-T174 PolarHBondContact O-OG1 3.04Å
171	V	87.8	Confident	77	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-59.4	-44.6	176.1	172	0	0	0	0	112.2	R167 F169 T174 Q175 C206 L210	R167-V171 VanDerWaalsContact O-CG2 3.31Å; R167-V171 WeakPolarHBondContact O-CG2 3.47Å; R167-V171 PolarHBondContact O-N 3.19Å; F169-V171 VanDerWaalsContact C-N 3.27Å; F169-V171 PolarHBondContact O-N 2.91Å; V171-T174 PolarHBondContact O-N 3.33Å; V171-Q175 WeakPolarHBondContact O-CG 3.15Å; V171-Q175 PolarHBondContact O-N 3.18Å; V171-Q175 VanDerWaalsContact O-N 3.15Å; V171-C206 HydrophobicContact CB-CB 4.49Å; V171-C206 HydrophobicContact CG1-CB 3.59Å; V171-C206 HydrophobicContact CG2-CB 4.05Å; V171-C206 VanDerWaalsContact CG2-SG 3.59Å; V171-L210 HydrophobicContact CG1-CD1 4.02Å; V171-L210 HydrophobicContact CG1-CD2 4.31Å; V171-L210 HydrophobicContact CG1-CG 3.96Å
172	H	86.4	Confident	74.3	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.009	30%	0.304	C	S	.	.	H	α-helix	trans	-62.3	-46.6	177.8	-178.3	-75.3	0	0	0	111.9	T168 F169 S170 T174 Q175 E176 L268 W272 R275	T168-H172 WeakPolarHBondContact O-CB 3.41Å; T168-H172 PolarHBondContact O-N 3.35Å; F169-H172 WeakPolarHBondContact O-CB 3.34Å; F169-H172 PolarHBondContact O-N 2.71Å; S170-H172 PolarHBondContact O-N 3.5Å; H172-T174 VanDerWaalsContact C-N 3.34Å; H172-T174 PolarHBondContact O-N 3.02Å; H172-Q175 PolarHBondContact O-N 2.82Å; H172-E176 PolarHBondContact O-N 3.26Å; H172-L268 PolarHBondContact CE1-O 3.39Å; H172-W272 HydrophobicContact CB-CB 4.34Å; H172-W272 HydrophobicContact CB-CG 4.31Å; H172-W272 AromaticContact CD2-CD1 3.98Å; H172-W272 PolarHBondContact CE1-N 3.19Å; H172-W272 AromaticContact CG-CD1 3.84Å; H172-W272 WeakPolarHBondContact NE2-CA 3.36Å; H172-W272 PolarHBondContact NE2-N 3.29Å; H172-R275 PolarHBondContact CD2-NH1 2.83Å; H172-R275 VanDerWaalsContact NE2-CZ 3.26Å; H172-R275 PolarHBondContact NE2-NE 3.15Å; H172-R275 PolarHBondContact NE2-NH2 3.1Å
173	M	85	Confident	71.8	Confident	30 Å²	30	56.7 Å²	56.7	15%	0.148	33%	0.331	C	S	.	.	H	α-helix	trans	-65.2	-36.6	-179.4	-66.8	-54.5	-65.3	0	0	112.4	F169 S170 G177 W265 L268 V269	F169-M173 HydrophobicContact CD1-CG 4Å; F169-M173 HydrophobicContact CD2-CG 4.29Å; F169-M173 HydrophobicContact CE1-CB 4.44Å; F169-M173 HydrophobicContact CE1-CG 3.35Å; F169-M173 HydrophobicContact CE1-SD 4.39Å; F169-M173 HydrophobicContact CE2-CG 3.72Å; F169-M173 HydrophobicContact CE2-SD 3.85Å; F169-M173 HydrophobicContact CG-CG 4.42Å; F169-M173 HydrophobicContact CZ-CE 4.44Å; F169-M173 HydrophobicContact CZ-CG 3.2Å; F169-M173 HydrophobicContact CZ-SD 3.64Å; F169-M173 WeakPolarHBondContact O-CG 3.44Å; F169-M173 PolarHBondContact O-N 3.13Å; S170-M173 PolarHBondContact O-N 2.88Å; M173-G177 WeakPolarHBondContact O-CA 3.18Å; M173-G177 PolarHBondContact O-N 2.69Å; M173-W265 VanDerWaalsContact CE-NE1 3.28Å; M173-L268 HydrophobicContact CE-CB 4.14Å; M173-L268 HydrophobicContact CE-CD1 4.49Å; M173-L268 HydrophobicContact SD-CB 4.34Å; M173-V269 HydrophobicContact CE-CG2 4.24Å; M173-V269 HydrophobicContact SD-CG2 4.15Å
174	T	82.5	Confident	69.2	Low	37 Å²	37	63.2 Å²	63.2	23%	0.227	36%	0.362	C	S	.	.	H	α-helix	trans	-65.5	-41.1	174.4	-49.2	0	0	0	0	111.7	S170 V171 H172 E178 Q195	S170-T174 PolarHBondContact O-N 3.42Å; S170-T174 PolarHBondContact O-OG1 3.04Å; V171-T174 PolarHBondContact O-N 3.33Å; H172-T174 VanDerWaalsContact C-N 3.34Å; H172-T174 PolarHBondContact O-N 3.02Å; T174-E178 WeakPolarHBondContact O-CB 3.44Å; T174-E178 WeakPolarHBondContact O-CG 3.45Å; T174-E178 PolarHBondContact O-N 3.46Å; T174-Q195 HydrophobicContact CG2-CB 3.71Å
175	Q	81.9	Confident	66.3	Low	87 Å²	87	66.5 Å²	66.5	41%	0.407	40%	0.398	S	S	.	.	H	α-helix	trans	-70.3	-39.2	-178.7	-74.9	-177.9	-7.4	0	0	113.7	V171 H172	V171-Q175 WeakPolarHBondContact O-CG 3.15Å; V171-Q175 PolarHBondContact O-N 3.18Å; V171-Q175 VanDerWaalsContact O-N 3.15Å; H172-Q175 PolarHBondContact O-N 2.82Å
176	E	70.3	Confident	63.7	Low	76 Å²	76	71 Å²	71	36%	0.355	44%	0.444	S	S	.	.	H	α-helix	trans	-86.7	-26.5	-179.7	-59.8	-75.3	157.7	0	0	112	H172 A179 L268 R275	H172-E176 PolarHBondContact O-N 3.26Å; E176-A179 PolarHBondContact O-N 2.91Å; E176-L268 HydrophobicContact CB-CD2 4.28Å; E176-R275 IonicContact OE1-CZ 3.97Å; E176-R275 IonicContact OE1-NH2 2.8Å; E176-R275 PolarHBondContact OE1-NH2 3.41Å
177	G	59.3	Low	61.1	Low	27 Å²	27	71.9 Å²	71.9	28%	0.278	46%	0.461	S	S	.	.	H	α-helix	trans	-73.4	-37.9	176.1	0	0	0	0	0	113.8	M173 A179 G180 E181	M173-G177 WeakPolarHBondContact O-CA 3.18Å; M173-G177 PolarHBondContact O-N 2.69Å; G177-A179 PolarHBondContact O-N 3.2Å; G177-G180 PolarHBondContact O-N 3.47Å; G177-G180 VanDerWaalsContact O-N 3.07Å; G177-E181 PolarHBondContact O-N 2.74Å
178	E	47.7	Very low	58.5	Low	129 Å²	129	73.4 Å²	73.4	60%	0.603	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-18.3	173.8	-77.1	177.4	176.7	0	0	113	T174 G180	T174-E178 WeakPolarHBondContact O-CB 3.44Å; T174-E178 WeakPolarHBondContact O-CG 3.45Å; T174-E178 PolarHBondContact O-N 3.46Å; E178-G180 VanDerWaalsContact C-N 3.33Å
179	A	44.1	Very low	56.4	Low	82 Å²	82	78.2 Å²	78.2	68%	0.678	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-16.4	174.7	0	0	0	0	0	113.4	E176 G177	E176-A179 PolarHBondContact O-N 2.91Å; G177-A179 PolarHBondContact O-N 3.2Å
180	G	41.4	Very low	54.5	Low	69 Å²	69	87.6 Å²	87.6	71%	0.711	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-28.4	-178	0	0	0	0	0	115.4	G177 E178	G177-G180 PolarHBondContact O-N 3.47Å; G177-G180 VanDerWaalsContact O-N 3.07Å; E178-G180 VanDerWaalsContact C-N 3.33Å
181	E	37.6	Very low	53.3	Low	169 Å²	169	89.2 Å²	89.2	79%	0.79	59%	0.587	S	S	*	*	S	Bend	trans	-106.7	19.3	-173.1	-67.3	-178	172.6	0	0	114	G177 E183	G177-E181 PolarHBondContact O-N 2.74Å; E181-E183 VanDerWaalsContact C-N 3.26Å; E181-E183 PolarHBondContact O-N 3.18Å; E181-E183 VanDerWaalsContact O-N 3.11Å
182	A	34.1	Very low	52	Low	87 Å²	87	90 Å²	90	72%	0.719	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	25.9	-174.5	0	0	0	0	0	115.9
183	E	37.1	Very low	51.4	Low	190 Å²	190	93.6 Å²	93.6	89%	0.888	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	-11.3	174.6	-82.5	-156.2	154.9	0	0	117.4	E181	E181-E183 VanDerWaalsContact C-N 3.26Å; E181-E183 PolarHBondContact O-N 3.18Å; E181-E183 VanDerWaalsContact O-N 3.11Å
184	E	34.9	Very low	51.1	Low	193 Å²	193	93.2 Å²	93.2	90%	0.902	62%	0.618	S	S	*	*	S	Bend	trans	-140.1	98.5	175	-70.8	-166	163	0	0	113.5
185	G	29.9	Very low	50.7	Low	77 Å²	77	98.2 Å²	98.2	79%	0.794	64%	0.639	S	S	*	*			trans	142.2	69.7	164.3	0	0	0	0	0	115.2	G187	G185-G187 PolarHBondContact O-N 3.48Å; G185-G187 VanDerWaalsContact O-N 3.1Å
186	G	38	Very low	50.4	Low	94 Å²	94	94.1 Å²	94.1	97%	0.969	62%	0.62	S	S	*	*			trans	-63	108.1	167.7	0	0	0	0	0	111.5
187	G	33.8	Very low	50.8	Low	65 Å²	65	90.6 Å²	90.6	67%	0.67	60%	0.604	S	S	*	*			trans	-173.1	70.3	175.6	0	0	0	0	0	112.4	G185	G185-G187 PolarHBondContact O-N 3.48Å; G185-G187 VanDerWaalsContact O-N 3.1Å
188	G	34.6	Very low	51.5	Low	71 Å²	71	93.3 Å²	93.3	73%	0.732	62%	0.615	S	S	*	*			trans	-63.8	126.3	171.1	0	0	0	0	0	110.8	E190	G188-E190 PolarHBondContact O-N 2.99Å
189	P	44.3	Very low	53.2	Low	100 Å²	100	89 Å²	89	65%	0.649	60%	0.598	S	S	*	*			trans	-76.3	107.5	175.1	1.6	12.3	0	0	0	109.7	G191 G192	P189-G191 PolarHBondContact O-N 3.05Å; P189-G191 VanDerWaalsContact O-N 3.16Å; P189-G192 PolarHBondContact O-N 2.76Å; P189-G192 VanDerWaalsContact O-N 3.1Å
190	E	49	Very low	54.9	Low	206 Å²	206	88.7 Å²	88.7	96%	0.963	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	113.8	164.1	-70.4	-172.2	154.3	0	0	108.9	G188	G188-E190 PolarHBondContact O-N 2.99Å
191	G	59.5	Low	56.5	Low	81 Å²	81	89.7 Å²	89.7	84%	0.835	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	106.8	9.5	-173.5	0	0	0	0	0	115.3	P189	P189-G191 PolarHBondContact O-N 3.05Å; P189-G191 VanDerWaalsContact O-N 3.16Å
192	G	61.4	Low	58.3	Low	18 Å²	18	91 Å²	91	19%	0.186	59%	0.587	C	S	.	*	P	Polyproline II helix	trans	-66.8	130.4	-167.4	0	0	0	0	0	116.8	P189 T201	P189-G192 PolarHBondContact O-N 2.76Å; P189-G192 VanDerWaalsContact O-N 3.1Å; G192-T201 WeakPolarHBondContact O-CB 3.42Å; G192-T201 VanDerWaalsContact O-CG2 3.25Å; G192-T201 WeakPolarHBondContact O-CG2 3.5Å; G192-T201 PolarHBondContact O-N 3.23Å; G192-T201 PolarHBondContact O-OG1 2.93Å
193	V	73.2	Confident	60.5	Low	77 Å²	77	95 Å²	95	47%	0.467	58%	0.583	S	S	.	*	B	Isolated β-bridge	trans	-64.4	141.6	156.4	177.5	0	0	0	0	108.7	Q195 T198	V193-Q195 PolarHBondContact O-N 2.7Å; V193-T198 VanDerWaalsContact CG1-CA 3.43Å; V193-T198 WeakPolarHBondContact CG1-O 3.35Å
194	C	78.9	Confident	62.7	Low	23 Å²	23	88.6 Å²	88.6	16%	0.155	56%	0.559	C	S	.	*	P	Polyproline II helix	trans	-65.8	128.1	176.7	176.6	0	0	0	0	110.8	G196 T198 V199 C204 C206	C194-G196 VanDerWaalsContact C-N 3.25Å; C194-G196 PolarHBondContact O-N 3.09Å; C194-T198 WeakPolarHBondContact O-CA 3.42Å; C194-T198 PolarHBondContact O-N 3.39Å; C194-V199 WeakPolarHBondContact CB-O 3.45Å; C194-V199 PolarHBondContact N-O 2.62Å; C194-C204 HydrophobicContact CB-CB 4.33Å; C194-C206 PolarHBondContact SG-SG 3.44Å
195	Q	73.6	Confident	65.2	Low	141 Å²	141	80 Å²	80	66%	0.659	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-27.7	-178.9	-65.8	-66.1	-5.7	0	0	113.6	T174 V193	T174-Q195 HydrophobicContact CG2-CB 3.71Å; V193-Q195 PolarHBondContact O-N 2.7Å
196	G	75.9	Confident	67.9	Low	2 Å²	2	76.9 Å²	76.9	2%	0.021	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-56.4	177.1	0	0	0	0	0	113.7	R167 C194	R167-G196 PolarHBondContact NH1-O 3.47Å; C194-G196 VanDerWaalsContact C-N 3.25Å; C194-G196 PolarHBondContact O-N 3.09Å
197	C	77.9	Confident	70.2	Confident	1 Å²	1	78.9 Å²	78.9	1%	0.007	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-1.6	-174.9	66.3	0	0	0	0	115.1	R167 V199 C206	R167-C197 VanDerWaalsContact CZ-O 3.26Å; R167-C197 VanDerWaalsContact NH1-C 3.26Å; R167-C197 PolarHBondContact NH1-O 3.47Å; R167-C197 PolarHBondContact NH2-O 3.4Å; C197-V199 WeakPolarHBondContact O-CG2 3.16Å; C197-V199 PolarHBondContact O-N 3.09Å; C197-C206 VanDerWaalsContact SG-SG 3.6Å
198	T	75.7	Confident	72.8	Confident	85 Å²	85	78.9 Å²	78.9	52%	0.521	45%	0.451	S	S	.	.			trans	54.8	18.7	178.3	61	0	0	0	0	114.7	R167 V193 C194	R167-T198 PolarHBondContact NH1-OG1 2.79Å; R167-T198 PolarHBondContact NH2-OG1 2.79Å; V193-T198 VanDerWaalsContact CG1-CA 3.43Å; V193-T198 WeakPolarHBondContact CG1-O 3.35Å; C194-T198 WeakPolarHBondContact O-CA 3.42Å; C194-T198 PolarHBondContact O-N 3.39Å
199	V	81.9	Confident	75.3	Confident	39 Å²	39	75.5 Å²	75.5	24%	0.236	42%	0.417	C	S	.	.	S	Bend	trans	-107.2	149.8	176.8	173	0	0	0	0	108.4	C194 C197 T201 R203	C194-V199 WeakPolarHBondContact CB-O 3.45Å; C194-V199 PolarHBondContact N-O 2.62Å; C197-V199 WeakPolarHBondContact O-CG2 3.16Å; C197-V199 PolarHBondContact O-N 3.09Å; V199-T201 PolarHBondContact O-N 3.27Å; V199-R203 HydrophobicContact CG1-CB 3.5Å; V199-R203 WeakPolarHBondContact CG1-O 3.36Å
200	P	81.4	Confident	77.3	Confident	75 Å²	75	71.8 Å²	71.8	49%	0.487	39%	0.391	S	S	.	.	B	Isolated β-bridge	trans	-46.5	138.5	174.9	-30.5	36.4	0	0	0	112.1	Q202 R203 C204	P200-Q202 PolarHBondContact O-N 2.64Å; P200-R203 CarbonylContact O-C 3.58Å; P200-R203 WeakPolarHBondContact O-CA 3.49Å; P200-R203 PolarHBondContact O-N 2.87Å; P200-C204 PolarHBondContact O-N 3Å
201	T	74.4	Confident	79.1	Confident	90 Å²	90	66.7 Å²	66.7	55%	0.552	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-49.2	-32.7	-176.2	27.4	0	0	0	0	113.9	G192 V199 R203 C204	G192-T201 WeakPolarHBondContact O-CB 3.42Å; G192-T201 VanDerWaalsContact O-CG2 3.25Å; G192-T201 WeakPolarHBondContact O-CG2 3.5Å; G192-T201 PolarHBondContact O-N 3.23Å; G192-T201 PolarHBondContact O-OG1 2.93Å; V199-T201 PolarHBondContact O-N 3.27Å; T201-R203 VanDerWaalsContact C-N 3.3Å; T201-R203 PolarHBondContact O-N 2.55Å; T201-C204 WeakPolarHBondContact O-CB 3.39Å; T201-C204 PolarHBondContact O-N 2.63Å
202	Q	75.8	Confident	80.6	Confident	195 Å²	195	63.4 Å²	63.4	91%	0.911	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-68.1	-21.8	176	-61.7	-171.5	3.8	0	0	115.1	P200	P200-Q202 PolarHBondContact O-N 2.64Å
203	R	79.4	Confident	81.9	Confident	171 Å²	171	62.7 Å²	62.7	65%	0.645	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-114.6	18.5	178.8	-65.7	-175.1	-174.4	-171.6	3	112	E89 V199 P200 T201 W205	E89-R203 IonicContact OE1-NH1 2.71Å; V199-R203 HydrophobicContact CG1-CB 3.5Å; V199-R203 WeakPolarHBondContact CG1-O 3.36Å; P200-R203 CarbonylContact O-C 3.58Å; P200-R203 WeakPolarHBondContact O-CA 3.49Å; P200-R203 PolarHBondContact O-N 2.87Å; T201-R203 VanDerWaalsContact C-N 3.3Å; T201-R203 PolarHBondContact O-N 2.55Å; R203-W205 PolarHBondContact O-N 3.47Å
204	C	83.8	Confident	82.6	Confident	57 Å²	57	64 Å²	64	39%	0.385	32%	0.323	S	S	.	.			trans	-59.4	136	176.8	179.6	0	0	0	0	110.9	C194 P200 T201 C206	C194-C204 HydrophobicContact CB-CB 4.33Å; P200-C204 PolarHBondContact O-N 3Å; T201-C204 WeakPolarHBondContact O-CB 3.39Å; T201-C204 PolarHBondContact O-N 2.63Å; C204-C206 PolarHBondContact SG-SG 2.91Å
205	W	87.8	Confident	83.1	Confident	11 Å²	11	65.9 Å²	65.9	4%	0.042	33%	0.33	C	S	.	.			trans	-129.4	22.1	177.4	69	-76.5	0	0	0	112.6	E90 K91 A94 R167 R203 Q207 Q208 A209	E90-W205 HydrophobicContact CG-CZ2 4.06Å; K91-W205 HydrophobicContact CB-CD2 4.09Å; K91-W205 HydrophobicContact CB-CE3 4.45Å; K91-W205 HydrophobicContact CB-CG 4.38Å; K91-W205 HydrophobicContact CB-CZ2 4.5Å; K91-W205 HydrophobicContact CD-CB 4.16Å; K91-W205 HydrophobicContact CD-CG 4.22Å; K91-W205 HydrophobicContact CG-CD2 4.22Å; K91-W205 HydrophobicContact CG-CE3 4.28Å; K91-W205 HydrophobicContact CG-CG 4.41Å; A94-W205 HydrophobicContact CB-CH2 3.9Å; A94-W205 HydrophobicContact CB-CZ3 4.11Å; R167-W205 HydrophobicContact CG-CH2 4.3Å; R167-W205 HydrophobicContact CG-CZ2 3.94Å; R203-W205 PolarHBondContact O-N 3.47Å; W205-Q207 PolarHBondContact O-N 2.85Å; W205-Q208 HydrophobicContact CB-CB 4.4Å; W205-Q208 CarbonylContact O-C 3.58Å; W205-Q208 WeakPolarHBondContact O-CB 3.24Å; W205-Q208 PolarHBondContact O-N 3.42Å; W205-Q208 VanDerWaalsContact O-N 3.17Å; W205-A209 HydrophobicContact CD2-CB 4.39Å; W205-A209 HydrophobicContact CE3-CB 3.64Å; W205-A209 HydrophobicContact CH2-CB 4.11Å; W205-A209 HydrophobicContact CZ3-CB 3.48Å; W205-A209 VanDerWaalsContact CZ3-CB 3.48Å; W205-A209 PolarHBondContact O-N 3.43Å
206	C	86.1	Confident	83.9	Confident	12 Å²	12	59.3 Å²	59.3	8%	0.081	30%	0.299	C	S	.	.	H	α-helix	trans	-55.3	-47	-178.8	-69.9	0	0	0	0	113.7	V171 C194 C197 C204 A209 L210	V171-C206 HydrophobicContact CB-CB 4.49Å; V171-C206 HydrophobicContact CG1-CB 3.59Å; V171-C206 HydrophobicContact CG2-CB 4.05Å; V171-C206 VanDerWaalsContact CG2-SG 3.59Å; C194-C206 PolarHBondContact SG-SG 3.44Å; C197-C206 VanDerWaalsContact SG-SG 3.6Å; C204-C206 PolarHBondContact SG-SG 2.91Å; C206-A209 WeakPolarHBondContact O-CB 3.47Å; C206-A209 PolarHBondContact O-N 3.48Å; C206-L210 PolarHBondContact O-N 3.16Å
207	Q	86.1	Confident	84.6	Confident	137 Å²	137	59.2 Å²	59.2	64%	0.64	30%	0.298	S	S	*	.	H	α-helix	trans	-62.2	-45.7	177	-177.3	-179.5	-13.7	0	0	111.1	W205 A209 L210 E211	W205-Q207 PolarHBondContact O-N 2.85Å; Q207-A209 VanDerWaalsContact C-N 3.29Å; Q207-A209 PolarHBondContact O-N 3.35Å; Q207-L210 PolarHBondContact O-N 3.41Å; Q207-E211 WeakPolarHBondContact CG-OE1 3.18Å; Q207-E211 PolarHBondContact NE2-OE1 3.36Å; Q207-E211 WeakPolarHBondContact O-CG 3.44Å; Q207-E211 PolarHBondContact O-N 3.4Å
208	Q	87.4	Confident	85.1	Confident	64 Å²	64	63.9 Å²	63.9	30%	0.299	32%	0.32	S	S	.	.	H	α-helix	trans	-62.4	-35.6	177.5	-174	174.6	11.1	0	0	112	W205 E211 Q212	W205-Q208 HydrophobicContact CB-CB 4.4Å; W205-Q208 CarbonylContact O-C 3.58Å; W205-Q208 WeakPolarHBondContact O-CB 3.24Å; W205-Q208 PolarHBondContact O-N 3.42Å; W205-Q208 VanDerWaalsContact O-N 3.17Å; Q208-E211 PolarHBondContact O-N 2.85Å; Q208-Q212 HydrophobicContact CG-CG 4.43Å; Q208-Q212 WeakPolarHBondContact O-CB 3.4Å; Q208-Q212 VanDerWaalsContact O-CG 3.25Å; Q208-Q212 WeakPolarHBondContact O-CG 3.48Å; Q208-Q212 PolarHBondContact O-N 2.92Å
209	A	87.1	Confident	85.7	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.008	30%	0.299	C	S	.	.	H	α-helix	trans	-62.9	-42.3	176.2	0	0	0	0	0	111.7	T168 W205 C206 Q207 Q212 L213	T168-A209 HydrophobicContact CG2-CB 4.27Å; W205-A209 HydrophobicContact CD2-CB 4.39Å; W205-A209 HydrophobicContact CE3-CB 3.64Å; W205-A209 HydrophobicContact CH2-CB 4.11Å; W205-A209 HydrophobicContact CZ3-CB 3.48Å; W205-A209 VanDerWaalsContact CZ3-CB 3.48Å; W205-A209 PolarHBondContact O-N 3.43Å; C206-A209 WeakPolarHBondContact O-CB 3.47Å; C206-A209 PolarHBondContact O-N 3.48Å; Q207-A209 VanDerWaalsContact C-N 3.29Å; Q207-A209 PolarHBondContact O-N 3.35Å; A209-Q212 PolarHBondContact O-N 3.44Å; A209-L213 WeakPolarHBondContact O-CB 3.47Å; A209-L213 PolarHBondContact O-N 3.44Å
210	L	87.2	Confident	86	Confident	22 Å²	22	58.6 Å²	58.6	12%	0.115	29%	0.288	C	S	.	.	H	α-helix	trans	-70.4	-37.2	177.3	-66.7	178.3	0	0	0	112.6	V171 C206 Q207 L213 Q214	V171-L210 HydrophobicContact CG1-CD1 4.02Å; V171-L210 HydrophobicContact CG1-CD2 4.31Å; V171-L210 HydrophobicContact CG1-CG 3.96Å; C206-L210 PolarHBondContact O-N 3.16Å; Q207-L210 PolarHBondContact O-N 3.41Å; L210-L213 HydrophobicContact CD2-CD2 4.43Å; L210-L213 WeakPolarHBondContact O-CB 3.36Å; L210-L213 PolarHBondContact O-N 2.84Å; L210-Q214 WeakPolarHBondContact O-CG 3.42Å; L210-Q214 PolarHBondContact O-N 3.17Å
211	E	87.7	Confident	86.3	Confident	98 Å²	98	56.4 Å²	56.4	46%	0.458	27%	0.274	S	S	.	.	H	α-helix	trans	-62.7	-45.9	172.1	-70.9	168.9	-173.4	0	0	111	Q207 Q208 L213 Q214 E215	Q207-E211 WeakPolarHBondContact CG-OE1 3.18Å; Q207-E211 PolarHBondContact NE2-OE1 3.36Å; Q207-E211 WeakPolarHBondContact O-CG 3.44Å; Q207-E211 PolarHBondContact O-N 3.4Å; Q208-E211 PolarHBondContact O-N 2.85Å; E211-L213 VanDerWaalsContact C-N 3.28Å; E211-L213 PolarHBondContact O-N 3.43Å; E211-Q214 PolarHBondContact O-N 3.32Å; E211-E215 PolarHBondContact O-N 3.18Å
212	Q	89.2	Confident	86.9	Confident	13 Å²	13	58.9 Å²	58.9	6%	0.061	27%	0.273	C	S	.	.	H	α-helix	trans	-63.2	-33.3	174.6	-74.9	-178.7	-16.6	0	0	112.4	L98 F164 Q208 A209 L216	L98-Q212 HydrophobicContact CD2-CB 4.25Å; L98-Q212 HydrophobicContact CD2-CG 3.96Å; F164-Q212 HydrophobicContact CE2-CB 4.2Å; F164-Q212 HydrophobicContact CZ-CB 4.09Å; Q208-Q212 HydrophobicContact CG-CG 4.43Å; Q208-Q212 WeakPolarHBondContact O-CB 3.4Å; Q208-Q212 VanDerWaalsContact O-CG 3.25Å; Q208-Q212 WeakPolarHBondContact O-CG 3.48Å; Q208-Q212 PolarHBondContact O-N 2.92Å; A209-Q212 PolarHBondContact O-N 3.44Å; Q212-L216 VanDerWaalsContact O-CB 3.24Å; Q212-L216 WeakPolarHBondContact O-CB 3.48Å; Q212-L216 PolarHBondContact O-N 2.92Å
213	L	89.4	Confident	87.3	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-64.4	-50.6	175.8	175.2	66.9	0	0	0	110.8	F164 Y165 T168 A209 L210 E211 E215 L216 S217 V276	F164-L213 HydrophobicContact CE1-CB 4.34Å; F164-L213 HydrophobicContact CE1-CD1 3.92Å; F164-L213 HydrophobicContact CZ-CB 4.17Å; Y165-L213 HydrophobicContact CD1-CD1 3.8Å; Y165-L213 HydrophobicContact CE1-CD1 3.49Å; Y165-L213 VanDerWaalsContact CE1-CD1 3.49Å; T168-L213 HydrophobicContact CG2-CB 4.03Å; T168-L213 HydrophobicContact CG2-CD1 4.44Å; T168-L213 HydrophobicContact CG2-CD2 4.49Å; A209-L213 WeakPolarHBondContact O-CB 3.47Å; A209-L213 PolarHBondContact O-N 3.44Å; L210-L213 HydrophobicContact CD2-CD2 4.43Å; L210-L213 WeakPolarHBondContact O-CB 3.36Å; L210-L213 PolarHBondContact O-N 2.84Å; E211-L213 VanDerWaalsContact C-N 3.28Å; E211-L213 PolarHBondContact O-N 3.43Å; L213-E215 VanDerWaalsContact C-N 3.27Å; L213-E215 PolarHBondContact O-N 3.42Å; L213-L216 PolarHBondContact O-N 2.95Å; L213-S217 WeakPolarHBondContact O-CB 3.49Å; L213-S217 PolarHBondContact O-N 2.55Å; L213-S217 PolarHBondContact O-OG 3.4Å; L213-V276 HydrophobicContact CD1-CG2 4.27Å; L213-V276 HydrophobicContact CD2-CG2 4.38Å
214	Q	88.6	Confident	87.6	Confident	106 Å²	106	45.2 Å²	45.2	50%	0.495	22%	0.217	S	C	.	.	H	α-helix	trans	-57.9	-43.8	178.3	-72.5	179	-3	0	0	111.1	L210 E211 S217 Q218	L210-Q214 WeakPolarHBondContact O-CG 3.42Å; L210-Q214 PolarHBondContact O-N 3.17Å; E211-Q214 PolarHBondContact O-N 3.32Å; Q214-S217 PolarHBondContact O-N 3.07Å; Q214-Q218 VanDerWaalsContact O-CG 3.29Å; Q214-Q218 WeakPolarHBondContact O-CG 3.4Å; Q214-Q218 PolarHBondContact O-N 3.03Å
215	E	89.3	Confident	87.7	Confident	61 Å²	61	42.6 Å²	42.6	29%	0.285	20%	0.199	S	C	.	.	H	α-helix	trans	-68.9	-41.5	179.8	-167.4	173.7	-170.5	0	0	112.8	L98 R102 E211 L213 S217 Q218 V219	L98-E215 HydrophobicContact CD1-CB 4.34Å; L98-E215 HydrophobicContact CD1-CG 4.19Å; L98-E215 WeakPolarHBondContact CD2-OE2 3.22Å; R102-E215 IonicContact CZ-OE1 3.02Å; R102-E215 IonicContact CZ-OE2 2.88Å; R102-E215 IonicContact NE-OE1 3.44Å; R102-E215 PolarHBondContact NE-OE1 3.38Å; R102-E215 IonicContact NE-OE2 2.78Å; R102-E215 IonicContact NH1-OE1 3.15Å; R102-E215 IonicContact NH2-OE1 3.67Å; R102-E215 PolarHBondContact NH2-OE1 3.16Å; R102-E215 IonicContact NH2-OE2 3.89Å; R102-E215 PolarHBondContact NH2-OE2 3.03Å; E211-E215 PolarHBondContact O-N 3.18Å; L213-E215 VanDerWaalsContact C-N 3.27Å; L213-E215 PolarHBondContact O-N 3.42Å; E215-S217 VanDerWaalsContact C-N 3.32Å; E215-S217 PolarHBondContact O-N 3.34Å; E215-Q218 PolarHBondContact O-N 3.48Å; E215-V219 VanDerWaalsContact O-CG2 3.3Å; E215-V219 WeakPolarHBondContact O-CG2 3.23Å; E215-V219 PolarHBondContact O-N 3.46Å
216	L	90	Very high	87.7	Confident	3 Å²	3	42.7 Å²	42.7	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-60.3	-44.4	174.1	-176.3	64.8	0	0	0	110.7	L97 L98 F101 F164 Q212 L213 Q218 V219 L220	L97-L216 HydrophobicContact CD2-CD2 4.23Å; L98-L216 HydrophobicContact CD1-CB 3.98Å; L98-L216 HydrophobicContact CD1-CD1 4.14Å; F101-L216 HydrophobicContact CB-CD1 4.28Å; F101-L216 HydrophobicContact CD2-CD1 3.83Å; F101-L216 HydrophobicContact CG-CD1 4.27Å; F164-L216 HydrophobicContact CD1-CD2 3.7Å; F164-L216 HydrophobicContact CE1-CB 4.44Å; F164-L216 HydrophobicContact CE1-CD2 3.47Å; F164-L216 VanDerWaalsContact CE1-CD2 3.47Å; F164-L216 HydrophobicContact CZ-CD2 4.37Å; Q212-L216 VanDerWaalsContact O-CB 3.24Å; Q212-L216 WeakPolarHBondContact O-CB 3.48Å; Q212-L216 PolarHBondContact O-N 2.92Å; L213-L216 PolarHBondContact O-N 2.95Å; L216-Q218 PolarHBondContact O-N 3.27Å; L216-V219 PolarHBondContact O-N 2.79Å; L216-L220 HydrophobicContact CD1-CD1 4.16Å; L216-L220 HydrophobicContact CD1-CG 4.19Å; L216-L220 HydrophobicContact CD2-CD1 4.41Å; L216-L220 HydrophobicContact CG-CD1 3.86Å; L216-L220 HydrophobicContact CG-CG 4.29Å; L216-L220 WeakPolarHBondContact O-CB 3.45Å; L216-L220 VanDerWaalsContact O-CG 3.27Å; L216-L220 WeakPolarHBondContact O-CG 3.48Å; L216-L220 PolarHBondContact O-N 2.8Å
217	S	89.7	Confident	87.5	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.007	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-41.6	176.3	-72.1	0	0	0	0	112.2	L213 Q214 E215 S221 V276	L213-S217 WeakPolarHBondContact O-CB 3.49Å; L213-S217 PolarHBondContact O-N 2.55Å; L213-S217 PolarHBondContact O-OG 3.4Å; Q214-S217 PolarHBondContact O-N 3.07Å; E215-S217 VanDerWaalsContact C-N 3.32Å; E215-S217 PolarHBondContact O-N 3.34Å; S217-S221 WeakPolarHBondContact O-CB 3.47Å; S217-S221 PolarHBondContact O-N 3.39Å; S217-V276 WeakPolarHBondContact CB-O 3.08Å; S217-V276 PolarHBondContact OG-O 3.4Å
218	Q	88.4	Confident	87.5	Confident	99 Å²	99	49.8 Å²	49.8	46%	0.463	23%	0.225	S	C	.	.	H	α-helix	trans	-63	-46.7	174.4	-73.5	170	6.4	0	0	112.1	Q214 E215 L216 S221 R222	Q214-Q218 VanDerWaalsContact O-CG 3.29Å; Q214-Q218 WeakPolarHBondContact O-CG 3.4Å; Q214-Q218 PolarHBondContact O-N 3.03Å; E215-Q218 PolarHBondContact O-N 3.48Å; L216-Q218 PolarHBondContact O-N 3.27Å; Q218-S221 PolarHBondContact O-N 3.27Å; Q218-R222 WeakPolarHBondContact O-CG 3.48Å; Q218-R222 PolarHBondContact O-N 2.96Å
219	V	89.3	Confident	87.4	Confident	12 Å²	12	47.4 Å²	47.4	7%	0.073	22%	0.215	C	C	.	.	H	α-helix	trans	-63.1	-45.8	178.8	173.3	0	0	0	0	110.9	F101 R102 L105 E215 L216 R222 L223	F101-V219 HydrophobicContact CB-CG1 3.84Å; F101-V219 WeakPolarHBondContact O-CG1 3.45Å; R102-V219 HydrophobicContact CG-CG2 4.03Å; L105-V219 HydrophobicContact CB-CG1 4.27Å; L105-V219 HydrophobicContact CD2-CG1 4.11Å; L105-V219 HydrophobicContact CD2-CG2 4.45Å; E215-V219 VanDerWaalsContact O-CG2 3.3Å; E215-V219 WeakPolarHBondContact O-CG2 3.23Å; E215-V219 PolarHBondContact O-N 3.46Å; L216-V219 PolarHBondContact O-N 2.79Å; V219-R222 PolarHBondContact O-N 3.3Å; V219-L223 HydrophobicContact CG1-CD1 4.13Å; V219-L223 WeakPolarHBondContact O-CG 3.35Å; V219-L223 PolarHBondContact O-N 2.97Å
220	L	88.8	Confident	87.5	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-67.3	-34.3	178.3	-72.1	176.7	0	0	0	112.9	F101 L216 L223 Q224 L225 L226 V229	F101-L220 HydrophobicContact CD1-CD2 3.6Å; F101-L220 HydrophobicContact CD2-CD2 4.44Å; F101-L220 HydrophobicContact CE1-CD2 3.46Å; F101-L220 VanDerWaalsContact CE1-CD2 3.46Å; F101-L220 HydrophobicContact CE2-CD2 4.31Å; F101-L220 HydrophobicContact CG-CD2 4.11Å; F101-L220 HydrophobicContact CZ-CD2 3.84Å; L216-L220 HydrophobicContact CD1-CD1 4.16Å; L216-L220 HydrophobicContact CD1-CG 4.19Å; L216-L220 HydrophobicContact CD2-CD1 4.41Å; L216-L220 HydrophobicContact CG-CD1 3.86Å; L216-L220 HydrophobicContact CG-CG 4.29Å; L216-L220 WeakPolarHBondContact O-CB 3.45Å; L216-L220 VanDerWaalsContact O-CG 3.27Å; L216-L220 WeakPolarHBondContact O-CG 3.48Å; L216-L220 PolarHBondContact O-N 2.8Å; L220-L223 PolarHBondContact O-N 3.47Å; L220-Q224 PolarHBondContact O-N 2.88Å; L220-Q224 VanDerWaalsContact O-N 3.15Å; L220-L225 HydrophobicContact CD2-CB 4.33Å; L220-L225 PolarHBondContact O-N 3.38Å; L220-L226 HydrophobicContact CB-CB 3.93Å; L220-L226 HydrophobicContact CB-CD1 3.89Å; L220-L226 HydrophobicContact CB-CG 4.5Å; L220-L226 HydrophobicContact CD1-CD1 3.97Å; L220-L226 PolarHBondContact O-N 3.09Å; L220-V229 HydrophobicContact CD1-CG1 4.41Å; L220-V229 HydrophobicContact CD2-CB 4.47Å; L220-V229 HydrophobicContact CD2-CG1 4.31Å
221	S	87.6	Confident	87.4	Confident	29 Å²	29	48.2 Å²	48.2	20%	0.203	22%	0.222	C	C	.	.	H	α-helix	trans	-65.8	-45.9	173.8	179.2	0	0	0	0	111	S217 Q218 L223 Q224 S279	S217-S221 WeakPolarHBondContact O-CB 3.47Å; S217-S221 PolarHBondContact O-N 3.39Å; Q218-S221 PolarHBondContact O-N 3.27Å; S221-L223 VanDerWaalsContact C-N 3.27Å; S221-L223 PolarHBondContact O-N 3.07Å; S221-Q224 PolarHBondContact O-N 3.35Å; S221-S279 PolarHBondContact OG-OG 3Å; S221-S279 VanDerWaalsContact OG-OG 3.12Å
222	R	85.9	Confident	87.5	Confident	142 Å²	142	49.1 Å²	49.1	54%	0.536	23%	0.226	S	C	.	.	H	α-helix	trans	-60.3	-35.2	174.8	-73.4	179.1	65.7	-176.4	-3.4	112.9	L105 Q218 V219 Q224	L105-R222 HydrophobicContact CD1-CB 4.23Å; L105-R222 HydrophobicContact CD2-CB 4.24Å; Q218-R222 WeakPolarHBondContact O-CG 3.48Å; Q218-R222 PolarHBondContact O-N 2.96Å; V219-R222 PolarHBondContact O-N 3.3Å; R222-Q224 VanDerWaalsContact C-N 3.27Å; R222-Q224 PolarHBondContact O-N 3.31Å
223	L	84.8	Confident	87.5	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-5.5	174.7	-69.7	173.7	0	0	0	113.8	F101 L104 L105 L108 F142 V219 L220 S221 L225	F101-L223 HydrophobicContact CD1-CD1 4.11Å; L104-L223 HydrophobicContact CD2-CD1 4.09Å; L104-L223 HydrophobicContact CG-CD1 4.38Å; L105-L223 HydrophobicContact CB-CD1 4.36Å; L105-L223 HydrophobicContact CB-CD2 4.12Å; L105-L223 HydrophobicContact CB-CG 4.29Å; L105-L223 HydrophobicContact CD1-CD2 3.68Å; L105-L223 HydrophobicContact CD1-CG 4.03Å; L108-L223 HydrophobicContact CD1-CD2 3.9Å; F142-L223 WeakPolarHBondContact CD1-O 3.45Å; F142-L223 VanDerWaalsContact CE1-C 3.5Å; F142-L223 WeakPolarHBondContact CE1-O 3.28Å; V219-L223 HydrophobicContact CG1-CD1 4.13Å; V219-L223 WeakPolarHBondContact O-CG 3.35Å; V219-L223 PolarHBondContact O-N 2.97Å; L220-L223 PolarHBondContact O-N 3.47Å; S221-L223 VanDerWaalsContact C-N 3.27Å; S221-L223 PolarHBondContact O-N 3.07Å; L223-L225 HydrophobicContact CB-CB 4.31Å; L223-L225 HydrophobicContact CB-CD1 4.13Å; L223-L225 HydrophobicContact CB-CG 3.92Å; L223-L225 HydrophobicContact CD1-CD1 4.46Å; L223-L225 WeakPolarHBondContact O-CG 3.32Å; L223-L225 PolarHBondContact O-N 3.44Å
224	Q	85.2	Confident	87.5	Confident	79 Å²	79	48.9 Å²	48.9	37%	0.369	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	36.4	-169.6	-54.2	-167.5	-19.1	0	0	113.7	F142 R146 L220 S221 R222	F142-Q224 HydrophobicContact CD1-CB 4.22Å; F142-Q224 HydrophobicContact CD1-CG 4.47Å; F142-Q224 HydrophobicContact CD2-CB 4.35Å; F142-Q224 VanDerWaalsContact CD2-CD 3.44Å; F142-Q224 HydrophobicContact CD2-CG 3.93Å; F142-Q224 HydrophobicContact CE1-CB 4.42Å; F142-Q224 HydrophobicContact CE1-CG 4.36Å; F142-Q224 HydrophobicContact CE2-CG 3.77Å; F142-Q224 HydrophobicContact CG-CB 4.21Å; F142-Q224 HydrophobicContact CG-CG 4.28Å; F142-Q224 HydrophobicContact CZ-CG 4.01Å; R146-Q224 PolarHBondContact NE-O 3.43Å; R146-Q224 PolarHBondContact NH2-O 2.94Å; L220-Q224 PolarHBondContact O-N 2.88Å; L220-Q224 VanDerWaalsContact O-N 3.15Å; S221-Q224 PolarHBondContact O-N 3.35Å; R222-Q224 VanDerWaalsContact C-N 3.27Å; R222-Q224 PolarHBondContact O-N 3.31Å
225	L	86.6	Confident	87.6	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	21%	0.214	C	C	.	.			trans	-111.1	-9.7	178.7	-62	-174.8	0	0	0	112.8	R146 L150 L220 L223 E227 R228 V229	R146-L225 HydrophobicContact CG-CD2 3.5Å; R146-L225 VanDerWaalsContact CG-CD2 3.5Å; L150-L225 HydrophobicContact CD1-CB 4.47Å; L150-L225 HydrophobicContact CD1-CD1 4.31Å; L150-L225 HydrophobicContact CD1-CD2 3.75Å; L150-L225 HydrophobicContact CD1-CG 4.38Å; L220-L225 HydrophobicContact CD2-CB 4.33Å; L220-L225 PolarHBondContact O-N 3.38Å; L223-L225 HydrophobicContact CB-CB 4.31Å; L223-L225 HydrophobicContact CB-CD1 4.13Å; L223-L225 HydrophobicContact CB-CG 3.92Å; L223-L225 HydrophobicContact CD1-CD1 4.46Å; L223-L225 WeakPolarHBondContact O-CG 3.32Å; L223-L225 PolarHBondContact O-N 3.44Å; L225-E227 PolarHBondContact O-N 3.23Å; L225-R228 PolarHBondContact O-N 3.05Å; L225-R228 VanDerWaalsContact O-N 3.1Å; L225-V229 HydrophobicContact CB-CG2 3.94Å; L225-V229 WeakPolarHBondContact O-CB 3.46Å; L225-V229 WeakPolarHBondContact O-CG2 3.25Å; L225-V229 PolarHBondContact O-N 3.06Å
226	L	86.4	Confident	87.7	Confident	13 Å²	13	45.4 Å²	45.4	7%	0.068	22%	0.22	C	C	.	.	H	α-helix	trans	-48.6	-59	-175	-176.2	58.7	0	0	0	112.4	L220 R228 V229 S230 F277	L220-L226 HydrophobicContact CB-CB 3.93Å; L220-L226 HydrophobicContact CB-CD1 3.89Å; L220-L226 HydrophobicContact CB-CG 4.5Å; L220-L226 HydrophobicContact CD1-CD1 3.97Å; L220-L226 PolarHBondContact O-N 3.09Å; L226-R228 VanDerWaalsContact C-N 3.3Å; L226-R228 PolarHBondContact O-N 3.49Å; L226-V229 PolarHBondContact O-N 2.93Å; L226-S230 WeakPolarHBondContact O-CB 3.39Å; L226-S230 PolarHBondContact O-N 3.24Å; L226-S230 PolarHBondContact O-OG 2.96Å; L226-F277 HydrophobicContact CD2-CD1 4.23Å; L226-F277 HydrophobicContact CG-CD1 4.14Å; L226-F277 HydrophobicContact CG-CE1 4.46Å
227	E	83.3	Confident	87.7	Confident	132 Å²	132	45.7 Å²	45.7	62%	0.617	22%	0.221	S	C	*	.	H	α-helix	trans	-58.5	-39.5	-179.1	-65.2	-175.5	170.3	0	0	113.2	L225 S231	L225-E227 PolarHBondContact O-N 3.23Å; E227-S231 WeakPolarHBondContact O-CB 3.48Å; E227-S231 PolarHBondContact O-N 3.48Å; E227-S231 PolarHBondContact O-OG 3.07Å
228	R	84.9	Confident	87.7	Confident	167 Å²	167	45.8 Å²	45.8	63%	0.63	22%	0.221	S	C	*	.	H	α-helix	trans	-75.4	-34.4	-175.6	-173.9	60.4	176	166.9	3.3	112.5	L150 L225 L226	L150-R228 HydrophobicContact CB-CG 4.48Å; L150-R228 HydrophobicContact CD1-CB 4.17Å; L150-R228 HydrophobicContact CD1-CG 3.77Å; L225-R228 PolarHBondContact O-N 3.05Å; L225-R228 VanDerWaalsContact O-N 3.1Å; L226-R228 VanDerWaalsContact C-N 3.3Å; L226-R228 PolarHBondContact O-N 3.49Å
229	V	87.1	Confident	87.9	Confident	14 Å²	14	43.1 Å²	43.1	9%	0.085	21%	0.209	C	C	.	.	H	α-helix	trans	-88.5	-38	-174.3	174.3	0	0	0	0	111.2	F101 L150 I161 L220 L225 L226	F101-V229 HydrophobicContact CZ-CG1 4.07Å; L150-V229 HydrophobicContact CD1-CG2 3.65Å; L150-V229 HydrophobicContact CD2-CG2 4.12Å; I161-V229 HydrophobicContact CD1-CG1 3.23Å; I161-V229 HydrophobicContact CG1-CG1 4.31Å; L220-V229 HydrophobicContact CD1-CG1 4.41Å; L220-V229 HydrophobicContact CD2-CB 4.47Å; L220-V229 HydrophobicContact CD2-CG1 4.31Å; L225-V229 HydrophobicContact CB-CG2 3.94Å; L225-V229 WeakPolarHBondContact O-CB 3.46Å; L225-V229 WeakPolarHBondContact O-CG2 3.25Å; L225-V229 PolarHBondContact O-N 3.06Å; L226-V229 PolarHBondContact O-N 2.93Å
230	S	87.2	Confident	88	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-89.9	-29.4	-176.3	72.9	0	0	0	0	114.4	Y165 L226 E232 A233 V234 F277	Y165-S230 VanDerWaalsContact OH-CB 3.29Å; Y165-S230 WeakPolarHBondContact OH-CB 3.43Å; L226-S230 WeakPolarHBondContact O-CB 3.39Å; L226-S230 PolarHBondContact O-N 3.24Å; L226-S230 PolarHBondContact O-OG 2.96Å; S230-E232 PolarHBondContact O-N 3.36Å; S230-A233 PolarHBondContact O-N 3.42Å; S230-V234 VanDerWaalsContact O-CB 3.3Å; S230-V234 WeakPolarHBondContact O-CB 3.12Å; S230-V234 WeakPolarHBondContact O-CG2 3.49Å; S230-V234 PolarHBondContact O-N 3.49Å; S230-F277 VanDerWaalsContact OG-CE1 3.24Å; S230-F277 WeakPolarHBondContact OG-CE1 3.36Å; S230-F277 WeakPolarHBondContact OG-CZ 3.45Å
231	S	86.6	Confident	87.9	Confident	40 Å²	40	50.1 Å²	50.1	28%	0.28	24%	0.24	S	C	.	.	H	α-helix	trans	-56.2	-48.2	-171.4	51.3	0	0	0	0	113.9	E227 V234 T235	E227-S231 WeakPolarHBondContact O-CB 3.48Å; E227-S231 PolarHBondContact O-N 3.48Å; E227-S231 PolarHBondContact O-OG 3.07Å; S231-V234 PolarHBondContact O-N 2.81Å; S231-T235 VanDerWaalsContact O-CB 3.3Å; S231-T235 WeakPolarHBondContact O-CB 3.41Å; S231-T235 PolarHBondContact O-N 3.4Å; S231-T235 PolarHBondContact O-OG1 3.42Å
232	E	88.3	Confident	87.9	Confident	117 Å²	117	48.9 Å²	48.9	55%	0.547	23%	0.231	S	C	.	.	H	α-helix	trans	-63	-47	-177.5	-175.8	175.8	-164.3	0	0	112.2	Q158 S230 T235 S236	Q158-E232 PolarHBondContact NE2-OE1 3.27Å; Q158-E232 PolarHBondContact NE2-OE2 3.48Å; S230-E232 PolarHBondContact O-N 3.36Å; E232-T235 PolarHBondContact O-N 3.38Å; E232-S236 WeakPolarHBondContact O-CB 3.22Å; E232-S236 PolarHBondContact O-N 2.89Å
233	A	89.2	Confident	88.2	Confident	10 Å²	10	46.3 Å²	46.3	8%	0.083	23%	0.225	C	C	.	.	H	α-helix	trans	-65.2	-46.2	178.5	0	0	0	0	0	111.5	I161 L162 Y165 S230 S236 I237	I161-A233 HydrophobicContact CG2-CB 3.65Å; L162-A233 HydrophobicContact CB-CB 4.41Å; L162-A233 HydrophobicContact CD1-CB 4.19Å; Y165-A233 HydrophobicContact CD2-CB 3.97Å; S230-A233 PolarHBondContact O-N 3.42Å; A233-S236 PolarHBondContact O-N 3.44Å; A233-I237 WeakPolarHBondContact O-CB 3.45Å; A233-I237 WeakPolarHBondContact O-CD1 3.43Å; A233-I237 VanDerWaalsContact O-CG1 3.22Å; A233-I237 WeakPolarHBondContact O-CG1 3.33Å; A233-I237 PolarHBondContact O-N 3.43Å
234	V	90.6	Very high	88.5	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59.1	-48.7	176.2	168.4	0	0	0	0	110.7	Y165 S230 S231 S236 I237 L238 W272 L273 V276 F277 W312	Y165-V234 HydrophobicContact CD2-CG2 4.36Å; S230-V234 VanDerWaalsContact O-CB 3.3Å; S230-V234 WeakPolarHBondContact O-CB 3.12Å; S230-V234 WeakPolarHBondContact O-CG2 3.49Å; S230-V234 PolarHBondContact O-N 3.49Å; S231-V234 PolarHBondContact O-N 2.81Å; V234-S236 VanDerWaalsContact C-N 3.34Å; V234-S236 PolarHBondContact O-N 3.22Å; V234-I237 PolarHBondContact O-N 3.45Å; V234-L238 HydrophobicContact CG1-CD1 3.75Å; V234-L238 HydrophobicContact CG1-CG 4.22Å; V234-L238 WeakPolarHBondContact O-CB 3.32Å; V234-L238 WeakPolarHBondContact O-CG 3.25Å; V234-L238 PolarHBondContact O-N 3.38Å; V234-W272 HydrophobicContact CG1-CZ3 4.11Å; V234-W272 HydrophobicContact CG2-CH2 3.96Å; V234-W272 HydrophobicContact CG2-CZ3 4.25Å; V234-L273 HydrophobicContact CG1-CD2 3.3Å; V234-V276 HydrophobicContact CG2-CG1 4.17Å; V234-F277 HydrophobicContact CG1-CE2 4.41Å; V234-W312 HydrophobicContact CB-CH2 4.48Å; V234-W312 HydrophobicContact CG1-CH2 3.88Å; V234-W312 HydrophobicContact CG1-CZ2 4.24Å; V234-W312 HydrophobicContact CG1-CZ3 4.2Å
235	T	91.1	Very high	88.5	Confident	36 Å²	36	50.4 Å²	50.4	22%	0.221	24%	0.241	C	C	.	.	H	α-helix	trans	-58.6	-45.2	177	-64.5	0	0	0	0	111.6	S231 E232 L238 H239 W312	S231-T235 VanDerWaalsContact O-CB 3.3Å; S231-T235 WeakPolarHBondContact O-CB 3.41Å; S231-T235 PolarHBondContact O-N 3.4Å; S231-T235 PolarHBondContact O-OG1 3.42Å; E232-T235 PolarHBondContact O-N 3.38Å; T235-L238 PolarHBondContact O-N 3.42Å; T235-H239 WeakPolarHBondContact CG2-CE1 3.46Å; T235-H239 WeakPolarHBondContact O-CB 3.16Å; T235-H239 PolarHBondContact O-CD2 3.21Å; T235-H239 PolarHBondContact O-N 2.86Å; T235-W312 VanDerWaalsContact OG1-CH2 3.29Å; T235-W312 WeakPolarHBondContact OG1-CH2 3.38Å
236	S	90.9	Very high	88.7	Confident	58 Å²	58	50.8 Å²	50.8	41%	0.406	24%	0.243	S	C	.	.	H	α-helix	trans	-61.9	-44.5	178.7	-178.1	0	0	0	0	112.2	E232 A233 V234 K240	E232-S236 WeakPolarHBondContact O-CB 3.22Å; E232-S236 PolarHBondContact O-N 2.89Å; A233-S236 PolarHBondContact O-N 3.44Å; V234-S236 VanDerWaalsContact C-N 3.34Å; V234-S236 PolarHBondContact O-N 3.22Å; S236-K240 WeakPolarHBondContact O-CB 3.19Å; S236-K240 PolarHBondContact O-N 3.37Å
237	I	89.8	Confident	88.8	Confident	8 Å²	8	54.6 Å²	54.6	4%	0.041	26%	0.26	C	S	.	.	H	α-helix	trans	-61	-53.2	176.7	-69.5	162	0	0	0	110.1	L162 S166 F169 A233 V234 H239 K240 L241	L162-I237 HydrophobicContact CD1-CD1 3.99Å; L162-I237 HydrophobicContact CD1-CG1 3.64Å; S166-I237 WeakPolarHBondContact OG-CG1 3.4Å; F169-I237 HydrophobicContact CB-CG2 4.48Å; F169-I237 HydrophobicContact CD1-CG2 4.48Å; F169-I237 HydrophobicContact CG-CG2 4.28Å; A233-I237 WeakPolarHBondContact O-CB 3.45Å; A233-I237 WeakPolarHBondContact O-CD1 3.43Å; A233-I237 VanDerWaalsContact O-CG1 3.22Å; A233-I237 WeakPolarHBondContact O-CG1 3.33Å; A233-I237 PolarHBondContact O-N 3.43Å; V234-I237 PolarHBondContact O-N 3.45Å; I237-H239 PolarHBondContact O-N 3.48Å; I237-K240 PolarHBondContact O-N 3.17Å; I237-L241 HydrophobicContact CG2-CD1 3.39Å; I237-L241 HydrophobicContact CG2-CG 4.25Å; I237-L241 WeakPolarHBondContact O-CB 3.44Å; I237-L241 VanDerWaalsContact O-CD1 3.32Å; I237-L241 WeakPolarHBondContact O-CD1 3.41Å; I237-L241 WeakPolarHBondContact O-CG 3.29Å; I237-L241 PolarHBondContact O-N 3.28Å
238	L	90.3	Very high	89	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-57.1	-47.5	-179.7	-69.2	173.1	0	0	0	111.9	V234 T235 L241 I242 V269 L273 W312 M316	V234-L238 HydrophobicContact CG1-CD1 3.75Å; V234-L238 HydrophobicContact CG1-CG 4.22Å; V234-L238 WeakPolarHBondContact O-CB 3.32Å; V234-L238 WeakPolarHBondContact O-CG 3.25Å; V234-L238 PolarHBondContact O-N 3.38Å; T235-L238 PolarHBondContact O-N 3.42Å; L238-L241 PolarHBondContact O-N 3.25Å; L238-I242 WeakPolarHBondContact O-CB 3.22Å; L238-I242 WeakPolarHBondContact O-CD1 3.33Å; L238-I242 VanDerWaalsContact O-CG1 3.23Å; L238-I242 WeakPolarHBondContact O-CG1 3.22Å; L238-I242 PolarHBondContact O-N 2.89Å; L238-V269 HydrophobicContact CD2-CG1 3.17Å; L238-L273 HydrophobicContact CD1-CD1 4.09Å; L238-L273 HydrophobicContact CD1-CD2 4.18Å; L238-L273 HydrophobicContact CD2-CD1 4.38Å; L238-W312 HydrophobicContact CD1-CE3 3.8Å; L238-W312 HydrophobicContact CD1-CZ3 3.6Å; L238-M316 HydrophobicContact CD1-CG 4.2Å; L238-M316 HydrophobicContact CD1-SD 4.2Å; L238-M316 HydrophobicContact CD2-CE 4.41Å; L238-M316 HydrophobicContact CD2-SD 4.23Å
239	H	92.4	Very high	89.1	Confident	43 Å²	43	51.4 Å²	51.4	20%	0.199	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-50.2	180	-71.1	177.6	0	0	0	111.5	T235 I237 L241 I242 E243 H315 F319	T235-H239 WeakPolarHBondContact CG2-CE1 3.46Å; T235-H239 WeakPolarHBondContact O-CB 3.16Å; T235-H239 PolarHBondContact O-CD2 3.21Å; T235-H239 PolarHBondContact O-N 2.86Å; I237-H239 PolarHBondContact O-N 3.48Å; H239-L241 VanDerWaalsContact C-N 3.3Å; H239-L241 PolarHBondContact O-N 3.08Å; H239-I242 PolarHBondContact O-N 2.89Å; H239-E243 WeakPolarHBondContact O-CB 3.1Å; H239-E243 WeakPolarHBondContact O-CG 3.4Å; H239-E243 PolarHBondContact O-N 2.77Å; H239-H315 AromaticContact NE2-CE1 3.32Å; H239-H315 PolarHBondContact NE2-CE1 2.83Å; H239-H315 VanDerWaalsContact NE2-CE1 3.32Å; H239-H315 AromaticContact NE2-NE2 3.92Å; H239-F319 HydrophobicContact CB-CE1 3.81Å; H239-F319 HydrophobicContact CB-CE2 4.07Å; H239-F319 HydrophobicContact CB-CZ 3.48Å; H239-F319 VanDerWaalsContact CB-CZ 3.48Å; H239-F319 AromaticContact CD2-CD1 3.65Å; H239-F319 AromaticContact CD2-CD2 3.39Å; H239-F319 WeakPolarHBondContact CD2-CD2 3.47Å; H239-F319 AromaticContact CD2-CE1 3.64Å; H239-F319 AromaticContact CD2-CE2 3.37Å; H239-F319 WeakPolarHBondContact CD2-CE2 3.4Å; H239-F319 AromaticContact CD2-CG 3.54Å; H239-F319 AromaticContact CD2-CZ 3.51Å; H239-F319 AromaticContact CE1-CD2 3.82Å; H239-F319 AromaticContact CE1-CE2 3.69Å; H239-F319 AromaticContact CG-CD2 3.97Å; H239-F319 AromaticContact CG-CE1 3.85Å; H239-F319 AromaticContact CG-CE2 3.45Å; H239-F319 VanDerWaalsContact CG-CE2 3.45Å; H239-F319 AromaticContact CG-CZ 3.39Å; H239-F319 AromaticContact ND1-CE2 3.64Å; H239-F319 AromaticContact ND1-CZ 3.99Å; H239-F319 AromaticContact NE2-CD2 3.29Å; H239-F319 VanDerWaalsContact NE2-CD2 3.29Å; H239-F319 WeakPolarHBondContact NE2-CD2 3.35Å; H239-F319 AromaticContact NE2-CE2 3.55Å; H239-F319 AromaticContact NE2-CG 3.74Å
240	K	90.4	Very high	89.1	Confident	124 Å²	124	50.8 Å²	50.8	54%	0.539	25%	0.248	S	C	.	.	H	α-helix	trans	-61.2	-38.7	-179.9	-174.7	178.3	179.1	-177.5	0	112.2	S236 I237 Q244	S236-K240 WeakPolarHBondContact O-CB 3.19Å; S236-K240 PolarHBondContact O-N 3.37Å; I237-K240 PolarHBondContact O-N 3.17Å; K240-Q244 WeakPolarHBondContact O-CB 3.39Å; K240-Q244 WeakPolarHBondContact O-CG 3.3Å; K240-Q244 PolarHBondContact O-N 2.91Å
241	L	86.4	Confident	89.3	Confident	37 Å²	37	56.2 Å²	56.2	19%	0.194	27%	0.269	C	S	.	.	H	α-helix	trans	-71.7	-43.9	-179.8	-71.7	164.1	0	0	0	112.8	F169 I237 L238 H239 E243 Q244 R245 W265	F169-L241 HydrophobicContact CD1-CD1 3.48Å; F169-L241 VanDerWaalsContact CD1-CD1 3.48Å; F169-L241 HydrophobicContact CD1-CD2 4.36Å; F169-L241 HydrophobicContact CD2-CD1 4.35Å; F169-L241 HydrophobicContact CE1-CD1 3.07Å; F169-L241 HydrophobicContact CE1-CD2 3.83Å; F169-L241 HydrophobicContact CE1-CG 4.05Å; F169-L241 HydrophobicContact CE2-CD1 4.01Å; F169-L241 HydrophobicContact CG-CD1 4.12Å; F169-L241 HydrophobicContact CZ-CD1 3.36Å; I237-L241 HydrophobicContact CG2-CD1 3.39Å; I237-L241 HydrophobicContact CG2-CG 4.25Å; I237-L241 WeakPolarHBondContact O-CB 3.44Å; I237-L241 VanDerWaalsContact O-CD1 3.32Å; I237-L241 WeakPolarHBondContact O-CD1 3.41Å; I237-L241 WeakPolarHBondContact O-CG 3.29Å; I237-L241 PolarHBondContact O-N 3.28Å; L238-L241 PolarHBondContact O-N 3.25Å; H239-L241 VanDerWaalsContact C-N 3.3Å; H239-L241 PolarHBondContact O-N 3.08Å; L241-E243 VanDerWaalsContact C-N 3.27Å; L241-E243 PolarHBondContact O-N 3.05Å; L241-Q244 PolarHBondContact O-N 3.33Å; L241-R245 WeakPolarHBondContact O-CB 3.44Å; L241-R245 PolarHBondContact O-N 3.44Å; L241-W265 HydrophobicContact CB-CH2 4.44Å
242	I	88.8	Confident	89.4	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-44.9	175.6	-69.1	165.5	0	0	0	109.1	L238 H239 M246 W265 L266 F319 F320	L238-I242 WeakPolarHBondContact O-CB 3.22Å; L238-I242 WeakPolarHBondContact O-CD1 3.33Å; L238-I242 VanDerWaalsContact O-CG1 3.23Å; L238-I242 WeakPolarHBondContact O-CG1 3.22Å; L238-I242 PolarHBondContact O-N 2.89Å; H239-I242 PolarHBondContact O-N 2.89Å; I242-M246 VanDerWaalsContact O-CB 3.22Å; I242-M246 WeakPolarHBondContact O-CB 3.07Å; I242-M246 PolarHBondContact O-N 3.2Å; I242-W265 HydrophobicContact CG1-CH2 4.12Å; I242-W265 HydrophobicContact CG1-CZ3 3.9Å; I242-L266 HydrophobicContact CD1-CD2 4.24Å; I242-L266 HydrophobicContact CG1-CD2 4.37Å; I242-F319 HydrophobicContact CB-CD1 4.2Å; I242-F319 HydrophobicContact CB-CE1 4.13Å; I242-F319 HydrophobicContact CD1-CD1 3.82Å; I242-F319 HydrophobicContact CD1-CE1 4.46Å; I242-F319 HydrophobicContact CG2-CD1 4.04Å; I242-F319 HydrophobicContact CG2-CE1 4.16Å; I242-F320 HydrophobicContact CG2-CB 4.34Å; I242-F320 HydrophobicContact CG2-CD2 4.4Å
243	E	91.9	Very high	89.5	Confident	89 Å²	89	55.9 Å²	55.9	42%	0.416	28%	0.275	S	S	.	.	H	α-helix	trans	-59.9	-49.6	175.4	-76	171.7	-172.8	0	0	112.1	H239 L241 M246 E247 F319 I323	H239-E243 WeakPolarHBondContact O-CB 3.1Å; H239-E243 WeakPolarHBondContact O-CG 3.4Å; H239-E243 PolarHBondContact O-N 2.77Å; L241-E243 VanDerWaalsContact C-N 3.27Å; L241-E243 PolarHBondContact O-N 3.05Å; E243-M246 PolarHBondContact O-N 2.89Å; E243-E247 WeakPolarHBondContact O-CB 3.38Å; E243-E247 PolarHBondContact O-N 2.85Å; E243-F319 HydrophobicContact CG-CE1 4.46Å; E243-F319 HydrophobicContact CG-CZ 4.46Å; E243-I323 HydrophobicContact CG-CG2 4.07Å
244	Q	90.3	Very high	89.7	Confident	89 Å²	89	56.8 Å²	56.8	42%	0.416	28%	0.276	S	S	.	.	H	α-helix	trans	-63.5	-45	-179.3	-77.2	177.3	-16.8	0	0	113	K240 L241 M246 E247 Q248	K240-Q244 WeakPolarHBondContact O-CB 3.39Å; K240-Q244 WeakPolarHBondContact O-CG 3.3Å; K240-Q244 PolarHBondContact O-N 2.91Å; L241-Q244 PolarHBondContact O-N 3.33Å; Q244-M246 VanDerWaalsContact C-N 3.34Å; Q244-E247 PolarHBondContact O-N 3.19Å; Q244-Q248 WeakPolarHBondContact O-CB 3.37Å; Q244-Q248 VanDerWaalsContact O-CG 3.29Å; Q244-Q248 WeakPolarHBondContact O-CG 3.5Å; Q244-Q248 PolarHBondContact O-N 3.3Å
245	R	87.1	Confident	89.7	Confident	76 Å²	76	63.8 Å²	63.8	29%	0.287	31%	0.309	S	S	.	.	H	α-helix	trans	-65.3	-41.1	179.3	-173.2	171.3	179	90.6	-5.8	110.8	L241 Q248 H249 F262	L241-R245 WeakPolarHBondContact O-CB 3.44Å; L241-R245 PolarHBondContact O-N 3.44Å; R245-Q248 PolarHBondContact O-N 3.05Å; R245-H249 WeakPolarHBondContact O-CB 3.31Å; R245-H249 PolarHBondContact O-CD2 3.46Å; R245-H249 PolarHBondContact O-N 3.46Å; R245-F262 HydrophobicContact CB-CE1 4.46Å; R245-F262 HydrophobicContact CG-CE1 4.14Å; R245-F262 HydrophobicContact CG-CZ 4.05Å
246	M	89.2	Confident	89.7	Confident	9 Å²	9	64.4 Å²	64.4	4%	0.044	32%	0.315	C	S	.	.	H	α-helix	trans	-65.5	-43.5	177.2	-169	-171.1	72.9	0	0	111.9	I242 E243 Q244 Q248 C250 F262 I323 Y324 M327	I242-M246 VanDerWaalsContact O-CB 3.22Å; I242-M246 WeakPolarHBondContact O-CB 3.07Å; I242-M246 PolarHBondContact O-N 3.2Å; E243-M246 PolarHBondContact O-N 2.89Å; Q244-M246 VanDerWaalsContact C-N 3.34Å; M246-Q248 VanDerWaalsContact C-N 3.28Å; M246-Q248 PolarHBondContact O-N 3.1Å; M246-C250 HydrophobicContact CG-CB 3.95Å; M246-C250 WeakPolarHBondContact O-CA 3.36Å; M246-C250 VanDerWaalsContact O-CB 3.23Å; M246-C250 WeakPolarHBondContact O-CB 3.41Å; M246-C250 PolarHBondContact O-N 2.99Å; M246-F262 HydrophobicContact CB-CZ 4.4Å; M246-I323 HydrophobicContact CE-CB 4.4Å; M246-I323 HydrophobicContact CE-CG2 3.21Å; M246-I323 HydrophobicContact SD-CB 4.41Å; M246-I323 HydrophobicContact SD-CG2 3.67Å; M246-Y324 HydrophobicContact CG-CD2 4.36Å; M246-Y324 WeakPolarHBondContact SD-CA 3.3Å; M246-Y324 HydrophobicContact SD-CD2 4.09Å; M246-Y324 PolarHBondContact SD-N 3.4Å; M246-M327 HydrophobicContact CE-CB 3.63Å; M246-M327 HydrophobicContact CE-CE 4.25Å; M246-M327 HydrophobicContact CE-CG 4.13Å; M246-M327 HydrophobicContact CE-SD 3.71Å; M246-M327 HydrophobicContact CG-CE 3.8Å; M246-M327 HydrophobicContact CG-SD 3.8Å; M246-M327 HydrophobicContact SD-CB 4.35Å; M246-M327 HydrophobicContact SD-CE 3.84Å; M246-M327 HydrophobicContact SD-SD 4.04Å
247	E	89.1	Confident	89.8	Confident	92 Å²	92	64.2 Å²	64.2	43%	0.43	31%	0.313	S	S	.	.	H	α-helix	trans	-61.7	-35.8	177.2	-175	65.2	-156.2	0	0	112.3	E243 Q244 R251	E243-E247 WeakPolarHBondContact O-CB 3.38Å; E243-E247 PolarHBondContact O-N 2.85Å; Q244-E247 PolarHBondContact O-N 3.19Å; E247-R251 VanDerWaalsContact CD-NH1 3.31Å; E247-R251 WeakPolarHBondContact O-CB 3.36Å; E247-R251 WeakPolarHBondContact OE1-CD 3.45Å; E247-R251 IonicContact OE1-CZ 2.99Å; E247-R251 IonicContact OE1-NE 3.31Å; E247-R251 IonicContact OE1-NH1 3.84Å; E247-R251 PolarHBondContact OE1-NH1 3.43Å; E247-R251 IonicContact OE2-NH1 3.56Å; E247-R251 PolarHBondContact OE2-NH1 3.16Å; E247-R251 VanDerWaalsContact OE2-NH1 3.15Å
248	Q	88.1	Confident	89.8	Confident	147 Å²	147	64.4 Å²	64.4	69%	0.687	31%	0.314	S	S	*	.	H	α-helix	trans	-81	-39	-178.3	-72.8	174.2	-3.5	0	0	114	Q244 R245 M246	Q244-Q248 WeakPolarHBondContact O-CB 3.37Å; Q244-Q248 VanDerWaalsContact O-CG 3.29Å; Q244-Q248 WeakPolarHBondContact O-CG 3.5Å; Q244-Q248 PolarHBondContact O-N 3.3Å; R245-Q248 PolarHBondContact O-N 3.05Å; M246-Q248 VanDerWaalsContact C-N 3.28Å; M246-Q248 PolarHBondContact O-N 3.1Å
249	H	86.5	Confident	89.7	Confident	86 Å²	86	65.2 Å²	65.2	40%	0.398	32%	0.318	S	S	.	.	H	α-helix	trans	-105.2	-24.4	-171.2	-72.3	-86.5	0	0	0	114.3	R245 F258	R245-H249 WeakPolarHBondContact O-CB 3.31Å; R245-H249 PolarHBondContact O-CD2 3.46Å; R245-H249 PolarHBondContact O-N 3.46Å; H249-F258 VanDerWaalsContact O-CE1 3.3Å; H249-F258 WeakPolarHBondContact O-CE1 3.02Å; H249-F258 WeakPolarHBondContact O-CZ 3.28Å
250	C	88	Confident	89.5	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-24	-173.8	-57.3	0	0	0	0	113.3	M246 G252 E253 F258 F262 Y324 M327 R328	M246-C250 HydrophobicContact CG-CB 3.95Å; M246-C250 WeakPolarHBondContact O-CA 3.36Å; M246-C250 VanDerWaalsContact O-CB 3.23Å; M246-C250 WeakPolarHBondContact O-CB 3.41Å; M246-C250 PolarHBondContact O-N 2.99Å; C250-G252 PolarHBondContact O-N 2.63Å; C250-E253 PolarHBondContact O-N 2.7Å; C250-F258 HydrophobicContact CB-CD2 4.36Å; C250-F258 HydrophobicContact CB-CE2 4.42Å; C250-F262 WeakPolarHBondContact SG-CE2 3.48Å; C250-F262 VanDerWaalsContact SG-CZ 3.55Å; C250-Y324 HydrophobicContact CB-CE2 4.35Å; C250-M327 HydrophobicContact CB-CE 3.68Å; C250-M327 HydrophobicContact CB-SD 4.05Å; C250-R328 VanDerWaalsContact O-CZ 3.32Å; C250-R328 PolarHBondContact O-NH1 2.85Å; C250-R328 PolarHBondContact O-NH2 3.4Å
251	R	89.8	Confident	89.4	Confident	115 Å²	115	67.2 Å²	67.2	43%	0.434	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	127.5	-170.9	-162.8	172.8	-173.9	149.7	12.6	111.1	E247 E253 M327 E330 E331	E247-R251 VanDerWaalsContact CD-NH1 3.31Å; E247-R251 WeakPolarHBondContact O-CB 3.36Å; E247-R251 WeakPolarHBondContact OE1-CD 3.45Å; E247-R251 IonicContact OE1-CZ 2.99Å; E247-R251 IonicContact OE1-NE 3.31Å; E247-R251 IonicContact OE1-NH1 3.84Å; E247-R251 PolarHBondContact OE1-NH1 3.43Å; E247-R251 IonicContact OE2-NH1 3.56Å; E247-R251 PolarHBondContact OE2-NH1 3.16Å; E247-R251 VanDerWaalsContact OE2-NH1 3.15Å; R251-E253 PolarHBondContact O-N 2.87Å; R251-M327 HydrophobicContact CB-SD 4.38Å; R251-E330 IonicContact NH2-OE2 3.88Å; R251-E331 WeakPolarHBondContact CG-OE1 3.48Å
252	G	89.1	Confident	89.4	Confident	45 Å²	45	65.7 Å²	65.7	46%	0.464	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	-5.4	-179.1	0	0	0	0	0	116.7	C250 E331	C250-G252 PolarHBondContact O-N 2.63Å; G252-E331 PolarHBondContact N-OE1 2.85Å
253	E	91.6	Very high	89.4	Confident	105 Å²	105	68.8 Å²	68.8	49%	0.491	34%	0.337	S	S	.	.			trans	-101.9	123	175.4	-67.5	-177.2	-167.9	0	0	110.5	C250 R251 F258 R328	C250-E253 PolarHBondContact O-N 2.7Å; R251-E253 PolarHBondContact O-N 2.87Å; E253-F258 HydrophobicContact CB-CE2 4.32Å; E253-F258 HydrophobicContact CB-CZ 3.8Å; E253-R328 PolarHBondContact O-NH2 3.25Å
254	Y	92.5	Very high	89.2	Confident	29 Å²	29	69.8 Å²	69.8	11%	0.114	34%	0.342	C	S	.	.			trans	-123.5	-12.5	-174	-45.5	-47.7	0	0	0	114.9	E331 I335 A345	Y254-E331 HydrophobicContact CE1-CB 4.17Å; Y254-I335 HydrophobicContact CD1-CD1 4.13Å; Y254-I335 HydrophobicContact CD1-CG1 3.58Å; Y254-I335 HydrophobicContact CD2-CG1 4.34Å; Y254-I335 HydrophobicContact CE1-CD1 4.13Å; Y254-I335 HydrophobicContact CE1-CG1 3.58Å; Y254-I335 HydrophobicContact CE2-CG1 4.36Å; Y254-I335 HydrophobicContact CG-CG1 3.98Å; Y254-A345 PolarHBondContact O-N 3.12Å
255	E	91.4	Very high	89.1	Confident	146 Å²	146	66.6 Å²	66.6	68%	0.682	33%	0.326	S	S	*	.	S	Bend	trans	-81.5	-17.8	-173	-63.5	179.2	-163.5	0	0	113.5	E341 P344	E255-E341 HydrophobicContact CG-CB 4.44Å; E255-P344 WeakPolarHBondContact O-CG 3.3Å
256	S	90.1	Very high	89.1	Confident	49 Å²	49	63 Å²	63	34%	0.343	31%	0.313	S	S	.	.	S	Bend	trans	-114.1	150.6	-179.1	52.1	0	0	0	0	111.3	F258	S256-F258 VanDerWaalsContact OG-CZ 3.25Å; S256-F258 WeakPolarHBondContact OG-CZ 3.39Å
257	S	92.7	Very high	89.1	Confident	54 Å²	54	66.5 Å²	66.5	38%	0.378	33%	0.329	S	S	.	.			trans	-87.7	134.3	168.7	173.1	0	0	0	0	109.1	D348	S257-D348 WeakPolarHBondContact CA-OD2 3.39Å; S257-D348 WeakPolarHBondContact CB-OD1 3.2Å; S257-D348 VanDerWaalsContact OG-CG 3.32Å; S257-D348 PolarHBondContact OG-OD1 2.88Å; S257-D348 PolarHBondContact OG-OD2 3.45Å
258	F	90.8	Very high	89	Confident	13 Å²	13	65 Å²	65	6%	0.057	32%	0.323	C	S	.	.			trans	-103.7	-6.1	-178.9	-63.3	-77	0	0	0	112.7	H249 C250 E253 S256 F260 F262 D348	H249-F258 VanDerWaalsContact O-CE1 3.3Å; H249-F258 WeakPolarHBondContact O-CE1 3.02Å; H249-F258 WeakPolarHBondContact O-CZ 3.28Å; C250-F258 HydrophobicContact CB-CD2 4.36Å; C250-F258 HydrophobicContact CB-CE2 4.42Å; E253-F258 HydrophobicContact CB-CE2 4.32Å; E253-F258 HydrophobicContact CB-CZ 3.8Å; S256-F258 VanDerWaalsContact OG-CZ 3.25Å; S256-F258 WeakPolarHBondContact OG-CZ 3.39Å; F258-F260 PolarHBondContact O-N 3.31Å; F258-F262 HydrophobicContact CB-CD2 3.91Å; F258-F262 HydrophobicContact CB-CE2 4.09Å; F258-F262 WeakPolarHBondContact O-CB 3.44Å; F258-F262 VanDerWaalsContact O-CD2 3.23Å; F258-F262 WeakPolarHBondContact O-CD2 3.47Å; F258-F262 PolarHBondContact O-N 3.29Å; F258-F262 VanDerWaalsContact O-N 3.07Å; F258-D348 PolarHBondContact N-OD2 2.95Å
259	L	88.5	Confident	89	Confident	19 Å²	19	58 Å²	58	10%	0.099	29%	0.29	C	S	.	.	H	α-helix	trans	-62.4	-41.3	-171.9	-71.7	179.5	0	0	0	113.4	Q263 F320 D348 F351	L259-Q263 WeakPolarHBondContact O-CB 3.41Å; L259-Q263 WeakPolarHBondContact O-CG 3.41Å; L259-Q263 PolarHBondContact O-N 3.33Å; L259-F320 HydrophobicContact CD2-CE1 3.76Å; L259-F320 HydrophobicContact CD2-CZ 4.14Å; L259-D348 HydrophobicContact CD1-CB 4.17Å; L259-D348 WeakPolarHBondContact CD1-OD1 3.39Å; L259-D348 HydrophobicContact CG-CB 4.09Å; L259-D348 WeakPolarHBondContact CG-OD1 3.46Å; L259-F351 HydrophobicContact CD1-CB 3.87Å; L259-F351 HydrophobicContact CD1-CD1 3.55Å; L259-F351 HydrophobicContact CD1-CD2 4.49Å; L259-F351 HydrophobicContact CD1-CE1 4.2Å; L259-F351 HydrophobicContact CD1-CG 3.73Å; L259-F351 HydrophobicContact CD2-CD1 4.05Å; L259-F351 HydrophobicContact CD2-CE1 4.39Å; L259-F351 HydrophobicContact CG-CD1 4.47Å
260	F	87.8	Confident	89	Confident	121 Å²	121	54.8 Å²	54.8	53%	0.531	28%	0.276	S	S	.	.	H	α-helix	trans	-70.6	-51.1	-177.6	-176.2	-97.8	0	0	0	111.3	F258 F262 Q263 E264	F258-F260 PolarHBondContact O-N 3.31Å; F260-F262 VanDerWaalsContact C-N 3.25Å; F260-F262 PolarHBondContact O-N 3.01Å; F260-Q263 WeakPolarHBondContact O-CA 3.48Å; F260-Q263 WeakPolarHBondContact O-CB 3.31Å; F260-Q263 PolarHBondContact O-N 3.15Å; F260-E264 HydrophobicContact CD1-CG 4.4Å; F260-E264 HydrophobicContact CE1-CG 3.92Å; F260-E264 WeakPolarHBondContact CE1-OE1 3.32Å; F260-E264 HydrophobicContact CZ-CG 4.02Å; F260-E264 WeakPolarHBondContact CZ-OE1 3.35Å; F260-E264 PolarHBondContact O-N 2.99Å
261	D	87.2	Confident	89	Confident	88 Å²	88	56 Å²	56	47%	0.471	29%	0.288	S	S	.	.	H	α-helix	trans	-58.1	-38.9	179.4	-58.6	-6.9	0	0	0	111.9	W265	D261-W265 VanDerWaalsContact O-CB 3.31Å; D261-W265 WeakPolarHBondContact O-CB 3.43Å; D261-W265 PolarHBondContact O-N 3.17Å
262	F	87.9	Confident	89	Confident	5 Å²	5	50.5 Å²	50.5	2%	0.022	27%	0.268	C	S	.	.	H	α-helix	trans	-70.5	-36.9	174.1	-87.8	-97.3	0	0	0	112.5	R245 M246 C250 F258 F260 W265 L266 F320	R245-F262 HydrophobicContact CB-CE1 4.46Å; R245-F262 HydrophobicContact CG-CE1 4.14Å; R245-F262 HydrophobicContact CG-CZ 4.05Å; M246-F262 HydrophobicContact CB-CZ 4.4Å; C250-F262 WeakPolarHBondContact SG-CE2 3.48Å; C250-F262 VanDerWaalsContact SG-CZ 3.55Å; F258-F262 HydrophobicContact CB-CD2 3.91Å; F258-F262 HydrophobicContact CB-CE2 4.09Å; F258-F262 WeakPolarHBondContact O-CB 3.44Å; F258-F262 VanDerWaalsContact O-CD2 3.23Å; F258-F262 WeakPolarHBondContact O-CD2 3.47Å; F258-F262 PolarHBondContact O-N 3.29Å; F258-F262 VanDerWaalsContact O-N 3.07Å; F260-F262 VanDerWaalsContact C-N 3.25Å; F260-F262 PolarHBondContact O-N 3.01Å; F262-W265 HydrophobicContact CD1-CE3 4.37Å; F262-W265 PolarHBondContact O-N 2.68Å; F262-L266 WeakPolarHBondContact O-CB 3.45Å; F262-L266 WeakPolarHBondContact O-CG 3.32Å; F262-L266 PolarHBondContact O-N 3.04Å; F262-F320 HydrophobicContact CB-CD2 4.47Å; F262-F320 HydrophobicContact CB-CE2 3.87Å; F262-F320 HydrophobicContact CB-CZ 3.96Å; F262-F320 AromaticContact CD1-CD2 3.7Å; F262-F320 HydrophobicContact CD1-CD2 3.7Å; F262-F320 AromaticContact CD1-CE2 3.39Å; F262-F320 HydrophobicContact CD1-CE2 3.39Å; F262-F320 HydrophobicContact CD1-CZ 4.31Å; F262-F320 HydrophobicContact CD2-CE2 4.16Å; F262-F320 HydrophobicContact CE1-CD2 4.22Å; F262-F320 AromaticContact CE1-CE2 3.9Å; F262-F320 HydrophobicContact CE1-CE2 3.9Å; F262-F320 HydrophobicContact CG-CD2 4.21Å; F262-F320 AromaticContact CG-CE2 3.52Å; F262-F320 HydrophobicContact CG-CE2 3.52Å; F262-F320 HydrophobicContact CG-CZ 4.01Å; F262-F320 HydrophobicContact CZ-CE2 4.46Å
263	Q	87.1	Confident	88.9	Confident	68 Å²	68	48.3 Å²	48.3	32%	0.318	25%	0.246	S	C	.	.	H	α-helix	trans	-61.2	-47.4	175.6	-78.6	171.2	25.4	0	0	111.3	L259 F260 W265 L266 E267	L259-Q263 WeakPolarHBondContact O-CB 3.41Å; L259-Q263 WeakPolarHBondContact O-CG 3.41Å; L259-Q263 PolarHBondContact O-N 3.33Å; F260-Q263 WeakPolarHBondContact O-CA 3.48Å; F260-Q263 WeakPolarHBondContact O-CB 3.31Å; F260-Q263 PolarHBondContact O-N 3.15Å; Q263-W265 PolarHBondContact O-N 3.38Å; Q263-L266 PolarHBondContact O-N 3.23Å; Q263-E267 PolarHBondContact O-N 3.32Å; Q263-E267 VanDerWaalsContact O-N 3.14Å
264	E	87.8	Confident	88.7	Confident	109 Å²	109	45.7 Å²	45.7	51%	0.509	24%	0.238	S	C	.	.	H	α-helix	trans	-61.6	-44.7	176.4	-67.5	-165.1	149.4	0	0	111.8	F260 L266 E267 L268	F260-E264 HydrophobicContact CD1-CG 4.4Å; F260-E264 HydrophobicContact CE1-CG 3.92Å; F260-E264 WeakPolarHBondContact CE1-OE1 3.32Å; F260-E264 HydrophobicContact CZ-CG 4.02Å; F260-E264 WeakPolarHBondContact CZ-OE1 3.35Å; F260-E264 PolarHBondContact O-N 2.99Å; E264-L266 VanDerWaalsContact C-N 3.33Å; E264-L266 PolarHBondContact O-N 3.45Å; E264-E267 WeakPolarHBondContact O-CB 3.4Å; E264-E267 PolarHBondContact O-N 3.34Å; E264-E267 VanDerWaalsContact O-N 3.1Å; E264-L268 PolarHBondContact O-N 3.28Å
265	W	89.4	Confident	88.4	Confident	23 Å²	23	47.8 Å²	47.8	9%	0.087	25%	0.246	C	C	.	.	H	α-helix	trans	-62.3	-39.2	176.4	178.6	82	0	0	0	112.6	M173 L241 I242 D261 F262 Q263 E267 L268 V269	M173-W265 VanDerWaalsContact CE-NE1 3.28Å; L241-W265 HydrophobicContact CB-CH2 4.44Å; I242-W265 HydrophobicContact CG1-CH2 4.12Å; I242-W265 HydrophobicContact CG1-CZ3 3.9Å; D261-W265 VanDerWaalsContact O-CB 3.31Å; D261-W265 WeakPolarHBondContact O-CB 3.43Å; D261-W265 PolarHBondContact O-N 3.17Å; F262-W265 HydrophobicContact CD1-CE3 4.37Å; F262-W265 PolarHBondContact O-N 2.68Å; Q263-W265 PolarHBondContact O-N 3.38Å; W265-E267 VanDerWaalsContact C-N 3.25Å; W265-E267 PolarHBondContact O-N 2.81Å; W265-L268 WeakPolarHBondContact O-CB 3.27Å; W265-L268 PolarHBondContact O-N 2.95Å; W265-L268 VanDerWaalsContact O-N 3.15Å; W265-V269 HydrophobicContact CD2-CG2 4.17Å; W265-V269 HydrophobicContact CE3-CG2 4.26Å; W265-V269 HydrophobicContact CH2-CG2 3.93Å; W265-V269 HydrophobicContact CZ2-CG2 3.82Å; W265-V269 HydrophobicContact CZ3-CG2 4.15Å; W265-V269 WeakPolarHBondContact O-CG2 3.47Å; W265-V269 PolarHBondContact O-N 2.84Å
266	L	87.6	Confident	88.2	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-64.8	-28.3	175.8	-70.6	172.2	0	0	0	111.8	I242 F262 Q263 E264 V269 L270 M316 F320	I242-L266 HydrophobicContact CD1-CD2 4.24Å; I242-L266 HydrophobicContact CG1-CD2 4.37Å; F262-L266 WeakPolarHBondContact O-CB 3.45Å; F262-L266 WeakPolarHBondContact O-CG 3.32Å; F262-L266 PolarHBondContact O-N 3.04Å; Q263-L266 PolarHBondContact O-N 3.23Å; E264-L266 VanDerWaalsContact C-N 3.33Å; E264-L266 PolarHBondContact O-N 3.45Å; L266-V269 PolarHBondContact O-N 2.77Å; L266-L270 VanDerWaalsContact O-CG 3.3Å; L266-L270 WeakPolarHBondContact O-CG 3.44Å; L266-L270 PolarHBondContact O-N 3.25Å; L266-M316 HydrophobicContact CB-CE 4.12Å; L266-M316 HydrophobicContact CD2-CB 4.26Å; L266-M316 HydrophobicContact CD2-CE 3.44Å; L266-M316 VanDerWaalsContact CD2-CE 3.44Å; L266-M316 HydrophobicContact CG-CE 4.35Å; L266-F320 HydrophobicContact CD1-CB 4.48Å
267	E	87.4	Confident	87.9	Confident	82 Å²	82	39.9 Å²	39.9	38%	0.383	20%	0.203	S	C	.	.	H	α-helix	trans	-64.9	-40.6	171.3	-60.2	-60.3	169.7	0	0	112.2	Q263 E264 W265 V269 L270 G271 R313	Q263-E267 PolarHBondContact O-N 3.32Å; Q263-E267 VanDerWaalsContact O-N 3.14Å; E264-E267 WeakPolarHBondContact O-CB 3.4Å; E264-E267 PolarHBondContact O-N 3.34Å; E264-E267 VanDerWaalsContact O-N 3.1Å; W265-E267 VanDerWaalsContact C-N 3.25Å; W265-E267 PolarHBondContact O-N 2.81Å; E267-V269 VanDerWaalsContact C-N 3.28Å; E267-V269 PolarHBondContact O-N 3.23Å; E267-L270 CarbonylContact O-C 3.58Å; E267-L270 WeakPolarHBondContact O-CB 3.28Å; E267-L270 PolarHBondContact O-N 3.21Å; E267-L270 VanDerWaalsContact O-N 3.15Å; E267-G271 PolarHBondContact O-N 3.49Å; E267-R313 IonicContact OE1-CZ 3.53Å; E267-R313 IonicContact OE1-NH1 2.68Å; E267-R313 PolarHBondContact OE1-NH1 2.99Å; E267-R313 IonicContact OE1-NH2 3.12Å; E267-R313 PolarHBondContact OE1-NH2 3.37Å; E267-R313 IonicContact OE2-CZ 3.51Å; E267-R313 IonicContact OE2-NH1 2.71Å; E267-R313 PolarHBondContact OE2-NH1 3.06Å
268	L	87.9	Confident	87.2	Confident	59 Å²	59	39.7 Å²	39.7	31%	0.309	21%	0.205	S	C	.	.	H	α-helix	trans	-61.9	-40.7	176.3	-61.1	177.6	0	0	0	111	H172 M173 E176 E264 W265 G271 W272	H172-L268 PolarHBondContact CE1-O 3.39Å; M173-L268 HydrophobicContact CE-CB 4.14Å; M173-L268 HydrophobicContact CE-CD1 4.49Å; M173-L268 HydrophobicContact SD-CB 4.34Å; E176-L268 HydrophobicContact CB-CD2 4.28Å; E264-L268 PolarHBondContact O-N 3.28Å; W265-L268 WeakPolarHBondContact O-CB 3.27Å; W265-L268 PolarHBondContact O-N 2.95Å; W265-L268 VanDerWaalsContact O-N 3.15Å; L268-G271 WeakPolarHBondContact O-CA 3.33Å; L268-G271 PolarHBondContact O-N 2.71Å; L268-G271 VanDerWaalsContact O-N 3.17Å; L268-W272 PolarHBondContact O-N 3.38Å; L268-W272 VanDerWaalsContact O-N 3.17Å
269	V	88.7	Confident	85.9	Confident	1 Å²	1	42 Å²	42	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-65.7	-39.2	175	177.4	0	0	0	0	111.3	F169 M173 L238 W265 L266 E267 G271 W272 L273 M316	F169-V269 HydrophobicContact CE2-CB 4.45Å; F169-V269 HydrophobicContact CE2-CG1 4.06Å; F169-V269 HydrophobicContact CE2-CG2 4.06Å; F169-V269 HydrophobicContact CZ-CG2 4.07Å; M173-V269 HydrophobicContact CE-CG2 4.24Å; M173-V269 HydrophobicContact SD-CG2 4.15Å; L238-V269 HydrophobicContact CD2-CG1 3.17Å; W265-V269 HydrophobicContact CD2-CG2 4.17Å; W265-V269 HydrophobicContact CE3-CG2 4.26Å; W265-V269 HydrophobicContact CH2-CG2 3.93Å; W265-V269 HydrophobicContact CZ2-CG2 3.82Å; W265-V269 HydrophobicContact CZ3-CG2 4.15Å; W265-V269 WeakPolarHBondContact O-CG2 3.47Å; W265-V269 PolarHBondContact O-N 2.84Å; L266-V269 PolarHBondContact O-N 2.77Å; E267-V269 VanDerWaalsContact C-N 3.28Å; E267-V269 PolarHBondContact O-N 3.23Å; V269-G271 VanDerWaalsContact C-N 3.27Å; V269-G271 PolarHBondContact O-N 3.5Å; V269-W272 PolarHBondContact O-N 2.49Å; V269-L273 WeakPolarHBondContact O-CG 3.43Å; V269-L273 PolarHBondContact O-N 3.49Å; V269-M316 HydrophobicContact CB-CE 3.67Å; V269-M316 HydrophobicContact CG1-CE 3.35Å; V269-M316 HydrophobicContact CG1-SD 4.2Å
270	L	86.7	Confident	84.1	Confident	18 Å²	18	47.5 Å²	47.5	9%	0.094	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-34.4	171.8	-73.8	167.4	0	0	0	112.1	L266 E267 W272 L273 S274 W312 R313 M316	L266-L270 VanDerWaalsContact O-CG 3.3Å; L266-L270 WeakPolarHBondContact O-CG 3.44Å; L266-L270 PolarHBondContact O-N 3.25Å; E267-L270 CarbonylContact O-C 3.58Å; E267-L270 WeakPolarHBondContact O-CB 3.28Å; E267-L270 PolarHBondContact O-N 3.21Å; E267-L270 VanDerWaalsContact O-N 3.15Å; L270-W272 PolarHBondContact O-N 3.48Å; L270-L273 HydrophobicContact CD2-CD1 4.02Å; L270-L273 PolarHBondContact O-N 3.04Å; L270-S274 PolarHBondContact O-N 2.93Å; L270-W312 HydrophobicContact CD2-CB 4.26Å; L270-R313 HydrophobicContact CD1-CB 3.79Å; L270-R313 HydrophobicContact CD1-CG 3.83Å; L270-R313 HydrophobicContact CD2-CB 4.03Å; L270-M316 HydrophobicContact CD2-SD 3.95Å; L270-M316 HydrophobicContact CG-CE 4.31Å; L270-M316 HydrophobicContact CG-SD 4.3Å
271	G	86.8	Confident	81.9	Confident	25 Å²	25	47.6 Å²	47.6	26%	0.258	26%	0.263	S	S	.	.	H	α-helix	trans	-55.2	-48	170.1	0	0	0	0	0	111.9	E267 L268 V269 S274 R275	E267-G271 PolarHBondContact O-N 3.49Å; L268-G271 WeakPolarHBondContact O-CA 3.33Å; L268-G271 PolarHBondContact O-N 2.71Å; L268-G271 VanDerWaalsContact O-N 3.17Å; V269-G271 VanDerWaalsContact C-N 3.27Å; V269-G271 PolarHBondContact O-N 3.5Å; G271-S274 WeakPolarHBondContact O-CB 3.27Å; G271-S274 PolarHBondContact O-N 3.36Å; G271-S274 PolarHBondContact O-OG 3Å; G271-R275 PolarHBondContact O-N 3.05Å
272	W	89.7	Confident	79.4	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-43.8	174.9	176.2	78.4	0	0	0	112.3	Y165 F169 H172 V234 L268 V269 L270 S274 R275 V276	Y165-W272 HydrophobicContact CD1-CZ2 4.06Å; Y165-W272 HydrophobicContact CG-CZ2 4.36Å; F169-W272 HydrophobicContact CB-CD2 4.21Å; F169-W272 HydrophobicContact CB-CH2 4.32Å; F169-W272 HydrophobicContact CB-CZ2 3.81Å; F169-W272 HydrophobicContact CD2-CB 4.31Å; F169-W272 AromaticContact CD2-CD2 3.6Å; F169-W272 HydrophobicContact CD2-CD2 3.6Å; F169-W272 AromaticContact CD2-CE3 3.66Å; F169-W272 HydrophobicContact CD2-CE3 3.66Å; F169-W272 AromaticContact CD2-CG 3.89Å; F169-W272 HydrophobicContact CD2-CG 3.89Å; F169-W272 HydrophobicContact CD2-CZ2 4.49Å; F169-W272 HydrophobicContact CD2-CZ3 4.12Å; F169-W272 HydrophobicContact CE2-CE3 4.37Å; F169-W272 HydrophobicContact CG-CD2 4.4Å; H172-W272 HydrophobicContact CB-CB 4.34Å; H172-W272 HydrophobicContact CB-CG 4.31Å; H172-W272 AromaticContact CD2-CD1 3.98Å; H172-W272 PolarHBondContact CE1-N 3.19Å; H172-W272 AromaticContact CG-CD1 3.84Å; H172-W272 WeakPolarHBondContact NE2-CA 3.36Å; H172-W272 PolarHBondContact NE2-N 3.29Å; V234-W272 HydrophobicContact CG1-CZ3 4.11Å; V234-W272 HydrophobicContact CG2-CH2 3.96Å; V234-W272 HydrophobicContact CG2-CZ3 4.25Å; L268-W272 PolarHBondContact O-N 3.38Å; L268-W272 VanDerWaalsContact O-N 3.17Å; V269-W272 PolarHBondContact O-N 2.49Å; L270-W272 PolarHBondContact O-N 3.48Å; W272-S274 PolarHBondContact O-N 2.93Å; W272-R275 WeakPolarHBondContact O-CA 3.49Å; W272-R275 WeakPolarHBondContact O-CB 3.41Å; W272-R275 PolarHBondContact O-N 3.33Å; W272-V276 HydrophobicContact CD2-CG2 3.79Å; W272-V276 VanDerWaalsContact CE2-CG2 3.47Å; W272-V276 HydrophobicContact CE3-CG2 4.1Å; W272-V276 HydrophobicContact CG-CG2 4.48Å; W272-V276 HydrophobicContact CH2-CG2 3.9Å; W272-V276 HydrophobicContact CZ2-CG2 3.54Å; W272-V276 HydrophobicContact CZ3-CG2 4.16Å; W272-V276 PolarHBondContact O-N 2.92Å
273	L	88.5	Confident	76.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-59.7	-35.5	177.5	-70	171.1	0	0	0	112.4	V234 L238 V269 L270 R275 V276 F277 L309 W312 M316	V234-L273 HydrophobicContact CG1-CD2 3.3Å; L238-L273 HydrophobicContact CD1-CD1 4.09Å; L238-L273 HydrophobicContact CD1-CD2 4.18Å; L238-L273 HydrophobicContact CD2-CD1 4.38Å; V269-L273 WeakPolarHBondContact O-CG 3.43Å; V269-L273 PolarHBondContact O-N 3.49Å; L270-L273 HydrophobicContact CD2-CD1 4.02Å; L270-L273 PolarHBondContact O-N 3.04Å; L273-R275 VanDerWaalsContact C-N 3.26Å; L273-R275 PolarHBondContact O-N 2.95Å; L273-V276 PolarHBondContact O-N 2.89Å; L273-F277 HydrophobicContact CD2-CD2 4.48Å; L273-F277 HydrophobicContact CD2-CE2 4.1Å; L273-F277 WeakPolarHBondContact O-CD2 3.28Å; L273-F277 PolarHBondContact O-N 3.27Å; L273-L309 HydrophobicContact CB-CD2 4.43Å; L273-W312 HydrophobicContact CD1-CB 4.08Å; L273-W312 HydrophobicContact CD1-CG 4.34Å; L273-M316 HydrophobicContact CD1-SD 3.45Å; L273-M316 WeakPolarHBondContact CD1-SD 3.45Å
274	S	86.9	Confident	73.7	Confident	49 Å²	49	52.6 Å²	52.6	34%	0.343	33%	0.328	S	S	.	.	H	α-helix	trans	-62.2	-34	174.3	81.8	0	0	0	0	112.5	L270 G271 W272 A278	L270-S274 PolarHBondContact O-N 2.93Å; G271-S274 WeakPolarHBondContact O-CB 3.27Å; G271-S274 PolarHBondContact O-N 3.36Å; G271-S274 PolarHBondContact O-OG 3Å; W272-S274 PolarHBondContact O-N 2.93Å; S274-A278 WeakPolarHBondContact O-CA 3.48Å; S274-A278 WeakPolarHBondContact O-CB 3.23Å; S274-A278 PolarHBondContact O-N 2.92Å
275	R	86.1	Confident	71.1	Confident	73 Å²	73	53.6 Å²	53.6	28%	0.275	35%	0.347	S	S	.	.	H	α-helix	trans	-74.2	-38.8	175	-59.6	-174.7	-169.6	170.1	8.6	111.6	H172 E176 G271 W272 L273 A278	H172-R275 PolarHBondContact CD2-NH1 2.83Å; H172-R275 VanDerWaalsContact NE2-CZ 3.26Å; H172-R275 PolarHBondContact NE2-NE 3.15Å; H172-R275 PolarHBondContact NE2-NH2 3.1Å; E176-R275 IonicContact OE1-CZ 3.97Å; E176-R275 IonicContact OE1-NH2 2.8Å; E176-R275 PolarHBondContact OE1-NH2 3.41Å; G271-R275 PolarHBondContact O-N 3.05Å; W272-R275 WeakPolarHBondContact O-CA 3.49Å; W272-R275 WeakPolarHBondContact O-CB 3.41Å; W272-R275 PolarHBondContact O-N 3.33Å; L273-R275 VanDerWaalsContact C-N 3.26Å; L273-R275 PolarHBondContact O-N 2.95Å; R275-A278 WeakPolarHBondContact O-CB 3.41Å
276	V	87	Confident	68.1	Low	0 Å²	0	55.7 Å²	55.7	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-65.9	-45.1	177.3	177.9	0	0	0	0	111.3	Y165 L213 S217 V234 W272 L273	Y165-V276 HydrophobicContact CD1-CG2 4.46Å; Y165-V276 HydrophobicContact CE1-CG1 3.89Å; Y165-V276 HydrophobicContact CE1-CG2 4.37Å; L213-V276 HydrophobicContact CD1-CG2 4.27Å; L213-V276 HydrophobicContact CD2-CG2 4.38Å; S217-V276 WeakPolarHBondContact CB-O 3.08Å; S217-V276 PolarHBondContact OG-O 3.4Å; V234-V276 HydrophobicContact CG2-CG1 4.17Å; W272-V276 HydrophobicContact CD2-CG2 3.79Å; W272-V276 VanDerWaalsContact CE2-CG2 3.47Å; W272-V276 HydrophobicContact CE3-CG2 4.1Å; W272-V276 HydrophobicContact CG-CG2 4.48Å; W272-V276 HydrophobicContact CH2-CG2 3.9Å; W272-V276 HydrophobicContact CZ2-CG2 3.54Å; W272-V276 HydrophobicContact CZ3-CG2 4.16Å; W272-V276 PolarHBondContact O-N 2.92Å; L273-V276 PolarHBondContact O-N 2.89Å
277	F	84.2	Confident	65.3	Low	29 Å²	29	63.5 Å²	63.5	13%	0.127	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	16.1	-178.7	-65.6	-73.6	0	0	0	113.7	L226 S230 V234 L273 S279 W312	L226-F277 HydrophobicContact CD2-CD1 4.23Å; L226-F277 HydrophobicContact CG-CD1 4.14Å; L226-F277 HydrophobicContact CG-CE1 4.46Å; S230-F277 VanDerWaalsContact OG-CE1 3.24Å; S230-F277 WeakPolarHBondContact OG-CE1 3.36Å; S230-F277 WeakPolarHBondContact OG-CZ 3.45Å; V234-F277 HydrophobicContact CG1-CE2 4.41Å; L273-F277 HydrophobicContact CD2-CD2 4.48Å; L273-F277 HydrophobicContact CD2-CE2 4.1Å; L273-F277 WeakPolarHBondContact O-CD2 3.28Å; L273-F277 PolarHBondContact O-N 3.27Å; F277-S279 PolarHBondContact O-N 3.2Å; F277-S279 VanDerWaalsContact O-N 3.12Å; F277-W312 AromaticContact CE2-CE2 3.85Å; F277-W312 HydrophobicContact CE2-CZ2 4.05Å; F277-W312 AromaticContact CE2-NE1 3.49Å; F277-W312 AromaticContact CZ-CZ2 3.93Å; F277-W312 HydrophobicContact CZ-CZ2 3.93Å; F277-W312 AromaticContact CZ-NE1 3.81Å
278	A	76.9	Confident	62.5	Low	50 Å²	50	63.2 Å²	63.2	41%	0.413	44%	0.436	S	S	.	.			trans	-60.9	115.7	174.4	0	0	0	0	0	109.7	S274 R275	S274-A278 WeakPolarHBondContact O-CA 3.48Å; S274-A278 WeakPolarHBondContact O-CB 3.23Å; S274-A278 PolarHBondContact O-N 2.92Å; R275-A278 WeakPolarHBondContact O-CB 3.41Å
279	S	63.3	Low	59.6	Low	62 Å²	62	66.5 Å²	66.5	43%	0.434	46%	0.458	S	S	.	.			trans	-113.2	125.3	178	-174.2	0	0	0	0	109.5	S221 F277 V281	S221-S279 PolarHBondContact OG-OG 3Å; S221-S279 VanDerWaalsContact OG-OG 3.12Å; F277-S279 PolarHBondContact O-N 3.2Å; F277-S279 VanDerWaalsContact O-N 3.12Å; S279-V281 PolarHBondContact O-N 3.39Å; S279-V281 VanDerWaalsContact OG-CG2 3.29Å; S279-V281 WeakPolarHBondContact OG-CG2 3.19Å
280	D	50.5	Low	57.2	Low	135 Å²	135	73 Å²	73	72%	0.722	50%	0.497	S	S	*	.			trans	-76.8	52.1	175.1	-159.3	16.3	0	0	0	111.3
281	V	43.2	Very low	54.4	Low	123 Å²	123	77.9 Å²	77.9	75%	0.745	53%	0.53	S	S	*	.			trans	-105.8	71.1	173.7	-178.2	0	0	0	0	106.8	S279	S279-V281 PolarHBondContact O-N 3.39Å; S279-V281 VanDerWaalsContact OG-CG2 3.29Å; S279-V281 WeakPolarHBondContact OG-CG2 3.19Å
282	G	33.2	Very low	52	Low	62 Å²	62	84.8 Å²	84.8	64%	0.639	56%	0.561	S	S	*	*			trans	175.8	41.7	-177.9	0	0	0	0	0	114.7	V284	G282-V284 VanDerWaalsContact C-N 3.3Å; G282-V284 PolarHBondContact O-N 2.86Å
283	G	28.8	Very low	49.1	Very low	72 Å²	72	88.2 Å²	88.2	74%	0.742	60%	0.597	S	S	*	*			trans	-68.5	84.4	170	0	0	0	0	0	112
284	V	27.8	Very low	46.6	Very low	131 Å²	131	95.4 Å²	95.4	79%	0.794	64%	0.641	S	S	*	*			trans	-146.8	102.6	135.8	-179.2	0	0	0	0	107.2	G282 G286	G282-V284 VanDerWaalsContact C-N 3.3Å; G282-V284 PolarHBondContact O-N 2.86Å; V284-G286 PolarHBondContact O-N 2.84Å; V284-G286 VanDerWaalsContact O-N 3.14Å
285	S	33.1	Very low	43.7	Very low	131 Å²	131	96.8 Å²	96.8	92%	0.916	66%	0.663	S	S	*	*			trans	-59.5	110.1	159.2	-54.7	0	0	0	0	108.9
286	G	25.8	Very low	41.3	Very low	67 Å²	67	99.9 Å²	99.9	69%	0.691	70%	0.695	S	S	*	*			trans	-119.1	109	168.9	0	0	0	0	0	108.8	V284	V284-G286 PolarHBondContact O-N 2.84Å; V284-G286 VanDerWaalsContact O-N 3.14Å
287	L	29.7	Very low	38.4	Very low	165 Å²	165	103.4 Å²	103.4	86%	0.864	73%	0.732	S	S	*	*			trans	-38.1	132.4	178.7	-149.2	73.1	0	0	0	113.4	T289	L287-T289 PolarHBondContact O-N 3.06Å; L287-T289 VanDerWaalsContact O-N 3.15Å
288	G	28.2	Very low	36.2	Very low	75 Å²	75	107.5 Å²	107.5	77%	0.773	77%	0.771	S	S	*	*			trans	-58	116.3	172.3	0	0	0	0	0	111.7
289	T	26.5	Very low	33.8	Very low	128 Å²	128	108.3 Å²	108.3	79%	0.785	79%	0.785	S	S	*	*			trans	-139.8	119.2	151.7	16.8	0	0	0	0	107.5	L287	L287-T289 PolarHBondContact O-N 3.06Å; L287-T289 VanDerWaalsContact O-N 3.15Å
290	V	37.8	Very low	32.5	Very low	137 Å²	137	112.2 Å²	112.2	83%	0.83	81%	0.806	S	S	*	*			trans	-59.5	142.8	172.3	-175.8	0	0	0	0	109.2
291	P	29.2	Very low	31.9	Very low	121 Å²	121	112.8 Å²	112.8	79%	0.786	81%	0.814	S	S	*	*			trans	-131.4	131.3	130.5	24.4	-7.2	0	0	0	112.4
292	N	36.6	Very low	31.4	Very low	170 Å²	170	109.5 Å²	109.5	91%	0.909	81%	0.805	S	S	*	*			trans	-54.4	139.8	165	-132.4	1.8	0	0	0	110.6
293	G	27.1	Very low	31.9	Very low	72 Å²	72	113.1 Å²	113.1	74%	0.742	81%	0.805	S	S	*	*			trans	173.9	95.5	173	0	0	0	0	0	114.2
294	T	36.7	Very low	32.8	Very low	152 Å²	152	114.8 Å²	114.8	93%	0.933	80%	0.803	S	S	*	*			trans	-52.5	133.9	167.8	45.2	0	0	0	0	113.4
295	G	26.7	Very low	33.9	Very low	77 Å²	77	111.3 Å²	111.3	79%	0.794	79%	0.787	S	S	*	*			trans	168.6	109.2	165.4	0	0	0	0	0	114.1
296	S	35.8	Very low	35.5	Very low	138 Å²	138	109.7 Å²	109.7	97%	0.965	77%	0.769	S	S	*	*			trans	-56.9	135.3	173.1	-56.2	0	0	0	0	113.1
297	G	26	Very low	37.9	Very low	74 Å²	74	109.7 Å²	109.7	76%	0.763	76%	0.762	S	S	*	*			trans	-176.3	108.6	169.6	0	0	0	0	0	111.7	G299	G297-G299 PolarHBondContact O-N 3.33Å
298	A	36.5	Very low	40.3	Very low	116 Å²	116	104.1 Å²	104.1	96%	0.959	74%	0.735	S	S	*	*			trans	-59.5	129.8	175.5	0	0	0	0	0	111.8
299	G	26.8	Very low	42.8	Very low	67 Å²	67	102.7 Å²	102.7	69%	0.691	71%	0.709	S	S	*	*			trans	178	69	178.2	0	0	0	0	0	110.6	G297 V301	G297-G299 PolarHBondContact O-N 3.33Å; G299-V301 PolarHBondContact O-N 3.46Å; G299-V301 VanDerWaalsContact O-N 3.08Å
300	V	37.5	Very low	45.6	Very low	144 Å²	144	101.7 Å²	101.7	87%	0.873	70%	0.696	S	S	*	*			trans	-70.3	100.4	177.4	178.9	0	0	0	0	109.3
301	V	36	Very low	47.9	Very low	147 Å²	147	104.8 Å²	104.8	89%	0.891	69%	0.692	S	S	*	*			trans	-116.5	74.4	150.4	-175.7	0	0	0	0	106.3	G299	G299-V301 PolarHBondContact O-N 3.46Å; G299-V301 VanDerWaalsContact O-N 3.08Å
302	G	34.1	Very low	50.7	Low	54 Å²	54	100.4 Å²	100.4	56%	0.557	66%	0.66	S	S	*	*			trans	-77.8	130.4	173.9	0	0	0	0	0	110.3
303	Q	43.5	Very low	53.2	Low	137 Å²	137	95.4 Å²	95.4	64%	0.64	63%	0.629	S	S	*	*			trans	-47.8	150.4	173.8	-65.8	166.4	-26.9	0	0	113.2	A305 N306	Q303-A305 VanDerWaalsContact C-N 3.28Å; Q303-A305 PolarHBondContact O-N 3.39Å; Q303-N306 PolarHBondContact O-N 3.19Å
304	P	48.4	Very low	56.2	Low	108 Å²	108	95.1 Å²	95.1	70%	0.701	61%	0.614	S	S	*	*	H	α-helix	trans	-63.4	-26.8	-178.4	23.8	-33	0	0	0	114.4	N306 A307	P304-N306 PolarHBondContact O-N 3.15Å; P304-A307 PolarHBondContact O-N 3.26Å
305	A	50.3	Low	58.7	Low	57 Å²	57	91.1 Å²	91.1	47%	0.471	59%	0.585	S	S	.	*	H	α-helix	trans	-65.5	-34.3	178.6	0	0	0	0	0	113.1	Q303 A307 L309	Q303-A305 VanDerWaalsContact C-N 3.28Å; Q303-A305 PolarHBondContact O-N 3.39Å; A305-A307 PolarHBondContact O-N 3.18Å; A305-L309 PolarHBondContact O-N 2.82Å
306	N	65.6	Low	61.8	Low	98 Å²	98	87.6 Å²	87.6	52%	0.524	55%	0.548	S	S	.	.	H	α-helix	trans	-71.6	-28.4	177.8	-83	-21.1	0	0	0	112.8	Q303 P304 Q310	Q303-N306 PolarHBondContact O-N 3.19Å; P304-N306 PolarHBondContact O-N 3.15Å; N306-Q310 VanDerWaalsContact O-CB 3.31Å; N306-Q310 WeakPolarHBondContact O-CB 3.26Å; N306-Q310 PolarHBondContact O-N 2.96Å
307	A	77.3	Confident	64.3	Low	67 Å²	67	83 Å²	83	55%	0.554	51%	0.511	S	S	*	.	H	α-helix	trans	-72.5	-38.1	-179.9	0	0	0	0	0	112.6	P304 A305 R311	P304-A307 PolarHBondContact O-N 3.26Å; A305-A307 PolarHBondContact O-N 3.18Å; A307-R311 PolarHBondContact O-N 3.48Å
308	V	78.9	Confident	67.5	Low	48 Å²	48	85.8 Å²	85.8	29%	0.291	50%	0.504	S	S	.	.	H	α-helix	trans	-68.2	-45	177.8	177.1	0	0	0	0	110.7	Q310 R311 W312	V308-Q310 VanDerWaalsContact C-N 3.35Å; V308-Q310 PolarHBondContact O-N 2.9Å; V308-R311 WeakPolarHBondContact O-CB 3.48Å; V308-R311 PolarHBondContact O-N 3.13Å; V308-W312 VanDerWaalsContact O-CD1 3.25Å; V308-W312 PolarHBondContact O-N 3.08Å
309	L	81.5	Confident	70.1	Confident	44 Å²	44	80.7 Å²	80.7	23%	0.23	46%	0.46	C	S	.	.	H	α-helix	trans	-63.3	-40.6	176.2	-67.6	174.8	0	0	0	112	L273 A305 R311 W312 R313	L273-L309 HydrophobicContact CB-CD2 4.43Å; A305-L309 PolarHBondContact O-N 2.82Å; L309-R311 VanDerWaalsContact C-N 3.3Å; L309-R311 PolarHBondContact O-N 3.26Å; L309-W312 PolarHBondContact O-N 3.3Å; L309-R313 WeakPolarHBondContact O-CB 3.33Å; L309-R313 PolarHBondContact O-N 3.46Å
310	Q	84.9	Confident	73.2	Confident	108 Å²	108	77.8 Å²	77.8	51%	0.505	43%	0.429	S	S	.	.	H	α-helix	trans	-63.8	-36.7	174.8	-168.1	65.5	5.7	0	0	112.2	N306 V308 R313 C314	N306-Q310 VanDerWaalsContact O-CB 3.31Å; N306-Q310 WeakPolarHBondContact O-CB 3.26Å; N306-Q310 PolarHBondContact O-N 2.96Å; V308-Q310 VanDerWaalsContact C-N 3.35Å; V308-Q310 PolarHBondContact O-N 2.9Å; Q310-R313 WeakPolarHBondContact O-CB 3.35Å; Q310-R313 PolarHBondContact O-N 2.97Å; Q310-C314 PolarHBondContact O-N 3.04Å; Q310-C314 PolarHBondContact O-SG 3.37Å
311	R	87.3	Confident	75.8	Confident	202 Å²	202	71.2 Å²	71.2	76%	0.762	39%	0.389	S	S	*	.	H	α-helix	trans	-64.2	-42.7	174.5	-174.6	177.1	-178.2	158.7	1	111.6	A307 V308 L309 C314 H315	A307-R311 PolarHBondContact O-N 3.48Å; V308-R311 WeakPolarHBondContact O-CB 3.48Å; V308-R311 PolarHBondContact O-N 3.13Å; L309-R311 VanDerWaalsContact C-N 3.3Å; L309-R311 PolarHBondContact O-N 3.26Å; R311-C314 PolarHBondContact O-N 3.48Å; R311-H315 VanDerWaalsContact O-CB 3.32Å; R311-H315 WeakPolarHBondContact O-CB 3.49Å; R311-H315 PolarHBondContact O-N 3.01Å
312	W	87.7	Confident	78.5	Confident	29 Å²	29	70.1 Å²	70.1	11%	0.11	37%	0.369	C	S	.	.	H	α-helix	trans	-65.2	-41.6	175.5	-81.3	110.7	0	0	0	112.4	V234 T235 L238 L270 L273 F277 V308 L309 C314 H315 M316	V234-W312 HydrophobicContact CB-CH2 4.48Å; V234-W312 HydrophobicContact CG1-CH2 3.88Å; V234-W312 HydrophobicContact CG1-CZ2 4.24Å; V234-W312 HydrophobicContact CG1-CZ3 4.2Å; T235-W312 VanDerWaalsContact OG1-CH2 3.29Å; T235-W312 WeakPolarHBondContact OG1-CH2 3.38Å; L238-W312 HydrophobicContact CD1-CE3 3.8Å; L238-W312 HydrophobicContact CD1-CZ3 3.6Å; L270-W312 HydrophobicContact CD2-CB 4.26Å; L273-W312 HydrophobicContact CD1-CB 4.08Å; L273-W312 HydrophobicContact CD1-CG 4.34Å; F277-W312 AromaticContact CE2-CE2 3.85Å; F277-W312 HydrophobicContact CE2-CZ2 4.05Å; F277-W312 AromaticContact CE2-NE1 3.49Å; F277-W312 AromaticContact CZ-CZ2 3.93Å; F277-W312 HydrophobicContact CZ-CZ2 3.93Å; F277-W312 AromaticContact CZ-NE1 3.81Å; V308-W312 VanDerWaalsContact O-CD1 3.25Å; V308-W312 PolarHBondContact O-N 3.08Å; L309-W312 PolarHBondContact O-N 3.3Å; W312-C314 PolarHBondContact O-N 3.13Å; W312-H315 AromaticContact CZ3-ND1 3.94Å; W312-H315 PolarHBondContact O-N 3.4Å; W312-M316 WeakPolarHBondContact O-CB 3.44Å; W312-M316 VanDerWaalsContact O-CG 3.31Å; W312-M316 WeakPolarHBondContact O-CG 3.42Å; W312-M316 PolarHBondContact O-N 3.21Å
313	R	89.1	Confident	81.2	Confident	65 Å²	65	68.7 Å²	68.7	25%	0.245	35%	0.348	C	S	.	.	H	α-helix	trans	-53.6	-54.3	172.1	179.7	-171.2	-168.4	81.1	7.1	110.9	E267 L270 L309 Q310 H315 M316 H317	E267-R313 IonicContact OE1-CZ 3.53Å; E267-R313 IonicContact OE1-NH1 2.68Å; E267-R313 PolarHBondContact OE1-NH1 2.99Å; E267-R313 IonicContact OE1-NH2 3.12Å; E267-R313 PolarHBondContact OE1-NH2 3.37Å; E267-R313 IonicContact OE2-CZ 3.51Å; E267-R313 IonicContact OE2-NH1 2.71Å; E267-R313 PolarHBondContact OE2-NH1 3.06Å; L270-R313 HydrophobicContact CD1-CB 3.79Å; L270-R313 HydrophobicContact CD1-CG 3.83Å; L270-R313 HydrophobicContact CD2-CB 4.03Å; L309-R313 WeakPolarHBondContact O-CB 3.33Å; L309-R313 PolarHBondContact O-N 3.46Å; Q310-R313 WeakPolarHBondContact O-CB 3.35Å; Q310-R313 PolarHBondContact O-N 2.97Å; R313-H315 VanDerWaalsContact C-N 3.32Å; R313-H315 PolarHBondContact O-N 3.08Å; R313-M316 PolarHBondContact O-N 3.45Å; R313-H317 PolarHBondContact O-N 3.24Å; R313-H317 PolarHBondContact O-ND1 3.43Å
314	C	89.4	Confident	83.6	Confident	65 Å²	65	62.2 Å²	62.2	44%	0.439	32%	0.318	S	S	.	.	H	α-helix	trans	-60.6	-42.4	179.3	-69.4	0	0	0	0	111.9	Q310 R311 W312 H317 Q318	Q310-C314 PolarHBondContact O-N 3.04Å; Q310-C314 PolarHBondContact O-SG 3.37Å; R311-C314 PolarHBondContact O-N 3.48Å; W312-C314 PolarHBondContact O-N 3.13Å; C314-H317 PolarHBondContact O-N 3.42Å; C314-Q318 WeakPolarHBondContact O-CB 3.45Å; C314-Q318 PolarHBondContact O-N 3.26Å
315	H	90.4	Very high	85.8	Confident	69 Å²	69	57 Å²	57	32%	0.319	29%	0.285	S	S	.	.	H	α-helix	trans	-62	-47	178.6	179.2	-102	0	0	0	112	H239 R311 W312 R313 Q318 F319	H239-H315 AromaticContact NE2-CE1 3.32Å; H239-H315 PolarHBondContact NE2-CE1 2.83Å; H239-H315 VanDerWaalsContact NE2-CE1 3.32Å; H239-H315 AromaticContact NE2-NE2 3.92Å; R311-H315 VanDerWaalsContact O-CB 3.32Å; R311-H315 WeakPolarHBondContact O-CB 3.49Å; R311-H315 PolarHBondContact O-N 3.01Å; W312-H315 AromaticContact CZ3-ND1 3.94Å; W312-H315 PolarHBondContact O-N 3.4Å; R313-H315 VanDerWaalsContact C-N 3.32Å; R313-H315 PolarHBondContact O-N 3.08Å; H315-Q318 PolarHBondContact O-N 3.46Å; H315-F319 WeakPolarHBondContact O-CB 3.32Å; H315-F319 PolarHBondContact O-N 3.34Å
316	M	90.6	Very high	87.9	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-64.2	-43.5	178.1	-72	166.3	55.2	0	0	111.9	L238 L266 V269 L270 L273 W312 R313 F319 F320	L238-M316 HydrophobicContact CD1-CG 4.2Å; L238-M316 HydrophobicContact CD1-SD 4.2Å; L238-M316 HydrophobicContact CD2-CE 4.41Å; L238-M316 HydrophobicContact CD2-SD 4.23Å; L266-M316 HydrophobicContact CB-CE 4.12Å; L266-M316 HydrophobicContact CD2-CB 4.26Å; L266-M316 HydrophobicContact CD2-CE 3.44Å; L266-M316 VanDerWaalsContact CD2-CE 3.44Å; L266-M316 HydrophobicContact CG-CE 4.35Å; V269-M316 HydrophobicContact CB-CE 3.67Å; V269-M316 HydrophobicContact CG1-CE 3.35Å; V269-M316 HydrophobicContact CG1-SD 4.2Å; L270-M316 HydrophobicContact CD2-SD 3.95Å; L270-M316 HydrophobicContact CG-CE 4.31Å; L270-M316 HydrophobicContact CG-SD 4.3Å; L273-M316 HydrophobicContact CD1-SD 3.45Å; L273-M316 WeakPolarHBondContact CD1-SD 3.45Å; W312-M316 WeakPolarHBondContact O-CB 3.44Å; W312-M316 VanDerWaalsContact O-CG 3.31Å; W312-M316 WeakPolarHBondContact O-CG 3.42Å; W312-M316 PolarHBondContact O-N 3.21Å; R313-M316 PolarHBondContact O-N 3.45Å; M316-F319 PolarHBondContact O-N 3.49Å; M316-F320 VanDerWaalsContact O-CB 3.29Å; M316-F320 WeakPolarHBondContact O-CB 3.25Å; M316-F320 PolarHBondContact O-N 2.85Å
317	H	89.6	Confident	89.2	Confident	42 Å²	42	52.1 Å²	52.1	19%	0.194	25%	0.25	C	S	.	.	H	α-helix	trans	-63.8	-42.3	176.8	-77.8	75.4	0	0	0	112	R313 C314 C321	R313-H317 PolarHBondContact O-N 3.24Å; R313-H317 PolarHBondContact O-ND1 3.43Å; C314-H317 PolarHBondContact O-N 3.42Å; H317-C321 WeakPolarHBondContact O-CB 3.26Å; H317-C321 PolarHBondContact O-N 3.24Å; H317-C321 PolarHBondContact O-SG 3.24Å
318	Q	91.1	Very high	90	Very high	133 Å²	133	49 Å²	49	62%	0.621	22%	0.224	S	C	*	.	H	α-helix	trans	-64.9	-42.2	174.8	-88.2	-175	-31.3	0	0	112.1	C314 H315 C321 R322	C314-Q318 WeakPolarHBondContact O-CB 3.45Å; C314-Q318 PolarHBondContact O-N 3.26Å; H315-Q318 PolarHBondContact O-N 3.46Å; Q318-C321 PolarHBondContact O-N 3.4Å; Q318-R322 WeakPolarHBondContact O-CB 2.86Å; Q318-R322 PolarHBondContact O-N 3.13Å
319	F	91.8	Very high	90.8	Very high	8 Å²	8	46.9 Å²	46.9	4%	0.035	21%	0.211	C	C	.	.	H	α-helix	trans	-63.4	-47.6	177.6	-175.5	-94.9	0	0	0	111.1	H239 I242 E243 H315 M316 R322 I323	H239-F319 HydrophobicContact CB-CE1 3.81Å; H239-F319 HydrophobicContact CB-CE2 4.07Å; H239-F319 HydrophobicContact CB-CZ 3.48Å; H239-F319 VanDerWaalsContact CB-CZ 3.48Å; H239-F319 AromaticContact CD2-CD1 3.65Å; H239-F319 AromaticContact CD2-CD2 3.39Å; H239-F319 WeakPolarHBondContact CD2-CD2 3.47Å; H239-F319 AromaticContact CD2-CE1 3.64Å; H239-F319 AromaticContact CD2-CE2 3.37Å; H239-F319 WeakPolarHBondContact CD2-CE2 3.4Å; H239-F319 AromaticContact CD2-CG 3.54Å; H239-F319 AromaticContact CD2-CZ 3.51Å; H239-F319 AromaticContact CE1-CD2 3.82Å; H239-F319 AromaticContact CE1-CE2 3.69Å; H239-F319 AromaticContact CG-CD2 3.97Å; H239-F319 AromaticContact CG-CE1 3.85Å; H239-F319 AromaticContact CG-CE2 3.45Å; H239-F319 VanDerWaalsContact CG-CE2 3.45Å; H239-F319 AromaticContact CG-CZ 3.39Å; H239-F319 AromaticContact ND1-CE2 3.64Å; H239-F319 AromaticContact ND1-CZ 3.99Å; H239-F319 AromaticContact NE2-CD2 3.29Å; H239-F319 VanDerWaalsContact NE2-CD2 3.29Å; H239-F319 WeakPolarHBondContact NE2-CD2 3.35Å; H239-F319 AromaticContact NE2-CE2 3.55Å; H239-F319 AromaticContact NE2-CG 3.74Å; I242-F319 HydrophobicContact CB-CD1 4.2Å; I242-F319 HydrophobicContact CB-CE1 4.13Å; I242-F319 HydrophobicContact CD1-CD1 3.82Å; I242-F319 HydrophobicContact CD1-CE1 4.46Å; I242-F319 HydrophobicContact CG2-CD1 4.04Å; I242-F319 HydrophobicContact CG2-CE1 4.16Å; E243-F319 HydrophobicContact CG-CE1 4.46Å; E243-F319 HydrophobicContact CG-CZ 4.46Å; H315-F319 WeakPolarHBondContact O-CB 3.32Å; H315-F319 PolarHBondContact O-N 3.34Å; M316-F319 PolarHBondContact O-N 3.49Å; F319-R322 VanDerWaalsContact CE2-NH2 3.25Å; F319-R322 PolarHBondContact O-N 2.92Å; F319-I323 HydrophobicContact CD1-CG1 4.12Å; F319-I323 HydrophobicContact CD2-CG1 4.48Å; F319-I323 HydrophobicContact CE1-CD1 4.49Å; F319-I323 HydrophobicContact CE1-CG1 3.68Å; F319-I323 HydrophobicContact CE2-CD1 4.33Å; F319-I323 HydrophobicContact CE2-CG1 4.08Å; F319-I323 HydrophobicContact CG-CG1 4.49Å; F319-I323 HydrophobicContact CZ-CD1 3.99Å; F319-I323 HydrophobicContact CZ-CG1 3.65Å; F319-I323 WeakPolarHBondContact O-CG1 3.24Å; F319-I323 PolarHBondContact O-N 3.19Å
320	F	91.8	Very high	91.3	Very high	7 Å²	7	50.9 Å²	50.9	3%	0.031	23%	0.229	C	C	.	.	H	α-helix	trans	-53.9	-55.3	173.2	165.4	-100.1	0	0	0	111.3	I242 L259 F262 L266 M316 R322 I323 Y324	I242-F320 HydrophobicContact CG2-CB 4.34Å; I242-F320 HydrophobicContact CG2-CD2 4.4Å; L259-F320 HydrophobicContact CD2-CE1 3.76Å; L259-F320 HydrophobicContact CD2-CZ 4.14Å; F262-F320 HydrophobicContact CB-CD2 4.47Å; F262-F320 HydrophobicContact CB-CE2 3.87Å; F262-F320 HydrophobicContact CB-CZ 3.96Å; F262-F320 AromaticContact CD1-CD2 3.7Å; F262-F320 HydrophobicContact CD1-CD2 3.7Å; F262-F320 AromaticContact CD1-CE2 3.39Å; F262-F320 HydrophobicContact CD1-CE2 3.39Å; F262-F320 HydrophobicContact CD1-CZ 4.31Å; F262-F320 HydrophobicContact CD2-CE2 4.16Å; F262-F320 HydrophobicContact CE1-CD2 4.22Å; F262-F320 AromaticContact CE1-CE2 3.9Å; F262-F320 HydrophobicContact CE1-CE2 3.9Å; F262-F320 HydrophobicContact CG-CD2 4.21Å; F262-F320 AromaticContact CG-CE2 3.52Å; F262-F320 HydrophobicContact CG-CE2 3.52Å; F262-F320 HydrophobicContact CG-CZ 4.01Å; F262-F320 HydrophobicContact CZ-CE2 4.46Å; L266-F320 HydrophobicContact CD1-CB 4.48Å; M316-F320 VanDerWaalsContact O-CB 3.29Å; M316-F320 WeakPolarHBondContact O-CB 3.25Å; M316-F320 PolarHBondContact O-N 2.85Å; F320-R322 VanDerWaalsContact C-N 3.27Å; F320-R322 PolarHBondContact O-N 3.37Å; F320-I323 PolarHBondContact O-N 3.42Å; F320-I323 VanDerWaalsContact O-N 3.16Å; F320-Y324 HydrophobicContact CE2-CD2 4.26Å; F320-Y324 HydrophobicContact CZ-CD2 4.16Å; F320-Y324 HydrophobicContact CZ-CG 4.2Å; F320-Y324 VanDerWaalsContact O-CB 3.28Å; F320-Y324 WeakPolarHBondContact O-CB 3.4Å; F320-Y324 PolarHBondContact O-N 3.43Å
321	C	92.2	Very high	91.8	Very high	6 Å²	6	46.6 Å²	46.6	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-56.8	-43.6	-179.1	-68.4	0	0	0	0	111.2	H317 Q318 I323 Y324 V325 C352 T356	H317-C321 WeakPolarHBondContact O-CB 3.26Å; H317-C321 PolarHBondContact O-N 3.24Å; H317-C321 PolarHBondContact O-SG 3.24Å; Q318-C321 PolarHBondContact O-N 3.4Å; C321-I323 PolarHBondContact O-N 3.01Å; C321-Y324 PolarHBondContact O-N 2.84Å; C321-V325 WeakPolarHBondContact O-CB 3.08Å; C321-V325 VanDerWaalsContact O-CG2 3.26Å; C321-V325 WeakPolarHBondContact O-CG2 3.38Å; C321-V325 PolarHBondContact O-N 2.67Å; C321-C352 HydrophobicContact CB-CB 4.18Å; C321-T356 HydrophobicContact CB-CG2 3.87Å
322	R	93.1	Very high	92.2	Very high	123 Å²	123	37.1 Å²	37.1	46%	0.464	17%	0.173	S	C	.	.	H	α-helix	trans	-61.8	-44	179.9	-176.9	176.6	68.3	179.4	2.8	112.6	Q318 F319 F320 N326 Q358	Q318-R322 WeakPolarHBondContact O-CB 2.86Å; Q318-R322 PolarHBondContact O-N 3.13Å; F319-R322 VanDerWaalsContact CE2-NH2 3.25Å; F319-R322 PolarHBondContact O-N 2.92Å; F320-R322 VanDerWaalsContact C-N 3.27Å; F320-R322 PolarHBondContact O-N 3.37Å; R322-N326 PolarHBondContact O-N 2.73Å; R322-N326 VanDerWaalsContact O-N 3.15Å; R322-N326 PolarHBondContact O-ND2 3.04Å; R322-Q358 PolarHBondContact O-OE1 2.88Å
323	I	91.8	Very high	92.6	Very high	25 Å²	25	36.4 Å²	36.4	13%	0.128	17%	0.171	C	C	.	.	H	α-helix	trans	-73.8	-39.7	-178	-65.3	-65.3	0	0	0	110.5	E243 M246 F319 F320 C321 N326 M327	E243-I323 HydrophobicContact CG-CG2 4.07Å; M246-I323 HydrophobicContact CE-CB 4.4Å; M246-I323 HydrophobicContact CE-CG2 3.21Å; M246-I323 HydrophobicContact SD-CB 4.41Å; M246-I323 HydrophobicContact SD-CG2 3.67Å; F319-I323 HydrophobicContact CD1-CG1 4.12Å; F319-I323 HydrophobicContact CD2-CG1 4.48Å; F319-I323 HydrophobicContact CE1-CD1 4.49Å; F319-I323 HydrophobicContact CE1-CG1 3.68Å; F319-I323 HydrophobicContact CE2-CD1 4.33Å; F319-I323 HydrophobicContact CE2-CG1 4.08Å; F319-I323 HydrophobicContact CG-CG1 4.49Å; F319-I323 HydrophobicContact CZ-CD1 3.99Å; F319-I323 HydrophobicContact CZ-CG1 3.65Å; F319-I323 WeakPolarHBondContact O-CG1 3.24Å; F319-I323 PolarHBondContact O-N 3.19Å; F320-I323 PolarHBondContact O-N 3.42Å; F320-I323 VanDerWaalsContact O-N 3.16Å; C321-I323 PolarHBondContact O-N 3.01Å; I323-N326 WeakPolarHBondContact O-CB 3.24Å; I323-N326 PolarHBondContact O-N 3.06Å; I323-M327 PolarHBondContact O-N 3.37Å
324	Y	92.7	Very high	92.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.5	-47.3	174.1	-169.8	-100.5	0	0	0	112.4	M246 C250 F320 C321 N326 M327 R328 D348 C352	M246-Y324 HydrophobicContact CG-CD2 4.36Å; M246-Y324 WeakPolarHBondContact SD-CA 3.3Å; M246-Y324 HydrophobicContact SD-CD2 4.09Å; M246-Y324 PolarHBondContact SD-N 3.4Å; C250-Y324 HydrophobicContact CB-CE2 4.35Å; F320-Y324 HydrophobicContact CE2-CD2 4.26Å; F320-Y324 HydrophobicContact CZ-CD2 4.16Å; F320-Y324 HydrophobicContact CZ-CG 4.2Å; F320-Y324 VanDerWaalsContact O-CB 3.28Å; F320-Y324 WeakPolarHBondContact O-CB 3.4Å; F320-Y324 PolarHBondContact O-N 3.43Å; C321-Y324 PolarHBondContact O-N 2.84Å; Y324-N326 VanDerWaalsContact C-N 3.34Å; Y324-N326 PolarHBondContact O-N 3.21Å; Y324-M327 HydrophobicContact CD2-CE 3.68Å; Y324-M327 HydrophobicContact CE2-CE 3.79Å; Y324-M327 HydrophobicContact CG-CE 4.5Å; Y324-M327 PolarHBondContact O-N 2.75Å; Y324-R328 HydrophobicContact CD1-CG 4.09Å; Y324-R328 HydrophobicContact CE1-CG 3.76Å; Y324-R328 HydrophobicContact CE2-CG 4.35Å; Y324-R328 WeakPolarHBondContact O-CB 3.43Å; Y324-R328 WeakPolarHBondContact O-CG 3.41Å; Y324-R328 PolarHBondContact O-N 3.13Å; Y324-R328 PolarHBondContact OH-NE 3.24Å; Y324-R328 VanDerWaalsContact OH-NE 3.13Å; Y324-R328 PolarHBondContact OH-NH2 2.94Å; Y324-D348 HydrophobicContact CE1-CB 3.69Å; Y324-D348 PolarHBondContact OH-OD2 3.18Å; Y324-D348 VanDerWaalsContact OH-OD2 3.14Å; Y324-C352 HydrophobicContact CD1-CB 4.41Å
325	V	94.6	Very high	93.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.1	-43.6	174.9	170.3	0	0	0	0	111.1	C321 M327 R328 I329 L349 C352 L353 T356 Q358	C321-V325 WeakPolarHBondContact O-CB 3.08Å; C321-V325 VanDerWaalsContact O-CG2 3.26Å; C321-V325 WeakPolarHBondContact O-CG2 3.38Å; C321-V325 PolarHBondContact O-N 2.67Å; V325-M327 PolarHBondContact O-N 3.06Å; V325-R328 PolarHBondContact O-N 3Å; V325-I329 HydrophobicContact CG1-CD1 3.46Å; V325-I329 VanDerWaalsContact CG1-CD1 3.46Å; V325-I329 HydrophobicContact CG1-CG1 4.04Å; V325-I329 WeakPolarHBondContact O-CB 3.21Å; V325-I329 WeakPolarHBondContact O-CG1 3.24Å; V325-I329 PolarHBondContact O-N 3.24Å; V325-L349 HydrophobicContact CB-CD1 4.39Å; V325-L349 HydrophobicContact CG1-CD1 4.26Å; V325-L349 HydrophobicContact CG2-CD1 4.09Å; V325-C352 HydrophobicContact CG2-CB 3.43Å; V325-C352 VanDerWaalsContact CG2-CB 3.43Å; V325-L353 HydrophobicContact CG1-CD1 3.79Å; V325-L353 HydrophobicContact CG2-CD1 4.09Å; V325-T356 HydrophobicContact CG2-CG2 4.27Å; V325-Q358 HydrophobicContact CG1-CB 3.98Å
326	N	93.8	Very high	93.5	Very high	41 Å²	41	27.9 Å²	27.9	22%	0.219	13%	0.13	C	C	.	.	H	α-helix	trans	-58.7	-49.9	178	-80.1	-28.6	0	0	0	112.3	R322 I323 Y324 I329 E330 Q358 Q361	R322-N326 PolarHBondContact O-N 2.73Å; R322-N326 VanDerWaalsContact O-N 3.15Å; R322-N326 PolarHBondContact O-ND2 3.04Å; I323-N326 WeakPolarHBondContact O-CB 3.24Å; I323-N326 PolarHBondContact O-N 3.06Å; Y324-N326 VanDerWaalsContact C-N 3.34Å; Y324-N326 PolarHBondContact O-N 3.21Å; N326-I329 PolarHBondContact O-N 3.01Å; N326-E330 PolarHBondContact O-N 3.16Å; N326-Q358 PolarHBondContact OD1-NE2 3.25Å; N326-Q361 PolarHBondContact OD1-NE2 2.84Å; N326-Q361 PolarHBondContact OD1-OE1 3.14Å
327	M	93.3	Very high	93.6	Very high	11 Å²	11	33.8 Å²	33.8	5%	0.054	15%	0.152	C	C	.	.	H	α-helix	trans	-59.9	-49	177.9	177.2	-165.1	60.6	0	0	111.1	M246 C250 R251 I323 Y324 V325 I329 E330 E331	M246-M327 HydrophobicContact CE-CB 3.63Å; M246-M327 HydrophobicContact CE-CE 4.25Å; M246-M327 HydrophobicContact CE-CG 4.13Å; M246-M327 HydrophobicContact CE-SD 3.71Å; M246-M327 HydrophobicContact CG-CE 3.8Å; M246-M327 HydrophobicContact CG-SD 3.8Å; M246-M327 HydrophobicContact SD-CB 4.35Å; M246-M327 HydrophobicContact SD-CE 3.84Å; M246-M327 HydrophobicContact SD-SD 4.04Å; C250-M327 HydrophobicContact CB-CE 3.68Å; C250-M327 HydrophobicContact CB-SD 4.05Å; R251-M327 HydrophobicContact CB-SD 4.38Å; I323-M327 PolarHBondContact O-N 3.37Å; Y324-M327 HydrophobicContact CD2-CE 3.68Å; Y324-M327 HydrophobicContact CE2-CE 3.79Å; Y324-M327 HydrophobicContact CG-CE 4.5Å; Y324-M327 PolarHBondContact O-N 2.75Å; V325-M327 PolarHBondContact O-N 3.06Å; M327-I329 VanDerWaalsContact C-N 3.29Å; M327-I329 PolarHBondContact O-N 3.27Å; M327-E330 WeakPolarHBondContact O-CB 3.43Å; M327-E330 PolarHBondContact O-N 2.93Å; M327-E330 VanDerWaalsContact O-N 3.09Å; M327-E331 PolarHBondContact O-N 3.1Å
328	R	94.4	Very high	93.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-65.7	-29.1	179.6	-69.1	-64.7	178.9	-119.6	5.5	113.2	C250 E253 Y324 V325 E331 L332 I335 L349	C250-R328 VanDerWaalsContact O-CZ 3.32Å; C250-R328 PolarHBondContact O-NH1 2.85Å; C250-R328 PolarHBondContact O-NH2 3.4Å; E253-R328 PolarHBondContact O-NH2 3.25Å; Y324-R328 HydrophobicContact CD1-CG 4.09Å; Y324-R328 HydrophobicContact CE1-CG 3.76Å; Y324-R328 HydrophobicContact CE2-CG 4.35Å; Y324-R328 WeakPolarHBondContact O-CB 3.43Å; Y324-R328 WeakPolarHBondContact O-CG 3.41Å; Y324-R328 PolarHBondContact O-N 3.13Å; Y324-R328 PolarHBondContact OH-NE 3.24Å; Y324-R328 VanDerWaalsContact OH-NE 3.13Å; Y324-R328 PolarHBondContact OH-NH2 2.94Å; V325-R328 PolarHBondContact O-N 3Å; R328-E331 IonicContact CZ-OE2 2.85Å; R328-E331 IonicContact NH1-OE2 3.62Å; R328-E331 PolarHBondContact NH1-OE2 3.33Å; R328-E331 CarbonylContact O-C 3.54Å; R328-E331 PolarHBondContact O-N 3.36Å; R328-L332 WeakPolarHBondContact O-CA 3.39Å; R328-L332 WeakPolarHBondContact O-CB 3.46Å; R328-L332 PolarHBondContact O-N 3.23Å; R328-I335 HydrophobicContact CB-CD1 4.41Å; R328-L349 HydrophobicContact CB-CD1 3.81Å; R328-L349 HydrophobicContact CB-CD2 4.39Å
329	I	94.9	Very high	93.8	Very high	5 Å²	5	29.3 Å²	29.3	3%	0.026	13%	0.132	C	C	.	.	H	α-helix	trans	-65.6	-38	172.2	-75.7	169.4	0	0	0	111.4	V325 N326 M327 E331 Q361 L362	V325-I329 HydrophobicContact CG1-CD1 3.46Å; V325-I329 VanDerWaalsContact CG1-CD1 3.46Å; V325-I329 HydrophobicContact CG1-CG1 4.04Å; V325-I329 WeakPolarHBondContact O-CB 3.21Å; V325-I329 WeakPolarHBondContact O-CG1 3.24Å; V325-I329 PolarHBondContact O-N 3.24Å; N326-I329 PolarHBondContact O-N 3.01Å; M327-I329 VanDerWaalsContact C-N 3.29Å; M327-I329 PolarHBondContact O-N 3.27Å; I329-E331 VanDerWaalsContact C-N 3.33Å; I329-Q361 HydrophobicContact CD1-CB 4.49Å; I329-Q361 HydrophobicContact CD1-CG 4.43Å; I329-L362 HydrophobicContact CD1-CB 3.8Å; I329-L362 HydrophobicContact CG1-CB 3.87Å; I329-L362 HydrophobicContact CG1-CD1 4.14Å; I329-L362 HydrophobicContact CG1-CG 4.07Å
330	E	93.9	Very high	93.7	Very high	128 Å²	128	33.1 Å²	33.1	60%	0.598	16%	0.158	S	C	*	.	H	α-helix	trans	-67.2	-36.2	176.4	-67.8	178.8	-174.7	0	0	111.6	R251 N326 M327	R251-E330 IonicContact NH2-OE2 3.88Å; N326-E330 PolarHBondContact O-N 3.16Å; M327-E330 WeakPolarHBondContact O-CB 3.43Å; M327-E330 PolarHBondContact O-N 2.93Å; M327-E330 VanDerWaalsContact O-N 3.09Å
331	E	95	Very high	93.7	Very high	17 Å²	17	39.2 Å²	39.2	8%	0.079	19%	0.186	C	C	.	.	H	α-helix	trans	-90.1	-6.5	-178.4	-63.1	178.4	144.2	0	0	113.7	R251 G252 Y254 M327 R328 I329 F333 S334 I335	R251-E331 WeakPolarHBondContact CG-OE1 3.48Å; G252-E331 PolarHBondContact N-OE1 2.85Å; Y254-E331 HydrophobicContact CE1-CB 4.17Å; M327-E331 PolarHBondContact O-N 3.1Å; R328-E331 IonicContact CZ-OE2 2.85Å; R328-E331 IonicContact NH1-OE2 3.62Å; R328-E331 PolarHBondContact NH1-OE2 3.33Å; R328-E331 CarbonylContact O-C 3.54Å; R328-E331 PolarHBondContact O-N 3.36Å; I329-E331 VanDerWaalsContact C-N 3.33Å; E331-F333 PolarHBondContact O-N 3.43Å; E331-S334 WeakPolarHBondContact O-CA 3.42Å; E331-S334 WeakPolarHBondContact O-CB 3.39Å; E331-S334 PolarHBondContact O-N 3.31Å; E331-I335 HydrophobicContact CB-CD1 4.16Å; E331-I335 HydrophobicContact CB-CG1 4.36Å; E331-I335 PolarHBondContact O-N 3.48Å
332	L	95.8	Very high	93.9	Very high	4 Å²	4	39 Å²	39	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-55.8	-35.1	-167.9	-174.5	57.7	0	0	0	113.8	R328 I335 I336 L349 L362 L366	R328-L332 WeakPolarHBondContact O-CA 3.39Å; R328-L332 WeakPolarHBondContact O-CB 3.46Å; R328-L332 PolarHBondContact O-N 3.23Å; L332-I335 PolarHBondContact O-N 3.45Å; L332-I336 HydrophobicContact CD1-CD1 4.29Å; L332-I336 HydrophobicContact CD1-CG1 4.3Å; L332-I336 HydrophobicContact CG-CD1 3.98Å; L332-I336 HydrophobicContact CG-CG1 4.46Å; L332-I336 WeakPolarHBondContact O-CB 3.44Å; L332-I336 VanDerWaalsContact O-CG1 3.23Å; L332-I336 WeakPolarHBondContact O-CG1 3.23Å; L332-I336 PolarHBondContact O-N 2.98Å; L332-L349 HydrophobicContact CD1-CD2 3.9Å; L332-L362 HydrophobicContact CD2-CD1 3.93Å; L332-L362 HydrophobicContact CD2-CD2 3.81Å; L332-L362 HydrophobicContact CD2-CG 3.69Å; L332-L366 HydrophobicContact CD2-CB 4.35Å; L332-L366 HydrophobicContact CD2-CD1 4.14Å; L332-L366 HydrophobicContact CD2-CD2 3.93Å; L332-L366 HydrophobicContact CD2-CG 4.37Å; L332-L366 HydrophobicContact CG-CD1 4.17Å
333	F	95.8	Very high	94	Very high	14 Å²	14	36.8 Å²	36.8	6%	0.061	18%	0.178	C	C	.	.	H	α-helix	trans	-62.9	-42.4	175.1	178.4	-82.6	0	0	0	112.1	E331 I336 R337 A369 F370 R373 L374 V387	E331-F333 PolarHBondContact O-N 3.43Å; F333-I336 PolarHBondContact O-N 3.47Å; F333-R337 PolarHBondContact O-N 2.87Å; F333-A369 HydrophobicContact CB-CB 4.09Å; F333-A369 HydrophobicContact CD2-CB 4.37Å; F333-F370 AromaticContact CD2-CD1 3.83Å; F333-F370 HydrophobicContact CD2-CD1 3.83Å; F333-F370 AromaticContact CD2-CE1 3.96Å; F333-F370 HydrophobicContact CD2-CE1 3.96Å; F333-F370 AromaticContact CE2-CD1 3.89Å; F333-F370 HydrophobicContact CE2-CD1 3.89Å; F333-F370 HydrophobicContact CE2-CE1 4.19Å; F333-R373 VanDerWaalsContact CD1-NH1 3.32Å; F333-R373 VanDerWaalsContact CD1-NH2 3.33Å; F333-R373 HydrophobicContact CE1-CB 4.31Å; F333-R373 HydrophobicContact CE2-CB 4.23Å; F333-R373 HydrophobicContact CZ-CB 4.02Å; F333-L374 HydrophobicContact CE2-CB 4.05Å; F333-L374 HydrophobicContact CZ-CB 4.39Å; F333-V387 HydrophobicContact CE2-CG1 4.42Å
334	S	95.3	Very high	94.1	Very high	19 Å²	19	37.4 Å²	37.4	13%	0.133	18%	0.184	C	C	.	.	H	α-helix	trans	-69	-42.8	177.6	-55.6	0	0	0	0	110.4	E331 I336 R337 D338	E331-S334 WeakPolarHBondContact O-CA 3.42Å; E331-S334 WeakPolarHBondContact O-CB 3.39Å; E331-S334 PolarHBondContact O-N 3.31Å; S334-I336 VanDerWaalsContact C-N 3.3Å; S334-I336 PolarHBondContact O-N 2.77Å; S334-R337 WeakPolarHBondContact O-CB 3.4Å; S334-R337 PolarHBondContact O-N 3.16Å; S334-R337 VanDerWaalsContact O-N 3.09Å; S334-D338 PolarHBondContact O-N 3.15Å
335	I	96.1	Very high	94.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-54.5	-46.9	173.3	-63.7	172.4	0	0	0	110.6	Y254 R328 E331 L332 R337 D338 F339 S342 A345 I346	Y254-I335 HydrophobicContact CD1-CD1 4.13Å; Y254-I335 HydrophobicContact CD1-CG1 3.58Å; Y254-I335 HydrophobicContact CD2-CG1 4.34Å; Y254-I335 HydrophobicContact CE1-CD1 4.13Å; Y254-I335 HydrophobicContact CE1-CG1 3.58Å; Y254-I335 HydrophobicContact CE2-CG1 4.36Å; Y254-I335 HydrophobicContact CG-CG1 3.98Å; R328-I335 HydrophobicContact CB-CD1 4.41Å; E331-I335 HydrophobicContact CB-CD1 4.16Å; E331-I335 HydrophobicContact CB-CG1 4.36Å; E331-I335 PolarHBondContact O-N 3.48Å; L332-I335 PolarHBondContact O-N 3.45Å; I335-R337 VanDerWaalsContact C-N 3.35Å; I335-R337 PolarHBondContact O-N 3.11Å; I335-D338 PolarHBondContact O-N 2.91Å; I335-F339 PolarHBondContact O-N 2.94Å; I335-S342 WeakPolarHBondContact O-CB 3.48Å; I335-S342 PolarHBondContact O-OG 3.49Å; I335-A345 HydrophobicContact CG2-CB 4.45Å; I335-I346 HydrophobicContact CG2-CD1 4.29Å; I335-I346 HydrophobicContact CG2-CG1 3.74Å
336	I	95.8	Very high	94.2	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-41	178.3	-74.1	166.9	0	0	0	111.7	L332 F333 S334 D338 F339 L366 F370 S390 A391 A394 L395	L332-I336 HydrophobicContact CD1-CD1 4.29Å; L332-I336 HydrophobicContact CD1-CG1 4.3Å; L332-I336 HydrophobicContact CG-CD1 3.98Å; L332-I336 HydrophobicContact CG-CG1 4.46Å; L332-I336 WeakPolarHBondContact O-CB 3.44Å; L332-I336 VanDerWaalsContact O-CG1 3.23Å; L332-I336 WeakPolarHBondContact O-CG1 3.23Å; L332-I336 PolarHBondContact O-N 2.98Å; F333-I336 PolarHBondContact O-N 3.47Å; S334-I336 VanDerWaalsContact C-N 3.3Å; S334-I336 PolarHBondContact O-N 2.77Å; I336-D338 VanDerWaalsContact C-N 3.31Å; I336-D338 PolarHBondContact O-N 2.95Å; I336-F339 WeakPolarHBondContact O-CB 3.18Å; I336-F339 PolarHBondContact O-N 3.29Å; I336-L366 HydrophobicContact CD1-CD1 3.82Å; I336-L366 HydrophobicContact CD1-CD2 4.17Å; I336-F370 HydrophobicContact CD1-CZ 4.35Å; I336-S390 WeakPolarHBondContact O-CB 3.25Å; I336-A391 VanDerWaalsContact CG2-CA 3.48Å; I336-A391 HydrophobicContact CG2-CB 3.74Å; I336-A394 HydrophobicContact CG1-CB 4.01Å; I336-L395 HydrophobicContact CD1-CD2 4.18Å; I336-L395 HydrophobicContact CD1-CG 4.39Å
337	R	92.7	Very high	94.3	Very high	126 Å²	126	38.6 Å²	38.6	48%	0.475	19%	0.19	S	C	.	.	H	α-helix	trans	-64.2	-38	179.6	-176.4	-167.8	63.6	-167.6	-6	111.8	F333 S334 I335 F339	F333-R337 PolarHBondContact O-N 2.87Å; S334-R337 WeakPolarHBondContact O-CB 3.4Å; S334-R337 PolarHBondContact O-N 3.16Å; S334-R337 VanDerWaalsContact O-N 3.09Å; I335-R337 VanDerWaalsContact C-N 3.35Å; I335-R337 PolarHBondContact O-N 3.11Å; R337-F339 VanDerWaalsContact C-N 3.28Å; R337-F339 PolarHBondContact O-N 3.4Å
338	D	92.6	Very high	94.3	Very high	52 Å²	52	38.3 Å²	38.3	28%	0.278	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	9.1	-174.6	-52.2	-16.3	0	0	0	112.1	S334 I335 I336 E341 S342	S334-D338 PolarHBondContact O-N 3.15Å; I335-D338 PolarHBondContact O-N 2.91Å; I336-D338 VanDerWaalsContact C-N 3.31Å; I336-D338 PolarHBondContact O-N 2.95Å; D338-E341 PolarHBondContact O-N 3.28Å; D338-S342 PolarHBondContact O-N 3.4Å
339	F	92.3	Very high	94.3	Very high	28 Å²	28	38.3 Å²	38.3	12%	0.123	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	134.1	173.6	-174.1	-85.7	0	0	0	110.4	I335 I336 R337 S342 K343 I346 K393 A394	I335-F339 PolarHBondContact O-N 2.94Å; I336-F339 WeakPolarHBondContact O-CB 3.18Å; I336-F339 PolarHBondContact O-N 3.29Å; R337-F339 VanDerWaalsContact C-N 3.28Å; R337-F339 PolarHBondContact O-N 3.4Å; F339-S342 VanDerWaalsContact CA-OG 3.32Å; F339-S342 WeakPolarHBondContact CA-OG 3.36Å; F339-S342 PolarHBondContact N-OG 3.47Å; F339-K343 HydrophobicContact CE2-CB 4.22Å; F339-I346 HydrophobicContact CD2-CD1 3.58Å; F339-I346 HydrophobicContact CE2-CD1 3.98Å; F339-K393 HydrophobicContact CD1-CB 3.75Å; F339-K393 HydrophobicContact CD1-CD 4.21Å; F339-K393 HydrophobicContact CE1-CB 3.31Å; F339-K393 HydrophobicContact CE1-CD 3.9Å; F339-K393 HydrophobicContact CE1-CG 4.19Å; F339-K393 HydrophobicContact CZ-CB 3.91Å; F339-A394 HydrophobicContact CB-CB 4.41Å; F339-A394 HydrophobicContact CD2-CB 3.94Å; F339-A394 HydrophobicContact CE2-CB 4.48Å; F339-A394 HydrophobicContact CG-CB 4.16Å
340	P	90.7	Very high	94.2	Very high	89 Å²	89	40.7 Å²	40.7	58%	0.578	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	cis	-94.5	-6.6	22.4	36.2	-37.2	0	0	0	116.7	S342 K343	P340-S342 PolarHBondContact O-N 3.28Å; P340-K343 WeakPolarHBondContact O-CB 3.23Å; P340-K343 PolarHBondContact O-N 2.83Å
341	E	92.3	Very high	94.1	Very high	135 Å²	135	37.7 Å²	37.7	63%	0.631	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-32.5	-177.3	-63	177.4	160.9	0	0	111.2	E255 D338 K343 P344	E255-E341 HydrophobicContact CG-CB 4.44Å; D338-E341 PolarHBondContact O-N 3.28Å; E341-K343 PolarHBondContact O-N 2.82Å; E341-P344 WeakPolarHBondContact O-CD 3.5Å
342	S	95.6	Very high	94	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.007	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	8.7	177.5	68.9	0	0	0	0	116	I335 D338 F339 P340 A345 I346	I335-S342 WeakPolarHBondContact O-CB 3.48Å; I335-S342 PolarHBondContact O-OG 3.49Å; D338-S342 PolarHBondContact O-N 3.4Å; F339-S342 VanDerWaalsContact CA-OG 3.32Å; F339-S342 WeakPolarHBondContact CA-OG 3.36Å; F339-S342 PolarHBondContact N-OG 3.47Å; P340-S342 PolarHBondContact O-N 3.28Å; S342-A345 PolarHBondContact O-N 3.37Å; S342-I346 PolarHBondContact O-N 3.44Å
343	K	94.3	Very high	93.7	Very high	76 Å²	76	37.8 Å²	37.8	33%	0.33	19%	0.185	S	C	.	.	H	α-helix	trans	-54.7	-44.5	-177.9	175.5	167.9	179.1	150.9	0	113.6	F339 P340 E341 A345 I346 D347 E397	F339-K343 HydrophobicContact CE2-CB 4.22Å; P340-K343 WeakPolarHBondContact O-CB 3.23Å; P340-K343 PolarHBondContact O-N 2.83Å; E341-K343 PolarHBondContact O-N 2.82Å; K343-A345 VanDerWaalsContact C-N 3.3Å; K343-A345 PolarHBondContact O-N 3.01Å; K343-I346 WeakPolarHBondContact O-CB 3.2Å; K343-I346 PolarHBondContact O-N 2.98Å; K343-D347 PolarHBondContact O-N 3.3Å; K343-E397 IonicContact NZ-OE1 3.91Å; K343-E397 PolarHBondContact NZ-OE1 3.01Å; K343-E397 IonicContact NZ-OE2 2.6Å
344	P	94.8	Very high	93.3	Very high	39 Å²	39	44 Å²	44	25%	0.253	21%	0.214	S	C	.	.	H	α-helix	trans	-59.2	-37.9	179.8	-29.2	41.3	0	0	0	113.4	E255 E341 I346 D347 D348	E255-P344 WeakPolarHBondContact O-CG 3.3Å; E341-P344 WeakPolarHBondContact O-CD 3.5Å; P344-I346 VanDerWaalsContact C-N 3.28Å; P344-I346 PolarHBondContact O-N 3.49Å; P344-D347 PolarHBondContact O-N 3.06Å; P344-D348 PolarHBondContact O-N 2.84Å
345	A	94.9	Very high	92.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.7	-32.3	174.7	0	0	0	0	0	113.1	Y254 I335 S342 K343 L349	Y254-A345 PolarHBondContact O-N 3.12Å; I335-A345 HydrophobicContact CG2-CB 4.45Å; S342-A345 PolarHBondContact O-N 3.37Å; K343-A345 VanDerWaalsContact C-N 3.3Å; K343-A345 PolarHBondContact O-N 3.01Å; A345-L349 WeakPolarHBondContact O-CB 3.18Å; A345-L349 PolarHBondContact O-N 3.34Å
346	I	95.3	Very high	92.4	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.015	24%	0.237	C	C	.	.	H	α-helix	trans	-72	-41.9	175.9	-61.6	170.8	0	0	0	110.8	I335 F339 S342 K343 P344 D348 L349 K350 A394 E397 L398	I335-I346 HydrophobicContact CG2-CD1 4.29Å; I335-I346 HydrophobicContact CG2-CG1 3.74Å; F339-I346 HydrophobicContact CD2-CD1 3.58Å; F339-I346 HydrophobicContact CE2-CD1 3.98Å; S342-I346 PolarHBondContact O-N 3.44Å; K343-I346 WeakPolarHBondContact O-CB 3.2Å; K343-I346 PolarHBondContact O-N 2.98Å; P344-I346 VanDerWaalsContact C-N 3.28Å; P344-I346 PolarHBondContact O-N 3.49Å; I346-D348 VanDerWaalsContact C-N 3.35Å; I346-L349 PolarHBondContact O-N 2.86Å; I346-K350 WeakPolarHBondContact O-CB 3.29Å; I346-K350 PolarHBondContact O-N 2.99Å; I346-A394 HydrophobicContact CD1-CB 3.51Å; I346-E397 HydrophobicContact CG2-CB 4.08Å; I346-L398 HydrophobicContact CG2-CB 3.86Å; I346-L398 HydrophobicContact CG2-CD1 4.39Å
347	D	93.9	Very high	91.8	Very high	62 Å²	62	58 Å²	58	33%	0.332	28%	0.279	S	S	.	.	H	α-helix	trans	-64.1	-41.2	177.5	-71.1	-29.3	0	0	0	111.2	K343 P344 K350 F351	K343-D347 PolarHBondContact O-N 3.3Å; P344-D347 PolarHBondContact O-N 3.06Å; D347-K350 WeakPolarHBondContact O-CB 3.49Å; D347-K350 PolarHBondContact O-N 3.41Å; D347-F351 PolarHBondContact O-N 3.45Å
348	D	94	Very high	91.6	Very high	5 Å²	5	53.1 Å²	53.1	3%	0.027	26%	0.261	C	S	.	.	H	α-helix	trans	-62.8	-45.8	172.6	-74.7	0.1	0	0	0	111.5	S257 F258 L259 Y324 P344 I346 K350 F351 C352	S257-D348 WeakPolarHBondContact CA-OD2 3.39Å; S257-D348 WeakPolarHBondContact CB-OD1 3.2Å; S257-D348 VanDerWaalsContact OG-CG 3.32Å; S257-D348 PolarHBondContact OG-OD1 2.88Å; S257-D348 PolarHBondContact OG-OD2 3.45Å; F258-D348 PolarHBondContact N-OD2 2.95Å; L259-D348 HydrophobicContact CD1-CB 4.17Å; L259-D348 WeakPolarHBondContact CD1-OD1 3.39Å; L259-D348 HydrophobicContact CG-CB 4.09Å; L259-D348 WeakPolarHBondContact CG-OD1 3.46Å; Y324-D348 HydrophobicContact CE1-CB 3.69Å; Y324-D348 PolarHBondContact OH-OD2 3.18Å; Y324-D348 VanDerWaalsContact OH-OD2 3.14Å; P344-D348 PolarHBondContact O-N 2.84Å; I346-D348 VanDerWaalsContact C-N 3.35Å; D348-K350 VanDerWaalsContact C-N 3.29Å; D348-K350 PolarHBondContact O-N 3.33Å; D348-F351 PolarHBondContact O-N 3.05Å; D348-C352 PolarHBondContact O-N 3.37Å
349	L	94.4	Very high	91.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.3	-41.2	178.4	179.6	59.8	0	0	0	111.1	V325 R328 L332 A345 I346 C352 L353 L362 L398	V325-L349 HydrophobicContact CB-CD1 4.39Å; V325-L349 HydrophobicContact CG1-CD1 4.26Å; V325-L349 HydrophobicContact CG2-CD1 4.09Å; R328-L349 HydrophobicContact CB-CD1 3.81Å; R328-L349 HydrophobicContact CB-CD2 4.39Å; L332-L349 HydrophobicContact CD1-CD2 3.9Å; A345-L349 WeakPolarHBondContact O-CB 3.18Å; A345-L349 PolarHBondContact O-N 3.34Å; I346-L349 PolarHBondContact O-N 2.86Å; L349-C352 PolarHBondContact O-N 3.29Å; L349-L353 HydrophobicContact CD1-CD1 3.3Å; L349-L353 HydrophobicContact CD2-CD1 4.49Å; L349-L353 HydrophobicContact CG-CD1 3.67Å; L349-L353 VanDerWaalsContact O-CB 3.31Å; L349-L353 WeakPolarHBondContact O-CB 3.48Å; L349-L353 WeakPolarHBondContact O-CD1 3.47Å; L349-L353 PolarHBondContact O-N 3.1Å; L349-L362 HydrophobicContact CD2-CD1 4.26Å; L349-L398 HydrophobicContact CB-CD1 4.26Å; L349-L398 HydrophobicContact CD2-CD1 4.08Å; L349-L398 HydrophobicContact CD2-CD2 4.4Å; L349-L398 HydrophobicContact CG-CD1 3.89Å
350	K	93.3	Very high	91.4	Very high	55 Å²	55	58.2 Å²	58.2	24%	0.239	28%	0.281	C	S	.	.	H	α-helix	trans	-59.1	-51.6	174.8	178.9	-178.1	-172.4	165.3	0	111.5	I346 D347 D348 C352 L353 E354 E397 L398	I346-K350 WeakPolarHBondContact O-CB 3.29Å; I346-K350 PolarHBondContact O-N 2.99Å; D347-K350 WeakPolarHBondContact O-CB 3.49Å; D347-K350 PolarHBondContact O-N 3.41Å; D348-K350 VanDerWaalsContact C-N 3.29Å; D348-K350 PolarHBondContact O-N 3.33Å; K350-C352 VanDerWaalsContact C-N 3.28Å; K350-C352 PolarHBondContact O-N 3.31Å; K350-L353 PolarHBondContact O-N 3.43Å; K350-L353 VanDerWaalsContact O-N 3.16Å; K350-E354 PolarHBondContact O-N 2.88Å; K350-E354 VanDerWaalsContact O-N 3.11Å; K350-E397 WeakPolarHBondContact CD-O 3.42Å; K350-E397 PolarHBondContact NZ-O 2.82Å; K350-L398 HydrophobicContact CB-CD1 4.02Å
351	F	91.9	Very high	91.5	Very high	66 Å²	66	58.3 Å²	58.3	29%	0.289	27%	0.274	S	S	.	.	H	α-helix	trans	-57.8	-40.8	178.7	176.1	-88	0	0	0	112.5	L259 D347 D348 R355	L259-F351 HydrophobicContact CD1-CB 3.87Å; L259-F351 HydrophobicContact CD1-CD1 3.55Å; L259-F351 HydrophobicContact CD1-CD2 4.49Å; L259-F351 HydrophobicContact CD1-CE1 4.2Å; L259-F351 HydrophobicContact CD1-CG 3.73Å; L259-F351 HydrophobicContact CD2-CD1 4.05Å; L259-F351 HydrophobicContact CD2-CE1 4.39Å; L259-F351 HydrophobicContact CG-CD1 4.47Å; D347-F351 PolarHBondContact O-N 3.45Å; D348-F351 PolarHBondContact O-N 3.05Å; F351-R355 VanDerWaalsContact CE2-NH2 3.3Å; F351-R355 VanDerWaalsContact CZ-NH1 3.35Å; F351-R355 PolarHBondContact O-NH1 2.84Å
352	C	92.1	Very high	91.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-76.8	-32.2	177.6	-69.2	0	0	0	0	112.9	C321 Y324 V325 D348 L349 K350 R355 T356	C321-C352 HydrophobicContact CB-CB 4.18Å; Y324-C352 HydrophobicContact CD1-CB 4.41Å; V325-C352 HydrophobicContact CG2-CB 3.43Å; V325-C352 VanDerWaalsContact CG2-CB 3.43Å; D348-C352 PolarHBondContact O-N 3.37Å; L349-C352 PolarHBondContact O-N 3.29Å; K350-C352 VanDerWaalsContact C-N 3.28Å; K350-C352 PolarHBondContact O-N 3.31Å; C352-R355 PolarHBondContact O-N 2.81Å; C352-T356 WeakPolarHBondContact O-CB 3.16Å; C352-T356 VanDerWaalsContact O-CG2 3.25Å; C352-T356 WeakPolarHBondContact O-CG2 3.49Å; C352-T356 PolarHBondContact O-N 3.33Å; C352-T356 VanDerWaalsContact O-N 3.14Å; C352-T356 PolarHBondContact O-OG1 2.83Å
353	L	90	Very high	91.5	Very high	22 Å²	22	52 Å²	52	12%	0.115	25%	0.245	C	C	.	.	H	α-helix	trans	-66	-37.4	176.5	-114.7	92.8	0	0	0	112.1	V325 L349 K350 R355 T356 R359 L362	V325-L353 HydrophobicContact CG1-CD1 3.79Å; V325-L353 HydrophobicContact CG2-CD1 4.09Å; L349-L353 HydrophobicContact CD1-CD1 3.3Å; L349-L353 HydrophobicContact CD2-CD1 4.49Å; L349-L353 HydrophobicContact CG-CD1 3.67Å; L349-L353 VanDerWaalsContact O-CB 3.31Å; L349-L353 WeakPolarHBondContact O-CB 3.48Å; L349-L353 WeakPolarHBondContact O-CD1 3.47Å; L349-L353 PolarHBondContact O-N 3.1Å; K350-L353 PolarHBondContact O-N 3.43Å; K350-L353 VanDerWaalsContact O-N 3.16Å; L353-R355 PolarHBondContact O-N 2.71Å; L353-T356 WeakPolarHBondContact CA-OG1 3.48Å; L353-T356 CarbonylContact O-C 3.59Å; L353-T356 PolarHBondContact O-N 3.08Å; L353-R359 HydrophobicContact CD2-CB 4.34Å; L353-L362 HydrophobicContact CD1-CD1 3.87Å; L353-L362 HydrophobicContact CD2-CD1 3.96Å
354	E	87.1	Confident	91.4	Very high	144 Å²	144	52 Å²	52	67%	0.673	25%	0.251	S	S	*	.	H	α-helix	trans	-62.8	-27.2	176.8	-70.9	174.5	178.7	0	0	112.6	K350	K350-E354 PolarHBondContact O-N 2.88Å; K350-E354 VanDerWaalsContact O-N 3.11Å
355	R	87.3	Confident	91.5	Very high	132 Å²	132	52.1 Å²	52.1	50%	0.498	25%	0.253	S	S	.	.	H	α-helix	trans	-94.3	-7.5	-179.6	-67.4	173.5	172.1	70.6	2.8	113.1	F351 C352 L353	F351-R355 VanDerWaalsContact CE2-NH2 3.3Å; F351-R355 VanDerWaalsContact CZ-NH1 3.35Å; F351-R355 PolarHBondContact O-NH1 2.84Å; C352-R355 PolarHBondContact O-N 2.81Å; L353-R355 PolarHBondContact O-N 2.71Å
356	T	84.9	Confident	91.5	Very high	17 Å²	17	52.2 Å²	52.2	10%	0.104	25%	0.253	C	S	.	.	S	Bend	trans	-123.5	142.1	-177.1	60.3	0	0	0	0	110.8	C321 V325 C352 L353 Q358	C321-T356 HydrophobicContact CB-CG2 3.87Å; V325-T356 HydrophobicContact CG2-CG2 4.27Å; C352-T356 WeakPolarHBondContact O-CB 3.16Å; C352-T356 VanDerWaalsContact O-CG2 3.25Å; C352-T356 WeakPolarHBondContact O-CG2 3.49Å; C352-T356 PolarHBondContact O-N 3.33Å; C352-T356 VanDerWaalsContact O-N 3.14Å; C352-T356 PolarHBondContact O-OG1 2.83Å; L353-T356 WeakPolarHBondContact CA-OG1 3.48Å; L353-T356 CarbonylContact O-C 3.59Å; L353-T356 PolarHBondContact O-N 3.08Å; T356-Q358 PolarHBondContact O-N 2.76Å; T356-Q358 VanDerWaalsContact O-N 3.08Å
357	N	84.4	Confident	91.4	Very high	166 Å²	166	54.9 Å²	54.9	89%	0.888	27%	0.265	S	S	*	.	S	Bend	trans	-86	41	177.7	-77	-46.7	0	0	0	112.5
358	Q	88.3	Confident	91.5	Very high	23 Å²	23	55.6 Å²	55.6	11%	0.107	27%	0.271	C	S	.	.			trans	-106.6	8	-167.3	-66	-177	-87.1	0	0	115.6	R322 V325 N326 T356 Q360 Q361 L362	R322-Q358 PolarHBondContact O-OE1 2.88Å; V325-Q358 HydrophobicContact CG1-CB 3.98Å; N326-Q358 PolarHBondContact OD1-NE2 3.25Å; T356-Q358 PolarHBondContact O-N 2.76Å; T356-Q358 VanDerWaalsContact O-N 3.08Å; Q358-Q360 VanDerWaalsContact C-N 3.28Å; Q358-Q360 PolarHBondContact O-N 3.4Å; Q358-Q361 WeakPolarHBondContact O-CB 3.49Å; Q358-Q361 PolarHBondContact O-N 2.7Å; Q358-L362 PolarHBondContact O-N 2.87Å; Q358-L362 VanDerWaalsContact O-N 3.11Å
359	R	90	Very high	91.6	Very high	63 Å²	63	56.2 Å²	56.2	24%	0.238	28%	0.277	C	S	.	.	H	α-helix	trans	-52.3	-39.1	179.1	-172.5	170.6	169.1	137.8	1.5	114.1	L353 L362 L363 D399 I404 D473	L353-R359 HydrophobicContact CD2-CB 4.34Å; R359-L362 WeakPolarHBondContact O-CB 3.49Å; R359-L362 PolarHBondContact O-N 2.99Å; R359-L363 WeakPolarHBondContact O-CG 3.41Å; R359-L363 PolarHBondContact O-N 3.45Å; R359-L363 VanDerWaalsContact O-N 3.09Å; R359-D399 IonicContact CZ-OD2 3.89Å; R359-D399 IonicContact NH1-OD1 3.23Å; R359-D399 IonicContact NH1-OD2 2.77Å; R359-D399 IonicContact NH2-OD2 2.67Å; R359-D399 PolarHBondContact NH2-OD2 2.83Å; R359-I404 HydrophobicContact CG-CD1 4Å; R359-I404 HydrophobicContact CG-CG1 4.29Å; R359-D473 IonicContact CZ-OD1 2.99Å; R359-D473 IonicContact CZ-OD2 2.74Å; R359-D473 VanDerWaalsContact CZ-OD2 3.23Å; R359-D473 IonicContact NE-OD1 3.97Å; R359-D473 PolarHBondContact NE-OD1 3.07Å; R359-D473 IonicContact NE-OD2 3.76Å; R359-D473 PolarHBondContact NE-OD2 3.47Å; R359-D473 IonicContact NH2-OD1 2.81Å; R359-D473 IonicContact NH2-OD2 2.65Å; R359-D473 PolarHBondContact NH2-OD2 3.35Å
360	Q	90	Very high	91.6	Very high	124 Å²	124	56.2 Å²	56.2	58%	0.579	28%	0.277	S	S	*	.	H	α-helix	trans	-69.1	-35.9	178.5	-172.5	62.8	22.4	0	0	113.1	Q358 L363 T364	Q358-Q360 VanDerWaalsContact C-N 3.28Å; Q358-Q360 PolarHBondContact O-N 3.4Å; Q360-L363 PolarHBondContact O-N 2.7Å; Q360-T364 PolarHBondContact O-N 3.02Å; Q360-T364 PolarHBondContact O-OG1 3.21Å
361	Q	92.9	Very high	91.6	Very high	92 Å²	92	57.8 Å²	57.8	43%	0.43	29%	0.288	S	S	.	.	H	α-helix	trans	-66.2	-42.8	176.2	-175.2	-174.9	-10.1	0	0	110	N326 I329 Q358 L363 T364 S365	N326-Q361 PolarHBondContact OD1-NE2 2.84Å; N326-Q361 PolarHBondContact OD1-OE1 3.14Å; I329-Q361 HydrophobicContact CD1-CB 4.49Å; I329-Q361 HydrophobicContact CD1-CG 4.43Å; Q358-Q361 WeakPolarHBondContact O-CB 3.49Å; Q358-Q361 PolarHBondContact O-N 2.7Å; Q361-L363 PolarHBondContact O-N 2.98Å; Q361-T364 PolarHBondContact O-N 3.36Å; Q361-S365 WeakPolarHBondContact O-CB 3.18Å; Q361-S365 PolarHBondContact O-N 3.25Å
362	L	94.4	Very high	91.7	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-56	-51.1	173.6	-175.3	154.1	0	0	0	111.2	I329 L332 L349 L353 Q358 R359 T364 S365 L366 L398 I404	I329-L362 HydrophobicContact CD1-CB 3.8Å; I329-L362 HydrophobicContact CG1-CB 3.87Å; I329-L362 HydrophobicContact CG1-CD1 4.14Å; I329-L362 HydrophobicContact CG1-CG 4.07Å; L332-L362 HydrophobicContact CD2-CD1 3.93Å; L332-L362 HydrophobicContact CD2-CD2 3.81Å; L332-L362 HydrophobicContact CD2-CG 3.69Å; L349-L362 HydrophobicContact CD2-CD1 4.26Å; L353-L362 HydrophobicContact CD1-CD1 3.87Å; L353-L362 HydrophobicContact CD2-CD1 3.96Å; Q358-L362 PolarHBondContact O-N 2.87Å; Q358-L362 VanDerWaalsContact O-N 3.11Å; R359-L362 WeakPolarHBondContact O-CB 3.49Å; R359-L362 PolarHBondContact O-N 2.99Å; L362-T364 VanDerWaalsContact C-N 3.32Å; L362-T364 PolarHBondContact O-N 2.83Å; L362-S365 PolarHBondContact O-N 2.93Å; L362-L366 HydrophobicContact CD2-CD2 4.45Å; L362-L366 VanDerWaalsContact O-CB 3.23Å; L362-L366 WeakPolarHBondContact O-CB 3.31Å; L362-L366 PolarHBondContact O-N 3.46Å; L362-L398 HydrophobicContact CD1-CD2 4Å; L362-I404 HydrophobicContact CD2-CG2 3.91Å
363	L	92.5	Very high	91.9	Very high	4 Å²	4	64 Å²	64	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-59.1	-42.1	179.3	-74.5	172.7	0	0	0	112.9	R359 Q360 Q361 K367 I404 V407 A408	R359-L363 WeakPolarHBondContact O-CG 3.41Å; R359-L363 PolarHBondContact O-N 3.45Å; R359-L363 VanDerWaalsContact O-N 3.09Å; Q360-L363 PolarHBondContact O-N 2.7Å; Q361-L363 PolarHBondContact O-N 2.98Å; L363-K367 WeakPolarHBondContact O-CB 3.48Å; L363-K367 VanDerWaalsContact O-CG 3.25Å; L363-K367 WeakPolarHBondContact O-CG 3.47Å; L363-K367 PolarHBondContact O-N 3.07Å; L363-K367 VanDerWaalsContact O-N 3.11Å; L363-I404 HydrophobicContact CD2-CB 4.35Å; L363-I404 HydrophobicContact CD2-CG2 3.89Å; L363-V407 HydrophobicContact CD1-CG1 4.18Å; L363-V407 HydrophobicContact CD2-CB 4.03Å; L363-V407 HydrophobicContact CD2-CG1 4.03Å; L363-A408 HydrophobicContact CD2-CB 4.13Å
364	T	93.6	Very high	92.1	Very high	75 Å²	75	63.2 Å²	63.2	46%	0.46	32%	0.316	S	S	.	.	H	α-helix	trans	-70.2	-44.9	-178.3	-52.4	0	0	0	0	111.1	Q360 Q361 L362 T368	Q360-T364 PolarHBondContact O-N 3.02Å; Q360-T364 PolarHBondContact O-OG1 3.21Å; Q361-T364 PolarHBondContact O-N 3.36Å; L362-T364 VanDerWaalsContact C-N 3.32Å; L362-T364 PolarHBondContact O-N 2.83Å; T364-T368 PolarHBondContact O-N 3.47Å; T364-T368 VanDerWaalsContact O-N 3.15Å; T364-T368 PolarHBondContact O-OG1 3.17Å
365	S	95.8	Very high	92.4	Very high	41 Å²	41	57.3 Å²	57.3	29%	0.287	29%	0.289	S	S	.	.	H	α-helix	trans	-62.3	-48.7	176.8	-174.2	0	0	0	0	111.3	Q361 L362 K367 T368 A369	Q361-S365 WeakPolarHBondContact O-CB 3.18Å; Q361-S365 PolarHBondContact O-N 3.25Å; L362-S365 PolarHBondContact O-N 2.93Å; S365-K367 PolarHBondContact O-N 3.06Å; S365-T368 WeakPolarHBondContact O-CB 3.4Å; S365-T368 PolarHBondContact O-N 3.25Å; S365-T368 VanDerWaalsContact O-N 3.16Å; S365-A369 PolarHBondContact O-N 2.81Å
366	L	95.5	Very high	92.7	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-65	-40.9	-177	-175.1	59.8	0	0	0	112.6	L332 I336 L362 T368 A369 F370 L395 A408	L332-L366 HydrophobicContact CD2-CB 4.35Å; L332-L366 HydrophobicContact CD2-CD1 4.14Å; L332-L366 HydrophobicContact CD2-CD2 3.93Å; L332-L366 HydrophobicContact CD2-CG 4.37Å; L332-L366 HydrophobicContact CG-CD1 4.17Å; I336-L366 HydrophobicContact CD1-CD1 3.82Å; I336-L366 HydrophobicContact CD1-CD2 4.17Å; L362-L366 HydrophobicContact CD2-CD2 4.45Å; L362-L366 VanDerWaalsContact O-CB 3.23Å; L362-L366 WeakPolarHBondContact O-CB 3.31Å; L362-L366 PolarHBondContact O-N 3.46Å; L366-T368 VanDerWaalsContact C-N 3.34Å; L366-T368 PolarHBondContact O-N 3.44Å; L366-A369 PolarHBondContact O-N 3.35Å; L366-F370 HydrophobicContact CD1-CD2 4.41Å; L366-F370 HydrophobicContact CD1-CE1 4.17Å; L366-F370 HydrophobicContact CD1-CE2 3.86Å; L366-F370 HydrophobicContact CD1-CZ 3.72Å; L366-F370 HydrophobicContact CD2-CE2 3.99Å; L366-F370 HydrophobicContact CD2-CZ 4.27Å; L366-F370 HydrophobicContact CG-CD2 4.11Å; L366-F370 HydrophobicContact CG-CE2 3.59Å; L366-F370 HydrophobicContact CG-CZ 3.96Å; L366-F370 WeakPolarHBondContact O-CD2 3.08Å; L366-F370 PolarHBondContact O-N 2.93Å; L366-L395 HydrophobicContact CD2-CD1 4.16Å; L366-L395 HydrophobicContact CD2-CD2 4.1Å; L366-A408 HydrophobicContact CD2-CB 3.74Å; L366-A408 HydrophobicContact CG-CB 4.33Å
367	K	94.1	Very high	93	Very high	60 Å²	60	59.4 Å²	59.4	26%	0.261	31%	0.313	S	S	.	.	H	α-helix	trans	-58.4	-47.2	172.3	-78.1	176.9	175.4	-174	0	111.6	L363 S365 A369 F370 D371 V407	L363-K367 WeakPolarHBondContact O-CB 3.48Å; L363-K367 VanDerWaalsContact O-CG 3.25Å; L363-K367 WeakPolarHBondContact O-CG 3.47Å; L363-K367 PolarHBondContact O-N 3.07Å; L363-K367 VanDerWaalsContact O-N 3.11Å; S365-K367 PolarHBondContact O-N 3.06Å; K367-A369 VanDerWaalsContact C-N 3.29Å; K367-A369 PolarHBondContact O-N 2.9Å; K367-F370 PolarHBondContact O-N 3.49Å; K367-D371 PolarHBondContact O-N 2.89Å; K367-V407 WeakPolarHBondContact CE-O 3.36Å; K367-V407 VanDerWaalsContact NZ-CG1 3.3Å; K367-V407 PolarHBondContact NZ-O 3.18Å
368	T	95.4	Very high	93.3	Very high	77 Å²	77	54.8 Å²	54.8	47%	0.472	30%	0.304	S	S	.	.	H	α-helix	trans	-61.7	-39.4	178.1	-51.6	0	0	0	0	111.1	T364 S365 L366 D371 T372	T364-T368 PolarHBondContact O-N 3.47Å; T364-T368 VanDerWaalsContact O-N 3.15Å; T364-T368 PolarHBondContact O-OG1 3.17Å; S365-T368 WeakPolarHBondContact O-CB 3.4Å; S365-T368 PolarHBondContact O-N 3.25Å; S365-T368 VanDerWaalsContact O-N 3.16Å; L366-T368 VanDerWaalsContact C-N 3.34Å; L366-T368 PolarHBondContact O-N 3.44Å; T368-D371 PolarHBondContact O-N 2.94Å; T368-T372 HydrophobicContact CG2-CG2 4.35Å; T368-T372 WeakPolarHBondContact O-CB 3.34Å; T368-T372 VanDerWaalsContact O-CG2 3.3Å; T368-T372 WeakPolarHBondContact O-CG2 3.35Å; T368-T372 PolarHBondContact O-N 3.06Å; T368-T372 PolarHBondContact O-OG1 3.27Å
369	A	95.2	Very high	93.5	Very high	18 Å²	18	54.7 Å²	54.7	15%	0.149	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-42.6	176.2	0	0	0	0	0	112.3	F333 S365 L366 K367 T372 R373	F333-A369 HydrophobicContact CB-CB 4.09Å; F333-A369 HydrophobicContact CD2-CB 4.37Å; S365-A369 PolarHBondContact O-N 2.81Å; L366-A369 PolarHBondContact O-N 3.35Å; K367-A369 VanDerWaalsContact C-N 3.29Å; K367-A369 PolarHBondContact O-N 2.9Å; A369-T372 PolarHBondContact O-OG1 2.91Å; A369-R373 VanDerWaalsContact O-CB 3.28Å; A369-R373 WeakPolarHBondContact O-CB 3.32Å; A369-R373 PolarHBondContact O-N 2.88Å
370	F	95.3	Very high	93.6	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63	-46.9	174.5	-69.9	-39.9	0	0	0	112	F333 I336 L366 K367 T372 L374 L375 V387 A391 A408 I412	F333-F370 AromaticContact CD2-CD1 3.83Å; F333-F370 HydrophobicContact CD2-CD1 3.83Å; F333-F370 AromaticContact CD2-CE1 3.96Å; F333-F370 HydrophobicContact CD2-CE1 3.96Å; F333-F370 AromaticContact CE2-CD1 3.89Å; F333-F370 HydrophobicContact CE2-CD1 3.89Å; F333-F370 HydrophobicContact CE2-CE1 4.19Å; I336-F370 HydrophobicContact CD1-CZ 4.35Å; L366-F370 HydrophobicContact CD1-CD2 4.41Å; L366-F370 HydrophobicContact CD1-CE1 4.17Å; L366-F370 HydrophobicContact CD1-CE2 3.86Å; L366-F370 HydrophobicContact CD1-CZ 3.72Å; L366-F370 HydrophobicContact CD2-CE2 3.99Å; L366-F370 HydrophobicContact CD2-CZ 4.27Å; L366-F370 HydrophobicContact CG-CD2 4.11Å; L366-F370 HydrophobicContact CG-CE2 3.59Å; L366-F370 HydrophobicContact CG-CZ 3.96Å; L366-F370 WeakPolarHBondContact O-CD2 3.08Å; L366-F370 PolarHBondContact O-N 2.93Å; K367-F370 PolarHBondContact O-N 3.49Å; F370-T372 VanDerWaalsContact C-N 3.32Å; F370-T372 PolarHBondContact O-N 3.4Å; F370-L374 HydrophobicContact CD1-CD2 4.07Å; F370-L374 WeakPolarHBondContact O-CB 3.36Å; F370-L374 PolarHBondContact O-N 3.37Å; F370-L375 HydrophobicContact CB-CD1 4.32Å; F370-L375 WeakPolarHBondContact O-CG 2.95Å; F370-L375 PolarHBondContact O-N 2.92Å; F370-V387 HydrophobicContact CE1-CG1 4.47Å; F370-A391 HydrophobicContact CZ-CB 4.3Å; F370-A408 HydrophobicContact CE2-CB 4.44Å; F370-I412 HydrophobicContact CB-CG1 4.47Å; F370-I412 HydrophobicContact CD1-CD1 4.02Å; F370-I412 HydrophobicContact CD2-CD1 3.85Å; F370-I412 HydrophobicContact CD2-CG1 4.22Å; F370-I412 HydrophobicContact CE1-CD1 4.02Å; F370-I412 HydrophobicContact CE2-CD1 3.82Å; F370-I412 HydrophobicContact CG-CD1 3.96Å; F370-I412 HydrophobicContact CG-CG1 4.23Å; F370-I412 HydrophobicContact CZ-CD1 3.92Å
371	D	94.1	Very high	93.7	Very high	88 Å²	88	52.3 Å²	52.3	47%	0.471	30%	0.297	S	S	.	.	H	α-helix	trans	-62.2	-38.4	-180	-72	-25.8	0	0	0	112.3	K367 T368	K367-D371 PolarHBondContact O-N 2.89Å; T368-D371 PolarHBondContact O-N 2.94Å
372	T	93.9	Very high	93.5	Very high	92 Å²	92	49.9 Å²	49.9	56%	0.564	29%	0.29	S	S	*	.	H	α-helix	trans	-85.5	-35.4	-175.7	53.1	0	0	0	0	114.2	T368 A369 F370	T368-T372 HydrophobicContact CG2-CG2 4.35Å; T368-T372 WeakPolarHBondContact O-CB 3.34Å; T368-T372 VanDerWaalsContact O-CG2 3.3Å; T368-T372 WeakPolarHBondContact O-CG2 3.35Å; T368-T372 PolarHBondContact O-N 3.06Å; T368-T372 PolarHBondContact O-OG1 3.27Å; A369-T372 PolarHBondContact O-OG1 2.91Å; F370-T372 VanDerWaalsContact C-N 3.32Å; F370-T372 PolarHBondContact O-N 3.4Å
373	R	94.8	Very high	93.3	Very high	105 Å²	105	53.5 Å²	53.5	40%	0.396	31%	0.31	S	S	.	.	H	α-helix	trans	-107.4	-18.3	-170.5	-59.6	175.3	64.4	-178.6	-3	114.8	F333 A369	F333-R373 VanDerWaalsContact CD1-NH1 3.32Å; F333-R373 VanDerWaalsContact CD1-NH2 3.33Å; F333-R373 HydrophobicContact CE1-CB 4.31Å; F333-R373 HydrophobicContact CE2-CB 4.23Å; F333-R373 HydrophobicContact CZ-CB 4.02Å; A369-R373 VanDerWaalsContact O-CB 3.28Å; A369-R373 WeakPolarHBondContact O-CB 3.32Å; A369-R373 PolarHBondContact O-N 2.88Å
374	L	94.9	Very high	93.3	Very high	5 Å²	5	53.3 Å²	53.3	3%	0.026	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	-44.1	-172.4	-170.4	70.4	0	0	0	113	F333 F370 H376 V379 I384 V387 I412	F333-L374 HydrophobicContact CE2-CB 4.05Å; F333-L374 HydrophobicContact CZ-CB 4.39Å; F370-L374 HydrophobicContact CD1-CD2 4.07Å; F370-L374 WeakPolarHBondContact O-CB 3.36Å; F370-L374 PolarHBondContact O-N 3.37Å; L374-H376 VanDerWaalsContact C-N 3.26Å; L374-H376 PolarHBondContact O-N 3.48Å; L374-V379 HydrophobicContact CD1-CG1 4.47Å; L374-V379 WeakPolarHBondContact O-CG2 3.34Å; L374-I384 HydrophobicContact CD1-CG1 4.14Å; L374-I384 HydrophobicContact CD2-CG2 4.24Å; L374-I384 HydrophobicContact CG-CG1 4.22Å; L374-I384 HydrophobicContact CG-CG2 4.31Å; L374-V387 HydrophobicContact CD1-CB 4.09Å; L374-V387 HydrophobicContact CD1-CG1 4.26Å; L374-V387 HydrophobicContact CD1-CG2 4.08Å; L374-V387 HydrophobicContact CD2-CB 4.18Å; L374-V387 HydrophobicContact CD2-CG1 3.83Å; L374-I412 HydrophobicContact CD2-CD1 4.32Å
375	L	94.2	Very high	93.2	Very high	20 Å²	20	49.8 Å²	49.8	11%	0.105	29%	0.287	C	S	.	.	S	Bend	trans	-90.5	52	-168.8	-55.5	-178.9	0	0	0	112.8	F370 I384 P411 I412 Y415	F370-L375 HydrophobicContact CB-CD1 4.32Å; F370-L375 WeakPolarHBondContact O-CG 2.95Å; F370-L375 PolarHBondContact O-N 2.92Å; L375-I384 HydrophobicContact CD2-CG2 4.34Å; L375-P411 HydrophobicContact CD1-CB 3.75Å; L375-P411 HydrophobicContact CD1-CG 4.41Å; L375-I412 HydrophobicContact CD1-CG1 4.34Å; L375-I412 HydrophobicContact CD2-CB 4.46Å; L375-I412 HydrophobicContact CD2-CG1 4.23Å; L375-Y415 HydrophobicContact CB-CD1 4.47Å; L375-Y415 HydrophobicContact CB-CD2 4.25Å; L375-Y415 HydrophobicContact CB-CG 4.22Å; L375-Y415 HydrophobicContact CD2-CD1 3.78Å; L375-Y415 HydrophobicContact CD2-CG 3.9Å
376	H	91.9	Very high	92.9	Very high	74 Å²	74	50.1 Å²	50.1	34%	0.343	29%	0.288	S	S	.	.	S	Bend	trans	-126.7	154.6	175	60	71.9	0	0	0	112.1	L374 G378 V379 Y415	L374-H376 VanDerWaalsContact C-N 3.26Å; L374-H376 PolarHBondContact O-N 3.48Å; H376-G378 PolarHBondContact ND1-N 2.9Å; H376-G378 PolarHBondContact O-N 3.4Å; H376-V379 WeakPolarHBondContact CE1-CG2 3.16Å; H376-V379 WeakPolarHBondContact ND1-CG2 3.33Å; H376-V379 PolarHBondContact O-N 3.33Å; H376-V379 VanDerWaalsContact O-N 3.16Å; H376-Y415 PolarHBondContact O-OH 3.14Å
377	P	91.5	Very high	92.8	Very high	119 Å²	119	50.9 Å²	50.9	77%	0.773	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.7	-174	-27.5	36.2	0	0	0	115.3	V379	P377-V379 VanDerWaalsContact C-N 3.29Å; P377-V379 PolarHBondContact O-N 2.83Å
378	G	90.8	Very high	92.7	Very high	68 Å²	68	48 Å²	48	70%	0.701	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-7.1	178.1	0	0	0	0	0	116.2	H376	H376-G378 PolarHBondContact ND1-N 2.9Å; H376-G378 PolarHBondContact O-N 3.4Å
379	V	93.5	Very high	92.4	Very high	22 Å²	22	44.4 Å²	44.4	13%	0.133	26%	0.258	C	S	.	.	S	Bend	trans	-96.2	136.9	177.4	-170.2	0	0	0	0	110.6	L374 H376 P377 D383 I384 R419	L374-V379 HydrophobicContact CD1-CG1 4.47Å; L374-V379 WeakPolarHBondContact O-CG2 3.34Å; H376-V379 WeakPolarHBondContact CE1-CG2 3.16Å; H376-V379 WeakPolarHBondContact ND1-CG2 3.33Å; H376-V379 PolarHBondContact O-N 3.33Å; H376-V379 VanDerWaalsContact O-N 3.16Å; P377-V379 VanDerWaalsContact C-N 3.29Å; P377-V379 PolarHBondContact O-N 2.83Å; V379-D383 HydrophobicContact CG1-CB 3.84Å; V379-I384 HydrophobicContact CB-CD1 4.29Å; V379-I384 HydrophobicContact CB-CG1 4.17Å; V379-I384 HydrophobicContact CG1-CD1 4.42Å; V379-I384 HydrophobicContact CG1-CG1 3.76Å; V379-R419 PolarHBondContact O-NH1 3.28Å
380	H	91.3	Very high	92.2	Very high	131 Å²	131	44 Å²	44	61%	0.606	25%	0.253	S	S	*	.			trans	-66.5	147.9	174.3	-64.5	-76.6	0	0	0	111.8	S382 D383 I384	H380-S382 VanDerWaalsContact C-N 3.25Å; H380-S382 PolarHBondContact O-N 3.04Å; H380-D383 IonicContact CD2-OD2 3.85Å; H380-D383 PolarHBondContact O-N 3.11Å; H380-I384 WeakPolarHBondContact O-CG1 3.19Å; H380-I384 PolarHBondContact O-N 2.99Å
381	T	91.6	Very high	92.1	Very high	5 Å²	5	44 Å²	44	3%	0.031	25%	0.253	C	S	.	.	H	α-helix	trans	-60.7	-38	-179	-43.6	0	0	0	0	111.9	D383 I384 I385 R419 D421 T422 Q425	T381-D383 VanDerWaalsContact C-N 3.35Å; T381-D383 PolarHBondContact O-N 3.41Å; T381-I384 PolarHBondContact O-N 3.36Å; T381-I385 HydrophobicContact CG2-CD1 4.02Å; T381-I385 VanDerWaalsContact O-CG1 3.31Å; T381-I385 WeakPolarHBondContact O-CG1 3.46Å; T381-I385 PolarHBondContact O-N 3.4Å; T381-R419 PolarHBondContact OG1-NE 3.35Å; T381-R419 PolarHBondContact OG1-NH2 3.45Å; T381-D421 WeakPolarHBondContact CB-OD2 3.47Å; T381-D421 VanDerWaalsContact OG1-CG 3.24Å; T381-D421 PolarHBondContact OG1-OD1 3.49Å; T381-D421 PolarHBondContact OG1-OD2 3.18Å; T381-T422 HydrophobicContact CG2-CG2 4.29Å; T381-Q425 HydrophobicContact CG2-CB 4.49Å; T381-Q425 HydrophobicContact CG2-CG 4.35Å
382	S	88.8	Confident	92	Very high	41 Å²	41	39.8 Å²	39.8	29%	0.287	23%	0.231	S	C	.	.	H	α-helix	trans	-53.6	-49.5	175.2	50.1	0	0	0	0	111.6	H380 I384 I385 T386	H380-S382 VanDerWaalsContact C-N 3.25Å; H380-S382 PolarHBondContact O-N 3.04Å; S382-I384 VanDerWaalsContact C-N 3.35Å; S382-I384 PolarHBondContact O-N 3.03Å; S382-I385 PolarHBondContact O-N 3.45Å; S382-T386 PolarHBondContact O-N 3.09Å; S382-T386 PolarHBondContact O-OG1 3.41Å
383	D	90.6	Very high	91.8	Very high	76 Å²	76	37.3 Å²	37.3	41%	0.406	21%	0.212	S	C	.	.	H	α-helix	trans	-67.4	-37.6	-175.9	-53.6	-25.9	0	0	0	111.5	V379 H380 T381 I385 T386 V387	V379-D383 HydrophobicContact CG1-CB 3.84Å; H380-D383 IonicContact CD2-OD2 3.85Å; H380-D383 PolarHBondContact O-N 3.11Å; T381-D383 VanDerWaalsContact C-N 3.35Å; T381-D383 PolarHBondContact O-N 3.41Å; D383-I385 VanDerWaalsContact C-N 3.34Å; D383-T386 PolarHBondContact O-N 3.36Å; D383-V387 WeakPolarHBondContact O-CG2 3.32Å; D383-V387 PolarHBondContact O-N 3.43Å
384	I	93.2	Very high	91.7	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63.2	-42.9	175.3	-57.5	177.3	0	0	0	110.5	L374 L375 V379 H380 T381 S382 Y388 I412 Y415 L416	L374-I384 HydrophobicContact CD1-CG1 4.14Å; L374-I384 HydrophobicContact CD2-CG2 4.24Å; L374-I384 HydrophobicContact CG-CG1 4.22Å; L374-I384 HydrophobicContact CG-CG2 4.31Å; L375-I384 HydrophobicContact CD2-CG2 4.34Å; V379-I384 HydrophobicContact CB-CD1 4.29Å; V379-I384 HydrophobicContact CB-CG1 4.17Å; V379-I384 HydrophobicContact CG1-CD1 4.42Å; V379-I384 HydrophobicContact CG1-CG1 3.76Å; H380-I384 WeakPolarHBondContact O-CG1 3.19Å; H380-I384 PolarHBondContact O-N 2.99Å; T381-I384 PolarHBondContact O-N 3.36Å; S382-I384 VanDerWaalsContact C-N 3.35Å; S382-I384 PolarHBondContact O-N 3.03Å; I384-Y388 VanDerWaalsContact O-CB 3.26Å; I384-Y388 WeakPolarHBondContact O-CB 3.44Å; I384-Y388 PolarHBondContact O-N 3.12Å; I384-I412 HydrophobicContact CG2-CG2 4.21Å; I384-Y415 HydrophobicContact CD1-CD1 4.03Å; I384-Y415 HydrophobicContact CD1-CE1 3.61Å; I384-L416 HydrophobicContact CB-CD2 4.29Å; I384-L416 HydrophobicContact CG2-CD2 3.74Å; I384-L416 HydrophobicContact CG2-CG 4.23Å
385	I	90.6	Very high	91.6	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-64.9	-45.4	177	-66.1	162.3	0	0	0	110.1	T381 S382 D383 Y388 I389 L416 T422 Q425 I426	T381-I385 HydrophobicContact CG2-CD1 4.02Å; T381-I385 VanDerWaalsContact O-CG1 3.31Å; T381-I385 WeakPolarHBondContact O-CG1 3.46Å; T381-I385 PolarHBondContact O-N 3.4Å; S382-I385 PolarHBondContact O-N 3.45Å; D383-I385 VanDerWaalsContact C-N 3.34Å; I385-Y388 WeakPolarHBondContact O-CB 3.43Å; I385-Y388 PolarHBondContact O-N 2.64Å; I385-Y388 VanDerWaalsContact O-N 3.16Å; I385-I389 HydrophobicContact CG2-CD1 3.85Å; I385-I389 HydrophobicContact CG2-CG1 4.38Å; I385-I389 WeakPolarHBondContact O-CG1 3.42Å; I385-I389 PolarHBondContact O-N 3.25Å; I385-L416 HydrophobicContact CG1-CD2 4.32Å; I385-T422 HydrophobicContact CD1-CG2 4.25Å; I385-Q425 HydrophobicContact CD1-CB 3.82Å; I385-I426 HydrophobicContact CD1-CG1 3.79Å; I385-I426 HydrophobicContact CG1-CG1 4.41Å
386	T	90	Very high	91.3	Very high	48 Å²	48	34.2 Å²	34.2	29%	0.294	20%	0.199	S	C	.	.	H	α-helix	trans	-59.2	-49.8	178.3	-57	0	0	0	0	111.4	S382 D383 Y388 I389 S390	S382-T386 PolarHBondContact O-N 3.09Å; S382-T386 PolarHBondContact O-OG1 3.41Å; D383-T386 PolarHBondContact O-N 3.36Å; T386-Y388 VanDerWaalsContact C-N 3.28Å; T386-Y388 PolarHBondContact O-N 3.49Å; T386-I389 PolarHBondContact O-N 3.27Å; T386-I389 VanDerWaalsContact O-N 3.17Å; T386-S390 PolarHBondContact O-N 3.25Å; T386-S390 PolarHBondContact O-OG 3.03Å
387	V	92.3	Very high	91.3	Very high	17 Å²	17	33.6 Å²	33.6	10%	0.103	20%	0.197	C	C	.	.	H	α-helix	trans	-63.2	-35.7	176.6	174.4	0	0	0	0	111.3	F333 F370 L374 D383 S390 A391	F333-V387 HydrophobicContact CE2-CG1 4.42Å; F370-V387 HydrophobicContact CE1-CG1 4.47Å; L374-V387 HydrophobicContact CD1-CB 4.09Å; L374-V387 HydrophobicContact CD1-CG1 4.26Å; L374-V387 HydrophobicContact CD1-CG2 4.08Å; L374-V387 HydrophobicContact CD2-CB 4.18Å; L374-V387 HydrophobicContact CD2-CG1 3.83Å; D383-V387 WeakPolarHBondContact O-CG2 3.32Å; D383-V387 PolarHBondContact O-N 3.43Å; V387-S390 PolarHBondContact O-N 3.04Å; V387-A391 VanDerWaalsContact O-CB 3.25Å; V387-A391 WeakPolarHBondContact O-CB 3.33Å; V387-A391 PolarHBondContact O-N 3.03Å
388	Y	92.4	Very high	91.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-66.4	-39.3	175.2	-179	-125.4	0	0	0	112.3	I384 I385 T386 A391 I392 C409 I412 R413 L416 L492 I495	I384-Y388 VanDerWaalsContact O-CB 3.26Å; I384-Y388 WeakPolarHBondContact O-CB 3.44Å; I384-Y388 PolarHBondContact O-N 3.12Å; I385-Y388 WeakPolarHBondContact O-CB 3.43Å; I385-Y388 PolarHBondContact O-N 2.64Å; I385-Y388 VanDerWaalsContact O-N 3.16Å; T386-Y388 VanDerWaalsContact C-N 3.28Å; T386-Y388 PolarHBondContact O-N 3.49Å; Y388-A391 PolarHBondContact O-N 3.25Å; Y388-I392 HydrophobicContact CD1-CD1 4.03Å; Y388-I392 HydrophobicContact CD2-CD1 4.41Å; Y388-I392 HydrophobicContact CD2-CG1 4.41Å; Y388-I392 HydrophobicContact CE1-CD1 3.66Å; Y388-I392 HydrophobicContact CE2-CD1 4.06Å; Y388-I392 HydrophobicContact CE2-CG1 4.06Å; Y388-I392 HydrophobicContact CG-CD1 4.4Å; Y388-I392 VanDerWaalsContact O-CG1 3.29Å; Y388-I392 WeakPolarHBondContact O-CG1 3.44Å; Y388-I392 PolarHBondContact O-N 3.24Å; Y388-C409 HydrophobicContact CD2-CB 4.15Å; Y388-C409 HydrophobicContact CE2-CB 3.58Å; Y388-I412 HydrophobicContact CD2-CB 4.4Å; Y388-I412 HydrophobicContact CD2-CD1 4.06Å; Y388-I412 HydrophobicContact CD2-CG2 3.92Å; Y388-I412 HydrophobicContact CG-CG2 4Å; Y388-R413 PolarHBondContact OH-NE 3.4Å; Y388-R413 PolarHBondContact OH-NH2 2.93Å; Y388-L416 HydrophobicContact CD1-CD1 4.4Å; Y388-L492 HydrophobicContact CD1-CD2 3.68Å; Y388-L492 HydrophobicContact CE1-CD2 3.69Å; Y388-L492 HydrophobicContact CE1-CG 4.37Å; Y388-I495 HydrophobicContact CE1-CD1 3.79Å
389	I	89.8	Confident	91.1	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-62.6	-48.3	173.5	-68.6	166.7	0	0	0	110.1	I385 T386 A391 I392 K393 L440 I488 L492	I385-I389 HydrophobicContact CG2-CD1 3.85Å; I385-I389 HydrophobicContact CG2-CG1 4.38Å; I385-I389 WeakPolarHBondContact O-CG1 3.42Å; I385-I389 PolarHBondContact O-N 3.25Å; T386-I389 PolarHBondContact O-N 3.27Å; T386-I389 VanDerWaalsContact O-N 3.17Å; I389-A391 VanDerWaalsContact C-N 3.29Å; I389-A391 PolarHBondContact O-N 3.02Å; I389-I392 WeakPolarHBondContact O-CB 3.47Å; I389-I392 PolarHBondContact O-N 2.99Å; I389-I392 VanDerWaalsContact O-N 3.14Å; I389-K393 HydrophobicContact CG2-CD 4.33Å; I389-K393 WeakPolarHBondContact O-CG 3.23Å; I389-K393 PolarHBondContact O-N 3.33Å; I389-L440 HydrophobicContact CD1-CB 4.3Å; I389-L440 HydrophobicContact CD1-CD1 4.35Å; I389-I488 HydrophobicContact CG1-CG2 4.14Å; I389-I488 HydrophobicContact CG2-CD1 4.37Å; I389-I488 HydrophobicContact CG2-CG2 4.3Å; I389-L492 HydrophobicContact CG1-CD1 4.45Å
390	S	91.4	Very high	90.5	Very high	8 Å²	8	29 Å²	29	6%	0.056	15%	0.153	C	C	.	.	H	α-helix	trans	-61.8	-38.1	176.2	-55.6	0	0	0	0	111.8	I336 T386 V387 I392 K393 A394	I336-S390 WeakPolarHBondContact O-CB 3.25Å; T386-S390 PolarHBondContact O-N 3.25Å; T386-S390 PolarHBondContact O-OG 3.03Å; V387-S390 PolarHBondContact O-N 3.04Å; S390-I392 PolarHBondContact O-N 3.36Å; S390-K393 PolarHBondContact O-N 2.98Å; S390-A394 WeakPolarHBondContact O-CB 3.46Å; S390-A394 PolarHBondContact O-N 2.71Å
391	A	93.7	Very high	90	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.4	-39.5	174.1	0	0	0	0	0	112.2	I336 F370 V387 Y388 I389 L395	I336-A391 VanDerWaalsContact CG2-CA 3.48Å; I336-A391 HydrophobicContact CG2-CB 3.74Å; F370-A391 HydrophobicContact CZ-CB 4.3Å; V387-A391 VanDerWaalsContact O-CB 3.25Å; V387-A391 WeakPolarHBondContact O-CB 3.33Å; V387-A391 PolarHBondContact O-N 3.03Å; Y388-A391 PolarHBondContact O-N 3.25Å; I389-A391 VanDerWaalsContact C-N 3.29Å; I389-A391 PolarHBondContact O-N 3.02Å; A391-L395 HydrophobicContact CB-CD1 4.48Å; A391-L395 WeakPolarHBondContact O-CB 3.36Å; A391-L395 WeakPolarHBondContact O-CG 3.36Å; A391-L395 PolarHBondContact O-N 3.03Å
392	I	90.1	Very high	89.5	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.3	-46.1	175.2	-70.1	163	0	0	0	110.4	Y388 I389 S390 R396 L405 I488 L491	Y388-I392 HydrophobicContact CD1-CD1 4.03Å; Y388-I392 HydrophobicContact CD2-CD1 4.41Å; Y388-I392 HydrophobicContact CD2-CG1 4.41Å; Y388-I392 HydrophobicContact CE1-CD1 3.66Å; Y388-I392 HydrophobicContact CE2-CD1 4.06Å; Y388-I392 HydrophobicContact CE2-CG1 4.06Å; Y388-I392 HydrophobicContact CG-CD1 4.4Å; Y388-I392 VanDerWaalsContact O-CG1 3.29Å; Y388-I392 WeakPolarHBondContact O-CG1 3.44Å; Y388-I392 PolarHBondContact O-N 3.24Å; I389-I392 WeakPolarHBondContact O-CB 3.47Å; I389-I392 PolarHBondContact O-N 2.99Å; I389-I392 VanDerWaalsContact O-N 3.14Å; S390-I392 PolarHBondContact O-N 3.36Å; I392-R396 WeakPolarHBondContact O-CB 3.34Å; I392-R396 PolarHBondContact O-N 3.05Å; I392-L405 HydrophobicContact CB-CD1 4.19Å; I392-L405 HydrophobicContact CG1-CD1 4.22Å; I392-L405 HydrophobicContact CG2-CD1 4.08Å; I392-I488 HydrophobicContact CD1-CG2 4.01Å; I392-I488 HydrophobicContact CG2-CG1 3.9Å; I392-L491 HydrophobicContact CD1-CB 4.14Å; I392-L491 HydrophobicContact CD1-CD1 4.35Å; I392-L491 HydrophobicContact CG1-CD1 4.4Å; I392-L491 HydrophobicContact CG2-CD1 3.77Å
393	K	89.6	Confident	89.4	Confident	40 Å²	40	23.5 Å²	23.5	17%	0.174	13%	0.128	C	C	.	.	H	α-helix	trans	-66.2	-49.2	-179.8	-63.7	174.2	179.9	178.9	0	111.4	F339 I389 S390 E397 D439 I488	F339-K393 HydrophobicContact CD1-CB 3.75Å; F339-K393 HydrophobicContact CD1-CD 4.21Å; F339-K393 HydrophobicContact CE1-CB 3.31Å; F339-K393 HydrophobicContact CE1-CD 3.9Å; F339-K393 HydrophobicContact CE1-CG 4.19Å; F339-K393 HydrophobicContact CZ-CB 3.91Å; I389-K393 HydrophobicContact CG2-CD 4.33Å; I389-K393 WeakPolarHBondContact O-CG 3.23Å; I389-K393 PolarHBondContact O-N 3.33Å; S390-K393 PolarHBondContact O-N 2.98Å; K393-E397 PolarHBondContact O-N 3.35Å; K393-D439 IonicContact NZ-OD2 2.61Å; K393-D439 PolarHBondContact NZ-OD2 3.24Å; K393-I488 HydrophobicContact CD-CD1 4.32Å; K393-I488 HydrophobicContact CG-CD1 3.79Å
394	A	93.6	Very high	89.3	Confident	2 Å²	2	20 Å²	20	2%	0.017	11%	0.109	C	C	.	.	H	α-helix	trans	-65.1	-48.6	-178.8	0	0	0	0	0	113.3	I336 F339 I346 S390 R396 E397 L398	I336-A394 HydrophobicContact CG1-CB 4.01Å; F339-A394 HydrophobicContact CB-CB 4.41Å; F339-A394 HydrophobicContact CD2-CB 3.94Å; F339-A394 HydrophobicContact CE2-CB 4.48Å; F339-A394 HydrophobicContact CG-CB 4.16Å; I346-A394 HydrophobicContact CD1-CB 3.51Å; S390-A394 WeakPolarHBondContact O-CB 3.46Å; S390-A394 PolarHBondContact O-N 2.71Å; A394-R396 VanDerWaalsContact C-N 3.26Å; A394-R396 PolarHBondContact O-N 2.95Å; A394-E397 PolarHBondContact O-N 3.1Å; A394-L398 PolarHBondContact O-N 3.01Å
395	L	92.6	Very high	89.1	Confident	1 Å²	1	20 Å²	20	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-72.5	-20.9	-177	-63.2	176.5	0	0	0	112.8	I336 L366 A391 L398 D399 I404 L405 A408	I336-L395 HydrophobicContact CD1-CD2 4.18Å; I336-L395 HydrophobicContact CD1-CG 4.39Å; L366-L395 HydrophobicContact CD2-CD1 4.16Å; L366-L395 HydrophobicContact CD2-CD2 4.1Å; A391-L395 HydrophobicContact CB-CD1 4.48Å; A391-L395 WeakPolarHBondContact O-CB 3.36Å; A391-L395 WeakPolarHBondContact O-CG 3.36Å; A391-L395 PolarHBondContact O-N 3.03Å; L395-L398 HydrophobicContact CD2-CD2 4.03Å; L395-D399 PolarHBondContact O-N 2.88Å; L395-I404 HydrophobicContact CD2-CG2 4.17Å; L395-L405 HydrophobicContact CB-CB 3.93Å; L395-L405 HydrophobicContact CB-CD1 4.44Å; L395-L405 HydrophobicContact CB-CG 4.34Å; L395-L405 HydrophobicContact CD1-CB 4.25Å; L395-L405 HydrophobicContact CD1-CG 4.5Å; L395-A408 HydrophobicContact CD1-CB 4.44Å
396	R	88.6	Confident	88.8	Confident	62 Å²	62	21.8 Å²	21.8	23%	0.234	12%	0.118	C	C	.	.	H	α-helix	trans	-67.9	-41.3	171.4	179.7	-173	-53.7	-173.7	-1.7	112	I392 A394 L398 D399 M402 S486	I392-R396 WeakPolarHBondContact O-CB 3.34Å; I392-R396 PolarHBondContact O-N 3.05Å; A394-R396 VanDerWaalsContact C-N 3.26Å; A394-R396 PolarHBondContact O-N 2.95Å; R396-L398 VanDerWaalsContact C-N 3.34Å; R396-D399 CarbonylContact O-C 3.59Å; R396-M402 HydrophobicContact CG-CE 3.97Å; R396-S486 PolarHBondContact NH1-O 3.29Å; R396-S486 PolarHBondContact NH2-O 2.92Å
397	E	90.7	Very high	88.7	Confident	62 Å²	62	20.3 Å²	20.3	29%	0.29	11%	0.109	S	C	.	.	H	α-helix	trans	-65.7	-41.9	175.7	-65.7	-74.1	-167.6	0	0	110.6	K343 I346 K350 K393 A394	K343-E397 IonicContact NZ-OE1 3.91Å; K343-E397 PolarHBondContact NZ-OE1 3.01Å; K343-E397 IonicContact NZ-OE2 2.6Å; I346-E397 HydrophobicContact CG2-CB 4.08Å; K350-E397 WeakPolarHBondContact CD-O 3.42Å; K350-E397 PolarHBondContact NZ-O 2.82Å; K393-E397 PolarHBondContact O-N 3.35Å; A394-E397 PolarHBondContact O-N 3.1Å
398	L	91.4	Very high	88.6	Confident	11 Å²	11	19.5 Å²	19.5	6%	0.058	10%	0.104	C	C	.	.	H	α-helix	trans	-63.8	-48.2	178.2	-175.7	64.2	0	0	0	113.1	I346 L349 K350 L362 A394 L395 R396 I404	I346-L398 HydrophobicContact CG2-CB 3.86Å; I346-L398 HydrophobicContact CG2-CD1 4.39Å; L349-L398 HydrophobicContact CB-CD1 4.26Å; L349-L398 HydrophobicContact CD2-CD1 4.08Å; L349-L398 HydrophobicContact CD2-CD2 4.4Å; L349-L398 HydrophobicContact CG-CD1 3.89Å; K350-L398 HydrophobicContact CB-CD1 4.02Å; L362-L398 HydrophobicContact CD1-CD2 4Å; A394-L398 PolarHBondContact O-N 3.01Å; L395-L398 HydrophobicContact CD2-CD2 4.03Å; R396-L398 VanDerWaalsContact C-N 3.34Å; L398-I404 HydrophobicContact CD2-CD1 4.38Å
399	D	87.4	Confident	88.5	Confident	13 Å²	13	19.5 Å²	19.5	7%	0.07	10%	0.104	C	C	.	.			trans	-132.8	97.9	-177.3	178.8	24.7	0	0	0	110.7	R359 L395 R396 S401 M402 V403 I404	R359-D399 IonicContact CZ-OD2 3.89Å; R359-D399 IonicContact NH1-OD1 3.23Å; R359-D399 IonicContact NH1-OD2 2.77Å; R359-D399 IonicContact NH2-OD2 2.67Å; R359-D399 PolarHBondContact NH2-OD2 2.83Å; L395-D399 PolarHBondContact O-N 2.88Å; R396-D399 CarbonylContact O-C 3.59Å; D399-S401 PolarHBondContact O-N 3.41Å; D399-S401 VanDerWaalsContact O-N 3.08Å; D399-S401 WeakPolarHBondContact OD1-CB 3.46Å; D399-S401 PolarHBondContact OD1-N 3.18Å; D399-S401 PolarHBondContact OD1-OG 2.79Å; D399-S401 PolarHBondContact OD2-OG 2.84Å; D399-M402 PolarHBondContact O-N 2.68Å; D399-V403 PolarHBondContact OD2-N 2.8Å; D399-I404 HydrophobicContact CB-CB 4.14Å; D399-I404 HydrophobicContact CB-CD1 3.87Å; D399-I404 HydrophobicContact CB-CG1 4.04Å; D399-I404 WeakPolarHBondContact OD2-CG1 3.5Å; D399-I404 PolarHBondContact OD2-N 2.99Å
400	P	81.4	Confident	88.5	Confident	88 Å²	88	25.1 Å²	25.1	57%	0.571	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.1	177.8	-26.5	35.2	0	0	0	113.9	M402	P400-M402 PolarHBondContact O-N 3.15Å
401	S	80.6	Confident	88.5	Confident	37 Å²	37	26 Å²	26	26%	0.259	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-11.4	175.9	75.5	0	0	0	0	113.6	D399 V403	D399-S401 PolarHBondContact O-N 3.41Å; D399-S401 VanDerWaalsContact O-N 3.08Å; D399-S401 WeakPolarHBondContact OD1-CB 3.46Å; D399-S401 PolarHBondContact OD1-N 3.18Å; D399-S401 PolarHBondContact OD1-OG 2.79Å; D399-S401 PolarHBondContact OD2-OG 2.84Å; S401-V403 PolarHBondContact O-N 3.03Å
402	M	81.8	Confident	88.5	Confident	16 Å²	16	26 Å²	26	8%	0.079	14%	0.135	C	C	.	.			trans	58.6	9	-176.7	-51.7	-163.6	-173.8	0	0	115.3	R396 D399 P400 L405 Q406	R396-M402 HydrophobicContact CG-CE 3.97Å; D399-M402 PolarHBondContact O-N 2.68Å; P400-M402 PolarHBondContact O-N 3.15Å; M402-L405 WeakPolarHBondContact O-CB 3.21Å; M402-L405 PolarHBondContact O-N 3.09Å; M402-Q406 WeakPolarHBondContact O-CG 3.4Å; M402-Q406 PolarHBondContact O-N 3.32Å
403	V	84.8	Confident	88.6	Confident	8 Å²	8	27.7 Å²	27.7	5%	0.048	14%	0.142	C	C	.	.	H	α-helix	trans	-67.2	-41.5	-179.1	170.6	0	0	0	0	110.6	D399 S401 L405 Q406 V407 P471 D473 A474	D399-V403 PolarHBondContact OD2-N 2.8Å; S401-V403 PolarHBondContact O-N 3.03Å; V403-L405 VanDerWaalsContact C-N 3.34Å; V403-L405 PolarHBondContact O-N 2.99Å; V403-Q406 PolarHBondContact O-N 3.43Å; V403-V407 HydrophobicContact CG1-CG2 4.46Å; V403-V407 WeakPolarHBondContact O-CG2 3.32Å; V403-V407 PolarHBondContact O-N 3.31Å; V403-V407 VanDerWaalsContact O-N 3.08Å; V403-P471 HydrophobicContact CB-CG 4.48Å; V403-P471 HydrophobicContact CG2-CG 4.08Å; V403-D473 WeakPolarHBondContact CG1-OD2 3.45Å; V403-A474 HydrophobicContact CG1-CB 4.24Å; V403-A474 HydrophobicContact CG2-CB 4.09Å
404	I	88.5	Confident	88.6	Confident	3 Å²	3	33.2 Å²	33.2	2%	0.015	17%	0.166	C	C	.	.	H	α-helix	trans	-58.4	-47.9	175.7	-67.2	-179.1	0	0	0	110.7	R359 L362 L363 L395 L398 D399 Q406 V407 A408	R359-I404 HydrophobicContact CG-CD1 4Å; R359-I404 HydrophobicContact CG-CG1 4.29Å; L362-I404 HydrophobicContact CD2-CG2 3.91Å; L363-I404 HydrophobicContact CD2-CB 4.35Å; L363-I404 HydrophobicContact CD2-CG2 3.89Å; L395-I404 HydrophobicContact CD2-CG2 4.17Å; L398-I404 HydrophobicContact CD2-CD1 4.38Å; D399-I404 HydrophobicContact CB-CB 4.14Å; D399-I404 HydrophobicContact CB-CD1 3.87Å; D399-I404 HydrophobicContact CB-CG1 4.04Å; D399-I404 WeakPolarHBondContact OD2-CG1 3.5Å; D399-I404 PolarHBondContact OD2-N 2.99Å; I404-Q406 VanDerWaalsContact C-N 3.33Å; I404-Q406 PolarHBondContact O-N 3.44Å; I404-V407 PolarHBondContact O-N 3.34Å; I404-A408 WeakPolarHBondContact O-CB 3.26Å; I404-A408 PolarHBondContact O-N 3.36Å
405	L	89.8	Confident	88.5	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-56.9	-46.4	178	-177	168.8	0	0	0	111.2	I392 L395 M402 V403 V407 C409	I392-L405 HydrophobicContact CB-CD1 4.19Å; I392-L405 HydrophobicContact CG1-CD1 4.22Å; I392-L405 HydrophobicContact CG2-CD1 4.08Å; L395-L405 HydrophobicContact CB-CB 3.93Å; L395-L405 HydrophobicContact CB-CD1 4.44Å; L395-L405 HydrophobicContact CB-CG 4.34Å; L395-L405 HydrophobicContact CD1-CB 4.25Å; L395-L405 HydrophobicContact CD1-CG 4.5Å; M402-L405 WeakPolarHBondContact O-CB 3.21Å; M402-L405 PolarHBondContact O-N 3.09Å; V403-L405 VanDerWaalsContact C-N 3.34Å; V403-L405 PolarHBondContact O-N 2.99Å; L405-V407 PolarHBondContact O-N 3.28Å; L405-C409 VanDerWaalsContact O-CB 3.24Å; L405-C409 WeakPolarHBondContact O-CB 3.41Å; L405-C409 PolarHBondContact O-N 3.48Å; L405-C409 PolarHBondContact O-SG 3.09Å
406	Q	84.1	Confident	88.5	Confident	39 Å²	39	35.3 Å²	35.3	18%	0.182	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-47.4	-179	-74.2	-171.4	-0.1	0	0	112.6	M402 V403 I404 Q410 R413 R483	M402-Q406 WeakPolarHBondContact O-CG 3.4Å; M402-Q406 PolarHBondContact O-N 3.32Å; V403-Q406 PolarHBondContact O-N 3.43Å; I404-Q406 VanDerWaalsContact C-N 3.33Å; I404-Q406 PolarHBondContact O-N 3.44Å; Q406-Q410 PolarHBondContact O-N 3.21Å; Q406-R413 PolarHBondContact O-NH1 2.84Å; Q406-R483 PolarHBondContact NE2-O 3.02Å
407	V	88.1	Confident	88.5	Confident	17 Å²	17	39.3 Å²	39.3	10%	0.103	19%	0.188	C	C	.	.	H	α-helix	trans	-71.4	-44.7	-177.3	178.2	0	0	0	0	110.8	L363 K367 V403 I404 L405 V475	L363-V407 HydrophobicContact CD1-CG1 4.18Å; L363-V407 HydrophobicContact CD2-CB 4.03Å; L363-V407 HydrophobicContact CD2-CG1 4.03Å; K367-V407 WeakPolarHBondContact CE-O 3.36Å; K367-V407 VanDerWaalsContact NZ-CG1 3.3Å; K367-V407 PolarHBondContact NZ-O 3.18Å; V403-V407 HydrophobicContact CG1-CG2 4.46Å; V403-V407 WeakPolarHBondContact O-CG2 3.32Å; V403-V407 PolarHBondContact O-N 3.31Å; V403-V407 VanDerWaalsContact O-N 3.08Å; I404-V407 PolarHBondContact O-N 3.34Å; L405-V407 PolarHBondContact O-N 3.28Å; V407-V475 HydrophobicContact CG2-CG2 3.92Å
408	A	90.9	Very high	88.4	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-70	-38.2	-177.3	0	0	0	0	0	113.1	L363 L366 F370 L395 I404 P411	L363-A408 HydrophobicContact CD2-CB 4.13Å; L366-A408 HydrophobicContact CD2-CB 3.74Å; L366-A408 HydrophobicContact CG-CB 4.33Å; F370-A408 HydrophobicContact CE2-CB 4.44Å; L395-A408 HydrophobicContact CD1-CB 4.44Å; I404-A408 WeakPolarHBondContact O-CB 3.26Å; I404-A408 PolarHBondContact O-N 3.36Å; A408-P411 VanDerWaalsContact O-CD 3.27Å; A408-P411 WeakPolarHBondContact O-CD 3.4Å; A408-P411 WeakPolarHBondContact O-CG 3.38Å
409	C	90.7	Very high	88.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-90.3	-0.4	-176.9	-58.6	0	0	0	0	114.3	Y388 L405 I412 R413	Y388-C409 HydrophobicContact CD2-CB 4.15Å; Y388-C409 HydrophobicContact CE2-CB 3.58Å; L405-C409 VanDerWaalsContact O-CB 3.24Å; L405-C409 WeakPolarHBondContact O-CB 3.41Å; L405-C409 PolarHBondContact O-N 3.48Å; L405-C409 PolarHBondContact O-SG 3.09Å; C409-I412 HydrophobicContact CB-CD1 4.27Å; C409-I412 WeakPolarHBondContact O-CB 3.25Å; C409-I412 PolarHBondContact O-N 3.37Å; C409-I412 VanDerWaalsContact O-N 3.13Å; C409-R413 WeakPolarHBondContact O-CG 3.41Å; C409-R413 PolarHBondContact O-N 3.29Å
410	Q	89.3	Confident	88	Confident	119 Å²	119	51.8 Å²	51.8	56%	0.556	25%	0.251	S	S	*	.	H	α-helix	trans	-49.3	-47.6	172.2	-171.3	-174	8.3	0	0	114.1	Q406 I412 R413 K414	Q406-Q410 PolarHBondContact O-N 3.21Å; Q410-I412 VanDerWaalsContact C-N 3.35Å; Q410-I412 PolarHBondContact O-N 3.04Å; Q410-R413 PolarHBondContact O-N 2.89Å; Q410-K414 PolarHBondContact O-N 3.4Å
411	P	92.2	Very high	88.2	Confident	27 Å²	27	50.7 Å²	50.7	18%	0.175	24%	0.24	C	C	.	.	H	α-helix	trans	-62.1	-39.1	176.4	24.2	-35.9	0	0	0	112.7	L375 A408 R413 K414 Y415	L375-P411 HydrophobicContact CD1-CB 3.75Å; L375-P411 HydrophobicContact CD1-CG 4.41Å; A408-P411 VanDerWaalsContact O-CD 3.27Å; A408-P411 WeakPolarHBondContact O-CD 3.4Å; A408-P411 WeakPolarHBondContact O-CG 3.38Å; P411-R413 PolarHBondContact O-N 3.17Å; P411-K414 PolarHBondContact O-N 3.33Å; P411-Y415 WeakPolarHBondContact O-CB 3.44Å; P411-Y415 PolarHBondContact O-N 2.63Å
412	I	93.7	Very high	88.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-59.3	-49.7	176.2	-55.4	177.9	0	0	0	110.3	F370 L374 L375 I384 Y388 C409 Q410 K414 Y415 L416	F370-I412 HydrophobicContact CB-CG1 4.47Å; F370-I412 HydrophobicContact CD1-CD1 4.02Å; F370-I412 HydrophobicContact CD2-CD1 3.85Å; F370-I412 HydrophobicContact CD2-CG1 4.22Å; F370-I412 HydrophobicContact CE1-CD1 4.02Å; F370-I412 HydrophobicContact CE2-CD1 3.82Å; F370-I412 HydrophobicContact CG-CD1 3.96Å; F370-I412 HydrophobicContact CG-CG1 4.23Å; F370-I412 HydrophobicContact CZ-CD1 3.92Å; L374-I412 HydrophobicContact CD2-CD1 4.32Å; L375-I412 HydrophobicContact CD1-CG1 4.34Å; L375-I412 HydrophobicContact CD2-CB 4.46Å; L375-I412 HydrophobicContact CD2-CG1 4.23Å; I384-I412 HydrophobicContact CG2-CG2 4.21Å; Y388-I412 HydrophobicContact CD2-CB 4.4Å; Y388-I412 HydrophobicContact CD2-CD1 4.06Å; Y388-I412 HydrophobicContact CD2-CG2 3.92Å; Y388-I412 HydrophobicContact CG-CG2 4Å; C409-I412 HydrophobicContact CB-CD1 4.27Å; C409-I412 WeakPolarHBondContact O-CB 3.25Å; C409-I412 PolarHBondContact O-N 3.37Å; C409-I412 VanDerWaalsContact O-N 3.13Å; Q410-I412 VanDerWaalsContact C-N 3.35Å; Q410-I412 PolarHBondContact O-N 3.04Å; I412-K414 VanDerWaalsContact C-N 3.31Å; I412-K414 PolarHBondContact O-N 3.5Å; I412-Y415 PolarHBondContact O-N 2.75Å; I412-Y415 VanDerWaalsContact O-N 3.17Å; I412-L416 HydrophobicContact CG2-CD1 3.94Å; I412-L416 HydrophobicContact CG2-CG 4.27Å; I412-L416 WeakPolarHBondContact O-CG 3.45Å; I412-L416 PolarHBondContact O-N 2.67Å
413	R	90.3	Very high	88.8	Confident	35 Å²	35	48.7 Å²	48.7	13%	0.132	23%	0.227	C	C	.	.	H	α-helix	trans	-60	-41.8	178.7	-62.5	-175.8	-170.3	103	1.6	111.9	Y388 Q406 C409 Q410 P411 Y415 R417 I495	Y388-R413 PolarHBondContact OH-NE 3.4Å; Y388-R413 PolarHBondContact OH-NH2 2.93Å; Q406-R413 PolarHBondContact O-NH1 2.84Å; C409-R413 WeakPolarHBondContact O-CG 3.41Å; C409-R413 PolarHBondContact O-N 3.29Å; Q410-R413 PolarHBondContact O-N 2.89Å; P411-R413 PolarHBondContact O-N 3.17Å; R413-Y415 VanDerWaalsContact C-N 3.34Å; R413-R417 WeakPolarHBondContact O-CG 3.31Å; R413-R417 PolarHBondContact O-N 3.42Å; R413-I495 HydrophobicContact CB-CG1 4.34Å; R413-I495 HydrophobicContact CB-CG2 4.37Å; R413-I495 HydrophobicContact CG-CD1 4.18Å; R413-I495 HydrophobicContact CG-CG1 3.97Å
414	K	90.1	Very high	88.9	Confident	157 Å²	157	54.2 Å²	54.2	68%	0.683	25%	0.247	S	C	*	.	H	α-helix	trans	-63.5	-42.2	177.3	-173.7	-179	177.3	-174.3	0	111.2	Q410 P411 I412	Q410-K414 PolarHBondContact O-N 3.4Å; P411-K414 PolarHBondContact O-N 3.33Å; I412-K414 VanDerWaalsContact C-N 3.31Å; I412-K414 PolarHBondContact O-N 3.5Å
415	Y	92.8	Very high	88.8	Confident	46 Å²	46	57.3 Å²	57.3	18%	0.18	26%	0.262	C	S	.	.	H	α-helix	trans	-69	-45.2	-179.9	-169.9	-100.4	0	0	0	112.2	L375 H376 I384 P411 I412 R413 R417 T418	L375-Y415 HydrophobicContact CB-CD1 4.47Å; L375-Y415 HydrophobicContact CB-CD2 4.25Å; L375-Y415 HydrophobicContact CB-CG 4.22Å; L375-Y415 HydrophobicContact CD2-CD1 3.78Å; L375-Y415 HydrophobicContact CD2-CG 3.9Å; H376-Y415 PolarHBondContact O-OH 3.14Å; I384-Y415 HydrophobicContact CD1-CD1 4.03Å; I384-Y415 HydrophobicContact CD1-CE1 3.61Å; P411-Y415 WeakPolarHBondContact O-CB 3.44Å; P411-Y415 PolarHBondContact O-N 2.63Å; I412-Y415 PolarHBondContact O-N 2.75Å; I412-Y415 VanDerWaalsContact O-N 3.17Å; R413-Y415 VanDerWaalsContact C-N 3.34Å; Y415-R417 VanDerWaalsContact C-N 3.27Å; Y415-R417 PolarHBondContact O-N 3.35Å; Y415-T418 WeakPolarHBondContact O-CB 3.43Å; Y415-T418 PolarHBondContact O-N 3.26Å; Y415-T418 PolarHBondContact O-OG1 3.18Å
416	L	91.1	Very high	88.7	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-60.1	-34.5	177.4	-74.6	178.5	0	0	0	112.9	I384 I385 Y388 I412 T418 R419 T422 I495 Y496	I384-L416 HydrophobicContact CB-CD2 4.29Å; I384-L416 HydrophobicContact CG2-CD2 3.74Å; I384-L416 HydrophobicContact CG2-CG 4.23Å; I385-L416 HydrophobicContact CG1-CD2 4.32Å; Y388-L416 HydrophobicContact CD1-CD1 4.4Å; I412-L416 HydrophobicContact CG2-CD1 3.94Å; I412-L416 HydrophobicContact CG2-CG 4.27Å; I412-L416 WeakPolarHBondContact O-CG 3.45Å; I412-L416 PolarHBondContact O-N 2.67Å; L416-T418 PolarHBondContact O-N 3.15Å; L416-R419 PolarHBondContact O-N 3.25Å; L416-T422 HydrophobicContact CB-CG2 4.16Å; L416-T422 HydrophobicContact CD2-CG2 3.91Å; L416-T422 HydrophobicContact CG-CG2 4.47Å; L416-T422 PolarHBondContact O-OG1 3Å; L416-T422 VanDerWaalsContact O-OG1 3.05Å; L416-I495 HydrophobicContact CD1-CD1 4.07Å; L416-Y496 PolarHBondContact O-OH 3.08Å; L416-Y496 VanDerWaalsContact O-OH 3.08Å
417	R	89.1	Confident	88.8	Confident	146 Å²	146	55.7 Å²	55.7	55%	0.551	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.2	172.6	-72.6	174.8	-176	176.8	-3.3	114.1	R413 Y415 I495	R413-R417 WeakPolarHBondContact O-CG 3.31Å; R413-R417 PolarHBondContact O-N 3.42Å; Y415-R417 VanDerWaalsContact C-N 3.27Å; Y415-R417 PolarHBondContact O-N 3.35Å; R417-I495 HydrophobicContact CG-CG2 3.61Å; R417-I495 PolarHBondContact NE-O 2.73Å; R417-I495 PolarHBondContact NH2-O 3.47Å
418	T	88.6	Confident	88.6	Confident	102 Å²	102	55.9 Å²	55.9	63%	0.626	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-15.2	179.8	63.1	0	0	0	0	113.1	Y415 L416	Y415-T418 WeakPolarHBondContact O-CB 3.43Å; Y415-T418 PolarHBondContact O-N 3.26Å; Y415-T418 PolarHBondContact O-OG1 3.18Å; L416-T418 PolarHBondContact O-N 3.15Å
419	R	88.9	Confident	88.2	Confident	53 Å²	53	56 Å²	56	20%	0.2	26%	0.259	C	S	.	.			trans	-96.7	119.1	-179.8	-70.3	-173.9	78	142.8	15.1	110.3	V379 T381 L416 D421 T422	V379-R419 PolarHBondContact O-NH1 3.28Å; T381-R419 PolarHBondContact OG1-NE 3.35Å; T381-R419 PolarHBondContact OG1-NH2 3.45Å; L416-R419 PolarHBondContact O-N 3.25Å; R419-D421 VanDerWaalsContact C-N 3.33Å; R419-D421 IonicContact NE-OD1 2.7Å; R419-D421 PolarHBondContact O-N 3.26Å; R419-T422 VanDerWaalsContact CB-OG1 3.22Å; R419-T422 WeakPolarHBondContact CB-OG1 3.29Å; R419-T422 PolarHBondContact O-N 2.95Å; R419-T422 PolarHBondContact O-OG1 3.14Å
420	E	81.6	Confident	87.8	Confident	194 Å²	194	56.6 Å²	56.6	91%	0.907	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-30.6	-176	-60.3	-177.2	166.4	0	0	112.8	T422	E420-T422 VanDerWaalsContact C-N 3.3Å; E420-T422 PolarHBondContact O-N 2.67Å
421	D	85	Confident	87.1	Confident	64 Å²	64	51.1 Å²	51.1	34%	0.342	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-7.6	-177.1	65.8	-39.4	0	0	0	114.3	T381 R419 V423 R424 Q425	T381-D421 WeakPolarHBondContact CB-OD2 3.47Å; T381-D421 VanDerWaalsContact OG1-CG 3.24Å; T381-D421 PolarHBondContact OG1-OD1 3.49Å; T381-D421 PolarHBondContact OG1-OD2 3.18Å; R419-D421 VanDerWaalsContact C-N 3.33Å; R419-D421 IonicContact NE-OD1 2.7Å; R419-D421 PolarHBondContact O-N 3.26Å; D421-V423 PolarHBondContact O-N 3.24Å; D421-R424 PolarHBondContact O-N 3.23Å; D421-Q425 WeakPolarHBondContact O-CG 3.45Å; D421-Q425 PolarHBondContact O-N 3.32Å
422	T	88.8	Confident	86.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-45	-172.8	-53.5	0	0	0	0	113.6	T381 I385 L416 R419 E420 R424 Q425 I426 Y496	T381-T422 HydrophobicContact CG2-CG2 4.29Å; I385-T422 HydrophobicContact CD1-CG2 4.25Å; L416-T422 HydrophobicContact CB-CG2 4.16Å; L416-T422 HydrophobicContact CD2-CG2 3.91Å; L416-T422 HydrophobicContact CG-CG2 4.47Å; L416-T422 PolarHBondContact O-OG1 3Å; L416-T422 VanDerWaalsContact O-OG1 3.05Å; R419-T422 VanDerWaalsContact CB-OG1 3.22Å; R419-T422 WeakPolarHBondContact CB-OG1 3.29Å; R419-T422 PolarHBondContact O-N 2.95Å; R419-T422 PolarHBondContact O-OG1 3.14Å; E420-T422 VanDerWaalsContact C-N 3.3Å; E420-T422 PolarHBondContact O-N 2.67Å; T422-R424 VanDerWaalsContact C-N 3.34Å; T422-R424 PolarHBondContact O-N 2.73Å; T422-Q425 PolarHBondContact O-N 2.87Å; T422-I426 HydrophobicContact CG2-CD1 3.88Å; T422-I426 HydrophobicContact CG2-CG1 4.41Å; T422-I426 WeakPolarHBondContact O-CG1 3.43Å; T422-I426 PolarHBondContact O-N 2.84Å; T422-Y496 WeakPolarHBondContact CB-OH 3.29Å; T422-Y496 HydrophobicContact CG2-CE2 4.5Å; T422-Y496 WeakPolarHBondContact CG2-OH 3.33Å
423	V	87.5	Confident	84.7	Confident	11 Å²	11	54.6 Å²	54.6	7%	0.067	26%	0.262	C	S	.	.	H	α-helix	trans	-64.6	-43.7	-177.5	-177.1	0	0	0	0	109.9	D421 Q425 I426 V427 Y496 I501 F502 E505	D421-V423 PolarHBondContact O-N 3.24Å; V423-Q425 VanDerWaalsContact C-N 3.31Å; V423-Q425 PolarHBondContact O-N 3.43Å; V423-I426 PolarHBondContact O-N 2.94Å; V423-V427 HydrophobicContact CG1-CG2 4.41Å; V423-V427 WeakPolarHBondContact O-CG2 3.44Å; V423-V427 PolarHBondContact O-N 3.08Å; V423-Y496 HydrophobicContact CG2-CD1 4.28Å; V423-Y496 HydrophobicContact CG2-CD2 4.42Å; V423-Y496 HydrophobicContact CG2-CE1 3.92Å; V423-Y496 HydrophobicContact CG2-CE2 4.08Å; V423-I501 HydrophobicContact CG1-CG2 4.19Å; V423-I501 HydrophobicContact CG2-CG2 3.97Å; V423-F502 HydrophobicContact CG1-CD1 3.92Å; V423-F502 HydrophobicContact CG1-CE1 4.17Å; V423-F502 HydrophobicContact CG1-CG 4.28Å; V423-E505 HydrophobicContact CB-CG 4.44Å; V423-E505 HydrophobicContact CG1-CB 3.73Å; V423-E505 HydrophobicContact CG1-CG 3.92Å
424	R	85.6	Confident	83.2	Confident	125 Å²	125	54.1 Å²	54.1	47%	0.472	27%	0.266	S	S	.	.	H	α-helix	trans	-58.3	-42.9	176.2	-167.5	169.3	177.8	-171.1	0.2	111.7	D421 T422 V427 A428 E505 V509	D421-R424 PolarHBondContact O-N 3.23Å; T422-R424 VanDerWaalsContact C-N 3.34Å; T422-R424 PolarHBondContact O-N 2.73Å; R424-V427 PolarHBondContact O-N 3.09Å; R424-A428 VanDerWaalsContact O-CB 3.31Å; R424-A428 WeakPolarHBondContact O-CB 3.21Å; R424-A428 PolarHBondContact O-N 3.08Å; R424-E505 HydrophobicContact CB-CG 4.27Å; R424-E505 WeakPolarHBondContact CB-OE1 3.3Å; R424-E505 WeakPolarHBondContact CD-OE1 3.09Å; R424-E505 WeakPolarHBondContact CG-OE1 3.33Å; R424-V509 HydrophobicContact CG-CG2 4.22Å
425	Q	86.9	Confident	81.5	Confident	67 Å²	67	56.3 Å²	56.3	31%	0.313	28%	0.279	S	S	.	.	H	α-helix	trans	-66.1	-41.1	176.7	-69.5	-69	-17	0	0	112.7	T381 I385 D421 T422 V423 A428 S429	T381-Q425 HydrophobicContact CG2-CB 4.49Å; T381-Q425 HydrophobicContact CG2-CG 4.35Å; I385-Q425 HydrophobicContact CD1-CB 3.82Å; D421-Q425 WeakPolarHBondContact O-CG 3.45Å; D421-Q425 PolarHBondContact O-N 3.32Å; T422-Q425 PolarHBondContact O-N 2.87Å; V423-Q425 VanDerWaalsContact C-N 3.31Å; V423-Q425 PolarHBondContact O-N 3.43Å; Q425-A428 PolarHBondContact O-N 2.9Å; Q425-S429 WeakPolarHBondContact O-CB 3.35Å; Q425-S429 PolarHBondContact O-N 3.29Å
426	I	87.5	Confident	79.5	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-63.2	-44.3	175.2	-64.7	165.8	0	0	0	110.5	I385 T422 V423 S429 L430 L440 L492 Y496 F502	I385-I426 HydrophobicContact CD1-CG1 3.79Å; I385-I426 HydrophobicContact CG1-CG1 4.41Å; T422-I426 HydrophobicContact CG2-CD1 3.88Å; T422-I426 HydrophobicContact CG2-CG1 4.41Å; T422-I426 WeakPolarHBondContact O-CG1 3.43Å; T422-I426 PolarHBondContact O-N 2.84Å; V423-I426 PolarHBondContact O-N 2.94Å; I426-S429 PolarHBondContact O-N 2.6Å; I426-L430 HydrophobicContact CG2-CD1 4.12Å; I426-L430 WeakPolarHBondContact O-CG 3.23Å; I426-L430 PolarHBondContact O-N 3.24Å; I426-L440 HydrophobicContact CG2-CD2 4.09Å; I426-L492 HydrophobicContact CD1-CD2 4.28Å; I426-Y496 HydrophobicContact CD1-CE2 4.43Å; I426-F502 HydrophobicContact CB-CE1 4.05Å; I426-F502 HydrophobicContact CD1-CE1 3.87Å; I426-F502 HydrophobicContact CD1-CZ 4.13Å; I426-F502 HydrophobicContact CG2-CD1 4.35Å; I426-F502 HydrophobicContact CG2-CE1 3.74Å
427	V	86.1	Confident	77.8	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.024	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-41.7	177.4	171.2	0	0	0	0	111.5	V423 R424 S429 L430 T431 F502 E505 Y506 V509	V423-V427 HydrophobicContact CG1-CG2 4.41Å; V423-V427 WeakPolarHBondContact O-CG2 3.44Å; V423-V427 PolarHBondContact O-N 3.08Å; R424-V427 PolarHBondContact O-N 3.09Å; V427-S429 VanDerWaalsContact C-N 3.32Å; V427-S429 PolarHBondContact O-N 2.88Å; V427-L430 PolarHBondContact O-N 2.94Å; V427-T431 WeakPolarHBondContact O-CG2 3.33Å; V427-T431 PolarHBondContact O-N 3.2Å; V427-T431 PolarHBondContact O-OG1 3.29Å; V427-F502 HydrophobicContact CG2-CD1 4.39Å; V427-E505 HydrophobicContact CG2-CB 4.35Å; V427-E505 HydrophobicContact CG2-CG 4.27Å; V427-Y506 HydrophobicContact CG1-CD2 3.72Å; V427-Y506 HydrophobicContact CG1-CG 4.33Å; V427-V509 HydrophobicContact CG1-CB 4.38Å; V427-V509 HydrophobicContact CG1-CG2 4.36Å
428	A	83.2	Confident	76.6	Confident	21 Å²	21	54.2 Å²	54.2	17%	0.174	31%	0.305	C	S	.	.	H	α-helix	trans	-61.9	-39.3	174.3	0	0	0	0	0	112	R424 Q425 T431 G432 D433	R424-A428 VanDerWaalsContact O-CB 3.31Å; R424-A428 WeakPolarHBondContact O-CB 3.21Å; R424-A428 PolarHBondContact O-N 3.08Å; Q425-A428 PolarHBondContact O-N 2.9Å; A428-T431 WeakPolarHBondContact CA-OG1 3.38Å; A428-T431 PolarHBondContact O-OG1 3.26Å; A428-T431 VanDerWaalsContact O-OG1 3.06Å; A428-G432 PolarHBondContact O-N 3.47Å; A428-D433 PolarHBondContact O-N 2.89Å
429	S	83.6	Confident	75.6	Confident	4 Å²	4	52.7 Å²	52.7	3%	0.028	29%	0.293	C	S	.	.	H	α-helix	trans	-67.6	-42.9	174.1	173.1	0	0	0	0	112.8	Q425 I426 V427 T431 G432 C437 L440	Q425-S429 WeakPolarHBondContact O-CB 3.35Å; Q425-S429 PolarHBondContact O-N 3.29Å; I426-S429 PolarHBondContact O-N 2.6Å; V427-S429 VanDerWaalsContact C-N 3.32Å; V427-S429 PolarHBondContact O-N 2.88Å; S429-T431 PolarHBondContact O-N 3.4Å; S429-G432 PolarHBondContact O-N 2.92Å; S429-G432 VanDerWaalsContact O-N 3.14Å; S429-C437 PolarHBondContact OG-O 3.23Å; S429-C437 PolarHBondContact OG-SG 3.27Å; S429-L440 WeakPolarHBondContact OG-CB 3.37Å
430	L	81.1	Confident	75	Confident	11 Å²	11	50.2 Å²	50.2	6%	0.058	28%	0.284	C	S	.	.	H	α-helix	trans	-60.6	-35.5	176.9	-79.1	167.3	0	0	0	112.6	I426 V427 G432 L440 L444 I489	I426-L430 HydrophobicContact CG2-CD1 4.12Å; I426-L430 WeakPolarHBondContact O-CG 3.23Å; I426-L430 PolarHBondContact O-N 3.24Å; V427-L430 PolarHBondContact O-N 2.94Å; L430-G432 VanDerWaalsContact C-N 3.32Å; L430-L440 HydrophobicContact CD2-CD1 4.5Å; L430-L440 HydrophobicContact CD2-CD2 3.76Å; L430-L440 HydrophobicContact CD2-CG 3.64Å; L430-L440 HydrophobicContact CG-CD2 3.68Å; L430-L440 HydrophobicContact CG-CG 4.12Å; L430-L444 HydrophobicContact CD2-CB 4.46Å; L430-L444 HydrophobicContact CD2-CD2 4.32Å; L430-I489 HydrophobicContact CD2-CD1 4.09Å; L430-I489 HydrophobicContact CD2-CG1 4.37Å
431	T	76	Confident	74.7	Confident	4 Å²	4	42.1 Å²	42.1	3%	0.025	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-7.3	-179.5	51.3	0	0	0	0	113.5	V427 A428 S429 Y506 R513 R524 N528	V427-T431 WeakPolarHBondContact O-CG2 3.33Å; V427-T431 PolarHBondContact O-N 3.2Å; V427-T431 PolarHBondContact O-OG1 3.29Å; A428-T431 WeakPolarHBondContact CA-OG1 3.38Å; A428-T431 PolarHBondContact O-OG1 3.26Å; A428-T431 VanDerWaalsContact O-OG1 3.06Å; S429-T431 PolarHBondContact O-N 3.4Å; T431-Y506 HydrophobicContact CG2-CD2 4.03Å; T431-Y506 HydrophobicContact CG2-CE2 3.51Å; T431-R513 PolarHBondContact OG1-NH1 3.42Å; T431-R513 PolarHBondContact OG1-NH2 3Å; T431-R524 PolarHBondContact O-NH2 3.37Å; T431-N528 PolarHBondContact O-ND2 3.06Å
432	G	70.1	Confident	74.3	Confident	36 Å²	36	42.8 Å²	42.8	37%	0.371	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	20.1	178.4	0	0	0	0	0	114.7	A428 S429 L430 R524	A428-G432 PolarHBondContact O-N 3.47Å; S429-G432 PolarHBondContact O-N 2.92Å; S429-G432 VanDerWaalsContact O-N 3.14Å; L430-G432 VanDerWaalsContact C-N 3.32Å; G432-R524 PolarHBondContact O-NH2 3.41Å
433	D	64.3	Low	73.7	Confident	65 Å²	65	44.9 Å²	44.9	35%	0.348	26%	0.263	S	S	.	.			trans	-88.8	-22.4	-179.9	-78.3	-7.1	0	0	0	113.7	A428 E435 R513 R524	A428-D433 PolarHBondContact O-N 2.89Å; D433-E435 PolarHBondContact O-N 3.25Å; D433-R513 IonicContact OD1-NH1 3.26Å; D433-R513 IonicContact OD2-CZ 2.88Å; D433-R513 IonicContact OD2-NE 2.76Å; D433-R513 PolarHBondContact OD2-NE 2.77Å; D433-R513 IonicContact OD2-NH1 3.62Å; D433-R513 PolarHBondContact OD2-NH1 3.43Å; D433-R513 IonicContact OD2-NH2 3.59Å; D433-R513 PolarHBondContact OD2-NH2 2.85Å; D433-R524 IonicContact OD1-CZ 2.71Å; D433-R524 IonicContact OD1-NH1 3.13Å; D433-R524 PolarHBondContact OD1-NH1 2.93Å; D433-R524 IonicContact OD1-NH2 3.33Å; D433-R524 PolarHBondContact OD1-NH2 3.37Å
434	A	60.1	Low	73	Confident	25 Å²	25	44.7 Å²	44.7	21%	0.207	26%	0.262	C	S	.	.	S	Bend	trans	-75.6	112	176.2	0	0	0	0	0	110.1	G436 C437	A434-G436 PolarHBondContact O-N 3.45Å; A434-G436 VanDerWaalsContact O-N 3.13Å; A434-C437 HydrophobicContact CB-CB 4.14Å; A434-C437 PolarHBondContact O-N 3.31Å
435	E	52.9	Low	72.3	Confident	203 Å²	203	42.1 Å²	42.1	95%	0.949	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	117.5	166.6	-68.3	-176.9	168.4	0	0	108.8	D433	D433-E435 PolarHBondContact O-N 3.25Å
436	G	52.2	Low	71.4	Confident	78 Å²	78	48.7 Å²	48.7	80%	0.804	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.5	-4.9	177.6	0	0	0	0	0	117.3	A434	A434-G436 PolarHBondContact O-N 3.45Å; A434-G436 VanDerWaalsContact O-N 3.13Å
437	C	54.9	Low	69.8	Low	8 Å²	8	50.2 Å²	50.2	5%	0.054	30%	0.298	C	S	.	.			trans	-122.2	45.5	178.7	-154.2	0	0	0	0	113.1	S429 A434 D439	S429-C437 PolarHBondContact OG-O 3.23Å; S429-C437 PolarHBondContact OG-SG 3.27Å; A434-C437 HydrophobicContact CB-CB 4.14Å; A434-C437 PolarHBondContact O-N 3.31Å; C437-D439 PolarHBondContact O-N 3.43Å
438	S	62.8	Low	68.3	Low	62 Å²	62	56.3 Å²	56.3	43%	0.434	33%	0.33	S	S	.	.	H	α-helix	trans	-69.1	-19.4	175.6	158.2	0	0	0	0	113.3	L440 A441 N442	S438-L440 VanDerWaalsContact C-N 3.26Å; S438-L440 PolarHBondContact O-N 3.49Å; S438-A441 PolarHBondContact O-N 3.13Å; S438-N442 VanDerWaalsContact O-CG 3.28Å; S438-N442 PolarHBondContact O-N 3.36Å; S438-N442 PolarHBondContact O-ND2 2.99Å; S438-N442 PolarHBondContact OG-ND2 3.42Å
439	D	68.9	Low	66.8	Low	70 Å²	70	59.6 Å²	59.6	37%	0.374	35%	0.35	S	S	.	.	H	α-helix	trans	-56.5	-38.4	-176.1	-92	20.5	0	0	0	113.5	K393 C437 N442 E443	K393-D439 IonicContact NZ-OD2 2.61Å; K393-D439 PolarHBondContact NZ-OD2 3.24Å; C437-D439 PolarHBondContact O-N 3.43Å; D439-N442 PolarHBondContact O-N 2.99Å; D439-E443 WeakPolarHBondContact O-CB 3.22Å; D439-E443 PolarHBondContact O-N 3.3Å
440	L	76.8	Confident	65.3	Low	1 Å²	1	63 Å²	63	1%	0.005	37%	0.37	C	S	.	.	H	α-helix	trans	-76.3	-36.1	-178.4	-164.9	63.4	0	0	0	112.1	I389 I426 S429 L430 S438 N442 E443 L444 I488 I489 L492	I389-L440 HydrophobicContact CD1-CB 4.3Å; I389-L440 HydrophobicContact CD1-CD1 4.35Å; I426-L440 HydrophobicContact CG2-CD2 4.09Å; S429-L440 WeakPolarHBondContact OG-CB 3.37Å; L430-L440 HydrophobicContact CD2-CD1 4.5Å; L430-L440 HydrophobicContact CD2-CD2 3.76Å; L430-L440 HydrophobicContact CD2-CG 3.64Å; L430-L440 HydrophobicContact CG-CD2 3.68Å; L430-L440 HydrophobicContact CG-CG 4.12Å; S438-L440 VanDerWaalsContact C-N 3.26Å; S438-L440 PolarHBondContact O-N 3.49Å; L440-N442 VanDerWaalsContact C-N 3.33Å; L440-E443 PolarHBondContact O-N 3.05Å; L440-L444 WeakPolarHBondContact O-CB 3.3Å; L440-L444 PolarHBondContact O-N 3.18Å; L440-I488 HydrophobicContact CD1-CG2 4.13Å; L440-I489 HydrophobicContact CD1-CG1 3.88Å; L440-L492 HydrophobicContact CD1-CD1 3.71Å; L440-L492 HydrophobicContact CD2-CD1 3.87Å; L440-L492 HydrophobicContact CG-CD1 4.48Å
441	A	74.5	Confident	64.1	Low	24 Å²	24	64.2 Å²	64.2	20%	0.198	38%	0.379	C	S	.	.	H	α-helix	trans	-65.8	-37.7	172	0	0	0	0	0	111.4	S438 L444 S445	S438-A441 PolarHBondContact O-N 3.13Å; A441-L444 WeakPolarHBondContact O-CB 3.25Å; A441-L444 PolarHBondContact O-N 3.02Å; A441-S445 PolarHBondContact O-N 3.16Å
442	N	76.1	Confident	63.1	Low	78 Å²	78	64.6 Å²	64.6	42%	0.417	38%	0.38	S	S	.	.	H	α-helix	trans	-65.1	-44.5	172.9	-67.6	-23.5	0	0	0	110.9	S438 D439 L440 L444 S445 R446	S438-N442 VanDerWaalsContact O-CG 3.28Å; S438-N442 PolarHBondContact O-N 3.36Å; S438-N442 PolarHBondContact O-ND2 2.99Å; S438-N442 PolarHBondContact OG-ND2 3.42Å; D439-N442 PolarHBondContact O-N 2.99Å; L440-N442 VanDerWaalsContact C-N 3.33Å; N442-L444 VanDerWaalsContact C-N 3.3Å; N442-L444 PolarHBondContact O-N 3.47Å; N442-S445 PolarHBondContact O-N 3.45Å; N442-S445 VanDerWaalsContact O-N 3.08Å; N442-S445 PolarHBondContact O-OG 2.82Å; N442-R446 WeakPolarHBondContact O-CG 3.38Å; N442-R446 PolarHBondContact O-N 2.89Å
443	E	75.5	Confident	62.1	Low	43 Å²	43	66.9 Å²	66.9	20%	0.201	38%	0.381	C	S	.	.	H	α-helix	trans	-60.2	-41.6	175.4	-164.9	71.1	-178.6	0	0	111.7	D439 L440 S445 R446 A447 I488	D439-E443 WeakPolarHBondContact O-CB 3.22Å; D439-E443 PolarHBondContact O-N 3.3Å; L440-E443 PolarHBondContact O-N 3.05Å; E443-S445 PolarHBondContact O-N 3.48Å; E443-R446 PolarHBondContact O-N 3.25Å; E443-A447 WeakPolarHBondContact O-CB 3.42Å; E443-A447 PolarHBondContact O-N 3.28Å; E443-I488 HydrophobicContact CG-CB 4.35Å; E443-I488 HydrophobicContact CG-CD1 4.04Å; E443-I488 HydrophobicContact CG-CG1 4.32Å
444	L	74.3	Confident	61.4	Low	7 Å²	7	67.5 Å²	67.5	4%	0.037	39%	0.387	C	S	.	.	H	α-helix	trans	-59.6	-35.7	174.8	-176	69.7	0	0	0	111.9	L430 L440 A441 N442 I489 L531 L532 R535	L430-L444 HydrophobicContact CD2-CB 4.46Å; L430-L444 HydrophobicContact CD2-CD2 4.32Å; L440-L444 WeakPolarHBondContact O-CB 3.3Å; L440-L444 PolarHBondContact O-N 3.18Å; A441-L444 WeakPolarHBondContact O-CB 3.25Å; A441-L444 PolarHBondContact O-N 3.02Å; N442-L444 VanDerWaalsContact C-N 3.3Å; N442-L444 PolarHBondContact O-N 3.47Å; L444-I489 HydrophobicContact CB-CD1 3.92Å; L444-I489 HydrophobicContact CD1-CD1 3.63Å; L444-I489 HydrophobicContact CG-CD1 4.39Å; L444-L531 HydrophobicContact CD1-CB 4.41Å; L444-L531 HydrophobicContact CD2-CB 3.76Å; L444-L531 HydrophobicContact CD2-CD1 4.11Å; L444-L531 HydrophobicContact CG-CB 3.87Å; L444-L531 HydrophobicContact CG-CD1 4.31Å; L444-L532 HydrophobicContact CD1-CD2 4.46Å; L444-L532 HydrophobicContact CD2-CD2 4.38Å; L444-R535 HydrophobicContact CD1-CG 3.67Å
445	S	70.9	Confident	60.9	Low	72 Å²	72	70.4 Å²	70.4	50%	0.503	40%	0.397	S	S	.	.	H	α-helix	trans	-79.2	-25.7	178	75.4	0	0	0	0	114.8	A441 N442 E443	A441-S445 PolarHBondContact O-N 3.16Å; N442-S445 PolarHBondContact O-N 3.45Å; N442-S445 VanDerWaalsContact O-N 3.08Å; N442-S445 PolarHBondContact O-OG 2.82Å; E443-S445 PolarHBondContact O-N 3.48Å
446	R	67.4	Low	60.5	Low	205 Å²	205	65.3 Å²	65.3	77%	0.774	38%	0.376	S	S	*	.	H	α-helix	trans	-89.3	-26.5	-173.2	-75.2	-176.7	82.1	148.5	5.9	113.9	N442 E443	N442-R446 WeakPolarHBondContact O-CG 3.38Å; N442-R446 PolarHBondContact O-N 2.89Å; E443-R446 PolarHBondContact O-N 3.25Å
447	A	54.9	Low	60.1	Low	33 Å²	33	65.1 Å²	65.1	27%	0.273	36%	0.362	S	S	.	.	S	Bend	trans	-77.8	141.7	-163.5	0	0	0	0	0	113.5	E443	E443-A447 WeakPolarHBondContact O-CB 3.42Å; E443-A447 PolarHBondContact O-N 3.28Å
448	D	54.3	Low	59.5	Low	132 Å²	132	73.3 Å²	73.3	71%	0.706	40%	0.4	S	S	*	.			trans	-57.3	143.9	171.3	-78.3	-42.8	0	0	0	110.4	V450 R535	D448-V450 PolarHBondContact O-N 3Å; D448-R535 PolarHBondContact O-NH1 2.92Å; D448-R535 VanDerWaalsContact O-NH1 3.14Å
449	P	50.3	Low	58.8	Low	91 Å²	91	75.6 Å²	75.6	59%	0.591	41%	0.407	S	S	*	.			trans	-73.7	57.7	-174.7	31.7	-36.5	0	0	0	112.1	T451 L534	P449-T451 PolarHBondContact O-N 2.84Å; P449-L534 HydrophobicContact CB-CD2 4.47Å
450	V	53.5	Low	57.6	Low	74 Å²	74	81.9 Å²	81.9	45%	0.448	44%	0.435	S	S	.	.			trans	-78.8	106.6	162.8	-177.6	0	0	0	0	106.4	D448 Q455	D448-V450 PolarHBondContact O-N 3Å; V450-Q455 HydrophobicContact CG1-CG 4.45Å
451	T	54.8	Low	56.4	Low	38 Å²	38	84.9 Å²	84.9	23%	0.233	47%	0.465	C	S	.	.			trans	-68	139.1	177	55.7	0	0	0	0	109	P449 E453 T454	P449-T451 PolarHBondContact O-N 2.84Å; T451-E453 PolarHBondContact O-N 3.37Å; T451-T454 PolarHBondContact O-N 3.4Å; T451-T454 PolarHBondContact O-OG1 2.76Å; T451-T454 WeakPolarHBondContact OG1-CG2 3.38Å; T451-T454 PolarHBondContact OG1-N 3.26Å; T451-T454 PolarHBondContact OG1-OG1 2.86Å
452	L	56.4	Low	55.3	Low	12 Å²	12	87.2 Å²	87.2	6%	0.063	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-13.8	173.9	-66.4	170.4	0	0	0	112.6	T490 K499 R535 F536	L452-T490 HydrophobicContact CD2-CG2 3.85Å; L452-T490 WeakPolarHBondContact CD2-OG1 3.41Å; L452-K499 VanDerWaalsContact C-NZ 3.28Å; L452-K499 HydrophobicContact CB-CD 4.38Å; L452-K499 HydrophobicContact CD1-CD 4.45Å; L452-K499 PolarHBondContact O-NZ 2.93Å; L452-R535 VanDerWaalsContact CB-O 3.24Å; L452-R535 WeakPolarHBondContact CB-O 3.33Å; L452-R535 WeakPolarHBondContact CG-O 3.02Å; L452-R535 PolarHBondContact N-O 3.27Å; L452-F536 HydrophobicContact CD1-CD1 3.58Å; L452-F536 HydrophobicContact CD1-CE1 3.6Å; L452-F536 HydrophobicContact CD1-CG 4.13Å; L452-F536 HydrophobicContact CD1-CZ 4.16Å
453	E	48.8	Very low	54.6	Low	83 Å²	83	87.9 Å²	87.9	39%	0.388	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-29.6	176.1	-61.3	-176.5	161.4	0	0	112.6	T451 H540	T451-E453 PolarHBondContact O-N 3.37Å; E453-H540 IonicContact OE1-CE1 2.63Å; E453-H540 PolarHBondContact OE1-CE1 2.97Å; E453-H540 IonicContact OE1-ND1 3.92Å; E453-H540 PolarHBondContact OE1-ND1 3.1Å
454	T	48.6	Very low	54.1	Low	78 Å²	78	91.2 Å²	91.2	48%	0.479	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-10.3	-179.2	42.3	0	0	0	0	114	T451 S457	T451-T454 PolarHBondContact O-N 3.4Å; T451-T454 PolarHBondContact O-OG1 2.76Å; T451-T454 WeakPolarHBondContact OG1-CG2 3.38Å; T451-T454 PolarHBondContact OG1-N 3.26Å; T451-T454 PolarHBondContact OG1-OG1 2.86Å; T454-S457 PolarHBondContact O-OG 2.78Å
455	Q	50.2	Low	53.9	Low	86 Å²	86	99.4 Å²	99.4	40%	0.402	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-15.8	172.8	-85.7	179.7	1.6	0	0	113.9	V450	V450-Q455 HydrophobicContact CG1-CG 4.45Å
456	D	44.7	Very low	53.6	Low	97 Å²	97	103.3 Å²	103.3	52%	0.519	56%	0.558	S	S	.	*	S	Bend	trans	-86.2	-15.1	176.1	-77.2	-45	0	0	0	112.5	K482	D456-K482 WeakPolarHBondContact OD1-CE 3.47Å; D456-K482 IonicContact OD1-NZ 3.82Å; D456-K482 PolarHBondContact OD1-NZ 3.11Å
457	S	43.3	Very low	54	Low	73 Å²	73	101.3 Å²	101.3	51%	0.51	55%	0.55	S	S	.	*	S	Bend	trans	-78.8	119.2	162.6	43.4	0	0	0	0	108.9	T454 D459	T454-S457 PolarHBondContact O-OG 2.78Å; S457-D459 PolarHBondContact O-N 3.26Å
458	E	43.2	Very low	54.6	Low	180 Å²	180	104.2 Å²	104.2	84%	0.841	56%	0.564	S	S	*	*			trans	-44	120.9	178.6	-62.5	177.6	166.1	0	0	110.8	E460	E458-E460 VanDerWaalsContact C-N 3.32Å; E458-E460 PolarHBondContact O-N 3.16Å
459	D	46.6	Very low	55.5	Low	110 Å²	110	102.4 Å²	102.4	59%	0.588	56%	0.56	S	S	*	*			trans	-62.3	86.2	-179.8	-174.4	18.9	0	0	0	110.4	S457 G461 S462	S457-D459 PolarHBondContact O-N 3.26Å; D459-G461 PolarHBondContact O-N 2.98Å; D459-G461 PolarHBondContact OD1-N 3.14Å; D459-S462 PolarHBondContact OD2-OG 3.39Å
460	E	44.9	Very low	56.4	Low	203 Å²	203	101.6 Å²	101.6	95%	0.949	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	15	167.9	-78.6	-163.8	152.4	0	0	112.3	E458	E458-E460 VanDerWaalsContact C-N 3.32Å; E458-E460 PolarHBondContact O-N 3.16Å
461	G	50.7	Low	57.4	Low	63 Å²	63	100 Å²	100	65%	0.649	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	-8.6	-169.9	0	0	0	0	0	117.3	D459 D463	D459-G461 PolarHBondContact O-N 2.98Å; D459-G461 PolarHBondContact OD1-N 3.14Å; G461-D463 PolarHBondContact O-N 3.18Å
462	S	51.3	Low	58.2	Low	73 Å²	73	108 Å²	108	51%	0.51	57%	0.574	S	S	.	*			trans	-72.3	118.9	179.4	-81.6	0	0	0	0	110.9	D459	D459-S462 PolarHBondContact OD2-OG 3.39Å
463	D	61.2	Low	58.9	Low	93 Å²	93	109.2 Å²	109.2	50%	0.497	58%	0.58	S	S	.	*			trans	-53.4	125.1	173.1	-159.3	-18.7	0	0	0	109	G461 E465 E466	G461-D463 PolarHBondContact O-N 3.18Å; D463-E465 PolarHBondContact O-N 3.23Å; D463-E466 PolarHBondContact O-N 3.23Å
464	P	66.3	Low	60	Low	113 Å²	113	106.2 Å²	106.2	73%	0.734	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	-21.1	-178.3	-29	35.5	0	0	0	114.3
465	E	70.1	Confident	60.9	Low	179 Å²	179	106 Å²	106	84%	0.836	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-22.6	177.8	-60.5	-173.7	172.8	0	0	113.7	D463	D463-E465 PolarHBondContact O-N 3.23Å
466	E	64.9	Low	61.4	Low	154 Å²	154	108.8 Å²	108.8	72%	0.72	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-12.5	179.6	-166.8	166.9	-166.3	0	0	112.6	D463 T468	D463-E466 PolarHBondContact O-N 3.23Å; E466-T468 PolarHBondContact O-N 3.3Å
467	W	74.2	Confident	61.9	Low	163 Å²	163	109.3 Å²	109.3	62%	0.617	59%	0.594	S	S	*	*			trans	-71.4	116.9	179.5	-173.8	88.5	0	0	0	111.8	P469	W467-P469 HydrophobicContact CH2-CB 3.98Å; W467-P469 HydrophobicContact CZ3-CB 4.27Å
468	T	68	Low	62.2	Low	93 Å²	93	116 Å²	116	57%	0.571	61%	0.614	S	S	*	*			trans	-113.8	141	169.7	51	0	0	0	0	111	E466 R484	E466-T468 PolarHBondContact O-N 3.3Å; T468-R484 PolarHBondContact O-NH2 3.14Å
469	P	74.3	Confident	62.4	Low	94 Å²	94	111 Å²	111	61%	0.61	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-68.5	148.9	177.9	28.1	-33.9	0	0	0	111.1	W467	W467-P469 HydrophobicContact CH2-CB 3.98Å; W467-P469 HydrophobicContact CZ3-CB 4.27Å
470	D	69.6	Low	62.6	Low	75 Å²	75	107.1 Å²	107.1	40%	0.401	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-65.4	140.9	179.7	-70.7	-14.8	0	0	0	111.4	A474 R484	D470-A474 HydrophobicContact CB-CB 3.88Å; D470-R484 IonicContact OD1-CZ 3.96Å; D470-R484 IonicContact OD1-NE 3.91Å; D470-R484 IonicContact OD1-NH2 3.04Å; D470-R484 PolarHBondContact OD1-NH2 3.32Å
471	P	73.9	Confident	62.8	Low	41 Å²	41	102.3 Å²	102.3	27%	0.266	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-65.2	158.7	176.3	6.9	-6.1	0	0	0	112.7	V403 D473 A474	V403-P471 HydrophobicContact CB-CG 4.48Å; V403-P471 HydrophobicContact CG2-CG 4.08Å; P471-D473 WeakPolarHBondContact CB-OD1 3.23Å; P471-D473 PolarHBondContact O-N 3.39Å; P471-A474 WeakPolarHBondContact O-CB 3.28Å; P471-A474 PolarHBondContact O-N 3.42Å
472	K	71.6	Confident	62.8	Low	206 Å²	206	105.8 Å²	105.8	90%	0.896	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-20.7	-172.4	64.3	-177.2	176.3	-175.2	0	115.9
473	D	71.4	Confident	62.9	Low	36 Å²	36	103.9 Å²	103.9	19%	0.193	55%	0.549	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-2.1	178.6	57.9	-52.1	0	0	0	113.1	R359 V403 P471 V475	R359-D473 IonicContact CZ-OD1 2.99Å; R359-D473 IonicContact CZ-OD2 2.74Å; R359-D473 VanDerWaalsContact CZ-OD2 3.23Å; R359-D473 IonicContact NE-OD1 3.97Å; R359-D473 PolarHBondContact NE-OD1 3.07Å; R359-D473 IonicContact NE-OD2 3.76Å; R359-D473 PolarHBondContact NE-OD2 3.47Å; R359-D473 IonicContact NH2-OD1 2.81Å; R359-D473 IonicContact NH2-OD2 2.65Å; R359-D473 PolarHBondContact NH2-OD2 3.35Å; V403-D473 WeakPolarHBondContact CG1-OD2 3.45Å; P471-D473 WeakPolarHBondContact CB-OD1 3.23Å; P471-D473 PolarHBondContact O-N 3.39Å; D473-V475 PolarHBondContact O-N 2.99Å
474	A	71.7	Confident	62.7	Low	21 Å²	21	104.7 Å²	104.7	17%	0.174	55%	0.545	C	S	.	.	S	Bend	trans	-61.7	131.1	173.1	0	0	0	0	0	110.6	V403 D470 P471 T476	V403-A474 HydrophobicContact CG1-CB 4.24Å; V403-A474 HydrophobicContact CG2-CB 4.09Å; D470-A474 HydrophobicContact CB-CB 3.88Å; P471-A474 WeakPolarHBondContact O-CB 3.28Å; P471-A474 PolarHBondContact O-N 3.42Å; A474-T476 PolarHBondContact O-N 3.43Å
475	V	66.7	Low	62.3	Low	73 Å²	73	99.9 Å²	99.9	44%	0.442	51%	0.514	S	S	.	.			trans	-67.4	126.8	179.3	-174.4	0	0	0	0	108.9	V407 D473 D477 R483	V407-V475 HydrophobicContact CG2-CG2 3.92Å; D473-V475 PolarHBondContact O-N 2.99Å; V475-D477 VanDerWaalsContact C-N 3.27Å; V475-D477 PolarHBondContact O-N 3.06Å; V475-R483 PolarHBondContact O-NH1 2.87Å; V475-R483 PolarHBondContact O-NH2 3.32Å
476	T	61	Low	61.8	Low	145 Å²	145	94.8 Å²	94.8	89%	0.89	50%	0.499	S	S	*	.			trans	-73.7	79.5	174.4	51.1	0	0	0	0	110.2	A474	A474-T476 PolarHBondContact O-N 3.43Å
477	D	54.8	Low	62.4	Low	108 Å²	108	88.4 Å²	88.4	58%	0.578	47%	0.469	S	S	*	.			trans	-123.7	145.6	172	-135.8	-11.3	0	0	0	108.3	V475 T479 R483	V475-D477 VanDerWaalsContact C-N 3.27Å; V475-D477 PolarHBondContact O-N 3.06Å; D477-T479 PolarHBondContact O-N 3.36Å; D477-R483 VanDerWaalsContact CA-NH2 3.34Å; D477-R483 VanDerWaalsContact N-NH2 3.13Å; D477-R483 PolarHBondContact O-NH2 3.46Å; D477-R483 VanDerWaalsContact O-NH2 3.07Å
478	K	50	Low	62.8	Low	213 Å²	213	80.8 Å²	80.8	93%	0.926	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	7	-166.7	-64.9	-178.4	178.8	179.1	0	115.1
479	T	48.2	Very low	63.5	Low	76 Å²	76	76.5 Å²	76.5	47%	0.466	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	18.4	-175.8	53.5	0	0	0	0	113.5	D477 S481 K482 R483	D477-T479 PolarHBondContact O-N 3.36Å; T479-S481 PolarHBondContact O-N 3.4Å; T479-K482 PolarHBondContact O-N 2.94Å; T479-R483 WeakPolarHBondContact O-CG 3.4Å
480	G	50.3	Low	63.7	Low	28 Å²	28	72.8 Å²	72.8	29%	0.289	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-42.2	-39.1	-173.7	0	0	0	0	0	116.4	R483	G480-R483 WeakPolarHBondContact O-CB 3.34Å
481	S	48.5	Very low	64.3	Low	101 Å²	101	69.7 Å²	69.7	71%	0.706	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-77	-36.4	-178.2	-169.5	0	0	0	0	113.8	T479 R483	T479-S481 PolarHBondContact O-N 3.4Å; S481-R483 PolarHBondContact O-N 2.92Å; S481-R483 VanDerWaalsContact O-N 3.1Å
482	K	50.6	Low	64.7	Low	137 Å²	137	67.9 Å²	67.9	60%	0.596	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-71	-7	179.2	-66.9	-171	171.6	-160.4	0	113.9	D456 T479	D456-K482 WeakPolarHBondContact OD1-CE 3.47Å; D456-K482 IonicContact OD1-NZ 3.82Å; D456-K482 PolarHBondContact OD1-NZ 3.11Å; T479-K482 PolarHBondContact O-N 2.94Å
483	R	53	Low	65.2	Low	33 Å²	33	58.5 Å²	58.5	13%	0.125	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-78.8	-18.4	-172.1	-74.8	179.1	-170.9	-171.6	-14.9	114.8	Q406 V475 D477 T479 G480 S481	Q406-R483 PolarHBondContact NE2-O 3.02Å; V475-R483 PolarHBondContact O-NH1 2.87Å; V475-R483 PolarHBondContact O-NH2 3.32Å; D477-R483 VanDerWaalsContact CA-NH2 3.34Å; D477-R483 VanDerWaalsContact N-NH2 3.13Å; D477-R483 PolarHBondContact O-NH2 3.46Å; D477-R483 VanDerWaalsContact O-NH2 3.07Å; T479-R483 WeakPolarHBondContact O-CG 3.4Å; G480-R483 WeakPolarHBondContact O-CB 3.34Å; S481-R483 PolarHBondContact O-N 2.92Å; S481-R483 VanDerWaalsContact O-N 3.1Å
484	R	57.7	Low	65.5	Low	109 Å²	109	59.5 Å²	59.5	41%	0.411	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-99.8	17.7	-173.9	-62.2	-177.1	179.2	-176.3	-2.9	113.2	T468 D470 S486	T468-R484 PolarHBondContact O-NH2 3.14Å; D470-R484 IonicContact OD1-CZ 3.96Å; D470-R484 IonicContact OD1-NE 3.91Å; D470-R484 IonicContact OD1-NH2 3.04Å; D470-R484 PolarHBondContact OD1-NH2 3.32Å; R484-S486 PolarHBondContact O-N 3.39Å; R484-S486 VanDerWaalsContact O-N 3.09Å
485	S	58.4	Low	65.9	Low	13 Å²	13	58.6 Å²	58.6	9%	0.091	32%	0.323	C	S	.	.			trans	-66.6	112.9	171.5	50.1	0	0	0	0	109.2	D487	S485-D487 PolarHBondContact O-N 3.13Å
486	S	59.4	Low	66.4	Low	72 Å²	72	57.4 Å²	57.4	50%	0.503	31%	0.311	S	S	.	.			trans	-76.8	3.3	-178.2	58.6	0	0	0	0	113.3	R396 R484	R396-S486 PolarHBondContact NH1-O 3.29Å; R396-S486 PolarHBondContact NH2-O 2.92Å; R484-S486 PolarHBondContact O-N 3.39Å; R484-S486 VanDerWaalsContact O-N 3.09Å
487	D	76.3	Confident	66.8	Low	20 Å²	20	53.8 Å²	53.8	11%	0.107	30%	0.303	C	S	.	.			trans	-99.4	128.3	-172.4	-169.4	-8.6	0	0	0	111.6	S485 I489 T490 L491 R535	S485-D487 PolarHBondContact O-N 3.13Å; D487-I489 PolarHBondContact O-N 2.91Å; D487-I489 PolarHBondContact OD1-N 3.42Å; D487-T490 WeakPolarHBondContact CB-OG1 3.4Å; D487-T490 PolarHBondContact O-N 3.28Å; D487-L491 WeakPolarHBondContact O-CG 3.24Å; D487-L491 PolarHBondContact O-N 3.49Å; D487-R535 IonicContact OD1-NH2 3.61Å; D487-R535 PolarHBondContact OD1-NH2 3.31Å; D487-R535 IonicContact OD2-CZ 3.16Å; D487-R535 IonicContact OD2-NH1 3.1Å; D487-R535 PolarHBondContact OD2-NH1 2.93Å; D487-R535 VanDerWaalsContact OD2-NH1 3.12Å; D487-R535 IonicContact OD2-NH2 3.9Å; D487-R535 PolarHBondContact OD2-NH2 3.04Å
488	I	83.6	Confident	67.7	Low	2 Å²	2	50.3 Å²	50.3	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-59.4	-40.3	178.2	-53.4	-178.1	0	0	0	110	I389 I392 K393 L440 E443 L491 L492	I389-I488 HydrophobicContact CG1-CG2 4.14Å; I389-I488 HydrophobicContact CG2-CD1 4.37Å; I389-I488 HydrophobicContact CG2-CG2 4.3Å; I392-I488 HydrophobicContact CD1-CG2 4.01Å; I392-I488 HydrophobicContact CG2-CG1 3.9Å; K393-I488 HydrophobicContact CD-CD1 4.32Å; K393-I488 HydrophobicContact CG-CD1 3.79Å; L440-I488 HydrophobicContact CD1-CG2 4.13Å; E443-I488 HydrophobicContact CG-CB 4.35Å; E443-I488 HydrophobicContact CG-CD1 4.04Å; E443-I488 HydrophobicContact CG-CG1 4.32Å; I488-L491 PolarHBondContact O-N 2.94Å; I488-L492 HydrophobicContact CG2-CD1 4.21Å; I488-L492 WeakPolarHBondContact O-CG 3.3Å; I488-L492 PolarHBondContact O-N 3.32Å
489	I	81.9	Confident	69	Low	4 Å²	4	42.4 Å²	42.4	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-66.5	-44.7	-178.8	-59.3	176	0	0	0	109.7	L430 L440 L444 D487 L491 L492 V493 F536	L430-I489 HydrophobicContact CD2-CD1 4.09Å; L430-I489 HydrophobicContact CD2-CG1 4.37Å; L440-I489 HydrophobicContact CD1-CG1 3.88Å; L444-I489 HydrophobicContact CB-CD1 3.92Å; L444-I489 HydrophobicContact CD1-CD1 3.63Å; L444-I489 HydrophobicContact CG-CD1 4.39Å; D487-I489 PolarHBondContact O-N 2.91Å; D487-I489 PolarHBondContact OD1-N 3.42Å; I489-L491 VanDerWaalsContact C-N 3.32Å; I489-L491 PolarHBondContact O-N 3.4Å; I489-L492 PolarHBondContact O-N 3Å; I489-V493 HydrophobicContact CG2-CG2 4.3Å; I489-V493 VanDerWaalsContact O-CG2 3.3Å; I489-V493 WeakPolarHBondContact O-CG2 3.37Å; I489-V493 PolarHBondContact O-N 2.91Å; I489-F536 HydrophobicContact CG2-CZ 4.38Å
490	T	79.1	Confident	70.3	Confident	16 Å²	16	41.9 Å²	41.9	10%	0.098	25%	0.245	C	C	.	.	H	α-helix	trans	-60.1	-42.5	174.9	-51.7	0	0	0	0	111.6	L452 D487 L492 V493 S494	L452-T490 HydrophobicContact CD2-CG2 3.85Å; L452-T490 WeakPolarHBondContact CD2-OG1 3.41Å; D487-T490 WeakPolarHBondContact CB-OG1 3.4Å; D487-T490 PolarHBondContact O-N 3.28Å; T490-L492 VanDerWaalsContact C-N 3.33Å; T490-L492 PolarHBondContact O-N 3.39Å; T490-V493 PolarHBondContact O-N 3.32Å; T490-S494 VanDerWaalsContact O-CB 3.24Å; T490-S494 WeakPolarHBondContact O-CB 3.43Å; T490-S494 PolarHBondContact O-N 2.95Å; T490-S494 PolarHBondContact O-OG 3.45Å
491	L	81.7	Confident	71.8	Confident	10 Å²	10	43.4 Å²	43.4	5%	0.052	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-36.2	176.7	-78.7	159.8	0	0	0	112.5	I392 D487 I488 I489 S494	I392-L491 HydrophobicContact CD1-CB 4.14Å; I392-L491 HydrophobicContact CD1-CD1 4.35Å; I392-L491 HydrophobicContact CG1-CD1 4.4Å; I392-L491 HydrophobicContact CG2-CD1 3.77Å; D487-L491 WeakPolarHBondContact O-CG 3.24Å; D487-L491 PolarHBondContact O-N 3.49Å; I488-L491 PolarHBondContact O-N 2.94Å; I489-L491 VanDerWaalsContact C-N 3.32Å; I489-L491 PolarHBondContact O-N 3.4Å; L491-S494 PolarHBondContact O-OG 2.97Å
492	L	83.4	Confident	73.5	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-71	-44.7	174.4	-75.7	165.7	0	0	0	111.9	Y388 I389 I426 L440 I488 I489 T490 S494 I495	Y388-L492 HydrophobicContact CD1-CD2 3.68Å; Y388-L492 HydrophobicContact CE1-CD2 3.69Å; Y388-L492 HydrophobicContact CE1-CG 4.37Å; I389-L492 HydrophobicContact CG1-CD1 4.45Å; I426-L492 HydrophobicContact CD1-CD2 4.28Å; L440-L492 HydrophobicContact CD1-CD1 3.71Å; L440-L492 HydrophobicContact CD2-CD1 3.87Å; L440-L492 HydrophobicContact CG-CD1 4.48Å; I488-L492 HydrophobicContact CG2-CD1 4.21Å; I488-L492 WeakPolarHBondContact O-CG 3.3Å; I488-L492 PolarHBondContact O-N 3.32Å; I489-L492 PolarHBondContact O-N 3Å; T490-L492 VanDerWaalsContact C-N 3.33Å; T490-L492 PolarHBondContact O-N 3.39Å; L492-S494 PolarHBondContact O-N 3.14Å; L492-I495 HydrophobicContact CD2-CD1 4.36Å; L492-I495 VanDerWaalsContact O-CB 3.27Å; L492-I495 WeakPolarHBondContact O-CB 3.29Å; L492-I495 WeakPolarHBondContact O-CG1 3.39Å; L492-I495 PolarHBondContact O-N 2.96Å
493	V	81.1	Confident	75.1	Confident	10 Å²	10	33.3 Å²	33.3	6%	0.061	19%	0.19	C	C	.	.	H	α-helix	trans	-66.9	-38.3	179.9	175	0	0	0	0	111.4	I489 T490 I495 Y496 G497 K499 F502 F536	I489-V493 HydrophobicContact CG2-CG2 4.3Å; I489-V493 VanDerWaalsContact O-CG2 3.3Å; I489-V493 WeakPolarHBondContact O-CG2 3.37Å; I489-V493 PolarHBondContact O-N 2.91Å; T490-V493 PolarHBondContact O-N 3.32Å; V493-I495 PolarHBondContact O-N 3.27Å; V493-I495 VanDerWaalsContact O-N 3.08Å; V493-Y496 PolarHBondContact O-N 2.78Å; V493-G497 PolarHBondContact O-N 2.59Å; V493-K499 HydrophobicContact CG1-CB 4.48Å; V493-K499 HydrophobicContact CG1-CG 3.92Å; V493-F502 HydrophobicContact CB-CD2 4.41Å; V493-F502 HydrophobicContact CB-CE2 4.1Å; V493-F502 HydrophobicContact CG1-CD2 4.05Å; V493-F502 HydrophobicContact CG1-CE2 4.07Å; V493-F502 HydrophobicContact CG2-CD2 4.1Å; V493-F502 HydrophobicContact CG2-CE2 4.04Å; V493-F502 HydrophobicContact CG2-CG 4.36Å; V493-F502 HydrophobicContact CG2-CZ 4.25Å; V493-F536 HydrophobicContact CG1-CE1 4.4Å; V493-F536 HydrophobicContact CG2-CE1 3.91Å; V493-F536 HydrophobicContact CG2-CZ 3.85Å
494	S	78.3	Confident	76.5	Confident	57 Å²	57	33.2 Å²	33.2	40%	0.399	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-17.9	176.9	74.6	0	0	0	0	113.7	T490 L491 L492 Y496 G497	T490-S494 VanDerWaalsContact O-CB 3.24Å; T490-S494 WeakPolarHBondContact O-CB 3.43Å; T490-S494 PolarHBondContact O-N 2.95Å; T490-S494 PolarHBondContact O-OG 3.45Å; L491-S494 PolarHBondContact O-OG 2.97Å; L492-S494 PolarHBondContact O-N 3.14Å; S494-Y496 VanDerWaalsContact C-N 3.26Å; S494-Y496 PolarHBondContact O-N 3.38Å; S494-G497 PolarHBondContact O-N 3.32Å
495	I	80.6	Confident	77.8	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.005	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-41.7	172.1	-59.3	177.7	0	0	0	109.4	Y388 R413 L416 R417 L492 V493	Y388-I495 HydrophobicContact CE1-CD1 3.79Å; R413-I495 HydrophobicContact CB-CG1 4.34Å; R413-I495 HydrophobicContact CB-CG2 4.37Å; R413-I495 HydrophobicContact CG-CD1 4.18Å; R413-I495 HydrophobicContact CG-CG1 3.97Å; L416-I495 HydrophobicContact CD1-CD1 4.07Å; R417-I495 HydrophobicContact CG-CG2 3.61Å; R417-I495 PolarHBondContact NE-O 2.73Å; R417-I495 PolarHBondContact NH2-O 3.47Å; L492-I495 HydrophobicContact CD2-CD1 4.36Å; L492-I495 VanDerWaalsContact O-CB 3.27Å; L492-I495 WeakPolarHBondContact O-CB 3.29Å; L492-I495 WeakPolarHBondContact O-CG1 3.39Å; L492-I495 PolarHBondContact O-N 2.96Å; V493-I495 PolarHBondContact O-N 3.27Å; V493-I495 VanDerWaalsContact O-N 3.08Å
496	Y	77	Confident	79.2	Confident	48 Å²	48	28.7 Å²	28.7	19%	0.188	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-10.2	-175.1	-64.1	-89.1	0	0	0	113.4	L416 T422 V423 I426 V493 S494 S498 F502	L416-Y496 PolarHBondContact O-OH 3.08Å; L416-Y496 VanDerWaalsContact O-OH 3.08Å; T422-Y496 WeakPolarHBondContact CB-OH 3.29Å; T422-Y496 HydrophobicContact CG2-CE2 4.5Å; T422-Y496 WeakPolarHBondContact CG2-OH 3.33Å; V423-Y496 HydrophobicContact CG2-CD1 4.28Å; V423-Y496 HydrophobicContact CG2-CD2 4.42Å; V423-Y496 HydrophobicContact CG2-CE1 3.92Å; V423-Y496 HydrophobicContact CG2-CE2 4.08Å; I426-Y496 HydrophobicContact CD1-CE2 4.43Å; V493-Y496 PolarHBondContact O-N 2.78Å; S494-Y496 VanDerWaalsContact C-N 3.26Å; S494-Y496 PolarHBondContact O-N 3.38Å; Y496-S498 PolarHBondContact O-N 3.46Å; Y496-F502 AromaticContact CD2-CE2 3.65Å; Y496-F502 HydrophobicContact CD2-CE2 3.65Å; Y496-F502 AromaticContact CD2-CZ 3.56Å; Y496-F502 HydrophobicContact CD2-CZ 3.56Å; Y496-F502 HydrophobicContact CE2-CZ 4.02Å; Y496-F502 HydrophobicContact CG-CE2 4.21Å; Y496-F502 HydrophobicContact CG-CZ 4.5Å
497	G	68.9	Low	80.6	Confident	70 Å²	70	27.3 Å²	27.3	72%	0.722	16%	0.157	S	C	*	.	S	Bend	trans	78.7	-33	176	0	0	0	0	0	114.3	V493 S494	V493-G497 PolarHBondContact O-N 2.59Å; S494-G497 PolarHBondContact O-N 3.32Å
498	S	74.1	Confident	81.1	Confident	35 Å²	35	26.9 Å²	26.9	25%	0.245	16%	0.156	C	C	.	.			trans	-109.8	136.9	173.3	178.9	0	0	0	0	112	Y496 E500	Y496-S498 PolarHBondContact O-N 3.46Å; S498-E500 VanDerWaalsContact C-N 3.31Å; S498-E500 WeakPolarHBondContact OG-CB 3.47Å; S498-E500 PolarHBondContact OG-N 2.83Å; S498-E500 VanDerWaalsContact OG-N 3.15Å
499	K	76.1	Confident	81.1	Confident	47 Å²	47	27.5 Å²	27.5	20%	0.204	16%	0.16	C	C	.	.	S	Bend	trans	-72.3	-26.8	173	-61.2	170.4	-173.9	168.8	0	111.5	L452 V493 I501 F502 I503 F536	L452-K499 VanDerWaalsContact C-NZ 3.28Å; L452-K499 HydrophobicContact CB-CD 4.38Å; L452-K499 HydrophobicContact CD1-CD 4.45Å; L452-K499 PolarHBondContact O-NZ 2.93Å; V493-K499 HydrophobicContact CG1-CB 4.48Å; V493-K499 HydrophobicContact CG1-CG 3.92Å; K499-I501 VanDerWaalsContact C-N 3.29Å; K499-I501 PolarHBondContact O-N 3.48Å; K499-F502 PolarHBondContact O-N 3.16Å; K499-I503 HydrophobicContact CB-CD1 4.36Å; K499-I503 WeakPolarHBondContact O-CD1 3.06Å; K499-I503 WeakPolarHBondContact O-CG1 3.43Å; K499-I503 PolarHBondContact O-N 3.28Å; K499-F536 HydrophobicContact CB-CD1 4.25Å; K499-F536 HydrophobicContact CB-CE1 4.46Å; K499-F536 HydrophobicContact CG-CD1 4.43Å
500	E	75.3	Confident	81.4	Confident	65 Å²	65	27.4 Å²	27.4	30%	0.304	16%	0.159	S	C	.	.	H	α-helix	trans	-61.7	-35.2	-174.1	-62.2	-178.9	166.8	0	0	112.7	S498 F502 I503 D504	S498-E500 VanDerWaalsContact C-N 3.31Å; S498-E500 WeakPolarHBondContact OG-CB 3.47Å; S498-E500 PolarHBondContact OG-N 2.83Å; S498-E500 VanDerWaalsContact OG-N 3.15Å; E500-F502 VanDerWaalsContact C-N 3.26Å; E500-F502 PolarHBondContact O-N 2.99Å; E500-I503 PolarHBondContact O-N 3.05Å; E500-I503 VanDerWaalsContact O-N 3.12Å; E500-D504 WeakPolarHBondContact O-CB 3.41Å; E500-D504 PolarHBondContact O-N 3.38Å
501	I	82.3	Confident	81.8	Confident	59 Å²	59	26.6 Å²	26.6	30%	0.303	15%	0.154	S	C	.	.	H	α-helix	trans	-60.4	-39	179.7	-59.8	166.6	0	0	0	110.8	V423 K499 E505	V423-I501 HydrophobicContact CG1-CG2 4.19Å; V423-I501 HydrophobicContact CG2-CG2 3.97Å; K499-I501 VanDerWaalsContact C-N 3.29Å; K499-I501 PolarHBondContact O-N 3.48Å; I501-E505 WeakPolarHBondContact O-CB 3.44Å; I501-E505 PolarHBondContact O-N 2.87Å
502	F	83.8	Confident	81.8	Confident	6 Å²	6	26.9 Å²	26.9	3%	0.026	16%	0.156	C	C	.	.	H	α-helix	trans	-71.7	-37.8	177.3	-73.6	-89.9	0	0	0	112.2	V423 I426 V427 V493 Y496 K499 E500 Y506	V423-F502 HydrophobicContact CG1-CD1 3.92Å; V423-F502 HydrophobicContact CG1-CE1 4.17Å; V423-F502 HydrophobicContact CG1-CG 4.28Å; I426-F502 HydrophobicContact CB-CE1 4.05Å; I426-F502 HydrophobicContact CD1-CE1 3.87Å; I426-F502 HydrophobicContact CD1-CZ 4.13Å; I426-F502 HydrophobicContact CG2-CD1 4.35Å; I426-F502 HydrophobicContact CG2-CE1 3.74Å; V427-F502 HydrophobicContact CG2-CD1 4.39Å; V493-F502 HydrophobicContact CB-CD2 4.41Å; V493-F502 HydrophobicContact CB-CE2 4.1Å; V493-F502 HydrophobicContact CG1-CD2 4.05Å; V493-F502 HydrophobicContact CG1-CE2 4.07Å; V493-F502 HydrophobicContact CG2-CD2 4.1Å; V493-F502 HydrophobicContact CG2-CE2 4.04Å; V493-F502 HydrophobicContact CG2-CG 4.36Å; V493-F502 HydrophobicContact CG2-CZ 4.25Å; Y496-F502 AromaticContact CD2-CE2 3.65Å; Y496-F502 HydrophobicContact CD2-CE2 3.65Å; Y496-F502 AromaticContact CD2-CZ 3.56Å; Y496-F502 HydrophobicContact CD2-CZ 3.56Å; Y496-F502 HydrophobicContact CE2-CZ 4.02Å; Y496-F502 HydrophobicContact CG-CE2 4.21Å; Y496-F502 HydrophobicContact CG-CZ 4.5Å; K499-F502 PolarHBondContact O-N 3.16Å; E500-F502 VanDerWaalsContact C-N 3.26Å; E500-F502 PolarHBondContact O-N 2.99Å; F502-Y506 VanDerWaalsContact O-CB 3.28Å; F502-Y506 WeakPolarHBondContact O-CB 3.44Å; F502-Y506 PolarHBondContact O-N 2.92Å
503	I	84.9	Confident	81.7	Confident	21 Å²	21	28.5 Å²	28.5	11%	0.108	16%	0.162	C	C	.	.	H	α-helix	trans	-69.1	-43.7	-178.5	-61.1	159.7	0	0	0	110.2	K499 E500 Y506 R507 H540 M541	K499-I503 HydrophobicContact CB-CD1 4.36Å; K499-I503 WeakPolarHBondContact O-CD1 3.06Å; K499-I503 WeakPolarHBondContact O-CG1 3.43Å; K499-I503 PolarHBondContact O-N 3.28Å; E500-I503 PolarHBondContact O-N 3.05Å; E500-I503 VanDerWaalsContact O-N 3.12Å; I503-Y506 PolarHBondContact O-N 2.93Å; I503-R507 WeakPolarHBondContact O-CB 3.5Å; I503-R507 PolarHBondContact O-N 2.71Å; I503-H540 HydrophobicContact CD1-CB 3.59Å; I503-H540 HydrophobicContact CG1-CB 4.5Å; I503-H540 WeakPolarHBondContact CG2-O 3.35Å; I503-M541 HydrophobicContact CB-CE 4.14Å; I503-M541 HydrophobicContact CD1-CE 4.33Å; I503-M541 HydrophobicContact CG1-CE 3.6Å; I503-M541 HydrophobicContact CG2-CE 3.68Å
504	D	82.8	Confident	81.9	Confident	31 Å²	31	28.1 Å²	28.1	17%	0.166	16%	0.159	C	C	.	.	H	α-helix	trans	-65.7	-40.9	179.1	-161.6	41.2	0	0	0	111.6	E500 R507 T508	E500-D504 WeakPolarHBondContact O-CB 3.41Å; E500-D504 PolarHBondContact O-N 3.38Å; D504-R507 PolarHBondContact O-N 3.13Å; D504-R507 IonicContact OD1-CZ 3.53Å; D504-R507 VanDerWaalsContact OD1-CZ 3.26Å; D504-R507 IonicContact OD1-NE 2.62Å; D504-R507 IonicContact OD1-NH2 2.73Å; D504-R507 PolarHBondContact OD1-NH2 3.05Å; D504-T508 WeakPolarHBondContact O-CB 3.22Å; D504-T508 PolarHBondContact O-N 2.88Å; D504-T508 PolarHBondContact O-OG1 3.4Å
505	E	85.5	Confident	82	Confident	18 Å²	18	26 Å²	26	8%	0.084	14%	0.144	C	C	.	.	H	α-helix	trans	-66.8	-42.6	173.8	-171.1	60.1	-166.3	0	0	111.6	V423 R424 V427 I501 R507 T508 V509 Q733	V423-E505 HydrophobicContact CB-CG 4.44Å; V423-E505 HydrophobicContact CG1-CB 3.73Å; V423-E505 HydrophobicContact CG1-CG 3.92Å; R424-E505 HydrophobicContact CB-CG 4.27Å; R424-E505 WeakPolarHBondContact CB-OE1 3.3Å; R424-E505 WeakPolarHBondContact CD-OE1 3.09Å; R424-E505 WeakPolarHBondContact CG-OE1 3.33Å; V427-E505 HydrophobicContact CG2-CB 4.35Å; V427-E505 HydrophobicContact CG2-CG 4.27Å; I501-E505 WeakPolarHBondContact O-CB 3.44Å; I501-E505 PolarHBondContact O-N 2.87Å; E505-R507 VanDerWaalsContact C-N 3.33Å; E505-R507 PolarHBondContact O-N 3.32Å; E505-T508 WeakPolarHBondContact O-CB 3.22Å; E505-T508 PolarHBondContact O-N 3.01Å; E505-V509 HydrophobicContact CG-CG2 4.44Å; E505-V509 WeakPolarHBondContact O-CB 3.32Å; E505-V509 WeakPolarHBondContact O-CG2 3.16Å; E505-V509 PolarHBondContact O-N 3.1Å; E505-Q733 PolarHBondContact OE2-NE2 3.32Å
506	Y	88.2	Confident	81.8	Confident	8 Å²	8	30.3 Å²	30.3	3%	0.031	16%	0.163	C	C	.	.	H	α-helix	trans	-61.3	-41.3	174.6	178.8	-116.5	0	0	0	112.4	V427 T431 F502 I503 T508 V509 L510 V529 L532 M541 C544	V427-Y506 HydrophobicContact CG1-CD2 3.72Å; V427-Y506 HydrophobicContact CG1-CG 4.33Å; T431-Y506 HydrophobicContact CG2-CD2 4.03Å; T431-Y506 HydrophobicContact CG2-CE2 3.51Å; F502-Y506 VanDerWaalsContact O-CB 3.28Å; F502-Y506 WeakPolarHBondContact O-CB 3.44Å; F502-Y506 PolarHBondContact O-N 2.92Å; I503-Y506 PolarHBondContact O-N 2.93Å; Y506-T508 VanDerWaalsContact C-N 3.3Å; Y506-T508 PolarHBondContact O-N 2.67Å; Y506-V509 PolarHBondContact O-N 3.16Å; Y506-L510 WeakPolarHBondContact O-CB 3.38Å; Y506-L510 PolarHBondContact O-N 3.16Å; Y506-V529 HydrophobicContact CE1-CG2 4Å; Y506-V529 WeakPolarHBondContact OH-CG2 3.3Å; Y506-L532 HydrophobicContact CD1-CD1 3.84Å; Y506-L532 HydrophobicContact CD2-CD1 4.26Å; Y506-L532 HydrophobicContact CE1-CD1 3.54Å; Y506-L532 HydrophobicContact CE2-CD1 4Å; Y506-L532 HydrophobicContact CG-CD1 4.18Å; Y506-M541 HydrophobicContact CD1-SD 4.47Å; Y506-C544 HydrophobicContact CD1-CB 4.47Å; Y506-C544 VanDerWaalsContact CD1-SG 3.6Å; Y506-C544 HydrophobicContact CE1-CB 4.1Å
507	R	87.8	Confident	81.4	Confident	43 Å²	43	33 Å²	33	16%	0.162	18%	0.178	C	C	.	.	H	α-helix	trans	-59.5	-43.2	174.4	-170.8	-174.3	61.4	-177.8	-1.1	111.3	I503 D504 E505 L510 A511 M547 P589	I503-R507 WeakPolarHBondContact O-CB 3.5Å; I503-R507 PolarHBondContact O-N 2.71Å; D504-R507 PolarHBondContact O-N 3.13Å; D504-R507 IonicContact OD1-CZ 3.53Å; D504-R507 VanDerWaalsContact OD1-CZ 3.26Å; D504-R507 IonicContact OD1-NE 2.62Å; D504-R507 IonicContact OD1-NH2 2.73Å; D504-R507 PolarHBondContact OD1-NH2 3.05Å; E505-R507 VanDerWaalsContact C-N 3.33Å; E505-R507 PolarHBondContact O-N 3.32Å; R507-L510 PolarHBondContact O-N 3.27Å; R507-A511 WeakPolarHBondContact O-CB 3.22Å; R507-A511 PolarHBondContact O-N 2.7Å; R507-M547 HydrophobicContact CG-CE 4.39Å; R507-M547 HydrophobicContact CG-SD 3.58Å; R507-M547 VanDerWaalsContact CG-SD 3.58Å; R507-P589 HydrophobicContact CG-CG 3.88Å
508	T	86.1	Confident	81.1	Confident	12 Å²	12	32.5 Å²	32.5	7%	0.074	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-49.2	178.6	-59.9	0	0	0	0	111.7	D504 E505 Y506 L510 A511 D512 T730	D504-T508 WeakPolarHBondContact O-CB 3.22Å; D504-T508 PolarHBondContact O-N 2.88Å; D504-T508 PolarHBondContact O-OG1 3.4Å; E505-T508 WeakPolarHBondContact O-CB 3.22Å; E505-T508 PolarHBondContact O-N 3.01Å; Y506-T508 VanDerWaalsContact C-N 3.3Å; Y506-T508 PolarHBondContact O-N 2.67Å; T508-L510 VanDerWaalsContact C-N 3.33Å; T508-L510 PolarHBondContact O-N 3.41Å; T508-A511 WeakPolarHBondContact O-CB 3.32Å; T508-A511 PolarHBondContact O-N 3.39Å; T508-D512 PolarHBondContact O-N 3.29Å; T508-T730 HydrophobicContact CG2-CG2 4.36Å; T508-T730 WeakPolarHBondContact CG2-OG1 3.35Å
509	V	85.4	Confident	80.5	Confident	15 Å²	15	38.6 Å²	38.6	9%	0.091	19%	0.186	C	C	.	.	H	α-helix	trans	-62.3	-40.4	176.8	170.5	0	0	0	0	111.6	R424 V427 E505 Y506 R513	R424-V509 HydrophobicContact CG-CG2 4.22Å; V427-V509 HydrophobicContact CG1-CB 4.38Å; V427-V509 HydrophobicContact CG1-CG2 4.36Å; E505-V509 HydrophobicContact CG-CG2 4.44Å; E505-V509 WeakPolarHBondContact O-CB 3.32Å; E505-V509 WeakPolarHBondContact O-CG2 3.16Å; E505-V509 PolarHBondContact O-N 3.1Å; Y506-V509 PolarHBondContact O-N 3.16Å; V509-R513 VanDerWaalsContact CG1-NE 3.33Å; V509-R513 WeakPolarHBondContact O-CG 3.18Å; V509-R513 PolarHBondContact O-N 3.32Å
510	L	86.9	Confident	79.9	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-64.7	-43.6	175.5	-178.7	64	0	0	0	111.2	Y506 R507 T508 R513 L514 E525 C544 M547 L548	Y506-L510 WeakPolarHBondContact O-CB 3.38Å; Y506-L510 PolarHBondContact O-N 3.16Å; R507-L510 PolarHBondContact O-N 3.27Å; T508-L510 VanDerWaalsContact C-N 3.33Å; T508-L510 PolarHBondContact O-N 3.41Å; L510-R513 PolarHBondContact O-N 3.02Å; L510-L514 HydrophobicContact CD1-CD1 4.07Å; L510-L514 HydrophobicContact CD1-CG 4.16Å; L510-L514 HydrophobicContact CG-CD1 3.92Å; L510-L514 HydrophobicContact CG-CG 4.38Å; L510-L514 WeakPolarHBondContact O-CB 3.38Å; L510-L514 VanDerWaalsContact O-CG 3.25Å; L510-L514 WeakPolarHBondContact O-CG 3.4Å; L510-L514 PolarHBondContact O-N 3.32Å; L510-E525 HydrophobicContact CD1-CB 4.08Å; L510-E525 HydrophobicContact CD1-CG 3.72Å; L510-C544 HydrophobicContact CD2-CB 3.72Å; L510-M547 HydrophobicContact CB-CE 4.39Å; L510-M547 HydrophobicContact CD2-CE 4.3Å; L510-M547 HydrophobicContact CD2-SD 4.43Å; L510-M547 HydrophobicContact CG-CE 4.2Å; L510-L548 HydrophobicContact CD1-CD2 4.31Å; L510-L548 HydrophobicContact CD2-CG 4.47Å
511	A	87.3	Confident	79.6	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.2	-49.8	177	0	0	0	0	0	111.1	R507 T508 R513 L514 L515 M547 W588 P589 T730	R507-A511 WeakPolarHBondContact O-CB 3.22Å; R507-A511 PolarHBondContact O-N 2.7Å; T508-A511 WeakPolarHBondContact O-CB 3.32Å; T508-A511 PolarHBondContact O-N 3.39Å; A511-R513 VanDerWaalsContact C-N 3.35Å; A511-R513 PolarHBondContact O-N 3.44Å; A511-L514 PolarHBondContact O-N 2.9Å; A511-L515 WeakPolarHBondContact O-CB 3.48Å; A511-L515 VanDerWaalsContact O-CG 3.24Å; A511-L515 WeakPolarHBondContact O-CG 3.43Å; A511-L515 PolarHBondContact O-N 3.5Å; A511-M547 HydrophobicContact CB-CE 3.61Å; A511-W588 HydrophobicContact CB-CE3 3.88Å; A511-W588 HydrophobicContact CB-CZ3 3.93Å; A511-P589 HydrophobicContact CB-CG 3.78Å; A511-T730 HydrophobicContact CB-CG2 4.12Å
512	D	82.6	Confident	79.5	Confident	16 Å²	16	38.5 Å²	38.5	9%	0.086	19%	0.189	C	C	.	.	H	α-helix	trans	-57.2	-48	177.9	-78.8	-20.9	0	0	0	110.6	T508 L514 L515 H516 S728 N729	T508-D512 PolarHBondContact O-N 3.29Å; D512-L514 PolarHBondContact O-N 2.87Å; D512-L515 PolarHBondContact O-N 3.47Å; D512-H516 PolarHBondContact O-N 2.66Å; D512-H516 PolarHBondContact O-ND1 3.4Å; D512-S728 PolarHBondContact OD1-OG 3.32Å; D512-S728 PolarHBondContact OD2-OG 3.4Å; D512-N729 PolarHBondContact OD1-N 2.95Å
513	R	80.8	Confident	79.6	Confident	35 Å²	35	40.8 Å²	40.8	13%	0.132	21%	0.209	C	C	.	.	H	α-helix	trans	-60.2	-44.6	178.9	-71.3	178.7	-149.6	-172.9	0.2	113.4	T431 D433 V509 L510 A511 L515 Q517	T431-R513 PolarHBondContact OG1-NH1 3.42Å; T431-R513 PolarHBondContact OG1-NH2 3Å; D433-R513 IonicContact OD1-NH1 3.26Å; D433-R513 IonicContact OD2-CZ 2.88Å; D433-R513 IonicContact OD2-NE 2.76Å; D433-R513 PolarHBondContact OD2-NE 2.77Å; D433-R513 IonicContact OD2-NH1 3.62Å; D433-R513 PolarHBondContact OD2-NH1 3.43Å; D433-R513 IonicContact OD2-NH2 3.59Å; D433-R513 PolarHBondContact OD2-NH2 2.85Å; V509-R513 VanDerWaalsContact CG1-NE 3.33Å; V509-R513 WeakPolarHBondContact O-CG 3.18Å; V509-R513 PolarHBondContact O-N 3.32Å; L510-R513 PolarHBondContact O-N 3.02Å; A511-R513 VanDerWaalsContact C-N 3.35Å; A511-R513 PolarHBondContact O-N 3.44Å; R513-L515 VanDerWaalsContact C-N 3.33Å; R513-Q517 PolarHBondContact O-N 2.89Å
514	L	85.1	Confident	79.5	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-66.8	-36.4	-178.6	-67.4	175.3	0	0	0	111.5	L510 A511 D512 Y520 T522 M547 L548 V551 M581 W588	L510-L514 HydrophobicContact CD1-CD1 4.07Å; L510-L514 HydrophobicContact CD1-CG 4.16Å; L510-L514 HydrophobicContact CG-CD1 3.92Å; L510-L514 HydrophobicContact CG-CG 4.38Å; L510-L514 WeakPolarHBondContact O-CB 3.38Å; L510-L514 VanDerWaalsContact O-CG 3.25Å; L510-L514 WeakPolarHBondContact O-CG 3.4Å; L510-L514 PolarHBondContact O-N 3.32Å; A511-L514 PolarHBondContact O-N 2.9Å; D512-L514 PolarHBondContact O-N 2.87Å; L514-Y520 HydrophobicContact CD2-CD1 4.07Å; L514-T522 HydrophobicContact CD2-CG2 4.33Å; L514-M547 HydrophobicContact CD1-CB 4.39Å; L514-M547 HydrophobicContact CD1-CE 4.49Å; L514-L548 HydrophobicContact CD1-CD2 4.18Å; L514-L548 HydrophobicContact CD2-CD2 4.12Å; L514-V551 HydrophobicContact CB-CG2 4.37Å; L514-V551 HydrophobicContact CD1-CG2 4.03Å; L514-V551 HydrophobicContact CD2-CG2 4.24Å; L514-V551 HydrophobicContact CG-CG2 4.44Å; L514-M581 WeakPolarHBondContact O-CE 3.4Å; L514-W588 HydrophobicContact CB-CH2 3.78Å; L514-W588 HydrophobicContact CB-CZ3 4.33Å; L514-W588 HydrophobicContact CD1-CH2 3.72Å; L514-W588 HydrophobicContact CD1-CZ2 4.18Å; L514-W588 HydrophobicContact CG-CH2 4.42Å
515	L	80.9	Confident	79.7	Confident	14 Å²	14	43.1 Å²	43.1	7%	0.073	21%	0.214	C	C	.	.	H	α-helix	trans	-72.9	-36.6	178.7	-68.7	171.5	0	0	0	112.9	A511 D512 R513 Q517 F518 M581 L583 W588 L591 L628 N729	A511-L515 WeakPolarHBondContact O-CB 3.48Å; A511-L515 VanDerWaalsContact O-CG 3.24Å; A511-L515 WeakPolarHBondContact O-CG 3.43Å; A511-L515 PolarHBondContact O-N 3.5Å; D512-L515 PolarHBondContact O-N 3.47Å; R513-L515 VanDerWaalsContact C-N 3.33Å; L515-Q517 VanDerWaalsContact C-N 3.34Å; L515-Q517 PolarHBondContact O-N 2.99Å; L515-F518 WeakPolarHBondContact O-CE2 3.2Å; L515-M581 HydrophobicContact CD2-SD 4.4Å; L515-L583 HydrophobicContact CD2-CD1 3.78Å; L515-W588 HydrophobicContact CD1-CZ3 4.44Å; L515-W588 HydrophobicContact CD2-CZ3 4.21Å; L515-W588 HydrophobicContact CG-CZ3 4.03Å; L515-L591 HydrophobicContact CD1-CD2 3.83Å; L515-L628 HydrophobicContact CD1-CD1 4.4Å; L515-N729 HydrophobicContact CD1-CB 4.15Å
516	H	75.9	Confident	79.8	Confident	90 Å²	90	45.7 Å²	45.7	42%	0.417	23%	0.227	S	C	.	.	H	α-helix	trans	-73	-22.9	-179.1	-74.6	86.4	0	0	0	113.5	D512 N729	D512-H516 PolarHBondContact O-N 2.66Å; D512-H516 PolarHBondContact O-ND1 3.4Å; H516-N729 PolarHBondContact CE1-ND2 2.89Å
517	Q	69.5	Low	79.7	Confident	104 Å²	104	53.4 Å²	53.4	49%	0.486	26%	0.256	S	S	.	.			trans	-125.8	88.8	-173.2	-61.3	-170.7	22.1	0	0	112.8	R513 L515 N519 Y520	R513-Q517 PolarHBondContact O-N 2.89Å; L515-Q517 VanDerWaalsContact C-N 3.34Å; L515-Q517 PolarHBondContact O-N 2.99Å; Q517-N519 PolarHBondContact O-N 3.45Å; Q517-Y520 HydrophobicContact CB-CD2 4.07Å; Q517-Y520 HydrophobicContact CB-CG 4.2Å; Q517-Y520 VanDerWaalsContact O-CB 3.23Å; Q517-Y520 WeakPolarHBondContact O-CB 3.11Å; Q517-Y520 PolarHBondContact O-N 3.45Å; Q517-Y520 VanDerWaalsContact OE1-CE2 3.28Å
518	F	62.6	Low	79.7	Confident	61 Å²	61	52.1 Å²	52.1	27%	0.268	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-28.4	179.9	-75.9	-102.2	0	0	0	113.8	L515 R555 M581 L630	L515-F518 WeakPolarHBondContact O-CE2 3.2Å; F518-R555 PolarHBondContact O-NH2 3.48Å; F518-M581 HydrophobicContact CD1-CB 4.41Å; F518-M581 HydrophobicContact CD1-CE 3.88Å; F518-M581 HydrophobicContact CE1-CB 3.99Å; F518-M581 HydrophobicContact CE1-CE 4.22Å; F518-M581 HydrophobicContact CG-CE 4.18Å; F518-L630 HydrophobicContact CD2-CB 4.43Å; F518-L630 HydrophobicContact CD2-CD1 3.43Å; F518-L630 VanDerWaalsContact CD2-CD1 3.43Å; F518-L630 HydrophobicContact CD2-CG 4.15Å; F518-L630 HydrophobicContact CE2-CB 4.09Å; F518-L630 HydrophobicContact CE2-CD1 3.54Å; F518-L630 HydrophobicContact CE2-CG 3.75Å
519	N	60	Low	79.8	Confident	162 Å²	162	51.8 Å²	51.8	87%	0.866	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	25.1	178.9	-71	-29.8	0	0	0	114.2	Q517	Q517-N519 PolarHBondContact O-N 3.45Å
520	Y	65.1	Low	79.8	Confident	32 Å²	32	56.5 Å²	56.5	13%	0.125	27%	0.272	C	S	.	.			trans	-66.3	144.9	-172.3	-164.5	-134.4	0	0	0	116	L514 Q517 T522 E525 R555	L514-Y520 HydrophobicContact CD2-CD1 4.07Å; Q517-Y520 HydrophobicContact CB-CD2 4.07Å; Q517-Y520 HydrophobicContact CB-CG 4.2Å; Q517-Y520 VanDerWaalsContact O-CB 3.23Å; Q517-Y520 WeakPolarHBondContact O-CB 3.11Å; Q517-Y520 PolarHBondContact O-N 3.45Å; Q517-Y520 VanDerWaalsContact OE1-CE2 3.28Å; Y520-T522 HydrophobicContact CD1-CG2 4.48Å; Y520-T522 PolarHBondContact O-N 2.98Å; Y520-E525 HydrophobicContact CE1-CG 3.79Å; Y520-E525 VanDerWaalsContact CE1-OE1 3.28Å; Y520-E525 WeakPolarHBondContact CE1-OE1 3.23Å; Y520-E525 WeakPolarHBondContact CE1-OE2 3.42Å; Y520-E525 VanDerWaalsContact CZ-CD 3.48Å; Y520-E525 VanDerWaalsContact CZ-OE1 3.22Å; Y520-E525 PolarHBondContact OH-OE1 2.9Å; Y520-R555 VanDerWaalsContact N-NH2 3.1Å; Y520-R555 PolarHBondContact O-NH1 3.46Å; Y520-R555 PolarHBondContact O-NH2 3.45Å
521	N	69.1	Low	79.7	Confident	116 Å²	116	58.3 Å²	58.3	62%	0.62	28%	0.281	S	S	*	.			trans	-86.8	100.1	169.3	-178.7	4.2	0	0	0	109.6	A523	N521-A523 PolarHBondContact O-N 2.9Å; N521-A523 VanDerWaalsContact O-N 3.1Å; N521-A523 WeakPolarHBondContact OD1-CB 3.2Å; N521-A523 PolarHBondContact OD1-N 3.37Å; N521-A523 VanDerWaalsContact OD1-N 3.13Å
522	T	80.2	Confident	79.6	Confident	21 Å²	21	58.7 Å²	58.7	13%	0.129	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-3.6	-177.8	55.1	0	0	0	0	114.5	L514 Y520 R524 E525 I526 L548 V551	L514-T522 HydrophobicContact CD2-CG2 4.33Å; Y520-T522 HydrophobicContact CD1-CG2 4.48Å; Y520-T522 PolarHBondContact O-N 2.98Å; T522-R524 PolarHBondContact O-N 3.06Å; T522-E525 WeakPolarHBondContact CA-OE2 3.28Å; T522-E525 PolarHBondContact O-N 3.25Å; T522-I526 WeakPolarHBondContact O-CD1 3.48Å; T522-I526 VanDerWaalsContact O-CG1 3.23Å; T522-I526 WeakPolarHBondContact O-CG1 3.48Å; T522-I526 PolarHBondContact O-N 3.07Å; T522-L548 HydrophobicContact CG2-CD2 4.38Å; T522-V551 HydrophobicContact CG2-CG1 4.04Å
523	A	84.3	Confident	79.8	Confident	54 Å²	54	59.8 Å²	59.8	45%	0.446	29%	0.287	S	S	.	.	H	α-helix	trans	-60.9	-32.9	-177.5	0	0	0	0	0	113.1	N521 R527	N521-A523 PolarHBondContact O-N 2.9Å; N521-A523 VanDerWaalsContact O-N 3.1Å; N521-A523 WeakPolarHBondContact OD1-CB 3.2Å; N521-A523 PolarHBondContact OD1-N 3.37Å; N521-A523 VanDerWaalsContact OD1-N 3.13Å; A523-R527 PolarHBondContact O-N 3.33Å
524	R	83.4	Confident	79.9	Confident	101 Å²	101	62.6 Å²	62.6	38%	0.381	30%	0.304	S	S	.	.	H	α-helix	trans	-69.8	-42.3	178.7	-177.5	-178.2	179.7	-158.7	-3.8	111.2	T431 G432 D433 T522 R527 N528	T431-R524 PolarHBondContact O-NH2 3.37Å; G432-R524 PolarHBondContact O-NH2 3.41Å; D433-R524 IonicContact OD1-CZ 2.71Å; D433-R524 IonicContact OD1-NH1 3.13Å; D433-R524 PolarHBondContact OD1-NH1 2.93Å; D433-R524 IonicContact OD1-NH2 3.33Å; D433-R524 PolarHBondContact OD1-NH2 3.37Å; T522-R524 PolarHBondContact O-N 3.06Å; R524-R527 WeakPolarHBondContact O-CB 3.48Å; R524-R527 PolarHBondContact O-N 3.33Å; R524-N528 PolarHBondContact O-N 2.93Å
525	E	86.3	Confident	79.4	Confident	1 Å²	1	63 Å²	63	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-71.6	-38.8	-177	-70.1	55.1	-131.1	0	0	110.2	L510 Y520 T522 R527 N528 V529 L548	L510-E525 HydrophobicContact CD1-CB 4.08Å; L510-E525 HydrophobicContact CD1-CG 3.72Å; Y520-E525 HydrophobicContact CE1-CG 3.79Å; Y520-E525 VanDerWaalsContact CE1-OE1 3.28Å; Y520-E525 WeakPolarHBondContact CE1-OE1 3.23Å; Y520-E525 WeakPolarHBondContact CE1-OE2 3.42Å; Y520-E525 VanDerWaalsContact CZ-CD 3.48Å; Y520-E525 VanDerWaalsContact CZ-OE1 3.22Å; Y520-E525 PolarHBondContact OH-OE1 2.9Å; T522-E525 WeakPolarHBondContact CA-OE2 3.28Å; T522-E525 PolarHBondContact O-N 3.25Å; E525-R527 VanDerWaalsContact C-N 3.32Å; E525-R527 PolarHBondContact O-N 2.94Å; E525-N528 PolarHBondContact O-N 2.83Å; E525-V529 WeakPolarHBondContact O-CG2 3.16Å; E525-V529 PolarHBondContact O-N 3.34Å; E525-L548 HydrophobicContact CB-CD1 4.06Å; E525-L548 HydrophobicContact CB-CD2 3.62Å; E525-L548 HydrophobicContact CB-CG 4.48Å; E525-L548 HydrophobicContact CG-CD2 4.37Å
526	I	88.3	Confident	79.3	Confident	71 Å²	71	62.5 Å²	62.5	36%	0.364	30%	0.303	S	S	.	.	H	α-helix	trans	-56.9	-49	172.7	-67.7	165.1	0	0	0	109.7	T522 N528 V529 E530 L548	T522-I526 WeakPolarHBondContact O-CD1 3.48Å; T522-I526 VanDerWaalsContact O-CG1 3.23Å; T522-I526 WeakPolarHBondContact O-CG1 3.48Å; T522-I526 PolarHBondContact O-N 3.07Å; I526-N528 PolarHBondContact O-N 3.25Å; I526-V529 PolarHBondContact O-N 3.38Å; I526-E530 WeakPolarHBondContact O-CG 3.3Å; I526-E530 PolarHBondContact O-N 2.89Å; I526-L548 HydrophobicContact CG1-CD1 4.03Å
527	R	86.6	Confident	79.4	Confident	170 Å²	170	58.4 Å²	58.4	64%	0.642	29%	0.285	S	S	*	.	H	α-helix	trans	-60	-44.3	176.4	-174.6	-173.8	-62.2	-176.2	0.4	112.1	A523 R524 E525 V529 E530 L531	A523-R527 PolarHBondContact O-N 3.33Å; R524-R527 WeakPolarHBondContact O-CB 3.48Å; R524-R527 PolarHBondContact O-N 3.33Å; E525-R527 VanDerWaalsContact C-N 3.32Å; E525-R527 PolarHBondContact O-N 2.94Å; R527-V529 VanDerWaalsContact C-N 3.35Å; R527-V529 PolarHBondContact O-N 2.99Å; R527-E530 PolarHBondContact O-N 2.96Å; R527-L531 HydrophobicContact CG-CD1 4.38Å; R527-L531 WeakPolarHBondContact O-CG 3.44Å; R527-L531 PolarHBondContact O-N 2.84Å
528	N	86.5	Confident	79.9	Confident	16 Å²	16	59.9 Å²	59.9	9%	0.086	29%	0.292	C	S	.	.	H	α-helix	trans	-62.6	-42.4	179	-72.2	-8.5	0	0	0	111.5	T431 R524 E525 I526 L531 L532	T431-N528 PolarHBondContact O-ND2 3.06Å; R524-N528 PolarHBondContact O-N 2.93Å; E525-N528 PolarHBondContact O-N 2.83Å; I526-N528 PolarHBondContact O-N 3.25Å; N528-L531 PolarHBondContact O-N 2.85Å; N528-L532 WeakPolarHBondContact O-CB 3.37Å; N528-L532 VanDerWaalsContact O-CG 3.26Å; N528-L532 WeakPolarHBondContact O-CG 3.49Å; N528-L532 PolarHBondContact O-N 2.81Å
529	V	88.6	Confident	80.8	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.03	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-42.9	175.1	172.1	0	0	0	0	111.2	Y506 E525 I526 R527 L531 L532 K533 M541 C544 E545 L548	Y506-V529 HydrophobicContact CE1-CG2 4Å; Y506-V529 WeakPolarHBondContact OH-CG2 3.3Å; E525-V529 WeakPolarHBondContact O-CG2 3.16Å; E525-V529 PolarHBondContact O-N 3.34Å; I526-V529 PolarHBondContact O-N 3.38Å; R527-V529 VanDerWaalsContact C-N 3.35Å; R527-V529 PolarHBondContact O-N 2.99Å; V529-L531 PolarHBondContact O-N 3.46Å; V529-L532 PolarHBondContact O-N 2.96Å; V529-K533 HydrophobicContact CG1-CD 4.35Å; V529-K533 HydrophobicContact CG1-CG 4.36Å; V529-K533 WeakPolarHBondContact O-CB 3.29Å; V529-K533 VanDerWaalsContact O-CG 3.32Å; V529-K533 WeakPolarHBondContact O-CG 3.31Å; V529-K533 PolarHBondContact O-N 3.33Å; V529-M541 HydrophobicContact CG1-CB 4.41Å; V529-C544 HydrophobicContact CG2-CB 4.17Å; V529-E545 HydrophobicContact CG1-CB 4.49Å; V529-L548 HydrophobicContact CB-CD1 4.35Å; V529-L548 HydrophobicContact CG2-CD1 3.7Å
530	E	86.9	Confident	81.7	Confident	114 Å²	114	55.7 Å²	55.7	53%	0.533	28%	0.276	S	S	.	.	H	α-helix	trans	-60.2	-44	176.6	-73.2	171.3	174.8	0	0	112.2	I526 R527 K533 L534	I526-E530 WeakPolarHBondContact O-CG 3.3Å; I526-E530 PolarHBondContact O-N 2.89Å; R527-E530 PolarHBondContact O-N 2.96Å; E530-K533 WeakPolarHBondContact O-CB 3.38Å; E530-K533 PolarHBondContact O-N 2.91Å; E530-L534 PolarHBondContact O-N 3.41Å
531	L	84.7	Confident	82.7	Confident	39 Å²	39	54.3 Å²	54.3	20%	0.204	27%	0.271	C	S	.	.	H	α-helix	trans	-64.9	-41.1	175.8	-70.5	175.1	0	0	0	112.2	L444 R527 N528 V529 K533 L534	L444-L531 HydrophobicContact CD1-CB 4.41Å; L444-L531 HydrophobicContact CD2-CB 3.76Å; L444-L531 HydrophobicContact CD2-CD1 4.11Å; L444-L531 HydrophobicContact CG-CB 3.87Å; L444-L531 HydrophobicContact CG-CD1 4.31Å; R527-L531 HydrophobicContact CG-CD1 4.38Å; R527-L531 WeakPolarHBondContact O-CG 3.44Å; R527-L531 PolarHBondContact O-N 2.84Å; N528-L531 PolarHBondContact O-N 2.85Å; V529-L531 PolarHBondContact O-N 3.46Å; L531-K533 VanDerWaalsContact C-N 3.35Å; L531-L534 WeakPolarHBondContact O-CB 3.44Å; L531-L534 PolarHBondContact O-N 2.93Å
532	L	85.3	Confident	83.5	Confident	9 Å²	9	52.9 Å²	52.9	5%	0.047	26%	0.261	C	S	.	.	H	α-helix	trans	-68.3	-33.5	176.4	-69.9	170	0	0	0	112	L444 Y506 N528 V529 L534 R535 F536 M541	L444-L532 HydrophobicContact CD1-CD2 4.46Å; L444-L532 HydrophobicContact CD2-CD2 4.38Å; Y506-L532 HydrophobicContact CD1-CD1 3.84Å; Y506-L532 HydrophobicContact CD2-CD1 4.26Å; Y506-L532 HydrophobicContact CE1-CD1 3.54Å; Y506-L532 HydrophobicContact CE2-CD1 4Å; Y506-L532 HydrophobicContact CG-CD1 4.18Å; N528-L532 WeakPolarHBondContact O-CB 3.37Å; N528-L532 VanDerWaalsContact O-CG 3.26Å; N528-L532 WeakPolarHBondContact O-CG 3.49Å; N528-L532 PolarHBondContact O-N 2.81Å; V529-L532 PolarHBondContact O-N 2.96Å; L532-L534 VanDerWaalsContact C-N 3.31Å; L532-L534 PolarHBondContact O-N 2.63Å; L532-R535 PolarHBondContact O-N 3.23Å; L532-R535 VanDerWaalsContact O-N 3.1Å; L532-F536 HydrophobicContact CB-CD2 4.29Å; L532-F536 HydrophobicContact CD2-CD2 3.81Å; L532-F536 HydrophobicContact CD2-CE2 3.54Å; L532-F536 PolarHBondContact O-N 3.49Å; L532-M541 HydrophobicContact CB-CG 4.29Å; L532-M541 HydrophobicContact CB-SD 3.65Å; L532-M541 HydrophobicContact CD1-SD 4.31Å
533	K	86.3	Confident	83.9	Confident	39 Å²	39	56.5 Å²	56.5	17%	0.17	27%	0.273	C	S	.	.	H	α-helix	trans	-59.2	-40.9	172.7	-80.4	178.6	171.6	-161.1	0	111.8	V529 E530 L531 R535 G537 M541 E545	V529-K533 HydrophobicContact CG1-CD 4.35Å; V529-K533 HydrophobicContact CG1-CG 4.36Å; V529-K533 WeakPolarHBondContact O-CB 3.29Å; V529-K533 VanDerWaalsContact O-CG 3.32Å; V529-K533 WeakPolarHBondContact O-CG 3.31Å; V529-K533 PolarHBondContact O-N 3.33Å; E530-K533 WeakPolarHBondContact O-CB 3.38Å; E530-K533 PolarHBondContact O-N 2.91Å; L531-K533 VanDerWaalsContact C-N 3.35Å; K533-R535 PolarHBondContact O-N 2.98Å; K533-G537 CarbonylContact O-C 3.6Å; K533-G537 VanDerWaalsContact O-CA 3.31Å; K533-G537 WeakPolarHBondContact O-CA 3.49Å; K533-G537 PolarHBondContact O-N 3.43Å; K533-M541 HydrophobicContact CG-CB 3.59Å; K533-M541 HydrophobicContact CG-CG 3.84Å; K533-E545 WeakPolarHBondContact CE-OE2 3.37Å; K533-E545 IonicContact NZ-OE1 3.65Å; K533-E545 PolarHBondContact NZ-OE1 2.9Å; K533-E545 IonicContact NZ-OE2 2.7Å; K533-E545 PolarHBondContact NZ-OE2 2.94Å
534	L	81.9	Confident	84.1	Confident	93 Å²	93	54 Å²	54	49%	0.487	25%	0.252	S	S	.	.	H	α-helix	trans	-62	-27.9	176.7	-67.1	174.4	0	0	0	112.8	P449 E530 L531 L532	P449-L534 HydrophobicContact CB-CD2 4.47Å; E530-L534 PolarHBondContact O-N 3.41Å; L531-L534 WeakPolarHBondContact O-CB 3.44Å; L531-L534 PolarHBondContact O-N 2.93Å; L532-L534 VanDerWaalsContact C-N 3.31Å; L532-L534 PolarHBondContact O-N 2.63Å
535	R	75.6	Confident	84.5	Confident	10 Å²	10	52.8 Å²	52.8	4%	0.038	25%	0.25	C	S	.	.	H	α-helix	trans	-96.2	-53.9	-177.8	-61	-50	-159.6	140.2	43.6	113.4	L444 D448 L452 D487 L532 K533	L444-R535 HydrophobicContact CD1-CG 3.67Å; D448-R535 PolarHBondContact O-NH1 2.92Å; D448-R535 VanDerWaalsContact O-NH1 3.14Å; L452-R535 VanDerWaalsContact CB-O 3.24Å; L452-R535 WeakPolarHBondContact CB-O 3.33Å; L452-R535 WeakPolarHBondContact CG-O 3.02Å; L452-R535 PolarHBondContact N-O 3.27Å; D487-R535 IonicContact OD1-NH2 3.61Å; D487-R535 PolarHBondContact OD1-NH2 3.31Å; D487-R535 IonicContact OD2-CZ 3.16Å; D487-R535 IonicContact OD2-NH1 3.1Å; D487-R535 PolarHBondContact OD2-NH1 2.93Å; D487-R535 VanDerWaalsContact OD2-NH1 3.12Å; D487-R535 IonicContact OD2-NH2 3.9Å; D487-R535 PolarHBondContact OD2-NH2 3.04Å; L532-R535 PolarHBondContact O-N 3.23Å; L532-R535 VanDerWaalsContact O-N 3.1Å; K533-R535 PolarHBondContact O-N 2.98Å
536	F	77.8	Confident	84.7	Confident	5 Å²	5	53.7 Å²	53.7	2%	0.022	26%	0.256	C	S	.	.	H	α-helix	trans	-89.5	-11.2	-172.4	-66.6	-83.6	0	0	0	113.3	L452 I489 V493 K499 L532 H540 M541	L452-F536 HydrophobicContact CD1-CD1 3.58Å; L452-F536 HydrophobicContact CD1-CE1 3.6Å; L452-F536 HydrophobicContact CD1-CG 4.13Å; L452-F536 HydrophobicContact CD1-CZ 4.16Å; I489-F536 HydrophobicContact CG2-CZ 4.38Å; V493-F536 HydrophobicContact CG1-CE1 4.4Å; V493-F536 HydrophobicContact CG2-CE1 3.91Å; V493-F536 HydrophobicContact CG2-CZ 3.85Å; K499-F536 HydrophobicContact CB-CD1 4.25Å; K499-F536 HydrophobicContact CB-CE1 4.46Å; K499-F536 HydrophobicContact CG-CD1 4.43Å; L532-F536 HydrophobicContact CB-CD2 4.29Å; L532-F536 HydrophobicContact CD2-CD2 3.81Å; L532-F536 HydrophobicContact CD2-CE2 3.54Å; L532-F536 PolarHBondContact O-N 3.49Å; F536-H540 HydrophobicContact CB-CB 4.48Å; F536-H540 PolarHBondContact O-ND1 2.82Å; F536-M541 HydrophobicContact CB-CE 4.42Å
537	G	79.2	Confident	84.8	Confident	3 Å²	3	50.3 Å²	50.3	3%	0.031	24%	0.239	C	C	.	.			trans	92	160.4	-175.2	0	0	0	0	0	112.7	K533	K533-G537 CarbonylContact O-C 3.6Å; K533-G537 VanDerWaalsContact O-CA 3.31Å; K533-G537 WeakPolarHBondContact O-CA 3.49Å; K533-G537 PolarHBondContact O-N 3.43Å
538	E	80.1	Confident	85	Confident	136 Å²	136	42.9 Å²	42.9	64%	0.636	21%	0.211	S	C	*	.	H	α-helix	trans	-73.3	-37.9	-173.7	-172.2	170.3	-162.1	0	0	112.8	H540 M541 H542	E538-H540 VanDerWaalsContact C-N 3.34Å; E538-H540 PolarHBondContact O-N 3.47Å; E538-M541 PolarHBondContact O-N 3.42Å; E538-H542 PolarHBondContact O-N 3.27Å
539	S	79.8	Confident	85.2	Confident	78 Å²	78	48.2 Å²	48.2	55%	0.545	23%	0.234	S	C	.	.	H	α-helix	trans	-58.1	-45.2	-179.5	55.9	0	0	0	0	112.1	M541 H542	S539-M541 VanDerWaalsContact C-N 3.33Å; S539-M541 PolarHBondContact O-N 2.79Å; S539-H542 WeakPolarHBondContact O-CB 3.32Å; S539-H542 PolarHBondContact O-N 3.01Å
540	H	78.9	Confident	85.3	Confident	57 Å²	57	49.2 Å²	49.2	26%	0.264	24%	0.239	S	C	.	.	H	α-helix	trans	-66.5	-32.2	-178.5	-68.5	105.6	0	0	0	113	E453 I503 F536 E538	E453-H540 IonicContact OE1-CE1 2.63Å; E453-H540 PolarHBondContact OE1-CE1 2.97Å; E453-H540 IonicContact OE1-ND1 3.92Å; E453-H540 PolarHBondContact OE1-ND1 3.1Å; I503-H540 HydrophobicContact CD1-CB 3.59Å; I503-H540 HydrophobicContact CG1-CB 4.5Å; I503-H540 WeakPolarHBondContact CG2-O 3.35Å; F536-H540 HydrophobicContact CB-CB 4.48Å; F536-H540 PolarHBondContact O-ND1 2.82Å; E538-H540 VanDerWaalsContact C-N 3.34Å; E538-H540 PolarHBondContact O-N 3.47Å
541	M	86.9	Confident	85.4	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-91.7	-4.2	-177.4	-67.6	-64	99.9	0	0	114	I503 Y506 V529 L532 K533 F536 E538 S539 Y543 C544 E545	I503-M541 HydrophobicContact CB-CE 4.14Å; I503-M541 HydrophobicContact CD1-CE 4.33Å; I503-M541 HydrophobicContact CG1-CE 3.6Å; I503-M541 HydrophobicContact CG2-CE 3.68Å; Y506-M541 HydrophobicContact CD1-SD 4.47Å; V529-M541 HydrophobicContact CG1-CB 4.41Å; L532-M541 HydrophobicContact CB-CG 4.29Å; L532-M541 HydrophobicContact CB-SD 3.65Å; L532-M541 HydrophobicContact CD1-SD 4.31Å; K533-M541 HydrophobicContact CG-CB 3.59Å; K533-M541 HydrophobicContact CG-CG 3.84Å; F536-M541 HydrophobicContact CB-CE 4.42Å; E538-M541 PolarHBondContact O-N 3.42Å; S539-M541 VanDerWaalsContact C-N 3.33Å; S539-M541 PolarHBondContact O-N 2.79Å; M541-Y543 VanDerWaalsContact C-N 3.29Å; M541-Y543 PolarHBondContact O-N 3.38Å; M541-C544 PolarHBondContact O-N 3.29Å; M541-C544 VanDerWaalsContact O-N 3.13Å; M541-E545 PolarHBondContact O-N 2.92Å; M541-E545 VanDerWaalsContact O-N 3.08Å
542	H	86	Confident	85.6	Confident	87 Å²	87	44 Å²	44	40%	0.403	22%	0.22	S	C	.	.	H	α-helix	trans	-55	-42.5	-175.1	-175.4	58.7	0	0	0	113	E538 S539 C544 E545 V546 F587	E538-H542 PolarHBondContact O-N 3.27Å; S539-H542 WeakPolarHBondContact O-CB 3.32Å; S539-H542 PolarHBondContact O-N 3.01Å; H542-C544 PolarHBondContact O-N 2.74Å; H542-E545 PolarHBondContact O-N 3.24Å; H542-V546 WeakPolarHBondContact O-CG2 3.34Å; H542-V546 PolarHBondContact O-N 3.43Å; H542-F587 AromaticContact NE2-CE1 3.92Å
543	Y	87.7	Confident	85.8	Confident	97 Å²	97	46 Å²	46	38%	0.38	23%	0.231	S	C	.	.	H	α-helix	trans	-58.1	-48.8	177.6	-73	-90.9	0	0	0	112.4	M541 E545 V546 M547 F587	M541-Y543 VanDerWaalsContact C-N 3.29Å; M541-Y543 PolarHBondContact O-N 3.38Å; Y543-E545 VanDerWaalsContact C-N 3.32Å; Y543-E545 PolarHBondContact O-N 3.1Å; Y543-V546 PolarHBondContact O-N 3.23Å; Y543-M547 VanDerWaalsContact O-CG 3.3Å; Y543-M547 WeakPolarHBondContact O-CG 3.43Å; Y543-M547 PolarHBondContact O-N 3.18Å; Y543-F587 HydrophobicContact CD1-CB 4.19Å; Y543-F587 AromaticContact CD1-CD1 3.71Å; Y543-F587 HydrophobicContact CD1-CD1 3.71Å; Y543-F587 HydrophobicContact CD1-CG 4.38Å; Y543-F587 AromaticContact CE1-CD1 3.96Å; Y543-F587 HydrophobicContact CE1-CD1 3.96Å; Y543-F587 HydrophobicContact CG-CD1 4.38Å
544	C	90.1	Very high	86	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.007	22%	0.224	C	C	.	.	H	α-helix	trans	-66.5	-34.9	-179.4	-65.9	0	0	0	0	112.2	Y506 L510 V529 M541 H542 M547 L548	Y506-C544 HydrophobicContact CD1-CB 4.47Å; Y506-C544 VanDerWaalsContact CD1-SG 3.6Å; Y506-C544 HydrophobicContact CE1-CB 4.1Å; L510-C544 HydrophobicContact CD2-CB 3.72Å; V529-C544 HydrophobicContact CG2-CB 4.17Å; M541-C544 PolarHBondContact O-N 3.29Å; M541-C544 VanDerWaalsContact O-N 3.13Å; H542-C544 PolarHBondContact O-N 2.74Å; C544-M547 PolarHBondContact O-N 3.26Å; C544-L548 PolarHBondContact O-N 3.05Å
545	E	90.4	Very high	86.3	Confident	75 Å²	75	44.3 Å²	44.3	35%	0.35	22%	0.218	S	C	.	.	H	α-helix	trans	-66	-44	174.8	176.5	175.5	-146.2	0	0	112.2	V529 K533 M541 H542 Y543 M547 L548 K549	V529-E545 HydrophobicContact CG1-CB 4.49Å; K533-E545 WeakPolarHBondContact CE-OE2 3.37Å; K533-E545 IonicContact NZ-OE1 3.65Å; K533-E545 PolarHBondContact NZ-OE1 2.9Å; K533-E545 IonicContact NZ-OE2 2.7Å; K533-E545 PolarHBondContact NZ-OE2 2.94Å; M541-E545 PolarHBondContact O-N 2.92Å; M541-E545 VanDerWaalsContact O-N 3.08Å; H542-E545 PolarHBondContact O-N 3.24Å; Y543-E545 VanDerWaalsContact C-N 3.32Å; Y543-E545 PolarHBondContact O-N 3.1Å; E545-M547 VanDerWaalsContact C-N 3.31Å; E545-M547 PolarHBondContact O-N 3.23Å; E545-L548 PolarHBondContact O-N 3Å; E545-K549 PolarHBondContact O-N 3.01Å
546	V	91.2	Very high	87	Confident	21 Å²	21	51.5 Å²	51.5	13%	0.127	25%	0.245	C	C	.	.	H	α-helix	trans	-62.3	-40.5	176.3	175.9	0	0	0	0	110.5	H542 Y543 L548 K549 D550 F587	H542-V546 WeakPolarHBondContact O-CG2 3.34Å; H542-V546 PolarHBondContact O-N 3.43Å; Y543-V546 PolarHBondContact O-N 3.23Å; V546-L548 VanDerWaalsContact C-N 3.35Å; V546-L548 PolarHBondContact O-N 3.29Å; V546-K549 WeakPolarHBondContact O-CB 3.33Å; V546-K549 PolarHBondContact O-N 3Å; V546-K549 VanDerWaalsContact O-N 3.16Å; V546-D550 VanDerWaalsContact O-CG 3.28Å; V546-D550 PolarHBondContact O-N 3.4Å; V546-F587 HydrophobicContact CB-CB 4.22Å; V546-F587 HydrophobicContact CB-CD1 4.03Å; V546-F587 HydrophobicContact CB-CD2 4.49Å; V546-F587 HydrophobicContact CB-CG 3.99Å; V546-F587 HydrophobicContact CG1-CB 3.95Å; V546-F587 HydrophobicContact CG1-CD1 4.08Å; V546-F587 HydrophobicContact CG1-CD2 3.66Å; V546-F587 HydrophobicContact CG1-CE2 4.15Å; V546-F587 HydrophobicContact CG1-CG 3.61Å; V546-F587 HydrophobicContact CG2-CD1 4.09Å; V546-F587 HydrophobicContact CG2-CE1 4.15Å; V546-F587 HydrophobicContact CG2-CG 4.46Å
547	M	90.8	Very high	87.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.9	-43.9	174.8	-66.8	167.4	65.2	0	0	112.6	R507 L510 A511 L514 Y543 C544 E545 D550 V551 W588	R507-M547 HydrophobicContact CG-CE 4.39Å; R507-M547 HydrophobicContact CG-SD 3.58Å; R507-M547 VanDerWaalsContact CG-SD 3.58Å; L510-M547 HydrophobicContact CB-CE 4.39Å; L510-M547 HydrophobicContact CD2-CE 4.3Å; L510-M547 HydrophobicContact CD2-SD 4.43Å; L510-M547 HydrophobicContact CG-CE 4.2Å; A511-M547 HydrophobicContact CB-CE 3.61Å; L514-M547 HydrophobicContact CD1-CB 4.39Å; L514-M547 HydrophobicContact CD1-CE 4.49Å; Y543-M547 VanDerWaalsContact O-CG 3.3Å; Y543-M547 WeakPolarHBondContact O-CG 3.43Å; Y543-M547 PolarHBondContact O-N 3.18Å; C544-M547 PolarHBondContact O-N 3.26Å; E545-M547 VanDerWaalsContact C-N 3.31Å; E545-M547 PolarHBondContact O-N 3.23Å; M547-D550 PolarHBondContact O-N 3.41Å; M547-V551 PolarHBondContact O-N 3.37Å; M547-W588 HydrophobicContact CB-CZ2 3.87Å; M547-W588 HydrophobicContact CE-CD2 3.96Å; M547-W588 HydrophobicContact CE-CE3 3.78Å; M547-W588 HydrophobicContact CE-CH2 4.2Å; M547-W588 HydrophobicContact CE-CZ2 4.33Å; M547-W588 HydrophobicContact CE-CZ3 3.92Å; M547-W588 HydrophobicContact CG-CD2 4Å; M547-W588 HydrophobicContact CG-CG 4.08Å; M547-W588 HydrophobicContact CG-CZ2 4.19Å
548	L	90.8	Very high	88.1	Confident	13 Å²	13	52.7 Å²	52.7	7%	0.068	25%	0.25	C	S	.	.	H	α-helix	trans	-67.2	-37.1	176.9	-70.9	172.7	0	0	0	112.3	L510 L514 T522 E525 I526 V529 C544 E545 V546 V551 A552	L510-L548 HydrophobicContact CD1-CD2 4.31Å; L510-L548 HydrophobicContact CD2-CG 4.47Å; L514-L548 HydrophobicContact CD1-CD2 4.18Å; L514-L548 HydrophobicContact CD2-CD2 4.12Å; T522-L548 HydrophobicContact CG2-CD2 4.38Å; E525-L548 HydrophobicContact CB-CD1 4.06Å; E525-L548 HydrophobicContact CB-CD2 3.62Å; E525-L548 HydrophobicContact CB-CG 4.48Å; E525-L548 HydrophobicContact CG-CD2 4.37Å; I526-L548 HydrophobicContact CG1-CD1 4.03Å; V529-L548 HydrophobicContact CB-CD1 4.35Å; V529-L548 HydrophobicContact CG2-CD1 3.7Å; C544-L548 PolarHBondContact O-N 3.05Å; E545-L548 PolarHBondContact O-N 3Å; V546-L548 VanDerWaalsContact C-N 3.35Å; V546-L548 PolarHBondContact O-N 3.29Å; L548-V551 PolarHBondContact O-N 2.87Å; L548-A552 PolarHBondContact O-N 3.26Å; L548-A552 VanDerWaalsContact O-N 3.15Å
549	K	90.7	Very high	88.5	Confident	128 Å²	128	49.5 Å²	49.5	56%	0.557	24%	0.241	S	C	*	.	H	α-helix	trans	-65	-41.2	174.6	-174.5	-179.5	177.8	-179	0	111.6	E545 V546 V551 A552 D553	E545-K549 PolarHBondContact O-N 3.01Å; V546-K549 WeakPolarHBondContact O-CB 3.33Å; V546-K549 PolarHBondContact O-N 3Å; V546-K549 VanDerWaalsContact O-N 3.16Å; K549-V551 VanDerWaalsContact C-N 3.32Å; K549-V551 PolarHBondContact O-N 3.26Å; K549-A552 PolarHBondContact O-N 3.46Å; K549-D553 WeakPolarHBondContact O-CB 3.46Å; K549-D553 PolarHBondContact O-N 3.1Å
550	D	90.9	Very high	89	Confident	27 Å²	27	49.5 Å²	49.5	14%	0.144	23%	0.234	C	C	.	.	H	α-helix	trans	-58.7	-43.7	176.6	-72.8	-15.1	0	0	0	111.2	V546 M547 A552 D553 S554 S584 W588	V546-D550 VanDerWaalsContact O-CG 3.28Å; V546-D550 PolarHBondContact O-N 3.4Å; M547-D550 PolarHBondContact O-N 3.41Å; D550-A552 PolarHBondContact O-N 3Å; D550-D553 PolarHBondContact O-N 3.33Å; D550-S554 WeakPolarHBondContact O-CB 3.42Å; D550-S554 PolarHBondContact O-N 3.44Å; D550-S584 WeakPolarHBondContact OD2-CB 3.29Å; D550-S584 PolarHBondContact OD2-N 3.46Å; D550-S584 PolarHBondContact OD2-OG 3Å; D550-W588 PolarHBondContact OD2-NE1 3.42Å; D550-W588 VanDerWaalsContact OD2-NE1 3.1Å
551	V	89.3	Confident	89.5	Confident	6 Å²	6	47 Å²	47	4%	0.036	22%	0.223	C	C	.	.	H	α-helix	trans	-63.3	-42.7	176.4	174.6	0	0	0	0	111.4	L514 T522 M547 L548 K549 S554 R555 M581 W588	L514-V551 HydrophobicContact CB-CG2 4.37Å; L514-V551 HydrophobicContact CD1-CG2 4.03Å; L514-V551 HydrophobicContact CD2-CG2 4.24Å; L514-V551 HydrophobicContact CG-CG2 4.44Å; T522-V551 HydrophobicContact CG2-CG1 4.04Å; M547-V551 PolarHBondContact O-N 3.37Å; L548-V551 PolarHBondContact O-N 2.87Å; K549-V551 VanDerWaalsContact C-N 3.32Å; K549-V551 PolarHBondContact O-N 3.26Å; V551-S554 PolarHBondContact O-N 3.43Å; V551-R555 WeakPolarHBondContact O-CG 3.07Å; V551-R555 PolarHBondContact O-N 2.89Å; V551-R555 VanDerWaalsContact O-N 3.09Å; V551-M581 HydrophobicContact CG2-SD 4.39Å; V551-W588 HydrophobicContact CG2-CH2 4.36Å; V551-W588 HydrophobicContact CG2-CZ2 4.22Å
552	A	88.8	Confident	89.5	Confident	36 Å²	36	52.9 Å²	52.9	30%	0.298	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-42.4	177.3	0	0	0	0	0	112.4	L548 K549 D550 R555 R556	L548-A552 PolarHBondContact O-N 3.26Å; L548-A552 VanDerWaalsContact O-N 3.15Å; K549-A552 PolarHBondContact O-N 3.46Å; D550-A552 PolarHBondContact O-N 3Å; A552-R555 PolarHBondContact O-N 3.02Å; A552-R556 PolarHBondContact O-N 3.45Å
553	D	89.5	Confident	89.5	Confident	52 Å²	52	54 Å²	54	28%	0.278	25%	0.25	S	S	.	.	H	α-helix	trans	-70.8	-35.8	178	-76.9	-17.7	0	0	0	111.5	K549 D550 R555 R556 I557	K549-D553 WeakPolarHBondContact O-CB 3.46Å; K549-D553 PolarHBondContact O-N 3.1Å; D550-D553 PolarHBondContact O-N 3.33Å; D553-R555 VanDerWaalsContact C-N 3.33Å; D553-R555 PolarHBondContact O-N 3.02Å; D553-R556 WeakPolarHBondContact O-CB 3.2Å; D553-R556 PolarHBondContact O-N 2.99Å; D553-R556 IonicContact OD1-CZ 3.55Å; D553-R556 IonicContact OD1-NH1 3.33Å; D553-R556 PolarHBondContact OD1-NH1 3.21Å; D553-I557 WeakPolarHBondContact O-CD1 3.29Å; D553-I557 VanDerWaalsContact O-CG1 3.29Å; D553-I557 WeakPolarHBondContact O-CG1 3.45Å; D553-I557 PolarHBondContact O-N 3.31Å
554	S	89.8	Confident	89.4	Confident	4 Å²	4	52.3 Å²	52.3	3%	0.028	25%	0.246	C	C	.	.	H	α-helix	trans	-59.8	-41.3	171.8	172.1	0	0	0	0	111.7	D550 V551 R556 I557 N558 A580 M581 I582	D550-S554 WeakPolarHBondContact O-CB 3.42Å; D550-S554 PolarHBondContact O-N 3.44Å; V551-S554 PolarHBondContact O-N 3.43Å; S554-R556 PolarHBondContact O-N 3.43Å; S554-I557 PolarHBondContact O-N 3.24Å; S554-N558 WeakPolarHBondContact O-CB 3.48Å; S554-N558 PolarHBondContact O-N 2.9Å; S554-N558 PolarHBondContact O-ND2 3.04Å; S554-N558 PolarHBondContact OG-ND2 2.99Å; S554-A580 PolarHBondContact OG-O 3.37Å; S554-A580 VanDerWaalsContact OG-O 3.05Å; S554-M581 WeakPolarHBondContact OG-CA 3.41Å; S554-I582 PolarHBondContact OG-N 2.86Å
555	R	88.3	Confident	89.2	Confident	92 Å²	92	53.3 Å²	53.3	35%	0.347	25%	0.25	S	S	.	.	H	α-helix	trans	-60.1	-45.8	173.5	-74.9	-179.7	179.7	-171.5	-1	112.2	F518 Y520 V551 A552 D553 I557 N558 T559	F518-R555 PolarHBondContact O-NH2 3.48Å; Y520-R555 VanDerWaalsContact N-NH2 3.1Å; Y520-R555 PolarHBondContact O-NH1 3.46Å; Y520-R555 PolarHBondContact O-NH2 3.45Å; V551-R555 WeakPolarHBondContact O-CG 3.07Å; V551-R555 PolarHBondContact O-N 2.89Å; V551-R555 VanDerWaalsContact O-N 3.09Å; A552-R555 PolarHBondContact O-N 3.02Å; D553-R555 VanDerWaalsContact C-N 3.33Å; D553-R555 PolarHBondContact O-N 3.02Å; R555-I557 VanDerWaalsContact C-N 3.31Å; R555-I557 PolarHBondContact O-N 3.15Å; R555-N558 PolarHBondContact O-N 3.2Å; R555-T559 PolarHBondContact O-N 3.42Å; R555-T559 PolarHBondContact O-OG1 3.26Å
556	R	89.5	Confident	88.8	Confident	161 Å²	161	53.7 Å²	53.7	61%	0.608	26%	0.261	S	S	*	.	H	α-helix	trans	-60.7	-42.2	177.6	-67.5	170.9	174.6	161.5	-4.9	111.7	A552 D553 S554 T559 N560	A552-R556 PolarHBondContact O-N 3.45Å; D553-R556 WeakPolarHBondContact O-CB 3.2Å; D553-R556 PolarHBondContact O-N 2.99Å; D553-R556 IonicContact OD1-CZ 3.55Å; D553-R556 IonicContact OD1-NH1 3.33Å; D553-R556 PolarHBondContact OD1-NH1 3.21Å; S554-R556 PolarHBondContact O-N 3.43Å; R556-T559 PolarHBondContact O-N 3.36Å; R556-N560 VanDerWaalsContact O-CG 3.25Å; R556-N560 PolarHBondContact O-N 2.83Å; R556-N560 PolarHBondContact O-OD1 3.5Å
557	I	90.4	Very high	88.4	Confident	18 Å²	18	63.1 Å²	63.1	9%	0.092	30%	0.295	C	S	.	.	H	α-helix	trans	-66.4	-45.8	178.6	-68	160.2	0	0	0	110.9	D553 S554 R555 T559 N560 I561 I582 Y613 L616	D553-I557 WeakPolarHBondContact O-CD1 3.29Å; D553-I557 VanDerWaalsContact O-CG1 3.29Å; D553-I557 WeakPolarHBondContact O-CG1 3.45Å; D553-I557 PolarHBondContact O-N 3.31Å; S554-I557 PolarHBondContact O-N 3.24Å; R555-I557 VanDerWaalsContact C-N 3.31Å; R555-I557 PolarHBondContact O-N 3.15Å; I557-T559 VanDerWaalsContact C-N 3.32Å; I557-T559 PolarHBondContact O-N 3.1Å; I557-N560 PolarHBondContact O-N 3.15Å; I557-I561 HydrophobicContact CG2-CD1 3.73Å; I557-I561 HydrophobicContact CG2-CG1 4.45Å; I557-I561 WeakPolarHBondContact O-CG1 3.31Å; I557-I561 PolarHBondContact O-N 3.4Å; I557-I582 HydrophobicContact CB-CD1 4Å; I557-I582 HydrophobicContact CD1-CD1 4.07Å; I557-I582 HydrophobicContact CG2-CD1 3.46Å; I557-I582 VanDerWaalsContact CG2-CD1 3.46Å; I557-Y613 HydrophobicContact CD1-CE2 4.25Å; I557-Y613 HydrophobicContact CG2-CD2 3.97Å; I557-Y613 HydrophobicContact CG2-CE2 4.2Å; I557-L616 HydrophobicContact CB-CD2 4.44Å; I557-L616 HydrophobicContact CG1-CD2 4.28Å; I557-L616 HydrophobicContact CG2-CD2 3.89Å
558	N	90.1	Very high	88	Confident	15 Å²	15	65.6 Å²	65.6	8%	0.08	31%	0.308	C	S	.	.	H	α-helix	trans	-57.9	-43.7	174.9	-80.1	-50.1	0	0	0	111.7	S554 R555 I561 R562 A580 Y609	S554-N558 WeakPolarHBondContact O-CB 3.48Å; S554-N558 PolarHBondContact O-N 2.9Å; S554-N558 PolarHBondContact O-ND2 3.04Å; S554-N558 PolarHBondContact OG-ND2 2.99Å; R555-N558 PolarHBondContact O-N 3.2Å; N558-I561 PolarHBondContact O-N 3.45Å; N558-R562 WeakPolarHBondContact O-CB 3.43Å; N558-R562 VanDerWaalsContact O-CG 3.28Å; N558-R562 WeakPolarHBondContact O-CG 3.43Å; N558-R562 PolarHBondContact O-N 2.94Å; N558-A580 PolarHBondContact ND2-O 3.21Å; N558-A580 PolarHBondContact OD1-N 3.1Å; N558-A580 PolarHBondContact OD1-O 3.41Å; N558-Y609 PolarHBondContact OD1-OH 3.2Å
559	T	89.8	Confident	87.4	Confident	70 Å²	70	67.9 Å²	67.9	43%	0.429	33%	0.328	S	S	.	.	H	α-helix	trans	-61.2	-46	176.7	-57.4	0	0	0	0	111.4	R555 R556 I557 I561 R562 E563	R555-T559 PolarHBondContact O-N 3.42Å; R555-T559 PolarHBondContact O-OG1 3.26Å; R556-T559 PolarHBondContact O-N 3.36Å; I557-T559 VanDerWaalsContact C-N 3.32Å; I557-T559 PolarHBondContact O-N 3.1Å; T559-I561 PolarHBondContact O-N 3.14Å; T559-R562 PolarHBondContact O-N 3.1Å; T559-E563 HydrophobicContact CG2-CG 4.42Å; T559-E563 WeakPolarHBondContact O-CB 3.19Å; T559-E563 WeakPolarHBondContact O-CG 3.23Å; T559-E563 PolarHBondContact O-N 3.4Å
560	N	90.1	Very high	86.4	Confident	78 Å²	78	70 Å²	70	42%	0.417	34%	0.341	S	S	.	.	H	α-helix	trans	-62.7	-40.8	178.8	-68.9	-13.2	0	0	0	112.6	R556 I557 E563 E564 L616	R556-N560 VanDerWaalsContact O-CG 3.25Å; R556-N560 PolarHBondContact O-N 2.83Å; R556-N560 PolarHBondContact O-OD1 3.5Å; I557-N560 PolarHBondContact O-N 3.15Å; N560-E563 PolarHBondContact O-N 2.89Å; N560-E564 PolarHBondContact O-N 3.26Å; N560-L616 HydrophobicContact CB-CD2 4.39Å
561	I	88.4	Confident	85.2	Confident	3 Å²	3	78.2 Å²	78.2	2%	0.015	38%	0.378	C	S	.	.	H	α-helix	trans	-68.6	-43.1	178.7	-69.2	170.8	0	0	0	110.4	I557 N558 T559 E563 E564 E565 Y609 R612	I557-I561 HydrophobicContact CG2-CD1 3.73Å; I557-I561 HydrophobicContact CG2-CG1 4.45Å; I557-I561 WeakPolarHBondContact O-CG1 3.31Å; I557-I561 PolarHBondContact O-N 3.4Å; N558-I561 PolarHBondContact O-N 3.45Å; T559-I561 PolarHBondContact O-N 3.14Å; I561-E563 VanDerWaalsContact C-N 3.34Å; I561-E563 PolarHBondContact O-N 3.36Å; I561-E564 PolarHBondContact O-N 3Å; I561-E565 WeakPolarHBondContact CG2-OE1 3.47Å; I561-E565 WeakPolarHBondContact O-CG 3.41Å; I561-E565 PolarHBondContact O-N 2.82Å; I561-Y609 HydrophobicContact CB-CE2 4.34Å; I561-Y609 HydrophobicContact CD1-CD2 4.44Å; I561-Y609 HydrophobicContact CD1-CE1 3.97Å; I561-Y609 HydrophobicContact CD1-CE2 3.76Å; I561-Y609 VanDerWaalsContact CD1-CZ 3.47Å; I561-Y609 WeakPolarHBondContact CD1-OH 3.45Å; I561-Y609 HydrophobicContact CG2-CD2 4.02Å; I561-Y609 HydrophobicContact CG2-CE2 3.83Å; I561-R612 HydrophobicContact CG2-CB 4.33Å
562	R	86.9	Confident	84.4	Confident	126 Å²	126	84.2 Å²	84.2	48%	0.475	41%	0.405	S	S	.	.	H	α-helix	trans	-63.6	-38.1	174.7	-74.8	177.3	174.5	-168.6	-3.4	112.6	N558 T559 E564 E565 S566 S579	N558-R562 WeakPolarHBondContact O-CB 3.43Å; N558-R562 VanDerWaalsContact O-CG 3.28Å; N558-R562 WeakPolarHBondContact O-CG 3.43Å; N558-R562 PolarHBondContact O-N 2.94Å; T559-R562 PolarHBondContact O-N 3.1Å; R562-E564 VanDerWaalsContact C-N 3.35Å; R562-E565 PolarHBondContact O-N 3.1Å; R562-S566 WeakPolarHBondContact O-CB 3.31Å; R562-S566 PolarHBondContact O-N 2.97Å; R562-S566 PolarHBondContact O-OG 2.98Å; R562-S579 PolarHBondContact NH2-OG 2.9Å
563	E	87.2	Confident	83.6	Confident	111 Å²	111	86.5 Å²	86.5	52%	0.519	41%	0.41	S	S	.	.	H	α-helix	trans	-63.4	-40.8	173.6	-79.3	179.5	-169.4	0	0	111.2	T559 N560 I561 S566 R567	T559-E563 HydrophobicContact CG2-CG 4.42Å; T559-E563 WeakPolarHBondContact O-CB 3.19Å; T559-E563 WeakPolarHBondContact O-CG 3.23Å; T559-E563 PolarHBondContact O-N 3.4Å; N560-E563 PolarHBondContact O-N 2.89Å; I561-E563 VanDerWaalsContact C-N 3.34Å; I561-E563 PolarHBondContact O-N 3.36Å; E563-S566 PolarHBondContact O-OG 3.39Å; E563-R567 WeakPolarHBondContact O-CD 3.19Å; E563-R567 VanDerWaalsContact O-CG 3.25Å; E563-R567 WeakPolarHBondContact O-CG 3.43Å; E563-R567 PolarHBondContact O-N 3.45Å
564	E	85.2	Confident	82.9	Confident	61 Å²	61	85.5 Å²	85.5	29%	0.285	41%	0.407	S	S	.	.	H	α-helix	trans	-64	-44.1	173.8	-169.1	-175.7	-161.1	0	0	111.5	N560 I561 R562 S566 R567 K615	N560-E564 PolarHBondContact O-N 3.26Å; I561-E564 PolarHBondContact O-N 3Å; R562-E564 VanDerWaalsContact C-N 3.35Å; E564-S566 PolarHBondContact O-N 3.27Å; E564-R567 WeakPolarHBondContact O-CB 3.23Å; E564-R567 PolarHBondContact O-N 2.82Å; E564-R567 VanDerWaalsContact O-N 3.16Å; E564-K615 IonicContact OE1-NZ 3.6Å; E564-K615 PolarHBondContact OE1-NZ 3.06Å
565	E	84.4	Confident	82.1	Confident	22 Å²	22	90.5 Å²	90.5	10%	0.103	44%	0.439	C	S	.	.	H	α-helix	trans	-59	-45.3	177.1	-77.6	169.6	-172.9	0	0	112.6	I561 R562 R567 L568 P574 R612	I561-E565 WeakPolarHBondContact CG2-OE1 3.47Å; I561-E565 WeakPolarHBondContact O-CG 3.41Å; I561-E565 PolarHBondContact O-N 2.82Å; R562-E565 PolarHBondContact O-N 3.1Å; E565-R567 PolarHBondContact O-N 2.81Å; E565-R567 VanDerWaalsContact O-N 3.15Å; E565-L568 WeakPolarHBondContact O-CB 3.27Å; E565-L568 PolarHBondContact O-N 2.65Å; E565-L568 VanDerWaalsContact O-N 3.1Å; E565-P574 HydrophobicContact CG-CG 4.23Å; E565-R612 VanDerWaalsContact CG-CZ 3.42Å; E565-R612 IonicContact OE1-CZ 2.63Å; E565-R612 IonicContact OE1-NH1 3.97Å; E565-R612 PolarHBondContact OE1-NH1 3.47Å
566	S	82.9	Confident	81.7	Confident	83 Å²	83	89.1 Å²	89.1	58%	0.58	44%	0.438	S	S	*	.	H	α-helix	trans	-65.6	-16.6	179.4	69.4	0	0	0	0	113.9	R562 E563 E564	R562-S566 WeakPolarHBondContact O-CB 3.31Å; R562-S566 PolarHBondContact O-N 2.97Å; R562-S566 PolarHBondContact O-OG 2.98Å; E563-S566 PolarHBondContact O-OG 3.39Å; E564-S566 PolarHBondContact O-N 3.27Å
567	R	83.6	Confident	81.3	Confident	219 Å²	219	86 Å²	86	83%	0.826	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-11.2	177.6	-67.5	171.5	76.4	172.5	6	113.1	E563 E564 E565	E563-R567 WeakPolarHBondContact O-CD 3.19Å; E563-R567 VanDerWaalsContact O-CG 3.25Å; E563-R567 WeakPolarHBondContact O-CG 3.43Å; E563-R567 PolarHBondContact O-N 3.45Å; E564-R567 WeakPolarHBondContact O-CB 3.23Å; E564-R567 PolarHBondContact O-N 2.82Å; E564-R567 VanDerWaalsContact O-N 3.16Å; E565-R567 PolarHBondContact O-N 2.81Å; E565-R567 VanDerWaalsContact O-N 3.15Å
568	L	81.8	Confident	81	Confident	52 Å²	52	87.3 Å²	87.3	27%	0.272	45%	0.454	S	S	.	.	S	Bend	trans	-75.8	151.5	173.8	-62	171.3	0	0	0	110.2	E565 E572 Q573	E565-L568 WeakPolarHBondContact O-CB 3.27Å; E565-L568 PolarHBondContact O-N 2.65Å; E565-L568 VanDerWaalsContact O-N 3.1Å; L568-E572 HydrophobicContact CB-CB 4.21Å; L568-Q573 HydrophobicContact CB-CG 4.36Å; L568-Q573 PolarHBondContact O-NE2 3.49Å
569	A	76.9	Confident	80.9	Confident	61 Å²	61	89.1 Å²	89.1	50%	0.504	47%	0.467	S	S	.	.			trans	-59.6	149.2	171.8	0	0	0	0	0	110.1	E571 E572 Q573	A569-E571 PolarHBondContact O-N 3.43Å; A569-E572 PolarHBondContact O-N 3.41Å; A569-Q573 PolarHBondContact O-N 2.96Å
570	E	70.5	Confident	80.8	Confident	174 Å²	174	86.1 Å²	86.1	81%	0.813	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-53.4	-29.7	-177	-71.6	-176.4	166.1	0	0	113.2
571	E	66.8	Low	80.7	Confident	198 Å²	198	84.3 Å²	84.3	93%	0.925	44%	0.439	S	S	*	.	G	3₁₀ helix	trans	-73.6	-21.7	177.2	-64.7	173.8	173.5	0	0	114.1	A569	A569-E571 PolarHBondContact O-N 3.43Å
572	E	70.7	Confident	80.8	Confident	132 Å²	132	85.3 Å²	85.3	62%	0.617	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-102.7	-1.2	179.5	-68.8	-173.5	164.1	0	0	113.1	L568 A569	L568-E572 HydrophobicContact CB-CB 4.21Å; A569-E572 PolarHBondContact O-N 3.41Å
573	Q	73.2	Confident	80.9	Confident	84 Å²	84	81.7 Å²	81.7	39%	0.393	43%	0.434	S	S	.	.	S	Bend	trans	-70.6	141.2	176.8	-72.9	178	12	0	0	110.5	L568 A569	L568-Q573 HydrophobicContact CB-CG 4.36Å; L568-Q573 PolarHBondContact O-NE2 3.49Å; A569-Q573 PolarHBondContact O-N 2.96Å
574	P	74	Confident	80.8	Confident	32 Å²	32	77.8 Å²	77.8	21%	0.208	42%	0.419	C	S	.	.			trans	-63	139.5	179.7	27.3	-33.5	0	0	0	110.2	E565 L576	E565-P574 HydrophobicContact CG-CG 4.23Å; P574-L576 PolarHBondContact O-N 2.91Å
575	P	73.3	Confident	80.6	Confident	108 Å²	108	80.3 Å²	80.3	70%	0.701	44%	0.443	S	S	*	.	S	Bend	trans	-66.7	-19.1	-179.6	26.8	-34.7	0	0	0	112.9	L601	P575-L601 HydrophobicContact CG-CD1 4.48Å
576	L	79.6	Confident	80.3	Confident	64 Å²	64	86.8 Å²	86.8	34%	0.335	47%	0.474	S	S	.	.	S	Bend	trans	-120.6	128.2	176.3	-70.5	178	0	0	0	110.4	P574 L578 L601 A605	P574-L576 PolarHBondContact O-N 2.91Å; L576-L578 PolarHBondContact O-N 3.26Å; L576-L578 VanDerWaalsContact O-N 3.08Å; L576-L601 HydrophobicContact CD1-CB 4.39Å; L576-L601 HydrophobicContact CD1-CD2 3.64Å; L576-L601 HydrophobicContact CD1-CG 3.56Å; L576-L601 HydrophobicContact CD2-CD2 3.83Å; L576-L601 HydrophobicContact CD2-CG 4.47Å; L576-L601 HydrophobicContact CG-CD2 3.85Å; L576-L601 HydrophobicContact CG-CG 3.94Å; L576-A605 HydrophobicContact CB-CB 4.13Å; L576-A605 HydrophobicContact CD1-CB 4.16Å
577	A	80.7	Confident	80.2	Confident	96 Å²	96	85.3 Å²	85.3	79%	0.793	46%	0.457	S	S	*	.			trans	-76.9	90.9	170.9	0	0	0	0	0	110.1
578	L	86	Confident	80.3	Confident	45 Å²	45	75.4 Å²	75.4	24%	0.236	42%	0.42	C	S	.	.			trans	-85.2	140	179.3	-172.1	66.1	0	0	0	111.3	L576 M606 Y609 W624	L576-L578 PolarHBondContact O-N 3.26Å; L576-L578 VanDerWaalsContact O-N 3.08Å; L578-M606 HydrophobicContact CD2-CB 4.48Å; L578-M606 HydrophobicContact CD2-CG 3.9Å; L578-Y609 HydrophobicContact CD2-CD2 4.28Å; L578-Y609 HydrophobicContact CD2-CG 4.08Å; L578-W624 HydrophobicContact CD2-CH2 3.68Å; L578-W624 HydrophobicContact CD2-CZ2 4.38Å; L578-W624 HydrophobicContact CD2-CZ3 4.33Å
579	S	86.7	Confident	80.4	Confident	52 Å²	52	73.1 Å²	73.1	36%	0.364	41%	0.408	S	S	.	.			trans	-128.5	126.8	169.1	-162.1	0	0	0	0	108.2	R562	R562-S579 PolarHBondContact NH2-OG 2.9Å
580	A	88.4	Confident	80.6	Confident	7 Å²	7	73.7 Å²	73.7	6%	0.058	41%	0.405	C	S	.	.			trans	-112.6	129.8	-177.3	0	0	0	0	0	111.2	S554 N558 I582 Y609 W624	S554-A580 PolarHBondContact OG-O 3.37Å; S554-A580 VanDerWaalsContact OG-O 3.05Å; N558-A580 PolarHBondContact ND2-O 3.21Å; N558-A580 PolarHBondContact OD1-N 3.1Å; N558-A580 PolarHBondContact OD1-O 3.41Å; A580-I582 HydrophobicContact CB-CG1 4.47Å; A580-I582 PolarHBondContact O-N 3.42Å; A580-Y609 HydrophobicContact CB-CD1 4.19Å; A580-Y609 HydrophobicContact CB-CE1 3.53Å; A580-Y609 HydrophobicContact CB-CE2 4.31Å; A580-W624 HydrophobicContact CB-CH2 3.74Å; A580-W624 HydrophobicContact CB-CZ3 3.81Å
581	M	88.1	Confident	81.1	Confident	40 Å²	40	67.1 Å²	67.1	20%	0.197	38%	0.375	C	S	.	.			trans	-82.2	113.6	166.3	-167.2	175	-67.5	0	0	108.6	L514 L515 F518 V551 S554 L583	L514-M581 WeakPolarHBondContact O-CE 3.4Å; L515-M581 HydrophobicContact CD2-SD 4.4Å; F518-M581 HydrophobicContact CD1-CB 4.41Å; F518-M581 HydrophobicContact CD1-CE 3.88Å; F518-M581 HydrophobicContact CE1-CB 3.99Å; F518-M581 HydrophobicContact CE1-CE 4.22Å; F518-M581 HydrophobicContact CG-CE 4.18Å; V551-M581 HydrophobicContact CG2-SD 4.39Å; S554-M581 WeakPolarHBondContact OG-CA 3.41Å; M581-L583 HydrophobicContact CG-CD2 3.61Å; M581-L583 HydrophobicContact CG-CG 4.2Å; M581-L583 HydrophobicContact SD-CD2 4.01Å
582	I	89.6	Confident	81.5	Confident	24 Å²	24	60 Å²	60	12%	0.123	34%	0.341	C	S	.	.			trans	-99.4	116.9	-174.5	-59.5	161.7	0	0	0	108.2	S554 I557 A580 Y613 L622	S554-I582 PolarHBondContact OG-N 2.86Å; I557-I582 HydrophobicContact CB-CD1 4Å; I557-I582 HydrophobicContact CD1-CD1 4.07Å; I557-I582 HydrophobicContact CG2-CD1 3.46Å; I557-I582 VanDerWaalsContact CG2-CD1 3.46Å; A580-I582 HydrophobicContact CB-CG1 4.47Å; A580-I582 PolarHBondContact O-N 3.42Å; I582-Y613 HydrophobicContact CD1-CD2 3.93Å; I582-Y613 HydrophobicContact CD1-CE2 3.77Å; I582-Y613 HydrophobicContact CG2-CE2 4.46Å; I582-L622 HydrophobicContact CG2-CD2 4.39Å
583	L	89.1	Confident	81.5	Confident	51 Å²	51	61 Å²	61	27%	0.267	35%	0.346	S	S	.	.			trans	-121.2	149.8	-171.2	-53.3	-178.2	0	0	0	111	L515 M581 W588	L515-L583 HydrophobicContact CD2-CD1 3.78Å; M581-L583 HydrophobicContact CG-CD2 3.61Å; M581-L583 HydrophobicContact CG-CG 4.2Å; M581-L583 HydrophobicContact SD-CD2 4.01Å; L583-W588 HydrophobicContact CB-CD2 4.38Å; L583-W588 HydrophobicContact CD1-CD2 4.03Å; L583-W588 HydrophobicContact CD1-CE3 3.98Å; L583-W588 HydrophobicContact CD1-CH2 4.07Å; L583-W588 HydrophobicContact CD1-CZ2 4.15Å; L583-W588 HydrophobicContact CD1-CZ3 3.99Å; L583-W588 HydrophobicContact CD2-CD2 4.45Å; L583-W588 HydrophobicContact CD2-CH2 3.77Å; L583-W588 HydrophobicContact CD2-CZ2 3.3Å; L583-W588 HydrophobicContact CG-CZ2 4.19Å
584	S	86.3	Confident	81.5	Confident	29 Å²	29	60.9 Å²	60.9	20%	0.203	35%	0.346	C	S	.	.			trans	-81.6	131.9	169.9	61.6	0	0	0	0	111.1	D550 E586 F587	D550-S584 WeakPolarHBondContact OD2-CB 3.29Å; D550-S584 PolarHBondContact OD2-N 3.46Å; D550-S584 PolarHBondContact OD2-OG 3Å; S584-E586 PolarHBondContact O-N 3.23Å; S584-F587 WeakPolarHBondContact OG-CD2 3.2Å
585	S	79.4	Confident	81.6	Confident	113 Å²	113	68.3 Å²	68.3	79%	0.79	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-28.7	-175.9	56.1	0	0	0	0	114
586	E	78.3	Confident	82	Confident	159 Å²	159	64.5 Å²	64.5	74%	0.743	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-27.9	-173.7	-66.4	-176.7	165	0	0	113.4	S584	S584-E586 PolarHBondContact O-N 3.23Å
587	F	81.3	Confident	82.2	Confident	52 Å²	52	67.5 Å²	67.5	23%	0.228	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-18.9	-172.9	-63.2	-85.5	0	0	0	113.7	H542 Y543 V546 S584	H542-F587 AromaticContact NE2-CE1 3.92Å; Y543-F587 HydrophobicContact CD1-CB 4.19Å; Y543-F587 AromaticContact CD1-CD1 3.71Å; Y543-F587 HydrophobicContact CD1-CD1 3.71Å; Y543-F587 HydrophobicContact CD1-CG 4.38Å; Y543-F587 AromaticContact CE1-CD1 3.96Å; Y543-F587 HydrophobicContact CE1-CD1 3.96Å; Y543-F587 HydrophobicContact CG-CD1 4.38Å; V546-F587 HydrophobicContact CB-CB 4.22Å; V546-F587 HydrophobicContact CB-CD1 4.03Å; V546-F587 HydrophobicContact CB-CD2 4.49Å; V546-F587 HydrophobicContact CB-CG 3.99Å; V546-F587 HydrophobicContact CG1-CB 3.95Å; V546-F587 HydrophobicContact CG1-CD1 4.08Å; V546-F587 HydrophobicContact CG1-CD2 3.66Å; V546-F587 HydrophobicContact CG1-CE2 4.15Å; V546-F587 HydrophobicContact CG1-CG 3.61Å; V546-F587 HydrophobicContact CG2-CD1 4.09Å; V546-F587 HydrophobicContact CG2-CE1 4.15Å; V546-F587 HydrophobicContact CG2-CG 4.46Å; S584-F587 WeakPolarHBondContact OG-CD2 3.2Å
588	W	85.9	Confident	82.2	Confident	11 Å²	11	64.7 Å²	64.7	4%	0.042	33%	0.331	C	S	.	.	S	Bend	trans	-86.6	152.8	177.8	-73.4	67	0	0	0	111	A511 L514 L515 M547 D550 V551 L583	A511-W588 HydrophobicContact CB-CE3 3.88Å; A511-W588 HydrophobicContact CB-CZ3 3.93Å; L514-W588 HydrophobicContact CB-CH2 3.78Å; L514-W588 HydrophobicContact CB-CZ3 4.33Å; L514-W588 HydrophobicContact CD1-CH2 3.72Å; L514-W588 HydrophobicContact CD1-CZ2 4.18Å; L514-W588 HydrophobicContact CG-CH2 4.42Å; L515-W588 HydrophobicContact CD1-CZ3 4.44Å; L515-W588 HydrophobicContact CD2-CZ3 4.21Å; L515-W588 HydrophobicContact CG-CZ3 4.03Å; M547-W588 HydrophobicContact CB-CZ2 3.87Å; M547-W588 HydrophobicContact CE-CD2 3.96Å; M547-W588 HydrophobicContact CE-CE3 3.78Å; M547-W588 HydrophobicContact CE-CH2 4.2Å; M547-W588 HydrophobicContact CE-CZ2 4.33Å; M547-W588 HydrophobicContact CE-CZ3 3.92Å; M547-W588 HydrophobicContact CG-CD2 4Å; M547-W588 HydrophobicContact CG-CG 4.08Å; M547-W588 HydrophobicContact CG-CZ2 4.19Å; D550-W588 PolarHBondContact OD2-NE1 3.42Å; D550-W588 VanDerWaalsContact OD2-NE1 3.1Å; V551-W588 HydrophobicContact CG2-CH2 4.36Å; V551-W588 HydrophobicContact CG2-CZ2 4.22Å; L583-W588 HydrophobicContact CB-CD2 4.38Å; L583-W588 HydrophobicContact CD1-CD2 4.03Å; L583-W588 HydrophobicContact CD1-CE3 3.98Å; L583-W588 HydrophobicContact CD1-CH2 4.07Å; L583-W588 HydrophobicContact CD1-CZ2 4.15Å; L583-W588 HydrophobicContact CD1-CZ3 3.99Å; L583-W588 HydrophobicContact CD2-CD2 4.45Å; L583-W588 HydrophobicContact CD2-CH2 3.77Å; L583-W588 HydrophobicContact CD2-CZ2 3.3Å; L583-W588 HydrophobicContact CG-CZ2 4.19Å
589	P	84	Confident	82.2	Confident	4 Å²	4	63.1 Å²	63.1	3%	0.026	32%	0.324	C	S	.	.			trans	-55.5	157.7	167.7	-20.3	31.3	0	0	0	111.6	R507 A511 L591 T730	R507-P589 HydrophobicContact CG-CG 3.88Å; A511-P589 HydrophobicContact CB-CG 3.78Å; P589-L591 PolarHBondContact O-N 3.19Å; P589-T730 HydrophobicContact CB-CG2 3.82Å; P589-T730 HydrophobicContact CG-CG2 4.18Å
590	T	80.6	Confident	82.1	Confident	72 Å²	72	65 Å²	65	44%	0.442	34%	0.335	S	S	.	.			trans	-62.8	107.6	176.1	47.8	0	0	0	0	110.1	T731	T590-T731 PolarHBondContact O-N 3.31Å; T590-T731 PolarHBondContact O-OG1 3.41Å; T590-T731 WeakPolarHBondContact OG1-CB 3.45Å; T590-T731 PolarHBondContact OG1-OG1 2.9Å
591	L	80.4	Confident	81.9	Confident	37 Å²	37	68.4 Å²	68.4	19%	0.194	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-74.1	142	175.4	-57.4	178.5	0	0	0	109.3	L515 P589 L628 T730	L515-L591 HydrophobicContact CD1-CD2 3.83Å; P589-L591 PolarHBondContact O-N 3.19Å; L591-L628 HydrophobicContact CB-CD1 4.21Å; L591-L628 HydrophobicContact CD1-CD1 3.91Å; L591-L628 HydrophobicContact CD2-CD1 4.23Å; L591-L628 HydrophobicContact CG-CD1 4.34Å; L591-T730 HydrophobicContact CD2-CG2 4.28Å
592	K	75.3	Confident	81.8	Confident	48 Å²	48	67.8 Å²	67.8	21%	0.209	35%	0.353	C	S	.	.			trans	-57.8	150.6	176.5	-71	175.8	174.8	168.8	0	110.4	H627 D727 S728 N729	K592-H627 PolarHBondContact O-CE1 2.86Å; K592-H627 PolarHBondContact O-NE2 2.93Å; K592-D727 VanDerWaalsContact NZ-CG 3.35Å; K592-D727 IonicContact NZ-OD1 3.6Å; K592-D727 PolarHBondContact NZ-OD1 2.85Å; K592-D727 IonicContact NZ-OD2 3.61Å; K592-S728 VanDerWaalsContact CE-O 3.22Å; K592-S728 WeakPolarHBondContact CE-O 3.48Å; K592-S728 PolarHBondContact NZ-O 3.48Å; K592-N729 PolarHBondContact N-O 3.02Å
593	E	72	Confident	81.6	Confident	154 Å²	154	68.5 Å²	68.5	72%	0.72	36%	0.36	S	S	*	.			trans	-115.4	102.6	175.9	-57.6	-151.8	145	0	0	110.5	K625	E593-K625 VanDerWaalsContact CG-NZ 3.32Å; E593-K625 IonicContact OE1-NZ 2.71Å; E593-K625 PolarHBondContact OE1-NZ 3.03Å
594	E	72.4	Confident	81.6	Confident	81 Å²	81	72 Å²	72	38%	0.379	38%	0.375	S	S	.	.			trans	-107.7	125.8	170.4	-63.6	-176.1	167.2	0	0	110.2	H627 M679	E594-H627 HydrophobicContact CB-CB 4.1Å; E594-H627 WeakPolarHBondContact OE2-CB 3.47Å; E594-H627 IonicContact OE2-CG 2.87Å; E594-M679 WeakPolarHBondContact OE1-CE 3.27Å; E594-M679 WeakPolarHBondContact OE2-CE 3.32Å
595	K	75.8	Confident	81.6	Confident	187 Å²	187	71.1 Å²	71.1	81%	0.813	37%	0.369	S	S	*	.			trans	-83.5	122.9	172.8	-66.4	-178	-178	177.6	0	108
596	M	81.7	Confident	82.1	Confident	29 Å²	29	66.8 Å²	66.8	14%	0.143	34%	0.337	C	S	.	.			trans	-139.9	135.1	178.2	178.2	-172.2	167.3	0	0	108.2	L598 I650 A653 L673 V675	M596-L598 HydrophobicContact CE-CD2 4.07Å; M596-L598 HydrophobicContact SD-CD2 4.24Å; M596-I650 HydrophobicContact CE-CB 4.21Å; M596-I650 HydrophobicContact CE-CG1 4.31Å; M596-I650 HydrophobicContact SD-CB 3.97Å; M596-I650 HydrophobicContact SD-CG1 4.23Å; M596-A653 HydrophobicContact CE-CB 3.21Å; M596-L673 HydrophobicContact CE-CD2 4.28Å; M596-V675 HydrophobicContact CB-CG2 4.26Å; M596-V675 HydrophobicContact CG-CG2 4.22Å
597	E	84.3	Confident	82.6	Confident	126 Å²	126	65.7 Å²	65.7	59%	0.589	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-80	124	168.9	-63.1	-163.5	172.1	0	0	109.3	L673	E597-L673 PolarHBondContact N-O 3.04Å
598	L	81.4	Confident	83	Confident	37 Å²	37	65.1 Å²	65.1	19%	0.194	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-91.9	146.8	-177.6	-73.1	175.4	0	0	0	111.7	M596 S603 M606 P626	M596-L598 HydrophobicContact CE-CD2 4.07Å; M596-L598 HydrophobicContact SD-CD2 4.24Å; L598-S603 PolarHBondContact O-OG 3Å; L598-M606 HydrophobicContact CD1-CE 3.74Å; L598-M606 HydrophobicContact CD1-SD 3.41Å; L598-M606 WeakPolarHBondContact CD1-SD 3.4Å; L598-P626 HydrophobicContact CD1-CB 3.86Å; L598-P626 HydrophobicContact CD1-CG 3.72Å; L598-P626 HydrophobicContact CD2-CB 3.83Å; L598-P626 HydrophobicContact CD2-CG 4.47Å; L598-P626 HydrophobicContact CG-CB 4.14Å; L598-P626 HydrophobicContact CG-CG 4.24Å
599	P	84.9	Confident	83.2	Confident	12 Å²	12	64.7 Å²	64.7	8%	0.078	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-54.8	144.5	173.1	-25.6	34.2	0	0	0	111.9	L601 A602 S603 A653 L656	P599-L601 PolarHBondContact O-N 2.88Å; P599-L601 VanDerWaalsContact O-N 3.09Å; P599-A602 PolarHBondContact O-N 3.31Å; P599-S603 PolarHBondContact O-N 2.84Å; P599-S603 VanDerWaalsContact O-N 3.07Å; P599-S603 PolarHBondContact O-OG 3.21Å; P599-A653 HydrophobicContact CG-CB 3.67Å; P599-L656 HydrophobicContact CB-CD1 3.99Å; P599-L656 HydrophobicContact CG-CB 4.47Å; P599-L656 HydrophobicContact CG-CD1 3.77Å
600	P	84.6	Confident	83.5	Confident	93 Å²	93	65.6 Å²	65.6	60%	0.604	34%	0.34	S	S	*	.	H	α-helix	trans	-54.2	-36.3	-176.7	-26.4	33.3	0	0	0	113.7	S603 Q604	P600-S603 PolarHBondContact O-N 2.9Å; P600-Q604 WeakPolarHBondContact O-CG 3.44Å; P600-Q604 PolarHBondContact O-N 3.49Å
601	L	84.1	Confident	83.9	Confident	78 Å²	78	68.2 Å²	68.2	41%	0.408	35%	0.347	S	S	.	.	H	α-helix	trans	-59.6	-45.4	177.8	-168.6	81.4	0	0	0	111.9	P575 L576 P599 A605	P575-L601 HydrophobicContact CG-CD1 4.48Å; L576-L601 HydrophobicContact CD1-CB 4.39Å; L576-L601 HydrophobicContact CD1-CD2 3.64Å; L576-L601 HydrophobicContact CD1-CG 3.56Å; L576-L601 HydrophobicContact CD2-CD2 3.83Å; L576-L601 HydrophobicContact CD2-CG 4.47Å; L576-L601 HydrophobicContact CG-CD2 3.85Å; L576-L601 HydrophobicContact CG-CG 3.94Å; P599-L601 PolarHBondContact O-N 2.88Å; P599-L601 VanDerWaalsContact O-N 3.09Å; L601-A605 PolarHBondContact O-N 3.45Å
602	A	86.3	Confident	84.2	Confident	27 Å²	27	68 Å²	68	22%	0.223	34%	0.344	C	S	.	.	H	α-helix	trans	-71.7	-42.7	179.4	0	0	0	0	0	111.3	P599 Q604 A605 M606	P599-A602 PolarHBondContact O-N 3.31Å; A602-Q604 PolarHBondContact O-N 3.39Å; A602-A605 PolarHBondContact O-N 2.91Å; A602-M606 WeakPolarHBondContact O-CB 3.34Å; A602-M606 VanDerWaalsContact O-CG 3.25Å; A602-M606 WeakPolarHBondContact O-CG 3.18Å; A602-M606 PolarHBondContact O-N 3.2Å
603	S	86.7	Confident	84.9	Confident	38 Å²	38	66.4 Å²	66.4	27%	0.266	34%	0.337	S	S	.	.	H	α-helix	trans	-59.1	-45.3	178.5	-61	0	0	0	0	112.1	L598 P599 P600 A605 M606 E607	L598-S603 PolarHBondContact O-OG 3Å; P599-S603 PolarHBondContact O-N 2.84Å; P599-S603 VanDerWaalsContact O-N 3.07Å; P599-S603 PolarHBondContact O-OG 3.21Å; P600-S603 PolarHBondContact O-N 2.9Å; S603-A605 PolarHBondContact O-N 3.22Å; S603-M606 PolarHBondContact O-N 3.03Å; S603-E607 WeakPolarHBondContact O-CG 3.3Å; S603-E607 PolarHBondContact O-N 3.02Å
604	Q	87.7	Confident	85.8	Confident	125 Å²	125	62.7 Å²	62.7	58%	0.584	32%	0.319	S	S	*	.	H	α-helix	trans	-63.5	-40.9	176.6	-71.7	174.3	20.5	0	0	112.5	P600 A602 M606 E607 A608	P600-Q604 WeakPolarHBondContact O-CG 3.44Å; P600-Q604 PolarHBondContact O-N 3.49Å; A602-Q604 PolarHBondContact O-N 3.39Å; Q604-M606 VanDerWaalsContact C-N 3.34Å; Q604-E607 PolarHBondContact O-N 2.76Å; Q604-A608 WeakPolarHBondContact O-CB 3.33Å; Q604-A608 PolarHBondContact O-N 3.16Å
605	A	87.3	Confident	86.6	Confident	10 Å²	10	65.8 Å²	65.8	8%	0.083	33%	0.332	C	S	.	.	H	α-helix	trans	-64.2	-40.2	176.5	0	0	0	0	0	111.7	L576 L601 A602 S603 A608 Y609	L576-A605 HydrophobicContact CB-CB 4.13Å; L576-A605 HydrophobicContact CD1-CB 4.16Å; L601-A605 PolarHBondContact O-N 3.45Å; A602-A605 PolarHBondContact O-N 2.91Å; S603-A605 PolarHBondContact O-N 3.22Å; A605-A608 PolarHBondContact O-N 3.18Å; A605-Y609 WeakPolarHBondContact O-CB 3.36Å; A605-Y609 PolarHBondContact O-N 2.79Å
606	M	89.2	Confident	87.2	Confident	23 Å²	23	60.5 Å²	60.5	11%	0.113	31%	0.312	C	S	.	.	H	α-helix	trans	-68.3	-39	177.4	-69.5	165.7	79.5	0	0	112.3	L578 L598 A602 S603 Q604 Y609 T610 W624 P626	L578-M606 HydrophobicContact CD2-CB 4.48Å; L578-M606 HydrophobicContact CD2-CG 3.9Å; L598-M606 HydrophobicContact CD1-CE 3.74Å; L598-M606 HydrophobicContact CD1-SD 3.41Å; L598-M606 WeakPolarHBondContact CD1-SD 3.4Å; A602-M606 WeakPolarHBondContact O-CB 3.34Å; A602-M606 VanDerWaalsContact O-CG 3.25Å; A602-M606 WeakPolarHBondContact O-CG 3.18Å; A602-M606 PolarHBondContact O-N 3.2Å; S603-M606 PolarHBondContact O-N 3.03Å; Q604-M606 VanDerWaalsContact C-N 3.34Å; M606-Y609 PolarHBondContact O-N 2.98Å; M606-T610 WeakPolarHBondContact O-CB 3.47Å; M606-T610 PolarHBondContact O-N 2.84Å; M606-T610 PolarHBondContact O-OG1 2.81Å; M606-W624 HydrophobicContact CB-CD2 4.33Å; M606-W624 HydrophobicContact CB-CH2 4.42Å; M606-W624 HydrophobicContact CB-CZ2 3.91Å; M606-W624 HydrophobicContact CE-CB 3.4Å; M606-W624 HydrophobicContact CE-CD2 3.23Å; M606-W624 HydrophobicContact CE-CE3 3.36Å; M606-W624 HydrophobicContact CE-CG 3.27Å; M606-W624 HydrophobicContact CE-CZ3 4.17Å; M606-W624 HydrophobicContact CG-CD2 4.27Å; M606-W624 HydrophobicContact CG-CE3 4.32Å; M606-W624 HydrophobicContact CG-CH2 4.18Å; M606-W624 HydrophobicContact CG-CZ2 4.15Å; M606-W624 HydrophobicContact CG-CZ3 4.26Å; M606-P626 HydrophobicContact CE-CG 4.45Å
607	E	89.2	Confident	87.4	Confident	136 Å²	136	63.4 Å²	63.4	64%	0.636	32%	0.323	S	S	*	.	H	α-helix	trans	-64	-46.5	173.2	-75.2	175.9	-169.1	0	0	111.7	S603 Q604 Y609 T610 H611	S603-E607 WeakPolarHBondContact O-CG 3.3Å; S603-E607 PolarHBondContact O-N 3.02Å; Q604-E607 PolarHBondContact O-N 2.76Å; E607-Y609 VanDerWaalsContact C-N 3.32Å; E607-Y609 PolarHBondContact O-N 3.41Å; E607-T610 WeakPolarHBondContact O-CB 3.24Å; E607-T610 PolarHBondContact O-N 3.35Å; E607-T610 VanDerWaalsContact O-N 3.14Å; E607-H611 PolarHBondContact O-N 2.97Å
608	A	88.4	Confident	87.5	Confident	39 Å²	39	61.2 Å²	61.2	32%	0.322	33%	0.327	S	S	.	.	H	α-helix	trans	-59.9	-43	176.6	0	0	0	0	0	111.8	Q604 A605 H611 R612	Q604-A608 WeakPolarHBondContact O-CB 3.33Å; Q604-A608 PolarHBondContact O-N 3.16Å; A605-A608 PolarHBondContact O-N 3.18Å; A608-H611 PolarHBondContact O-N 3.1Å; A608-R612 WeakPolarHBondContact O-CG 3.34Å; A608-R612 PolarHBondContact O-N 3.38Å; A608-R612 VanDerWaalsContact O-N 3.11Å
609	Y	90.1	Very high	87.5	Confident	3 Å²	3	69 Å²	69	1%	0.012	37%	0.365	C	S	.	.	H	α-helix	trans	-64	-40.9	174.8	-170.9	-81.4	0	0	0	111.9	N558 I561 L578 A580 A605 M606 E607 H611 R612 Y613 L622 W624	N558-Y609 PolarHBondContact OD1-OH 3.2Å; I561-Y609 HydrophobicContact CB-CE2 4.34Å; I561-Y609 HydrophobicContact CD1-CD2 4.44Å; I561-Y609 HydrophobicContact CD1-CE1 3.97Å; I561-Y609 HydrophobicContact CD1-CE2 3.76Å; I561-Y609 VanDerWaalsContact CD1-CZ 3.47Å; I561-Y609 WeakPolarHBondContact CD1-OH 3.45Å; I561-Y609 HydrophobicContact CG2-CD2 4.02Å; I561-Y609 HydrophobicContact CG2-CE2 3.83Å; L578-Y609 HydrophobicContact CD2-CD2 4.28Å; L578-Y609 HydrophobicContact CD2-CG 4.08Å; A580-Y609 HydrophobicContact CB-CD1 4.19Å; A580-Y609 HydrophobicContact CB-CE1 3.53Å; A580-Y609 HydrophobicContact CB-CE2 4.31Å; A605-Y609 WeakPolarHBondContact O-CB 3.36Å; A605-Y609 PolarHBondContact O-N 2.79Å; M606-Y609 PolarHBondContact O-N 2.98Å; E607-Y609 VanDerWaalsContact C-N 3.32Å; E607-Y609 PolarHBondContact O-N 3.41Å; Y609-H611 PolarHBondContact O-N 3.48Å; Y609-R612 PolarHBondContact O-N 3.3Å; Y609-Y613 WeakPolarHBondContact O-CB 3.37Å; Y609-Y613 PolarHBondContact O-N 3.44Å; Y609-L622 HydrophobicContact CD1-CD1 3.77Å; Y609-L622 HydrophobicContact CE1-CD1 3.89Å; Y609-W624 AromaticContact CD1-CH2 3.8Å; Y609-W624 HydrophobicContact CD1-CH2 3.8Å; Y609-W624 AromaticContact CD1-CZ2 3.86Å; Y609-W624 HydrophobicContact CD1-CZ2 3.86Å; Y609-W624 HydrophobicContact CE1-CH2 4.4Å; Y609-W624 HydrophobicContact CG-CH2 4.23Å; Y609-W624 HydrophobicContact CG-CZ2 4.38Å
610	T	90.8	Very high	87.6	Confident	22 Å²	22	75.6 Å²	75.6	14%	0.135	39%	0.388	C	S	.	.	H	α-helix	trans	-61.2	-43.9	177.3	-56	0	0	0	0	111.3	M606 E607 R612 Y613 E614 L622 W624	M606-T610 WeakPolarHBondContact O-CB 3.47Å; M606-T610 PolarHBondContact O-N 2.84Å; M606-T610 PolarHBondContact O-OG1 2.81Å; E607-T610 WeakPolarHBondContact O-CB 3.24Å; E607-T610 PolarHBondContact O-N 3.35Å; E607-T610 VanDerWaalsContact O-N 3.14Å; T610-R612 PolarHBondContact O-N 3.4Å; T610-Y613 WeakPolarHBondContact O-CB 3.4Å; T610-Y613 PolarHBondContact O-N 3.11Å; T610-E614 WeakPolarHBondContact O-CG 3.45Å; T610-E614 PolarHBondContact O-N 3.21Å; T610-L622 HydrophobicContact CG2-CB 4.24Å; T610-W624 PolarHBondContact OG1-NE1 3.49Å
611	H	88.6	Confident	87.7	Confident	127 Å²	127	76.4 Å²	76.4	59%	0.588	39%	0.392	S	S	*	.	H	α-helix	trans	-63.4	-41.7	176.4	-179.3	-85.5	0	0	0	112.5	E607 A608 Y609 Y613 E614 K615	E607-H611 PolarHBondContact O-N 2.97Å; A608-H611 PolarHBondContact O-N 3.1Å; Y609-H611 PolarHBondContact O-N 3.48Å; H611-Y613 VanDerWaalsContact C-N 3.33Å; H611-E614 PolarHBondContact O-N 3.38Å; H611-K615 PolarHBondContact O-N 3.3Å; H611-K615 VanDerWaalsContact O-N 3.14Å
612	R	88.1	Confident	87.9	Confident	34 Å²	34	74.5 Å²	74.5	13%	0.128	38%	0.382	C	S	.	.	H	α-helix	trans	-63.7	-39.8	174.3	-71	-179.8	-178.7	135	2.6	111.6	I561 E565 A608 Y609 T610 K615 L616	I561-R612 HydrophobicContact CG2-CB 4.33Å; E565-R612 VanDerWaalsContact CG-CZ 3.42Å; E565-R612 IonicContact OE1-CZ 2.63Å; E565-R612 IonicContact OE1-NH1 3.97Å; E565-R612 PolarHBondContact OE1-NH1 3.47Å; A608-R612 WeakPolarHBondContact O-CG 3.34Å; A608-R612 PolarHBondContact O-N 3.38Å; A608-R612 VanDerWaalsContact O-N 3.11Å; Y609-R612 PolarHBondContact O-N 3.3Å; T610-R612 PolarHBondContact O-N 3.4Å; R612-K615 PolarHBondContact O-N 3.17Å; R612-L616 PolarHBondContact O-N 2.83Å; R612-L616 VanDerWaalsContact O-N 3.09Å
613	Y	89.8	Confident	88	Confident	13 Å²	13	78.3 Å²	78.3	5%	0.051	41%	0.407	C	S	.	.	H	α-helix	trans	-64.1	-44.6	176.2	-179.9	-99.9	0	0	0	112.4	I557 I582 Y609 T610 H611 K615 L616 K617 R620 L622	I557-Y613 HydrophobicContact CD1-CE2 4.25Å; I557-Y613 HydrophobicContact CG2-CD2 3.97Å; I557-Y613 HydrophobicContact CG2-CE2 4.2Å; I582-Y613 HydrophobicContact CD1-CD2 3.93Å; I582-Y613 HydrophobicContact CD1-CE2 3.77Å; I582-Y613 HydrophobicContact CG2-CE2 4.46Å; Y609-Y613 WeakPolarHBondContact O-CB 3.37Å; Y609-Y613 PolarHBondContact O-N 3.44Å; T610-Y613 WeakPolarHBondContact O-CB 3.4Å; T610-Y613 PolarHBondContact O-N 3.11Å; H611-Y613 VanDerWaalsContact C-N 3.33Å; Y613-K615 VanDerWaalsContact C-N 3.29Å; Y613-K615 PolarHBondContact O-N 3.36Å; Y613-L616 PolarHBondContact O-N 3.09Å; Y613-L616 VanDerWaalsContact O-N 3.09Å; Y613-K617 HydrophobicContact CE1-CB 4.33Å; Y613-K617 HydrophobicContact CE2-CB 4.31Å; Y613-K617 HydrophobicContact CE2-CG 4.06Å; Y613-K617 PolarHBondContact O-N 3.21Å; Y613-R620 HydrophobicContact CE1-CB 3.96Å; Y613-L622 HydrophobicContact CD1-CD1 4.05Å; Y613-L622 HydrophobicContact CD1-CD2 3.71Å; Y613-L622 HydrophobicContact CD1-CG 3.61Å; Y613-L622 HydrophobicContact CD2-CD2 4.49Å; Y613-L622 HydrophobicContact CE1-CD2 3.62Å; Y613-L622 HydrophobicContact CE1-CG 4.02Å; Y613-L622 HydrophobicContact CE2-CD2 4.44Å; Y613-L622 HydrophobicContact CG-CD1 3.95Å; Y613-L622 HydrophobicContact CG-CD2 4.14Å; Y613-L622 HydrophobicContact CG-CG 4.03Å
614	E	91.1	Very high	88	Confident	77 Å²	77	80.1 Å²	80.1	36%	0.36	41%	0.408	S	S	.	.	H	α-helix	trans	-60.8	-37.1	176.7	-76.1	172.7	-176.5	0	0	112.5	T610 H611 K617 A618 R620 T621	T610-E614 WeakPolarHBondContact O-CG 3.45Å; T610-E614 PolarHBondContact O-N 3.21Å; H611-E614 PolarHBondContact O-N 3.38Å; E614-K617 CarbonylContact O-C 3.43Å; E614-K617 VanDerWaalsContact O-C 3.31Å; E614-A618 PolarHBondContact O-N 3.27Å; E614-R620 WeakPolarHBondContact CG-O 3.13Å; E614-T621 HydrophobicContact CG-CG2 4.45Å; E614-T621 VanDerWaalsContact OE1-CG2 3.32Å; E614-T621 WeakPolarHBondContact OE1-CG2 3.42Å
615	K	88.5	Confident	88	Confident	146 Å²	146	77.3 Å²	77.3	64%	0.635	39%	0.394	S	S	*	.	H	α-helix	trans	-65	-39.6	173.4	-175.9	-175.7	175	-169.8	0	112	E564 H611 R612 Y613	E564-K615 IonicContact OE1-NZ 3.6Å; E564-K615 PolarHBondContact OE1-NZ 3.06Å; H611-K615 PolarHBondContact O-N 3.3Å; H611-K615 VanDerWaalsContact O-N 3.14Å; R612-K615 PolarHBondContact O-N 3.17Å; Y613-K615 VanDerWaalsContact C-N 3.29Å; Y613-K615 PolarHBondContact O-N 3.36Å
616	L	88.3	Confident	87.8	Confident	75 Å²	75	78.2 Å²	78.2	39%	0.393	40%	0.398	S	S	.	.	H	α-helix	trans	-75.7	-37.6	179.1	-174	69.9	0	0	0	112.5	I557 N560 R612 Y613	I557-L616 HydrophobicContact CB-CD2 4.44Å; I557-L616 HydrophobicContact CG1-CD2 4.28Å; I557-L616 HydrophobicContact CG2-CD2 3.89Å; N560-L616 HydrophobicContact CB-CD2 4.39Å; R612-L616 PolarHBondContact O-N 2.83Å; R612-L616 VanDerWaalsContact O-N 3.09Å; Y613-L616 PolarHBondContact O-N 3.09Å; Y613-L616 VanDerWaalsContact O-N 3.09Å
617	K	87.1	Confident	87.4	Confident	90 Å²	90	78.5 Å²	78.5	39%	0.391	40%	0.4	S	S	.	.	S	Bend	trans	-127.9	90.5	-176.7	-70.9	-67.9	-172.2	177.6	0	110	Y613 E614 R620	Y613-K617 HydrophobicContact CE1-CB 4.33Å; Y613-K617 HydrophobicContact CE2-CB 4.31Å; Y613-K617 HydrophobicContact CE2-CG 4.06Å; Y613-K617 PolarHBondContact O-N 3.21Å; E614-K617 CarbonylContact O-C 3.43Å; E614-K617 VanDerWaalsContact O-C 3.31Å; K617-R620 PolarHBondContact O-N 3.06Å
618	A	84.7	Confident	87.1	Confident	81 Å²	81	73.2 Å²	73.2	67%	0.669	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	142.8	179.3	0	0	0	0	0	112.7	E614 R620	E614-A618 PolarHBondContact O-N 3.27Å; A618-R620 VanDerWaalsContact C-N 3.3Å; A618-R620 PolarHBondContact O-N 3.15Å
619	M	82.8	Confident	86.8	Confident	200 Å²	200	72.5 Å²	72.5	99%	0.985	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	28.7	178.8	-52.2	-163.8	-177.5	0	0	115.1
620	R	85.7	Confident	86.5	Confident	150 Å²	150	75.9 Å²	75.9	57%	0.566	39%	0.389	S	S	*	.			trans	-132.5	133.3	172.5	-61.1	-174.9	-179.1	-166.6	-5.3	109.8	Y613 E614 K617 A618	Y613-R620 HydrophobicContact CE1-CB 3.96Å; E614-R620 WeakPolarHBondContact CG-O 3.13Å; K617-R620 PolarHBondContact O-N 3.06Å; A618-R620 VanDerWaalsContact C-N 3.3Å; A618-R620 PolarHBondContact O-N 3.15Å
621	T	87.1	Confident	86.3	Confident	111 Å²	111	77.2 Å²	77.2	68%	0.681	40%	0.398	S	S	*	.			trans	-116.7	159.1	175.1	62.6	0	0	0	0	109.7	E614	E614-T621 HydrophobicContact CG-CG2 4.45Å; E614-T621 VanDerWaalsContact OE1-CG2 3.32Å; E614-T621 WeakPolarHBondContact OE1-CG2 3.42Å
622	L	88.4	Confident	86.3	Confident	37 Å²	37	75.9 Å²	75.9	19%	0.194	40%	0.399	C	S	.	.			trans	-97.3	133.7	-179.4	-64.9	175.5	0	0	0	110.8	I582 Y609 T610 Y613 W624	I582-L622 HydrophobicContact CG2-CD2 4.39Å; Y609-L622 HydrophobicContact CD1-CD1 3.77Å; Y609-L622 HydrophobicContact CE1-CD1 3.89Å; T610-L622 HydrophobicContact CG2-CB 4.24Å; Y613-L622 HydrophobicContact CD1-CD1 4.05Å; Y613-L622 HydrophobicContact CD1-CD2 3.71Å; Y613-L622 HydrophobicContact CD1-CG 3.61Å; Y613-L622 HydrophobicContact CD2-CD2 4.49Å; Y613-L622 HydrophobicContact CE1-CD2 3.62Å; Y613-L622 HydrophobicContact CE1-CG 4.02Å; Y613-L622 HydrophobicContact CE2-CD2 4.44Å; Y613-L622 HydrophobicContact CG-CD1 3.95Å; Y613-L622 HydrophobicContact CG-CD2 4.14Å; Y613-L622 HydrophobicContact CG-CG 4.03Å; L622-W624 HydrophobicContact CD1-CZ2 3.98Å
623	S	87.6	Confident	86.3	Confident	107 Å²	107	75.6 Å²	75.6	75%	0.748	40%	0.4	S	S	*	.			trans	-104.5	117.2	165.4	-177.3	0	0	0	0	108.1
624	W	87.4	Confident	86.2	Confident	77 Å²	77	79.9 Å²	79.9	29%	0.292	42%	0.423	S	S	.	.			trans	-87.1	142.2	-175	-66.3	93.1	0	0	0	111.5	L578 A580 M606 Y609 T610 L622 P626	L578-W624 HydrophobicContact CD2-CH2 3.68Å; L578-W624 HydrophobicContact CD2-CZ2 4.38Å; L578-W624 HydrophobicContact CD2-CZ3 4.33Å; A580-W624 HydrophobicContact CB-CH2 3.74Å; A580-W624 HydrophobicContact CB-CZ3 3.81Å; M606-W624 HydrophobicContact CB-CD2 4.33Å; M606-W624 HydrophobicContact CB-CH2 4.42Å; M606-W624 HydrophobicContact CB-CZ2 3.91Å; M606-W624 HydrophobicContact CE-CB 3.4Å; M606-W624 HydrophobicContact CE-CD2 3.23Å; M606-W624 HydrophobicContact CE-CE3 3.36Å; M606-W624 HydrophobicContact CE-CG 3.27Å; M606-W624 HydrophobicContact CE-CZ3 4.17Å; M606-W624 HydrophobicContact CG-CD2 4.27Å; M606-W624 HydrophobicContact CG-CE3 4.32Å; M606-W624 HydrophobicContact CG-CH2 4.18Å; M606-W624 HydrophobicContact CG-CZ2 4.15Å; M606-W624 HydrophobicContact CG-CZ3 4.26Å; Y609-W624 AromaticContact CD1-CH2 3.8Å; Y609-W624 HydrophobicContact CD1-CH2 3.8Å; Y609-W624 AromaticContact CD1-CZ2 3.86Å; Y609-W624 HydrophobicContact CD1-CZ2 3.86Å; Y609-W624 HydrophobicContact CE1-CH2 4.4Å; Y609-W624 HydrophobicContact CG-CH2 4.23Å; Y609-W624 HydrophobicContact CG-CZ2 4.38Å; T610-W624 PolarHBondContact OG1-NE1 3.49Å; L622-W624 HydrophobicContact CD1-CZ2 3.98Å; W624-P626 WeakPolarHBondContact O-CD 3.43Å
625	K	87.2	Confident	86	Confident	66 Å²	66	77 Å²	77	29%	0.287	41%	0.411	S	S	.	.			trans	-118.4	82.3	172.8	-64.4	-66.1	-175.6	175.6	0	109.1	E593 H627 L628	E593-K625 VanDerWaalsContact CG-NZ 3.32Å; E593-K625 IonicContact OE1-NZ 2.71Å; E593-K625 PolarHBondContact OE1-NZ 3.03Å; K625-H627 VanDerWaalsContact C-N 3.34Å; K625-H627 PolarHBondContact O-N 3.46Å; K625-L628 HydrophobicContact CB-CD1 4.37Å; K625-L628 PolarHBondContact O-N 3.2Å
626	P	83	Confident	86	Confident	28 Å²	28	77.8 Å²	77.8	18%	0.182	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-68.6	-30.1	-166.4	-19.7	32.4	0	0	0	113.9	L598 M606 W624 L628 G629 P649	L598-P626 HydrophobicContact CD1-CB 3.86Å; L598-P626 HydrophobicContact CD1-CG 3.72Å; L598-P626 HydrophobicContact CD2-CB 3.83Å; L598-P626 HydrophobicContact CD2-CG 4.47Å; L598-P626 HydrophobicContact CG-CB 4.14Å; L598-P626 HydrophobicContact CG-CG 4.24Å; M606-P626 HydrophobicContact CE-CG 4.45Å; W624-P626 WeakPolarHBondContact O-CD 3.43Å; P626-L628 PolarHBondContact O-N 3.26Å; P626-G629 PolarHBondContact O-N 3.19Å; P626-G629 VanDerWaalsContact O-N 3.14Å; P626-P649 WeakPolarHBondContact O-CG 3.5Å
627	H	81.4	Confident	85.8	Confident	30 Å²	30	75.2 Å²	75.2	14%	0.139	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-63.8	-22.9	-178.8	58.3	-83.9	0	0	0	113.7	K592 E594 K625	K592-H627 PolarHBondContact O-CE1 2.86Å; K592-H627 PolarHBondContact O-NE2 2.93Å; E594-H627 HydrophobicContact CB-CB 4.1Å; E594-H627 WeakPolarHBondContact OE2-CB 3.47Å; E594-H627 IonicContact OE2-CG 2.87Å; K625-H627 VanDerWaalsContact C-N 3.34Å; K625-H627 PolarHBondContact O-N 3.46Å
628	L	82.1	Confident	85.5	Confident	25 Å²	25	78.5 Å²	78.5	13%	0.131	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-89.7	2.9	178	-58	178.7	0	0	0	114	L515 L591 K625 P626 N729	L515-L628 HydrophobicContact CD1-CD1 4.4Å; L591-L628 HydrophobicContact CB-CD1 4.21Å; L591-L628 HydrophobicContact CD1-CD1 3.91Å; L591-L628 HydrophobicContact CD2-CD1 4.23Å; L591-L628 HydrophobicContact CG-CD1 4.34Å; K625-L628 HydrophobicContact CB-CD1 4.37Å; K625-L628 PolarHBondContact O-N 3.2Å; P626-L628 PolarHBondContact O-N 3.26Å; L628-N729 HydrophobicContact CD2-CB 3.69Å
629	G	82.6	Confident	85.3	Confident	23 Å²	23	78.5 Å²	78.5	24%	0.237	41%	0.409	C	S	.	.			trans	-74.6	171.2	-178.5	0	0	0	0	0	113.2	P626 P649	P626-G629 PolarHBondContact O-N 3.19Å; P626-G629 VanDerWaalsContact O-N 3.14Å; G629-P649 WeakPolarHBondContact O-CD 3.31Å
630	L	85.1	Confident	85.2	Confident	74 Å²	74	71.7 Å²	71.7	39%	0.387	37%	0.372	S	S	.	.			trans	-127.9	134.4	165.2	-70.7	171.4	0	0	0	108.3	F518 T646 M718	F518-L630 HydrophobicContact CD2-CB 4.43Å; F518-L630 HydrophobicContact CD2-CD1 3.43Å; F518-L630 VanDerWaalsContact CD2-CD1 3.43Å; F518-L630 HydrophobicContact CD2-CG 4.15Å; F518-L630 HydrophobicContact CE2-CB 4.09Å; F518-L630 HydrophobicContact CE2-CD1 3.54Å; F518-L630 HydrophobicContact CE2-CG 3.75Å; L630-T646 HydrophobicContact CB-CG2 4.45Å; L630-T646 HydrophobicContact CD2-CG2 4.14Å; L630-M718 HydrophobicContact CD1-CE 4.03Å; L630-M718 HydrophobicContact CD2-CE 4.45Å
631	V	86.6	Confident	85	Confident	51 Å²	51	68.7 Å²	68.7	31%	0.309	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	128.1	177.8	-175.5	0	0	0	0	108.6	T646 V647 P649 A652	V631-T646 WeakPolarHBondContact O-CA 3.31Å; V631-V647 PolarHBondContact N-O 2.88Å; V631-V647 PolarHBondContact O-N 3.29Å; V631-P649 HydrophobicContact CG2-CB 4.18Å; V631-P649 HydrophobicContact CG2-CG 3.87Å; V631-A652 HydrophobicContact CB-CB 4.02Å; V631-A652 HydrophobicContact CG1-CB 3.97Å; V631-A652 HydrophobicContact CG2-CB 4.19Å
632	T	87.8	Confident	84.7	Confident	99 Å²	99	64.1 Å²	64.1	61%	0.607	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	121.4	168.3	52.3	0	0	0	0	108.7	L645	T632-L645 CarbonylContact C-O 3.59Å; T632-L645 WeakPolarHBondContact CA-O 3.3Å
633	L	87.6	Confident	84.4	Confident	28 Å²	28	65.8 Å²	65.8	15%	0.147	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	149.3	-178.4	55.6	86.7	0	0	0	111.8	V635 L645 V647 A652 W687	L633-V635 HydrophobicContact CD1-CG2 3.32Å; L633-L645 HydrophobicContact CD1-CB 3.64Å; L633-L645 HydrophobicContact CD1-CD1 3.79Å; L633-L645 HydrophobicContact CD1-CG 4.24Å; L633-L645 HydrophobicContact CG-CB 4.17Å; L633-L645 PolarHBondContact N-O 3.39Å; L633-L645 PolarHBondContact O-N 3.45Å; L633-V647 HydrophobicContact CD2-CG2 3.32Å; L633-V647 HydrophobicContact CG-CG2 4.1Å; L633-A652 HydrophobicContact CD2-CB 3.75Å; L633-W687 HydrophobicContact CD1-CH2 3.89Å; L633-W687 HydrophobicContact CD2-CH2 4.45Å; L633-W687 HydrophobicContact CD2-CZ2 4.43Å
634	D	88.1	Confident	83.9	Confident	103 Å²	103	65.8 Å²	65.8	55%	0.551	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.6	118.6	171.1	-68.2	-29.4	0	0	0	107.4	L642 T643 N644	D634-L642 CarbonylContact C-O 3.59Å; D634-L642 WeakPolarHBondContact CA-O 3.27Å; D634-T643 WeakPolarHBondContact OD1-CA 3.18Å; D634-N644 PolarHBondContact OD1-N 3.33Å
635	V	86.6	Confident	83.6	Confident	17 Å²	17	63.1 Å²	63.1	10%	0.103	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	114.5	178.6	-172.3	0	0	0	0	108.9	L633 L637 T641 L642 L645 I655	L633-V635 HydrophobicContact CD1-CG2 3.32Å; V635-L637 HydrophobicContact CG1-CD2 4.13Å; V635-L637 HydrophobicContact CG1-CG 4.14Å; V635-T641 CarbonylContact O-C 3.48Å; V635-T641 WeakPolarHBondContact O-CA 3.39Å; V635-L642 HydrophobicContact CB-CB 4.32Å; V635-L642 PolarHBondContact N-O 2.9Å; V635-L642 PolarHBondContact O-N 3.38Å; V635-L645 HydrophobicContact CG2-CD1 4.15Å; V635-I655 HydrophobicContact CG2-CG2 4.39Å
636	E	88.1	Confident	83.4	Confident	162 Å²	162	61.6 Å²	61.6	76%	0.757	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	112.4	174	-57.5	-170.9	160.5	0	0	109.4	T641	E636-T641 HydrophobicContact CB-CG2 4.22Å; E636-T641 HydrophobicContact CG-CG2 3.92Å
637	L	84.9	Confident	83.6	Confident	21 Å²	21	60.3 Å²	60.3	11%	0.11	33%	0.325	C	S	.	.			trans	-105.8	168.2	172.1	-59.2	168.9	0	0	0	109.4	V635 D639 R640 V703	V635-L637 HydrophobicContact CG1-CD2 4.13Å; V635-L637 HydrophobicContact CG1-CG 4.14Å; L637-D639 VanDerWaalsContact C-N 3.26Å; L637-D639 PolarHBondContact O-N 3.5Å; L637-R640 HydrophobicContact CB-CG 4.37Å; L637-R640 WeakPolarHBondContact CB-O 3.48Å; L637-R640 HydrophobicContact CD1-CG 4.05Å; L637-R640 PolarHBondContact N-O 3.07Å; L637-V703 HydrophobicContact CD2-CG1 4.28Å
638	E	81.7	Confident	83.8	Confident	158 Å²	158	59.5 Å²	59.5	74%	0.738	32%	0.322	S	S	*	.	S	Bend	trans	-56.3	-35.3	-179	-70.5	-174	168.1	0	0	114.2	E705	E638-E705 HydrophobicContact CB-CB 4.14Å; E638-E705 HydrophobicContact CG-CB 3.92Å; E638-E705 HydrophobicContact CG-CG 4.24Å; E638-E705 PolarHBondContact N-OE2 2.88Å
639	D	80.1	Confident	84	Confident	81 Å²	81	59.1 Å²	59.1	43%	0.433	32%	0.321	S	S	.	.	S	Bend	trans	-105	-21.4	-175.4	73.5	-19.3	0	0	0	115.1	L637 E705 T706 G707	L637-D639 VanDerWaalsContact C-N 3.26Å; L637-D639 PolarHBondContact O-N 3.5Å; D639-E705 VanDerWaalsContact OD1-O 3.12Å; D639-T706 HydrophobicContact CB-CG2 4.27Å; D639-G707 PolarHBondContact OD2-N 3.46Å
640	R	81.3	Confident	84.3	Confident	58 Å²	58	58.5 Å²	58.5	22%	0.219	31%	0.312	C	S	.	.			trans	-150.5	147.1	-171.8	70.3	-162.3	172.4	149.2	0.9	112.6	L637 L642 Q690 G691	L637-R640 HydrophobicContact CB-CG 4.37Å; L637-R640 WeakPolarHBondContact CB-O 3.48Å; L637-R640 HydrophobicContact CD1-CG 4.05Å; L637-R640 PolarHBondContact N-O 3.07Å; R640-L642 HydrophobicContact CG-CD2 4.43Å; R640-Q690 PolarHBondContact NH2-O 3.36Å; R640-G691 PolarHBondContact NH2-O 2.84Å
641	T	81.6	Confident	84.4	Confident	86 Å²	86	55.1 Å²	55.1	53%	0.528	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	118.8	168.1	55.7	0	0	0	0	109.2	V635 E636	V635-T641 CarbonylContact O-C 3.48Å; V635-T641 WeakPolarHBondContact O-CA 3.39Å; E636-T641 HydrophobicContact CB-CG2 4.22Å; E636-T641 HydrophobicContact CG-CG2 3.92Å
642	L	80.8	Confident	84.5	Confident	15 Å²	15	53 Å²	53	8%	0.079	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	100.4	173.5	-57.6	177	0	0	0	107.7	D634 V635 R640 L645 V692 P713	D634-L642 CarbonylContact C-O 3.59Å; D634-L642 WeakPolarHBondContact CA-O 3.27Å; V635-L642 HydrophobicContact CB-CB 4.32Å; V635-L642 PolarHBondContact N-O 2.9Å; V635-L642 PolarHBondContact O-N 3.38Å; R640-L642 HydrophobicContact CG-CD2 4.43Å; L642-L645 HydrophobicContact CB-CD1 3.72Å; L642-L645 HydrophobicContact CB-CD2 4.42Å; L642-L645 HydrophobicContact CB-CG 4.08Å; L642-L645 HydrophobicContact CD1-CD1 4.07Å; L642-V692 HydrophobicContact CD1-CG2 3.86Å; L642-P713 HydrophobicContact CD2-CG 4.27Å
643	T	80.1	Confident	84.6	Confident	72 Å²	72	48.4 Å²	48.4	44%	0.442	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	144.8	-176	59.8	0	0	0	0	112.5	D634	D634-T643 WeakPolarHBondContact OD1-CA 3.18Å
644	N	77.3	Confident	84.8	Confident	108 Å²	108	47 Å²	47	58%	0.578	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	57.3	44.2	176.3	-63.5	-71.5	0	0	0	113.8	D634 T646	D634-N644 PolarHBondContact OD1-N 3.33Å; N644-T646 PolarHBondContact O-N 3.12Å
645	L	82.3	Confident	84.8	Confident	21 Å²	21	43.3 Å²	43.3	11%	0.11	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	114.2	171.5	-64	-176.9	0	0	0	109.3	T632 L633 V635 L642 W687 L719	T632-L645 CarbonylContact C-O 3.59Å; T632-L645 WeakPolarHBondContact CA-O 3.3Å; L633-L645 HydrophobicContact CD1-CB 3.64Å; L633-L645 HydrophobicContact CD1-CD1 3.79Å; L633-L645 HydrophobicContact CD1-CG 4.24Å; L633-L645 HydrophobicContact CG-CB 4.17Å; L633-L645 PolarHBondContact N-O 3.39Å; L633-L645 PolarHBondContact O-N 3.45Å; V635-L645 HydrophobicContact CG2-CD1 4.15Å; L642-L645 HydrophobicContact CB-CD1 3.72Å; L642-L645 HydrophobicContact CB-CD2 4.42Å; L642-L645 HydrophobicContact CB-CG 4.08Å; L642-L645 HydrophobicContact CD1-CD1 4.07Å; L645-W687 HydrophobicContact CD1-CH2 4.04Å; L645-W687 HydrophobicContact CD1-CZ3 3.96Å; L645-L719 HydrophobicContact CB-CD1 4.27Å; L645-L719 HydrophobicContact CD1-CD1 4.4Å; L645-L719 HydrophobicContact CD2-CD1 3.93Å; L645-L719 HydrophobicContact CG-CD1 4.43Å
646	T	83.3	Confident	84.9	Confident	33 Å²	33	45.4 Å²	45.4	20%	0.202	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	114.4	172.3	-53.7	0	0	0	0	108.7	L630 V631 N644 M718 L719	L630-T646 HydrophobicContact CB-CG2 4.45Å; L630-T646 HydrophobicContact CD2-CG2 4.14Å; V631-T646 WeakPolarHBondContact O-CA 3.31Å; N644-T646 PolarHBondContact O-N 3.12Å; T646-M718 HydrophobicContact CG2-CE 4.18Å; T646-M718 HydrophobicContact CG2-CG 4.2Å; T646-L719 PolarHBondContact O-N 2.93Å
647	V	85.7	Confident	85	Confident	2 Å²	2	39 Å²	39	1%	0.012	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	164.7	-179.7	-58.1	0	0	0	0	111.2	V631 L633 H651 A652 W687 L719	V631-V647 PolarHBondContact N-O 2.88Å; V631-V647 PolarHBondContact O-N 3.29Å; L633-V647 HydrophobicContact CD2-CG2 3.32Å; L633-V647 HydrophobicContact CG-CG2 4.1Å; V647-H651 HydrophobicContact CB-CB 3.8Å; V647-H651 HydrophobicContact CG1-CB 4.46Å; V647-H651 HydrophobicContact CG2-CB 3.9Å; V647-A652 HydrophobicContact CG2-CB 4.12Å; V647-W687 HydrophobicContact CG1-CH2 4.26Å; V647-W687 HydrophobicContact CG1-CZ2 4.15Å; V647-L719 HydrophobicContact CG1-CB 4.21Å; V647-L719 HydrophobicContact CG1-CD1 3.64Å
648	S	86.2	Confident	85.2	Confident	13 Å²	13	38.6 Å²	38.6	9%	0.091	21%	0.205	C	C	.	.			trans	-73.2	156.5	171.5	65.9	0	0	0	0	112.1	I650 H651 A652	S648-I650 PolarHBondContact O-N 2.87Å; S648-I650 VanDerWaalsContact O-N 3.13Å; S648-I650 WeakPolarHBondContact OG-CG2 3.46Å; S648-H651 WeakPolarHBondContact O-CB 3.45Å; S648-H651 PolarHBondContact O-N 3.46Å; S648-H651 PolarHBondContact OG-CE1 3.35Å; S648-H651 PolarHBondContact OG-ND1 3.5Å; S648-A652 PolarHBondContact O-N 3.46Å
649	P	87.6	Confident	85.5	Confident	16 Å²	16	38.4 Å²	38.4	10%	0.104	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-28.1	-173.3	-31.6	40.8	0	0	0	114.3	P626 G629 V631 A652 A653	P626-P649 WeakPolarHBondContact O-CG 3.5Å; G629-P649 WeakPolarHBondContact O-CD 3.31Å; V631-P649 HydrophobicContact CG2-CB 4.18Å; V631-P649 HydrophobicContact CG2-CG 3.87Å; P649-A652 PolarHBondContact O-N 3.38Å; P649-A653 WeakPolarHBondContact O-CB 3.36Å; P649-A653 PolarHBondContact O-N 3.16Å
650	I	87.9	Confident	85.8	Confident	10 Å²	10	41.2 Å²	41.2	5%	0.051	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-41.8	173.7	-165.7	163.7	0	0	0	111.9	M596 S648 A652 A653 I654 V675 M679 K683	M596-I650 HydrophobicContact CE-CB 4.21Å; M596-I650 HydrophobicContact CE-CG1 4.31Å; M596-I650 HydrophobicContact SD-CB 3.97Å; M596-I650 HydrophobicContact SD-CG1 4.23Å; S648-I650 PolarHBondContact O-N 2.87Å; S648-I650 VanDerWaalsContact O-N 3.13Å; S648-I650 WeakPolarHBondContact OG-CG2 3.46Å; I650-A652 VanDerWaalsContact C-N 3.34Å; I650-A652 PolarHBondContact O-N 3.36Å; I650-A653 PolarHBondContact O-N 2.99Å; I650-I654 HydrophobicContact CG1-CD1 4.44Å; I650-I654 VanDerWaalsContact O-CG1 3.23Å; I650-I654 WeakPolarHBondContact O-CG1 3.25Å; I650-I654 PolarHBondContact O-N 3.37Å; I650-V675 HydrophobicContact CD1-CB 4.5Å; I650-V675 HydrophobicContact CD1-CG1 4.05Å; I650-V675 HydrophobicContact CD1-CG2 4.07Å; I650-M679 HydrophobicContact CD1-CE 4.11Å; I650-M679 HydrophobicContact CD1-SD 4.45Å; I650-K683 HydrophobicContact CD1-CG 4.28Å; I650-K683 HydrophobicContact CG2-CD 3.82Å; I650-K683 HydrophobicContact CG2-CG 3.94Å
651	H	88.1	Confident	86.2	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.014	23%	0.225	C	C	.	.	H	α-helix	trans	-65.1	-39.6	175.7	-67.5	107.7	0	0	0	111.5	V647 S648 I655 K683 W687	V647-H651 HydrophobicContact CB-CB 3.8Å; V647-H651 HydrophobicContact CG1-CB 4.46Å; V647-H651 HydrophobicContact CG2-CB 3.9Å; S648-H651 WeakPolarHBondContact O-CB 3.45Å; S648-H651 PolarHBondContact O-N 3.46Å; S648-H651 PolarHBondContact OG-CE1 3.35Å; S648-H651 PolarHBondContact OG-ND1 3.5Å; H651-I655 PolarHBondContact O-N 3.07Å; H651-K683 PolarHBondContact CD2-O 3.42Å; H651-K683 VanDerWaalsContact CD2-O 3.23Å; H651-K683 WeakPolarHBondContact CE1-CD 3.42Å; H651-K683 WeakPolarHBondContact NE2-CD 3.42Å; H651-K683 PolarHBondContact NE2-O 3.04Å; H651-W687 HydrophobicContact CB-CZ2 4.18Å; H651-W687 AromaticContact CD2-NE1 3.91Å; H651-W687 PolarHBondContact O-NE1 3.03Å; H651-W687 VanDerWaalsContact O-NE1 3.12Å
652	A	88.8	Confident	86.4	Confident	8 Å²	8	42 Å²	42	7%	0.066	23%	0.227	C	C	.	.	H	α-helix	trans	-65.4	-44.1	176.3	0	0	0	0	0	112	V631 L633 V647 S648 P649 I650 I654 I655 L656	V631-A652 HydrophobicContact CB-CB 4.02Å; V631-A652 HydrophobicContact CG1-CB 3.97Å; V631-A652 HydrophobicContact CG2-CB 4.19Å; L633-A652 HydrophobicContact CD2-CB 3.75Å; V647-A652 HydrophobicContact CG2-CB 4.12Å; S648-A652 PolarHBondContact O-N 3.46Å; P649-A652 PolarHBondContact O-N 3.38Å; I650-A652 VanDerWaalsContact C-N 3.34Å; I650-A652 PolarHBondContact O-N 3.36Å; A652-I654 VanDerWaalsContact C-N 3.35Å; A652-I654 PolarHBondContact O-N 3.44Å; A652-I655 PolarHBondContact O-N 2.84Å; A652-L656 WeakPolarHBondContact O-CG 3.47Å; A652-L656 PolarHBondContact O-N 3.35Å
653	A	89.8	Confident	86.7	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.008	24%	0.24	C	C	.	.	H	α-helix	trans	-62.8	-40.6	178.2	0	0	0	0	0	112.4	M596 P599 P649 I650 I655 L656 H657 L673	M596-A653 HydrophobicContact CE-CB 3.21Å; P599-A653 HydrophobicContact CG-CB 3.67Å; P649-A653 WeakPolarHBondContact O-CB 3.36Å; P649-A653 PolarHBondContact O-N 3.16Å; I650-A653 PolarHBondContact O-N 2.99Å; A653-I655 PolarHBondContact O-N 3.24Å; A653-L656 PolarHBondContact O-N 2.89Å; A653-H657 PolarHBondContact O-CD2 2.86Å; A653-H657 PolarHBondContact O-N 3.31Å; A653-H657 VanDerWaalsContact O-N 3.09Å; A653-L673 HydrophobicContact CB-CD2 3.82Å
654	I	90	Very high	87.3	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-54.4	-54.4	174.4	-70.3	165.9	0	0	0	110	I650 A652 L656 H657 F658 L669 L673 K683 L684 L693	I650-I654 HydrophobicContact CG1-CD1 4.44Å; I650-I654 VanDerWaalsContact O-CG1 3.23Å; I650-I654 WeakPolarHBondContact O-CG1 3.25Å; I650-I654 PolarHBondContact O-N 3.37Å; A652-I654 VanDerWaalsContact C-N 3.35Å; A652-I654 PolarHBondContact O-N 3.44Å; I654-L656 PolarHBondContact O-N 3.46Å; I654-H657 PolarHBondContact O-N 2.97Å; I654-F658 HydrophobicContact CG2-CD2 3.93Å; I654-F658 HydrophobicContact CG2-CE2 3.81Å; I654-F658 VanDerWaalsContact O-CD2 3.25Å; I654-F658 WeakPolarHBondContact O-CD2 3.48Å; I654-F658 PolarHBondContact O-N 3.29Å; I654-L669 HydrophobicContact CG1-CD2 4.03Å; I654-L669 HydrophobicContact CG2-CD2 4.31Å; I654-L673 HydrophobicContact CD1-CD1 4.49Å; I654-L673 HydrophobicContact CG1-CD1 3.69Å; I654-K683 HydrophobicContact CD1-CB 3.9Å; I654-L684 HydrophobicContact CG2-CD2 3.72Å; I654-L693 HydrophobicContact CG2-CD1 4.42Å
655	I	89.4	Confident	88	Confident	24 Å²	24	37.9 Å²	37.9	12%	0.123	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-36.6	-177.2	-67.7	-57.7	0	0	0	112.6	V635 H651 A652 A653 H657 F658 Q659 W687 V692 L693	V635-I655 HydrophobicContact CG2-CG2 4.39Å; H651-I655 PolarHBondContact O-N 3.07Å; A652-I655 PolarHBondContact O-N 2.84Å; A653-I655 PolarHBondContact O-N 3.24Å; I655-H657 VanDerWaalsContact C-N 3.3Å; I655-H657 PolarHBondContact O-N 2.94Å; I655-F658 WeakPolarHBondContact O-CB 3.35Å; I655-F658 PolarHBondContact O-N 3.37Å; I655-F658 VanDerWaalsContact O-N 3.08Å; I655-Q659 PolarHBondContact O-N 3.43Å; I655-Q659 VanDerWaalsContact O-N 3.15Å; I655-W687 HydrophobicContact CB-CZ2 4.4Å; I655-W687 HydrophobicContact CD1-CB 4.5Å; I655-W687 HydrophobicContact CD1-CD2 3.61Å; I655-W687 HydrophobicContact CD1-CE3 3.98Å; I655-W687 HydrophobicContact CD1-CG 3.83Å; I655-W687 HydrophobicContact CD1-CZ2 4.3Å; I655-W687 HydrophobicContact CD1-CZ3 4.47Å; I655-W687 HydrophobicContact CG1-CD2 3.61Å; I655-W687 HydrophobicContact CG1-CE3 4.07Å; I655-W687 HydrophobicContact CG1-CG 4.17Å; I655-W687 HydrophobicContact CG1-CH2 3.84Å; I655-W687 HydrophobicContact CG1-CZ2 3.36Å; I655-W687 HydrophobicContact CG1-CZ3 4.17Å; I655-V692 HydrophobicContact CD1-CG1 3.9Å; I655-L693 HydrophobicContact CD1-CD1 4.36Å; I655-L693 HydrophobicContact CD1-CG 4.42Å
656	L	88.4	Confident	88.2	Confident	61 Å²	61	38.2 Å²	38.2	32%	0.319	21%	0.206	S	C	.	.	H	α-helix	trans	-60.8	-37.9	174.5	-74.9	165.9	0	0	0	112.1	P599 A652 A653 I654 F658 Q659	P599-L656 HydrophobicContact CB-CD1 3.99Å; P599-L656 HydrophobicContact CG-CB 4.47Å; P599-L656 HydrophobicContact CG-CD1 3.77Å; A652-L656 WeakPolarHBondContact O-CG 3.47Å; A652-L656 PolarHBondContact O-N 3.35Å; A653-L656 PolarHBondContact O-N 2.89Å; I654-L656 PolarHBondContact O-N 3.46Å; L656-F658 VanDerWaalsContact C-N 3.32Å; L656-F658 PolarHBondContact O-N 3.24Å; L656-Q659 VanDerWaalsContact O-CB 3.23Å; L656-Q659 WeakPolarHBondContact O-CB 3.32Å; L656-Q659 PolarHBondContact O-N 2.7Å
657	H	89.1	Confident	88.5	Confident	28 Å²	28	43.3 Å²	43.3	13%	0.13	23%	0.228	C	C	.	.	H	α-helix	trans	-69.6	-29	174	-72	-57.2	0	0	0	113.4	A653 I654 I655 Q659 D660 K661 W664 V672	A653-H657 PolarHBondContact O-CD2 2.86Å; A653-H657 PolarHBondContact O-N 3.31Å; A653-H657 VanDerWaalsContact O-N 3.09Å; I654-H657 PolarHBondContact O-N 2.97Å; I655-H657 VanDerWaalsContact C-N 3.3Å; I655-H657 PolarHBondContact O-N 2.94Å; H657-Q659 PolarHBondContact O-N 3.4Å; H657-D660 PolarHBondContact O-N 3.47Å; H657-K661 PolarHBondContact O-N 3.31Å; H657-W664 HydrophobicContact CB-CZ2 4.19Å; H657-W664 PolarHBondContact O-NE1 3.4Å; H657-V672 VanDerWaalsContact CE1-CG1 3.45Å; H657-V672 WeakPolarHBondContact CE1-CG1 3.49Å
658	F	89.8	Confident	88.7	Confident	12 Å²	12	47.1 Å²	47.1	5%	0.053	25%	0.245	C	C	.	.	H	α-helix	trans	-69.9	-21.2	172.7	-84.7	-78.3	0	0	0	113.1	I654 I655 L656 K661 W664 L669 L684 L693 Y701 V703	I654-F658 HydrophobicContact CG2-CD2 3.93Å; I654-F658 HydrophobicContact CG2-CE2 3.81Å; I654-F658 VanDerWaalsContact O-CD2 3.25Å; I654-F658 WeakPolarHBondContact O-CD2 3.48Å; I654-F658 PolarHBondContact O-N 3.29Å; I655-F658 WeakPolarHBondContact O-CB 3.35Å; I655-F658 PolarHBondContact O-N 3.37Å; I655-F658 VanDerWaalsContact O-N 3.08Å; L656-F658 VanDerWaalsContact C-N 3.32Å; L656-F658 PolarHBondContact O-N 3.24Å; F658-K661 CarbonylContact C-O 3.57Å; F658-K661 WeakPolarHBondContact CA-O 3.43Å; F658-K661 CarbonylContact O-C 3.59Å; F658-W664 AromaticContact CD1-CD1 3.65Å; F658-W664 HydrophobicContact CE1-CB 4.22Å; F658-W664 AromaticContact CE1-CD1 3.59Å; F658-W664 HydrophobicContact CE1-CG 4.29Å; F658-W664 HydrophobicContact CZ-CB 4.02Å; F658-W664 AromaticContact CZ-CD1 3.9Å; F658-W664 HydrophobicContact CZ-CG 4.3Å; F658-L669 HydrophobicContact CE2-CD1 4.02Å; F658-L669 HydrophobicContact CZ-CD1 4.47Å; F658-L684 HydrophobicContact CE2-CD2 4.25Å; F658-L693 HydrophobicContact CD1-CD2 3.86Å; F658-L693 HydrophobicContact CD2-CD1 4.14Å; F658-L693 HydrophobicContact CD2-CD2 3.95Å; F658-L693 HydrophobicContact CE1-CD2 3.8Å; F658-L693 HydrophobicContact CE2-CD1 3.68Å; F658-L693 HydrophobicContact CE2-CD2 3.94Å; F658-L693 HydrophobicContact CG-CD2 3.93Å; F658-L693 HydrophobicContact CZ-CD1 4.03Å; F658-L693 HydrophobicContact CZ-CD2 3.86Å; F658-Y701 WeakPolarHBondContact CE1-O 3.34Å; F658-V703 HydrophobicContact CB-CG2 3.79Å; F658-V703 HydrophobicContact CD1-CG2 3.48Å; F658-V703 VanDerWaalsContact CD1-CG2 3.48Å; F658-V703 HydrophobicContact CE1-CG2 4.39Å; F658-V703 HydrophobicContact CG-CG2 3.97Å
659	Q	87.8	Confident	88.8	Confident	155 Å²	155	46.7 Å²	46.7	72%	0.724	24%	0.242	S	C	*	.	H	α-helix	trans	-66.8	-37.5	172.5	-171.9	178	-14	0	0	112	I655 L656 H657	I655-Q659 PolarHBondContact O-N 3.43Å; I655-Q659 VanDerWaalsContact O-N 3.15Å; L656-Q659 VanDerWaalsContact O-CB 3.23Å; L656-Q659 WeakPolarHBondContact O-CB 3.32Å; L656-Q659 PolarHBondContact O-N 2.7Å; H657-Q659 PolarHBondContact O-N 3.4Å
660	D	87.4	Confident	88.9	Confident	139 Å²	139	46.8 Å²	46.8	74%	0.743	24%	0.243	S	C	*	.	H	α-helix	trans	-79.7	-36.5	179.5	-66.2	-34.2	0	0	0	112.5	H657	H657-D660 PolarHBondContact O-N 3.47Å
661	K	88.4	Confident	88.9	Confident	82 Å²	82	49 Å²	49	36%	0.357	27%	0.268	S	S	.	.			trans	-139.9	122.1	-178	-177	-167.5	-175.6	-167.2	0	110	H657 F658 S663 W664 E668	H657-K661 PolarHBondContact O-N 3.31Å; F658-K661 CarbonylContact C-O 3.57Å; F658-K661 WeakPolarHBondContact CA-O 3.43Å; F658-K661 CarbonylContact O-C 3.59Å; K661-S663 VanDerWaalsContact C-N 3.28Å; K661-S663 WeakPolarHBondContact CD-O 3.42Å; K661-S663 WeakPolarHBondContact CE-O 3.38Å; K661-S663 WeakPolarHBondContact CG-O 3.46Å; K661-S663 PolarHBondContact NZ-O 2.98Å; K661-S663 PolarHBondContact O-N 3.26Å; K661-W664 HydrophobicContact CB-CZ2 3.83Å; K661-W664 HydrophobicContact CD-CD2 4Å; K661-W664 HydrophobicContact CD-CE3 4.37Å; K661-W664 HydrophobicContact CD-CH2 4.28Å; K661-W664 HydrophobicContact CD-CZ2 3.89Å; K661-W664 HydrophobicContact CG-CZ2 4.48Å; K661-W664 VanDerWaalsContact O-CD1 3.25Å; K661-W664 PolarHBondContact O-NE1 3.24Å; K661-E668 IonicContact NZ-OE1 3.78Å; K661-E668 IonicContact NZ-OE2 2.71Å; K661-E668 PolarHBondContact NZ-OE2 3.04Å
662	S	86	Confident	88.9	Confident	80 Å²	80	51.2 Å²	51.2	56%	0.559	28%	0.282	S	S	*	.	S	Bend	trans	-71.7	-12.9	-173.5	59.1	0	0	0	0	115.7	S702 V703	S662-S702 WeakPolarHBondContact O-CA 3.17Å; S662-V703 PolarHBondContact O-N 2.6Å
663	S	88.5	Confident	88.7	Confident	51 Å²	51	50.9 Å²	50.9	36%	0.357	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	133.5	179.6	53.5	0	0	0	0	112.6	K661 Y701	K661-S663 VanDerWaalsContact C-N 3.28Å; K661-S663 WeakPolarHBondContact CD-O 3.42Å; K661-S663 WeakPolarHBondContact CE-O 3.38Å; K661-S663 WeakPolarHBondContact CG-O 3.46Å; K661-S663 PolarHBondContact NZ-O 2.98Å; K661-S663 PolarHBondContact O-N 3.26Å; S663-Y701 CarbonylContact C-O 3.6Å; S663-Y701 VanDerWaalsContact CA-O 3.24Å; S663-Y701 WeakPolarHBondContact CA-O 3.25Å
664	W	91.7	Very high	88.5	Confident	32 Å²	32	52.9 Å²	52.9	12%	0.121	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	148.4	-176.9	-72.5	91.4	0	0	0	111.3	H657 F658 K661 E668 L669 V672 Y701	H657-W664 HydrophobicContact CB-CZ2 4.19Å; H657-W664 PolarHBondContact O-NE1 3.4Å; F658-W664 AromaticContact CD1-CD1 3.65Å; F658-W664 HydrophobicContact CE1-CB 4.22Å; F658-W664 AromaticContact CE1-CD1 3.59Å; F658-W664 HydrophobicContact CE1-CG 4.29Å; F658-W664 HydrophobicContact CZ-CB 4.02Å; F658-W664 AromaticContact CZ-CD1 3.9Å; F658-W664 HydrophobicContact CZ-CG 4.3Å; K661-W664 HydrophobicContact CB-CZ2 3.83Å; K661-W664 HydrophobicContact CD-CD2 4Å; K661-W664 HydrophobicContact CD-CE3 4.37Å; K661-W664 HydrophobicContact CD-CH2 4.28Å; K661-W664 HydrophobicContact CD-CZ2 3.89Å; K661-W664 HydrophobicContact CG-CZ2 4.48Å; K661-W664 VanDerWaalsContact O-CD1 3.25Å; K661-W664 PolarHBondContact O-NE1 3.24Å; W664-E668 HydrophobicContact CE3-CB 3.72Å; W664-E668 HydrophobicContact CZ3-CB 4.06Å; W664-L669 HydrophobicContact CB-CD1 3.78Å; W664-L669 HydrophobicContact CD2-CD1 4.03Å; W664-L669 HydrophobicContact CE3-CD1 4.4Å; W664-L669 HydrophobicContact CG-CD1 3.77Å; W664-V672 HydrophobicContact CH2-CG2 4.15Å; W664-V672 HydrophobicContact CZ3-CG2 3.87Å; W664-Y701 PolarHBondContact N-O 3.39Å; W664-Y701 PolarHBondContact O-N 3.45Å
665	T	91.1	Very high	88.3	Confident	24 Å²	24	53.2 Å²	53.2	15%	0.147	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	158.7	165.3	61.4	0	0	0	0	110.8	E667 E668 L669 H700	T665-E667 VanDerWaalsContact C-N 3.25Å; T665-E667 PolarHBondContact O-N 3.17Å; T665-E668 PolarHBondContact O-N 3.5Å; T665-E668 WeakPolarHBondContact OG1-CB 3.24Å; T665-E668 WeakPolarHBondContact OG1-CG 3.41Å; T665-E668 PolarHBondContact OG1-N 3.29Å; T665-L669 WeakPolarHBondContact O-CB 3.29Å; T665-L669 PolarHBondContact O-N 2.62Å; T665-H700 WeakPolarHBondContact CG2-CE1 3.18Å; T665-H700 VanDerWaalsContact CG2-ND1 3.35Å; T665-H700 WeakPolarHBondContact CG2-ND1 3.2Å
666	L	88.2	Confident	88.3	Confident	28 Å²	28	56.3 Å²	56.3	15%	0.147	32%	0.323	C	S	.	.	H	α-helix	trans	-57.6	-37.7	173.7	-72.2	167.9	0	0	0	112.9	S670 V680 R681 L684 G699 Y701	L666-S670 WeakPolarHBondContact O-CB 3.5Å; L666-S670 PolarHBondContact O-N 3.17Å; L666-V680 HydrophobicContact CD2-CG1 4.16Å; L666-R681 HydrophobicContact CD2-CB 4.24Å; L666-L684 HydrophobicContact CD2-CD1 3.63Å; L666-G699 PolarHBondContact N-O 2.89Å; L666-Y701 HydrophobicContact CD1-CE2 4.05Å; L666-Y701 HydrophobicContact CD2-CD2 4.31Å; L666-Y701 HydrophobicContact CD2-CE2 3.55Å; L666-Y701 HydrophobicContact CG-CD2 4.32Å; L666-Y701 HydrophobicContact CG-CE2 3.59Å
667	E	89.3	Confident	88.2	Confident	141 Å²	141	57.8 Å²	57.8	66%	0.659	33%	0.328	S	S	*	.	H	α-helix	trans	-68.2	-45	179.8	-58.3	-171.7	165.8	0	0	111.5	T665 G671	T665-E667 VanDerWaalsContact C-N 3.25Å; T665-E667 PolarHBondContact O-N 3.17Å; E667-G671 PolarHBondContact O-N 3.36Å
668	E	89.1	Confident	88.1	Confident	81 Å²	81	63.6 Å²	63.6	38%	0.379	36%	0.356	S	S	.	.	H	α-helix	trans	-63.1	-46.3	176.6	-72.1	171	-175.5	0	0	111	K661 W664 T665 S670 G671 V672	K661-E668 IonicContact NZ-OE1 3.78Å; K661-E668 IonicContact NZ-OE2 2.71Å; K661-E668 PolarHBondContact NZ-OE2 3.04Å; W664-E668 HydrophobicContact CE3-CB 3.72Å; W664-E668 HydrophobicContact CZ3-CB 4.06Å; T665-E668 PolarHBondContact O-N 3.5Å; T665-E668 WeakPolarHBondContact OG1-CB 3.24Å; T665-E668 WeakPolarHBondContact OG1-CG 3.41Å; T665-E668 PolarHBondContact OG1-N 3.29Å; E668-S670 PolarHBondContact O-N 2.84Å; E668-G671 PolarHBondContact O-N 3.47Å; E668-V672 WeakPolarHBondContact O-CG2 3.36Å; E668-V672 PolarHBondContact O-N 2.99Å
669	L	88.2	Confident	87.8	Confident	4 Å²	4	64.4 Å²	64.4	2%	0.021	36%	0.36	C	S	.	.	H	α-helix	trans	-66.9	-39	-178.5	-151.6	99.7	0	0	0	111.8	I654 F658 W664 T665 V672 L673 V680 L684	I654-L669 HydrophobicContact CG1-CD2 4.03Å; I654-L669 HydrophobicContact CG2-CD2 4.31Å; F658-L669 HydrophobicContact CE2-CD1 4.02Å; F658-L669 HydrophobicContact CZ-CD1 4.47Å; W664-L669 HydrophobicContact CB-CD1 3.78Å; W664-L669 HydrophobicContact CD2-CD1 4.03Å; W664-L669 HydrophobicContact CE3-CD1 4.4Å; W664-L669 HydrophobicContact CG-CD1 3.77Å; T665-L669 WeakPolarHBondContact O-CB 3.29Å; T665-L669 PolarHBondContact O-N 2.62Å; L669-V672 PolarHBondContact O-N 3.37Å; L669-L673 HydrophobicContact CD2-CD1 3.66Å; L669-L673 HydrophobicContact CG-CD1 3.85Å; L669-L673 WeakPolarHBondContact O-CB 3.42Å; L669-L673 WeakPolarHBondContact O-CG 3.46Å; L669-L673 PolarHBondContact O-N 3.3Å; L669-V680 HydrophobicContact CB-CG1 4.31Å; L669-V680 HydrophobicContact CD2-CG1 3.32Å; L669-V680 HydrophobicContact CG-CG1 4.38Å; L669-L684 HydrophobicContact CD2-CD1 4.28Å; L669-L684 HydrophobicContact CD2-CD2 4.37Å; L669-L684 HydrophobicContact CD2-CG 4.5Å
670	S	89.9	Confident	87.8	Confident	19 Å²	19	57 Å²	57	13%	0.133	33%	0.326	C	S	.	.	H	α-helix	trans	-63	-41.7	174.1	175.7	0	0	0	0	111.9	L666 E668 G674 V675	L666-S670 WeakPolarHBondContact O-CB 3.5Å; L666-S670 PolarHBondContact O-N 3.17Å; E668-S670 PolarHBondContact O-N 2.84Å; S670-G674 WeakPolarHBondContact O-CA 3.46Å; S670-G674 PolarHBondContact O-N 3.45Å; S670-V675 WeakPolarHBondContact CB-O 3.43Å; S670-V675 PolarHBondContact O-N 3.1Å; S670-V675 PolarHBondContact OG-O 2.97Å
671	G	87.9	Confident	87.8	Confident	55 Å²	55	56.9 Å²	56.9	57%	0.567	32%	0.315	S	S	*	.	H	α-helix	trans	-65	-41.2	176.2	0	0	0	0	0	113.2	E667 E668	E667-G671 PolarHBondContact O-N 3.36Å; E668-G671 PolarHBondContact O-N 3.47Å
672	V	87.5	Confident	87.6	Confident	51 Å²	51	59.4 Å²	59.4	31%	0.309	32%	0.322	S	S	.	.	H	α-helix	trans	-74.5	-37.8	-179.3	173.8	0	0	0	0	112.5	H657 W664 E668 L669	H657-V672 VanDerWaalsContact CE1-CG1 3.45Å; H657-V672 WeakPolarHBondContact CE1-CG1 3.49Å; W664-V672 HydrophobicContact CH2-CG2 4.15Å; W664-V672 HydrophobicContact CZ3-CG2 3.87Å; E668-V672 WeakPolarHBondContact O-CG2 3.36Å; E668-V672 PolarHBondContact O-N 2.99Å; L669-V672 PolarHBondContact O-N 3.37Å
673	L	86.4	Confident	87.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-81.2	-18.4	178.9	-67.5	168.1	0	0	0	112.7	M596 E597 A653 I654 L669 V675 V680	M596-L673 HydrophobicContact CE-CD2 4.28Å; E597-L673 PolarHBondContact N-O 3.04Å; A653-L673 HydrophobicContact CB-CD2 3.82Å; I654-L673 HydrophobicContact CD1-CD1 4.49Å; I654-L673 HydrophobicContact CG1-CD1 3.69Å; L669-L673 HydrophobicContact CD2-CD1 3.66Å; L669-L673 HydrophobicContact CG-CD1 3.85Å; L669-L673 WeakPolarHBondContact O-CB 3.42Å; L669-L673 WeakPolarHBondContact O-CG 3.46Å; L669-L673 PolarHBondContact O-N 3.3Å; L673-V675 VanDerWaalsContact C-N 3.27Å; L673-V675 HydrophobicContact CB-CB 4.37Å; L673-V675 HydrophobicContact CB-CG2 4.17Å; L673-V675 PolarHBondContact O-N 2.86Å; L673-V680 HydrophobicContact CD1-CG2 4.22Å
674	G	85.3	Confident	87.5	Confident	43 Å²	43	54 Å²	54	44%	0.443	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	19.9	-174	0	0	0	0	0	113.9	S670	S670-G674 WeakPolarHBondContact O-CA 3.46Å; S670-G674 PolarHBondContact O-N 3.45Å
675	V	85.9	Confident	87.3	Confident	7 Å²	7	54 Å²	54	4%	0.042	29%	0.289	C	S	.	.	S	Bend	trans	-116	144.6	-172.5	-179.5	0	0	0	0	110.6	M596 I650 S670 L673 M679 V680	M596-V675 HydrophobicContact CB-CG2 4.26Å; M596-V675 HydrophobicContact CG-CG2 4.22Å; I650-V675 HydrophobicContact CD1-CB 4.5Å; I650-V675 HydrophobicContact CD1-CG1 4.05Å; I650-V675 HydrophobicContact CD1-CG2 4.07Å; S670-V675 WeakPolarHBondContact CB-O 3.43Å; S670-V675 PolarHBondContact O-N 3.1Å; S670-V675 PolarHBondContact OG-O 2.97Å; L673-V675 VanDerWaalsContact C-N 3.27Å; L673-V675 HydrophobicContact CB-CB 4.37Å; L673-V675 HydrophobicContact CB-CG2 4.17Å; L673-V675 PolarHBondContact O-N 2.86Å; V675-M679 HydrophobicContact CG1-CB 3.81Å; V675-M679 HydrophobicContact CG1-CG 3.87Å; V675-M679 HydrophobicContact CG1-SD 3.44Å; V675-M679 WeakPolarHBondContact CG1-SD 3.4Å; V675-V680 HydrophobicContact CB-CG2 4.17Å; V675-V680 HydrophobicContact CG1-CG2 4.26Å
676	P	88.5	Confident	86.9	Confident	89 Å²	89	53.3 Å²	53.3	58%	0.578	28%	0.284	S	S	*	.			trans	-57	143.1	177.9	-25.4	35	0	0	0	114.1	E678 M679 V680	P676-E678 PolarHBondContact O-N 3.12Å; P676-E678 VanDerWaalsContact O-N 3.16Å; P676-M679 PolarHBondContact O-N 2.89Å; P676-V680 PolarHBondContact O-N 2.85Å; P676-V680 VanDerWaalsContact O-N 3.13Å
677	Q	86.9	Confident	86.8	Confident	92 Å²	92	52 Å²	52	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-55.4	-35.7	-177.3	-65.7	-179.7	8.3	0	0	113.6	M679 V680 R681	Q677-M679 VanDerWaalsContact C-N 3.34Å; Q677-M679 PolarHBondContact O-N 3.38Å; Q677-V680 PolarHBondContact O-N 2.61Å; Q677-R681 WeakPolarHBondContact O-CB 3.43Å; Q677-R681 PolarHBondContact O-N 3.2Å
678	E	86.1	Confident	86.7	Confident	150 Å²	150	48 Å²	48	70%	0.701	26%	0.258	S	S	*	.	H	α-helix	trans	-64.7	-37.4	178.5	-66.6	-174.7	169.6	0	0	112.8	P676 R682	P676-E678 PolarHBondContact O-N 3.12Å; P676-E678 VanDerWaalsContact O-N 3.16Å; E678-R682 WeakPolarHBondContact O-CG 3.47Å; E678-R682 PolarHBondContact O-N 2.93Å; E678-R682 PolarHBondContact O-NE 2.9Å
679	M	83.8	Confident	86.4	Confident	29 Å²	29	51 Å²	51	14%	0.143	27%	0.273	C	S	.	.	H	α-helix	trans	-74.3	-41.9	177.8	-174.8	178.7	-174.5	0	0	110.4	E594 I650 V675 P676 Q677 R681 R682 K683	E594-M679 WeakPolarHBondContact OE1-CE 3.27Å; E594-M679 WeakPolarHBondContact OE2-CE 3.32Å; I650-M679 HydrophobicContact CD1-CE 4.11Å; I650-M679 HydrophobicContact CD1-SD 4.45Å; V675-M679 HydrophobicContact CG1-CB 3.81Å; V675-M679 HydrophobicContact CG1-CG 3.87Å; V675-M679 HydrophobicContact CG1-SD 3.44Å; V675-M679 WeakPolarHBondContact CG1-SD 3.4Å; P676-M679 PolarHBondContact O-N 2.89Å; Q677-M679 VanDerWaalsContact C-N 3.34Å; Q677-M679 PolarHBondContact O-N 3.38Å; M679-R681 PolarHBondContact O-N 2.96Å; M679-R682 PolarHBondContact O-N 3.15Å; M679-K683 HydrophobicContact CG-CG 4.49Å; M679-K683 WeakPolarHBondContact O-CG 3.37Å; M679-K683 PolarHBondContact O-N 3.45Å
680	V	87	Confident	85.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.9	-47.2	174	169.7	0	0	0	0	111.5	L666 L669 L673 V675 P676 Q677 R682 K683 L684	L666-V680 HydrophobicContact CD2-CG1 4.16Å; L669-V680 HydrophobicContact CB-CG1 4.31Å; L669-V680 HydrophobicContact CD2-CG1 3.32Å; L669-V680 HydrophobicContact CG-CG1 4.38Å; L673-V680 HydrophobicContact CD1-CG2 4.22Å; V675-V680 HydrophobicContact CB-CG2 4.17Å; V675-V680 HydrophobicContact CG1-CG2 4.26Å; P676-V680 PolarHBondContact O-N 2.85Å; P676-V680 VanDerWaalsContact O-N 3.13Å; Q677-V680 PolarHBondContact O-N 2.61Å; V680-R682 VanDerWaalsContact C-N 3.31Å; V680-R682 PolarHBondContact O-N 3.31Å; V680-K683 PolarHBondContact O-N 3.5Å; V680-L684 HydrophobicContact CG1-CD1 3.74Å; V680-L684 HydrophobicContact CG1-CG 4.27Å; V680-L684 WeakPolarHBondContact O-CB 3.48Å; V680-L684 VanDerWaalsContact O-CG 3.29Å; V680-L684 WeakPolarHBondContact O-CG 3.48Å; V680-L684 PolarHBondContact O-N 2.91Å
681	R	87.3	Confident	85.5	Confident	136 Å²	136	53.5 Å²	53.5	51%	0.513	29%	0.289	S	S	.	.	H	α-helix	trans	-59	-41.7	177.5	-179.1	-178	164.3	91.1	4.1	111.9	L666 Q677 M679 A685 E695	L666-R681 HydrophobicContact CD2-CB 4.24Å; Q677-R681 WeakPolarHBondContact O-CB 3.43Å; Q677-R681 PolarHBondContact O-N 3.2Å; M679-R681 PolarHBondContact O-N 2.96Å; R681-A685 PolarHBondContact O-N 3.49Å; R681-E695 IonicContact NH1-OE1 3.55Å
682	R	84.9	Confident	85.3	Confident	136 Å²	136	51 Å²	51	51%	0.513	26%	0.263	S	S	.	.	H	α-helix	trans	-62.5	-50.4	175.5	-77.5	-176.9	-80.8	169.2	-4.9	111.4	E678 M679 V680 L684 A685	E678-R682 WeakPolarHBondContact O-CG 3.47Å; E678-R682 PolarHBondContact O-N 2.93Å; E678-R682 PolarHBondContact O-NE 2.9Å; M679-R682 PolarHBondContact O-N 3.15Å; V680-R682 VanDerWaalsContact C-N 3.31Å; V680-R682 PolarHBondContact O-N 3.31Å; R682-L684 VanDerWaalsContact C-N 3.3Å; R682-L684 PolarHBondContact O-N 3.42Å; R682-A685 WeakPolarHBondContact O-CB 3.44Å; R682-A685 PolarHBondContact O-N 3.33Å
683	K	85.7	Confident	85.4	Confident	16 Å²	16	48.9 Å²	48.9	7%	0.07	25%	0.249	C	C	.	.	H	α-helix	trans	-67.3	-26.8	-179.6	-60.4	-66.5	173.3	-165.9	0	113.4	I650 H651 I654 M679 V680 A685 D721 E724	I650-K683 HydrophobicContact CD1-CG 4.28Å; I650-K683 HydrophobicContact CG2-CD 3.82Å; I650-K683 HydrophobicContact CG2-CG 3.94Å; H651-K683 PolarHBondContact CD2-O 3.42Å; H651-K683 VanDerWaalsContact CD2-O 3.23Å; H651-K683 WeakPolarHBondContact CE1-CD 3.42Å; H651-K683 WeakPolarHBondContact NE2-CD 3.42Å; H651-K683 PolarHBondContact NE2-O 3.04Å; I654-K683 HydrophobicContact CD1-CB 3.9Å; M679-K683 HydrophobicContact CG-CG 4.49Å; M679-K683 WeakPolarHBondContact O-CG 3.37Å; M679-K683 PolarHBondContact O-N 3.45Å; V680-K683 PolarHBondContact O-N 3.5Å; K683-A685 VanDerWaalsContact C-N 3.3Å; K683-A685 PolarHBondContact O-N 2.84Å; K683-D721 IonicContact NZ-OD2 3.59Å; K683-D721 PolarHBondContact NZ-OD2 3.16Å; K683-E724 IonicContact NZ-OE1 3.85Å; K683-E724 PolarHBondContact NZ-OE1 2.68Å
684	L	87.4	Confident	85.5	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-67.9	-28	171.7	-76.8	166.8	0	0	0	112.8	I654 F658 L666 L669 V680 R682 L686 W687 Q688 L693 Y701	I654-L684 HydrophobicContact CG2-CD2 3.72Å; F658-L684 HydrophobicContact CE2-CD2 4.25Å; L666-L684 HydrophobicContact CD2-CD1 3.63Å; L669-L684 HydrophobicContact CD2-CD1 4.28Å; L669-L684 HydrophobicContact CD2-CD2 4.37Å; L669-L684 HydrophobicContact CD2-CG 4.5Å; V680-L684 HydrophobicContact CG1-CD1 3.74Å; V680-L684 HydrophobicContact CG1-CG 4.27Å; V680-L684 WeakPolarHBondContact O-CB 3.48Å; V680-L684 VanDerWaalsContact O-CG 3.29Å; V680-L684 WeakPolarHBondContact O-CG 3.48Å; V680-L684 PolarHBondContact O-N 2.91Å; R682-L684 VanDerWaalsContact C-N 3.3Å; R682-L684 PolarHBondContact O-N 3.42Å; L684-L686 VanDerWaalsContact C-N 3.25Å; L684-L686 PolarHBondContact O-N 2.99Å; L684-W687 PolarHBondContact O-N 3.46Å; L684-W687 VanDerWaalsContact O-N 3.15Å; L684-Q688 WeakPolarHBondContact O-CG 3.19Å; L684-Q688 PolarHBondContact O-N 3.45Å; L684-L693 HydrophobicContact CD2-CD1 3.45Å; L684-L693 VanDerWaalsContact CD2-CD1 3.45Å; L684-Y701 HydrophobicContact CB-CD1 4.47Å; L684-Y701 HydrophobicContact CB-CE1 4.03Å; L684-Y701 HydrophobicContact CD1-CD1 4.02Å; L684-Y701 HydrophobicContact CD1-CD2 4.1Å; L684-Y701 HydrophobicContact CD1-CE1 3.82Å; L684-Y701 HydrophobicContact CD1-CE2 3.97Å; L684-Y701 HydrophobicContact CD1-CG 4.16Å; L684-Y701 HydrophobicContact CD2-CD1 4.3Å; L684-Y701 HydrophobicContact CG-CE1 4.4Å
685	A	86.7	Confident	85.6	Confident	31 Å²	31	55.8 Å²	55.8	26%	0.256	27%	0.269	S	S	.	.	H	α-helix	trans	-60.9	-35.1	-177.8	0	0	0	0	0	112.3	R681 R682 K683 Q688 Q689	R681-A685 PolarHBondContact O-N 3.49Å; R682-A685 WeakPolarHBondContact O-CB 3.44Å; R682-A685 PolarHBondContact O-N 3.33Å; K683-A685 VanDerWaalsContact C-N 3.3Å; K683-A685 PolarHBondContact O-N 2.84Å; A685-Q688 WeakPolarHBondContact O-CB 3.09Å; A685-Q688 PolarHBondContact O-N 2.99Å; A685-Q689 VanDerWaalsContact O-CG 3.28Å; A685-Q689 WeakPolarHBondContact O-CG 3.44Å; A685-Q689 PolarHBondContact O-N 3.39Å
686	L	83.8	Confident	85.5	Confident	9 Å²	9	60.4 Å²	60.4	5%	0.047	29%	0.29	C	S	.	.	H	α-helix	trans	-61.9	-44.7	176.3	-173.9	147.1	0	0	0	111.5	L684 Q688 Q689 Q690 L719 D721	L684-L686 VanDerWaalsContact C-N 3.25Å; L684-L686 PolarHBondContact O-N 2.99Å; L686-Q688 VanDerWaalsContact C-N 3.33Å; L686-Q688 PolarHBondContact O-N 3.4Å; L686-Q689 PolarHBondContact O-N 2.97Å; L686-Q690 WeakPolarHBondContact O-CG 3.42Å; L686-Q690 PolarHBondContact O-N 3.45Å; L686-L719 HydrophobicContact CD1-CB 4.23Å; L686-L719 HydrophobicContact CD2-CB 4.36Å; L686-L719 HydrophobicContact CD2-CD1 4.13Å; L686-D721 HydrophobicContact CD1-CB 4.43Å
687	W	86.4	Confident	84.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-70.9	-28.2	176.9	-69.2	119.9	0	0	0	113.5	L633 L645 V647 H651 I655 L684 G691 V692 L693	L633-W687 HydrophobicContact CD1-CH2 3.89Å; L633-W687 HydrophobicContact CD2-CH2 4.45Å; L633-W687 HydrophobicContact CD2-CZ2 4.43Å; L645-W687 HydrophobicContact CD1-CH2 4.04Å; L645-W687 HydrophobicContact CD1-CZ3 3.96Å; V647-W687 HydrophobicContact CG1-CH2 4.26Å; V647-W687 HydrophobicContact CG1-CZ2 4.15Å; H651-W687 HydrophobicContact CB-CZ2 4.18Å; H651-W687 AromaticContact CD2-NE1 3.91Å; H651-W687 PolarHBondContact O-NE1 3.03Å; H651-W687 VanDerWaalsContact O-NE1 3.12Å; I655-W687 HydrophobicContact CB-CZ2 4.4Å; I655-W687 HydrophobicContact CD1-CB 4.5Å; I655-W687 HydrophobicContact CD1-CD2 3.61Å; I655-W687 HydrophobicContact CD1-CE3 3.98Å; I655-W687 HydrophobicContact CD1-CG 3.83Å; I655-W687 HydrophobicContact CD1-CZ2 4.3Å; I655-W687 HydrophobicContact CD1-CZ3 4.47Å; I655-W687 HydrophobicContact CG1-CD2 3.61Å; I655-W687 HydrophobicContact CG1-CE3 4.07Å; I655-W687 HydrophobicContact CG1-CG 4.17Å; I655-W687 HydrophobicContact CG1-CH2 3.84Å; I655-W687 HydrophobicContact CG1-CZ2 3.36Å; I655-W687 HydrophobicContact CG1-CZ3 4.17Å; L684-W687 PolarHBondContact O-N 3.46Å; L684-W687 VanDerWaalsContact O-N 3.15Å; W687-G691 PolarHBondContact O-N 2.99Å; W687-V692 HydrophobicContact CE3-CB 3.95Å; W687-V692 HydrophobicContact CE3-CG1 4.26Å; W687-V692 HydrophobicContact CE3-CG2 3.79Å; W687-V692 HydrophobicContact CZ3-CG2 4.11Å; W687-V692 PolarHBondContact O-N 3.37Å; W687-L693 HydrophobicContact CB-CB 4.32Å; W687-L693 HydrophobicContact CB-CD1 3.68Å; W687-L693 HydrophobicContact CB-CG 3.9Å; W687-L693 HydrophobicContact CG-CD1 4.31Å; W687-L693 PolarHBondContact O-N 2.6Å
688	Q	85.6	Confident	84.1	Confident	58 Å²	58	60.1 Å²	60.1	27%	0.271	32%	0.318	S	S	.	.	H	α-helix	trans	-67.8	-44.3	169.8	-68	177.6	-42.9	0	0	111.6	L684 A685 L686 Q690 G691 L693 E695 Y701	L684-Q688 WeakPolarHBondContact O-CG 3.19Å; L684-Q688 PolarHBondContact O-N 3.45Å; A685-Q688 WeakPolarHBondContact O-CB 3.09Å; A685-Q688 PolarHBondContact O-N 2.99Å; L686-Q688 VanDerWaalsContact C-N 3.33Å; L686-Q688 PolarHBondContact O-N 3.4Å; Q688-Q690 VanDerWaalsContact C-N 3.3Å; Q688-Q690 PolarHBondContact O-N 3.31Å; Q688-G691 WeakPolarHBondContact O-CA 3.25Å; Q688-G691 PolarHBondContact O-N 3.5Å; Q688-L693 WeakPolarHBondContact CA-O 3.43Å; Q688-E695 PolarHBondContact NE2-OE2 3.11Å; Q688-Y701 HydrophobicContact CG-CE1 4.47Å; Q688-Y701 VanDerWaalsContact NE2-CE1 3.27Å
689	Q	83.3	Confident	83.7	Confident	145 Å²	145	53.8 Å²	53.8	68%	0.678	29%	0.293	S	S	*	.	H	α-helix	trans	-62.3	-37.2	177.3	-72.4	172.8	17.1	0	0	111.9	A685 L686 G691	A685-Q689 VanDerWaalsContact O-CG 3.28Å; A685-Q689 WeakPolarHBondContact O-CG 3.44Å; A685-Q689 PolarHBondContact O-N 3.39Å; L686-Q689 PolarHBondContact O-N 2.97Å; Q689-G691 PolarHBondContact O-N 3.44Å
690	Q	77.9	Confident	83.8	Confident	48 Å²	48	56.2 Å²	56.2	22%	0.224	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-5.5	174.1	-63.8	-55.3	-41.1	0	0	113.8	R640 L686 Q688 V692 L719	R640-Q690 PolarHBondContact NH2-O 3.36Å; L686-Q690 WeakPolarHBondContact O-CG 3.42Å; L686-Q690 PolarHBondContact O-N 3.45Å; Q688-Q690 VanDerWaalsContact C-N 3.3Å; Q688-Q690 PolarHBondContact O-N 3.31Å; Q690-V692 VanDerWaalsContact C-N 3.29Å; Q690-V692 HydrophobicContact CB-CG2 4.18Å; Q690-V692 PolarHBondContact O-N 3.15Å; Q690-L719 HydrophobicContact CG-CD2 4Å; Q690-L719 VanDerWaalsContact NE2-CD2 3.26Å
691	G	80.6	Confident	83.9	Confident	26 Å²	26	56.4 Å²	56.4	27%	0.268	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	26.7	-179.2	0	0	0	0	0	113.6	R640 W687 Q688 Q689	R640-G691 PolarHBondContact NH2-O 2.84Å; W687-G691 PolarHBondContact O-N 2.99Å; Q688-G691 WeakPolarHBondContact O-CA 3.25Å; Q688-G691 PolarHBondContact O-N 3.5Å; Q689-G691 PolarHBondContact O-N 3.44Å
692	V	85.4	Confident	84	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.018	29%	0.287	C	S	.	.	S	Bend	trans	-86.9	-37	174.8	179.4	0	0	0	0	110.4	L642 I655 W687 Q690 L704	L642-V692 HydrophobicContact CD1-CG2 3.86Å; I655-V692 HydrophobicContact CD1-CG1 3.9Å; W687-V692 HydrophobicContact CE3-CB 3.95Å; W687-V692 HydrophobicContact CE3-CG1 4.26Å; W687-V692 HydrophobicContact CE3-CG2 3.79Å; W687-V692 HydrophobicContact CZ3-CG2 4.11Å; W687-V692 PolarHBondContact O-N 3.37Å; Q690-V692 VanDerWaalsContact C-N 3.29Å; Q690-V692 HydrophobicContact CB-CG2 4.18Å; Q690-V692 PolarHBondContact O-N 3.15Å; V692-L704 PolarHBondContact O-N 2.72Å
693	L	88.6	Confident	84.2	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.031	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	146.8	179.4	-61.5	179.6	0	0	0	111.3	I654 I655 F658 L684 W687 Q688 V703	I654-L693 HydrophobicContact CG2-CD1 4.42Å; I655-L693 HydrophobicContact CD1-CD1 4.36Å; I655-L693 HydrophobicContact CD1-CG 4.42Å; F658-L693 HydrophobicContact CD1-CD2 3.86Å; F658-L693 HydrophobicContact CD2-CD1 4.14Å; F658-L693 HydrophobicContact CD2-CD2 3.95Å; F658-L693 HydrophobicContact CE1-CD2 3.8Å; F658-L693 HydrophobicContact CE2-CD1 3.68Å; F658-L693 HydrophobicContact CE2-CD2 3.94Å; F658-L693 HydrophobicContact CG-CD2 3.93Å; F658-L693 HydrophobicContact CZ-CD1 4.03Å; F658-L693 HydrophobicContact CZ-CD2 3.86Å; L684-L693 HydrophobicContact CD2-CD1 3.45Å; L684-L693 VanDerWaalsContact CD2-CD1 3.45Å; W687-L693 HydrophobicContact CB-CB 4.32Å; W687-L693 HydrophobicContact CB-CD1 3.68Å; W687-L693 HydrophobicContact CB-CG 3.9Å; W687-L693 HydrophobicContact CG-CD1 4.31Å; W687-L693 PolarHBondContact O-N 2.6Å; Q688-L693 WeakPolarHBondContact CA-O 3.43Å; L693-V703 HydrophobicContact CD2-CG2 4.2Å
694	K	87.6	Confident	84.2	Confident	111 Å²	111	47.6 Å²	47.6	48%	0.483	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	138.8	171.5	-179.6	-178.9	173.9	-166.9	0	110.3	Y701 S702 L704	K694-Y701 WeakPolarHBondContact O-CA 3.47Å; K694-S702 PolarHBondContact N-O 3.02Å; K694-S702 PolarHBondContact O-N 2.95Å; K694-L704 HydrophobicContact CB-CD1 3.63Å; K694-L704 HydrophobicContact CD-CD1 3.7Å; K694-L704 HydrophobicContact CG-CD1 4.21Å
695	E	88.2	Confident	83.8	Confident	78 Å²	78	50.7 Å²	50.7	36%	0.364	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	122.1	170.9	-174.9	172.5	177.7	0	0	109.9	R681 Q688 H700 Y701	R681-E695 IonicContact NH1-OE1 3.55Å; Q688-E695 PolarHBondContact NE2-OE2 3.11Å; E695-H700 CarbonylContact C-O 3.46Å; E695-H700 WeakPolarHBondContact CA-O 3.37Å; E695-Y701 HydrophobicContact CB-CD1 4.39Å; E695-Y701 HydrophobicContact CB-CE1 4.11Å; E695-Y701 HydrophobicContact CG-CE1 4.35Å; E695-Y701 HydrophobicContact CG-CE2 4.49Å
696	E	84.9	Confident	83.3	Confident	103 Å²	103	53.5 Å²	53.5	48%	0.481	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	168.4	170.1	-61.5	-164.7	147.8	0	0	110.6	G698 H700	E696-G698 PolarHBondContact O-N 3.07Å; E696-H700 HydrophobicContact CB-CB 4.22Å; E696-H700 PolarHBondContact N-O 3Å
697	A	75.6	Confident	82.4	Confident	100 Å²	100	54.2 Å²	54.2	83%	0.826	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	132.3	-179.6	0	0	0	0	0	111.3
698	G	70.3	Confident	81	Confident	76 Å²	76	59.8 Å²	59.8	78%	0.784	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.5	15.6	176.6	0	0	0	0	0	115.8	E696	E696-G698 PolarHBondContact O-N 3.07Å
699	G	77.5	Confident	79	Confident	17 Å²	17	62.9 Å²	62.9	18%	0.175	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	23.5	178.1	0	0	0	0	0	113.6	L666	L666-G699 PolarHBondContact N-O 2.89Å
700	H	85.6	Confident	77.1	Confident	80 Å²	80	67 Å²	67	37%	0.37	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	136.6	170.8	-79.5	-85.2	0	0	0	109.8	T665 E695 E696	T665-H700 WeakPolarHBondContact CG2-CE1 3.18Å; T665-H700 VanDerWaalsContact CG2-ND1 3.35Å; T665-H700 WeakPolarHBondContact CG2-ND1 3.2Å; E695-H700 CarbonylContact C-O 3.46Å; E695-H700 WeakPolarHBondContact CA-O 3.37Å; E696-H700 HydrophobicContact CB-CB 4.22Å; E696-H700 PolarHBondContact N-O 3Å
701	Y	89.6	Confident	75.5	Confident	3 Å²	3	73 Å²	73	1%	0.012	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131	176.4	-68.9	-101.8	0	0	0	108.3	F658 S663 W664 L666 L684 Q688 K694 E695	F658-Y701 WeakPolarHBondContact CE1-O 3.34Å; S663-Y701 CarbonylContact C-O 3.6Å; S663-Y701 VanDerWaalsContact CA-O 3.24Å; S663-Y701 WeakPolarHBondContact CA-O 3.25Å; W664-Y701 PolarHBondContact N-O 3.39Å; W664-Y701 PolarHBondContact O-N 3.45Å; L666-Y701 HydrophobicContact CD1-CE2 4.05Å; L666-Y701 HydrophobicContact CD2-CD2 4.31Å; L666-Y701 HydrophobicContact CD2-CE2 3.55Å; L666-Y701 HydrophobicContact CG-CD2 4.32Å; L666-Y701 HydrophobicContact CG-CE2 3.59Å; L684-Y701 HydrophobicContact CB-CD1 4.47Å; L684-Y701 HydrophobicContact CB-CE1 4.03Å; L684-Y701 HydrophobicContact CD1-CD1 4.02Å; L684-Y701 HydrophobicContact CD1-CD2 4.1Å; L684-Y701 HydrophobicContact CD1-CE1 3.82Å; L684-Y701 HydrophobicContact CD1-CE2 3.97Å; L684-Y701 HydrophobicContact CD1-CG 4.16Å; L684-Y701 HydrophobicContact CD2-CD1 4.3Å; L684-Y701 HydrophobicContact CG-CE1 4.4Å; Q688-Y701 HydrophobicContact CG-CE1 4.47Å; Q688-Y701 VanDerWaalsContact NE2-CE1 3.27Å; K694-Y701 WeakPolarHBondContact O-CA 3.47Å; E695-Y701 HydrophobicContact CB-CD1 4.39Å; E695-Y701 HydrophobicContact CB-CE1 4.11Å; E695-Y701 HydrophobicContact CG-CE1 4.35Å; E695-Y701 HydrophobicContact CG-CE2 4.49Å
702	S	88.4	Confident	73.6	Confident	20 Å²	20	83.2 Å²	83.2	14%	0.14	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.9	178.8	63.4	0	0	0	0	111.2	S662 K694	S662-S702 WeakPolarHBondContact O-CA 3.17Å; K694-S702 PolarHBondContact N-O 3.02Å; K694-S702 PolarHBondContact O-N 2.95Å
703	V	89.1	Confident	71.7	Confident	32 Å²	32	86.4 Å²	86.4	19%	0.194	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	137.1	172.1	-174.2	0	0	0	0	110.2	L637 F658 S662 L693	L637-V703 HydrophobicContact CD2-CG1 4.28Å; F658-V703 HydrophobicContact CB-CG2 3.79Å; F658-V703 HydrophobicContact CD1-CG2 3.48Å; F658-V703 VanDerWaalsContact CD1-CG2 3.48Å; F658-V703 HydrophobicContact CE1-CG2 4.39Å; F658-V703 HydrophobicContact CG-CG2 3.97Å; S662-V703 PolarHBondContact O-N 2.6Å; L693-V703 HydrophobicContact CD2-CG2 4.2Å
704	L	85.8	Confident	69.3	Low	51 Å²	51	94.2 Å²	94.2	27%	0.267	51%	0.511	S	S	.	.			trans	-112	93.2	179	-157.9	138.6	0	0	0	109.4	V692 K694 T706	V692-L704 PolarHBondContact O-N 2.72Å; K694-L704 HydrophobicContact CB-CD1 3.63Å; K694-L704 HydrophobicContact CD-CD1 3.7Å; K694-L704 HydrophobicContact CG-CD1 4.21Å; L704-T706 VanDerWaalsContact C-N 3.3Å; L704-T706 WeakPolarHBondContact CD2-O 3.11Å; L704-T706 PolarHBondContact O-N 3.07Å
705	E	79.9	Confident	66.9	Low	68 Å²	68	100.7 Å²	100.7	32%	0.318	53%	0.532	S	S	.	.			trans	-69.1	-22.4	-173.4	-65.5	-64.7	167.1	0	0	114.5	E638 D639	E638-E705 HydrophobicContact CB-CB 4.14Å; E638-E705 HydrophobicContact CG-CB 3.92Å; E638-E705 HydrophobicContact CG-CG 4.24Å; E638-E705 PolarHBondContact N-OE2 2.88Å; D639-E705 VanDerWaalsContact OD1-O 3.12Å
706	T	76.3	Confident	64.7	Low	89 Å²	89	100.2 Å²	100.2	55%	0.546	55%	0.549	S	S	.	.	S	Bend	trans	-125.5	112.6	-177.5	36.5	0	0	0	0	111.1	D639 L704	D639-T706 HydrophobicContact CB-CG2 4.27Å; L704-T706 VanDerWaalsContact C-N 3.3Å; L704-T706 WeakPolarHBondContact CD2-O 3.11Å; L704-T706 PolarHBondContact O-N 3.07Å
707	G	64.4	Low	62.6	Low	25 Å²	25	99.4 Å²	99.4	26%	0.258	55%	0.551	S	S	.	*			trans	-69.9	140.8	-179.7	0	0	0	0	0	113	D639 S709	D639-G707 PolarHBondContact OD2-N 3.46Å; G707-S709 PolarHBondContact O-N 3.06Å
708	S	56.9	Low	61	Low	116 Å²	116	99.2 Å²	99.2	81%	0.811	53%	0.534	S	S	*	.			trans	-65.6	121.8	163.5	56.8	0	0	0	0	109.1	R710	S708-R710 VanDerWaalsContact C-N 3.3Å; S708-R710 PolarHBondContact O-N 3.35Å
709	S	43.3	Very low	60.1	Low	123 Å²	123	96.7 Å²	96.7	86%	0.86	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	57.7	-165.2	65.4	0	0	0	0	117.2	G707	G707-S709 PolarHBondContact O-N 3.06Å
710	R	43.8	Very low	58.7	Low	232 Å²	232	100.3 Å²	100.3	88%	0.875	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.7	-13.7	-178.9	-116.3	177	168.3	152.8	-2.8	120.8	S708	S708-R710 VanDerWaalsContact C-N 3.3Å; S708-R710 PolarHBondContact O-N 3.35Å
711	E	43.1	Very low	56.9	Low	173 Å²	173	97.6 Å²	97.6	81%	0.808	51%	0.505	S	S	*	.			trans	-139.2	109.5	177.8	-66.8	-179	176.4	0	0	109.9	P713	E711-P713 WeakPolarHBondContact O-CD 3.19Å
712	R	42.1	Very low	54.5	Low	241 Å²	241	101.7 Å²	101.7	91%	0.909	53%	0.534	S	S	*	.			trans	-79.9	114.1	163.8	-78.6	179.5	174.4	167.8	-1.9	106.1	E714	R712-E714 PolarHBondContact O-N 2.78Å
713	P	45.6	Very low	52.4	Low	70 Å²	70	106.2 Å²	106.2	46%	0.455	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-66.7	126.4	169	25.8	-27.7	0	0	0	108	L642 E711	L642-P713 HydrophobicContact CD2-CG 4.27Å; E711-P713 WeakPolarHBondContact O-CD 3.19Å
714	E	37.1	Very low	50.3	Low	171 Å²	171	108.3 Å²	108.3	80%	0.799	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-63.6	145.9	174.5	-69.3	-172.8	155	0	0	110.2	R712 G716	R712-E714 PolarHBondContact O-N 2.78Å; E714-G716 PolarHBondContact O-N 3.11Å
715	R	37.2	Very low	48.3	Very low	246 Å²	246	112.9 Å²	112.9	93%	0.928	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	131.6	-175	-75.4	176.2	178.2	176.6	-1.9	111.7
716	G	41.6	Very low	46.5	Very low	68 Å²	68	112.9 Å²	112.9	70%	0.701	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	89.1	28.6	161.8	0	0	0	0	0	116.1	E714 M718	E714-G716 PolarHBondContact O-N 3.11Å; G716-M718 PolarHBondContact O-N 2.87Å
717	V	41.8	Very low	45.4	Very low	87 Å²	87	112.9 Å²	112.9	53%	0.527	60%	0.599	S	S	.	*			trans	-77.7	115.9	171.4	-179.1	0	0	0	0	108.7	L719	V717-L719 PolarHBondContact O-N 3.27Å
718	M	42.8	Very low	45.1	Very low	95 Å²	95	112.9 Å²	112.9	47%	0.468	60%	0.595	S	S	.	*			trans	-58.2	117.8	160.5	-131.8	-177.6	178.2	0	0	105.9	L630 T646 G716 I720	L630-M718 HydrophobicContact CD1-CE 4.03Å; L630-M718 HydrophobicContact CD2-CE 4.45Å; T646-M718 HydrophobicContact CG2-CE 4.18Å; T646-M718 HydrophobicContact CG2-CG 4.2Å; G716-M718 PolarHBondContact O-N 2.87Å; M718-I720 HydrophobicContact CB-CG1 4.21Å; M718-I720 PolarHBondContact O-N 3.36Å
719	L	51	Low	45.5	Very low	24 Å²	24	109 Å²	109	13%	0.126	57%	0.565	C	S	.	*			trans	-75.8	82	178.9	-72.4	167.3	0	0	0	107.3	L645 T646 V647 L686 Q690 V717 D721	L645-L719 HydrophobicContact CB-CD1 4.27Å; L645-L719 HydrophobicContact CD1-CD1 4.4Å; L645-L719 HydrophobicContact CD2-CD1 3.93Å; L645-L719 HydrophobicContact CG-CD1 4.43Å; T646-L719 PolarHBondContact O-N 2.93Å; V647-L719 HydrophobicContact CG1-CB 4.21Å; V647-L719 HydrophobicContact CG1-CD1 3.64Å; L686-L719 HydrophobicContact CD1-CB 4.23Å; L686-L719 HydrophobicContact CD2-CB 4.36Å; L686-L719 HydrophobicContact CD2-CD1 4.13Å; Q690-L719 HydrophobicContact CG-CD2 4Å; Q690-L719 VanDerWaalsContact NE2-CD2 3.26Å; V717-L719 PolarHBondContact O-N 3.27Å; L719-D721 PolarHBondContact O-N 2.95Å
720	I	46.7	Very low	46.4	Very low	93 Å²	93	103.2 Å²	103.2	48%	0.477	53%	0.525	S	S	.	.			trans	-73.9	114.1	176.2	-58.7	171.4	0	0	0	106.3	M718 S722 E725	M718-I720 HydrophobicContact CB-CG1 4.21Å; M718-I720 PolarHBondContact O-N 3.36Å; I720-S722 PolarHBondContact O-N 2.84Å; I720-E725 HydrophobicContact CG2-CG 4Å
721	D	47.9	Very low	47.2	Very low	22 Å²	22	93.2 Å²	93.2	12%	0.118	49%	0.489	C	S	.	.			trans	-61.2	115.1	165.1	-164.2	-1.5	0	0	0	106.6	K683 L686 L719 D723 E724	K683-D721 IonicContact NZ-OD2 3.59Å; K683-D721 PolarHBondContact NZ-OD2 3.16Å; L686-D721 HydrophobicContact CD1-CB 4.43Å; L719-D721 PolarHBondContact O-N 2.95Å; D721-D723 PolarHBondContact O-N 2.97Å; D721-E724 HydrophobicContact CB-CB 4.2Å; D721-E724 HydrophobicContact CB-CG 3.95Å; D721-E724 PolarHBondContact O-N 3.06Å
722	S	40.5	Very low	48.2	Very low	89 Å²	89	87.2 Å²	87.2	62%	0.622	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-19.9	-172.1	-37.5	0	0	0	0	112.6	I720	I720-S722 PolarHBondContact O-N 2.84Å
723	D	43.4	Very low	48.9	Very low	115 Å²	115	79.5 Å²	79.5	62%	0.615	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-17.4	177.5	-71.9	-14.1	0	0	0	113.3	D721	D721-D723 PolarHBondContact O-N 2.97Å
724	E	45.9	Very low	49.6	Very low	76 Å²	76	80 Å²	80	36%	0.355	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-18.8	178.2	-79.2	-177.2	-177.6	0	0	113.2	K683 D721 G726 D727	K683-E724 IonicContact NZ-OE1 3.85Å; K683-E724 PolarHBondContact NZ-OE1 2.68Å; D721-E724 HydrophobicContact CB-CB 4.2Å; D721-E724 HydrophobicContact CB-CG 3.95Å; D721-E724 PolarHBondContact O-N 3.06Å; E724-G726 PolarHBondContact O-N 3.45Å; E724-D727 PolarHBondContact O-N 3.08Å
725	E	42.5	Very low	50.7	Low	148 Å²	148	76.1 Å²	76.1	69%	0.692	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-22	174	-74	-169.3	161.7	0	0	112.8	I720	I720-E725 HydrophobicContact CG2-CG 4Å
726	G	43.2	Very low	51.9	Low	68 Å²	68	65 Å²	65	70%	0.701	39%	0.385	S	S	*	.	S	Bend	trans	-94.3	-18.6	179.7	0	0	0	0	0	115.1	E724	E724-G726 PolarHBondContact O-N 3.45Å
727	D	52.8	Low	53.1	Low	89 Å²	89	68.4 Å²	68.4	48%	0.476	38%	0.376	S	S	.	.	S	Bend	trans	-111	99.6	-168	-143	-5.7	0	0	0	109.7	K592 E724	K592-D727 VanDerWaalsContact NZ-CG 3.35Å; K592-D727 IonicContact NZ-OD1 3.6Å; K592-D727 PolarHBondContact NZ-OD1 2.85Å; K592-D727 IonicContact NZ-OD2 3.61Å; E724-D727 PolarHBondContact O-N 3.08Å
728	S	59.1	Low	54.4	Low	24 Å²	24	70 Å²	70	17%	0.168	38%	0.378	C	S	.	.			trans	-56.1	144.4	-179.4	179.5	0	0	0	0	110.9	D512 K592 T730	D512-S728 PolarHBondContact OD1-OG 3.32Å; D512-S728 PolarHBondContact OD2-OG 3.4Å; K592-S728 VanDerWaalsContact CE-O 3.22Å; K592-S728 WeakPolarHBondContact CE-O 3.48Å; K592-S728 PolarHBondContact NZ-O 3.48Å; S728-T730 PolarHBondContact O-N 3.48Å; S728-T730 PolarHBondContact OG-N 3.12Å; S728-T730 PolarHBondContact OG-OG1 2.85Å
729	N	63.6	Low	55.6	Low	36 Å²	36	71 Å²	71	19%	0.193	38%	0.381	C	S	.	.	S	Bend	trans	-70.4	-10.3	173.8	-71.9	-31.9	0	0	0	112.2	D512 L515 H516 K592 L628	D512-N729 PolarHBondContact OD1-N 2.95Å; L515-N729 HydrophobicContact CD1-CB 4.15Å; H516-N729 PolarHBondContact CE1-ND2 2.89Å; K592-N729 PolarHBondContact N-O 3.02Å; L628-N729 HydrophobicContact CD2-CB 3.69Å
730	T	62.4	Low	56.6	Low	1 Å²	1	73 Å²	73	1%	0.006	39%	0.389	C	S	.	.	B	Isolated β-bridge	trans	-103.5	157.5	175.6	71.3	0	0	0	0	110.8	T508 A511 P589 L591 S728	T508-T730 HydrophobicContact CG2-CG2 4.36Å; T508-T730 WeakPolarHBondContact CG2-OG1 3.35Å; A511-T730 HydrophobicContact CB-CG2 4.12Å; P589-T730 HydrophobicContact CB-CG2 3.82Å; P589-T730 HydrophobicContact CG-CG2 4.18Å; L591-T730 HydrophobicContact CD2-CG2 4.28Å; S728-T730 PolarHBondContact O-N 3.48Å; S728-T730 PolarHBondContact OG-N 3.12Å; S728-T730 PolarHBondContact OG-OG1 2.85Å
731	T	61.8	Low	58.1	Low	22 Å²	22	70.4 Å²	70.4	14%	0.135	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-64.3	133.2	174.4	-43.7	0	0	0	0	109.4	T590 E735 Q736	T590-T731 PolarHBondContact O-N 3.31Å; T590-T731 PolarHBondContact O-OG1 3.41Å; T590-T731 WeakPolarHBondContact OG1-CB 3.45Å; T590-T731 PolarHBondContact OG1-OG1 2.9Å; T731-E735 HydrophobicContact CG2-CB 3.58Å; T731-E735 HydrophobicContact CG2-CG 4.46Å; T731-E735 WeakPolarHBondContact CG2-OE2 3.43Å; T731-Q736 HydrophobicContact CG2-CG 4.21Å; T731-Q736 PolarHBondContact O-NE2 3.07Å
732	T	62.9	Low	59.6	Low	47 Å²	47	74.8 Å²	74.8	29%	0.288	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-62	151.1	-174.8	60	0	0	0	0	111.7	S734 E735 Q736	T732-S734 WeakPolarHBondContact CB-OG 3.21Å; T732-S734 PolarHBondContact O-N 3.44Å; T732-S734 VanDerWaalsContact O-N 3.14Å; T732-S734 PolarHBondContact OG1-OG 2.93Å; T732-E735 PolarHBondContact N-OE2 2.89Å; T732-E735 PolarHBondContact O-N 3.26Å; T732-E735 WeakPolarHBondContact OG1-CB 3.23Å; T732-E735 WeakPolarHBondContact OG1-CG 3.34Å; T732-E735 PolarHBondContact OG1-N 2.94Å; T732-E735 PolarHBondContact OG1-OE2 3.18Å; T732-Q736 WeakPolarHBondContact O-CG 3.31Å; T732-Q736 PolarHBondContact O-N 3.37Å
733	Q	57.6	Low	61.6	Low	79 Å²	79	73.7 Å²	73.7	37%	0.369	38%	0.382	S	S	.	.	H	α-helix	trans	-55.1	-33.1	174.5	-74.4	-160.3	2.4	0	0	112.2	E505 R737	E505-Q733 PolarHBondContact OE2-NE2 3.32Å; Q733-R737 WeakPolarHBondContact O-CB 3.39Å; Q733-R737 PolarHBondContact O-N 3.48Å
734	S	59.1	Low	63.5	Low	81 Å²	81	68.9 Å²	68.9	57%	0.566	36%	0.356	S	S	*	.	H	α-helix	trans	-63.8	-44.4	175.6	39.9	0	0	0	0	112.8	T732 R737 E738	T732-S734 WeakPolarHBondContact CB-OG 3.21Å; T732-S734 PolarHBondContact O-N 3.44Å; T732-S734 VanDerWaalsContact O-N 3.14Å; T732-S734 PolarHBondContact OG1-OG 2.93Å; S734-R737 PolarHBondContact O-N 3.25Å; S734-E738 WeakPolarHBondContact O-CB 3.38Å; S734-E738 PolarHBondContact O-N 3.29Å
735	E	62	Low	65.5	Low	88 Å²	88	66.7 Å²	66.7	41%	0.411	35%	0.345	S	S	.	.	H	α-helix	trans	-68.9	-45.1	178.4	-74.4	163	153.7	0	0	110.6	T731 T732 R737 E738 E739	T731-E735 HydrophobicContact CG2-CB 3.58Å; T731-E735 HydrophobicContact CG2-CG 4.46Å; T731-E735 WeakPolarHBondContact CG2-OE2 3.43Å; T732-E735 PolarHBondContact N-OE2 2.89Å; T732-E735 PolarHBondContact O-N 3.26Å; T732-E735 WeakPolarHBondContact OG1-CB 3.23Å; T732-E735 WeakPolarHBondContact OG1-CG 3.34Å; T732-E735 PolarHBondContact OG1-N 2.94Å; T732-E735 PolarHBondContact OG1-OE2 3.18Å; E735-R737 VanDerWaalsContact C-N 3.28Å; E735-R737 PolarHBondContact O-N 2.7Å; E735-E738 PolarHBondContact O-N 3.49Å; E735-E738 VanDerWaalsContact O-N 3.12Å; E735-E739 WeakPolarHBondContact O-CG 3.18Å; E735-E739 PolarHBondContact O-N 3.27Å
736	Q	62.2	Low	67.6	Low	13 Å²	13	62 Å²	62	6%	0.061	33%	0.332	C	S	.	.	H	α-helix	trans	-60.9	-38.5	173.9	-65.2	-178.4	20.8	0	0	111.7	T731 T732 K740	T731-Q736 HydrophobicContact CG2-CG 4.21Å; T731-Q736 PolarHBondContact O-NE2 3.07Å; T732-Q736 WeakPolarHBondContact O-CG 3.31Å; T732-Q736 PolarHBondContact O-N 3.37Å; Q736-K740 WeakPolarHBondContact O-CB 3.44Å; Q736-K740 WeakPolarHBondContact O-CD 3.45Å; Q736-K740 WeakPolarHBondContact O-CG 3.35Å; Q736-K740 PolarHBondContact O-N 3.32Å
737	R	65.9	Low	69.6	Low	140 Å²	140	63.5 Å²	63.5	53%	0.528	32%	0.317	S	S	.	.	H	α-helix	trans	-67	-39.2	175.3	-174.7	179.6	-172.2	-166.9	5.2	111.4	Q733 S734 E735 K740 L741 E784	Q733-R737 WeakPolarHBondContact O-CB 3.39Å; Q733-R737 PolarHBondContact O-N 3.48Å; S734-R737 PolarHBondContact O-N 3.25Å; E735-R737 VanDerWaalsContact C-N 3.28Å; E735-R737 PolarHBondContact O-N 2.7Å; R737-K740 PolarHBondContact O-N 3.19Å; R737-L741 HydrophobicContact CG-CD1 4.24Å; R737-L741 HydrophobicContact CG-CG 4.48Å; R737-L741 WeakPolarHBondContact O-CB 3.49Å; R737-L741 VanDerWaalsContact O-CG 3.24Å; R737-L741 WeakPolarHBondContact O-CG 3.5Å; R737-L741 PolarHBondContact O-N 3.24Å; R737-E784 IonicContact CZ-OE1 3.76Å; R737-E784 IonicContact NE-OE1 2.63Å; R737-E784 PolarHBondContact NE-OE1 3.24Å; R737-E784 IonicContact NH2-OE1 2.75Å; R737-E784 PolarHBondContact NH2-OE1 3.19Å
738	E	69.2	Low	71.3	Confident	119 Å²	119	59.3 Å²	59.3	56%	0.556	29%	0.294	S	S	*	.	H	α-helix	trans	-64.9	-44.4	176.3	-173.5	164.1	-172.5	0	0	111.3	S734 E735 K740 L741 Q742	S734-E738 WeakPolarHBondContact O-CB 3.38Å; S734-E738 PolarHBondContact O-N 3.29Å; E735-E738 PolarHBondContact O-N 3.49Å; E735-E738 VanDerWaalsContact O-N 3.12Å; E738-K740 PolarHBondContact O-N 3.05Å; E738-L741 PolarHBondContact O-N 3.42Å; E738-Q742 WeakPolarHBondContact O-CB 3.49Å; E738-Q742 VanDerWaalsContact O-CG 3.27Å; E738-Q742 WeakPolarHBondContact O-CG 3.3Å; E738-Q742 PolarHBondContact O-N 3.14Å
739	E	69.1	Low	72.7	Confident	116 Å²	116	61.7 Å²	61.7	54%	0.542	30%	0.303	S	S	.	.	H	α-helix	trans	-59.5	-44.2	172.8	-71.7	-177.5	168.2	0	0	112	E735 L741 Q742 L743	E735-E739 WeakPolarHBondContact O-CG 3.18Å; E735-E739 PolarHBondContact O-N 3.27Å; E739-L741 PolarHBondContact O-N 3.14Å; E739-Q742 WeakPolarHBondContact O-CB 3.37Å; E739-Q742 PolarHBondContact O-N 3.06Å; E739-L743 PolarHBondContact O-N 3.49Å
740	K	71.5	Confident	73.8	Confident	67 Å²	67	62.3 Å²	62.3	29%	0.291	31%	0.313	S	S	.	.	H	α-helix	trans	-59.8	-45.6	174.5	-73.2	165.8	-172.8	175	0	111.7	Q736 R737 E738 Q742 L743 F744 T778	Q736-K740 WeakPolarHBondContact O-CB 3.44Å; Q736-K740 WeakPolarHBondContact O-CD 3.45Å; Q736-K740 WeakPolarHBondContact O-CG 3.35Å; Q736-K740 PolarHBondContact O-N 3.32Å; R737-K740 PolarHBondContact O-N 3.19Å; E738-K740 PolarHBondContact O-N 3.05Å; K740-Q742 VanDerWaalsContact C-N 3.31Å; K740-Q742 PolarHBondContact O-N 3.03Å; K740-L743 WeakPolarHBondContact O-CB 3.29Å; K740-L743 PolarHBondContact O-N 3.11Å; K740-F744 WeakPolarHBondContact O-CD2 3.37Å; K740-F744 PolarHBondContact O-N 2.86Å; K740-T778 HydrophobicContact CD-CG2 3.98Å; K740-T778 HydrophobicContact CG-CG2 4.47Å
741	L	77.3	Confident	75	Confident	38 Å²	38	63.2 Å²	63.2	20%	0.199	32%	0.317	C	S	.	.	H	α-helix	trans	-66.2	-33.5	177.3	-72.8	174.4	0	0	0	112.1	R737 E738 E739 F744 W745 F788	R737-L741 HydrophobicContact CG-CD1 4.24Å; R737-L741 HydrophobicContact CG-CG 4.48Å; R737-L741 WeakPolarHBondContact O-CB 3.49Å; R737-L741 VanDerWaalsContact O-CG 3.24Å; R737-L741 WeakPolarHBondContact O-CG 3.5Å; R737-L741 PolarHBondContact O-N 3.24Å; E738-L741 PolarHBondContact O-N 3.42Å; E739-L741 PolarHBondContact O-N 3.14Å; L741-F744 HydrophobicContact CD2-CD2 4.45Å; L741-W745 VanDerWaalsContact O-CB 3.28Å; L741-W745 WeakPolarHBondContact O-CB 3.38Å; L741-W745 PolarHBondContact O-N 3.31Å; L741-F788 HydrophobicContact CB-CE2 3.85Å; L741-F788 HydrophobicContact CB-CZ 4.18Å; L741-F788 HydrophobicContact CD1-CD2 4.31Å; L741-F788 HydrophobicContact CD1-CE2 4.31Å; L741-F788 HydrophobicContact CD2-CD2 3.69Å; L741-F788 HydrophobicContact CD2-CE2 3.86Å; L741-F788 HydrophobicContact CD2-CG 4.03Å; L741-F788 HydrophobicContact CD2-CZ 4.33Å; L741-F788 HydrophobicContact CG-CD2 4.39Å; L741-F788 HydrophobicContact CG-CE2 4.22Å; L741-F788 WeakPolarHBondContact O-CZ 3.32Å
742	Q	80.5	Confident	76.3	Confident	114 Å²	114	62.3 Å²	62.3	53%	0.533	31%	0.312	S	S	.	.	H	α-helix	trans	-67.8	-39.7	172.4	-72.8	178.1	16.8	0	0	111.7	E738 E739 K740 W745 A746	E738-Q742 WeakPolarHBondContact O-CB 3.49Å; E738-Q742 VanDerWaalsContact O-CG 3.27Å; E738-Q742 WeakPolarHBondContact O-CG 3.3Å; E738-Q742 PolarHBondContact O-N 3.14Å; E739-Q742 WeakPolarHBondContact O-CB 3.37Å; E739-Q742 PolarHBondContact O-N 3.06Å; K740-Q742 VanDerWaalsContact C-N 3.31Å; K740-Q742 PolarHBondContact O-N 3.03Å; Q742-W745 WeakPolarHBondContact O-CB 3.42Å; Q742-W745 PolarHBondContact O-N 3.03Å; Q742-A746 PolarHBondContact O-N 3.49Å
743	L	80.8	Confident	77.5	Confident	66 Å²	66	64.6 Å²	64.6	35%	0.346	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-50.9	173.2	-175.7	67.8	0	0	0	111	E739 K740 W745 A746 Y747	E739-L743 PolarHBondContact O-N 3.49Å; K740-L743 WeakPolarHBondContact O-CB 3.29Å; K740-L743 PolarHBondContact O-N 3.11Å; L743-W745 PolarHBondContact O-N 3.01Å; L743-A746 WeakPolarHBondContact O-CB 3.31Å; L743-A746 PolarHBondContact O-N 2.89Å; L743-A746 VanDerWaalsContact O-N 3.09Å; L743-Y747 HydrophobicContact CD1-CD2 4.19Å; L743-Y747 HydrophobicContact CD1-CE2 3.84Å; L743-Y747 HydrophobicContact CG-CD2 4.13Å; L743-Y747 HydrophobicContact CG-CE2 4.03Å; L743-Y747 WeakPolarHBondContact O-CD2 3.46Å; L743-Y747 PolarHBondContact O-N 3.13Å
744	F	83.8	Confident	78.9	Confident	14 Å²	14	67.2 Å²	67.2	6%	0.061	34%	0.342	C	S	.	.	H	α-helix	trans	-57.1	-40.4	175.3	-71.5	-43.6	0	0	0	111.7	K740 L741 Y747 I748 L767 V771 M780	K740-F744 WeakPolarHBondContact O-CD2 3.37Å; K740-F744 PolarHBondContact O-N 2.86Å; L741-F744 HydrophobicContact CD2-CD2 4.45Å; F744-Y747 PolarHBondContact O-N 3.24Å; F744-I748 HydrophobicContact CB-CD1 4.49Å; F744-I748 WeakPolarHBondContact O-CB 3.42Å; F744-I748 WeakPolarHBondContact O-CD1 3.2Å; F744-I748 WeakPolarHBondContact O-CG1 3.45Å; F744-I748 PolarHBondContact O-N 3.35Å; F744-L767 HydrophobicContact CD1-CD2 3.95Å; F744-V771 HydrophobicContact CD1-CG1 4.16Å; F744-V771 HydrophobicContact CD1-CG2 4.31Å; F744-V771 HydrophobicContact CE1-CB 4.04Å; F744-V771 HydrophobicContact CE1-CG1 3.55Å; F744-V771 HydrophobicContact CE1-CG2 4.28Å; F744-V771 HydrophobicContact CZ-CG1 4.47Å; F744-M780 HydrophobicContact CD1-CE 4.22Å; F744-M780 HydrophobicContact CD2-CE 3.91Å; F744-M780 HydrophobicContact CD2-SD 3.9Å; F744-M780 HydrophobicContact CE1-CE 4.37Å; F744-M780 HydrophobicContact CE2-CB 4.06Å; F744-M780 HydrophobicContact CE2-CE 4.11Å; F744-M780 HydrophobicContact CE2-SD 4.01Å; F744-M780 HydrophobicContact CG-CE 3.98Å; F744-M780 HydrophobicContact CZ-CB 4.05Å; F744-M780 HydrophobicContact CZ-CE 4.33Å
745	W	88.3	Confident	80.1	Confident	30 Å²	30	66.9 Å²	66.9	11%	0.114	33%	0.334	C	S	.	.	H	α-helix	trans	-60.2	-44.9	175	179.2	-119.2	0	0	0	112.4	L741 Q742 L743 Y747 I748 Q749 F788 K792 Q797 L798 L807	L741-W745 VanDerWaalsContact O-CB 3.28Å; L741-W745 WeakPolarHBondContact O-CB 3.38Å; L741-W745 PolarHBondContact O-N 3.31Å; Q742-W745 WeakPolarHBondContact O-CB 3.42Å; Q742-W745 PolarHBondContact O-N 3.03Å; L743-W745 PolarHBondContact O-N 3.01Å; W745-Y747 VanDerWaalsContact C-N 3.34Å; W745-Y747 PolarHBondContact O-N 3.1Å; W745-I748 HydrophobicContact CE3-CG2 4.48Å; W745-I748 HydrophobicContact CZ3-CG2 4.39Å; W745-I748 PolarHBondContact O-N 3.42Å; W745-Q749 HydrophobicContact CD2-CG 3.84Å; W745-Q749 VanDerWaalsContact CE2-CG 3.47Å; W745-Q749 HydrophobicContact CE3-CG 4.22Å; W745-Q749 HydrophobicContact CG-CG 4.4Å; W745-Q749 HydrophobicContact CH2-CG 3.9Å; W745-Q749 HydrophobicContact CZ2-CG 3.51Å; W745-Q749 VanDerWaalsContact CZ2-NE2 3.31Å; W745-Q749 HydrophobicContact CZ3-CG 4.24Å; W745-Q749 VanDerWaalsContact NE1-OE1 3.15Å; W745-Q749 WeakPolarHBondContact O-CB 3.29Å; W745-Q749 VanDerWaalsContact O-CG 3.3Å; W745-Q749 WeakPolarHBondContact O-CG 3.47Å; W745-Q749 PolarHBondContact O-N 3.44Å; W745-F788 HydrophobicContact CB-CE1 4.41Å; W745-F788 HydrophobicContact CB-CZ 4.08Å; W745-K792 HydrophobicContact CD2-CD 4.2Å; W745-K792 HydrophobicContact CE3-CD 4.02Å; W745-K792 HydrophobicContact CE3-CG 3.99Å; W745-K792 HydrophobicContact CH2-CD 4.36Å; W745-K792 HydrophobicContact CZ3-CB 4.18Å; W745-K792 HydrophobicContact CZ3-CD 4.11Å; W745-K792 HydrophobicContact CZ3-CG 3.95Å; W745-Q797 HydrophobicContact CH2-CB 3.85Å; W745-Q797 HydrophobicContact CZ2-CB 3.83Å; W745-L798 HydrophobicContact CH2-CD1 4.43Å; W745-L798 HydrophobicContact CH2-CD2 4.13Å; W745-L798 HydrophobicContact CH2-CG 3.85Å; W745-L798 HydrophobicContact CZ3-CD1 3.84Å; W745-L798 HydrophobicContact CZ3-CD2 4.14Å; W745-L798 HydrophobicContact CZ3-CG 3.76Å; W745-L807 HydrophobicContact CH2-CD2 4.29Å
746	A	86.2	Confident	81.1	Confident	51 Å²	51	69.8 Å²	69.8	42%	0.421	35%	0.347	S	S	.	.	H	α-helix	trans	-60.1	-43.3	176.7	0	0	0	0	0	112	Q742 L743 Q749 A750	Q742-A746 PolarHBondContact O-N 3.49Å; L743-A746 WeakPolarHBondContact O-CB 3.31Å; L743-A746 PolarHBondContact O-N 2.89Å; L743-A746 VanDerWaalsContact O-N 3.09Å; A746-Q749 PolarHBondContact O-N 2.69Å; A746-A750 WeakPolarHBondContact O-CB 3.49Å; A746-A750 PolarHBondContact O-N 2.94Å
747	Y	86.2	Confident	82.3	Confident	98 Å²	98	72.7 Å²	72.7	38%	0.384	37%	0.366	S	S	.	.	H	α-helix	trans	-64.3	-44.9	174.7	-86.1	-84.7	0	0	0	112.5	L743 F744 W745 Q749 A750 M751 V771	L743-Y747 HydrophobicContact CD1-CD2 4.19Å; L743-Y747 HydrophobicContact CD1-CE2 3.84Å; L743-Y747 HydrophobicContact CG-CD2 4.13Å; L743-Y747 HydrophobicContact CG-CE2 4.03Å; L743-Y747 WeakPolarHBondContact O-CD2 3.46Å; L743-Y747 PolarHBondContact O-N 3.13Å; F744-Y747 PolarHBondContact O-N 3.24Å; W745-Y747 VanDerWaalsContact C-N 3.34Å; W745-Y747 PolarHBondContact O-N 3.1Å; Y747-Q749 VanDerWaalsContact C-N 3.34Å; Y747-Q749 PolarHBondContact O-N 3.28Å; Y747-A750 PolarHBondContact O-N 3.46Å; Y747-M751 WeakPolarHBondContact O-CB 3.32Å; Y747-M751 WeakPolarHBondContact O-CE 3.26Å; Y747-M751 VanDerWaalsContact O-CG 3.3Å; Y747-M751 WeakPolarHBondContact O-CG 3.42Å; Y747-M751 PolarHBondContact O-N 2.85Å; Y747-V771 HydrophobicContact CD1-CG2 4.29Å; Y747-V771 HydrophobicContact CD2-CG2 4.1Å; Y747-V771 HydrophobicContact CE1-CG2 4.48Å; Y747-V771 HydrophobicContact CE2-CG2 4.32Å; Y747-V771 HydrophobicContact CG-CG2 4.1Å
748	I	88.1	Confident	83.4	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-62.9	-42.4	177.8	-68.9	160.5	0	0	0	110.5	F744 W745 M751 L752 I763 L767 L785 F788 L789	F744-I748 HydrophobicContact CB-CD1 4.49Å; F744-I748 WeakPolarHBondContact O-CB 3.42Å; F744-I748 WeakPolarHBondContact O-CD1 3.2Å; F744-I748 WeakPolarHBondContact O-CG1 3.45Å; F744-I748 PolarHBondContact O-N 3.35Å; W745-I748 HydrophobicContact CE3-CG2 4.48Å; W745-I748 HydrophobicContact CZ3-CG2 4.39Å; W745-I748 PolarHBondContact O-N 3.42Å; I748-M751 PolarHBondContact O-N 2.94Å; I748-L752 HydrophobicContact CG2-CD1 3.71Å; I748-L752 HydrophobicContact CG2-CG 4.28Å; I748-L752 WeakPolarHBondContact O-CB 3.32Å; I748-L752 WeakPolarHBondContact O-CG 3.31Å; I748-L752 PolarHBondContact O-N 3.46Å; I748-I763 HydrophobicContact CD1-CG2 4.37Å; I748-I763 HydrophobicContact CG1-CG2 3.94Å; I748-L767 HydrophobicContact CD1-CD1 4.05Å; I748-L767 HydrophobicContact CG1-CD1 4.02Å; I748-L767 HydrophobicContact CG1-CD2 4.3Å; I748-L785 HydrophobicContact CD1-CD1 4.1Å; I748-F788 HydrophobicContact CD1-CD1 4.41Å; I748-F788 HydrophobicContact CD1-CE1 4.15Å; I748-L789 HydrophobicContact CD1-CD2 4.1Å; I748-L789 HydrophobicContact CG2-CD2 4.23Å
749	Q	88.2	Confident	84.4	Confident	75 Å²	75	63.3 Å²	63.3	35%	0.35	33%	0.332	S	S	.	.	H	α-helix	trans	-60.8	-46.6	174.6	-76.1	-176.6	-56	0	0	111.1	W745 A746 Y747 M751 L752 T753 L807	W745-Q749 HydrophobicContact CD2-CG 3.84Å; W745-Q749 VanDerWaalsContact CE2-CG 3.47Å; W745-Q749 HydrophobicContact CE3-CG 4.22Å; W745-Q749 HydrophobicContact CG-CG 4.4Å; W745-Q749 HydrophobicContact CH2-CG 3.9Å; W745-Q749 HydrophobicContact CZ2-CG 3.51Å; W745-Q749 VanDerWaalsContact CZ2-NE2 3.31Å; W745-Q749 HydrophobicContact CZ3-CG 4.24Å; W745-Q749 VanDerWaalsContact NE1-OE1 3.15Å; W745-Q749 WeakPolarHBondContact O-CB 3.29Å; W745-Q749 VanDerWaalsContact O-CG 3.3Å; W745-Q749 WeakPolarHBondContact O-CG 3.47Å; W745-Q749 PolarHBondContact O-N 3.44Å; A746-Q749 PolarHBondContact O-N 2.69Å; Y747-Q749 VanDerWaalsContact C-N 3.34Å; Y747-Q749 PolarHBondContact O-N 3.28Å; Q749-M751 PolarHBondContact O-N 3.41Å; Q749-L752 PolarHBondContact O-N 2.88Å; Q749-T753 VanDerWaalsContact O-CB 3.25Å; Q749-T753 WeakPolarHBondContact O-CB 3.49Å; Q749-T753 PolarHBondContact O-N 3.46Å; Q749-T753 PolarHBondContact O-OG1 3.39Å; Q749-L807 HydrophobicContact CG-CD2 4.36Å
750	A	86.2	Confident	85.4	Confident	49 Å²	49	59.2 Å²	59.2	41%	0.405	31%	0.314	S	S	.	.	H	α-helix	trans	-62	-42.8	176.9	0	0	0	0	0	111.9	A746 Y747 T753 N754	A746-A750 WeakPolarHBondContact O-CB 3.49Å; A746-A750 PolarHBondContact O-N 2.94Å; Y747-A750 PolarHBondContact O-N 3.46Å; A750-T753 PolarHBondContact O-N 2.85Å; A750-N754 WeakPolarHBondContact O-CB 3.25Å; A750-N754 PolarHBondContact O-N 2.67Å; A750-N754 VanDerWaalsContact O-N 3.09Å; A750-N754 PolarHBondContact O-ND2 2.87Å
751	M	88.4	Confident	86.1	Confident	19 Å²	19	63.6 Å²	63.6	9%	0.094	34%	0.335	C	S	.	.	H	α-helix	trans	-61.5	-49.2	176.2	-75.5	-176.6	-112.4	0	0	112	Y747 I748 Q749 T753 N754 L755 M758 M766 L767	Y747-M751 WeakPolarHBondContact O-CB 3.32Å; Y747-M751 WeakPolarHBondContact O-CE 3.26Å; Y747-M751 VanDerWaalsContact O-CG 3.3Å; Y747-M751 WeakPolarHBondContact O-CG 3.42Å; Y747-M751 PolarHBondContact O-N 2.85Å; I748-M751 PolarHBondContact O-N 2.94Å; Q749-M751 PolarHBondContact O-N 3.41Å; M751-T753 VanDerWaalsContact C-N 3.32Å; M751-T753 PolarHBondContact O-N 2.96Å; M751-N754 PolarHBondContact O-N 3.22Å; M751-L755 VanDerWaalsContact O-CB 3.27Å; M751-L755 WeakPolarHBondContact O-CB 3.19Å; M751-L755 PolarHBondContact O-N 3.4Å; M751-M758 HydrophobicContact CB-SD 3.88Å; M751-M758 HydrophobicContact SD-CE 4.44Å; M751-M766 HydrophobicContact CE-CB 4.41Å; M751-M766 HydrophobicContact CG-SD 4.47Å; M751-M766 HydrophobicContact SD-CB 3.52Å; M751-M766 VanDerWaalsContact SD-CB 3.52Å; M751-M766 HydrophobicContact SD-CG 4.32Å; M751-M766 HydrophobicContact SD-SD 3.89Å; M751-L767 HydrophobicContact CE-CD2 3.46Å; M751-L767 VanDerWaalsContact CE-CD2 3.46Å; M751-L767 HydrophobicContact CE-CG 3.85Å
752	L	89	Confident	86.6	Confident	3 Å²	3	68.4 Å²	68.4	2%	0.016	35%	0.351	C	S	.	.	H	α-helix	trans	-73.2	-23.6	-179.3	-67.9	174.8	0	0	0	113	I748 Q749 E756 M758 L798 Y805 L807	I748-L752 HydrophobicContact CG2-CD1 3.71Å; I748-L752 HydrophobicContact CG2-CG 4.28Å; I748-L752 WeakPolarHBondContact O-CB 3.32Å; I748-L752 WeakPolarHBondContact O-CG 3.31Å; I748-L752 PolarHBondContact O-N 3.46Å; Q749-L752 PolarHBondContact O-N 2.88Å; L752-E756 WeakPolarHBondContact O-CA 3.46Å; L752-E756 PolarHBondContact O-N 3.03Å; L752-M758 HydrophobicContact CD2-CB 3.89Å; L752-M758 HydrophobicContact CD2-CG 3.97Å; L752-M758 HydrophobicContact CD2-SD 4.36Å; L752-L798 HydrophobicContact CD1-CD2 3.36Å; L752-Y805 WeakPolarHBondContact CD2-O 3.3Å; L752-L807 HydrophobicContact CB-CD1 3.83Å; L752-L807 HydrophobicContact CB-CG 3.8Å; L752-L807 HydrophobicContact CD1-CG 4.37Å
753	T	88.2	Confident	86.9	Confident	95 Å²	95	63 Å²	63	58%	0.583	33%	0.326	S	S	*	.	H	α-helix	trans	-70.8	-39.7	171.6	-57.4	0	0	0	0	110.8	Q749 A750 M751 L807	Q749-T753 VanDerWaalsContact O-CB 3.25Å; Q749-T753 WeakPolarHBondContact O-CB 3.49Å; Q749-T753 PolarHBondContact O-N 3.46Å; Q749-T753 PolarHBondContact O-OG1 3.39Å; A750-T753 PolarHBondContact O-N 2.85Å; M751-T753 VanDerWaalsContact C-N 3.32Å; M751-T753 PolarHBondContact O-N 2.96Å; T753-L807 WeakPolarHBondContact OG1-CD1 3.3Å
754	N	86.6	Confident	87.1	Confident	134 Å²	134	61.5 Å²	61.5	72%	0.717	32%	0.317	S	S	*	.	H	α-helix	trans	-83.9	-33.3	-178.5	-70.4	-47.1	0	0	0	113.9	A750 M751	A750-N754 WeakPolarHBondContact O-CB 3.25Å; A750-N754 PolarHBondContact O-N 2.67Å; A750-N754 VanDerWaalsContact O-N 3.09Å; A750-N754 PolarHBondContact O-ND2 2.87Å; M751-N754 PolarHBondContact O-N 3.22Å
755	L	85.3	Confident	87.2	Confident	75 Å²	75	63.7 Å²	63.7	39%	0.393	33%	0.334	S	S	.	.	H	α-helix	trans	-108.1	-2.1	-173.4	-61.1	170.2	0	0	0	113.5	M751 T757 M758 M766	M751-L755 VanDerWaalsContact O-CB 3.27Å; M751-L755 WeakPolarHBondContact O-CB 3.19Å; M751-L755 PolarHBondContact O-N 3.4Å; L755-T757 PolarHBondContact O-N 3.33Å; L755-M758 HydrophobicContact CB-CG 4.28Å; L755-M758 HydrophobicContact CB-SD 4.39Å; L755-M758 HydrophobicContact CD1-CE 4.33Å; L755-M758 HydrophobicContact CD1-CG 4.41Å; L755-M758 HydrophobicContact CD1-SD 3.72Å; L755-M766 HydrophobicContact CD1-CE 3.92Å; L755-M766 HydrophobicContact CD1-SD 3.94Å
756	E	82.4	Confident	86.9	Confident	148 Å²	148	64.1 Å²	64.1	69%	0.692	34%	0.338	S	S	*	.	S	Bend	trans	60.7	-43.9	-179	-59.4	-174.7	170.8	0	0	116.2	L752	L752-E756 WeakPolarHBondContact O-CA 3.46Å; L752-E756 PolarHBondContact O-N 3.03Å
757	T	87.5	Confident	86.6	Confident	74 Å²	74	62.1 Å²	62.1	45%	0.454	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	138.1	-175.3	67.8	0	0	0	0	111.8	L755 Y805 R806	L755-T757 PolarHBondContact O-N 3.33Å; T757-Y805 WeakPolarHBondContact CA-O 3.39Å; T757-R806 HydrophobicContact CG2-CB 4.1Å
758	M	88.7	Confident	86.2	Confident	4 Å²	4	64.2 Å²	64.2	2%	0.02	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	149.6	178.7	-66.7	-176.8	67.9	0	0	113.2	M751 L752 L755 R762 I763 M766 I804 Y805	M751-M758 HydrophobicContact CB-SD 3.88Å; M751-M758 HydrophobicContact SD-CE 4.44Å; L752-M758 HydrophobicContact CD2-CB 3.89Å; L752-M758 HydrophobicContact CD2-CG 3.97Å; L752-M758 HydrophobicContact CD2-SD 4.36Å; L755-M758 HydrophobicContact CB-CG 4.28Å; L755-M758 HydrophobicContact CB-SD 4.39Å; L755-M758 HydrophobicContact CD1-CE 4.33Å; L755-M758 HydrophobicContact CD1-CG 4.41Å; L755-M758 HydrophobicContact CD1-SD 3.72Å; M758-R762 HydrophobicContact CE-CB 3.93Å; M758-R762 HydrophobicContact CE-CG 3.66Å; M758-R762 WeakPolarHBondContact CE-O 3.45Å; M758-I763 HydrophobicContact CB-CD1 4.05Å; M758-I763 HydrophobicContact CB-CG1 3.68Å; M758-I763 HydrophobicContact CE-CG1 3.96Å; M758-I763 HydrophobicContact SD-CG1 4.16Å; M758-M766 HydrophobicContact CE-CG 4.15Å; M758-M766 HydrophobicContact CE-SD 3.31Å; M758-M766 WeakPolarHBondContact CE-SD 3.03Å; M758-M766 HydrophobicContact SD-SD 4.24Å; M758-I804 WeakPolarHBondContact O-CG2 3.07Å; M758-Y805 PolarHBondContact N-O 3.36Å; M758-Y805 PolarHBondContact O-N 2.93Å
759	T	91.1	Very high	85.4	Confident	59 Å²	59	70 Å²	70	36%	0.362	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	159.8	171.8	60.8	0	0	0	0	111.4	E761 R762 I763 I804	T759-E761 VanDerWaalsContact C-N 3.3Å; T759-E761 PolarHBondContact O-N 3.43Å; T759-R762 PolarHBondContact O-N 2.85Å; T759-R762 WeakPolarHBondContact OG1-CB 3.45Å; T759-R762 PolarHBondContact OG1-N 2.98Å; T759-I763 WeakPolarHBondContact O-CG1 3.24Å; T759-I763 PolarHBondContact O-N 3.23Å; T759-I804 HydrophobicContact CG2-CG1 4.38Å
760	L	88.8	Confident	84.6	Confident	30 Å²	30	71.6 Å²	71.6	16%	0.157	36%	0.361	C	S	.	.	H	α-helix	trans	-51.7	-49.1	176.1	-179.2	63.7	0	0	0	112	R762 I763 H764 V782 L785 Q786 L789 Y805	L760-R762 VanDerWaalsContact C-N 3.3Å; L760-R762 PolarHBondContact O-N 3.08Å; L760-I763 PolarHBondContact O-N 2.98Å; L760-H764 WeakPolarHBondContact O-CB 3.39Å; L760-H764 PolarHBondContact O-N 3.11Å; L760-V782 HydrophobicContact CD2-CG1 4.09Å; L760-V782 HydrophobicContact CG-CG1 4.47Å; L760-L785 HydrophobicContact CD1-CD2 3.91Å; L760-L785 HydrophobicContact CD1-CG 3.88Å; L760-Q786 HydrophobicContact CD1-CB 4.21Å; L760-Q786 HydrophobicContact CD2-CB 3.98Å; L760-Q786 HydrophobicContact CD2-CG 4.1Å; L760-L789 HydrophobicContact CD1-CD1 3.69Å; L760-Y805 HydrophobicContact CB-CE2 4Å; L760-Y805 HydrophobicContact CD1-CE2 4.35Å
761	E	87.4	Confident	83.5	Confident	158 Å²	158	69.6 Å²	69.6	74%	0.738	34%	0.344	S	S	*	.	H	α-helix	trans	-61.3	-38.9	-178.2	-64.8	175.2	-179.6	0	0	112.1	T759 H764 S765	T759-E761 VanDerWaalsContact C-N 3.3Å; T759-E761 PolarHBondContact O-N 3.43Å; E761-H764 PolarHBondContact O-N 3.39Å; E761-S765 WeakPolarHBondContact O-CB 3.29Å; E761-S765 PolarHBondContact O-N 2.96Å; E761-S765 PolarHBondContact O-OG 2.81Å
762	R	86.7	Confident	81.8	Confident	139 Å²	139	70 Å²	70	53%	0.525	35%	0.351	S	S	.	.	H	α-helix	trans	-74.7	-34.8	-179.2	-160.7	176.5	175.6	163	-4.2	112.1	M758 T759 L760 S765 M766	M758-R762 HydrophobicContact CE-CB 3.93Å; M758-R762 HydrophobicContact CE-CG 3.66Å; M758-R762 WeakPolarHBondContact CE-O 3.45Å; T759-R762 PolarHBondContact O-N 2.85Å; T759-R762 WeakPolarHBondContact OG1-CB 3.45Å; T759-R762 PolarHBondContact OG1-N 2.98Å; L760-R762 VanDerWaalsContact C-N 3.3Å; L760-R762 PolarHBondContact O-N 3.08Å; R762-S765 PolarHBondContact O-OG 3.35Å; R762-S765 VanDerWaalsContact O-OG 3.09Å; R762-M766 WeakPolarHBondContact O-CB 3.33Å; R762-M766 WeakPolarHBondContact O-CG 3.34Å; R762-M766 PolarHBondContact O-N 2.93Å
763	I	87.3	Confident	79.8	Confident	1 Å²	1	75.4 Å²	75.4	1%	0.005	38%	0.384	C	S	.	.	H	α-helix	trans	-64.4	-46.8	171.7	-65.2	169.4	0	0	0	109	I748 M758 T759 L760 S765 M766 L767 L785 L789 Y805	I748-I763 HydrophobicContact CD1-CG2 4.37Å; I748-I763 HydrophobicContact CG1-CG2 3.94Å; M758-I763 HydrophobicContact CB-CD1 4.05Å; M758-I763 HydrophobicContact CB-CG1 3.68Å; M758-I763 HydrophobicContact CE-CG1 3.96Å; M758-I763 HydrophobicContact SD-CG1 4.16Å; T759-I763 WeakPolarHBondContact O-CG1 3.24Å; T759-I763 PolarHBondContact O-N 3.23Å; L760-I763 PolarHBondContact O-N 2.98Å; I763-S765 PolarHBondContact O-N 3.5Å; I763-M766 PolarHBondContact O-N 3.14Å; I763-L767 HydrophobicContact CG2-CD1 3.71Å; I763-L767 HydrophobicContact CG2-CG 4.29Å; I763-L767 WeakPolarHBondContact O-CB 3.4Å; I763-L767 VanDerWaalsContact O-CG 3.28Å; I763-L767 WeakPolarHBondContact O-CG 3.48Å; I763-L767 PolarHBondContact O-N 3.24Å; I763-L785 HydrophobicContact CB-CD2 4.47Å; I763-L785 HydrophobicContact CG2-CD1 4.19Å; I763-L785 HydrophobicContact CG2-CD2 4.06Å; I763-L789 HydrophobicContact CD1-CD1 4.08Å; I763-Y805 HydrophobicContact CD1-CD2 3.83Å; I763-Y805 HydrophobicContact CD1-CG 4.22Å
764	H	85.5	Confident	78.1	Confident	35 Å²	35	72 Å²	72	16%	0.162	37%	0.368	C	S	.	.	H	α-helix	trans	-59.1	-48	177.7	-171.2	-102.4	0	0	0	112.2	L760 E761 M766 L767 R768 M780 V782 L785	L760-H764 WeakPolarHBondContact O-CB 3.39Å; L760-H764 PolarHBondContact O-N 3.11Å; E761-H764 PolarHBondContact O-N 3.39Å; H764-M766 VanDerWaalsContact C-N 3.35Å; H764-M766 PolarHBondContact O-N 2.87Å; H764-L767 PolarHBondContact O-N 3.49Å; H764-R768 WeakPolarHBondContact O-CB 3.44Å; H764-R768 PolarHBondContact O-N 3.27Å; H764-M780 PolarHBondContact NE2-O 2.89Å; H764-V782 VanDerWaalsContact CE1-CG2 3.48Å; H764-V782 WeakPolarHBondContact CE1-CG2 3.46Å; H764-L785 HydrophobicContact CB-CD2 3.67Å
765	S	84.8	Confident	75.9	Confident	60 Å²	60	72 Å²	72	42%	0.42	38%	0.375	S	S	.	.	H	α-helix	trans	-64.1	-39	179.4	74.4	0	0	0	0	112.5	E761 R762 I763 R768 M769	E761-S765 WeakPolarHBondContact O-CB 3.29Å; E761-S765 PolarHBondContact O-N 2.96Å; E761-S765 PolarHBondContact O-OG 2.81Å; R762-S765 PolarHBondContact O-OG 3.35Å; R762-S765 VanDerWaalsContact O-OG 3.09Å; I763-S765 PolarHBondContact O-N 3.5Å; S765-R768 PolarHBondContact O-N 3.35Å; S765-M769 WeakPolarHBondContact O-CB 3.45Å; S765-M769 PolarHBondContact O-N 3Å
766	M	82.3	Confident	74.1	Confident	39 Å²	39	73.1 Å²	73.1	19%	0.192	38%	0.38	C	S	.	.	H	α-helix	trans	-70.6	-41.3	177.8	-77.6	-170.1	155.1	0	0	111.8	M751 L755 M758 R762 I763 H764 R768 M769 F770	M751-M766 HydrophobicContact CE-CB 4.41Å; M751-M766 HydrophobicContact CG-SD 4.47Å; M751-M766 HydrophobicContact SD-CB 3.52Å; M751-M766 VanDerWaalsContact SD-CB 3.52Å; M751-M766 HydrophobicContact SD-CG 4.32Å; M751-M766 HydrophobicContact SD-SD 3.89Å; L755-M766 HydrophobicContact CD1-CE 3.92Å; L755-M766 HydrophobicContact CD1-SD 3.94Å; M758-M766 HydrophobicContact CE-CG 4.15Å; M758-M766 HydrophobicContact CE-SD 3.31Å; M758-M766 WeakPolarHBondContact CE-SD 3.03Å; M758-M766 HydrophobicContact SD-SD 4.24Å; R762-M766 WeakPolarHBondContact O-CB 3.33Å; R762-M766 WeakPolarHBondContact O-CG 3.34Å; R762-M766 PolarHBondContact O-N 2.93Å; I763-M766 PolarHBondContact O-N 3.14Å; H764-M766 VanDerWaalsContact C-N 3.35Å; H764-M766 PolarHBondContact O-N 2.87Å; M766-R768 VanDerWaalsContact C-N 3.29Å; M766-R768 PolarHBondContact O-N 3.32Å; M766-M769 PolarHBondContact O-N 3.28Å; M766-F770 HydrophobicContact CB-CD2 4.05Å; M766-F770 HydrophobicContact CB-CE2 4.18Å; M766-F770 HydrophobicContact CG-CD2 4.46Å; M766-F770 HydrophobicContact CG-CE2 4.09Å; M766-F770 WeakPolarHBondContact O-CB 3.37Å; M766-F770 WeakPolarHBondContact O-CD2 3.41Å; M766-F770 PolarHBondContact O-N 3.29Å
767	L	81.1	Confident	72.4	Confident	8 Å²	8	70.6 Å²	70.6	4%	0.042	38%	0.375	C	S	.	.	H	α-helix	trans	-61.6	-41.2	173.4	-71.7	171	0	0	0	111	F744 I748 M751 I763 H764 M769 V771 A772 M780 L785	F744-L767 HydrophobicContact CD1-CD2 3.95Å; I748-L767 HydrophobicContact CD1-CD1 4.05Å; I748-L767 HydrophobicContact CG1-CD1 4.02Å; I748-L767 HydrophobicContact CG1-CD2 4.3Å; M751-L767 HydrophobicContact CE-CD2 3.46Å; M751-L767 VanDerWaalsContact CE-CD2 3.46Å; M751-L767 HydrophobicContact CE-CG 3.85Å; I763-L767 HydrophobicContact CG2-CD1 3.71Å; I763-L767 HydrophobicContact CG2-CG 4.29Å; I763-L767 WeakPolarHBondContact O-CB 3.4Å; I763-L767 VanDerWaalsContact O-CG 3.28Å; I763-L767 WeakPolarHBondContact O-CG 3.48Å; I763-L767 PolarHBondContact O-N 3.24Å; H764-L767 PolarHBondContact O-N 3.49Å; L767-M769 VanDerWaalsContact C-N 3.35Å; L767-M769 PolarHBondContact O-N 3.49Å; L767-V771 HydrophobicContact CD2-CG2 3.83Å; L767-V771 WeakPolarHBondContact O-CA 3.32Å; L767-V771 WeakPolarHBondContact O-CB 3.45Å; L767-V771 PolarHBondContact O-N 2.93Å; L767-A772 PolarHBondContact O-N 3.33Å; L767-M780 HydrophobicContact CD1-CE 3.46Å; L767-M780 VanDerWaalsContact CD1-CE 3.46Å; L767-L785 HydrophobicContact CD1-CD1 3.93Å; L767-L785 HydrophobicContact CD1-CD2 4.29Å
768	R	75.9	Confident	70.7	Confident	142 Å²	142	68 Å²	68	54%	0.536	36%	0.359	S	S	.	.	H	α-helix	trans	-63.2	-41.1	174	-158.4	179.5	-163.9	162.1	10.3	112.1	H764 S765 M766 A772 E779	H764-R768 WeakPolarHBondContact O-CB 3.44Å; H764-R768 PolarHBondContact O-N 3.27Å; S765-R768 PolarHBondContact O-N 3.35Å; M766-R768 VanDerWaalsContact C-N 3.29Å; M766-R768 PolarHBondContact O-N 3.32Å; R768-A772 HydrophobicContact CG-CB 4.28Å; R768-A772 WeakPolarHBondContact O-CB 3.49Å; R768-A772 PolarHBondContact O-N 3.22Å; R768-E779 IonicContact CZ-OE1 3.43Å; R768-E779 IonicContact NE-OE1 3.49Å; R768-E779 IonicContact NH2-OE1 3.99Å; R768-E779 PolarHBondContact NH2-OE1 3.02Å
769	M	72.8	Confident	69.3	Low	124 Å²	124	73.2 Å²	73.2	61%	0.611	38%	0.383	S	S	*	.	H	α-helix	trans	-71.5	-40.6	-179	-170.9	179	-72.1	0	0	112.9	S765 M766 L767 T773	S765-M769 WeakPolarHBondContact O-CB 3.45Å; S765-M769 PolarHBondContact O-N 3Å; M766-M769 PolarHBondContact O-N 3.28Å; L767-M769 VanDerWaalsContact C-N 3.35Å; L767-M769 PolarHBondContact O-N 3.49Å; M769-T773 PolarHBondContact O-OG1 3.24Å
770	F	69.8	Low	68.1	Low	107 Å²	107	71.3 Å²	71.3	47%	0.469	37%	0.371	S	S	.	.	H	α-helix	trans	-102	-22.5	-170.8	-63.5	-62.6	0	0	0	114.8	M766	M766-F770 HydrophobicContact CB-CD2 4.05Å; M766-F770 HydrophobicContact CB-CE2 4.18Å; M766-F770 HydrophobicContact CG-CD2 4.46Å; M766-F770 HydrophobicContact CG-CE2 4.09Å; M766-F770 WeakPolarHBondContact O-CB 3.37Å; M766-F770 WeakPolarHBondContact O-CD2 3.41Å; M766-F770 PolarHBondContact O-N 3.29Å
771	V	64.2	Low	67.2	Low	8 Å²	8	74 Å²	74	5%	0.048	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-38.4	179.2	-169.8	0	0	0	0	111	F744 Y747 L767 T773 G774	F744-V771 HydrophobicContact CD1-CG1 4.16Å; F744-V771 HydrophobicContact CD1-CG2 4.31Å; F744-V771 HydrophobicContact CE1-CB 4.04Å; F744-V771 HydrophobicContact CE1-CG1 3.55Å; F744-V771 HydrophobicContact CE1-CG2 4.28Å; F744-V771 HydrophobicContact CZ-CG1 4.47Å; Y747-V771 HydrophobicContact CD1-CG2 4.29Å; Y747-V771 HydrophobicContact CD2-CG2 4.1Å; Y747-V771 HydrophobicContact CE1-CG2 4.48Å; Y747-V771 HydrophobicContact CE2-CG2 4.32Å; Y747-V771 HydrophobicContact CG-CG2 4.1Å; L767-V771 HydrophobicContact CD2-CG2 3.83Å; L767-V771 WeakPolarHBondContact O-CA 3.32Å; L767-V771 WeakPolarHBondContact O-CB 3.45Å; L767-V771 PolarHBondContact O-N 2.93Å; V771-T773 VanDerWaalsContact C-N 3.3Å; V771-T773 PolarHBondContact O-N 3.16Å; V771-G774 PolarHBondContact O-N 3.5Å; V771-G774 VanDerWaalsContact O-N 3.16Å
772	A	53	Low	66.8	Low	28 Å²	28	69.1 Å²	69.1	23%	0.231	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-14.4	180	0	0	0	0	0	114.5	L767 R768	L767-A772 PolarHBondContact O-N 3.33Å; R768-A772 HydrophobicContact CG-CB 4.28Å; R768-A772 WeakPolarHBondContact O-CB 3.49Å; R768-A772 PolarHBondContact O-N 3.22Å
773	T	47.6	Very low	66.2	Low	116 Å²	116	67.5 Å²	67.5	71%	0.712	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-0.5	170.7	53	0	0	0	0	113.4	M769 V771	M769-T773 PolarHBondContact O-OG1 3.24Å; V771-T773 VanDerWaalsContact C-N 3.3Å; V771-T773 PolarHBondContact O-N 3.16Å
774	G	50.8	Low	65.6	Low	24 Å²	24	70.8 Å²	70.8	25%	0.247	38%	0.383	C	S	.	.	S	Bend	trans	-77	168	173	0	0	0	0	0	112.3	V771 I776	V771-G774 PolarHBondContact O-N 3.5Å; V771-G774 VanDerWaalsContact O-N 3.16Å; G774-I776 PolarHBondContact O-N 2.99Å
775	P	41.6	Very low	65.5	Low	133 Å²	133	69.1 Å²	69.1	86%	0.864	38%	0.376	S	S	*	.	S	Bend	trans	-62.5	-9.2	179.9	23.5	-31.9	0	0	0	114.4
776	I	46.3	Very low	65.5	Low	98 Å²	98	69.8 Å²	69.8	50%	0.503	37%	0.372	S	S	.	.	S	Bend	trans	-109.6	88.4	175.9	-54.4	172.1	0	0	0	107.4	G774 T778	G774-I776 PolarHBondContact O-N 2.99Å; I776-T778 HydrophobicContact CG2-CG2 4.13Å; I776-T778 PolarHBondContact O-N 2.71Å; I776-T778 PolarHBondContact O-OG1 3.36Å
777	V	46.7	Very low	65.5	Low	95 Å²	95	70.4 Å²	70.4	58%	0.576	38%	0.383	S	S	*	.			trans	-64.9	103.9	175.7	-177.4	0	0	0	0	107.9
778	T	53.1	Low	65.8	Low	21 Å²	21	71 Å²	71	13%	0.129	39%	0.386	C	S	.	.			trans	-138.1	112.8	172.6	38.8	0	0	0	0	109.2	K740 I776	K740-T778 HydrophobicContact CD-CG2 3.98Å; K740-T778 HydrophobicContact CG-CG2 4.47Å; I776-T778 HydrophobicContact CG2-CG2 4.13Å; I776-T778 PolarHBondContact O-N 2.71Å; I776-T778 PolarHBondContact O-OG1 3.36Å
779	E	57.8	Low	66.3	Low	112 Å²	112	64.3 Å²	64.3	52%	0.523	36%	0.36	S	S	.	.			trans	-82.7	135.3	169.9	-64.3	-157.2	132.5	0	0	110.1	R768	R768-E779 IonicContact CZ-OE1 3.43Å; R768-E779 IonicContact NE-OE1 3.49Å; R768-E779 IonicContact NH2-OE1 3.99Å; R768-E779 PolarHBondContact NH2-OE1 3.02Å
780	M	67.5	Low	67	Low	19 Å²	19	62.1 Å²	62.1	9%	0.094	35%	0.349	C	S	.	.			trans	-114.1	127.5	170.6	-179.4	170.8	46	0	0	109.2	F744 H764 L767 E784 L785	F744-M780 HydrophobicContact CD1-CE 4.22Å; F744-M780 HydrophobicContact CD2-CE 3.91Å; F744-M780 HydrophobicContact CD2-SD 3.9Å; F744-M780 HydrophobicContact CE1-CE 4.37Å; F744-M780 HydrophobicContact CE2-CB 4.06Å; F744-M780 HydrophobicContact CE2-CE 4.11Å; F744-M780 HydrophobicContact CE2-SD 4.01Å; F744-M780 HydrophobicContact CG-CE 3.98Å; F744-M780 HydrophobicContact CZ-CB 4.05Å; F744-M780 HydrophobicContact CZ-CE 4.33Å; H764-M780 PolarHBondContact NE2-O 2.89Å; L767-M780 HydrophobicContact CD1-CE 3.46Å; L767-M780 VanDerWaalsContact CD1-CE 3.46Å; M780-E784 HydrophobicContact CG-CB 4.3Å; M780-E784 HydrophobicContact CG-CG 4.35Å; M780-L785 HydrophobicContact CE-CB 3.93Å; M780-L785 HydrophobicContact CE-CD1 3.52Å; M780-L785 HydrophobicContact CE-CD2 4.45Å; M780-L785 HydrophobicContact CE-CG 4.13Å; M780-L785 HydrophobicContact CG-CB 4.15Å; M780-L785 HydrophobicContact SD-CB 3.89Å; M780-L785 HydrophobicContact SD-CD1 4.15Å
781	D	69.9	Low	67.9	Low	88 Å²	88	64.3 Å²	64.3	47%	0.471	35%	0.354	S	S	.	.			trans	-68.8	151.8	177.1	-175.2	30.1	0	0	0	111.2	N783 E784 L785	D781-N783 VanDerWaalsContact C-N 3.26Å; D781-N783 PolarHBondContact O-N 2.64Å; D781-N783 WeakPolarHBondContact OD2-CB 2.84Å; D781-N783 PolarHBondContact OD2-ND2 3.15Å; D781-E784 HydrophobicContact CB-CB 4.25Å; D781-E784 PolarHBondContact O-N 2.87Å; D781-L785 PolarHBondContact O-N 3.45Å
782	V	77.3	Confident	69	Low	55 Å²	55	65.5 Å²	65.5	33%	0.333	36%	0.358	S	S	.	.	H	α-helix	trans	-60.1	-39.7	178.6	179.7	0	0	0	0	110.7	L760 H764 Q786	L760-V782 HydrophobicContact CD2-CG1 4.09Å; L760-V782 HydrophobicContact CG-CG1 4.47Å; H764-V782 VanDerWaalsContact CE1-CG2 3.48Å; H764-V782 WeakPolarHBondContact CE1-CG2 3.46Å; V782-Q786 WeakPolarHBondContact O-CB 3.42Å; V782-Q786 PolarHBondContact O-N 3.45Å
783	N	74.6	Confident	70.7	Confident	105 Å²	105	66.1 Å²	66.1	56%	0.561	36%	0.359	S	S	*	.	H	α-helix	trans	-68.6	-37.9	179.2	-58.7	-57.1	0	0	0	111.6	D781 Q786 A787	D781-N783 VanDerWaalsContact C-N 3.26Å; D781-N783 PolarHBondContact O-N 2.64Å; D781-N783 WeakPolarHBondContact OD2-CB 2.84Å; D781-N783 PolarHBondContact OD2-ND2 3.15Å; N783-Q786 PolarHBondContact O-N 2.81Å; N783-A787 PolarHBondContact O-N 2.69Å
784	E	75.3	Confident	72.6	Confident	70 Å²	70	68.1 Å²	68.1	33%	0.327	35%	0.354	S	S	.	.	H	α-helix	trans	-67.9	-45.7	177.3	-174.3	171.6	-157.5	0	0	111.2	R737 M780 D781 Q786 A787 F788	R737-E784 IonicContact CZ-OE1 3.76Å; R737-E784 IonicContact NE-OE1 2.63Å; R737-E784 PolarHBondContact NE-OE1 3.24Å; R737-E784 IonicContact NH2-OE1 2.75Å; R737-E784 PolarHBondContact NH2-OE1 3.19Å; M780-E784 HydrophobicContact CG-CB 4.3Å; M780-E784 HydrophobicContact CG-CG 4.35Å; D781-E784 HydrophobicContact CB-CB 4.25Å; D781-E784 PolarHBondContact O-N 2.87Å; E784-Q786 VanDerWaalsContact C-N 3.29Å; E784-Q786 PolarHBondContact O-N 3.44Å; E784-A787 PolarHBondContact O-N 2.89Å; E784-F788 WeakPolarHBondContact O-CB 3.32Å; E784-F788 PolarHBondContact O-N 3.37Å
785	L	83.4	Confident	74.4	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-58.4	-42.4	172.8	174.1	62.9	0	0	0	111.2	I748 L760 I763 H764 L767 M780 D781 F788 L789	I748-L785 HydrophobicContact CD1-CD1 4.1Å; L760-L785 HydrophobicContact CD1-CD2 3.91Å; L760-L785 HydrophobicContact CD1-CG 3.88Å; I763-L785 HydrophobicContact CB-CD2 4.47Å; I763-L785 HydrophobicContact CG2-CD1 4.19Å; I763-L785 HydrophobicContact CG2-CD2 4.06Å; H764-L785 HydrophobicContact CB-CD2 3.67Å; L767-L785 HydrophobicContact CD1-CD1 3.93Å; L767-L785 HydrophobicContact CD1-CD2 4.29Å; M780-L785 HydrophobicContact CE-CB 3.93Å; M780-L785 HydrophobicContact CE-CD1 3.52Å; M780-L785 HydrophobicContact CE-CD2 4.45Å; M780-L785 HydrophobicContact CE-CG 4.13Å; M780-L785 HydrophobicContact CG-CB 4.15Å; M780-L785 HydrophobicContact SD-CB 3.89Å; M780-L785 HydrophobicContact SD-CD1 4.15Å; D781-L785 PolarHBondContact O-N 3.45Å; L785-F788 PolarHBondContact O-N 2.96Å; L785-L789 HydrophobicContact CD1-CD1 3.86Å; L785-L789 HydrophobicContact CD1-CD2 4.37Å; L785-L789 HydrophobicContact CD1-CG 3.85Å; L785-L789 HydrophobicContact CG-CD1 3.95Å; L785-L789 HydrophobicContact CG-CG 4.32Å; L785-L789 WeakPolarHBondContact O-CB 3.25Å; L785-L789 VanDerWaalsContact O-CG 3.29Å; L785-L789 WeakPolarHBondContact O-CG 3.28Å; L785-L789 PolarHBondContact O-N 2.75Å
786	Q	85	Confident	76.5	Confident	73 Å²	73	72 Å²	72	34%	0.341	36%	0.356	S	S	.	.	H	α-helix	trans	-61.6	-47.2	177.7	-173.5	-179.6	7.8	0	0	111.5	L760 V782 N783 E784 F788 L789 Q790	L760-Q786 HydrophobicContact CD1-CB 4.21Å; L760-Q786 HydrophobicContact CD2-CB 3.98Å; L760-Q786 HydrophobicContact CD2-CG 4.1Å; V782-Q786 WeakPolarHBondContact O-CB 3.42Å; V782-Q786 PolarHBondContact O-N 3.45Å; N783-Q786 PolarHBondContact O-N 2.81Å; E784-Q786 VanDerWaalsContact C-N 3.29Å; E784-Q786 PolarHBondContact O-N 3.44Å; Q786-F788 VanDerWaalsContact C-N 3.3Å; Q786-F788 PolarHBondContact O-N 2.99Å; Q786-L789 PolarHBondContact O-N 2.88Å; Q786-Q790 WeakPolarHBondContact O-CB 3.26Å; Q786-Q790 WeakPolarHBondContact O-CG 3.28Å; Q786-Q790 PolarHBondContact O-N 3.45Å
787	A	82.8	Confident	78.3	Confident	52 Å²	52	70.9 Å²	70.9	43%	0.43	35%	0.349	S	S	.	.	H	α-helix	trans	-62.4	-39.2	177.5	0	0	0	0	0	111.8	N783 E784 Q790 R791	N783-A787 PolarHBondContact O-N 2.69Å; E784-A787 PolarHBondContact O-N 2.89Å; A787-Q790 PolarHBondContact O-N 3.37Å; A787-R791 PolarHBondContact O-N 3.49Å
788	F	85.4	Confident	80.4	Confident	22 Å²	22	66.5 Å²	66.5	10%	0.096	32%	0.322	C	S	.	.	H	α-helix	trans	-64.5	-49.8	176.3	-180	-113.2	0	0	0	112.5	L741 W745 I748 E784 L785 Q786 Q790 R791 K792	L741-F788 HydrophobicContact CB-CE2 3.85Å; L741-F788 HydrophobicContact CB-CZ 4.18Å; L741-F788 HydrophobicContact CD1-CD2 4.31Å; L741-F788 HydrophobicContact CD1-CE2 4.31Å; L741-F788 HydrophobicContact CD2-CD2 3.69Å; L741-F788 HydrophobicContact CD2-CE2 3.86Å; L741-F788 HydrophobicContact CD2-CG 4.03Å; L741-F788 HydrophobicContact CD2-CZ 4.33Å; L741-F788 HydrophobicContact CG-CD2 4.39Å; L741-F788 HydrophobicContact CG-CE2 4.22Å; L741-F788 WeakPolarHBondContact O-CZ 3.32Å; W745-F788 HydrophobicContact CB-CE1 4.41Å; W745-F788 HydrophobicContact CB-CZ 4.08Å; I748-F788 HydrophobicContact CD1-CD1 4.41Å; I748-F788 HydrophobicContact CD1-CE1 4.15Å; E784-F788 WeakPolarHBondContact O-CB 3.32Å; E784-F788 PolarHBondContact O-N 3.37Å; L785-F788 PolarHBondContact O-N 2.96Å; Q786-F788 VanDerWaalsContact C-N 3.3Å; Q786-F788 PolarHBondContact O-N 2.99Å; F788-Q790 VanDerWaalsContact C-N 3.3Å; F788-Q790 PolarHBondContact O-N 3.27Å; F788-R791 WeakPolarHBondContact O-CB 3.46Å; F788-R791 PolarHBondContact O-N 2.91Å; F788-R791 VanDerWaalsContact O-N 3.12Å; F788-K792 HydrophobicContact CE1-CG 4.38Å; F788-K792 HydrophobicContact CE2-CG 4.49Å; F788-K792 HydrophobicContact CZ-CG 4.28Å; F788-K792 PolarHBondContact O-N 2.95Å
789	L	87.6	Confident	82.1	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-62.6	-38.2	176.6	-68	174.8	0	0	0	111.4	I748 L760 I763 L785 Q786 R791 K792 V793 L798 Y805	I748-L789 HydrophobicContact CD1-CD2 4.1Å; I748-L789 HydrophobicContact CG2-CD2 4.23Å; L760-L789 HydrophobicContact CD1-CD1 3.69Å; I763-L789 HydrophobicContact CD1-CD1 4.08Å; L785-L789 HydrophobicContact CD1-CD1 3.86Å; L785-L789 HydrophobicContact CD1-CD2 4.37Å; L785-L789 HydrophobicContact CD1-CG 3.85Å; L785-L789 HydrophobicContact CG-CD1 3.95Å; L785-L789 HydrophobicContact CG-CG 4.32Å; L785-L789 WeakPolarHBondContact O-CB 3.25Å; L785-L789 VanDerWaalsContact O-CG 3.29Å; L785-L789 WeakPolarHBondContact O-CG 3.28Å; L785-L789 PolarHBondContact O-N 2.75Å; Q786-L789 PolarHBondContact O-N 2.88Å; L789-R791 VanDerWaalsContact C-N 3.33Å; L789-R791 PolarHBondContact O-N 3.31Å; L789-K792 PolarHBondContact O-N 3.22Å; L789-V793 VanDerWaalsContact O-CG2 3.29Å; L789-V793 WeakPolarHBondContact O-CG2 3.34Å; L789-V793 PolarHBondContact O-N 3.1Å; L789-L798 HydrophobicContact CB-CD1 4.48Å; L789-L798 HydrophobicContact CD2-CD1 3.48Å; L789-L798 VanDerWaalsContact CD2-CD1 3.48Å; L789-Y805 HydrophobicContact CB-CD1 4.24Å; L789-Y805 HydrophobicContact CB-CE1 3.64Å; L789-Y805 HydrophobicContact CD1-CD1 4.39Å; L789-Y805 HydrophobicContact CD1-CD2 4.04Å; L789-Y805 HydrophobicContact CD1-CE1 4.09Å; L789-Y805 HydrophobicContact CD1-CE2 3.7Å; L789-Y805 HydrophobicContact CD1-CG 4.37Å; L789-Y805 HydrophobicContact CG-CE1 4.42Å
790	Q	87.8	Confident	83.5	Confident	79 Å²	79	67.6 Å²	67.6	37%	0.369	33%	0.328	S	S	.	.	H	α-helix	trans	-62	-39.3	173.7	-76.6	175	4	0	0	112.3	Q786 A787 F788 V793 R794	Q786-Q790 WeakPolarHBondContact O-CB 3.26Å; Q786-Q790 WeakPolarHBondContact O-CG 3.28Å; Q786-Q790 PolarHBondContact O-N 3.45Å; A787-Q790 PolarHBondContact O-N 3.37Å; F788-Q790 VanDerWaalsContact C-N 3.3Å; F788-Q790 PolarHBondContact O-N 3.27Å; Q790-V793 PolarHBondContact O-N 2.87Å; Q790-R794 WeakPolarHBondContact O-CG 3.42Å; Q790-R794 PolarHBondContact O-N 3.33Å
791	R	87.3	Confident	84.2	Confident	152 Å²	152	69.7 Å²	69.7	57%	0.574	34%	0.344	S	S	*	.	H	α-helix	trans	-60.9	-47.1	173	-173.5	175.5	-179.8	167.4	-1.5	110.8	A787 F788 L789 V793 R794 D795	A787-R791 PolarHBondContact O-N 3.49Å; F788-R791 WeakPolarHBondContact O-CB 3.46Å; F788-R791 PolarHBondContact O-N 2.91Å; F788-R791 VanDerWaalsContact O-N 3.12Å; L789-R791 VanDerWaalsContact C-N 3.33Å; L789-R791 PolarHBondContact O-N 3.31Å; R791-V793 VanDerWaalsContact C-N 3.27Å; R791-V793 PolarHBondContact O-N 3.11Å; R791-R794 WeakPolarHBondContact O-CB 3.36Å; R791-R794 PolarHBondContact O-N 3.35Å; R791-D795 PolarHBondContact O-N 2.69Å
792	K	88.4	Confident	84.7	Confident	33 Å²	33	70.6 Å²	70.6	14%	0.143	36%	0.364	C	S	.	.	H	α-helix	trans	-63.1	-29.9	176.4	-66.4	-64.6	-173.2	-178.2	0	113.7	W745 F788 L789 H796 Q797 L798	W745-K792 HydrophobicContact CD2-CD 4.2Å; W745-K792 HydrophobicContact CE3-CD 4.02Å; W745-K792 HydrophobicContact CE3-CG 3.99Å; W745-K792 HydrophobicContact CH2-CD 4.36Å; W745-K792 HydrophobicContact CZ3-CB 4.18Å; W745-K792 HydrophobicContact CZ3-CD 4.11Å; W745-K792 HydrophobicContact CZ3-CG 3.95Å; F788-K792 HydrophobicContact CE1-CG 4.38Å; F788-K792 HydrophobicContact CE2-CG 4.49Å; F788-K792 HydrophobicContact CZ-CG 4.28Å; F788-K792 PolarHBondContact O-N 2.95Å; L789-K792 PolarHBondContact O-N 3.22Å; K792-H796 PolarHBondContact O-N 3.26Å; K792-Q797 HydrophobicContact CD-CB 4.35Å; K792-Q797 PolarHBondContact O-N 3.31Å; K792-L798 HydrophobicContact CB-CB 4.4Å; K792-L798 HydrophobicContact CB-CD1 3.84Å; K792-L798 HydrophobicContact CB-CG 4.12Å; K792-L798 PolarHBondContact O-N 2.81Å; K792-L798 VanDerWaalsContact O-N 3.07Å
793	V	89.2	Confident	84.9	Confident	41 Å²	41	70.1 Å²	70.1	25%	0.248	37%	0.37	C	S	.	.	H	α-helix	trans	-70.4	-41.8	171.4	172.4	0	0	0	0	111.5	L789 Q790 R791 D795 H796 L798 M800 Y805	L789-V793 VanDerWaalsContact O-CG2 3.29Å; L789-V793 WeakPolarHBondContact O-CG2 3.34Å; L789-V793 PolarHBondContact O-N 3.1Å; Q790-V793 PolarHBondContact O-N 2.87Å; R791-V793 VanDerWaalsContact C-N 3.27Å; R791-V793 PolarHBondContact O-N 3.11Å; V793-D795 VanDerWaalsContact C-N 3.31Å; V793-D795 PolarHBondContact O-N 3.34Å; V793-H796 PolarHBondContact O-N 2.99Å; V793-L798 WeakPolarHBondContact CA-O 3.48Å; V793-L798 HydrophobicContact CG2-CB 3.71Å; V793-M800 HydrophobicContact CG1-CB 4.43Å; V793-M800 HydrophobicContact CG2-CB 4Å; V793-Y805 HydrophobicContact CG2-CD1 4.27Å; V793-Y805 HydrophobicContact CG2-CE1 4.23Å
794	R	87.9	Confident	85.6	Confident	158 Å²	158	68.1 Å²	68.1	60%	0.596	36%	0.359	S	S	*	.	H	α-helix	trans	-62.5	-38.7	173.9	-70.5	-171	-61.4	-103.3	3.3	112	Q790 R791 H796	Q790-R794 WeakPolarHBondContact O-CG 3.42Å; Q790-R794 PolarHBondContact O-N 3.33Å; R791-R794 WeakPolarHBondContact O-CB 3.36Å; R791-R794 PolarHBondContact O-N 3.35Å; R794-H796 PolarHBondContact O-N 3.14Å; R794-H796 VanDerWaalsContact O-N 3.17Å
795	D	87.3	Confident	86.3	Confident	79 Å²	79	65.2 Å²	65.2	42%	0.422	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	7.5	178.7	-58	-19.1	0	0	0	112.8	R791 V793 Q797	R791-D795 PolarHBondContact O-N 2.69Å; V793-D795 VanDerWaalsContact C-N 3.31Å; V793-D795 PolarHBondContact O-N 3.34Å; D795-Q797 HydrophobicContact CB-CG 4.2Å; D795-Q797 PolarHBondContact O-N 2.74Å; D795-Q797 VanDerWaalsContact O-N 3.09Å
796	H	85.6	Confident	86.7	Confident	159 Å²	159	69.7 Å²	69.7	74%	0.736	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	18.1	-177.4	-56.3	-53.7	0	0	0	115.2	K792 V793 R794	K792-H796 PolarHBondContact O-N 3.26Å; V793-H796 PolarHBondContact O-N 2.99Å; R794-H796 PolarHBondContact O-N 3.14Å; R794-H796 VanDerWaalsContact O-N 3.17Å
797	Q	85.4	Confident	86.9	Confident	75 Å²	75	68.1 Å²	68.1	35%	0.35	36%	0.356	S	S	.	.	S	Bend	trans	-85.8	-18.8	176.1	-60.4	-175.6	-2.5	0	0	112.3	W745 K792 D795 P808	W745-Q797 HydrophobicContact CH2-CB 3.85Å; W745-Q797 HydrophobicContact CZ2-CB 3.83Å; K792-Q797 HydrophobicContact CD-CB 4.35Å; K792-Q797 PolarHBondContact O-N 3.31Å; D795-Q797 HydrophobicContact CB-CG 4.2Å; D795-Q797 PolarHBondContact O-N 2.74Å; D795-Q797 VanDerWaalsContact O-N 3.09Å; Q797-P808 WeakPolarHBondContact O-CD 3.35Å
798	L	89.5	Confident	87	Confident	3 Å²	3	68.3 Å²	68.3	2%	0.016	35%	0.353	C	S	.	.			trans	-132.7	153.3	172.7	-76.2	177.2	0	0	0	111.1	W745 L752 L789 K792 V793 Y805 L807	W745-L798 HydrophobicContact CH2-CD1 4.43Å; W745-L798 HydrophobicContact CH2-CD2 4.13Å; W745-L798 HydrophobicContact CH2-CG 3.85Å; W745-L798 HydrophobicContact CZ3-CD1 3.84Å; W745-L798 HydrophobicContact CZ3-CD2 4.14Å; W745-L798 HydrophobicContact CZ3-CG 3.76Å; L752-L798 HydrophobicContact CD1-CD2 3.36Å; L789-L798 HydrophobicContact CB-CD1 4.48Å; L789-L798 HydrophobicContact CD2-CD1 3.48Å; L789-L798 VanDerWaalsContact CD2-CD1 3.48Å; K792-L798 HydrophobicContact CB-CB 4.4Å; K792-L798 HydrophobicContact CB-CD1 3.84Å; K792-L798 HydrophobicContact CB-CG 4.12Å; K792-L798 PolarHBondContact O-N 2.81Å; K792-L798 VanDerWaalsContact O-N 3.07Å; V793-L798 WeakPolarHBondContact CA-O 3.48Å; V793-L798 HydrophobicContact CG2-CB 3.71Å; L798-Y805 HydrophobicContact CD1-CD1 4.35Å; L798-L807 HydrophobicContact CD2-CD2 3.99Å
799	I	88.8	Confident	86.4	Confident	58 Å²	58	75.4 Å²	75.4	30%	0.297	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.4	170.3	-58.1	172.1	0	0	0	107.6	Y805 R806 P808	I799-Y805 WeakPolarHBondContact O-CA 3.38Å; I799-R806 HydrophobicContact CB-CG 3.72Å; I799-R806 HydrophobicContact CG2-CG 4.25Å; I799-R806 PolarHBondContact N-O 2.95Å; I799-R806 PolarHBondContact O-N 3.21Å; I799-P808 HydrophobicContact CD1-CB 4.07Å; I799-P808 HydrophobicContact CG1-CB 4.42Å
800	M	86.6	Confident	84.9	Confident	99 Å²	99	80.4 Å²	80.4	49%	0.488	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.2	172.6	-173.6	-164.2	70	0	0	109.6	V793 I804 Y805	V793-M800 HydrophobicContact CG1-CB 4.43Å; V793-M800 HydrophobicContact CG2-CB 4Å; M800-I804 WeakPolarHBondContact CA-O 3.34Å; M800-Y805 HydrophobicContact CB-CD1 4.23Å; M800-Y805 HydrophobicContact CB-CE1 4.2Å; M800-Y805 HydrophobicContact CG-CD1 4.34Å; M800-Y805 HydrophobicContact CG-CE1 4.07Å; M800-Y805 HydrophobicContact SD-CE1 4.36Å
801	S	82.9	Confident	82.7	Confident	62 Å²	62	83.4 Å²	83.4	43%	0.434	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	125.7	175	55	0	0	0	0	109.9	G803 I804	S801-G803 VanDerWaalsContact C-N 3.27Å; S801-G803 PolarHBondContact O-N 3.15Å; S801-I804 PolarHBondContact N-O 3.35Å; S801-I804 PolarHBondContact O-N 3Å
802	A	80.4	Confident	80.1	Confident	107 Å²	107	86.9 Å²	86.9	88%	0.884	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	38	178.1	0	0	0	0	0	114.7	I804	A802-I804 VanDerWaalsContact C-N 3.32Å; A802-I804 PolarHBondContact O-N 2.88Å
803	G	81.1	Confident	79.7	Confident	45 Å²	45	89.6 Å²	89.6	46%	0.464	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	8.6	179.4	0	0	0	0	0	115.2	S801	S801-G803 VanDerWaalsContact C-N 3.27Å; S801-G803 PolarHBondContact O-N 3.15Å
804	I	89.6	Confident	79.2	Confident	64 Å²	64	92.1 Å²	92.1	33%	0.328	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	135.3	179.7	-45.7	177.7	0	0	0	109.3	M758 T759 M800 S801 A802	M758-I804 WeakPolarHBondContact O-CG2 3.07Å; T759-I804 HydrophobicContact CG2-CG1 4.38Å; M800-I804 WeakPolarHBondContact CA-O 3.34Å; S801-I804 PolarHBondContact N-O 3.35Å; S801-I804 PolarHBondContact O-N 3Å; A802-I804 VanDerWaalsContact C-N 3.32Å; A802-I804 PolarHBondContact O-N 2.88Å
805	Y	91.3	Very high	78.8	Confident	9 Å²	9	88.4 Å²	88.4	4%	0.035	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	139.9	176.5	-61.6	-84.9	0	0	0	110.7	L752 T757 M758 L760 I763 L789 V793 L798 I799 M800	L752-Y805 WeakPolarHBondContact CD2-O 3.3Å; T757-Y805 WeakPolarHBondContact CA-O 3.39Å; M758-Y805 PolarHBondContact N-O 3.36Å; M758-Y805 PolarHBondContact O-N 2.93Å; L760-Y805 HydrophobicContact CB-CE2 4Å; L760-Y805 HydrophobicContact CD1-CE2 4.35Å; I763-Y805 HydrophobicContact CD1-CD2 3.83Å; I763-Y805 HydrophobicContact CD1-CG 4.22Å; L789-Y805 HydrophobicContact CB-CD1 4.24Å; L789-Y805 HydrophobicContact CB-CE1 3.64Å; L789-Y805 HydrophobicContact CD1-CD1 4.39Å; L789-Y805 HydrophobicContact CD1-CD2 4.04Å; L789-Y805 HydrophobicContact CD1-CE1 4.09Å; L789-Y805 HydrophobicContact CD1-CE2 3.7Å; L789-Y805 HydrophobicContact CD1-CG 4.37Å; L789-Y805 HydrophobicContact CG-CE1 4.42Å; V793-Y805 HydrophobicContact CG2-CD1 4.27Å; V793-Y805 HydrophobicContact CG2-CE1 4.23Å; L798-Y805 HydrophobicContact CD1-CD1 4.35Å; I799-Y805 WeakPolarHBondContact O-CA 3.38Å; M800-Y805 HydrophobicContact CB-CD1 4.23Å; M800-Y805 HydrophobicContact CB-CE1 4.2Å; M800-Y805 HydrophobicContact CG-CD1 4.34Å; M800-Y805 HydrophobicContact CG-CE1 4.07Å; M800-Y805 HydrophobicContact SD-CE1 4.36Å
806	R	89.9	Confident	78.3	Confident	93 Å²	93	89 Å²	89	35%	0.351	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	155.4	174.7	72.2	-179.6	-159.4	155.5	4.6	111.2	T757 I799	T757-R806 HydrophobicContact CG2-CB 4.1Å; I799-R806 HydrophobicContact CB-CG 3.72Å; I799-R806 HydrophobicContact CG2-CG 4.25Å; I799-R806 PolarHBondContact N-O 2.95Å; I799-R806 PolarHBondContact O-N 3.21Å
807	L	89.3	Confident	77.8	Confident	41 Å²	41	84.6 Å²	84.6	22%	0.215	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-74.6	145	170.5	-70.9	166.4	0	0	0	110.7	W745 Q749 L752 T753 L798	W745-L807 HydrophobicContact CH2-CD2 4.29Å; Q749-L807 HydrophobicContact CG-CD2 4.36Å; L752-L807 HydrophobicContact CB-CD1 3.83Å; L752-L807 HydrophobicContact CB-CG 3.8Å; L752-L807 HydrophobicContact CD1-CG 4.37Å; T753-L807 WeakPolarHBondContact OG1-CD1 3.3Å; L798-L807 HydrophobicContact CD2-CD2 3.99Å
808	P	84.8	Confident	77.3	Confident	55 Å²	55	85.3 Å²	85.3	36%	0.357	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-61	137.4	168.9	25.2	-31.2	0	0	0	109.4	Q797 I799 S810	Q797-P808 WeakPolarHBondContact O-CD 3.35Å; I799-P808 HydrophobicContact CD1-CB 4.07Å; I799-P808 HydrophobicContact CG1-CB 4.42Å; P808-S810 PolarHBondContact O-N 2.81Å
809	K	74.2	Confident	76.4	Confident	172 Å²	172	91.1 Å²	91.1	75%	0.748	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-64.2	122.5	175.3	-68.2	-173.2	175.2	-172.1	0	107.7	T811	K809-T811 PolarHBondContact O-N 3.15Å; K809-T811 VanDerWaalsContact O-N 3.07Å
810	S	56.5	Low	75.5	Confident	104 Å²	104	93.7 Å²	93.7	73%	0.727	55%	0.547	S	S	*	.			trans	-58.9	115.3	168.4	46	0	0	0	0	107.9	P808 N812	P808-S810 PolarHBondContact O-N 2.81Å; S810-N812 VanDerWaalsContact C-N 3.26Å; S810-N812 PolarHBondContact O-N 3.28Å
811	T	40.2	Very low	74.5	Confident	142 Å²	142	93.3 Å²	93.3	87%	0.871	55%	0.551	S	S	*	*			trans	-69.9	92.5	163.6	46.9	0	0	0	0	106.5	K809	K809-T811 PolarHBondContact O-N 3.15Å; K809-T811 VanDerWaalsContact O-N 3.07Å
812	N	34.4	Very low	73.8	Confident	225 Å²	225	96.1 Å²	96.1	100%	1.203	56%	0.562	S	S	*	*			trans	-67.1	0	155.3	-96.2	-3.7	0	0	0	109.5	S810	S810-N812 VanDerWaalsContact C-N 3.26Å; S810-N812 PolarHBondContact O-N 3.28Å

Retrieved 812 of 812 residues in 215.9 ms (Link to these results)

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