A0A087Y561_POEFO Loading...

TBC domain-containing protein kinase-like protein

Component of the FERRY complex (Five-subunit Endosomal Rab5 and RNA/ribosome intermediary). The FERRY complex directly interacts with mRNAs and RAB5A, and functions as a RAB5A effector involved in the localization and the distribution of specific mRNAs most likely by mediating their endosomal transport. The complex recruits mRNAs and ribosomes to early endosomes through direct mRNA-interaction. Also involved in the modulation of mTOR signaling and expression of mTOR complex components. Involved in the control of actin-cytoskeleton organization.

AlphaFold DB , UniProt , Accession A0A087Y561, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 891 aa.

						>A0A087Y561_POEFO|A0A087Y561
MKPIRDAQLGAFTFFASALPHDVCGSNGLPLTPNSIKILGRFQILKTITHPRLCQYVDISRGKHERLIVVAEHYSRNVGDFRQEQTARICVSPEKVLQVAYEVLEGLDFMNKHGLVHRALSPNNVLLDCKGNVKLAKFGLYHMTDHGADVDFPIGNPSYLAPEVIALGCFHPSDPSHSETPLPSGPKSDVWSLGILLFELCAGRRLLQNIELSDKLKFILTLGCMDDIVTVLAEEHGCLEIIKEMPENVVELLRKCLTFLPSKRPTPAELLGDPVFDAVSCHYLPFQKPVSLFSSSLRCAHLELPDDISDLCKDDDEDYLSERGIDEVYHLWCLAGGDLEKELTNKEIIQSKPPICTLPKFVLEDGESFGQGRDRSFLLDDTTVTLSLCQLRNRLKDVAGEAYYPLLEDEQSSLPQSNSSNELSATVTLPLIIRERDTEYQLIRIILFDRLLKGYPYKKNLMWKEARVDIPPLVRGLAWAALLGIEGDIQAKYDSTDKDTPIPTDRQIEVDIPRCHQYDELLSSPQGHIKFRRVLKAWVVSHPDLVYWQGLDSLCAPFLYLNFNNEALAYACMSAFIPKYLYNFFLKDNSHVIQEYLTVFSQMIAFHDPELSNHLNEIGFIPDLYAIPWFLTMFTHVFPLHKIFHLWDTLLLGSSSFPFCIGVAILQQLRDRLLANGFNECILLFSDLPEIDIERCVRESINLFCWTPKSATYRQYAQPMKAGGEGIFGKTATYFSSDYQDMPKTDLSREPLALCDLKAEVSPRISAEDLIDLCELSLAGPTKRSKSGKPKIVAVDIRNVEDFGRGHVSGSINIPFNSVFGPDGELVQCPASGVLQNYRGRVIVIVSHAVKSAALFAAHLVKVNFSRVCILDGGISKLKPTGLLTVPSPQI
					

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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	54.6	Low	85.2	Confident	125 Å²	125	47.5 Å²	47.5	62%	0.616	23%	0.225	S	C	*	.				0	157.4	0	-66.4	154.8	-172.8	0	0	108.2	D326	M1-D326 VanDerWaalsContact CE-OD2 3.29Å; M1-D326 WeakPolarHBondContact CE-OD2 3.19Å; M1-D326 VanDerWaalsContact SD-OD1 3.39Å
2	K	68.8	Low	85.8	Confident	67 Å²	67	44.2 Å²	44.2	29%	0.291	21%	0.208	S	C	.	.			trans	-76.9	131.6	172.6	-75.8	-175.1	176.6	179.7	0	109	T49 H50 G324	K2-T49 HydrophobicContact CD-CG2 3.77Å; K2-T49 VanDerWaalsContact CE-CG2 3.46Å; K2-T49 HydrophobicContact CG-CG2 4.25Å; K2-H50 PolarHBondContact NZ-O 3.15Å; K2-H50 VanDerWaalsContact NZ-O 3.12Å; K2-G324 WeakPolarHBondContact O-CA 3.38Å
3	P	81.5	Confident	86.3	Confident	38 Å²	38	40.8 Å²	40.8	25%	0.247	19%	0.193	C	C	.	.	B	Isolated β-bridge	trans	-62.6	147.1	177	27.5	-34.8	0	0	0	110.5	R5 S321 R323	P3-R5 VanDerWaalsContact C-N 3.33Å; P3-R5 HydrophobicContact CB-CG 3.98Å; P3-R5 HydrophobicContact CG-CG 3.9Å; P3-S321 WeakPolarHBondContact CB-O 3.4Å; P3-R323 CarbonylContact C-O 3.59Å; P3-R323 WeakPolarHBondContact CA-O 3.38Å
4	I	85.4	Confident	86.6	Confident	9 Å²	9	38 Å²	38	5%	0.046	18%	0.179	C	C	.	.			trans	-67.3	-34.3	178.4	-167.4	175.9	0	0	0	111.6	D6 A7 S321 R323 I325 V328	I4-D6 PolarHBondContact O-N 3.3Å; I4-A7 HydrophobicContact CG1-CB 3.97Å; I4-A7 WeakPolarHBondContact CG1-O 3.21Å; I4-A7 WeakPolarHBondContact O-CA 3.39Å; I4-A7 WeakPolarHBondContact O-CB 3.33Å; I4-A7 PolarHBondContact O-N 2.68Å; I4-S321 WeakPolarHBondContact CG2-O 3.41Å; I4-S321 PolarHBondContact N-O 2.92Å; I4-S321 VanDerWaalsContact N-O 3.15Å; I4-R323 PolarHBondContact N-O 3.09Å; I4-I325 HydrophobicContact CB-CB 4.47Å; I4-I325 HydrophobicContact CD1-CG1 4.11Å; I4-I325 HydrophobicContact CG1-CB 4.43Å; I4-I325 HydrophobicContact CG1-CD1 4.44Å; I4-I325 HydrophobicContact CG1-CG1 4.21Å; I4-V328 HydrophobicContact CD1-CG1 4.25Å; I4-V328 HydrophobicContact CG2-CG2 4.26Å
5	R	86.6	Confident	86.7	Confident	147 Å²	147	37.9 Å²	37.9	56%	0.555	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.2	-118.2	-179.1	-62.4	-178.2	172.4	168.9	-1.2	111.8	P3 S321	P3-R5 VanDerWaalsContact C-N 3.33Å; P3-R5 HydrophobicContact CB-CG 3.98Å; P3-R5 HydrophobicContact CG-CG 3.9Å; R5-S321 PolarHBondContact N-O 3.46Å
6	D	85.3	Confident	86.9	Confident	60 Å²	60	36.1 Å²	36.1	32%	0.321	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-4.3	178.8	62.4	-54.2	0	0	0	113.8	I4 Y74 C129	I4-D6 PolarHBondContact O-N 3.3Å; D6-Y74 WeakPolarHBondContact OD2-CE1 3.49Å; D6-C129 HydrophobicContact CB-CB 4.14Å; D6-C129 WeakPolarHBondContact OD2-CB 3.48Å; D6-C129 PolarHBondContact OD2-N 2.71Å; D6-C129 PolarHBondContact OD2-SG 3.33Å
7	A	91.4	Very high	86.9	Confident	8 Å²	8	34.5 Å²	34.5	7%	0.066	17%	0.165	C	C	.	.			trans	-69	157.8	176.5	0	0	0	0	0	111.8	I4 E72 Y74	I4-A7 HydrophobicContact CG1-CB 3.97Å; I4-A7 WeakPolarHBondContact CG1-O 3.21Å; I4-A7 WeakPolarHBondContact O-CA 3.39Å; I4-A7 WeakPolarHBondContact O-CB 3.33Å; I4-A7 PolarHBondContact O-N 2.68Å; A7-E72 HydrophobicContact CB-CG 3.66Å; A7-Y74 HydrophobicContact CB-CE1 3.87Å; A7-Y74 HydrophobicContact CB-CE2 4.14Å
8	Q	94.5	Very high	86.4	Confident	68 Å²	68	36.8 Å²	36.8	32%	0.318	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	159.8	176.9	-53.8	179.5	-16.5	0	0	110.4	G10 H73 T385	Q8-G10 PolarHBondContact O-N 3.49Å; Q8-H73 PolarHBondContact N-O 3.01Å; Q8-H73 PolarHBondContact O-N 2.95Å; Q8-T385 HydrophobicContact CB-CG2 3.78Å; Q8-T385 HydrophobicContact CG-CG2 4.21Å; Q8-T385 PolarHBondContact OE1-OG1 3.31Å
9	L	96.4	Very high	85.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	109.4	168.1	-67.4	173.9	0	0	0	108.6	V70 I325 Y329 W332 T385 L386 L388	L9-V70 HydrophobicContact CD2-CG1 4.34Å; L9-I325 HydrophobicContact CD2-CD1 4.01Å; L9-I325 HydrophobicContact CD2-CG1 3.58Å; L9-Y329 HydrophobicContact CD1-CD2 4.25Å; L9-Y329 HydrophobicContact CD2-CD2 4.49Å; L9-W332 HydrophobicContact CD1-CB 4.41Å; L9-W332 HydrophobicContact CD1-CG 4.39Å; L9-T385 CarbonylContact O-C 3.24Å; L9-T385 WeakPolarHBondContact O-CA 3.44Å; L9-L386 HydrophobicContact CB-CB 3.96Å; L9-L386 HydrophobicContact CB-CD1 4.02Å; L9-L386 HydrophobicContact CB-CG 4.19Å; L9-L386 PolarHBondContact O-N 3.02Å; L9-L388 HydrophobicContact CD1-CD2 3.76Å
10	G	96.2	Very high	84.6	Confident	1 Å²	1	41 Å²	41	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	134.9	174.1	0	0	0	0	0	111.5	Q8 V70 A71 V384	Q8-G10 PolarHBondContact O-N 3.49Å; G10-V70 CarbonylContact O-C 3.58Å; G10-V70 WeakPolarHBondContact O-CA 3.35Å; G10-A71 PolarHBondContact N-O 3.37Å; G10-A71 PolarHBondContact O-N 2.86Å; G10-V384 CarbonylContact C-O 3.54Å; G10-V384 WeakPolarHBondContact CA-O 3.41Å
11	A	96.1	Very high	83.1	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.3	174.5	0	0	0	0	0	111.1	I68 V69 V70 L339 L343 T383 V384 L386	A11-I68 HydrophobicContact CB-CG2 4.3Å; A11-V69 VanDerWaalsContact CA-O 3.28Å; A11-V69 WeakPolarHBondContact CA-O 3.5Å; A11-V70 HydrophobicContact CB-CG2 4.47Å; A11-L339 HydrophobicContact CB-CD2 4.33Å; A11-L343 HydrophobicContact CB-CD2 4.39Å; A11-T383 WeakPolarHBondContact O-CA 3.3Å; A11-V384 PolarHBondContact N-O 2.82Å; A11-V384 PolarHBondContact O-N 2.81Å; A11-L386 HydrophobicContact CB-CD1 4.4Å; A11-L386 HydrophobicContact CB-CD2 3.86Å; A11-L386 HydrophobicContact CB-CG 4.22Å
12	F	93.1	Very high	83	Confident	7 Å²	7	49.5 Å²	49.5	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	161.6	170.7	68.4	-87.4	0	0	0	110.2	F14 Y56 I68 V69	F12-F14 HydrophobicContact CD2-CD1 4.44Å; F12-F14 HydrophobicContact CE2-CD1 4.16Å; F12-F14 HydrophobicContact CE2-CE1 4.25Å; F12-Y56 HydrophobicContact CE1-CE1 4.4Å; F12-Y56 HydrophobicContact CZ-CE1 4.42Å; F12-I68 WeakPolarHBondContact O-CA 3.38Å; F12-V69 HydrophobicContact CD1-CB 4.17Å; F12-V69 HydrophobicContact CD1-CG1 4.43Å; F12-V69 HydrophobicContact CD2-CB 4.45Å; F12-V69 HydrophobicContact CE1-CB 3.63Å; F12-V69 HydrophobicContact CE1-CG1 3.54Å; F12-V69 HydrophobicContact CE2-CB 3.94Å; F12-V69 HydrophobicContact CE2-CG1 4.47Å; F12-V69 HydrophobicContact CE2-CG2 4.14Å; F12-V69 HydrophobicContact CZ-CB 3.51Å; F12-V69 HydrophobicContact CZ-CG1 3.57Å; F12-V69 HydrophobicContact CZ-CG2 3.99Å; F12-V69 PolarHBondContact N-O 2.79Å; F12-V69 PolarHBondContact O-N 3.29Å
13	T	92.2	Very high	82.6	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	148.5	-171.7	-175.5	0	0	0	0	112.7	R66 L67 L343 I348 D380	T13-R66 VanDerWaalsContact CG2-NH1 3.28Å; T13-R66 WeakPolarHBondContact OG1-CD 3.45Å; T13-R66 VanDerWaalsContact OG1-CG 3.26Å; T13-R66 WeakPolarHBondContact OG1-CG 3.31Å; T13-R66 PolarHBondContact OG1-NH1 2.81Å; T13-R66 VanDerWaalsContact OG1-NH1 3.14Å; T13-L67 VanDerWaalsContact CA-O 3.23Å; T13-L67 WeakPolarHBondContact CA-O 3.42Å; T13-L67 WeakPolarHBondContact CB-O 3.36Å; T13-L67 PolarHBondContact OG1-O 3.11Å; T13-L343 HydrophobicContact CG2-CD1 4.27Å; T13-I348 HydrophobicContact CG2-CG2 3.6Å; T13-D380 PolarHBondContact O-N 3.4Å
14	F	90.9	Very high	81.8	Confident	1 Å²	1	51.4 Å²	51.4	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	171	175	64.8	-87	0	0	0	110	F12 I38 L67 V69 L140 M143 T144 V150 F152 L378 L379	F12-F14 HydrophobicContact CD2-CD1 4.44Å; F12-F14 HydrophobicContact CE2-CD1 4.16Å; F12-F14 HydrophobicContact CE2-CE1 4.25Å; F14-I38 HydrophobicContact CE2-CD1 4.12Å; F14-I38 HydrophobicContact CE2-CG2 4.49Å; F14-I38 HydrophobicContact CZ-CG2 4.13Å; F14-L67 HydrophobicContact CE1-CB 4.22Å; F14-L67 HydrophobicContact CE2-CB 4.28Å; F14-L67 HydrophobicContact CE2-CD1 3.69Å; F14-L67 HydrophobicContact CZ-CB 4.05Å; F14-L67 HydrophobicContact CZ-CD1 3.75Å; F14-L67 PolarHBondContact N-O 2.92Å; F14-L67 VanDerWaalsContact N-O 3.09Å; F14-L67 PolarHBondContact O-N 3.27Å; F14-V69 HydrophobicContact CE1-CG2 3.83Å; F14-L140 HydrophobicContact CD1-CD1 4.16Å; F14-L140 HydrophobicContact CE1-CD1 3.92Å; F14-L140 HydrophobicContact CZ-CD1 4.15Å; F14-M143 HydrophobicContact CE1-SD 4.12Å; F14-M143 HydrophobicContact CZ-SD 3.91Å; F14-T144 HydrophobicContact CE2-CG2 3.86Å; F14-T144 HydrophobicContact CZ-CG2 4.16Å; F14-V150 HydrophobicContact CD2-CG1 4.04Å; F14-V150 HydrophobicContact CE2-CG1 4.06Å; F14-F152 HydrophobicContact CB-CE1 3.92Å; F14-F152 HydrophobicContact CB-CZ 3.94Å; F14-F152 AromaticContact CD2-CE1 3.99Å; F14-F152 HydrophobicContact CD2-CE1 3.99Å; F14-F152 AromaticContact CD2-CZ 3.89Å; F14-F152 HydrophobicContact CD2-CZ 3.89Å; F14-F152 HydrophobicContact CG-CE1 4.33Å; F14-F152 HydrophobicContact CG-CZ 4.1Å; F14-L378 CarbonylContact C-O 3.45Å; F14-L378 WeakPolarHBondContact CA-O 3.32Å; F14-L378 WeakPolarHBondContact CB-O 3.48Å; F14-L379 HydrophobicContact CB-CD1 3.81Å
15	F	88.1	Confident	80.8	Confident	37 Å²	37	52 Å²	52	16%	0.162	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.7	177.6	-72.2	-95.4	0	0	0	111.1	H64 R66 F377 L378	F15-H64 WeakPolarHBondContact CD1-O 3.46Å; F15-R66 HydrophobicContact CD1-CB 3.94Å; F15-R66 HydrophobicContact CE1-CB 3.7Å; F15-R66 HydrophobicContact CE1-CG 4.3Å; F15-R66 VanDerWaalsContact CE2-NH2 3.33Å; F15-R66 HydrophobicContact CZ-CB 4.19Å; F15-R66 HydrophobicContact CZ-CG 4.32Å; F15-R66 VanDerWaalsContact CZ-NE 3.3Å; F15-F377 WeakPolarHBondContact CD2-O 3.42Å; F15-F377 VanDerWaalsContact CE2-O 3.29Å; F15-F377 WeakPolarHBondContact CE2-O 3.31Å; F15-L378 HydrophobicContact CB-CD2 4.29Å; F15-L378 PolarHBondContact N-O 3.3Å
16	A	89.9	Confident	79.6	Confident	8 Å²	8	51.7 Å²	51.7	7%	0.066	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-70.6	150.8	164.6	0	0	0	0	0	110	A18 N34 I38 E65 L67 D149	A16-A18 PolarHBondContact O-N 3.34Å; A16-N34 HydrophobicContact CB-CB 4.05Å; A16-I38 HydrophobicContact CB-CD1 3.7Å; A16-E65 HydrophobicContact CB-CB 4.21Å; A16-E65 PolarHBondContact N-O 2.88Å; A16-L67 HydrophobicContact CB-CD1 4.48Å; A16-D149 WeakPolarHBondContact CA-O 3.33Å
17	S	85.9	Confident	78.5	Confident	10 Å²	10	53.7 Å²	53.7	7%	0.07	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-65.7	133.9	174.2	58.6	0	0	0	0	109.8	N34 D149 D151	S17-N34 WeakPolarHBondContact O-CB 3.49Å; S17-N34 PolarHBondContact O-ND2 3.23Å; S17-N34 VanDerWaalsContact O-ND2 3.08Å; S17-N34 PolarHBondContact OG-ND2 3.31Å; S17-D149 PolarHBondContact N-O 3.41Å; S17-D149 VanDerWaalsContact OG-C 3.23Å; S17-D149 PolarHBondContact OG-O 2.86Å; S17-D151 VanDerWaalsContact CB-CG 3.47Å; S17-D151 VanDerWaalsContact CB-OD1 3.31Å; S17-D151 WeakPolarHBondContact CB-OD1 3.33Å; S17-D151 WeakPolarHBondContact CB-OD2 3.45Å
18	A	78.8	Confident	77.4	Confident	76 Å²	76	56 Å²	56	63%	0.628	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-79	132.7	-179.7	0	0	0	0	0	110.3	A16	A16-A18 PolarHBondContact O-N 3.34Å
19	L	73.9	Confident	76.1	Confident	58 Å²	58	55 Å²	55	30%	0.304	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-71.5	146.3	168.2	-65.3	174.8	0	0	0	109.7	L31	L19-L31 HydrophobicContact CD1-CB 3.65Å; L19-L31 HydrophobicContact CD1-CD1 4.14Å
20	P	63.3	Low	74.9	Confident	98 Å²	98	59.2 Å²	59.2	64%	0.636	37%	0.367	S	S	*	.	P	Polyproline II helix	trans	-54.5	143.8	169.5	-21.6	31.9	0	0	0	110.8	V23	P20-V23 HydrophobicContact CB-CG2 4.14Å
21	H	51.7	Low	74.1	Confident	177 Å²	177	62.4 Å²	62.4	82%	0.819	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	147.6	173.7	-60.2	-61.1	0	0	0	110.4
22	D	53.3	Low	73.6	Confident	168 Å²	168	64.3 Å²	64.3	90%	0.898	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	39	174.6	-52.6	-34.3	0	0	0	117.4
23	V	60.9	Low	73.5	Confident	65 Å²	65	65.9 Å²	65.9	39%	0.394	41%	0.407	S	S	.	.			trans	-109.1	117.2	172.1	-163.6	0	0	0	0	111	P20 L31	P20-V23 HydrophobicContact CB-CG2 4.14Å; V23-L31 HydrophobicContact CB-CD1 3.7Å; V23-L31 HydrophobicContact CB-CG 4.24Å; V23-L31 HydrophobicContact CG1-CD1 3.41Å; V23-L31 VanDerWaalsContact CG1-CD1 3.41Å; V23-L31 HydrophobicContact CG1-CG 4.05Å; V23-L31 PolarHBondContact O-N 3.48Å
24	C	62.9	Low	73.4	Confident	80 Å²	80	66.2 Å²	66.2	54%	0.541	41%	0.408	S	S	.	.	B	Isolated β-bridge	trans	-95.5	146.3	167.8	-66.3	0	0	0	0	110.3	L29	C24-L29 CarbonylContact C-O 3.56Å; C24-L29 WeakPolarHBondContact CA-O 3.48Å
25	G	65.1	Low	73.6	Confident	21 Å²	21	66.2 Å²	66.2	22%	0.216	41%	0.408	C	S	.	.			trans	-66.1	171.6	167.9	0	0	0	0	0	112.1	N27 G28 L29	G25-N27 PolarHBondContact O-N 2.7Å; G25-G28 PolarHBondContact O-N 3.33Å; G25-L29 PolarHBondContact N-O 3.12Å
26	S	62.5	Low	73.9	Confident	141 Å²	141	65.2 Å²	65.2	99%	0.986	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-17.7	176.7	52.7	0	0	0	0	114
27	N	62.3	Low	74.1	Confident	103 Å²	103	67.2 Å²	67.2	55%	0.551	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	3.6	175.7	60.6	-3.4	0	0	0	113.8	G25 L29	G25-N27 PolarHBondContact O-N 2.7Å; N27-L29 PolarHBondContact O-N 3.44Å; N27-L29 PolarHBondContact OD1-N 3.26Å
28	G	66.5	Low	74.6	Confident	55 Å²	55	66.8 Å²	66.8	57%	0.567	41%	0.409	S	S	*	.	S	Bend	trans	75	2.7	-179	0	0	0	0	0	114.8	G25	G25-G28 PolarHBondContact O-N 3.33Å
29	L	67.2	Low	75.5	Confident	47 Å²	47	63.9 Å²	63.9	25%	0.246	38%	0.382	C	S	.	.	S	Bend	trans	-86.7	151.5	173.9	-65.4	176.8	0	0	0	110.6	C24 G25 N27 L31 P513	C24-L29 CarbonylContact C-O 3.56Å; C24-L29 WeakPolarHBondContact CA-O 3.48Å; G25-L29 PolarHBondContact N-O 3.12Å; N27-L29 PolarHBondContact O-N 3.44Å; N27-L29 PolarHBondContact OD1-N 3.26Å; L29-L31 PolarHBondContact O-N 3.39Å; L29-P513 HydrophobicContact CD1-CB 3.58Å
30	P	71.1	Confident	76.6	Confident	89 Å²	89	61.2 Å²	61.2	58%	0.578	37%	0.369	S	S	*	.	B	Isolated β-bridge	trans	-54.2	140.7	171.8	-22	32	0	0	0	110.9	T32	P30-T32 PolarHBondContact O-N 2.94Å
31	L	79.5	Confident	78.2	Confident	69 Å²	69	58.5 Å²	58.5	36%	0.361	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-60.5	135.1	172.8	-72.4	-176.8	0	0	0	110.5	L19 V23 L29 P33	L19-L31 HydrophobicContact CD1-CB 3.65Å; L19-L31 HydrophobicContact CD1-CD1 4.14Å; V23-L31 HydrophobicContact CB-CD1 3.7Å; V23-L31 HydrophobicContact CB-CG 4.24Å; V23-L31 HydrophobicContact CG1-CD1 3.41Å; V23-L31 VanDerWaalsContact CG1-CD1 3.41Å; V23-L31 HydrophobicContact CG1-CG 4.05Å; V23-L31 PolarHBondContact O-N 3.48Å; L29-L31 PolarHBondContact O-N 3.39Å; L31-P33 WeakPolarHBondContact O-CD 3.44Å
32	T	86.9	Confident	80.4	Confident	40 Å²	40	50 Å²	50	25%	0.245	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-61.3	122.2	173.4	-50.6	0	0	0	0	109.9	P30 I36 K37	P30-T32 PolarHBondContact O-N 2.94Å; T32-I36 HydrophobicContact CG2-CB 3.79Å; T32-I36 HydrophobicContact CG2-CG2 3.53Å; T32-K37 HydrophobicContact CG2-CG 4.25Å; T32-K37 WeakPolarHBondContact O-CE 3.37Å
33	P	89.6	Confident	82.5	Confident	40 Å²	40	43 Å²	43	26%	0.26	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-53.2	143.9	175.3	-25.6	32.5	0	0	0	112.3	L31 S35 I36 K37 E65	L31-P33 WeakPolarHBondContact O-CD 3.44Å; P33-S35 PolarHBondContact O-N 2.99Å; P33-I36 HydrophobicContact CB-CG1 4.33Å; P33-I36 HydrophobicContact CG-CD1 4.15Å; P33-I36 HydrophobicContact CG-CG1 4.42Å; P33-I36 WeakPolarHBondContact O-CB 3.48Å; P33-I36 PolarHBondContact O-N 3.37Å; P33-K37 PolarHBondContact O-N 2.94Å; P33-K37 VanDerWaalsContact O-N 3.15Å; P33-E65 WeakPolarHBondContact CB-OE2 3.46Å
34	N	91.8	Very high	84.1	Confident	8 Å²	8	43.3 Å²	43.3	4%	0.043	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-34.5	180	-72.6	-15.3	0	0	0	111.5	A16 S17 I36 K37 I38 D149	A16-N34 HydrophobicContact CB-CB 4.05Å; S17-N34 WeakPolarHBondContact O-CB 3.49Å; S17-N34 PolarHBondContact O-ND2 3.23Å; S17-N34 VanDerWaalsContact O-ND2 3.08Å; S17-N34 PolarHBondContact OG-ND2 3.31Å; N34-I36 VanDerWaalsContact C-N 3.28Å; N34-I36 PolarHBondContact O-N 3.44Å; N34-K37 WeakPolarHBondContact O-CB 3.33Å; N34-K37 PolarHBondContact O-N 3.45Å; N34-K37 VanDerWaalsContact O-N 3.14Å; N34-K37 WeakPolarHBondContact OD1-CE 3.36Å; N34-K37 PolarHBondContact OD1-NZ 3.17Å; N34-I38 VanDerWaalsContact O-CG1 3.22Å; N34-I38 WeakPolarHBondContact O-CG1 3.09Å; N34-I38 PolarHBondContact O-N 2.86Å; N34-D149 HydrophobicContact CB-CB 4.09Å; N34-D149 PolarHBondContact OD1-OD1 2.85Å
35	S	93.6	Very high	85.8	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59	-36.2	172.8	56.4	0	0	0	0	113.6	P33 I38 L39 R61 E65	P33-S35 PolarHBondContact O-N 2.99Å; S35-I38 PolarHBondContact O-N 2.89Å; S35-L39 WeakPolarHBondContact O-CB 3.47Å; S35-L39 PolarHBondContact O-N 3.1Å; S35-R61 WeakPolarHBondContact OG-CD 3.36Å; S35-R61 PolarHBondContact OG-NE 2.8Å; S35-E65 WeakPolarHBondContact CB-OE2 3.43Å; S35-E65 PolarHBondContact N-OE2 3.48Å; S35-E65 PolarHBondContact OG-OE1 2.93Å; S35-E65 PolarHBondContact OG-OE2 3.46Å
36	I	94.4	Very high	87.2	Confident	17 Å²	17	41.7 Å²	41.7	9%	0.087	25%	0.246	C	C	.	.	H	α-helix	trans	-71.4	-38.8	175.6	-66.5	-172.8	0	0	0	111	T32 P33 N34 I38 L39 G40 E520	T32-I36 HydrophobicContact CG2-CB 3.79Å; T32-I36 HydrophobicContact CG2-CG2 3.53Å; P33-I36 HydrophobicContact CB-CG1 4.33Å; P33-I36 HydrophobicContact CG-CD1 4.15Å; P33-I36 HydrophobicContact CG-CG1 4.42Å; P33-I36 WeakPolarHBondContact O-CB 3.48Å; P33-I36 PolarHBondContact O-N 3.37Å; N34-I36 VanDerWaalsContact C-N 3.28Å; N34-I36 PolarHBondContact O-N 3.44Å; I36-I38 VanDerWaalsContact C-N 3.33Å; I36-I38 PolarHBondContact O-N 3.49Å; I36-L39 PolarHBondContact O-N 3.44Å; I36-G40 PolarHBondContact O-N 3.2Å; I36-E520 HydrophobicContact CD1-CB 4.34Å; I36-E520 HydrophobicContact CD1-CG 4.2Å; I36-E520 HydrophobicContact CG1-CB 4.41Å; I36-E520 VanDerWaalsContact CG2-O 3.3Å; I36-E520 WeakPolarHBondContact CG2-O 3.19Å
37	K	95.3	Very high	88.6	Confident	50 Å²	50	37.7 Å²	37.7	22%	0.217	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-44.6	173.2	-56.5	-179.2	-172.3	159.5	0	111.3	T32 P33 N34 G40 R41 D149 P525	T32-K37 HydrophobicContact CG2-CG 4.25Å; T32-K37 WeakPolarHBondContact O-CE 3.37Å; P33-K37 PolarHBondContact O-N 2.94Å; P33-K37 VanDerWaalsContact O-N 3.15Å; N34-K37 WeakPolarHBondContact O-CB 3.33Å; N34-K37 PolarHBondContact O-N 3.45Å; N34-K37 VanDerWaalsContact O-N 3.14Å; N34-K37 WeakPolarHBondContact OD1-CE 3.36Å; N34-K37 PolarHBondContact OD1-NZ 3.17Å; K37-G40 PolarHBondContact O-N 3.29Å; K37-R41 PolarHBondContact O-N 3.27Å; K37-D149 IonicContact NZ-OD1 2.65Å; K37-P525 HydrophobicContact CB-CG 4.5Å; K37-P525 HydrophobicContact CG-CG 3.93Å
38	I	97.1	Very high	90.1	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.9	-44.3	177.7	-63.6	170	0	0	0	110.6	F14 A16 N34 S35 I36 G40 R41 F42 I59 L67 M143 T144 D149 V150	F14-I38 HydrophobicContact CE2-CD1 4.12Å; F14-I38 HydrophobicContact CE2-CG2 4.49Å; F14-I38 HydrophobicContact CZ-CG2 4.13Å; A16-I38 HydrophobicContact CB-CD1 3.7Å; N34-I38 VanDerWaalsContact O-CG1 3.22Å; N34-I38 WeakPolarHBondContact O-CG1 3.09Å; N34-I38 PolarHBondContact O-N 2.86Å; S35-I38 PolarHBondContact O-N 2.89Å; I36-I38 VanDerWaalsContact C-N 3.33Å; I36-I38 PolarHBondContact O-N 3.49Å; I38-G40 VanDerWaalsContact C-N 3.3Å; I38-G40 PolarHBondContact O-N 3.07Å; I38-R41 PolarHBondContact O-N 3.32Å; I38-F42 WeakPolarHBondContact O-CB 3.39Å; I38-F42 PolarHBondContact O-N 3.35Å; I38-I59 HydrophobicContact CG2-CD1 4.25Å; I38-L67 HydrophobicContact CB-CD1 3.74Å; I38-L67 HydrophobicContact CD1-CD1 3.76Å; I38-L67 HydrophobicContact CG1-CD1 4.36Å; I38-L67 HydrophobicContact CG2-CD1 3.49Å; I38-L67 VanDerWaalsContact CG2-CD1 3.49Å; I38-M143 WeakPolarHBondContact CA-O 3.31Å; I38-M143 WeakPolarHBondContact CG1-O 3.45Å; I38-M143 HydrophobicContact CG2-CB 4.03Å; I38-M143 HydrophobicContact CG2-CG 3.95Å; I38-M143 HydrophobicContact CG2-SD 4.28Å; I38-T144 HydrophobicContact CD1-CG2 4.23Å; I38-D149 HydrophobicContact CD1-CB 3.86Å; I38-D149 HydrophobicContact CG1-CB 3.9Å; I38-V150 HydrophobicContact CD1-CG1 4.26Å
39	L	96.9	Very high	91.3	Very high	15 Å²	15	32.6 Å²	32.6	8%	0.079	18%	0.177	C	C	.	.	H	α-helix	trans	-57.9	-42	176.2	-177.8	146.5	0	0	0	112.1	S35 I36 Q43 I59 L521	S35-L39 WeakPolarHBondContact O-CB 3.47Å; S35-L39 PolarHBondContact O-N 3.1Å; I36-L39 PolarHBondContact O-N 3.44Å; L39-Q43 PolarHBondContact O-NE2 3.46Å; L39-I59 HydrophobicContact CD1-CG2 4.48Å; L39-I59 HydrophobicContact CG-CG2 4.13Å; L39-L521 HydrophobicContact CD2-CB 4.09Å; L39-L521 HydrophobicContact CD2-CD1 3.92Å
40	G	96.8	Very high	92.6	Very high	3 Å²	3	30.9 Å²	30.9	3%	0.031	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-47.1	174.6	0	0	0	0	0	112.9	I36 K37 I38 F42 Q43	I36-G40 PolarHBondContact O-N 3.2Å; K37-G40 PolarHBondContact O-N 3.29Å; I38-G40 VanDerWaalsContact C-N 3.3Å; I38-G40 PolarHBondContact O-N 3.07Å; G40-F42 VanDerWaalsContact C-N 3.33Å; G40-F42 PolarHBondContact O-N 2.81Å; G40-Q43 PolarHBondContact O-N 3.01Å
41	R	96.8	Very high	93.6	Very high	40 Å²	40	29.1 Å²	29.1	15%	0.151	16%	0.156	C	C	.	.	H	α-helix	trans	-65.2	-32.8	176.7	-72.9	-168.6	-173.4	97.3	-8.7	113	K37 I38 Q43 I44 H142 D145 D149 Q526	K37-R41 PolarHBondContact O-N 3.27Å; I38-R41 PolarHBondContact O-N 3.32Å; R41-Q43 PolarHBondContact O-N 2.99Å; R41-I44 WeakPolarHBondContact O-CG2 3.39Å; R41-H142 PolarHBondContact O-CE1 3.19Å; R41-D145 VanDerWaalsContact CZ-CB 3.42Å; R41-D145 IonicContact CZ-OD1 3.94Å; R41-D145 VanDerWaalsContact CZ-OD1 3.29Å; R41-D145 IonicContact CZ-OD2 2.91Å; R41-D145 IonicContact NE-OD1 3.43Å; R41-D145 PolarHBondContact NE-OD1 3.45Å; R41-D145 IonicContact NH2-OD1 3.68Å; R41-D145 PolarHBondContact NH2-OD1 2.96Å; R41-D145 IonicContact NH2-OD2 2.93Å; R41-D145 PolarHBondContact NH2-OD2 3.15Å; R41-D149 IonicContact CZ-OD2 2.88Å; R41-D149 IonicContact NH1-OD2 3.05Å; R41-D149 PolarHBondContact NH1-OD2 2.8Å; R41-D149 IonicContact NH2-OD2 2.78Å; R41-Q526 HydrophobicContact CG-CG 4.23Å; R41-Q526 VanDerWaalsContact CG-NE2 3.32Å
42	F	98.2	Very high	94.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.4	-32.3	179.9	174.6	-93.4	0	0	0	112.6	I38 G40 I44 L45 K46 Y56 D58 I59 V69 M143	I38-F42 WeakPolarHBondContact O-CB 3.39Å; I38-F42 PolarHBondContact O-N 3.35Å; G40-F42 VanDerWaalsContact C-N 3.33Å; G40-F42 PolarHBondContact O-N 2.81Å; F42-I44 VanDerWaalsContact C-N 3.26Å; F42-I44 PolarHBondContact O-N 3.15Å; F42-I44 VanDerWaalsContact O-N 3.11Å; F42-L45 HydrophobicContact CD2-CD1 3.9Å; F42-L45 HydrophobicContact CE2-CD1 4.37Å; F42-L45 WeakPolarHBondContact O-CB 3.34Å; F42-L45 PolarHBondContact O-N 3.11Å; F42-K46 HydrophobicContact CD1-CD 4.37Å; F42-K46 HydrophobicContact CD1-CG 4.29Å; F42-K46 HydrophobicContact CE1-CD 3.9Å; F42-K46 HydrophobicContact CE1-CG 3.69Å; F42-K46 HydrophobicContact CZ-CG 4.36Å; F42-Y56 AromaticContact CE2-CD1 3.57Å; F42-Y56 HydrophobicContact CE2-CD1 3.57Å; F42-Y56 HydrophobicContact CE2-CE1 4.2Å; F42-Y56 HydrophobicContact CE2-CG 4.07Å; F42-Y56 HydrophobicContact CZ-CD1 4.04Å; F42-Y56 HydrophobicContact CZ-CG 4.35Å; F42-D58 VanDerWaalsContact CE1-C 3.48Å; F42-D58 VanDerWaalsContact CZ-C 3.49Å; F42-D58 WeakPolarHBondContact CZ-O 3.31Å; F42-I59 HydrophobicContact CB-CD1 4.1Å; F42-I59 HydrophobicContact CB-CG2 3.98Å; F42-I59 HydrophobicContact CD1-CB 3.63Å; F42-I59 HydrophobicContact CD1-CG2 3.21Å; F42-I59 HydrophobicContact CD2-CB 4.13Å; F42-I59 HydrophobicContact CD2-CD1 4.12Å; F42-I59 HydrophobicContact CD2-CG2 4.4Å; F42-I59 HydrophobicContact CE1-CB 3.72Å; F42-I59 HydrophobicContact CE1-CG2 3.72Å; F42-I59 HydrophobicContact CE2-CB 4.23Å; F42-I59 HydrophobicContact CG-CB 3.83Å; F42-I59 HydrophobicContact CG-CD1 4.05Å; F42-I59 HydrophobicContact CG-CG2 3.61Å; F42-I59 HydrophobicContact CZ-CB 4.02Å; F42-I59 HydrophobicContact CZ-CG2 4.49Å; F42-V69 HydrophobicContact CE2-CG1 3.65Å; F42-V69 HydrophobicContact CZ-CG1 4.21Å; F42-M143 HydrophobicContact CD2-CE 3.89Å; F42-M143 HydrophobicContact CD2-SD 4.09Å; F42-M143 HydrophobicContact CE2-CE 4.29Å
43	Q	96.9	Very high	94.9	Very high	19 Å²	19	25 Å²	25	9%	0.089	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-57	-35.6	-170.4	-61.5	-55.3	-44	0	0	114.1	L39 G40 R41 L45 K46 L521 F563 N564	L39-Q43 PolarHBondContact O-NE2 3.46Å; G40-Q43 PolarHBondContact O-N 3.01Å; R41-Q43 PolarHBondContact O-N 2.99Å; Q43-L45 PolarHBondContact O-N 3.14Å; Q43-K46 WeakPolarHBondContact O-CB 3.42Å; Q43-K46 PolarHBondContact O-N 3.46Å; Q43-L521 HydrophobicContact CG-CD1 3.58Å; Q43-F563 HydrophobicContact CB-CD1 3.65Å; Q43-F563 HydrophobicContact CB-CE1 3.66Å; Q43-F563 HydrophobicContact CG-CD1 3.68Å; Q43-F563 HydrophobicContact CG-CE1 3.56Å; Q43-F563 HydrophobicContact CG-CZ 4.47Å; Q43-N564 VanDerWaalsContact C-OD1 3.31Å; Q43-N564 WeakPolarHBondContact CB-OD1 3.43Å; Q43-N564 PolarHBondContact O-ND2 3.13Å; Q43-N564 PolarHBondContact O-OD1 3.23Å; Q43-N564 VanDerWaalsContact O-OD1 3.13Å
44	I	95.3	Very high	95.2	Very high	72 Å²	72	23.3 Å²	23.3	37%	0.369	12%	0.12	S	C	.	.	G	3₁₀ helix	trans	-62.8	-30.5	177.9	-166.4	62.8	0	0	0	112.1	R41 F42 K46 T47 H142	R41-I44 WeakPolarHBondContact O-CG2 3.39Å; F42-I44 VanDerWaalsContact C-N 3.26Å; F42-I44 PolarHBondContact O-N 3.15Å; F42-I44 VanDerWaalsContact O-N 3.11Å; I44-K46 VanDerWaalsContact C-N 3.25Å; I44-K46 PolarHBondContact O-N 3.33Å; I44-T47 HydrophobicContact CD1-CG2 4.45Å; I44-T47 WeakPolarHBondContact O-CB 3.35Å; I44-T47 PolarHBondContact O-N 3.29Å; I44-T47 PolarHBondContact O-OG1 2.97Å; I44-H142 VanDerWaalsContact CG2-CE1 3.44Å; I44-H142 WeakPolarHBondContact CG2-CE1 3.03Å
45	L	97.2	Very high	95.4	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-65.2	-29.8	179.8	-58.1	174.6	0	0	0	111.8	F42 Q43 T47 I48 Y56 L115 F138 M143	F42-L45 HydrophobicContact CD2-CD1 3.9Å; F42-L45 HydrophobicContact CE2-CD1 4.37Å; F42-L45 WeakPolarHBondContact O-CB 3.34Å; F42-L45 PolarHBondContact O-N 3.11Å; Q43-L45 PolarHBondContact O-N 3.14Å; L45-T47 PolarHBondContact O-N 2.66Å; L45-I48 PolarHBondContact O-N 2.97Å; L45-Y56 HydrophobicContact CB-CD2 3.77Å; L45-Y56 HydrophobicContact CB-CE2 4.43Å; L45-Y56 HydrophobicContact CB-CG 4.05Å; L45-Y56 HydrophobicContact CD1-CD2 4.34Å; L45-Y56 HydrophobicContact CD1-CE2 4.26Å; L45-L115 HydrophobicContact CD2-CD1 4.09Å; L45-L115 HydrophobicContact CD2-CD2 4.43Å; L45-F138 HydrophobicContact CD2-CE2 4.32Å; L45-M143 HydrophobicContact CD1-CB 4.28Å; L45-M143 HydrophobicContact CD1-CE 3.6Å
46	K	95.3	Very high	95.6	Very high	68 Å²	68	24.2 Å²	24.2	30%	0.296	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-63.7	-18.6	173.4	-59.8	178	68	148.2	0	112.8	F42 Q43 I44 V57 D58	F42-K46 HydrophobicContact CD1-CD 4.37Å; F42-K46 HydrophobicContact CD1-CG 4.29Å; F42-K46 HydrophobicContact CE1-CD 3.9Å; F42-K46 HydrophobicContact CE1-CG 3.69Å; F42-K46 HydrophobicContact CZ-CG 4.36Å; Q43-K46 WeakPolarHBondContact O-CB 3.42Å; Q43-K46 PolarHBondContact O-N 3.46Å; I44-K46 VanDerWaalsContact C-N 3.25Å; I44-K46 PolarHBondContact O-N 3.33Å; K46-V57 WeakPolarHBondContact CE-O 3.15Å; K46-V57 PolarHBondContact NZ-O 2.94Å; K46-V57 VanDerWaalsContact NZ-O 3.16Å; K46-D58 IonicContact NZ-OD1 2.67Å; K46-D58 PolarHBondContact NZ-OD1 2.94Å; K46-D58 VanDerWaalsContact NZ-OD1 3.13Å
47	T	92.9	Very high	95.7	Very high	57 Å²	57	23.6 Å²	23.6	35%	0.35	12%	0.121	S	C	.	.	G	3₁₀ helix	trans	-91.9	-14.2	179.8	78.1	0	0	0	0	113.4	I44 L45 T49 N564	I44-T47 HydrophobicContact CD1-CG2 4.45Å; I44-T47 WeakPolarHBondContact O-CB 3.35Å; I44-T47 PolarHBondContact O-N 3.29Å; I44-T47 PolarHBondContact O-OG1 2.97Å; L45-T47 PolarHBondContact O-N 2.66Å; T47-T49 PolarHBondContact O-N 2.67Å; T47-N564 HydrophobicContact CG2-CB 3.46Å; T47-N564 VanDerWaalsContact CG2-CB 3.46Å; T47-N564 VanDerWaalsContact CG2-CG 3.49Å
48	I	93.3	Very high	95.8	Very high	5 Å²	5	23.2 Å²	23.2	3%	0.026	12%	0.121	C	C	.	.			trans	-79.1	110.6	-178.3	-58	-54.2	0	0	0	108.2	L45 L53 F109 H113 L115 F138	L45-I48 PolarHBondContact O-N 2.97Å; I48-L53 HydrophobicContact CG2-CD1 3.63Å; I48-F109 HydrophobicContact CG2-CD1 4.48Å; I48-F109 HydrophobicContact CG2-CE1 3.8Å; I48-H113 HydrophobicContact CD1-CB 4.23Å; I48-L115 HydrophobicContact CD1-CD1 4.4Å; I48-L115 HydrophobicContact CG1-CD1 4.19Å; I48-F138 HydrophobicContact CG2-CE2 4.09Å; I48-F138 HydrophobicContact CG2-CZ 4Å
49	T	91.8	Very high	95.8	Very high	46 Å²	46	23.7 Å²	23.7	28%	0.282	12%	0.124	S	C	.	.			trans	-127.2	116.5	177.6	-59.3	0	0	0	0	109.5	K2 T47 F286	K2-T49 HydrophobicContact CD-CG2 3.77Å; K2-T49 VanDerWaalsContact CE-CG2 3.46Å; K2-T49 HydrophobicContact CG-CG2 4.25Å; T47-T49 PolarHBondContact O-N 2.67Å; T49-F286 WeakPolarHBondContact O-CZ 3.48Å
50	H	93.8	Very high	95.6	Very high	11 Å²	11	24.6 Å²	24.6	5%	0.051	13%	0.131	C	C	.	.			trans	-146.1	151.5	179	-169.7	-106.2	0	0	0	110	K2 R52 L53 F109 F286	K2-H50 PolarHBondContact NZ-O 3.15Å; K2-H50 VanDerWaalsContact NZ-O 3.12Å; H50-R52 VanDerWaalsContact CE1-CG 3.49Å; H50-R52 WeakPolarHBondContact CE1-CG 3.32Å; H50-R52 WeakPolarHBondContact ND1-CB 3.38Å; H50-R52 PolarHBondContact ND1-N 2.88Å; H50-R52 VanDerWaalsContact ND1-N 3.13Å; H50-R52 PolarHBondContact O-N 3.49Å; H50-L53 HydrophobicContact CB-CB 4.13Å; H50-L53 HydrophobicContact CB-CD1 3.88Å; H50-L53 HydrophobicContact CB-CG 3.87Å; H50-F109 HydrophobicContact CB-CD1 3.88Å; H50-F109 HydrophobicContact CB-CE1 3.9Å; H50-F109 HydrophobicContact CB-CG 4.19Å; H50-F109 HydrophobicContact CB-CZ 4.23Å; H50-F109 AromaticContact CD2-CD2 3.38Å; H50-F109 WeakPolarHBondContact CD2-CD2 3.4Å; H50-F109 AromaticContact CD2-CE2 3.83Å; H50-F109 AromaticContact CD2-CG 3.54Å; H50-F109 AromaticContact CG-CG 3.82Å; H50-F109 AromaticContact NE2-CD2 4Å; H50-F286 AromaticContact CD2-CD1 3.5Å; H50-F286 AromaticContact CD2-CE1 4Å; H50-F286 AromaticContact CD2-CG 3.65Å; H50-F286 AromaticContact NE2-CG 3.92Å
51	P	92.8	Very high	95.4	Very high	52 Å²	52	28.6 Å²	28.6	34%	0.338	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-31.1	176.6	-25.2	36.4	0	0	0	113.2	K134 F286	P51-K134 VanDerWaalsContact O-CD 3.3Å; P51-K134 WeakPolarHBondContact O-CD 3.37Å; P51-K134 WeakPolarHBondContact O-CE 3.35Å; P51-F286 HydrophobicContact CG-CD2 3.73Å; P51-F286 HydrophobicContact CG-CE2 4.24Å; P51-F286 HydrophobicContact CG-CG 4.49Å
52	R	96.1	Very high	94.9	Very high	20 Å²	20	27.2 Å²	27.2	8%	0.075	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	2.8	-176.9	-47.7	-56.8	175	-171.3	2.4	115.5	H50 E102 E105 V133 L135	H50-R52 VanDerWaalsContact CE1-CG 3.49Å; H50-R52 WeakPolarHBondContact CE1-CG 3.32Å; H50-R52 WeakPolarHBondContact ND1-CB 3.38Å; H50-R52 PolarHBondContact ND1-N 2.88Å; H50-R52 VanDerWaalsContact ND1-N 3.13Å; H50-R52 PolarHBondContact O-N 3.49Å; R52-E102 WeakPolarHBondContact CG-O 3.37Å; R52-E102 IonicContact CZ-OE1 3.82Å; R52-E102 IonicContact NH1-OE1 3.29Å; R52-E102 PolarHBondContact NH1-OE1 3.34Å; R52-E102 IonicContact NH1-OE2 2.65Å; R52-E102 IonicContact NH2-OE1 2.95Å; R52-E102 PolarHBondContact NH2-OE1 3.1Å; R52-E105 HydrophobicContact CG-CB 4.01Å; R52-E105 IonicContact CZ-OE2 3.75Å; R52-E105 IonicContact NE-OE2 2.83Å; R52-E105 PolarHBondContact NE-OE2 3.37Å; R52-E105 IonicContact NH2-OE2 3.68Å; R52-V133 WeakPolarHBondContact CA-O 3.44Å; R52-L135 WeakPolarHBondContact O-CG 3.41Å; R52-L135 PolarHBondContact O-N 3.46Å
53	L	96.8	Very high	94.2	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.016	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-122.4	139.5	-177.6	-58.3	-178.9	0	0	0	109.4	I48 H50 F109 M110 L135 F138	I48-L53 HydrophobicContact CG2-CD1 3.63Å; H50-L53 HydrophobicContact CB-CB 4.13Å; H50-L53 HydrophobicContact CB-CD1 3.88Å; H50-L53 HydrophobicContact CB-CG 3.87Å; L53-F109 HydrophobicContact CD1-CD1 3.71Å; L53-F109 HydrophobicContact CD1-CE1 4.14Å; L53-M110 HydrophobicContact CD1-CG 3.86Å; L53-M110 HydrophobicContact CD2-CG 4.05Å; L53-M110 HydrophobicContact CD2-SD 3.9Å; L53-L135 HydrophobicContact CD2-CB 3.79Å; L53-L135 HydrophobicContact CD2-CD1 3.85Å; L53-L135 HydrophobicContact CD2-CG 4.16Å; L53-F138 HydrophobicContact CB-CD1 4.41Å; L53-F138 HydrophobicContact CB-CE1 3.8Å; L53-F138 HydrophobicContact CB-CZ 4.22Å; L53-F138 HydrophobicContact CD1-CE1 4.39Å; L53-F138 HydrophobicContact CD1-CE2 4.41Å; L53-F138 HydrophobicContact CD1-CZ 4.16Å; L53-F138 HydrophobicContact CD2-CD1 4.2Å; L53-F138 HydrophobicContact CD2-CE1 4.35Å; L53-F138 HydrophobicContact CG-CE1 4.4Å
54	C	96.8	Very high	93.4	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.02	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-68.7	127.8	169.1	-67.2	0	0	0	0	109.7	Y56 E72 L135 F138	C54-Y56 PolarHBondContact O-N 3.07Å; C54-E72 WeakPolarHBondContact CA-OE2 3.38Å; C54-E72 HydrophobicContact CB-CB 4.05Å; C54-E72 WeakPolarHBondContact CB-O 3.49Å; C54-L135 WeakPolarHBondContact CB-O 3.41Å; C54-L135 PolarHBondContact N-O 2.98Å; C54-L135 PolarHBondContact SG-O 3.3Å; C54-F138 VanDerWaalsContact O-CE1 3.29Å; C54-F138 WeakPolarHBondContact O-CE1 3.38Å
55	Q	96.1	Very high	92.9	Very high	23 Å²	23	39.1 Å²	39.1	11%	0.107	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-68.6	126	178.8	-173.2	174.3	-21.8	0	0	111.3	A71 E72 I325	Q55-A71 CarbonylContact O-C 3.57Å; Q55-A71 WeakPolarHBondContact O-CA 3.44Å; Q55-E72 HydrophobicContact CB-CB 4.27Å; Q55-E72 PolarHBondContact N-OE2 2.88Å; Q55-E72 PolarHBondContact O-N 3.34Å; Q55-I325 HydrophobicContact CB-CG2 4.34Å; Q55-I325 HydrophobicContact CG-CG2 4.18Å
56	Y	97.6	Very high	92.5	Very high	4 Å²	4	40.4 Å²	40.4	2%	0.016	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	132.7	168.6	-80.2	-76.1	0	0	0	110.3	F12 F42 L45 C54 V69 A71 K137 F138 G139 M143	F12-Y56 HydrophobicContact CE1-CE1 4.4Å; F12-Y56 HydrophobicContact CZ-CE1 4.42Å; F42-Y56 AromaticContact CE2-CD1 3.57Å; F42-Y56 HydrophobicContact CE2-CD1 3.57Å; F42-Y56 HydrophobicContact CE2-CE1 4.2Å; F42-Y56 HydrophobicContact CE2-CG 4.07Å; F42-Y56 HydrophobicContact CZ-CD1 4.04Å; F42-Y56 HydrophobicContact CZ-CG 4.35Å; L45-Y56 HydrophobicContact CB-CD2 3.77Å; L45-Y56 HydrophobicContact CB-CE2 4.43Å; L45-Y56 HydrophobicContact CB-CG 4.05Å; L45-Y56 HydrophobicContact CD1-CD2 4.34Å; L45-Y56 HydrophobicContact CD1-CE2 4.26Å; C54-Y56 PolarHBondContact O-N 3.07Å; Y56-V69 HydrophobicContact CD1-CG1 3.74Å; Y56-V69 HydrophobicContact CE1-CG1 3.68Å; Y56-A71 HydrophobicContact CD1-CB 3.89Å; Y56-A71 HydrophobicContact CE1-CB 4.22Å; Y56-K137 VanDerWaalsContact OH-CA 3.26Å; Y56-K137 WeakPolarHBondContact OH-CA 3.35Å; Y56-F138 AromaticContact CD2-CE1 3.96Å; Y56-F138 HydrophobicContact CD2-CE1 3.96Å; Y56-F138 HydrophobicContact CD2-CE2 4.16Å; Y56-F138 AromaticContact CD2-CZ 3.61Å; Y56-F138 HydrophobicContact CD2-CZ 3.61Å; Y56-F138 AromaticContact CE2-CD1 3.99Å; Y56-F138 HydrophobicContact CE2-CD1 3.99Å; Y56-F138 HydrophobicContact CE2-CD2 4.17Å; Y56-F138 AromaticContact CE2-CE1 3.61Å; Y56-F138 HydrophobicContact CE2-CE1 3.61Å; Y56-F138 AromaticContact CE2-CE2 3.8Å; Y56-F138 HydrophobicContact CE2-CE2 3.8Å; Y56-F138 HydrophobicContact CE2-CG 4.25Å; Y56-F138 AromaticContact CE2-CZ 3.5Å; Y56-F138 HydrophobicContact CE2-CZ 3.5Å; Y56-F138 PolarHBondContact OH-N 3.18Å; Y56-G139 WeakPolarHBondContact OH-CA 3.48Å; Y56-G139 PolarHBondContact OH-N 3.12Å; Y56-M143 HydrophobicContact CE1-CE 4.17Å
57	V	96.6	Very high	92.4	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.03	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-56.7	-172.6	-179	0	0	0	0	110.7	K46 V70 I325 Y329	K46-V57 WeakPolarHBondContact CE-O 3.15Å; K46-V57 PolarHBondContact NZ-O 2.94Å; K46-V57 VanDerWaalsContact NZ-O 3.16Å; V57-V70 HydrophobicContact CB-CB 4.38Å; V57-V70 HydrophobicContact CB-CG1 4.16Å; V57-V70 PolarHBondContact N-O 3.47Å; V57-I325 HydrophobicContact CG2-CD1 3.87Å; V57-I325 HydrophobicContact CG2-CG1 3.85Å; V57-I325 HydrophobicContact CG2-CG2 3.98Å; V57-Y329 HydrophobicContact CG1-CD1 3.66Å; V57-Y329 HydrophobicContact CG1-CE1 4.48Å; V57-Y329 HydrophobicContact CG1-CG 3.66Å
58	D	96.6	Very high	92.5	Very high	42 Å²	42	34.4 Å²	34.4	23%	0.225	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	164	-175	-152.2	31.9	0	0	0	113.6	F42 K46 V70 Y329	F42-D58 VanDerWaalsContact CE1-C 3.48Å; F42-D58 VanDerWaalsContact CZ-C 3.49Å; F42-D58 WeakPolarHBondContact CZ-O 3.31Å; K46-D58 IonicContact NZ-OD1 2.67Å; K46-D58 PolarHBondContact NZ-OD1 2.94Å; K46-D58 VanDerWaalsContact NZ-OD1 3.13Å; D58-V70 PolarHBondContact N-O 2.99Å; D58-V70 PolarHBondContact O-N 3Å; D58-Y329 HydrophobicContact CB-CD1 4.12Å; D58-Y329 HydrophobicContact CB-CE1 3.44Å; D58-Y329 VanDerWaalsContact CB-CE1 3.44Å; D58-Y329 WeakPolarHBondContact OD2-CE1 3.47Å; D58-Y329 PolarHBondContact OD2-OH 3.37Å
59	I	96.7	Very high	92.7	Very high	10 Å²	10	34.2 Å²	34.2	5%	0.051	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	132.2	171.6	-169.2	170.5	0	0	0	109.1	I38 L39 F42 L67 I68 V69	I38-I59 HydrophobicContact CG2-CD1 4.25Å; L39-I59 HydrophobicContact CD1-CG2 4.48Å; L39-I59 HydrophobicContact CG-CG2 4.13Å; F42-I59 HydrophobicContact CB-CD1 4.1Å; F42-I59 HydrophobicContact CB-CG2 3.98Å; F42-I59 HydrophobicContact CD1-CB 3.63Å; F42-I59 HydrophobicContact CD1-CG2 3.21Å; F42-I59 HydrophobicContact CD2-CB 4.13Å; F42-I59 HydrophobicContact CD2-CD1 4.12Å; F42-I59 HydrophobicContact CD2-CG2 4.4Å; F42-I59 HydrophobicContact CE1-CB 3.72Å; F42-I59 HydrophobicContact CE1-CG2 3.72Å; F42-I59 HydrophobicContact CE2-CB 4.23Å; F42-I59 HydrophobicContact CG-CB 3.83Å; F42-I59 HydrophobicContact CG-CD1 4.05Å; F42-I59 HydrophobicContact CG-CG2 3.61Å; F42-I59 HydrophobicContact CZ-CB 4.02Å; F42-I59 HydrophobicContact CZ-CG2 4.49Å; I59-L67 HydrophobicContact CD1-CB 4.35Å; I59-L67 HydrophobicContact CD1-CD1 4.34Å; I59-L67 HydrophobicContact CD1-CD2 4.04Å; I59-L67 HydrophobicContact CD1-CG 4.49Å; I59-L67 HydrophobicContact CG1-CD2 4.22Å; I59-I68 CarbonylContact C-O 3.59Å; I59-I68 WeakPolarHBondContact CA-O 3.18Å; I59-V69 HydrophobicContact CD1-CG2 3.83Å; I59-V69 HydrophobicContact CG1-CG2 3.88Å
60	S	94.6	Very high	93	Very high	33 Å²	33	32 Å²	32	23%	0.231	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	138.2	175.2	69.5	0	0	0	0	111	L67 I68 L339	S60-L67 WeakPolarHBondContact O-CA 3.49Å; S60-I68 PolarHBondContact N-O 3.39Å; S60-I68 PolarHBondContact O-N 2.95Å; S60-L339 WeakPolarHBondContact OG-CD1 3.44Å
61	R	91.9	Very high	93.1	Very high	88 Å²	88	32 Å²	32	33%	0.332	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	121.4	171.7	-173.8	173.1	173.1	-97.7	-4.9	109.9	S35 E65 L67 E520	S35-R61 WeakPolarHBondContact OG-CD 3.36Å; S35-R61 PolarHBondContact OG-NE 2.8Å; R61-E65 IonicContact CZ-OE1 3.43Å; R61-E65 IonicContact NE-OE1 2.76Å; R61-E65 IonicContact NH2-OE1 3.57Å; R61-E65 PolarHBondContact NH2-OE1 2.8Å; R61-L67 HydrophobicContact CB-CD2 4.16Å; R61-L67 HydrophobicContact CG-CD2 4.39Å; R61-E520 WeakPolarHBondContact CD-OE1 3.41Å; R61-E520 IonicContact CZ-OE1 3.62Å; R61-E520 IonicContact NH1-OE1 2.97Å; R61-E520 PolarHBondContact NH1-OE1 3.2Å
62	G	86.7	Confident	93.3	Very high	11 Å²	11	30.4 Å²	30.4	11%	0.113	14%	0.144	C	C	.	.			trans	-98.2	-167.3	173.6	0	0	0	0	0	111.9	R66 E340	G62-R66 PolarHBondContact N-O 3.13Å; G62-E340 VanDerWaalsContact CA-OE1 3.26Å; G62-E340 WeakPolarHBondContact CA-OE1 3.45Å
63	K	82.1	Confident	93.3	Very high	148 Å²	148	30.9 Å²	30.9	64%	0.643	15%	0.147	S	C	*	.	G	3₁₀ helix	trans	-67.5	149.9	178.4	-60.4	178.7	-174.9	171	0	112.2	E65 R66	K63-E65 PolarHBondContact O-N 2.77Å; K63-R66 VanDerWaalsContact O-CB 3.27Å; K63-R66 WeakPolarHBondContact O-CB 3.49Å; K63-R66 PolarHBondContact O-N 2.9Å
64	H	79.9	Confident	93.2	Very high	162 Å²	162	31.4 Å²	31.4	75%	0.75	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	56.8	46.2	173.9	-44.6	98.5	0	0	0	114.1	F15 R66	F15-H64 WeakPolarHBondContact CD1-O 3.46Å; H64-R66 PolarHBondContact O-N 2.92Å; H64-R66 VanDerWaalsContact O-N 3.11Å
65	E	85.4	Confident	92.9	Very high	31 Å²	31	35.5 Å²	35.5	15%	0.145	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	63.2	13.8	179.7	-55.9	-65.7	115.8	0	0	114.9	A16 P33 S35 R61 K63	A16-E65 HydrophobicContact CB-CB 4.21Å; A16-E65 PolarHBondContact N-O 2.88Å; P33-E65 WeakPolarHBondContact CB-OE2 3.46Å; S35-E65 WeakPolarHBondContact CB-OE2 3.43Å; S35-E65 PolarHBondContact N-OE2 3.48Å; S35-E65 PolarHBondContact OG-OE1 2.93Å; S35-E65 PolarHBondContact OG-OE2 3.46Å; R61-E65 IonicContact CZ-OE1 3.43Å; R61-E65 IonicContact NE-OE1 2.76Å; R61-E65 IonicContact NH2-OE1 3.57Å; R61-E65 PolarHBondContact NH2-OE1 2.8Å; K63-E65 PolarHBondContact O-N 2.77Å
66	R	88.6	Confident	92.8	Very high	26 Å²	26	38.7 Å²	38.7	10%	0.098	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	136.8	171.7	-174.9	-179.2	-75.3	-96.8	10.8	110	T13 F15 G62 K63 H64	T13-R66 VanDerWaalsContact CG2-NH1 3.28Å; T13-R66 WeakPolarHBondContact OG1-CD 3.45Å; T13-R66 VanDerWaalsContact OG1-CG 3.26Å; T13-R66 WeakPolarHBondContact OG1-CG 3.31Å; T13-R66 PolarHBondContact OG1-NH1 2.81Å; T13-R66 VanDerWaalsContact OG1-NH1 3.14Å; F15-R66 HydrophobicContact CD1-CB 3.94Å; F15-R66 HydrophobicContact CE1-CB 3.7Å; F15-R66 HydrophobicContact CE1-CG 4.3Å; F15-R66 VanDerWaalsContact CE2-NH2 3.33Å; F15-R66 HydrophobicContact CZ-CB 4.19Å; F15-R66 HydrophobicContact CZ-CG 4.32Å; F15-R66 VanDerWaalsContact CZ-NE 3.3Å; G62-R66 PolarHBondContact N-O 3.13Å; K63-R66 VanDerWaalsContact O-CB 3.27Å; K63-R66 WeakPolarHBondContact O-CB 3.49Å; K63-R66 PolarHBondContact O-N 2.9Å; H64-R66 PolarHBondContact O-N 2.92Å; H64-R66 VanDerWaalsContact O-N 3.11Å
67	L	93.4	Very high	92.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	141.8	170.6	-68	166.3	0	0	0	109.4	T13 F14 A16 I38 I59 S60 R61	T13-L67 VanDerWaalsContact CA-O 3.23Å; T13-L67 WeakPolarHBondContact CA-O 3.42Å; T13-L67 WeakPolarHBondContact CB-O 3.36Å; T13-L67 PolarHBondContact OG1-O 3.11Å; F14-L67 HydrophobicContact CE1-CB 4.22Å; F14-L67 HydrophobicContact CE2-CB 4.28Å; F14-L67 HydrophobicContact CE2-CD1 3.69Å; F14-L67 HydrophobicContact CZ-CB 4.05Å; F14-L67 HydrophobicContact CZ-CD1 3.75Å; F14-L67 PolarHBondContact N-O 2.92Å; F14-L67 VanDerWaalsContact N-O 3.09Å; F14-L67 PolarHBondContact O-N 3.27Å; A16-L67 HydrophobicContact CB-CD1 4.48Å; I38-L67 HydrophobicContact CB-CD1 3.74Å; I38-L67 HydrophobicContact CD1-CD1 3.76Å; I38-L67 HydrophobicContact CG1-CD1 4.36Å; I38-L67 HydrophobicContact CG2-CD1 3.49Å; I38-L67 VanDerWaalsContact CG2-CD1 3.49Å; I59-L67 HydrophobicContact CD1-CB 4.35Å; I59-L67 HydrophobicContact CD1-CD1 4.34Å; I59-L67 HydrophobicContact CD1-CD2 4.04Å; I59-L67 HydrophobicContact CD1-CG 4.49Å; I59-L67 HydrophobicContact CG1-CD2 4.22Å; S60-L67 WeakPolarHBondContact O-CA 3.49Å; R61-L67 HydrophobicContact CB-CD2 4.16Å; R61-L67 HydrophobicContact CG-CD2 4.39Å
68	I	95.1	Very high	92.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	123.7	172.9	-55.4	163.4	0	0	0	106.9	A11 F12 I59 S60 L339 E340 L343 I349	A11-I68 HydrophobicContact CB-CG2 4.3Å; F12-I68 WeakPolarHBondContact O-CA 3.38Å; I59-I68 CarbonylContact C-O 3.59Å; I59-I68 WeakPolarHBondContact CA-O 3.18Å; S60-I68 PolarHBondContact N-O 3.39Å; S60-I68 PolarHBondContact O-N 2.95Å; I68-L339 HydrophobicContact CB-CD1 4.43Å; I68-L339 HydrophobicContact CD1-CB 4.1Å; I68-L339 HydrophobicContact CG2-CB 4.24Å; I68-L339 HydrophobicContact CG2-CD1 3.99Å; I68-E340 HydrophobicContact CD1-CG 3.9Å; I68-L343 HydrophobicContact CB-CD1 4.38Å; I68-L343 HydrophobicContact CD1-CD1 3.82Å; I68-L343 HydrophobicContact CG1-CD1 3.8Å; I68-L343 HydrophobicContact CG2-CD1 3.69Å; I68-I349 HydrophobicContact CD1-CD1 4.32Å
69	V	97	Very high	91.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.1	-178.5	177.9	0	0	0	0	108.9	A11 F12 F14 F42 Y56 I59 M143	A11-V69 VanDerWaalsContact CA-O 3.28Å; A11-V69 WeakPolarHBondContact CA-O 3.5Å; F12-V69 HydrophobicContact CD1-CB 4.17Å; F12-V69 HydrophobicContact CD1-CG1 4.43Å; F12-V69 HydrophobicContact CD2-CB 4.45Å; F12-V69 HydrophobicContact CE1-CB 3.63Å; F12-V69 HydrophobicContact CE1-CG1 3.54Å; F12-V69 HydrophobicContact CE2-CB 3.94Å; F12-V69 HydrophobicContact CE2-CG1 4.47Å; F12-V69 HydrophobicContact CE2-CG2 4.14Å; F12-V69 HydrophobicContact CZ-CB 3.51Å; F12-V69 HydrophobicContact CZ-CG1 3.57Å; F12-V69 HydrophobicContact CZ-CG2 3.99Å; F12-V69 PolarHBondContact N-O 2.79Å; F12-V69 PolarHBondContact O-N 3.29Å; F14-V69 HydrophobicContact CE1-CG2 3.83Å; F42-V69 HydrophobicContact CE2-CG1 3.65Å; F42-V69 HydrophobicContact CZ-CG1 4.21Å; Y56-V69 HydrophobicContact CD1-CG1 3.74Å; Y56-V69 HydrophobicContact CE1-CG1 3.68Å; I59-V69 HydrophobicContact CD1-CG2 3.83Å; I59-V69 HydrophobicContact CG1-CG2 3.88Å; V69-M143 HydrophobicContact CG2-SD 4.17Å
70	V	97.8	Very high	90.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130.5	176.6	-173.1	0	0	0	0	109.4	L9 G10 A11 V57 D58 Y329 L339 L386	L9-V70 HydrophobicContact CD2-CG1 4.34Å; G10-V70 CarbonylContact O-C 3.58Å; G10-V70 WeakPolarHBondContact O-CA 3.35Å; A11-V70 HydrophobicContact CB-CG2 4.47Å; V57-V70 HydrophobicContact CB-CB 4.38Å; V57-V70 HydrophobicContact CB-CG1 4.16Å; V57-V70 PolarHBondContact N-O 3.47Å; D58-V70 PolarHBondContact N-O 2.99Å; D58-V70 PolarHBondContact O-N 3Å; V70-Y329 HydrophobicContact CB-CE2 4.24Å; V70-Y329 HydrophobicContact CG1-CD2 3.89Å; V70-Y329 HydrophobicContact CG1-CE2 3.93Å; V70-Y329 HydrophobicContact CG2-CE2 3.82Å; V70-L339 HydrophobicContact CG2-CD1 3.71Å; V70-L339 HydrophobicContact CG2-CD2 3.69Å; V70-L339 HydrophobicContact CG2-CG 4.36Å; V70-L386 HydrophobicContact CG1-CD1 4.28Å
71	A	97.2	Very high	90.2	Very high	11 Å²	11	38.3 Å²	38.3	9%	0.091	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	164.4	179.1	0	0	0	0	0	111.4	G10 Q55 Y56	G10-A71 PolarHBondContact N-O 3.37Å; G10-A71 PolarHBondContact O-N 2.86Å; Q55-A71 CarbonylContact O-C 3.57Å; Q55-A71 WeakPolarHBondContact O-CA 3.44Å; Y56-A71 HydrophobicContact CD1-CB 3.89Å; Y56-A71 HydrophobicContact CE1-CB 4.22Å
72	E	96.8	Very high	89	Confident	19 Å²	19	38.3 Å²	38.3	9%	0.089	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54	134.6	165.1	-169.8	-172.6	175.8	0	0	110.2	A7 C54 Q55 Y74 K134 I325	A7-E72 HydrophobicContact CB-CG 3.66Å; C54-E72 WeakPolarHBondContact CA-OE2 3.38Å; C54-E72 HydrophobicContact CB-CB 4.05Å; C54-E72 WeakPolarHBondContact CB-O 3.49Å; Q55-E72 HydrophobicContact CB-CB 4.27Å; Q55-E72 PolarHBondContact N-OE2 2.88Å; Q55-E72 PolarHBondContact O-N 3.34Å; E72-Y74 HydrophobicContact CG-CE2 3.85Å; E72-Y74 VanDerWaalsContact OE1-CE2 3.23Å; E72-Y74 WeakPolarHBondContact OE1-CE2 3.49Å; E72-Y74 VanDerWaalsContact OE1-CZ 3.29Å; E72-Y74 PolarHBondContact OE1-OH 2.97Å; E72-K134 IonicContact OE1-NZ 3.05Å; E72-K134 PolarHBondContact OE1-NZ 2.69Å; E72-K134 IonicContact OE2-NZ 3.1Å; E72-K134 PolarHBondContact OE2-NZ 3.39Å; E72-I325 VanDerWaalsContact CA-CD1 3.5Å; E72-I325 HydrophobicContact CB-CD1 3.65Å; E72-I325 HydrophobicContact CG-CD1 4.01Å
73	H	96.1	Very high	87.7	Confident	29 Å²	29	45.5 Å²	45.5	13%	0.134	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	148.3	-178.4	-176.2	63.1	0	0	0	111.6	Q8 L126	Q8-H73 PolarHBondContact N-O 3.01Å; Q8-H73 PolarHBondContact O-N 2.95Å; H73-L126 WeakPolarHBondContact ND1-CD1 3.43Å
74	Y	95.1	Very high	86.5	Confident	15 Å²	15	43.6 Å²	43.6	6%	0.059	21%	0.209	C	C	.	.			trans	-130.2	142.5	173.7	-61.8	-95.3	0	0	0	108.9	D6 A7 E72 R76 L126 L127 D128 K134	D6-Y74 WeakPolarHBondContact OD2-CE1 3.49Å; A7-Y74 HydrophobicContact CB-CE1 3.87Å; A7-Y74 HydrophobicContact CB-CE2 4.14Å; E72-Y74 HydrophobicContact CG-CE2 3.85Å; E72-Y74 VanDerWaalsContact OE1-CE2 3.23Å; E72-Y74 WeakPolarHBondContact OE1-CE2 3.49Å; E72-Y74 VanDerWaalsContact OE1-CZ 3.29Å; E72-Y74 PolarHBondContact OE1-OH 2.97Å; Y74-R76 VanDerWaalsContact C-N 3.32Å; Y74-R76 PolarHBondContact O-N 3.19Å; Y74-L126 HydrophobicContact CD2-CB 4.47Å; Y74-L127 VanDerWaalsContact CB-O 3.32Å; Y74-L127 WeakPolarHBondContact CB-O 3.1Å; Y74-D128 HydrophobicContact CD1-CB 4.11Å; Y74-D128 HydrophobicContact CE1-CB 3.63Å; Y74-K134 HydrophobicContact CD2-CB 4.19Å; Y74-K134 HydrophobicContact CD2-CG 4.13Å; Y74-K134 HydrophobicContact CE2-CB 4.16Å; Y74-K134 HydrophobicContact CE2-CD 3.98Å; Y74-K134 HydrophobicContact CE2-CG 3.67Å
75	S	90.6	Very high	85.4	Confident	88 Å²	88	38.7 Å²	38.7	62%	0.615	19%	0.186	S	C	*	.	S	Bend	trans	-71.1	-27.9	-175.1	57.4	0	0	0	0	113.4
76	R	92	Very high	83.5	Confident	90 Å²	90	44.3 Å²	44.3	34%	0.34	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	141.4	179.2	-67.6	-179.6	76	-159.8	3.9	110.7	Y74 D80 E84 L126 L127	Y74-R76 VanDerWaalsContact C-N 3.32Å; Y74-R76 PolarHBondContact O-N 3.19Å; R76-D80 WeakPolarHBondContact CA-OD2 3.5Å; R76-E84 IonicContact CZ-OE1 3.01Å; R76-E84 IonicContact NE-OE1 3.36Å; R76-E84 PolarHBondContact NE-OE1 3.44Å; R76-E84 VanDerWaalsContact NH2-CD 3.26Å; R76-E84 IonicContact NH2-OE1 3.26Å; R76-E84 PolarHBondContact NH2-OE1 3.08Å; R76-E84 IonicContact NH2-OE2 3.18Å; R76-E84 PolarHBondContact NH2-OE2 3.03Å; R76-L126 WeakPolarHBondContact O-CA 3.37Å; R76-L127 HydrophobicContact CB-CB 4.21Å; R76-L127 PolarHBondContact O-N 2.87Å
77	N	92.3	Very high	81.4	Confident	23 Å²	23	46 Å²	46	12%	0.123	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	165.1	174.2	67.1	83.5	0	0	0	110.9	G79 D80 P122 V125 L126	N77-G79 PolarHBondContact O-N 3.12Å; N77-G79 VanDerWaalsContact O-N 3.16Å; N77-G79 WeakPolarHBondContact OD1-CA 3.5Å; N77-G79 PolarHBondContact OD1-N 2.96Å; N77-D80 PolarHBondContact N-OD2 3.2Å; N77-D80 VanDerWaalsContact ND2-CG 3.34Å; N77-D80 PolarHBondContact ND2-OD1 2.65Å; N77-D80 PolarHBondContact ND2-OD2 3.07Å; N77-D80 VanDerWaalsContact O-CB 3.31Å; N77-D80 WeakPolarHBondContact O-CB 3.4Å; N77-D80 PolarHBondContact O-N 3.21Å; N77-D80 PolarHBondContact OD1-N 3.43Å; N77-P122 PolarHBondContact OD1-O 3.48Å; N77-V125 CarbonylContact C-O 3.21Å; N77-V125 WeakPolarHBondContact CA-O 3.49Å; N77-L126 HydrophobicContact CB-CD2 3.85Å
78	V	90.1	Very high	79.2	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-62.3	-23	-179.2	165.6	0	0	0	0	112.6	D80 F81 V99 V125 L127 L196 L200	V78-D80 PolarHBondContact O-N 2.67Å; V78-F81 HydrophobicContact CB-CD2 4.42Å; V78-F81 HydrophobicContact CB-CE2 4.27Å; V78-F81 HydrophobicContact CG1-CD2 4.04Å; V78-F81 HydrophobicContact CG1-CE2 4.11Å; V78-F81 HydrophobicContact CG2-CE2 3.92Å; V78-F81 HydrophobicContact CG2-CZ 4.46Å; V78-F81 WeakPolarHBondContact O-CD2 3.36Å; V78-F81 PolarHBondContact O-N 2.87Å; V78-V99 HydrophobicContact CG2-CG1 4.27Å; V78-V125 HydrophobicContact CB-CB 4.13Å; V78-V125 HydrophobicContact CB-CG1 4.18Å; V78-V125 HydrophobicContact CG2-CB 3.95Å; V78-V125 HydrophobicContact CG2-CG1 3.47Å; V78-V125 VanDerWaalsContact CG2-CG1 3.47Å; V78-V125 PolarHBondContact N-O 3.05Å; V78-L127 HydrophobicContact CG2-CD1 4.3Å; V78-L127 HydrophobicContact CG2-CD2 3.87Å; V78-L127 HydrophobicContact CG2-CG 4.16Å; V78-L196 HydrophobicContact CG1-CD2 4.33Å; V78-L200 HydrophobicContact CG1-CD1 3.71Å; V78-L200 HydrophobicContact CG1-CD2 3.59Å; V78-L200 HydrophobicContact CG1-CG 4.1Å
79	G	83.4	Confident	77.3	Confident	7 Å²	7	64.4 Å²	64.4	7%	0.072	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-64.8	-23.2	170.7	0	0	0	0	0	114.4	N77	N77-G79 PolarHBondContact O-N 3.12Å; N77-G79 VanDerWaalsContact O-N 3.16Å; N77-G79 WeakPolarHBondContact OD1-CA 3.5Å; N77-G79 PolarHBondContact OD1-N 2.96Å
80	D	82.6	Confident	75.7	Confident	31 Å²	31	65.9 Å²	65.9	17%	0.166	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-78.4	-18.6	-178.1	-57.6	-31.1	0	0	0	113.1	R76 N77 V78 R82 Q83 E84	R76-D80 WeakPolarHBondContact CA-OD2 3.5Å; N77-D80 PolarHBondContact N-OD2 3.2Å; N77-D80 VanDerWaalsContact ND2-CG 3.34Å; N77-D80 PolarHBondContact ND2-OD1 2.65Å; N77-D80 PolarHBondContact ND2-OD2 3.07Å; N77-D80 VanDerWaalsContact O-CB 3.31Å; N77-D80 WeakPolarHBondContact O-CB 3.4Å; N77-D80 PolarHBondContact O-N 3.21Å; N77-D80 PolarHBondContact OD1-N 3.43Å; V78-D80 PolarHBondContact O-N 2.67Å; D80-R82 PolarHBondContact O-N 2.98Å; D80-Q83 PolarHBondContact O-N 3.33Å; D80-E84 PolarHBondContact O-N 3.01Å
81	F	79.1	Confident	74.9	Confident	26 Å²	26	66.6 Å²	66.6	11%	0.114	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-53.2	-20.2	171.9	-67.5	-27.3	0	0	0	112.9	V78 Q85 V91 V99 L127 L200	V78-F81 HydrophobicContact CB-CD2 4.42Å; V78-F81 HydrophobicContact CB-CE2 4.27Å; V78-F81 HydrophobicContact CG1-CD2 4.04Å; V78-F81 HydrophobicContact CG1-CE2 4.11Å; V78-F81 HydrophobicContact CG2-CE2 3.92Å; V78-F81 HydrophobicContact CG2-CZ 4.46Å; V78-F81 WeakPolarHBondContact O-CD2 3.36Å; V78-F81 PolarHBondContact O-N 2.87Å; F81-Q85 WeakPolarHBondContact O-CG 3.31Å; F81-Q85 PolarHBondContact O-NE2 3.38Å; F81-V91 HydrophobicContact CB-CG2 4.02Å; F81-V91 HydrophobicContact CD2-CG2 4.27Å; F81-V91 HydrophobicContact CG-CG2 4.46Å; F81-V99 HydrophobicContact CE2-CG2 4.19Å; F81-L127 HydrophobicContact CD1-CD1 4.25Å; F81-L127 HydrophobicContact CE1-CD1 3.34Å; F81-L127 HydrophobicContact CE2-CD1 4.19Å; F81-L127 HydrophobicContact CZ-CD1 3.31Å; F81-L127 HydrophobicContact CZ-CD2 4.15Å; F81-L127 HydrophobicContact CZ-CG 4.37Å; F81-L200 HydrophobicContact CD2-CD2 4.2Å
82	R	67	Low	74.5	Confident	87 Å²	87	68.8 Å²	68.8	33%	0.328	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-82.3	-30.8	177	-59.4	176.3	61	-128.7	0.8	113.5	D80 G203	D80-R82 PolarHBondContact O-N 2.98Å; R82-G203 PolarHBondContact NE-O 3.39Å
83	Q	60	Low	74.2	Confident	162 Å²	162	69.5 Å²	69.5	76%	0.757	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-30	-176.7	-63.8	-174.7	21.4	0	0	112.4	D80 Q85	D80-Q83 PolarHBondContact O-N 3.33Å; Q83-Q85 PolarHBondContact O-N 3.34Å
84	E	57	Low	73.9	Confident	109 Å²	109	73.8 Å²	73.8	51%	0.509	38%	0.376	S	S	.	.	S	Bend	trans	-71.9	-13.7	178.7	-68.4	174	-172.9	0	0	112.9	R76 D80 T86	R76-E84 IonicContact CZ-OE1 3.01Å; R76-E84 IonicContact NE-OE1 3.36Å; R76-E84 PolarHBondContact NE-OE1 3.44Å; R76-E84 VanDerWaalsContact NH2-CD 3.26Å; R76-E84 IonicContact NH2-OE1 3.26Å; R76-E84 PolarHBondContact NH2-OE1 3.08Å; R76-E84 IonicContact NH2-OE2 3.18Å; R76-E84 PolarHBondContact NH2-OE2 3.03Å; D80-E84 PolarHBondContact O-N 3.01Å; E84-T86 PolarHBondContact O-N 2.9Å
85	Q	56.6	Low	73.7	Confident	58 Å²	58	75.4 Å²	75.4	27%	0.271	38%	0.383	S	S	.	.			trans	-89.7	94.3	-179.8	-66.2	-174.7	15	0	0	111.3	F81 Q83 A87 I89 C90	F81-Q85 WeakPolarHBondContact O-CG 3.31Å; F81-Q85 PolarHBondContact O-NE2 3.38Å; Q83-Q85 PolarHBondContact O-N 3.34Å; Q85-A87 PolarHBondContact O-N 3.17Å; Q85-A87 VanDerWaalsContact O-N 3.15Å; Q85-I89 VanDerWaalsContact OE1-C 3.32Å; Q85-C90 PolarHBondContact NE2-O 2.91Å
86	T	46.2	Very low	73.9	Confident	149 Å²	149	71.2 Å²	71.2	91%	0.914	35%	0.354	S	S	*	.	S	Bend	trans	-70.2	-2.5	174.9	-5	0	0	0	0	113.6	E84	E84-T86 PolarHBondContact O-N 2.9Å
87	A	44	Very low	74	Confident	63 Å²	63	67.6 Å²	67.6	52%	0.521	34%	0.342	S	S	.	.	S	Bend	trans	-158.7	112.9	171.8	0	0	0	0	0	110.3	Q85 I89	Q85-A87 PolarHBondContact O-N 3.17Å; Q85-A87 VanDerWaalsContact O-N 3.15Å; A87-I89 VanDerWaalsContact C-N 3.25Å; A87-I89 WeakPolarHBondContact O-CB 3.42Å; A87-I89 WeakPolarHBondContact O-CG1 3.46Å; A87-I89 PolarHBondContact O-N 3.26Å
88	R	48.3	Very low	74.1	Confident	254 Å²	254	69.3 Å²	69.3	96%	0.958	35%	0.349	S	S	*	.	S	Bend	trans	35.9	15.7	154.1	-73.4	-174.4	177.2	176.8	-0.8	121.9
89	I	53.8	Low	74.4	Confident	132 Å²	132	69.3 Å²	69.3	68%	0.677	35%	0.349	S	S	*	.			trans	-86.5	-7.2	-159.6	-83.3	166.5	0	0	0	117.8	Q85 A87	Q85-I89 VanDerWaalsContact OE1-C 3.32Å; A87-I89 VanDerWaalsContact C-N 3.25Å; A87-I89 WeakPolarHBondContact O-CB 3.42Å; A87-I89 WeakPolarHBondContact O-CG1 3.46Å; A87-I89 PolarHBondContact O-N 3.26Å
90	C	64.8	Low	75	Confident	31 Å²	31	69 Å²	69	21%	0.209	35%	0.345	C	S	.	.			trans	55	160.8	-176.4	-56.4	0	0	0	0	114	Q85 M245	Q85-C90 PolarHBondContact NE2-O 2.91Å; C90-M245 HydrophobicContact CB-CE 4.4Å
91	V	79.8	Confident	75.7	Confident	15 Å²	15	68.9 Å²	68.9	9%	0.091	34%	0.343	C	S	.	.			trans	-83.1	140	175.8	179.3	0	0	0	0	108.3	F81 K95 V96 L200	F81-V91 HydrophobicContact CB-CG2 4.02Å; F81-V91 HydrophobicContact CD2-CG2 4.27Å; F81-V91 HydrophobicContact CG-CG2 4.46Å; V91-K95 HydrophobicContact CG1-CB 3.74Å; V91-K95 HydrophobicContact CG1-CG 3.81Å; V91-V96 HydrophobicContact CB-CG2 4.03Å; V91-V96 HydrophobicContact CG1-CG2 3.9Å; V91-L200 HydrophobicContact CG2-CD2 4.3Å
92	S	88.5	Confident	76.6	Confident	57 Å²	57	67.7 Å²	67.7	40%	0.399	34%	0.338	S	S	.	.			trans	-61	144.1	179.4	93.7	0	0	0	0	110.7	E94 K95 V96	S92-E94 WeakPolarHBondContact CB-OE2 2.99Å; S92-E94 PolarHBondContact O-N 3.45Å; S92-E94 PolarHBondContact OG-OE2 2.89Å; S92-K95 PolarHBondContact O-N 2.97Å; S92-K95 PolarHBondContact OG-N 3.27Å; S92-V96 PolarHBondContact O-N 3.39Å
93	P	90.8	Very high	78.1	Confident	33 Å²	33	63.5 Å²	63.5	21%	0.214	32%	0.322	C	S	.	.	H	α-helix	trans	-53.4	-38.6	179.3	-28.5	36.4	0	0	0	113.2	K95 V96 L97 M245 P246 V249	P93-K95 VanDerWaalsContact C-N 3.35Å; P93-K95 PolarHBondContact O-N 3.26Å; P93-V96 PolarHBondContact O-N 3.43Å; P93-L97 WeakPolarHBondContact O-CG 3.1Å; P93-L97 PolarHBondContact O-N 2.88Å; P93-M245 HydrophobicContact CG-SD 4.32Å; P93-P246 HydrophobicContact CB-CG 3.8Å; P93-P246 HydrophobicContact CG-CG 3.73Å; P93-V249 HydrophobicContact CB-CG2 4.19Å
94	E	90.9	Very high	79.9	Confident	119 Å²	119	55.8 Å²	55.8	56%	0.556	29%	0.286	S	S	*	.	H	α-helix	trans	-63.1	-41.8	177.7	-56.3	75.3	-162.4	0	0	111.3	S92 L97 Q98	S92-E94 WeakPolarHBondContact CB-OE2 2.99Å; S92-E94 PolarHBondContact O-N 3.45Å; S92-E94 PolarHBondContact OG-OE2 2.89Å; E94-L97 PolarHBondContact O-N 3.16Å; E94-Q98 VanDerWaalsContact O-CG 3.3Å; E94-Q98 WeakPolarHBondContact O-CG 3.38Å; E94-Q98 PolarHBondContact O-N 2.84Å
95	K	90.7	Very high	81.8	Confident	49 Å²	49	51.9 Å²	51.9	21%	0.213	27%	0.267	C	S	.	.	H	α-helix	trans	-70.4	-34.9	178.1	-173.7	59.7	176.7	174.8	0	111.7	V91 S92 P93 Q98 V99 G131	V91-K95 HydrophobicContact CG1-CB 3.74Å; V91-K95 HydrophobicContact CG1-CG 3.81Å; S92-K95 PolarHBondContact O-N 2.97Å; S92-K95 PolarHBondContact OG-N 3.27Å; P93-K95 VanDerWaalsContact C-N 3.35Å; P93-K95 PolarHBondContact O-N 3.26Å; K95-Q98 HydrophobicContact CD-CB 4.47Å; K95-Q98 VanDerWaalsContact CD-OE1 3.3Å; K95-Q98 PolarHBondContact O-N 3.22Å; K95-V99 WeakPolarHBondContact O-CG2 2.94Å; K95-V99 PolarHBondContact O-N 3.1Å; K95-G131 PolarHBondContact NZ-O 3.15Å
96	V	93.4	Very high	83.7	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-60.1	-46.7	171.6	175.9	0	0	0	0	110.3	V91 S92 P93 V99 A100 L197 L200 V249	V91-V96 HydrophobicContact CB-CG2 4.03Å; V91-V96 HydrophobicContact CG1-CG2 3.9Å; S92-V96 PolarHBondContact O-N 3.39Å; P93-V96 PolarHBondContact O-N 3.43Å; V96-V99 PolarHBondContact O-N 2.78Å; V96-A100 WeakPolarHBondContact O-CB 3.42Å; V96-A100 PolarHBondContact O-N 3.1Å; V96-L197 HydrophobicContact CG1-CD2 4.05Å; V96-L200 HydrophobicContact CG2-CB 4.27Å; V96-V249 HydrophobicContact CG1-CG1 4.25Å
97	L	95.3	Very high	86.1	Confident	14 Å²	14	42 Å²	42	7%	0.073	21%	0.211	C	C	.	.	H	α-helix	trans	-65.8	-38.9	177.6	-68.1	178.5	0	0	0	112.6	P93 E94 A100 Y101 V249 L252 V275 F276 V279	P93-L97 WeakPolarHBondContact O-CG 3.1Å; P93-L97 PolarHBondContact O-N 2.88Å; E94-L97 PolarHBondContact O-N 3.16Å; L97-A100 PolarHBondContact O-N 3.47Å; L97-Y101 WeakPolarHBondContact O-CB 3.46Å; L97-Y101 PolarHBondContact O-N 3.23Å; L97-V249 HydrophobicContact CD1-CG2 4.23Å; L97-V249 HydrophobicContact CD2-CG2 4.06Å; L97-V249 HydrophobicContact CG-CG2 4.06Å; L97-L252 HydrophobicContact CD2-CD2 3.87Å; L97-V275 HydrophobicContact CD1-CG2 4.26Å; L97-V275 HydrophobicContact CD2-CG2 3.62Å; L97-F276 HydrophobicContact CB-CE1 4.45Å; L97-F276 HydrophobicContact CD2-CE1 4.16Å; L97-F276 WeakPolarHBondContact O-CE1 3.45Å; L97-V279 HydrophobicContact CB-CG2 4.07Å
98	Q	94.5	Very high	88.7	Confident	59 Å²	59	40.1 Å²	40.1	28%	0.276	19%	0.192	S	C	.	.	H	α-helix	trans	-59.7	-50.2	173	-75.1	171.9	-4.5	0	0	111.5	E94 K95 A100 Y101 E102 V279	E94-Q98 VanDerWaalsContact O-CG 3.3Å; E94-Q98 WeakPolarHBondContact O-CG 3.38Å; E94-Q98 PolarHBondContact O-N 2.84Å; K95-Q98 HydrophobicContact CD-CB 4.47Å; K95-Q98 VanDerWaalsContact CD-OE1 3.3Å; K95-Q98 PolarHBondContact O-N 3.22Å; Q98-A100 VanDerWaalsContact C-N 3.33Å; Q98-A100 PolarHBondContact O-N 3.02Å; Q98-Y101 PolarHBondContact O-N 3.45Å; Q98-E102 WeakPolarHBondContact O-CG 2.9Å; Q98-E102 PolarHBondContact O-N 2.9Å; Q98-V279 HydrophobicContact CG-CG1 4.19Å
99	V	95.5	Very high	90.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.6	-44.5	177.6	171.1	0	0	0	0	110.6	V78 F81 K95 V96 Y101 E102 V103 V133 L200	V78-V99 HydrophobicContact CG2-CG1 4.27Å; F81-V99 HydrophobicContact CE2-CG2 4.19Å; K95-V99 WeakPolarHBondContact O-CG2 2.94Å; K95-V99 PolarHBondContact O-N 3.1Å; V96-V99 PolarHBondContact O-N 2.78Å; V99-Y101 PolarHBondContact O-N 3.45Å; V99-E102 PolarHBondContact O-N 2.81Å; V99-V103 HydrophobicContact CG1-CG2 4.15Å; V99-V103 WeakPolarHBondContact O-CB 3.22Å; V99-V103 WeakPolarHBondContact O-CG2 3.33Å; V99-V103 PolarHBondContact O-N 3.47Å; V99-V133 HydrophobicContact CB-CG2 4.47Å; V99-V133 HydrophobicContact CG1-CG2 4.16Å; V99-V133 HydrophobicContact CG2-CG2 4.35Å; V99-L200 HydrophobicContact CG1-CD1 4.24Å
100	A	97.3	Very high	92.9	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-58.3	-48.2	177.4	0	0	0	0	0	111.7	V96 L97 Q98 V103 L104 L197 L252 F276	V96-A100 WeakPolarHBondContact O-CB 3.42Å; V96-A100 PolarHBondContact O-N 3.1Å; L97-A100 PolarHBondContact O-N 3.47Å; Q98-A100 VanDerWaalsContact C-N 3.33Å; Q98-A100 PolarHBondContact O-N 3.02Å; A100-V103 PolarHBondContact O-N 3.28Å; A100-L104 WeakPolarHBondContact O-CB 3.3Å; A100-L104 WeakPolarHBondContact O-CD1 3.24Å; A100-L104 WeakPolarHBondContact O-CG 3.45Å; A100-L104 PolarHBondContact O-N 3.47Å; A100-L197 HydrophobicContact CB-CD1 3.65Å; A100-L197 HydrophobicContact CB-CD2 3.8Å; A100-L197 HydrophobicContact CB-CG 4.38Å; A100-L252 HydrophobicContact CB-CD2 3.99Å; A100-F276 HydrophobicContact CB-CE1 3.93Å; A100-F276 HydrophobicContact CB-CZ 3.9Å
101	Y	96.9	Very high	94.3	Very high	28 Å²	28	23.2 Å²	23.2	11%	0.11	12%	0.119	C	C	.	.	H	α-helix	trans	-60.2	-50.1	179	-171.9	-97.3	0	0	0	111.7	L97 Q98 V99 V103 L104 E105 L271 F276 V279 S280 Y283	L97-Y101 WeakPolarHBondContact O-CB 3.46Å; L97-Y101 PolarHBondContact O-N 3.23Å; Q98-Y101 PolarHBondContact O-N 3.45Å; V99-Y101 PolarHBondContact O-N 3.45Å; Y101-V103 PolarHBondContact O-N 3.46Å; Y101-L104 PolarHBondContact O-N 2.56Å; Y101-E105 HydrophobicContact CD1-CG 4.13Å; Y101-E105 HydrophobicContact CE1-CG 3.84Å; Y101-E105 PolarHBondContact O-N 3.23Å; Y101-L271 HydrophobicContact CD2-CD2 3.8Å; Y101-L271 HydrophobicContact CE2-CD2 3.72Å; Y101-L271 HydrophobicContact CG-CD2 4.41Å; Y101-F276 HydrophobicContact CD2-CB 3.67Å; Y101-F276 AromaticContact CD2-CD1 3.77Å; Y101-F276 HydrophobicContact CD2-CD1 3.77Å; Y101-F276 HydrophobicContact CD2-CD2 4.15Å; Y101-F276 HydrophobicContact CD2-CE1 4.44Å; Y101-F276 AromaticContact CD2-CG 3.6Å; Y101-F276 HydrophobicContact CD2-CG 3.6Å; Y101-F276 HydrophobicContact CE2-CB 4.02Å; Y101-F276 HydrophobicContact CE2-CG 4.36Å; Y101-F276 HydrophobicContact CG-CD1 4.25Å; Y101-V279 HydrophobicContact CD1-CG1 4.24Å; Y101-V279 HydrophobicContact CG-CG1 3.97Å; Y101-S280 WeakPolarHBondContact OH-CB 3.32Å; Y101-Y283 AromaticContact CD1-CD2 3.61Å; Y101-Y283 HydrophobicContact CD1-CD2 3.61Å; Y101-Y283 AromaticContact CD1-CE2 3.86Å; Y101-Y283 HydrophobicContact CD1-CE2 3.86Å; Y101-Y283 HydrophobicContact CD1-CG 4.34Å; Y101-Y283 AromaticContact CE1-CD2 3.52Å; Y101-Y283 HydrophobicContact CE1-CD2 3.52Å; Y101-Y283 HydrophobicContact CE1-CE2 4.26Å; Y101-Y283 HydrophobicContact CE1-CG 4.01Å
102	E	96.9	Very high	95	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-67.1	-35.3	-177.9	-66.4	-172.2	142.6	0	0	113	R52 Q98 V99 G106 N132 V133 Y283	R52-E102 WeakPolarHBondContact CG-O 3.37Å; R52-E102 IonicContact CZ-OE1 3.82Å; R52-E102 IonicContact NH1-OE1 3.29Å; R52-E102 PolarHBondContact NH1-OE1 3.34Å; R52-E102 IonicContact NH1-OE2 2.65Å; R52-E102 IonicContact NH2-OE1 2.95Å; R52-E102 PolarHBondContact NH2-OE1 3.1Å; Q98-E102 WeakPolarHBondContact O-CG 2.9Å; Q98-E102 PolarHBondContact O-N 2.9Å; V99-E102 PolarHBondContact O-N 2.81Å; E102-G106 PolarHBondContact O-N 3Å; E102-N132 PolarHBondContact OE1-OD1 3.37Å; E102-V133 HydrophobicContact CB-CB 3.75Å; E102-V133 HydrophobicContact CB-CG1 4.47Å; E102-V133 HydrophobicContact CB-CG2 4.01Å; E102-V133 WeakPolarHBondContact OE2-CB 3.3Å; E102-V133 WeakPolarHBondContact OE2-CG2 3.35Å; E102-V133 PolarHBondContact OE2-N 2.88Å; E102-Y283 HydrophobicContact CG-CE1 4.21Å; E102-Y283 WeakPolarHBondContact OE1-CE1 3.38Å; E102-Y283 PolarHBondContact OE1-OH 3Å
103	V	98.2	Very high	95.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-65.5	-45.7	172	174.1	0	0	0	0	110.1	V99 A100 Y101 E105 G106 L107 L120 V125 V133 L135 L193	V99-V103 HydrophobicContact CG1-CG2 4.15Å; V99-V103 WeakPolarHBondContact O-CB 3.22Å; V99-V103 WeakPolarHBondContact O-CG2 3.33Å; V99-V103 PolarHBondContact O-N 3.47Å; A100-V103 PolarHBondContact O-N 3.28Å; Y101-V103 PolarHBondContact O-N 3.46Å; V103-E105 VanDerWaalsContact C-N 3.35Å; V103-E105 PolarHBondContact O-N 3.47Å; V103-G106 PolarHBondContact O-N 2.8Å; V103-G106 VanDerWaalsContact O-N 3.14Å; V103-L107 HydrophobicContact CG1-CD1 3.93Å; V103-L107 HydrophobicContact CG1-CG 4.17Å; V103-L107 WeakPolarHBondContact O-CG 3.31Å; V103-L107 PolarHBondContact O-N 3.36Å; V103-L120 HydrophobicContact CG1-CD1 4.36Å; V103-L120 HydrophobicContact CG1-CD2 4.15Å; V103-V125 HydrophobicContact CG2-CG1 3.94Å; V103-V125 HydrophobicContact CG2-CG2 4.42Å; V103-V133 HydrophobicContact CG2-CG1 3.87Å; V103-V133 HydrophobicContact CG2-CG2 4.36Å; V103-L135 HydrophobicContact CB-CD2 4.48Å; V103-L135 HydrophobicContact CG1-CD1 4.46Å; V103-L135 HydrophobicContact CG1-CD2 4.11Å; V103-L135 HydrophobicContact CG2-CD2 4.08Å; V103-L193 HydrophobicContact CB-CD1 4.09Å; V103-L193 HydrophobicContact CG1-CD1 3.83Å; V103-L193 HydrophobicContact CG1-CD2 4.39Å; V103-L193 HydrophobicContact CG2-CD1 4.43Å
104	L	97.9	Very high	95.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-39.5	179	-74.1	167.2	0	0	0	112.2	A100 Y101 G106 L107 D108 L193 P267 L270 L271 F276	A100-L104 WeakPolarHBondContact O-CB 3.3Å; A100-L104 WeakPolarHBondContact O-CD1 3.24Å; A100-L104 WeakPolarHBondContact O-CG 3.45Å; A100-L104 PolarHBondContact O-N 3.47Å; Y101-L104 PolarHBondContact O-N 2.56Å; L104-G106 VanDerWaalsContact C-N 3.31Å; L104-G106 PolarHBondContact O-N 3.5Å; L104-L107 PolarHBondContact O-N 3.33Å; L104-D108 WeakPolarHBondContact O-CB 3.47Å; L104-D108 PolarHBondContact O-N 2.92Å; L104-L193 HydrophobicContact CD1-CD2 4.34Å; L104-L193 HydrophobicContact CD2-CD2 3.62Å; L104-L193 HydrophobicContact CG-CD2 3.67Å; L104-P267 HydrophobicContact CD2-CB 4.03Å; L104-L270 HydrophobicContact CD1-CB 3.83Å; L104-L270 HydrophobicContact CD2-CB 3.99Å; L104-L270 HydrophobicContact CD2-CD1 3.9Å; L104-L271 HydrophobicContact CB-CD1 4.45Å; L104-L271 HydrophobicContact CB-CD2 3.58Å; L104-L271 HydrophobicContact CB-CG 3.79Å; L104-F276 HydrophobicContact CD1-CE2 3.62Å; L104-F276 HydrophobicContact CD1-CZ 3.68Å
105	E	96.8	Very high	95.5	Very high	26 Å²	26	27.3 Å²	27.3	12%	0.121	14%	0.143	C	C	.	.	H	α-helix	trans	-56.9	-45.3	172.2	-77.5	-166.9	114.4	0	0	111.4	R52 Y101 V103 F109 L271	R52-E105 HydrophobicContact CG-CB 4.01Å; R52-E105 IonicContact CZ-OE2 3.75Å; R52-E105 IonicContact NE-OE2 2.83Å; R52-E105 PolarHBondContact NE-OE2 3.37Å; R52-E105 IonicContact NH2-OE2 3.68Å; Y101-E105 HydrophobicContact CD1-CG 4.13Å; Y101-E105 HydrophobicContact CE1-CG 3.84Å; Y101-E105 PolarHBondContact O-N 3.23Å; V103-E105 VanDerWaalsContact C-N 3.35Å; V103-E105 PolarHBondContact O-N 3.47Å; E105-F109 WeakPolarHBondContact O-CB 3.37Å; E105-F109 PolarHBondContact O-N 2.93Å; E105-F109 VanDerWaalsContact O-N 3.09Å; E105-L271 HydrophobicContact CG-CD2 4.08Å
106	G	97.1	Very high	95.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63	-44.8	176.2	0	0	0	0	0	112.8	E102 V103 L104 F109 M110	E102-G106 PolarHBondContact O-N 3Å; V103-G106 PolarHBondContact O-N 2.8Å; V103-G106 VanDerWaalsContact O-N 3.14Å; L104-G106 VanDerWaalsContact C-N 3.31Å; L104-G106 PolarHBondContact O-N 3.5Å; G106-F109 PolarHBondContact O-N 2.94Å; G106-M110 VanDerWaalsContact O-CG 3.31Å; G106-M110 WeakPolarHBondContact O-CG 3.38Å; G106-M110 PolarHBondContact O-N 3.06Å
107	L	97.7	Very high	95.8	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-67	-43.8	179.8	-67.3	177.9	0	0	0	112.3	V103 L104 F109 M110 N111 H117 L120 L135 D189 P267	V103-L107 HydrophobicContact CG1-CD1 3.93Å; V103-L107 HydrophobicContact CG1-CG 4.17Å; V103-L107 WeakPolarHBondContact O-CG 3.31Å; V103-L107 PolarHBondContact O-N 3.36Å; L104-L107 PolarHBondContact O-N 3.33Å; L107-F109 VanDerWaalsContact C-N 3.34Å; L107-F109 PolarHBondContact O-N 3.48Å; L107-M110 HydrophobicContact CD2-SD 4.42Å; L107-M110 WeakPolarHBondContact O-CB 3.32Å; L107-M110 PolarHBondContact O-N 2.67Å; L107-N111 PolarHBondContact O-N 3.06Å; L107-N111 PolarHBondContact O-ND2 2.87Å; L107-N111 PolarHBondContact O-OD1 3.46Å; L107-H117 HydrophobicContact CD2-CB 4.06Å; L107-L120 HydrophobicContact CD1-CD2 4.31Å; L107-L135 HydrophobicContact CD2-CD1 4.23Å; L107-L135 HydrophobicContact CG-CD1 4.37Å; L107-D189 HydrophobicContact CD1-CB 3.98Å; L107-D189 HydrophobicContact CD2-CB 3.93Å; L107-P267 HydrophobicContact CB-CB 3.95Å; L107-P267 HydrophobicContact CB-CG 3.89Å
108	D	96.6	Very high	95.6	Very high	24 Å²	24	26.4 Å²	26.4	13%	0.128	14%	0.139	C	C	.	.	H	α-helix	trans	-60.3	-44.9	175.4	173.7	56.5	0	0	0	111.2	L104 M110 N111 K112 P267 A268 L271	L104-D108 WeakPolarHBondContact O-CB 3.47Å; L104-D108 PolarHBondContact O-N 2.92Å; D108-M110 VanDerWaalsContact C-N 3.33Å; D108-M110 PolarHBondContact O-N 3.28Å; D108-N111 PolarHBondContact O-N 2.89Å; D108-K112 WeakPolarHBondContact O-CG 3.27Å; D108-K112 PolarHBondContact O-N 3.02Å; D108-K112 WeakPolarHBondContact OD1-CE 3.37Å; D108-K112 IonicContact OD1-NZ 3.73Å; D108-K112 VanDerWaalsContact OD2-CE 3.27Å; D108-K112 WeakPolarHBondContact OD2-CE 3.39Å; D108-K112 IonicContact OD2-NZ 3.58Å; D108-K112 PolarHBondContact OD2-NZ 3.07Å; D108-P267 HydrophobicContact CB-CB 4.28Å; D108-A268 WeakPolarHBondContact OD1-CB 3.42Å; D108-L271 HydrophobicContact CB-CD1 3.67Å
109	F	96.3	Very high	95.5	Very high	29 Å²	29	24 Å²	24	13%	0.127	13%	0.129	C	C	.	.	H	α-helix	trans	-58.4	-44.9	174.8	-178	-89.4	0	0	0	111.9	I48 H50 L53 E105 G106 L107 K112 H113 F286	I48-F109 HydrophobicContact CG2-CD1 4.48Å; I48-F109 HydrophobicContact CG2-CE1 3.8Å; H50-F109 HydrophobicContact CB-CD1 3.88Å; H50-F109 HydrophobicContact CB-CE1 3.9Å; H50-F109 HydrophobicContact CB-CG 4.19Å; H50-F109 HydrophobicContact CB-CZ 4.23Å; H50-F109 AromaticContact CD2-CD2 3.38Å; H50-F109 WeakPolarHBondContact CD2-CD2 3.4Å; H50-F109 AromaticContact CD2-CE2 3.83Å; H50-F109 AromaticContact CD2-CG 3.54Å; H50-F109 AromaticContact CG-CG 3.82Å; H50-F109 AromaticContact NE2-CD2 4Å; L53-F109 HydrophobicContact CD1-CD1 3.71Å; L53-F109 HydrophobicContact CD1-CE1 4.14Å; E105-F109 WeakPolarHBondContact O-CB 3.37Å; E105-F109 PolarHBondContact O-N 2.93Å; E105-F109 VanDerWaalsContact O-N 3.09Å; G106-F109 PolarHBondContact O-N 2.94Å; L107-F109 VanDerWaalsContact C-N 3.34Å; L107-F109 PolarHBondContact O-N 3.48Å; F109-K112 PolarHBondContact O-N 2.92Å; F109-H113 AromaticContact CD1-ND1 3.94Å; F109-H113 AromaticContact CE1-CE1 3.54Å; F109-H113 AromaticContact CE1-ND1 3.7Å; F109-H113 AromaticContact CE2-CE1 3.49Å; F109-H113 VanDerWaalsContact CE2-CE1 3.49Å; F109-H113 WeakPolarHBondContact CE2-CE1 3.38Å; F109-H113 AromaticContact CZ-CE1 3.2Å; F109-H113 WeakPolarHBondContact CZ-CE1 3.43Å; F109-H113 AromaticContact CZ-ND1 3.85Å; F109-H113 AromaticContact CZ-NE2 3.84Å; F109-H113 PolarHBondContact O-N 3.21Å; F109-H113 PolarHBondContact O-ND1 2.97Å; F109-F286 HydrophobicContact CD2-CD1 4.24Å; F109-F286 HydrophobicContact CD2-CE1 4.49Å; F109-F286 AromaticContact CE2-CD1 3.89Å; F109-F286 HydrophobicContact CE2-CD1 3.89Å; F109-F286 AromaticContact CE2-CE1 3.72Å; F109-F286 HydrophobicContact CE2-CE1 3.72Å; F109-F286 HydrophobicContact CZ-CE1 4.29Å
110	M	95.4	Very high	95.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61	-44.6	175.9	-74.8	176.6	56.8	0	0	112.2	L53 G106 L107 D108 K112 H113 G114 L115 H117 F138	L53-M110 HydrophobicContact CD1-CG 3.86Å; L53-M110 HydrophobicContact CD2-CG 4.05Å; L53-M110 HydrophobicContact CD2-SD 3.9Å; G106-M110 VanDerWaalsContact O-CG 3.31Å; G106-M110 WeakPolarHBondContact O-CG 3.38Å; G106-M110 PolarHBondContact O-N 3.06Å; L107-M110 HydrophobicContact CD2-SD 4.42Å; L107-M110 WeakPolarHBondContact O-CB 3.32Å; L107-M110 PolarHBondContact O-N 2.67Å; D108-M110 VanDerWaalsContact C-N 3.33Å; D108-M110 PolarHBondContact O-N 3.28Å; M110-K112 VanDerWaalsContact C-N 3.32Å; M110-K112 PolarHBondContact O-N 2.86Å; M110-H113 CarbonylContact O-C 3.57Å; M110-H113 WeakPolarHBondContact O-CA 3.37Å; M110-H113 PolarHBondContact O-N 2.94Å; M110-G114 PolarHBondContact O-N 3.36Å; M110-L115 CarbonylContact C-O 3.34Å; M110-L115 HydrophobicContact CB-CB 4.06Å; M110-L115 HydrophobicContact CE-CB 4.06Å; M110-L115 WeakPolarHBondContact O-CB 3.32Å; M110-L115 PolarHBondContact O-N 2.98Å; M110-H117 HydrophobicContact CE-CB 3.83Å; M110-H117 HydrophobicContact SD-CB 4.45Å; M110-F138 HydrophobicContact CE-CB 3.65Å; M110-F138 HydrophobicContact CE-CD2 3.84Å; M110-F138 HydrophobicContact CE-CG 4.11Å; M110-F138 HydrophobicContact CG-CD2 4.35Å; M110-F138 HydrophobicContact SD-CB 3.68Å; M110-F138 HydrophobicContact SD-CD2 3.93Å; M110-F138 HydrophobicContact SD-CG 3.91Å
111	N	94.3	Very high	95.3	Very high	33 Å²	33	24.3 Å²	24.3	18%	0.176	13%	0.131	C	C	.	.	H	α-helix	trans	-64.6	-37.3	-178.2	-59	159.3	0	0	0	111.9	L107 D108 H113 G114 L115 P186 P267	L107-N111 PolarHBondContact O-N 3.06Å; L107-N111 PolarHBondContact O-ND2 2.87Å; L107-N111 PolarHBondContact O-OD1 3.46Å; D108-N111 PolarHBondContact O-N 2.89Å; N111-H113 PolarHBondContact O-N 3.36Å; N111-G114 PolarHBondContact O-N 2.96Å; N111-L115 PolarHBondContact N-O 3.26Å; N111-L115 PolarHBondContact ND2-O 2.56Å; N111-P186 HydrophobicContact CB-CB 4.49Å; N111-P186 HydrophobicContact CB-CG 4.15Å; N111-P186 WeakPolarHBondContact OD1-CB 3.29Å; N111-P267 VanDerWaalsContact OD1-CG 3.31Å; N111-P267 WeakPolarHBondContact OD1-CG 3.39Å
112	K	94.1	Very high	95	Very high	149 Å²	149	23.4 Å²	23.4	65%	0.648	13%	0.129	S	C	*	.	H	α-helix	trans	-60.9	-21.5	171.6	-73.5	168.5	177.3	163.5	0	113.3	D108 F109 M110	D108-K112 WeakPolarHBondContact O-CG 3.27Å; D108-K112 PolarHBondContact O-N 3.02Å; D108-K112 WeakPolarHBondContact OD1-CE 3.37Å; D108-K112 IonicContact OD1-NZ 3.73Å; D108-K112 VanDerWaalsContact OD2-CE 3.27Å; D108-K112 WeakPolarHBondContact OD2-CE 3.39Å; D108-K112 IonicContact OD2-NZ 3.58Å; D108-K112 PolarHBondContact OD2-NZ 3.07Å; F109-K112 PolarHBondContact O-N 2.92Å; M110-K112 VanDerWaalsContact C-N 3.32Å; M110-K112 PolarHBondContact O-N 2.86Å
113	H	93.3	Very high	94.8	Very high	87 Å²	87	26.5 Å²	26.5	40%	0.403	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	11.3	173.9	-66.6	78.7	0	0	0	113.2	I48 F109 M110 N111 L115	I48-H113 HydrophobicContact CD1-CB 4.23Å; F109-H113 AromaticContact CD1-ND1 3.94Å; F109-H113 AromaticContact CE1-CE1 3.54Å; F109-H113 AromaticContact CE1-ND1 3.7Å; F109-H113 AromaticContact CE2-CE1 3.49Å; F109-H113 VanDerWaalsContact CE2-CE1 3.49Å; F109-H113 WeakPolarHBondContact CE2-CE1 3.38Å; F109-H113 AromaticContact CZ-CE1 3.2Å; F109-H113 WeakPolarHBondContact CZ-CE1 3.43Å; F109-H113 AromaticContact CZ-ND1 3.85Å; F109-H113 AromaticContact CZ-NE2 3.84Å; F109-H113 PolarHBondContact O-N 3.21Å; F109-H113 PolarHBondContact O-ND1 2.97Å; M110-H113 CarbonylContact O-C 3.57Å; M110-H113 WeakPolarHBondContact O-CA 3.37Å; M110-H113 PolarHBondContact O-N 2.94Å; N111-H113 PolarHBondContact O-N 3.36Å; H113-L115 VanDerWaalsContact C-N 3.28Å; H113-L115 HydrophobicContact CB-CD1 4.41Å; H113-L115 HydrophobicContact CB-CG 4.44Å; H113-L115 PolarHBondContact O-N 2.94Å
114	G	92.8	Very high	94.6	Very high	66 Å²	66	26.9 Å²	26.9	68%	0.68	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.8	19.1	-179.3	0	0	0	0	0	114.3	M110 N111	M110-G114 PolarHBondContact O-N 3.36Å; N111-G114 PolarHBondContact O-N 2.96Å
115	L	94.6	Very high	94.6	Very high	7 Å²	7	26.9 Å²	26.9	4%	0.037	15%	0.148	C	C	.	.			trans	-104.4	147.2	-179.3	-59.3	174.2	0	0	0	111.5	L45 I48 M110 N111 H113 F138 H142	L45-L115 HydrophobicContact CD2-CD1 4.09Å; L45-L115 HydrophobicContact CD2-CD2 4.43Å; I48-L115 HydrophobicContact CD1-CD1 4.4Å; I48-L115 HydrophobicContact CG1-CD1 4.19Å; M110-L115 CarbonylContact C-O 3.34Å; M110-L115 HydrophobicContact CB-CB 4.06Å; M110-L115 HydrophobicContact CE-CB 4.06Å; M110-L115 WeakPolarHBondContact O-CB 3.32Å; M110-L115 PolarHBondContact O-N 2.98Å; N111-L115 PolarHBondContact N-O 3.26Å; N111-L115 PolarHBondContact ND2-O 2.56Å; H113-L115 VanDerWaalsContact C-N 3.28Å; H113-L115 HydrophobicContact CB-CD1 4.41Å; H113-L115 HydrophobicContact CB-CG 4.44Å; H113-L115 PolarHBondContact O-N 2.94Å; L115-F138 HydrophobicContact CD1-CE2 4.42Å; L115-H142 HydrophobicContact CD2-CB 3.67Å; L115-H142 WeakPolarHBondContact CD2-CD2 3.37Å; L115-H142 VanDerWaalsContact CD2-CG 3.48Å
116	V	94.1	Very high	94.6	Very high	17 Å²	17	25.9 Å²	25.9	10%	0.103	14%	0.143	C	C	.	.			trans	-132.4	135.9	174.2	-174.6	0	0	0	0	107.1	R118 P186 D189	V116-R118 HydrophobicContact CB-CG 4.5Å; V116-R118 HydrophobicContact CG1-CG 3.9Å; V116-P186 HydrophobicContact CG2-CG 4.42Å; V116-D189 WeakPolarHBondContact CG1-OD2 3.47Å
117	H	95.3	Very high	94.5	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.144	C	C	.	.			trans	-72.1	-47.3	-171.2	-170.8	-35.8	0	0	0	112.3	L107 M110 A119 L120 A136 D189	L107-H117 HydrophobicContact CD2-CB 4.06Å; M110-H117 HydrophobicContact CE-CB 3.83Å; M110-H117 HydrophobicContact SD-CB 4.45Å; H117-A119 VanDerWaalsContact CE1-C 3.43Å; H117-A119 PolarHBondContact ND1-N 3.27Å; H117-A119 PolarHBondContact O-N 3.01Å; H117-L120 PolarHBondContact ND1-N 2.99Å; H117-A136 PolarHBondContact CE1-O 3.44Å; H117-A136 VanDerWaalsContact CE1-O 3.29Å; H117-A136 PolarHBondContact NE2-O 2.89Å; H117-D189 PolarHBondContact N-OD1 2.88Å; H117-D189 PolarHBondContact N-OD2 3.16Å
118	R	92.7	Very high	94.2	Very high	28 Å²	28	27.1 Å²	27.1	11%	0.106	15%	0.15	C	C	.	.	S	Bend	trans	55.5	2.3	178.2	-75.9	-69.8	-85.2	96	4.8	117.5	V116 Y141 I154 G155 S184 D189	V116-R118 HydrophobicContact CB-CG 4.5Å; V116-R118 HydrophobicContact CG1-CG 3.9Å; R118-Y141 HydrophobicContact CB-CD1 4.08Å; R118-Y141 HydrophobicContact CB-CD2 3.98Å; R118-Y141 HydrophobicContact CB-CG 3.71Å; R118-Y141 HydrophobicContact CG-CD1 3.6Å; R118-Y141 HydrophobicContact CG-CD2 3.97Å; R118-Y141 HydrophobicContact CG-CE1 3.75Å; R118-Y141 HydrophobicContact CG-CE2 4.13Å; R118-Y141 HydrophobicContact CG-CG 3.71Å; R118-I154 HydrophobicContact CB-CG2 4.45Å; R118-I154 PolarHBondContact NH1-O 3.28Å; R118-G155 VanDerWaalsContact O-CA 3.25Å; R118-G155 WeakPolarHBondContact O-CA 3.25Å; R118-S184 VanDerWaalsContact CD-CB 3.46Å; R118-S184 VanDerWaalsContact NE-CB 3.33Å; R118-S184 PolarHBondContact NE-OG 2.97Å; R118-D189 PolarHBondContact N-OD1 2.62Å
119	A	91.8	Very high	93.7	Very high	9 Å²	9	30 Å²	30	7%	0.074	17%	0.171	C	C	.	.			trans	-138.3	23	-179.5	0	0	0	0	0	111.7	H117 S121 N124	H117-A119 VanDerWaalsContact CE1-C 3.43Å; H117-A119 PolarHBondContact ND1-N 3.27Å; H117-A119 PolarHBondContact O-N 3.01Å; A119-S121 PolarHBondContact O-N 3.46Å; A119-N124 PolarHBondContact O-ND2 3.35Å
120	L	94.6	Very high	93.3	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.01	20%	0.198	C	C	.	.			trans	-65.3	125.5	179.1	-170.9	67.9	0	0	0	109.6	V103 L107 H117 V125 L135 L193	V103-L120 HydrophobicContact CG1-CD1 4.36Å; V103-L120 HydrophobicContact CG1-CD2 4.15Å; L107-L120 HydrophobicContact CD1-CD2 4.31Å; H117-L120 PolarHBondContact ND1-N 2.99Å; L120-V125 HydrophobicContact CD1-CG2 3.68Å; L120-L135 HydrophobicContact CD1-CD2 3.98Å; L120-L193 HydrophobicContact CD2-CB 3.96Å
121	S	92.9	Very high	93	Very high	4 Å²	4	36.9 Å²	36.9	3%	0.028	21%	0.205	C	C	.	.			trans	-158.5	164.1	177.9	70.9	0	0	0	0	108.8	A119 N123 N124 V125	A119-S121 PolarHBondContact O-N 3.46Å; S121-N123 PolarHBondContact O-N 3.22Å; S121-N123 VanDerWaalsContact O-N 3.1Å; S121-N124 PolarHBondContact O-N 3.18Å; S121-V125 PolarHBondContact O-N 3.23Å
122	P	92.3	Very high	92.9	Very high	9 Å²	9	37.6 Å²	37.6	6%	0.058	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-54	-32.9	179.2	-27.3	33.9	0	0	0	114	N77 N124 V125 Y159 L196 E199	N77-P122 PolarHBondContact OD1-O 3.48Å; P122-N124 VanDerWaalsContact C-N 3.3Å; P122-N124 PolarHBondContact O-N 2.99Å; P122-V125 PolarHBondContact O-N 3.26Å; P122-Y159 VanDerWaalsContact CD-CE1 3.47Å; P122-Y159 WeakPolarHBondContact CD-OH 3.28Å; P122-Y159 HydrophobicContact CG-CE1 4.08Å; P122-Y159 WeakPolarHBondContact CG-OH 3.49Å; P122-L196 HydrophobicContact CG-CD1 4.36Å; P122-L196 HydrophobicContact CG-CG 4.23Å; P122-E199 WeakPolarHBondContact CG-OE2 3.43Å
123	N	91.3	Very high	93	Very high	66 Å²	66	30.5 Å²	30.5	35%	0.353	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-71.4	-24.2	178.5	-63.4	-10.7	0	0	0	113.1	S121 L126	S121-N123 PolarHBondContact O-N 3.22Å; S121-N123 VanDerWaalsContact O-N 3.1Å; N123-L126 WeakPolarHBondContact O-CD2 3.41Å
124	N	95.1	Very high	93.2	Very high	9 Å²	9	27.2 Å²	27.2	5%	0.048	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-98.9	1.8	-179.3	-70.7	-22	0	0	0	112.6	A119 S121 P122 A136 K137	A119-N124 PolarHBondContact O-ND2 3.35Å; S121-N124 PolarHBondContact O-N 3.18Å; P122-N124 VanDerWaalsContact C-N 3.3Å; P122-N124 PolarHBondContact O-N 2.99Å; N124-A136 PolarHBondContact O-N 2.99Å; N124-K137 WeakPolarHBondContact OD1-CD 3.3Å
125	V	97	Very high	93.4	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	90	169.9	-173.5	0	0	0	0	107.6	N77 V78 V103 L120 S121 P122 V133 L135 L196	N77-V125 CarbonylContact C-O 3.21Å; N77-V125 WeakPolarHBondContact CA-O 3.49Å; V78-V125 HydrophobicContact CB-CB 4.13Å; V78-V125 HydrophobicContact CB-CG1 4.18Å; V78-V125 HydrophobicContact CG2-CB 3.95Å; V78-V125 HydrophobicContact CG2-CG1 3.47Å; V78-V125 VanDerWaalsContact CG2-CG1 3.47Å; V78-V125 PolarHBondContact N-O 3.05Å; V103-V125 HydrophobicContact CG2-CG1 3.94Å; V103-V125 HydrophobicContact CG2-CG2 4.42Å; L120-V125 HydrophobicContact CD1-CG2 3.68Å; S121-V125 PolarHBondContact O-N 3.23Å; P122-V125 PolarHBondContact O-N 3.26Å; V125-V133 HydrophobicContact CG1-CB 4.4Å; V125-V133 HydrophobicContact CG1-CG1 3.67Å; V125-V133 HydrophobicContact CG1-CG2 3.96Å; V125-L135 HydrophobicContact CB-CD2 4.49Å; V125-L135 HydrophobicContact CG1-CD2 4.26Å; V125-L135 HydrophobicContact CG2-CD2 3.92Å; V125-L196 HydrophobicContact CG2-CD1 3.65Å
126	L	96.7	Very high	93.6	Very high	5 Å²	5	24.2 Å²	24.2	3%	0.026	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	163.7	-178	-51.5	-174.4	0	0	0	111.3	H73 Y74 R76 N77 N123 V133 K134 A136	H73-L126 WeakPolarHBondContact ND1-CD1 3.43Å; Y74-L126 HydrophobicContact CD2-CB 4.47Å; R76-L126 WeakPolarHBondContact O-CA 3.37Å; N77-L126 HydrophobicContact CB-CD2 3.85Å; N123-L126 WeakPolarHBondContact O-CD2 3.41Å; L126-V133 WeakPolarHBondContact O-CA 3.47Å; L126-K134 WeakPolarHBondContact CA-O 3.48Å; L126-K134 HydrophobicContact CB-CB 4.19Å; L126-K134 WeakPolarHBondContact CB-O 3.49Å; L126-K134 PolarHBondContact N-O 2.78Å; L126-K134 PolarHBondContact O-N 2.83Å; L126-A136 HydrophobicContact CD1-CB 3.69Å; L126-A136 HydrophobicContact CG-CB 3.87Å
127	L	94.6	Very high	93.6	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.016	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	128	-178.2	-60.9	170.3	0	0	0	110.7	Y74 R76 V78 F81 N132 V133	Y74-L127 VanDerWaalsContact CB-O 3.32Å; Y74-L127 WeakPolarHBondContact CB-O 3.1Å; R76-L127 HydrophobicContact CB-CB 4.21Å; R76-L127 PolarHBondContact O-N 2.87Å; V78-L127 HydrophobicContact CG2-CD1 4.3Å; V78-L127 HydrophobicContact CG2-CD2 3.87Å; V78-L127 HydrophobicContact CG2-CG 4.16Å; F81-L127 HydrophobicContact CD1-CD1 4.25Å; F81-L127 HydrophobicContact CE1-CD1 3.34Å; F81-L127 HydrophobicContact CE2-CD1 4.19Å; F81-L127 HydrophobicContact CZ-CD1 3.31Å; F81-L127 HydrophobicContact CZ-CD2 4.15Å; F81-L127 HydrophobicContact CZ-CG 4.37Å; L127-N132 WeakPolarHBondContact CA-O 3.4Å; L127-V133 HydrophobicContact CD2-CG2 4.32Å
128	D	91.8	Very high	93.6	Very high	22 Å²	22	24.2 Å²	24.2	12%	0.118	13%	0.131	C	C	.	.			trans	-71.7	174.6	170.4	75.4	6.8	0	0	0	111.9	Y74 K130 G131 N132	Y74-D128 HydrophobicContact CD1-CB 4.11Å; Y74-D128 HydrophobicContact CE1-CB 3.63Å; D128-K130 PolarHBondContact O-N 3.32Å; D128-K130 VanDerWaalsContact O-N 3.11Å; D128-K130 VanDerWaalsContact OD1-C 3.28Å; D128-K130 VanDerWaalsContact OD1-CA 3.31Å; D128-K130 WeakPolarHBondContact OD1-CA 3.23Å; D128-K130 WeakPolarHBondContact OD1-CB 3.47Å; D128-K130 PolarHBondContact OD1-N 3.46Å; D128-G131 PolarHBondContact O-N 3.36Å; D128-G131 PolarHBondContact OD1-N 3.44Å; D128-N132 PolarHBondContact N-O 3.12Å; D128-N132 VanDerWaalsContact N-O 3.07Å; D128-N132 WeakPolarHBondContact OD1-CB 3.42Å; D128-N132 PolarHBondContact OD1-N 2.82Å; D128-N132 PolarHBondContact OD1-ND2 3.47Å; D128-N132 WeakPolarHBondContact OD2-CB 3.36Å; D128-N132 PolarHBondContact OD2-ND2 2.9Å
129	C	87.3	Confident	93.7	Very high	86 Å²	86	22.9 Å²	22.9	58%	0.581	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.5	178.1	62.9	0	0	0	0	114.1	D6	D6-C129 HydrophobicContact CB-CB 4.14Å; D6-C129 WeakPolarHBondContact OD2-CB 3.48Å; D6-C129 PolarHBondContact OD2-N 2.71Å; D6-C129 PolarHBondContact OD2-SG 3.33Å
130	K	88.1	Confident	93.8	Very high	159 Å²	159	22.8 Å²	22.8	69%	0.691	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-4.2	176.4	-61.2	-177.9	-178.2	-173.6	0	112.3	D128 N132	D128-K130 PolarHBondContact O-N 3.32Å; D128-K130 VanDerWaalsContact O-N 3.11Å; D128-K130 VanDerWaalsContact OD1-C 3.28Å; D128-K130 VanDerWaalsContact OD1-CA 3.31Å; D128-K130 WeakPolarHBondContact OD1-CA 3.23Å; D128-K130 WeakPolarHBondContact OD1-CB 3.47Å; D128-K130 PolarHBondContact OD1-N 3.46Å; K130-N132 WeakPolarHBondContact CB-ND2 3.18Å
131	G	89.1	Confident	93.8	Very high	14 Å²	14	23.3 Å²	23.3	14%	0.144	13%	0.126	C	C	.	.			trans	79.5	20.7	179.9	0	0	0	0	0	114.4	K95 D128	K95-G131 PolarHBondContact NZ-O 3.15Å; D128-G131 PolarHBondContact O-N 3.36Å; D128-G131 PolarHBondContact OD1-N 3.44Å
132	N	92.3	Very high	93.9	Very high	47 Å²	47	25.5 Å²	25.5	25%	0.251	14%	0.135	S	C	.	.			trans	-84.6	146	174	-57.1	-53	0	0	0	111.1	E102 L127 D128 K130	E102-N132 PolarHBondContact OE1-OD1 3.37Å; L127-N132 WeakPolarHBondContact CA-O 3.4Å; D128-N132 PolarHBondContact N-O 3.12Å; D128-N132 VanDerWaalsContact N-O 3.07Å; D128-N132 WeakPolarHBondContact OD1-CB 3.42Å; D128-N132 PolarHBondContact OD1-N 2.82Å; D128-N132 PolarHBondContact OD1-ND2 3.47Å; D128-N132 WeakPolarHBondContact OD2-CB 3.36Å; D128-N132 PolarHBondContact OD2-ND2 2.9Å; K130-N132 WeakPolarHBondContact CB-ND2 3.18Å
133	V	96.3	Very high	94.1	Very high	1 Å²	1	25 Å²	25	1%	0.006	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	137	-180	166.4	0	0	0	0	112.9	R52 V99 E102 V103 V125 L126 L127 L135	R52-V133 WeakPolarHBondContact CA-O 3.44Å; V99-V133 HydrophobicContact CB-CG2 4.47Å; V99-V133 HydrophobicContact CG1-CG2 4.16Å; V99-V133 HydrophobicContact CG2-CG2 4.35Å; E102-V133 HydrophobicContact CB-CB 3.75Å; E102-V133 HydrophobicContact CB-CG1 4.47Å; E102-V133 HydrophobicContact CB-CG2 4.01Å; E102-V133 WeakPolarHBondContact OE2-CB 3.3Å; E102-V133 WeakPolarHBondContact OE2-CG2 3.35Å; E102-V133 PolarHBondContact OE2-N 2.88Å; V103-V133 HydrophobicContact CG2-CG1 3.87Å; V103-V133 HydrophobicContact CG2-CG2 4.36Å; V125-V133 HydrophobicContact CG1-CB 4.4Å; V125-V133 HydrophobicContact CG1-CG1 3.67Å; V125-V133 HydrophobicContact CG1-CG2 3.96Å; L126-V133 WeakPolarHBondContact O-CA 3.47Å; L127-V133 HydrophobicContact CD2-CG2 4.32Å; V133-L135 HydrophobicContact CG1-CD2 3.9Å; V133-L135 HydrophobicContact CG1-CG 4.34Å
134	K	96.7	Very high	94.2	Very high	18 Å²	18	21.9 Å²	21.9	8%	0.078	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	106.1	171.8	-73.4	-81.3	-172.7	153.4	0	110	P51 E72 Y74 L126 A136	P51-K134 VanDerWaalsContact O-CD 3.3Å; P51-K134 WeakPolarHBondContact O-CD 3.37Å; P51-K134 WeakPolarHBondContact O-CE 3.35Å; E72-K134 IonicContact OE1-NZ 3.05Å; E72-K134 PolarHBondContact OE1-NZ 2.69Å; E72-K134 IonicContact OE2-NZ 3.1Å; E72-K134 PolarHBondContact OE2-NZ 3.39Å; Y74-K134 HydrophobicContact CD2-CB 4.19Å; Y74-K134 HydrophobicContact CD2-CG 4.13Å; Y74-K134 HydrophobicContact CE2-CB 4.16Å; Y74-K134 HydrophobicContact CE2-CD 3.98Å; Y74-K134 HydrophobicContact CE2-CG 3.67Å; L126-K134 WeakPolarHBondContact CA-O 3.48Å; L126-K134 HydrophobicContact CB-CB 4.19Å; L126-K134 WeakPolarHBondContact CB-O 3.49Å; L126-K134 PolarHBondContact N-O 2.78Å; L126-K134 PolarHBondContact O-N 2.83Å; K134-A136 PolarHBondContact O-N 3.05Å
135	L	98	Very high	94.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	126.3	177.6	-55.3	-178.8	0	0	0	110.5	R52 L53 C54 V103 L107 L120 V125 V133	R52-L135 WeakPolarHBondContact O-CG 3.41Å; R52-L135 PolarHBondContact O-N 3.46Å; L53-L135 HydrophobicContact CD2-CB 3.79Å; L53-L135 HydrophobicContact CD2-CD1 3.85Å; L53-L135 HydrophobicContact CD2-CG 4.16Å; C54-L135 WeakPolarHBondContact CB-O 3.41Å; C54-L135 PolarHBondContact N-O 2.98Å; C54-L135 PolarHBondContact SG-O 3.3Å; V103-L135 HydrophobicContact CB-CD2 4.48Å; V103-L135 HydrophobicContact CG1-CD1 4.46Å; V103-L135 HydrophobicContact CG1-CD2 4.11Å; V103-L135 HydrophobicContact CG2-CD2 4.08Å; L107-L135 HydrophobicContact CD2-CD1 4.23Å; L107-L135 HydrophobicContact CG-CD1 4.37Å; L120-L135 HydrophobicContact CD1-CD2 3.98Å; V125-L135 HydrophobicContact CB-CD2 4.49Å; V125-L135 HydrophobicContact CG1-CD2 4.26Å; V125-L135 HydrophobicContact CG2-CD2 3.92Å; V133-L135 HydrophobicContact CG1-CD2 3.9Å; V133-L135 HydrophobicContact CG1-CG 4.34Å
136	A	96.9	Very high	93.8	Very high	10 Å²	10	28.4 Å²	28.4	8%	0.083	15%	0.148	C	C	.	.			trans	-109.6	160	179.5	0	0	0	0	0	111.5	H117 N124 L126 K134 F138	H117-A136 PolarHBondContact CE1-O 3.44Å; H117-A136 VanDerWaalsContact CE1-O 3.29Å; H117-A136 PolarHBondContact NE2-O 2.89Å; N124-A136 PolarHBondContact O-N 2.99Å; L126-A136 HydrophobicContact CD1-CB 3.69Å; L126-A136 HydrophobicContact CG-CB 3.87Å; K134-A136 PolarHBondContact O-N 3.05Å; A136-F138 PolarHBondContact O-N 3.39Å
137	K	94.2	Very high	93.4	Very high	16 Å²	16	29 Å²	29	7%	0.07	16%	0.155	C	C	.	.	S	Bend	trans	58.1	15	176	-52.3	-167.3	-171.9	-172.8	0	115.9	Y56 N124 G139 L140 D381 T383	Y56-K137 VanDerWaalsContact OH-CA 3.26Å; Y56-K137 WeakPolarHBondContact OH-CA 3.35Å; N124-K137 WeakPolarHBondContact OD1-CD 3.3Å; K137-G139 PolarHBondContact O-N 3.42Å; K137-G139 VanDerWaalsContact O-N 3.14Å; K137-L140 PolarHBondContact O-N 2.92Å; K137-D381 PolarHBondContact NZ-O 2.82Å; K137-D381 IonicContact NZ-OD1 2.76Å; K137-D381 PolarHBondContact NZ-OD1 2.99Å; K137-T383 WeakPolarHBondContact CE-OG1 3.19Å
138	F	95.8	Very high	93	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-17	-176.9	70.7	-98.9	0	0	0	114.3	L45 I48 L53 C54 Y56 M110 L115 A136	L45-F138 HydrophobicContact CD2-CE2 4.32Å; I48-F138 HydrophobicContact CG2-CE2 4.09Å; I48-F138 HydrophobicContact CG2-CZ 4Å; L53-F138 HydrophobicContact CB-CD1 4.41Å; L53-F138 HydrophobicContact CB-CE1 3.8Å; L53-F138 HydrophobicContact CB-CZ 4.22Å; L53-F138 HydrophobicContact CD1-CE1 4.39Å; L53-F138 HydrophobicContact CD1-CE2 4.41Å; L53-F138 HydrophobicContact CD1-CZ 4.16Å; L53-F138 HydrophobicContact CD2-CD1 4.2Å; L53-F138 HydrophobicContact CD2-CE1 4.35Å; L53-F138 HydrophobicContact CG-CE1 4.4Å; C54-F138 VanDerWaalsContact O-CE1 3.29Å; C54-F138 WeakPolarHBondContact O-CE1 3.38Å; Y56-F138 AromaticContact CD2-CE1 3.96Å; Y56-F138 HydrophobicContact CD2-CE1 3.96Å; Y56-F138 HydrophobicContact CD2-CE2 4.16Å; Y56-F138 AromaticContact CD2-CZ 3.61Å; Y56-F138 HydrophobicContact CD2-CZ 3.61Å; Y56-F138 AromaticContact CE2-CD1 3.99Å; Y56-F138 HydrophobicContact CE2-CD1 3.99Å; Y56-F138 HydrophobicContact CE2-CD2 4.17Å; Y56-F138 AromaticContact CE2-CE1 3.61Å; Y56-F138 HydrophobicContact CE2-CE1 3.61Å; Y56-F138 AromaticContact CE2-CE2 3.8Å; Y56-F138 HydrophobicContact CE2-CE2 3.8Å; Y56-F138 HydrophobicContact CE2-CG 4.25Å; Y56-F138 AromaticContact CE2-CZ 3.5Å; Y56-F138 HydrophobicContact CE2-CZ 3.5Å; Y56-F138 PolarHBondContact OH-N 3.18Å; M110-F138 HydrophobicContact CE-CB 3.65Å; M110-F138 HydrophobicContact CE-CD2 3.84Å; M110-F138 HydrophobicContact CE-CG 4.11Å; M110-F138 HydrophobicContact CG-CD2 4.35Å; M110-F138 HydrophobicContact SD-CB 3.68Å; M110-F138 HydrophobicContact SD-CD2 3.93Å; M110-F138 HydrophobicContact SD-CG 3.91Å; L115-F138 HydrophobicContact CD1-CE2 4.42Å; A136-F138 PolarHBondContact O-N 3.39Å
139	G	95.4	Very high	92.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-9	-178.9	0	0	0	0	0	115.1	Y56 K137 Y141 H142 M143	Y56-G139 WeakPolarHBondContact OH-CA 3.48Å; Y56-G139 PolarHBondContact OH-N 3.12Å; K137-G139 PolarHBondContact O-N 3.42Å; K137-G139 VanDerWaalsContact O-N 3.14Å; G139-Y141 PolarHBondContact O-N 2.77Å; G139-H142 PolarHBondContact O-N 2.84Å; G139-M143 VanDerWaalsContact C-CE 3.46Å; G139-M143 WeakPolarHBondContact O-CE 3.48Å; G139-M143 WeakPolarHBondContact O-CG 3.44Å; G139-M143 PolarHBondContact O-N 3.3Å
140	L	94.2	Very high	92.9	Very high	8 Å²	8	25.2 Å²	25.2	4%	0.042	13%	0.132	C	C	.	.	H	α-helix	trans	-59.7	-48.8	-172.3	-174.4	61.9	0	0	0	111.8	F14 K137 H142 M143 T144 F152 L379	F14-L140 HydrophobicContact CD1-CD1 4.16Å; F14-L140 HydrophobicContact CE1-CD1 3.92Å; F14-L140 HydrophobicContact CZ-CD1 4.15Å; K137-L140 PolarHBondContact O-N 2.92Å; L140-H142 VanDerWaalsContact C-N 3.32Å; L140-H142 PolarHBondContact O-N 3.19Å; L140-M143 HydrophobicContact CD1-SD 4.47Å; L140-M143 WeakPolarHBondContact O-CG 3.33Å; L140-M143 PolarHBondContact O-N 3.19Å; L140-T144 HydrophobicContact CD1-CG2 4.06Å; L140-T144 WeakPolarHBondContact O-CG2 3.35Å; L140-T144 PolarHBondContact O-N 2.74Å; L140-T144 PolarHBondContact O-OG1 3.27Å; L140-F152 HydrophobicContact CD2-CE2 4.42Å; L140-L379 HydrophobicContact CD2-CD1 4.25Å; L140-L379 HydrophobicContact CD2-CD2 4.41Å
141	Y	93.9	Very high	92.7	Very high	13 Å²	13	21.7 Å²	21.7	5%	0.051	12%	0.121	C	C	.	.	H	α-helix	trans	-60.1	-39.3	179	-175.1	-116.8	0	0	0	113.2	R118 G139 H146 I154 S184	R118-Y141 HydrophobicContact CB-CD1 4.08Å; R118-Y141 HydrophobicContact CB-CD2 3.98Å; R118-Y141 HydrophobicContact CB-CG 3.71Å; R118-Y141 HydrophobicContact CG-CD1 3.6Å; R118-Y141 HydrophobicContact CG-CD2 3.97Å; R118-Y141 HydrophobicContact CG-CE1 3.75Å; R118-Y141 HydrophobicContact CG-CE2 4.13Å; R118-Y141 HydrophobicContact CG-CG 3.71Å; G139-Y141 PolarHBondContact O-N 2.77Å; Y141-H146 AromaticContact CD1-ND1 3.57Å; Y141-H146 HydrophobicContact CD2-CB 4.35Å; Y141-H146 HydrophobicContact CE1-CB 4.14Å; Y141-H146 AromaticContact CE1-CG 3.95Å; Y141-H146 AromaticContact CE1-ND1 3.1Å; Y141-H146 WeakPolarHBondContact CE1-ND1 3.43Å; Y141-H146 HydrophobicContact CE2-CB 3.64Å; Y141-H146 WeakPolarHBondContact CE2-O 3.5Å; Y141-H146 AromaticContact CZ-CG 3.82Å; Y141-H146 AromaticContact CZ-ND1 3.46Å; Y141-H146 WeakPolarHBondContact O-CA 3.47Å; Y141-H146 PolarHBondContact O-N 3.29Å; Y141-I154 HydrophobicContact CD2-CB 4.43Å; Y141-I154 HydrophobicContact CD2-CD1 4.08Å; Y141-I154 HydrophobicContact CD2-CG2 4.18Å; Y141-S184 PolarHBondContact OH-N 2.88Å
142	H	95.1	Very high	92.4	Very high	49 Å²	49	22 Å²	22	23%	0.227	12%	0.118	C	C	.	.	H	α-helix	trans	-70.9	-48.7	178.4	170.5	-87.3	0	0	0	112.1	R41 I44 L115 G139 L140 T144 D145	R41-H142 PolarHBondContact O-CE1 3.19Å; I44-H142 VanDerWaalsContact CG2-CE1 3.44Å; I44-H142 WeakPolarHBondContact CG2-CE1 3.03Å; L115-H142 HydrophobicContact CD2-CB 3.67Å; L115-H142 WeakPolarHBondContact CD2-CD2 3.37Å; L115-H142 VanDerWaalsContact CD2-CG 3.48Å; G139-H142 PolarHBondContact O-N 2.84Å; L140-H142 VanDerWaalsContact C-N 3.32Å; L140-H142 PolarHBondContact O-N 3.19Å; H142-T144 PolarHBondContact O-N 2.93Å; H142-D145 PolarHBondContact O-N 2.98Å
143	M	95.9	Very high	91.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65.9	-29.9	-173.2	72.5	179.8	80	0	0	112.3	F14 I38 F42 L45 Y56 V69 G139 L140 D145	F14-M143 HydrophobicContact CE1-SD 4.12Å; F14-M143 HydrophobicContact CZ-SD 3.91Å; I38-M143 WeakPolarHBondContact CA-O 3.31Å; I38-M143 WeakPolarHBondContact CG1-O 3.45Å; I38-M143 HydrophobicContact CG2-CB 4.03Å; I38-M143 HydrophobicContact CG2-CG 3.95Å; I38-M143 HydrophobicContact CG2-SD 4.28Å; F42-M143 HydrophobicContact CD2-CE 3.89Å; F42-M143 HydrophobicContact CD2-SD 4.09Å; F42-M143 HydrophobicContact CE2-CE 4.29Å; L45-M143 HydrophobicContact CD1-CB 4.28Å; L45-M143 HydrophobicContact CD1-CE 3.6Å; Y56-M143 HydrophobicContact CE1-CE 4.17Å; V69-M143 HydrophobicContact CG2-SD 4.17Å; G139-M143 VanDerWaalsContact C-CE 3.46Å; G139-M143 WeakPolarHBondContact O-CE 3.48Å; G139-M143 WeakPolarHBondContact O-CG 3.44Å; G139-M143 PolarHBondContact O-N 3.3Å; L140-M143 HydrophobicContact CD1-SD 4.47Å; L140-M143 WeakPolarHBondContact O-CG 3.33Å; L140-M143 PolarHBondContact O-N 3.19Å; M143-D145 VanDerWaalsContact C-N 3.32Å; M143-D145 PolarHBondContact O-N 2.88Å
144	T	93.9	Very high	91.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	22.5	-179.7	65.8	0	0	0	0	113.9	F14 I38 L140 H142 H146 G147 A148 D149 V150 I154	F14-T144 HydrophobicContact CE2-CG2 3.86Å; F14-T144 HydrophobicContact CZ-CG2 4.16Å; I38-T144 HydrophobicContact CD1-CG2 4.23Å; L140-T144 HydrophobicContact CD1-CG2 4.06Å; L140-T144 WeakPolarHBondContact O-CG2 3.35Å; L140-T144 PolarHBondContact O-N 2.74Å; L140-T144 PolarHBondContact O-OG1 3.27Å; H142-T144 PolarHBondContact O-N 2.93Å; T144-H146 PolarHBondContact O-N 2.58Å; T144-G147 CarbonylContact O-C 3.24Å; T144-G147 WeakPolarHBondContact O-CA 3.34Å; T144-G147 PolarHBondContact O-N 2.85Å; T144-G147 PolarHBondContact OG1-N 3.05Å; T144-A148 PolarHBondContact O-N 2.88Å; T144-A148 VanDerWaalsContact O-N 3.15Å; T144-D149 PolarHBondContact O-N 2.93Å; T144-D149 VanDerWaalsContact O-N 3.14Å; T144-V150 HydrophobicContact CG2-CG1 3.6Å; T144-V150 HydrophobicContact CG2-CG2 4.33Å; T144-I154 WeakPolarHBondContact OG1-CD1 3.46Å
145	D	92.5	Very high	90.9	Very high	56 Å²	56	25 Å²	25	30%	0.299	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	53.3	52.3	-179.4	-156.8	38	0	0	0	113	R41 H142 M143 G147 A148 D149	R41-D145 VanDerWaalsContact CZ-CB 3.42Å; R41-D145 IonicContact CZ-OD1 3.94Å; R41-D145 VanDerWaalsContact CZ-OD1 3.29Å; R41-D145 IonicContact CZ-OD2 2.91Å; R41-D145 IonicContact NE-OD1 3.43Å; R41-D145 PolarHBondContact NE-OD1 3.45Å; R41-D145 IonicContact NH2-OD1 3.68Å; R41-D145 PolarHBondContact NH2-OD1 2.96Å; R41-D145 IonicContact NH2-OD2 2.93Å; R41-D145 PolarHBondContact NH2-OD2 3.15Å; H142-D145 PolarHBondContact O-N 2.98Å; M143-D145 VanDerWaalsContact C-N 3.32Å; M143-D145 PolarHBondContact O-N 2.88Å; D145-G147 PolarHBondContact O-N 3.5Å; D145-A148 HydrophobicContact CB-CB 4.2Å; D145-A148 WeakPolarHBondContact O-CB 3.4Å; D145-A148 PolarHBondContact O-N 3.27Å; D145-D149 WeakPolarHBondContact CB-OD2 3.4Å
146	H	90.6	Very high	90.4	Very high	90 Å²	90	27.9 Å²	27.9	42%	0.417	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	61.3	19.9	-178.2	-50.5	-59.1	0	0	0	114	Y141 T144	Y141-H146 AromaticContact CD1-ND1 3.57Å; Y141-H146 HydrophobicContact CD2-CB 4.35Å; Y141-H146 HydrophobicContact CE1-CB 4.14Å; Y141-H146 AromaticContact CE1-CG 3.95Å; Y141-H146 AromaticContact CE1-ND1 3.1Å; Y141-H146 WeakPolarHBondContact CE1-ND1 3.43Å; Y141-H146 HydrophobicContact CE2-CB 3.64Å; Y141-H146 WeakPolarHBondContact CE2-O 3.5Å; Y141-H146 AromaticContact CZ-CG 3.82Å; Y141-H146 AromaticContact CZ-ND1 3.46Å; Y141-H146 WeakPolarHBondContact O-CA 3.47Å; Y141-H146 PolarHBondContact O-N 3.29Å; T144-H146 PolarHBondContact O-N 2.58Å
147	G	88.1	Confident	89.9	Confident	17 Å²	17	29.4 Å²	29.4	18%	0.175	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	101.2	-4.6	-179	0	0	0	0	0	114.3	T144 D145 D149 V150	T144-G147 CarbonylContact O-C 3.24Å; T144-G147 WeakPolarHBondContact O-CA 3.34Å; T144-G147 PolarHBondContact O-N 2.85Å; T144-G147 PolarHBondContact OG1-N 3.05Å; D145-G147 PolarHBondContact O-N 3.5Å; G147-D149 VanDerWaalsContact C-N 3.3Å; G147-D149 PolarHBondContact O-N 2.93Å; G147-V150 PolarHBondContact O-N 2.88Å; G147-V150 VanDerWaalsContact O-O 3.12Å
148	A	86.9	Confident	89.8	Confident	20 Å²	20	29.1 Å²	29.1	17%	0.165	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-26.9	-178.4	0	0	0	0	0	113.6	T144 D145 P172	T144-A148 PolarHBondContact O-N 2.88Å; T144-A148 VanDerWaalsContact O-N 3.15Å; D145-A148 HydrophobicContact CB-CB 4.2Å; D145-A148 WeakPolarHBondContact O-CB 3.4Å; D145-A148 PolarHBondContact O-N 3.27Å; A148-P172 HydrophobicContact CB-CG 3.96Å
149	D	90.6	Very high	89.7	Confident	7 Å²	7	29.7 Å²	29.7	4%	0.037	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	11.3	-177.4	-71.7	-32.4	0	0	0	113.4	A16 S17 N34 K37 I38 R41 T144 D145 G147	A16-D149 WeakPolarHBondContact CA-O 3.33Å; S17-D149 PolarHBondContact N-O 3.41Å; S17-D149 VanDerWaalsContact OG-C 3.23Å; S17-D149 PolarHBondContact OG-O 2.86Å; N34-D149 HydrophobicContact CB-CB 4.09Å; N34-D149 PolarHBondContact OD1-OD1 2.85Å; K37-D149 IonicContact NZ-OD1 2.65Å; I38-D149 HydrophobicContact CD1-CB 3.86Å; I38-D149 HydrophobicContact CG1-CB 3.9Å; R41-D149 IonicContact CZ-OD2 2.88Å; R41-D149 IonicContact NH1-OD2 3.05Å; R41-D149 PolarHBondContact NH1-OD2 2.8Å; R41-D149 IonicContact NH2-OD2 2.78Å; T144-D149 PolarHBondContact O-N 2.93Å; T144-D149 VanDerWaalsContact O-N 3.14Å; D145-D149 WeakPolarHBondContact CB-OD2 3.4Å; G147-D149 VanDerWaalsContact C-N 3.3Å; G147-D149 PolarHBondContact O-N 2.93Å
150	V	87.4	Confident	89.5	Confident	5 Å²	5	30.9 Å²	30.9	3%	0.03	18%	0.178	C	C	.	.	S	Bend	trans	-139.9	154.3	-179.8	-67.3	0	0	0	0	112.3	F14 I38 T144 G147 F152 I154	F14-V150 HydrophobicContact CD2-CG1 4.04Å; F14-V150 HydrophobicContact CE2-CG1 4.06Å; I38-V150 HydrophobicContact CD1-CG1 4.26Å; T144-V150 HydrophobicContact CG2-CG1 3.6Å; T144-V150 HydrophobicContact CG2-CG2 4.33Å; G147-V150 PolarHBondContact O-N 2.88Å; G147-V150 VanDerWaalsContact O-O 3.12Å; V150-F152 HydrophobicContact CB-CD1 3.8Å; V150-F152 HydrophobicContact CB-CE1 3.47Å; V150-F152 VanDerWaalsContact CB-CE1 3.47Å; V150-F152 HydrophobicContact CB-CE2 4.38Å; V150-F152 HydrophobicContact CB-CG 4.44Å; V150-F152 HydrophobicContact CB-CZ 3.8Å; V150-F152 HydrophobicContact CG1-CD1 4.41Å; V150-F152 HydrophobicContact CG1-CE1 3.6Å; V150-F152 HydrophobicContact CG1-CZ 3.74Å; V150-F152 HydrophobicContact CG2-CD1 4.26Å; V150-F152 HydrophobicContact CG2-CD2 4.31Å; V150-F152 HydrophobicContact CG2-CE1 4.02Å; V150-F152 HydrophobicContact CG2-CE2 4.01Å; V150-F152 HydrophobicContact CG2-CG 4.43Å; V150-F152 HydrophobicContact CG2-CZ 3.88Å; V150-I154 HydrophobicContact CG2-CD1 4.37Å
151	D	82.8	Confident	89.4	Confident	85 Å²	85	30.6 Å²	30.6	46%	0.455	18%	0.177	S	C	.	.	S	Bend	trans	-99.2	26	-178.2	-68.1	-35.8	0	0	0	113.4	S17 L378	S17-D151 VanDerWaalsContact CB-CG 3.47Å; S17-D151 VanDerWaalsContact CB-OD1 3.31Å; S17-D151 WeakPolarHBondContact CB-OD1 3.33Å; S17-D151 WeakPolarHBondContact CB-OD2 3.45Å; D151-L378 HydrophobicContact CB-CD1 3.89Å; D151-L378 WeakPolarHBondContact O-CD1 3.48Å
152	F	82.2	Confident	89.4	Confident	20 Å²	20	30.1 Å²	30.1	9%	0.088	18%	0.175	C	C	.	.	S	Bend	trans	-134	147.9	179.4	59.2	-97.6	0	0	0	111.8	F14 L140 V150 I154 L378 L379	F14-F152 HydrophobicContact CB-CE1 3.92Å; F14-F152 HydrophobicContact CB-CZ 3.94Å; F14-F152 AromaticContact CD2-CE1 3.99Å; F14-F152 HydrophobicContact CD2-CE1 3.99Å; F14-F152 AromaticContact CD2-CZ 3.89Å; F14-F152 HydrophobicContact CD2-CZ 3.89Å; F14-F152 HydrophobicContact CG-CE1 4.33Å; F14-F152 HydrophobicContact CG-CZ 4.1Å; L140-F152 HydrophobicContact CD2-CE2 4.42Å; V150-F152 HydrophobicContact CB-CD1 3.8Å; V150-F152 HydrophobicContact CB-CE1 3.47Å; V150-F152 VanDerWaalsContact CB-CE1 3.47Å; V150-F152 HydrophobicContact CB-CE2 4.38Å; V150-F152 HydrophobicContact CB-CG 4.44Å; V150-F152 HydrophobicContact CB-CZ 3.8Å; V150-F152 HydrophobicContact CG1-CD1 4.41Å; V150-F152 HydrophobicContact CG1-CE1 3.6Å; V150-F152 HydrophobicContact CG1-CZ 3.74Å; V150-F152 HydrophobicContact CG2-CD1 4.26Å; V150-F152 HydrophobicContact CG2-CD2 4.31Å; V150-F152 HydrophobicContact CG2-CE1 4.02Å; V150-F152 HydrophobicContact CG2-CE2 4.01Å; V150-F152 HydrophobicContact CG2-CG 4.43Å; V150-F152 HydrophobicContact CG2-CZ 3.88Å; F152-I154 HydrophobicContact CE2-CG1 4.25Å; F152-L378 HydrophobicContact CB-CB 4.22Å; F152-L378 HydrophobicContact CD1-CB 3.87Å; F152-L378 WeakPolarHBondContact CE1-O 3.31Å; F152-L378 HydrophobicContact CG-CB 4.47Å; F152-L379 HydrophobicContact CB-CB 4.43Å; F152-L379 HydrophobicContact CD1-CB 3.89Å; F152-L379 HydrophobicContact CD2-CB 3.7Å; F152-L379 HydrophobicContact CD2-CD2 3.68Å; F152-L379 HydrophobicContact CD2-CG 4.2Å; F152-L379 HydrophobicContact CE1-CB 3.96Å; F152-L379 HydrophobicContact CE2-CB 3.82Å; F152-L379 HydrophobicContact CE2-CD1 4.02Å; F152-L379 HydrophobicContact CE2-CD2 3.63Å; F152-L379 HydrophobicContact CE2-CG 4.02Å; F152-L379 HydrophobicContact CG-CB 3.74Å; F152-L379 HydrophobicContact CZ-CB 3.93Å; F152-L379 HydrophobicContact CZ-CD1 4.01Å; F152-L379 HydrophobicContact CZ-CD2 4.41Å; F152-L379 HydrophobicContact CZ-CG 4.33Å
153	P	81.9	Confident	89.2	Confident	95 Å²	95	29.7 Å²	29.7	62%	0.617	17%	0.173	S	C	*	.			trans	-69.2	140.6	176.7	29.2	-34.6	0	0	0	111.1
154	I	86.4	Confident	88.8	Confident	12 Å²	12	30.1 Å²	30.1	6%	0.062	18%	0.176	C	C	.	.			trans	-95.3	124.3	178.2	-59.6	-179.7	0	0	0	110.7	R118 Y141 T144 V150 F152	R118-I154 HydrophobicContact CB-CG2 4.45Å; R118-I154 PolarHBondContact NH1-O 3.28Å; Y141-I154 HydrophobicContact CD2-CB 4.43Å; Y141-I154 HydrophobicContact CD2-CD1 4.08Å; Y141-I154 HydrophobicContact CD2-CG2 4.18Å; T144-I154 WeakPolarHBondContact OG1-CD1 3.46Å; V150-I154 HydrophobicContact CG2-CD1 4.37Å; F152-I154 HydrophobicContact CE2-CG1 4.25Å
155	G	86.5	Confident	88.6	Confident	23 Å²	23	31.3 Å²	31.3	24%	0.237	18%	0.182	C	C	.	.	S	Bend	trans	106.4	167.2	177.3	0	0	0	0	0	113.3	R118	R118-G155 VanDerWaalsContact O-CA 3.25Å; R118-G155 WeakPolarHBondContact O-CA 3.25Å
156	N	87.3	Confident	88.2	Confident	59 Å²	59	32.2 Å²	32.2	32%	0.316	20%	0.197	S	C	.	.			trans	-93.7	122.4	179.3	-177.6	-40.3	0	0	0	109.9	S158 Y159 L160	N156-S158 PolarHBondContact O-N 3.46Å; N156-S158 PolarHBondContact OD1-N 3.45Å; N156-S158 VanDerWaalsContact OD1-N 3.09Å; N156-Y159 HydrophobicContact CB-CD2 3.82Å; N156-Y159 HydrophobicContact CB-CE2 4.45Å; N156-Y159 PolarHBondContact O-N 2.86Å; N156-L160 WeakPolarHBondContact O-CG 3.32Å; N156-L160 PolarHBondContact O-N 3.29Å
157	P	87.5	Confident	87.5	Confident	42 Å²	42	32.8 Å²	32.8	27%	0.273	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-50.8	-33	-175.8	-30.6	36	0	0	0	115.8	Y159 L212 L216 I219	P157-Y159 PolarHBondContact O-N 3.35Å; P157-L212 HydrophobicContact CB-CD1 3.41Å; P157-L212 VanDerWaalsContact CB-CD1 3.41Å; P157-L212 HydrophobicContact CG-CD1 3.57Å; P157-L216 HydrophobicContact CB-CD2 4.35Å; P157-I219 WeakPolarHBondContact O-CD1 3.37Å
158	S	90.6	Very high	86.5	Confident	10 Å²	10	34.3 Å²	34.3	7%	0.07	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-68.3	-20.9	179.5	-72.1	0	0	0	0	113.8	N156	N156-S158 PolarHBondContact O-N 3.46Å; N156-S158 PolarHBondContact OD1-N 3.45Å; N156-S158 VanDerWaalsContact OD1-N 3.09Å
159	Y	93.6	Very high	85.1	Confident	13 Å²	13	38.4 Å²	38.4	5%	0.051	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-113.4	-1.7	-175.3	-55.6	-92.9	0	0	0	112.4	P122 N156 P157 S192 I195 E199	P122-Y159 VanDerWaalsContact CD-CE1 3.47Å; P122-Y159 WeakPolarHBondContact CD-OH 3.28Å; P122-Y159 HydrophobicContact CG-CE1 4.08Å; P122-Y159 WeakPolarHBondContact CG-OH 3.49Å; N156-Y159 HydrophobicContact CB-CD2 3.82Å; N156-Y159 HydrophobicContact CB-CE2 4.45Å; N156-Y159 PolarHBondContact O-N 2.86Å; P157-Y159 PolarHBondContact O-N 3.35Å; Y159-S192 WeakPolarHBondContact O-CA 3.09Å; Y159-S192 WeakPolarHBondContact O-CB 3.47Å; Y159-S192 PolarHBondContact O-OG 3.48Å; Y159-I195 HydrophobicContact CD1-CB 3.97Å; Y159-I195 HydrophobicContact CD1-CG2 3.5Å; Y159-I195 HydrophobicContact CE1-CG2 3.77Å; Y159-I195 HydrophobicContact CG-CG2 4.31Å; Y159-E199 WeakPolarHBondContact CE1-OE2 3.33Å; Y159-E199 VanDerWaalsContact OH-CD 3.24Å; Y159-E199 PolarHBondContact OH-OE1 2.95Å; Y159-E199 PolarHBondContact OH-OE2 2.81Å
160	L	91.8	Very high	83.5	Confident	25 Å²	25	42.1 Å²	42.1	13%	0.131	26%	0.261	C	S	.	.			trans	-67.2	138	-179.4	-68.6	-176.9	0	0	0	110.9	N156 V164 I165 W191	N156-L160 WeakPolarHBondContact O-CG 3.32Å; N156-L160 PolarHBondContact O-N 3.29Å; L160-V164 HydrophobicContact CD1-CG1 4.47Å; L160-V164 HydrophobicContact CD2-CG1 4.18Å; L160-I165 HydrophobicContact CB-CD1 4.06Å; L160-I165 HydrophobicContact CB-CG1 3.8Å; L160-I165 HydrophobicContact CD1-CG1 4.35Å; L160-W191 PolarHBondContact O-NE1 3.14Å
161	A	93.1	Very high	81.9	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.008	28%	0.282	C	S	.	.			trans	-68.6	148.3	175.1	0	0	0	0	0	111.5	E163 V164 I165 W191	A161-E163 VanDerWaalsContact C-N 3.26Å; A161-E163 VanDerWaalsContact CB-CD 3.46Å; A161-E163 HydrophobicContact CB-CG 4.42Å; A161-E163 WeakPolarHBondContact CB-OE1 3.39Å; A161-E163 WeakPolarHBondContact CB-OE2 3.3Å; A161-E163 PolarHBondContact O-N 3.38Å; A161-V164 HydrophobicContact CB-CG2 4.19Å; A161-V164 WeakPolarHBondContact O-CB 3.27Å; A161-V164 PolarHBondContact O-N 2.6Å; A161-I165 PolarHBondContact O-N 3.17Å; A161-I165 VanDerWaalsContact O-N 3.13Å; A161-W191 VanDerWaalsContact CA-CD1 3.41Å; A161-W191 HydrophobicContact CB-CB 3.81Å; A161-W191 HydrophobicContact CB-CG 3.84Å
162	P	92.4	Very high	80.2	Confident	3 Å²	3	46.7 Å²	46.7	2%	0.019	29%	0.287	C	S	.	.	H	α-helix	trans	-56.5	-40	-177.9	-24.5	32.7	0	0	0	112.9	V164 I165 A166 W191 I219 F259	P162-V164 VanDerWaalsContact C-N 3.27Å; P162-V164 PolarHBondContact O-N 3.45Å; P162-I165 PolarHBondContact O-N 2.9Å; P162-A166 WeakPolarHBondContact O-CB 3.42Å; P162-A166 PolarHBondContact O-N 3.13Å; P162-W191 HydrophobicContact CG-CD2 4.34Å; P162-W191 HydrophobicContact CG-CE3 4.28Å; P162-W191 HydrophobicContact CG-CH2 3.66Å; P162-W191 HydrophobicContact CG-CZ2 3.73Å; P162-W191 HydrophobicContact CG-CZ3 3.95Å; P162-I219 HydrophobicContact CB-CG2 4.45Å; P162-I219 HydrophobicContact CG-CG2 4.02Å; P162-F259 HydrophobicContact CB-CD2 3.93Å; P162-F259 HydrophobicContact CB-CE2 3.41Å; P162-F259 VanDerWaalsContact CB-CE2 3.41Å; P162-F259 HydrophobicContact CB-CZ 3.75Å; P162-F259 HydrophobicContact CG-CD2 3.63Å; P162-F259 HydrophobicContact CG-CE2 3.59Å; P162-F259 HydrophobicContact CG-CG 4.45Å; P162-F259 HydrophobicContact CG-CZ 4.39Å
163	E	90.5	Very high	78.6	Confident	40 Å²	40	50.5 Å²	50.5	19%	0.187	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-31.6	178.3	66.7	-84.6	-164	0	0	112.9	A161 L167 P261 R264	A161-E163 VanDerWaalsContact C-N 3.26Å; A161-E163 VanDerWaalsContact CB-CD 3.46Å; A161-E163 HydrophobicContact CB-CG 4.42Å; A161-E163 WeakPolarHBondContact CB-OE1 3.39Å; A161-E163 WeakPolarHBondContact CB-OE2 3.3Å; A161-E163 PolarHBondContact O-N 3.38Å; E163-L167 VanDerWaalsContact O-CD1 3.26Å; E163-L167 WeakPolarHBondContact O-CD1 3.34Å; E163-L167 WeakPolarHBondContact O-CG 3.42Å; E163-L167 PolarHBondContact O-N 2.88Å; E163-P261 HydrophobicContact CB-CG 4.16Å; E163-P261 HydrophobicContact CG-CB 4.38Å; E163-P261 HydrophobicContact CG-CG 4.13Å; E163-R264 IonicContact OE1-CZ 2.62Å; E163-R264 IonicContact OE1-NH1 2.78Å; E163-R264 PolarHBondContact OE1-NH1 2.79Å; E163-R264 IonicContact OE1-NH2 3.14Å; E163-R264 IonicContact OE2-CZ 2.93Å; E163-R264 IonicContact OE2-NH1 3.28Å; E163-R264 PolarHBondContact OE2-NH1 3.34Å; E163-R264 IonicContact OE2-NH2 3.28Å; E163-R264 PolarHBondContact OE2-NH2 3.4Å
164	V	89.1	Confident	77.1	Confident	9 Å²	9	49.8 Å²	49.8	6%	0.055	31%	0.306	C	S	.	.	H	α-helix	trans	-71.4	-42.6	176.2	169.9	0	0	0	0	110.6	L160 A161 P162 A166 L167	L160-V164 HydrophobicContact CD1-CG1 4.47Å; L160-V164 HydrophobicContact CD2-CG1 4.18Å; A161-V164 HydrophobicContact CB-CG2 4.19Å; A161-V164 WeakPolarHBondContact O-CB 3.27Å; A161-V164 PolarHBondContact O-N 2.6Å; P162-V164 VanDerWaalsContact C-N 3.27Å; P162-V164 PolarHBondContact O-N 3.45Å; V164-A166 VanDerWaalsContact C-N 3.34Å; V164-L167 PolarHBondContact O-N 3.09Å
165	I	88.2	Confident	75.3	Confident	25 Å²	25	55.4 Å²	55.4	13%	0.128	34%	0.344	C	S	.	.	H	α-helix	trans	-64.6	-43	177.8	-61.8	168.7	0	0	0	110	L160 A161 P162 L167 G168 L216 I219 L220	L160-I165 HydrophobicContact CB-CD1 4.06Å; L160-I165 HydrophobicContact CB-CG1 3.8Å; L160-I165 HydrophobicContact CD1-CG1 4.35Å; A161-I165 PolarHBondContact O-N 3.17Å; A161-I165 VanDerWaalsContact O-N 3.13Å; P162-I165 PolarHBondContact O-N 2.9Å; I165-L167 VanDerWaalsContact C-N 3.31Å; I165-L167 PolarHBondContact O-N 3.44Å; I165-G168 PolarHBondContact O-N 3.36Å; I165-G168 VanDerWaalsContact O-N 3.17Å; I165-L216 HydrophobicContact CD1-CD2 3.79Å; I165-L216 HydrophobicContact CG1-CD2 3.97Å; I165-L216 HydrophobicContact CG2-CB 4.21Å; I165-L216 HydrophobicContact CG2-CD2 3.93Å; I165-L216 HydrophobicContact CG2-CG 4.48Å; I165-I219 HydrophobicContact CD1-CB 3.92Å; I165-I219 HydrophobicContact CD1-CD1 3.86Å; I165-I219 HydrophobicContact CD1-CG2 3.58Å; I165-L220 HydrophobicContact CB-CD2 4.24Å; I165-L220 HydrophobicContact CG2-CD1 3.95Å; I165-L220 HydrophobicContact CG2-CD2 4.06Å; I165-L220 HydrophobicContact CG2-CG 4.01Å
166	A	84.1	Confident	73.6	Confident	75 Å²	75	58.3 Å²	58.3	62%	0.62	36%	0.361	S	S	*	.	H	α-helix	trans	-64.9	-32.2	-179.4	0	0	0	0	0	113.4	P162 V164 G168 L220	P162-A166 WeakPolarHBondContact O-CB 3.42Å; P162-A166 PolarHBondContact O-N 3.13Å; V164-A166 VanDerWaalsContact C-N 3.34Å; A166-G168 VanDerWaalsContact C-N 3.3Å; A166-L220 HydrophobicContact CB-CD2 4.33Å
167	L	76.5	Confident	71.8	Confident	102 Å²	102	61.1 Å²	61.1	53%	0.534	37%	0.372	S	S	.	.	H	α-helix	trans	-67.6	-28.4	174.5	-82	157	0	0	0	112.9	E163 V164 I165 P181	E163-L167 VanDerWaalsContact O-CD1 3.26Å; E163-L167 WeakPolarHBondContact O-CD1 3.34Å; E163-L167 WeakPolarHBondContact O-CG 3.42Å; E163-L167 PolarHBondContact O-N 2.88Å; V164-L167 PolarHBondContact O-N 3.09Å; I165-L167 VanDerWaalsContact C-N 3.31Å; I165-L167 PolarHBondContact O-N 3.44Å; L167-P181 HydrophobicContact CD2-CB 4.17Å
168	G	67.6	Low	69.8	Low	50 Å²	50	65.2 Å²	65.2	52%	0.515	40%	0.401	S	S	.	.			trans	72.8	-170	-178.1	0	0	0	0	0	114.3	I165 A166	I165-G168 PolarHBondContact O-N 3.36Å; I165-G168 VanDerWaalsContact O-N 3.17Å; A166-G168 VanDerWaalsContact C-N 3.3Å
169	C	58.2	Low	67.8	Low	105 Å²	105	72.2 Å²	72.2	71%	0.709	43%	0.433	S	S	*	.			trans	-82.7	127.7	173.9	-64.2	0	0	0	0	109.5
170	F	55.4	Low	65.8	Low	86 Å²	86	77.5 Å²	77.5	38%	0.377	47%	0.466	S	S	.	.			trans	-91	122.6	176	179.9	-106.3	0	0	0	110.5	P172 P181	F170-P172 HydrophobicContact CE1-CB 4.37Å; F170-P172 HydrophobicContact CE1-CG 4.09Å; F170-P181 HydrophobicContact CB-CG 4.26Å; F170-P181 HydrophobicContact CD1-CG 4.45Å; F170-P181 VanDerWaalsContact CD2-CD 3.49Å; F170-P181 HydrophobicContact CD2-CG 3.3Å; F170-P181 HydrophobicContact CE2-CG 3.63Å; F170-P181 HydrophobicContact CG-CG 3.76Å; F170-P181 HydrophobicContact CZ-CG 4.33Å
171	H	53.8	Low	63.9	Low	100 Å²	100	78.8 Å²	78.8	46%	0.463	48%	0.476	S	S	.	.			trans	-110.8	123.9	165.5	-89	-66.9	0	0	0	109.5	S173 D174	H171-S173 PolarHBondContact O-N 3.15Å; H171-D174 PolarHBondContact O-N 3.17Å; H171-D174 VanDerWaalsContact O-N 3.15Å
172	P	47.5	Very low	62.1	Low	86 Å²	86	85.9 Å²	85.9	56%	0.558	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-19	-179	-23.6	31	0	0	0	114.8	A148 F170	A148-P172 HydrophobicContact CB-CG 3.96Å; F170-P172 HydrophobicContact CE1-CB 4.37Å; F170-P172 HydrophobicContact CE1-CG 4.09Å
173	S	49.9	Very low	60.6	Low	99 Å²	99	89.5 Å²	89.5	69%	0.692	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	0.9	-177.2	54.9	0	0	0	0	114.5	H171 P175	H171-S173 PolarHBondContact O-N 3.15Å; S173-P175 VanDerWaalsContact O-CD 3.24Å; S173-P175 WeakPolarHBondContact O-CD 3.37Å
174	D	49.5	Very low	59.7	Low	80 Å²	80	88.3 Å²	88.3	43%	0.428	53%	0.533	S	S	.	.			trans	-82.2	108.6	178.5	-159.7	-29.1	0	0	0	110.8	H171 S176	H171-D174 PolarHBondContact O-N 3.17Å; H171-D174 VanDerWaalsContact O-N 3.15Å; D174-S176 PolarHBondContact O-N 2.85Å; D174-S176 VanDerWaalsContact O-N 3.12Å; D174-S176 VanDerWaalsContact OD1-CB 3.3Å; D174-S176 WeakPolarHBondContact OD1-CB 3.24Å; D174-S176 PolarHBondContact OD1-N 3.38Å; D174-S176 VanDerWaalsContact OD1-N 3.12Å; D174-S176 PolarHBondContact OD1-OG 3.2Å; D174-S176 PolarHBondContact OD2-OG 3.22Å
175	P	48.8	Very low	59.5	Low	131 Å²	131	89.7 Å²	89.7	85%	0.851	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-6.2	-177.5	-5.4	21.7	0	0	0	113.2	S173 H177	S173-P175 VanDerWaalsContact O-CD 3.24Å; S173-P175 WeakPolarHBondContact O-CD 3.37Å; P175-H177 VanDerWaalsContact C-N 3.33Å
176	S	51	Low	59.7	Low	84 Å²	84	90.7 Å²	90.7	59%	0.587	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-12.3	-177.1	66.1	0	0	0	0	114.3	D174	D174-S176 PolarHBondContact O-N 2.85Å; D174-S176 VanDerWaalsContact O-N 3.12Å; D174-S176 VanDerWaalsContact OD1-CB 3.3Å; D174-S176 WeakPolarHBondContact OD1-CB 3.24Å; D174-S176 PolarHBondContact OD1-N 3.38Å; D174-S176 VanDerWaalsContact OD1-N 3.12Å; D174-S176 PolarHBondContact OD1-OG 3.2Å; D174-S176 PolarHBondContact OD2-OG 3.22Å
177	H	49.6	Very low	60.3	Low	118 Å²	118	89.5 Å²	89.5	55%	0.546	54%	0.538	S	S	.	.			trans	-105.1	104.1	178.5	-68.9	-73	0	0	0	111.1	P175 E179	P175-H177 VanDerWaalsContact C-N 3.33Å; H177-E179 VanDerWaalsContact C-N 3.26Å; H177-E179 PolarHBondContact O-N 3.47Å
178	S	44.3	Very low	61.1	Low	127 Å²	127	84.8 Å²	84.8	89%	0.888	51%	0.513	S	S	*	.	S	Bend	trans	-74.4	-13.7	177.5	60.5	0	0	0	0	114.1
179	E	48.8	Very low	62.5	Low	157 Å²	157	82.4 Å²	82.4	73%	0.734	49%	0.489	S	S	*	.	S	Bend	trans	-126.2	132.6	178.6	-67.3	-175.5	172	0	0	109.6	H177	H177-E179 VanDerWaalsContact C-N 3.26Å; H177-E179 PolarHBondContact O-N 3.47Å
180	T	51.3	Low	64.4	Low	124 Å²	124	77.4 Å²	77.4	76%	0.761	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-60.1	123.6	169.9	46.3	0	0	0	0	108.8	L182	T180-L182 PolarHBondContact O-N 2.96Å
181	P	51.7	Low	66.4	Low	52 Å²	52	73.3 Å²	73.3	34%	0.338	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-59.7	139.3	178	22.3	-29.7	0	0	0	109.9	L167 F170	L167-P181 HydrophobicContact CD2-CB 4.17Å; F170-P181 HydrophobicContact CB-CG 4.26Å; F170-P181 HydrophobicContact CD1-CG 4.45Å; F170-P181 VanDerWaalsContact CD2-CD 3.49Å; F170-P181 HydrophobicContact CD2-CG 3.3Å; F170-P181 HydrophobicContact CE2-CG 3.63Å; F170-P181 HydrophobicContact CG-CG 3.76Å; F170-P181 HydrophobicContact CZ-CG 4.33Å
182	L	55.8	Low	68.5	Low	151 Å²	151	68.9 Å²	68.9	79%	0.791	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-59.7	133.8	176.7	-77.5	143.7	0	0	0	109.4	T180 S184	T180-L182 PolarHBondContact O-N 2.96Å; L182-S184 PolarHBondContact O-N 2.84Å
183	P	60.1	Low	70.8	Confident	78 Å²	78	64.8 Å²	64.8	51%	0.506	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-56	142.9	174.1	21.2	-29.9	0	0	0	109.8	G185	P183-G185 PolarHBondContact O-N 2.92Å
184	S	73.6	Confident	73.1	Confident	16 Å²	16	60.1 Å²	60.1	11%	0.112	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-57	127.1	179	-58.2	0	0	0	0	109.7	R118 Y141 L182	R118-S184 VanDerWaalsContact CD-CB 3.46Å; R118-S184 VanDerWaalsContact NE-CB 3.33Å; R118-S184 PolarHBondContact NE-OG 2.97Å; Y141-S184 PolarHBondContact OH-N 2.88Å; L182-S184 PolarHBondContact O-N 2.84Å
185	G	84.6	Confident	75.3	Confident	37 Å²	37	56.6 Å²	56.6	38%	0.381	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-79.4	168	-176.9	0	0	0	0	0	113.6	P183 K187 S188	P183-G185 PolarHBondContact O-N 2.92Å; G185-K187 PolarHBondContact O-N 3.31Å; G185-S188 WeakPolarHBondContact O-CB 3.28Å; G185-S188 PolarHBondContact O-N 3.03Å; G185-S188 PolarHBondContact O-OG 3.12Å
186	P	92.3	Very high	77.6	Confident	46 Å²	46	50.4 Å²	50.4	30%	0.299	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.1	-34.1	175.8	-36.9	40.6	0	0	0	116.4	N111 V116 S188 D189	N111-P186 HydrophobicContact CB-CB 4.49Å; N111-P186 HydrophobicContact CB-CG 4.15Å; N111-P186 WeakPolarHBondContact OD1-CB 3.29Å; V116-P186 HydrophobicContact CG2-CG 4.42Å; P186-S188 PolarHBondContact O-N 3.41Å; P186-D189 PolarHBondContact O-N 2.8Å
187	K	95.4	Very high	79.7	Confident	50 Å²	50	46.4 Å²	46.4	22%	0.217	27%	0.271	C	S	.	.	H	α-helix	trans	-66.8	-19.5	-177.2	-60.4	-174.3	174.6	-163.5	0	113.2	G185 D189 V190 W191 P261 R264 T266	G185-K187 PolarHBondContact O-N 3.31Å; K187-D189 VanDerWaalsContact C-N 3.33Å; K187-V190 WeakPolarHBondContact O-CB 2.95Å; K187-V190 PolarHBondContact O-N 2.67Å; K187-W191 PolarHBondContact O-N 2.93Å; K187-P261 WeakPolarHBondContact CD-O 3.29Å; K187-P261 PolarHBondContact NZ-O 3.49Å; K187-R264 WeakPolarHBondContact CD-O 3.48Å; K187-R264 WeakPolarHBondContact CE-O 3.25Å; K187-R264 PolarHBondContact NZ-O 3.19Å; K187-R264 VanDerWaalsContact O-CD 3.23Å; K187-R264 WeakPolarHBondContact O-CD 3.15Å; K187-R264 PolarHBondContact O-NH1 3.06Å; K187-T266 HydrophobicContact CD-CG2 4.45Å; K187-T266 HydrophobicContact CG-CG2 4.08Å
188	S	94.6	Very high	81.8	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-64.5	-38.7	173.8	60.6	0	0	0	0	111.7	G185 P186 V190 W191 S192	G185-S188 WeakPolarHBondContact O-CB 3.28Å; G185-S188 PolarHBondContact O-N 3.03Å; G185-S188 PolarHBondContact O-OG 3.12Å; P186-S188 PolarHBondContact O-N 3.41Å; S188-V190 VanDerWaalsContact C-N 3.31Å; S188-V190 PolarHBondContact O-N 3.09Å; S188-W191 WeakPolarHBondContact O-CB 3.48Å; S188-W191 PolarHBondContact O-N 2.97Å; S188-S192 PolarHBondContact O-N 2.97Å; S188-S192 PolarHBondContact O-OG 2.68Å
189	D	96.7	Very high	84.1	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-68.6	-30.5	176.5	-64.9	-30.8	0	0	0	112.2	L107 V116 H117 R118 P186 K187 W191 S192 L193	L107-D189 HydrophobicContact CD1-CB 3.98Å; L107-D189 HydrophobicContact CD2-CB 3.93Å; V116-D189 WeakPolarHBondContact CG1-OD2 3.47Å; H117-D189 PolarHBondContact N-OD1 2.88Å; H117-D189 PolarHBondContact N-OD2 3.16Å; R118-D189 PolarHBondContact N-OD1 2.62Å; P186-D189 PolarHBondContact O-N 2.8Å; K187-D189 VanDerWaalsContact C-N 3.33Å; D189-W191 VanDerWaalsContact C-N 3.32Å; D189-W191 PolarHBondContact O-N 2.99Å; D189-S192 PolarHBondContact O-N 3.39Å; D189-L193 WeakPolarHBondContact O-CB 3.28Å; D189-L193 PolarHBondContact O-N 3.3Å
190	V	97.9	Very high	86.2	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.6	-37.8	175	174.4	0	0	0	0	111.4	K187 S188 L193 G194 C256 R264 P267 L270	K187-V190 WeakPolarHBondContact O-CB 2.95Å; K187-V190 PolarHBondContact O-N 2.67Å; S188-V190 VanDerWaalsContact C-N 3.31Å; S188-V190 PolarHBondContact O-N 3.09Å; V190-L193 PolarHBondContact O-N 3.33Å; V190-G194 PolarHBondContact O-N 3.47Å; V190-C256 HydrophobicContact CG1-CB 4.19Å; V190-R264 HydrophobicContact CG1-CG 4.04Å; V190-P267 HydrophobicContact CG2-CG 3.69Å; V190-L270 HydrophobicContact CG1-CD1 3.57Å; V190-L270 HydrophobicContact CG2-CD1 4.38Å
191	W	97.3	Very high	88	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.3	-47.4	172.7	174.1	-81.6	0	0	0	111.6	L160 A161 P162 K187 S188 D189 L193 G194 I195 I219 L222 I228 L257	L160-W191 PolarHBondContact O-NE1 3.14Å; A161-W191 VanDerWaalsContact CA-CD1 3.41Å; A161-W191 HydrophobicContact CB-CB 3.81Å; A161-W191 HydrophobicContact CB-CG 3.84Å; P162-W191 HydrophobicContact CG-CD2 4.34Å; P162-W191 HydrophobicContact CG-CE3 4.28Å; P162-W191 HydrophobicContact CG-CH2 3.66Å; P162-W191 HydrophobicContact CG-CZ2 3.73Å; P162-W191 HydrophobicContact CG-CZ3 3.95Å; K187-W191 PolarHBondContact O-N 2.93Å; S188-W191 WeakPolarHBondContact O-CB 3.48Å; S188-W191 PolarHBondContact O-N 2.97Å; D189-W191 VanDerWaalsContact C-N 3.32Å; D189-W191 PolarHBondContact O-N 2.99Å; W191-L193 PolarHBondContact O-N 3.4Å; W191-G194 WeakPolarHBondContact O-CA 3.5Å; W191-G194 PolarHBondContact O-N 3.46Å; W191-I195 HydrophobicContact CZ2-CD1 4.42Å; W191-I195 PolarHBondContact O-N 3.04Å; W191-I219 HydrophobicContact CZ2-CG2 4.14Å; W191-L222 HydrophobicContact CH2-CD1 4.05Å; W191-L222 HydrophobicContact CZ2-CD1 4.09Å; W191-I228 HydrophobicContact CH2-CD1 4.45Å; W191-I228 HydrophobicContact CH2-CG2 4.49Å; W191-I228 HydrophobicContact CZ3-CD1 4.46Å; W191-L257 HydrophobicContact CD2-CD2 4.19Å; W191-L257 HydrophobicContact CE3-CD2 4.26Å; W191-L257 HydrophobicContact CZ2-CD2 4.47Å; W191-L257 HydrophobicContact CZ3-CB 4.45Å; W191-L257 HydrophobicContact CZ3-CD2 4.43Å; W191-L257 WeakPolarHBondContact CZ3-O 3.3Å
192	S	96.9	Very high	89.8	Confident	7 Å²	7	19.6 Å²	19.6	5%	0.049	12%	0.119	C	C	.	.	H	α-helix	trans	-58.1	-38.5	177.5	-57.1	0	0	0	0	111.6	Y159 S188 D189 I195 L196	Y159-S192 WeakPolarHBondContact O-CA 3.09Å; Y159-S192 WeakPolarHBondContact O-CB 3.47Å; Y159-S192 PolarHBondContact O-OG 3.48Å; S188-S192 PolarHBondContact O-N 2.97Å; S188-S192 PolarHBondContact O-OG 2.68Å; D189-S192 PolarHBondContact O-N 3.39Å; S192-I195 PolarHBondContact O-N 3.32Å; S192-L196 WeakPolarHBondContact O-CB 3.34Å; S192-L196 PolarHBondContact O-N 2.75Å
193	L	97.8	Very high	91.2	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-62.4	-45	171.5	176.5	61.8	0	0	0	111.4	V103 L104 L120 D189 V190 W191 I195 L196 L197	V103-L193 HydrophobicContact CB-CD1 4.09Å; V103-L193 HydrophobicContact CG1-CD1 3.83Å; V103-L193 HydrophobicContact CG1-CD2 4.39Å; V103-L193 HydrophobicContact CG2-CD1 4.43Å; L104-L193 HydrophobicContact CD1-CD2 4.34Å; L104-L193 HydrophobicContact CD2-CD2 3.62Å; L104-L193 HydrophobicContact CG-CD2 3.67Å; L120-L193 HydrophobicContact CD2-CB 3.96Å; D189-L193 WeakPolarHBondContact O-CB 3.28Å; D189-L193 PolarHBondContact O-N 3.3Å; V190-L193 PolarHBondContact O-N 3.33Å; W191-L193 PolarHBondContact O-N 3.4Å; L193-I195 VanDerWaalsContact C-N 3.34Å; L193-I195 PolarHBondContact O-N 3.01Å; L193-L196 WeakPolarHBondContact O-CB 3.28Å; L193-L196 PolarHBondContact O-N 3.4Å; L193-L196 VanDerWaalsContact O-N 3.14Å; L193-L197 HydrophobicContact CD1-CD1 3.94Å; L193-L197 HydrophobicContact CD1-CD2 4.02Å; L193-L197 HydrophobicContact CD1-CG 3.72Å; L193-L197 HydrophobicContact CD2-CD1 4.4Å; L193-L197 HydrophobicContact CG-CD1 3.84Å; L193-L197 HydrophobicContact CG-CG 4.07Å; L193-L197 VanDerWaalsContact O-CG 3.31Å; L193-L197 WeakPolarHBondContact O-CG 3.26Å; L193-L197 PolarHBondContact O-N 3.12Å
194	G	97.4	Very high	92.3	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-55.8	-45.2	176.9	0	0	0	0	0	113.2	V190 W191 F198 C256	V190-G194 PolarHBondContact O-N 3.47Å; W191-G194 WeakPolarHBondContact O-CA 3.5Å; W191-G194 PolarHBondContact O-N 3.46Å; G194-F198 WeakPolarHBondContact O-CB 3.34Å; G194-F198 PolarHBondContact O-N 3.36Å; G194-C256 VanDerWaalsContact CA-CB 3.46Å
195	I	96.3	Very high	92.8	Very high	7 Å²	7	18.3 Å²	18.3	4%	0.036	10%	0.101	C	C	.	.	H	α-helix	trans	-64.4	-43.5	176	-61.7	-65.3	0	0	0	110.7	Y159 W191 S192 L193 F198 E199 L206 L232 L257	Y159-I195 HydrophobicContact CD1-CB 3.97Å; Y159-I195 HydrophobicContact CD1-CG2 3.5Å; Y159-I195 HydrophobicContact CE1-CG2 3.77Å; Y159-I195 HydrophobicContact CG-CG2 4.31Å; W191-I195 HydrophobicContact CZ2-CD1 4.42Å; W191-I195 PolarHBondContact O-N 3.04Å; S192-I195 PolarHBondContact O-N 3.32Å; L193-I195 VanDerWaalsContact C-N 3.34Å; L193-I195 PolarHBondContact O-N 3.01Å; I195-F198 WeakPolarHBondContact O-CB 3.32Å; I195-F198 PolarHBondContact O-N 3.5Å; I195-E199 WeakPolarHBondContact O-CG 3.29Å; I195-E199 PolarHBondContact O-N 2.84Å; I195-L206 HydrophobicContact CG2-CD1 4.11Å; I195-L232 HydrophobicContact CD1-CD1 4.23Å; I195-L257 HydrophobicContact CD1-CD2 3.52Å; I195-L257 HydrophobicContact CG1-CD2 3.82Å
196	L	95.5	Very high	92.8	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.8	-48.9	177.4	-178.8	157.9	0	0	0	111.8	V78 P122 V125 S192 L193 F198 E199 L200	V78-L196 HydrophobicContact CG1-CD2 4.33Å; P122-L196 HydrophobicContact CG-CD1 4.36Å; P122-L196 HydrophobicContact CG-CG 4.23Å; V125-L196 HydrophobicContact CG2-CD1 3.65Å; S192-L196 WeakPolarHBondContact O-CB 3.34Å; S192-L196 PolarHBondContact O-N 2.75Å; L193-L196 WeakPolarHBondContact O-CB 3.28Å; L193-L196 PolarHBondContact O-N 3.4Å; L193-L196 VanDerWaalsContact O-N 3.14Å; L196-F198 VanDerWaalsContact C-N 3.3Å; L196-F198 PolarHBondContact O-N 3.11Å; L196-E199 WeakPolarHBondContact O-CB 3.35Å; L196-E199 PolarHBondContact O-N 3.3Å; L196-L200 HydrophobicContact CD2-CD1 3.78Å; L196-L200 HydrophobicContact CD2-CG 4.26Å; L196-L200 WeakPolarHBondContact O-CG 3.44Å; L196-L200 PolarHBondContact O-N 3.18Å; L196-L200 VanDerWaalsContact O-N 3.1Å
197	L	95.5	Very high	92.4	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.2	-37.9	178.7	-65.2	178.3	0	0	0	111.1	V96 A100 L193 E199 L200 C201 L252 L253	V96-L197 HydrophobicContact CG1-CD2 4.05Å; A100-L197 HydrophobicContact CB-CD1 3.65Å; A100-L197 HydrophobicContact CB-CD2 3.8Å; A100-L197 HydrophobicContact CB-CG 4.38Å; L193-L197 HydrophobicContact CD1-CD1 3.94Å; L193-L197 HydrophobicContact CD1-CD2 4.02Å; L193-L197 HydrophobicContact CD1-CG 3.72Å; L193-L197 HydrophobicContact CD2-CD1 4.4Å; L193-L197 HydrophobicContact CG-CD1 3.84Å; L193-L197 HydrophobicContact CG-CG 4.07Å; L193-L197 VanDerWaalsContact O-CG 3.31Å; L193-L197 WeakPolarHBondContact O-CG 3.26Å; L193-L197 PolarHBondContact O-N 3.12Å; L197-E199 VanDerWaalsContact C-N 3.34Å; L197-E199 PolarHBondContact O-N 3.4Å; L197-L200 HydrophobicContact CD2-CD1 4.34Å; L197-L200 WeakPolarHBondContact O-CB 3.48Å; L197-L200 PolarHBondContact O-N 3.4Å; L197-C201 PolarHBondContact O-N 3.1Å; L197-C201 PolarHBondContact O-SG 3.05Å; L197-C201 VanDerWaalsContact O-SG 3.33Å; L197-L252 HydrophobicContact CD1-CD2 4.11Å; L197-L253 HydrophobicContact CB-CD2 3.57Å
198	F	95	Very high	91.5	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-59.3	-46.2	174.3	-170.2	-71.7	0	0	0	111.2	G194 I195 L196 L200 C201 A202 L206 V229 L232 A233 I242 L253 L257	G194-F198 WeakPolarHBondContact O-CB 3.34Å; G194-F198 PolarHBondContact O-N 3.36Å; I195-F198 WeakPolarHBondContact O-CB 3.32Å; I195-F198 PolarHBondContact O-N 3.5Å; L196-F198 VanDerWaalsContact C-N 3.3Å; L196-F198 PolarHBondContact O-N 3.11Å; F198-L200 VanDerWaalsContact C-N 3.29Å; F198-L200 PolarHBondContact O-N 3.36Å; F198-C201 PolarHBondContact O-N 2.87Å; F198-A202 HydrophobicContact CD1-CB 4.2Å; F198-A202 HydrophobicContact CE1-CB 4.02Å; F198-A202 VanDerWaalsContact O-CB 3.32Å; F198-A202 WeakPolarHBondContact O-CB 3.44Å; F198-A202 PolarHBondContact O-N 2.79Å; F198-L206 HydrophobicContact CB-CD1 4.41Å; F198-L206 HydrophobicContact CD1-CD1 3.62Å; F198-L206 HydrophobicContact CD1-CD2 3.91Å; F198-L206 HydrophobicContact CD1-CG 4.14Å; F198-L206 HydrophobicContact CE1-CD1 4.22Å; F198-L206 HydrophobicContact CE1-CD2 3.78Å; F198-L206 HydrophobicContact CE1-CG 4.5Å; F198-L206 HydrophobicContact CG-CD1 4.19Å; F198-V229 HydrophobicContact CD2-CG1 4.29Å; F198-V229 HydrophobicContact CE2-CG1 3.88Å; F198-L232 HydrophobicContact CD2-CD1 4.47Å; F198-L232 HydrophobicContact CE1-CB 4.44Å; F198-L232 HydrophobicContact CE2-CB 3.85Å; F198-L232 HydrophobicContact CZ-CB 3.81Å; F198-A233 HydrophobicContact CE2-CB 4.42Å; F198-A233 HydrophobicContact CZ-CB 3.85Å; F198-I242 HydrophobicContact CE1-CD1 4.36Å; F198-I242 HydrophobicContact CE1-CG1 4.49Å; F198-I242 HydrophobicContact CE2-CD1 4.19Å; F198-I242 HydrophobicContact CE2-CG1 4.2Å; F198-I242 HydrophobicContact CZ-CD1 4.08Å; F198-I242 HydrophobicContact CZ-CG1 3.9Å; F198-L253 HydrophobicContact CB-CD2 4.19Å; F198-L253 HydrophobicContact CD2-CD1 4.22Å; F198-L257 HydrophobicContact CD2-CD1 4.28Å
199	E	92.3	Very high	90.7	Very high	6 Å²	6	24.9 Å²	24.9	3%	0.028	12%	0.123	C	C	.	.	H	α-helix	trans	-60.5	-37.6	176.6	-74.4	-172.1	149.4	0	0	112.7	P122 Y159 I195 L196 L197 A202 G203 R204 R205 L206	P122-E199 WeakPolarHBondContact CG-OE2 3.43Å; Y159-E199 WeakPolarHBondContact CE1-OE2 3.33Å; Y159-E199 VanDerWaalsContact OH-CD 3.24Å; Y159-E199 PolarHBondContact OH-OE1 2.95Å; Y159-E199 PolarHBondContact OH-OE2 2.81Å; I195-E199 WeakPolarHBondContact O-CG 3.29Å; I195-E199 PolarHBondContact O-N 2.84Å; L196-E199 WeakPolarHBondContact O-CB 3.35Å; L196-E199 PolarHBondContact O-N 3.3Å; L197-E199 VanDerWaalsContact C-N 3.34Å; L197-E199 PolarHBondContact O-N 3.4Å; E199-A202 PolarHBondContact O-N 3.04Å; E199-G203 PolarHBondContact O-N 3.48Å; E199-R204 PolarHBondContact O-N 3.46Å; E199-R205 WeakPolarHBondContact OE1-CA 3.48Å; E199-L206 HydrophobicContact CG-CB 4.29Å; E199-L206 HydrophobicContact CG-CD1 4.08Å; E199-L206 HydrophobicContact CG-CG 3.76Å; E199-L206 PolarHBondContact OE1-N 2.91Å
200	L	91.4	Very high	90.2	Very high	6 Å²	6	28.1 Å²	28.1	3%	0.031	14%	0.14	C	C	.	.	H	α-helix	trans	-65.4	-44.3	175.5	-67.5	-178.9	0	0	0	112.2	V78 F81 V91 V96 V99 L196 L197 F198	V78-L200 HydrophobicContact CG1-CD1 3.71Å; V78-L200 HydrophobicContact CG1-CD2 3.59Å; V78-L200 HydrophobicContact CG1-CG 4.1Å; F81-L200 HydrophobicContact CD2-CD2 4.2Å; V91-L200 HydrophobicContact CG2-CD2 4.3Å; V96-L200 HydrophobicContact CG2-CB 4.27Å; V99-L200 HydrophobicContact CG1-CD1 4.24Å; L196-L200 HydrophobicContact CD2-CD1 3.78Å; L196-L200 HydrophobicContact CD2-CG 4.26Å; L196-L200 WeakPolarHBondContact O-CG 3.44Å; L196-L200 PolarHBondContact O-N 3.18Å; L196-L200 VanDerWaalsContact O-N 3.1Å; L197-L200 HydrophobicContact CD2-CD1 4.34Å; L197-L200 WeakPolarHBondContact O-CB 3.48Å; L197-L200 PolarHBondContact O-N 3.4Å; F198-L200 VanDerWaalsContact C-N 3.29Å; F198-L200 PolarHBondContact O-N 3.36Å
201	C	91.1	Very high	89.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.5	-44.5	175.1	-67	0	0	0	0	111.5	L197 F198 G203 I241 I242 M245	L197-C201 PolarHBondContact O-N 3.1Å; L197-C201 PolarHBondContact O-SG 3.05Å; L197-C201 VanDerWaalsContact O-SG 3.33Å; F198-C201 PolarHBondContact O-N 2.87Å; C201-G203 VanDerWaalsContact C-N 3.32Å; C201-G203 PolarHBondContact O-N 3.48Å; C201-I241 WeakPolarHBondContact O-CG2 3.33Å; C201-I242 HydrophobicContact CB-CD1 3.85Å; C201-M245 HydrophobicContact CB-CE 3.95Å; C201-M245 HydrophobicContact CB-CG 4.39Å; C201-M245 WeakPolarHBondContact O-CE 3.41Å
202	A	88.4	Confident	89	Confident	3 Å²	3	39.4 Å²	39.4	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-78.4	-13.7	-176.2	0	0	0	0	0	114.2	F198 E199 R204 C238 I242	F198-A202 HydrophobicContact CD1-CB 4.2Å; F198-A202 HydrophobicContact CE1-CB 4.02Å; F198-A202 VanDerWaalsContact O-CB 3.32Å; F198-A202 WeakPolarHBondContact O-CB 3.44Å; F198-A202 PolarHBondContact O-N 2.79Å; E199-A202 PolarHBondContact O-N 3.04Å; A202-R204 HydrophobicContact CB-CG 3.95Å; A202-R204 PolarHBondContact O-N 3.31Å; A202-C238 HydrophobicContact CB-CB 4.11Å; A202-I242 HydrophobicContact CB-CD1 4.4Å
203	G	84.5	Confident	88.6	Confident	30 Å²	30	42.5 Å²	42.5	31%	0.309	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	10.7	-176.2	0	0	0	0	0	114.6	R82 E199 C201	R82-G203 PolarHBondContact NE-O 3.39Å; E199-G203 PolarHBondContact O-N 3.48Å; C201-G203 VanDerWaalsContact C-N 3.32Å; C201-G203 PolarHBondContact O-N 3.48Å
204	R	83.3	Confident	88.2	Confident	88 Å²	88	46.2 Å²	46.2	33%	0.332	24%	0.237	S	C	.	.	S	Bend	trans	-138.7	153.6	-173	67.7	-173.6	68.1	-176.9	2.5	111.5	E199 A202 H236 G237	E199-R204 PolarHBondContact O-N 3.46Å; A202-R204 HydrophobicContact CB-CG 3.95Å; A202-R204 PolarHBondContact O-N 3.31Å; R204-H236 PolarHBondContact NH1-O 2.81Å; R204-G237 VanDerWaalsContact NH1-C 3.34Å; R204-G237 PolarHBondContact NH1-O 2.97Å
205	R	84	Confident	87.8	Confident	101 Å²	101	48 Å²	48	38%	0.381	25%	0.245	S	C	.	.			trans	-77.3	135	173.8	-85.8	179.1	-175.6	-168.9	1.6	110.4	E199 Q208	E199-R205 WeakPolarHBondContact OE1-CA 3.48Å; R205-Q208 HydrophobicContact CB-CB 4.29Å
206	L	85.4	Confident	87.5	Confident	6 Å²	6	50 Å²	50	3%	0.031	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	152.1	173.7	-63.4	177.1	0	0	0	110.3	I195 F198 E199 Q208 H236	I195-L206 HydrophobicContact CG2-CD1 4.11Å; F198-L206 HydrophobicContact CB-CD1 4.41Å; F198-L206 HydrophobicContact CD1-CD1 3.62Å; F198-L206 HydrophobicContact CD1-CD2 3.91Å; F198-L206 HydrophobicContact CD1-CG 4.14Å; F198-L206 HydrophobicContact CE1-CD1 4.22Å; F198-L206 HydrophobicContact CE1-CD2 3.78Å; F198-L206 HydrophobicContact CE1-CG 4.5Å; F198-L206 HydrophobicContact CG-CD1 4.19Å; E199-L206 HydrophobicContact CG-CB 4.29Å; E199-L206 HydrophobicContact CG-CD1 4.08Å; E199-L206 HydrophobicContact CG-CG 3.76Å; E199-L206 PolarHBondContact OE1-N 2.91Å; L206-Q208 PolarHBondContact O-N 2.86Å; L206-H236 HydrophobicContact CD2-CB 3.81Å
207	L	83.2	Confident	87.2	Confident	6 Å²	6	56.7 Å²	56.7	3%	0.031	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	32.7	173.8	-53.4	174.3	0	0	0	113	I210 K215 F218 I219 H236	L207-I210 HydrophobicContact CB-CD1 4.34Å; L207-I210 HydrophobicContact CD2-CD1 3.78Å; L207-K215 HydrophobicContact CB-CD 4.17Å; L207-K215 HydrophobicContact CB-CG 4.13Å; L207-K215 HydrophobicContact CD1-CB 4.48Å; L207-K215 WeakPolarHBondContact O-CE 3.42Å; L207-K215 PolarHBondContact O-NZ 3.23Å; L207-F218 HydrophobicContact CD1-CD1 4.18Å; L207-F218 HydrophobicContact CD2-CD1 3.5Å; L207-F218 HydrophobicContact CD2-CE1 3.84Å; L207-F218 HydrophobicContact CD2-CG 4.14Å; L207-F218 HydrophobicContact CG-CD1 4.42Å; L207-I219 HydrophobicContact CD1-CD1 4.12Å; L207-I219 HydrophobicContact CD1-CG1 4.09Å; L207-H236 PolarHBondContact N-NE2 2.76Å
208	Q	76.6	Confident	87	Confident	106 Å²	106	58.4 Å²	58.4	50%	0.495	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	137.2	178.1	-168.6	174.5	-0.4	0	0	109.2	R205 L206 I210	R205-Q208 HydrophobicContact CB-CB 4.29Å; L206-Q208 PolarHBondContact O-N 2.86Å; Q208-I210 PolarHBondContact O-N 3.04Å
209	N	78.6	Confident	86.9	Confident	155 Å²	155	58.6 Å²	58.6	83%	0.829	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.3	18.6	179.8	-47.9	-33.5	0	0	0	115.8
210	I	85.3	Confident	86.7	Confident	69 Å²	69	61.7 Å²	61.7	35%	0.354	31%	0.309	S	S	.	.			trans	-95.8	144.4	171.2	-56.5	-179.2	0	0	0	109.2	L207 Q208 D214 K215	L207-I210 HydrophobicContact CB-CD1 4.34Å; L207-I210 HydrophobicContact CD2-CD1 3.78Å; Q208-I210 PolarHBondContact O-N 3.04Å; I210-D214 HydrophobicContact CG2-CB 3.47Å; I210-D214 VanDerWaalsContact CG2-CB 3.47Å; I210-K215 HydrophobicContact CB-CG 3.89Å; I210-K215 HydrophobicContact CG2-CG 3.88Å; I210-K215 WeakPolarHBondContact O-CE 3.12Å
211	E	87.3	Confident	86.7	Confident	138 Å²	138	64.6 Å²	64.6	65%	0.645	33%	0.327	S	S	*	.			trans	-63.7	148.9	174	-68.7	-164.1	167.2	0	0	111.8	S213 D214 K215	E211-S213 VanDerWaalsContact C-N 3.31Å; E211-S213 PolarHBondContact O-N 2.99Å; E211-D214 PolarHBondContact O-N 3.13Å; E211-K215 WeakPolarHBondContact O-CG 3.39Å; E211-K215 PolarHBondContact O-N 3.15Å
212	L	84.3	Confident	86.7	Confident	98 Å²	98	64.7 Å²	64.7	51%	0.513	33%	0.328	S	S	.	.	H	α-helix	trans	-55.9	-43.9	-175.2	179	61.1	0	0	0	112.6	P157 D214 K215 L216	P157-L212 HydrophobicContact CB-CD1 3.41Å; P157-L212 VanDerWaalsContact CB-CD1 3.41Å; P157-L212 HydrophobicContact CG-CD1 3.57Å; L212-D214 VanDerWaalsContact C-N 3.3Å; L212-D214 PolarHBondContact O-N 3.12Å; L212-K215 PolarHBondContact O-N 3.25Å; L212-L216 HydrophobicContact CD1-CD1 4.23Å; L212-L216 HydrophobicContact CD1-CD2 4.45Å; L212-L216 HydrophobicContact CD1-CG 4.14Å; L212-L216 HydrophobicContact CG-CD1 4.17Å; L212-L216 HydrophobicContact CG-CG 4.46Å; L212-L216 VanDerWaalsContact O-CG 3.29Å; L212-L216 WeakPolarHBondContact O-CG 3.49Å; L212-L216 PolarHBondContact O-N 3.46Å
213	S	87.3	Confident	86.6	Confident	72 Å²	72	66.3 Å²	66.3	50%	0.503	35%	0.345	S	S	.	.	H	α-helix	trans	-57.5	-43.3	177	42.9	0	0	0	0	112.3	E211 L216 K217	E211-S213 VanDerWaalsContact C-N 3.31Å; E211-S213 PolarHBondContact O-N 2.99Å; S213-L216 PolarHBondContact O-N 3.46Å; S213-K217 VanDerWaalsContact O-CB 3.28Å; S213-K217 WeakPolarHBondContact O-CB 3.38Å; S213-K217 PolarHBondContact O-N 3.38Å
214	D	89.5	Confident	86.8	Confident	79 Å²	79	69.9 Å²	69.9	42%	0.422	36%	0.364	S	S	.	.	H	α-helix	trans	-71.7	-36.5	-179.1	-69.2	-29.7	0	0	0	111.6	I210 E211 L212 K217 F218	I210-D214 HydrophobicContact CG2-CB 3.47Å; I210-D214 VanDerWaalsContact CG2-CB 3.47Å; E211-D214 PolarHBondContact O-N 3.13Å; L212-D214 VanDerWaalsContact C-N 3.3Å; L212-D214 PolarHBondContact O-N 3.12Å; D214-K217 PolarHBondContact O-N 3.03Å; D214-F218 VanDerWaalsContact O-CB 3.24Å; D214-F218 WeakPolarHBondContact O-CB 3.3Å; D214-F218 PolarHBondContact O-N 3.18Å
215	K	89.8	Confident	87.1	Confident	39 Å²	39	69.9 Å²	69.9	17%	0.17	37%	0.368	C	S	.	.	H	α-helix	trans	-59.4	-50.1	172	-63.2	-172.5	-168.8	-161.5	0	111.7	L207 I210 E211 L212 K217 F218 I219	L207-K215 HydrophobicContact CB-CD 4.17Å; L207-K215 HydrophobicContact CB-CG 4.13Å; L207-K215 HydrophobicContact CD1-CB 4.48Å; L207-K215 WeakPolarHBondContact O-CE 3.42Å; L207-K215 PolarHBondContact O-NZ 3.23Å; I210-K215 HydrophobicContact CB-CG 3.89Å; I210-K215 HydrophobicContact CG2-CG 3.88Å; I210-K215 WeakPolarHBondContact O-CE 3.12Å; E211-K215 WeakPolarHBondContact O-CG 3.39Å; E211-K215 PolarHBondContact O-N 3.15Å; L212-K215 PolarHBondContact O-N 3.25Å; K215-K217 VanDerWaalsContact C-N 3.35Å; K215-F218 PolarHBondContact O-N 3.1Å; K215-I219 WeakPolarHBondContact O-CG1 3.47Å; K215-I219 PolarHBondContact O-N 3.07Å
216	L	89.4	Confident	87.1	Confident	49 Å²	49	73.6 Å²	73.6	26%	0.257	40%	0.396	S	S	.	.	H	α-helix	trans	-64.4	-43.3	-178.6	-63.8	178.6	0	0	0	110.6	P157 I165 L212 S213 F218 I219 L220	P157-L216 HydrophobicContact CB-CD2 4.35Å; I165-L216 HydrophobicContact CD1-CD2 3.79Å; I165-L216 HydrophobicContact CG1-CD2 3.97Å; I165-L216 HydrophobicContact CG2-CB 4.21Å; I165-L216 HydrophobicContact CG2-CD2 3.93Å; I165-L216 HydrophobicContact CG2-CG 4.48Å; L212-L216 HydrophobicContact CD1-CD1 4.23Å; L212-L216 HydrophobicContact CD1-CD2 4.45Å; L212-L216 HydrophobicContact CD1-CG 4.14Å; L212-L216 HydrophobicContact CG-CD1 4.17Å; L212-L216 HydrophobicContact CG-CG 4.46Å; L212-L216 VanDerWaalsContact O-CG 3.29Å; L212-L216 WeakPolarHBondContact O-CG 3.49Å; L212-L216 PolarHBondContact O-N 3.46Å; S213-L216 PolarHBondContact O-N 3.46Å; L216-F218 PolarHBondContact O-N 2.8Å; L216-I219 PolarHBondContact O-N 3.03Å; L216-L220 VanDerWaalsContact O-CG 3.29Å; L216-L220 WeakPolarHBondContact O-CG 3.43Å; L216-L220 PolarHBondContact O-N 3.12Å
217	K	89.9	Confident	87.4	Confident	139 Å²	139	75.9 Å²	75.9	60%	0.604	41%	0.408	S	S	*	.	H	α-helix	trans	-58.6	-48.1	174.6	-176.4	-179.7	177.4	-174.6	0	111.3	S213 D214 K215 I219 L220 T221	S213-K217 VanDerWaalsContact O-CB 3.28Å; S213-K217 WeakPolarHBondContact O-CB 3.38Å; S213-K217 PolarHBondContact O-N 3.38Å; D214-K217 PolarHBondContact O-N 3.03Å; K215-K217 VanDerWaalsContact C-N 3.35Å; K217-I219 PolarHBondContact O-N 3.09Å; K217-L220 PolarHBondContact O-N 3.07Å; K217-T221 HydrophobicContact CG-CG2 4.42Å; K217-T221 WeakPolarHBondContact O-CG2 3.4Å; K217-T221 PolarHBondContact O-N 3.28Å; K217-T221 PolarHBondContact O-OG1 2.78Å; K217-T221 VanDerWaalsContact O-OG1 3.11Å
218	F	91.6	Very high	87.9	Confident	36 Å²	36	76.4 Å²	76.4	16%	0.158	41%	0.411	C	S	.	.	H	α-helix	trans	-56.5	-50.7	178.5	177.5	-100.1	0	0	0	111.6	L207 D214 K215 L216 L220 T221 L222 L232 E235	L207-F218 HydrophobicContact CD1-CD1 4.18Å; L207-F218 HydrophobicContact CD2-CD1 3.5Å; L207-F218 HydrophobicContact CD2-CE1 3.84Å; L207-F218 HydrophobicContact CD2-CG 4.14Å; L207-F218 HydrophobicContact CG-CD1 4.42Å; D214-F218 VanDerWaalsContact O-CB 3.24Å; D214-F218 WeakPolarHBondContact O-CB 3.3Å; D214-F218 PolarHBondContact O-N 3.18Å; K215-F218 PolarHBondContact O-N 3.1Å; L216-F218 PolarHBondContact O-N 2.8Å; F218-L220 VanDerWaalsContact C-N 3.32Å; F218-L220 PolarHBondContact O-N 2.95Å; F218-T221 WeakPolarHBondContact CA-OG1 3.38Å; F218-T221 PolarHBondContact O-N 3.12Å; F218-T221 VanDerWaalsContact O-N 3.12Å; F218-T221 PolarHBondContact O-OG1 3.16Å; F218-L222 HydrophobicContact CE1-CD1 4.38Å; F218-L222 HydrophobicContact CE1-CD2 4.19Å; F218-L222 HydrophobicContact CE1-CG 4.45Å; F218-L222 HydrophobicContact CZ-CD2 4.01Å; F218-L222 PolarHBondContact O-N 3.03Å; F218-L232 HydrophobicContact CE1-CD2 3.61Å; F218-L232 HydrophobicContact CZ-CD2 3.99Å; F218-E235 HydrophobicContact CE2-CB 4.33Å; F218-E235 HydrophobicContact CE2-CG 3.84Å; F218-E235 HydrophobicContact CZ-CB 4.24Å; F218-E235 HydrophobicContact CZ-CG 4.12Å
219	I	91.1	Very high	88.8	Confident	4 Å²	4	71.5 Å²	71.5	2%	0.021	39%	0.388	C	S	.	.	H	α-helix	trans	-59.6	-42.6	178.9	-65.3	166	0	0	0	111.2	P157 P162 I165 W191 L207 K215 L216 K217 T221 L222	P157-I219 WeakPolarHBondContact O-CD1 3.37Å; P162-I219 HydrophobicContact CB-CG2 4.45Å; P162-I219 HydrophobicContact CG-CG2 4.02Å; I165-I219 HydrophobicContact CD1-CB 3.92Å; I165-I219 HydrophobicContact CD1-CD1 3.86Å; I165-I219 HydrophobicContact CD1-CG2 3.58Å; W191-I219 HydrophobicContact CZ2-CG2 4.14Å; L207-I219 HydrophobicContact CD1-CD1 4.12Å; L207-I219 HydrophobicContact CD1-CG1 4.09Å; K215-I219 WeakPolarHBondContact O-CG1 3.47Å; K215-I219 PolarHBondContact O-N 3.07Å; L216-I219 PolarHBondContact O-N 3.03Å; K217-I219 PolarHBondContact O-N 3.09Å; I219-T221 VanDerWaalsContact C-N 3.34Å; I219-T221 PolarHBondContact O-N 2.97Å; I219-L222 WeakPolarHBondContact O-CB 3.4Å; I219-L222 PolarHBondContact O-N 3.43Å
220	L	89.7	Confident	89.5	Confident	72 Å²	72	66.4 Å²	66.4	38%	0.377	36%	0.363	S	S	.	.	H	α-helix	trans	-67.3	-33.7	178	-69.6	172.9	0	0	0	112.5	I165 A166 L216 K217 F218 L222	I165-L220 HydrophobicContact CB-CD2 4.24Å; I165-L220 HydrophobicContact CG2-CD1 3.95Å; I165-L220 HydrophobicContact CG2-CD2 4.06Å; I165-L220 HydrophobicContact CG2-CG 4.01Å; A166-L220 HydrophobicContact CB-CD2 4.33Å; L216-L220 VanDerWaalsContact O-CG 3.29Å; L216-L220 WeakPolarHBondContact O-CG 3.43Å; L216-L220 PolarHBondContact O-N 3.12Å; K217-L220 PolarHBondContact O-N 3.07Å; F218-L220 VanDerWaalsContact C-N 3.32Å; F218-L220 PolarHBondContact O-N 2.95Å; L220-L222 VanDerWaalsContact C-N 3.29Å; L220-L222 PolarHBondContact O-N 2.89Å
221	T	91.6	Very high	89.9	Confident	66 Å²	66	64.4 Å²	64.4	41%	0.405	35%	0.353	S	S	.	.	H	α-helix	trans	-74	-16.1	177.9	51.7	0	0	0	0	114.1	K217 F218 I219 G223 C224	K217-T221 HydrophobicContact CG-CG2 4.42Å; K217-T221 WeakPolarHBondContact O-CG2 3.4Å; K217-T221 PolarHBondContact O-N 3.28Å; K217-T221 PolarHBondContact O-OG1 2.78Å; K217-T221 VanDerWaalsContact O-OG1 3.11Å; F218-T221 WeakPolarHBondContact CA-OG1 3.38Å; F218-T221 PolarHBondContact O-N 3.12Å; F218-T221 VanDerWaalsContact O-N 3.12Å; F218-T221 PolarHBondContact O-OG1 3.16Å; I219-T221 VanDerWaalsContact C-N 3.34Å; I219-T221 PolarHBondContact O-N 2.97Å; T221-G223 PolarHBondContact O-N 3.2Å; T221-G223 VanDerWaalsContact O-N 3.13Å; T221-C224 WeakPolarHBondContact O-CB 3.33Å; T221-C224 PolarHBondContact O-N 3.44Å
222	L	91	Very high	90.1	Very high	3 Å²	3	57.9 Å²	57.9	2%	0.016	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-58.8	-24.3	174.2	-68.4	174.4	0	0	0	112.6	W191 F218 I219 L220 C224 M225 I228 V231 L232 F259	W191-L222 HydrophobicContact CH2-CD1 4.05Å; W191-L222 HydrophobicContact CZ2-CD1 4.09Å; F218-L222 HydrophobicContact CE1-CD1 4.38Å; F218-L222 HydrophobicContact CE1-CD2 4.19Å; F218-L222 HydrophobicContact CE1-CG 4.45Å; F218-L222 HydrophobicContact CZ-CD2 4.01Å; F218-L222 PolarHBondContact O-N 3.03Å; I219-L222 WeakPolarHBondContact O-CB 3.4Å; I219-L222 PolarHBondContact O-N 3.43Å; L220-L222 VanDerWaalsContact C-N 3.29Å; L220-L222 PolarHBondContact O-N 2.89Å; L222-C224 PolarHBondContact O-N 3.47Å; L222-M225 WeakPolarHBondContact O-CB 3.16Å; L222-M225 PolarHBondContact O-N 3.43Å; L222-M225 VanDerWaalsContact O-N 3.1Å; L222-I228 HydrophobicContact CB-CD1 4.23Å; L222-I228 HydrophobicContact CB-CG1 4.19Å; L222-I228 HydrophobicContact CD1-CG2 4.05Å; L222-I228 HydrophobicContact CD2-CG2 4.26Å; L222-V231 HydrophobicContact CD2-CG1 4.09Å; L222-L232 HydrophobicContact CD1-CD2 4.4Å; L222-F259 HydrophobicContact CB-CD2 4.4Å
223	G	85.9	Confident	90.5	Very high	37 Å²	37	53.2 Å²	53.2	38%	0.381	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-67.5	-13.6	176.3	0	0	0	0	0	114.6	T221 F259	T221-G223 PolarHBondContact O-N 3.2Å; T221-G223 VanDerWaalsContact O-N 3.13Å; G223-F259 VanDerWaalsContact CA-CE2 3.4Å; G223-F259 VanDerWaalsContact N-CD2 3.32Å
224	C	88.3	Confident	90.8	Very high	105 Å²	105	55.2 Å²	55.2	71%	0.709	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-88.8	-4.8	174.2	-60.6	0	0	0	0	113.1	T221 L222	T221-C224 WeakPolarHBondContact O-CB 3.33Å; T221-C224 PolarHBondContact O-N 3.44Å; L222-C224 PolarHBondContact O-N 3.47Å
225	M	89.8	Confident	90.8	Very high	87 Å²	87	57.8 Å²	57.8	43%	0.429	31%	0.309	S	S	.	.			trans	-103.8	143.9	-173.1	-57.5	-70.1	105.5	0	0	110.9	L222 V231	L222-M225 WeakPolarHBondContact O-CB 3.16Å; L222-M225 PolarHBondContact O-N 3.43Å; L222-M225 VanDerWaalsContact O-N 3.1Å; M225-V231 HydrophobicContact CB-CG2 4.07Å; M225-V231 HydrophobicContact CG-CG1 4.33Å; M225-V231 HydrophobicContact CG-CG2 3.97Å; M225-V231 HydrophobicContact SD-CG2 3.92Å
226	D	84.4	Confident	90.7	Very high	180 Å²	180	57.4 Å²	57.4	96%	0.963	31%	0.308	S	S	*	.	S	Bend	trans	-79.6	-35.4	178.8	-68.3	-40.2	0	0	0	112.7
227	D	91.2	Very high	90.7	Very high	54 Å²	54	57.8 Å²	57.8	29%	0.289	32%	0.324	S	S	.	.			trans	-126.5	94.9	178.1	-174.3	-5.8	0	0	0	111.5	V229 T230 V231	D227-V229 VanDerWaalsContact C-N 3.3Å; D227-V229 PolarHBondContact O-N 3.41Å; D227-V229 PolarHBondContact OD1-N 3.02Å; D227-V229 VanDerWaalsContact OD1-N 3.09Å; D227-T230 VanDerWaalsContact CG-OG1 3.25Å; D227-T230 PolarHBondContact O-N 3.19Å; D227-T230 PolarHBondContact OD1-N 3.29Å; D227-T230 WeakPolarHBondContact OD2-CB 3.43Å; D227-T230 PolarHBondContact OD2-OG1 3.1Å; D227-V231 WeakPolarHBondContact O-CG2 3.37Å; D227-V231 PolarHBondContact O-N 3.36Å; D227-V231 VanDerWaalsContact O-N 3.12Å
228	I	94.5	Very high	90.7	Very high	17 Å²	17	51.2 Å²	51.2	9%	0.087	30%	0.295	C	S	.	.	H	α-helix	trans	-63.8	-35.5	-178.7	-69.1	172.5	0	0	0	111.9	W191 L222 L232 L257 F259	W191-I228 HydrophobicContact CH2-CD1 4.45Å; W191-I228 HydrophobicContact CH2-CG2 4.49Å; W191-I228 HydrophobicContact CZ3-CD1 4.46Å; L222-I228 HydrophobicContact CB-CD1 4.23Å; L222-I228 HydrophobicContact CB-CG1 4.19Å; L222-I228 HydrophobicContact CD1-CG2 4.05Å; L222-I228 HydrophobicContact CD2-CG2 4.26Å; I228-L232 HydrophobicContact CG2-CD1 3.77Å; I228-L232 HydrophobicContact CG2-CG 4.24Å; I228-L232 WeakPolarHBondContact O-CB 3.38Å; I228-L232 VanDerWaalsContact O-CG 3.25Å; I228-L232 WeakPolarHBondContact O-CG 3.45Å; I228-L232 PolarHBondContact O-N 3.43Å; I228-L257 VanDerWaalsContact CD1-O 3.32Å; I228-L257 WeakPolarHBondContact CD1-O 3.33Å; I228-L257 HydrophobicContact CG2-CB 4.15Å; I228-F259 HydrophobicContact CD1-CB 3.82Å
229	V	94.7	Very high	90.7	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.018	30%	0.296	C	S	.	.	H	α-helix	trans	-67.6	-45.2	-177.9	178.8	0	0	0	0	109.8	F198 D227 L232 A233 I242 V250 L253 R254 L257	F198-V229 HydrophobicContact CD2-CG1 4.29Å; F198-V229 HydrophobicContact CE2-CG1 3.88Å; D227-V229 VanDerWaalsContact C-N 3.3Å; D227-V229 PolarHBondContact O-N 3.41Å; D227-V229 PolarHBondContact OD1-N 3.02Å; D227-V229 VanDerWaalsContact OD1-N 3.09Å; V229-L232 PolarHBondContact O-N 3.46Å; V229-A233 WeakPolarHBondContact O-CB 3.21Å; V229-A233 PolarHBondContact O-N 3.49Å; V229-I242 HydrophobicContact CG1-CG2 4Å; V229-V250 HydrophobicContact CG1-CG1 4.36Å; V229-L253 HydrophobicContact CG2-CB 4.1Å; V229-R254 HydrophobicContact CB-CG 4.39Å; V229-R254 HydrophobicContact CG2-CB 4.39Å; V229-R254 HydrophobicContact CG2-CG 3.71Å; V229-L257 HydrophobicContact CG2-CD1 4.11Å
230	T	93.4	Very high	90.6	Very high	48 Å²	48	56.5 Å²	56.5	29%	0.294	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-46	177.2	-65.9	0	0	0	0	111.7	D227 L232 A233 E234 L239	D227-T230 VanDerWaalsContact CG-OG1 3.25Å; D227-T230 PolarHBondContact O-N 3.19Å; D227-T230 PolarHBondContact OD1-N 3.29Å; D227-T230 WeakPolarHBondContact OD2-CB 3.43Å; D227-T230 PolarHBondContact OD2-OG1 3.1Å; T230-L232 PolarHBondContact O-N 3.29Å; T230-A233 WeakPolarHBondContact O-CB 3.22Å; T230-A233 PolarHBondContact O-N 3.05Å; T230-A233 VanDerWaalsContact O-N 3.1Å; T230-E234 WeakPolarHBondContact O-CG 3.3Å; T230-E234 PolarHBondContact O-N 3.23Å; T230-L239 HydrophobicContact CG2-CD1 4.02Å
231	V	93.6	Very high	90.6	Very high	26 Å²	26	55.1 Å²	55.1	16%	0.158	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-44.6	177.9	171.8	0	0	0	0	111.6	L222 M225 D227 A233 E234 E235	L222-V231 HydrophobicContact CD2-CG1 4.09Å; M225-V231 HydrophobicContact CB-CG2 4.07Å; M225-V231 HydrophobicContact CG-CG1 4.33Å; M225-V231 HydrophobicContact CG-CG2 3.97Å; M225-V231 HydrophobicContact SD-CG2 3.92Å; D227-V231 WeakPolarHBondContact O-CG2 3.37Å; D227-V231 PolarHBondContact O-N 3.36Å; D227-V231 VanDerWaalsContact O-N 3.12Å; V231-A233 PolarHBondContact O-N 3.06Å; V231-E234 PolarHBondContact O-N 2.88Å; V231-E235 HydrophobicContact CG1-CG 4.33Å; V231-E235 WeakPolarHBondContact O-CB 3.35Å; V231-E235 VanDerWaalsContact O-CG 3.31Å; V231-E235 WeakPolarHBondContact O-CG 3.28Å; V231-E235 PolarHBondContact O-N 2.9Å
232	L	92	Very high	90.6	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-58.3	-40	174.3	-78.4	170.8	0	0	0	111.6	I195 F198 F218 L222 I228 V229 T230 H236 L257	I195-L232 HydrophobicContact CD1-CD1 4.23Å; F198-L232 HydrophobicContact CD2-CD1 4.47Å; F198-L232 HydrophobicContact CE1-CB 4.44Å; F198-L232 HydrophobicContact CE2-CB 3.85Å; F198-L232 HydrophobicContact CZ-CB 3.81Å; F218-L232 HydrophobicContact CE1-CD2 3.61Å; F218-L232 HydrophobicContact CZ-CD2 3.99Å; L222-L232 HydrophobicContact CD1-CD2 4.4Å; I228-L232 HydrophobicContact CG2-CD1 3.77Å; I228-L232 HydrophobicContact CG2-CG 4.24Å; I228-L232 WeakPolarHBondContact O-CB 3.38Å; I228-L232 VanDerWaalsContact O-CG 3.25Å; I228-L232 WeakPolarHBondContact O-CG 3.45Å; I228-L232 PolarHBondContact O-N 3.43Å; V229-L232 PolarHBondContact O-N 3.46Å; T230-L232 PolarHBondContact O-N 3.29Å; L232-H236 WeakPolarHBondContact O-CB 3.45Å; L232-H236 PolarHBondContact O-N 3.32Å; L232-H236 PolarHBondContact O-ND1 3.4Å; L232-L257 HydrophobicContact CD1-CD1 3.79Å
233	A	92.6	Very high	90.5	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-70.7	-38.8	-178.2	0	0	0	0	0	113	F198 V229 T230 V231 G237 C238 L239 I242	F198-A233 HydrophobicContact CE2-CB 4.42Å; F198-A233 HydrophobicContact CZ-CB 3.85Å; V229-A233 WeakPolarHBondContact O-CB 3.21Å; V229-A233 PolarHBondContact O-N 3.49Å; T230-A233 WeakPolarHBondContact O-CB 3.22Å; T230-A233 PolarHBondContact O-N 3.05Å; T230-A233 VanDerWaalsContact O-N 3.1Å; V231-A233 PolarHBondContact O-N 3.06Å; A233-G237 PolarHBondContact O-N 2.85Å; A233-G237 VanDerWaalsContact O-N 3.15Å; A233-C238 PolarHBondContact O-N 3.13Å; A233-L239 HydrophobicContact CB-CB 4.29Å; A233-L239 HydrophobicContact CB-CD1 4.03Å; A233-L239 PolarHBondContact O-N 2.94Å; A233-I242 HydrophobicContact CB-CB 4.24Å; A233-I242 HydrophobicContact CB-CG1 3.97Å
234	E	92.1	Very high	90.8	Very high	113 Å²	113	64.7 Å²	64.7	53%	0.528	34%	0.342	S	S	.	.	H	α-helix	trans	-65.1	-53.2	175.4	-75	179.2	170.3	0	0	111.7	T230 V231 H236 G237 L239	T230-E234 WeakPolarHBondContact O-CG 3.3Å; T230-E234 PolarHBondContact O-N 3.23Å; V231-E234 PolarHBondContact O-N 2.88Å; E234-H236 PolarHBondContact O-N 3.43Å; E234-H236 VanDerWaalsContact O-N 3.14Å; E234-G237 PolarHBondContact O-N 2.79Å; E234-L239 HydrophobicContact CG-CB 4.47Å; E234-L239 HydrophobicContact CG-CD1 4.25Å; E234-L239 HydrophobicContact CG-CD2 3.93Å; E234-L239 HydrophobicContact CG-CG 4.44Å
235	E	89.4	Confident	90.9	Very high	133 Å²	133	60.9 Å²	60.9	62%	0.621	31%	0.314	S	S	*	.	H	α-helix	trans	-59.7	-29.3	-177.8	-72.8	-70.5	153.9	0	0	112.9	F218 V231	F218-E235 HydrophobicContact CE2-CB 4.33Å; F218-E235 HydrophobicContact CE2-CG 3.84Å; F218-E235 HydrophobicContact CZ-CB 4.24Å; F218-E235 HydrophobicContact CZ-CG 4.12Å; V231-E235 HydrophobicContact CG1-CG 4.33Å; V231-E235 WeakPolarHBondContact O-CB 3.35Å; V231-E235 VanDerWaalsContact O-CG 3.31Å; V231-E235 WeakPolarHBondContact O-CG 3.28Å; V231-E235 PolarHBondContact O-N 2.9Å
236	H	88.9	Confident	91.1	Very high	32 Å²	32	59.2 Å²	59.2	15%	0.148	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104	9.8	179.8	-61.3	83.1	0	0	0	113.5	R204 L206 L207 L232 E234 C238	R204-H236 PolarHBondContact NH1-O 2.81Å; L206-H236 HydrophobicContact CD2-CB 3.81Å; L207-H236 PolarHBondContact N-NE2 2.76Å; L232-H236 WeakPolarHBondContact O-CB 3.45Å; L232-H236 PolarHBondContact O-N 3.32Å; L232-H236 PolarHBondContact O-ND1 3.4Å; E234-H236 PolarHBondContact O-N 3.43Å; E234-H236 VanDerWaalsContact O-N 3.14Å; H236-C238 VanDerWaalsContact C-N 3.33Å; H236-C238 PolarHBondContact O-N 3.38Å
237	G	88.9	Confident	91.5	Very high	56 Å²	56	56.3 Å²	56.3	58%	0.577	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	38.7	175	0	0	0	0	0	113.8	R204 A233 E234	R204-G237 VanDerWaalsContact NH1-C 3.34Å; R204-G237 PolarHBondContact NH1-O 2.97Å; A233-G237 PolarHBondContact O-N 2.85Å; A233-G237 VanDerWaalsContact O-N 3.15Å; E234-G237 PolarHBondContact O-N 2.79Å
238	C	90.1	Very high	91.7	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.014	30%	0.295	C	S	.	.			trans	-127.8	15.2	-178.5	61.1	0	0	0	0	113.9	A202 A233 H236 E240 I241 I242	A202-C238 HydrophobicContact CB-CB 4.11Å; A233-C238 PolarHBondContact O-N 3.13Å; H236-C238 VanDerWaalsContact C-N 3.33Å; H236-C238 PolarHBondContact O-N 3.38Å; C238-E240 VanDerWaalsContact C-N 3.33Å; C238-E240 PolarHBondContact O-N 3.25Å; C238-I241 HydrophobicContact CB-CD1 4.27Å; C238-I241 WeakPolarHBondContact O-CB 3.39Å; C238-I241 PolarHBondContact O-N 3.46Å; C238-I241 VanDerWaalsContact O-N 3.1Å; C238-I242 PolarHBondContact O-N 2.99Å
239	L	91.4	Very high	91.7	Very high	33 Å²	33	56.5 Å²	56.5	17%	0.173	29%	0.292	C	S	.	.	H	α-helix	trans	-51.9	-46.3	179.3	-174.8	65.2	0	0	0	113.5	T230 A233 E234 I241 I242 K243	T230-L239 HydrophobicContact CG2-CD1 4.02Å; A233-L239 HydrophobicContact CB-CB 4.29Å; A233-L239 HydrophobicContact CB-CD1 4.03Å; A233-L239 PolarHBondContact O-N 2.94Å; E234-L239 HydrophobicContact CG-CB 4.47Å; E234-L239 HydrophobicContact CG-CD1 4.25Å; E234-L239 HydrophobicContact CG-CD2 3.93Å; E234-L239 HydrophobicContact CG-CG 4.44Å; L239-I241 VanDerWaalsContact C-N 3.33Å; L239-I241 PolarHBondContact O-N 3.2Å; L239-I242 PolarHBondContact O-N 3.4Å; L239-K243 HydrophobicContact CD1-CG 4.5Å; L239-K243 HydrophobicContact CG-CD 4.2Å; L239-K243 WeakPolarHBondContact O-CB 3.45Å; L239-K243 WeakPolarHBondContact O-CG 3.43Å; L239-K243 PolarHBondContact O-N 2.99Å
240	E	89.5	Confident	91.7	Very high	118 Å²	118	56.8 Å²	56.8	55%	0.551	29%	0.294	S	S	*	.	H	α-helix	trans	-65.7	-36.9	-179.3	-59.7	-54.8	115.5	0	0	112.1	C238 K243 E244	C238-E240 VanDerWaalsContact C-N 3.33Å; C238-E240 PolarHBondContact O-N 3.25Å; E240-K243 PolarHBondContact O-N 3.29Å; E240-K243 IonicContact OE1-NZ 3.01Å; E240-K243 PolarHBondContact OE1-NZ 3.47Å; E240-E244 WeakPolarHBondContact O-CG 3.47Å; E240-E244 PolarHBondContact O-N 3.1Å; E240-E244 VanDerWaalsContact O-N 3.12Å
241	I	89	Confident	91.8	Very high	43 Å²	43	58 Å²	58	22%	0.221	30%	0.296	C	S	.	.	H	α-helix	trans	-64.8	-44.8	176.8	-59.3	172.1	0	0	0	110.2	C201 C238 L239 E244 M245	C201-I241 WeakPolarHBondContact O-CG2 3.33Å; C238-I241 HydrophobicContact CB-CD1 4.27Å; C238-I241 WeakPolarHBondContact O-CB 3.39Å; C238-I241 PolarHBondContact O-N 3.46Å; C238-I241 VanDerWaalsContact O-N 3.1Å; L239-I241 VanDerWaalsContact C-N 3.33Å; L239-I241 PolarHBondContact O-N 3.2Å; I241-E244 PolarHBondContact O-N 2.82Å; I241-M245 HydrophobicContact CG2-CE 4.38Å; I241-M245 PolarHBondContact O-N 3.35Å
242	I	91.6	Very high	91.9	Very high	9 Å²	9	56.9 Å²	56.9	5%	0.046	29%	0.289	C	S	.	.	H	α-helix	trans	-69	-34.7	-179.7	-62.5	-60.6	0	0	0	111.5	F198 C201 A202 V229 A233 C238 L239 E244 M245	F198-I242 HydrophobicContact CE1-CD1 4.36Å; F198-I242 HydrophobicContact CE1-CG1 4.49Å; F198-I242 HydrophobicContact CE2-CD1 4.19Å; F198-I242 HydrophobicContact CE2-CG1 4.2Å; F198-I242 HydrophobicContact CZ-CD1 4.08Å; F198-I242 HydrophobicContact CZ-CG1 3.9Å; C201-I242 HydrophobicContact CB-CD1 3.85Å; A202-I242 HydrophobicContact CB-CD1 4.4Å; V229-I242 HydrophobicContact CG1-CG2 4Å; A233-I242 HydrophobicContact CB-CB 4.24Å; A233-I242 HydrophobicContact CB-CG1 3.97Å; C238-I242 PolarHBondContact O-N 2.99Å; L239-I242 PolarHBondContact O-N 3.4Å; I242-E244 VanDerWaalsContact C-N 3.32Å; I242-E244 PolarHBondContact O-N 3Å; I242-M245 WeakPolarHBondContact O-CB 3.42Å; I242-M245 PolarHBondContact O-N 2.65Å
243	K	89.9	Confident	92.2	Very high	133 Å²	133	56.9 Å²	56.9	58%	0.578	29%	0.289	S	S	*	.	H	α-helix	trans	-67.8	-29	174.8	-76.3	176.6	-178.6	164.2	0	113.6	L239 E240 M245	L239-K243 HydrophobicContact CD1-CG 4.5Å; L239-K243 HydrophobicContact CG-CD 4.2Å; L239-K243 WeakPolarHBondContact O-CB 3.45Å; L239-K243 WeakPolarHBondContact O-CG 3.43Å; L239-K243 PolarHBondContact O-N 2.99Å; E240-K243 PolarHBondContact O-N 3.29Å; E240-K243 IonicContact OE1-NZ 3.01Å; E240-K243 PolarHBondContact OE1-NZ 3.47Å; K243-M245 VanDerWaalsContact C-N 3.28Å
244	E	90.7	Very high	92.4	Very high	165 Å²	165	60.7 Å²	60.7	77%	0.771	30%	0.303	S	S	*	.	H	α-helix	trans	-77.5	-13.2	175.6	-73.9	179.2	177.1	0	0	112.9	E240 I241 I242	E240-E244 WeakPolarHBondContact O-CG 3.47Å; E240-E244 PolarHBondContact O-N 3.1Å; E240-E244 VanDerWaalsContact O-N 3.12Å; I241-E244 PolarHBondContact O-N 2.82Å; I242-E244 VanDerWaalsContact C-N 3.32Å; I242-E244 PolarHBondContact O-N 3Å
245	M	91.4	Very high	92.6	Very high	24 Å²	24	58 Å²	58	12%	0.118	29%	0.29	C	S	.	.	S	Bend	trans	-70.8	148.2	178.7	-72	-69.8	173.4	0	0	112	C90 P93 C201 I241 I242 K243 E247 V250	C90-M245 HydrophobicContact CB-CE 4.4Å; P93-M245 HydrophobicContact CG-SD 4.32Å; C201-M245 HydrophobicContact CB-CE 3.95Å; C201-M245 HydrophobicContact CB-CG 4.39Å; C201-M245 WeakPolarHBondContact O-CE 3.41Å; I241-M245 HydrophobicContact CG2-CE 4.38Å; I241-M245 PolarHBondContact O-N 3.35Å; I242-M245 WeakPolarHBondContact O-CB 3.42Å; I242-M245 PolarHBondContact O-N 2.65Å; K243-M245 VanDerWaalsContact C-N 3.28Å; M245-E247 PolarHBondContact O-N 2.83Å; M245-V250 HydrophobicContact CB-CG2 3.95Å
246	P	93.8	Very high	93	Very high	52 Å²	52	51.6 Å²	51.6	34%	0.338	26%	0.26	S	S	.	.			trans	-55.2	135.9	173.6	-28.3	38	0	0	0	112.6	P93 N248 V249 V250	P93-P246 HydrophobicContact CB-CG 3.8Å; P93-P246 HydrophobicContact CG-CG 3.73Å; P246-N248 WeakPolarHBondContact CB-OD1 3.29Å; P246-N248 PolarHBondContact O-N 3.19Å; P246-N248 VanDerWaalsContact O-N 3.12Å; P246-V249 HydrophobicContact CB-CG2 4.29Å; P246-V249 WeakPolarHBondContact O-CB 3.47Å; P246-V249 PolarHBondContact O-N 2.84Å; P246-V250 PolarHBondContact O-N 3.18Å
247	E	93.9	Very high	93.4	Very high	120 Å²	120	50.2 Å²	50.2	56%	0.561	25%	0.254	S	S	*	.	H	α-helix	trans	-57.7	-32.8	-174.3	-172	60.6	-145.8	0	0	112.8	M245 V249 V250 E251 R254	M245-E247 PolarHBondContact O-N 2.83Å; E247-V249 VanDerWaalsContact C-N 3.31Å; E247-V249 PolarHBondContact O-N 3.5Å; E247-V250 PolarHBondContact O-N 2.98Å; E247-E251 VanDerWaalsContact O-CB 3.3Å; E247-E251 WeakPolarHBondContact O-CB 3.48Å; E247-E251 PolarHBondContact O-N 3.42Å; E247-R254 IonicContact OE1-CZ 2.82Å; E247-R254 IonicContact OE1-NH1 3.98Å; E247-R254 PolarHBondContact OE1-NH1 2.93Å; E247-R254 IonicContact OE1-NH2 3.46Å; E247-R254 PolarHBondContact OE1-NH2 3.45Å
248	N	93.6	Very high	93.7	Very high	73 Å²	73	49.4 Å²	49.4	39%	0.39	24%	0.238	S	C	.	.	H	α-helix	trans	-63.7	-34.6	176.4	66.1	-37.1	0	0	0	112.7	P246 L252 V275	P246-N248 WeakPolarHBondContact CB-OD1 3.29Å; P246-N248 PolarHBondContact O-N 3.19Å; P246-N248 VanDerWaalsContact O-N 3.12Å; N248-L252 PolarHBondContact O-N 2.98Å; N248-V275 HydrophobicContact CB-CG2 3.95Å
249	V	94.3	Very high	93.9	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-72.5	-42.8	174.3	-179.9	0	0	0	0	110.6	P93 V96 L97 P246 E247 E251 L252 L253	P93-V249 HydrophobicContact CB-CG2 4.19Å; V96-V249 HydrophobicContact CG1-CG1 4.25Å; L97-V249 HydrophobicContact CD1-CG2 4.23Å; L97-V249 HydrophobicContact CD2-CG2 4.06Å; L97-V249 HydrophobicContact CG-CG2 4.06Å; P246-V249 HydrophobicContact CB-CG2 4.29Å; P246-V249 WeakPolarHBondContact O-CB 3.47Å; P246-V249 PolarHBondContact O-N 2.84Å; E247-V249 VanDerWaalsContact C-N 3.31Å; E247-V249 PolarHBondContact O-N 3.5Å; V249-E251 VanDerWaalsContact C-N 3.31Å; V249-E251 PolarHBondContact O-N 3.42Å; V249-L252 WeakPolarHBondContact O-CB 3.38Å; V249-L252 PolarHBondContact O-N 2.94Å; V249-L253 WeakPolarHBondContact O-CG 3.26Å; V249-L253 PolarHBondContact O-N 2.81Å
250	V	95.4	Very high	93.9	Very high	10 Å²	10	54.4 Å²	54.4	6%	0.061	26%	0.261	C	S	.	.	H	α-helix	trans	-63.4	-39.8	177.8	-175.1	0	0	0	0	110.8	V229 M245 P246 E247 L252 L253 R254	V229-V250 HydrophobicContact CG1-CG1 4.36Å; M245-V250 HydrophobicContact CB-CG2 3.95Å; P246-V250 PolarHBondContact O-N 3.18Å; E247-V250 PolarHBondContact O-N 2.98Å; V250-L252 PolarHBondContact O-N 3.46Å; V250-L253 WeakPolarHBondContact O-CB 3.4Å; V250-L253 PolarHBondContact O-N 2.87Å; V250-L253 VanDerWaalsContact O-N 3.15Å; V250-R254 WeakPolarHBondContact O-CG 3.43Å; V250-R254 PolarHBondContact O-N 2.96Å
251	E	95.4	Very high	94	Very high	73 Å²	73	51 Å²	51	34%	0.341	25%	0.25	S	C	.	.	H	α-helix	trans	-65.1	-38.7	176.3	-173.2	56.3	-156.4	0	0	112.4	E247 V249 L253 R254 K255	E247-E251 VanDerWaalsContact O-CB 3.3Å; E247-E251 WeakPolarHBondContact O-CB 3.48Å; E247-E251 PolarHBondContact O-N 3.42Å; V249-E251 VanDerWaalsContact C-N 3.31Å; V249-E251 PolarHBondContact O-N 3.42Å; E251-L253 VanDerWaalsContact C-N 3.32Å; E251-L253 PolarHBondContact O-N 3.27Å; E251-R254 PolarHBondContact O-N 2.97Å; E251-R254 IonicContact OE2-CZ 2.67Å; E251-R254 IonicContact OE2-NH1 2.98Å; E251-R254 PolarHBondContact OE2-NH1 3.11Å; E251-K255 WeakPolarHBondContact O-CG 3.48Å; E251-K255 PolarHBondContact O-N 3.45Å
252	L	97	Very high	94.2	Very high	3 Å²	3	53.6 Å²	53.6	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-59.6	-42.2	170.8	177.2	64.5	0	0	0	111.5	L97 A100 L197 N248 V249 V250 K255 C256 L270 V275 F276	L97-L252 HydrophobicContact CD2-CD2 3.87Å; A100-L252 HydrophobicContact CB-CD2 3.99Å; L197-L252 HydrophobicContact CD1-CD2 4.11Å; N248-L252 PolarHBondContact O-N 2.98Å; V249-L252 WeakPolarHBondContact O-CB 3.38Å; V249-L252 PolarHBondContact O-N 2.94Å; V250-L252 PolarHBondContact O-N 3.46Å; L252-K255 PolarHBondContact O-N 2.85Å; L252-C256 PolarHBondContact O-N 3.5Å; L252-C256 PolarHBondContact O-SG 3.24Å; L252-L270 HydrophobicContact CD1-CD2 4.01Å; L252-V275 HydrophobicContact CD1-CG1 4.47Å; L252-F276 HydrophobicContact CD1-CE2 4.28Å; L252-F276 HydrophobicContact CD1-CZ 4.16Å; L252-F276 HydrophobicContact CD2-CE1 4.31Å; L252-F276 HydrophobicContact CD2-CZ 3.78Å
253	L	97.2	Very high	94.3	Very high	2 Å²	2	60.7 Å²	60.7	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-61.8	-45.1	175.3	-67	175.5	0	0	0	111.7	L197 F198 V229 V249 V250 E251 K255 C256 L257	L197-L253 HydrophobicContact CB-CD2 3.57Å; F198-L253 HydrophobicContact CB-CD2 4.19Å; F198-L253 HydrophobicContact CD2-CD1 4.22Å; V229-L253 HydrophobicContact CG2-CB 4.1Å; V249-L253 WeakPolarHBondContact O-CG 3.26Å; V249-L253 PolarHBondContact O-N 2.81Å; V250-L253 WeakPolarHBondContact O-CB 3.4Å; V250-L253 PolarHBondContact O-N 2.87Å; V250-L253 VanDerWaalsContact O-N 3.15Å; E251-L253 VanDerWaalsContact C-N 3.32Å; E251-L253 PolarHBondContact O-N 3.27Å; L253-K255 VanDerWaalsContact C-N 3.34Å; L253-K255 PolarHBondContact O-N 3.45Å; L253-C256 PolarHBondContact O-N 3.39Å; L253-L257 VanDerWaalsContact O-CB 3.29Å; L253-L257 WeakPolarHBondContact O-CB 3.32Å; L253-L257 WeakPolarHBondContact O-CG 3.41Å; L253-L257 PolarHBondContact O-N 2.99Å
254	R	96.6	Very high	94.5	Very high	79 Å²	79	54.4 Å²	54.4	30%	0.298	28%	0.275	S	S	.	.	H	α-helix	trans	-60.5	-42.6	177.4	-67.8	-174.2	-163.1	110	1.4	111.9	V229 E247 V250 E251 L257 T258	V229-R254 HydrophobicContact CB-CG 4.39Å; V229-R254 HydrophobicContact CG2-CB 4.39Å; V229-R254 HydrophobicContact CG2-CG 3.71Å; E247-R254 IonicContact OE1-CZ 2.82Å; E247-R254 IonicContact OE1-NH1 3.98Å; E247-R254 PolarHBondContact OE1-NH1 2.93Å; E247-R254 IonicContact OE1-NH2 3.46Å; E247-R254 PolarHBondContact OE1-NH2 3.45Å; V250-R254 WeakPolarHBondContact O-CG 3.43Å; V250-R254 PolarHBondContact O-N 2.96Å; E251-R254 PolarHBondContact O-N 2.97Å; E251-R254 IonicContact OE2-CZ 2.67Å; E251-R254 IonicContact OE2-NH1 2.98Å; E251-R254 PolarHBondContact OE2-NH1 3.11Å; R254-L257 CarbonylContact O-C 3.49Å; R254-L257 PolarHBondContact O-N 3.46Å; R254-T258 PolarHBondContact O-N 3.14Å; R254-T258 PolarHBondContact O-OG1 3.31Å; R254-T258 VanDerWaalsContact O-OG1 3.14Å
255	K	97.1	Very high	94.8	Very high	56 Å²	56	47.7 Å²	47.7	24%	0.243	25%	0.245	C	C	.	.	H	α-helix	trans	-60.9	-47.8	175.2	-72.8	171.3	-177.6	170.3	0	111.6	E251 L252 L253 T258 P265 L270 D273	E251-K255 WeakPolarHBondContact O-CG 3.48Å; E251-K255 PolarHBondContact O-N 3.45Å; L252-K255 PolarHBondContact O-N 2.85Å; L253-K255 VanDerWaalsContact C-N 3.34Å; L253-K255 PolarHBondContact O-N 3.45Å; K255-T258 PolarHBondContact O-OG1 3.18Å; K255-T258 VanDerWaalsContact O-OG1 3.12Å; K255-P265 HydrophobicContact CB-CG 4.27Å; K255-P265 WeakPolarHBondContact O-CD 3.39Å; K255-L270 HydrophobicContact CB-CD2 4.14Å; K255-L270 HydrophobicContact CD-CD2 4.36Å; K255-D273 IonicContact NZ-OD1 3.92Å; K255-D273 IonicContact NZ-OD2 3.78Å; K255-D273 PolarHBondContact NZ-OD2 3.35Å
256	C	97.5	Very high	95.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.7	-42.5	179.7	-64.6	0	0	0	0	112.5	V190 G194 L252 L253 T258 R264	V190-C256 HydrophobicContact CG1-CB 4.19Å; G194-C256 VanDerWaalsContact CA-CB 3.46Å; L252-C256 PolarHBondContact O-N 3.5Å; L252-C256 PolarHBondContact O-SG 3.24Å; L253-C256 PolarHBondContact O-N 3.39Å; C256-T258 PolarHBondContact O-N 3.31Å; C256-R264 WeakPolarHBondContact O-CD 3.43Å
257	L	96.8	Very high	95.2	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.016	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	28.3	-177.4	-62.6	173.2	0	0	0	113.2	W191 I195 F198 I228 V229 L232 L253 R254 F259	W191-L257 HydrophobicContact CD2-CD2 4.19Å; W191-L257 HydrophobicContact CE3-CD2 4.26Å; W191-L257 HydrophobicContact CZ2-CD2 4.47Å; W191-L257 HydrophobicContact CZ3-CB 4.45Å; W191-L257 HydrophobicContact CZ3-CD2 4.43Å; W191-L257 WeakPolarHBondContact CZ3-O 3.3Å; I195-L257 HydrophobicContact CD1-CD2 3.52Å; I195-L257 HydrophobicContact CG1-CD2 3.82Å; F198-L257 HydrophobicContact CD2-CD1 4.28Å; I228-L257 VanDerWaalsContact CD1-O 3.32Å; I228-L257 WeakPolarHBondContact CD1-O 3.33Å; I228-L257 HydrophobicContact CG2-CB 4.15Å; V229-L257 HydrophobicContact CG2-CD1 4.11Å; L232-L257 HydrophobicContact CD1-CD1 3.79Å; L253-L257 VanDerWaalsContact O-CB 3.29Å; L253-L257 WeakPolarHBondContact O-CB 3.32Å; L253-L257 WeakPolarHBondContact O-CG 3.41Å; L253-L257 PolarHBondContact O-N 2.99Å; R254-L257 CarbonylContact O-C 3.49Å; R254-L257 PolarHBondContact O-N 3.46Å; L257-F259 PolarHBondContact O-N 3.19Å
258	T	95.9	Very high	95.3	Very high	39 Å²	39	42.6 Å²	42.6	24%	0.239	23%	0.228	C	C	.	.			trans	-71.5	119.5	170	-66.5	0	0	0	0	109.8	R254 K255 C256 L260 K263 R264	R254-T258 PolarHBondContact O-N 3.14Å; R254-T258 PolarHBondContact O-OG1 3.31Å; R254-T258 VanDerWaalsContact O-OG1 3.14Å; K255-T258 PolarHBondContact O-OG1 3.18Å; K255-T258 VanDerWaalsContact O-OG1 3.12Å; C256-T258 PolarHBondContact O-N 3.31Å; T258-L260 PolarHBondContact O-N 3.19Å; T258-K263 HydrophobicContact CG2-CB 3.75Å; T258-R264 HydrophobicContact CG2-CB 4.28Å; T258-R264 PolarHBondContact O-NE 3.29Å; T258-R264 PolarHBondContact O-NH2 3.31Å
259	F	94.1	Very high	95.5	Very high	54 Å²	54	44.7 Å²	44.7	24%	0.237	24%	0.235	C	C	.	.	S	Bend	trans	-58.7	-51.1	-174.8	-172.3	-95	0	0	0	113.2	P162 L222 G223 I228 L257 P261 R264	P162-F259 HydrophobicContact CB-CD2 3.93Å; P162-F259 HydrophobicContact CB-CE2 3.41Å; P162-F259 VanDerWaalsContact CB-CE2 3.41Å; P162-F259 HydrophobicContact CB-CZ 3.75Å; P162-F259 HydrophobicContact CG-CD2 3.63Å; P162-F259 HydrophobicContact CG-CE2 3.59Å; P162-F259 HydrophobicContact CG-CG 4.45Å; P162-F259 HydrophobicContact CG-CZ 4.39Å; L222-F259 HydrophobicContact CB-CD2 4.4Å; G223-F259 VanDerWaalsContact CA-CE2 3.4Å; G223-F259 VanDerWaalsContact N-CD2 3.32Å; I228-F259 HydrophobicContact CD1-CB 3.82Å; L257-F259 PolarHBondContact O-N 3.19Å; F259-P261 WeakPolarHBondContact O-CD 3.43Å; F259-R264 PolarHBondContact O-NH2 2.86Å
260	L	91.6	Very high	95.6	Very high	85 Å²	85	44.7 Å²	44.7	45%	0.445	24%	0.236	S	C	.	.	S	Bend	trans	-78.7	121.1	-177.1	-67.5	174.7	0	0	0	111.1	T258 S262 K263 R264	T258-L260 PolarHBondContact O-N 3.19Å; L260-S262 PolarHBondContact O-N 3.14Å; L260-S262 VanDerWaalsContact O-N 3.17Å; L260-K263 HydrophobicContact CD1-CD 4.44Å; L260-K263 PolarHBondContact O-N 3.3Å; L260-R264 PolarHBondContact O-N 2.99Å
261	P	91.7	Very high	95.6	Very high	48 Å²	48	45.9 Å²	45.9	31%	0.312	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.7	-179.3	25.4	-34.5	0	0	0	112.8	E163 K187 F259 K263	E163-P261 HydrophobicContact CB-CG 4.16Å; E163-P261 HydrophobicContact CG-CB 4.38Å; E163-P261 HydrophobicContact CG-CG 4.13Å; K187-P261 WeakPolarHBondContact CD-O 3.29Å; K187-P261 PolarHBondContact NZ-O 3.49Å; F259-P261 WeakPolarHBondContact O-CD 3.43Å; P261-K263 VanDerWaalsContact C-N 3.25Å; P261-K263 PolarHBondContact O-N 2.88Å
262	S	91.9	Very high	95.5	Very high	96 Å²	96	45.5 Å²	45.5	67%	0.671	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-31.3	173.9	54.5	0	0	0	0	113	L260	L260-S262 PolarHBondContact O-N 3.14Å; L260-S262 VanDerWaalsContact O-N 3.17Å
263	K	94.2	Very high	95.5	Very high	159 Å²	159	46.7 Å²	46.7	69%	0.691	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-23.7	179.9	-64.3	-175.7	179.3	-178.9	0	113.5	T258 L260 P261	T258-K263 HydrophobicContact CG2-CB 3.75Å; L260-K263 HydrophobicContact CD1-CD 4.44Å; L260-K263 PolarHBondContact O-N 3.3Å; P261-K263 VanDerWaalsContact C-N 3.25Å; P261-K263 PolarHBondContact O-N 2.88Å
264	R	95.5	Very high	95.3	Very high	1 Å²	1	51 Å²	51	0%	0.004	29%	0.291	C	S	.	.	S	Bend	trans	-64.2	136.1	177.7	-164.6	-176	-56.5	144.6	6.9	109.8	E163 K187 V190 C256 T258 F259 L260	E163-R264 IonicContact OE1-CZ 2.62Å; E163-R264 IonicContact OE1-NH1 2.78Å; E163-R264 PolarHBondContact OE1-NH1 2.79Å; E163-R264 IonicContact OE1-NH2 3.14Å; E163-R264 IonicContact OE2-CZ 2.93Å; E163-R264 IonicContact OE2-NH1 3.28Å; E163-R264 PolarHBondContact OE2-NH1 3.34Å; E163-R264 IonicContact OE2-NH2 3.28Å; E163-R264 PolarHBondContact OE2-NH2 3.4Å; K187-R264 WeakPolarHBondContact CD-O 3.48Å; K187-R264 WeakPolarHBondContact CE-O 3.25Å; K187-R264 PolarHBondContact NZ-O 3.19Å; K187-R264 VanDerWaalsContact O-CD 3.23Å; K187-R264 WeakPolarHBondContact O-CD 3.15Å; K187-R264 PolarHBondContact O-NH1 3.06Å; V190-R264 HydrophobicContact CG1-CG 4.04Å; C256-R264 WeakPolarHBondContact O-CD 3.43Å; T258-R264 HydrophobicContact CG2-CB 4.28Å; T258-R264 PolarHBondContact O-NE 3.29Å; T258-R264 PolarHBondContact O-NH2 3.31Å; F259-R264 PolarHBondContact O-NH2 2.86Å; L260-R264 PolarHBondContact O-N 2.99Å
265	P	97.1	Very high	95.2	Very high	24 Å²	24	48 Å²	48	16%	0.156	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-70.2	160.8	176.1	29.6	-34.9	0	0	0	111.5	K255 E269 L270	K255-P265 HydrophobicContact CB-CG 4.27Å; K255-P265 WeakPolarHBondContact O-CD 3.39Å; P265-E269 WeakPolarHBondContact CA-OE2 3.23Å; P265-E269 HydrophobicContact CB-CB 4.07Å; P265-L270 HydrophobicContact CB-CD2 4.19Å; P265-L270 HydrophobicContact CB-CG 3.97Å; P265-L270 HydrophobicContact CG-CD1 4.02Å; P265-L270 HydrophobicContact CG-CD2 3.58Å; P265-L270 HydrophobicContact CG-CG 3.64Å
266	T	96.8	Very high	95.1	Very high	38 Å²	38	45.4 Å²	45.4	23%	0.233	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-82.8	163.6	168.1	60.4	0	0	0	0	111	K187 A268 E269 L270	K187-T266 HydrophobicContact CD-CG2 4.45Å; K187-T266 HydrophobicContact CG-CG2 4.08Å; T266-A268 VanDerWaalsContact C-N 3.28Å; T266-A268 PolarHBondContact O-N 3.26Å; T266-E269 PolarHBondContact N-OE2 3.36Å; T266-E269 PolarHBondContact O-N 3.27Å; T266-E269 VanDerWaalsContact OG1-CD 3.3Å; T266-E269 VanDerWaalsContact OG1-CG 3.28Å; T266-E269 WeakPolarHBondContact OG1-CG 3.45Å; T266-E269 PolarHBondContact OG1-N 3.47Å; T266-E269 PolarHBondContact OG1-OE2 3.4Å; T266-L270 PolarHBondContact O-N 3.42Å; T266-L270 VanDerWaalsContact O-N 3.08Å
267	P	96.8	Very high	94.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-55.8	-40.8	174.1	-29.8	39.1	0	0	0	113.7	L104 L107 D108 N111 V190 E269 L270 L271	L104-P267 HydrophobicContact CD2-CB 4.03Å; L107-P267 HydrophobicContact CB-CB 3.95Å; L107-P267 HydrophobicContact CB-CG 3.89Å; D108-P267 HydrophobicContact CB-CB 4.28Å; N111-P267 VanDerWaalsContact OD1-CG 3.31Å; N111-P267 WeakPolarHBondContact OD1-CG 3.39Å; V190-P267 HydrophobicContact CG2-CG 3.69Å; P267-E269 PolarHBondContact O-N 2.67Å; P267-L270 PolarHBondContact O-N 2.82Å; P267-L271 WeakPolarHBondContact O-CG 3.26Å; P267-L271 PolarHBondContact O-N 2.86Å
268	A	96.1	Very high	94.4	Very high	51 Å²	51	54.2 Å²	54.2	42%	0.421	33%	0.328	S	S	.	.	H	α-helix	trans	-62.3	-42	177.3	0	0	0	0	0	112.9	D108 T266 L271 G272	D108-A268 WeakPolarHBondContact OD1-CB 3.42Å; T266-A268 VanDerWaalsContact C-N 3.28Å; T266-A268 PolarHBondContact O-N 3.26Å; A268-L271 PolarHBondContact O-N 3.04Å; A268-G272 PolarHBondContact O-N 3.31Å
269	E	97	Very high	94	Very high	116 Å²	116	52.8 Å²	52.8	54%	0.542	32%	0.32	S	S	.	.	H	α-helix	trans	-65.8	-38.8	176.9	-72.9	164.1	155.1	0	0	111.6	P265 T266 P267 G272	P265-E269 WeakPolarHBondContact CA-OE2 3.23Å; P265-E269 HydrophobicContact CB-CB 4.07Å; T266-E269 PolarHBondContact N-OE2 3.36Å; T266-E269 PolarHBondContact O-N 3.27Å; T266-E269 VanDerWaalsContact OG1-CD 3.3Å; T266-E269 VanDerWaalsContact OG1-CG 3.28Å; T266-E269 WeakPolarHBondContact OG1-CG 3.45Å; T266-E269 PolarHBondContact OG1-N 3.47Å; T266-E269 PolarHBondContact OG1-OE2 3.4Å; P267-E269 PolarHBondContact O-N 2.67Å; E269-G272 PolarHBondContact O-N 3.2Å
270	L	96.9	Very high	93.7	Very high	2 Å²	2	52 Å²	52	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-69.7	-35.1	176.5	-75.7	175.8	0	0	0	113.1	L104 V190 L252 K255 P265 T266 P267 G272 D273 F276	L104-L270 HydrophobicContact CD1-CB 3.83Å; L104-L270 HydrophobicContact CD2-CB 3.99Å; L104-L270 HydrophobicContact CD2-CD1 3.9Å; V190-L270 HydrophobicContact CG1-CD1 3.57Å; V190-L270 HydrophobicContact CG2-CD1 4.38Å; L252-L270 HydrophobicContact CD1-CD2 4.01Å; K255-L270 HydrophobicContact CB-CD2 4.14Å; K255-L270 HydrophobicContact CD-CD2 4.36Å; P265-L270 HydrophobicContact CB-CD2 4.19Å; P265-L270 HydrophobicContact CB-CG 3.97Å; P265-L270 HydrophobicContact CG-CD1 4.02Å; P265-L270 HydrophobicContact CG-CD2 3.58Å; P265-L270 HydrophobicContact CG-CG 3.64Å; T266-L270 PolarHBondContact O-N 3.42Å; T266-L270 VanDerWaalsContact O-N 3.08Å; P267-L270 PolarHBondContact O-N 2.82Å; L270-G272 PolarHBondContact O-N 3.13Å; L270-D273 WeakPolarHBondContact O-CB 3.47Å; L270-D273 PolarHBondContact O-N 2.85Å; L270-D273 VanDerWaalsContact O-N 3.08Å; L270-F276 VanDerWaalsContact O-CD2 3.29Å; L270-F276 WeakPolarHBondContact O-CD2 3.44Å; L270-F276 WeakPolarHBondContact O-CE2 3.26Å
271	L	94.9	Very high	93.5	Very high	34 Å²	34	52.4 Å²	52.4	18%	0.178	33%	0.33	C	S	.	.	H	α-helix	trans	-62.7	-29.2	175.6	-78.5	170.7	0	0	0	112.9	Y101 L104 E105 D108 P267 A268 D273	Y101-L271 HydrophobicContact CD2-CD2 3.8Å; Y101-L271 HydrophobicContact CE2-CD2 3.72Å; Y101-L271 HydrophobicContact CG-CD2 4.41Å; L104-L271 HydrophobicContact CB-CD1 4.45Å; L104-L271 HydrophobicContact CB-CD2 3.58Å; L104-L271 HydrophobicContact CB-CG 3.79Å; E105-L271 HydrophobicContact CG-CD2 4.08Å; D108-L271 HydrophobicContact CB-CD1 3.67Å; P267-L271 WeakPolarHBondContact O-CG 3.26Å; P267-L271 PolarHBondContact O-N 2.86Å; A268-L271 PolarHBondContact O-N 3.04Å; L271-D273 VanDerWaalsContact C-N 3.27Å
272	G	93.8	Very high	93.1	Very high	66 Å²	66	56.7 Å²	56.7	68%	0.68	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	4.9	175.3	0	0	0	0	0	114.3	A268 E269 L270	A268-G272 PolarHBondContact O-N 3.31Å; E269-G272 PolarHBondContact O-N 3.2Å; L270-G272 PolarHBondContact O-N 3.13Å
273	D	95.6	Very high	92.8	Very high	28 Å²	28	54.3 Å²	54.3	15%	0.15	32%	0.322	C	S	.	.	S	Bend	trans	-76.6	136	-178.3	-164.3	-73.4	0	0	0	111.6	K255 L270 L271 V275 F276	K255-D273 IonicContact NZ-OD1 3.92Å; K255-D273 IonicContact NZ-OD2 3.78Å; K255-D273 PolarHBondContact NZ-OD2 3.35Å; L270-D273 WeakPolarHBondContact O-CB 3.47Å; L270-D273 PolarHBondContact O-N 2.85Å; L270-D273 VanDerWaalsContact O-N 3.08Å; L271-D273 VanDerWaalsContact C-N 3.27Å; D273-V275 HydrophobicContact CB-CG1 3.97Å; D273-V275 PolarHBondContact O-N 3.44Å; D273-V275 WeakPolarHBondContact OD1-CB 3.4Å; D273-V275 WeakPolarHBondContact OD1-CG1 3.29Å; D273-V275 PolarHBondContact OD1-N 3.21Å; D273-V275 VanDerWaalsContact OD1-N 3.07Å; D273-F276 HydrophobicContact CB-CD2 4.48Å; D273-F276 PolarHBondContact O-N 3.49Å
274	P	94.2	Very high	92.3	Very high	91 Å²	91	54.5 Å²	54.5	59%	0.591	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-56.9	-19.2	-179.7	-26.2	34.4	0	0	0	115	F276 D277	P274-F276 PolarHBondContact O-N 3.1Å; P274-F276 VanDerWaalsContact O-N 3.09Å; P274-D277 WeakPolarHBondContact O-CB 3.27Å; P274-D277 PolarHBondContact O-N 3.03Å; P274-D277 VanDerWaalsContact O-N 3.12Å
275	V	94.4	Very high	91.7	Very high	17 Å²	17	59.7 Å²	59.7	10%	0.103	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-55.5	-25.3	173.9	71.2	0	0	0	0	112.8	L97 N248 L252 D273	L97-V275 HydrophobicContact CD1-CG2 4.26Å; L97-V275 HydrophobicContact CD2-CG2 3.62Å; N248-V275 HydrophobicContact CB-CG2 3.95Å; L252-V275 HydrophobicContact CD1-CG1 4.47Å; D273-V275 HydrophobicContact CB-CG1 3.97Å; D273-V275 PolarHBondContact O-N 3.44Å; D273-V275 WeakPolarHBondContact OD1-CB 3.4Å; D273-V275 WeakPolarHBondContact OD1-CG1 3.29Å; D273-V275 PolarHBondContact OD1-N 3.21Å; D273-V275 VanDerWaalsContact OD1-N 3.07Å
276	F	95.5	Very high	91.1	Very high	1 Å²	1	61.4 Å²	61.4	0%	0.004	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-99	5.2	-179.1	-62	-61.5	0	0	0	114.6	L97 A100 Y101 L104 L252 L270 D273 P274 A278 V279 S280	L97-F276 HydrophobicContact CB-CE1 4.45Å; L97-F276 HydrophobicContact CD2-CE1 4.16Å; L97-F276 WeakPolarHBondContact O-CE1 3.45Å; A100-F276 HydrophobicContact CB-CE1 3.93Å; A100-F276 HydrophobicContact CB-CZ 3.9Å; Y101-F276 HydrophobicContact CD2-CB 3.67Å; Y101-F276 AromaticContact CD2-CD1 3.77Å; Y101-F276 HydrophobicContact CD2-CD1 3.77Å; Y101-F276 HydrophobicContact CD2-CD2 4.15Å; Y101-F276 HydrophobicContact CD2-CE1 4.44Å; Y101-F276 AromaticContact CD2-CG 3.6Å; Y101-F276 HydrophobicContact CD2-CG 3.6Å; Y101-F276 HydrophobicContact CE2-CB 4.02Å; Y101-F276 HydrophobicContact CE2-CG 4.36Å; Y101-F276 HydrophobicContact CG-CD1 4.25Å; L104-F276 HydrophobicContact CD1-CE2 3.62Å; L104-F276 HydrophobicContact CD1-CZ 3.68Å; L252-F276 HydrophobicContact CD1-CE2 4.28Å; L252-F276 HydrophobicContact CD1-CZ 4.16Å; L252-F276 HydrophobicContact CD2-CE1 4.31Å; L252-F276 HydrophobicContact CD2-CZ 3.78Å; L270-F276 VanDerWaalsContact O-CD2 3.29Å; L270-F276 WeakPolarHBondContact O-CD2 3.44Å; L270-F276 WeakPolarHBondContact O-CE2 3.26Å; D273-F276 HydrophobicContact CB-CD2 4.48Å; D273-F276 PolarHBondContact O-N 3.49Å; P274-F276 PolarHBondContact O-N 3.1Å; P274-F276 VanDerWaalsContact O-N 3.09Å; F276-A278 VanDerWaalsContact C-N 3.25Å; F276-A278 PolarHBondContact O-N 3.09Å; F276-V279 PolarHBondContact O-N 3.14Å; F276-S280 WeakPolarHBondContact O-CB 3.36Å; F276-S280 PolarHBondContact O-N 3.01Å; F276-S280 PolarHBondContact O-OG 3.22Å; F276-S280 VanDerWaalsContact O-OG 3.07Å
277	D	90.7	Very high	90.3	Very high	112 Å²	112	66.3 Å²	66.3	60%	0.599	39%	0.389	S	S	*	.	H	α-helix	trans	-57.8	-38.7	-179.1	-74.7	-12.9	0	0	0	112.4	P274 V279 S280	P274-D277 WeakPolarHBondContact O-CB 3.27Å; P274-D277 PolarHBondContact O-N 3.03Å; P274-D277 VanDerWaalsContact O-N 3.12Å; D277-V279 VanDerWaalsContact C-N 3.3Å; D277-V279 PolarHBondContact O-N 2.9Å; D277-S280 PolarHBondContact O-OG 2.78Å
278	A	86.9	Confident	89.5	Confident	76 Å²	76	74.2 Å²	74.2	63%	0.628	42%	0.423	S	S	*	.	H	α-helix	trans	-75.2	-16.8	177.4	0	0	0	0	0	113.9	F276 H282	F276-A278 VanDerWaalsContact C-N 3.25Å; F276-A278 PolarHBondContact O-N 3.09Å; A278-H282 PolarHBondContact O-CD2 3.5Å; A278-H282 PolarHBondContact O-NE2 3.26Å
279	V	89.3	Confident	88.5	Confident	10 Å²	10	76.4 Å²	76.4	6%	0.061	43%	0.433	C	S	.	.	H	α-helix	trans	-102.2	-42	-174.8	176.9	0	0	0	0	111	L97 Q98 Y101 F276 D277 C281 H282 Y283	L97-V279 HydrophobicContact CB-CG2 4.07Å; Q98-V279 HydrophobicContact CG-CG1 4.19Å; Y101-V279 HydrophobicContact CD1-CG1 4.24Å; Y101-V279 HydrophobicContact CG-CG1 3.97Å; F276-V279 PolarHBondContact O-N 3.14Å; D277-V279 VanDerWaalsContact C-N 3.3Å; D277-V279 PolarHBondContact O-N 2.9Å; V279-C281 VanDerWaalsContact C-N 3.26Å; V279-C281 PolarHBondContact O-N 3.24Å; V279-H282 WeakPolarHBondContact O-CB 3.39Å; V279-H282 PolarHBondContact O-N 2.91Å; V279-H282 VanDerWaalsContact O-N 3.12Å; V279-Y283 HydrophobicContact CG1-CD2 4.33Å; V279-Y283 HydrophobicContact CG1-CE2 3.67Å; V279-Y283 VanDerWaalsContact O-CD2 3.28Å; V279-Y283 WeakPolarHBondContact O-CD2 3.35Å
280	S	87.7	Confident	87.7	Confident	38 Å²	38	73.5 Å²	73.5	27%	0.266	42%	0.423	S	S	.	.	H	α-helix	trans	-60.8	-31.4	-174.8	60	0	0	0	0	113.3	Y101 F276 D277 H282 Y283	Y101-S280 WeakPolarHBondContact OH-CB 3.32Å; F276-S280 WeakPolarHBondContact O-CB 3.36Å; F276-S280 PolarHBondContact O-N 3.01Å; F276-S280 PolarHBondContact O-OG 3.22Å; F276-S280 VanDerWaalsContact O-OG 3.07Å; D277-S280 PolarHBondContact O-OG 2.78Å; S280-H282 PolarHBondContact O-N 2.82Å; S280-H282 VanDerWaalsContact O-N 3.15Å; S280-Y283 PolarHBondContact O-N 2.91Å; S280-Y283 VanDerWaalsContact O-N 3.1Å
281	C	86.3	Confident	87	Confident	92 Å²	92	76.2 Å²	76.2	62%	0.622	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.1	178.2	66.2	0	0	0	0	114	V279	V279-C281 VanDerWaalsContact C-N 3.26Å; V279-C281 PolarHBondContact O-N 3.24Å
282	H	84.4	Confident	86.4	Confident	138 Å²	138	76.1 Å²	76.1	64%	0.639	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-9.4	176.8	-61.3	-55.7	0	0	0	113.5	A278 V279 S280	A278-H282 PolarHBondContact O-CD2 3.5Å; A278-H282 PolarHBondContact O-NE2 3.26Å; V279-H282 WeakPolarHBondContact O-CB 3.39Å; V279-H282 PolarHBondContact O-N 2.91Å; V279-H282 VanDerWaalsContact O-N 3.12Å; S280-H282 PolarHBondContact O-N 2.82Å; S280-H282 VanDerWaalsContact O-N 3.15Å
283	Y	85.7	Confident	85.9	Confident	46 Å²	46	73.4 Å²	73.4	18%	0.18	41%	0.411	C	S	.	.			trans	-119.3	133.6	-174.4	-58.6	-74.5	0	0	0	111.6	Y101 E102 V279 S280	Y101-Y283 AromaticContact CD1-CD2 3.61Å; Y101-Y283 HydrophobicContact CD1-CD2 3.61Å; Y101-Y283 AromaticContact CD1-CE2 3.86Å; Y101-Y283 HydrophobicContact CD1-CE2 3.86Å; Y101-Y283 HydrophobicContact CD1-CG 4.34Å; Y101-Y283 AromaticContact CE1-CD2 3.52Å; Y101-Y283 HydrophobicContact CE1-CD2 3.52Å; Y101-Y283 HydrophobicContact CE1-CE2 4.26Å; Y101-Y283 HydrophobicContact CE1-CG 4.01Å; E102-Y283 HydrophobicContact CG-CE1 4.21Å; E102-Y283 WeakPolarHBondContact OE1-CE1 3.38Å; E102-Y283 PolarHBondContact OE1-OH 3Å; V279-Y283 HydrophobicContact CG1-CD2 4.33Å; V279-Y283 HydrophobicContact CG1-CE2 3.67Å; V279-Y283 VanDerWaalsContact O-CD2 3.28Å; V279-Y283 WeakPolarHBondContact O-CD2 3.35Å; S280-Y283 PolarHBondContact O-N 2.91Å; S280-Y283 VanDerWaalsContact O-N 3.1Å
284	L	82.1	Confident	85.1	Confident	163 Å²	163	73.9 Å²	73.9	85%	0.853	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-87	137.8	173.3	-69.8	169.5	0	0	0	109.7	F286	L284-F286 PolarHBondContact O-N 3.1Å
285	P	82.7	Confident	84.2	Confident	110 Å²	110	73.6 Å²	73.6	71%	0.714	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-55.3	132.3	173.9	-25.2	33.8	0	0	0	111.3	Q287	P285-Q287 PolarHBondContact O-N 3.04Å
286	F	85.1	Confident	83.6	Confident	61 Å²	61	76 Å²	76	27%	0.268	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-63.8	124.8	178.1	174.8	-110.3	0	0	0	111.5	T49 H50 P51 F109 L284	T49-F286 WeakPolarHBondContact O-CZ 3.48Å; H50-F286 AromaticContact CD2-CD1 3.5Å; H50-F286 AromaticContact CD2-CE1 4Å; H50-F286 AromaticContact CD2-CG 3.65Å; H50-F286 AromaticContact NE2-CG 3.92Å; P51-F286 HydrophobicContact CG-CD2 3.73Å; P51-F286 HydrophobicContact CG-CE2 4.24Å; P51-F286 HydrophobicContact CG-CG 4.49Å; F109-F286 HydrophobicContact CD2-CD1 4.24Å; F109-F286 HydrophobicContact CD2-CE1 4.49Å; F109-F286 AromaticContact CE2-CD1 3.89Å; F109-F286 HydrophobicContact CE2-CD1 3.89Å; F109-F286 AromaticContact CE2-CE1 3.72Å; F109-F286 HydrophobicContact CE2-CE1 3.72Å; F109-F286 HydrophobicContact CZ-CE1 4.29Å; L284-F286 PolarHBondContact O-N 3.1Å
287	Q	80.8	Confident	82.9	Confident	140 Å²	140	82 Å²	82	65%	0.654	47%	0.467	S	S	*	.			trans	-106.5	128	171.8	-64.9	-175	1.3	0	0	110.3	P285	P285-Q287 PolarHBondContact O-N 3.04Å
288	K	79.5	Confident	82.5	Confident	166 Å²	166	81.7 Å²	81.7	72%	0.722	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-69	130.4	175.7	-172.1	175.8	-179.1	175.6	0	109.3
289	P	75.3	Confident	82	Confident	98 Å²	98	81.8 Å²	81.8	64%	0.636	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-57.5	143.6	175.6	-23.8	32.9	0	0	0	112.1	S291	P289-S291 PolarHBondContact O-N 2.9Å
290	V	79.6	Confident	81.5	Confident	54 Å²	54	84.2 Å²	84.2	33%	0.327	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-65.1	130.5	175.3	-178.5	0	0	0	0	109.7	R298	V290-R298 HydrophobicContact CB-CG 4.42Å; V290-R298 HydrophobicContact CG1-CG 4.14Å
291	S	82.4	Confident	80.9	Confident	60 Å²	60	89.5 Å²	89.5	42%	0.42	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-64.3	154.8	177.1	180	0	0	0	0	111.9	P289 F293 S294	P289-S291 PolarHBondContact O-N 2.9Å; S291-F293 VanDerWaalsContact C-N 3.3Å; S291-F293 PolarHBondContact O-N 3.45Å; S291-S294 WeakPolarHBondContact O-CB 3.48Å; S291-S294 PolarHBondContact O-N 2.65Å
292	L	82.6	Confident	80.4	Confident	32 Å²	32	90.8 Å²	90.8	17%	0.168	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-43.8	178.2	-165.1	76.4	0	0	0	112.2	R298 L452 L477	L292-R298 PolarHBondContact O-NH1 3.06Å; L292-L452 HydrophobicContact CD1-CB 4.49Å; L292-L452 WeakPolarHBondContact CD1-O 3.41Å; L292-L452 HydrophobicContact CD2-CB 4.29Å; L292-L452 HydrophobicContact CD2-CD2 3.93Å; L292-L477 HydrophobicContact CD2-CD2 4.33Å
293	F	82.8	Confident	79.8	Confident	8 Å²	8	92.9 Å²	92.9	4%	0.035	50%	0.504	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	58.7	-179.2	-53.3	-72.9	0	0	0	110.2	S291 Y455 L477 A480 I485 G487 I489 L568	S291-F293 VanDerWaalsContact C-N 3.3Å; S291-F293 PolarHBondContact O-N 3.45Å; F293-Y455 HydrophobicContact CD1-CE1 4.25Å; F293-Y455 HydrophobicContact CE1-CD1 4.19Å; F293-Y455 AromaticContact CE1-CE1 3.82Å; F293-Y455 HydrophobicContact CE1-CE1 3.82Å; F293-L477 HydrophobicContact CE2-CD2 3.95Å; F293-A480 HydrophobicContact CE1-CB 4.28Å; F293-A480 HydrophobicContact CE2-CB 3.85Å; F293-A480 HydrophobicContact CZ-CB 3.48Å; F293-A480 VanDerWaalsContact CZ-CB 3.48Å; F293-I485 HydrophobicContact CD1-CB 4.33Å; F293-I485 HydrophobicContact CD1-CG2 4.06Å; F293-I485 WeakPolarHBondContact CD1-O 3.43Å; F293-I485 HydrophobicContact CE1-CB 4.23Å; F293-I485 HydrophobicContact CE1-CG2 4.41Å; F293-I485 WeakPolarHBondContact CE1-O 3.39Å; F293-I485 HydrophobicContact CG-CG2 4.35Å; F293-G487 CarbonylContact C-O 3.31Å; F293-I489 HydrophobicContact CB-CD1 3.74Å; F293-I489 HydrophobicContact CB-CG1 4.1Å; F293-I489 HydrophobicContact CB-CG2 4.43Å; F293-I489 HydrophobicContact CD2-CD1 4.24Å; F293-I489 HydrophobicContact CG-CD1 4.3Å; F293-L568 HydrophobicContact CD2-CD1 3.62Å; F293-L568 HydrophobicContact CD2-CD2 4.12Å; F293-L568 HydrophobicContact CE2-CD1 3.59Å; F293-L568 HydrophobicContact CE2-CD2 3.83Å; F293-L568 HydrophobicContact CE2-CG 4.4Å; F293-L568 HydrophobicContact CG-CD1 4.37Å; F293-L568 HydrophobicContact CZ-CD1 4.34Å
294	S	79.1	Confident	79.3	Confident	38 Å²	38	96.5 Å²	96.5	27%	0.266	53%	0.526	S	S	.	.			trans	-114.8	154.8	175.3	-176.5	0	0	0	0	110.1	S291 S296	S291-S294 WeakPolarHBondContact O-CB 3.48Å; S291-S294 PolarHBondContact O-N 2.65Å; S294-S296 VanDerWaalsContact C-N 3.26Å; S294-S296 PolarHBondContact OG-N 2.66Å
295	S	76.2	Confident	78.8	Confident	86 Å²	86	91.2 Å²	91.2	60%	0.601	50%	0.501	S	S	*	.	S	Bend	trans	-70.8	-21.6	171.2	49.9	0	0	0	0	113
296	S	81.2	Confident	78.6	Confident	68 Å²	68	94.8 Å²	94.8	48%	0.476	51%	0.514	S	S	.	.	S	Bend	trans	-76.8	143.6	-179.8	-62.8	0	0	0	0	112.5	S294 R298	S294-S296 VanDerWaalsContact C-N 3.26Å; S294-S296 PolarHBondContact OG-N 2.66Å; S296-R298 PolarHBondContact O-N 3.33Å
297	L	79.7	Confident	78.1	Confident	127 Å²	127	95.6 Å²	95.6	67%	0.665	52%	0.521	S	S	*	.			trans	-65.9	119.5	174.5	-71.2	170.2	0	0	0	110.3	C299 A300	L297-C299 PolarHBondContact O-N 3.49Å; L297-A300 HydrophobicContact CB-CB 4.11Å; L297-A300 VanDerWaalsContact O-CB 3.29Å; L297-A300 WeakPolarHBondContact O-CB 3.49Å; L297-A300 PolarHBondContact O-N 3.4Å; L297-A300 VanDerWaalsContact O-N 3.09Å
298	R	82.4	Confident	77.6	Confident	104 Å²	104	94.6 Å²	94.6	39%	0.392	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.7	178	-64.5	-170.5	-63.9	-95.3	-0.7	113.4	V290 L292 S296 K453 Y455	V290-R298 HydrophobicContact CB-CG 4.42Å; V290-R298 HydrophobicContact CG1-CG 4.14Å; L292-R298 PolarHBondContact O-NH1 3.06Å; S296-R298 PolarHBondContact O-N 3.33Å; R298-K453 PolarHBondContact NH2-O 3.36Å; R298-Y455 PolarHBondContact NH2-O 2.88Å
299	C	78.1	Confident	77	Confident	79 Å²	79	89.2 Å²	89.2	53%	0.534	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	8.5	178	57.8	0	0	0	0	114	L297 H301 L302	L297-C299 PolarHBondContact O-N 3.49Å; C299-H301 PolarHBondContact O-N 3.45Å; C299-H301 VanDerWaalsContact O-N 3.08Å; C299-L302 HydrophobicContact CB-CB 4.27Å; C299-L302 PolarHBondContact O-N 3.09Å; C299-L302 VanDerWaalsContact O-N 3.13Å
300	A	78.5	Confident	76.3	Confident	61 Å²	61	88.8 Å²	88.8	50%	0.504	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-28.7	-176.3	0	0	0	0	0	114	L297	L297-A300 HydrophobicContact CB-CB 4.11Å; L297-A300 VanDerWaalsContact O-CB 3.29Å; L297-A300 WeakPolarHBondContact O-CB 3.49Å; L297-A300 PolarHBondContact O-N 3.4Å; L297-A300 VanDerWaalsContact O-N 3.09Å
301	H	74.1	Confident	75.2	Confident	148 Å²	148	91.2 Å²	91.2	69%	0.685	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	21.6	-177.8	-51.8	-60.4	0	0	0	112.1	C299 E303	C299-H301 PolarHBondContact O-N 3.45Å; C299-H301 VanDerWaalsContact O-N 3.08Å; H301-E303 PolarHBondContact O-N 3.46Å
302	L	75.6	Confident	74	Confident	120 Å²	120	93 Å²	93	63%	0.628	52%	0.517	S	S	*	.			trans	-77.9	107.9	176.8	-175.9	69.8	0	0	0	109	C299 L304	C299-L302 HydrophobicContact CB-CB 4.27Å; C299-L302 PolarHBondContact O-N 3.09Å; C299-L302 VanDerWaalsContact O-N 3.13Å; L302-L304 HydrophobicContact CD2-CD2 4.3Å; L302-L304 HydrophobicContact CG-CD2 4.45Å
303	E	73.1	Confident	72.5	Confident	181 Å²	181	97.5 Å²	97.5	85%	0.846	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-93.5	118.9	168.5	-67.6	-179.4	177.8	0	0	108.4	H301	H301-E303 PolarHBondContact O-N 3.46Å
304	L	73.9	Confident	71.2	Confident	123 Å²	123	102.4 Å²	102.4	64%	0.644	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-86.8	138.7	171.2	-67	172.3	0	0	0	108.1	L302	L302-L304 HydrophobicContact CD2-CD2 4.3Å; L302-L304 HydrophobicContact CG-CD2 4.45Å
305	P	73.3	Confident	69.8	Low	51 Å²	51	108.4 Å²	108.4	33%	0.331	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-56.2	144.3	171.2	-23.7	35	0	0	0	111	D307 L311	P305-D307 PolarHBondContact O-N 3.03Å; P305-L311 HydrophobicContact CG-CD1 4.25Å; P305-L311 HydrophobicContact CG-CD2 3.8Å; P305-L311 HydrophobicContact CG-CG 3.88Å
306	D	76.8	Confident	68.8	Low	185 Å²	185	112.3 Å²	112.3	99%	0.989	61%	0.605	S	S	*	*	S	Bend	trans	-61.2	-29.5	177.5	-70.7	-39.6	0	0	0	112
307	D	75.9	Confident	68.1	Low	79 Å²	79	111.8 Å²	111.8	42%	0.422	60%	0.595	S	S	.	*	S	Bend	trans	-113.8	108.8	172.1	-169.4	-12.7	0	0	0	110.1	P305 S309 D310	P305-D307 PolarHBondContact O-N 3.03Å; D307-S309 PolarHBondContact O-N 2.71Å; D307-S309 VanDerWaalsContact O-N 3.16Å; D307-S309 WeakPolarHBondContact OD1-CB 3.12Å; D307-S309 PolarHBondContact OD1-N 3.12Å; D307-S309 PolarHBondContact OD1-OG 3.33Å; D307-S309 PolarHBondContact OD2-OG 3.44Å; D307-D310 WeakPolarHBondContact O-CB 3.38Å; D307-D310 PolarHBondContact O-N 2.87Å
308	I	70.1	Confident	68.2	Low	119 Å²	119	108.6 Å²	108.6	61%	0.61	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-61	-24	177.3	-64.1	171.2	0	0	0	111.1	D310 L311	I308-D310 PolarHBondContact O-N 3.34Å; I308-L311 VanDerWaalsContact O-CB 3.3Å; I308-L311 WeakPolarHBondContact O-CB 3.46Å; I308-L311 PolarHBondContact O-N 2.65Å
309	S	66.4	Low	68.4	Low	52 Å²	52	107.5 Å²	107.5	36%	0.364	58%	0.575	S	S	.	*	G	3₁₀ helix	trans	-65.9	-21.3	175.7	76.4	0	0	0	0	113	D307 L311 C312 K313	D307-S309 PolarHBondContact O-N 2.71Å; D307-S309 VanDerWaalsContact O-N 3.16Å; D307-S309 WeakPolarHBondContact OD1-CB 3.12Å; D307-S309 PolarHBondContact OD1-N 3.12Å; D307-S309 PolarHBondContact OD1-OG 3.33Å; D307-S309 PolarHBondContact OD2-OG 3.44Å; S309-L311 PolarHBondContact O-N 3.41Å; S309-C312 PolarHBondContact O-N 3.45Å; S309-K313 WeakPolarHBondContact O-CG 3.36Å
310	D	60.1	Low	68.8	Low	89 Å²	89	104 Å²	104	48%	0.476	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-67	-20.5	170.5	-69.9	-25.9	0	0	0	112.6	D307 I308 C312 K313	D307-D310 WeakPolarHBondContact O-CB 3.38Å; D307-D310 PolarHBondContact O-N 2.87Å; I308-D310 PolarHBondContact O-N 3.34Å; D310-C312 VanDerWaalsContact C-N 3.28Å; D310-K313 WeakPolarHBondContact OD1-CE 3.25Å; D310-K313 IonicContact OD1-NZ 3.34Å; D310-K313 PolarHBondContact OD1-NZ 2.97Å
311	L	58.1	Low	69.3	Low	106 Å²	106	102 Å²	102	56%	0.555	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-82.6	-3.5	170.5	-61.2	170.1	0	0	0	113	P305 I308 S309	P305-L311 HydrophobicContact CG-CD1 4.25Å; P305-L311 HydrophobicContact CG-CD2 3.8Å; P305-L311 HydrophobicContact CG-CG 3.88Å; I308-L311 VanDerWaalsContact O-CB 3.3Å; I308-L311 WeakPolarHBondContact O-CB 3.46Å; I308-L311 PolarHBondContact O-N 2.65Å; S309-L311 PolarHBondContact O-N 3.41Å
312	C	56.3	Low	69.9	Low	97 Å²	97	98.9 Å²	98.9	66%	0.655	52%	0.519	S	S	*	.	S	Bend	trans	-124.4	17.5	-171.6	-58	0	0	0	0	113.4	S309 D310	S309-C312 PolarHBondContact O-N 3.45Å; D310-C312 VanDerWaalsContact C-N 3.28Å
313	K	50.5	Low	70.7	Confident	127 Å²	127	94.6 Å²	94.6	55%	0.552	49%	0.494	S	S	*	.			trans	-94.3	0.2	-165.3	-97.1	176.4	-168.6	168.5	0	117.3	S309 D310	S309-K313 WeakPolarHBondContact O-CG 3.36Å; D310-K313 WeakPolarHBondContact OD1-CE 3.25Å; D310-K313 IonicContact OD1-NZ 3.34Å; D310-K313 PolarHBondContact OD1-NZ 2.97Å
314	D	55.1	Low	71.6	Confident	110 Å²	110	86.2 Å²	86.2	59%	0.588	46%	0.456	S	S	*	.			trans	-105	99.6	-176.1	-68.5	-32.2	0	0	0	111.1	D316 E317	D314-D316 VanDerWaalsContact C-N 3.27Å; D314-D316 PolarHBondContact O-N 3.08Å; D314-E317 HydrophobicContact CB-CG 3.25Å; D314-E317 WeakPolarHBondContact CB-OE1 3.14Å; D314-E317 WeakPolarHBondContact O-CG 3.31Å
315	D	49.7	Very low	72.5	Confident	165 Å²	165	80.5 Å²	80.5	88%	0.882	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-0	176.4	-79	-36.6	0	0	0	113
316	D	56	Low	73.5	Confident	168 Å²	168	80 Å²	80	90%	0.898	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.9	31.7	179.8	-80.6	-37.7	0	0	0	112.3	D314 D318	D314-D316 VanDerWaalsContact C-N 3.27Å; D314-D316 PolarHBondContact O-N 3.08Å; D316-D318 PolarHBondContact O-N 2.6Å
317	E	66.3	Low	74.4	Confident	56 Å²	56	71.4 Å²	71.4	26%	0.262	38%	0.375	S	S	.	.			trans	-70.3	119.2	-170.6	-78.1	-159.2	-173.3	0	0	114.4	D314 Y319	D314-E317 HydrophobicContact CB-CG 3.25Å; D314-E317 WeakPolarHBondContact CB-OE1 3.14Å; D314-E317 WeakPolarHBondContact O-CG 3.31Å; E317-Y319 HydrophobicContact CB-CD1 3.88Å; E317-Y319 HydrophobicContact CB-CE1 3.74Å; E317-Y319 PolarHBondContact O-N 3.35Å
318	D	81.9	Confident	75.4	Confident	60 Å²	60	67.7 Å²	67.7	32%	0.321	36%	0.355	S	S	.	.			trans	-67.9	82.7	155.1	179	10	0	0	0	109.6	D316 L320 S321 R392	D316-D318 PolarHBondContact O-N 2.6Å; D318-L320 PolarHBondContact O-N 3.41Å; D318-L320 WeakPolarHBondContact OD1-CB 3.29Å; D318-L320 PolarHBondContact OD1-N 3.26Å; D318-S321 WeakPolarHBondContact O-CB 3.37Å; D318-S321 PolarHBondContact O-N 2.55Å; D318-S321 PolarHBondContact O-OG 3.01Å; D318-R392 IonicContact OD1-CZ 2.7Å; D318-R392 IonicContact OD1-NH1 2.66Å; D318-R392 PolarHBondContact OD1-NH1 3.41Å; D318-R392 IonicContact OD1-NH2 3.67Å; D318-R392 IonicContact OD2-CZ 3.27Å; D318-R392 VanDerWaalsContact OD2-CZ 3.22Å; D318-R392 IonicContact OD2-NH1 3.61Å; D318-R392 PolarHBondContact OD2-NH1 3.32Å; D318-R392 IonicContact OD2-NH2 3.22Å; D318-R392 PolarHBondContact OD2-NH2 3.22Å
319	Y	86.4	Confident	76.6	Confident	82 Å²	82	62.9 Å²	62.9	32%	0.322	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-24.6	-178.1	-58.1	-64.4	0	0	0	114.2	E317 S321 E322 Y403 Y404	E317-Y319 HydrophobicContact CB-CD1 3.88Å; E317-Y319 HydrophobicContact CB-CE1 3.74Å; E317-Y319 PolarHBondContact O-N 3.35Å; Y319-S321 VanDerWaalsContact C-N 3.3Å; Y319-E322 PolarHBondContact O-N 2.85Å; Y319-Y403 HydrophobicContact CD2-CD2 4.16Å; Y319-Y403 HydrophobicContact CD2-CE2 4.23Å; Y319-Y403 AromaticContact CG-CD2 3.99Å; Y319-Y403 HydrophobicContact CG-CD2 3.99Å; Y319-Y403 HydrophobicContact CG-CE2 4.3Å; Y319-Y403 HydrophobicContact CG-CG 4.13Å; Y319-Y404 AromaticContact CD1-CE2 3.86Å; Y319-Y404 HydrophobicContact CD1-CE2 3.86Å; Y319-Y404 HydrophobicContact CE1-CE2 4.1Å
320	L	87.9	Confident	78.1	Confident	5 Å²	5	62.4 Å²	62.4	3%	0.026	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-28.7	176	-169.1	66.5	0	0	0	111.7	D318 E322 R323 V328 L391 R392 L395	D318-L320 PolarHBondContact O-N 3.41Å; D318-L320 WeakPolarHBondContact OD1-CB 3.29Å; D318-L320 PolarHBondContact OD1-N 3.26Å; L320-E322 PolarHBondContact O-N 3.44Å; L320-R323 HydrophobicContact CD1-CG 4.42Å; L320-R323 WeakPolarHBondContact O-CB 3.31Å; L320-R323 PolarHBondContact O-N 3.14Å; L320-R323 VanDerWaalsContact O-N 3.16Å; L320-V328 HydrophobicContact CD1-CG2 3.96Å; L320-V328 HydrophobicContact CD2-CG1 4.46Å; L320-V328 HydrophobicContact CG-CG1 4.44Å; L320-V328 HydrophobicContact CG-CG2 4.18Å; L320-L391 HydrophobicContact CD1-CD2 4.28Å; L320-L391 HydrophobicContact CD2-CD2 3.84Å; L320-L391 HydrophobicContact CD2-CG 4.15Å; L320-R392 HydrophobicContact CD2-CG 4.22Å; L320-L395 HydrophobicContact CD1-CD1 4.14Å
321	S	87.9	Confident	79.8	Confident	19 Å²	19	58.1 Å²	58.1	13%	0.133	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-25.8	178	74.9	0	0	0	0	112.9	P3 I4 R5 D318 Y319 R323	P3-S321 WeakPolarHBondContact CB-O 3.4Å; I4-S321 WeakPolarHBondContact CG2-O 3.41Å; I4-S321 PolarHBondContact N-O 2.92Å; I4-S321 VanDerWaalsContact N-O 3.15Å; R5-S321 PolarHBondContact N-O 3.46Å; D318-S321 WeakPolarHBondContact O-CB 3.37Å; D318-S321 PolarHBondContact O-N 2.55Å; D318-S321 PolarHBondContact O-OG 3.01Å; Y319-S321 VanDerWaalsContact C-N 3.3Å; S321-R323 VanDerWaalsContact C-N 3.26Å; S321-R323 PolarHBondContact O-N 3Å
322	E	87.6	Confident	81.7	Confident	82 Å²	82	53.2 Å²	53.2	38%	0.383	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-2.9	176.7	-63.4	-49.9	120	0	0	113.6	Y319 L320	Y319-E322 PolarHBondContact O-N 2.85Å; L320-E322 PolarHBondContact O-N 3.44Å
323	R	90.9	Very high	83.6	Confident	30 Å²	30	51 Å²	51	11%	0.113	26%	0.257	C	S	.	.	S	Bend	trans	-88.9	154.4	179	-53.8	-53.8	-62.4	168.1	4.1	112	P3 I4 L320 S321 E327 V328 Y403	P3-R323 CarbonylContact C-O 3.59Å; P3-R323 WeakPolarHBondContact CA-O 3.38Å; I4-R323 PolarHBondContact N-O 3.09Å; L320-R323 HydrophobicContact CD1-CG 4.42Å; L320-R323 WeakPolarHBondContact O-CB 3.31Å; L320-R323 PolarHBondContact O-N 3.14Å; L320-R323 VanDerWaalsContact O-N 3.16Å; S321-R323 VanDerWaalsContact C-N 3.26Å; S321-R323 PolarHBondContact O-N 3Å; R323-E327 IonicContact CZ-OE1 2.65Å; R323-E327 IonicContact CZ-OE2 3.65Å; R323-E327 VanDerWaalsContact CZ-OE2 3.28Å; R323-E327 VanDerWaalsContact NE-CD 3.34Å; R323-E327 IonicContact NE-OE1 3.7Å; R323-E327 PolarHBondContact NE-OE1 3.45Å; R323-E327 IonicContact NE-OE2 3.07Å; R323-E327 PolarHBondContact NE-OE2 2.85Å; R323-E327 IonicContact NH2-OE1 2.74Å; R323-E327 PolarHBondContact NH2-OE1 3.3Å; R323-E327 IonicContact NH2-OE2 3.19Å; R323-E327 PolarHBondContact NH2-OE2 3.08Å; R323-V328 HydrophobicContact CB-CG2 3.82Å; R323-Y403 HydrophobicContact CG-CE1 4.4Å
324	G	92	Very high	85.8	Confident	5 Å²	5	46.6 Å²	46.6	5%	0.052	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-62.5	139.6	177	0	0	0	0	0	111.9	K2 D326 E327 V328	K2-G324 WeakPolarHBondContact O-CA 3.38Å; G324-D326 PolarHBondContact O-N 3.5Å; G324-E327 WeakPolarHBondContact O-CB 3.32Å; G324-E327 PolarHBondContact O-N 2.96Å; G324-V328 WeakPolarHBondContact O-CG2 3.37Å; G324-V328 PolarHBondContact O-N 3.1Å
325	I	94.3	Very high	87.8	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-59.2	-33.6	-178.3	-168.6	172.1	0	0	0	113.3	I4 L9 Q55 V57 E72 V328 Y329	I4-I325 HydrophobicContact CB-CB 4.47Å; I4-I325 HydrophobicContact CD1-CG1 4.11Å; I4-I325 HydrophobicContact CG1-CB 4.43Å; I4-I325 HydrophobicContact CG1-CD1 4.44Å; I4-I325 HydrophobicContact CG1-CG1 4.21Å; L9-I325 HydrophobicContact CD2-CD1 4.01Å; L9-I325 HydrophobicContact CD2-CG1 3.58Å; Q55-I325 HydrophobicContact CB-CG2 4.34Å; Q55-I325 HydrophobicContact CG-CG2 4.18Å; V57-I325 HydrophobicContact CG2-CD1 3.87Å; V57-I325 HydrophobicContact CG2-CG1 3.85Å; V57-I325 HydrophobicContact CG2-CG2 3.98Å; E72-I325 VanDerWaalsContact CA-CD1 3.5Å; E72-I325 HydrophobicContact CB-CD1 3.65Å; E72-I325 HydrophobicContact CG-CD1 4.01Å; I325-V328 PolarHBondContact O-N 2.89Å; I325-Y329 WeakPolarHBondContact O-CB 3.32Å; I325-Y329 PolarHBondContact O-N 3.39Å
326	D	93.4	Very high	89.9	Confident	41 Å²	41	35.9 Å²	35.9	22%	0.219	19%	0.194	C	C	.	.	H	α-helix	trans	-68.5	-38.7	175.2	56.3	-49.3	0	0	0	112.6	M1 G324 H330	M1-D326 VanDerWaalsContact CE-OD2 3.29Å; M1-D326 WeakPolarHBondContact CE-OD2 3.19Å; M1-D326 VanDerWaalsContact SD-OD1 3.39Å; G324-D326 PolarHBondContact O-N 3.5Å; D326-H330 WeakPolarHBondContact O-CB 3.42Å; D326-H330 PolarHBondContact O-N 3.44Å
327	E	95.4	Very high	91.8	Very high	4 Å²	4	28.6 Å²	28.6	2%	0.019	16%	0.158	C	C	.	.	H	α-helix	trans	-66.8	-45.8	172.1	-179.8	-176.8	158.9	0	0	111.6	R323 G324 Y329 H330 L331 I445 L473	R323-E327 IonicContact CZ-OE1 2.65Å; R323-E327 IonicContact CZ-OE2 3.65Å; R323-E327 VanDerWaalsContact CZ-OE2 3.28Å; R323-E327 VanDerWaalsContact NE-CD 3.34Å; R323-E327 IonicContact NE-OE1 3.7Å; R323-E327 PolarHBondContact NE-OE1 3.45Å; R323-E327 IonicContact NE-OE2 3.07Å; R323-E327 PolarHBondContact NE-OE2 2.85Å; R323-E327 IonicContact NH2-OE1 2.74Å; R323-E327 PolarHBondContact NH2-OE1 3.3Å; R323-E327 IonicContact NH2-OE2 3.19Å; R323-E327 PolarHBondContact NH2-OE2 3.08Å; G324-E327 WeakPolarHBondContact O-CB 3.32Å; G324-E327 PolarHBondContact O-N 2.96Å; E327-Y329 VanDerWaalsContact C-N 3.31Å; E327-Y329 PolarHBondContact O-N 3.08Å; E327-H330 WeakPolarHBondContact O-CB 3.22Å; E327-H330 PolarHBondContact O-N 3.34Å; E327-L331 HydrophobicContact CG-CD1 4.15Å; E327-L331 WeakPolarHBondContact O-CG 3.29Å; E327-L331 PolarHBondContact O-N 3.12Å; E327-I445 HydrophobicContact CG-CG2 4.05Å; E327-L473 HydrophobicContact CB-CD2 3.98Å; E327-L473 HydrophobicContact CG-CD2 4.09Å
328	V	96.3	Very high	93.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.6	-43.2	177.8	175.6	0	0	0	0	110.6	I4 L320 R323 G324 I325 L331 W332 L388 L391	I4-V328 HydrophobicContact CD1-CG1 4.25Å; I4-V328 HydrophobicContact CG2-CG2 4.26Å; L320-V328 HydrophobicContact CD1-CG2 3.96Å; L320-V328 HydrophobicContact CD2-CG1 4.46Å; L320-V328 HydrophobicContact CG-CG1 4.44Å; L320-V328 HydrophobicContact CG-CG2 4.18Å; R323-V328 HydrophobicContact CB-CG2 3.82Å; G324-V328 WeakPolarHBondContact O-CG2 3.37Å; G324-V328 PolarHBondContact O-N 3.1Å; I325-V328 PolarHBondContact O-N 2.89Å; V328-L331 PolarHBondContact O-N 3.09Å; V328-W332 VanDerWaalsContact O-CB 3.28Å; V328-W332 WeakPolarHBondContact O-CB 3.24Å; V328-W332 PolarHBondContact O-N 3.31Å; V328-L388 HydrophobicContact CG1-CD1 4.23Å; V328-L388 HydrophobicContact CG1-CD2 3.94Å; V328-L391 HydrophobicContact CG1-CD2 4.14Å
329	Y	97	Very high	93.6	Very high	19 Å²	19	27.4 Å²	27.4	8%	0.075	15%	0.154	C	C	.	.	H	α-helix	trans	-63.8	-42.6	175.1	175.4	-104.7	0	0	0	112.4	L9 V57 D58 V70 I325 E327 L331 W332 C333 L339 L386	L9-Y329 HydrophobicContact CD1-CD2 4.25Å; L9-Y329 HydrophobicContact CD2-CD2 4.49Å; V57-Y329 HydrophobicContact CG1-CD1 3.66Å; V57-Y329 HydrophobicContact CG1-CE1 4.48Å; V57-Y329 HydrophobicContact CG1-CG 3.66Å; D58-Y329 HydrophobicContact CB-CD1 4.12Å; D58-Y329 HydrophobicContact CB-CE1 3.44Å; D58-Y329 VanDerWaalsContact CB-CE1 3.44Å; D58-Y329 WeakPolarHBondContact OD2-CE1 3.47Å; D58-Y329 PolarHBondContact OD2-OH 3.37Å; V70-Y329 HydrophobicContact CB-CE2 4.24Å; V70-Y329 HydrophobicContact CG1-CD2 3.89Å; V70-Y329 HydrophobicContact CG1-CE2 3.93Å; V70-Y329 HydrophobicContact CG2-CE2 3.82Å; I325-Y329 WeakPolarHBondContact O-CB 3.32Å; I325-Y329 PolarHBondContact O-N 3.39Å; E327-Y329 VanDerWaalsContact C-N 3.31Å; E327-Y329 PolarHBondContact O-N 3.08Å; Y329-L331 PolarHBondContact O-N 3.22Å; Y329-W332 HydrophobicContact CD2-CE3 4.06Å; Y329-W332 AromaticContact CE2-CE3 3.93Å; Y329-W332 HydrophobicContact CE2-CE3 3.93Å; Y329-W332 HydrophobicContact CE2-CZ3 4.03Å; Y329-W332 WeakPolarHBondContact O-CB 3.31Å; Y329-W332 PolarHBondContact O-N 3.37Å; Y329-C333 PolarHBondContact O-N 3.15Å; Y329-C333 PolarHBondContact O-SG 3.16Å; Y329-C333 VanDerWaalsContact O-SG 3.39Å; Y329-L339 HydrophobicContact CE2-CD2 4.34Å; Y329-L339 WeakPolarHBondContact OH-CD1 3.13Å; Y329-L386 HydrophobicContact CE2-CD1 4.5Å
330	H	96.8	Very high	93.8	Very high	41 Å²	41	26.9 Å²	26.9	19%	0.19	15%	0.154	C	C	.	.	H	α-helix	trans	-58	-48.1	175.3	178	71.9	0	0	0	111.6	D326 E327 W332 C333 L334 L473	D326-H330 WeakPolarHBondContact O-CB 3.42Å; D326-H330 PolarHBondContact O-N 3.44Å; E327-H330 WeakPolarHBondContact O-CB 3.22Å; E327-H330 PolarHBondContact O-N 3.34Å; H330-W332 VanDerWaalsContact C-N 3.32Å; H330-W332 PolarHBondContact O-N 3.2Å; H330-C333 WeakPolarHBondContact O-CB 3.33Å; H330-C333 PolarHBondContact O-N 3.13Å; H330-L334 WeakPolarHBondContact O-CG 3.49Å; H330-L334 PolarHBondContact O-N 2.92Å; H330-L473 HydrophobicContact CB-CD1 4.14Å; H330-L473 HydrophobicContact CB-CD2 4.22Å
331	L	97	Very high	93.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.6	-35.1	176.7	-65.5	171	0	0	0	112.2	E327 V328 Y329 L334 A335 L391 T438 Q441 L442 I445	E327-L331 HydrophobicContact CG-CD1 4.15Å; E327-L331 WeakPolarHBondContact O-CG 3.29Å; E327-L331 PolarHBondContact O-N 3.12Å; V328-L331 PolarHBondContact O-N 3.09Å; Y329-L331 PolarHBondContact O-N 3.22Å; L331-L334 HydrophobicContact CD2-CD1 4.44Å; L331-L334 PolarHBondContact O-N 3.01Å; L331-A335 WeakPolarHBondContact O-CB 3.48Å; L331-A335 PolarHBondContact O-N 3.41Å; L331-L391 HydrophobicContact CB-CD1 3.78Å; L331-L391 HydrophobicContact CB-CD2 4.05Å; L331-T438 HydrophobicContact CB-CG2 4.45Å; L331-T438 HydrophobicContact CD2-CG2 4.37Å; L331-Q441 HydrophobicContact CD2-CB 4.32Å; L331-L442 HydrophobicContact CD1-CB 4.3Å; L331-L442 HydrophobicContact CD1-CD1 3.58Å; L331-L442 HydrophobicContact CD2-CB 4.1Å; L331-I445 HydrophobicContact CD2-CD1 4.4Å
332	W	97.4	Very high	94.1	Very high	3 Å²	3	32.9 Å²	32.9	1%	0.011	18%	0.178	C	C	.	.	H	α-helix	trans	-61.1	-43.6	174.9	176.7	87.3	0	0	0	111.6	L9 V328 Y329 H330 L334 A335 G337 D338 L339 E342 L386 S387 L388 L391	L9-W332 HydrophobicContact CD1-CB 4.41Å; L9-W332 HydrophobicContact CD1-CG 4.39Å; V328-W332 VanDerWaalsContact O-CB 3.28Å; V328-W332 WeakPolarHBondContact O-CB 3.24Å; V328-W332 PolarHBondContact O-N 3.31Å; Y329-W332 HydrophobicContact CD2-CE3 4.06Å; Y329-W332 AromaticContact CE2-CE3 3.93Å; Y329-W332 HydrophobicContact CE2-CE3 3.93Å; Y329-W332 HydrophobicContact CE2-CZ3 4.03Å; Y329-W332 WeakPolarHBondContact O-CB 3.31Å; Y329-W332 PolarHBondContact O-N 3.37Å; H330-W332 VanDerWaalsContact C-N 3.32Å; H330-W332 PolarHBondContact O-N 3.2Å; W332-L334 PolarHBondContact O-N 2.94Å; W332-A335 WeakPolarHBondContact O-CB 3.39Å; W332-A335 PolarHBondContact O-N 2.82Å; W332-G337 VanDerWaalsContact CH2-C 3.41Å; W332-G337 VanDerWaalsContact CH2-CA 3.49Å; W332-G337 VanDerWaalsContact CZ2-CA 3.42Å; W332-G337 WeakPolarHBondContact O-CA 3.48Å; W332-G337 PolarHBondContact O-N 2.86Å; W332-D338 VanDerWaalsContact CH2-N 3.28Å; W332-L339 HydrophobicContact CH2-CD2 3.95Å; W332-L339 HydrophobicContact CH2-CG 4.39Å; W332-L339 HydrophobicContact CZ3-CD2 3.97Å; W332-L339 HydrophobicContact CZ3-CG 4.25Å; W332-E342 HydrophobicContact CH2-CG 4.36Å; W332-E342 HydrophobicContact CZ2-CG 3.95Å; W332-L386 HydrophobicContact CH2-CD1 4.01Å; W332-L386 HydrophobicContact CH2-CD2 4.47Å; W332-L386 HydrophobicContact CZ2-CB 4.17Å; W332-L386 HydrophobicContact CZ2-CD1 4.17Å; W332-L386 HydrophobicContact CZ2-CD2 4.42Å; W332-L386 HydrophobicContact CZ2-CG 4.5Å; W332-L386 HydrophobicContact CZ3-CD1 4.19Å; W332-S387 PolarHBondContact NE1-O 2.81Å; W332-L388 HydrophobicContact CG-CD2 4.5Å; W332-L391 HydrophobicContact CB-CD2 4.24Å
333	C	96.8	Very high	94.2	Very high	50 Å²	50	29 Å²	29	34%	0.338	16%	0.16	S	C	.	.	H	α-helix	trans	-59.6	-44.9	172.9	-66.7	0	0	0	0	111.4	Y329 H330 A335 G336	Y329-C333 PolarHBondContact O-N 3.15Å; Y329-C333 PolarHBondContact O-SG 3.16Å; Y329-C333 VanDerWaalsContact O-SG 3.39Å; H330-C333 WeakPolarHBondContact O-CB 3.33Å; H330-C333 PolarHBondContact O-N 3.13Å; C333-A335 VanDerWaalsContact C-N 3.28Å; C333-A335 PolarHBondContact O-N 2.76Å; C333-G336 PolarHBondContact O-N 3.46Å; C333-G336 VanDerWaalsContact O-N 3.15Å
334	L	96.4	Very high	94	Very high	34 Å²	34	30.7 Å²	30.7	18%	0.178	17%	0.174	C	C	.	.	H	α-helix	trans	-64.6	-32.1	177	-63.9	-178.1	0	0	0	113	H330 L331 W332 G336 R394 T438 Q441	H330-L334 WeakPolarHBondContact O-CG 3.49Å; H330-L334 PolarHBondContact O-N 2.92Å; L331-L334 HydrophobicContact CD2-CD1 4.44Å; L331-L334 PolarHBondContact O-N 3.01Å; W332-L334 PolarHBondContact O-N 2.94Å; L334-G336 PolarHBondContact O-N 2.8Å; L334-R394 PolarHBondContact O-NH1 3.21Å; L334-T438 HydrophobicContact CB-CG2 4.47Å; L334-T438 PolarHBondContact O-OG1 3.06Å; L334-Q441 HydrophobicContact CD1-CB 3.68Å; L334-Q441 HydrophobicContact CD1-CG 3.62Å
335	A	96.1	Very high	93.8	Very high	4 Å²	4	35.4 Å²	35.4	3%	0.033	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-5.1	177	0	0	0	0	0	113.7	L331 W332 C333 L391 R394 T438	L331-A335 WeakPolarHBondContact O-CB 3.48Å; L331-A335 PolarHBondContact O-N 3.41Å; W332-A335 WeakPolarHBondContact O-CB 3.39Å; W332-A335 PolarHBondContact O-N 2.82Å; C333-A335 VanDerWaalsContact C-N 3.28Å; C333-A335 PolarHBondContact O-N 2.76Å; A335-L391 HydrophobicContact CB-CB 4.02Å; A335-L391 HydrophobicContact CB-CD1 4.03Å; A335-R394 VanDerWaalsContact O-CZ 3.29Å; A335-R394 PolarHBondContact O-NE 3.26Å; A335-R394 PolarHBondContact O-NH2 3.21Å; A335-R394 VanDerWaalsContact O-NH2 3.13Å; A335-T438 HydrophobicContact CB-CG2 4.32Å
336	G	94.7	Very high	93.5	Very high	46 Å²	46	41 Å²	41	47%	0.474	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	101.9	13	-177.6	0	0	0	0	0	114	C333 L334	C333-G336 PolarHBondContact O-N 3.46Å; C333-G336 VanDerWaalsContact O-N 3.15Å; L334-G336 PolarHBondContact O-N 2.8Å
337	G	94.9	Very high	92.9	Very high	15 Å²	15	46.2 Å²	46.2	16%	0.155	25%	0.245	C	C	.	.			trans	-60.9	131.5	171.9	0	0	0	0	0	111.8	W332	W332-G337 VanDerWaalsContact CH2-C 3.41Å; W332-G337 VanDerWaalsContact CH2-CA 3.49Å; W332-G337 VanDerWaalsContact CZ2-CA 3.42Å; W332-G337 WeakPolarHBondContact O-CA 3.48Å; W332-G337 PolarHBondContact O-N 2.86Å
338	D	93.9	Very high	92.2	Very high	79 Å²	79	47 Å²	47	42%	0.422	25%	0.249	S	C	.	.			trans	-136.2	113.7	-179.3	177.3	-26.2	0	0	0	108.8	W332 E340 K341 E342	W332-D338 VanDerWaalsContact CH2-N 3.28Å; D338-E340 PolarHBondContact OD1-N 3.37Å; D338-K341 HydrophobicContact CB-CB 3.78Å; D338-K341 PolarHBondContact O-N 3.28Å; D338-K341 PolarHBondContact OD1-N 3.18Å; D338-E342 WeakPolarHBondContact O-CB 3.23Å; D338-E342 WeakPolarHBondContact O-CG 3.37Å; D338-E342 PolarHBondContact O-N 3.02Å
339	L	93.6	Very high	91.3	Very high	13 Å²	13	48.3 Å²	48.3	7%	0.068	26%	0.256	C	S	.	.	H	α-helix	trans	-62.8	-43.7	-176.8	-68.7	177.8	0	0	0	112.5	A11 S60 I68 V70 Y329 W332 K341 E342 L343 L386	A11-L339 HydrophobicContact CB-CD2 4.33Å; S60-L339 WeakPolarHBondContact OG-CD1 3.44Å; I68-L339 HydrophobicContact CB-CD1 4.43Å; I68-L339 HydrophobicContact CD1-CB 4.1Å; I68-L339 HydrophobicContact CG2-CB 4.24Å; I68-L339 HydrophobicContact CG2-CD1 3.99Å; V70-L339 HydrophobicContact CG2-CD1 3.71Å; V70-L339 HydrophobicContact CG2-CD2 3.69Å; V70-L339 HydrophobicContact CG2-CG 4.36Å; Y329-L339 HydrophobicContact CE2-CD2 4.34Å; Y329-L339 WeakPolarHBondContact OH-CD1 3.13Å; W332-L339 HydrophobicContact CH2-CD2 3.95Å; W332-L339 HydrophobicContact CH2-CG 4.39Å; W332-L339 HydrophobicContact CZ3-CD2 3.97Å; W332-L339 HydrophobicContact CZ3-CG 4.25Å; L339-K341 VanDerWaalsContact C-N 3.32Å; L339-K341 PolarHBondContact O-N 3.22Å; L339-E342 PolarHBondContact O-N 2.8Å; L339-L343 WeakPolarHBondContact O-CB 3.01Å; L339-L343 VanDerWaalsContact O-CG 3.27Å; L339-L343 WeakPolarHBondContact O-CG 3.36Å; L339-L343 PolarHBondContact O-N 2.96Å; L339-L386 HydrophobicContact CD2-CD1 3.52Å; L339-L386 HydrophobicContact CD2-CD2 4.04Å; L339-L386 HydrophobicContact CD2-CG 4.44Å
340	E	90.2	Very high	90	Very high	71 Å²	71	52.2 Å²	52.2	33%	0.332	28%	0.275	S	S	.	.	H	α-helix	trans	-65.4	-41.4	-179.5	-71.9	-165	171.1	0	0	110.2	G62 I68 D338 T344	G62-E340 VanDerWaalsContact CA-OE1 3.26Å; G62-E340 WeakPolarHBondContact CA-OE1 3.45Å; I68-E340 HydrophobicContact CD1-CG 3.9Å; D338-E340 PolarHBondContact OD1-N 3.37Å; E340-T344 VanDerWaalsContact O-CB 3.3Å; E340-T344 WeakPolarHBondContact O-CB 3.49Å; E340-T344 PolarHBondContact O-N 3.5Å; E340-T344 PolarHBondContact O-OG1 2.72Å
341	K	90.4	Very high	88.2	Confident	117 Å²	117	56 Å²	56	51%	0.509	31%	0.306	S	S	.	.	H	α-helix	trans	-65.4	-46	177.6	-175.1	179.5	176.9	-176.1	0	112.4	D338 L339 T344 N345	D338-K341 HydrophobicContact CB-CB 3.78Å; D338-K341 PolarHBondContact O-N 3.28Å; D338-K341 PolarHBondContact OD1-N 3.18Å; L339-K341 VanDerWaalsContact C-N 3.32Å; L339-K341 PolarHBondContact O-N 3.22Å; K341-T344 PolarHBondContact O-N 2.7Å; K341-N345 WeakPolarHBondContact O-CB 3.41Å; K341-N345 PolarHBondContact O-N 3.49Å; K341-N345 PolarHBondContact O-ND2 3.4Å; K341-N345 PolarHBondContact O-OD1 3.35Å
342	E	91.5	Very high	86.1	Confident	33 Å²	33	60.8 Å²	60.8	15%	0.154	33%	0.327	C	S	.	.	H	α-helix	trans	-60.7	-45.3	177.2	-76.4	-60.7	136.9	0	0	111.5	W332 D338 L339 T344 N345 K346 L386	W332-E342 HydrophobicContact CH2-CG 4.36Å; W332-E342 HydrophobicContact CZ2-CG 3.95Å; D338-E342 WeakPolarHBondContact O-CB 3.23Å; D338-E342 WeakPolarHBondContact O-CG 3.37Å; D338-E342 PolarHBondContact O-N 3.02Å; L339-E342 PolarHBondContact O-N 2.8Å; E342-T344 VanDerWaalsContact C-N 3.34Å; E342-T344 PolarHBondContact O-N 2.82Å; E342-N345 PolarHBondContact O-N 3.44Å; E342-K346 WeakPolarHBondContact O-CG 3.46Å; E342-K346 PolarHBondContact O-N 2.97Å; E342-K346 VanDerWaalsContact O-N 3.13Å; E342-L386 HydrophobicContact CB-CD2 4.08Å; E342-L386 HydrophobicContact CG-CD2 4.29Å
343	L	88.6	Confident	83.8	Confident	0 Å²	0	64 Å²	64	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-67.9	-32.6	177.3	-66.9	179.6	0	0	0	112.8	A11 T13 I68 L339 K346 E347 I348 I349 V384	A11-L343 HydrophobicContact CB-CD2 4.39Å; T13-L343 HydrophobicContact CG2-CD1 4.27Å; I68-L343 HydrophobicContact CB-CD1 4.38Å; I68-L343 HydrophobicContact CD1-CD1 3.82Å; I68-L343 HydrophobicContact CG1-CD1 3.8Å; I68-L343 HydrophobicContact CG2-CD1 3.69Å; L339-L343 WeakPolarHBondContact O-CB 3.01Å; L339-L343 VanDerWaalsContact O-CG 3.27Å; L339-L343 WeakPolarHBondContact O-CG 3.36Å; L339-L343 PolarHBondContact O-N 2.96Å; L343-K346 PolarHBondContact O-N 3.24Å; L343-E347 PolarHBondContact O-N 3.26Å; L343-I348 HydrophobicContact CB-CB 4.3Å; L343-I348 HydrophobicContact CD2-CB 4.34Å; L343-I348 HydrophobicContact CD2-CG1 4.43Å; L343-I348 HydrophobicContact CD2-CG2 4.33Å; L343-I348 WeakPolarHBondContact O-CB 3.35Å; L343-I348 PolarHBondContact O-N 3.04Å; L343-I349 HydrophobicContact CB-CB 4.47Å; L343-I349 HydrophobicContact CB-CD1 3.68Å; L343-I349 HydrophobicContact CB-CG1 3.77Å; L343-I349 HydrophobicContact CD1-CD1 3.91Å; L343-I349 HydrophobicContact CD1-CG1 4.37Å; L343-I349 HydrophobicContact CG-CD1 4.46Å; L343-I349 PolarHBondContact O-N 3.06Å; L343-V384 HydrophobicContact CD2-CB 3.74Å; L343-V384 HydrophobicContact CD2-CG1 4.23Å; L343-V384 HydrophobicContact CD2-CG2 3.67Å
344	T	87.3	Confident	81.2	Confident	66 Å²	66	67 Å²	67	41%	0.405	37%	0.367	S	S	.	.	H	α-helix	trans	-67.9	-43.6	173.3	-57.8	0	0	0	0	111.1	E340 K341 E342 K346 E347	E340-T344 VanDerWaalsContact O-CB 3.3Å; E340-T344 WeakPolarHBondContact O-CB 3.49Å; E340-T344 PolarHBondContact O-N 3.5Å; E340-T344 PolarHBondContact O-OG1 2.72Å; K341-T344 PolarHBondContact O-N 2.7Å; E342-T344 VanDerWaalsContact C-N 3.34Å; E342-T344 PolarHBondContact O-N 2.82Å; T344-K346 PolarHBondContact O-N 2.95Å; T344-E347 PolarHBondContact O-N 2.98Å
345	N	89	Confident	79	Confident	103 Å²	103	71.4 Å²	71.4	55%	0.551	39%	0.389	S	S	*	.	H	α-helix	trans	-61.8	-27.3	177.1	-70.1	-18.1	0	0	0	112.7	K341 E342 E347	K341-N345 WeakPolarHBondContact O-CB 3.41Å; K341-N345 PolarHBondContact O-N 3.49Å; K341-N345 PolarHBondContact O-ND2 3.4Å; K341-N345 PolarHBondContact O-OD1 3.35Å; E342-N345 PolarHBondContact O-N 3.44Å; N345-E347 VanDerWaalsContact C-N 3.34Å
346	K	86.3	Confident	76.6	Confident	123 Å²	123	73.6 Å²	73.6	54%	0.535	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	9.4	176.1	-63.9	-69.5	-173.1	177.2	0	113.3	E342 L343 T344 I348 V384	E342-K346 WeakPolarHBondContact O-CG 3.46Å; E342-K346 PolarHBondContact O-N 2.97Å; E342-K346 VanDerWaalsContact O-N 3.13Å; L343-K346 PolarHBondContact O-N 3.24Å; T344-K346 PolarHBondContact O-N 2.95Å; K346-I348 HydrophobicContact CB-CG1 4.17Å; K346-I348 PolarHBondContact O-N 3.26Å; K346-I348 VanDerWaalsContact O-N 3.11Å; K346-V384 HydrophobicContact CB-CG1 4.38Å; K346-V384 HydrophobicContact CB-CG2 4.09Å; K346-V384 HydrophobicContact CG-CG1 3.77Å; K346-V384 HydrophobicContact CG-CG2 4.34Å
347	E	82	Confident	74.6	Confident	149 Å²	149	76.6 Å²	76.6	70%	0.696	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	14.6	178.5	-54.5	-176.1	164.3	0	0	115.3	L343 T344 N345 Q350	L343-E347 PolarHBondContact O-N 3.26Å; T344-E347 PolarHBondContact O-N 2.98Å; N345-E347 VanDerWaalsContact C-N 3.34Å; E347-Q350 WeakPolarHBondContact O-CG 3.43Å; E347-Q350 PolarHBondContact O-NE2 3.13Å
348	I	81.2	Confident	72.7	Confident	21 Å²	21	80.8 Å²	80.8	11%	0.108	43%	0.431	C	S	.	.	S	Bend	trans	-74.1	-42.1	174.5	-58	-55.1	0	0	0	110.3	T13 L343 K346 T382 V384	T13-I348 HydrophobicContact CG2-CG2 3.6Å; L343-I348 HydrophobicContact CB-CB 4.3Å; L343-I348 HydrophobicContact CD2-CB 4.34Å; L343-I348 HydrophobicContact CD2-CG1 4.43Å; L343-I348 HydrophobicContact CD2-CG2 4.33Å; L343-I348 WeakPolarHBondContact O-CB 3.35Å; L343-I348 PolarHBondContact O-N 3.04Å; K346-I348 HydrophobicContact CB-CG1 4.17Å; K346-I348 PolarHBondContact O-N 3.26Å; K346-I348 VanDerWaalsContact O-N 3.11Å; I348-T382 HydrophobicContact CD1-CG2 3.81Å; I348-V384 HydrophobicContact CD1-CG2 4.29Å; I348-V384 HydrophobicContact CG1-CG2 3.57Å
349	I	77.6	Confident	70.5	Confident	27 Å²	27	80.6 Å²	80.6	14%	0.138	44%	0.435	C	S	.	.	S	Bend	trans	-96.9	111.5	171.1	-62.6	179	0	0	0	108.2	I68 L343	I68-I349 HydrophobicContact CD1-CD1 4.32Å; L343-I349 HydrophobicContact CB-CB 4.47Å; L343-I349 HydrophobicContact CB-CD1 3.68Å; L343-I349 HydrophobicContact CB-CG1 3.77Å; L343-I349 HydrophobicContact CD1-CD1 3.91Å; L343-I349 HydrophobicContact CD1-CG1 4.37Å; L343-I349 HydrophobicContact CG-CD1 4.46Å; L343-I349 PolarHBondContact O-N 3.06Å
350	Q	69.1	Low	68.6	Low	102 Å²	102	85.7 Å²	85.7	48%	0.477	46%	0.456	S	S	.	.			trans	-105.4	127.4	174.3	-61.1	-178.6	4	0	0	110.1	E347 K352	E347-Q350 WeakPolarHBondContact O-CG 3.43Å; E347-Q350 PolarHBondContact O-NE2 3.13Å; Q350-K352 PolarHBondContact O-N 2.98Å
351	S	59.2	Low	67.4	Low	121 Å²	121	87.6 Å²	87.6	85%	0.846	46%	0.464	S	S	*	.			trans	-79.2	91.8	170.6	59.3	0	0	0	0	109.9
352	K	52.8	Low	66	Low	99 Å²	99	87 Å²	87	43%	0.43	47%	0.47	S	S	.	.			trans	-82.8	132.5	171.5	-68.7	-166.7	-178.9	-176.1	0	110.5	Q350 D374 F377	Q350-K352 PolarHBondContact O-N 2.98Å; K352-D374 IonicContact NZ-OD2 4Å; K352-D374 PolarHBondContact NZ-OD2 3.46Å; K352-F377 HydrophobicContact CD-CE2 4.19Å; K352-F377 HydrophobicContact CD-CZ 4.27Å
353	P	47.7	Very low	65.3	Low	71 Å²	71	90.1 Å²	90.1	46%	0.461	49%	0.487	S	S	.	.			trans	-65.9	152.7	174.4	-16.4	28.2	0	0	0	112.3	I355 C356	P353-I355 HydrophobicContact CB-CG2 4.25Å; P353-I355 PolarHBondContact O-N 3.27Å; P353-C356 WeakPolarHBondContact O-CB 3.4Å; P353-C356 PolarHBondContact O-N 3.46Å
354	P	43.5	Very low	64.3	Low	114 Å²	114	100.4 Å²	100.4	74%	0.74	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-57.5	-22.7	179.7	-25.2	33.5	0	0	0	115.3	C356 T357	P354-C356 PolarHBondContact O-N 3.37Å; P354-T357 PolarHBondContact O-N 3.23Å; P354-T357 PolarHBondContact O-OG1 2.79Å
355	I	49.9	Very low	64	Low	125 Å²	125	102.9 Å²	102.9	64%	0.641	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-71.9	-16.4	177	-160.1	159.3	0	0	0	112.8	P353 T357 L358	P353-I355 HydrophobicContact CB-CG2 4.25Å; P353-I355 PolarHBondContact O-N 3.27Å; I355-T357 VanDerWaalsContact C-N 3.27Å; I355-T357 PolarHBondContact O-N 2.92Å; I355-L358 HydrophobicContact CG1-CD1 4.29Å
356	C	46	Very low	62.6	Low	51 Å²	51	100.7 Å²	100.7	35%	0.345	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-88.8	13	175.4	-57.4	0	0	0	0	113	P353 P354 Q371	P353-C356 WeakPolarHBondContact O-CB 3.4Å; P353-C356 PolarHBondContact O-N 3.46Å; P354-C356 PolarHBondContact O-N 3.37Å; C356-Q371 PolarHBondContact O-OE1 3.08Å
357	T	51.8	Low	61.8	Low	109 Å²	109	101.3 Å²	101.3	67%	0.669	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-125.1	21.6	179.1	56.2	0	0	0	0	113.3	P354 I355	P354-T357 PolarHBondContact O-N 3.23Å; P354-T357 PolarHBondContact O-OG1 2.79Å; I355-T357 VanDerWaalsContact C-N 3.27Å; I355-T357 PolarHBondContact O-N 2.92Å
358	L	54.5	Low	61	Low	102 Å²	102	97 Å²	97	53%	0.534	54%	0.538	S	S	.	.			trans	-62.3	147.9	-179.9	-71.6	170.3	0	0	0	112.6	I355	I355-L358 HydrophobicContact CG1-CD1 4.29Å
359	P	48.3	Very low	60.1	Low	76 Å²	76	103 Å²	103	49%	0.494	56%	0.564	S	S	.	*			trans	-65.8	150.9	-171.1	25.7	-34.1	0	0	0	113.4	F361	P359-F361 HydrophobicContact CG-CE2 3.99Å; P359-F361 HydrophobicContact CG-CZ 3.88Å
360	K	54.9	Low	59.4	Low	119 Å²	119	103.6 Å²	103.6	52%	0.517	58%	0.577	S	S	.	*			trans	-86.3	108.8	167.5	-170.7	178.4	-178.3	-174.9	0	108.2	S368	K360-S368 WeakPolarHBondContact CE-OG 3.36Å; K360-S368 PolarHBondContact NZ-OG 3.11Å
361	F	64	Low	58.8	Low	112 Å²	112	104 Å²	104	49%	0.491	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.4	139.9	172.2	-63.6	-83.6	0	0	0	109.2	P359 S368 F369	P359-F361 HydrophobicContact CG-CE2 3.99Å; P359-F361 HydrophobicContact CG-CZ 3.88Å; F361-S368 CarbonylContact O-C 3.56Å; F361-S368 WeakPolarHBondContact O-CA 3.49Å; F361-S368 VanDerWaalsContact O-CB 3.3Å; F361-S368 WeakPolarHBondContact O-CB 3.49Å; F361-F369 HydrophobicContact CB-CD1 4.09Å; F361-F369 HydrophobicContact CB-CE1 4.41Å; F361-F369 WeakPolarHBondContact CB-O 3.45Å; F361-F369 HydrophobicContact CD2-CD1 4.12Å; F361-F369 AromaticContact CD2-CE1 3.75Å; F361-F369 HydrophobicContact CD2-CE1 3.75Å; F361-F369 HydrophobicContact CD2-CZ 4.36Å; F361-F369 HydrophobicContact CE2-CE1 4.43Å; F361-F369 HydrophobicContact CG-CD1 4.45Å; F361-F369 HydrophobicContact CG-CE1 4.3Å; F361-F369 PolarHBondContact N-O 3.13Å; F361-F369 PolarHBondContact O-N 3.32Å
362	V	61.3	Low	58.5	Low	104 Å²	104	100.5 Å²	100.5	63%	0.63	56%	0.562	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-120.4	121.9	171.8	-175.8	0	0	0	0	106.7	E367	V362-E367 WeakPolarHBondContact CA-O 3.37Å
363	L	75.9	Confident	58.3	Low	98 Å²	98	107 Å²	107	51%	0.513	58%	0.584	S	S	.	*			trans	-84.5	162.5	177.2	-62.5	175.3	0	0	0	109.9	D365 G366 E367	L363-D365 VanDerWaalsContact CB-OD1 3.28Å; L363-D365 WeakPolarHBondContact CB-OD1 3.11Å; L363-D365 PolarHBondContact O-N 3.28Å; L363-D365 VanDerWaalsContact O-N 3.13Å; L363-G366 PolarHBondContact O-N 3Å; L363-E367 PolarHBondContact N-O 3.47Å
364	E	68.8	Low	58.4	Low	216 Å²	216	107.2 Å²	107.2	100%	1.009	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-18.8	-177.1	-74	-172.7	155	0	0	114	G366	E364-G366 VanDerWaalsContact C-N 3.35Å
365	D	80.3	Confident	58.5	Low	118 Å²	118	112.4 Å²	112.4	63%	0.631	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-0.6	175.6	59.2	7.3	0	0	0	113.9	L363 E367	L363-D365 VanDerWaalsContact CB-OD1 3.28Å; L363-D365 WeakPolarHBondContact CB-OD1 3.11Å; L363-D365 PolarHBondContact O-N 3.28Å; L363-D365 VanDerWaalsContact O-N 3.13Å; D365-E367 PolarHBondContact OD1-N 3.17Å
366	G	58.8	Low	58.4	Low	57 Å²	57	110.2 Å²	110.2	59%	0.588	58%	0.582	S	S	*	*	S	Bend	trans	86.4	-1.1	-179.5	0	0	0	0	0	114.6	L363 E364	L363-G366 PolarHBondContact O-N 3Å; E364-G366 VanDerWaalsContact C-N 3.35Å
367	E	69.9	Low	59	Low	137 Å²	137	110.9 Å²	110.9	64%	0.64	58%	0.579	S	S	*	*			trans	-69.1	143.2	169.6	-76.1	-159.3	156	0	0	110.7	V362 L363 D365	V362-E367 WeakPolarHBondContact CA-O 3.37Å; L363-E367 PolarHBondContact N-O 3.47Å; D365-E367 PolarHBondContact OD1-N 3.17Å
368	S	65.9	Low	59.8	Low	57 Å²	57	108.2 Å²	108.2	40%	0.399	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.9	134.3	179.6	63.6	0	0	0	0	112.6	K360 F361	K360-S368 WeakPolarHBondContact CE-OG 3.36Å; K360-S368 PolarHBondContact NZ-OG 3.11Å; F361-S368 CarbonylContact O-C 3.56Å; F361-S368 WeakPolarHBondContact O-CA 3.49Å; F361-S368 VanDerWaalsContact O-CB 3.3Å; F361-S368 WeakPolarHBondContact O-CB 3.49Å
369	F	61.2	Low	60.8	Low	148 Å²	148	105.7 Å²	105.7	65%	0.649	55%	0.547	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.2	135.1	-179.7	122.5	-92.9	0	0	0	110.7	F361	F361-F369 HydrophobicContact CB-CD1 4.09Å; F361-F369 HydrophobicContact CB-CE1 4.41Å; F361-F369 WeakPolarHBondContact CB-O 3.45Å; F361-F369 HydrophobicContact CD2-CD1 4.12Å; F361-F369 AromaticContact CD2-CE1 3.75Å; F361-F369 HydrophobicContact CD2-CE1 3.75Å; F361-F369 HydrophobicContact CD2-CZ 4.36Å; F361-F369 HydrophobicContact CE2-CE1 4.43Å; F361-F369 HydrophobicContact CG-CD1 4.45Å; F361-F369 HydrophobicContact CG-CE1 4.3Å; F361-F369 PolarHBondContact N-O 3.13Å; F361-F369 PolarHBondContact O-N 3.32Å
370	G	63	Low	62	Low	40 Å²	40	104.2 Å²	104.2	41%	0.412	54%	0.535	S	S	.	.	S	Bend	trans	128.5	167.7	-171.9	0	0	0	0	0	112.2	G372	G370-G372 PolarHBondContact O-N 3.27Å
371	Q	57.8	Low	63	Low	110 Å²	110	102.4 Å²	102.4	51%	0.514	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-77.3	123.2	178.5	-80.3	-178	-17.2	0	0	109.8	C356	C356-Q371 PolarHBondContact O-OE1 3.08Å
372	G	51.4	Low	64.1	Low	48 Å²	48	100.3 Å²	100.3	50%	0.495	53%	0.528	S	S	.	.	P	Polyproline II helix	trans	-62	140.6	169.5	0	0	0	0	0	110	G370 D374	G370-G372 PolarHBondContact O-N 3.27Å; G372-D374 PolarHBondContact O-N 2.96Å
373	R	49.2	Very low	65.5	Low	235 Å²	235	97.3 Å²	97.3	89%	0.887	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-49.7	121.2	163.6	-85.3	-174.1	179.6	178.7	-0	106.9	R375	R373-R375 VanDerWaalsContact C-N 3.32Å; R373-R375 PolarHBondContact O-N 3.05Å
374	D	50.5	Low	66.3	Low	75 Å²	75	93.1 Å²	93.1	40%	0.401	49%	0.488	S	S	.	.			trans	-71.3	94.1	-177.8	-167.1	-6.8	0	0	0	107.9	K352 G372 S376 F377	K352-D374 IonicContact NZ-OD2 4Å; K352-D374 PolarHBondContact NZ-OD2 3.46Å; G372-D374 PolarHBondContact O-N 2.96Å; D374-S376 VanDerWaalsContact CG-OG 3.31Å; D374-S376 PolarHBondContact O-N 3.32Å; D374-S376 VanDerWaalsContact O-N 3.1Å; D374-S376 PolarHBondContact OD1-OG 2.93Å; D374-F377 HydrophobicContact CB-CD2 3.56Å; D374-F377 HydrophobicContact CB-CE2 3.45Å; D374-F377 VanDerWaalsContact CB-CE2 3.45Å; D374-F377 WeakPolarHBondContact O-CD2 3.3Å; D374-F377 PolarHBondContact O-N 3.27Å; D374-F377 WeakPolarHBondContact OD2-CE2 3.37Å; D374-F377 WeakPolarHBondContact OD2-CZ 3.22Å
375	R	44.1	Very low	67.6	Low	223 Å²	223	85.4 Å²	85.4	84%	0.842	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-64.4	-11.3	-175.3	-66.8	-178.6	176.4	-178.3	-3.9	112.4	R373 F377	R373-R375 VanDerWaalsContact C-N 3.32Å; R373-R375 PolarHBondContact O-N 3.05Å; R375-F377 VanDerWaalsContact C-N 3.26Å; R375-F377 PolarHBondContact O-N 2.77Å
376	S	48.8	Very low	68.3	Low	79 Å²	79	79.9 Å²	79.9	55%	0.552	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-73	-11	178.5	66.9	0	0	0	0	114.1	D374	D374-S376 VanDerWaalsContact CG-OG 3.31Å; D374-S376 PolarHBondContact O-N 3.32Å; D374-S376 VanDerWaalsContact O-N 3.1Å; D374-S376 PolarHBondContact OD1-OG 2.93Å
377	F	58.6	Low	69.9	Low	65 Å²	65	79.7 Å²	79.7	29%	0.285	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-91.6	-8.6	-177.3	-68.5	-63.5	0	0	0	116.7	F15 K352 D374 R375	F15-F377 WeakPolarHBondContact CD2-O 3.42Å; F15-F377 VanDerWaalsContact CE2-O 3.29Å; F15-F377 WeakPolarHBondContact CE2-O 3.31Å; K352-F377 HydrophobicContact CD-CE2 4.19Å; K352-F377 HydrophobicContact CD-CZ 4.27Å; D374-F377 HydrophobicContact CB-CD2 3.56Å; D374-F377 HydrophobicContact CB-CE2 3.45Å; D374-F377 VanDerWaalsContact CB-CE2 3.45Å; D374-F377 WeakPolarHBondContact O-CD2 3.3Å; D374-F377 PolarHBondContact O-N 3.27Å; D374-F377 WeakPolarHBondContact OD2-CE2 3.37Å; D374-F377 WeakPolarHBondContact OD2-CZ 3.22Å; R375-F377 VanDerWaalsContact C-N 3.26Å; R375-F377 PolarHBondContact O-N 2.77Å
378	L	67.9	Low	71	Confident	53 Å²	53	74.3 Å²	74.3	28%	0.277	39%	0.391	S	S	.	.	S	Bend	trans	-75.5	-35.8	-170.2	-66.7	173.9	0	0	0	113.2	F14 F15 D151 F152	F14-L378 CarbonylContact C-O 3.45Å; F14-L378 WeakPolarHBondContact CA-O 3.32Å; F14-L378 WeakPolarHBondContact CB-O 3.48Å; F15-L378 HydrophobicContact CB-CD2 4.29Å; F15-L378 PolarHBondContact N-O 3.3Å; D151-L378 HydrophobicContact CB-CD1 3.89Å; D151-L378 WeakPolarHBondContact O-CD1 3.48Å; F152-L378 HydrophobicContact CB-CB 4.22Å; F152-L378 HydrophobicContact CD1-CB 3.87Å; F152-L378 WeakPolarHBondContact CE1-O 3.31Å; F152-L378 HydrophobicContact CG-CB 4.47Å
379	L	76	Confident	72.3	Confident	50 Å²	50	75.1 Å²	75.1	26%	0.262	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	115.1	171.6	173.8	67	0	0	0	108.1	F14 L140 F152	F14-L379 HydrophobicContact CB-CD1 3.81Å; L140-L379 HydrophobicContact CD2-CD1 4.25Å; L140-L379 HydrophobicContact CD2-CD2 4.41Å; F152-L379 HydrophobicContact CB-CB 4.43Å; F152-L379 HydrophobicContact CD1-CB 3.89Å; F152-L379 HydrophobicContact CD2-CB 3.7Å; F152-L379 HydrophobicContact CD2-CD2 3.68Å; F152-L379 HydrophobicContact CD2-CG 4.2Å; F152-L379 HydrophobicContact CE1-CB 3.96Å; F152-L379 HydrophobicContact CE2-CB 3.82Å; F152-L379 HydrophobicContact CE2-CD1 4.02Å; F152-L379 HydrophobicContact CE2-CD2 3.63Å; F152-L379 HydrophobicContact CE2-CG 4.02Å; F152-L379 HydrophobicContact CG-CB 3.74Å; F152-L379 HydrophobicContact CZ-CB 3.93Å; F152-L379 HydrophobicContact CZ-CD1 4.01Å; F152-L379 HydrophobicContact CZ-CD2 4.41Å; F152-L379 HydrophobicContact CZ-CG 4.33Å
380	D	74.2	Confident	73.8	Confident	45 Å²	45	72.5 Å²	72.5	24%	0.241	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	116	167.1	-167.5	-27.2	0	0	0	108.3	T13 T382	T13-D380 PolarHBondContact O-N 3.4Å; D380-T382 PolarHBondContact O-N 3.46Å; D380-T382 WeakPolarHBondContact OD1-CB 3.44Å; D380-T382 PolarHBondContact OD1-N 3.31Å; D380-T382 PolarHBondContact OD1-OG1 2.65Å
381	D	75.9	Confident	75.4	Confident	80 Å²	80	70.6 Å²	70.6	43%	0.428	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	-0.8	-179.1	-158	34.8	0	0	0	112.3	K137 T383	K137-D381 PolarHBondContact NZ-O 2.82Å; K137-D381 IonicContact NZ-OD1 2.76Å; K137-D381 PolarHBondContact NZ-OD1 2.99Å; D381-T383 PolarHBondContact O-N 2.91Å
382	T	86.7	Confident	77	Confident	69 Å²	69	70 Å²	70	42%	0.423	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	129	176.7	-48.3	0	0	0	0	110.8	I348 D380	I348-T382 HydrophobicContact CD1-CG2 3.81Å; D380-T382 PolarHBondContact O-N 3.46Å; D380-T382 WeakPolarHBondContact OD1-CB 3.44Å; D380-T382 PolarHBondContact OD1-N 3.31Å; D380-T382 PolarHBondContact OD1-OG1 2.65Å
383	T	91.3	Very high	79	Confident	40 Å²	40	72.9 Å²	72.9	25%	0.245	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	124.2	169.4	-55.7	0	0	0	0	108.7	A11 K137 D381	A11-T383 WeakPolarHBondContact O-CA 3.3Å; K137-T383 WeakPolarHBondContact CE-OG1 3.19Å; D381-T383 PolarHBondContact O-N 2.91Å
384	V	92.7	Very high	81	Confident	11 Å²	11	67.6 Å²	67.6	7%	0.067	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	123	177.2	171.2	0	0	0	0	109.2	G10 A11 L343 K346 I348 L386	G10-V384 CarbonylContact C-O 3.54Å; G10-V384 WeakPolarHBondContact CA-O 3.41Å; A11-V384 PolarHBondContact N-O 2.82Å; A11-V384 PolarHBondContact O-N 2.81Å; L343-V384 HydrophobicContact CD2-CB 3.74Å; L343-V384 HydrophobicContact CD2-CG1 4.23Å; L343-V384 HydrophobicContact CD2-CG2 3.67Å; K346-V384 HydrophobicContact CB-CG1 4.38Å; K346-V384 HydrophobicContact CB-CG2 4.09Å; K346-V384 HydrophobicContact CG-CG1 3.77Å; K346-V384 HydrophobicContact CG-CG2 4.34Å; I348-V384 HydrophobicContact CD1-CG2 4.29Å; I348-V384 HydrophobicContact CG1-CG2 3.57Å; V384-L386 PolarHBondContact O-N 3.24Å
385	T	94.6	Very high	82.9	Confident	53 Å²	53	64.5 Å²	64.5	33%	0.325	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	124.9	168	-60.2	0	0	0	0	110.6	Q8 L9	Q8-T385 HydrophobicContact CB-CG2 3.78Å; Q8-T385 HydrophobicContact CG-CG2 4.21Å; Q8-T385 PolarHBondContact OE1-OG1 3.31Å; L9-T385 CarbonylContact O-C 3.24Å; L9-T385 WeakPolarHBondContact O-CA 3.44Å
386	L	95.3	Very high	85	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.016	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-78.8	131.7	173.5	-51.5	-179.4	0	0	0	110.3	L9 A11 V70 Y329 W332 L339 E342 V384	L9-L386 HydrophobicContact CB-CB 3.96Å; L9-L386 HydrophobicContact CB-CD1 4.02Å; L9-L386 HydrophobicContact CB-CG 4.19Å; L9-L386 PolarHBondContact O-N 3.02Å; A11-L386 HydrophobicContact CB-CD1 4.4Å; A11-L386 HydrophobicContact CB-CD2 3.86Å; A11-L386 HydrophobicContact CB-CG 4.22Å; V70-L386 HydrophobicContact CG1-CD1 4.28Å; Y329-L386 HydrophobicContact CE2-CD1 4.5Å; W332-L386 HydrophobicContact CH2-CD1 4.01Å; W332-L386 HydrophobicContact CH2-CD2 4.47Å; W332-L386 HydrophobicContact CZ2-CB 4.17Å; W332-L386 HydrophobicContact CZ2-CD1 4.17Å; W332-L386 HydrophobicContact CZ2-CD2 4.42Å; W332-L386 HydrophobicContact CZ2-CG 4.5Å; W332-L386 HydrophobicContact CZ3-CD1 4.19Å; L339-L386 HydrophobicContact CD2-CD1 3.52Å; L339-L386 HydrophobicContact CD2-CD2 4.04Å; L339-L386 HydrophobicContact CD2-CG 4.44Å; E342-L386 HydrophobicContact CB-CD2 4.08Å; E342-L386 HydrophobicContact CG-CD2 4.29Å; V384-L386 PolarHBondContact O-N 3.24Å
387	S	92.8	Very high	86.7	Confident	52 Å²	52	61.8 Å²	61.8	36%	0.364	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-74.7	127.8	180	-179.9	0	0	0	0	112	W332 C389	W332-S387 PolarHBondContact NE1-O 2.81Å; S387-C389 VanDerWaalsContact C-N 3.34Å; S387-C389 WeakPolarHBondContact OG-CB 3.28Å; S387-C389 PolarHBondContact OG-N 3.43Å; S387-C389 PolarHBondContact OG-SG 3.45Å
388	L	93.6	Very high	87.9	Confident	24 Å²	24	59.4 Å²	59.4	13%	0.126	31%	0.306	C	S	.	.			trans	-87	0.4	171.9	-62.4	-177.4	0	0	0	113.2	L9 V328 W332 Q390 L391 R392	L9-L388 HydrophobicContact CD1-CD2 3.76Å; V328-L388 HydrophobicContact CG1-CD1 4.23Å; V328-L388 HydrophobicContact CG1-CD2 3.94Å; W332-L388 HydrophobicContact CG-CD2 4.5Å; L388-Q390 VanDerWaalsContact C-N 3.33Å; L388-Q390 PolarHBondContact O-N 3.3Å; L388-L391 HydrophobicContact CD2-CD2 4.45Å; L388-L391 PolarHBondContact O-N 2.81Å; L388-L391 VanDerWaalsContact O-N 3.17Å; L388-R392 HydrophobicContact CB-CG 4.44Å; L388-R392 WeakPolarHBondContact O-CG 3.2Å; L388-R392 PolarHBondContact O-N 3.48Å
389	C	93.1	Very high	88.6	Confident	75 Å²	75	57.8 Å²	57.8	51%	0.507	30%	0.301	S	S	.	.	H	α-helix	trans	-57.9	-41.9	-173	-65.5	0	0	0	0	113.1	S387 N393	S387-C389 VanDerWaalsContact C-N 3.34Å; S387-C389 WeakPolarHBondContact OG-CB 3.28Å; S387-C389 PolarHBondContact OG-N 3.43Å; S387-C389 PolarHBondContact OG-SG 3.45Å; C389-N393 VanDerWaalsContact O-CB 3.3Å; C389-N393 WeakPolarHBondContact O-CB 3.27Å; C389-N393 PolarHBondContact O-N 3.33Å; C389-N393 PolarHBondContact O-ND2 2.68Å
390	Q	93.1	Very high	88.7	Confident	92 Å²	92	56 Å²	56	43%	0.43	30%	0.295	S	S	.	.	H	α-helix	trans	-65.2	-42.9	179	-69.4	179.5	-4.1	0	0	112.1	L388 N393 R394	L388-Q390 VanDerWaalsContact C-N 3.33Å; L388-Q390 PolarHBondContact O-N 3.3Å; Q390-N393 PolarHBondContact O-N 2.97Å; Q390-R394 PolarHBondContact O-N 2.94Å
391	L	95.1	Very high	88.8	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-48.9	176.8	175.5	59.4	0	0	0	110.8	L320 V328 L331 W332 A335 L388 N393 R394 L395 T438	L320-L391 HydrophobicContact CD1-CD2 4.28Å; L320-L391 HydrophobicContact CD2-CD2 3.84Å; L320-L391 HydrophobicContact CD2-CG 4.15Å; V328-L391 HydrophobicContact CG1-CD2 4.14Å; L331-L391 HydrophobicContact CB-CD1 3.78Å; L331-L391 HydrophobicContact CB-CD2 4.05Å; W332-L391 HydrophobicContact CB-CD2 4.24Å; A335-L391 HydrophobicContact CB-CB 4.02Å; A335-L391 HydrophobicContact CB-CD1 4.03Å; L388-L391 HydrophobicContact CD2-CD2 4.45Å; L388-L391 PolarHBondContact O-N 2.81Å; L388-L391 VanDerWaalsContact O-N 3.17Å; L391-N393 VanDerWaalsContact C-N 3.29Å; L391-N393 PolarHBondContact O-N 2.73Å; L391-R394 PolarHBondContact O-N 3.13Å; L391-R394 VanDerWaalsContact O-N 3.08Å; L391-L395 HydrophobicContact CD1-CD1 3.66Å; L391-L395 HydrophobicContact CD1-CG 4.02Å; L391-L395 HydrophobicContact CG-CD1 4.06Å; L391-L395 WeakPolarHBondContact O-CG 3.49Å; L391-L395 PolarHBondContact O-N 3.35Å; L391-T438 HydrophobicContact CD1-CG2 3.62Å
392	R	93.2	Very high	89	Confident	98 Å²	98	56.8 Å²	56.8	37%	0.37	30%	0.295	S	S	.	.	H	α-helix	trans	-57.2	-42.4	175.7	-69.2	179.5	-179.1	-71.3	-0.1	112	D318 L320 L388 R394 L395 K396	D318-R392 IonicContact OD1-CZ 2.7Å; D318-R392 IonicContact OD1-NH1 2.66Å; D318-R392 PolarHBondContact OD1-NH1 3.41Å; D318-R392 IonicContact OD1-NH2 3.67Å; D318-R392 IonicContact OD2-CZ 3.27Å; D318-R392 VanDerWaalsContact OD2-CZ 3.22Å; D318-R392 IonicContact OD2-NH1 3.61Å; D318-R392 PolarHBondContact OD2-NH1 3.32Å; D318-R392 IonicContact OD2-NH2 3.22Å; D318-R392 PolarHBondContact OD2-NH2 3.22Å; L320-R392 HydrophobicContact CD2-CG 4.22Å; L388-R392 HydrophobicContact CB-CG 4.44Å; L388-R392 WeakPolarHBondContact O-CG 3.2Å; L388-R392 PolarHBondContact O-N 3.48Å; R392-R394 VanDerWaalsContact C-N 3.32Å; R392-R394 PolarHBondContact O-N 3.01Å; R392-L395 CarbonylContact O-C 3.45Å; R392-L395 PolarHBondContact O-N 3.22Å; R392-K396 PolarHBondContact O-N 3.16Å
393	N	92	Very high	88.8	Confident	109 Å²	109	54.1 Å²	54.1	58%	0.583	28%	0.277	S	S	*	.	H	α-helix	trans	-64.9	-34.1	177.2	-74	-19.6	0	0	0	113	C389 Q390 L391 K396	C389-N393 VanDerWaalsContact O-CB 3.3Å; C389-N393 WeakPolarHBondContact O-CB 3.27Å; C389-N393 PolarHBondContact O-N 3.33Å; C389-N393 PolarHBondContact O-ND2 2.68Å; Q390-N393 PolarHBondContact O-N 2.97Å; L391-N393 VanDerWaalsContact C-N 3.29Å; L391-N393 PolarHBondContact O-N 2.73Å; N393-K396 WeakPolarHBondContact O-CD 3.49Å; N393-K396 WeakPolarHBondContact O-CG 3.2Å
394	R	91.8	Very high	88.3	Confident	124 Å²	124	57 Å²	57	47%	0.468	28%	0.284	S	S	.	.	H	α-helix	trans	-72.3	-31	174	-75.4	-160.7	-177.7	-178.4	4.4	112.8	L334 A335 Q390 L391 R392 T438	L334-R394 PolarHBondContact O-NH1 3.21Å; A335-R394 VanDerWaalsContact O-CZ 3.29Å; A335-R394 PolarHBondContact O-NE 3.26Å; A335-R394 PolarHBondContact O-NH2 3.21Å; A335-R394 VanDerWaalsContact O-NH2 3.13Å; Q390-R394 PolarHBondContact O-N 2.94Å; L391-R394 PolarHBondContact O-N 3.13Å; L391-R394 VanDerWaalsContact O-N 3.08Å; R392-R394 VanDerWaalsContact C-N 3.32Å; R392-R394 PolarHBondContact O-N 3.01Å; R394-T438 PolarHBondContact NH1-OG1 3.05Å
395	L	90.9	Very high	87.5	Confident	10 Å²	10	57 Å²	57	5%	0.052	28%	0.284	C	S	.	.	H	α-helix	trans	-95.4	-0.8	-177.1	-60.8	-178.9	0	0	0	113.9	L320 L391 R392 D397 V398 T438 L442	L320-L395 HydrophobicContact CD1-CD1 4.14Å; L391-L395 HydrophobicContact CD1-CD1 3.66Å; L391-L395 HydrophobicContact CD1-CG 4.02Å; L391-L395 HydrophobicContact CG-CD1 4.06Å; L391-L395 WeakPolarHBondContact O-CG 3.49Å; L391-L395 PolarHBondContact O-N 3.35Å; R392-L395 CarbonylContact O-C 3.45Å; R392-L395 PolarHBondContact O-N 3.22Å; L395-D397 PolarHBondContact O-N 3.19Å; L395-D397 VanDerWaalsContact O-N 3.12Å; L395-V398 HydrophobicContact CB-CG2 4.41Å; L395-V398 HydrophobicContact CD2-CG2 4.09Å; L395-V398 WeakPolarHBondContact O-CB 3.4Å; L395-V398 PolarHBondContact O-N 3Å; L395-T438 HydrophobicContact CD2-CG2 4.35Å; L395-L442 HydrophobicContact CD1-CD2 4.05Å; L395-L442 HydrophobicContact CD2-CD2 3.72Å; L395-L442 HydrophobicContact CG-CD2 4.44Å
396	K	87.9	Confident	86.4	Confident	147 Å²	147	61.1 Å²	61.1	64%	0.639	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-28.8	-173.5	73.8	-177.1	-176	172.3	0	114.3	R392 N393	R392-K396 PolarHBondContact O-N 3.16Å; N393-K396 WeakPolarHBondContact O-CD 3.49Å; N393-K396 WeakPolarHBondContact O-CG 3.2Å
397	D	84.1	Confident	85.3	Confident	98 Å²	98	63.3 Å²	63.3	52%	0.524	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	1.1	-176.2	-59.8	-47.3	0	0	0	112	L395	L395-D397 PolarHBondContact O-N 3.19Å; L395-D397 VanDerWaalsContact O-N 3.12Å
398	V	84.3	Confident	83.8	Confident	14 Å²	14	68.8 Å²	68.8	9%	0.085	34%	0.335	C	S	.	.	S	Bend	trans	-78.7	121.6	176.1	-179.3	0	0	0	0	109.1	L395 A402 Y403 E439 L442	L395-V398 HydrophobicContact CB-CG2 4.41Å; L395-V398 HydrophobicContact CD2-CG2 4.09Å; L395-V398 WeakPolarHBondContact O-CB 3.4Å; L395-V398 PolarHBondContact O-N 3Å; V398-A402 HydrophobicContact CG1-CB 3.67Å; V398-Y403 HydrophobicContact CB-CE2 4.38Å; V398-Y403 HydrophobicContact CG1-CD2 4.39Å; V398-Y403 HydrophobicContact CG1-CE2 3.82Å; V398-E439 HydrophobicContact CG2-CG 3.74Å; V398-L442 HydrophobicContact CG1-CD2 4.27Å
399	A	81.4	Confident	81.8	Confident	20 Å²	20	72.5 Å²	72.5	17%	0.165	36%	0.355	C	S	.	.			trans	-69.4	148.5	-179.3	0	0	0	0	0	111.7	E401 A402	A399-E401 VanDerWaalsContact CB-OE2 3.24Å; A399-E401 WeakPolarHBondContact CB-OE2 3.45Å; A399-E401 PolarHBondContact O-N 2.68Å; A399-A402 VanDerWaalsContact O-CB 3.27Å; A399-A402 WeakPolarHBondContact O-CB 3.28Å; A399-A402 PolarHBondContact O-N 3.48Å
400	G	77.9	Confident	79.5	Confident	13 Å²	13	78.4 Å²	78.4	13%	0.134	38%	0.375	C	S	.	.	H	α-helix	trans	-58.1	-31.8	-178.2	0	0	0	0	0	113.2	A402 Y403	G400-A402 PolarHBondContact O-N 3.27Å; G400-Y403 WeakPolarHBondContact O-CB 3.45Å; G400-Y403 PolarHBondContact O-N 3.2Å
401	E	77.7	Confident	77	Confident	138 Å²	138	82.6 Å²	82.6	65%	0.645	40%	0.395	S	S	*	.	H	α-helix	trans	-62.2	-27.1	176.8	-58.3	84.7	170.3	0	0	112.8	A399 Y403 Y404	A399-E401 VanDerWaalsContact CB-OE2 3.24Å; A399-E401 WeakPolarHBondContact CB-OE2 3.45Å; A399-E401 PolarHBondContact O-N 2.68Å; E401-Y403 PolarHBondContact O-N 3.33Å; E401-Y404 CarbonylContact O-C 3.59Å; E401-Y404 VanDerWaalsContact O-C 3.24Å; E401-Y404 PolarHBondContact O-N 2.89Å
402	A	79.2	Confident	74.5	Confident	3 Å²	3	85.7 Å²	85.7	3%	0.025	42%	0.416	C	S	.	.	H	α-helix	trans	-67.8	-25.3	175.5	0	0	0	0	0	112.1	V398 A399 G400 Y404 I443	V398-A402 HydrophobicContact CG1-CB 3.67Å; A399-A402 VanDerWaalsContact O-CB 3.27Å; A399-A402 WeakPolarHBondContact O-CB 3.28Å; A399-A402 PolarHBondContact O-N 3.48Å; G400-A402 PolarHBondContact O-N 3.27Å; A402-Y404 VanDerWaalsContact C-N 3.25Å; A402-I443 HydrophobicContact CB-CG1 4.46Å
403	Y	82.9	Confident	72.2	Confident	12 Å²	12	84.7 Å²	84.7	5%	0.047	42%	0.424	C	S	.	.	H	α-helix	trans	-75.3	-19.8	172.5	-69.6	-97.9	0	0	0	112.4	Y319 R323 V398 G400 E401 L442 I446	Y319-Y403 HydrophobicContact CD2-CD2 4.16Å; Y319-Y403 HydrophobicContact CD2-CE2 4.23Å; Y319-Y403 AromaticContact CG-CD2 3.99Å; Y319-Y403 HydrophobicContact CG-CD2 3.99Å; Y319-Y403 HydrophobicContact CG-CE2 4.3Å; Y319-Y403 HydrophobicContact CG-CG 4.13Å; R323-Y403 HydrophobicContact CG-CE1 4.4Å; V398-Y403 HydrophobicContact CB-CE2 4.38Å; V398-Y403 HydrophobicContact CG1-CD2 4.39Å; V398-Y403 HydrophobicContact CG1-CE2 3.82Å; G400-Y403 WeakPolarHBondContact O-CB 3.45Å; G400-Y403 PolarHBondContact O-N 3.2Å; E401-Y403 PolarHBondContact O-N 3.33Å; Y403-L442 HydrophobicContact CE1-CD1 4.15Å; Y403-L442 HydrophobicContact CE1-CD2 4.05Å; Y403-L442 HydrophobicContact CE2-CD2 4.32Å; Y403-I446 HydrophobicContact CD1-CD1 4.03Å; Y403-I446 HydrophobicContact CG-CD1 4.38Å
404	Y	80.8	Confident	70.1	Confident	102 Å²	102	81.9 Å²	81.9	40%	0.4	41%	0.409	S	S	.	.	S	Bend	trans	-131.3	56.9	-174.9	-54.8	-84.5	0	0	0	116.1	Y319 E401 A402 L406 R450	Y319-Y404 AromaticContact CD1-CE2 3.86Å; Y319-Y404 HydrophobicContact CD1-CE2 3.86Å; Y319-Y404 HydrophobicContact CE1-CE2 4.1Å; E401-Y404 CarbonylContact O-C 3.59Å; E401-Y404 VanDerWaalsContact O-C 3.24Å; E401-Y404 PolarHBondContact O-N 2.89Å; A402-Y404 VanDerWaalsContact C-N 3.25Å; Y404-L406 PolarHBondContact O-N 2.93Å; Y404-R450 VanDerWaalsContact CA-CZ 3.48Å; Y404-R450 PolarHBondContact O-NH1 2.94Å
405	P	75.9	Confident	67.7	Low	10 Å²	10	77.8 Å²	77.8	7%	0.065	40%	0.398	C	S	.	.			trans	-70.6	125.8	-171.4	28.5	-36	0	0	0	115.5	P415 I446 R450	P405-P415 HydrophobicContact CB-CG 3.54Å; P405-I446 VanDerWaalsContact CD-CG2 3.46Å; P405-I446 HydrophobicContact CG-CG2 3.73Å; P405-R450 VanDerWaalsContact N-NH1 3.18Å; P405-R450 PolarHBondContact O-NH1 3.41Å
406	L	71.8	Confident	65.4	Low	140 Å²	140	84 Å²	84	73%	0.733	43%	0.427	S	S	*	.			trans	-70.7	132.3	176.2	-63.1	175.1	0	0	0	111.7	Y404	Y404-L406 PolarHBondContact O-N 2.93Å
407	L	70.9	Confident	63	Low	48 Å²	48	77.1 Å²	77.1	25%	0.251	40%	0.397	S	S	.	.	S	Bend	trans	-93.3	-4.6	-174.1	-67.2	179.2	0	0	0	114.9	L447 R450 L451	L407-L447 HydrophobicContact CD2-CD1 3.96Å; L407-R450 HydrophobicContact CD1-CB 4.15Å; L407-R450 HydrophobicContact CD2-CB 4.49Å; L407-L451 HydrophobicContact CD1-CD2 4.45Å; L407-L451 HydrophobicContact CD2-CD2 3.96Å; L407-L451 HydrophobicContact CD2-CG 4.38Å
408	E	62.7	Low	61	Low	168 Å²	168	79.9 Å²	79.9	79%	0.785	41%	0.412	S	S	*	.			trans	-103.1	-11.1	-166.9	-63.1	-164.1	156.3	0	0	115.6	E410	E408-E410 PolarHBondContact O-N 3.22Å
409	D	50.2	Low	59	Low	101 Å²	101	80.3 Å²	80.3	54%	0.54	42%	0.416	S	S	.	.			trans	-83.1	106.1	175.3	-97.3	-33.3	0	0	0	110.9	Q411 S412	D409-Q411 PolarHBondContact O-N 3.19Å; D409-S412 PolarHBondContact O-N 2.97Å; D409-S412 PolarHBondContact O-OG 2.72Å
410	E	44.8	Very low	57.3	Low	199 Å²	199	81.5 Å²	81.5	93%	0.93	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-13.1	168.9	-71.5	-168	157.7	0	0	112.7	E408	E408-E410 PolarHBondContact O-N 3.22Å
411	Q	42.4	Very low	56	Low	181 Å²	181	87.7 Å²	87.7	85%	0.846	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-9.3	175.2	-66.9	-178.3	1	0	0	114	D409 S413	D409-Q411 PolarHBondContact O-N 3.19Å; Q411-S413 PolarHBondContact O-N 3.29Å; Q411-S413 VanDerWaalsContact O-N 3.1Å
412	S	42	Very low	54.7	Low	64 Å²	64	87.6 Å²	87.6	45%	0.448	45%	0.452	S	S	.	.			trans	-80.7	97.2	178	63	0	0	0	0	110.2	D409	D409-S412 PolarHBondContact O-N 2.97Å; D409-S412 PolarHBondContact O-OG 2.72Å
413	S	44.2	Very low	53.7	Low	77 Å²	77	88 Å²	88	54%	0.538	45%	0.454	S	S	.	.			trans	-48.4	148.9	143.7	51	0	0	0	0	108.8	Q411	Q411-S413 PolarHBondContact O-N 3.29Å; Q411-S413 VanDerWaalsContact O-N 3.1Å
414	L	47.2	Very low	52.7	Low	50 Å²	50	91.5 Å²	91.5	26%	0.262	48%	0.48	S	S	.	.	S	Bend	trans	-29.2	136.4	174.2	-75.8	157.3	0	0	0	112.1	Q416 V427 I443 L447	L414-Q416 PolarHBondContact O-N 2.98Å; L414-Q416 VanDerWaalsContact O-N 3.12Å; L414-V427 HydrophobicContact CD1-CG2 4.49Å; L414-I443 HydrophobicContact CD2-CG2 4.19Å; L414-L447 HydrophobicContact CD2-CD2 3.95Å
415	P	43.2	Very low	52.1	Low	38 Å²	38	89 Å²	89	25%	0.247	48%	0.481	C	S	.	.			trans	-46.8	123.9	-179.4	-19	23.9	0	0	0	110.2	P405 S417	P405-P415 HydrophobicContact CB-CG 3.54Å; P415-S417 PolarHBondContact O-N 3.05Å
416	Q	41	Very low	52.2	Low	141 Å²	141	89.3 Å²	89.3	66%	0.659	48%	0.482	S	S	*	.			trans	-78.6	111.8	-178	-69.3	178	-1.6	0	0	108	L414	L414-Q416 PolarHBondContact O-N 2.98Å; L414-Q416 VanDerWaalsContact O-N 3.12Å
417	S	38.4	Very low	52.5	Low	2 Å²	2	85 Å²	85	1%	0.014	46%	0.462	C	S	.	.			trans	-63.5	162.9	159.5	56.9	0	0	0	0	109.6	P415 S419 S420 E439	P415-S417 PolarHBondContact O-N 3.05Å; S417-S419 WeakPolarHBondContact CB-OG 3.32Å; S417-S419 PolarHBondContact O-N 2.88Å; S417-S419 VanDerWaalsContact O-N 3.07Å; S417-S419 PolarHBondContact OG-N 3.17Å; S417-S419 PolarHBondContact OG-OG 2.72Å; S417-S420 WeakPolarHBondContact O-CA 3.47Å; S417-S420 VanDerWaalsContact O-CB 3.31Å; S417-S420 WeakPolarHBondContact O-CB 3.38Å; S417-S420 PolarHBondContact O-N 3.27Å; S417-E439 WeakPolarHBondContact CB-OE1 3.4Å; S417-E439 PolarHBondContact OG-OE1 3.13Å; S417-E439 VanDerWaalsContact OG-OE1 3.12Å
418	N	41.4	Very low	53	Low	156 Å²	156	88.2 Å²	88.2	83%	0.834	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-12.6	168.9	-76.9	-30.9	0	0	0	112.1
419	S	42.1	Very low	54.2	Low	23 Å²	23	83.6 Å²	83.6	16%	0.161	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	25.9	167.4	57.2	0	0	0	0	113.4	S417 N421 E422 L423 E439	S417-S419 WeakPolarHBondContact CB-OG 3.32Å; S417-S419 PolarHBondContact O-N 2.88Å; S417-S419 VanDerWaalsContact O-N 3.07Å; S417-S419 PolarHBondContact OG-N 3.17Å; S417-S419 PolarHBondContact OG-OG 2.72Å; S419-N421 PolarHBondContact O-N 3.11Å; S419-E422 PolarHBondContact O-N 3.17Å; S419-L423 PolarHBondContact O-N 3.37Å; S419-E439 PolarHBondContact OG-OE1 2.9Å
420	S	46.1	Very low	55.9	Low	45 Å²	45	81 Å²	81	32%	0.315	45%	0.452	S	S	.	.	H	α-helix	trans	-47.4	-30.7	-176.8	55.5	0	0	0	0	115.9	S417 S424	S417-S420 WeakPolarHBondContact O-CA 3.47Å; S417-S420 VanDerWaalsContact O-CB 3.31Å; S417-S420 WeakPolarHBondContact O-CB 3.38Å; S417-S420 PolarHBondContact O-N 3.27Å; S420-S424 WeakPolarHBondContact O-CB 3.44Å; S420-S424 PolarHBondContact O-N 2.89Å
421	N	50.4	Low	58.1	Low	143 Å²	143	71.9 Å²	71.9	77%	0.765	41%	0.41	S	S	*	.	H	α-helix	trans	-68.7	-34.5	174.3	-76.5	-24.5	0	0	0	113.3	S419 A425	S419-N421 PolarHBondContact O-N 3.11Å; N421-A425 WeakPolarHBondContact O-CB 3.34Å; N421-A425 PolarHBondContact O-N 3.02Å
422	E	51.1	Low	60.3	Low	136 Å²	136	68 Å²	68	64%	0.636	39%	0.394	S	S	*	.	H	α-helix	trans	-80	-43	-179.5	-65.1	-171	165.7	0	0	111.6	S419 S424 A425 T426	S419-E422 PolarHBondContact O-N 3.17Å; E422-S424 VanDerWaalsContact C-N 3.34Å; E422-S424 PolarHBondContact O-N 3.44Å; E422-A425 CarbonylContact O-C 3.49Å; E422-A425 WeakPolarHBondContact O-CA 3.2Å; E422-A425 WeakPolarHBondContact O-CB 2.94Å; E422-A425 PolarHBondContact O-N 3.29Å; E422-T426 PolarHBondContact O-N 3.38Å; E422-T426 PolarHBondContact O-OG1 3.26Å; E422-T426 VanDerWaalsContact O-OG1 3.1Å
423	L	59.1	Low	62.6	Low	13 Å²	13	68.7 Å²	68.7	7%	0.068	39%	0.392	C	S	.	.	H	α-helix	trans	-64.2	-39.4	177.6	-158.2	80.1	0	0	0	112	S419 A425 T426 V427 E439 Y440 I443	S419-L423 PolarHBondContact O-N 3.37Å; L423-A425 VanDerWaalsContact C-N 3.27Å; L423-A425 PolarHBondContact O-N 2.81Å; L423-T426 PolarHBondContact O-N 3.01Å; L423-V427 WeakPolarHBondContact O-CG2 3.07Å; L423-V427 PolarHBondContact O-N 3.18Å; L423-E439 HydrophobicContact CD1-CG 4.17Å; L423-Y440 HydrophobicContact CD1-CD2 4.1Å; L423-Y440 HydrophobicContact CG-CD2 4.48Å; L423-I443 HydrophobicContact CD1-CD1 3.81Å; L423-I443 HydrophobicContact CD2-CD1 3.43Å; L423-I443 VanDerWaalsContact CD2-CD1 3.43Å; L423-I443 HydrophobicContact CG-CD1 4.28Å
424	S	61.7	Low	64.9	Low	84 Å²	84	66.5 Å²	66.5	59%	0.587	37%	0.372	S	S	*	.	H	α-helix	trans	-64.1	-31.7	172.2	-177.1	0	0	0	0	112.4	S420 E422	S420-S424 WeakPolarHBondContact O-CB 3.44Å; S420-S424 PolarHBondContact O-N 2.89Å; E422-S424 VanDerWaalsContact C-N 3.34Å; E422-S424 PolarHBondContact O-N 3.44Å
425	A	67.7	Low	67.1	Low	50 Å²	50	66.7 Å²	66.7	41%	0.413	37%	0.371	S	S	.	.	H	α-helix	trans	-73.3	-41.2	174	0	0	0	0	0	111.1	N421 E422 L423 V427 T428	N421-A425 WeakPolarHBondContact O-CB 3.34Å; N421-A425 PolarHBondContact O-N 3.02Å; E422-A425 CarbonylContact O-C 3.49Å; E422-A425 WeakPolarHBondContact O-CA 3.2Å; E422-A425 WeakPolarHBondContact O-CB 2.94Å; E422-A425 PolarHBondContact O-N 3.29Å; L423-A425 VanDerWaalsContact C-N 3.27Å; L423-A425 PolarHBondContact O-N 2.81Å; A425-V427 VanDerWaalsContact C-N 3.32Å; A425-V427 PolarHBondContact O-N 3.46Å; A425-T428 PolarHBondContact O-N 3.38Å; A425-T428 PolarHBondContact O-OG1 3.23Å
426	T	77.6	Confident	69.5	Low	16 Å²	16	73.3 Å²	73.3	10%	0.098	39%	0.392	C	S	.	.	H	α-helix	trans	-60.8	-37.3	-179.9	-62	0	0	0	0	112.7	E422 L423 T428 L429 R434 D437 Y440	E422-T426 PolarHBondContact O-N 3.38Å; E422-T426 PolarHBondContact O-OG1 3.26Å; E422-T426 VanDerWaalsContact O-OG1 3.1Å; L423-T426 PolarHBondContact O-N 3.01Å; T426-T428 PolarHBondContact O-N 3.28Å; T426-T428 VanDerWaalsContact O-N 3.1Å; T426-L429 HydrophobicContact CG2-CD1 4.39Å; T426-L429 VanDerWaalsContact O-CB 3.32Å; T426-L429 WeakPolarHBondContact O-CB 3.43Å; T426-L429 PolarHBondContact O-N 2.83Å; T426-R434 HydrophobicContact CG2-CG 4.18Å; T426-R434 VanDerWaalsContact O-CD 3.32Å; T426-R434 WeakPolarHBondContact O-CD 3.47Å; T426-R434 VanDerWaalsContact O-CG 3.22Å; T426-R434 WeakPolarHBondContact O-CG 3.31Å; T426-D437 HydrophobicContact CG2-CB 4.27Å; T426-Y440 HydrophobicContact CG2-CD2 4.09Å; T426-Y440 HydrophobicContact CG2-CG 4.07Å
427	V	78.6	Confident	72.1	Confident	50 Å²	50	69 Å²	69	30%	0.303	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-29	174.3	172.7	0	0	0	0	112.5	L414 L423 A425 Y440 V468	L414-V427 HydrophobicContact CD1-CG2 4.49Å; L423-V427 WeakPolarHBondContact O-CG2 3.07Å; L423-V427 PolarHBondContact O-N 3.18Å; A425-V427 VanDerWaalsContact C-N 3.32Å; A425-V427 PolarHBondContact O-N 3.46Å; V427-Y440 HydrophobicContact CG2-CE2 3.69Å; V427-V468 HydrophobicContact CG1-CG1 4.34Å
428	T	80.6	Confident	74.7	Confident	116 Å²	116	69.1 Å²	69.1	71%	0.712	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-8	179.6	70.5	0	0	0	0	113.9	A425 T426	A425-T428 PolarHBondContact O-N 3.38Å; A425-T428 PolarHBondContact O-OG1 3.23Å; T426-T428 PolarHBondContact O-N 3.28Å; T426-T428 VanDerWaalsContact O-N 3.1Å
429	L	87.5	Confident	77.2	Confident	70 Å²	70	63.1 Å²	63.1	37%	0.366	34%	0.341	S	S	.	.	S	Bend	trans	-77.4	155.6	179	-61.2	177.5	0	0	0	111.7	T426 I433 R434	T426-L429 HydrophobicContact CG2-CD1 4.39Å; T426-L429 VanDerWaalsContact O-CB 3.32Å; T426-L429 WeakPolarHBondContact O-CB 3.43Å; T426-L429 PolarHBondContact O-N 2.83Å; L429-I433 HydrophobicContact CB-CB 4.34Å; L429-I433 HydrophobicContact CB-CG2 4.29Å; L429-I433 HydrophobicContact CD1-CG2 3.79Å; L429-R434 HydrophobicContact CB-CG 4.45Å; L429-R434 PolarHBondContact O-NE 3.14Å; L429-R434 VanDerWaalsContact O-NE 3.08Å
430	P	87.8	Confident	79.5	Confident	46 Å²	46	62.1 Å²	62.1	30%	0.299	33%	0.333	S	S	.	.			trans	-45.6	141.7	170	-32.2	36.2	0	0	0	113.1	I432 I433 R434 E694	P430-I432 HydrophobicContact CB-CG2 4.29Å; P430-I432 PolarHBondContact O-N 3.23Å; P430-I432 VanDerWaalsContact O-N 3.15Å; P430-I433 HydrophobicContact CB-CD1 4.25Å; P430-I433 HydrophobicContact CG-CD1 4.15Å; P430-I433 WeakPolarHBondContact O-CB 3.1Å; P430-I433 PolarHBondContact O-N 3.21Å; P430-R434 PolarHBondContact O-N 3.46Å; P430-E694 WeakPolarHBondContact CB-OE2 3.4Å
431	L	89.4	Confident	81.8	Confident	8 Å²	8	60 Å²	60	4%	0.042	32%	0.319	C	S	.	.	H	α-helix	trans	-55.3	-39.2	-174.7	-179.5	64.4	0	0	0	112.3	I433 R434 E435 D469 H645	L431-I433 PolarHBondContact O-N 2.93Å; L431-R434 WeakPolarHBondContact O-CB 3.21Å; L431-R434 PolarHBondContact O-N 2.9Å; L431-R434 VanDerWaalsContact O-N 3.09Å; L431-E435 HydrophobicContact CD1-CG 4.15Å; L431-E435 HydrophobicContact CG-CG 4.2Å; L431-E435 PolarHBondContact O-N 3.48Å; L431-D469 HydrophobicContact CD1-CB 3.59Å; L431-H645 HydrophobicContact CD2-CB 4.41Å; L431-H645 WeakPolarHBondContact CD2-CD2 3.21Å; L431-H645 WeakPolarHBondContact CD2-NE2 3.39Å
432	I	89.6	Confident	83.9	Confident	100 Å²	100	53.2 Å²	53.2	51%	0.513	28%	0.282	S	S	.	.	H	α-helix	trans	-60.9	-28.4	179.5	-165	167.2	0	0	0	113.4	P430 R436	P430-I432 HydrophobicContact CB-CG2 4.29Å; P430-I432 PolarHBondContact O-N 3.23Å; P430-I432 VanDerWaalsContact O-N 3.15Å; I432-R436 WeakPolarHBondContact O-CG 3.35Å
433	I	90.7	Very high	85.8	Confident	79 Å²	79	47 Å²	47	41%	0.405	25%	0.253	S	S	.	.	H	α-helix	trans	-78.9	-44.3	175.4	-66	165.7	0	0	0	109.3	L429 P430 L431 E435 R436 D437	L429-I433 HydrophobicContact CB-CB 4.34Å; L429-I433 HydrophobicContact CB-CG2 4.29Å; L429-I433 HydrophobicContact CD1-CG2 3.79Å; P430-I433 HydrophobicContact CB-CD1 4.25Å; P430-I433 HydrophobicContact CG-CD1 4.15Å; P430-I433 WeakPolarHBondContact O-CB 3.1Å; P430-I433 PolarHBondContact O-N 3.21Å; L431-I433 PolarHBondContact O-N 2.93Å; I433-E435 VanDerWaalsContact C-N 3.31Å; I433-E435 PolarHBondContact O-N 3.35Å; I433-R436 PolarHBondContact O-N 3.48Å; I433-D437 PolarHBondContact O-N 3.15Å; I433-D437 VanDerWaalsContact O-N 3.11Å
434	R	92.5	Very high	87.4	Confident	31 Å²	31	46.4 Å²	46.4	12%	0.117	25%	0.25	C	S	.	.	H	α-helix	trans	-58.7	-39.5	176.3	-67.3	-170.8	-77	151.5	-6.1	112.8	T426 L429 P430 L431 R436 D437 Y440 Q441 V468 D469	T426-R434 HydrophobicContact CG2-CG 4.18Å; T426-R434 VanDerWaalsContact O-CD 3.32Å; T426-R434 WeakPolarHBondContact O-CD 3.47Å; T426-R434 VanDerWaalsContact O-CG 3.22Å; T426-R434 WeakPolarHBondContact O-CG 3.31Å; L429-R434 HydrophobicContact CB-CG 4.45Å; L429-R434 PolarHBondContact O-NE 3.14Å; L429-R434 VanDerWaalsContact O-NE 3.08Å; P430-R434 PolarHBondContact O-N 3.46Å; L431-R434 WeakPolarHBondContact O-CB 3.21Å; L431-R434 PolarHBondContact O-N 2.9Å; L431-R434 VanDerWaalsContact O-N 3.09Å; R434-R436 PolarHBondContact O-N 3.48Å; R434-D437 PolarHBondContact O-N 3.47Å; R434-Y440 HydrophobicContact CB-CD1 3.94Å; R434-Y440 HydrophobicContact CB-CE1 3.74Å; R434-Y440 HydrophobicContact CG-CE1 4.26Å; R434-Y440 WeakPolarHBondContact O-CD1 3.22Å; R434-Q441 PolarHBondContact O-NE2 2.51Å; R434-V468 PolarHBondContact NH1-O 3.2Å; R434-D469 IonicContact CZ-OD2 2.64Å; R434-D469 IonicContact NE-OD2 3.99Å; R434-D469 IonicContact NH1-OD2 3.81Å; R434-D469 PolarHBondContact NH1-OD2 2.93Å
435	E	93.6	Very high	89	Confident	53 Å²	53	42.5 Å²	42.5	25%	0.248	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-16.9	176.1	-73	-170.1	150.4	0	0	113.8	L431 I433 P472 R475	L431-E435 HydrophobicContact CD1-CG 4.15Å; L431-E435 HydrophobicContact CG-CG 4.2Å; L431-E435 PolarHBondContact O-N 3.48Å; I433-E435 VanDerWaalsContact C-N 3.31Å; I433-E435 PolarHBondContact O-N 3.35Å; E435-P472 HydrophobicContact CB-CG 4.38Å; E435-P472 HydrophobicContact CG-CG 3.98Å; E435-P472 WeakPolarHBondContact OE1-CG 3.37Å; E435-R475 IonicContact OE1-CZ 2.66Å; E435-R475 IonicContact OE1-NH2 3.03Å; E435-R475 PolarHBondContact OE1-NH2 3.16Å
436	R	93.5	Very high	90.2	Very high	178 Å²	178	40.2 Å²	40.2	67%	0.672	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-10.4	178.3	-69.2	-176.6	179.4	-166.7	0.5	113.8	I432 I433 R434	I432-R436 WeakPolarHBondContact O-CG 3.35Å; I433-R436 PolarHBondContact O-N 3.48Å; R434-R436 PolarHBondContact O-N 3.48Å
437	D	94.1	Very high	90.8	Very high	51 Å²	51	40.4 Å²	40.4	27%	0.273	20%	0.204	S	C	.	.			trans	-80.4	121.8	-179.4	-174.2	-73.8	0	0	0	111.1	T426 I433 R434 E439 Y440 Q441	T426-D437 HydrophobicContact CG2-CB 4.27Å; I433-D437 PolarHBondContact O-N 3.15Å; I433-D437 VanDerWaalsContact O-N 3.11Å; R434-D437 PolarHBondContact O-N 3.47Å; D437-E439 PolarHBondContact OD1-N 2.96Å; D437-Y440 WeakPolarHBondContact OD1-CB 3.42Å; D437-Y440 PolarHBondContact OD1-N 3.4Å; D437-Q441 VanDerWaalsContact O-CB 3.3Å; D437-Q441 WeakPolarHBondContact O-CB 3.41Å; D437-Q441 WeakPolarHBondContact O-CG 3.43Å; D437-Q441 PolarHBondContact O-N 3.31Å
438	T	94.3	Very high	91.6	Very high	4 Å²	4	38 Å²	38	3%	0.025	19%	0.19	C	C	.	.	H	α-helix	trans	-68.8	-44.5	-171.6	-46.2	0	0	0	0	112.9	L331 L334 A335 L391 R394 L395 L442	L331-T438 HydrophobicContact CB-CG2 4.45Å; L331-T438 HydrophobicContact CD2-CG2 4.37Å; L334-T438 HydrophobicContact CB-CG2 4.47Å; L334-T438 PolarHBondContact O-OG1 3.06Å; A335-T438 HydrophobicContact CB-CG2 4.32Å; L391-T438 HydrophobicContact CD1-CG2 3.62Å; R394-T438 PolarHBondContact NH1-OG1 3.05Å; L395-T438 HydrophobicContact CD2-CG2 4.35Å; T438-L442 WeakPolarHBondContact O-CB 3.33Å; T438-L442 PolarHBondContact O-N 3.33Å
439	E	92.5	Very high	92.1	Very high	30 Å²	30	34 Å²	34	14%	0.14	16%	0.163	C	C	.	.	H	α-helix	trans	-69.9	-45.4	-178.3	178.6	178.1	165.5	0	0	110.2	V398 S417 S419 L423 D437 Q441 L442 I443	V398-E439 HydrophobicContact CG2-CG 3.74Å; S417-E439 WeakPolarHBondContact CB-OE1 3.4Å; S417-E439 PolarHBondContact OG-OE1 3.13Å; S417-E439 VanDerWaalsContact OG-OE1 3.12Å; S419-E439 PolarHBondContact OG-OE1 2.9Å; L423-E439 HydrophobicContact CD1-CG 4.17Å; D437-E439 PolarHBondContact OD1-N 2.96Å; E439-Q441 PolarHBondContact O-N 3.19Å; E439-L442 WeakPolarHBondContact O-CB 3.22Å; E439-L442 PolarHBondContact O-N 3.42Å; E439-I443 HydrophobicContact CG-CD1 4.1Å; E439-I443 WeakPolarHBondContact O-CG1 3.49Å; E439-I443 PolarHBondContact O-N 3.2Å; E439-I443 VanDerWaalsContact O-N 3.1Å
440	Y	92.1	Very high	92.2	Very high	1 Å²	1	33.9 Å²	33.9	0%	0.004	16%	0.158	C	C	.	.	H	α-helix	trans	-59.5	-47.1	176.7	-175.2	-97.2	0	0	0	111.6	L423 T426 V427 R434 D437 L442 I443 R444 D469	L423-Y440 HydrophobicContact CD1-CD2 4.1Å; L423-Y440 HydrophobicContact CG-CD2 4.48Å; T426-Y440 HydrophobicContact CG2-CD2 4.09Å; T426-Y440 HydrophobicContact CG2-CG 4.07Å; V427-Y440 HydrophobicContact CG2-CE2 3.69Å; R434-Y440 HydrophobicContact CB-CD1 3.94Å; R434-Y440 HydrophobicContact CB-CE1 3.74Å; R434-Y440 HydrophobicContact CG-CE1 4.26Å; R434-Y440 WeakPolarHBondContact O-CD1 3.22Å; D437-Y440 WeakPolarHBondContact OD1-CB 3.42Å; D437-Y440 PolarHBondContact OD1-N 3.4Å; Y440-L442 PolarHBondContact O-N 3.29Å; Y440-I443 PolarHBondContact O-N 2.87Å; Y440-R444 HydrophobicContact CD1-CG 4.02Å; Y440-R444 HydrophobicContact CE1-CG 3.62Å; Y440-R444 HydrophobicContact CE2-CG 4.13Å; Y440-R444 HydrophobicContact CG-CG 4.45Å; Y440-R444 VanDerWaalsContact O-CG 3.25Å; Y440-R444 WeakPolarHBondContact O-CG 3.12Å; Y440-R444 PolarHBondContact O-N 2.84Å; Y440-D469 VanDerWaalsContact CE1-OD2 3.24Å; Y440-D469 WeakPolarHBondContact CE1-OD2 3.37Å; Y440-D469 VanDerWaalsContact CZ-OD2 3.3Å; Y440-D469 PolarHBondContact OH-OD1 2.78Å; Y440-D469 PolarHBondContact OH-OD2 3Å
441	Q	94.4	Very high	92.4	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-63.5	-41.2	177.7	-73.5	-55.2	-55.4	0	0	112.4	L331 L334 R434 D437 E439 I443 R444 I445 P472	L331-Q441 HydrophobicContact CD2-CB 4.32Å; L334-Q441 HydrophobicContact CD1-CB 3.68Å; L334-Q441 HydrophobicContact CD1-CG 3.62Å; R434-Q441 PolarHBondContact O-NE2 2.51Å; D437-Q441 VanDerWaalsContact O-CB 3.3Å; D437-Q441 WeakPolarHBondContact O-CB 3.41Å; D437-Q441 WeakPolarHBondContact O-CG 3.43Å; D437-Q441 PolarHBondContact O-N 3.31Å; E439-Q441 PolarHBondContact O-N 3.19Å; Q441-I443 PolarHBondContact O-N 3.4Å; Q441-R444 PolarHBondContact O-N 3.13Å; Q441-I445 HydrophobicContact CB-CD1 4.35Å; Q441-I445 VanDerWaalsContact O-CB 3.31Å; Q441-I445 WeakPolarHBondContact O-CB 3.5Å; Q441-I445 WeakPolarHBondContact O-CD1 3.26Å; Q441-I445 WeakPolarHBondContact O-CG1 3.29Å; Q441-I445 PolarHBondContact O-N 3.19Å; Q441-P472 VanDerWaalsContact OE1-CD 3.32Å
442	L	93.8	Very high	92.5	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-53.8	-53.6	174.6	174.1	71.6	0	0	0	110.8	L331 L395 V398 Y403 T438 E439 Y440 R444 I445 I446	L331-L442 HydrophobicContact CD1-CB 4.3Å; L331-L442 HydrophobicContact CD1-CD1 3.58Å; L331-L442 HydrophobicContact CD2-CB 4.1Å; L395-L442 HydrophobicContact CD1-CD2 4.05Å; L395-L442 HydrophobicContact CD2-CD2 3.72Å; L395-L442 HydrophobicContact CG-CD2 4.44Å; V398-L442 HydrophobicContact CG1-CD2 4.27Å; Y403-L442 HydrophobicContact CE1-CD1 4.15Å; Y403-L442 HydrophobicContact CE1-CD2 4.05Å; Y403-L442 HydrophobicContact CE2-CD2 4.32Å; T438-L442 WeakPolarHBondContact O-CB 3.33Å; T438-L442 PolarHBondContact O-N 3.33Å; E439-L442 WeakPolarHBondContact O-CB 3.22Å; E439-L442 PolarHBondContact O-N 3.42Å; Y440-L442 PolarHBondContact O-N 3.29Å; L442-R444 VanDerWaalsContact C-N 3.35Å; L442-R444 PolarHBondContact O-N 3.17Å; L442-I445 PolarHBondContact O-N 3.46Å; L442-I446 HydrophobicContact CD1-CD1 3.8Å; L442-I446 HydrophobicContact CD1-CG1 4.37Å; L442-I446 HydrophobicContact CG-CD1 3.99Å; L442-I446 VanDerWaalsContact O-CG1 3.26Å; L442-I446 WeakPolarHBondContact O-CG1 3.15Å; L442-I446 PolarHBondContact O-N 3.04Å
443	I	90.7	Very high	92.4	Very high	5 Å²	5	32.6 Å²	32.6	3%	0.026	14%	0.144	C	C	.	.	H	α-helix	trans	-61.7	-44.3	-176.9	-66.9	169.6	0	0	0	110.9	A402 L414 L423 E439 Y440 Q441 I446 L447	A402-I443 HydrophobicContact CB-CG1 4.46Å; L414-I443 HydrophobicContact CD2-CG2 4.19Å; L423-I443 HydrophobicContact CD1-CD1 3.81Å; L423-I443 HydrophobicContact CD2-CD1 3.43Å; L423-I443 VanDerWaalsContact CD2-CD1 3.43Å; L423-I443 HydrophobicContact CG-CD1 4.28Å; E439-I443 HydrophobicContact CG-CD1 4.1Å; E439-I443 WeakPolarHBondContact O-CG1 3.49Å; E439-I443 PolarHBondContact O-N 3.2Å; E439-I443 VanDerWaalsContact O-N 3.1Å; Y440-I443 PolarHBondContact O-N 2.87Å; Q441-I443 PolarHBondContact O-N 3.4Å; I443-I446 PolarHBondContact O-N 2.72Å; I443-L447 WeakPolarHBondContact O-CB 3.44Å; I443-L447 PolarHBondContact O-N 3.08Å
444	R	93	Very high	92.2	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-68.9	-39.3	-179.7	-60.9	-68.9	-68.8	161.4	-6.4	112.2	Y440 Q441 L442 L447 F448 E465 D469 P471	Y440-R444 HydrophobicContact CD1-CG 4.02Å; Y440-R444 HydrophobicContact CE1-CG 3.62Å; Y440-R444 HydrophobicContact CE2-CG 4.13Å; Y440-R444 HydrophobicContact CG-CG 4.45Å; Y440-R444 VanDerWaalsContact O-CG 3.25Å; Y440-R444 WeakPolarHBondContact O-CG 3.12Å; Y440-R444 PolarHBondContact O-N 2.84Å; Q441-R444 PolarHBondContact O-N 3.13Å; L442-R444 VanDerWaalsContact C-N 3.35Å; L442-R444 PolarHBondContact O-N 3.17Å; R444-L447 PolarHBondContact O-N 3.27Å; R444-F448 WeakPolarHBondContact O-CD2 3.41Å; R444-F448 PolarHBondContact O-N 3.23Å; R444-E465 IonicContact CZ-OE2 3.5Å; R444-E465 IonicContact NH1-OE2 2.86Å; R444-E465 PolarHBondContact NH1-OE2 2.98Å; R444-E465 PolarHBondContact NH2-O 3.35Å; R444-D469 IonicContact CZ-OD1 3.63Å; R444-D469 VanDerWaalsContact CZ-OD1 3.27Å; R444-D469 IonicContact NE-OD1 2.88Å; R444-D469 PolarHBondContact NE-OD1 3.4Å; R444-D469 PolarHBondContact NH2-O 3.2Å; R444-D469 IonicContact NH2-OD1 3.15Å; R444-D469 PolarHBondContact NH2-OD1 2.92Å; R444-P471 HydrophobicContact CB-CB 4.43Å; R444-P471 HydrophobicContact CB-CG 3.45Å; R444-P471 VanDerWaalsContact CB-CG 3.45Å
445	I	94.9	Very high	92.1	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.015	13%	0.132	C	C	.	.	H	α-helix	trans	-61.2	-46.7	176.2	-71.4	163.6	0	0	0	110.3	E327 L331 Q441 L442 L447 F448 D449 P471 L473	E327-I445 HydrophobicContact CG-CG2 4.05Å; L331-I445 HydrophobicContact CD2-CD1 4.4Å; Q441-I445 HydrophobicContact CB-CD1 4.35Å; Q441-I445 VanDerWaalsContact O-CB 3.31Å; Q441-I445 WeakPolarHBondContact O-CB 3.5Å; Q441-I445 WeakPolarHBondContact O-CD1 3.26Å; Q441-I445 WeakPolarHBondContact O-CG1 3.29Å; Q441-I445 PolarHBondContact O-N 3.19Å; L442-I445 PolarHBondContact O-N 3.46Å; I445-L447 VanDerWaalsContact C-N 3.35Å; I445-L447 PolarHBondContact O-N 3.14Å; I445-F448 PolarHBondContact O-N 3.26Å; I445-D449 WeakPolarHBondContact O-CB 3.48Å; I445-D449 PolarHBondContact O-N 3.09Å; I445-P471 HydrophobicContact CG1-CB 3.88Å; I445-L473 HydrophobicContact CD1-CB 4.15Å; I445-L473 HydrophobicContact CD1-CD2 3.91Å; I445-L473 HydrophobicContact CG1-CB 4.38Å; I445-L473 HydrophobicContact CG1-CD2 4.45Å; I445-L473 HydrophobicContact CG2-CD2 4.22Å
446	I	92.4	Very high	91.8	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-60.6	-45.4	178.7	-68.2	178.8	0	0	0	111.3	Y403 P405 L442 I443 D449 R450	Y403-I446 HydrophobicContact CD1-CD1 4.03Å; Y403-I446 HydrophobicContact CG-CD1 4.38Å; P405-I446 VanDerWaalsContact CD-CG2 3.46Å; P405-I446 HydrophobicContact CG-CG2 3.73Å; L442-I446 HydrophobicContact CD1-CD1 3.8Å; L442-I446 HydrophobicContact CD1-CG1 4.37Å; L442-I446 HydrophobicContact CG-CD1 3.99Å; L442-I446 VanDerWaalsContact O-CG1 3.26Å; L442-I446 WeakPolarHBondContact O-CG1 3.15Å; L442-I446 PolarHBondContact O-N 3.04Å; I443-I446 PolarHBondContact O-N 2.72Å; I446-D449 PolarHBondContact O-N 3.43Å; I446-R450 WeakPolarHBondContact O-CG 3.23Å; I446-R450 PolarHBondContact O-N 3.01Å; I446-R450 VanDerWaalsContact O-N 3.09Å
447	L	91.6	Very high	91.5	Very high	21 Å²	21	30.5 Å²	30.5	11%	0.11	14%	0.144	C	C	.	.	H	α-helix	trans	-59.9	-50.1	177.8	176.1	61	0	0	0	111.5	L407 L414 I443 R444 I445 R450 L451 E465	L407-L447 HydrophobicContact CD2-CD1 3.96Å; L414-L447 HydrophobicContact CD2-CD2 3.95Å; I443-L447 WeakPolarHBondContact O-CB 3.44Å; I443-L447 PolarHBondContact O-N 3.08Å; R444-L447 PolarHBondContact O-N 3.27Å; I445-L447 VanDerWaalsContact C-N 3.35Å; I445-L447 PolarHBondContact O-N 3.14Å; L447-R450 PolarHBondContact O-N 3.28Å; L447-L451 HydrophobicContact CD1-CD1 4.06Å; L447-L451 HydrophobicContact CD1-CG 4.25Å; L447-L451 HydrophobicContact CG-CD1 4Å; L447-L451 VanDerWaalsContact O-CG 3.3Å; L447-L451 WeakPolarHBondContact O-CG 3.19Å; L447-L451 PolarHBondContact O-N 2.84Å; L447-E465 HydrophobicContact CD2-CG 3.98Å
448	F	93.8	Very high	91.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-67	-38.4	180	-88.9	-102.8	0	0	0	112.6	R444 I445 R450 L451 L452 M462 E465 A466 D469 I470 P471 V474 A478	R444-F448 WeakPolarHBondContact O-CD2 3.41Å; R444-F448 PolarHBondContact O-N 3.23Å; I445-F448 PolarHBondContact O-N 3.26Å; F448-R450 VanDerWaalsContact C-N 3.3Å; F448-R450 PolarHBondContact O-N 2.76Å; F448-L451 PolarHBondContact O-N 3.44Å; F448-L452 VanDerWaalsContact O-CB 3.28Å; F448-L452 WeakPolarHBondContact O-CB 3.38Å; F448-L452 WeakPolarHBondContact O-CD1 3.43Å; F448-L452 WeakPolarHBondContact O-CG 3.4Å; F448-L452 PolarHBondContact O-N 3.13Å; F448-M462 HydrophobicContact CE1-CG 4.29Å; F448-E465 HydrophobicContact CE2-CB 4.21Å; F448-E465 HydrophobicContact CZ-CB 4.27Å; F448-A466 HydrophobicContact CZ-CB 4.42Å; F448-D469 WeakPolarHBondContact CZ-O 3.38Å; F448-I470 HydrophobicContact CE1-CG1 4.41Å; F448-I470 HydrophobicContact CE1-CG2 4.28Å; F448-I470 HydrophobicContact CZ-CG1 4.33Å; F448-P471 HydrophobicContact CD2-CG 3.92Å; F448-P471 HydrophobicContact CE2-CG 4.28Å; F448-P471 HydrophobicContact CG-CG 4.39Å; F448-V474 HydrophobicContact CB-CG2 3.73Å; F448-V474 HydrophobicContact CD1-CG2 4.43Å; F448-V474 HydrophobicContact CG-CG2 4.19Å; F448-A478 HydrophobicContact CD1-CB 3.96Å; F448-A478 HydrophobicContact CE1-CB 3.92Å
449	D	92.1	Very high	90.9	Very high	30 Å²	30	34.3 Å²	34.3	16%	0.16	16%	0.158	C	C	.	.	H	α-helix	trans	-57.2	-44	174	173.5	68.9	0	0	0	111.1	I445 I446 L452 K453	I445-D449 WeakPolarHBondContact O-CB 3.48Å; I445-D449 PolarHBondContact O-N 3.09Å; I446-D449 PolarHBondContact O-N 3.43Å; D449-L452 PolarHBondContact O-N 3.09Å; D449-K453 WeakPolarHBondContact O-CB 3.41Å; D449-K453 VanDerWaalsContact O-CG 3.31Å; D449-K453 WeakPolarHBondContact O-CG 3.45Å; D449-K453 PolarHBondContact O-N 2.89Å; D449-K453 WeakPolarHBondContact OD1-CE 3.36Å; D449-K453 IonicContact OD1-NZ 2.69Å; D449-K453 WeakPolarHBondContact OD2-CE 3.27Å; D449-K453 IonicContact OD2-NZ 3.45Å; D449-K453 PolarHBondContact OD2-NZ 3.5Å
450	R	89.6	Confident	90.6	Very high	68 Å²	68	38.7 Å²	38.7	26%	0.257	18%	0.183	S	C	.	.	H	α-helix	trans	-66.4	-43.9	175.7	-72.3	-174.2	175.3	-142.4	-15.3	113	Y404 P405 L407 I446 L447 F448 L452 K453 G454	Y404-R450 VanDerWaalsContact CA-CZ 3.48Å; Y404-R450 PolarHBondContact O-NH1 2.94Å; P405-R450 VanDerWaalsContact N-NH1 3.18Å; P405-R450 PolarHBondContact O-NH1 3.41Å; L407-R450 HydrophobicContact CD1-CB 4.15Å; L407-R450 HydrophobicContact CD2-CB 4.49Å; I446-R450 WeakPolarHBondContact O-CG 3.23Å; I446-R450 PolarHBondContact O-N 3.01Å; I446-R450 VanDerWaalsContact O-N 3.09Å; L447-R450 PolarHBondContact O-N 3.28Å; F448-R450 VanDerWaalsContact C-N 3.3Å; F448-R450 PolarHBondContact O-N 2.76Å; R450-L452 VanDerWaalsContact C-N 3.31Å; R450-L452 PolarHBondContact O-N 2.96Å; R450-K453 PolarHBondContact O-N 3.18Å; R450-G454 PolarHBondContact O-N 2.76Å
451	L	91	Very high	90.3	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-62.4	-40.1	177.1	-69.8	172.2	0	0	0	111.7	L407 L447 F448 G454 Y455 K458 L461 M462 E465	L407-L451 HydrophobicContact CD1-CD2 4.45Å; L407-L451 HydrophobicContact CD2-CD2 3.96Å; L407-L451 HydrophobicContact CD2-CG 4.38Å; L447-L451 HydrophobicContact CD1-CD1 4.06Å; L447-L451 HydrophobicContact CD1-CG 4.25Å; L447-L451 HydrophobicContact CG-CD1 4Å; L447-L451 VanDerWaalsContact O-CG 3.3Å; L447-L451 WeakPolarHBondContact O-CG 3.19Å; L447-L451 PolarHBondContact O-N 2.84Å; F448-L451 PolarHBondContact O-N 3.44Å; L451-G454 CarbonylContact O-C 3.52Å; L451-G454 PolarHBondContact O-N 3.35Å; L451-Y455 PolarHBondContact O-N 3.39Å; L451-Y455 VanDerWaalsContact O-N 3.09Å; L451-K458 HydrophobicContact CD2-CB 4.13Å; L451-L461 HydrophobicContact CD2-CB 3.82Å; L451-L461 HydrophobicContact CD2-CD1 4.42Å; L451-M462 HydrophobicContact CB-CE 4.17Å; L451-E465 HydrophobicContact CD1-CB 4.23Å; L451-E465 HydrophobicContact CD1-CG 3.97Å
452	L	91.6	Very high	90.1	Very high	5 Å²	5	41.6 Å²	41.6	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-64.9	-46.5	175.2	-73.9	164.9	0	0	0	110.8	L292 F448 D449 R450 G454 Y455 M462 V474 L477 A481	L292-L452 HydrophobicContact CD1-CB 4.49Å; L292-L452 WeakPolarHBondContact CD1-O 3.41Å; L292-L452 HydrophobicContact CD2-CB 4.29Å; L292-L452 HydrophobicContact CD2-CD2 3.93Å; F448-L452 VanDerWaalsContact O-CB 3.28Å; F448-L452 WeakPolarHBondContact O-CB 3.38Å; F448-L452 WeakPolarHBondContact O-CD1 3.43Å; F448-L452 WeakPolarHBondContact O-CG 3.4Å; F448-L452 PolarHBondContact O-N 3.13Å; D449-L452 PolarHBondContact O-N 3.09Å; R450-L452 VanDerWaalsContact C-N 3.31Å; R450-L452 PolarHBondContact O-N 2.96Å; L452-G454 PolarHBondContact O-N 3.14Å; L452-Y455 WeakPolarHBondContact O-CB 3.34Å; L452-Y455 PolarHBondContact O-N 3.42Å; L452-M462 HydrophobicContact CD2-CE 3.58Å; L452-M462 HydrophobicContact CD2-SD 4.31Å; L452-M462 HydrophobicContact CG-CE 3.9Å; L452-V474 HydrophobicContact CD1-CB 4.32Å; L452-L477 HydrophobicContact CD1-CB 3.77Å; L452-L477 HydrophobicContact CD1-CD1 4.18Å; L452-L477 HydrophobicContact CD2-CB 3.9Å; L452-A481 HydrophobicContact CD2-CB 4.21Å
453	K	88.4	Confident	89.9	Confident	121 Å²	121	44.6 Å²	44.6	53%	0.526	21%	0.209	S	C	.	.	H	α-helix	trans	-57.6	-31.6	174.4	-75.5	168.3	177.6	166.9	0	112.9	R298 D449 R450	R298-K453 PolarHBondContact NH2-O 3.36Å; D449-K453 WeakPolarHBondContact O-CB 3.41Å; D449-K453 VanDerWaalsContact O-CG 3.31Å; D449-K453 WeakPolarHBondContact O-CG 3.45Å; D449-K453 PolarHBondContact O-N 2.89Å; D449-K453 WeakPolarHBondContact OD1-CE 3.36Å; D449-K453 IonicContact OD1-NZ 2.69Å; D449-K453 WeakPolarHBondContact OD2-CE 3.27Å; D449-K453 IonicContact OD2-NZ 3.45Å; D449-K453 PolarHBondContact OD2-NZ 3.5Å; R450-K453 PolarHBondContact O-N 3.18Å
454	G	87.3	Confident	89.8	Confident	24 Å²	24	50 Å²	50	25%	0.247	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-1.6	174.4	0	0	0	0	0	116	R450 L451 L452 Y457 K458	R450-G454 PolarHBondContact O-N 2.76Å; L451-G454 CarbonylContact O-C 3.52Å; L451-G454 PolarHBondContact O-N 3.35Å; L452-G454 PolarHBondContact O-N 3.14Å; G454-Y457 PolarHBondContact O-N 3.33Å; G454-Y457 VanDerWaalsContact O-N 3.13Å; G454-K458 PolarHBondContact O-N 3.47Å
455	Y	88.5	Confident	89.7	Confident	6 Å²	6	51.7 Å²	51.7	2%	0.024	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	139.4	177.4	-179.7	-90.1	0	0	0	111.2	F293 R298 L451 L452 K459 M462 A481 G484 I485 E486	F293-Y455 HydrophobicContact CD1-CE1 4.25Å; F293-Y455 HydrophobicContact CE1-CD1 4.19Å; F293-Y455 AromaticContact CE1-CE1 3.82Å; F293-Y455 HydrophobicContact CE1-CE1 3.82Å; R298-Y455 PolarHBondContact NH2-O 2.88Å; L451-Y455 PolarHBondContact O-N 3.39Å; L451-Y455 VanDerWaalsContact O-N 3.09Å; L452-Y455 WeakPolarHBondContact O-CB 3.34Å; L452-Y455 PolarHBondContact O-N 3.42Å; Y455-K459 HydrophobicContact CD2-CB 4.4Å; Y455-K459 HydrophobicContact CE2-CB 4.29Å; Y455-K459 HydrophobicContact CE2-CD 4.5Å; Y455-K459 HydrophobicContact CE2-CG 4.34Å; Y455-M462 HydrophobicContact CD2-CE 4.32Å; Y455-A481 HydrophobicContact CD2-CB 3.58Å; Y455-A481 HydrophobicContact CE2-CB 3.55Å; Y455-A481 HydrophobicContact CG-CB 4.27Å; Y455-G484 VanDerWaalsContact OH-C 3.22Å; Y455-G484 WeakPolarHBondContact OH-CA 3.4Å; Y455-I485 WeakPolarHBondContact CE1-O 3.46Å; Y455-I485 PolarHBondContact OH-N 3.46Å; Y455-I485 PolarHBondContact OH-O 3.37Å; Y455-E486 HydrophobicContact CE1-CG 4.02Å; Y455-E486 WeakPolarHBondContact OH-CG 3.47Å
456	P	88.9	Confident	89.6	Confident	50 Å²	50	51.8 Å²	51.8	33%	0.325	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	cis	-86.5	-12.4	10.9	33.2	-35.3	0	0	0	116	K458 K459 E486	P456-K458 PolarHBondContact O-N 2.99Å; P456-K458 VanDerWaalsContact O-N 3.13Å; P456-K459 VanDerWaalsContact O-CB 3.27Å; P456-K459 WeakPolarHBondContact O-CB 3.44Å; P456-K459 PolarHBondContact O-N 3.25Å; P456-E486 WeakPolarHBondContact CB-OE1 3.45Å
457	Y	87.2	Confident	89.4	Confident	217 Å²	217	58.7 Å²	58.7	85%	0.851	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-29.9	-173.9	-60.1	-76.7	0	0	0	114.5	G454	G454-Y457 PolarHBondContact O-N 3.33Å; G454-Y457 VanDerWaalsContact O-N 3.13Å
458	K	86.6	Confident	89.4	Confident	54 Å²	54	60.3 Å²	60.3	24%	0.235	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	14.2	179.3	-60.5	-64.3	-169.4	172.4	0	114.2	L451 G454 P456 N460 L461 M462	L451-K458 HydrophobicContact CD2-CB 4.13Å; G454-K458 PolarHBondContact O-N 3.47Å; P456-K458 PolarHBondContact O-N 2.99Å; P456-K458 VanDerWaalsContact O-N 3.13Å; K458-N460 VanDerWaalsContact C-N 3.3Å; K458-N460 PolarHBondContact O-N 3.28Å; K458-L461 HydrophobicContact CD-CD1 4.01Å; K458-L461 PolarHBondContact O-N 3.39Å; K458-L461 VanDerWaalsContact O-N 3.14Å; K458-M462 PolarHBondContact O-N 3.25Å
459	K	87.9	Confident	89.3	Confident	81 Å²	81	60.7 Å²	60.7	35%	0.352	28%	0.28	S	S	.	.	H	α-helix	trans	-52.9	-41.6	-178.8	-177.1	-177.2	180	-174.8	0	113.8	Y455 P456 M462 W463	Y455-K459 HydrophobicContact CD2-CB 4.4Å; Y455-K459 HydrophobicContact CE2-CB 4.29Å; Y455-K459 HydrophobicContact CE2-CD 4.5Å; Y455-K459 HydrophobicContact CE2-CG 4.34Å; P456-K459 VanDerWaalsContact O-CB 3.27Å; P456-K459 WeakPolarHBondContact O-CB 3.44Å; P456-K459 PolarHBondContact O-N 3.25Å; K459-M462 WeakPolarHBondContact O-CB 3.38Å; K459-M462 PolarHBondContact O-N 3.18Å; K459-W463 PolarHBondContact O-N 3.12Å
460	N	86.1	Confident	89.5	Confident	122 Å²	122	59.2 Å²	59.2	65%	0.652	27%	0.272	S	S	*	.	H	α-helix	trans	-66.5	-39.2	-179.6	-69.1	-19.7	0	0	0	112.8	K458 W463 K464	K458-N460 VanDerWaalsContact C-N 3.3Å; K458-N460 PolarHBondContact O-N 3.28Å; N460-W463 PolarHBondContact O-N 3.05Å; N460-K464 PolarHBondContact O-N 3.35Å
461	L	87.3	Confident	89.8	Confident	61 Å²	61	56 Å²	56	32%	0.319	26%	0.26	S	S	.	.	H	α-helix	trans	-67.6	-40	174.1	-69.2	-177.1	0	0	0	110.8	L451 K458 W463 K464 E465	L451-L461 HydrophobicContact CD2-CB 3.82Å; L451-L461 HydrophobicContact CD2-CD1 4.42Å; K458-L461 HydrophobicContact CD-CD1 4.01Å; K458-L461 PolarHBondContact O-N 3.39Å; K458-L461 VanDerWaalsContact O-N 3.14Å; L461-W463 VanDerWaalsContact C-N 3.33Å; L461-W463 PolarHBondContact O-N 3.26Å; L461-K464 WeakPolarHBondContact O-CB 3.38Å; L461-K464 PolarHBondContact O-N 3.19Å; L461-K464 VanDerWaalsContact O-N 3.14Å; L461-E465 WeakPolarHBondContact O-CG 3.37Å; L461-E465 PolarHBondContact O-N 3.43Å
462	M	89	Confident	90.1	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-59.5	-42.8	174.3	-169.9	-176	-63.3	0	0	112.4	F448 L451 L452 Y455 K458 K459 K464 E465 A466 A481	F448-M462 HydrophobicContact CE1-CG 4.29Å; L451-M462 HydrophobicContact CB-CE 4.17Å; L452-M462 HydrophobicContact CD2-CE 3.58Å; L452-M462 HydrophobicContact CD2-SD 4.31Å; L452-M462 HydrophobicContact CG-CE 3.9Å; Y455-M462 HydrophobicContact CD2-CE 4.32Å; K458-M462 PolarHBondContact O-N 3.25Å; K459-M462 WeakPolarHBondContact O-CB 3.38Å; K459-M462 PolarHBondContact O-N 3.18Å; M462-K464 VanDerWaalsContact C-N 3.35Å; M462-K464 PolarHBondContact O-N 3.12Å; M462-E465 PolarHBondContact O-N 3.49Å; M462-A466 VanDerWaalsContact O-CB 3.23Å; M462-A466 WeakPolarHBondContact O-CB 3.34Å; M462-A466 PolarHBondContact O-N 2.72Å; M462-A481 HydrophobicContact CE-CB 3.7Å; M462-A481 HydrophobicContact SD-CB 3.19Å; M462-A481 WeakPolarHBondContact SD-CB 3.38Å
463	W	90.7	Very high	90.2	Very high	65 Å²	65	60.2 Å²	60.2	25%	0.246	29%	0.285	C	S	.	.	H	α-helix	trans	-61.7	-42.1	173.9	-175.3	96.1	0	0	0	112	K459 N460 L461 A466 R467 L482 L652 F735	K459-W463 PolarHBondContact O-N 3.12Å; N460-W463 PolarHBondContact O-N 3.05Å; L461-W463 VanDerWaalsContact C-N 3.33Å; L461-W463 PolarHBondContact O-N 3.26Å; W463-A466 PolarHBondContact O-N 3.42Å; W463-R467 HydrophobicContact CE3-CG 4.42Å; W463-R467 HydrophobicContact CH2-CG 4.35Å; W463-R467 HydrophobicContact CZ3-CG 4.27Å; W463-R467 PolarHBondContact O-N 2.94Å; W463-L482 HydrophobicContact CB-CD2 4.18Å; W463-L482 HydrophobicContact CG-CD2 4.49Å; W463-L652 HydrophobicContact CD2-CD2 4.5Å; W463-L652 HydrophobicContact CG-CD2 4.12Å; W463-F735 WeakPolarHBondContact CH2-O 3.5Å
464	K	88.4	Confident	90.6	Very high	117 Å²	117	54.9 Å²	54.9	51%	0.509	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-46	176.6	-176.9	-173.4	173.8	-168	0	111.5	N460 L461 M462 R467	N460-K464 PolarHBondContact O-N 3.35Å; L461-K464 WeakPolarHBondContact O-CB 3.38Å; L461-K464 PolarHBondContact O-N 3.19Å; L461-K464 VanDerWaalsContact O-N 3.14Å; M462-K464 VanDerWaalsContact C-N 3.35Å; M462-K464 PolarHBondContact O-N 3.12Å; K464-R467 WeakPolarHBondContact O-CB 3.45Å; K464-R467 PolarHBondContact O-N 3.5Å
465	E	90.3	Very high	91.1	Very high	37 Å²	37	54.4 Å²	54.4	17%	0.173	25%	0.253	C	S	.	.	H	α-helix	trans	-71.1	-35.8	-179.6	-68.4	-53	131.5	0	0	112.6	R444 L447 F448 L451 L461 M462 R467 V468	R444-E465 IonicContact CZ-OE2 3.5Å; R444-E465 IonicContact NH1-OE2 2.86Å; R444-E465 PolarHBondContact NH1-OE2 2.98Å; R444-E465 PolarHBondContact NH2-O 3.35Å; L447-E465 HydrophobicContact CD2-CG 3.98Å; F448-E465 HydrophobicContact CE2-CB 4.21Å; F448-E465 HydrophobicContact CZ-CB 4.27Å; L451-E465 HydrophobicContact CD1-CB 4.23Å; L451-E465 HydrophobicContact CD1-CG 3.97Å; L461-E465 WeakPolarHBondContact O-CG 3.37Å; L461-E465 PolarHBondContact O-N 3.43Å; M462-E465 PolarHBondContact O-N 3.49Å; E465-R467 PolarHBondContact O-N 3.44Å; E465-V468 WeakPolarHBondContact O-CB 3.46Å; E465-V468 PolarHBondContact O-N 2.81Å
466	A	92.4	Very high	91.5	Very high	4 Å²	4	54.4 Å²	54.4	3%	0.033	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-21.9	175.3	0	0	0	0	0	113.3	F448 M462 W463 V468 I470 L482 L652	F448-A466 HydrophobicContact CZ-CB 4.42Å; M462-A466 VanDerWaalsContact O-CB 3.23Å; M462-A466 WeakPolarHBondContact O-CB 3.34Å; M462-A466 PolarHBondContact O-N 2.72Å; W463-A466 PolarHBondContact O-N 3.42Å; A466-V468 PolarHBondContact O-N 2.98Å; A466-I470 HydrophobicContact CB-CD1 4.02Å; A466-I470 HydrophobicContact CB-CG1 3.86Å; A466-L482 HydrophobicContact CB-CD1 4.09Å; A466-L482 HydrophobicContact CB-CD2 4.24Å; A466-L652 HydrophobicContact CB-CD2 3.83Å
467	R	89.4	Confident	91.8	Very high	147 Å²	147	55.1 Å²	55.1	56%	0.555	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-22.3	171.5	-70.7	178	65.3	-178	1.8	113.7	W463 K464 E465 L652	W463-R467 HydrophobicContact CE3-CG 4.42Å; W463-R467 HydrophobicContact CH2-CG 4.35Å; W463-R467 HydrophobicContact CZ3-CG 4.27Å; W463-R467 PolarHBondContact O-N 2.94Å; K464-R467 WeakPolarHBondContact O-CB 3.45Å; K464-R467 PolarHBondContact O-N 3.5Å; E465-R467 PolarHBondContact O-N 3.44Å; R467-L652 HydrophobicContact CB-CD1 4.36Å; R467-L652 HydrophobicContact CG-CD1 3.86Å
468	V	89.9	Confident	92.3	Very high	54 Å²	54	44.8 Å²	44.8	33%	0.327	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-55.6	174.3	-179.8	0	0	0	0	109.1	V427 R434 E465 A466	V427-V468 HydrophobicContact CG1-CG1 4.34Å; R434-V468 PolarHBondContact NH1-O 3.2Å; E465-V468 WeakPolarHBondContact O-CB 3.46Å; E465-V468 PolarHBondContact O-N 2.81Å; A466-V468 PolarHBondContact O-N 2.98Å
469	D	92.7	Very high	92.9	Very high	8 Å²	8	42.3 Å²	42.3	4%	0.043	20%	0.204	C	C	.	.			trans	-179.2	174.7	171.6	53.2	32.1	0	0	0	110.5	L431 R434 Y440 R444 F448	L431-D469 HydrophobicContact CD1-CB 3.59Å; R434-D469 IonicContact CZ-OD2 2.64Å; R434-D469 IonicContact NE-OD2 3.99Å; R434-D469 IonicContact NH1-OD2 3.81Å; R434-D469 PolarHBondContact NH1-OD2 2.93Å; Y440-D469 VanDerWaalsContact CE1-OD2 3.24Å; Y440-D469 WeakPolarHBondContact CE1-OD2 3.37Å; Y440-D469 VanDerWaalsContact CZ-OD2 3.3Å; Y440-D469 PolarHBondContact OH-OD1 2.78Å; Y440-D469 PolarHBondContact OH-OD2 3Å; R444-D469 IonicContact CZ-OD1 3.63Å; R444-D469 VanDerWaalsContact CZ-OD1 3.27Å; R444-D469 IonicContact NE-OD1 2.88Å; R444-D469 PolarHBondContact NE-OD1 3.4Å; R444-D469 PolarHBondContact NH2-O 3.2Å; R444-D469 IonicContact NH2-OD1 3.15Å; R444-D469 PolarHBondContact NH2-OD1 2.92Å; F448-D469 WeakPolarHBondContact CZ-O 3.38Å
470	I	96.1	Very high	93.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.187	C	C	.	.			trans	-122.1	126.1	173.2	-58.1	-180	0	0	0	108.6	F448 A466 R475 A478 L482 D648	F448-I470 HydrophobicContact CE1-CG1 4.41Å; F448-I470 HydrophobicContact CE1-CG2 4.28Å; F448-I470 HydrophobicContact CZ-CG1 4.33Å; A466-I470 HydrophobicContact CB-CD1 4.02Å; A466-I470 HydrophobicContact CB-CG1 3.86Å; I470-R475 HydrophobicContact CG2-CB 4.07Å; I470-R475 HydrophobicContact CG2-CG 4.13Å; I470-R475 PolarHBondContact O-NH2 2.94Å; I470-R475 VanDerWaalsContact O-NH2 3.13Å; I470-A478 HydrophobicContact CD1-CB 4.46Å; I470-A478 HydrophobicContact CG2-CB 3.61Å; I470-L482 HydrophobicContact CD1-CD1 3.79Å; I470-D648 HydrophobicContact CD1-CB 4.22Å
471	P	96.2	Very high	93.7	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.006	16%	0.156	C	C	.	.			trans	-65.8	135.7	179.2	-22	34	0	0	0	111.9	R444 I445 F448 L473 V474 R475	R444-P471 HydrophobicContact CB-CB 4.43Å; R444-P471 HydrophobicContact CB-CG 3.45Å; R444-P471 VanDerWaalsContact CB-CG 3.45Å; I445-P471 HydrophobicContact CG1-CB 3.88Å; F448-P471 HydrophobicContact CD2-CG 3.92Å; F448-P471 HydrophobicContact CE2-CG 4.28Å; F448-P471 HydrophobicContact CG-CG 4.39Å; P471-L473 VanDerWaalsContact C-N 3.3Å; P471-L473 PolarHBondContact O-N 3.06Å; P471-V474 HydrophobicContact CB-CG2 3.91Å; P471-V474 HydrophobicContact CG-CG2 4.12Å; P471-V474 PolarHBondContact O-N 2.99Å; P471-R475 PolarHBondContact O-N 3.33Å; P471-R475 VanDerWaalsContact O-N 3.16Å
472	P	96.4	Very high	94.1	Very high	39 Å²	39	30.7 Å²	30.7	25%	0.253	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-54.8	-40.9	-176.7	-29.4	35.8	0	0	0	115.1	E435 Q441 V474 R475	E435-P472 HydrophobicContact CB-CG 4.38Å; E435-P472 HydrophobicContact CG-CG 3.98Å; E435-P472 WeakPolarHBondContact OE1-CG 3.37Å; Q441-P472 VanDerWaalsContact OE1-CD 3.32Å; P472-V474 VanDerWaalsContact C-N 3.26Å; P472-V474 PolarHBondContact O-N 3.32Å; P472-R475 VanDerWaalsContact CA-NH1 3.32Å; P472-R475 PolarHBondContact O-N 3.13Å
473	L	95.4	Very high	94.4	Very high	56 Å²	56	31.8 Å²	31.8	29%	0.293	15%	0.152	S	C	.	.	G	3₁₀ helix	trans	-60.4	-33.6	-176.3	-173.6	65.7	0	0	0	113.2	E327 H330 I445 P471	E327-L473 HydrophobicContact CB-CD2 3.98Å; E327-L473 HydrophobicContact CG-CD2 4.09Å; H330-L473 HydrophobicContact CB-CD1 4.14Å; H330-L473 HydrophobicContact CB-CD2 4.22Å; I445-L473 HydrophobicContact CD1-CB 4.15Å; I445-L473 HydrophobicContact CD1-CD2 3.91Å; I445-L473 HydrophobicContact CG1-CB 4.38Å; I445-L473 HydrophobicContact CG1-CD2 4.45Å; I445-L473 HydrophobicContact CG2-CD2 4.22Å; P471-L473 VanDerWaalsContact C-N 3.3Å; P471-L473 PolarHBondContact O-N 3.06Å
474	V	95.8	Very high	94.5	Very high	9 Å²	9	29.9 Å²	29.9	6%	0.055	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-110.4	5.7	-175.6	-65.3	0	0	0	0	113.3	F448 L452 P471 P472 G476 L477 A478	F448-V474 HydrophobicContact CB-CG2 3.73Å; F448-V474 HydrophobicContact CD1-CG2 4.43Å; F448-V474 HydrophobicContact CG-CG2 4.19Å; L452-V474 HydrophobicContact CD1-CB 4.32Å; P471-V474 HydrophobicContact CB-CG2 3.91Å; P471-V474 HydrophobicContact CG-CG2 4.12Å; P471-V474 PolarHBondContact O-N 2.99Å; P472-V474 VanDerWaalsContact C-N 3.26Å; P472-V474 PolarHBondContact O-N 3.32Å; V474-G476 VanDerWaalsContact C-N 3.34Å; V474-G476 PolarHBondContact O-N 3.01Å; V474-L477 PolarHBondContact O-N 2.91Å; V474-L477 VanDerWaalsContact O-N 3.12Å; V474-A478 PolarHBondContact O-N 2.66Å
475	R	97.7	Very high	94.8	Very high	13 Å²	13	25 Å²	25	5%	0.049	13%	0.132	C	C	.	.	H	α-helix	trans	-54.8	-43.5	-172.5	-177.4	176	-73.8	114.2	1.7	113.6	E435 I470 P471 P472 L477 A478 W479 L561 D648	E435-R475 IonicContact OE1-CZ 2.66Å; E435-R475 IonicContact OE1-NH2 3.03Å; E435-R475 PolarHBondContact OE1-NH2 3.16Å; I470-R475 HydrophobicContact CG2-CB 4.07Å; I470-R475 HydrophobicContact CG2-CG 4.13Å; I470-R475 PolarHBondContact O-NH2 2.94Å; I470-R475 VanDerWaalsContact O-NH2 3.13Å; P471-R475 PolarHBondContact O-N 3.33Å; P471-R475 VanDerWaalsContact O-N 3.16Å; P472-R475 VanDerWaalsContact CA-NH1 3.32Å; P472-R475 PolarHBondContact O-N 3.13Å; R475-L477 VanDerWaalsContact C-N 3.34Å; R475-L477 PolarHBondContact O-N 2.91Å; R475-A478 PolarHBondContact O-N 3.31Å; R475-W479 HydrophobicContact CG-CD2 4.41Å; R475-W479 HydrophobicContact CG-CG 4.37Å; R475-W479 HydrophobicContact CG-CZ2 4.48Å; R475-W479 WeakPolarHBondContact O-CB 3.46Å; R475-W479 PolarHBondContact O-N 3.37Å; R475-L561 HydrophobicContact CB-CD2 4.29Å; R475-L561 HydrophobicContact CG-CD1 4Å; R475-L561 HydrophobicContact CG-CD2 4.32Å; R475-D648 IonicContact CZ-OD2 3.84Å; R475-D648 IonicContact NE-OD1 3.93Å; R475-D648 PolarHBondContact NE-OD1 3.2Å; R475-D648 IonicContact NE-OD2 2.69Å; R475-D648 PolarHBondContact NE-OD2 3.29Å; R475-D648 IonicContact NH2-OD2 3.28Å; R475-D648 PolarHBondContact NH2-OD2 3.03Å
476	G	96.9	Very high	94.7	Very high	7 Å²	7	29 Å²	29	7%	0.072	15%	0.15	C	C	.	.	H	α-helix	trans	-58.7	-42.9	179.1	0	0	0	0	0	113.3	V474 A480	V474-G476 VanDerWaalsContact C-N 3.34Å; V474-G476 PolarHBondContact O-N 3.01Å; G476-A480 PolarHBondContact O-N 3.01Å
477	L	96.3	Very high	94.4	Very high	64 Å²	64	30.7 Å²	30.7	34%	0.335	17%	0.169	S	C	.	.	H	α-helix	trans	-72.4	-39.8	177.4	-63.6	177.6	0	0	0	111.9	L292 F293 L452 V474 R475 A480 A481 L568	L292-L477 HydrophobicContact CD2-CD2 4.33Å; F293-L477 HydrophobicContact CE2-CD2 3.95Å; L452-L477 HydrophobicContact CD1-CB 3.77Å; L452-L477 HydrophobicContact CD1-CD1 4.18Å; L452-L477 HydrophobicContact CD2-CB 3.9Å; V474-L477 PolarHBondContact O-N 2.91Å; V474-L477 VanDerWaalsContact O-N 3.12Å; R475-L477 VanDerWaalsContact C-N 3.34Å; R475-L477 PolarHBondContact O-N 2.91Å; L477-A480 PolarHBondContact O-N 3.46Å; L477-A481 PolarHBondContact O-N 3.33Å; L477-L568 HydrophobicContact CD2-CD2 3.92Å
478	A	97.1	Very high	94.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.4	-45	175.7	0	0	0	0	0	111.5	F448 I470 V474 R475 A480 A481 L482	F448-A478 HydrophobicContact CD1-CB 3.96Å; F448-A478 HydrophobicContact CE1-CB 3.92Å; I470-A478 HydrophobicContact CD1-CB 4.46Å; I470-A478 HydrophobicContact CG2-CB 3.61Å; V474-A478 PolarHBondContact O-N 2.66Å; R475-A478 PolarHBondContact O-N 3.31Å; A478-A480 PolarHBondContact O-N 2.67Å; A478-A481 PolarHBondContact O-N 3.34Å; A478-L482 WeakPolarHBondContact O-CG 3.24Å; A478-L482 PolarHBondContact O-N 2.95Å
479	W	98	Very high	94.5	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.008	15%	0.148	C	C	.	.	H	α-helix	trans	-60.2	-43.7	175.7	-79.8	21.3	0	0	0	112.4	R475 A481 L482 L483 P557 F558 L561 F644 W647 D648 L651	R475-W479 HydrophobicContact CG-CD2 4.41Å; R475-W479 HydrophobicContact CG-CG 4.37Å; R475-W479 HydrophobicContact CG-CZ2 4.48Å; R475-W479 WeakPolarHBondContact O-CB 3.46Å; R475-W479 PolarHBondContact O-N 3.37Å; W479-A481 VanDerWaalsContact C-N 3.32Å; W479-A481 PolarHBondContact O-N 3.15Å; W479-L482 PolarHBondContact O-N 2.82Å; W479-L483 WeakPolarHBondContact O-CB 3.35Å; W479-L483 WeakPolarHBondContact O-CG 3.3Å; W479-L483 PolarHBondContact O-N 3.37Å; W479-P557 HydrophobicContact CH2-CB 4.42Å; W479-P557 HydrophobicContact CZ3-CB 4.07Å; W479-F558 HydrophobicContact CE3-CD1 4.29Å; W479-F558 HydrophobicContact CE3-CE1 4.05Å; W479-F558 HydrophobicContact CZ3-CE1 4.35Å; W479-L561 HydrophobicContact CD2-CD1 3.93Å; W479-L561 HydrophobicContact CE3-CD1 3.6Å; W479-L561 HydrophobicContact CH2-CD1 4.07Å; W479-L561 HydrophobicContact CZ2-CD1 4.37Å; W479-L561 HydrophobicContact CZ3-CD1 3.66Å; W479-F644 AromaticContact CH2-CD1 3.85Å; W479-F644 HydrophobicContact CH2-CD1 3.85Å; W479-F644 HydrophobicContact CZ2-CD1 4.27Å; W479-W647 HydrophobicContact CE3-CE3 4.29Å; W479-W647 HydrophobicContact CH2-CB 3.41Å; W479-W647 VanDerWaalsContact CH2-CB 3.41Å; W479-W647 HydrophobicContact CH2-CD2 4.04Å; W479-W647 AromaticContact CH2-CE3 3.49Å; W479-W647 HydrophobicContact CH2-CE3 3.49Å; W479-W647 VanDerWaalsContact CH2-CE3 3.49Å; W479-W647 HydrophobicContact CH2-CG 4.08Å; W479-W647 HydrophobicContact CH2-CZ3 4.43Å; W479-W647 HydrophobicContact CZ2-CB 3.43Å; W479-W647 VanDerWaalsContact CZ2-CB 3.43Å; W479-W647 HydrophobicContact CZ3-CB 4.36Å; W479-W647 HydrophobicContact CZ3-CD2 4.35Å; W479-W647 AromaticContact CZ3-CE3 3.37Å; W479-W647 HydrophobicContact CZ3-CE3 3.37Å; W479-W647 AromaticContact CZ3-CZ3 3.97Å; W479-W647 HydrophobicContact CZ3-CZ3 3.97Å; W479-D648 PolarHBondContact NE1-OD1 3.28Å; W479-L651 HydrophobicContact CB-CD1 3.9Å; W479-L651 HydrophobicContact CD2-CD1 3.49Å; W479-L651 VanDerWaalsContact CD2-CD1 3.49Å; W479-L651 HydrophobicContact CE3-CD1 4.13Å; W479-L651 HydrophobicContact CG-CD1 3.37Å
480	A	97.1	Very high	94.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59.6	-43.2	175.9	0	0	0	0	0	112.3	F293 G476 L477 A478 L483 G484 I485 L568 C572	F293-A480 HydrophobicContact CE1-CB 4.28Å; F293-A480 HydrophobicContact CE2-CB 3.85Å; F293-A480 HydrophobicContact CZ-CB 3.48Å; F293-A480 VanDerWaalsContact CZ-CB 3.48Å; G476-A480 PolarHBondContact O-N 3.01Å; L477-A480 PolarHBondContact O-N 3.46Å; A478-A480 PolarHBondContact O-N 2.67Å; A480-L483 CarbonylContact O-C 3.11Å; A480-L483 PolarHBondContact O-N 3Å; A480-G484 PolarHBondContact O-N 3.43Å; A480-G484 VanDerWaalsContact O-N 3.16Å; A480-I485 HydrophobicContact CB-CB 4.34Å; A480-I485 HydrophobicContact CB-CG1 4.14Å; A480-I485 WeakPolarHBondContact O-CB 3.45Å; A480-I485 VanDerWaalsContact O-CG1 3.29Å; A480-I485 WeakPolarHBondContact O-CG1 3.5Å; A480-I485 PolarHBondContact O-N 2.81Å; A480-L568 HydrophobicContact CB-CD1 3.65Å; A480-L568 HydrophobicContact CB-CD2 4.49Å; A480-L568 HydrophobicContact CB-CG 4.35Å; A480-C572 VanDerWaalsContact CB-SG 3.57Å
481	A	95.2	Very high	94.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-69.9	-36.5	177.6	0	0	0	0	0	113.1	L452 Y455 M462 L477 A478 W479 L483 G484	L452-A481 HydrophobicContact CD2-CB 4.21Å; Y455-A481 HydrophobicContact CD2-CB 3.58Å; Y455-A481 HydrophobicContact CE2-CB 3.55Å; Y455-A481 HydrophobicContact CG-CB 4.27Å; M462-A481 HydrophobicContact CE-CB 3.7Å; M462-A481 HydrophobicContact SD-CB 3.19Å; M462-A481 WeakPolarHBondContact SD-CB 3.38Å; L477-A481 PolarHBondContact O-N 3.33Å; A478-A481 PolarHBondContact O-N 3.34Å; W479-A481 VanDerWaalsContact C-N 3.32Å; W479-A481 PolarHBondContact O-N 3.15Å; A481-L483 VanDerWaalsContact C-N 3.3Å; A481-L483 PolarHBondContact O-N 3.14Å; A481-G484 PolarHBondContact O-N 2.65Å
482	L	95.4	Very high	94.2	Very high	20 Å²	20	37.1 Å²	37.1	11%	0.105	21%	0.211	C	C	.	.	H	α-helix	trans	-63.9	-35.3	171.9	-70	175.7	0	0	0	112.2	W463 A466 I470 A478 W479 G484 L651 L652	W463-L482 HydrophobicContact CB-CD2 4.18Å; W463-L482 HydrophobicContact CG-CD2 4.49Å; A466-L482 HydrophobicContact CB-CD1 4.09Å; A466-L482 HydrophobicContact CB-CD2 4.24Å; I470-L482 HydrophobicContact CD1-CD1 3.79Å; A478-L482 WeakPolarHBondContact O-CG 3.24Å; A478-L482 PolarHBondContact O-N 2.95Å; W479-L482 PolarHBondContact O-N 2.82Å; L482-G484 PolarHBondContact O-N 3.46Å; L482-L651 HydrophobicContact CD1-CB 4.32Å; L482-L652 HydrophobicContact CD1-CD2 4.05Å; L482-L652 HydrophobicContact CD2-CD2 3.89Å
483	L	95.4	Very high	94.2	Very high	24 Å²	24	35.5 Å²	35.5	13%	0.126	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-5.7	173.1	-72.4	168.5	0	0	0	113.4	W479 A480 A481 I485 F558 C572 A575 F576 L651	W479-L483 WeakPolarHBondContact O-CB 3.35Å; W479-L483 WeakPolarHBondContact O-CG 3.3Å; W479-L483 PolarHBondContact O-N 3.37Å; A480-L483 CarbonylContact O-C 3.11Å; A480-L483 PolarHBondContact O-N 3Å; A481-L483 VanDerWaalsContact C-N 3.3Å; A481-L483 PolarHBondContact O-N 3.14Å; L483-I485 HydrophobicContact CB-CD1 4.35Å; L483-I485 HydrophobicContact CB-CG1 4.25Å; L483-F558 HydrophobicContact CD1-CE1 4.09Å; L483-C572 HydrophobicContact CD1-CB 3.87Å; L483-A575 HydrophobicContact CB-CB 4.21Å; L483-F576 HydrophobicContact CD1-CB 4.48Å; L483-F576 HydrophobicContact CD2-CB 4.21Å; L483-F576 HydrophobicContact CD2-CD2 4.27Å; L483-L651 HydrophobicContact CD1-CD2 4.46Å; L483-L651 HydrophobicContact CD2-CD2 3.79Å; L483-L651 HydrophobicContact CG-CD2 4.09Å
484	G	93.2	Very high	94.2	Very high	26 Å²	26	37 Å²	37	27%	0.268	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	35	178.3	0	0	0	0	0	113.4	Y455 A480 A481 L482 E486	Y455-G484 VanDerWaalsContact OH-C 3.22Å; Y455-G484 WeakPolarHBondContact OH-CA 3.4Å; A480-G484 PolarHBondContact O-N 3.43Å; A480-G484 VanDerWaalsContact O-N 3.16Å; A481-G484 PolarHBondContact O-N 2.65Å; L482-G484 PolarHBondContact O-N 3.46Å; G484-E486 PolarHBondContact O-N 3.3Å
485	I	93.6	Very high	94.2	Very high	14 Å²	14	41.3 Å²	41.3	7%	0.072	24%	0.238	C	C	.	.			trans	-68.5	125.1	177.4	-58.8	-53	0	0	0	109.9	F293 Y455 A480 L483 I489 L568 A571 A575	F293-I485 HydrophobicContact CD1-CB 4.33Å; F293-I485 HydrophobicContact CD1-CG2 4.06Å; F293-I485 WeakPolarHBondContact CD1-O 3.43Å; F293-I485 HydrophobicContact CE1-CB 4.23Å; F293-I485 HydrophobicContact CE1-CG2 4.41Å; F293-I485 WeakPolarHBondContact CE1-O 3.39Å; F293-I485 HydrophobicContact CG-CG2 4.35Å; Y455-I485 WeakPolarHBondContact CE1-O 3.46Å; Y455-I485 PolarHBondContact OH-N 3.46Å; Y455-I485 PolarHBondContact OH-O 3.37Å; A480-I485 HydrophobicContact CB-CB 4.34Å; A480-I485 HydrophobicContact CB-CG1 4.14Å; A480-I485 WeakPolarHBondContact O-CB 3.45Å; A480-I485 VanDerWaalsContact O-CG1 3.29Å; A480-I485 WeakPolarHBondContact O-CG1 3.5Å; A480-I485 PolarHBondContact O-N 2.81Å; L483-I485 HydrophobicContact CB-CD1 4.35Å; L483-I485 HydrophobicContact CB-CG1 4.25Å; I485-I489 HydrophobicContact CG2-CG2 3.63Å; I485-L568 HydrophobicContact CG2-CD1 4.23Å; I485-A571 HydrophobicContact CD1-CB 4.14Å; I485-A571 WeakPolarHBondContact CD1-O 3.44Å; I485-A571 HydrophobicContact CG2-CB 4.05Å; I485-A575 HydrophobicContact CD1-CB 3.55Å
486	E	88.3	Confident	94	Very high	120 Å²	120	41.5 Å²	41.5	56%	0.561	24%	0.241	S	C	*	.			trans	-145.3	162.6	179.7	-66	-177.6	-172.1	0	0	110.3	Y455 P456 G484	Y455-E486 HydrophobicContact CE1-CG 4.02Å; Y455-E486 WeakPolarHBondContact OH-CG 3.47Å; P456-E486 WeakPolarHBondContact CB-OE1 3.45Å; G484-E486 PolarHBondContact O-N 3.3Å
487	G	85.4	Confident	93.9	Very high	41 Å²	41	44.4 Å²	44.4	42%	0.423	26%	0.255	S	S	.	.	S	Bend	trans	85.4	-175.3	179.7	0	0	0	0	0	114.1	F293 I489	F293-G487 CarbonylContact C-O 3.31Å; G487-I489 PolarHBondContact O-N 2.99Å
488	D	88.7	Confident	93.7	Very high	71 Å²	71	42.4 Å²	42.4	38%	0.38	24%	0.243	S	C	.	.			trans	-81.1	84.6	-178.9	-167.3	-17.3	0	0	0	111.2	Q490 A491 K492	D488-Q490 PolarHBondContact O-N 3.47Å; D488-Q490 PolarHBondContact OD1-N 2.62Å; D488-A491 HydrophobicContact CB-CB 4.25Å; D488-A491 PolarHBondContact OD1-N 2.93Å; D488-K492 PolarHBondContact O-N 3.12Å
489	I	94.2	Very high	93.4	Very high	13 Å²	13	48.6 Å²	48.6	7%	0.067	28%	0.277	C	S	.	.	H	α-helix	trans	-64.4	-30	-179.9	60.8	174.5	0	0	0	112.5	F293 I485 G487 Y493 A567 L568 A571	F293-I489 HydrophobicContact CB-CD1 3.74Å; F293-I489 HydrophobicContact CB-CG1 4.1Å; F293-I489 HydrophobicContact CB-CG2 4.43Å; F293-I489 HydrophobicContact CD2-CD1 4.24Å; F293-I489 HydrophobicContact CG-CD1 4.3Å; I485-I489 HydrophobicContact CG2-CG2 3.63Å; G487-I489 PolarHBondContact O-N 2.99Å; I489-Y493 WeakPolarHBondContact O-CB 3.34Å; I489-Y493 PolarHBondContact O-N 3.15Å; I489-A567 HydrophobicContact CG1-CB 4.37Å; I489-L568 HydrophobicContact CD1-CB 3.84Å; I489-L568 HydrophobicContact CD1-CD1 3.74Å; I489-L568 HydrophobicContact CD1-CG 4.38Å; I489-A571 HydrophobicContact CB-CB 4.32Å; I489-A571 HydrophobicContact CG2-CB 3.93Å
490	Q	93.3	Very high	93.2	Very high	84 Å²	84	52.1 Å²	52.1	39%	0.393	30%	0.299	S	S	.	.	H	α-helix	trans	-71.7	-50.2	-175.4	-173.6	62	53	0	0	109.6	D488 K492 Y493 D494	D488-Q490 PolarHBondContact O-N 3.47Å; D488-Q490 PolarHBondContact OD1-N 2.62Å; Q490-K492 VanDerWaalsContact C-N 3.28Å; Q490-K492 PolarHBondContact O-N 3.33Å; Q490-Y493 PolarHBondContact O-N 3.12Å; Q490-Y493 VanDerWaalsContact O-N 3.14Å; Q490-D494 WeakPolarHBondContact CG-OD2 3.3Å; Q490-D494 PolarHBondContact NE2-OD1 3.1Å; Q490-D494 PolarHBondContact NE2-OD2 3.43Å; Q490-D494 WeakPolarHBondContact O-CB 3.46Å; Q490-D494 VanDerWaalsContact O-CG 3.31Å; Q490-D494 PolarHBondContact O-N 2.87Å
491	A	92.8	Very high	93	Very high	51 Å²	51	57.4 Å²	57.4	42%	0.421	33%	0.333	S	S	.	.	H	α-helix	trans	-56.9	-42.2	176.6	0	0	0	0	0	112.1	D488 D494 S495	D488-A491 HydrophobicContact CB-CB 4.25Å; D488-A491 PolarHBondContact OD1-N 2.93Å; A491-D494 PolarHBondContact O-N 2.76Å; A491-S495 WeakPolarHBondContact O-CB 3.36Å; A491-S495 PolarHBondContact O-N 3.24Å; A491-S495 PolarHBondContact O-OG 3.05Å
492	K	93	Very high	92.8	Very high	126 Å²	126	59.2 Å²	59.2	55%	0.548	34%	0.342	S	S	.	.	H	α-helix	trans	-63.6	-41.6	177.5	-176.9	177.3	179.2	-177.7	0	112.7	D488 Q490 S495 T496	D488-K492 PolarHBondContact O-N 3.12Å; Q490-K492 VanDerWaalsContact C-N 3.28Å; Q490-K492 PolarHBondContact O-N 3.33Å; K492-S495 PolarHBondContact O-OG 3.31Å; K492-T496 PolarHBondContact O-OG1 2.89Å
493	Y	95.9	Very high	92.5	Very high	4 Å²	4	64.6 Å²	64.6	2%	0.016	38%	0.379	C	S	.	.	H	α-helix	trans	-69.8	-41.3	178.7	-176.3	-106.6	0	0	0	111.8	I489 Q490 T496 K498 R533 A537 E566 A567 Y570	I489-Y493 WeakPolarHBondContact O-CB 3.34Å; I489-Y493 PolarHBondContact O-N 3.15Å; Q490-Y493 PolarHBondContact O-N 3.12Å; Q490-Y493 VanDerWaalsContact O-N 3.14Å; Y493-T496 PolarHBondContact O-N 3.33Å; Y493-K498 HydrophobicContact CE1-CD 4.02Å; Y493-K498 HydrophobicContact CE2-CD 4.27Å; Y493-K498 PolarHBondContact O-NZ 3.05Å; Y493-R533 WeakPolarHBondContact OH-CB 3.24Å; Y493-A537 HydrophobicContact CD2-CB 4.16Å; Y493-A537 HydrophobicContact CE2-CB 3.62Å; Y493-E566 HydrophobicContact CE1-CB 3.74Å; Y493-E566 PolarHBondContact OH-OE2 3.47Å; Y493-A567 HydrophobicContact CD1-CB 4.12Å; Y493-A567 HydrophobicContact CG-CB 3.93Å; Y493-Y570 AromaticContact CD2-CD1 3.73Å; Y493-Y570 HydrophobicContact CD2-CD1 3.73Å; Y493-Y570 HydrophobicContact CD2-CD2 4.25Å; Y493-Y570 HydrophobicContact CD2-CE1 4.5Å; Y493-Y570 AromaticContact CD2-CG 3.59Å; Y493-Y570 HydrophobicContact CD2-CG 3.59Å; Y493-Y570 HydrophobicContact CE2-CD2 4.36Å; Y493-Y570 AromaticContact CE2-CG 3.97Å; Y493-Y570 HydrophobicContact CE2-CG 3.97Å
494	D	95.2	Very high	92.3	Very high	88 Å²	88	65 Å²	65	47%	0.471	38%	0.382	S	S	.	.	H	α-helix	trans	-67.6	-36.8	-179.7	-68.9	-22.6	0	0	0	111.8	Q490 A491 T496 K498	Q490-D494 WeakPolarHBondContact CG-OD2 3.3Å; Q490-D494 PolarHBondContact NE2-OD1 3.1Å; Q490-D494 PolarHBondContact NE2-OD2 3.43Å; Q490-D494 WeakPolarHBondContact O-CB 3.46Å; Q490-D494 VanDerWaalsContact O-CG 3.31Å; Q490-D494 PolarHBondContact O-N 2.87Å; A491-D494 PolarHBondContact O-N 2.76Å; D494-T496 PolarHBondContact O-N 3.29Å; D494-K498 PolarHBondContact O-NZ 3.31Å
495	S	94.9	Very high	92.2	Very high	99 Å²	99	64.7 Å²	64.7	69%	0.692	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-13	176.8	67.4	0	0	0	0	114.7	A491 K492	A491-S495 WeakPolarHBondContact O-CB 3.36Å; A491-S495 PolarHBondContact O-N 3.24Å; A491-S495 PolarHBondContact O-OG 3.05Å; K492-S495 PolarHBondContact O-OG 3.31Å
496	T	94.7	Very high	92.1	Very high	18 Å²	18	73.8 Å²	73.8	11%	0.11	41%	0.407	C	S	.	.	S	Bend	trans	-84.7	130.9	-179.7	-55.6	0	0	0	0	110.4	K492 Y493 D494 K498 A537 V540	K492-T496 PolarHBondContact O-OG1 2.89Å; Y493-T496 PolarHBondContact O-N 3.33Å; D494-T496 PolarHBondContact O-N 3.29Å; T496-K498 PolarHBondContact O-N 3.46Å; T496-K498 PolarHBondContact O-NZ 3.03Å; T496-A537 HydrophobicContact CG2-CB 3.98Å; T496-A537 WeakPolarHBondContact CG2-O 3.05Å; T496-V540 HydrophobicContact CG2-CB 4.3Å; T496-V540 HydrophobicContact CG2-CG1 4.14Å
497	D	93.3	Very high	92.4	Very high	68 Å²	68	71.9 Å²	71.9	36%	0.364	40%	0.399	S	S	.	.			trans	-67.8	123	176.7	-174.5	-4.7	0	0	0	111.1	D499 T500 V540	D497-D499 PolarHBondContact OD1-N 3.28Å; D497-T500 PolarHBondContact OD1-N 3.14Å; D497-T500 PolarHBondContact OD1-OG1 3.19Å; D497-T500 WeakPolarHBondContact OD2-CB 3.44Å; D497-T500 PolarHBondContact OD2-OG1 2.92Å; D497-V540 HydrophobicContact CB-CG1 4.43Å
498	K	93.8	Very high	92.8	Very high	21 Å²	21	70 Å²	70	9%	0.091	38%	0.379	C	S	.	.			trans	-119.3	-5.5	-179.2	-66.1	168.4	-66.8	-70.3	0	112.1	Y493 D494 T496 R533 K536 A537	Y493-K498 HydrophobicContact CE1-CD 4.02Å; Y493-K498 HydrophobicContact CE2-CD 4.27Å; Y493-K498 PolarHBondContact O-NZ 3.05Å; D494-K498 PolarHBondContact O-NZ 3.31Å; T496-K498 PolarHBondContact O-N 3.46Å; T496-K498 PolarHBondContact O-NZ 3.03Å; K498-R533 HydrophobicContact CD-CB 4.39Å; K498-K536 WeakPolarHBondContact O-CD 3.27Å; K498-K536 WeakPolarHBondContact O-CE 3.15Å; K498-K536 PolarHBondContact O-NZ 2.87Å; K498-A537 HydrophobicContact CD-CB 4.3Å; K498-A537 HydrophobicContact CG-CB 4.06Å
499	D	91	Very high	92.9	Very high	130 Å²	130	70.8 Å²	70.8	70%	0.695	38%	0.38	S	S	*	.	S	Bend	trans	-107.4	-40.4	-167.1	-61.3	-54.9	0	0	0	111	D497 P501 K536	D497-D499 PolarHBondContact OD1-N 3.28Å; D499-P501 WeakPolarHBondContact O-CD 3.21Å; D499-K536 PolarHBondContact O-NZ 3.06Å
500	T	92.7	Very high	92.7	Very high	77 Å²	77	73.7 Å²	73.7	47%	0.472	40%	0.399	S	S	.	.	S	Bend	trans	-59.2	123.4	-178.7	-60.6	0	0	0	0	111.3	D497 I502 K536	D497-T500 PolarHBondContact OD1-N 3.14Å; D497-T500 PolarHBondContact OD1-OG1 3.19Å; D497-T500 WeakPolarHBondContact OD2-CB 3.44Å; D497-T500 PolarHBondContact OD2-OG1 2.92Å; T500-I502 PolarHBondContact O-N 3.09Å; T500-K536 WeakPolarHBondContact O-CE 3.36Å; T500-K536 PolarHBondContact O-NZ 3.38Å
501	P	92.5	Very high	92.8	Very high	111 Å²	111	69.8 Å²	69.8	72%	0.721	38%	0.38	S	S	*	.			trans	-58.3	132.9	-179.6	-26.7	35.2	0	0	0	112.9	D499 D505	D499-P501 WeakPolarHBondContact O-CD 3.21Å; P501-D505 WeakPolarHBondContact CA-OD2 3.49Å
502	I	91.1	Very high	92.8	Very high	37 Å²	37	67.7 Å²	67.7	19%	0.19	36%	0.362	C	S	.	.			trans	-121.7	154.9	177.3	58.9	173.1	0	0	0	111.4	T500 T504 D505 K536 V539 V540	T500-I502 PolarHBondContact O-N 3.09Å; I502-T504 WeakPolarHBondContact CD1-OG1 3.36Å; I502-T504 WeakPolarHBondContact CG1-OG1 3.42Å; I502-T504 PolarHBondContact O-N 3.01Å; I502-D505 WeakPolarHBondContact CG1-OD1 3.33Å; I502-D505 PolarHBondContact N-OD2 3Å; I502-D505 WeakPolarHBondContact O-CB 3.38Å; I502-D505 PolarHBondContact O-N 3.43Å; I502-K536 HydrophobicContact CD1-CD 4.4Å; I502-K536 HydrophobicContact CD1-CG 3.98Å; I502-K536 HydrophobicContact CG1-CD 4.49Å; I502-V539 HydrophobicContact CD1-CG1 4.14Å; I502-V540 HydrophobicContact CD1-CG2 4.27Å
503	P	89.4	Confident	92.6	Very high	134 Å²	134	62.8 Å²	62.8	87%	0.87	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-26.3	-176.6	-27.2	35.5	0	0	0	114.9
504	T	91.1	Very high	92.3	Very high	31 Å²	31	68.7 Å²	68.7	19%	0.19	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-12.2	179.4	52.8	0	0	0	0	113.8	I502 R506 Q507 I508	I502-T504 WeakPolarHBondContact CD1-OG1 3.36Å; I502-T504 WeakPolarHBondContact CG1-OG1 3.42Å; I502-T504 PolarHBondContact O-N 3.01Å; T504-R506 VanDerWaalsContact C-N 3.27Å; T504-R506 PolarHBondContact O-N 3.15Å; T504-Q507 PolarHBondContact O-N 3.28Å; T504-I508 WeakPolarHBondContact O-CG1 3.44Å; T504-I508 PolarHBondContact O-N 2.97Å; T504-I508 VanDerWaalsContact O-N 3.07Å
505	D	91.9	Very high	92.1	Very high	21 Å²	21	64.8 Å²	64.8	11%	0.112	35%	0.345	C	S	.	.	H	α-helix	trans	-56.9	-41.7	-175.8	-78.2	-16.6	0	0	0	111.5	P501 I502 Q507 I508 E509 K536	P501-D505 WeakPolarHBondContact CA-OD2 3.49Å; I502-D505 WeakPolarHBondContact CG1-OD1 3.33Å; I502-D505 PolarHBondContact N-OD2 3Å; I502-D505 WeakPolarHBondContact O-CB 3.38Å; I502-D505 PolarHBondContact O-N 3.43Å; D505-Q507 VanDerWaalsContact C-N 3.29Å; D505-Q507 PolarHBondContact O-N 3.36Å; D505-I508 PolarHBondContact O-N 2.96Å; D505-E509 WeakPolarHBondContact O-CB 3.33Å; D505-E509 VanDerWaalsContact O-CG 3.27Å; D505-E509 WeakPolarHBondContact O-CG 3.29Å; D505-E509 PolarHBondContact O-N 3.08Å; D505-K536 IonicContact OD1-NZ 2.68Å; D505-K536 IonicContact OD2-NZ 2.77Å; D505-K536 PolarHBondContact OD2-NZ 3.04Å
506	R	91.9	Very high	91.8	Very high	204 Å²	204	61 Å²	61	77%	0.77	32%	0.316	S	S	*	.	H	α-helix	trans	-59.5	-38.8	177.6	-174.9	179.1	179.6	-177.4	0.6	112.7	T504 V510	T504-R506 VanDerWaalsContact C-N 3.27Å; T504-R506 PolarHBondContact O-N 3.15Å; R506-V510 WeakPolarHBondContact O-CG2 3.34Å; R506-V510 PolarHBondContact O-N 3.27Å
507	Q	93.6	Very high	91.6	Very high	81 Å²	81	65 Å²	65	38%	0.379	33%	0.333	S	S	.	.	H	α-helix	trans	-71.5	-44.9	179.2	-174.5	64.3	45	0	0	110.6	T504 D505 E509 V510 D511 Y547	T504-Q507 PolarHBondContact O-N 3.28Å; D505-Q507 VanDerWaalsContact C-N 3.29Å; D505-Q507 PolarHBondContact O-N 3.36Å; Q507-E509 VanDerWaalsContact C-N 3.26Å; Q507-E509 PolarHBondContact O-N 2.83Å; Q507-V510 PolarHBondContact O-N 3.18Å; Q507-V510 VanDerWaalsContact O-N 3.1Å; Q507-D511 VanDerWaalsContact NE2-CG 3.33Å; Q507-D511 PolarHBondContact NE2-OD1 3.15Å; Q507-D511 PolarHBondContact NE2-OD2 3.28Å; Q507-D511 VanDerWaalsContact NE2-OD2 3.13Å; Q507-D511 PolarHBondContact O-N 2.9Å; Q507-Y547 HydrophobicContact CB-CD1 4.32Å; Q507-Y547 HydrophobicContact CB-CE1 4.31Å; Q507-Y547 HydrophobicContact CG-CD1 3.84Å; Q507-Y547 HydrophobicContact CG-CE1 3.55Å
508	I	93.6	Very high	91.5	Very high	0 Å²	0	68 Å²	68	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-56	-42.8	176.3	-67.8	170.4	0	0	0	110.6	T504 D505 V510 D511 I512 R532 L535 Y547	T504-I508 WeakPolarHBondContact O-CG1 3.44Å; T504-I508 PolarHBondContact O-N 2.97Å; T504-I508 VanDerWaalsContact O-N 3.07Å; D505-I508 PolarHBondContact O-N 2.96Å; I508-V510 VanDerWaalsContact C-N 3.3Å; I508-V510 PolarHBondContact O-N 3.04Å; I508-D511 PolarHBondContact O-N 3.25Å; I508-I512 HydrophobicContact CG2-CD1 3.4Å; I508-I512 HydrophobicContact CG2-CG1 4.16Å; I508-I512 WeakPolarHBondContact O-CD1 3.4Å; I508-I512 VanDerWaalsContact O-CG1 3.26Å; I508-I512 WeakPolarHBondContact O-CG1 3.22Å; I508-I512 PolarHBondContact O-N 3.32Å; I508-I512 VanDerWaalsContact O-N 3.11Å; I508-R532 HydrophobicContact CG2-CB 4.48Å; I508-R532 HydrophobicContact CG2-CG 4.36Å; I508-L535 HydrophobicContact CD1-CB 4.4Å; I508-L535 HydrophobicContact CG2-CD1 4.17Å; I508-Y547 HydrophobicContact CD1-CD2 4.18Å; I508-Y547 HydrophobicContact CG1-CD1 4.47Å; I508-Y547 HydrophobicContact CG1-CD2 3.74Å; I508-Y547 HydrophobicContact CG1-CE1 4.47Å; I508-Y547 HydrophobicContact CG1-CE2 3.71Å; I508-Y547 HydrophobicContact CG1-CG 4.12Å
509	E	90.6	Very high	91.5	Very high	88 Å²	88	68.1 Å²	68.1	41%	0.411	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-29.3	178.7	-75.6	-176.5	154.9	0	0	114.6	D505 Q507 P513 R532	D505-E509 WeakPolarHBondContact O-CB 3.33Å; D505-E509 VanDerWaalsContact O-CG 3.27Å; D505-E509 WeakPolarHBondContact O-CG 3.29Å; D505-E509 PolarHBondContact O-N 3.08Å; Q507-E509 VanDerWaalsContact C-N 3.26Å; Q507-E509 PolarHBondContact O-N 2.83Å; E509-P513 WeakPolarHBondContact O-CD 3.32Å; E509-P513 WeakPolarHBondContact O-CG 3.33Å; E509-R532 VanDerWaalsContact CG-NH2 3.35Å; E509-R532 IonicContact OE1-CZ 2.96Å; E509-R532 IonicContact OE1-NH1 3.5Å; E509-R532 PolarHBondContact OE1-NH1 3.05Å; E509-R532 IonicContact OE1-NH2 3.61Å; E509-R532 PolarHBondContact OE1-NH2 2.95Å
510	V	91.3	Very high	91.7	Very high	75 Å²	75	65 Å²	65	46%	0.455	32%	0.324	S	S	.	.	H	α-helix	trans	-86	-30.8	179.4	174.2	0	0	0	0	111.4	R506 Q507 I508 R514	R506-V510 WeakPolarHBondContact O-CG2 3.34Å; R506-V510 PolarHBondContact O-N 3.27Å; Q507-V510 PolarHBondContact O-N 3.18Å; Q507-V510 VanDerWaalsContact O-N 3.1Å; I508-V510 VanDerWaalsContact C-N 3.3Å; I508-V510 PolarHBondContact O-N 3.04Å; V510-R514 PolarHBondContact O-NE 3.49Å
511	D	93.6	Very high	91.7	Very high	2 Å²	2	62.5 Å²	62.5	1%	0.011	31%	0.307	C	S	.	.	H	α-helix	trans	-79.4	-46	-177.3	-69.8	-11	0	0	0	112.3	Q507 I508 R514 C515 Y547	Q507-D511 VanDerWaalsContact NE2-CG 3.33Å; Q507-D511 PolarHBondContact NE2-OD1 3.15Å; Q507-D511 PolarHBondContact NE2-OD2 3.28Å; Q507-D511 VanDerWaalsContact NE2-OD2 3.13Å; Q507-D511 PolarHBondContact O-N 2.9Å; I508-D511 PolarHBondContact O-N 3.25Å; D511-R514 PolarHBondContact O-N 2.94Å; D511-R514 IonicContact OD1-CZ 2.7Å; D511-R514 IonicContact OD1-NH2 3.87Å; D511-R514 PolarHBondContact OD1-NH2 3.34Å; D511-C515 PolarHBondContact O-N 3.44Å; D511-C515 VanDerWaalsContact O-N 3.13Å; D511-Y547 WeakPolarHBondContact CB-OH 3.26Å; D511-Y547 WeakPolarHBondContact OD2-CE1 3.4Å; D511-Y547 PolarHBondContact OD2-OH 2.99Å
512	I	93.2	Very high	91.9	Very high	6 Å²	6	57.2 Å²	57.2	3%	0.031	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-51.4	-48.8	-175.7	-72.9	168.8	0	0	0	113.4	I508 R514 C515 H528 F531 R532 L535	I508-I512 HydrophobicContact CG2-CD1 3.4Å; I508-I512 HydrophobicContact CG2-CG1 4.16Å; I508-I512 WeakPolarHBondContact O-CD1 3.4Å; I508-I512 VanDerWaalsContact O-CG1 3.26Å; I508-I512 WeakPolarHBondContact O-CG1 3.22Å; I508-I512 PolarHBondContact O-N 3.32Å; I508-I512 VanDerWaalsContact O-N 3.11Å; I512-R514 PolarHBondContact O-N 2.83Å; I512-R514 VanDerWaalsContact O-N 3.13Å; I512-C515 WeakPolarHBondContact O-CB 3.46Å; I512-C515 PolarHBondContact O-N 2.8Å; I512-C515 VanDerWaalsContact O-N 3.1Å; I512-H528 HydrophobicContact CG2-CB 3.72Å; I512-H528 WeakPolarHBondContact CG2-CD2 3.4Å; I512-F531 HydrophobicContact CD1-CB 3.58Å; I512-F531 HydrophobicContact CG1-CB 3.82Å; I512-F531 HydrophobicContact CG1-CG 4.35Å; I512-F531 HydrophobicContact CG2-CB 4.16Å; I512-F531 HydrophobicContact CG2-CD2 4.26Å; I512-F531 HydrophobicContact CG2-CG 4.48Å; I512-R532 HydrophobicContact CD1-CB 3.98Å; I512-L535 HydrophobicContact CD1-CD1 4.33Å; I512-L535 HydrophobicContact CG1-CD1 4.31Å
513	P	89.4	Confident	92	Very high	24 Å²	24	56.2 Å²	56.2	16%	0.156	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-66.1	-16.7	-178.1	-23.1	35.7	0	0	0	114.6	L29 E509	L29-P513 HydrophobicContact CD1-CB 3.58Å; E509-P513 WeakPolarHBondContact O-CD 3.32Å; E509-P513 WeakPolarHBondContact O-CG 3.33Å
514	R	89.1	Confident	92.2	Very high	127 Å²	127	49.8 Å²	49.8	48%	0.479	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-95.6	-17.8	178	-58.4	-177.9	-70.6	162.6	4.3	111.9	V510 D511 I512	V510-R514 PolarHBondContact O-NE 3.49Å; D511-R514 PolarHBondContact O-N 2.94Å; D511-R514 IonicContact OD1-CZ 2.7Å; D511-R514 IonicContact OD1-NH2 3.87Å; D511-R514 PolarHBondContact OD1-NH2 3.34Å; I512-R514 PolarHBondContact O-N 2.83Å; I512-R514 VanDerWaalsContact O-N 3.13Å
515	C	90.7	Very high	92.3	Very high	6 Å²	6	50.1 Å²	50.1	4%	0.041	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	120.2	-177.9	-171.6	0	0	0	0	111	D511 I512 Q517 D552	D511-C515 PolarHBondContact O-N 3.44Å; D511-C515 VanDerWaalsContact O-N 3.13Å; I512-C515 WeakPolarHBondContact O-CB 3.46Å; I512-C515 PolarHBondContact O-N 2.8Å; I512-C515 VanDerWaalsContact O-N 3.1Å; C515-Q517 PolarHBondContact O-N 3.36Å; C515-Q517 VanDerWaalsContact O-N 3.1Å; C515-D552 HydrophobicContact CB-CB 4.46Å; C515-D552 WeakPolarHBondContact CB-OD2 3.3Å
516	H	90.2	Very high	92.5	Very high	19 Å²	19	51.1 Å²	51.1	9%	0.088	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	47	41.4	177.5	-62.7	-75.5	0	0	0	114.5	Y518 D519 L522 A556 T635	H516-Y518 HydrophobicContact CB-CE1 4.2Å; H516-Y518 AromaticContact ND1-CE1 3.62Å; H516-Y518 AromaticContact ND1-CZ 3.55Å; H516-Y518 PolarHBondContact ND1-OH 2.87Å; H516-Y518 PolarHBondContact O-N 2.85Å; H516-D519 WeakPolarHBondContact O-CB 3.47Å; H516-D519 PolarHBondContact O-N 3.07Å; H516-L522 HydrophobicContact CB-CD1 4.08Å; H516-A556 WeakPolarHBondContact CD2-CB 3.39Å; H516-T635 PolarHBondContact CE1-O 3.49Å; H516-T635 VanDerWaalsContact CE1-O 3.24Å
517	Q	90	Very high	92.7	Very high	102 Å²	102	41.4 Å²	41.4	48%	0.477	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.4	-175.1	-160.5	-175.1	-0.1	0	0	114.2	C515 D519	C515-Q517 PolarHBondContact O-N 3.36Å; C515-Q517 VanDerWaalsContact O-N 3.1Å; Q517-D519 VanDerWaalsContact C-N 3.26Å; Q517-D519 PolarHBondContact O-N 3.2Å
518	Y	91.5	Very high	92.8	Very high	131 Å²	131	39.8 Å²	39.8	51%	0.514	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-17.7	174.9	65.8	-100.8	0	0	0	113.4	H516 P639 L640	H516-Y518 HydrophobicContact CB-CE1 4.2Å; H516-Y518 AromaticContact ND1-CE1 3.62Å; H516-Y518 AromaticContact ND1-CZ 3.55Å; H516-Y518 PolarHBondContact ND1-OH 2.87Å; H516-Y518 PolarHBondContact O-N 2.85Å; Y518-P639 WeakPolarHBondContact OH-CA 3.46Å; Y518-L640 PolarHBondContact OH-N 3.38Å
519	D	94.1	Very high	92.9	Very high	24 Å²	24	44.1 Å²	44.1	13%	0.128	21%	0.212	C	C	.	.			trans	-91.8	118	-178.4	-174.2	-89.1	0	0	0	110.2	H516 Q517 L521 L522 S523 Y560	H516-D519 WeakPolarHBondContact O-CB 3.47Å; H516-D519 PolarHBondContact O-N 3.07Å; Q517-D519 VanDerWaalsContact C-N 3.26Å; Q517-D519 PolarHBondContact O-N 3.2Å; D519-L521 VanDerWaalsContact C-N 3.27Å; D519-L521 PolarHBondContact O-N 3.39Å; D519-L521 WeakPolarHBondContact OD1-CB 3.37Å; D519-L521 PolarHBondContact OD1-N 3.12Å; D519-L521 VanDerWaalsContact OD1-N 3.16Å; D519-L522 HydrophobicContact CB-CB 4.25Å; D519-L522 WeakPolarHBondContact OD1-CG 3.46Å; D519-L522 PolarHBondContact OD1-N 2.85Å; D519-S523 VanDerWaalsContact O-CB 3.24Å; D519-S523 WeakPolarHBondContact O-CB 3.37Å; D519-S523 PolarHBondContact O-N 2.76Å; D519-S523 PolarHBondContact O-OG 2.85Å; D519-Y560 WeakPolarHBondContact OD2-CE2 3.45Å
520	E	93.4	Very high	93.2	Very high	66 Å²	66	41.3 Å²	41.3	31%	0.308	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-34	-175	-61.5	-172.6	152	0	0	112.4	I36 R61 S523 S524	I36-E520 HydrophobicContact CD1-CB 4.34Å; I36-E520 HydrophobicContact CD1-CG 4.2Å; I36-E520 HydrophobicContact CG1-CB 4.41Å; I36-E520 VanDerWaalsContact CG2-O 3.3Å; I36-E520 WeakPolarHBondContact CG2-O 3.19Å; R61-E520 WeakPolarHBondContact CD-OE1 3.41Å; R61-E520 IonicContact CZ-OE1 3.62Å; R61-E520 IonicContact NH1-OE1 2.97Å; R61-E520 PolarHBondContact NH1-OE1 3.2Å; E520-S523 WeakPolarHBondContact CA-OG 3.43Å; E520-S523 PolarHBondContact O-OG 2.99Å; E520-S524 PolarHBondContact O-N 3.37Å
521	L	94.3	Very high	93.4	Very high	23 Å²	23	37.8 Å²	37.8	12%	0.12	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-48.7	-177.7	177.1	60.1	0	0	0	111.3	L39 Q43 D519 S524 Y560 F563	L39-L521 HydrophobicContact CD2-CB 4.09Å; L39-L521 HydrophobicContact CD2-CD1 3.92Å; Q43-L521 HydrophobicContact CG-CD1 3.58Å; D519-L521 VanDerWaalsContact C-N 3.27Å; D519-L521 PolarHBondContact O-N 3.39Å; D519-L521 WeakPolarHBondContact OD1-CB 3.37Å; D519-L521 PolarHBondContact OD1-N 3.12Å; D519-L521 VanDerWaalsContact OD1-N 3.16Å; L521-S524 WeakPolarHBondContact O-CB 3.38Å; L521-S524 PolarHBondContact O-N 2.76Å; L521-S524 PolarHBondContact O-OG 2.9Å; L521-Y560 HydrophobicContact CD2-CD2 4.29Å; L521-Y560 HydrophobicContact CD2-CE2 4.29Å; L521-F563 HydrophobicContact CD1-CD1 4.11Å; L521-F563 HydrophobicContact CD1-CD2 3.94Å; L521-F563 HydrophobicContact CD1-CE1 3.81Å; L521-F563 HydrophobicContact CD1-CE2 3.6Å; L521-F563 HydrophobicContact CD1-CG 4.17Å; L521-F563 HydrophobicContact CD1-CZ 3.53Å; L521-F563 HydrophobicContact CD2-CB 4.32Å; L521-F563 HydrophobicContact CD2-CD2 3.89Å; L521-F563 HydrophobicContact CD2-CE2 4.33Å; L521-F563 HydrophobicContact CD2-CG 4.06Å; L521-F563 HydrophobicContact CG-CD2 3.78Å; L521-F563 HydrophobicContact CG-CE2 3.71Å; L521-F563 HydrophobicContact CG-CG 4.29Å; L521-F563 HydrophobicContact CG-CZ 4.18Å
522	L	95.1	Very high	93.5	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-32.9	-179	-68.9	-173.6	0	0	0	113.1	H516 D519 S524 H528 F531 A556 L559 Y560 L640	H516-L522 HydrophobicContact CB-CD1 4.08Å; D519-L522 HydrophobicContact CB-CB 4.25Å; D519-L522 WeakPolarHBondContact OD1-CG 3.46Å; D519-L522 PolarHBondContact OD1-N 2.85Å; L522-S524 VanDerWaalsContact C-N 3.25Å; L522-S524 PolarHBondContact O-N 3.13Å; L522-H528 PolarHBondContact O-CD2 3.07Å; L522-F531 HydrophobicContact CB-CE2 4.02Å; L522-F531 HydrophobicContact CD1-CE2 4.29Å; L522-F531 HydrophobicContact CD1-CZ 4.12Å; L522-F531 HydrophobicContact CD2-CE2 3.78Å; L522-F531 HydrophobicContact CD2-CZ 4.06Å; L522-F531 HydrophobicContact CG-CE2 4.24Å; L522-A556 HydrophobicContact CD1-CB 3.98Å; L522-L559 HydrophobicContact CD2-CD2 4.37Å; L522-L559 HydrophobicContact CD2-CG 4.37Å; L522-Y560 HydrophobicContact CD1-CD2 4.45Å; L522-Y560 HydrophobicContact CG-CD2 4.2Å; L522-L640 HydrophobicContact CD1-CD1 3.69Å
523	S	93.4	Very high	93.7	Very high	15 Å²	15	46 Å²	46	11%	0.105	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-6.8	175.8	62.8	0	0	0	0	114.1	D519 E520 H528	D519-S523 VanDerWaalsContact O-CB 3.24Å; D519-S523 WeakPolarHBondContact O-CB 3.37Å; D519-S523 PolarHBondContact O-N 2.76Å; D519-S523 PolarHBondContact O-OG 2.85Å; E520-S523 WeakPolarHBondContact CA-OG 3.43Å; E520-S523 PolarHBondContact O-OG 2.99Å; S523-H528 PolarHBondContact O-CE1 2.98Å; S523-H528 PolarHBondContact O-NE2 3.32Å
524	S	94.2	Very high	94.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-67.5	153.2	174.6	75.2	0	0	0	0	111.5	E520 L521 L522 Q526 G527 H528	E520-S524 PolarHBondContact O-N 3.37Å; L521-S524 WeakPolarHBondContact O-CB 3.38Å; L521-S524 PolarHBondContact O-N 2.76Å; L521-S524 PolarHBondContact O-OG 2.9Å; L522-S524 VanDerWaalsContact C-N 3.25Å; L522-S524 PolarHBondContact O-N 3.13Å; S524-Q526 PolarHBondContact O-N 3.07Å; S524-G527 WeakPolarHBondContact O-CA 3.28Å; S524-G527 PolarHBondContact O-N 3.06Å; S524-G527 PolarHBondContact OG-N 2.88Å; S524-H528 PolarHBondContact O-N 3.24Å
525	P	93.8	Very high	94.5	Very high	38 Å²	38	38.8 Å²	38.8	25%	0.247	18%	0.177	C	C	.	.	H	α-helix	trans	-56.9	-35.6	176.4	-23.9	34.4	0	0	0	112.8	K37 H528 I529	K37-P525 HydrophobicContact CB-CG 4.5Å; K37-P525 HydrophobicContact CG-CG 3.93Å; P525-H528 PolarHBondContact O-N 2.99Å; P525-I529 VanDerWaalsContact O-CG1 3.29Å; P525-I529 WeakPolarHBondContact O-CG1 3.27Å; P525-I529 PolarHBondContact O-N 3.44Å
526	Q	95.5	Very high	94.8	Very high	41 Å²	41	38.9 Å²	38.9	19%	0.192	18%	0.177	C	C	.	.	H	α-helix	trans	-66	-40.7	175.7	-79	61.8	31.1	0	0	111.1	R41 S524 I529 K530 F563	R41-Q526 HydrophobicContact CG-CG 4.23Å; R41-Q526 VanDerWaalsContact CG-NE2 3.32Å; S524-Q526 PolarHBondContact O-N 3.07Å; Q526-I529 PolarHBondContact O-N 3.03Å; Q526-K530 WeakPolarHBondContact O-CB 3.39Å; Q526-K530 VanDerWaalsContact O-CG 3.24Å; Q526-K530 WeakPolarHBondContact O-CG 3.24Å; Q526-K530 PolarHBondContact O-N 3.42Å; Q526-F563 HydrophobicContact CB-CZ 4.26Å
527	G	96.3	Very high	95.1	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58	-47.4	170.8	0	0	0	0	0	111.7	S524 I529 K530 F531	S524-G527 WeakPolarHBondContact O-CA 3.28Å; S524-G527 PolarHBondContact O-N 3.06Å; S524-G527 PolarHBondContact OG-N 2.88Å; G527-I529 PolarHBondContact O-N 3.4Å; G527-K530 PolarHBondContact O-N 3.3Å; G527-F531 WeakPolarHBondContact O-CD2 3.46Å; G527-F531 PolarHBondContact O-N 3.41Å
528	H	95.4	Very high	95.4	Very high	47 Å²	47	33.2 Å²	33.2	22%	0.218	15%	0.15	C	C	.	.	H	α-helix	trans	-61.6	-43.1	178.1	-63.2	173.4	0	0	0	113.3	I512 L522 S523 S524 P525 K530 F531 R532	I512-H528 HydrophobicContact CG2-CB 3.72Å; I512-H528 WeakPolarHBondContact CG2-CD2 3.4Å; L522-H528 PolarHBondContact O-CD2 3.07Å; S523-H528 PolarHBondContact O-CE1 2.98Å; S523-H528 PolarHBondContact O-NE2 3.32Å; S524-H528 PolarHBondContact O-N 3.24Å; P525-H528 PolarHBondContact O-N 2.99Å; H528-K530 VanDerWaalsContact C-N 3.33Å; H528-K530 PolarHBondContact O-N 2.97Å; H528-F531 PolarHBondContact O-N 3.5Å; H528-R532 WeakPolarHBondContact O-CB 3.04Å; H528-R532 PolarHBondContact O-N 3.26Å
529	I	95.6	Very high	95.6	Very high	92 Å²	92	27.8 Å²	27.8	47%	0.472	13%	0.131	S	C	.	.	H	α-helix	trans	-60.9	-44.5	176.4	-69.9	163.4	0	0	0	110.3	P525 Q526 G527 R532 R533	P525-I529 VanDerWaalsContact O-CG1 3.29Å; P525-I529 WeakPolarHBondContact O-CG1 3.27Å; P525-I529 PolarHBondContact O-N 3.44Å; Q526-I529 PolarHBondContact O-N 3.03Å; G527-I529 PolarHBondContact O-N 3.4Å; I529-R532 PolarHBondContact O-N 2.8Å; I529-R533 WeakPolarHBondContact O-CG 3.41Å; I529-R533 PolarHBondContact O-N 2.81Å
530	K	97	Very high	95.6	Very high	29 Å²	29	29.3 Å²	29.3	13%	0.126	14%	0.141	C	C	.	.	H	α-helix	trans	-68.3	-42.2	-179.7	-70.8	174.5	171.1	-75.1	0	112.5	Q526 G527 H528 R532 R533 V534 L559 F563 E566	Q526-K530 WeakPolarHBondContact O-CB 3.39Å; Q526-K530 VanDerWaalsContact O-CG 3.24Å; Q526-K530 WeakPolarHBondContact O-CG 3.24Å; Q526-K530 PolarHBondContact O-N 3.42Å; G527-K530 PolarHBondContact O-N 3.3Å; H528-K530 VanDerWaalsContact C-N 3.33Å; H528-K530 PolarHBondContact O-N 2.97Å; K530-R532 VanDerWaalsContact C-N 3.34Å; K530-R532 PolarHBondContact O-N 3.19Å; K530-R533 PolarHBondContact O-N 3.47Å; K530-V534 WeakPolarHBondContact O-CG2 3.46Å; K530-V534 PolarHBondContact O-N 3.44Å; K530-L559 HydrophobicContact CB-CD1 3.86Å; K530-L559 HydrophobicContact CB-CD2 4.08Å; K530-F563 HydrophobicContact CD-CD1 4.02Å; K530-F563 HydrophobicContact CD-CD2 4.29Å; K530-F563 HydrophobicContact CD-CE1 3.72Å; K530-F563 HydrophobicContact CD-CE2 4.03Å; K530-F563 HydrophobicContact CD-CG 4.3Å; K530-F563 HydrophobicContact CD-CZ 3.74Å; K530-F563 WeakPolarHBondContact CD-O 3.25Å; K530-F563 VanDerWaalsContact CE-O 3.27Å; K530-F563 WeakPolarHBondContact CE-O 3.37Å; K530-F563 PolarHBondContact NZ-O 3.22Å; K530-E566 HydrophobicContact CB-CG 4.36Å; K530-E566 HydrophobicContact CG-CG 4.13Å; K530-E566 IonicContact NZ-OE1 2.89Å; K530-E566 PolarHBondContact NZ-OE1 2.83Å
531	F	96.1	Very high	95.6	Very high	1 Å²	1	28.1 Å²	28.1	0%	0.004	14%	0.14	C	C	.	.	H	α-helix	trans	-53.8	-52.7	171.9	-95.4	-65.1	0	0	0	111.2	I512 L522 G527 H528 R533 V534 L535 D552 C555 A556 L559	I512-F531 HydrophobicContact CD1-CB 3.58Å; I512-F531 HydrophobicContact CG1-CB 3.82Å; I512-F531 HydrophobicContact CG1-CG 4.35Å; I512-F531 HydrophobicContact CG2-CB 4.16Å; I512-F531 HydrophobicContact CG2-CD2 4.26Å; I512-F531 HydrophobicContact CG2-CG 4.48Å; L522-F531 HydrophobicContact CB-CE2 4.02Å; L522-F531 HydrophobicContact CD1-CE2 4.29Å; L522-F531 HydrophobicContact CD1-CZ 4.12Å; L522-F531 HydrophobicContact CD2-CE2 3.78Å; L522-F531 HydrophobicContact CD2-CZ 4.06Å; L522-F531 HydrophobicContact CG-CE2 4.24Å; G527-F531 WeakPolarHBondContact O-CD2 3.46Å; G527-F531 PolarHBondContact O-N 3.41Å; H528-F531 PolarHBondContact O-N 3.5Å; F531-R533 VanDerWaalsContact C-N 3.31Å; F531-R533 PolarHBondContact O-N 3.37Å; F531-V534 PolarHBondContact O-N 3.39Å; F531-L535 HydrophobicContact CD1-CD1 4.37Å; F531-L535 VanDerWaalsContact O-CB 3.31Å; F531-L535 WeakPolarHBondContact O-CB 3.28Å; F531-L535 VanDerWaalsContact O-CG 3.26Å; F531-L535 WeakPolarHBondContact O-CG 3.47Å; F531-L535 PolarHBondContact O-N 3.41Å; F531-D552 WeakPolarHBondContact CE1-O 3.25Å; F531-C555 HydrophobicContact CD1-CB 4.26Å; F531-C555 HydrophobicContact CE1-CB 4.07Å; F531-A556 HydrophobicContact CE1-CB 3.98Å; F531-A556 HydrophobicContact CZ-CB 3.66Å; F531-L559 HydrophobicContact CB-CD2 4.17Å; F531-L559 HydrophobicContact CD1-CD2 3.74Å; F531-L559 HydrophobicContact CD2-CD2 3.67Å; F531-L559 HydrophobicContact CE1-CD2 4.02Å; F531-L559 HydrophobicContact CE2-CD2 3.96Å; F531-L559 HydrophobicContact CG-CD2 3.55Å; F531-L559 HydrophobicContact CZ-CD2 4.12Å
532	R	96.1	Very high	95.6	Very high	95 Å²	95	29.4 Å²	29.4	36%	0.358	15%	0.145	S	C	.	.	H	α-helix	trans	-55.2	-48.5	179.7	-177.1	-163.8	-64.5	-123.5	-0.7	110.9	I508 E509 I512 H528 I529 K530 K536	I508-R532 HydrophobicContact CG2-CB 4.48Å; I508-R532 HydrophobicContact CG2-CG 4.36Å; E509-R532 VanDerWaalsContact CG-NH2 3.35Å; E509-R532 IonicContact OE1-CZ 2.96Å; E509-R532 IonicContact OE1-NH1 3.5Å; E509-R532 PolarHBondContact OE1-NH1 3.05Å; E509-R532 IonicContact OE1-NH2 3.61Å; E509-R532 PolarHBondContact OE1-NH2 2.95Å; I512-R532 HydrophobicContact CD1-CB 3.98Å; H528-R532 WeakPolarHBondContact O-CB 3.04Å; H528-R532 PolarHBondContact O-N 3.26Å; I529-R532 PolarHBondContact O-N 2.8Å; K530-R532 VanDerWaalsContact C-N 3.34Å; K530-R532 PolarHBondContact O-N 3.19Å; R532-K536 WeakPolarHBondContact O-CB 3.41Å; R532-K536 PolarHBondContact O-N 3.03Å
533	R	97	Very high	95.4	Very high	85 Å²	85	34.5 Å²	34.5	32%	0.321	18%	0.179	S	C	.	.	H	α-helix	trans	-63.6	-44.9	-178.9	-73.3	169.8	59.3	112.2	1.8	112.6	Y493 K498 I529 K530 F531 A537 E566	Y493-R533 WeakPolarHBondContact OH-CB 3.24Å; K498-R533 HydrophobicContact CD-CB 4.39Å; I529-R533 WeakPolarHBondContact O-CG 3.41Å; I529-R533 PolarHBondContact O-N 2.81Å; K530-R533 PolarHBondContact O-N 3.47Å; F531-R533 VanDerWaalsContact C-N 3.31Å; F531-R533 PolarHBondContact O-N 3.37Å; R533-A537 VanDerWaalsContact O-CB 3.24Å; R533-A537 WeakPolarHBondContact O-CB 3.34Å; R533-A537 PolarHBondContact O-N 3.27Å; R533-E566 IonicContact CZ-OE2 3.36Å; R533-E566 IonicContact NE-OE2 3.59Å; R533-E566 PolarHBondContact NE-OE2 2.93Å; R533-E566 IonicContact NH2-OE2 2.71Å
534	V	97.8	Very high	95.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-67.9	-46.1	179.5	173.8	0	0	0	0	111.6	K530 F531 A537 W538 E566 M573	K530-V534 WeakPolarHBondContact O-CG2 3.46Å; K530-V534 PolarHBondContact O-N 3.44Å; F531-V534 PolarHBondContact O-N 3.39Å; V534-A537 PolarHBondContact O-N 3.16Å; V534-W538 PolarHBondContact O-N 3.38Å; V534-E566 HydrophobicContact CG2-CB 4.07Å; V534-E566 HydrophobicContact CG2-CG 4.19Å; V534-M573 HydrophobicContact CG1-CE 4.22Å
535	L	97.3	Very high	95.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.2	-45.2	178	-70.9	169.2	0	0	0	111.4	I508 I512 F531 W538 V539 Y547 L551 D552 C555	I508-L535 HydrophobicContact CD1-CB 4.4Å; I508-L535 HydrophobicContact CG2-CD1 4.17Å; I512-L535 HydrophobicContact CD1-CD1 4.33Å; I512-L535 HydrophobicContact CG1-CD1 4.31Å; F531-L535 HydrophobicContact CD1-CD1 4.37Å; F531-L535 VanDerWaalsContact O-CB 3.31Å; F531-L535 WeakPolarHBondContact O-CB 3.28Å; F531-L535 VanDerWaalsContact O-CG 3.26Å; F531-L535 WeakPolarHBondContact O-CG 3.47Å; F531-L535 PolarHBondContact O-N 3.41Å; L535-W538 WeakPolarHBondContact O-CB 3.49Å; L535-W538 PolarHBondContact O-N 3.38Å; L535-V539 WeakPolarHBondContact O-CG2 3.48Å; L535-V539 PolarHBondContact O-N 3.26Å; L535-Y547 HydrophobicContact CD1-CE2 4.3Å; L535-Y547 HydrophobicContact CD2-CE2 4.39Å; L535-L551 HydrophobicContact CD2-CB 4.48Å; L535-L551 HydrophobicContact CD2-CD2 4.11Å; L535-L551 HydrophobicContact CD2-CG 3.74Å; L535-D552 HydrophobicContact CD1-CB 4.09Å; L535-C555 HydrophobicContact CD2-CB 3.82Å; L535-C555 HydrophobicContact CG-CB 4.41Å
536	K	95.8	Very high	95.3	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.035	22%	0.216	C	C	.	.	H	α-helix	trans	-64.2	-44.9	178.1	-174.2	160.7	176.5	172.8	0	111.9	K498 D499 T500 I502 D505 R532 W538 V539 V540	K498-K536 WeakPolarHBondContact O-CD 3.27Å; K498-K536 WeakPolarHBondContact O-CE 3.15Å; K498-K536 PolarHBondContact O-NZ 2.87Å; D499-K536 PolarHBondContact O-NZ 3.06Å; T500-K536 WeakPolarHBondContact O-CE 3.36Å; T500-K536 PolarHBondContact O-NZ 3.38Å; I502-K536 HydrophobicContact CD1-CD 4.4Å; I502-K536 HydrophobicContact CD1-CG 3.98Å; I502-K536 HydrophobicContact CG1-CD 4.49Å; D505-K536 IonicContact OD1-NZ 2.68Å; D505-K536 IonicContact OD2-NZ 2.77Å; D505-K536 PolarHBondContact OD2-NZ 3.04Å; R532-K536 WeakPolarHBondContact O-CB 3.41Å; R532-K536 PolarHBondContact O-N 3.03Å; K536-W538 PolarHBondContact O-N 3.47Å; K536-V539 PolarHBondContact O-N 2.97Å; K536-V540 HydrophobicContact CG-CG2 4.23Å; K536-V540 WeakPolarHBondContact O-CB 3.47Å; K536-V540 VanDerWaalsContact O-CG2 3.29Å; K536-V540 WeakPolarHBondContact O-CG2 3.41Å; K536-V540 PolarHBondContact O-N 3.27Å
537	A	96.8	Very high	95.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-55.9	-40.1	173.6	0	0	0	0	0	111.5	Y493 T496 K498 R533 V534 S541 Y570	Y493-A537 HydrophobicContact CD2-CB 4.16Å; Y493-A537 HydrophobicContact CE2-CB 3.62Å; T496-A537 HydrophobicContact CG2-CB 3.98Å; T496-A537 WeakPolarHBondContact CG2-O 3.05Å; K498-A537 HydrophobicContact CD-CB 4.3Å; K498-A537 HydrophobicContact CG-CB 4.06Å; R533-A537 VanDerWaalsContact O-CB 3.24Å; R533-A537 WeakPolarHBondContact O-CB 3.34Å; R533-A537 PolarHBondContact O-N 3.27Å; V534-A537 PolarHBondContact O-N 3.16Å; A537-S541 VanDerWaalsContact O-CB 3.29Å; A537-S541 WeakPolarHBondContact O-CB 3.39Å; A537-S541 PolarHBondContact O-N 3.47Å; A537-S541 PolarHBondContact O-OG 3.47Å; A537-Y570 HydrophobicContact CB-CD2 3.98Å; A537-Y570 HydrophobicContact CB-CE2 4.07Å
538	W	96.6	Very high	95.2	Very high	1 Å²	1	45.3 Å²	45.3	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-66.9	-49.8	176.7	-169.6	86.4	0	0	0	113.4	V534 L535 K536 V540 S541 H542 L545 L551 Y570 M573 I577 F585	V534-W538 PolarHBondContact O-N 3.38Å; L535-W538 WeakPolarHBondContact O-CB 3.49Å; L535-W538 PolarHBondContact O-N 3.38Å; K536-W538 PolarHBondContact O-N 3.47Å; W538-V540 VanDerWaalsContact C-N 3.34Å; W538-V540 PolarHBondContact O-N 3.35Å; W538-S541 PolarHBondContact O-N 3.12Å; W538-S541 PolarHBondContact O-OG 3.06Å; W538-S541 VanDerWaalsContact O-OG 3.05Å; W538-H542 AromaticContact CD1-CE1 3.58Å; W538-H542 AromaticContact CD1-ND1 3.76Å; W538-H542 AromaticContact CD2-ND1 3.99Å; W538-H542 AromaticContact CE2-CE1 3.97Å; W538-H542 AromaticContact CE2-ND1 3.77Å; W538-H542 AromaticContact CG-ND1 3.98Å; W538-H542 AromaticContact NE1-CE1 3.37Å; W538-H542 PolarHBondContact NE1-CE1 2.98Å; W538-H542 AromaticContact NE1-ND1 3.61Å; W538-H542 AromaticContact NE1-NE2 3.96Å; W538-H542 PolarHBondContact O-N 3.14Å; W538-H542 PolarHBondContact O-ND1 2.88Å; W538-L545 HydrophobicContact CH2-CB 3.92Å; W538-L545 HydrophobicContact CH2-CD1 3.47Å; W538-L545 VanDerWaalsContact CH2-CD1 3.47Å; W538-L545 HydrophobicContact CH2-CG 4.33Å; W538-L545 HydrophobicContact CZ2-CD1 3.6Å; W538-L545 HydrophobicContact CZ3-CB 4.26Å; W538-L551 HydrophobicContact CE3-CD2 3.67Å; W538-L551 HydrophobicContact CZ3-CD2 3.73Å; W538-Y570 HydrophobicContact CB-CD2 4.36Å; W538-Y570 HydrophobicContact CB-CE2 4.18Å; W538-M573 HydrophobicContact CB-CE 3.29Å; W538-M573 HydrophobicContact CD2-CE 4.14Å; W538-M573 HydrophobicContact CG-CE 3.34Å; W538-I577 HydrophobicContact CD2-CD1 4.26Å; W538-I577 VanDerWaalsContact CE2-CD1 3.47Å; W538-I577 HydrophobicContact CH2-CD1 4.24Å; W538-I577 HydrophobicContact CZ2-CB 4.41Å; W538-I577 HydrophobicContact CZ2-CD1 3.49Å; W538-I577 VanDerWaalsContact CZ2-CD1 3.49Å; W538-I577 HydrophobicContact CZ2-CG2 3.89Å; W538-F585 HydrophobicContact CH2-CB 3.92Å; W538-F585 AromaticContact CH2-CD2 3.9Å; W538-F585 HydrophobicContact CH2-CD2 3.9Å; W538-F585 AromaticContact CH2-CG 3.99Å; W538-F585 HydrophobicContact CH2-CG 3.99Å; W538-F585 HydrophobicContact CZ2-CD2 4.48Å; W538-F585 HydrophobicContact CZ3-CB 4.44Å
539	V	95.3	Very high	95.1	Very high	17 Å²	17	48.7 Å²	48.7	10%	0.103	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-43.6	178.4	175.1	0	0	0	0	111.3	I502 L535 K536 S541 H542	I502-V539 HydrophobicContact CD1-CG1 4.14Å; L535-V539 WeakPolarHBondContact O-CG2 3.48Å; L535-V539 PolarHBondContact O-N 3.26Å; K536-V539 PolarHBondContact O-N 2.97Å; V539-S541 PolarHBondContact O-N 2.89Å; V539-H542 CarbonylContact O-C 3.56Å; V539-H542 PolarHBondContact O-N 2.88Å
540	V	94.7	Very high	94.9	Very high	56 Å²	56	44.5 Å²	44.5	34%	0.339	22%	0.223	S	C	.	.	H	α-helix	trans	-67	-37	-179.8	170.9	0	0	0	0	112	T496 D497 I502 K536 W538 H542	T496-V540 HydrophobicContact CG2-CB 4.3Å; T496-V540 HydrophobicContact CG2-CG1 4.14Å; D497-V540 HydrophobicContact CB-CG1 4.43Å; I502-V540 HydrophobicContact CD1-CG2 4.27Å; K536-V540 HydrophobicContact CG-CG2 4.23Å; K536-V540 WeakPolarHBondContact O-CB 3.47Å; K536-V540 VanDerWaalsContact O-CG2 3.29Å; K536-V540 WeakPolarHBondContact O-CG2 3.41Å; K536-V540 PolarHBondContact O-N 3.27Å; W538-V540 VanDerWaalsContact C-N 3.34Å; W538-V540 PolarHBondContact O-N 3.35Å; V540-H542 VanDerWaalsContact C-N 3.25Å; V540-H542 PolarHBondContact O-N 3.14Å
541	S	94.2	Very high	94.9	Very high	41 Å²	41	43.1 Å²	43.1	29%	0.287	22%	0.217	S	C	.	.	H	α-helix	trans	-76.8	-7.6	178.8	55	0	0	0	0	114.4	A537 W538 V539 Y570	A537-S541 VanDerWaalsContact O-CB 3.29Å; A537-S541 WeakPolarHBondContact O-CB 3.39Å; A537-S541 PolarHBondContact O-N 3.47Å; A537-S541 PolarHBondContact O-OG 3.47Å; W538-S541 PolarHBondContact O-N 3.12Å; W538-S541 PolarHBondContact O-OG 3.06Å; W538-S541 VanDerWaalsContact O-OG 3.05Å; V539-S541 PolarHBondContact O-N 2.89Å; S541-Y570 VanDerWaalsContact CB-OH 3.28Å; S541-Y570 WeakPolarHBondContact CB-OH 3.39Å; S541-Y570 PolarHBondContact OG-OH 3.21Å
542	H	93.6	Very high	94.9	Very high	50 Å²	50	43.4 Å²	43.4	23%	0.231	22%	0.219	C	C	.	.			trans	-130.2	75.4	-179.2	-59.2	83.5	0	0	0	110.5	W538 V539 V540 D544 L545	W538-H542 AromaticContact CD1-CE1 3.58Å; W538-H542 AromaticContact CD1-ND1 3.76Å; W538-H542 AromaticContact CD2-ND1 3.99Å; W538-H542 AromaticContact CE2-CE1 3.97Å; W538-H542 AromaticContact CE2-ND1 3.77Å; W538-H542 AromaticContact CG-ND1 3.98Å; W538-H542 AromaticContact NE1-CE1 3.37Å; W538-H542 PolarHBondContact NE1-CE1 2.98Å; W538-H542 AromaticContact NE1-ND1 3.61Å; W538-H542 AromaticContact NE1-NE2 3.96Å; W538-H542 PolarHBondContact O-N 3.14Å; W538-H542 PolarHBondContact O-ND1 2.88Å; V539-H542 CarbonylContact O-C 3.56Å; V539-H542 PolarHBondContact O-N 2.88Å; V540-H542 VanDerWaalsContact C-N 3.25Å; V540-H542 PolarHBondContact O-N 3.14Å; H542-D544 PolarHBondContact O-N 2.89Å; H542-D544 VanDerWaalsContact O-N 3.09Å; H542-L545 HydrophobicContact CB-CB 4.06Å; H542-L545 HydrophobicContact CB-CD1 3.91Å; H542-L545 HydrophobicContact CB-CG 4.06Å; H542-L545 PolarHBondContact O-N 3.06Å
543	P	91	Very high	94.9	Very high	109 Å²	109	39.1 Å²	39.1	71%	0.708	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-22	-172.1	25.7	-35.6	0	0	0	114.3	L545	P543-L545 VanDerWaalsContact C-N 3.3Å
544	D	91.5	Very high	94.9	Very high	133 Å²	133	35 Å²	35	71%	0.711	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-10.3	177.1	-59.1	-44.3	0	0	0	113.2	H542	H542-D544 PolarHBondContact O-N 2.89Å; H542-D544 VanDerWaalsContact O-N 3.09Å
545	L	94.1	Very high	95	Very high	26 Å²	26	35 Å²	35	14%	0.136	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-110.6	153.1	-178.4	-54.1	-178	0	0	0	110.6	W538 H542 P543 F585 L586	W538-L545 HydrophobicContact CH2-CB 3.92Å; W538-L545 HydrophobicContact CH2-CD1 3.47Å; W538-L545 VanDerWaalsContact CH2-CD1 3.47Å; W538-L545 HydrophobicContact CH2-CG 4.33Å; W538-L545 HydrophobicContact CZ2-CD1 3.6Å; W538-L545 HydrophobicContact CZ3-CB 4.26Å; H542-L545 HydrophobicContact CB-CB 4.06Å; H542-L545 HydrophobicContact CB-CD1 3.91Å; H542-L545 HydrophobicContact CB-CG 4.06Å; H542-L545 PolarHBondContact O-N 3.06Å; P543-L545 VanDerWaalsContact C-N 3.3Å; L545-F585 CarbonylContact C-O 3.5Å; L545-F585 WeakPolarHBondContact CA-O 3.49Å; L545-F585 HydrophobicContact CB-CB 4.2Å; L545-F585 HydrophobicContact CD2-CB 4.44Å; L545-L586 HydrophobicContact CD2-CD2 3.94Å; L545-L586 HydrophobicContact CD2-CG 4.32Å
546	V	94.1	Very high	95	Very high	48 Å²	48	35 Å²	35	29%	0.291	19%	0.188	S	C	.	.			trans	-122.8	155.7	179.3	-58.6	0	0	0	0	110.9	W548 F585 K587	V546-W548 PolarHBondContact O-N 2.73Å; V546-F585 PolarHBondContact N-O 2.67Å; V546-K587 HydrophobicContact CG1-CB 4.2Å
547	Y	95.5	Very high	95.1	Very high	19 Å²	19	34.7 Å²	34.7	8%	0.075	19%	0.186	C	C	.	.			trans	-67.6	122.5	171.5	-179.7	-87.3	0	0	0	110.1	Q507 I508 D511 L535 L551	Q507-Y547 HydrophobicContact CB-CD1 4.32Å; Q507-Y547 HydrophobicContact CB-CE1 4.31Å; Q507-Y547 HydrophobicContact CG-CD1 3.84Å; Q507-Y547 HydrophobicContact CG-CE1 3.55Å; I508-Y547 HydrophobicContact CD1-CD2 4.18Å; I508-Y547 HydrophobicContact CG1-CD1 4.47Å; I508-Y547 HydrophobicContact CG1-CD2 3.74Å; I508-Y547 HydrophobicContact CG1-CE1 4.47Å; I508-Y547 HydrophobicContact CG1-CE2 3.71Å; I508-Y547 HydrophobicContact CG1-CG 4.12Å; D511-Y547 WeakPolarHBondContact CB-OH 3.26Å; D511-Y547 WeakPolarHBondContact OD2-CE1 3.4Å; D511-Y547 PolarHBondContact OD2-OH 2.99Å; L535-Y547 HydrophobicContact CD1-CE2 4.3Å; L535-Y547 HydrophobicContact CD2-CE2 4.39Å; Y547-L551 HydrophobicContact CD2-CB 4.22Å; Y547-L551 HydrophobicContact CD2-CD2 3.79Å; Y547-L551 HydrophobicContact CD2-CG 4.46Å; Y547-L551 HydrophobicContact CE2-CB 3.99Å; Y547-L551 HydrophobicContact CE2-CD2 4.28Å; Y547-L551 HydrophobicContact CE2-CG 4.48Å
548	W	94.5	Very high	95.2	Very high	94 Å²	94	34.7 Å²	34.7	36%	0.356	19%	0.186	S	C	.	.			trans	-109.6	141.2	167.5	-78.6	82.7	0	0	0	109.7	V546 G550 L551 F585 L586 N589	V546-W548 PolarHBondContact O-N 2.73Å; W548-G550 PolarHBondContact O-N 3.22Å; W548-L551 VanDerWaalsContact O-CB 3.29Å; W548-L551 WeakPolarHBondContact O-CB 3.49Å; W548-L551 PolarHBondContact O-N 3.4Å; W548-F585 HydrophobicContact CB-CD1 3.91Å; W548-F585 HydrophobicContact CB-CE1 4.15Å; W548-F585 AromaticContact CD1-CD1 3.97Å; W548-F585 HydrophobicContact CG-CD1 4.25Å; W548-L586 PolarHBondContact NE1-O 3.22Å; W548-N589 WeakPolarHBondContact CZ2-ND2 3.37Å
549	Q	92.3	Very high	95.3	Very high	118 Å²	118	34.6 Å²	34.6	55%	0.551	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	128.8	173.2	-174.1	-177.5	-15.5	0	0	109.6
550	G	92.4	Very high	95.4	Very high	4 Å²	4	37.9 Å²	37.9	4%	0.041	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	108.2	-16.7	-171.2	0	0	0	0	0	113.8	W548 D552 S553 L554 T632	W548-G550 PolarHBondContact O-N 3.22Å; G550-D552 VanDerWaalsContact C-N 3.27Å; G550-D552 VanDerWaalsContact C-OD1 3.23Å; G550-D552 WeakPolarHBondContact CA-OD1 3.43Å; G550-D552 PolarHBondContact N-OD1 2.94Å; G550-D552 PolarHBondContact O-N 3.15Å; G550-S553 WeakPolarHBondContact O-CB 3.46Å; G550-S553 PolarHBondContact O-N 3.17Å; G550-L554 PolarHBondContact O-N 3.32Å; G550-T632 WeakPolarHBondContact O-CG2 3.21Å
551	L	96.2	Very high	95.6	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.6	-32.5	173.2	-178.2	61.7	0	0	0	112	L535 W538 Y547 W548 L554 C555 I577 F585	L535-L551 HydrophobicContact CD2-CB 4.48Å; L535-L551 HydrophobicContact CD2-CD2 4.11Å; L535-L551 HydrophobicContact CD2-CG 3.74Å; W538-L551 HydrophobicContact CE3-CD2 3.67Å; W538-L551 HydrophobicContact CZ3-CD2 3.73Å; Y547-L551 HydrophobicContact CD2-CB 4.22Å; Y547-L551 HydrophobicContact CD2-CD2 3.79Å; Y547-L551 HydrophobicContact CD2-CG 4.46Å; Y547-L551 HydrophobicContact CE2-CB 3.99Å; Y547-L551 HydrophobicContact CE2-CD2 4.28Å; Y547-L551 HydrophobicContact CE2-CG 4.48Å; W548-L551 VanDerWaalsContact O-CB 3.29Å; W548-L551 WeakPolarHBondContact O-CB 3.49Å; W548-L551 PolarHBondContact O-N 3.4Å; L551-L554 HydrophobicContact CD1-CD2 3.99Å; L551-L554 PolarHBondContact O-N 2.91Å; L551-C555 WeakPolarHBondContact O-CB 3.4Å; L551-C555 PolarHBondContact O-N 2.69Å; L551-I577 HydrophobicContact CD1-CD1 4Å; L551-F585 HydrophobicContact CB-CE1 4.1Å; L551-F585 HydrophobicContact CD1-CE1 4Å; L551-F585 HydrophobicContact CD1-CE2 4.24Å; L551-F585 HydrophobicContact CD1-CZ 3.79Å; L551-F585 HydrophobicContact CG-CE1 4.49Å
552	D	96.3	Very high	95.7	Very high	8 Å²	8	35.7 Å²	35.7	4%	0.043	18%	0.18	C	C	.	.	H	α-helix	trans	-57.8	-47	168.3	60.1	-38.4	0	0	0	112	C515 F531 L535 G550 L554 C555 A556	C515-D552 HydrophobicContact CB-CB 4.46Å; C515-D552 WeakPolarHBondContact CB-OD2 3.3Å; F531-D552 WeakPolarHBondContact CE1-O 3.25Å; L535-D552 HydrophobicContact CD1-CB 4.09Å; G550-D552 VanDerWaalsContact C-N 3.27Å; G550-D552 VanDerWaalsContact C-OD1 3.23Å; G550-D552 WeakPolarHBondContact CA-OD1 3.43Å; G550-D552 PolarHBondContact N-OD1 2.94Å; G550-D552 PolarHBondContact O-N 3.15Å; D552-L554 VanDerWaalsContact C-N 3.33Å; D552-L554 PolarHBondContact O-N 3.45Å; D552-C555 WeakPolarHBondContact O-CB 3.27Å; D552-C555 PolarHBondContact O-N 3.14Å; D552-A556 PolarHBondContact O-N 3.39Å; D552-A556 VanDerWaalsContact O-N 3.15Å
553	S	96.6	Very high	95.9	Very high	4 Å²	4	33.7 Å²	33.7	3%	0.028	17%	0.17	C	C	.	.	H	α-helix	trans	-64.9	-37.4	175.4	-59.1	0	0	0	0	111.5	G550 C555 A556 P557 T635	G550-S553 WeakPolarHBondContact O-CB 3.46Å; G550-S553 PolarHBondContact O-N 3.17Å; S553-C555 VanDerWaalsContact C-N 3.33Å; S553-A556 PolarHBondContact O-N 3.15Å; S553-P557 WeakPolarHBondContact O-CD 3.43Å; S553-T635 VanDerWaalsContact O-CB 3.28Å; S553-T635 WeakPolarHBondContact O-CB 3.5Å; S553-T635 PolarHBondContact O-OG1 3.35Å
554	L	97.4	Very high	96	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.6	-35.3	175	-175.5	74.3	0	0	0	112.2	G550 L551 D552 A556 P557 F576 I577 L581 F585 T632 M633 T635 W647	G550-L554 PolarHBondContact O-N 3.32Å; L551-L554 HydrophobicContact CD1-CD2 3.99Å; L551-L554 PolarHBondContact O-N 2.91Å; D552-L554 VanDerWaalsContact C-N 3.33Å; D552-L554 PolarHBondContact O-N 3.45Å; L554-A556 VanDerWaalsContact C-N 3.31Å; L554-P557 WeakPolarHBondContact O-CD 3.41Å; L554-F576 HydrophobicContact CD1-CD1 4.44Å; L554-F576 HydrophobicContact CD1-CE1 3.94Å; L554-I577 HydrophobicContact CD2-CD1 3.96Å; L554-I577 HydrophobicContact CD2-CG1 3.75Å; L554-L581 HydrophobicContact CD1-CD1 3.92Å; L554-L581 HydrophobicContact CD2-CD1 3.41Å; L554-L581 VanDerWaalsContact CD2-CD1 3.41Å; L554-L581 HydrophobicContact CG-CD1 4.33Å; L554-F585 HydrophobicContact CD2-CE2 4.36Å; L554-F585 HydrophobicContact CD2-CZ 4.17Å; L554-T632 WeakPolarHBondContact CD1-O 3.34Å; L554-M633 HydrophobicContact CD1-CB 3.97Å; L554-M633 HydrophobicContact CD1-CG 4.27Å; L554-T635 PolarHBondContact N-OG1 3.36Å; L554-W647 HydrophobicContact CD1-CH2 3.85Å; L554-W647 HydrophobicContact CD1-CZ2 4.03Å
555	C	98.2	Very high	96.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-69.7	-28.8	178.1	-177.8	0	0	0	0	112.4	F531 L535 L551 D552 S553 F558 L559 M573	F531-C555 HydrophobicContact CD1-CB 4.26Å; F531-C555 HydrophobicContact CE1-CB 4.07Å; L535-C555 HydrophobicContact CD2-CB 3.82Å; L535-C555 HydrophobicContact CG-CB 4.41Å; L551-C555 WeakPolarHBondContact O-CB 3.4Å; L551-C555 PolarHBondContact O-N 2.69Å; D552-C555 WeakPolarHBondContact O-CB 3.27Å; D552-C555 PolarHBondContact O-N 3.14Å; S553-C555 VanDerWaalsContact C-N 3.33Å; C555-F558 PolarHBondContact O-N 2.7Å; C555-L559 PolarHBondContact O-N 3.42Å; C555-M573 HydrophobicContact CB-SD 3.71Å
556	A	98.2	Very high	96.4	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-57.4	-46.7	-169.2	0	0	0	0	0	114.9	H516 L522 F531 D552 S553 L554 F558 L559 Y560 L640	H516-A556 WeakPolarHBondContact CD2-CB 3.39Å; L522-A556 HydrophobicContact CD1-CB 3.98Å; F531-A556 HydrophobicContact CE1-CB 3.98Å; F531-A556 HydrophobicContact CZ-CB 3.66Å; D552-A556 PolarHBondContact O-N 3.39Å; D552-A556 VanDerWaalsContact O-N 3.15Å; S553-A556 PolarHBondContact O-N 3.15Å; L554-A556 VanDerWaalsContact C-N 3.31Å; A556-F558 VanDerWaalsContact C-N 3.34Å; A556-F558 PolarHBondContact O-N 2.98Å; A556-L559 PolarHBondContact O-N 3.42Å; A556-Y560 VanDerWaalsContact O-CB 3.28Å; A556-Y560 WeakPolarHBondContact O-CB 3.3Å; A556-Y560 PolarHBondContact O-N 2.87Å; A556-L640 HydrophobicContact CB-CD2 4.32Å
557	P	98.4	Very high	96.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.5	-39.9	177.5	-23.1	34.2	0	0	0	113.1	W479 S553 L554 L561 T635 L640 I643 F644 W647	W479-P557 HydrophobicContact CH2-CB 4.42Å; W479-P557 HydrophobicContact CZ3-CB 4.07Å; S553-P557 WeakPolarHBondContact O-CD 3.43Å; L554-P557 WeakPolarHBondContact O-CD 3.41Å; P557-L561 WeakPolarHBondContact O-CB 3.37Å; P557-L561 WeakPolarHBondContact O-CG 3.43Å; P557-L561 PolarHBondContact O-N 3.28Å; P557-L561 VanDerWaalsContact O-N 3.12Å; P557-T635 HydrophobicContact CG-CG2 3.69Å; P557-L640 HydrophobicContact CB-CD2 4.3Å; P557-L640 HydrophobicContact CG-CD2 3.82Å; P557-I643 HydrophobicContact CB-CG2 4.32Å; P557-I643 HydrophobicContact CG-CG2 3.82Å; P557-F644 HydrophobicContact CB-CE1 4.05Å; P557-W647 HydrophobicContact CB-CE3 4.33Å; P557-W647 HydrophobicContact CB-CH2 4.42Å; P557-W647 HydrophobicContact CB-CZ3 3.92Å; P557-W647 HydrophobicContact CG-CH2 3.99Å; P557-W647 HydrophobicContact CG-CZ3 3.99Å
558	F	98.5	Very high	96.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-68.6	-42.4	179.6	-63.1	-61.2	0	0	0	111.9	W479 L483 C555 A556 N562 A569 C572 M573 F576 W647	W479-F558 HydrophobicContact CE3-CD1 4.29Å; W479-F558 HydrophobicContact CE3-CE1 4.05Å; W479-F558 HydrophobicContact CZ3-CE1 4.35Å; L483-F558 HydrophobicContact CD1-CE1 4.09Å; C555-F558 PolarHBondContact O-N 2.7Å; A556-F558 VanDerWaalsContact C-N 3.34Å; A556-F558 PolarHBondContact O-N 2.98Å; F558-N562 WeakPolarHBondContact O-CB 3.25Å; F558-N562 PolarHBondContact O-N 3.46Å; F558-N562 VanDerWaalsContact O-N 3.15Å; F558-N562 PolarHBondContact O-ND2 3.13Å; F558-A569 HydrophobicContact CB-CB 4.43Å; F558-C572 HydrophobicContact CD1-CB 3.51Å; F558-C572 HydrophobicContact CE1-CB 3.87Å; F558-C572 HydrophobicContact CG-CB 4.21Å; F558-M573 HydrophobicContact CD2-CB 3.87Å; F558-M573 HydrophobicContact CD2-CG 4.17Å; F558-M573 HydrophobicContact CE2-CB 4.27Å; F558-M573 HydrophobicContact CE2-CG 4.41Å; F558-M573 HydrophobicContact CG-CB 4.42Å; F558-F576 HydrophobicContact CE2-CB 4.12Å; F558-F576 HydrophobicContact CE2-CD1 4.29Å; F558-F576 HydrophobicContact CE2-CG 4.08Å; F558-F576 HydrophobicContact CZ-CB 3.61Å; F558-F576 HydrophobicContact CZ-CD1 4.18Å; F558-F576 AromaticContact CZ-CD2 3.65Å; F558-F576 HydrophobicContact CZ-CD2 3.65Å; F558-F576 HydrophobicContact CZ-CE2 4.32Å; F558-F576 AromaticContact CZ-CG 3.56Å; F558-F576 HydrophobicContact CZ-CG 3.56Å; F558-W647 HydrophobicContact CD2-CZ3 4.32Å; F558-W647 HydrophobicContact CE1-CZ3 4.02Å; F558-W647 AromaticContact CE2-CH2 3.97Å; F558-W647 HydrophobicContact CE2-CH2 3.97Å; F558-W647 AromaticContact CE2-CZ3 3.6Å; F558-W647 HydrophobicContact CE2-CZ3 3.6Å; F558-W647 HydrophobicContact CZ-CE3 4.22Å; F558-W647 HydrophobicContact CZ-CH2 4.16Å; F558-W647 AromaticContact CZ-CZ3 3.42Å; F558-W647 HydrophobicContact CZ-CZ3 3.42Å; F558-W647 VanDerWaalsContact CZ-CZ3 3.42Å
559	L	98.2	Very high	96.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-69.2	-42.4	177.7	179.3	59.7	0	0	0	111.4	L522 K530 F531 C555 A556 N562 F563	L522-L559 HydrophobicContact CD2-CD2 4.37Å; L522-L559 HydrophobicContact CD2-CG 4.37Å; K530-L559 HydrophobicContact CB-CD1 3.86Å; K530-L559 HydrophobicContact CB-CD2 4.08Å; F531-L559 HydrophobicContact CB-CD2 4.17Å; F531-L559 HydrophobicContact CD1-CD2 3.74Å; F531-L559 HydrophobicContact CD2-CD2 3.67Å; F531-L559 HydrophobicContact CE1-CD2 4.02Å; F531-L559 HydrophobicContact CE2-CD2 3.96Å; F531-L559 HydrophobicContact CG-CD2 3.55Å; F531-L559 HydrophobicContact CZ-CD2 4.12Å; C555-L559 PolarHBondContact O-N 3.42Å; A556-L559 PolarHBondContact O-N 3.42Å; L559-N562 CarbonylContact O-C 3.57Å; L559-N562 VanDerWaalsContact O-C 3.24Å; L559-N562 PolarHBondContact O-N 2.87Å; L559-F563 HydrophobicContact CG-CD2 4.49Å; L559-F563 WeakPolarHBondContact O-CA 3.45Å; L559-F563 PolarHBondContact O-N 3.47Å
560	Y	98	Very high	97.1	Very high	85 Å²	85	14 Å²	14	33%	0.333	7%	0.069	S	C	.	.	H	α-helix	trans	-58.5	-51.4	177.7	-178.5	-86.8	0	0	0	111.5	D519 L521 L522 A556 N562 L640 F644	D519-Y560 WeakPolarHBondContact OD2-CE2 3.45Å; L521-Y560 HydrophobicContact CD2-CD2 4.29Å; L521-Y560 HydrophobicContact CD2-CE2 4.29Å; L522-Y560 HydrophobicContact CD1-CD2 4.45Å; L522-Y560 HydrophobicContact CG-CD2 4.2Å; A556-Y560 VanDerWaalsContact O-CB 3.28Å; A556-Y560 WeakPolarHBondContact O-CB 3.3Å; A556-Y560 PolarHBondContact O-N 2.87Å; Y560-N562 PolarHBondContact O-N 3.33Å; Y560-L640 HydrophobicContact CD2-CD1 3.91Å; Y560-L640 HydrophobicContact CE2-CD1 4.49Å; Y560-L640 HydrophobicContact CG-CD1 4.08Å; Y560-F644 HydrophobicContact CD1-CE1 4.47Å; Y560-F644 AromaticContact CD1-CE2 3.99Å; Y560-F644 HydrophobicContact CD1-CE2 3.99Å; Y560-F644 AromaticContact CD1-CZ 3.45Å; Y560-F644 HydrophobicContact CD1-CZ 3.45Å; Y560-F644 VanDerWaalsContact CD1-CZ 3.45Å; Y560-F644 AromaticContact CE1-CE2 3.9Å; Y560-F644 HydrophobicContact CE1-CE2 3.9Å; Y560-F644 AromaticContact CE1-CZ 3.87Å; Y560-F644 HydrophobicContact CE1-CZ 3.87Å; Y560-F644 HydrophobicContact CG-CZ 4.17Å
561	L	97.6	Very high	97.3	Very high	38 Å²	38	14.5 Å²	14.5	20%	0.199	7%	0.072	C	C	.	.	H	α-helix	trans	-68.4	-21.9	-178.9	-68	175.2	0	0	0	113.4	R475 W479 P557 F644	R475-L561 HydrophobicContact CB-CD2 4.29Å; R475-L561 HydrophobicContact CG-CD1 4Å; R475-L561 HydrophobicContact CG-CD2 4.32Å; W479-L561 HydrophobicContact CD2-CD1 3.93Å; W479-L561 HydrophobicContact CE3-CD1 3.6Å; W479-L561 HydrophobicContact CH2-CD1 4.07Å; W479-L561 HydrophobicContact CZ2-CD1 4.37Å; W479-L561 HydrophobicContact CZ3-CD1 3.66Å; P557-L561 WeakPolarHBondContact O-CB 3.37Å; P557-L561 WeakPolarHBondContact O-CG 3.43Å; P557-L561 PolarHBondContact O-N 3.28Å; P557-L561 VanDerWaalsContact O-N 3.12Å; L561-F644 HydrophobicContact CD1-CD1 4.14Å; L561-F644 HydrophobicContact CD1-CE1 3.94Å; L561-F644 HydrophobicContact CD2-CD1 4.49Å; L561-F644 HydrophobicContact CD2-CE1 4.06Å; L561-F644 HydrophobicContact CD2-CE2 4.48Å; L561-F644 HydrophobicContact CD2-CZ 4.08Å; L561-F644 HydrophobicContact CG-CD1 4.44Å; L561-F644 HydrophobicContact CG-CE1 3.83Å; L561-F644 HydrophobicContact CG-CZ 4.18Å
562	N	97.2	Very high	97.4	Very high	13 Å²	13	14.5 Å²	14.5	7%	0.07	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.1	38	-176.7	-54.7	-78.4	0	0	0	111.7	F558 L559 Y560 N564 N565 L568 A569	F558-N562 WeakPolarHBondContact O-CB 3.25Å; F558-N562 PolarHBondContact O-N 3.46Å; F558-N562 VanDerWaalsContact O-N 3.15Å; F558-N562 PolarHBondContact O-ND2 3.13Å; L559-N562 CarbonylContact O-C 3.57Å; L559-N562 VanDerWaalsContact O-C 3.24Å; L559-N562 PolarHBondContact O-N 2.87Å; Y560-N562 PolarHBondContact O-N 3.33Å; N562-N564 PolarHBondContact O-N 3.19Å; N562-N564 VanDerWaalsContact O-N 3.08Å; N562-N565 CarbonylContact O-C 3.54Å; N562-N565 WeakPolarHBondContact O-CA 3.38Å; N562-N565 PolarHBondContact O-N 3.46Å; N562-L568 HydrophobicContact CB-CB 4.47Å; N562-L568 WeakPolarHBondContact OD1-CD2 3.46Å; N562-A569 HydrophobicContact CB-CB 4.09Å
563	F	97.1	Very high	97.5	Very high	8 Å²	8	14.1 Å²	14.1	4%	0.035	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-35.6	-170.8	-169.3	-91.2	0	0	0	113.1	Q43 L521 Q526 K530 L559	Q43-F563 HydrophobicContact CB-CD1 3.65Å; Q43-F563 HydrophobicContact CB-CE1 3.66Å; Q43-F563 HydrophobicContact CG-CD1 3.68Å; Q43-F563 HydrophobicContact CG-CE1 3.56Å; Q43-F563 HydrophobicContact CG-CZ 4.47Å; L521-F563 HydrophobicContact CD1-CD1 4.11Å; L521-F563 HydrophobicContact CD1-CD2 3.94Å; L521-F563 HydrophobicContact CD1-CE1 3.81Å; L521-F563 HydrophobicContact CD1-CE2 3.6Å; L521-F563 HydrophobicContact CD1-CG 4.17Å; L521-F563 HydrophobicContact CD1-CZ 3.53Å; L521-F563 HydrophobicContact CD2-CB 4.32Å; L521-F563 HydrophobicContact CD2-CD2 3.89Å; L521-F563 HydrophobicContact CD2-CE2 4.33Å; L521-F563 HydrophobicContact CD2-CG 4.06Å; L521-F563 HydrophobicContact CG-CD2 3.78Å; L521-F563 HydrophobicContact CG-CE2 3.71Å; L521-F563 HydrophobicContact CG-CG 4.29Å; L521-F563 HydrophobicContact CG-CZ 4.18Å; Q526-F563 HydrophobicContact CB-CZ 4.26Å; K530-F563 HydrophobicContact CD-CD1 4.02Å; K530-F563 HydrophobicContact CD-CD2 4.29Å; K530-F563 HydrophobicContact CD-CE1 3.72Å; K530-F563 HydrophobicContact CD-CE2 4.03Å; K530-F563 HydrophobicContact CD-CG 4.3Å; K530-F563 HydrophobicContact CD-CZ 3.74Å; K530-F563 WeakPolarHBondContact CD-O 3.25Å; K530-F563 VanDerWaalsContact CE-O 3.27Å; K530-F563 WeakPolarHBondContact CE-O 3.37Å; K530-F563 PolarHBondContact NZ-O 3.22Å; L559-F563 HydrophobicContact CG-CD2 4.49Å; L559-F563 WeakPolarHBondContact O-CA 3.45Å; L559-F563 PolarHBondContact O-N 3.47Å
564	N	94.9	Very high	97.5	Very high	55 Å²	55	14.7 Å²	14.7	29%	0.294	7%	0.074	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	1.4	179.1	-76.4	-25.5	0	0	0	114.4	Q43 T47 N562	Q43-N564 VanDerWaalsContact C-OD1 3.31Å; Q43-N564 WeakPolarHBondContact CB-OD1 3.43Å; Q43-N564 PolarHBondContact O-ND2 3.13Å; Q43-N564 PolarHBondContact O-OD1 3.23Å; Q43-N564 VanDerWaalsContact O-OD1 3.13Å; T47-N564 HydrophobicContact CG2-CB 3.46Å; T47-N564 VanDerWaalsContact CG2-CB 3.46Å; T47-N564 VanDerWaalsContact CG2-CG 3.49Å; N562-N564 PolarHBondContact O-N 3.19Å; N562-N564 VanDerWaalsContact O-N 3.08Å
565	N	95.6	Very high	97.4	Very high	44 Å²	44	16.3 Å²	16.3	24%	0.235	9%	0.087	C	C	.	.			trans	-138.8	75.6	178.8	-169.6	-17.2	0	0	0	109.9	N562 A567 L568 A569	N562-N565 CarbonylContact O-C 3.54Å; N562-N565 WeakPolarHBondContact O-CA 3.38Å; N562-N565 PolarHBondContact O-N 3.46Å; N565-A567 PolarHBondContact O-N 3.24Å; N565-L568 HydrophobicContact CB-CB 4.05Å; N565-L568 PolarHBondContact O-N 3.45Å; N565-L568 WeakPolarHBondContact OD1-CB 3.37Å; N565-L568 PolarHBondContact OD1-N 3.01Å; N565-A569 PolarHBondContact O-N 3.01Å
566	E	97.1	Very high	97.4	Very high	30 Å²	30	16.3 Å²	16.3	14%	0.14	9%	0.087	C	C	.	.	H	α-helix	trans	-55.9	-36.1	179.6	-73.8	164.6	-122.7	0	0	112.4	Y493 K530 R533 V534 L568 A569 Y570	Y493-E566 HydrophobicContact CE1-CB 3.74Å; Y493-E566 PolarHBondContact OH-OE2 3.47Å; K530-E566 HydrophobicContact CB-CG 4.36Å; K530-E566 HydrophobicContact CG-CG 4.13Å; K530-E566 IonicContact NZ-OE1 2.89Å; K530-E566 PolarHBondContact NZ-OE1 2.83Å; R533-E566 IonicContact CZ-OE2 3.36Å; R533-E566 IonicContact NE-OE2 3.59Å; R533-E566 PolarHBondContact NE-OE2 2.93Å; R533-E566 IonicContact NH2-OE2 2.71Å; V534-E566 HydrophobicContact CG2-CB 4.07Å; V534-E566 HydrophobicContact CG2-CG 4.19Å; E566-L568 VanDerWaalsContact C-N 3.34Å; E566-L568 PolarHBondContact O-N 3.19Å; E566-A569 PolarHBondContact O-N 3.39Å; E566-Y570 VanDerWaalsContact O-CB 3.3Å; E566-Y570 WeakPolarHBondContact O-CB 3.34Å; E566-Y570 PolarHBondContact O-N 3.17Å
567	A	96.9	Very high	97.3	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.1	-41.1	177.2	0	0	0	0	0	111.8	I489 Y493 N565 A571	I489-A567 HydrophobicContact CG1-CB 4.37Å; Y493-A567 HydrophobicContact CD1-CB 4.12Å; Y493-A567 HydrophobicContact CG-CB 3.93Å; N565-A567 PolarHBondContact O-N 3.24Å; A567-A571 VanDerWaalsContact O-CB 3.26Å; A567-A571 WeakPolarHBondContact O-CB 3.5Å; A567-A571 PolarHBondContact O-N 3.27Å
568	L	97.3	Very high	97	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-70.7	-41.3	175.7	-172.9	58.8	0	0	0	112.1	F293 L477 A480 I485 I489 N562 N565 E566 Y570 A571 C572	F293-L568 HydrophobicContact CD2-CD1 3.62Å; F293-L568 HydrophobicContact CD2-CD2 4.12Å; F293-L568 HydrophobicContact CE2-CD1 3.59Å; F293-L568 HydrophobicContact CE2-CD2 3.83Å; F293-L568 HydrophobicContact CE2-CG 4.4Å; F293-L568 HydrophobicContact CG-CD1 4.37Å; F293-L568 HydrophobicContact CZ-CD1 4.34Å; L477-L568 HydrophobicContact CD2-CD2 3.92Å; A480-L568 HydrophobicContact CB-CD1 3.65Å; A480-L568 HydrophobicContact CB-CD2 4.49Å; A480-L568 HydrophobicContact CB-CG 4.35Å; I485-L568 HydrophobicContact CG2-CD1 4.23Å; I489-L568 HydrophobicContact CD1-CB 3.84Å; I489-L568 HydrophobicContact CD1-CD1 3.74Å; I489-L568 HydrophobicContact CD1-CG 4.38Å; N562-L568 HydrophobicContact CB-CB 4.47Å; N562-L568 WeakPolarHBondContact OD1-CD2 3.46Å; N565-L568 HydrophobicContact CB-CB 4.05Å; N565-L568 PolarHBondContact O-N 3.45Å; N565-L568 WeakPolarHBondContact OD1-CB 3.37Å; N565-L568 PolarHBondContact OD1-N 3.01Å; E566-L568 VanDerWaalsContact C-N 3.34Å; E566-L568 PolarHBondContact O-N 3.19Å; L568-Y570 VanDerWaalsContact C-N 3.33Å; L568-Y570 PolarHBondContact O-N 2.87Å; L568-A571 PolarHBondContact O-N 3.42Å; L568-C572 WeakPolarHBondContact O-CB 3.38Å; L568-C572 PolarHBondContact O-N 3.4Å; L568-C572 PolarHBondContact O-SG 3.08Å
569	A	98.2	Very high	96.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-56.7	-48.9	173.2	0	0	0	0	0	111.2	F558 N562 N565 E566 C572 M573	F558-A569 HydrophobicContact CB-CB 4.43Å; N562-A569 HydrophobicContact CB-CB 4.09Å; N565-A569 PolarHBondContact O-N 3.01Å; E566-A569 PolarHBondContact O-N 3.39Å; A569-C572 PolarHBondContact O-N 3.37Å; A569-M573 WeakPolarHBondContact O-CB 3.4Å; A569-M573 PolarHBondContact O-N 3Å
570	Y	98.1	Very high	96.6	Very high	5 Å²	5	21.3 Å²	21.3	2%	0.02	11%	0.113	C	C	.	.	H	α-helix	trans	-60.6	-45.2	176.2	166	-98.7	0	0	0	112.3	Y493 A537 W538 S541 E566 L568 M573 S574	Y493-Y570 AromaticContact CD2-CD1 3.73Å; Y493-Y570 HydrophobicContact CD2-CD1 3.73Å; Y493-Y570 HydrophobicContact CD2-CD2 4.25Å; Y493-Y570 HydrophobicContact CD2-CE1 4.5Å; Y493-Y570 AromaticContact CD2-CG 3.59Å; Y493-Y570 HydrophobicContact CD2-CG 3.59Å; Y493-Y570 HydrophobicContact CE2-CD2 4.36Å; Y493-Y570 AromaticContact CE2-CG 3.97Å; Y493-Y570 HydrophobicContact CE2-CG 3.97Å; A537-Y570 HydrophobicContact CB-CD2 3.98Å; A537-Y570 HydrophobicContact CB-CE2 4.07Å; W538-Y570 HydrophobicContact CB-CD2 4.36Å; W538-Y570 HydrophobicContact CB-CE2 4.18Å; S541-Y570 VanDerWaalsContact CB-OH 3.28Å; S541-Y570 WeakPolarHBondContact CB-OH 3.39Å; S541-Y570 PolarHBondContact OG-OH 3.21Å; E566-Y570 VanDerWaalsContact O-CB 3.3Å; E566-Y570 WeakPolarHBondContact O-CB 3.34Å; E566-Y570 PolarHBondContact O-N 3.17Å; L568-Y570 VanDerWaalsContact C-N 3.33Å; L568-Y570 PolarHBondContact O-N 2.87Å; Y570-M573 PolarHBondContact O-N 3.35Å; Y570-S574 WeakPolarHBondContact CE2-OG 3.23Å; Y570-S574 VanDerWaalsContact O-CB 3.26Å; Y570-S574 WeakPolarHBondContact O-CB 3.33Å; Y570-S574 PolarHBondContact O-N 3.29Å; Y570-S574 PolarHBondContact O-OG 2.77Å
571	A	97.7	Very high	96.4	Very high	13 Å²	13	17.2 Å²	17.2	11%	0.107	10%	0.097	C	C	.	.	H	α-helix	trans	-63.4	-46.3	179.5	0	0	0	0	0	111.5	I485 I489 A567 L568 S574 A575	I485-A571 HydrophobicContact CD1-CB 4.14Å; I485-A571 WeakPolarHBondContact CD1-O 3.44Å; I485-A571 HydrophobicContact CG2-CB 4.05Å; I489-A571 HydrophobicContact CB-CB 4.32Å; I489-A571 HydrophobicContact CG2-CB 3.93Å; A567-A571 VanDerWaalsContact O-CB 3.26Å; A567-A571 WeakPolarHBondContact O-CB 3.5Å; A567-A571 PolarHBondContact O-N 3.27Å; L568-A571 PolarHBondContact O-N 3.42Å; A571-S574 PolarHBondContact O-N 2.99Å; A571-A575 WeakPolarHBondContact O-CB 3.39Å; A571-A575 PolarHBondContact O-N 2.76Å
572	C	98.2	Very high	96.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-58.6	-49	175.1	-71.5	0	0	0	0	111.6	A480 L483 F558 L568 A569 S574 A575 F576	A480-C572 VanDerWaalsContact CB-SG 3.57Å; L483-C572 HydrophobicContact CD1-CB 3.87Å; F558-C572 HydrophobicContact CD1-CB 3.51Å; F558-C572 HydrophobicContact CE1-CB 3.87Å; F558-C572 HydrophobicContact CG-CB 4.21Å; L568-C572 WeakPolarHBondContact O-CB 3.38Å; L568-C572 PolarHBondContact O-N 3.4Å; L568-C572 PolarHBondContact O-SG 3.08Å; A569-C572 PolarHBondContact O-N 3.37Å; C572-S574 VanDerWaalsContact C-N 3.33Å; C572-S574 PolarHBondContact O-N 3.28Å; C572-A575 PolarHBondContact O-N 3.41Å; C572-F576 VanDerWaalsContact O-CB 3.27Å; C572-F576 WeakPolarHBondContact O-CB 3.47Å; C572-F576 PolarHBondContact O-N 3.23Å
573	M	97.6	Very high	96.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.1	-42.8	178	-170.9	175.5	81.9	0	0	111.8	V534 W538 C555 F558 A569 Y570 A575 F576 I577	V534-M573 HydrophobicContact CG1-CE 4.22Å; W538-M573 HydrophobicContact CB-CE 3.29Å; W538-M573 HydrophobicContact CD2-CE 4.14Å; W538-M573 HydrophobicContact CG-CE 3.34Å; C555-M573 HydrophobicContact CB-SD 3.71Å; F558-M573 HydrophobicContact CD2-CB 3.87Å; F558-M573 HydrophobicContact CD2-CG 4.17Å; F558-M573 HydrophobicContact CE2-CB 4.27Å; F558-M573 HydrophobicContact CE2-CG 4.41Å; F558-M573 HydrophobicContact CG-CB 4.42Å; A569-M573 WeakPolarHBondContact O-CB 3.4Å; A569-M573 PolarHBondContact O-N 3Å; Y570-M573 PolarHBondContact O-N 3.35Å; M573-A575 VanDerWaalsContact C-N 3.3Å; M573-A575 PolarHBondContact O-N 2.94Å; M573-F576 PolarHBondContact O-N 3.41Å; M573-I577 HydrophobicContact CG-CD1 3.83Å; M573-I577 HydrophobicContact CG-CG1 4.46Å; M573-I577 WeakPolarHBondContact O-CG1 3.29Å; M573-I577 PolarHBondContact O-N 3.15Å
574	S	96.4	Very high	96	Very high	17 Å²	17	19.8 Å²	19.8	12%	0.119	11%	0.106	C	C	.	.	H	α-helix	trans	-67.3	-28.1	178.9	-58.4	0	0	0	0	113.2	Y570 A571 C572 P578	Y570-S574 WeakPolarHBondContact CE2-OG 3.23Å; Y570-S574 VanDerWaalsContact O-CB 3.26Å; Y570-S574 WeakPolarHBondContact O-CB 3.33Å; Y570-S574 PolarHBondContact O-N 3.29Å; Y570-S574 PolarHBondContact O-OG 2.77Å; A571-S574 PolarHBondContact O-N 2.99Å; C572-S574 VanDerWaalsContact C-N 3.33Å; C572-S574 PolarHBondContact O-N 3.28Å; S574-P578 WeakPolarHBondContact O-CD 3.44Å; S574-P578 WeakPolarHBondContact O-CG 3.28Å
575	A	96.2	Very high	96.1	Very high	33 Å²	33	17.2 Å²	17.2	27%	0.273	9%	0.092	S	C	.	.	H	α-helix	trans	-82.5	-33.4	173	0	0	0	0	0	112.5	L483 I485 A571 C572 M573	L483-A575 HydrophobicContact CB-CB 4.21Å; I485-A575 HydrophobicContact CD1-CB 3.55Å; A571-A575 WeakPolarHBondContact O-CB 3.39Å; A571-A575 PolarHBondContact O-N 2.76Å; C572-A575 PolarHBondContact O-N 3.41Å; M573-A575 VanDerWaalsContact C-N 3.3Å; M573-A575 PolarHBondContact O-N 2.94Å
576	F	97.4	Very high	96.1	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-71.1	-45.3	-178.2	-176.4	-86.4	0	0	0	112.7	L483 L554 F558 C572 M573 K579 Y580 L581 M633 W647 L650 L651	L483-F576 HydrophobicContact CD1-CB 4.48Å; L483-F576 HydrophobicContact CD2-CB 4.21Å; L483-F576 HydrophobicContact CD2-CD2 4.27Å; L554-F576 HydrophobicContact CD1-CD1 4.44Å; L554-F576 HydrophobicContact CD1-CE1 3.94Å; F558-F576 HydrophobicContact CE2-CB 4.12Å; F558-F576 HydrophobicContact CE2-CD1 4.29Å; F558-F576 HydrophobicContact CE2-CG 4.08Å; F558-F576 HydrophobicContact CZ-CB 3.61Å; F558-F576 HydrophobicContact CZ-CD1 4.18Å; F558-F576 AromaticContact CZ-CD2 3.65Å; F558-F576 HydrophobicContact CZ-CD2 3.65Å; F558-F576 HydrophobicContact CZ-CE2 4.32Å; F558-F576 AromaticContact CZ-CG 3.56Å; F558-F576 HydrophobicContact CZ-CG 3.56Å; C572-F576 VanDerWaalsContact O-CB 3.27Å; C572-F576 WeakPolarHBondContact O-CB 3.47Å; C572-F576 PolarHBondContact O-N 3.23Å; M573-F576 PolarHBondContact O-N 3.41Å; F576-K579 WeakPolarHBondContact O-CB 3.26Å; F576-K579 PolarHBondContact O-N 3.23Å; F576-K579 VanDerWaalsContact O-N 3.1Å; F576-Y580 HydrophobicContact CD1-CD2 4.12Å; F576-Y580 AromaticContact CD2-CD2 3.69Å; F576-Y580 HydrophobicContact CD2-CD2 3.69Å; F576-Y580 AromaticContact CD2-CE2 3.77Å; F576-Y580 HydrophobicContact CD2-CE2 3.77Å; F576-Y580 AromaticContact CE1-CD2 3.91Å; F576-Y580 HydrophobicContact CE1-CD2 3.91Å; F576-Y580 HydrophobicContact CE1-CG 4.43Å; F576-Y580 AromaticContact CE2-CD2 3.48Å; F576-Y580 HydrophobicContact CE2-CD2 3.48Å; F576-Y580 VanDerWaalsContact CE2-CD2 3.48Å; F576-Y580 AromaticContact CE2-CE2 3.58Å; F576-Y580 HydrophobicContact CE2-CE2 3.58Å; F576-Y580 HydrophobicContact CE2-CG 4.46Å; F576-Y580 HydrophobicContact CG-CD2 4.02Å; F576-Y580 HydrophobicContact CG-CE2 4.48Å; F576-Y580 AromaticContact CZ-CD2 3.6Å; F576-Y580 HydrophobicContact CZ-CD2 3.6Å; F576-Y580 HydrophobicContact CZ-CE2 4.14Å; F576-Y580 HydrophobicContact CZ-CG 4.2Å; F576-Y580 PolarHBondContact O-N 3.47Å; F576-Y580 VanDerWaalsContact O-N 3.17Å; F576-L581 HydrophobicContact CE1-CD1 4.49Å; F576-M633 HydrophobicContact CE1-CB 4.29Å; F576-M633 HydrophobicContact CE1-CG 3.91Å; F576-M633 HydrophobicContact CZ-CB 4.25Å; F576-M633 HydrophobicContact CZ-CG 4.12Å; F576-W647 HydrophobicContact CE1-CH2 4.27Å; F576-W647 HydrophobicContact CE1-CZ2 4.41Å; F576-W647 HydrophobicContact CE2-CD2 4.44Å; F576-W647 HydrophobicContact CE2-CE3 4.19Å; F576-W647 HydrophobicContact CE2-CH2 4.47Å; F576-W647 HydrophobicContact CE2-CZ3 4.25Å; F576-W647 HydrophobicContact CZ-CD2 4.46Å; F576-W647 HydrophobicContact CZ-CE3 4.43Å; F576-W647 HydrophobicContact CZ-CH2 4.03Å; F576-W647 AromaticContact CZ-CZ2 3.97Å; F576-W647 HydrophobicContact CZ-CZ2 3.97Å; F576-W647 HydrophobicContact CZ-CZ3 4.27Å; F576-L650 HydrophobicContact CE2-CD2 4.13Å; F576-L650 HydrophobicContact CZ-CD2 3.9Å; F576-L651 HydrophobicContact CD2-CD2 3.73Å; F576-L651 HydrophobicContact CE2-CD2 3.81Å
577	I	96.3	Very high	95.9	Very high	5 Å²	5	24.4 Å²	24.4	3%	0.026	12%	0.123	C	C	.	.	H	α-helix	trans	-59.4	-48.6	-174.4	-72.7	167.7	0	0	0	112.2	W538 L551 L554 M573 K579 Y580 L581 Y582 F585	W538-I577 HydrophobicContact CD2-CD1 4.26Å; W538-I577 VanDerWaalsContact CE2-CD1 3.47Å; W538-I577 HydrophobicContact CH2-CD1 4.24Å; W538-I577 HydrophobicContact CZ2-CB 4.41Å; W538-I577 HydrophobicContact CZ2-CD1 3.49Å; W538-I577 VanDerWaalsContact CZ2-CD1 3.49Å; W538-I577 HydrophobicContact CZ2-CG2 3.89Å; L551-I577 HydrophobicContact CD1-CD1 4Å; L554-I577 HydrophobicContact CD2-CD1 3.96Å; L554-I577 HydrophobicContact CD2-CG1 3.75Å; M573-I577 HydrophobicContact CG-CD1 3.83Å; M573-I577 HydrophobicContact CG-CG1 4.46Å; M573-I577 WeakPolarHBondContact O-CG1 3.29Å; M573-I577 PolarHBondContact O-N 3.15Å; I577-K579 PolarHBondContact O-N 2.9Å; I577-Y580 PolarHBondContact O-N 3.43Å; I577-L581 HydrophobicContact CG1-CD1 4.43Å; I577-L581 HydrophobicContact CG2-CB 4.08Å; I577-L581 CarbonylContact O-C 3.59Å; I577-L581 WeakPolarHBondContact O-CA 3.38Å; I577-L581 WeakPolarHBondContact O-CB 3.48Å; I577-L581 PolarHBondContact O-N 3.06Å; I577-Y582 PolarHBondContact O-N 2.86Å; I577-F585 HydrophobicContact CD1-CE2 4.26Å; I577-F585 HydrophobicContact CG1-CE2 4.32Å; I577-F585 HydrophobicContact CG2-CD2 4Å; I577-F585 HydrophobicContact CG2-CE2 4.06Å
578	P	93.4	Very high	95.7	Very high	34 Å²	34	29.2 Å²	29.2	22%	0.221	15%	0.149	C	C	.	.	H	α-helix	trans	-60.2	-32.8	176.7	-25.6	35.5	0	0	0	113.4	S574 Y582 Q718	S574-P578 WeakPolarHBondContact O-CD 3.44Å; S574-P578 WeakPolarHBondContact O-CG 3.28Å; P578-Y582 WeakPolarHBondContact O-CB 3.32Å; P578-Q718 VanDerWaalsContact C-OE1 3.31Å; P578-Q718 PolarHBondContact O-OE1 2.94Å
579	K	92.3	Very high	95.6	Very high	65 Å²	65	29.9 Å²	29.9	28%	0.283	15%	0.153	S	C	.	.	H	α-helix	trans	-70.2	-42.5	-178.6	-173.9	175.4	176.8	-165.4	0	112.6	F576 I577 L651 G653 S655	F576-K579 WeakPolarHBondContact O-CB 3.26Å; F576-K579 PolarHBondContact O-N 3.23Å; F576-K579 VanDerWaalsContact O-N 3.1Å; I577-K579 PolarHBondContact O-N 2.9Å; K579-L651 PolarHBondContact NZ-O 2.88Å; K579-G653 WeakPolarHBondContact CE-O 3.43Å; K579-G653 PolarHBondContact NZ-O 3.4Å; K579-G653 VanDerWaalsContact NZ-O 3.14Å; K579-S655 WeakPolarHBondContact O-CB 3.43Å
580	Y	94.6	Very high	95.4	Very high	1 Å²	1	32.4 Å²	32.4	0%	0.004	17%	0.17	C	C	.	.	H	α-helix	trans	-114.5	-25.6	-171.7	-60.4	-77.1	0	0	0	114.5	F576 I577 M633 L650 L651 G653 S654 P658	F576-Y580 HydrophobicContact CD1-CD2 4.12Å; F576-Y580 AromaticContact CD2-CD2 3.69Å; F576-Y580 HydrophobicContact CD2-CD2 3.69Å; F576-Y580 AromaticContact CD2-CE2 3.77Å; F576-Y580 HydrophobicContact CD2-CE2 3.77Å; F576-Y580 AromaticContact CE1-CD2 3.91Å; F576-Y580 HydrophobicContact CE1-CD2 3.91Å; F576-Y580 HydrophobicContact CE1-CG 4.43Å; F576-Y580 AromaticContact CE2-CD2 3.48Å; F576-Y580 HydrophobicContact CE2-CD2 3.48Å; F576-Y580 VanDerWaalsContact CE2-CD2 3.48Å; F576-Y580 AromaticContact CE2-CE2 3.58Å; F576-Y580 HydrophobicContact CE2-CE2 3.58Å; F576-Y580 HydrophobicContact CE2-CG 4.46Å; F576-Y580 HydrophobicContact CG-CD2 4.02Å; F576-Y580 HydrophobicContact CG-CE2 4.48Å; F576-Y580 AromaticContact CZ-CD2 3.6Å; F576-Y580 HydrophobicContact CZ-CD2 3.6Å; F576-Y580 HydrophobicContact CZ-CE2 4.14Å; F576-Y580 HydrophobicContact CZ-CG 4.2Å; F576-Y580 PolarHBondContact O-N 3.47Å; F576-Y580 VanDerWaalsContact O-N 3.17Å; I577-Y580 PolarHBondContact O-N 3.43Å; Y580-M633 WeakPolarHBondContact O-CE 3.33Å; Y580-L650 HydrophobicContact CD1-CD1 4.08Å; Y580-L650 HydrophobicContact CE1-CD1 3.67Å; Y580-L650 HydrophobicContact CE1-CG 4.08Å; Y580-L650 PolarHBondContact OH-O 3.32Å; Y580-L651 HydrophobicContact CE2-CD2 4.35Å; Y580-L651 WeakPolarHBondContact OH-CA 3.38Å; Y580-G653 PolarHBondContact OH-O 2.94Å; Y580-G653 VanDerWaalsContact OH-O 3.12Å; Y580-S654 WeakPolarHBondContact CE1-O 3.02Å; Y580-P658 HydrophobicContact CD1-CG 3.97Å
581	L	95.3	Very high	95.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	-127.2	30.3	-169.6	-66.2	171.7	0	0	0	112	L554 F576 I577 N583 F584 F585 F630 M633	L554-L581 HydrophobicContact CD1-CD1 3.92Å; L554-L581 HydrophobicContact CD2-CD1 3.41Å; L554-L581 VanDerWaalsContact CD2-CD1 3.41Å; L554-L581 HydrophobicContact CG-CD1 4.33Å; F576-L581 HydrophobicContact CE1-CD1 4.49Å; I577-L581 HydrophobicContact CG1-CD1 4.43Å; I577-L581 HydrophobicContact CG2-CB 4.08Å; I577-L581 CarbonylContact O-C 3.59Å; I577-L581 WeakPolarHBondContact O-CA 3.38Å; I577-L581 WeakPolarHBondContact O-CB 3.48Å; I577-L581 PolarHBondContact O-N 3.06Å; L581-N583 PolarHBondContact O-N 3.23Å; L581-N583 VanDerWaalsContact O-N 3.17Å; L581-F584 HydrophobicContact CB-CB 4.16Å; L581-F584 HydrophobicContact CB-CG 4.25Å; L581-F584 HydrophobicContact CD2-CB 4.31Å; L581-F584 HydrophobicContact CD2-CD1 3.53Å; L581-F584 HydrophobicContact CD2-CD2 4.36Å; L581-F584 HydrophobicContact CD2-CE1 3.85Å; L581-F584 HydrophobicContact CD2-CG 3.81Å; L581-F584 HydrophobicContact CD2-CZ 4.39Å; L581-F584 WeakPolarHBondContact O-CB 3.38Å; L581-F584 PolarHBondContact O-N 3.49Å; L581-F585 HydrophobicContact CB-CE2 4.1Å; L581-F585 HydrophobicContact CD1-CE2 3.96Å; L581-F585 HydrophobicContact CD1-CZ 4.23Å; L581-F630 VanDerWaalsContact CD2-O 3.22Å; L581-F630 WeakPolarHBondContact CD2-O 3.38Å; L581-M633 HydrophobicContact CD1-CG 4.01Å; L581-M633 HydrophobicContact CD2-CE 3.28Å; L581-M633 HydrophobicContact CD2-CG 4.17Å; L581-M633 HydrophobicContact CG-CE 3.73Å; L581-M633 HydrophobicContact CG-CG 4.13Å
582	Y	94.2	Very high	95.1	Very high	67 Å²	67	36.8 Å²	36.8	26%	0.263	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	124.1	179.7	-169.6	-108.6	0	0	0	110.8	I577 P578 F584 Y716 Q718	I577-Y582 PolarHBondContact O-N 2.86Å; P578-Y582 WeakPolarHBondContact O-CB 3.32Å; Y582-F584 PolarHBondContact O-N 3.49Å; Y582-F584 VanDerWaalsContact O-N 3.08Å; Y582-Y716 WeakPolarHBondContact CD1-O 3.24Å; Y582-Q718 HydrophobicContact CD1-CB 4.35Å; Y582-Q718 HydrophobicContact CD2-CB 3.85Å; Y582-Q718 HydrophobicContact CD2-CG 3.9Å; Y582-Q718 HydrophobicContact CE2-CB 4.4Å; Y582-Q718 HydrophobicContact CE2-CG 4.09Å; Y582-Q718 HydrophobicContact CG-CB 3.83Å; Y582-Q718 HydrophobicContact CG-CG 4.4Å
583	N	94.1	Very high	94.9	Very high	44 Å²	44	37.8 Å²	37.8	24%	0.235	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	10.6	-178.9	-66.9	-9.8	0	0	0	116.7	L581 F585 L586 V592	L581-N583 PolarHBondContact O-N 3.23Å; L581-N583 VanDerWaalsContact O-N 3.17Å; N583-F585 PolarHBondContact O-N 2.95Å; N583-L586 HydrophobicContact CB-CD1 3.68Å; N583-L586 HydrophobicContact CB-CG 4Å; N583-L586 WeakPolarHBondContact O-CG 3.44Å; N583-L586 PolarHBondContact O-N 3.5Å; N583-V592 HydrophobicContact CB-CG2 4.12Å
584	F	95.4	Very high	94.9	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-28.6	175.3	-90.7	-125.3	0	0	0	112.7	L581 Y582 N589 V592 I593 Y596 F630 L631	L581-F584 HydrophobicContact CB-CB 4.16Å; L581-F584 HydrophobicContact CB-CG 4.25Å; L581-F584 HydrophobicContact CD2-CB 4.31Å; L581-F584 HydrophobicContact CD2-CD1 3.53Å; L581-F584 HydrophobicContact CD2-CD2 4.36Å; L581-F584 HydrophobicContact CD2-CE1 3.85Å; L581-F584 HydrophobicContact CD2-CG 3.81Å; L581-F584 HydrophobicContact CD2-CZ 4.39Å; L581-F584 WeakPolarHBondContact O-CB 3.38Å; L581-F584 PolarHBondContact O-N 3.49Å; Y582-F584 PolarHBondContact O-N 3.49Å; Y582-F584 VanDerWaalsContact O-N 3.08Å; F584-N589 WeakPolarHBondContact O-CB 3.43Å; F584-N589 PolarHBondContact O-ND2 3.45Å; F584-V592 HydrophobicContact CD2-CG1 3.77Å; F584-V592 HydrophobicContact CE2-CG1 3.88Å; F584-I593 HydrophobicContact CD1-CD1 3.45Å; F584-I593 VanDerWaalsContact CD1-CD1 3.45Å; F584-I593 HydrophobicContact CE1-CD1 3.48Å; F584-I593 VanDerWaalsContact CE1-CD1 3.48Å; F584-I593 HydrophobicContact CG-CD1 4.04Å; F584-I593 HydrophobicContact CZ-CD1 4.09Å; F584-Y596 AromaticContact CE2-CD2 3.67Å; F584-Y596 HydrophobicContact CE2-CD2 3.67Å; F584-Y596 HydrophobicContact CE2-CE2 4.05Å; F584-Y596 HydrophobicContact CE2-CG 4.25Å; F584-Y596 HydrophobicContact CZ-CD1 4.12Å; F584-Y596 AromaticContact CZ-CD2 3.38Å; F584-Y596 HydrophobicContact CZ-CD2 3.38Å; F584-Y596 HydrophobicContact CZ-CE1 4.4Å; F584-Y596 AromaticContact CZ-CE2 3.68Å; F584-Y596 HydrophobicContact CZ-CE2 3.68Å; F584-Y596 AromaticContact CZ-CG 3.61Å; F584-Y596 HydrophobicContact CZ-CG 3.61Å; F584-F630 HydrophobicContact CE1-CB 4.22Å; F584-L631 HydrophobicContact CD1-CD1 4.2Å
585	F	95.7	Very high	94.8	Very high	1 Å²	1	40.5 Å²	40.5	0%	0.004	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	18.1	-175.6	-60.6	-75.1	0	0	0	113.2	W538 L545 V546 W548 L551 L554 I577 L581 N583 L631	W538-F585 HydrophobicContact CH2-CB 3.92Å; W538-F585 AromaticContact CH2-CD2 3.9Å; W538-F585 HydrophobicContact CH2-CD2 3.9Å; W538-F585 AromaticContact CH2-CG 3.99Å; W538-F585 HydrophobicContact CH2-CG 3.99Å; W538-F585 HydrophobicContact CZ2-CD2 4.48Å; W538-F585 HydrophobicContact CZ3-CB 4.44Å; L545-F585 CarbonylContact C-O 3.5Å; L545-F585 WeakPolarHBondContact CA-O 3.49Å; L545-F585 HydrophobicContact CB-CB 4.2Å; L545-F585 HydrophobicContact CD2-CB 4.44Å; V546-F585 PolarHBondContact N-O 2.67Å; W548-F585 HydrophobicContact CB-CD1 3.91Å; W548-F585 HydrophobicContact CB-CE1 4.15Å; W548-F585 AromaticContact CD1-CD1 3.97Å; W548-F585 HydrophobicContact CG-CD1 4.25Å; L551-F585 HydrophobicContact CB-CE1 4.1Å; L551-F585 HydrophobicContact CD1-CE1 4Å; L551-F585 HydrophobicContact CD1-CE2 4.24Å; L551-F585 HydrophobicContact CD1-CZ 3.79Å; L551-F585 HydrophobicContact CG-CE1 4.49Å; L554-F585 HydrophobicContact CD2-CE2 4.36Å; L554-F585 HydrophobicContact CD2-CZ 4.17Å; I577-F585 HydrophobicContact CD1-CE2 4.26Å; I577-F585 HydrophobicContact CG1-CE2 4.32Å; I577-F585 HydrophobicContact CG2-CD2 4Å; I577-F585 HydrophobicContact CG2-CE2 4.06Å; L581-F585 HydrophobicContact CB-CE2 4.1Å; L581-F585 HydrophobicContact CD1-CE2 3.96Å; L581-F585 HydrophobicContact CD1-CZ 4.23Å; N583-F585 PolarHBondContact O-N 2.95Å; F585-L631 HydrophobicContact CD1-CD1 4.43Å; F585-L631 HydrophobicContact CE1-CD1 3.81Å; F585-L631 HydrophobicContact CZ-CD1 4.16Å
586	L	95.3	Very high	94.9	Very high	48 Å²	48	39.1 Å²	39.1	25%	0.251	19%	0.192	S	C	.	.	B	Isolated β-bridge	trans	-61.2	156.1	170.2	-71.5	173.4	0	0	0	110.7	L545 W548 N583 D588 N589 V592	L545-L586 HydrophobicContact CD2-CD2 3.94Å; L545-L586 HydrophobicContact CD2-CG 4.32Å; W548-L586 PolarHBondContact NE1-O 3.22Å; N583-L586 HydrophobicContact CB-CD1 3.68Å; N583-L586 HydrophobicContact CB-CG 4Å; N583-L586 WeakPolarHBondContact O-CG 3.44Å; N583-L586 PolarHBondContact O-N 3.5Å; L586-D588 VanDerWaalsContact C-N 3.27Å; L586-D588 WeakPolarHBondContact CB-O 3.42Å; L586-D588 PolarHBondContact O-N 2.86Å; L586-N589 HydrophobicContact CB-CB 4.33Å; L586-V592 HydrophobicContact CD1-CG2 4.48Å
587	K	92.6	Very high	94.9	Very high	177 Å²	177	39.3 Å²	39.3	77%	0.77	19%	0.193	S	C	*	.	S	Bend	trans	-60	-39.8	172.5	-174	178.3	179.6	-179.9	0	112.1	V546	V546-K587 HydrophobicContact CG1-CB 4.2Å
588	D	94.4	Very high	94.9	Very high	101 Å²	101	39.9 Å²	39.9	54%	0.54	20%	0.197	S	C	.	.	S	Bend	trans	-117.4	104.3	165.2	-178.4	10.4	0	0	0	108.7	L586 S590	L586-D588 VanDerWaalsContact C-N 3.27Å; L586-D588 WeakPolarHBondContact CB-O 3.42Å; L586-D588 PolarHBondContact O-N 2.86Å; D588-S590 VanDerWaalsContact OD1-CB 3.26Å; D588-S590 WeakPolarHBondContact OD1-CB 3.13Å; D588-S590 PolarHBondContact OD1-N 3.07Å; D588-S590 VanDerWaalsContact OD1-N 3.07Å; D588-S590 PolarHBondContact OD1-OG 3.3Å
589	N	94.1	Very high	95.1	Very high	16 Å²	16	38.2 Å²	38.2	9%	0.086	19%	0.187	C	C	.	.			trans	-106.2	8.1	179.1	63.2	2.8	0	0	0	112	W548 F584 L586 H591 V592 I593	W548-N589 WeakPolarHBondContact CZ2-ND2 3.37Å; F584-N589 WeakPolarHBondContact O-CB 3.43Å; F584-N589 PolarHBondContact O-ND2 3.45Å; L586-N589 HydrophobicContact CB-CB 4.33Å; N589-H591 VanDerWaalsContact C-N 3.33Å; N589-H591 PolarHBondContact O-N 3.38Å; N589-V592 WeakPolarHBondContact O-CB 3.44Å; N589-V592 PolarHBondContact O-N 3.18Å; N589-I593 HydrophobicContact CB-CG1 4.29Å; N589-I593 WeakPolarHBondContact O-CG1 3.33Å; N589-I593 PolarHBondContact O-N 3.45Å
590	S	94.1	Very high	95.3	Very high	53 Å²	53	35.1 Å²	35.1	37%	0.371	17%	0.173	S	C	.	.	H	α-helix	trans	-57.1	-44.6	-168.8	-52.6	0	0	0	0	112.2	D588 V592 Q594	D588-S590 VanDerWaalsContact OD1-CB 3.26Å; D588-S590 WeakPolarHBondContact OD1-CB 3.13Å; D588-S590 PolarHBondContact OD1-N 3.07Å; D588-S590 VanDerWaalsContact OD1-N 3.07Å; D588-S590 PolarHBondContact OD1-OG 3.3Å; S590-V592 PolarHBondContact O-N 3.4Å; S590-Q594 VanDerWaalsContact O-CB 3.24Å; S590-Q594 WeakPolarHBondContact O-CB 3.31Å; S590-Q594 WeakPolarHBondContact O-CG 3.47Å; S590-Q594 PolarHBondContact O-N 3.1Å
591	H	93.9	Very high	95.5	Very high	103 Å²	103	36.5 Å²	36.5	48%	0.477	18%	0.183	S	C	.	.	H	α-helix	trans	-66.2	-37	178	-68.5	-71.2	0	0	0	112.9	N589 E595 Y716	N589-H591 VanDerWaalsContact C-N 3.33Å; N589-H591 PolarHBondContact O-N 3.38Å; H591-E595 WeakPolarHBondContact O-CB 3.47Å; H591-E595 PolarHBondContact O-N 3.13Å; H591-Y716 HydrophobicContact CB-CE2 3.99Å
592	V	94.9	Very high	95.6	Very high	7 Å²	7	36.7 Å²	36.7	4%	0.042	18%	0.184	C	C	.	.	H	α-helix	trans	-67.4	-50.3	179.4	-176.7	0	0	0	0	110	N583 F584 L586 N589 S590 E595 Y596 Y716	N583-V592 HydrophobicContact CB-CG2 4.12Å; F584-V592 HydrophobicContact CD2-CG1 3.77Å; F584-V592 HydrophobicContact CE2-CG1 3.88Å; L586-V592 HydrophobicContact CD1-CG2 4.48Å; N589-V592 WeakPolarHBondContact O-CB 3.44Å; N589-V592 PolarHBondContact O-N 3.18Å; S590-V592 PolarHBondContact O-N 3.4Å; V592-E595 PolarHBondContact O-N 2.91Å; V592-Y596 WeakPolarHBondContact O-CB 3.17Å; V592-Y596 PolarHBondContact O-N 2.91Å; V592-Y716 HydrophobicContact CG2-CD1 4.27Å; V592-Y716 HydrophobicContact CG2-CG 4.06Å
593	I	95.6	Very high	95.8	Very high	20 Å²	20	33.6 Å²	33.6	10%	0.103	17%	0.172	C	C	.	.	H	α-helix	trans	-64.5	-45.3	179.8	-62.4	-61.1	0	0	0	110.7	F584 N589 E595 Y596 L597 I627	F584-I593 HydrophobicContact CD1-CD1 3.45Å; F584-I593 VanDerWaalsContact CD1-CD1 3.45Å; F584-I593 HydrophobicContact CE1-CD1 3.48Å; F584-I593 VanDerWaalsContact CE1-CD1 3.48Å; F584-I593 HydrophobicContact CG-CD1 4.04Å; F584-I593 HydrophobicContact CZ-CD1 4.09Å; N589-I593 HydrophobicContact CB-CG1 4.29Å; N589-I593 WeakPolarHBondContact O-CG1 3.33Å; N589-I593 PolarHBondContact O-N 3.45Å; I593-E595 PolarHBondContact O-N 3.1Å; I593-Y596 PolarHBondContact O-N 3.1Å; I593-L597 HydrophobicContact CG2-CD1 3.68Å; I593-L597 HydrophobicContact CG2-CG 4.18Å; I593-L597 WeakPolarHBondContact O-CB 3.13Å; I593-L597 VanDerWaalsContact O-CG 3.29Å; I593-L597 WeakPolarHBondContact O-CG 3.37Å; I593-L597 PolarHBondContact O-N 2.98Å; I593-I627 HydrophobicContact CG2-CD1 4.47Å; I593-I627 HydrophobicContact CG2-CG1 4.14Å
594	Q	96.4	Very high	96	Very high	66 Å²	66	31.7 Å²	31.7	31%	0.308	16%	0.162	S	C	.	.	H	α-helix	trans	-64.8	-40.9	179.6	-72.8	-178.6	19.2	0	0	112.7	S590 Y596 T598 L754	S590-Q594 VanDerWaalsContact O-CB 3.24Å; S590-Q594 WeakPolarHBondContact O-CB 3.31Å; S590-Q594 WeakPolarHBondContact O-CG 3.47Å; S590-Q594 PolarHBondContact O-N 3.1Å; Q594-Y596 VanDerWaalsContact C-N 3.35Å; Q594-T598 VanDerWaalsContact O-CB 3.31Å; Q594-T598 WeakPolarHBondContact O-CB 3.34Å; Q594-T598 PolarHBondContact O-N 3.13Å; Q594-T598 PolarHBondContact O-OG1 2.97Å; Q594-L754 HydrophobicContact CB-CD1 4.38Å; Q594-L754 HydrophobicContact CB-CD2 3.9Å
595	E	95.6	Very high	96	Very high	9 Å²	9	31.7 Å²	31.7	4%	0.042	16%	0.162	C	C	.	.	H	α-helix	trans	-59.7	-49	172.3	-178.9	-176.6	-126.8	0	0	110.1	H591 V592 I593 L597 T598 V599 R714 Q715 Y716 L754 L757	H591-E595 WeakPolarHBondContact O-CB 3.47Å; H591-E595 PolarHBondContact O-N 3.13Å; V592-E595 PolarHBondContact O-N 2.91Å; I593-E595 PolarHBondContact O-N 3.1Å; E595-L597 PolarHBondContact O-N 3.3Å; E595-T598 PolarHBondContact O-N 3Å; E595-V599 HydrophobicContact CG-CG2 4.47Å; E595-V599 WeakPolarHBondContact O-CG2 3.49Å; E595-V599 PolarHBondContact O-N 3.27Å; E595-R714 HydrophobicContact CG-CG 4.46Å; E595-R714 WeakPolarHBondContact OE2-CB 3.37Å; E595-Q715 WeakPolarHBondContact OE1-CB 3.39Å; E595-Q715 PolarHBondContact OE1-N 3.2Å; E595-Q715 PolarHBondContact OE2-N 3.32Å; E595-Y716 HydrophobicContact CB-CD2 4.17Å; E595-Y716 VanDerWaalsContact OE2-CD2 3.26Å; E595-Y716 WeakPolarHBondContact OE2-CD2 3.5Å; E595-Y716 PolarHBondContact OE2-N 2.97Å; E595-L754 HydrophobicContact CB-CD1 4.27Å; E595-L757 HydrophobicContact CG-CD2 3.93Å
596	Y	96.6	Very high	96.1	Very high	3 Å²	3	31.8 Å²	31.8	1%	0.012	16%	0.162	C	C	.	.	H	α-helix	trans	-58.8	-47	-177.6	-161.8	-80.1	0	0	0	112.4	F584 V592 I593 Q594 V599 F600 F630 P658 F659	F584-Y596 AromaticContact CE2-CD2 3.67Å; F584-Y596 HydrophobicContact CE2-CD2 3.67Å; F584-Y596 HydrophobicContact CE2-CE2 4.05Å; F584-Y596 HydrophobicContact CE2-CG 4.25Å; F584-Y596 HydrophobicContact CZ-CD1 4.12Å; F584-Y596 AromaticContact CZ-CD2 3.38Å; F584-Y596 HydrophobicContact CZ-CD2 3.38Å; F584-Y596 HydrophobicContact CZ-CE1 4.4Å; F584-Y596 AromaticContact CZ-CE2 3.68Å; F584-Y596 HydrophobicContact CZ-CE2 3.68Å; F584-Y596 AromaticContact CZ-CG 3.61Å; F584-Y596 HydrophobicContact CZ-CG 3.61Å; V592-Y596 WeakPolarHBondContact O-CB 3.17Å; V592-Y596 PolarHBondContact O-N 2.91Å; I593-Y596 PolarHBondContact O-N 3.1Å; Q594-Y596 VanDerWaalsContact C-N 3.35Å; Y596-V599 PolarHBondContact O-N 2.77Å; Y596-F600 PolarHBondContact O-N 3.16Å; Y596-F630 HydrophobicContact CD1-CB 4.32Å; Y596-F630 AromaticContact CD1-CD2 3.89Å; Y596-F630 HydrophobicContact CD1-CD2 3.89Å; Y596-F630 HydrophobicContact CD1-CE2 4.33Å; Y596-F630 HydrophobicContact CD1-CG 4.01Å; Y596-F630 HydrophobicContact CE1-CB 3.83Å; Y596-F630 AromaticContact CE1-CD1 3.52Å; Y596-F630 HydrophobicContact CE1-CD1 3.52Å; Y596-F630 AromaticContact CE1-CD2 3.6Å; Y596-F630 HydrophobicContact CE1-CD2 3.6Å; Y596-F630 AromaticContact CE1-CE1 3.91Å; Y596-F630 HydrophobicContact CE1-CE1 3.91Å; Y596-F630 AromaticContact CE1-CE2 3.97Å; Y596-F630 HydrophobicContact CE1-CE2 3.97Å; Y596-F630 AromaticContact CE1-CG 3.35Å; Y596-F630 HydrophobicContact CE1-CG 3.35Å; Y596-F630 HydrophobicContact CE1-CZ 4.12Å; Y596-P658 WeakPolarHBondContact OH-CB 3.28Å; Y596-F659 HydrophobicContact CD1-CD1 4.47Å; Y596-F659 AromaticContact CD1-CE1 3.43Å; Y596-F659 HydrophobicContact CD1-CE1 3.43Å; Y596-F659 VanDerWaalsContact CD1-CE1 3.43Å; Y596-F659 AromaticContact CD1-CZ 3.86Å; Y596-F659 HydrophobicContact CD1-CZ 3.86Å; Y596-F659 HydrophobicContact CD2-CE1 4.26Å; Y596-F659 AromaticContact CD2-CZ 3.83Å; Y596-F659 HydrophobicContact CD2-CZ 3.83Å; Y596-F659 AromaticContact CE1-CD1 3.87Å; Y596-F659 HydrophobicContact CE1-CD1 3.87Å; Y596-F659 AromaticContact CE1-CE1 3.12Å; Y596-F659 HydrophobicContact CE1-CE1 3.12Å; Y596-F659 AromaticContact CE1-CZ 3.61Å; Y596-F659 HydrophobicContact CE1-CZ 3.61Å; Y596-F659 HydrophobicContact CE2-CE1 4.05Å; Y596-F659 HydrophobicContact CE2-CE2 4.36Å; Y596-F659 AromaticContact CE2-CZ 3.61Å; Y596-F659 HydrophobicContact CE2-CZ 3.61Å; Y596-F659 AromaticContact CG-CE1 3.99Å; Y596-F659 HydrophobicContact CG-CE1 3.99Å; Y596-F659 AromaticContact CG-CZ 3.95Å; Y596-F659 HydrophobicContact CG-CZ 3.95Å; Y596-F659 AromaticContact CZ-CE1 3.48Å; Y596-F659 VanDerWaalsContact CZ-CE1 3.48Å; Y596-F659 AromaticContact CZ-CZ 3.48Å; Y596-F659 VanDerWaalsContact CZ-CZ 3.48Å; Y596-F659 WeakPolarHBondContact O-CE1 3.44Å
597	L	97.6	Very high	96.2	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-67.9	-34.3	177.5	-67.4	172.9	0	0	0	112.5	I593 E595 F600 S601 P622 D623 A626 I627 F630	I593-L597 HydrophobicContact CG2-CD1 3.68Å; I593-L597 HydrophobicContact CG2-CG 4.18Å; I593-L597 WeakPolarHBondContact O-CB 3.13Å; I593-L597 VanDerWaalsContact O-CG 3.29Å; I593-L597 WeakPolarHBondContact O-CG 3.37Å; I593-L597 PolarHBondContact O-N 2.98Å; E595-L597 PolarHBondContact O-N 3.3Å; L597-F600 PolarHBondContact O-N 3.28Å; L597-S601 PolarHBondContact O-N 2.92Å; L597-P622 HydrophobicContact CD2-CB 4.16Å; L597-D623 HydrophobicContact CD1-CB 4.23Å; L597-A626 HydrophobicContact CD2-CB 3.79Å; L597-I627 HydrophobicContact CD1-CD1 4.37Å; L597-I627 HydrophobicContact CD1-CG1 3.88Å; L597-F630 HydrophobicContact CD2-CD2 4.21Å; L597-F630 HydrophobicContact CD2-CE2 4.44Å
598	T	97.1	Very high	96.4	Very high	17 Å²	17	22.5 Å²	22.5	10%	0.104	12%	0.121	C	C	.	.	H	α-helix	trans	-65.4	-46	174.9	-55.7	0	0	0	0	110.5	Q594 E595 F600 S601 Q602 L757 K758	Q594-T598 VanDerWaalsContact O-CB 3.31Å; Q594-T598 WeakPolarHBondContact O-CB 3.34Å; Q594-T598 PolarHBondContact O-N 3.13Å; Q594-T598 PolarHBondContact O-OG1 2.97Å; E595-T598 PolarHBondContact O-N 3Å; T598-F600 VanDerWaalsContact C-N 3.28Å; T598-F600 PolarHBondContact O-N 3.22Å; T598-S601 WeakPolarHBondContact O-CB 3.48Å; T598-S601 PolarHBondContact O-N 3.42Å; T598-Q602 WeakPolarHBondContact O-CG 3.37Å; T598-Q602 PolarHBondContact O-N 3.06Å; T598-L757 HydrophobicContact CG2-CB 4.44Å; T598-L757 HydrophobicContact CG2-CD2 3.98Å; T598-L757 HydrophobicContact CG2-CG 3.75Å; T598-K758 HydrophobicContact CG2-CB 4.44Å; T598-K758 HydrophobicContact CG2-CG 3.84Å; T598-K758 WeakPolarHBondContact OG1-CG 3.46Å
599	V	96.6	Very high	96.5	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.7	-40.5	173.9	173.8	0	0	0	0	110.5	E595 Y596 S601 Q602 M603 F659 R714 L757	E595-V599 HydrophobicContact CG-CG2 4.47Å; E595-V599 WeakPolarHBondContact O-CG2 3.49Å; E595-V599 PolarHBondContact O-N 3.27Å; Y596-V599 PolarHBondContact O-N 2.77Å; V599-S601 PolarHBondContact O-N 3.48Å; V599-Q602 PolarHBondContact O-N 3.13Å; V599-M603 HydrophobicContact CG1-CG 4.46Å; V599-M603 VanDerWaalsContact O-CG 3.29Å; V599-M603 WeakPolarHBondContact O-CG 3.4Å; V599-M603 PolarHBondContact O-N 3.5Å; V599-F659 HydrophobicContact CB-CZ 4.24Å; V599-F659 HydrophobicContact CG1-CD2 4.5Å; V599-F659 HydrophobicContact CG1-CE1 4.31Å; V599-F659 HydrophobicContact CG1-CE2 3.98Å; V599-F659 HydrophobicContact CG1-CZ 3.88Å; V599-R714 HydrophobicContact CG2-CG 4.05Å; V599-L757 HydrophobicContact CG2-CD2 4.24Å
600	F	98.1	Very high	96.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.3	-41.6	175.1	-177.5	-124.1	0	0	0	112.6	Y596 L597 T598 Q602 M603 I604 P622 Y625 A626 F630 F659 V663 L666	Y596-F600 PolarHBondContact O-N 3.16Å; L597-F600 PolarHBondContact O-N 3.28Å; T598-F600 VanDerWaalsContact C-N 3.28Å; T598-F600 PolarHBondContact O-N 3.22Å; F600-Q602 VanDerWaalsContact C-N 3.35Å; F600-Q602 PolarHBondContact O-N 3.05Å; F600-M603 WeakPolarHBondContact O-CA 3.01Å; F600-M603 WeakPolarHBondContact O-CB 3.26Å; F600-M603 PolarHBondContact O-N 3.33Å; F600-M603 VanDerWaalsContact O-N 3.08Å; F600-I604 HydrophobicContact CD1-CD1 4.18Å; F600-I604 HydrophobicContact CE1-CD1 3.85Å; F600-I604 HydrophobicContact CE1-CG1 4.43Å; F600-I604 HydrophobicContact CE2-CG1 4.35Å; F600-I604 HydrophobicContact CZ-CD1 4.1Å; F600-I604 HydrophobicContact CZ-CG1 4.24Å; F600-I604 WeakPolarHBondContact O-CG1 3.33Å; F600-I604 PolarHBondContact O-N 3.4Å; F600-P622 HydrophobicContact CD1-CB 3.88Å; F600-P622 HydrophobicContact CD1-CG 4.06Å; F600-P622 HydrophobicContact CE1-CB 4.38Å; F600-Y625 HydrophobicContact CE1-CE2 4.22Å; F600-A626 HydrophobicContact CD1-CB 4.2Å; F600-A626 HydrophobicContact CE1-CB 4.05Å; F600-F630 HydrophobicContact CB-CE2 4.17Å; F600-F630 HydrophobicContact CB-CZ 4.39Å; F600-F630 AromaticContact CD1-CE2 3.67Å; F600-F630 HydrophobicContact CD1-CE2 3.67Å; F600-F630 AromaticContact CD1-CZ 3.97Å; F600-F630 HydrophobicContact CD1-CZ 3.97Å; F600-F630 HydrophobicContact CD2-CE2 4.16Å; F600-F630 AromaticContact CD2-CZ 3.66Å; F600-F630 HydrophobicContact CD2-CZ 3.66Å; F600-F630 HydrophobicContact CE1-CE2 4.04Å; F600-F630 HydrophobicContact CE1-CZ 4.12Å; F600-F630 HydrophobicContact CE2-CE2 4.48Å; F600-F630 AromaticContact CE2-CZ 3.81Å; F600-F630 HydrophobicContact CE2-CZ 3.81Å; F600-F630 AromaticContact CG-CE2 3.73Å; F600-F630 HydrophobicContact CG-CE2 3.73Å; F600-F630 AromaticContact CG-CZ 3.73Å; F600-F630 HydrophobicContact CG-CZ 3.73Å; F600-F630 HydrophobicContact CZ-CE2 4.43Å; F600-F630 HydrophobicContact CZ-CZ 4.04Å; F600-F659 HydrophobicContact CB-CD1 3.81Å; F600-F659 HydrophobicContact CB-CE1 3.94Å; F600-F659 HydrophobicContact CD2-CB 4.43Å; F600-F659 AromaticContact CD2-CD1 3.89Å; F600-F659 HydrophobicContact CD2-CD1 3.89Å; F600-F659 HydrophobicContact CG-CD1 4.26Å; F600-V663 HydrophobicContact CD2-CG2 4.45Å; F600-V663 HydrophobicContact CE2-CG2 3.85Å; F600-L666 HydrophobicContact CE1-CD1 4.19Å; F600-L666 HydrophobicContact CZ-CD1 3.76Å
601	S	98	Very high	96.8	Very high	30 Å²	30	19 Å²	19	21%	0.21	10%	0.095	C	C	.	.	H	α-helix	trans	-58.5	-45.6	174.1	-170.5	0	0	0	0	111.9	L597 T598 V599 M603 I604 A605	L597-S601 PolarHBondContact O-N 2.92Å; T598-S601 WeakPolarHBondContact O-CB 3.48Å; T598-S601 PolarHBondContact O-N 3.42Å; V599-S601 PolarHBondContact O-N 3.48Å; S601-M603 VanDerWaalsContact C-N 3.27Å; S601-M603 PolarHBondContact O-N 3.41Å; S601-I604 WeakPolarHBondContact O-CB 3.4Å; S601-I604 PolarHBondContact O-N 3.25Å; S601-I604 VanDerWaalsContact O-N 3.16Å; S601-A605 PolarHBondContact O-N 3.03Å
602	Q	97.3	Very high	97	Very high	4 Å²	4	14.3 Å²	14.3	2%	0.019	7%	0.074	C	C	.	.	H	α-helix	trans	-62.1	-34.2	174.3	-67.9	179.1	-12.7	0	0	112.2	T598 V599 F600 A605 F606 L757 E760 P763	T598-Q602 WeakPolarHBondContact O-CG 3.37Å; T598-Q602 PolarHBondContact O-N 3.06Å; V599-Q602 PolarHBondContact O-N 3.13Å; F600-Q602 VanDerWaalsContact C-N 3.35Å; F600-Q602 PolarHBondContact O-N 3.05Å; Q602-A605 PolarHBondContact O-N 3.27Å; Q602-F606 WeakPolarHBondContact O-CB 3.41Å; Q602-F606 PolarHBondContact O-N 2.91Å; Q602-L757 PolarHBondContact NE2-O 3.14Å; Q602-L757 VanDerWaalsContact NE2-O 3.1Å; Q602-E760 PolarHBondContact NE2-O 3.2Å; Q602-P763 HydrophobicContact CB-CB 4.46Å
603	M	97.8	Very high	97.1	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-68.7	-35.6	175.2	-73.3	-56.7	-60.9	0	0	112.8	V599 F600 S601 F606 H607 F659 V663 T707 T712	V599-M603 HydrophobicContact CG1-CG 4.46Å; V599-M603 VanDerWaalsContact O-CG 3.29Å; V599-M603 WeakPolarHBondContact O-CG 3.4Å; V599-M603 PolarHBondContact O-N 3.5Å; F600-M603 WeakPolarHBondContact O-CA 3.01Å; F600-M603 WeakPolarHBondContact O-CB 3.26Å; F600-M603 PolarHBondContact O-N 3.33Å; F600-M603 VanDerWaalsContact O-N 3.08Å; S601-M603 VanDerWaalsContact C-N 3.27Å; S601-M603 PolarHBondContact O-N 3.41Å; M603-F606 PolarHBondContact O-N 3.45Å; M603-H607 WeakPolarHBondContact CE-NE2 3.48Å; M603-H607 PolarHBondContact O-CD2 3.04Å; M603-H607 PolarHBondContact O-N 2.9Å; M603-H607 VanDerWaalsContact O-N 3.12Å; M603-F659 HydrophobicContact CG-CB 4.19Å; M603-F659 HydrophobicContact CG-CG 4.45Å; M603-V663 HydrophobicContact CB-CG2 4.23Å; M603-T707 HydrophobicContact CE-CG2 3.45Å; M603-T707 VanDerWaalsContact CE-CG2 3.45Å; M603-T707 WeakPolarHBondContact CE-OG1 3.13Å; M603-T707 HydrophobicContact SD-CG2 3.95Å; M603-T712 HydrophobicContact CE-CG2 4.12Å; M603-T712 HydrophobicContact CG-CG2 4.29Å; M603-T712 HydrophobicContact SD-CG2 3.59Å; M603-T712 VanDerWaalsContact SD-CG2 3.59Å
604	I	98.1	Very high	97.2	Very high	5 Å²	5	16 Å²	16	3%	0.026	8%	0.082	C	C	.	.	H	α-helix	trans	-63.9	-50.7	171.2	-58.1	165	0	0	0	108.8	F600 S601 F606 H607 D608 P622 V663 L666	F600-I604 HydrophobicContact CD1-CD1 4.18Å; F600-I604 HydrophobicContact CE1-CD1 3.85Å; F600-I604 HydrophobicContact CE1-CG1 4.43Å; F600-I604 HydrophobicContact CE2-CG1 4.35Å; F600-I604 HydrophobicContact CZ-CD1 4.1Å; F600-I604 HydrophobicContact CZ-CG1 4.24Å; F600-I604 WeakPolarHBondContact O-CG1 3.33Å; F600-I604 PolarHBondContact O-N 3.4Å; S601-I604 WeakPolarHBondContact O-CB 3.4Å; S601-I604 PolarHBondContact O-N 3.25Å; S601-I604 VanDerWaalsContact O-N 3.16Å; I604-F606 VanDerWaalsContact C-N 3.27Å; I604-F606 PolarHBondContact O-N 3.3Å; I604-H607 PolarHBondContact O-N 3.38Å; I604-D608 CarbonylContact O-C 3.59Å; I604-D608 VanDerWaalsContact O-C 3.31Å; I604-D608 WeakPolarHBondContact O-CA 3.49Å; I604-D608 PolarHBondContact O-N 3.2Å; I604-P622 HydrophobicContact CD1-CG 4.17Å; I604-V663 HydrophobicContact CG1-CG2 4.18Å; I604-L666 HydrophobicContact CD1-CD1 3.47Å; I604-L666 VanDerWaalsContact CD1-CD1 3.47Å; I604-L666 HydrophobicContact CG1-CD1 3.75Å
605	A	97.4	Very high	97.2	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.008	7%	0.068	C	C	.	.	H	α-helix	trans	-58.7	-38	177.7	0	0	0	0	0	113	S601 Q602 S612 V761 V861	S601-A605 PolarHBondContact O-N 3.03Å; Q602-A605 PolarHBondContact O-N 3.27Å; A605-S612 WeakPolarHBondContact CB-OG 3.11Å; A605-V761 HydrophobicContact CB-CG1 3.87Å; A605-V761 WeakPolarHBondContact CB-O 3.37Å; A605-V861 HydrophobicContact CB-CG1 4.25Å
606	F	96.9	Very high	97.2	Very high	2 Å²	2	16.1 Å²	16.1	1%	0.009	9%	0.085	C	C	.	.	H	α-helix	trans	-66.6	-39	178.6	-177.1	-93.6	0	0	0	112.1	Q602 M603 I604 P763 V842 R867 C869	Q602-F606 WeakPolarHBondContact O-CB 3.41Å; Q602-F606 PolarHBondContact O-N 2.91Å; M603-F606 PolarHBondContact O-N 3.45Å; I604-F606 VanDerWaalsContact C-N 3.27Å; I604-F606 PolarHBondContact O-N 3.3Å; F606-P763 HydrophobicContact CB-CG 4.16Å; F606-P763 HydrophobicContact CD2-CG 3.7Å; F606-P763 HydrophobicContact CE2-CG 4.5Å; F606-P763 HydrophobicContact CG-CG 4.16Å; F606-V842 HydrophobicContact CE2-CG1 4.47Å; F606-V842 HydrophobicContact CZ-CG1 4.32Å; F606-V842 HydrophobicContact CZ-CG2 4.31Å; F606-R867 HydrophobicContact CD1-CG 4.34Å; F606-R867 HydrophobicContact CD2-CB 4.45Å; F606-R867 HydrophobicContact CE1-CB 4.08Å; F606-R867 HydrophobicContact CE1-CG 3.86Å; F606-R867 HydrophobicContact CE2-CB 3.84Å; F606-R867 HydrophobicContact CE2-CG 4.5Å; F606-R867 HydrophobicContact CZ-CB 3.65Å; F606-R867 HydrophobicContact CZ-CG 3.95Å; F606-R867 VanDerWaalsContact O-CA 3.27Å; F606-R867 WeakPolarHBondContact O-CA 3.45Å; F606-R867 PolarHBondContact O-N 3.46Å; F606-C869 WeakPolarHBondContact CE2-SG 3.38Å
607	H	96.8	Very high	97.2	Very high	18 Å²	18	23.4 Å²	23.4	8%	0.083	12%	0.119	C	C	.	.	H	α-helix	trans	-98	-35.5	-176.1	-73.8	-67.1	0	0	0	114.5	M603 I604 V663 L703 T707	M603-H607 WeakPolarHBondContact CE-NE2 3.48Å; M603-H607 PolarHBondContact O-CD2 3.04Å; M603-H607 PolarHBondContact O-N 2.9Å; M603-H607 VanDerWaalsContact O-N 3.12Å; I604-H607 PolarHBondContact O-N 3.38Å; H607-V663 HydrophobicContact CB-CG1 3.98Å; H607-L703 HydrophobicContact CB-CD2 3.81Å; H607-L703 PolarHBondContact CE1-O 2.9Å; H607-L703 VanDerWaalsContact CG-CD2 3.45Å; H607-L703 WeakPolarHBondContact ND1-CD2 3.29Å; H607-T707 PolarHBondContact CE1-OG1 3.29Å; H607-T707 VanDerWaalsContact CE1-OG1 3.27Å; H607-T707 PolarHBondContact NE2-OG1 2.87Å
608	D	96.9	Very high	97.2	Very high	13 Å²	13	25.2 Å²	25.2	7%	0.07	13%	0.128	C	C	.	.			trans	-137.3	79.6	-180	-162.3	-20.6	0	0	0	110.5	I604 E610 L611 S612 R670	I604-D608 CarbonylContact O-C 3.59Å; I604-D608 VanDerWaalsContact O-C 3.31Å; I604-D608 WeakPolarHBondContact O-CA 3.49Å; I604-D608 PolarHBondContact O-N 3.2Å; D608-E610 VanDerWaalsContact C-N 3.29Å; D608-E610 PolarHBondContact O-N 3.1Å; D608-L611 HydrophobicContact CB-CB 4.04Å; D608-L611 VanDerWaalsContact CG-CB 3.45Å; D608-L611 PolarHBondContact O-N 2.95Å; D608-L611 PolarHBondContact OD1-N 3.21Å; D608-S612 PolarHBondContact O-N 3.4Å; D608-R670 IonicContact OD1-NE 3.57Å; D608-R670 IonicContact OD1-NH2 3.13Å; D608-R670 PolarHBondContact OD1-NH2 3.14Å; D608-R670 VanDerWaalsContact OD2-CD 3.32Å; D608-R670 WeakPolarHBondContact OD2-CD 3.41Å; D608-R670 IonicContact OD2-CZ 3.6Å; D608-R670 IonicContact OD2-NE 3.7Å; D608-R670 PolarHBondContact OD2-NE 3.38Å
609	P	96.6	Very high	97.1	Very high	8 Å²	8	26.2 Å²	26.2	5%	0.052	14%	0.142	C	C	.	.	H	α-helix	trans	-64.1	-33.4	-176.6	27.6	-37.7	0	0	0	112.6	S612 N613 V861 N864	P609-S612 PolarHBondContact O-N 3.23Å; P609-N613 WeakPolarHBondContact O-CB 3.49Å; P609-N613 PolarHBondContact O-N 3.31Å; P609-N613 PolarHBondContact O-ND2 2.85Å; P609-V861 HydrophobicContact CB-CG1 3.86Å; P609-N864 HydrophobicContact CG-CB 4.4Å
610	E	97.4	Very high	97.1	Very high	87 Å²	87	26.2 Å²	26.2	41%	0.407	14%	0.142	S	C	.	.	H	α-helix	trans	-64.2	-47.7	178.6	-176.3	-177.5	175.8	0	0	110.7	D608 N613 H614 R670 L674 N864	D608-E610 VanDerWaalsContact C-N 3.29Å; D608-E610 PolarHBondContact O-N 3.1Å; E610-N613 PolarHBondContact O-N 2.96Å; E610-H614 PolarHBondContact O-N 2.98Å; E610-H614 VanDerWaalsContact O-N 3.08Å; E610-R670 VanDerWaalsContact CD-NH2 3.32Å; E610-R670 IonicContact OE2-CZ 2.6Å; E610-R670 IonicContact OE2-NH2 3.98Å; E610-R670 PolarHBondContact OE2-NH2 3.11Å; E610-L674 HydrophobicContact CG-CD2 4.37Å; E610-N864 VanDerWaalsContact CA-OD1 3.32Å; E610-N864 WeakPolarHBondContact CA-OD1 3.34Å; E610-N864 PolarHBondContact N-OD1 3.02Å
611	L	97.7	Very high	97	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-62.2	-44.8	174.5	-177.9	61.7	0	0	0	111.2	D608 N613 H614 L615 L666 L673 L674	D608-L611 HydrophobicContact CB-CB 4.04Å; D608-L611 VanDerWaalsContact CG-CB 3.45Å; D608-L611 PolarHBondContact O-N 2.95Å; D608-L611 PolarHBondContact OD1-N 3.21Å; L611-N613 PolarHBondContact O-N 3.01Å; L611-H614 PolarHBondContact O-N 3.41Å; L611-L615 HydrophobicContact CD1-CD1 4.04Å; L611-L615 HydrophobicContact CD1-CD2 4.25Å; L611-L615 HydrophobicContact CD1-CG 4Å; L611-L615 HydrophobicContact CG-CD1 3.9Å; L611-L615 HydrophobicContact CG-CG 4.26Å; L611-L615 VanDerWaalsContact O-CG 3.24Å; L611-L615 WeakPolarHBondContact O-CG 3.43Å; L611-L615 PolarHBondContact O-N 3.45Å; L611-L666 HydrophobicContact CD2-CB 4.13Å; L611-L673 HydrophobicContact CD1-CB 3.69Å; L611-L673 HydrophobicContact CD1-CD1 4.02Å; L611-L673 HydrophobicContact CD2-CD1 4.28Å; L611-L674 HydrophobicContact CD1-CD2 4.11Å; L611-L674 HydrophobicContact CD1-CG 4.22Å
612	S	97.6	Very high	96.9	Very high	4 Å²	4	28.4 Å²	28.4	3%	0.028	15%	0.15	C	C	.	.	H	α-helix	trans	-58.8	-45.6	178.1	-174.2	0	0	0	0	112.6	A605 D608 P609 L615 N616	A605-S612 WeakPolarHBondContact CB-OG 3.11Å; D608-S612 PolarHBondContact O-N 3.4Å; P609-S612 PolarHBondContact O-N 3.23Å; S612-L615 PolarHBondContact O-N 3.27Å; S612-N616 WeakPolarHBondContact O-CB 3.07Å; S612-N616 VanDerWaalsContact O-CG 3.25Å; S612-N616 PolarHBondContact O-N 3.38Å; S612-N616 PolarHBondContact O-ND2 3.07Å; S612-N616 PolarHBondContact OG-ND2 3.12Å
613	N	97	Very high	96.7	Very high	27 Å²	27	31.3 Å²	31.3	14%	0.144	17%	0.166	C	C	.	.	H	α-helix	trans	-60	-49.6	178.4	-68.9	-28.8	0	0	0	110.7	P609 E610 L611 L615 N616 E617 V861 N864	P609-N613 WeakPolarHBondContact O-CB 3.49Å; P609-N613 PolarHBondContact O-N 3.31Å; P609-N613 PolarHBondContact O-ND2 2.85Å; E610-N613 PolarHBondContact O-N 2.96Å; L611-N613 PolarHBondContact O-N 3.01Å; N613-L615 PolarHBondContact O-N 3.02Å; N613-N616 PolarHBondContact O-N 3.35Å; N613-E617 WeakPolarHBondContact O-CB 3.46Å; N613-E617 VanDerWaalsContact O-CG 3.3Å; N613-E617 WeakPolarHBondContact O-CG 3.45Å; N613-E617 PolarHBondContact O-N 3.36Å; N613-V861 PolarHBondContact ND2-O 3.06Å; N613-N864 PolarHBondContact ND2-OD1 2.69Å; N613-N864 VanDerWaalsContact ND2-OD1 3.13Å
614	H	97.8	Very high	96.5	Very high	35 Å²	35	35.5 Å²	35.5	16%	0.162	19%	0.188	C	C	.	.	H	α-helix	trans	-58.3	-49.9	177.7	177.9	71.8	0	0	0	112.6	E610 L611 N616 E617 I618 L673 L674 N676	E610-H614 PolarHBondContact O-N 2.98Å; E610-H614 VanDerWaalsContact O-N 3.08Å; L611-H614 PolarHBondContact O-N 3.41Å; H614-N616 VanDerWaalsContact C-N 3.29Å; H614-N616 PolarHBondContact O-N 3.27Å; H614-E617 WeakPolarHBondContact O-CB 3.24Å; H614-E617 PolarHBondContact O-N 3.01Å; H614-E617 VanDerWaalsContact O-N 3.14Å; H614-I618 WeakPolarHBondContact O-CG1 3.34Å; H614-I618 PolarHBondContact O-N 3.15Å; H614-L673 PolarHBondContact CD2-O 3Å; H614-L673 PolarHBondContact NE2-O 2.56Å; H614-L674 HydrophobicContact CB-CD2 3.73Å; H614-N676 PolarHBondContact CE1-O 3.47Å; H614-N676 PolarHBondContact NE2-O 3.32Å
615	L	96.9	Very high	96.3	Very high	6 Å²	6	36 Å²	36	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-62.2	-37.9	-179.1	-63.5	177	0	0	0	111.8	L611 S612 N613 I618 G619 F620 L673	L611-L615 HydrophobicContact CD1-CD1 4.04Å; L611-L615 HydrophobicContact CD1-CD2 4.25Å; L611-L615 HydrophobicContact CD1-CG 4Å; L611-L615 HydrophobicContact CG-CD1 3.9Å; L611-L615 HydrophobicContact CG-CG 4.26Å; L611-L615 VanDerWaalsContact O-CG 3.24Å; L611-L615 WeakPolarHBondContact O-CG 3.43Å; L611-L615 PolarHBondContact O-N 3.45Å; S612-L615 PolarHBondContact O-N 3.27Å; N613-L615 PolarHBondContact O-N 3.02Å; L615-I618 HydrophobicContact CD2-CD1 4.39Å; L615-I618 WeakPolarHBondContact O-CG1 3.45Å; L615-G619 PolarHBondContact O-N 3.4Å; L615-F620 HydrophobicContact CD2-CB 4.5Å; L615-F620 HydrophobicContact CD2-CD1 3.87Å; L615-F620 PolarHBondContact O-N 2.74Å; L615-L673 HydrophobicContact CD2-CB 4.44Å
616	N	95.5	Very high	96.2	Very high	72 Å²	72	35.9 Å²	35.9	39%	0.385	19%	0.189	S	C	.	.	H	α-helix	trans	-67.9	-40.5	174.6	-73.4	-35.2	0	0	0	112.1	S612 N613 H614 I618 G619	S612-N616 WeakPolarHBondContact O-CB 3.07Å; S612-N616 VanDerWaalsContact O-CG 3.25Å; S612-N616 PolarHBondContact O-N 3.38Å; S612-N616 PolarHBondContact O-ND2 3.07Å; S612-N616 PolarHBondContact OG-ND2 3.12Å; N613-N616 PolarHBondContact O-N 3.35Å; H614-N616 VanDerWaalsContact C-N 3.29Å; H614-N616 PolarHBondContact O-N 3.27Å; N616-I618 VanDerWaalsContact C-N 3.34Å; N616-I618 PolarHBondContact O-N 3.17Å; N616-G619 PolarHBondContact O-N 3.04Å; N616-G619 VanDerWaalsContact O-N 3.14Å
617	E	96.4	Very high	96.1	Very high	156 Å²	156	39 Å²	39	73%	0.729	21%	0.206	S	C	*	.	H	α-helix	trans	-61.7	-40	178	-77.9	174	-170.9	0	0	112.3	N613 H614 G619	N613-E617 WeakPolarHBondContact O-CB 3.46Å; N613-E617 VanDerWaalsContact O-CG 3.3Å; N613-E617 WeakPolarHBondContact O-CG 3.45Å; N613-E617 PolarHBondContact O-N 3.36Å; H614-E617 WeakPolarHBondContact O-CB 3.24Å; H614-E617 PolarHBondContact O-N 3.01Å; H614-E617 VanDerWaalsContact O-N 3.14Å; E617-G619 VanDerWaalsContact C-N 3.3Å
618	I	97.1	Very high	95.9	Very high	43 Å²	43	41 Å²	41	22%	0.221	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-1.4	177	69.1	172.9	0	0	0	113.4	H614 L615 N616 F620	H614-I618 WeakPolarHBondContact O-CG1 3.34Å; H614-I618 PolarHBondContact O-N 3.15Å; L615-I618 HydrophobicContact CD2-CD1 4.39Å; L615-I618 WeakPolarHBondContact O-CG1 3.45Å; N616-I618 VanDerWaalsContact C-N 3.34Å; N616-I618 PolarHBondContact O-N 3.17Å; I618-F620 VanDerWaalsContact C-N 3.31Å; I618-F620 HydrophobicContact CD1-CB 3.71Å; I618-F620 HydrophobicContact CG1-CB 3.7Å; I618-F620 PolarHBondContact O-N 2.87Å
619	G	96.2	Very high	95.9	Very high	37 Å²	37	41 Å²	41	38%	0.381	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	19.9	-178.2	0	0	0	0	0	115	L615 N616 E617 I621	L615-G619 PolarHBondContact O-N 3.4Å; N616-G619 PolarHBondContact O-N 3.04Å; N616-G619 VanDerWaalsContact O-N 3.14Å; E617-G619 VanDerWaalsContact C-N 3.3Å; G619-I621 PolarHBondContact O-N 3.26Å
620	F	96.7	Very high	95.9	Very high	1 Å²	1	40.8 Å²	40.8	0%	0.004	22%	0.217	C	C	.	.			trans	-90.5	78.4	179.5	-170.1	-99.5	0	0	0	110.9	L615 I618 L624 Y625 F678 C681 I682 F685	L615-F620 HydrophobicContact CD2-CB 4.5Å; L615-F620 HydrophobicContact CD2-CD1 3.87Å; L615-F620 PolarHBondContact O-N 2.74Å; I618-F620 VanDerWaalsContact C-N 3.31Å; I618-F620 HydrophobicContact CD1-CB 3.71Å; I618-F620 HydrophobicContact CG1-CB 3.7Å; I618-F620 PolarHBondContact O-N 2.87Å; F620-L624 HydrophobicContact CD2-CD1 4.33Å; F620-Y625 AromaticContact CD1-CD1 4Å; F620-Y625 HydrophobicContact CD1-CD1 4Å; F620-Y625 AromaticContact CD1-CE1 3.77Å; F620-Y625 HydrophobicContact CD1-CE1 3.77Å; F620-Y625 AromaticContact CE1-CD1 3.32Å; F620-Y625 HydrophobicContact CE1-CD1 3.32Å; F620-Y625 AromaticContact CE1-CE1 3.42Å; F620-Y625 HydrophobicContact CE1-CE1 3.42Å; F620-Y625 VanDerWaalsContact CE1-CE1 3.42Å; F620-Y625 HydrophobicContact CE1-CG 4.22Å; F620-Y625 HydrophobicContact CE2-CD1 4.41Å; F620-Y625 AromaticContact CZ-CD1 3.57Å; F620-Y625 HydrophobicContact CZ-CD1 3.57Å; F620-Y625 HydrophobicContact CZ-CE1 4.16Å; F620-Y625 HydrophobicContact CZ-CG 4.25Å; F620-F678 HydrophobicContact CB-CD2 4.2Å; F620-F678 HydrophobicContact CD2-CD2 4.16Å; F620-F678 HydrophobicContact CD2-CE2 4.26Å; F620-C681 HydrophobicContact CD1-CB 4.19Å; F620-C681 HydrophobicContact CD2-CB 3.8Å; F620-C681 HydrophobicContact CE1-CB 4.1Å; F620-C681 HydrophobicContact CE2-CB 3.73Å; F620-C681 HydrophobicContact CG-CB 4.02Å; F620-C681 HydrophobicContact CZ-CB 3.88Å; F620-I682 HydrophobicContact CD2-CD1 4.17Å; F620-I682 HydrophobicContact CD2-CG1 4.28Å; F620-I682 HydrophobicContact CE2-CD1 3.62Å; F620-I682 HydrophobicContact CE2-CG1 3.87Å; F620-F685 HydrophobicContact CE1-CD2 4.07Å; F620-F685 AromaticContact CE1-CE2 3.56Å; F620-F685 HydrophobicContact CE1-CE2 3.56Å; F620-F685 AromaticContact CE1-CZ 3.99Å; F620-F685 HydrophobicContact CE1-CZ 3.99Å; F620-F685 AromaticContact CZ-CD2 3.67Å; F620-F685 HydrophobicContact CZ-CD2 3.67Å; F620-F685 AromaticContact CZ-CE2 3.68Å; F620-F685 HydrophobicContact CZ-CE2 3.68Å; F620-F685 HydrophobicContact CZ-CG 4.27Å; F620-F685 HydrophobicContact CZ-CZ 4.32Å
621	I	94.5	Very high	95.7	Very high	70 Å²	70	37.3 Å²	37.3	36%	0.359	20%	0.202	S	C	.	.			trans	-88.2	156.1	-174	61.5	172.9	0	0	0	113.1	G619 D623 L624 Y625	G619-I621 PolarHBondContact O-N 3.26Å; I621-D623 HydrophobicContact CD1-CB 4.05Å; I621-D623 HydrophobicContact CG1-CB 4.18Å; I621-D623 PolarHBondContact O-N 3.5Å; I621-D623 VanDerWaalsContact O-N 3.09Å; I621-L624 HydrophobicContact CG1-CD1 4.42Å; I621-L624 HydrophobicContact CG1-CG 4.27Å; I621-L624 PolarHBondContact O-N 2.85Å; I621-L624 VanDerWaalsContact O-N 3.1Å; I621-Y625 WeakPolarHBondContact O-CE1 3.39Å
622	P	96	Very high	95.7	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.032	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-53	-29.8	-179.8	-30.7	37.6	0	0	0	116.5	L597 F600 I604 L624 Y625 A626	L597-P622 HydrophobicContact CD2-CB 4.16Å; F600-P622 HydrophobicContact CD1-CB 3.88Å; F600-P622 HydrophobicContact CD1-CG 4.06Å; F600-P622 HydrophobicContact CE1-CB 4.38Å; I604-P622 HydrophobicContact CD1-CG 4.17Å; P622-L624 PolarHBondContact O-N 2.73Å; P622-Y625 PolarHBondContact O-N 3.35Å; P622-Y625 VanDerWaalsContact O-N 3.14Å; P622-A626 HydrophobicContact CB-CB 4.18Å; P622-A626 VanDerWaalsContact O-CB 3.32Å; P622-A626 WeakPolarHBondContact O-CB 3.42Å; P622-A626 PolarHBondContact O-N 3.2Å
623	D	93.9	Very high	95.7	Very high	65 Å²	65	37.2 Å²	37.2	35%	0.348	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-54.2	-24.7	177.1	-58.5	-120.7	0	0	0	113.5	L597 I621 I627	L597-D623 HydrophobicContact CD1-CB 4.23Å; I621-D623 HydrophobicContact CD1-CB 4.05Å; I621-D623 HydrophobicContact CG1-CB 4.18Å; I621-D623 PolarHBondContact O-N 3.5Å; I621-D623 VanDerWaalsContact O-N 3.09Å; D623-I627 WeakPolarHBondContact O-CD1 3.27Å
624	L	93.9	Very high	95.7	Very high	90 Å²	90	36 Å²	36	47%	0.471	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-83.2	-25.9	-177.8	-60.6	174.6	0	0	0	113.8	F620 I621 P622 F678	F620-L624 HydrophobicContact CD2-CD1 4.33Å; I621-L624 HydrophobicContact CG1-CD1 4.42Å; I621-L624 HydrophobicContact CG1-CG 4.27Å; I621-L624 PolarHBondContact O-N 2.85Å; I621-L624 VanDerWaalsContact O-N 3.1Å; P622-L624 PolarHBondContact O-N 2.73Å; L624-F678 HydrophobicContact CD1-CE2 3.61Å; L624-F678 HydrophobicContact CD1-CZ 4.04Å
625	Y	93.7	Very high	95.6	Very high	14 Å²	14	34.3 Å²	34.3	6%	0.055	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.9	-23.4	-169.1	65.2	-99.2	0	0	0	115	F600 F620 I621 P622 W629 L666 F685	F600-Y625 HydrophobicContact CE1-CE2 4.22Å; F620-Y625 AromaticContact CD1-CD1 4Å; F620-Y625 HydrophobicContact CD1-CD1 4Å; F620-Y625 AromaticContact CD1-CE1 3.77Å; F620-Y625 HydrophobicContact CD1-CE1 3.77Å; F620-Y625 AromaticContact CE1-CD1 3.32Å; F620-Y625 HydrophobicContact CE1-CD1 3.32Å; F620-Y625 AromaticContact CE1-CE1 3.42Å; F620-Y625 HydrophobicContact CE1-CE1 3.42Å; F620-Y625 VanDerWaalsContact CE1-CE1 3.42Å; F620-Y625 HydrophobicContact CE1-CG 4.22Å; F620-Y625 HydrophobicContact CE2-CD1 4.41Å; F620-Y625 AromaticContact CZ-CD1 3.57Å; F620-Y625 HydrophobicContact CZ-CD1 3.57Å; F620-Y625 HydrophobicContact CZ-CE1 4.16Å; F620-Y625 HydrophobicContact CZ-CG 4.25Å; I621-Y625 WeakPolarHBondContact O-CE1 3.39Å; P622-Y625 PolarHBondContact O-N 3.35Å; P622-Y625 VanDerWaalsContact O-N 3.14Å; Y625-W629 HydrophobicContact CD2-CH2 4.22Å; Y625-W629 HydrophobicContact CD2-CZ2 4.32Å; Y625-W629 HydrophobicContact CD2-CZ3 4.3Å; Y625-W629 HydrophobicContact CE2-CH2 4.27Å; Y625-W629 HydrophobicContact CE2-CZ3 4.13Å; Y625-L666 HydrophobicContact CE2-CD2 4.09Å; Y625-F685 HydrophobicContact CD1-CE1 4.35Å; Y625-F685 HydrophobicContact CD1-CZ 4.44Å; Y625-F685 AromaticContact CD2-CD1 3.85Å; Y625-F685 HydrophobicContact CD2-CD1 3.85Å; Y625-F685 AromaticContact CD2-CE1 3.25Å; Y625-F685 HydrophobicContact CD2-CE1 3.25Å; Y625-F685 AromaticContact CD2-CZ 3.92Å; Y625-F685 HydrophobicContact CD2-CZ 3.92Å; Y625-F685 AromaticContact CE2-CE1 3.79Å; Y625-F685 HydrophobicContact CE2-CE1 3.79Å; Y625-F685 HydrophobicContact CE2-CZ 4.1Å; Y625-F685 AromaticContact CG-CD1 3.84Å; Y625-F685 HydrophobicContact CG-CD1 3.84Å; Y625-F685 AromaticContact CG-CE1 3.58Å; Y625-F685 HydrophobicContact CG-CE1 3.58Å; Y625-F685 HydrophobicContact CG-CZ 4.1Å
626	A	95.6	Very high	95.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-94.3	-9.9	-169.7	0	0	0	0	0	114	L597 F600 P622 W629 F630	L597-A626 HydrophobicContact CD2-CB 3.79Å; F600-A626 HydrophobicContact CD1-CB 4.2Å; F600-A626 HydrophobicContact CE1-CB 4.05Å; P622-A626 HydrophobicContact CB-CB 4.18Å; P622-A626 VanDerWaalsContact O-CB 3.32Å; P622-A626 WeakPolarHBondContact O-CB 3.42Å; P622-A626 PolarHBondContact O-N 3.2Å; A626-W629 HydrophobicContact CB-CE3 4.48Å; A626-W629 WeakPolarHBondContact O-CB 3.45Å; A626-W629 PolarHBondContact O-N 3.25Å; A626-F630 HydrophobicContact CB-CD2 4.01Å; A626-F630 HydrophobicContact CB-CE2 3.75Å; A626-F630 WeakPolarHBondContact O-CD2 3.45Å; A626-F630 PolarHBondContact O-N 3.2Å
627	I	94.3	Very high	95.1	Very high	68 Å²	68	38.2 Å²	38.2	35%	0.349	21%	0.205	S	C	.	.	H	α-helix	trans	-59	-52.6	176.4	-66.8	168.4	0	0	0	111.1	I593 L597 D623 W629 F630 L631	I593-I627 HydrophobicContact CG2-CD1 4.47Å; I593-I627 HydrophobicContact CG2-CG1 4.14Å; L597-I627 HydrophobicContact CD1-CD1 4.37Å; L597-I627 HydrophobicContact CD1-CG1 3.88Å; D623-I627 WeakPolarHBondContact O-CD1 3.27Å; I627-W629 PolarHBondContact O-N 2.68Å; I627-F630 PolarHBondContact O-N 3.12Å; I627-L631 WeakPolarHBondContact O-CB 3.47Å; I627-L631 PolarHBondContact O-N 3.39Å
628	P	93	Very high	95	Very high	60 Å²	60	31.4 Å²	31.4	39%	0.39	17%	0.173	S	C	.	.	H	α-helix	trans	-61.7	-33.7	178.4	-22.3	34.5	0	0	0	112.7	T632	P628-T632 WeakPolarHBondContact O-CB 3.2Å; P628-T632 PolarHBondContact O-N 3.5Å; P628-T632 PolarHBondContact O-OG1 2.95Å
629	W	95.5	Very high	94.9	Very high	12 Å²	12	31.2 Å²	31.2	5%	0.045	17%	0.174	C	C	.	.	H	α-helix	trans	-61	-52.8	178.5	-66.6	10.4	0	0	0	111	Y625 A626 I627 M633 F634 V637 I665 L666 F685	Y625-W629 HydrophobicContact CD2-CH2 4.22Å; Y625-W629 HydrophobicContact CD2-CZ2 4.32Å; Y625-W629 HydrophobicContact CD2-CZ3 4.3Å; Y625-W629 HydrophobicContact CE2-CH2 4.27Å; Y625-W629 HydrophobicContact CE2-CZ3 4.13Å; A626-W629 HydrophobicContact CB-CE3 4.48Å; A626-W629 WeakPolarHBondContact O-CB 3.45Å; A626-W629 PolarHBondContact O-N 3.25Å; I627-W629 PolarHBondContact O-N 2.68Å; W629-M633 CarbonylContact O-C 3.5Å; W629-M633 VanDerWaalsContact O-CA 3.28Å; W629-M633 WeakPolarHBondContact O-CA 3.46Å; W629-M633 PolarHBondContact O-N 3.3Å; W629-F634 HydrophobicContact CB-CD1 3.84Å; W629-F634 HydrophobicContact CB-CE1 3.72Å; W629-F634 HydrophobicContact CD2-CE1 4.24Å; W629-F634 HydrophobicContact CE3-CE1 4.06Å; W629-F634 HydrophobicContact CG-CD1 4.18Å; W629-F634 HydrophobicContact CG-CE1 4.18Å; W629-F634 PolarHBondContact O-N 2.99Å; W629-V637 VanDerWaalsContact CD1-CG2 3.48Å; W629-V637 HydrophobicContact CG-CG2 4.41Å; W629-I665 HydrophobicContact CH2-CB 4.21Å; W629-I665 HydrophobicContact CH2-CG2 3.59Å; W629-I665 HydrophobicContact CZ2-CG2 4.07Å; W629-I665 HydrophobicContact CZ3-CB 4.37Å; W629-I665 HydrophobicContact CZ3-CG2 4.23Å; W629-L666 HydrophobicContact CH2-CD2 4.08Å; W629-L666 HydrophobicContact CH2-CG 4.41Å; W629-L666 HydrophobicContact CZ3-CD2 4.4Å; W629-L666 HydrophobicContact CZ3-CG 4.35Å; W629-F685 HydrophobicContact CH2-CD1 4.27Å; W629-F685 AromaticContact CH2-CE1 3.45Å; W629-F685 HydrophobicContact CH2-CE1 3.45Å; W629-F685 VanDerWaalsContact CH2-CE1 3.45Å; W629-F685 HydrophobicContact CH2-CZ 4.29Å; W629-F685 AromaticContact CZ2-CD1 3.62Å; W629-F685 HydrophobicContact CZ2-CD1 3.62Å; W629-F685 AromaticContact CZ2-CE1 3.27Å; W629-F685 HydrophobicContact CZ2-CE1 3.27Å; W629-F685 HydrophobicContact CZ2-CZ 4.42Å
630	F	96.3	Very high	94.9	Very high	3 Å²	3	29.7 Å²	29.7	1%	0.013	16%	0.157	C	C	.	.	H	α-helix	trans	-80.5	-40.5	-176	-62	-56.5	0	0	0	112.2	L581 F584 Y596 L597 F600 A626 I627 T632 M633 F634 P658 F659	L581-F630 VanDerWaalsContact CD2-O 3.22Å; L581-F630 WeakPolarHBondContact CD2-O 3.38Å; F584-F630 HydrophobicContact CE1-CB 4.22Å; Y596-F630 HydrophobicContact CD1-CB 4.32Å; Y596-F630 AromaticContact CD1-CD2 3.89Å; Y596-F630 HydrophobicContact CD1-CD2 3.89Å; Y596-F630 HydrophobicContact CD1-CE2 4.33Å; Y596-F630 HydrophobicContact CD1-CG 4.01Å; Y596-F630 HydrophobicContact CE1-CB 3.83Å; Y596-F630 AromaticContact CE1-CD1 3.52Å; Y596-F630 HydrophobicContact CE1-CD1 3.52Å; Y596-F630 AromaticContact CE1-CD2 3.6Å; Y596-F630 HydrophobicContact CE1-CD2 3.6Å; Y596-F630 AromaticContact CE1-CE1 3.91Å; Y596-F630 HydrophobicContact CE1-CE1 3.91Å; Y596-F630 AromaticContact CE1-CE2 3.97Å; Y596-F630 HydrophobicContact CE1-CE2 3.97Å; Y596-F630 AromaticContact CE1-CG 3.35Å; Y596-F630 HydrophobicContact CE1-CG 3.35Å; Y596-F630 HydrophobicContact CE1-CZ 4.12Å; L597-F630 HydrophobicContact CD2-CD2 4.21Å; L597-F630 HydrophobicContact CD2-CE2 4.44Å; F600-F630 HydrophobicContact CB-CE2 4.17Å; F600-F630 HydrophobicContact CB-CZ 4.39Å; F600-F630 AromaticContact CD1-CE2 3.67Å; F600-F630 HydrophobicContact CD1-CE2 3.67Å; F600-F630 AromaticContact CD1-CZ 3.97Å; F600-F630 HydrophobicContact CD1-CZ 3.97Å; F600-F630 HydrophobicContact CD2-CE2 4.16Å; F600-F630 AromaticContact CD2-CZ 3.66Å; F600-F630 HydrophobicContact CD2-CZ 3.66Å; F600-F630 HydrophobicContact CE1-CE2 4.04Å; F600-F630 HydrophobicContact CE1-CZ 4.12Å; F600-F630 HydrophobicContact CE2-CE2 4.48Å; F600-F630 AromaticContact CE2-CZ 3.81Å; F600-F630 HydrophobicContact CE2-CZ 3.81Å; F600-F630 AromaticContact CG-CE2 3.73Å; F600-F630 HydrophobicContact CG-CE2 3.73Å; F600-F630 AromaticContact CG-CZ 3.73Å; F600-F630 HydrophobicContact CG-CZ 3.73Å; F600-F630 HydrophobicContact CZ-CE2 4.43Å; F600-F630 HydrophobicContact CZ-CZ 4.04Å; A626-F630 HydrophobicContact CB-CD2 4.01Å; A626-F630 HydrophobicContact CB-CE2 3.75Å; A626-F630 WeakPolarHBondContact O-CD2 3.45Å; A626-F630 PolarHBondContact O-N 3.2Å; I627-F630 PolarHBondContact O-N 3.12Å; F630-T632 PolarHBondContact O-N 3.43Å; F630-M633 WeakPolarHBondContact O-CE 3.4Å; F630-M633 PolarHBondContact O-N 3.14Å; F630-M633 VanDerWaalsContact O-N 3.11Å; F630-F634 HydrophobicContact CD1-CZ 4.16Å; F630-F634 AromaticContact CE1-CZ 3.87Å; F630-F634 HydrophobicContact CE1-CZ 3.87Å; F630-P658 HydrophobicContact CD1-CB 4.31Å; F630-P658 HydrophobicContact CE1-CB 4.29Å; F630-F659 HydrophobicContact CZ-CD1 4.33Å
631	L	95.1	Very high	94.7	Very high	15 Å²	15	35.6 Å²	35.6	8%	0.079	19%	0.185	C	C	.	.	H	α-helix	trans	-58.3	-35.1	179.8	-175.1	65.9	0	0	0	112.6	F584 F585 I627	F584-L631 HydrophobicContact CD1-CD1 4.2Å; F585-L631 HydrophobicContact CD1-CD1 4.43Å; F585-L631 HydrophobicContact CE1-CD1 3.81Å; F585-L631 HydrophobicContact CZ-CD1 4.16Å; I627-L631 WeakPolarHBondContact O-CB 3.47Å; I627-L631 PolarHBondContact O-N 3.39Å
632	T	95.9	Very high	94.8	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.018	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	1.1	180	71.4	0	0	0	0	113.2	G550 L554 P628 F630 F634 T635 H636	G550-T632 WeakPolarHBondContact O-CG2 3.21Å; L554-T632 WeakPolarHBondContact CD1-O 3.34Å; P628-T632 WeakPolarHBondContact O-CB 3.2Å; P628-T632 PolarHBondContact O-N 3.5Å; P628-T632 PolarHBondContact O-OG1 2.95Å; F630-T632 PolarHBondContact O-N 3.43Å; T632-F634 PolarHBondContact O-N 2.89Å; T632-T635 WeakPolarHBondContact O-CG2 3.47Å; T632-T635 PolarHBondContact O-N 3.31Å; T632-T635 PolarHBondContact O-OG1 3.38Å; T632-H636 HydrophobicContact CG2-CB 3.88Å; T632-H636 PolarHBondContact OG1-N 2.97Å
633	M	97.6	Very high	94.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	47.5	-171.4	-69.6	-70.8	159.3	0	0	112.2	L554 F576 Y580 L581 W629 F630 T635 W647 P658	L554-M633 HydrophobicContact CD1-CB 3.97Å; L554-M633 HydrophobicContact CD1-CG 4.27Å; F576-M633 HydrophobicContact CE1-CB 4.29Å; F576-M633 HydrophobicContact CE1-CG 3.91Å; F576-M633 HydrophobicContact CZ-CB 4.25Å; F576-M633 HydrophobicContact CZ-CG 4.12Å; Y580-M633 WeakPolarHBondContact O-CE 3.33Å; L581-M633 HydrophobicContact CD1-CG 4.01Å; L581-M633 HydrophobicContact CD2-CE 3.28Å; L581-M633 HydrophobicContact CD2-CG 4.17Å; L581-M633 HydrophobicContact CG-CE 3.73Å; L581-M633 HydrophobicContact CG-CG 4.13Å; W629-M633 CarbonylContact O-C 3.5Å; W629-M633 VanDerWaalsContact O-CA 3.28Å; W629-M633 WeakPolarHBondContact O-CA 3.46Å; W629-M633 PolarHBondContact O-N 3.3Å; F630-M633 WeakPolarHBondContact O-CE 3.4Å; F630-M633 PolarHBondContact O-N 3.14Å; F630-M633 VanDerWaalsContact O-N 3.11Å; M633-T635 PolarHBondContact O-N 3.05Å; M633-W647 HydrophobicContact CB-CZ2 3.74Å; M633-W647 PolarHBondContact O-NE1 3.05Å; M633-P658 HydrophobicContact CE-CB 4.39Å; M633-P658 HydrophobicContact CE-CG 4.16Å; M633-P658 HydrophobicContact SD-CB 4.01Å; M633-P658 HydrophobicContact SD-CG 3.83Å
634	F	96.8	Very high	95	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	-1.8	177.1	-47.3	-85.2	0	0	0	116.1	W629 F630 T632 H636 V637 F638 I643 L646 P658 I661 I665	W629-F634 HydrophobicContact CB-CD1 3.84Å; W629-F634 HydrophobicContact CB-CE1 3.72Å; W629-F634 HydrophobicContact CD2-CE1 4.24Å; W629-F634 HydrophobicContact CE3-CE1 4.06Å; W629-F634 HydrophobicContact CG-CD1 4.18Å; W629-F634 HydrophobicContact CG-CE1 4.18Å; W629-F634 PolarHBondContact O-N 2.99Å; F630-F634 HydrophobicContact CD1-CZ 4.16Å; F630-F634 AromaticContact CE1-CZ 3.87Å; F630-F634 HydrophobicContact CE1-CZ 3.87Å; T632-F634 PolarHBondContact O-N 2.89Å; F634-H636 VanDerWaalsContact C-N 3.33Å; F634-H636 PolarHBondContact O-N 3.46Å; F634-V637 WeakPolarHBondContact O-CB 3.28Å; F634-V637 PolarHBondContact O-N 2.96Å; F634-F638 HydrophobicContact CB-CD2 3.93Å; F634-F638 HydrophobicContact CB-CE2 4.18Å; F634-F638 HydrophobicContact CD1-CE2 4.5Å; F634-F638 PolarHBondContact O-N 2.9Å; F634-F638 VanDerWaalsContact O-N 3.08Å; F634-I643 HydrophobicContact CB-CD1 4.22Å; F634-I643 WeakPolarHBondContact O-CD1 3.33Å; F634-L646 HydrophobicContact CB-CD2 4.19Å; F634-L646 HydrophobicContact CD2-CD2 4.09Å; F634-L646 HydrophobicContact CG-CD2 4.29Å; F634-P658 HydrophobicContact CE2-CB 4.46Å; F634-I661 HydrophobicContact CD1-CG2 4.39Å; F634-I661 HydrophobicContact CD2-CG2 3.98Å; F634-I661 HydrophobicContact CE1-CG2 3.95Å; F634-I661 HydrophobicContact CE2-CB 3.85Å; F634-I661 HydrophobicContact CE2-CD1 4.2Å; F634-I661 HydrophobicContact CE2-CG2 3.53Å; F634-I661 HydrophobicContact CG-CG2 4.4Å; F634-I661 HydrophobicContact CZ-CB 3.85Å; F634-I661 HydrophobicContact CZ-CG2 3.52Å; F634-I665 HydrophobicContact CD1-CD1 3.84Å; F634-I665 HydrophobicContact CE1-CD1 3.75Å
635	T	96.3	Very high	95	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-29.9	-173.4	63.5	0	0	0	0	114.2	H516 S553 L554 P557 T632 M633 V637 F638 I643 W647	H516-T635 PolarHBondContact CE1-O 3.49Å; H516-T635 VanDerWaalsContact CE1-O 3.24Å; S553-T635 VanDerWaalsContact O-CB 3.28Å; S553-T635 WeakPolarHBondContact O-CB 3.5Å; S553-T635 PolarHBondContact O-OG1 3.35Å; L554-T635 PolarHBondContact N-OG1 3.36Å; P557-T635 HydrophobicContact CG-CG2 3.69Å; T632-T635 WeakPolarHBondContact O-CG2 3.47Å; T632-T635 PolarHBondContact O-N 3.31Å; T632-T635 PolarHBondContact O-OG1 3.38Å; M633-T635 PolarHBondContact O-N 3.05Å; T635-V637 PolarHBondContact O-N 2.98Å; T635-F638 VanDerWaalsContact O-O 3.05Å; T635-I643 HydrophobicContact CG2-CD1 4.19Å; T635-I643 HydrophobicContact CG2-CG1 4.25Å; T635-I643 HydrophobicContact CG2-CG2 3.93Å; T635-W647 HydrophobicContact CG2-CH2 3.79Å; T635-W647 HydrophobicContact CG2-CZ2 3.29Å
636	H	92.3	Very high	95.1	Very high	118 Å²	118	28.4 Å²	28.4	55%	0.546	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-22.3	173.5	-176.5	-78.6	0	0	0	112.3	T632 F634	T632-H636 HydrophobicContact CG2-CB 3.88Å; T632-H636 PolarHBondContact OG1-N 2.97Å; F634-H636 VanDerWaalsContact C-N 3.33Å; F634-H636 PolarHBondContact O-N 3.46Å
637	V	90.9	Very high	95.3	Very high	43 Å²	43	28.4 Å²	28.4	26%	0.261	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-39.7	-174.4	-175.1	0	0	0	0	111.3	W629 F634 T635 L688	W629-V637 VanDerWaalsContact CD1-CG2 3.48Å; W629-V637 HydrophobicContact CG-CG2 4.41Å; F634-V637 WeakPolarHBondContact O-CB 3.28Å; F634-V637 PolarHBondContact O-N 2.96Å; T635-V637 PolarHBondContact O-N 2.98Å; V637-L688 HydrophobicContact CG1-CD2 3.67Å
638	F	93.8	Very high	95.3	Very high	13 Å²	13	25.4 Å²	25.4	6%	0.057	13%	0.129	C	C	.	.	S	Bend	trans	-114.5	146.9	-175.3	-58.9	-59.2	0	0	0	112.5	F634 T635 K642 I643 I665 L688 I691 I693	F634-F638 HydrophobicContact CB-CD2 3.93Å; F634-F638 HydrophobicContact CB-CE2 4.18Å; F634-F638 HydrophobicContact CD1-CE2 4.5Å; F634-F638 PolarHBondContact O-N 2.9Å; F634-F638 VanDerWaalsContact O-N 3.08Å; T635-F638 VanDerWaalsContact O-O 3.05Å; F638-K642 HydrophobicContact CB-CB 4.01Å; F638-I643 HydrophobicContact CB-CD1 3.86Å; F638-I643 HydrophobicContact CB-CG1 4.21Å; F638-I643 HydrophobicContact CD2-CD1 4.31Å; F638-I665 HydrophobicContact CE2-CD1 3.81Å; F638-I665 HydrophobicContact CZ-CD1 3.94Å; F638-I665 HydrophobicContact CZ-CG1 4.38Å; F638-L688 HydrophobicContact CE1-CD2 3.96Å; F638-L688 HydrophobicContact CZ-CD2 4.18Å; F638-I691 HydrophobicContact CE1-CB 3.85Å; F638-I691 HydrophobicContact CE1-CG1 3.81Å; F638-I691 HydrophobicContact CE1-CG2 4.5Å; F638-I691 HydrophobicContact CZ-CB 4.12Å; F638-I691 HydrophobicContact CZ-CG1 3.99Å; F638-I691 HydrophobicContact CZ-CG2 4.33Å; F638-I693 HydrophobicContact CD1-CD1 4.42Å; F638-I693 HydrophobicContact CD2-CD1 4.46Å; F638-I693 HydrophobicContact CE1-CD1 4.44Å; F638-I693 HydrophobicContact CE2-CD1 4.47Å; F638-I693 HydrophobicContact CG-CD1 4.43Å; F638-I693 HydrophobicContact CZ-CD1 4.46Å
639	P	94.4	Very high	95.4	Very high	38 Å²	38	23.8 Å²	23.8	25%	0.247	12%	0.118	C	C	.	.			trans	-63.3	153.6	172.9	28.4	-36.3	0	0	0	111.7	Y518 H641 K642 I643	Y518-P639 WeakPolarHBondContact OH-CA 3.46Å; P639-H641 VanDerWaalsContact C-N 3.3Å; P639-H641 WeakPolarHBondContact CG-CE1 3.32Å; P639-H641 PolarHBondContact O-N 2.76Å; P639-H641 VanDerWaalsContact O-N 3.13Å; P639-K642 HydrophobicContact CG-CB 4.26Å; P639-K642 HydrophobicContact CG-CD 4.02Å; P639-K642 HydrophobicContact CG-CG 4.03Å; P639-K642 WeakPolarHBondContact O-CA 3.39Å; P639-K642 WeakPolarHBondContact O-CB 3.19Å; P639-K642 PolarHBondContact O-N 3.14Å; P639-I643 PolarHBondContact O-N 2.67Å; P639-I643 VanDerWaalsContact O-N 3.13Å
640	L	95.6	Very high	95.4	Very high	5 Å²	5	23.2 Å²	23.2	3%	0.026	12%	0.116	C	C	.	.	H	α-helix	trans	-51	-41.2	-173.6	-71.9	175.8	0	0	0	114.7	Y518 L522 A556 P557 Y560 K642 I643 F644	Y518-L640 PolarHBondContact OH-N 3.38Å; L522-L640 HydrophobicContact CD1-CD1 3.69Å; A556-L640 HydrophobicContact CB-CD2 4.32Å; P557-L640 HydrophobicContact CB-CD2 4.3Å; P557-L640 HydrophobicContact CG-CD2 3.82Å; Y560-L640 HydrophobicContact CD2-CD1 3.91Å; Y560-L640 HydrophobicContact CE2-CD1 4.49Å; Y560-L640 HydrophobicContact CG-CD1 4.08Å; L640-K642 VanDerWaalsContact C-N 3.28Å; L640-K642 PolarHBondContact O-N 3.11Å; L640-I643 CarbonylContact O-C 3.57Å; L640-I643 WeakPolarHBondContact O-CA 3.26Å; L640-I643 WeakPolarHBondContact O-CB 3.31Å; L640-I643 PolarHBondContact O-N 3.38Å; L640-F644 HydrophobicContact CB-CE2 4.09Å; L640-F644 HydrophobicContact CB-CZ 3.9Å; L640-F644 WeakPolarHBondContact O-CD2 3.5Å; L640-F644 VanDerWaalsContact O-CG 3.27Å; L640-F644 WeakPolarHBondContact O-CG 3.26Å; L640-F644 PolarHBondContact O-N 3.34Å
641	H	93.7	Very high	95.4	Very high	126 Å²	126	23.3 Å²	23.3	58%	0.583	12%	0.116	S	C	*	.	H	α-helix	trans	-63.1	-33.8	179.4	69	-88.7	0	0	0	112.9	P639	P639-H641 VanDerWaalsContact C-N 3.3Å; P639-H641 WeakPolarHBondContact CG-CE1 3.32Å; P639-H641 PolarHBondContact O-N 2.76Å; P639-H641 VanDerWaalsContact O-N 3.13Å
642	K	95.4	Very high	95.2	Very high	33 Å²	33	23.9 Å²	23.9	14%	0.143	12%	0.12	C	C	.	.	H	α-helix	trans	-71.2	-38.4	172.6	-73.5	-168.9	178.9	-169.6	0	110.7	F638 P639 L640 H645 L646 E690 I691 I693	F638-K642 HydrophobicContact CB-CB 4.01Å; P639-K642 HydrophobicContact CG-CB 4.26Å; P639-K642 HydrophobicContact CG-CD 4.02Å; P639-K642 HydrophobicContact CG-CG 4.03Å; P639-K642 WeakPolarHBondContact O-CA 3.39Å; P639-K642 WeakPolarHBondContact O-CB 3.19Å; P639-K642 PolarHBondContact O-N 3.14Å; L640-K642 VanDerWaalsContact C-N 3.28Å; L640-K642 PolarHBondContact O-N 3.11Å; K642-H645 PolarHBondContact O-N 3.35Å; K642-L646 WeakPolarHBondContact O-CB 3.27Å; K642-L646 PolarHBondContact O-N 2.97Å; K642-L646 VanDerWaalsContact O-N 3.07Å; K642-E690 IonicContact NZ-OE1 2.66Å; K642-E690 PolarHBondContact NZ-OE1 3.06Å; K642-I691 PolarHBondContact NZ-O 3.04Å; K642-I693 HydrophobicContact CB-CD1 4.06Å; K642-I693 HydrophobicContact CB-CG1 3.68Å; K642-I693 HydrophobicContact CD-CD1 4.1Å; K642-I693 HydrophobicContact CD-CG1 3.61Å; K642-I693 HydrophobicContact CG-CD1 4.34Å; K642-I693 HydrophobicContact CG-CG1 3.61Å
643	I	97.3	Very high	94.7	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.5	-42	175.4	-64.4	-59.4	0	0	0	112.1	P557 F634 T635 F638 P639 L640 H645 L646 W647	P557-I643 HydrophobicContact CB-CG2 4.32Å; P557-I643 HydrophobicContact CG-CG2 3.82Å; F634-I643 HydrophobicContact CB-CD1 4.22Å; F634-I643 WeakPolarHBondContact O-CD1 3.33Å; T635-I643 HydrophobicContact CG2-CD1 4.19Å; T635-I643 HydrophobicContact CG2-CG1 4.25Å; T635-I643 HydrophobicContact CG2-CG2 3.93Å; F638-I643 HydrophobicContact CB-CD1 3.86Å; F638-I643 HydrophobicContact CB-CG1 4.21Å; F638-I643 HydrophobicContact CD2-CD1 4.31Å; P639-I643 PolarHBondContact O-N 2.67Å; P639-I643 VanDerWaalsContact O-N 3.13Å; L640-I643 CarbonylContact O-C 3.57Å; L640-I643 WeakPolarHBondContact O-CA 3.26Å; L640-I643 WeakPolarHBondContact O-CB 3.31Å; L640-I643 PolarHBondContact O-N 3.38Å; I643-H645 PolarHBondContact O-N 3.07Å; I643-L646 PolarHBondContact O-N 3.31Å; I643-W647 HydrophobicContact CG2-CD2 3.87Å; I643-W647 HydrophobicContact CG2-CE3 4.46Å; I643-W647 HydrophobicContact CG2-CG 3.92Å; I643-W647 HydrophobicContact CG2-CZ2 4.44Å; I643-W647 VanDerWaalsContact O-CB 3.28Å; I643-W647 WeakPolarHBondContact O-CB 3.48Å; I643-W647 PolarHBondContact O-N 3.18Å
644	F	97.1	Very high	94.2	Very high	18 Å²	18	25 Å²	25	8%	0.079	13%	0.129	C	C	.	.	H	α-helix	trans	-58.8	-47.4	178.8	-60.3	-33.5	0	0	0	111.5	W479 P557 Y560 L561 L640 L646 W647 D648	W479-F644 AromaticContact CH2-CD1 3.85Å; W479-F644 HydrophobicContact CH2-CD1 3.85Å; W479-F644 HydrophobicContact CZ2-CD1 4.27Å; P557-F644 HydrophobicContact CB-CE1 4.05Å; Y560-F644 HydrophobicContact CD1-CE1 4.47Å; Y560-F644 AromaticContact CD1-CE2 3.99Å; Y560-F644 HydrophobicContact CD1-CE2 3.99Å; Y560-F644 AromaticContact CD1-CZ 3.45Å; Y560-F644 HydrophobicContact CD1-CZ 3.45Å; Y560-F644 VanDerWaalsContact CD1-CZ 3.45Å; Y560-F644 AromaticContact CE1-CE2 3.9Å; Y560-F644 HydrophobicContact CE1-CE2 3.9Å; Y560-F644 AromaticContact CE1-CZ 3.87Å; Y560-F644 HydrophobicContact CE1-CZ 3.87Å; Y560-F644 HydrophobicContact CG-CZ 4.17Å; L561-F644 HydrophobicContact CD1-CD1 4.14Å; L561-F644 HydrophobicContact CD1-CE1 3.94Å; L561-F644 HydrophobicContact CD2-CD1 4.49Å; L561-F644 HydrophobicContact CD2-CE1 4.06Å; L561-F644 HydrophobicContact CD2-CE2 4.48Å; L561-F644 HydrophobicContact CD2-CZ 4.08Å; L561-F644 HydrophobicContact CG-CD1 4.44Å; L561-F644 HydrophobicContact CG-CE1 3.83Å; L561-F644 HydrophobicContact CG-CZ 4.18Å; L640-F644 HydrophobicContact CB-CE2 4.09Å; L640-F644 HydrophobicContact CB-CZ 3.9Å; L640-F644 WeakPolarHBondContact O-CD2 3.5Å; L640-F644 VanDerWaalsContact O-CG 3.27Å; L640-F644 WeakPolarHBondContact O-CG 3.26Å; L640-F644 PolarHBondContact O-N 3.34Å; F644-L646 PolarHBondContact O-N 3.2Å; F644-W647 PolarHBondContact O-N 3.26Å; F644-D648 WeakPolarHBondContact O-CB 3.41Å; F644-D648 PolarHBondContact O-N 3.49Å
645	H	94.9	Very high	93.9	Very high	39 Å²	39	26.4 Å²	26.4	18%	0.181	14%	0.139	C	C	.	.	H	α-helix	trans	-61.3	-43.7	175.9	-173.5	179.2	0	0	0	111.9	L431 K642 I643 I693	L431-H645 HydrophobicContact CD2-CB 4.41Å; L431-H645 WeakPolarHBondContact CD2-CD2 3.21Å; L431-H645 WeakPolarHBondContact CD2-NE2 3.39Å; K642-H645 PolarHBondContact O-N 3.35Å; I643-H645 PolarHBondContact O-N 3.07Å; H645-I693 HydrophobicContact CB-CG2 4.05Å
646	L	96.3	Very high	93.6	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-64.7	-43.6	178.5	-173.3	65	0	0	0	112.2	F634 K642 I643 F644 T649 L650 I661 I693 V697	F634-L646 HydrophobicContact CB-CD2 4.19Å; F634-L646 HydrophobicContact CD2-CD2 4.09Å; F634-L646 HydrophobicContact CG-CD2 4.29Å; K642-L646 WeakPolarHBondContact O-CB 3.27Å; K642-L646 PolarHBondContact O-N 2.97Å; K642-L646 VanDerWaalsContact O-N 3.07Å; I643-L646 PolarHBondContact O-N 3.31Å; F644-L646 PolarHBondContact O-N 3.2Å; L646-T649 PolarHBondContact O-N 2.73Å; L646-L650 PolarHBondContact O-N 3.37Å; L646-I661 HydrophobicContact CD1-CD1 3.78Å; L646-I661 HydrophobicContact CD1-CG1 4.02Å; L646-I661 HydrophobicContact CD1-CG2 3.91Å; L646-I661 HydrophobicContact CD2-CD1 4.38Å; L646-I661 HydrophobicContact CD2-CG2 4.05Å; L646-I661 HydrophobicContact CG-CD1 4.03Å; L646-I661 HydrophobicContact CG-CG2 4.49Å; L646-I693 HydrophobicContact CB-CG2 4.38Å; L646-V697 HydrophobicContact CD1-CG2 4.1Å
647	W	97.9	Very high	93.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-79	-27.6	-174.3	-79.9	26.6	0	0	0	113.5	W479 L554 P557 F558 F576 M633 T635 I643 F644 T649 L650 L651	W479-W647 HydrophobicContact CE3-CE3 4.29Å; W479-W647 HydrophobicContact CH2-CB 3.41Å; W479-W647 VanDerWaalsContact CH2-CB 3.41Å; W479-W647 HydrophobicContact CH2-CD2 4.04Å; W479-W647 AromaticContact CH2-CE3 3.49Å; W479-W647 HydrophobicContact CH2-CE3 3.49Å; W479-W647 VanDerWaalsContact CH2-CE3 3.49Å; W479-W647 HydrophobicContact CH2-CG 4.08Å; W479-W647 HydrophobicContact CH2-CZ3 4.43Å; W479-W647 HydrophobicContact CZ2-CB 3.43Å; W479-W647 VanDerWaalsContact CZ2-CB 3.43Å; W479-W647 HydrophobicContact CZ3-CB 4.36Å; W479-W647 HydrophobicContact CZ3-CD2 4.35Å; W479-W647 AromaticContact CZ3-CE3 3.37Å; W479-W647 HydrophobicContact CZ3-CE3 3.37Å; W479-W647 AromaticContact CZ3-CZ3 3.97Å; W479-W647 HydrophobicContact CZ3-CZ3 3.97Å; L554-W647 HydrophobicContact CD1-CH2 3.85Å; L554-W647 HydrophobicContact CD1-CZ2 4.03Å; P557-W647 HydrophobicContact CB-CE3 4.33Å; P557-W647 HydrophobicContact CB-CH2 4.42Å; P557-W647 HydrophobicContact CB-CZ3 3.92Å; P557-W647 HydrophobicContact CG-CH2 3.99Å; P557-W647 HydrophobicContact CG-CZ3 3.99Å; F558-W647 HydrophobicContact CD2-CZ3 4.32Å; F558-W647 HydrophobicContact CE1-CZ3 4.02Å; F558-W647 AromaticContact CE2-CH2 3.97Å; F558-W647 HydrophobicContact CE2-CH2 3.97Å; F558-W647 AromaticContact CE2-CZ3 3.6Å; F558-W647 HydrophobicContact CE2-CZ3 3.6Å; F558-W647 HydrophobicContact CZ-CE3 4.22Å; F558-W647 HydrophobicContact CZ-CH2 4.16Å; F558-W647 AromaticContact CZ-CZ3 3.42Å; F558-W647 HydrophobicContact CZ-CZ3 3.42Å; F558-W647 VanDerWaalsContact CZ-CZ3 3.42Å; F576-W647 HydrophobicContact CE1-CH2 4.27Å; F576-W647 HydrophobicContact CE1-CZ2 4.41Å; F576-W647 HydrophobicContact CE2-CD2 4.44Å; F576-W647 HydrophobicContact CE2-CE3 4.19Å; F576-W647 HydrophobicContact CE2-CH2 4.47Å; F576-W647 HydrophobicContact CE2-CZ3 4.25Å; F576-W647 HydrophobicContact CZ-CD2 4.46Å; F576-W647 HydrophobicContact CZ-CE3 4.43Å; F576-W647 HydrophobicContact CZ-CH2 4.03Å; F576-W647 AromaticContact CZ-CZ2 3.97Å; F576-W647 HydrophobicContact CZ-CZ2 3.97Å; F576-W647 HydrophobicContact CZ-CZ3 4.27Å; M633-W647 HydrophobicContact CB-CZ2 3.74Å; M633-W647 PolarHBondContact O-NE1 3.05Å; T635-W647 HydrophobicContact CG2-CH2 3.79Å; T635-W647 HydrophobicContact CG2-CZ2 3.29Å; I643-W647 HydrophobicContact CG2-CD2 3.87Å; I643-W647 HydrophobicContact CG2-CE3 4.46Å; I643-W647 HydrophobicContact CG2-CG 3.92Å; I643-W647 HydrophobicContact CG2-CZ2 4.44Å; I643-W647 VanDerWaalsContact O-CB 3.28Å; I643-W647 WeakPolarHBondContact O-CB 3.48Å; I643-W647 PolarHBondContact O-N 3.18Å; F644-W647 PolarHBondContact O-N 3.26Å; W647-T649 PolarHBondContact O-N 3.11Å; W647-L650 HydrophobicContact CD2-CD2 4.39Å; W647-L650 HydrophobicContact CG-CD2 4.06Å; W647-L650 PolarHBondContact O-N 2.93Å; W647-L650 VanDerWaalsContact O-N 3.15Å; W647-L651 WeakPolarHBondContact O-CB 3.47Å; W647-L651 VanDerWaalsContact O-CG 3.3Å; W647-L651 WeakPolarHBondContact O-CG 3.31Å; W647-L651 PolarHBondContact O-N 3.46Å
648	D	96.3	Very high	94	Very high	6 Å²	6	19.5 Å²	19.5	3%	0.032	11%	0.105	C	C	.	.	H	α-helix	trans	-52.2	-36.8	168.6	-76	-8.7	0	0	0	110.3	I470 R475 W479 F644 L652	I470-D648 HydrophobicContact CD1-CB 4.22Å; R475-D648 IonicContact CZ-OD2 3.84Å; R475-D648 IonicContact NE-OD1 3.93Å; R475-D648 PolarHBondContact NE-OD1 3.2Å; R475-D648 IonicContact NE-OD2 2.69Å; R475-D648 PolarHBondContact NE-OD2 3.29Å; R475-D648 IonicContact NH2-OD2 3.28Å; R475-D648 PolarHBondContact NH2-OD2 3.03Å; W479-D648 PolarHBondContact NE1-OD1 3.28Å; F644-D648 WeakPolarHBondContact O-CB 3.41Å; F644-D648 PolarHBondContact O-N 3.49Å; D648-L652 WeakPolarHBondContact O-CD1 3.18Å; D648-L652 WeakPolarHBondContact O-CG 3.48Å
649	T	94.2	Very high	94.2	Very high	26 Å²	26	18.9 Å²	18.9	16%	0.16	10%	0.102	C	C	.	.	H	α-helix	trans	-85.9	-40.8	173.8	-55.3	0	0	0	0	113.1	L646 W647 L651 L652 G653 F657 V697 I701	L646-T649 PolarHBondContact O-N 2.73Å; W647-T649 PolarHBondContact O-N 3.11Å; T649-L651 VanDerWaalsContact C-N 3.27Å; T649-L651 PolarHBondContact O-N 3.38Å; T649-L652 WeakPolarHBondContact O-CB 3.49Å; T649-L652 PolarHBondContact O-N 2.64Å; T649-L652 VanDerWaalsContact O-N 3.1Å; T649-G653 PolarHBondContact O-N 2.66Å; T649-F657 HydrophobicContact CG2-CE1 3.87Å; T649-F657 HydrophobicContact CG2-CZ 3.64Å; T649-V697 HydrophobicContact CG2-CG1 4.12Å; T649-V697 VanDerWaalsContact OG1-CG1 3.32Å; T649-V697 WeakPolarHBondContact OG1-CG1 3.49Å; T649-I701 HydrophobicContact CG2-CD1 3.96Å; T649-I701 HydrophobicContact CG2-CG1 3.98Å
650	L	96	Very high	94.4	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-53.9	-44.7	-179.7	177.6	59.7	0	0	0	112.1	F576 Y580 L646 W647 L652 G653 F657 P658 I661	F576-L650 HydrophobicContact CE2-CD2 4.13Å; F576-L650 HydrophobicContact CZ-CD2 3.9Å; Y580-L650 HydrophobicContact CD1-CD1 4.08Å; Y580-L650 HydrophobicContact CE1-CD1 3.67Å; Y580-L650 HydrophobicContact CE1-CG 4.08Å; Y580-L650 PolarHBondContact OH-O 3.32Å; L646-L650 PolarHBondContact O-N 3.37Å; W647-L650 HydrophobicContact CD2-CD2 4.39Å; W647-L650 HydrophobicContact CG-CD2 4.06Å; W647-L650 PolarHBondContact O-N 2.93Å; W647-L650 VanDerWaalsContact O-N 3.15Å; L650-L652 PolarHBondContact O-N 3.32Å; L650-G653 WeakPolarHBondContact O-CA 3.46Å; L650-G653 PolarHBondContact O-N 2.89Å; L650-F657 HydrophobicContact CD1-CB 4.34Å; L650-F657 HydrophobicContact CD1-CD1 3.89Å; L650-P658 HydrophobicContact CD1-CG 3.79Å; L650-I661 HydrophobicContact CD1-CD1 4.14Å
651	L	95.7	Very high	94.5	Very high	4 Å²	4	16.9 Å²	16.9	2%	0.021	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-29.3	-177.9	-70.6	177.6	0	0	0	112.9	W479 L482 L483 F576 K579 Y580 W647 T649 G653	W479-L651 HydrophobicContact CB-CD1 3.9Å; W479-L651 HydrophobicContact CD2-CD1 3.49Å; W479-L651 VanDerWaalsContact CD2-CD1 3.49Å; W479-L651 HydrophobicContact CE3-CD1 4.13Å; W479-L651 HydrophobicContact CG-CD1 3.37Å; L482-L651 HydrophobicContact CD1-CB 4.32Å; L483-L651 HydrophobicContact CD1-CD2 4.46Å; L483-L651 HydrophobicContact CD2-CD2 3.79Å; L483-L651 HydrophobicContact CG-CD2 4.09Å; F576-L651 HydrophobicContact CD2-CD2 3.73Å; F576-L651 HydrophobicContact CE2-CD2 3.81Å; K579-L651 PolarHBondContact NZ-O 2.88Å; Y580-L651 HydrophobicContact CE2-CD2 4.35Å; Y580-L651 WeakPolarHBondContact OH-CA 3.38Å; W647-L651 WeakPolarHBondContact O-CB 3.47Å; W647-L651 VanDerWaalsContact O-CG 3.3Å; W647-L651 WeakPolarHBondContact O-CG 3.31Å; W647-L651 PolarHBondContact O-N 3.46Å; T649-L651 VanDerWaalsContact C-N 3.27Å; T649-L651 PolarHBondContact O-N 3.38Å; L651-G653 VanDerWaalsContact C-N 3.34Å
652	L	91.5	Very high	94.7	Very high	28 Å²	28	10.9 Å²	10.9	15%	0.147	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-26.1	174.4	-53.3	173.8	0	0	0	112	W463 A466 R467 L482 D648 T649 L650	W463-L652 HydrophobicContact CD2-CD2 4.5Å; W463-L652 HydrophobicContact CG-CD2 4.12Å; A466-L652 HydrophobicContact CB-CD2 3.83Å; R467-L652 HydrophobicContact CB-CD1 4.36Å; R467-L652 HydrophobicContact CG-CD1 3.86Å; L482-L652 HydrophobicContact CD1-CD2 4.05Å; L482-L652 HydrophobicContact CD2-CD2 3.89Å; D648-L652 WeakPolarHBondContact O-CD1 3.18Å; D648-L652 WeakPolarHBondContact O-CG 3.48Å; T649-L652 WeakPolarHBondContact O-CB 3.49Å; T649-L652 PolarHBondContact O-N 2.64Å; T649-L652 VanDerWaalsContact O-N 3.1Å; L650-L652 PolarHBondContact O-N 3.32Å
653	G	85.4	Confident	94.8	Very high	12 Å²	12	9.4 Å²	9.4	12%	0.124	6%	0.056	C	C	.	.	S	Bend	trans	-79.2	168.4	177.7	0	0	0	0	0	114.2	K579 Y580 T649 L650 L651	K579-G653 WeakPolarHBondContact CE-O 3.43Å; K579-G653 PolarHBondContact NZ-O 3.4Å; K579-G653 VanDerWaalsContact NZ-O 3.14Å; Y580-G653 PolarHBondContact OH-O 2.94Å; Y580-G653 VanDerWaalsContact OH-O 3.12Å; T649-G653 PolarHBondContact O-N 2.66Å; L650-G653 WeakPolarHBondContact O-CA 3.46Å; L650-G653 PolarHBondContact O-N 2.89Å; L651-G653 VanDerWaalsContact C-N 3.34Å
654	S	87.1	Confident	94.8	Very high	13 Å²	13	9.4 Å²	9.4	9%	0.091	6%	0.056	C	C	.	.			trans	-87.9	178.6	174	73.8	0	0	0	0	112.5	Y580 S656 F657 Q740	Y580-S654 WeakPolarHBondContact CE1-O 3.02Å; S654-S656 PolarHBondContact O-N 2.92Å; S654-S656 PolarHBondContact OG-OG 3.43Å; S654-S656 VanDerWaalsContact OG-OG 3.1Å; S654-F657 WeakPolarHBondContact O-CB 3.45Å; S654-F657 PolarHBondContact O-N 3.06Å; S654-Q740 PolarHBondContact OG-NE2 3.35Å
655	S	89.4	Confident	94.8	Very high	31 Å²	31	8.6 Å²	8.6	22%	0.217	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-11.6	-179.6	68.7	0	0	0	0	114.5	K579 R714	K579-S655 WeakPolarHBondContact O-CB 3.43Å; S655-R714 PolarHBondContact O-NH2 3.28Å; S655-R714 PolarHBondContact OG-NH2 3.39Å
656	S	90.9	Very high	95	Very high	10 Å²	10	6.8 Å²	6.8	7%	0.07	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-13.5	175.5	63.2	0	0	0	0	114.4	S654 P658 F659 T712	S654-S656 PolarHBondContact O-N 2.92Å; S654-S656 PolarHBondContact OG-OG 3.43Å; S654-S656 VanDerWaalsContact OG-OG 3.1Å; S656-P658 VanDerWaalsContact C-N 3.35Å; S656-F659 WeakPolarHBondContact O-CB 3.18Å; S656-F659 WeakPolarHBondContact O-CD2 3.18Å; S656-F659 PolarHBondContact O-N 3.3Å; S656-F659 VanDerWaalsContact O-N 3.15Å; S656-T712 WeakPolarHBondContact CB-OG1 3.39Å
657	F	94.9	Very high	95	Very high	5 Å²	5	8.9 Å²	8.9	2%	0.022	5%	0.054	C	C	.	.	H	α-helix	trans	-58.1	-35.8	179.9	-165.3	-103.5	0	0	0	114.3	T649 L650 S654 F659 C660 I661 I701 F704	T649-F657 HydrophobicContact CG2-CE1 3.87Å; T649-F657 HydrophobicContact CG2-CZ 3.64Å; L650-F657 HydrophobicContact CD1-CB 4.34Å; L650-F657 HydrophobicContact CD1-CD1 3.89Å; S654-F657 WeakPolarHBondContact O-CB 3.45Å; S654-F657 PolarHBondContact O-N 3.06Å; F657-F659 PolarHBondContact O-N 3.21Å; F657-F659 VanDerWaalsContact O-N 3.14Å; F657-C660 WeakPolarHBondContact O-CB 3.27Å; F657-C660 PolarHBondContact O-N 2.96Å; F657-I661 HydrophobicContact CD1-CD1 3.85Å; F657-I661 HydrophobicContact CD1-CG1 4.09Å; F657-I661 HydrophobicContact CE1-CD1 3.89Å; F657-I661 HydrophobicContact CE1-CG1 3.93Å; F657-I661 PolarHBondContact O-N 3.14Å; F657-I701 HydrophobicContact CE2-CG1 4.33Å; F657-I701 HydrophobicContact CZ-CG1 4.15Å; F657-F704 HydrophobicContact CB-CD2 4.46Å; F657-F704 HydrophobicContact CD2-CB 3.93Å; F657-F704 HydrophobicContact CD2-CD1 4.48Å; F657-F704 AromaticContact CD2-CD2 3.71Å; F657-F704 HydrophobicContact CD2-CD2 3.71Å; F657-F704 HydrophobicContact CD2-CE2 4.33Å; F657-F704 AromaticContact CD2-CG 3.79Å; F657-F704 HydrophobicContact CD2-CG 3.79Å; F657-F704 HydrophobicContact CE2-CB 3.95Å; F657-F704 HydrophobicContact CE2-CG 4.21Å
658	P	97.3	Very high	94.9	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-54.1	-32.4	174.7	-27.4	34.4	0	0	0	114.5	Y580 Y596 F630 M633 F634 L650 S656 C660 I661 G662	Y580-P658 HydrophobicContact CD1-CG 3.97Å; Y596-P658 WeakPolarHBondContact OH-CB 3.28Å; F630-P658 HydrophobicContact CD1-CB 4.31Å; F630-P658 HydrophobicContact CE1-CB 4.29Å; M633-P658 HydrophobicContact CE-CB 4.39Å; M633-P658 HydrophobicContact CE-CG 4.16Å; M633-P658 HydrophobicContact SD-CB 4.01Å; M633-P658 HydrophobicContact SD-CG 3.83Å; F634-P658 HydrophobicContact CE2-CB 4.46Å; L650-P658 HydrophobicContact CD1-CG 3.79Å; S656-P658 VanDerWaalsContact C-N 3.35Å; P658-C660 VanDerWaalsContact C-N 3.3Å; P658-C660 PolarHBondContact O-N 3.4Å; P658-I661 WeakPolarHBondContact O-CB 3.11Å; P658-I661 PolarHBondContact O-N 3.08Å; P658-G662 PolarHBondContact O-N 3.41Å
659	F	97.6	Very high	94.9	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-63	-38.9	175.9	-62.8	-58.9	0	0	0	111.9	Y596 V599 F600 M603 F630 S656 F657 I661 G662 V663 T712	Y596-F659 HydrophobicContact CD1-CD1 4.47Å; Y596-F659 AromaticContact CD1-CE1 3.43Å; Y596-F659 HydrophobicContact CD1-CE1 3.43Å; Y596-F659 VanDerWaalsContact CD1-CE1 3.43Å; Y596-F659 AromaticContact CD1-CZ 3.86Å; Y596-F659 HydrophobicContact CD1-CZ 3.86Å; Y596-F659 HydrophobicContact CD2-CE1 4.26Å; Y596-F659 AromaticContact CD2-CZ 3.83Å; Y596-F659 HydrophobicContact CD2-CZ 3.83Å; Y596-F659 AromaticContact CE1-CD1 3.87Å; Y596-F659 HydrophobicContact CE1-CD1 3.87Å; Y596-F659 AromaticContact CE1-CE1 3.12Å; Y596-F659 HydrophobicContact CE1-CE1 3.12Å; Y596-F659 AromaticContact CE1-CZ 3.61Å; Y596-F659 HydrophobicContact CE1-CZ 3.61Å; Y596-F659 HydrophobicContact CE2-CE1 4.05Å; Y596-F659 HydrophobicContact CE2-CE2 4.36Å; Y596-F659 AromaticContact CE2-CZ 3.61Å; Y596-F659 HydrophobicContact CE2-CZ 3.61Å; Y596-F659 AromaticContact CG-CE1 3.99Å; Y596-F659 HydrophobicContact CG-CE1 3.99Å; Y596-F659 AromaticContact CG-CZ 3.95Å; Y596-F659 HydrophobicContact CG-CZ 3.95Å; Y596-F659 AromaticContact CZ-CE1 3.48Å; Y596-F659 VanDerWaalsContact CZ-CE1 3.48Å; Y596-F659 AromaticContact CZ-CZ 3.48Å; Y596-F659 VanDerWaalsContact CZ-CZ 3.48Å; Y596-F659 WeakPolarHBondContact O-CE1 3.44Å; V599-F659 HydrophobicContact CB-CZ 4.24Å; V599-F659 HydrophobicContact CG1-CD2 4.5Å; V599-F659 HydrophobicContact CG1-CE1 4.31Å; V599-F659 HydrophobicContact CG1-CE2 3.98Å; V599-F659 HydrophobicContact CG1-CZ 3.88Å; F600-F659 HydrophobicContact CB-CD1 3.81Å; F600-F659 HydrophobicContact CB-CE1 3.94Å; F600-F659 HydrophobicContact CD2-CB 4.43Å; F600-F659 AromaticContact CD2-CD1 3.89Å; F600-F659 HydrophobicContact CD2-CD1 3.89Å; F600-F659 HydrophobicContact CG-CD1 4.26Å; M603-F659 HydrophobicContact CG-CB 4.19Å; M603-F659 HydrophobicContact CG-CG 4.45Å; F630-F659 HydrophobicContact CZ-CD1 4.33Å; S656-F659 WeakPolarHBondContact O-CB 3.18Å; S656-F659 WeakPolarHBondContact O-CD2 3.18Å; S656-F659 PolarHBondContact O-N 3.3Å; S656-F659 VanDerWaalsContact O-N 3.15Å; F657-F659 PolarHBondContact O-N 3.21Å; F657-F659 VanDerWaalsContact O-N 3.14Å; F659-I661 VanDerWaalsContact C-N 3.29Å; F659-I661 PolarHBondContact O-N 3.25Å; F659-G662 PolarHBondContact O-N 3.45Å; F659-V663 WeakPolarHBondContact O-CG2 3.35Å; F659-V663 PolarHBondContact O-N 3.22Å; F659-T712 HydrophobicContact CD2-CG2 4.23Å
660	C	97.7	Very high	95	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.007	7%	0.066	C	C	.	.	H	α-helix	trans	-68.8	-31.2	178	-59.2	0	0	0	0	111.5	F657 P658 A664 S700 L703 F704	F657-C660 WeakPolarHBondContact O-CB 3.27Å; F657-C660 PolarHBondContact O-N 2.96Å; P658-C660 VanDerWaalsContact C-N 3.3Å; P658-C660 PolarHBondContact O-N 3.4Å; C660-A664 VanDerWaalsContact O-CB 3.25Å; C660-A664 WeakPolarHBondContact O-CB 3.31Å; C660-A664 PolarHBondContact O-N 3.34Å; C660-S700 WeakPolarHBondContact CB-O 3.48Å; C660-S700 PolarHBondContact O-OG 3.35Å; C660-S700 VanDerWaalsContact O-OG 3.13Å; C660-L703 HydrophobicContact CB-CB 4.06Å; C660-L703 WeakPolarHBondContact O-CD1 3.16Å; C660-F704 HydrophobicContact CB-CB 4.45Å
661	I	97.8	Very high	95.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-65.3	-50.6	170.7	-61.9	171.1	0	0	0	110.2	F634 L646 L650 F657 P658 F659 V663 A664 I665 S700	F634-I661 HydrophobicContact CD1-CG2 4.39Å; F634-I661 HydrophobicContact CD2-CG2 3.98Å; F634-I661 HydrophobicContact CE1-CG2 3.95Å; F634-I661 HydrophobicContact CE2-CB 3.85Å; F634-I661 HydrophobicContact CE2-CD1 4.2Å; F634-I661 HydrophobicContact CE2-CG2 3.53Å; F634-I661 HydrophobicContact CG-CG2 4.4Å; F634-I661 HydrophobicContact CZ-CB 3.85Å; F634-I661 HydrophobicContact CZ-CG2 3.52Å; L646-I661 HydrophobicContact CD1-CD1 3.78Å; L646-I661 HydrophobicContact CD1-CG1 4.02Å; L646-I661 HydrophobicContact CD1-CG2 3.91Å; L646-I661 HydrophobicContact CD2-CD1 4.38Å; L646-I661 HydrophobicContact CD2-CG2 4.05Å; L646-I661 HydrophobicContact CG-CD1 4.03Å; L646-I661 HydrophobicContact CG-CG2 4.49Å; L650-I661 HydrophobicContact CD1-CD1 4.14Å; F657-I661 HydrophobicContact CD1-CD1 3.85Å; F657-I661 HydrophobicContact CD1-CG1 4.09Å; F657-I661 HydrophobicContact CE1-CD1 3.89Å; F657-I661 HydrophobicContact CE1-CG1 3.93Å; F657-I661 PolarHBondContact O-N 3.14Å; P658-I661 WeakPolarHBondContact O-CB 3.11Å; P658-I661 PolarHBondContact O-N 3.08Å; F659-I661 VanDerWaalsContact C-N 3.29Å; F659-I661 PolarHBondContact O-N 3.25Å; I661-V663 VanDerWaalsContact C-N 3.34Å; I661-V663 PolarHBondContact O-N 2.86Å; I661-A664 PolarHBondContact O-N 3.16Å; I661-I665 HydrophobicContact CG2-CD1 3.97Å; I661-I665 WeakPolarHBondContact O-CG1 3.2Å; I661-I665 PolarHBondContact O-N 3.04Å; I661-S700 VanDerWaalsContact CA-OG 3.25Å; I661-S700 WeakPolarHBondContact CA-OG 3.47Å; I661-S700 PolarHBondContact N-OG 3.08Å
662	G	97.5	Very high	95.1	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-57.1	-44.9	178.3	0	0	0	0	0	112.8	P658 F659 I665 L666	P658-G662 PolarHBondContact O-N 3.41Å; F659-G662 PolarHBondContact O-N 3.45Å; G662-I665 PolarHBondContact O-N 3.38Å; G662-L666 WeakPolarHBondContact O-CG 3.41Å; G662-L666 PolarHBondContact O-N 3.14Å; G662-L666 VanDerWaalsContact O-N 3.14Å
663	V	98.2	Very high	95.3	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.012	12%	0.116	C	C	.	.	H	α-helix	trans	-66.4	-40.5	177.4	174.6	0	0	0	0	111.3	F600 M603 I604 H607 F659 I661 I665 L666 Q667 L703	F600-V663 HydrophobicContact CD2-CG2 4.45Å; F600-V663 HydrophobicContact CE2-CG2 3.85Å; M603-V663 HydrophobicContact CB-CG2 4.23Å; I604-V663 HydrophobicContact CG1-CG2 4.18Å; H607-V663 HydrophobicContact CB-CG1 3.98Å; F659-V663 WeakPolarHBondContact O-CG2 3.35Å; F659-V663 PolarHBondContact O-N 3.22Å; I661-V663 VanDerWaalsContact C-N 3.34Å; I661-V663 PolarHBondContact O-N 2.86Å; V663-I665 VanDerWaalsContact C-N 3.32Å; V663-I665 PolarHBondContact O-N 3.3Å; V663-L666 PolarHBondContact O-N 3.39Å; V663-Q667 HydrophobicContact CG1-CG 4.29Å; V663-Q667 WeakPolarHBondContact O-CG 3.29Å; V663-Q667 PolarHBondContact O-N 3.1Å; V663-L703 HydrophobicContact CB-CD1 4.01Å; V663-L703 HydrophobicContact CG1-CD1 3.82Å; V663-L703 HydrophobicContact CG1-CD2 4.24Å
664	A	98	Very high	95.9	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.008	12%	0.12	C	C	.	.	H	α-helix	trans	-62.6	-38.3	177.5	0	0	0	0	0	112.4	C660 I661 Q667 Q668 E699 S700 L703	C660-A664 VanDerWaalsContact O-CB 3.25Å; C660-A664 WeakPolarHBondContact O-CB 3.31Å; C660-A664 PolarHBondContact O-N 3.34Å; I661-A664 PolarHBondContact O-N 3.16Å; A664-Q667 PolarHBondContact O-N 3.22Å; A664-Q668 WeakPolarHBondContact O-CG 3.43Å; A664-Q668 PolarHBondContact O-N 2.94Å; A664-E699 HydrophobicContact CB-CB 4.04Å; A664-S700 WeakPolarHBondContact CB-OG 3.42Å; A664-L703 HydrophobicContact CB-CD1 4.02Å
665	I	97.1	Very high	96.3	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-62.3	-47.5	173.7	-65.8	165.7	0	0	0	110.1	W629 F634 F638 I661 G662 V663 Q667 Q668 L669 I691	W629-I665 HydrophobicContact CH2-CB 4.21Å; W629-I665 HydrophobicContact CH2-CG2 3.59Å; W629-I665 HydrophobicContact CZ2-CG2 4.07Å; W629-I665 HydrophobicContact CZ3-CB 4.37Å; W629-I665 HydrophobicContact CZ3-CG2 4.23Å; F634-I665 HydrophobicContact CD1-CD1 3.84Å; F634-I665 HydrophobicContact CE1-CD1 3.75Å; F638-I665 HydrophobicContact CE2-CD1 3.81Å; F638-I665 HydrophobicContact CZ-CD1 3.94Å; F638-I665 HydrophobicContact CZ-CG1 4.38Å; I661-I665 HydrophobicContact CG2-CD1 3.97Å; I661-I665 WeakPolarHBondContact O-CG1 3.2Å; I661-I665 PolarHBondContact O-N 3.04Å; G662-I665 PolarHBondContact O-N 3.38Å; V663-I665 VanDerWaalsContact C-N 3.32Å; V663-I665 PolarHBondContact O-N 3.3Å; I665-Q667 VanDerWaalsContact C-N 3.32Å; I665-Q667 PolarHBondContact O-N 2.95Å; I665-Q668 PolarHBondContact O-N 3.5Å; I665-L669 HydrophobicContact CG2-CD1 4.43Å; I665-L669 PolarHBondContact O-N 3.26Å; I665-I691 HydrophobicContact CG2-CD1 4.25Å; I665-I691 HydrophobicContact CG2-CG1 4.4Å
666	L	97.4	Very high	96.6	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-39.2	177.4	-67.8	175.4	0	0	0	112.5	F600 I604 L611 Y625 W629 G662 V663 Q668 L669 R670 L673 F685	F600-L666 HydrophobicContact CE1-CD1 4.19Å; F600-L666 HydrophobicContact CZ-CD1 3.76Å; I604-L666 HydrophobicContact CD1-CD1 3.47Å; I604-L666 VanDerWaalsContact CD1-CD1 3.47Å; I604-L666 HydrophobicContact CG1-CD1 3.75Å; L611-L666 HydrophobicContact CD2-CB 4.13Å; Y625-L666 HydrophobicContact CE2-CD2 4.09Å; W629-L666 HydrophobicContact CH2-CD2 4.08Å; W629-L666 HydrophobicContact CH2-CG 4.41Å; W629-L666 HydrophobicContact CZ3-CD2 4.4Å; W629-L666 HydrophobicContact CZ3-CG 4.35Å; G662-L666 WeakPolarHBondContact O-CG 3.41Å; G662-L666 PolarHBondContact O-N 3.14Å; G662-L666 VanDerWaalsContact O-N 3.14Å; V663-L666 PolarHBondContact O-N 3.39Å; L666-Q668 VanDerWaalsContact C-N 3.29Å; L666-Q668 PolarHBondContact O-N 3.22Å; L666-L669 CarbonylContact O-C 3.54Å; L666-L669 PolarHBondContact O-N 2.97Å; L666-R670 PolarHBondContact O-N 2.89Å; L666-L673 HydrophobicContact CD2-CD1 4.02Å; L666-F685 HydrophobicContact CD2-CE1 4.2Å; L666-F685 HydrophobicContact CD2-CZ 3.62Å
667	Q	96.8	Very high	96.9	Very high	46 Å²	46	30.3 Å²	30.3	22%	0.215	16%	0.162	C	C	.	.	H	α-helix	trans	-64.4	-30.9	177.1	-77.2	-178.8	-24	0	0	113.2	V663 A664 I665 L669 R670	V663-Q667 HydrophobicContact CG1-CG 4.29Å; V663-Q667 WeakPolarHBondContact O-CG 3.29Å; V663-Q667 PolarHBondContact O-N 3.1Å; A664-Q667 PolarHBondContact O-N 3.22Å; I665-Q667 VanDerWaalsContact C-N 3.32Å; I665-Q667 PolarHBondContact O-N 2.95Å; Q667-L669 VanDerWaalsContact C-N 3.31Å; Q667-R670 VanDerWaalsContact O-CB 3.26Å; Q667-R670 WeakPolarHBondContact O-CB 3.11Å
668	Q	96.9	Very high	96.9	Very high	40 Å²	40	33.8 Å²	33.8	19%	0.187	18%	0.177	C	C	.	.	H	α-helix	trans	-71.7	-28.9	172.9	-68.4	-169.8	52.5	0	0	112.4	A664 I665 L666 I691 D692	A664-Q668 WeakPolarHBondContact O-CG 3.43Å; A664-Q668 PolarHBondContact O-N 2.94Å; I665-Q668 PolarHBondContact O-N 3.5Å; L666-Q668 VanDerWaalsContact C-N 3.29Å; L666-Q668 PolarHBondContact O-N 3.22Å; Q668-I691 HydrophobicContact CB-CD1 4.44Å; Q668-D692 PolarHBondContact NE2-O 3.27Å
669	L	96.3	Very high	96.8	Very high	6 Å²	6	39 Å²	39	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-91.3	-4.4	177.7	-60.3	177.3	0	0	0	113.3	I665 L666 Q667 D671 R672 L673 L688 P689 I691	I665-L669 HydrophobicContact CG2-CD1 4.43Å; I665-L669 PolarHBondContact O-N 3.26Å; L666-L669 CarbonylContact O-C 3.54Å; L666-L669 PolarHBondContact O-N 2.97Å; Q667-L669 VanDerWaalsContact C-N 3.31Å; L669-D671 PolarHBondContact O-N 3.4Å; L669-R672 WeakPolarHBondContact O-CB 3.38Å; L669-R672 PolarHBondContact O-N 2.84Å; L669-L673 HydrophobicContact CB-CD1 3.9Å; L669-L673 HydrophobicContact CB-CG 4.07Å; L669-L673 WeakPolarHBondContact O-CG 3.48Å; L669-L673 PolarHBondContact O-N 3.14Å; L669-L688 HydrophobicContact CD1-CD1 3.69Å; L669-P689 HydrophobicContact CD2-CB 4.19Å; L669-P689 HydrophobicContact CD2-CG 3.85Å; L669-I691 HydrophobicContact CD1-CD1 4.46Å; L669-I691 HydrophobicContact CD2-CD1 3.95Å; L669-I691 HydrophobicContact CG-CD1 4.12Å
670	R	96.6	Very high	96.6	Very high	61 Å²	61	43.4 Å²	43.4	23%	0.23	23%	0.226	C	C	.	.	H	α-helix	trans	-45.4	-54	-169.1	-176.8	-174.5	-168.2	-83.5	-4.7	114.1	D608 E610 L666 Q667 R672 L673 L674	D608-R670 IonicContact OD1-NE 3.57Å; D608-R670 IonicContact OD1-NH2 3.13Å; D608-R670 PolarHBondContact OD1-NH2 3.14Å; D608-R670 VanDerWaalsContact OD2-CD 3.32Å; D608-R670 WeakPolarHBondContact OD2-CD 3.41Å; D608-R670 IonicContact OD2-CZ 3.6Å; D608-R670 IonicContact OD2-NE 3.7Å; D608-R670 PolarHBondContact OD2-NE 3.38Å; E610-R670 VanDerWaalsContact CD-NH2 3.32Å; E610-R670 IonicContact OE2-CZ 2.6Å; E610-R670 IonicContact OE2-NH2 3.98Å; E610-R670 PolarHBondContact OE2-NH2 3.11Å; L666-R670 PolarHBondContact O-N 2.89Å; Q667-R670 VanDerWaalsContact O-CB 3.26Å; Q667-R670 WeakPolarHBondContact O-CB 3.11Å; R670-R672 VanDerWaalsContact C-N 3.26Å; R670-R672 PolarHBondContact O-N 2.74Å; R670-L673 PolarHBondContact O-N 3.11Å; R670-L673 VanDerWaalsContact O-N 3.1Å; R670-L674 HydrophobicContact CG-CD1 3.89Å; R670-L674 HydrophobicContact CG-CG 4.41Å; R670-L674 VanDerWaalsContact NH1-CD1 3.29Å; R670-L674 WeakPolarHBondContact O-CG 3.3Å; R670-L674 PolarHBondContact O-N 3.31Å
671	D	96.3	Very high	96.5	Very high	126 Å²	126	43.4 Å²	43.4	67%	0.674	23%	0.225	S	C	*	.	H	α-helix	trans	-63	-35.8	-175	-61.3	-25.9	0	0	0	111.7	L669 A675	L669-D671 PolarHBondContact O-N 3.4Å; D671-A675 WeakPolarHBondContact O-CB 3.4Å; D671-A675 PolarHBondContact O-N 2.84Å
672	R	95.8	Very high	96.3	Very high	140 Å²	140	46.2 Å²	46.2	53%	0.528	24%	0.24	S	C	.	.	H	α-helix	trans	-73.5	-36	175.5	-62.5	-174.9	-176.9	-170.4	2.7	111.8	L669 R670 N676 L684	L669-R672 WeakPolarHBondContact O-CB 3.38Å; L669-R672 PolarHBondContact O-N 2.84Å; R670-R672 VanDerWaalsContact C-N 3.26Å; R670-R672 PolarHBondContact O-N 2.74Å; R672-N676 VanDerWaalsContact O-CB 3.31Å; R672-N676 WeakPolarHBondContact O-CB 3.49Å; R672-N676 PolarHBondContact O-ND2 3.26Å; R672-L684 HydrophobicContact CB-CD2 4.04Å
673	L	96.6	Very high	96	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-67.7	-45.6	178.4	-66	172.6	0	0	0	111.4	L611 H614 L615 L666 L669 R670 A675 N676 L684 F685	L611-L673 HydrophobicContact CD1-CB 3.69Å; L611-L673 HydrophobicContact CD1-CD1 4.02Å; L611-L673 HydrophobicContact CD2-CD1 4.28Å; H614-L673 PolarHBondContact CD2-O 3Å; H614-L673 PolarHBondContact NE2-O 2.56Å; L615-L673 HydrophobicContact CD2-CB 4.44Å; L666-L673 HydrophobicContact CD2-CD1 4.02Å; L669-L673 HydrophobicContact CB-CD1 3.9Å; L669-L673 HydrophobicContact CB-CG 4.07Å; L669-L673 WeakPolarHBondContact O-CG 3.48Å; L669-L673 PolarHBondContact O-N 3.14Å; R670-L673 PolarHBondContact O-N 3.11Å; R670-L673 VanDerWaalsContact O-N 3.1Å; L673-A675 VanDerWaalsContact C-N 3.28Å; L673-A675 PolarHBondContact O-N 3.3Å; L673-N676 PolarHBondContact O-N 3.06Å; L673-L684 HydrophobicContact CD2-CD2 3.69Å; L673-L684 HydrophobicContact CG-CD2 4.29Å; L673-F685 HydrophobicContact CD2-CE2 3.67Å; L673-F685 HydrophobicContact CD2-CZ 4.4Å
674	L	97.4	Very high	95.7	Very high	43 Å²	43	53 Å²	53	23%	0.225	28%	0.275	C	S	.	.	H	α-helix	trans	-65.8	-29.8	178.7	-70.2	175.3	0	0	0	112.9	E610 L611 H614 R670 N676	E610-L674 HydrophobicContact CG-CD2 4.37Å; L611-L674 HydrophobicContact CD1-CD2 4.11Å; L611-L674 HydrophobicContact CD1-CG 4.22Å; H614-L674 HydrophobicContact CB-CD2 3.73Å; R670-L674 HydrophobicContact CG-CD1 3.89Å; R670-L674 HydrophobicContact CG-CG 4.41Å; R670-L674 VanDerWaalsContact NH1-CD1 3.29Å; R670-L674 WeakPolarHBondContact O-CG 3.3Å; R670-L674 PolarHBondContact O-N 3.31Å; L674-N676 VanDerWaalsContact C-N 3.31Å
675	A	96.5	Very high	95.3	Very high	81 Å²	81	54.5 Å²	54.5	67%	0.669	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-11.7	179.4	0	0	0	0	0	114.1	D671 L673	D671-A675 WeakPolarHBondContact O-CB 3.4Å; D671-A675 PolarHBondContact O-N 2.84Å; L673-A675 VanDerWaalsContact C-N 3.28Å; L673-A675 PolarHBondContact O-N 3.3Å
676	N	96.1	Very high	94.9	Very high	56 Å²	56	59.1 Å²	59.1	30%	0.299	31%	0.314	S	S	.	.			trans	-122.1	153.7	-165.6	-81.1	-41	0	0	0	113	H614 R672 L673 L674 E680	H614-N676 PolarHBondContact CE1-O 3.47Å; H614-N676 PolarHBondContact NE2-O 3.32Å; R672-N676 VanDerWaalsContact O-CB 3.31Å; R672-N676 WeakPolarHBondContact O-CB 3.49Å; R672-N676 PolarHBondContact O-ND2 3.26Å; L673-N676 PolarHBondContact O-N 3.06Å; L674-N676 VanDerWaalsContact C-N 3.31Å; N676-E680 HydrophobicContact CB-CB 3.7Å
677	G	95.7	Very high	94.3	Very high	27 Å²	27	65.6 Å²	65.6	28%	0.278	35%	0.349	S	S	.	.			trans	-88.8	-172.1	173	0	0	0	0	0	112.8	N679 E680 C681	G677-N679 PolarHBondContact O-N 2.9Å; G677-E680 WeakPolarHBondContact CA-OE2 3.22Å; G677-E680 PolarHBondContact N-OE2 3.43Å; G677-C681 WeakPolarHBondContact O-CB 3.29Å; G677-C681 PolarHBondContact O-N 3.02Å; G677-C681 PolarHBondContact O-SG 3.1Å
678	F	95.8	Very high	93.8	Very high	78 Å²	78	65.2 Å²	65.2	34%	0.342	35%	0.348	S	S	.	.	H	α-helix	trans	-55.6	-48.3	-175.9	178.4	-93.5	0	0	0	113.6	F620 L624 C681 I682	F620-F678 HydrophobicContact CB-CD2 4.2Å; F620-F678 HydrophobicContact CD2-CD2 4.16Å; F620-F678 HydrophobicContact CD2-CE2 4.26Å; L624-F678 HydrophobicContact CD1-CE2 3.61Å; L624-F678 HydrophobicContact CD1-CZ 4.04Å; F678-C681 PolarHBondContact O-N 3.24Å; F678-I682 HydrophobicContact CD1-CG1 4.4Å; F678-I682 HydrophobicContact CE1-CG1 4.02Å; F678-I682 HydrophobicContact CZ-CD1 4.24Å; F678-I682 HydrophobicContact CZ-CG1 4.14Å; F678-I682 WeakPolarHBondContact O-CG1 3.36Å; F678-I682 PolarHBondContact O-N 2.81Å; F678-I682 VanDerWaalsContact O-N 3.08Å
679	N	94.3	Very high	93.4	Very high	110 Å²	110	64.5 Å²	64.5	59%	0.588	35%	0.347	S	S	*	.	H	α-helix	trans	-68.8	-42.3	-173.8	-66.1	-41	0	0	0	111.8	G677 C681 I682 L683	G677-N679 PolarHBondContact O-N 2.9Å; N679-C681 VanDerWaalsContact C-N 3.33Å; N679-I682 PolarHBondContact O-N 3.28Å; N679-L683 PolarHBondContact O-N 3.44Å; N679-L683 VanDerWaalsContact O-N 3.14Å
680	E	94.6	Very high	93.2	Very high	92 Å²	92	72.3 Å²	72.3	43%	0.43	38%	0.383	S	S	.	.	H	α-helix	trans	-67.1	-36.8	179	-63.4	75	-160.2	0	0	111	N676 G677 L683 L684	N676-E680 HydrophobicContact CB-CB 3.7Å; G677-E680 WeakPolarHBondContact CA-OE2 3.22Å; G677-E680 PolarHBondContact N-OE2 3.43Å; E680-L683 PolarHBondContact O-N 3.2Å; E680-L684 WeakPolarHBondContact O-CB 3.48Å; E680-L684 PolarHBondContact O-N 2.74Å
681	C	95	Very high	93.1	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-62.6	-42	171.6	-74.3	0	0	0	0	112.1	F620 G677 F678 N679 L683 L684 F685	F620-C681 HydrophobicContact CD1-CB 4.19Å; F620-C681 HydrophobicContact CD2-CB 3.8Å; F620-C681 HydrophobicContact CE1-CB 4.1Å; F620-C681 HydrophobicContact CE2-CB 3.73Å; F620-C681 HydrophobicContact CG-CB 4.02Å; F620-C681 HydrophobicContact CZ-CB 3.88Å; G677-C681 WeakPolarHBondContact O-CB 3.29Å; G677-C681 PolarHBondContact O-N 3.02Å; G677-C681 PolarHBondContact O-SG 3.1Å; F678-C681 PolarHBondContact O-N 3.24Å; N679-C681 VanDerWaalsContact C-N 3.33Å; C681-L683 VanDerWaalsContact C-N 3.31Å; C681-L683 PolarHBondContact O-N 2.84Å; C681-L684 WeakPolarHBondContact O-CB 3.42Å; C681-L684 PolarHBondContact O-N 3.37Å; C681-F685 VanDerWaalsContact O-CD2 3.31Å; C681-F685 WeakPolarHBondContact O-CD2 3.22Å; C681-F685 PolarHBondContact O-N 3.05Å
682	I	93.1	Very high	93	Very high	60 Å²	60	67.5 Å²	67.5	31%	0.308	36%	0.362	S	S	.	.	H	α-helix	trans	-60.1	-41.9	175.6	-68.4	-76.4	0	0	0	111.5	F620 F678 N679 F685 S686	F620-I682 HydrophobicContact CD2-CD1 4.17Å; F620-I682 HydrophobicContact CD2-CG1 4.28Å; F620-I682 HydrophobicContact CE2-CD1 3.62Å; F620-I682 HydrophobicContact CE2-CG1 3.87Å; F678-I682 HydrophobicContact CD1-CG1 4.4Å; F678-I682 HydrophobicContact CE1-CG1 4.02Å; F678-I682 HydrophobicContact CZ-CD1 4.24Å; F678-I682 HydrophobicContact CZ-CG1 4.14Å; F678-I682 WeakPolarHBondContact O-CG1 3.36Å; F678-I682 PolarHBondContact O-N 2.81Å; F678-I682 VanDerWaalsContact O-N 3.08Å; N679-I682 PolarHBondContact O-N 3.28Å; I682-F685 PolarHBondContact O-N 2.67Å; I682-S686 PolarHBondContact O-N 3.25Å; I682-S686 VanDerWaalsContact O-N 3.14Å; I682-S686 PolarHBondContact O-OG 3.41Å
683	L	91.9	Very high	92.9	Very high	121 Å²	121	61.4 Å²	61.4	63%	0.634	34%	0.34	S	S	*	.	H	α-helix	trans	-65.3	-42	177	-69	173.1	0	0	0	111.3	N679 E680 C681 F685 S686 D687	N679-L683 PolarHBondContact O-N 3.44Å; N679-L683 VanDerWaalsContact O-N 3.14Å; E680-L683 PolarHBondContact O-N 3.2Å; C681-L683 VanDerWaalsContact C-N 3.31Å; C681-L683 PolarHBondContact O-N 2.84Å; L683-F685 VanDerWaalsContact C-N 3.26Å; L683-F685 PolarHBondContact O-N 2.78Å; L683-S686 PolarHBondContact O-N 3.2Å; L683-S686 VanDerWaalsContact O-N 3.16Å; L683-D687 PolarHBondContact O-N 3.29Å; L683-D687 VanDerWaalsContact O-N 3.13Å
684	L	92.6	Very high	92.7	Very high	22 Å²	22	64.6 Å²	64.6	12%	0.115	36%	0.355	C	S	.	.	H	α-helix	trans	-59.4	-34.2	179.3	-174.8	68.5	0	0	0	113.1	R672 L673 E680 C681 D687 L688 P689	R672-L684 HydrophobicContact CB-CD2 4.04Å; L673-L684 HydrophobicContact CD2-CD2 3.69Å; L673-L684 HydrophobicContact CG-CD2 4.29Å; E680-L684 WeakPolarHBondContact O-CB 3.48Å; E680-L684 PolarHBondContact O-N 2.74Å; C681-L684 WeakPolarHBondContact O-CB 3.42Å; C681-L684 PolarHBondContact O-N 3.37Å; L684-D687 CarbonylContact O-C 3.57Å; L684-D687 VanDerWaalsContact O-O 3.08Å; L684-L688 WeakPolarHBondContact O-CA 3.39Å; L684-L688 PolarHBondContact O-N 2.82Å; L684-P689 HydrophobicContact CD1-CG 3.47Å; L684-P689 VanDerWaalsContact CD1-CG 3.47Å; L684-P689 HydrophobicContact CG-CG 4.44Å
685	F	89.6	Confident	92.6	Very high	33 Å²	33	67.5 Å²	67.5	15%	0.145	36%	0.363	C	S	.	.	H	α-helix	trans	-87.3	-22	178.1	-80.1	-109	0	0	0	113.5	F620 Y625 W629 L666 L673 C681 I682 L683 D687 L688	F620-F685 HydrophobicContact CE1-CD2 4.07Å; F620-F685 AromaticContact CE1-CE2 3.56Å; F620-F685 HydrophobicContact CE1-CE2 3.56Å; F620-F685 AromaticContact CE1-CZ 3.99Å; F620-F685 HydrophobicContact CE1-CZ 3.99Å; F620-F685 AromaticContact CZ-CD2 3.67Å; F620-F685 HydrophobicContact CZ-CD2 3.67Å; F620-F685 AromaticContact CZ-CE2 3.68Å; F620-F685 HydrophobicContact CZ-CE2 3.68Å; F620-F685 HydrophobicContact CZ-CG 4.27Å; F620-F685 HydrophobicContact CZ-CZ 4.32Å; Y625-F685 HydrophobicContact CD1-CE1 4.35Å; Y625-F685 HydrophobicContact CD1-CZ 4.44Å; Y625-F685 AromaticContact CD2-CD1 3.85Å; Y625-F685 HydrophobicContact CD2-CD1 3.85Å; Y625-F685 AromaticContact CD2-CE1 3.25Å; Y625-F685 HydrophobicContact CD2-CE1 3.25Å; Y625-F685 AromaticContact CD2-CZ 3.92Å; Y625-F685 HydrophobicContact CD2-CZ 3.92Å; Y625-F685 AromaticContact CE2-CE1 3.79Å; Y625-F685 HydrophobicContact CE2-CE1 3.79Å; Y625-F685 HydrophobicContact CE2-CZ 4.1Å; Y625-F685 AromaticContact CG-CD1 3.84Å; Y625-F685 HydrophobicContact CG-CD1 3.84Å; Y625-F685 AromaticContact CG-CE1 3.58Å; Y625-F685 HydrophobicContact CG-CE1 3.58Å; Y625-F685 HydrophobicContact CG-CZ 4.1Å; W629-F685 HydrophobicContact CH2-CD1 4.27Å; W629-F685 AromaticContact CH2-CE1 3.45Å; W629-F685 HydrophobicContact CH2-CE1 3.45Å; W629-F685 VanDerWaalsContact CH2-CE1 3.45Å; W629-F685 HydrophobicContact CH2-CZ 4.29Å; W629-F685 AromaticContact CZ2-CD1 3.62Å; W629-F685 HydrophobicContact CZ2-CD1 3.62Å; W629-F685 AromaticContact CZ2-CE1 3.27Å; W629-F685 HydrophobicContact CZ2-CE1 3.27Å; W629-F685 HydrophobicContact CZ2-CZ 4.42Å; L666-F685 HydrophobicContact CD2-CE1 4.2Å; L666-F685 HydrophobicContact CD2-CZ 3.62Å; L673-F685 HydrophobicContact CD2-CE2 3.67Å; L673-F685 HydrophobicContact CD2-CZ 4.4Å; C681-F685 VanDerWaalsContact O-CD2 3.31Å; C681-F685 WeakPolarHBondContact O-CD2 3.22Å; C681-F685 PolarHBondContact O-N 3.05Å; I682-F685 PolarHBondContact O-N 2.67Å; L683-F685 VanDerWaalsContact C-N 3.26Å; L683-F685 PolarHBondContact O-N 2.78Å; F685-D687 VanDerWaalsContact C-N 3.32Å; F685-L688 HydrophobicContact CD1-CD1 4.43Å
686	S	86.8	Confident	92.6	Very high	99 Å²	99	63.7 Å²	63.7	69%	0.692	33%	0.331	S	S	*	.	H	α-helix	trans	-70.2	-33.6	172.9	-58.1	0	0	0	0	111.5	I682 L683	I682-S686 PolarHBondContact O-N 3.25Å; I682-S686 VanDerWaalsContact O-N 3.14Å; I682-S686 PolarHBondContact O-OG 3.41Å; L683-S686 PolarHBondContact O-N 3.2Å; L683-S686 VanDerWaalsContact O-N 3.16Å
687	D	85.1	Confident	92.5	Very high	137 Å²	137	61.6 Å²	61.6	73%	0.733	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.7	77.7	173.2	-173	24	0	0	0	109.4	L683 L684 F685 P689	L683-D687 PolarHBondContact O-N 3.29Å; L683-D687 VanDerWaalsContact O-N 3.13Å; L684-D687 CarbonylContact O-C 3.57Å; L684-D687 VanDerWaalsContact O-O 3.08Å; F685-D687 VanDerWaalsContact C-N 3.32Å; D687-P689 WeakPolarHBondContact O-CD 3.4Å
688	L	86.6	Confident	92.4	Very high	37 Å²	37	66.6 Å²	66.6	19%	0.194	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-62.5	124.2	-172.8	-164	75.2	0	0	0	110.2	V637 F638 L669 L684 F685 I691	V637-L688 HydrophobicContact CG1-CD2 3.67Å; F638-L688 HydrophobicContact CE1-CD2 3.96Å; F638-L688 HydrophobicContact CZ-CD2 4.18Å; L669-L688 HydrophobicContact CD1-CD1 3.69Å; L684-L688 WeakPolarHBondContact O-CA 3.39Å; L684-L688 PolarHBondContact O-N 2.82Å; F685-L688 HydrophobicContact CD1-CD1 4.43Å; L688-I691 HydrophobicContact CD2-CG1 4Å; L688-I691 HydrophobicContact CG-CG1 4.47Å
689	P	89.6	Confident	92.4	Very high	26 Å²	26	65.2 Å²	65.2	17%	0.169	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-57.6	159.2	174.3	-23	32.8	0	0	0	111.8	L669 L684 D687 I691	L669-P689 HydrophobicContact CD2-CB 4.19Å; L669-P689 HydrophobicContact CD2-CG 3.85Å; L684-P689 HydrophobicContact CD1-CG 3.47Å; L684-P689 VanDerWaalsContact CD1-CG 3.47Å; L684-P689 HydrophobicContact CG-CG 4.44Å; D687-P689 WeakPolarHBondContact O-CD 3.4Å; P689-I691 PolarHBondContact O-N 3.18Å
690	E	90.6	Very high	92.5	Very high	169 Å²	169	60 Å²	60	79%	0.79	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-59.5	118.2	177.2	-174.8	165.4	-156.8	0	0	111.6	K642	K642-E690 IonicContact NZ-OE1 2.66Å; K642-E690 PolarHBondContact NZ-OE1 3.06Å
691	I	94.1	Very high	92.4	Very high	4 Å²	4	59.2 Å²	59.2	2%	0.021	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-90.6	131.5	174	-57.6	-56.6	0	0	0	109.7	F638 K642 I665 Q668 L669 L688 P689 I693 C696	F638-I691 HydrophobicContact CE1-CB 3.85Å; F638-I691 HydrophobicContact CE1-CG1 3.81Å; F638-I691 HydrophobicContact CE1-CG2 4.5Å; F638-I691 HydrophobicContact CZ-CB 4.12Å; F638-I691 HydrophobicContact CZ-CG1 3.99Å; F638-I691 HydrophobicContact CZ-CG2 4.33Å; K642-I691 PolarHBondContact NZ-O 3.04Å; I665-I691 HydrophobicContact CG2-CD1 4.25Å; I665-I691 HydrophobicContact CG2-CG1 4.4Å; Q668-I691 HydrophobicContact CB-CD1 4.44Å; L669-I691 HydrophobicContact CD1-CD1 4.46Å; L669-I691 HydrophobicContact CD2-CD1 3.95Å; L669-I691 HydrophobicContact CG-CD1 4.12Å; L688-I691 HydrophobicContact CD2-CG1 4Å; L688-I691 HydrophobicContact CG-CG1 4.47Å; P689-I691 PolarHBondContact O-N 3.18Å; I691-I693 HydrophobicContact CG2-CD1 4.26Å; I691-I693 PolarHBondContact O-N 3.48Å; I691-C696 HydrophobicContact CG2-CB 4.49Å
692	D	94.9	Very high	92.3	Very high	83 Å²	83	62.6 Å²	62.6	44%	0.444	31%	0.314	S	S	.	.			trans	-78.3	109.2	168.7	178.2	-14.4	0	0	0	108.8	Q668 E694 R695 C696	Q668-D692 PolarHBondContact NE2-O 3.27Å; D692-E694 PolarHBondContact OD1-N 2.97Å; D692-R695 HydrophobicContact CB-CB 3.97Å; D692-R695 PolarHBondContact OD1-N 3.15Å; D692-C696 WeakPolarHBondContact O-CB 3.49Å; D692-C696 PolarHBondContact O-N 3.04Å
693	I	94.6	Very high	92.3	Very high	11 Å²	11	60.1 Å²	60.1	6%	0.056	30%	0.301	C	S	.	.	H	α-helix	trans	-73.4	-33	-176.4	-58.6	-61.6	0	0	0	112	F638 K642 H645 L646 I691 C696 V697	F638-I693 HydrophobicContact CD1-CD1 4.42Å; F638-I693 HydrophobicContact CD2-CD1 4.46Å; F638-I693 HydrophobicContact CE1-CD1 4.44Å; F638-I693 HydrophobicContact CE2-CD1 4.47Å; F638-I693 HydrophobicContact CG-CD1 4.43Å; F638-I693 HydrophobicContact CZ-CD1 4.46Å; K642-I693 HydrophobicContact CB-CD1 4.06Å; K642-I693 HydrophobicContact CB-CG1 3.68Å; K642-I693 HydrophobicContact CD-CD1 4.1Å; K642-I693 HydrophobicContact CD-CG1 3.61Å; K642-I693 HydrophobicContact CG-CD1 4.34Å; K642-I693 HydrophobicContact CG-CG1 3.61Å; H645-I693 HydrophobicContact CB-CG2 4.05Å; L646-I693 HydrophobicContact CB-CG2 4.38Å; I691-I693 HydrophobicContact CG2-CD1 4.26Å; I691-I693 PolarHBondContact O-N 3.48Å; I693-C696 WeakPolarHBondContact O-CB 3.29Å; I693-C696 PolarHBondContact O-N 2.59Å; I693-V697 HydrophobicContact CG2-CG2 4.33Å; I693-V697 WeakPolarHBondContact O-CG2 3.01Å; I693-V697 PolarHBondContact O-N 3.02Å
694	E	92.5	Very high	92.3	Very high	67 Å²	67	57.1 Å²	57.1	31%	0.313	28%	0.283	S	S	.	.	H	α-helix	trans	-67.8	-43.9	178.3	-173.7	173.7	163.6	0	0	110.4	P430 D692 C696 V697 R698	P430-E694 WeakPolarHBondContact CB-OE2 3.4Å; D692-E694 PolarHBondContact OD1-N 2.97Å; E694-C696 VanDerWaalsContact C-N 3.32Å; E694-V697 PolarHBondContact O-N 3.34Å; E694-R698 PolarHBondContact O-N 3.21Å; E694-R698 VanDerWaalsContact O-N 3.12Å
695	R	95	Very high	92.1	Very high	105 Å²	105	58.6 Å²	58.6	40%	0.396	29%	0.294	S	S	.	.	H	α-helix	trans	-60	-44.2	169.2	-178.9	176.8	-179.7	-167.7	-1.7	111.1	D692 V697 R698 E699	D692-R695 HydrophobicContact CB-CB 3.97Å; D692-R695 PolarHBondContact OD1-N 3.15Å; R695-V697 PolarHBondContact O-N 3.27Å; R695-R698 PolarHBondContact O-N 3.07Å; R695-E699 HydrophobicContact CG-CG 4.22Å; R695-E699 WeakPolarHBondContact O-CG 3.41Å; R695-E699 PolarHBondContact O-N 3.37Å
696	C	96.6	Very high	92	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-57.2	-51.4	179.4	-168.1	0	0	0	0	111.4	I691 D692 I693 E694 R698 E699 S700	I691-C696 HydrophobicContact CG2-CB 4.49Å; D692-C696 WeakPolarHBondContact O-CB 3.49Å; D692-C696 PolarHBondContact O-N 3.04Å; I693-C696 WeakPolarHBondContact O-CB 3.29Å; I693-C696 PolarHBondContact O-N 2.59Å; E694-C696 VanDerWaalsContact C-N 3.32Å; C696-R698 PolarHBondContact O-N 3.49Å; C696-E699 PolarHBondContact O-N 3.04Å; C696-S700 WeakPolarHBondContact O-CB 3.07Å; C696-S700 PolarHBondContact O-N 3.41Å; C696-S700 PolarHBondContact O-OG 2.92Å
697	V	94.1	Very high	92.2	Very high	13 Å²	13	55.8 Å²	55.8	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-57.8	-48.3	179	166.7	0	0	0	0	111.1	L646 T649 I693 E694 R695 E699 S700 I701	L646-V697 HydrophobicContact CD1-CG2 4.1Å; T649-V697 HydrophobicContact CG2-CG1 4.12Å; T649-V697 VanDerWaalsContact OG1-CG1 3.32Å; T649-V697 WeakPolarHBondContact OG1-CG1 3.49Å; I693-V697 HydrophobicContact CG2-CG2 4.33Å; I693-V697 WeakPolarHBondContact O-CG2 3.01Å; I693-V697 PolarHBondContact O-N 3.02Å; E694-V697 PolarHBondContact O-N 3.34Å; R695-V697 PolarHBondContact O-N 3.27Å; V697-E699 PolarHBondContact O-N 2.82Å; V697-S700 PolarHBondContact O-N 2.92Å; V697-I701 HydrophobicContact CG1-CD1 3.99Å; V697-I701 WeakPolarHBondContact O-CG1 3.5Å; V697-I701 PolarHBondContact O-N 3.29Å
698	R	93.9	Very high	92.4	Very high	132 Å²	132	49.4 Å²	49.4	50%	0.498	24%	0.235	S	C	.	.	H	α-helix	trans	-60	-47.7	179.2	-178.5	177.7	60.9	-117.7	-0.9	112.1	E694 R695 C696 I701 N702	E694-R698 PolarHBondContact O-N 3.21Å; E694-R698 VanDerWaalsContact O-N 3.12Å; R695-R698 PolarHBondContact O-N 3.07Å; C696-R698 PolarHBondContact O-N 3.49Å; R698-I701 PolarHBondContact O-N 3.48Å; R698-N702 PolarHBondContact O-N 3.3Å; R698-N702 VanDerWaalsContact O-N 3.09Å
699	E	95.9	Very high	92.4	Very high	49 Å²	49	50.3 Å²	50.3	23%	0.229	24%	0.237	C	C	.	.	H	α-helix	trans	-67.4	-39.1	178.4	-65	-48.2	144.2	0	0	111.6	A664 R695 C696 V697 I701 N702 L703	A664-E699 HydrophobicContact CB-CB 4.04Å; R695-E699 HydrophobicContact CG-CG 4.22Å; R695-E699 WeakPolarHBondContact O-CG 3.41Å; R695-E699 PolarHBondContact O-N 3.37Å; C696-E699 PolarHBondContact O-N 3.04Å; V697-E699 PolarHBondContact O-N 2.82Å; E699-I701 VanDerWaalsContact C-N 3.33Å; E699-I701 PolarHBondContact O-N 2.93Å; E699-N702 WeakPolarHBondContact O-CB 3.2Å; E699-N702 PolarHBondContact O-N 3.41Å; E699-N702 VanDerWaalsContact O-N 3.14Å; E699-L703 WeakPolarHBondContact O-CB 3.46Å; E699-L703 WeakPolarHBondContact O-CG 3.47Å; E699-L703 PolarHBondContact O-N 3.3Å
700	S	96.2	Very high	92.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.1	-41	175.5	-60.5	0	0	0	0	112.6	C660 I661 A664 C696 V697 F704	C660-S700 WeakPolarHBondContact CB-O 3.48Å; C660-S700 PolarHBondContact O-OG 3.35Å; C660-S700 VanDerWaalsContact O-OG 3.13Å; I661-S700 VanDerWaalsContact CA-OG 3.25Å; I661-S700 WeakPolarHBondContact CA-OG 3.47Å; I661-S700 PolarHBondContact N-OG 3.08Å; A664-S700 WeakPolarHBondContact CB-OG 3.42Å; C696-S700 WeakPolarHBondContact O-CB 3.07Å; C696-S700 PolarHBondContact O-N 3.41Å; C696-S700 PolarHBondContact O-OG 2.92Å; V697-S700 PolarHBondContact O-N 2.92Å; S700-F704 VanDerWaalsContact O-CB 3.25Å; S700-F704 WeakPolarHBondContact O-CB 3.5Å; S700-F704 PolarHBondContact O-N 3.05Å
701	I	91.6	Very high	92.4	Very high	75 Å²	75	41.7 Å²	41.7	39%	0.385	20%	0.196	S	C	.	.	H	α-helix	trans	-63.1	-45.6	173.9	-66.6	165.6	0	0	0	110.5	T649 F657 V697 R698 E699 F704 C705	T649-I701 HydrophobicContact CG2-CD1 3.96Å; T649-I701 HydrophobicContact CG2-CG1 3.98Å; F657-I701 HydrophobicContact CE2-CG1 4.33Å; F657-I701 HydrophobicContact CZ-CG1 4.15Å; V697-I701 HydrophobicContact CG1-CD1 3.99Å; V697-I701 WeakPolarHBondContact O-CG1 3.5Å; V697-I701 PolarHBondContact O-N 3.29Å; R698-I701 PolarHBondContact O-N 3.48Å; E699-I701 VanDerWaalsContact C-N 3.33Å; E699-I701 PolarHBondContact O-N 2.93Å; I701-F704 PolarHBondContact O-N 2.92Å; I701-C705 PolarHBondContact O-N 2.67Å; I701-C705 PolarHBondContact O-SG 3.44Å; I701-C705 VanDerWaalsContact O-SG 3.35Å
702	N	92.3	Very high	92.3	Very high	72 Å²	72	42 Å²	42	39%	0.385	20%	0.198	S	C	.	.	H	α-helix	trans	-60	-50.1	178	-175.4	19.2	0	0	0	111.3	R698 E699 F704 C705 W706	R698-N702 PolarHBondContact O-N 3.3Å; R698-N702 VanDerWaalsContact O-N 3.09Å; E699-N702 WeakPolarHBondContact O-CB 3.2Å; E699-N702 PolarHBondContact O-N 3.41Å; E699-N702 VanDerWaalsContact O-N 3.14Å; N702-F704 VanDerWaalsContact C-N 3.31Å; N702-F704 PolarHBondContact O-N 3.04Å; N702-C705 PolarHBondContact O-N 2.93Å; N702-W706 PolarHBondContact O-N 2.96Å; N702-W706 PolarHBondContact OD1-NE1 3.27Å
703	L	93.8	Very high	92.2	Very high	7 Å²	7	40.5 Å²	40.5	4%	0.037	19%	0.187	C	C	.	.	H	α-helix	trans	-56.8	-45.3	176	-68.2	167.9	0	0	0	111.2	H607 C660 V663 A664 E699 C705 W706 T707	H607-L703 HydrophobicContact CB-CD2 3.81Å; H607-L703 PolarHBondContact CE1-O 2.9Å; H607-L703 VanDerWaalsContact CG-CD2 3.45Å; H607-L703 WeakPolarHBondContact ND1-CD2 3.29Å; C660-L703 HydrophobicContact CB-CB 4.06Å; C660-L703 WeakPolarHBondContact O-CD1 3.16Å; V663-L703 HydrophobicContact CB-CD1 4.01Å; V663-L703 HydrophobicContact CG1-CD1 3.82Å; V663-L703 HydrophobicContact CG1-CD2 4.24Å; A664-L703 HydrophobicContact CB-CD1 4.02Å; E699-L703 WeakPolarHBondContact O-CB 3.46Å; E699-L703 WeakPolarHBondContact O-CG 3.47Å; E699-L703 PolarHBondContact O-N 3.3Å; L703-C705 PolarHBondContact O-N 2.92Å; L703-W706 PolarHBondContact O-N 3.35Å; L703-W706 VanDerWaalsContact O-N 3.15Å; L703-T707 PolarHBondContact O-N 3.41Å; L703-T707 VanDerWaalsContact O-N 3.14Å; L703-T707 PolarHBondContact O-OG1 2.72Å
704	F	91.6	Very high	92	Very high	59 Å²	59	40.8 Å²	40.8	26%	0.259	19%	0.187	S	C	.	.	H	α-helix	trans	-59.8	-44.2	177	-175.1	-99.9	0	0	0	111.8	F657 C660 S700 I701 N702 W706 T707	F657-F704 HydrophobicContact CB-CD2 4.46Å; F657-F704 HydrophobicContact CD2-CB 3.93Å; F657-F704 HydrophobicContact CD2-CD1 4.48Å; F657-F704 AromaticContact CD2-CD2 3.71Å; F657-F704 HydrophobicContact CD2-CD2 3.71Å; F657-F704 HydrophobicContact CD2-CE2 4.33Å; F657-F704 AromaticContact CD2-CG 3.79Å; F657-F704 HydrophobicContact CD2-CG 3.79Å; F657-F704 HydrophobicContact CE2-CB 3.95Å; F657-F704 HydrophobicContact CE2-CG 4.21Å; C660-F704 HydrophobicContact CB-CB 4.45Å; S700-F704 VanDerWaalsContact O-CB 3.25Å; S700-F704 WeakPolarHBondContact O-CB 3.5Å; S700-F704 PolarHBondContact O-N 3.05Å; I701-F704 PolarHBondContact O-N 2.92Å; N702-F704 VanDerWaalsContact C-N 3.31Å; N702-F704 PolarHBondContact O-N 3.04Å; F704-W706 PolarHBondContact O-N 2.91Å; F704-T707 PolarHBondContact O-N 3.44Å; F704-T707 VanDerWaalsContact O-N 3.15Å
705	C	88.4	Confident	91.7	Very high	53 Å²	53	41.9 Å²	41.9	36%	0.358	19%	0.192	S	C	.	.	H	α-helix	trans	-65.5	-18.5	177.4	-72	0	0	0	0	114.9	I701 N702 L703	I701-C705 PolarHBondContact O-N 2.67Å; I701-C705 PolarHBondContact O-SG 3.44Å; I701-C705 VanDerWaalsContact O-SG 3.35Å; N702-C705 PolarHBondContact O-N 2.93Å; L703-C705 PolarHBondContact O-N 2.92Å
706	W	88.8	Confident	91.3	Very high	63 Å²	63	40.5 Å²	40.5	24%	0.239	19%	0.187	C	C	.	.	H	α-helix	trans	-100.2	-4.2	176	-76.6	107.2	0	0	0	113.8	N702 L703 F704 P708 K791 V842 R867	N702-W706 PolarHBondContact O-N 2.96Å; N702-W706 PolarHBondContact OD1-NE1 3.27Å; L703-W706 PolarHBondContact O-N 3.35Å; L703-W706 VanDerWaalsContact O-N 3.15Å; F704-W706 PolarHBondContact O-N 2.91Å; W706-P708 WeakPolarHBondContact O-CD 3.17Å; W706-K791 HydrophobicContact CH2-CD 4.23Å; W706-K791 HydrophobicContact CH2-CG 4.06Å; W706-K791 HydrophobicContact CZ3-CB 3.97Å; W706-K791 HydrophobicContact CZ3-CD 4.06Å; W706-K791 HydrophobicContact CZ3-CG 3.95Å; W706-V842 HydrophobicContact CE3-CG2 4.36Å; W706-R867 VanDerWaalsContact CD1-NH2 3.33Å; W706-R867 VanDerWaalsContact CD2-CZ 3.45Å; W706-R867 VanDerWaalsContact CG-NH2 3.29Å
707	T	90.6	Very high	90.8	Very high	10 Å²	10	41.7 Å²	41.7	6%	0.061	20%	0.197	C	C	.	.	S	Bend	trans	-97	116.8	-177.6	-57.2	0	0	0	0	109.8	M603 H607 L703 F704 A711 T712	M603-T707 HydrophobicContact CE-CG2 3.45Å; M603-T707 VanDerWaalsContact CE-CG2 3.45Å; M603-T707 WeakPolarHBondContact CE-OG1 3.13Å; M603-T707 HydrophobicContact SD-CG2 3.95Å; H607-T707 PolarHBondContact CE1-OG1 3.29Å; H607-T707 VanDerWaalsContact CE1-OG1 3.27Å; H607-T707 PolarHBondContact NE2-OG1 2.87Å; L703-T707 PolarHBondContact O-N 3.41Å; L703-T707 VanDerWaalsContact O-N 3.14Å; L703-T707 PolarHBondContact O-OG1 2.72Å; F704-T707 PolarHBondContact O-N 3.44Å; F704-T707 VanDerWaalsContact O-N 3.15Å; T707-A711 HydrophobicContact CG2-CB 4.25Å; T707-T712 HydrophobicContact CG2-CG2 3.74Å
708	P	89.8	Confident	90.3	Very high	3 Å²	3	44.9 Å²	44.9	2%	0.019	21%	0.211	C	C	.	.			trans	-58.4	141.4	170.3	-22.4	33.8	0	0	0	111.1	W706 S710 A711 I765 L773 V842	W706-P708 WeakPolarHBondContact O-CD 3.17Å; P708-S710 VanDerWaalsContact C-N 3.35Å; P708-S710 PolarHBondContact O-N 3.16Å; P708-A711 HydrophobicContact CB-CB 4.25Å; P708-A711 WeakPolarHBondContact O-CB 3.32Å; P708-A711 PolarHBondContact O-N 3.45Å; P708-I765 HydrophobicContact CB-CD1 3.68Å; P708-I765 HydrophobicContact CB-CG1 3.98Å; P708-I765 HydrophobicContact CG-CD1 3.92Å; P708-L773 HydrophobicContact CB-CD1 4.03Å; P708-L773 HydrophobicContact CG-CD1 4.14Å; P708-V842 HydrophobicContact CG-CG1 4.12Å
709	K	85.1	Confident	89.1	Confident	56 Å²	56	42.6 Å²	42.6	24%	0.243	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-57.3	-48.1	-172.8	-66.9	178.5	178.8	178.6	0	111.8	A711 T712 D769	K709-A711 VanDerWaalsContact C-N 3.25Å; K709-A711 PolarHBondContact O-N 2.87Å; K709-T712 PolarHBondContact O-N 3.23Å; K709-T712 PolarHBondContact O-OG1 3.01Å; K709-D769 PolarHBondContact N-OD2 3.14Å; K709-D769 VanDerWaalsContact N-OD2 3.14Å
710	S	89.9	Confident	87.4	Confident	13 Å²	13	45 Å²	45	9%	0.091	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-68.8	-16.2	180	57.3	0	0	0	0	114.6	P708 T712 Y713 R749 R764 I765 S766 D769	P708-S710 VanDerWaalsContact C-N 3.35Å; P708-S710 PolarHBondContact O-N 3.16Å; S710-T712 PolarHBondContact O-N 2.97Å; S710-Y713 VanDerWaalsContact O-CB 3.26Å; S710-Y713 WeakPolarHBondContact O-CB 3.43Å; S710-Y713 PolarHBondContact O-N 3.18Å; S710-R749 PolarHBondContact O-NH1 2.87Å; S710-R764 CarbonylContact C-O 3.6Å; S710-R764 VanDerWaalsContact O-O 3.1Å; S710-I765 WeakPolarHBondContact OG-CA 3.19Å; S710-I765 WeakPolarHBondContact OG-CG1 3.35Å; S710-S766 PolarHBondContact OG-N 3.33Å; S710-D769 WeakPolarHBondContact CB-OD2 3.37Å; S710-D769 PolarHBondContact N-OD2 2.88Å; S710-D769 PolarHBondContact OG-OD2 3.49Å
711	A	91	Very high	85.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-61.8	-29.9	173.2	0	0	0	0	0	111.7	T707 P708 K709 P763 R764	T707-A711 HydrophobicContact CG2-CB 4.25Å; P708-A711 HydrophobicContact CB-CB 4.25Å; P708-A711 WeakPolarHBondContact O-CB 3.32Å; P708-A711 PolarHBondContact O-N 3.45Å; K709-A711 VanDerWaalsContact C-N 3.25Å; K709-A711 PolarHBondContact O-N 2.87Å; A711-P763 HydrophobicContact CB-CB 3.94Å; A711-P763 HydrophobicContact CB-CG 4.12Å; A711-P763 WeakPolarHBondContact O-CB 3.44Å; A711-R764 VanDerWaalsContact CA-O 3.31Å; A711-R764 WeakPolarHBondContact CA-O 3.37Å; A711-R764 PolarHBondContact N-O 3.3Å
712	T	92.4	Very high	83	Confident	11 Å²	11	54.4 Å²	54.4	7%	0.067	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-99.6	14.3	180	60.4	0	0	0	0	114	M603 S656 F659 T707 K709 S710	M603-T712 HydrophobicContact CE-CG2 4.12Å; M603-T712 HydrophobicContact CG-CG2 4.29Å; M603-T712 HydrophobicContact SD-CG2 3.59Å; M603-T712 VanDerWaalsContact SD-CG2 3.59Å; S656-T712 WeakPolarHBondContact CB-OG1 3.39Å; F659-T712 HydrophobicContact CD2-CG2 4.23Å; T707-T712 HydrophobicContact CG2-CG2 3.74Å; K709-T712 PolarHBondContact O-N 3.23Å; K709-T712 PolarHBondContact O-OG1 3.01Å; S710-T712 PolarHBondContact O-N 2.97Å
713	Y	91.2	Very high	80.4	Confident	52 Å²	52	54.5 Å²	54.5	20%	0.204	30%	0.301	C	S	.	.			trans	-59.6	139.8	179.4	171.5	-83.1	0	0	0	111.6	S710 R749	S710-Y713 VanDerWaalsContact O-CB 3.26Å; S710-Y713 WeakPolarHBondContact O-CB 3.43Å; S710-Y713 PolarHBondContact O-N 3.18Å; Y713-R749 HydrophobicContact CD1-CG 4.22Å; Y713-R749 HydrophobicContact CG-CG 4.26Å
714	R	91.1	Very high	77.5	Confident	16 Å²	16	57.7 Å²	57.7	6%	0.06	34%	0.336	C	S	.	.			trans	-136.9	132.7	179.1	-72.7	178	-71.5	147.2	-8.2	109	E595 V599 S655 Y716 A717	E595-R714 HydrophobicContact CG-CG 4.46Å; E595-R714 WeakPolarHBondContact OE2-CB 3.37Å; V599-R714 HydrophobicContact CG2-CG 4.05Å; S655-R714 PolarHBondContact O-NH2 3.28Å; S655-R714 PolarHBondContact OG-NH2 3.39Å; R714-Y716 VanDerWaalsContact C-N 3.29Å; R714-A717 HydrophobicContact CB-CB 3.97Å; R714-A717 PolarHBondContact O-N 3.35Å
715	Q	87.6	Confident	74.6	Confident	90 Å²	90	64.8 Å²	64.8	42%	0.421	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-36.6	174.2	179	179.1	-21.9	0	0	111.2	E595 A717 P751	E595-Q715 WeakPolarHBondContact OE1-CB 3.39Å; E595-Q715 PolarHBondContact OE1-N 3.2Å; E595-Q715 PolarHBondContact OE2-N 3.32Å; Q715-A717 VanDerWaalsContact C-N 3.33Å; Q715-P751 HydrophobicContact CB-CB 4.31Å; Q715-P751 HydrophobicContact CG-CB 4.16Å
716	Y	86.1	Confident	71.8	Confident	77 Å²	77	65.5 Å²	65.5	30%	0.302	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	18.9	-178.5	-57.2	-74	0	0	0	113.5	Y582 H591 V592 E595 R714	Y582-Y716 WeakPolarHBondContact CD1-O 3.24Å; H591-Y716 HydrophobicContact CB-CE2 3.99Å; V592-Y716 HydrophobicContact CG2-CD1 4.27Å; V592-Y716 HydrophobicContact CG2-CG 4.06Å; E595-Y716 HydrophobicContact CB-CD2 4.17Å; E595-Y716 VanDerWaalsContact OE2-CD2 3.26Å; E595-Y716 WeakPolarHBondContact OE2-CD2 3.5Å; E595-Y716 PolarHBondContact OE2-N 2.97Å; R714-Y716 VanDerWaalsContact C-N 3.29Å
717	A	85.1	Confident	69	Low	24 Å²	24	70.7 Å²	70.7	20%	0.198	42%	0.417	C	S	.	.	S	Bend	trans	-76.5	161.2	167.7	0	0	0	0	0	111.2	R714 Q715	R714-A717 HydrophobicContact CB-CB 3.97Å; R714-A717 PolarHBondContact O-N 3.35Å; Q715-A717 VanDerWaalsContact C-N 3.33Å
718	Q	83.6	Confident	66.2	Low	81 Å²	81	80.6 Å²	80.6	38%	0.379	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-55.8	127.6	177.7	-171.4	175	19.5	0	0	110.6	P578 Y582	P578-Q718 VanDerWaalsContact C-OE1 3.31Å; P578-Q718 PolarHBondContact O-OE1 2.94Å; Y582-Q718 HydrophobicContact CD1-CB 4.35Å; Y582-Q718 HydrophobicContact CD2-CB 3.85Å; Y582-Q718 HydrophobicContact CD2-CG 3.9Å; Y582-Q718 HydrophobicContact CE2-CB 4.4Å; Y582-Q718 HydrophobicContact CE2-CG 4.09Å; Y582-Q718 HydrophobicContact CG-CB 3.83Å; Y582-Q718 HydrophobicContact CG-CG 4.4Å
719	P	69.9	Low	63.5	Low	83 Å²	83	83.9 Å²	83.9	54%	0.539	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-66.4	149.6	176.3	9.5	-7.9	0	0	0	111.4	K721	P719-K721 PolarHBondContact O-N 3.13Å
720	M	60.4	Low	61	Low	99 Å²	99	91 Å²	91	49%	0.488	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-54.5	131.4	175.9	-71.2	157.9	160.2	0	0	110.6	Q740 M742	M720-Q740 WeakPolarHBondContact CE-O 3.22Å; M720-M742 WeakPolarHBondContact CE-O 3.49Å
721	K	55.7	Low	58.1	Low	167 Å²	167	97.1 Å²	97.1	73%	0.726	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-75.6	124.4	167.8	-75.8	-176.8	178	178.6	0	107.6	P719 G723	P719-K721 PolarHBondContact O-N 3.13Å; K721-G723 PolarHBondContact O-N 3.05Å
722	A	38.9	Very low	55.2	Low	107 Å²	107	99.5 Å²	99.5	88%	0.884	58%	0.581	S	S	*	*			trans	-62.8	102.7	169.2	0	0	0	0	0	108.5
723	G	38.5	Very low	52.4	Low	73 Å²	73	103.6 Å²	103.6	75%	0.753	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-61.9	135.4	173.8	0	0	0	0	0	110.4	K721	K721-G723 PolarHBondContact O-N 3.05Å
724	G	31.2	Very low	49.6	Very low	74 Å²	74	105.4 Å²	105.4	76%	0.763	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-59.3	148	172.2	0	0	0	0	0	111.7	G726	G724-G726 PolarHBondContact O-N 3.08Å; G724-G726 VanDerWaalsContact O-N 3.16Å
725	E	31	Very low	46.9	Very low	209 Å²	209	110 Å²	110	98%	0.977	63%	0.634	S	S	*	*	S	Bend	trans	-49.4	116.1	179.1	-64.6	-174.1	152.8	0	0	111.9
726	G	30.3	Very low	44.5	Very low	67 Å²	67	107.7 Å²	107.7	69%	0.691	63%	0.628	S	S	*	*			trans	-177	99.3	177.5	0	0	0	0	0	115	G724	G724-G726 PolarHBondContact O-N 3.08Å; G724-G726 VanDerWaalsContact O-N 3.16Å
727	I	30.1	Very low	42.2	Very low	173 Å²	173	107.4 Å²	107.4	89%	0.887	64%	0.637	S	S	*	*			trans	79.3	89.5	160.2	-45.8	177.2	0	0	0	116.5
728	F	30.6	Very low	40	Very low	218 Å²	218	110.9 Å²	110.9	96%	0.956	65%	0.652	S	S	*	*			trans	-63	132.8	158.4	-89.9	-98.1	0	0	0	111.3
729	G	34.3	Very low	37.8	Very low	71 Å²	71	110.6 Å²	110.6	73%	0.732	65%	0.648	S	S	*	*			trans	116.1	59.3	152.4	0	0	0	0	0	117.6
730	K	31.4	Very low	36.3	Very low	205 Å²	205	110.6 Å²	110.6	89%	0.891	64%	0.641	S	S	*	*			trans	-144.4	136.5	149.4	-73.1	-168.4	179.3	174.5	0	110.3	A732	K730-A732 PolarHBondContact O-N 3.42Å
731	T	30	Very low	35.7	Very low	143 Å²	143	110.2 Å²	110.2	88%	0.877	64%	0.641	S	S	*	*			trans	-60.3	103.6	172.6	24.5	0	0	0	0	109.6
732	A	30.4	Very low	35.2	Very low	50 Å²	50	108 Å²	108	41%	0.413	63%	0.634	S	S	.	*			trans	-71.4	134.7	178	0	0	0	0	0	109.7	K730 Y739	K730-A732 PolarHBondContact O-N 3.42Å; A732-Y739 HydrophobicContact CB-CD2 3.3Å; A732-Y739 HydrophobicContact CB-CE2 3.58Å; A732-Y739 HydrophobicContact CB-CG 4.49Å; A732-Y739 WeakPolarHBondContact O-CE2 3.32Å
733	T	32.8	Very low	35.6	Very low	97 Å²	97	107.3 Å²	107.3	60%	0.595	62%	0.621	S	S	*	*			trans	-82.3	153.4	-179.7	48.6	0	0	0	0	110.8	F735 S736	T733-F735 PolarHBondContact O-N 2.85Å; T733-S736 PolarHBondContact O-N 3.33Å
734	Y	32.9	Very low	36.7	Very low	90 Å²	90	111 Å²	111	35%	0.353	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-49.4	-20	-179.3	-152.4	-98.3	0	0	0	115	L773	Y734-L773 HydrophobicContact CE2-CD2 4.27Å
735	F	34.6	Very low	38.6	Very low	113 Å²	113	110.6 Å²	110.6	50%	0.496	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.9	5.3	-176.9	-58	-76.9	0	0	0	115.4	W463 T733	W463-F735 WeakPolarHBondContact CH2-O 3.5Å; T733-F735 PolarHBondContact O-N 2.85Å
736	S	37.2	Very low	40.6	Very low	40 Å²	40	108.1 Å²	108.1	28%	0.28	59%	0.593	S	S	.	*			trans	-79.7	138.3	175.9	-170.7	0	0	0	0	111.4	T733 D738 Y739	T733-S736 PolarHBondContact O-N 3.33Å; S736-D738 PolarHBondContact O-N 3.48Å; S736-D738 PolarHBondContact OG-N 3.43Å; S736-Y739 PolarHBondContact O-N 3.45Å
737	S	37.5	Very low	42.8	Very low	72 Å²	72	106.3 Å²	106.3	50%	0.503	57%	0.567	S	S	.	*	G	3₁₀ helix	trans	-55.7	-32.5	170.3	50.8	0	0	0	0	112	Y739	S737-Y739 VanDerWaalsContact C-N 3.31Å; S737-Y739 PolarHBondContact O-N 2.96Å
738	D	38.6	Very low	45.4	Very low	96 Å²	96	99.3 Å²	99.3	51%	0.513	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-85.4	-4	-170.2	-48.8	-18.6	0	0	0	112.3	S736 Q740 D741	S736-D738 PolarHBondContact O-N 3.48Å; S736-D738 PolarHBondContact OG-N 3.43Å; D738-Q740 PolarHBondContact O-N 3.05Å; D738-D741 PolarHBondContact O-N 3Å
739	Y	36.7	Very low	47.8	Very low	76 Å²	76	89.6 Å²	89.6	30%	0.298	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-75.1	-12.3	175.4	-145	-83.2	0	0	0	112.5	A732 S736 S737	A732-Y739 HydrophobicContact CB-CD2 3.3Å; A732-Y739 HydrophobicContact CB-CE2 3.58Å; A732-Y739 HydrophobicContact CB-CG 4.49Å; A732-Y739 WeakPolarHBondContact O-CE2 3.32Å; S736-Y739 PolarHBondContact O-N 3.45Å; S737-Y739 VanDerWaalsContact C-N 3.31Å; S737-Y739 PolarHBondContact O-N 2.96Å
740	Q	40.4	Very low	50.1	Low	83 Å²	83	91.7 Å²	91.7	39%	0.388	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-82	-2.9	176.4	-65.3	-164.4	-32.6	0	0	113	S654 M720 D738	S654-Q740 PolarHBondContact OG-NE2 3.35Å; M720-Q740 WeakPolarHBondContact CE-O 3.22Å; D738-Q740 PolarHBondContact O-N 3.05Å
741	D	46.5	Very low	52.6	Low	90 Å²	90	85.2 Å²	85.2	48%	0.481	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-104.1	19.5	-174.1	-63.2	-42	0	0	0	113.7	D738	D738-D741 PolarHBondContact O-N 3Å
742	M	45.2	Very low	55.3	Low	120 Å²	120	79.7 Å²	79.7	59%	0.591	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-75.5	137.6	175.2	-75.8	-66.4	-68	0	0	111.5	M720	M720-M742 WeakPolarHBondContact CE-O 3.49Å
743	P	48.4	Very low	58.1	Low	94 Å²	94	79.8 Å²	79.8	61%	0.61	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-61.4	141.1	-177.5	23.4	-32.3	0	0	0	111.9	T745	P743-T745 WeakPolarHBondContact O-CG2 3.48Å; P743-T745 PolarHBondContact O-N 2.85Å; P743-T745 VanDerWaalsContact O-N 3.14Å
744	K	60.3	Low	60.8	Low	151 Å²	151	77 Å²	77	66%	0.657	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-55.6	117.8	174.2	-72.4	-175.6	176.8	-176.7	0	110
745	T	70.8	Confident	63.6	Low	65 Å²	65	76.9 Å²	76.9	40%	0.399	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-100.4	171.6	170.8	86.9	0	0	0	0	110.8	P743 L747 S748 E768	P743-T745 WeakPolarHBondContact O-CG2 3.48Å; P743-T745 PolarHBondContact O-N 2.85Å; P743-T745 VanDerWaalsContact O-N 3.14Å; T745-L747 PolarHBondContact O-N 3.13Å; T745-L747 WeakPolarHBondContact OG1-CB 3.3Å; T745-L747 PolarHBondContact OG1-N 3.26Å; T745-S748 VanDerWaalsContact O-CB 3.28Å; T745-S748 WeakPolarHBondContact O-CB 3.45Å; T745-S748 PolarHBondContact O-N 3.05Å; T745-S748 PolarHBondContact O-OG 3.14Å; T745-E768 WeakPolarHBondContact CB-OE1 3.33Å; T745-E768 WeakPolarHBondContact CG2-OE1 3.47Å; T745-E768 PolarHBondContact OG1-OE1 2.75Å
746	D	72.9	Confident	66.3	Low	156 Å²	156	75.5 Å²	75.5	83%	0.834	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-14.7	172.5	-65.1	-27	0	0	0	113.4
747	L	78.4	Confident	68.9	Low	30 Å²	30	73.8 Å²	73.8	16%	0.157	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-6.9	177.9	-57.9	177.3	0	0	0	113	T745 A767 E768 I771 K877 T881	T745-L747 PolarHBondContact O-N 3.13Å; T745-L747 WeakPolarHBondContact OG1-CB 3.3Å; T745-L747 PolarHBondContact OG1-N 3.26Å; L747-A767 HydrophobicContact CB-CB 4.02Å; L747-A767 HydrophobicContact CD2-CB 4.01Å; L747-A767 PolarHBondContact O-N 3.41Å; L747-A767 VanDerWaalsContact O-N 3.09Å; L747-E768 HydrophobicContact CB-CG 3.41Å; L747-E768 VanDerWaalsContact CB-CG 3.41Å; L747-E768 HydrophobicContact CD1-CG 4.46Å; L747-E768 PolarHBondContact O-N 3.49Å; L747-I771 HydrophobicContact CD1-CD1 4.07Å; L747-K877 WeakPolarHBondContact CD2-O 3.36Å; L747-T881 HydrophobicContact CD1-CG2 3.75Å; L747-T881 HydrophobicContact CD2-CG2 3.57Å; L747-T881 HydrophobicContact CG-CG2 4.27Å
748	S	83.1	Confident	71.5	Confident	25 Å²	25	75.1 Å²	75.1	18%	0.175	40%	0.401	C	S	.	.	S	Bend	trans	-71.9	162.3	177.8	70.3	0	0	0	0	112.3	T745 K877	T745-S748 VanDerWaalsContact O-CB 3.28Å; T745-S748 WeakPolarHBondContact O-CB 3.45Å; T745-S748 PolarHBondContact O-N 3.05Å; T745-S748 PolarHBondContact O-OG 3.14Å; S748-K877 PolarHBondContact O-NZ 3.12Å
749	R	81.9	Confident	74.1	Confident	14 Å²	14	74.4 Å²	74.4	5%	0.053	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-75.5	136.8	179.7	177.7	172.9	166.3	-169.8	-4.2	110.7	S710 Y713 D872	S710-R749 PolarHBondContact O-NH1 2.87Å; Y713-R749 HydrophobicContact CD1-CG 4.22Å; Y713-R749 HydrophobicContact CG-CG 4.26Å; R749-D872 HydrophobicContact CG-CB 4.4Å
750	E	81.4	Confident	76.8	Confident	115 Å²	115	71.8 Å²	71.8	54%	0.537	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-86.8	149.8	174.1	-77.2	163.1	-132.7	0	0	112.4	D872 K877	E750-D872 PolarHBondContact N-OD2 3Å; E750-K877 WeakPolarHBondContact OE1-CE 3.4Å; E750-K877 IonicContact OE1-NZ 2.81Å; E750-K877 PolarHBondContact OE1-NZ 3.31Å
751	P	84.5	Confident	79.3	Confident	69 Å²	69	70.4 Å²	70.4	45%	0.448	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-60.8	143	170.8	-14	25.6	0	0	0	111.9	Q715	Q715-P751 HydrophobicContact CB-CB 4.31Å; Q715-P751 HydrophobicContact CG-CB 4.16Å
752	L	86.5	Confident	81.6	Confident	27 Å²	27	66.2 Å²	66.2	14%	0.141	37%	0.373	C	S	.	.			trans	-109.7	144.5	174	-72.2	166.3	0	0	0	110.4	L757	L752-L757 HydrophobicContact CB-CB 4.47Å; L752-L757 HydrophobicContact CD1-CD1 4.24Å
753	A	89.9	Confident	84	Confident	53 Å²	53	60.5 Å²	60.5	44%	0.438	35%	0.345	S	S	.	.			trans	-60.9	141.3	167.2	0	0	0	0	0	109.4	C755 D756 L757	A753-C755 PolarHBondContact O-N 3.04Å; A753-C755 VanDerWaalsContact O-N 3.14Å; A753-D756 PolarHBondContact O-N 3.1Å; A753-L757 PolarHBondContact O-N 3.49Å
754	L	89.6	Confident	86.1	Confident	38 Å²	38	57 Å²	57	20%	0.199	32%	0.32	C	S	.	.	H	α-helix	trans	-57.8	-32.6	-175.6	-176.2	62.3	0	0	0	113	Q594 E595 L757 K758	Q594-L754 HydrophobicContact CB-CD1 4.38Å; Q594-L754 HydrophobicContact CB-CD2 3.9Å; E595-L754 HydrophobicContact CB-CD1 4.27Å; L754-L757 HydrophobicContact CD1-CD2 4.47Å; L754-L757 PolarHBondContact O-N 3.14Å; L754-K758 HydrophobicContact CD1-CG 4.42Å; L754-K758 HydrophobicContact CG-CD 4.32Å; L754-K758 WeakPolarHBondContact O-CB 3.35Å; L754-K758 WeakPolarHBondContact O-CG 3.38Å; L754-K758 PolarHBondContact O-N 3.07Å
755	C	91.7	Very high	87.6	Confident	88 Å²	88	49.9 Å²	49.9	60%	0.595	29%	0.289	S	S	*	.	H	α-helix	trans	-65	-39.8	175.6	58.4	0	0	0	0	112.5	A753 A759	A753-C755 PolarHBondContact O-N 3.04Å; A753-C755 VanDerWaalsContact O-N 3.14Å; C755-A759 PolarHBondContact O-N 2.9Å; C755-A759 VanDerWaalsContact O-N 3.17Å
756	D	90.5	Very high	88.6	Confident	84 Å²	84	47 Å²	47	45%	0.449	27%	0.271	S	S	.	.	H	α-helix	trans	-72.6	-39.8	177.8	-62.4	-33.3	0	0	0	110.6	A753 K758 A759 E760	A753-D756 PolarHBondContact O-N 3.1Å; D756-K758 VanDerWaalsContact C-N 3.34Å; D756-K758 PolarHBondContact O-N 3.31Å; D756-A759 PolarHBondContact O-N 3.02Å; D756-E760 PolarHBondContact O-N 3.26Å
757	L	92.1	Very high	89.3	Confident	3 Å²	3	39.5 Å²	39.5	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-43.9	175.5	-172.5	71.4	0	0	0	111.4	E595 T598 V599 Q602 L752 A753 L754 A759 E760	E595-L757 HydrophobicContact CG-CD2 3.93Å; T598-L757 HydrophobicContact CG2-CB 4.44Å; T598-L757 HydrophobicContact CG2-CD2 3.98Å; T598-L757 HydrophobicContact CG2-CG 3.75Å; V599-L757 HydrophobicContact CG2-CD2 4.24Å; Q602-L757 PolarHBondContact NE2-O 3.14Å; Q602-L757 VanDerWaalsContact NE2-O 3.1Å; L752-L757 HydrophobicContact CB-CB 4.47Å; L752-L757 HydrophobicContact CD1-CD1 4.24Å; A753-L757 PolarHBondContact O-N 3.49Å; L754-L757 HydrophobicContact CD1-CD2 4.47Å; L754-L757 PolarHBondContact O-N 3.14Å; L757-A759 VanDerWaalsContact C-N 3.27Å; L757-A759 PolarHBondContact O-N 3.35Å; L757-E760 PolarHBondContact O-N 3.05Å
758	K	92.4	Very high	89.7	Confident	101 Å²	101	40.7 Å²	40.7	44%	0.439	24%	0.236	S	C	.	.	H	α-helix	trans	-67.1	-25.9	176.9	-76.5	-179.7	177.5	-176.2	0	113.5	T598 L754 D756 E760	T598-K758 HydrophobicContact CG2-CB 4.44Å; T598-K758 HydrophobicContact CG2-CG 3.84Å; T598-K758 WeakPolarHBondContact OG1-CG 3.46Å; L754-K758 HydrophobicContact CD1-CG 4.42Å; L754-K758 HydrophobicContact CG-CD 4.32Å; L754-K758 WeakPolarHBondContact O-CB 3.35Å; L754-K758 WeakPolarHBondContact O-CG 3.38Å; L754-K758 PolarHBondContact O-N 3.07Å; D756-K758 VanDerWaalsContact C-N 3.34Å; D756-K758 PolarHBondContact O-N 3.31Å; K758-E760 VanDerWaalsContact C-N 3.3Å
759	A	92.1	Very high	89.8	Confident	80 Å²	80	40.2 Å²	40.2	66%	0.661	23%	0.231	S	C	*	.	H	α-helix	trans	-77	-18	176.9	0	0	0	0	0	112.8	C755 D756 L757	C755-A759 PolarHBondContact O-N 2.9Å; C755-A759 VanDerWaalsContact O-N 3.17Å; D756-A759 PolarHBondContact O-N 3.02Å; L757-A759 VanDerWaalsContact C-N 3.27Å; L757-A759 PolarHBondContact O-N 3.35Å
760	E	93.4	Very high	90	Very high	21 Å²	21	39.6 Å²	39.6	10%	0.098	23%	0.229	C	C	.	.			trans	-96.1	124.3	-179.1	-70	-178.3	-177.9	0	0	111.6	Q602 D756 L757 K758 R764 A854	Q602-E760 PolarHBondContact NE2-O 3.2Å; D756-E760 PolarHBondContact O-N 3.26Å; L757-E760 PolarHBondContact O-N 3.05Å; K758-E760 VanDerWaalsContact C-N 3.3Å; E760-R764 IonicContact OE1-CZ 3.84Å; E760-R764 IonicContact OE1-NE 3.7Å; E760-R764 PolarHBondContact OE1-NE 3.31Å; E760-R764 IonicContact OE1-NH2 2.72Å; E760-R764 PolarHBondContact OE1-NH2 2.89Å; E760-R764 IonicContact OE2-CZ 3.8Å; E760-R764 IonicContact OE2-NE 2.9Å; E760-R764 PolarHBondContact OE2-NE 3.1Å; E760-R764 IonicContact OE2-NH2 3.82Å; E760-A854 HydrophobicContact CG-CB 4.14Å
761	V	93.5	Very high	90.1	Very high	54 Å²	54	34.3 Å²	34.3	33%	0.327	21%	0.205	S	C	.	.	S	Bend	trans	-78.7	-32.2	176.2	178.9	0	0	0	0	111.9	A605 A858 V861	A605-V761 HydrophobicContact CB-CG1 3.87Å; A605-V761 WeakPolarHBondContact CB-O 3.37Å; V761-A858 HydrophobicContact CG2-CB 4.41Å; V761-V861 HydrophobicContact CG1-CB 4.15Å; V761-V861 HydrophobicContact CG1-CG1 3.74Å; V761-V861 HydrophobicContact CG1-CG2 4.27Å
762	S	95	Very high	89.8	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.014	20%	0.204	C	C	.	.	S	Bend	trans	-104.7	142.7	-176.4	-62.9	0	0	0	0	111.4	V861 V868	S762-V861 WeakPolarHBondContact OG-CG2 3.4Å; S762-V868 WeakPolarHBondContact CB-O 3.39Å
763	P	95.1	Very high	89.5	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.006	21%	0.211	C	C	.	.			trans	-69.8	161.7	176.8	29.7	-34.6	0	0	0	112.1	Q602 F606 A711 C869 I870	Q602-P763 HydrophobicContact CB-CB 4.46Å; F606-P763 HydrophobicContact CB-CG 4.16Å; F606-P763 HydrophobicContact CD2-CG 3.7Å; F606-P763 HydrophobicContact CE2-CG 4.5Å; F606-P763 HydrophobicContact CG-CG 4.16Å; A711-P763 HydrophobicContact CB-CB 3.94Å; A711-P763 HydrophobicContact CB-CG 4.12Å; A711-P763 WeakPolarHBondContact O-CB 3.44Å; P763-C869 CarbonylContact O-C 3.51Å; P763-C869 VanDerWaalsContact O-CA 3.26Å; P763-C869 WeakPolarHBondContact O-CA 3.43Å; P763-I870 PolarHBondContact O-N 3.48Å
764	R	93.3	Very high	88.8	Confident	21 Å²	21	35.4 Å²	35.4	8%	0.079	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	146	173.1	-59.5	-161.6	-174.3	175.3	6.3	112.3	S710 A711 E760 V850 I870 D872	S710-R764 CarbonylContact C-O 3.6Å; S710-R764 VanDerWaalsContact O-O 3.1Å; A711-R764 VanDerWaalsContact CA-O 3.31Å; A711-R764 WeakPolarHBondContact CA-O 3.37Å; A711-R764 PolarHBondContact N-O 3.3Å; E760-R764 IonicContact OE1-CZ 3.84Å; E760-R764 IonicContact OE1-NE 3.7Å; E760-R764 PolarHBondContact OE1-NE 3.31Å; E760-R764 IonicContact OE1-NH2 2.72Å; E760-R764 PolarHBondContact OE1-NH2 2.89Å; E760-R764 IonicContact OE2-CZ 3.8Å; E760-R764 IonicContact OE2-NE 2.9Å; E760-R764 PolarHBondContact OE2-NE 3.1Å; E760-R764 IonicContact OE2-NH2 3.82Å; R764-V850 VanDerWaalsContact NH2-CG1 3.33Å; R764-I870 CarbonylContact C-O 3.43Å; R764-I870 VanDerWaalsContact CA-O 3.23Å; R764-I870 WeakPolarHBondContact CA-O 3.46Å; R764-I870 HydrophobicContact CG-CB 4.32Å; R764-D872 HydrophobicContact CB-CB 4.4Å; R764-D872 WeakPolarHBondContact CD-OD1 3.16Å; R764-D872 IonicContact CZ-OD1 2.99Å; R764-D872 IonicContact NH1-OD1 3.85Å; R764-D872 PolarHBondContact NH1-OD1 3.06Å
765	I	91.7	Very high	87.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	141	173.4	-166.1	175.6	0	0	0	110.3	P708 S710 D769 L773 I792 V844 C869 I870 D872	P708-I765 HydrophobicContact CB-CD1 3.68Å; P708-I765 HydrophobicContact CB-CG1 3.98Å; P708-I765 HydrophobicContact CG-CD1 3.92Å; S710-I765 WeakPolarHBondContact OG-CA 3.19Å; S710-I765 WeakPolarHBondContact OG-CG1 3.35Å; I765-D769 HydrophobicContact CD1-CB 3.92Å; I765-D769 HydrophobicContact CG1-CB 3.59Å; I765-L773 HydrophobicContact CD1-CD1 4Å; I765-I792 HydrophobicContact CD1-CD1 4.23Å; I765-V844 HydrophobicContact CD1-CG2 4.3Å; I765-V844 HydrophobicContact CG2-CB 4.48Å; I765-V844 HydrophobicContact CG2-CG1 3.59Å; I765-V844 HydrophobicContact CG2-CG2 4.04Å; I765-C869 HydrophobicContact CB-CB 4.32Å; I765-C869 HydrophobicContact CG2-CB 4.23Å; I765-I870 PolarHBondContact N-O 3.39Å; I765-D872 WeakPolarHBondContact O-CB 3.4Å; I765-D872 PolarHBondContact O-N 3.24Å
766	S	90.9	Very high	86.4	Confident	4 Å²	4	39.3 Å²	39.3	3%	0.028	21%	0.211	C	C	.	.			trans	-71.4	160.7	174.2	67.2	0	0	0	0	111.4	S710 E768 D769 L770	S710-S766 PolarHBondContact OG-N 3.33Å; S766-E768 VanDerWaalsContact C-N 3.29Å; S766-D769 WeakPolarHBondContact OG-CB 3.03Å; S766-D769 PolarHBondContact OG-N 2.49Å; S766-D769 VanDerWaalsContact OG-N 3.11Å; S766-L770 PolarHBondContact O-N 3.09Å; S766-L770 VanDerWaalsContact O-N 3.14Å
767	A	87.8	Confident	84.6	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.1	-34.1	174.1	0	0	0	0	0	111.3	L747 L770 I771 L871 K877 L878	L747-A767 HydrophobicContact CB-CB 4.02Å; L747-A767 HydrophobicContact CD2-CB 4.01Å; L747-A767 PolarHBondContact O-N 3.41Å; L747-A767 VanDerWaalsContact O-N 3.09Å; A767-L770 PolarHBondContact O-N 2.8Å; A767-I771 WeakPolarHBondContact O-CB 3.22Å; A767-I771 WeakPolarHBondContact O-CD1 3.26Å; A767-I771 WeakPolarHBondContact O-CG1 3.33Å; A767-I771 PolarHBondContact O-N 2.81Å; A767-L871 HydrophobicContact CB-CD1 4.4Å; A767-K877 HydrophobicContact CB-CB 4.29Å; A767-L878 HydrophobicContact CB-CD2 3.8Å; A767-L878 HydrophobicContact CB-CG 4.41Å
768	E	86.6	Confident	82.5	Confident	55 Å²	55	44.7 Å²	44.7	26%	0.257	25%	0.245	S	C	.	.	H	α-helix	trans	-59.1	-53.1	173.8	-61.2	170	166.2	0	0	111.7	T745 L747 S766 L770 I771 D772	T745-E768 WeakPolarHBondContact CB-OE1 3.33Å; T745-E768 WeakPolarHBondContact CG2-OE1 3.47Å; T745-E768 PolarHBondContact OG1-OE1 2.75Å; L747-E768 HydrophobicContact CB-CG 3.41Å; L747-E768 VanDerWaalsContact CB-CG 3.41Å; L747-E768 HydrophobicContact CD1-CG 4.46Å; L747-E768 PolarHBondContact O-N 3.49Å; S766-E768 VanDerWaalsContact C-N 3.29Å; E768-L770 VanDerWaalsContact C-N 3.26Å; E768-L770 PolarHBondContact O-N 2.94Å; E768-I771 PolarHBondContact O-N 2.85Å; E768-I771 VanDerWaalsContact O-N 3.11Å; E768-D772 WeakPolarHBondContact O-CB 3.4Å; E768-D772 PolarHBondContact O-N 2.87Å
769	D	85.4	Confident	80	Confident	14 Å²	14	43.8 Å²	43.8	8%	0.075	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-38	179.9	-89	1.5	0	0	0	111	K709 S710 I765 S766 L773	K709-D769 PolarHBondContact N-OD2 3.14Å; K709-D769 VanDerWaalsContact N-OD2 3.14Å; S710-D769 WeakPolarHBondContact CB-OD2 3.37Å; S710-D769 PolarHBondContact N-OD2 2.88Å; S710-D769 PolarHBondContact OG-OD2 3.49Å; I765-D769 HydrophobicContact CD1-CB 3.92Å; I765-D769 HydrophobicContact CG1-CB 3.59Å; S766-D769 WeakPolarHBondContact OG-CB 3.03Å; S766-D769 PolarHBondContact OG-N 2.49Å; S766-D769 VanDerWaalsContact OG-N 3.11Å; D769-L773 WeakPolarHBondContact O-CB 3.49Å; D769-L773 WeakPolarHBondContact O-CD1 3.5Å; D769-L773 WeakPolarHBondContact O-CG 3.34Å; D769-L773 PolarHBondContact O-N 2.85Å
770	L	86.9	Confident	77.3	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-41.5	176.3	-179.3	63.8	0	0	0	111.9	S766 A767 E768 C774 I792 V844 L871 L878	S766-L770 PolarHBondContact O-N 3.09Å; S766-L770 VanDerWaalsContact O-N 3.14Å; A767-L770 PolarHBondContact O-N 2.8Å; E768-L770 VanDerWaalsContact C-N 3.26Å; E768-L770 PolarHBondContact O-N 2.94Å; L770-C774 WeakPolarHBondContact O-CB 3.26Å; L770-C774 PolarHBondContact O-N 2.92Å; L770-C774 PolarHBondContact O-SG 3.18Å; L770-I792 HydrophobicContact CD1-CD1 3.87Å; L770-V844 HydrophobicContact CD1-CB 4.18Å; L770-V844 HydrophobicContact CD1-CG1 4.19Å; L770-V844 HydrophobicContact CD1-CG2 4.04Å; L770-V844 HydrophobicContact CD2-CG1 4.4Å; L770-L871 HydrophobicContact CB-CD1 4.48Å; L770-L871 HydrophobicContact CD2-CD1 3.84Å; L770-L871 HydrophobicContact CD2-CD2 4.05Å; L770-L871 HydrophobicContact CD2-CG 4.47Å; L770-L878 HydrophobicContact CD2-CD1 4.12Å
771	I	83.3	Confident	74.6	Confident	5 Å²	5	48 Å²	48	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-64.6	-49.6	177.8	-72	164.1	0	0	0	110.2	L747 A767 E768 C774 E775 L776 L878 T881 L883	L747-I771 HydrophobicContact CD1-CD1 4.07Å; A767-I771 WeakPolarHBondContact O-CB 3.22Å; A767-I771 WeakPolarHBondContact O-CD1 3.26Å; A767-I771 WeakPolarHBondContact O-CG1 3.33Å; A767-I771 PolarHBondContact O-N 2.81Å; E768-I771 PolarHBondContact O-N 2.85Å; E768-I771 VanDerWaalsContact O-N 3.11Å; I771-C774 PolarHBondContact O-N 2.98Å; I771-E775 PolarHBondContact O-N 3Å; I771-E775 VanDerWaalsContact O-N 3.14Å; I771-L776 HydrophobicContact CG2-CB 4.12Å; I771-L776 WeakPolarHBondContact CG2-O 3.43Å; I771-L776 PolarHBondContact O-N 3.47Å; I771-L878 HydrophobicContact CD1-CD2 3.88Å; I771-L878 HydrophobicContact CG1-CD2 4.06Å; I771-T881 HydrophobicContact CD1-CG2 4.25Å; I771-L883 HydrophobicContact CD1-CD1 3.69Å; I771-L883 HydrophobicContact CG1-CD1 3.78Å; I771-L883 HydrophobicContact CG2-CD1 4.02Å
772	D	79.1	Confident	71.7	Confident	80 Å²	80	51.9 Å²	51.9	43%	0.428	31%	0.313	S	S	.	.	H	α-helix	trans	-61.8	-46.3	-179.7	-77.5	-2.7	0	0	0	111.4	E768 C774 E775	E768-D772 WeakPolarHBondContact O-CB 3.4Å; E768-D772 PolarHBondContact O-N 2.87Å; D772-C774 PolarHBondContact O-N 2.9Å; D772-E775 PolarHBondContact O-N 2.81Å
773	L	79.9	Confident	68.9	Low	56 Å²	56	61.7 Å²	61.7	29%	0.293	36%	0.355	S	S	.	.	H	α-helix	trans	-72.5	-26.7	-178.9	-70.1	172.9	0	0	0	113.6	P708 Y734 I765 D769 E775 I792	P708-L773 HydrophobicContact CB-CD1 4.03Å; P708-L773 HydrophobicContact CG-CD1 4.14Å; Y734-L773 HydrophobicContact CE2-CD2 4.27Å; I765-L773 HydrophobicContact CD1-CD1 4Å; D769-L773 WeakPolarHBondContact O-CB 3.49Å; D769-L773 WeakPolarHBondContact O-CD1 3.5Å; D769-L773 WeakPolarHBondContact O-CG 3.34Å; D769-L773 PolarHBondContact O-N 2.85Å; L773-E775 VanDerWaalsContact C-N 3.3Å; L773-I792 HydrophobicContact CB-CD1 3.81Å; L773-I792 HydrophobicContact CB-CG2 4.18Å; L773-I792 HydrophobicContact CD1-CD1 3.88Å; L773-I792 WeakPolarHBondContact O-CG2 3.44Å
774	C	74.6	Confident	66.4	Low	36 Å²	36	73.7 Å²	73.7	24%	0.243	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	0.6	173.1	-71	0	0	0	0	113	L770 I771 D772 L776 I792	L770-C774 WeakPolarHBondContact O-CB 3.26Å; L770-C774 PolarHBondContact O-N 2.92Å; L770-C774 PolarHBondContact O-SG 3.18Å; I771-C774 PolarHBondContact O-N 2.98Å; D772-C774 PolarHBondContact O-N 2.9Å; C774-L776 HydrophobicContact CB-CD1 3.81Å; C774-L776 HydrophobicContact CB-CD2 4.35Å; C774-L776 HydrophobicContact CB-CG 3.63Å; C774-L776 PolarHBondContact O-N 3.28Å; C774-I792 VanDerWaalsContact SG-CG2 3.52Å
775	E	70.6	Confident	63.6	Low	173 Å²	173	77.9 Å²	77.9	81%	0.808	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	35.8	-175.9	-57.9	180	177.2	0	0	113.1	I771 D772 L773 S777	I771-E775 PolarHBondContact O-N 3Å; I771-E775 VanDerWaalsContact O-N 3.14Å; D772-E775 PolarHBondContact O-N 2.81Å; L773-E775 VanDerWaalsContact C-N 3.3Å; E775-S777 PolarHBondContact O-N 3.08Å
776	L	59.5	Low	61.3	Low	35 Å²	35	87 Å²	87	18%	0.183	47%	0.473	C	S	.	.			trans	-80	101.7	-179.1	-61.5	173.6	0	0	0	109.2	I771 C774 V808 L883	I771-L776 HydrophobicContact CG2-CB 4.12Å; I771-L776 WeakPolarHBondContact CG2-O 3.43Å; I771-L776 PolarHBondContact O-N 3.47Å; C774-L776 HydrophobicContact CB-CD1 3.81Å; C774-L776 HydrophobicContact CB-CD2 4.35Å; C774-L776 HydrophobicContact CB-CG 3.63Å; C774-L776 PolarHBondContact O-N 3.28Å; L776-V808 HydrophobicContact CD1-CG1 3.96Å; L776-L883 HydrophobicContact CB-CD1 4.35Å
777	S	52.5	Low	58.9	Low	74 Å²	74	93.2 Å²	93.2	52%	0.517	52%	0.516	S	S	.	.			trans	-68.3	131.5	-177.2	-178.5	0	0	0	0	112.8	E775 A779	E775-S777 PolarHBondContact O-N 3.08Å; S777-A779 VanDerWaalsContact C-N 3.35Å; S777-A779 VanDerWaalsContact OG-C 3.28Å; S777-A779 PolarHBondContact OG-N 3.17Å; S777-A779 VanDerWaalsContact OG-N 3.1Å; S777-A779 PolarHBondContact OG-O 3.09Å; S777-A779 VanDerWaalsContact OG-O 3.06Å
778	L	49.4	Very low	57.1	Low	126 Å²	126	96.1 Å²	96.1	66%	0.66	55%	0.546	S	S	*	.	S	Bend	trans	-81.8	-8	169.4	-74.9	160.2	0	0	0	113.1	L883	L778-L883 HydrophobicContact CD2-CD1 4.03Å; L778-L883 HydrophobicContact CD2-CD2 4.42Å; L778-L883 HydrophobicContact CD2-CG 4.35Å
779	A	38.8	Very low	55.6	Low	82 Å²	82	101.9 Å²	101.9	68%	0.678	57%	0.57	S	S	*	*	S	Bend	trans	-156.4	110.3	176.2	0	0	0	0	0	113.1	S777	S777-A779 VanDerWaalsContact C-N 3.35Å; S777-A779 VanDerWaalsContact OG-C 3.28Å; S777-A779 PolarHBondContact OG-N 3.17Å; S777-A779 VanDerWaalsContact OG-N 3.1Å; S777-A779 PolarHBondContact OG-O 3.09Å; S777-A779 VanDerWaalsContact OG-O 3.06Å
780	G	35.5	Very low	54.6	Low	55 Å²	55	105.2 Å²	105.2	57%	0.567	59%	0.592	S	S	*	*			trans	66.4	154.9	158.5	0	0	0	0	0	118.7	T782	G780-T782 PolarHBondContact O-N 2.93Å
781	P	37.1	Very low	54	Low	134 Å²	134	111.2 Å²	111.2	87%	0.87	62%	0.618	S	S	*	*			trans	-91.6	98.1	-176.7	34.9	-28.2	0	0	0	110.9
782	T	33	Very low	54.1	Low	135 Å²	135	111.3 Å²	111.3	83%	0.828	62%	0.619	S	S	*	*			trans	-141.5	126.8	161.9	42.5	0	0	0	0	114.3	G780	G780-T782 PolarHBondContact O-N 2.93Å
783	K	35.8	Very low	54.5	Low	209 Å²	209	108 Å²	108	91%	0.909	60%	0.601	S	S	*	*			trans	69.9	88.1	163.3	-69.8	-174.9	176.3	178.8	0	118.7
784	R	41.7	Very low	55.1	Low	252 Å²	252	105.5 Å²	105.5	95%	0.951	59%	0.589	S	S	*	*			trans	-85.5	133.2	161	-74.4	-179.6	171.8	173.4	-2	112.3
785	S	35	Very low	55.9	Low	110 Å²	110	103.8 Å²	103.8	77%	0.769	58%	0.577	S	S	*	*			trans	-162.8	119.8	148.5	-177	0	0	0	0	105.5
786	K	44.2	Very low	57	Low	192 Å²	192	95.6 Å²	95.6	84%	0.835	54%	0.539	S	S	*	.				-151.8	157.8	57.4	-76.2	175.1	174.4	175.6	0	111.8	G788	K786-G788 VanDerWaalsContact C-N 3.29Å; K786-G788 PolarHBondContact O-N 3.3Å
787	S	39.6	Very low	58.6	Low	133 Å²	133	94.3 Å²	94.3	93%	0.93	53%	0.533	S	S	*	.			trans	-65.9	60	179.8	58.5	0	0	0	0	115.6
788	G	50.1	Low	60.5	Low	61 Å²	61	91.8 Å²	91.8	63%	0.629	51%	0.512	S	S	*	.			trans	-108.2	146.4	171	0	0	0	0	0	112	K786	K786-G788 VanDerWaalsContact C-N 3.29Å; K786-G788 PolarHBondContact O-N 3.3Å
789	K	56.2	Low	62.5	Low	176 Å²	176	89.4 Å²	89.4	77%	0.765	50%	0.5	S	S	*	.			trans	-62.6	141	166.4	-68.9	178.6	178.9	178.4	0	108.7	K791	K789-K791 PolarHBondContact O-N 3.37Å
790	P	64.4	Low	64.8	Low	84 Å²	84	90.3 Å²	90.3	55%	0.545	50%	0.496	S	S	.	.			trans	-61.5	136.8	-176.6	24	-33.2	0	0	0	111.1	I792 R841	P790-I792 PolarHBondContact O-N 3.38Å; P790-R841 WeakPolarHBondContact O-CD 3.26Å; P790-R841 PolarHBondContact O-NH1 2.93Å
791	K	73.6	Confident	67.4	Low	127 Å²	127	94.4 Å²	94.4	55%	0.552	50%	0.501	S	S	*	.	S	Bend	trans	-68.4	-20.4	179.9	-74.3	-172.5	176.2	-176.1	0	113.4	W706 K789 V842	W706-K791 HydrophobicContact CH2-CD 4.23Å; W706-K791 HydrophobicContact CH2-CG 4.06Å; W706-K791 HydrophobicContact CZ3-CB 3.97Å; W706-K791 HydrophobicContact CZ3-CD 4.06Å; W706-K791 HydrophobicContact CZ3-CG 3.95Å; K789-K791 PolarHBondContact O-N 3.37Å; K791-V842 PolarHBondContact O-N 3.37Å
792	I	84.7	Confident	69.8	Low	8 Å²	8	89.4 Å²	89.4	4%	0.041	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	149.6	-175.4	-166.9	161.5	0	0	0	110.6	I765 L770 L773 C774 P790 V842 V844	I765-I792 HydrophobicContact CD1-CD1 4.23Å; L770-I792 HydrophobicContact CD1-CD1 3.87Å; L773-I792 HydrophobicContact CB-CD1 3.81Å; L773-I792 HydrophobicContact CB-CG2 4.18Å; L773-I792 HydrophobicContact CD1-CD1 3.88Å; L773-I792 WeakPolarHBondContact O-CG2 3.44Å; C774-I792 VanDerWaalsContact SG-CG2 3.52Å; P790-I792 PolarHBondContact O-N 3.38Å; I792-V842 CarbonylContact C-O 3.51Å; I792-V842 WeakPolarHBondContact CA-O 3.23Å; I792-V842 HydrophobicContact CB-CB 4.4Å; I792-V842 HydrophobicContact CD1-CG1 4.25Å; I792-V842 HydrophobicContact CG1-CB 4.14Å; I792-V842 HydrophobicContact CG1-CG1 4.18Å; I792-V844 HydrophobicContact CD1-CG2 3.72Å; I792-V844 HydrophobicContact CG1-CG2 3.92Å
793	V	89	Confident	72.5	Confident	9 Å²	9	84.5 Å²	84.5	6%	0.055	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	130.9	172.6	62.3	0	0	0	0	109.5	I812 Y838 V842 I843 V844	V793-I812 HydrophobicContact CG2-CD1 3.71Å; V793-I812 HydrophobicContact CG2-CG1 4.26Å; V793-Y838 HydrophobicContact CB-CD1 4.09Å; V793-Y838 HydrophobicContact CB-CG 4.47Å; V793-Y838 HydrophobicContact CG1-CD1 4.16Å; V793-Y838 HydrophobicContact CG1-CG 4.12Å; V793-Y838 HydrophobicContact CG2-CD1 4.04Å; V793-Y838 HydrophobicContact CG2-CE1 4.13Å; V793-Y838 HydrophobicContact CG2-CG 4.3Å; V793-V842 PolarHBondContact N-O 3.35Å; V793-I843 HydrophobicContact CG1-CB 4.35Å; V793-I843 HydrophobicContact CG1-CG1 3.89Å; V793-V844 PolarHBondContact O-N 3.09Å
794	A	91	Very high	75	Confident	4 Å²	4	76 Å²	76	3%	0.033	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	125.6	172.1	0	0	0	0	0	109.7	S811 I812 V844 V846	A794-S811 CarbonylContact O-C 3.59Å; A794-S811 VanDerWaalsContact O-CA 3.26Å; A794-S811 WeakPolarHBondContact O-CA 3.33Å; A794-S811 WeakPolarHBondContact O-CB 3.34Å; A794-I812 PolarHBondContact O-N 2.97Å; A794-V844 CarbonylContact C-O 3.41Å; A794-V844 WeakPolarHBondContact CA-O 3.45Å; A794-V846 HydrophobicContact CB-CG2 4.23Å
795	V	92.8	Very high	77.1	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	108.9	175.9	178	0	0	0	0	108.1	I797 I814 L835 I843 V844 I845 V846	V795-I797 HydrophobicContact CG1-CG2 4.25Å; V795-I814 HydrophobicContact CG1-CB 3.9Å; V795-I814 HydrophobicContact CG1-CD1 3.91Å; V795-I814 HydrophobicContact CG1-CG1 4.06Å; V795-L835 HydrophobicContact CG2-CD1 4.1Å; V795-I843 HydrophobicContact CB-CG2 4.41Å; V795-I843 HydrophobicContact CG2-CG2 3.76Å; V795-V844 PolarHBondContact N-O 3.05Å; V795-I845 HydrophobicContact CB-CD1 4.05Å; V795-I845 HydrophobicContact CG1-CD1 4.38Å; V795-I845 WeakPolarHBondContact O-CA 3.39Å; V795-V846 PolarHBondContact O-N 2.95Å
796	D	92.8	Very high	79.6	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	112.3	-179.5	-164.8	-38.3	0	0	0	110	R798 F803 I812 N813 I814 V846	D796-R798 VanDerWaalsContact C-N 3.33Å; D796-R798 WeakPolarHBondContact OD1-CB 3.48Å; D796-R798 WeakPolarHBondContact OD1-CG 3.47Å; D796-R798 IonicContact OD1-CZ 2.65Å; D796-R798 PolarHBondContact OD1-N 3.13Å; D796-R798 IonicContact OD1-NE 2.72Å; D796-R798 PolarHBondContact OD1-NE 3.1Å; D796-R798 IonicContact OD1-NH2 2.91Å; D796-R798 IonicContact OD2-CZ 3.65Å; D796-R798 VanDerWaalsContact OD2-CZ 3.28Å; D796-R798 IonicContact OD2-NE 2.68Å; D796-R798 PolarHBondContact OD2-NE 2.86Å; D796-R798 IonicContact OD2-NH2 3.27Å; D796-R798 PolarHBondContact OD2-NH2 2.91Å; D796-F803 HydrophobicContact CB-CD2 3.7Å; D796-F803 HydrophobicContact CB-CE2 3.85Å; D796-I812 PolarHBondContact N-O 3.09Å; D796-N813 WeakPolarHBondContact O-CA 3.42Å; D796-N813 PolarHBondContact O-ND2 3.47Å; D796-I814 PolarHBondContact O-N 3.41Å; D796-V846 WeakPolarHBondContact CA-O 3.42Å
797	I	93.6	Very high	81.7	Confident	9 Å²	9	59.6 Å²	59.6	5%	0.046	32%	0.324	C	S	.	.			trans	-91.9	6.3	-174.8	63.4	158.8	0	0	0	113.9	V795 I814 F816 I845 V846 A853 F856	V795-I797 HydrophobicContact CG1-CG2 4.25Å; I797-I814 VanDerWaalsContact CA-O 3.27Å; I797-I814 WeakPolarHBondContact CA-O 3.42Å; I797-F816 HydrophobicContact CD1-CD2 4.03Å; I797-F816 PolarHBondContact O-N 3.43Å; I797-F816 VanDerWaalsContact O-N 3.12Å; I797-I845 HydrophobicContact CD1-CG2 3.98Å; I797-I845 HydrophobicContact CG1-CG2 4.07Å; I797-I845 HydrophobicContact CG2-CG2 3.88Å; I797-V846 WeakPolarHBondContact CG1-O 3.42Å; I797-V846 PolarHBondContact N-O 3.46Å; I797-A853 HydrophobicContact CD1-CB 4.42Å; I797-F856 HydrophobicContact CD1-CB 4.13Å; I797-F856 HydrophobicContact CD1-CG 4.45Å; I797-F856 HydrophobicContact CG2-CD1 3.88Å; I797-F856 HydrophobicContact CG2-CD2 3.93Å; I797-F856 HydrophobicContact CG2-CE1 3.88Å; I797-F856 HydrophobicContact CG2-CE2 3.96Å; I797-F856 HydrophobicContact CG2-CG 3.9Å; I797-F856 HydrophobicContact CG2-CZ 3.94Å
798	R	92.4	Very high	84	Confident	20 Å²	20	53.4 Å²	53.4	8%	0.075	28%	0.281	C	S	.	.	S	Bend	trans	-70.7	163.8	176.3	-59.5	179.4	-68.2	150.2	2.6	110.8	D796 D802 G806 N813 H848	D796-R798 VanDerWaalsContact C-N 3.33Å; D796-R798 WeakPolarHBondContact OD1-CB 3.48Å; D796-R798 WeakPolarHBondContact OD1-CG 3.47Å; D796-R798 IonicContact OD1-CZ 2.65Å; D796-R798 PolarHBondContact OD1-N 3.13Å; D796-R798 IonicContact OD1-NE 2.72Å; D796-R798 PolarHBondContact OD1-NE 3.1Å; D796-R798 IonicContact OD1-NH2 2.91Å; D796-R798 IonicContact OD2-CZ 3.65Å; D796-R798 VanDerWaalsContact OD2-CZ 3.28Å; D796-R798 IonicContact OD2-NE 2.68Å; D796-R798 PolarHBondContact OD2-NE 2.86Å; D796-R798 IonicContact OD2-NH2 3.27Å; D796-R798 PolarHBondContact OD2-NH2 2.91Å; R798-D802 HydrophobicContact CB-CB 4.15Å; R798-D802 PolarHBondContact NH1-O 3.41Å; R798-G806 PolarHBondContact NH2-O 3.38Å; R798-N813 PolarHBondContact O-ND2 3.14Å; R798-H848 WeakPolarHBondContact CD-CD2 3.28Å; R798-H848 VanDerWaalsContact CD-NE2 3.27Å; R798-H848 WeakPolarHBondContact CD-NE2 3.41Å; R798-H848 PolarHBondContact NH1-NE2 3.41Å
799	N	90.6	Very high	85.6	Confident	76 Å²	76	53.7 Å²	53.7	41%	0.406	27%	0.273	S	S	.	.			trans	-62.3	161.8	172.8	64.8	51.8	0	0	0	110.6	E801 D802 F803	N799-E801 PolarHBondContact O-N 3.42Å; N799-E801 PolarHBondContact OD1-N 2.99Å; N799-D802 PolarHBondContact ND2-OD2 3.3Å; N799-D802 PolarHBondContact O-N 3.22Å; N799-D802 WeakPolarHBondContact OD1-CB 3.46Å; N799-D802 PolarHBondContact OD1-N 3.48Å; N799-D802 PolarHBondContact OD1-OD2 3.18Å; N799-F803 PolarHBondContact O-N 2.78Å
800	V	88.4	Confident	86.9	Confident	101 Å²	101	48.6 Å²	48.6	61%	0.612	27%	0.27	S	S	*	.	H	α-helix	trans	-61.8	-32.9	-175.5	-177.7	0	0	0	0	111.9	G804 P815	V800-G804 PolarHBondContact O-N 2.8Å; V800-P815 HydrophobicContact CG2-CG 4.28Å
801	E	88.8	Confident	88	Confident	141 Å²	141	45.3 Å²	45.3	66%	0.659	25%	0.25	S	C	*	.	H	α-helix	trans	-66.8	-47.5	179.2	-61.7	-178.4	-175.1	0	0	111.8	N799 F803 G804 R805	N799-E801 PolarHBondContact O-N 3.42Å; N799-E801 PolarHBondContact OD1-N 2.99Å; E801-F803 VanDerWaalsContact C-N 3.33Å; E801-G804 CarbonylContact O-C 3.58Å; E801-G804 PolarHBondContact O-N 3.05Å; E801-R805 WeakPolarHBondContact O-CG 3.44Å; E801-R805 PolarHBondContact O-N 3.27Å
802	D	89	Confident	88.8	Confident	29 Å²	29	40.7 Å²	40.7	16%	0.155	23%	0.231	C	C	.	.	H	α-helix	trans	-70.7	-30.4	179.6	-72	-34.3	0	0	0	112.2	R798 N799 R805	R798-D802 HydrophobicContact CB-CB 4.15Å; R798-D802 PolarHBondContact NH1-O 3.41Å; N799-D802 PolarHBondContact ND2-OD2 3.3Å; N799-D802 PolarHBondContact O-N 3.22Å; N799-D802 WeakPolarHBondContact OD1-CB 3.46Å; N799-D802 PolarHBondContact OD1-N 3.48Å; N799-D802 PolarHBondContact OD1-OD2 3.18Å; D802-R805 PolarHBondContact O-N 3.49Å; D802-R805 IonicContact OD1-CZ 3.25Å; D802-R805 IonicContact OD1-NH1 3.67Å; D802-R805 PolarHBondContact OD1-NH1 3.4Å
803	F	89.6	Confident	89.1	Confident	33 Å²	33	42.2 Å²	42.2	15%	0.145	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-44.5	168.2	-176	-94.1	0	0	0	111.4	D796 N799 E801 R805 G806 H807 S811 N813	D796-F803 HydrophobicContact CB-CD2 3.7Å; D796-F803 HydrophobicContact CB-CE2 3.85Å; N799-F803 PolarHBondContact O-N 2.78Å; E801-F803 VanDerWaalsContact C-N 3.33Å; F803-R805 VanDerWaalsContact C-N 3.26Å; F803-R805 PolarHBondContact O-N 3.2Å; F803-G806 CarbonylContact O-C 3.44Å; F803-G806 PolarHBondContact O-N 2.94Å; F803-G806 VanDerWaalsContact O-N 3.16Å; F803-H807 HydrophobicContact CD1-CB 4.47Å; F803-H807 HydrophobicContact CD2-CB 3.62Å; F803-H807 HydrophobicContact CE1-CB 4.29Å; F803-H807 AromaticContact CE1-CG 3.81Å; F803-H807 AromaticContact CE1-ND1 3.84Å; F803-H807 HydrophobicContact CE2-CB 3.42Å; F803-H807 VanDerWaalsContact CE2-CB 3.42Å; F803-H807 AromaticContact CE2-CG 3.72Å; F803-H807 HydrophobicContact CG-CB 4.17Å; F803-H807 HydrophobicContact CZ-CB 3.78Å; F803-H807 AromaticContact CZ-CD2 3.5Å; F803-H807 VanDerWaalsContact CZ-CD2 3.5Å; F803-H807 WeakPolarHBondContact CZ-CD2 3.27Å; F803-H807 AromaticContact CZ-CG 3.49Å; F803-H807 VanDerWaalsContact CZ-CG 3.49Å; F803-H807 PolarHBondContact O-ND1 3.03Å; F803-S811 WeakPolarHBondContact CE2-OG 3.38Å; F803-N813 HydrophobicContact CB-CB 4.32Å; F803-N813 HydrophobicContact CD1-CB 3.89Å; F803-N813 HydrophobicContact CD2-CB 3.59Å; F803-N813 HydrophobicContact CE1-CB 4.05Å; F803-N813 HydrophobicContact CE2-CB 3.73Å; F803-N813 HydrophobicContact CG-CB 3.66Å; F803-N813 HydrophobicContact CZ-CB 3.97Å
804	G	86.6	Confident	89.2	Confident	30 Å²	30	41.9 Å²	41.9	31%	0.309	24%	0.237	S	C	.	.	H	α-helix	trans	-64.4	-25.9	176.2	0	0	0	0	0	114	V800 E801 G806 P887	V800-G804 PolarHBondContact O-N 2.8Å; E801-G804 CarbonylContact O-C 3.58Å; E801-G804 PolarHBondContact O-N 3.05Å; G804-G806 VanDerWaalsContact C-N 3.26Å; G804-G806 PolarHBondContact O-N 2.87Å; G804-P887 WeakPolarHBondContact O-CD 3.4Å; G804-P887 WeakPolarHBondContact O-CG 3.32Å
805	R	86.6	Confident	89.1	Confident	177 Å²	177	43.4 Å²	43.4	67%	0.668	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-14.4	174.6	-73.2	171.5	179.6	170.7	-3.5	114.2	E801 D802 F803	E801-R805 WeakPolarHBondContact O-CG 3.44Å; E801-R805 PolarHBondContact O-N 3.27Å; D802-R805 PolarHBondContact O-N 3.49Å; D802-R805 IonicContact OD1-CZ 3.25Å; D802-R805 IonicContact OD1-NH1 3.67Å; D802-R805 PolarHBondContact OD1-NH1 3.4Å; F803-R805 VanDerWaalsContact C-N 3.26Å; F803-R805 PolarHBondContact O-N 3.2Å
806	G	87.4	Confident	88.8	Confident	5 Å²	5	46.2 Å²	46.2	5%	0.052	26%	0.259	C	S	.	.			trans	152.5	126.8	179.5	0	0	0	0	0	111.7	R798 F803 G804 T885	R798-G806 PolarHBondContact NH2-O 3.38Å; F803-G806 CarbonylContact O-C 3.44Å; F803-G806 PolarHBondContact O-N 2.94Å; F803-G806 VanDerWaalsContact O-N 3.16Å; G804-G806 VanDerWaalsContact C-N 3.26Å; G804-G806 PolarHBondContact O-N 2.87Å; G806-T885 WeakPolarHBondContact CA-O 3.37Å
807	H	89.4	Confident	88.2	Confident	28 Å²	28	53.1 Å²	53.1	13%	0.13	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	165.1	-177.4	60.7	-81.9	0	0	0	111.9	F803 L884 T885	F803-H807 HydrophobicContact CD1-CB 4.47Å; F803-H807 HydrophobicContact CD2-CB 3.62Å; F803-H807 HydrophobicContact CE1-CB 4.29Å; F803-H807 AromaticContact CE1-CG 3.81Å; F803-H807 AromaticContact CE1-ND1 3.84Å; F803-H807 HydrophobicContact CE2-CB 3.42Å; F803-H807 VanDerWaalsContact CE2-CB 3.42Å; F803-H807 AromaticContact CE2-CG 3.72Å; F803-H807 HydrophobicContact CG-CB 4.17Å; F803-H807 HydrophobicContact CZ-CB 3.78Å; F803-H807 AromaticContact CZ-CD2 3.5Å; F803-H807 VanDerWaalsContact CZ-CD2 3.5Å; F803-H807 WeakPolarHBondContact CZ-CD2 3.27Å; F803-H807 AromaticContact CZ-CG 3.49Å; F803-H807 VanDerWaalsContact CZ-CG 3.49Å; F803-H807 PolarHBondContact O-ND1 3.03Å; H807-L884 CarbonylContact O-C 3.41Å; H807-L884 WeakPolarHBondContact O-CA 3.5Å; H807-T885 PolarHBondContact CE1-O 2.98Å; H807-T885 PolarHBondContact N-O 3.14Å; H807-T885 PolarHBondContact ND1-O 2.97Å; H807-T885 PolarHBondContact O-N 2.97Å
808	V	87.5	Confident	87.6	Confident	3 Å²	3	55 Å²	55	2%	0.018	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	131.1	174.4	-179.5	0	0	0	0	109.3	L776 G810 S811 I875 L878 L884	L776-V808 HydrophobicContact CD1-CG1 3.96Å; V808-G810 PolarHBondContact O-N 2.88Å; V808-S811 VanDerWaalsContact O-CB 3.22Å; V808-S811 WeakPolarHBondContact O-CB 3.38Å; V808-S811 PolarHBondContact O-N 2.94Å; V808-S811 PolarHBondContact O-OG 3.03Å; V808-I875 HydrophobicContact CG2-CD1 3.92Å; V808-L878 HydrophobicContact CG2-CD1 3.57Å; V808-L884 HydrophobicContact CG2-CD2 4.2Å
809	S	83.1	Confident	86.9	Confident	66 Å²	66	54 Å²	54	46%	0.462	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	126.5	179.8	177.3	0	0	0	0	111.5	S811 T885	S809-S811 VanDerWaalsContact C-N 3.31Å; S809-S811 PolarHBondContact O-N 3.02Å; S809-T885 WeakPolarHBondContact CB-OG1 3.42Å
810	G	82.6	Confident	86.4	Confident	69 Å²	69	51.7 Å²	51.7	71%	0.711	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	6.8	-178.7	0	0	0	0	0	115.2	V808	V808-G810 PolarHBondContact O-N 2.88Å
811	S	89.1	Confident	85.8	Confident	16 Å²	16	47.9 Å²	47.9	11%	0.112	27%	0.273	C	S	.	.			trans	-75.3	158.8	172.2	74	0	0	0	0	112.5	A794 F803 V808 S809	A794-S811 CarbonylContact O-C 3.59Å; A794-S811 VanDerWaalsContact O-CA 3.26Å; A794-S811 WeakPolarHBondContact O-CA 3.33Å; A794-S811 WeakPolarHBondContact O-CB 3.34Å; F803-S811 WeakPolarHBondContact CE2-OG 3.38Å; V808-S811 VanDerWaalsContact O-CB 3.22Å; V808-S811 WeakPolarHBondContact O-CB 3.38Å; V808-S811 PolarHBondContact O-N 2.94Å; V808-S811 PolarHBondContact O-OG 3.03Å; S809-S811 VanDerWaalsContact C-N 3.31Å; S809-S811 PolarHBondContact O-N 3.02Å
812	I	89.7	Confident	85	Confident	30 Å²	30	47.7 Å²	47.7	15%	0.154	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.1	-178.4	-52.6	171	0	0	0	108.3	V793 A794 D796 I814 V834 Y838	V793-I812 HydrophobicContact CG2-CD1 3.71Å; V793-I812 HydrophobicContact CG2-CG1 4.26Å; A794-I812 PolarHBondContact O-N 2.97Å; D796-I812 PolarHBondContact N-O 3.09Å; I812-I814 HydrophobicContact CG2-CD1 4.18Å; I812-I814 HydrophobicContact CG2-CG1 3.9Å; I812-V834 HydrophobicContact CD1-CG1 4.05Å; I812-V834 HydrophobicContact CG2-CG1 3.9Å; I812-Y838 HydrophobicContact CD1-CD2 3.84Å; I812-Y838 HydrophobicContact CD1-CE1 4.31Å; I812-Y838 HydrophobicContact CD1-CE2 3.15Å; I812-Y838 VanDerWaalsContact CD1-CZ 3.42Å
813	N	91.6	Very high	84.1	Confident	39 Å²	39	52.8 Å²	52.8	21%	0.209	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	117.2	173.8	-171.7	-131.1	0	0	0	111	D796 R798 F803	D796-N813 WeakPolarHBondContact O-CA 3.42Å; D796-N813 PolarHBondContact O-ND2 3.47Å; R798-N813 PolarHBondContact O-ND2 3.14Å; F803-N813 HydrophobicContact CB-CB 4.32Å; F803-N813 HydrophobicContact CD1-CB 3.89Å; F803-N813 HydrophobicContact CD2-CB 3.59Å; F803-N813 HydrophobicContact CE1-CB 4.05Å; F803-N813 HydrophobicContact CE2-CB 3.73Å; F803-N813 HydrophobicContact CG-CB 3.66Å; F803-N813 HydrophobicContact CZ-CB 3.97Å
814	I	90.4	Very high	83.1	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.01	31%	0.308	C	S	.	.			trans	-132.5	86.2	175.7	-60.5	-175.2	0	0	0	107.5	V795 D796 I797 I812 F816 V819 A831 L835 F856	V795-I814 HydrophobicContact CG1-CB 3.9Å; V795-I814 HydrophobicContact CG1-CD1 3.91Å; V795-I814 HydrophobicContact CG1-CG1 4.06Å; D796-I814 PolarHBondContact O-N 3.41Å; I797-I814 VanDerWaalsContact CA-O 3.27Å; I797-I814 WeakPolarHBondContact CA-O 3.42Å; I812-I814 HydrophobicContact CG2-CD1 4.18Å; I812-I814 HydrophobicContact CG2-CG1 3.9Å; I814-F816 PolarHBondContact O-N 3.25Å; I814-V819 HydrophobicContact CG2-CB 4.33Å; I814-V819 HydrophobicContact CG2-CG2 3.23Å; I814-A831 HydrophobicContact CG2-CB 4.24Å; I814-L835 HydrophobicContact CD1-CB 4.28Å; I814-L835 HydrophobicContact CD1-CD1 4.12Å; I814-F856 HydrophobicContact CG2-CZ 4.07Å
815	P	88.9	Confident	82.6	Confident	37 Å²	37	57 Å²	57	24%	0.24	33%	0.325	C	S	.	.			trans	-54.1	139.8	-176.5	-26.7	34.8	0	0	0	112.2	V800 N817 S818	V800-P815 HydrophobicContact CG2-CG 4.28Å; P815-N817 VanDerWaalsContact C-N 3.27Å; P815-N817 PolarHBondContact O-N 2.85Å; P815-S818 VanDerWaalsContact O-CB 3.32Å; P815-S818 WeakPolarHBondContact O-CB 3.31Å; P815-S818 PolarHBondContact O-N 3.19Å; P815-S818 PolarHBondContact O-OG 3.04Å
816	F	85.8	Confident	82.2	Confident	59 Å²	59	50.8 Å²	50.8	26%	0.259	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-46.6	-44.3	-173	-177.5	-90.8	0	0	0	114.4	I797 I814 S818 S852 L855 F856	I797-F816 HydrophobicContact CD1-CD2 4.03Å; I797-F816 PolarHBondContact O-N 3.43Å; I797-F816 VanDerWaalsContact O-N 3.12Å; I814-F816 PolarHBondContact O-N 3.25Å; F816-S818 VanDerWaalsContact C-N 3.29Å; F816-S818 PolarHBondContact O-N 3Å; F816-S852 VanDerWaalsContact CE2-O 3.32Å; F816-S852 WeakPolarHBondContact CE2-O 3.15Å; F816-L855 HydrophobicContact CE2-CB 4.1Å; F816-L855 HydrophobicContact CZ-CB 4.21Å; F816-F856 HydrophobicContact CD2-CB 3.94Å; F816-F856 AromaticContact CD2-CD2 3.72Å; F816-F856 HydrophobicContact CD2-CD2 3.72Å; F816-F856 HydrophobicContact CD2-CG 4.31Å; F816-F856 HydrophobicContact CE2-CB 3.9Å; F816-F856 HydrophobicContact CE2-CD2 4.23Å; F816-F856 HydrophobicContact CG-CD2 4.42Å
817	N	81.7	Confident	81.8	Confident	146 Å²	146	53.9 Å²	53.9	78%	0.781	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-80.8	4.4	-177.2	-65.3	-29.1	0	0	0	114.9	P815	P815-N817 VanDerWaalsContact C-N 3.27Å; P815-N817 PolarHBondContact O-N 2.85Å
818	S	79.6	Confident	81.1	Confident	48 Å²	48	61.8 Å²	61.8	34%	0.336	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-96.7	-16	-170.2	67.7	0	0	0	0	115.3	P815 F816 C829	P815-S818 VanDerWaalsContact O-CB 3.32Å; P815-S818 WeakPolarHBondContact O-CB 3.31Å; P815-S818 PolarHBondContact O-N 3.19Å; P815-S818 PolarHBondContact O-OG 3.04Å; F816-S818 VanDerWaalsContact C-N 3.29Å; F816-S818 PolarHBondContact O-N 3Å; S818-C829 PolarHBondContact O-SG 3.06Å; S818-C829 VanDerWaalsContact O-SG 3.37Å
819	V	79.1	Confident	80.6	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-26	-169.8	173.7	0	0	0	0	113.9	I814 L826 V827 A831	I814-V819 HydrophobicContact CG2-CB 4.33Å; I814-V819 HydrophobicContact CG2-CG2 3.23Å; V819-L826 HydrophobicContact CG1-CD1 3.69Å; V819-L826 HydrophobicContact CG1-CG 4.09Å; V819-V827 PolarHBondContact O-N 2.96Å; V819-A831 HydrophobicContact CG2-CB 3.75Å
820	F	80.3	Confident	80.3	Confident	27 Å²	27	65.8 Å²	65.8	12%	0.118	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-110.5	136	-176.2	-59.4	-67.2	0	0	0	111.7	E825 L826 F856 H859 L860	F820-E825 WeakPolarHBondContact CA-O 3.46Å; F820-L826 HydrophobicContact CD1-CD1 4.42Å; F820-L826 HydrophobicContact CE1-CD1 3.8Å; F820-F856 AromaticContact CD2-CD2 3.99Å; F820-F856 HydrophobicContact CD2-CD2 3.99Å; F820-F856 AromaticContact CD2-CE2 3.91Å; F820-F856 HydrophobicContact CD2-CE2 3.91Å; F820-F856 HydrophobicContact CE2-CD1 4.29Å; F820-F856 AromaticContact CE2-CD2 3.45Å; F820-F856 HydrophobicContact CE2-CD2 3.45Å; F820-F856 VanDerWaalsContact CE2-CD2 3.45Å; F820-F856 HydrophobicContact CE2-CE1 4.23Å; F820-F856 AromaticContact CE2-CE2 3.36Å; F820-F856 HydrophobicContact CE2-CE2 3.36Å; F820-F856 AromaticContact CE2-CG 3.92Å; F820-F856 HydrophobicContact CE2-CG 3.92Å; F820-F856 AromaticContact CE2-CZ 3.78Å; F820-F856 HydrophobicContact CE2-CZ 3.78Å; F820-F856 HydrophobicContact CZ-CE2 4.37Å; F820-F856 HydrophobicContact CZ-CZ 4.39Å; F820-H859 HydrophobicContact CD1-CB 3.93Å; F820-H859 HydrophobicContact CD2-CB 4.17Å; F820-H859 HydrophobicContact CE1-CB 3.52Å; F820-H859 HydrophobicContact CE2-CB 3.75Å; F820-H859 HydrophobicContact CG-CB 4.23Å; F820-H859 HydrophobicContact CZ-CB 3.41Å; F820-H859 VanDerWaalsContact CZ-CB 3.41Å; F820-L860 HydrophobicContact CE1-CD2 4.28Å; F820-L860 HydrophobicContact CZ-CD2 3.63Å; F820-L860 HydrophobicContact CZ-CG 4.04Å
821	G	75.6	Confident	80	Confident	21 Å²	21	63.6 Å²	63.6	22%	0.216	36%	0.36	C	S	.	.			trans	-75.1	174.1	172.4	0	0	0	0	0	111.9	D823 G824 E825	G821-D823 PolarHBondContact O-N 3.24Å; G821-D823 VanDerWaalsContact O-N 3.16Å; G821-G824 PolarHBondContact O-N 3.4Å; G821-E825 PolarHBondContact N-O 3.35Å
822	P	72.2	Confident	79.5	Confident	137 Å²	137	63.2 Å²	63.2	89%	0.89	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-28.3	177.5	22.4	-31.5	0	0	0	113.1	G824	P822-G824 VanDerWaalsContact C-N 3.34Å
823	D	69.6	Low	79	Confident	135 Å²	135	63.5 Å²	63.5	72%	0.722	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	3.8	178.6	-55.2	-47.6	0	0	0	113.5	G821 E825	G821-D823 PolarHBondContact O-N 3.24Å; G821-D823 VanDerWaalsContact O-N 3.16Å; D823-E825 VanDerWaalsContact C-N 3.3Å; D823-E825 PolarHBondContact O-N 3.41Å
824	G	69.1	Low	78.6	Confident	7 Å²	7	64.3 Å²	64.3	7%	0.072	37%	0.374	C	S	.	.	S	Bend	trans	78.4	8.1	179.5	0	0	0	0	0	115	G821 P822	G821-G824 PolarHBondContact O-N 3.4Å; P822-G824 VanDerWaalsContact C-N 3.34Å
825	E	76.5	Confident	78.2	Confident	144 Å²	144	64.2 Å²	64.2	67%	0.673	37%	0.374	S	S	*	.			trans	-76.3	151.1	172.9	-64.2	-167.9	166.4	0	0	111.9	F820 G821 D823 V827	F820-E825 WeakPolarHBondContact CA-O 3.46Å; G821-E825 PolarHBondContact N-O 3.35Å; D823-E825 VanDerWaalsContact C-N 3.3Å; D823-E825 PolarHBondContact O-N 3.41Å; E825-V827 PolarHBondContact O-N 3.19Å
826	L	77.4	Confident	78	Confident	47 Å²	47	66.3 Å²	66.3	25%	0.246	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-73	112.5	178.1	-153.5	98.3	0	0	0	109.5	V819 F820 V863 F865	V819-L826 HydrophobicContact CG1-CD1 3.69Å; V819-L826 HydrophobicContact CG1-CG 4.09Å; F820-L826 HydrophobicContact CD1-CD1 4.42Å; F820-L826 HydrophobicContact CE1-CD1 3.8Å; L826-V863 HydrophobicContact CD1-CG2 4.03Å; L826-F865 HydrophobicContact CD1-CE2 4.37Å
827	V	79.3	Confident	77.9	Confident	70 Å²	70	69.3 Å²	69.3	42%	0.424	40%	0.399	S	S	.	.			trans	-75.2	135.1	177	-177.6	0	0	0	0	109	V819 E825 C829 S832	V819-V827 PolarHBondContact O-N 2.96Å; E825-V827 PolarHBondContact O-N 3.19Å; V827-C829 PolarHBondContact O-N 3.16Å; V827-S832 VanDerWaalsContact O-CB 3.3Å; V827-S832 WeakPolarHBondContact O-CB 3.29Å; V827-S832 PolarHBondContact O-OG 2.94Å
828	Q	75.1	Confident	77.9	Confident	195 Å²	195	65.1 Å²	65.1	91%	0.911	37%	0.373	S	S	*	.			trans	-71.6	103	176.2	-162.1	172.2	9	0	0	109.6
829	C	76.1	Confident	78	Confident	34 Å²	34	69.6 Å²	69.6	23%	0.23	38%	0.382	C	S	.	.	S	Bend	trans	-146.8	165.6	-176.4	72	0	0	0	0	109.8	S818 V827 A831 S832 G833	S818-C829 PolarHBondContact O-SG 3.06Å; S818-C829 VanDerWaalsContact O-SG 3.37Å; V827-C829 PolarHBondContact O-N 3.16Å; C829-A831 PolarHBondContact O-N 2.85Å; C829-S832 PolarHBondContact N-OG 3.33Å; C829-S832 PolarHBondContact O-N 3.12Å; C829-S832 VanDerWaalsContact O-N 3.15Å; C829-S832 PolarHBondContact O-OG 3.21Å; C829-S832 PolarHBondContact SG-N 3Å; C829-S832 VanDerWaalsContact SG-N 3.37Å; C829-G833 PolarHBondContact O-N 3.17Å
830	P	77.1	Confident	78.1	Confident	118 Å²	118	71.1 Å²	71.1	77%	0.766	40%	0.398	S	S	*	.	H	α-helix	trans	-55.7	-37.2	178.5	-27.1	35.7	0	0	0	113.1	G833 V834	P830-G833 PolarHBondContact O-N 3.06Å; P830-V834 WeakPolarHBondContact O-CG2 3.5Å; P830-V834 PolarHBondContact O-N 2.67Å
831	A	76.2	Confident	78.4	Confident	24 Å²	24	72 Å²	72	20%	0.198	40%	0.4	C	S	.	.	H	α-helix	trans	-67.3	-38.6	178.9	0	0	0	0	0	112.7	I814 V819 C829 V834 L835	I814-A831 HydrophobicContact CG2-CB 4.24Å; V819-A831 HydrophobicContact CG2-CB 3.75Å; C829-A831 PolarHBondContact O-N 2.85Å; A831-V834 PolarHBondContact O-N 2.69Å; A831-L835 PolarHBondContact O-N 3.1Å
832	S	78.8	Confident	79.1	Confident	7 Å²	7	71.3 Å²	71.3	5%	0.049	39%	0.392	C	S	.	.	H	α-helix	trans	-70.1	-35.2	174.1	61.8	0	0	0	0	112.2	V827 C829 V834 L835 Q836	V827-S832 VanDerWaalsContact O-CB 3.3Å; V827-S832 WeakPolarHBondContact O-CB 3.29Å; V827-S832 PolarHBondContact O-OG 2.94Å; C829-S832 PolarHBondContact N-OG 3.33Å; C829-S832 PolarHBondContact O-N 3.12Å; C829-S832 VanDerWaalsContact O-N 3.15Å; C829-S832 PolarHBondContact O-OG 3.21Å; C829-S832 PolarHBondContact SG-N 3Å; C829-S832 VanDerWaalsContact SG-N 3.37Å; S832-V834 PolarHBondContact O-N 3.42Å; S832-L835 PolarHBondContact O-N 2.98Å; S832-Q836 WeakPolarHBondContact O-CG 3.48Å; S832-Q836 PolarHBondContact O-N 3.18Å
833	G	79.3	Confident	80.1	Confident	37 Å²	37	64.8 Å²	64.8	38%	0.381	35%	0.35	S	S	.	.	H	α-helix	trans	-61.4	-39.9	170.6	0	0	0	0	0	113.3	C829 P830 Q836 N837	C829-G833 PolarHBondContact O-N 3.17Å; P830-G833 PolarHBondContact O-N 3.06Å; G833-Q836 PolarHBondContact O-N 2.79Å; G833-N837 PolarHBondContact O-ND2 2.78Å
834	V	82.1	Confident	81.3	Confident	55 Å²	55	58.4 Å²	58.4	33%	0.333	32%	0.315	S	S	.	.	H	α-helix	trans	-63.5	-44.1	173.9	172.2	0	0	0	0	110.8	I812 P830 A831 S832 Q836 N837 Y838	I812-V834 HydrophobicContact CD1-CG1 4.05Å; I812-V834 HydrophobicContact CG2-CG1 3.9Å; P830-V834 WeakPolarHBondContact O-CG2 3.5Å; P830-V834 PolarHBondContact O-N 2.67Å; A831-V834 PolarHBondContact O-N 2.69Å; S832-V834 PolarHBondContact O-N 3.42Å; V834-Q836 VanDerWaalsContact C-N 3.35Å; V834-Q836 PolarHBondContact O-N 2.96Å; V834-N837 WeakPolarHBondContact O-CB 3.44Å; V834-N837 PolarHBondContact O-N 3.24Å; V834-Y838 HydrophobicContact CG1-CE2 3.95Å; V834-Y838 WeakPolarHBondContact O-CD2 3.33Å; V834-Y838 WeakPolarHBondContact O-CE2 3.41Å
835	L	83.6	Confident	82.5	Confident	1 Å²	1	58 Å²	58	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-63.8	-38.3	-179.6	-166.6	68	0	0	0	112.7	V795 I814 A831 S832 N837 Y838 I843 L860 F865	V795-L835 HydrophobicContact CG2-CD1 4.1Å; I814-L835 HydrophobicContact CD1-CB 4.28Å; I814-L835 HydrophobicContact CD1-CD1 4.12Å; A831-L835 PolarHBondContact O-N 3.1Å; S832-L835 PolarHBondContact O-N 2.98Å; L835-N837 PolarHBondContact O-N 2.88Å; L835-Y838 PolarHBondContact O-N 2.89Å; L835-Y838 VanDerWaalsContact O-N 3.07Å; L835-I843 HydrophobicContact CD1-CD1 4.45Å; L835-L860 HydrophobicContact CD2-CD1 4.33Å; L835-L860 HydrophobicContact CD2-CD2 3.37Å; L835-F865 HydrophobicContact CD2-CE1 4.13Å; L835-F865 HydrophobicContact CD2-CE2 4.45Å; L835-F865 HydrophobicContact CD2-CZ 3.99Å; L835-F865 HydrophobicContact CG-CE1 3.82Å; L835-F865 HydrophobicContact CG-CZ 4.03Å
836	Q	83.8	Confident	83.3	Confident	80 Å²	80	51.2 Å²	51.2	37%	0.374	28%	0.28	S	S	.	.	H	α-helix	trans	-58.9	-31.7	176	-71.3	-68.1	-12.5	0	0	112.9	S832 G833 V834 Y838 R839	S832-Q836 WeakPolarHBondContact O-CG 3.48Å; S832-Q836 PolarHBondContact O-N 3.18Å; G833-Q836 PolarHBondContact O-N 2.79Å; V834-Q836 VanDerWaalsContact C-N 3.35Å; V834-Q836 PolarHBondContact O-N 2.96Å; Q836-Y838 PolarHBondContact O-N 3.02Å; Q836-Y838 VanDerWaalsContact O-N 3.12Å; Q836-R839 WeakPolarHBondContact O-CB 3.42Å; Q836-R839 PolarHBondContact O-N 2.91Å
837	N	83.7	Confident	84	Confident	122 Å²	122	49.2 Å²	49.2	65%	0.652	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-12.6	177.9	-66.6	-35.2	0	0	0	114.1	G833 V834 L835	G833-N837 PolarHBondContact O-ND2 2.78Å; V834-N837 WeakPolarHBondContact O-CB 3.44Å; V834-N837 PolarHBondContact O-N 3.24Å; L835-N837 PolarHBondContact O-N 2.88Å
838	Y	81.4	Confident	84.2	Confident	59 Å²	59	50 Å²	50	23%	0.231	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109	9.3	179.7	-59.4	-79.9	0	0	0	113.3	V793 I812 V834 L835 Q836 G840 R841	V793-Y838 HydrophobicContact CB-CD1 4.09Å; V793-Y838 HydrophobicContact CB-CG 4.47Å; V793-Y838 HydrophobicContact CG1-CD1 4.16Å; V793-Y838 HydrophobicContact CG1-CG 4.12Å; V793-Y838 HydrophobicContact CG2-CD1 4.04Å; V793-Y838 HydrophobicContact CG2-CE1 4.13Å; V793-Y838 HydrophobicContact CG2-CG 4.3Å; I812-Y838 HydrophobicContact CD1-CD2 3.84Å; I812-Y838 HydrophobicContact CD1-CE1 4.31Å; I812-Y838 HydrophobicContact CD1-CE2 3.15Å; I812-Y838 VanDerWaalsContact CD1-CZ 3.42Å; V834-Y838 HydrophobicContact CG1-CE2 3.95Å; V834-Y838 WeakPolarHBondContact O-CD2 3.33Å; V834-Y838 WeakPolarHBondContact O-CE2 3.41Å; L835-Y838 PolarHBondContact O-N 2.89Å; L835-Y838 VanDerWaalsContact O-N 3.07Å; Q836-Y838 PolarHBondContact O-N 3.02Å; Q836-Y838 VanDerWaalsContact O-N 3.12Å; Y838-G840 PolarHBondContact O-N 3.05Å; Y838-R841 WeakPolarHBondContact O-CB 2.99Å; Y838-R841 PolarHBondContact O-N 3.05Å
839	R	82.8	Confident	84.4	Confident	142 Å²	142	43 Å²	43	54%	0.536	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	133.4	176	-161.7	171.5	-172.2	172	2.3	110.5	Q836 N864	Q836-R839 WeakPolarHBondContact O-CB 3.42Å; Q836-R839 PolarHBondContact O-N 2.91Å; R839-N864 PolarHBondContact NH2-O 3.24Å
840	G	79.6	Confident	84.7	Confident	31 Å²	31	43.2 Å²	43.2	32%	0.32	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	84	-2.4	-176	0	0	0	0	0	115.4	Y838 R867	Y838-G840 PolarHBondContact O-N 3.05Å; G840-R867 PolarHBondContact O-NH1 3.16Å
841	R	87.3	Confident	85.1	Confident	45 Å²	45	45.9 Å²	45.9	17%	0.17	24%	0.244	C	C	.	.	S	Bend	trans	-92.6	164.3	169.2	-56.3	-161.4	-162.9	-178.4	17.3	111.3	P790 Y838 I843 R867	P790-R841 WeakPolarHBondContact O-CD 3.26Å; P790-R841 PolarHBondContact O-NH1 2.93Å; Y838-R841 WeakPolarHBondContact O-CB 2.99Å; Y838-R841 PolarHBondContact O-N 3.05Å; R841-I843 PolarHBondContact O-N 2.9Å; R841-R867 WeakPolarHBondContact O-CB 3.48Å
842	V	90.4	Very high	85.7	Confident	8 Å²	8	47 Å²	47	5%	0.048	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	117.3	170.2	-177.2	0	0	0	0	108.6	F606 W706 P708 K791 I792 V793 V844 R867	F606-V842 HydrophobicContact CE2-CG1 4.47Å; F606-V842 HydrophobicContact CZ-CG1 4.32Å; F606-V842 HydrophobicContact CZ-CG2 4.31Å; W706-V842 HydrophobicContact CE3-CG2 4.36Å; P708-V842 HydrophobicContact CG-CG1 4.12Å; K791-V842 PolarHBondContact O-N 3.37Å; I792-V842 CarbonylContact C-O 3.51Å; I792-V842 WeakPolarHBondContact CA-O 3.23Å; I792-V842 HydrophobicContact CB-CB 4.4Å; I792-V842 HydrophobicContact CD1-CG1 4.25Å; I792-V842 HydrophobicContact CG1-CB 4.14Å; I792-V842 HydrophobicContact CG1-CG1 4.18Å; V793-V842 PolarHBondContact N-O 3.35Å; V842-V844 HydrophobicContact CG1-CG2 4.32Å; V842-R867 CarbonylContact C-O 3.56Å; V842-R867 WeakPolarHBondContact CA-O 3.33Å; V842-R867 HydrophobicContact CG2-CB 4.34Å
843	I	93.6	Very high	86.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	116.4	-178.6	-59.3	174.6	0	0	0	108	V793 V795 L835 R841 I845 F865 R867 V868 C869	V793-I843 HydrophobicContact CG1-CB 4.35Å; V793-I843 HydrophobicContact CG1-CG1 3.89Å; V795-I843 HydrophobicContact CB-CG2 4.41Å; V795-I843 HydrophobicContact CG2-CG2 3.76Å; L835-I843 HydrophobicContact CD1-CD1 4.45Å; R841-I843 PolarHBondContact O-N 2.9Å; I843-I845 HydrophobicContact CG2-CD1 3.84Å; I843-F865 HydrophobicContact CD1-CD1 3.84Å; I843-R867 PolarHBondContact N-O 2.96Å; I843-V868 CarbonylContact O-C 3.58Å; I843-V868 WeakPolarHBondContact O-CA 3.16Å; I843-C869 PolarHBondContact O-N 3.15Å
844	V	94.3	Very high	86.9	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	115.3	177.9	-178	0	0	0	0	110.1	I765 L770 I792 V793 A794 V795 V842 V846 C869 L871	I765-V844 HydrophobicContact CD1-CG2 4.3Å; I765-V844 HydrophobicContact CG2-CB 4.48Å; I765-V844 HydrophobicContact CG2-CG1 3.59Å; I765-V844 HydrophobicContact CG2-CG2 4.04Å; L770-V844 HydrophobicContact CD1-CB 4.18Å; L770-V844 HydrophobicContact CD1-CG1 4.19Å; L770-V844 HydrophobicContact CD1-CG2 4.04Å; L770-V844 HydrophobicContact CD2-CG1 4.4Å; I792-V844 HydrophobicContact CD1-CG2 3.72Å; I792-V844 HydrophobicContact CG1-CG2 3.92Å; V793-V844 PolarHBondContact O-N 3.09Å; A794-V844 CarbonylContact C-O 3.41Å; A794-V844 WeakPolarHBondContact CA-O 3.45Å; V795-V844 PolarHBondContact N-O 3.05Å; V842-V844 HydrophobicContact CG1-CG2 4.32Å; V844-V846 HydrophobicContact CG1-CG2 4.37Å; V844-C869 CarbonylContact C-O 3.51Å; V844-C869 WeakPolarHBondContact CA-O 3.44Å; V844-C869 HydrophobicContact CG2-CB 4.31Å; V844-L871 HydrophobicContact CG1-CB 4.02Å
845	I	94.9	Very high	87.4	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	122.8	177.7	-52	-52.8	0	0	0	109.5	V795 I797 I843 A853 F856 A857 L860 V868 C869 L871	V795-I845 HydrophobicContact CB-CD1 4.05Å; V795-I845 HydrophobicContact CG1-CD1 4.38Å; V795-I845 WeakPolarHBondContact O-CA 3.39Å; I797-I845 HydrophobicContact CD1-CG2 3.98Å; I797-I845 HydrophobicContact CG1-CG2 4.07Å; I797-I845 HydrophobicContact CG2-CG2 3.88Å; I843-I845 HydrophobicContact CG2-CD1 3.84Å; I845-A853 HydrophobicContact CB-CB 4.38Å; I845-A853 HydrophobicContact CG2-CB 3.74Å; I845-F856 HydrophobicContact CD1-CD1 3.75Å; I845-F856 HydrophobicContact CD1-CE1 3.94Å; I845-F856 HydrophobicContact CG1-CD1 4.23Å; I845-F856 HydrophobicContact CG2-CB 4.46Å; I845-F856 HydrophobicContact CG2-CD1 4.23Å; I845-A857 HydrophobicContact CG1-CB 4.3Å; I845-L860 HydrophobicContact CD1-CD1 3.95Å; I845-V868 HydrophobicContact CG1-CG1 4.07Å; I845-C869 PolarHBondContact N-O 2.98Å; I845-L871 PolarHBondContact O-N 3.35Å
846	V	92.9	Very high	87.8	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.6	-178.5	-179.5	0	0	0	0	109.4	A794 V795 D796 I797 V844 L871 I875	A794-V846 HydrophobicContact CB-CG2 4.23Å; V795-V846 PolarHBondContact O-N 2.95Å; D796-V846 WeakPolarHBondContact CA-O 3.42Å; I797-V846 WeakPolarHBondContact CG1-O 3.42Å; I797-V846 PolarHBondContact N-O 3.46Å; V844-V846 HydrophobicContact CG1-CG2 4.37Å; V846-L871 HydrophobicContact CG1-CD2 4.1Å; V846-L871 HydrophobicContact CG2-CB 4.27Å; V846-L871 HydrophobicContact CG2-CD2 4.06Å; V846-I875 HydrophobicContact CG1-CB 3.87Å; V846-I875 HydrophobicContact CG1-CD1 3.64Å; V846-I875 HydrophobicContact CG1-CG1 4.32Å
847	S	91.7	Very high	88.3	Confident	5 Å²	5	44 Å²	44	4%	0.035	23%	0.229	C	C	.	.			trans	-146.9	175.7	-180	79.6	0	0	0	0	112.1	A849 G874 I875	S847-A849 VanDerWaalsContact OG-C 3.23Å; S847-A849 PolarHBondContact OG-N 3.29Å; S847-A849 PolarHBondContact OG-O 2.93Å; S847-G874 CarbonylContact O-C 3.59Å; S847-G874 VanDerWaalsContact O-CA 3.24Å; S847-G874 WeakPolarHBondContact O-CA 3.24Å; S847-I875 PolarHBondContact O-N 3.32Å
848	H	84.6	Confident	88.8	Confident	86 Å²	86	39.8 Å²	39.8	40%	0.398	21%	0.211	S	C	.	.	S	Bend	trans	-83.2	-44	163.3	-76.9	-56.4	0	0	0	112.1	R798 I875	R798-H848 WeakPolarHBondContact CD-CD2 3.28Å; R798-H848 VanDerWaalsContact CD-NE2 3.27Å; R798-H848 WeakPolarHBondContact CD-NE2 3.41Å; R798-H848 PolarHBondContact NH1-NE2 3.41Å; H848-I875 WeakPolarHBondContact CE1-CG2 3.48Å; H848-I875 WeakPolarHBondContact ND1-CG2 3.4Å
849	A	79.1	Confident	89.3	Confident	49 Å²	49	39.6 Å²	39.6	41%	0.405	21%	0.211	S	C	.	.	S	Bend	trans	-101.9	118.7	-178.7	0	0	0	0	0	110.6	S847 K851 S852 A853	S847-A849 VanDerWaalsContact OG-C 3.23Å; S847-A849 PolarHBondContact OG-N 3.29Å; S847-A849 PolarHBondContact OG-O 2.93Å; A849-K851 PolarHBondContact O-N 2.89Å; A849-S852 PolarHBondContact O-N 3.19Å; A849-S852 VanDerWaalsContact O-N 3.1Å; A849-A853 PolarHBondContact O-N 3.36Å
850	V	81.3	Confident	89.8	Confident	37 Å²	37	32.8 Å²	32.8	22%	0.224	19%	0.186	C	C	.	.	H	α-helix	trans	-59.5	-36.1	-178.4	-175.9	0	0	0	0	111.8	R764 S852 A853 A854	R764-V850 VanDerWaalsContact NH2-CG1 3.33Å; V850-S852 VanDerWaalsContact C-N 3.34Å; V850-S852 PolarHBondContact O-N 3.45Å; V850-A853 PolarHBondContact O-N 2.8Å; V850-A853 VanDerWaalsContact O-N 3.12Å; V850-A854 PolarHBondContact O-N 3.12Å
851	K	86.1	Confident	90.4	Very high	175 Å²	175	31.4 Å²	31.4	76%	0.761	17%	0.171	S	C	*	.	H	α-helix	trans	-57.7	-42.4	175.4	-66.9	-172.9	178.5	-175.6	0	113	A849 A853 A854 L855	A849-K851 PolarHBondContact O-N 2.89Å; K851-A853 VanDerWaalsContact C-N 3.34Å; K851-A854 PolarHBondContact O-N 3.01Å; K851-L855 WeakPolarHBondContact O-CG 3.41Å; K851-L855 PolarHBondContact O-N 2.62Å
852	S	88.7	Confident	90.7	Very high	46 Å²	46	35.5 Å²	35.5	32%	0.322	19%	0.19	S	C	.	.	H	α-helix	trans	-67.2	-36.9	177.5	-55.7	0	0	0	0	111.6	F816 A849 V850 F856	F816-S852 VanDerWaalsContact CE2-O 3.32Å; F816-S852 WeakPolarHBondContact CE2-O 3.15Å; A849-S852 PolarHBondContact O-N 3.19Å; A849-S852 VanDerWaalsContact O-N 3.1Å; V850-S852 VanDerWaalsContact C-N 3.34Å; V850-S852 PolarHBondContact O-N 3.45Å; S852-F856 WeakPolarHBondContact O-CB 3.47Å; S852-F856 PolarHBondContact O-N 3.3Å
853	A	91.5	Very high	90.7	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-67.7	-41.9	175.5	0	0	0	0	0	111.8	I797 I845 A849 V850 K851 F856 A857 I870	I797-A853 HydrophobicContact CD1-CB 4.42Å; I845-A853 HydrophobicContact CB-CB 4.38Å; I845-A853 HydrophobicContact CG2-CB 3.74Å; A849-A853 PolarHBondContact O-N 3.36Å; V850-A853 PolarHBondContact O-N 2.8Å; V850-A853 VanDerWaalsContact O-N 3.12Å; K851-A853 VanDerWaalsContact C-N 3.34Å; A853-F856 PolarHBondContact O-N 3.06Å; A853-A857 VanDerWaalsContact O-CB 3.27Å; A853-A857 WeakPolarHBondContact O-CB 3.36Å; A853-A857 PolarHBondContact O-N 2.87Å; A853-I870 HydrophobicContact CB-CG1 4.48Å; A853-I870 HydrophobicContact CB-CG2 3.63Å
854	A	92.4	Very high	90.7	Very high	21 Å²	21	39.8 Å²	39.8	17%	0.174	21%	0.214	C	C	.	.	H	α-helix	trans	-61.5	-45.2	176.4	0	0	0	0	0	112.5	E760 V850 K851 A857 A858 I870	E760-A854 HydrophobicContact CG-CB 4.14Å; V850-A854 PolarHBondContact O-N 3.12Å; K851-A854 PolarHBondContact O-N 3.01Å; A854-A857 PolarHBondContact O-N 3.03Å; A854-A858 WeakPolarHBondContact O-CB 3.19Å; A854-A858 PolarHBondContact O-N 3.18Å; A854-I870 HydrophobicContact CB-CD1 4Å
855	L	91.8	Very high	90.6	Very high	96 Å²	96	39.9 Å²	39.9	50%	0.503	22%	0.215	S	C	.	.	H	α-helix	trans	-62.4	-46.5	175.3	-71.7	171.6	0	0	0	111.8	F816 K851 A857 A858 H859	F816-L855 HydrophobicContact CE2-CB 4.1Å; F816-L855 HydrophobicContact CZ-CB 4.21Å; K851-L855 WeakPolarHBondContact O-CG 3.41Å; K851-L855 PolarHBondContact O-N 2.62Å; L855-A857 VanDerWaalsContact C-N 3.33Å; L855-A857 PolarHBondContact O-N 3.37Å; L855-A858 PolarHBondContact O-N 2.92Å; L855-H859 PolarHBondContact O-CD2 3.49Å; L855-H859 PolarHBondContact O-N 3.41Å
856	F	92.8	Very high	90.5	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-43.3	178.6	-166.1	-86.4	0	0	0	111.5	I797 I814 F816 F820 I845 S852 A853 H859 L860	I797-F856 HydrophobicContact CD1-CB 4.13Å; I797-F856 HydrophobicContact CD1-CG 4.45Å; I797-F856 HydrophobicContact CG2-CD1 3.88Å; I797-F856 HydrophobicContact CG2-CD2 3.93Å; I797-F856 HydrophobicContact CG2-CE1 3.88Å; I797-F856 HydrophobicContact CG2-CE2 3.96Å; I797-F856 HydrophobicContact CG2-CG 3.9Å; I797-F856 HydrophobicContact CG2-CZ 3.94Å; I814-F856 HydrophobicContact CG2-CZ 4.07Å; F816-F856 HydrophobicContact CD2-CB 3.94Å; F816-F856 AromaticContact CD2-CD2 3.72Å; F816-F856 HydrophobicContact CD2-CD2 3.72Å; F816-F856 HydrophobicContact CD2-CG 4.31Å; F816-F856 HydrophobicContact CE2-CB 3.9Å; F816-F856 HydrophobicContact CE2-CD2 4.23Å; F816-F856 HydrophobicContact CG-CD2 4.42Å; F820-F856 AromaticContact CD2-CD2 3.99Å; F820-F856 HydrophobicContact CD2-CD2 3.99Å; F820-F856 AromaticContact CD2-CE2 3.91Å; F820-F856 HydrophobicContact CD2-CE2 3.91Å; F820-F856 HydrophobicContact CE2-CD1 4.29Å; F820-F856 AromaticContact CE2-CD2 3.45Å; F820-F856 HydrophobicContact CE2-CD2 3.45Å; F820-F856 VanDerWaalsContact CE2-CD2 3.45Å; F820-F856 HydrophobicContact CE2-CE1 4.23Å; F820-F856 AromaticContact CE2-CE2 3.36Å; F820-F856 HydrophobicContact CE2-CE2 3.36Å; F820-F856 AromaticContact CE2-CG 3.92Å; F820-F856 HydrophobicContact CE2-CG 3.92Å; F820-F856 AromaticContact CE2-CZ 3.78Å; F820-F856 HydrophobicContact CE2-CZ 3.78Å; F820-F856 HydrophobicContact CZ-CE2 4.37Å; F820-F856 HydrophobicContact CZ-CZ 4.39Å; I845-F856 HydrophobicContact CD1-CD1 3.75Å; I845-F856 HydrophobicContact CD1-CE1 3.94Å; I845-F856 HydrophobicContact CG1-CD1 4.23Å; I845-F856 HydrophobicContact CG2-CB 4.46Å; I845-F856 HydrophobicContact CG2-CD1 4.23Å; S852-F856 WeakPolarHBondContact O-CB 3.47Å; S852-F856 PolarHBondContact O-N 3.3Å; A853-F856 PolarHBondContact O-N 3.06Å; F856-H859 PolarHBondContact O-N 3.45Å; F856-L860 HydrophobicContact CD1-CD1 4.01Å; F856-L860 HydrophobicContact CD1-CG 4.21Å; F856-L860 HydrophobicContact CE1-CD1 3.78Å; F856-L860 HydrophobicContact CE1-CD2 4.43Å; F856-L860 HydrophobicContact CE1-CG 4.09Å; F856-L860 WeakPolarHBondContact O-CG 3.34Å; F856-L860 PolarHBondContact O-N 3.42Å; F856-L860 VanDerWaalsContact O-N 3.09Å
857	A	94.3	Very high	90.6	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-44.2	176.3	0	0	0	0	0	111.9	I845 A853 A854 L855 H859 L860 V861 V868 I870	I845-A857 HydrophobicContact CG1-CB 4.3Å; A853-A857 VanDerWaalsContact O-CB 3.27Å; A853-A857 WeakPolarHBondContact O-CB 3.36Å; A853-A857 PolarHBondContact O-N 2.87Å; A854-A857 PolarHBondContact O-N 3.03Å; L855-A857 VanDerWaalsContact C-N 3.33Å; L855-A857 PolarHBondContact O-N 3.37Å; A857-H859 VanDerWaalsContact C-N 3.33Å; A857-H859 PolarHBondContact O-N 3.02Å; A857-L860 WeakPolarHBondContact O-CB 3.27Å; A857-L860 PolarHBondContact O-N 2.92Å; A857-L860 VanDerWaalsContact O-N 3.13Å; A857-V861 WeakPolarHBondContact O-CG2 3.24Å; A857-V861 PolarHBondContact O-N 3.41Å; A857-V868 HydrophobicContact CB-CG1 3.73Å; A857-I870 HydrophobicContact CB-CD1 4.15Å; A857-I870 HydrophobicContact CB-CG1 3.91Å
858	A	93.9	Very high	90.7	Very high	33 Å²	33	42.7 Å²	42.7	27%	0.273	23%	0.228	S	C	.	.	H	α-helix	trans	-60.4	-40.7	176.2	0	0	0	0	0	112.3	V761 A854 L855 L860 V861 K862	V761-A858 HydrophobicContact CG2-CB 4.41Å; A854-A858 WeakPolarHBondContact O-CB 3.19Å; A854-A858 PolarHBondContact O-N 3.18Å; L855-A858 PolarHBondContact O-N 2.92Å; A858-L860 VanDerWaalsContact C-N 3.35Å; A858-L860 PolarHBondContact O-N 3Å; A858-V861 PolarHBondContact O-N 2.91Å; A858-K862 WeakPolarHBondContact O-CB 3.42Å; A858-K862 PolarHBondContact O-N 3.29Å
859	H	91.9	Very high	91.2	Very high	54 Å²	54	38.6 Å²	38.6	25%	0.25	21%	0.209	C	C	.	.	H	α-helix	trans	-63.1	-39.5	174	-74.6	-65.7	0	0	0	112.6	F820 L855 F856 A857 K862 V863	F820-H859 HydrophobicContact CD1-CB 3.93Å; F820-H859 HydrophobicContact CD2-CB 4.17Å; F820-H859 HydrophobicContact CE1-CB 3.52Å; F820-H859 HydrophobicContact CE2-CB 3.75Å; F820-H859 HydrophobicContact CG-CB 4.23Å; F820-H859 HydrophobicContact CZ-CB 3.41Å; F820-H859 VanDerWaalsContact CZ-CB 3.41Å; L855-H859 PolarHBondContact O-CD2 3.49Å; L855-H859 PolarHBondContact O-N 3.41Å; F856-H859 PolarHBondContact O-N 3.45Å; A857-H859 VanDerWaalsContact C-N 3.33Å; A857-H859 PolarHBondContact O-N 3.02Å; H859-K862 PolarHBondContact O-N 3.25Å; H859-V863 WeakPolarHBondContact O-CG2 3.26Å; H859-V863 PolarHBondContact O-N 3Å
860	L	92.3	Very high	92	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.5	-43.3	175.4	-70.8	-174.1	0	0	0	112.8	F820 L835 I845 F856 A857 A858 K862 V863 N864 F865 V868	F820-L860 HydrophobicContact CE1-CD2 4.28Å; F820-L860 HydrophobicContact CZ-CD2 3.63Å; F820-L860 HydrophobicContact CZ-CG 4.04Å; L835-L860 HydrophobicContact CD2-CD1 4.33Å; L835-L860 HydrophobicContact CD2-CD2 3.37Å; I845-L860 HydrophobicContact CD1-CD1 3.95Å; F856-L860 HydrophobicContact CD1-CD1 4.01Å; F856-L860 HydrophobicContact CD1-CG 4.21Å; F856-L860 HydrophobicContact CE1-CD1 3.78Å; F856-L860 HydrophobicContact CE1-CD2 4.43Å; F856-L860 HydrophobicContact CE1-CG 4.09Å; F856-L860 WeakPolarHBondContact O-CG 3.34Å; F856-L860 PolarHBondContact O-N 3.42Å; F856-L860 VanDerWaalsContact O-N 3.09Å; A857-L860 WeakPolarHBondContact O-CB 3.27Å; A857-L860 PolarHBondContact O-N 2.92Å; A857-L860 VanDerWaalsContact O-N 3.13Å; A858-L860 VanDerWaalsContact C-N 3.35Å; A858-L860 PolarHBondContact O-N 3Å; L860-K862 VanDerWaalsContact C-N 3.34Å; L860-V863 CarbonylContact O-C 3.4Å; L860-V863 WeakPolarHBondContact O-CG2 3.32Å; L860-V863 PolarHBondContact O-N 3.5Å; L860-N864 PolarHBondContact O-N 2.64Å; L860-F865 HydrophobicContact CB-CB 4.08Å; L860-F865 HydrophobicContact CD2-CD2 4.08Å; L860-F865 HydrophobicContact CD2-CE2 4.36Å; L860-F865 HydrophobicContact CD2-CG 4.37Å; L860-F865 WeakPolarHBondContact O-CB 3.32Å; L860-F865 PolarHBondContact O-N 3.07Å; L860-V868 HydrophobicContact CB-CG1 4.48Å; L860-V868 HydrophobicContact CB-CG2 4.04Å; L860-V868 HydrophobicContact CD1-CG1 4.2Å; L860-V868 HydrophobicContact CD1-CG2 4.28Å
861	V	93.7	Very high	92.5	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-62.8	-42.7	175.8	174	0	0	0	0	110.6	A605 P609 N613 V761 S762 A857 A858 V863 N864 V868	A605-V861 HydrophobicContact CB-CG1 4.25Å; P609-V861 HydrophobicContact CB-CG1 3.86Å; N613-V861 PolarHBondContact ND2-O 3.06Å; V761-V861 HydrophobicContact CG1-CB 4.15Å; V761-V861 HydrophobicContact CG1-CG1 3.74Å; V761-V861 HydrophobicContact CG1-CG2 4.27Å; S762-V861 WeakPolarHBondContact OG-CG2 3.4Å; A857-V861 WeakPolarHBondContact O-CG2 3.24Å; A857-V861 PolarHBondContact O-N 3.41Å; A858-V861 PolarHBondContact O-N 2.91Å; V861-V863 PolarHBondContact O-N 3.01Å; V861-N864 WeakPolarHBondContact O-CA 3.34Å; V861-N864 PolarHBondContact O-N 2.94Å; V861-V868 HydrophobicContact CG2-CB 4.38Å
862	K	92.9	Very high	92.7	Very high	130 Å²	130	26.6 Å²	26.6	57%	0.565	15%	0.145	S	C	*	.	H	α-helix	trans	-58.3	-33.1	177.3	-171	178.5	-179.3	-174.5	0	113.1	A858 H859 L860 N864	A858-K862 WeakPolarHBondContact O-CB 3.42Å; A858-K862 PolarHBondContact O-N 3.29Å; H859-K862 PolarHBondContact O-N 3.25Å; L860-K862 VanDerWaalsContact C-N 3.34Å; K862-N864 VanDerWaalsContact C-N 3.32Å
863	V	90.8	Very high	92.6	Very high	44 Å²	44	25.5 Å²	25.5	27%	0.267	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	24.7	175.2	-55	0	0	0	0	113	L826 H859 L860 V861 F865	L826-V863 HydrophobicContact CD1-CG2 4.03Å; H859-V863 WeakPolarHBondContact O-CG2 3.26Å; H859-V863 PolarHBondContact O-N 3Å; L860-V863 CarbonylContact O-C 3.4Å; L860-V863 WeakPolarHBondContact O-CG2 3.32Å; L860-V863 PolarHBondContact O-N 3.5Å; V861-V863 PolarHBondContact O-N 3.01Å; V863-F865 HydrophobicContact CG2-CD2 3.71Å; V863-F865 HydrophobicContact CG2-CE2 3.94Å; V863-F865 PolarHBondContact O-N 3.43Å
864	N	92.3	Very high	92.5	Very high	54 Å²	54	25.4 Å²	25.4	29%	0.289	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	63	35.1	171.1	-58.4	-33.3	0	0	0	115.3	P609 E610 N613 R839 L860 V861 K862	P609-N864 HydrophobicContact CG-CB 4.4Å; E610-N864 VanDerWaalsContact CA-OD1 3.32Å; E610-N864 WeakPolarHBondContact CA-OD1 3.34Å; E610-N864 PolarHBondContact N-OD1 3.02Å; N613-N864 PolarHBondContact ND2-OD1 2.69Å; N613-N864 VanDerWaalsContact ND2-OD1 3.13Å; R839-N864 PolarHBondContact NH2-O 3.24Å; L860-N864 PolarHBondContact O-N 2.64Å; V861-N864 WeakPolarHBondContact O-CA 3.34Å; V861-N864 PolarHBondContact O-N 2.94Å; K862-N864 VanDerWaalsContact C-N 3.32Å
865	F	92.4	Very high	92.3	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.009	13%	0.133	C	C	.	.			trans	-81.6	117.2	162.4	-78.9	-99.9	0	0	0	110	L826 L835 I843 L860 V863 V868	L826-F865 HydrophobicContact CD1-CE2 4.37Å; L835-F865 HydrophobicContact CD2-CE1 4.13Å; L835-F865 HydrophobicContact CD2-CE2 4.45Å; L835-F865 HydrophobicContact CD2-CZ 3.99Å; L835-F865 HydrophobicContact CG-CE1 3.82Å; L835-F865 HydrophobicContact CG-CZ 4.03Å; I843-F865 HydrophobicContact CD1-CD1 3.84Å; L860-F865 HydrophobicContact CB-CB 4.08Å; L860-F865 HydrophobicContact CD2-CD2 4.08Å; L860-F865 HydrophobicContact CD2-CE2 4.36Å; L860-F865 HydrophobicContact CD2-CG 4.37Å; L860-F865 WeakPolarHBondContact O-CB 3.32Å; L860-F865 PolarHBondContact O-N 3.07Å; V863-F865 HydrophobicContact CG2-CD2 3.71Å; V863-F865 HydrophobicContact CG2-CE2 3.94Å; V863-F865 PolarHBondContact O-N 3.43Å; F865-V868 HydrophobicContact CB-CG2 3.96Å; F865-V868 WeakPolarHBondContact O-CG2 3.37Å
866	S	93.2	Very high	92.1	Very high	23 Å²	23	22.6 Å²	22.6	16%	0.161	13%	0.128	C	C	.	.			trans	-78.2	160	172.6	63	0	0	0	0	111.1
867	R	94.1	Very high	91.9	Very high	42 Å²	42	23.8 Å²	23.8	16%	0.158	13%	0.133	C	C	.	.	S	Bend	trans	64.1	36.6	168.5	-55.9	173.6	-177.8	178.2	-9.5	114	F606 W706 G840 R841 V842 I843	F606-R867 HydrophobicContact CD1-CG 4.34Å; F606-R867 HydrophobicContact CD2-CB 4.45Å; F606-R867 HydrophobicContact CE1-CB 4.08Å; F606-R867 HydrophobicContact CE1-CG 3.86Å; F606-R867 HydrophobicContact CE2-CB 3.84Å; F606-R867 HydrophobicContact CE2-CG 4.5Å; F606-R867 HydrophobicContact CZ-CB 3.65Å; F606-R867 HydrophobicContact CZ-CG 3.95Å; F606-R867 VanDerWaalsContact O-CA 3.27Å; F606-R867 WeakPolarHBondContact O-CA 3.45Å; F606-R867 PolarHBondContact O-N 3.46Å; W706-R867 VanDerWaalsContact CD1-NH2 3.33Å; W706-R867 VanDerWaalsContact CD2-CZ 3.45Å; W706-R867 VanDerWaalsContact CG-NH2 3.29Å; G840-R867 PolarHBondContact O-NH1 3.16Å; R841-R867 WeakPolarHBondContact O-CB 3.48Å; V842-R867 CarbonylContact C-O 3.56Å; V842-R867 WeakPolarHBondContact CA-O 3.33Å; V842-R867 HydrophobicContact CG2-CB 4.34Å; I843-R867 PolarHBondContact N-O 2.96Å
868	V	95.2	Very high	91.5	Very high	1 Å²	1	24 Å²	24	1%	0.006	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	126.8	177.4	-174.9	0	0	0	0	109.5	S762 I843 I845 A857 L860 V861 F865	S762-V868 WeakPolarHBondContact CB-O 3.39Å; I843-V868 CarbonylContact O-C 3.58Å; I843-V868 WeakPolarHBondContact O-CA 3.16Å; I845-V868 HydrophobicContact CG1-CG1 4.07Å; A857-V868 HydrophobicContact CB-CG1 3.73Å; L860-V868 HydrophobicContact CB-CG1 4.48Å; L860-V868 HydrophobicContact CB-CG2 4.04Å; L860-V868 HydrophobicContact CD1-CG1 4.2Å; L860-V868 HydrophobicContact CD1-CG2 4.28Å; V861-V868 HydrophobicContact CG2-CB 4.38Å; F865-V868 HydrophobicContact CB-CG2 3.96Å; F865-V868 WeakPolarHBondContact O-CG2 3.37Å
869	C	94.8	Very high	91	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	160	175.6	-76.5	0	0	0	0	110.8	F606 P763 I765 I843 V844 I845	F606-C869 WeakPolarHBondContact CE2-SG 3.38Å; P763-C869 CarbonylContact O-C 3.51Å; P763-C869 VanDerWaalsContact O-CA 3.26Å; P763-C869 WeakPolarHBondContact O-CA 3.43Å; I765-C869 HydrophobicContact CB-CB 4.32Å; I765-C869 HydrophobicContact CG2-CB 4.23Å; I843-C869 PolarHBondContact O-N 3.15Å; V844-C869 CarbonylContact C-O 3.51Å; V844-C869 WeakPolarHBondContact CA-O 3.44Å; V844-C869 HydrophobicContact CG2-CB 4.31Å; I845-C869 PolarHBondContact N-O 2.98Å
870	I	94.9	Very high	90.6	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.1	173.5	-58.5	156.4	0	0	0	109.2	P763 R764 I765 A853 A854 A857 D872	P763-I870 PolarHBondContact O-N 3.48Å; R764-I870 CarbonylContact C-O 3.43Å; R764-I870 VanDerWaalsContact CA-O 3.23Å; R764-I870 WeakPolarHBondContact CA-O 3.46Å; R764-I870 HydrophobicContact CG-CB 4.32Å; I765-I870 PolarHBondContact N-O 3.39Å; A853-I870 HydrophobicContact CB-CG1 4.48Å; A853-I870 HydrophobicContact CB-CG2 3.63Å; A854-I870 HydrophobicContact CB-CD1 4Å; A857-I870 HydrophobicContact CB-CD1 4.15Å; A857-I870 HydrophobicContact CB-CG1 3.91Å; I870-D872 PolarHBondContact O-N 3.32Å
871	L	93.4	Very high	90.1	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.01	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	118.4	172.6	178	60.3	0	0	0	110.4	A767 L770 V844 I845 V846 G873 G874 L878	A767-L871 HydrophobicContact CB-CD1 4.4Å; L770-L871 HydrophobicContact CB-CD1 4.48Å; L770-L871 HydrophobicContact CD2-CD1 3.84Å; L770-L871 HydrophobicContact CD2-CD2 4.05Å; L770-L871 HydrophobicContact CD2-CG 4.47Å; V844-L871 HydrophobicContact CG1-CB 4.02Å; I845-L871 PolarHBondContact O-N 3.35Å; V846-L871 HydrophobicContact CG1-CD2 4.1Å; V846-L871 HydrophobicContact CG2-CB 4.27Å; V846-L871 HydrophobicContact CG2-CD2 4.06Å; L871-G873 PolarHBondContact O-N 2.78Å; L871-G874 WeakPolarHBondContact CD2-O 3.26Å; L871-G874 PolarHBondContact O-N 3.39Å; L871-G874 VanDerWaalsContact O-N 3.15Å; L871-L878 HydrophobicContact CD2-CD1 3.79Å; L871-L878 HydrophobicContact CD2-CG 4.37Å
872	D	90.4	Very high	89.4	Confident	4 Å²	4	35.9 Å²	35.9	2%	0.021	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	134	176.6	-170.5	58.8	0	0	0	111	R749 E750 R764 I765 I870 G874 K877	R749-D872 HydrophobicContact CG-CB 4.4Å; E750-D872 PolarHBondContact N-OD2 3Å; R764-D872 HydrophobicContact CB-CB 4.4Å; R764-D872 WeakPolarHBondContact CD-OD1 3.16Å; R764-D872 IonicContact CZ-OD1 2.99Å; R764-D872 IonicContact NH1-OD1 3.85Å; R764-D872 PolarHBondContact NH1-OD1 3.06Å; I765-D872 WeakPolarHBondContact O-CB 3.4Å; I765-D872 PolarHBondContact O-N 3.24Å; I870-D872 PolarHBondContact O-N 3.32Å; D872-G874 PolarHBondContact O-N 2.77Å; D872-K877 WeakPolarHBondContact O-CD 3.36Å; D872-K877 IonicContact OD2-NZ 3.5Å; D872-K877 PolarHBondContact OD2-NZ 3.27Å
873	G	86.4	Confident	88.9	Confident	23 Å²	23	31.5 Å²	31.5	24%	0.237	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.7	6.2	-176.1	0	0	0	0	0	115.9	L871 S876	L871-G873 PolarHBondContact O-N 2.78Å; G873-S876 PolarHBondContact O-OG 2.71Å
874	G	89.1	Confident	88.7	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	62.4	-164	176.1	0	0	0	0	0	114.6	S847 L871 D872 S876 K877	S847-G874 CarbonylContact O-C 3.59Å; S847-G874 VanDerWaalsContact O-CA 3.24Å; S847-G874 WeakPolarHBondContact O-CA 3.24Å; L871-G874 WeakPolarHBondContact CD2-O 3.26Å; L871-G874 PolarHBondContact O-N 3.39Å; L871-G874 VanDerWaalsContact O-N 3.15Å; D872-G874 PolarHBondContact O-N 2.77Å; G874-S876 PolarHBondContact O-N 3.21Å; G874-S876 VanDerWaalsContact O-N 3.1Å; G874-K877 PolarHBondContact O-N 3.27Å
875	I	88.8	Confident	88.2	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-61	-22.2	-178.9	-164.9	74.4	0	0	0	112.8	V808 V846 S847 H848 K877 L878 L884	V808-I875 HydrophobicContact CG2-CD1 3.92Å; V846-I875 HydrophobicContact CG1-CB 3.87Å; V846-I875 HydrophobicContact CG1-CD1 3.64Å; V846-I875 HydrophobicContact CG1-CG1 4.32Å; S847-I875 PolarHBondContact O-N 3.32Å; H848-I875 WeakPolarHBondContact CE1-CG2 3.48Å; H848-I875 WeakPolarHBondContact ND1-CG2 3.4Å; I875-K877 VanDerWaalsContact C-N 3.33Å; I875-K877 PolarHBondContact O-N 3.4Å; I875-L878 HydrophobicContact CD1-CD1 4.36Å; I875-L878 PolarHBondContact O-N 3.36Å; I875-L884 HydrophobicContact CD1-CD2 3.74Å; I875-L884 HydrophobicContact CG1-CD1 4.38Å; I875-L884 HydrophobicContact CG1-CD2 4.34Å
876	S	87.3	Confident	87.7	Confident	57 Å²	57	35.6 Å²	35.6	40%	0.399	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-59.5	-38.9	177.4	16.5	0	0	0	0	113.3	G873 G874 L878 K879	G873-S876 PolarHBondContact O-OG 2.71Å; G874-S876 PolarHBondContact O-N 3.21Å; G874-S876 VanDerWaalsContact O-N 3.1Å; S876-L878 PolarHBondContact O-N 2.88Å; S876-K879 WeakPolarHBondContact O-CB 3.27Å; S876-K879 PolarHBondContact O-N 3.1Å; S876-K879 VanDerWaalsContact O-N 3.12Å
877	K	87.4	Confident	86.5	Confident	25 Å²	25	37.8 Å²	37.8	11%	0.109	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-63.8	-22	178.7	-81.8	-160.4	177.8	-176.1	0	112.8	L747 S748 E750 A767 D872 G874 I875	L747-K877 WeakPolarHBondContact CD2-O 3.36Å; S748-K877 PolarHBondContact O-NZ 3.12Å; E750-K877 WeakPolarHBondContact OE1-CE 3.4Å; E750-K877 IonicContact OE1-NZ 2.81Å; E750-K877 PolarHBondContact OE1-NZ 3.31Å; A767-K877 HydrophobicContact CB-CB 4.29Å; D872-K877 WeakPolarHBondContact O-CD 3.36Å; D872-K877 IonicContact OD2-NZ 3.5Å; D872-K877 PolarHBondContact OD2-NZ 3.27Å; G874-K877 PolarHBondContact O-N 3.27Å; I875-K877 VanDerWaalsContact C-N 3.33Å; I875-K877 PolarHBondContact O-N 3.4Å
878	L	86.3	Confident	84.8	Confident	6 Å²	6	40.8 Å²	40.8	3%	0.031	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-90.5	-9.4	177.8	-66.2	172.3	0	0	0	113.9	A767 L770 I771 V808 L871 I875 S876 T881 L884	A767-L878 HydrophobicContact CB-CD2 3.8Å; A767-L878 HydrophobicContact CB-CG 4.41Å; L770-L878 HydrophobicContact CD2-CD1 4.12Å; I771-L878 HydrophobicContact CD1-CD2 3.88Å; I771-L878 HydrophobicContact CG1-CD2 4.06Å; V808-L878 HydrophobicContact CG2-CD1 3.57Å; L871-L878 HydrophobicContact CD2-CD1 3.79Å; L871-L878 HydrophobicContact CD2-CG 4.37Å; I875-L878 HydrophobicContact CD1-CD1 4.36Å; I875-L878 PolarHBondContact O-N 3.36Å; S876-L878 PolarHBondContact O-N 2.88Å; L878-T881 PolarHBondContact O-N 2.68Å; L878-T881 PolarHBondContact O-OG1 2.98Å; L878-L884 HydrophobicContact CB-CD2 4Å
879	K	83.9	Confident	82.9	Confident	127 Å²	127	46.2 Å²	46.2	55%	0.552	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-62.1	-42.9	179.9	-68.8	-179.2	176.9	-176.8	0	113.7	S876 T881 L884	S876-K879 WeakPolarHBondContact O-CB 3.27Å; S876-K879 PolarHBondContact O-N 3.1Å; S876-K879 VanDerWaalsContact O-N 3.12Å; K879-T881 PolarHBondContact O-N 3.49Å; K879-L884 HydrophobicContact CG-CD1 3.99Å
880	P	82.3	Confident	80.7	Confident	115 Å²	115	55.6 Å²	55.6	75%	0.747	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-67.2	-18.1	-178.5	-20.9	34.2	0	0	0	114.3
881	T	81.9	Confident	78	Confident	29 Å²	29	66.5 Å²	66.5	18%	0.178	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-81.3	-16	-174.5	69.3	0	0	0	0	113.4	L747 I771 L878 K879 L883	L747-T881 HydrophobicContact CD1-CG2 3.75Å; L747-T881 HydrophobicContact CD2-CG2 3.57Å; L747-T881 HydrophobicContact CG-CG2 4.27Å; I771-T881 HydrophobicContact CD1-CG2 4.25Å; L878-T881 PolarHBondContact O-N 2.68Å; L878-T881 PolarHBondContact O-OG1 2.98Å; K879-T881 PolarHBondContact O-N 3.49Å; T881-L883 PolarHBondContact O-N 3.45Å; T881-L883 WeakPolarHBondContact OG1-CB 3.2Å; T881-L883 WeakPolarHBondContact OG1-CG 3.25Å; T881-L883 PolarHBondContact OG1-N 3.33Å
882	G	79.9	Confident	77.2	Confident	67 Å²	67	69.7 Å²	69.7	69%	0.691	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	8.5	-174.5	0	0	0	0	0	114.6	L884	G882-L884 VanDerWaalsContact C-N 3.28Å; G882-L884 PolarHBondContact O-N 3.18Å
883	L	82.6	Confident	76.6	Confident	37 Å²	37	73.2 Å²	73.2	19%	0.194	44%	0.436	C	S	.	.			trans	-84.2	2.4	-176.7	-63.6	173.7	0	0	0	114	I771 L776 L778 T881	I771-L883 HydrophobicContact CD1-CD1 3.69Å; I771-L883 HydrophobicContact CG1-CD1 3.78Å; I771-L883 HydrophobicContact CG2-CD1 4.02Å; L776-L883 HydrophobicContact CB-CD1 4.35Å; L778-L883 HydrophobicContact CD2-CD1 4.03Å; L778-L883 HydrophobicContact CD2-CD2 4.42Å; L778-L883 HydrophobicContact CD2-CG 4.35Å; T881-L883 PolarHBondContact O-N 3.45Å; T881-L883 WeakPolarHBondContact OG1-CB 3.2Å; T881-L883 WeakPolarHBondContact OG1-CG 3.25Å; T881-L883 PolarHBondContact OG1-N 3.33Å
884	L	85.5	Confident	76	Confident	38 Å²	38	75.9 Å²	75.9	20%	0.199	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	126.2	178.7	-60.5	-177.7	0	0	0	110.5	H807 V808 I875 L878 K879 G882	H807-L884 CarbonylContact O-C 3.41Å; H807-L884 WeakPolarHBondContact O-CA 3.5Å; V808-L884 HydrophobicContact CG2-CD2 4.2Å; I875-L884 HydrophobicContact CD1-CD2 3.74Å; I875-L884 HydrophobicContact CG1-CD1 4.38Å; I875-L884 HydrophobicContact CG1-CD2 4.34Å; L878-L884 HydrophobicContact CB-CD2 4Å; K879-L884 HydrophobicContact CG-CD1 3.99Å; G882-L884 VanDerWaalsContact C-N 3.28Å; G882-L884 PolarHBondContact O-N 3.18Å
885	T	83.3	Confident	75.2	Confident	56 Å²	56	80.4 Å²	80.4	34%	0.344	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	124.2	173.2	-56.4	0	0	0	0	109.4	G806 H807 S809	G806-T885 WeakPolarHBondContact CA-O 3.37Å; H807-T885 PolarHBondContact CE1-O 2.98Å; H807-T885 PolarHBondContact N-O 3.14Å; H807-T885 PolarHBondContact ND1-O 2.97Å; H807-T885 PolarHBondContact O-N 2.97Å; S809-T885 WeakPolarHBondContact CB-OG1 3.42Å
886	V	82.1	Confident	74.4	Confident	93 Å²	93	85.4 Å²	85.4	56%	0.564	50%	0.502	S	S	*	.			trans	-107.3	125.9	171.6	-171.9	0	0	0	0	107.3	S888	V886-S888 PolarHBondContact O-N 3.17Å
887	P	67.1	Low	73.5	Confident	68 Å²	68	87.3 Å²	87.3	44%	0.442	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-55.6	131.5	173.3	-17.1	29.1	0	0	0	109.7	G804	G804-P887 WeakPolarHBondContact O-CD 3.4Å; G804-P887 WeakPolarHBondContact O-CG 3.32Å
888	S	57.5	Low	72.5	Confident	106 Å²	106	91.7 Å²	91.7	74%	0.741	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-57.4	133.4	172.1	-52.1	0	0	0	0	108.8	V886 Q890	V886-S888 PolarHBondContact O-N 3.17Å; S888-Q890 PolarHBondContact O-N 2.99Å
889	P	55.8	Low	71.5	Confident	115 Å²	115	98.3 Å²	98.3	75%	0.747	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-56.8	120.5	172.3	22.2	-29.3	0	0	0	107.2	I891	P889-I891 PolarHBondContact O-N 2.84Å
890	Q	49.3	Very low	70.5	Confident	196 Å²	196	95.9 Å²	95.9	92%	0.916	58%	0.579	S	S	*	*			trans	-59.8	109.4	167.5	-72.4	-179.4	-16.1	0	0	106	S888	S888-Q890 PolarHBondContact O-N 2.99Å
891	I	38.4	Very low	69.4	Low	231 Å²	231	94.2 Å²	94.2	100%	1.185	56%	0.564	S	S	*	*			trans	-74.4	0	168.4	-62.9	176.1	0	0	0	107.9	P889	P889-I891 PolarHBondContact O-N 2.84Å

Retrieved 891 of 891 residues in 578.1 ms (Link to these results)

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