A0A061AD72_CAEEL Loading...

KAP NTPase domain-containing protein

AlphaFold DB , UniProt , Accession A0A061AD72, Species CAEEL (Caenorhabditis elegans), Gene kdin-1, Length 1,484 aa.

						>A0A061AD72_CAEEL|A0A061AD72|kdin-1
MVQTLRRPWQEAASSAFAVASALPVTMNSTQIAELFEQVEHGTTELRCALTAEISALRNANGESLLTVAVRSGNTAVAKQLAQLDPDAIDETDNEGWSALLNAAHCGHVDIVRLLIDNGASVDQPDLMGWSPLMWAVYKNHLDVVDLLVNAKAHVNLIDEEDGLTPLIVASGRGFSQIVERLIDSDCQVNACDKFGSTALIWAARKGHLPVVQLLLNSGAEVDAVGMYSSTALMLATRGNFIQVVELLLTREPNVNVADQNGLTALGMAARDGYADICESLINSGAFVNQCDRFGNWILTSAVRSGNAAIVRMILDKFADINCQDSEKRTPLHLAIDKSFNDIAYILLEKKPNLELKNKDGETPLLRAAKCRHVHLCTYLMSFGAKLAAVDNCGDNALHLALRARSRRLTQALLSNPSDSRLLYRPNKLGQTPYSIDLSNPQPILPLIFGPIDAEDKMDTAMGYDVYSNVLADIVCEPSLSLPLTIGLYAKWGSGKSALLAKLKEAMHSFSRDWLDGVSLSVSFALFFAIFLFFGMFSLTFTMLIAISNSVTAYLISWSVFLLIFIIFCSLIVVVYYGDRKNWYTSMDIANFFARVFSRIRLVYNILTLHAPMNSEDSASMPVSFLFADYHRLSSIGGEQALAKIVATLFEAAETHFGVLPVRLFCCMKPPYQYIDTGFGFTSPFSRTTYRSLQQPNAHQQAGIHGSLRRHCGVPHVILLIVAVFLLIMAQVFGTVWLLSDRDPNNFNLFIAIAFLCGFVMIAIYPLALIIMYSWTNVPRRRVNAAARNAHKLRFEGLMQKLQTEVDLLADMIRSLDAFTRSHTRLVVVVDGLDNCEQERMVQTLDALELLFSARKHRPFITIIAVDPHVIVSAINHNMHSALSGTELTGHDYLKNIISMPFYLHNSALRQLQSKLREKRESMAEWKERFKRQDTFYGSHLSLREADGRTSRKSFQKSTVPNMNSNSVVGRNMNDGILGEDYFSNMNPRAMRRIVNALTLTGRLMRAFEIDFSWMSLGHWVSLLEQWPSRMCWLIDRALEVHNNQLLLSEVYYQLKDHIPAQDDLMQLDRNLENFEGFLDSKGIPSAERLTVGHVKKFVPCTSSLDPYLRKLIRERSKGLVDIEAQVGSAGMAIPPNARLLFSDDLTWMSIDTPLVEMKLDAVVNLIRKIDIPSNRLDSILDRFYQLNLCGLVLATCPLPELKDSMQLPLGDWTLIRLLLETLKVFGSSPPGLRVDKRKALTLREEDEEEEIEEAAEAALNSEKERAPLLGSVRAEQRRRSTIVQNATELSIDHKCLMEKLSGMDLTETEGDVNEMHFSHFSSSTDGPSPMADGFLPASVSAAPSVRFDDNINDLEREASDADSTQSRYDSKENLLEDERSASPPAHVDLMRFDSGNTSSDFVRSSYRTSSRYRRMSRGDLMRGMHQNDTIRSSMDQSGTGAAPSSSSLMASDEDLNQQTVQRRGGDDFERIQLEQLFNRQSDA
					

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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	38.4	Very low	48.4	Very low	205 Å²	205	153.9 Å²	153.9	100%	1.01	73%	0.727	S	S	*	*				0	-60.7	0	-78.6	177	169.1	0	0	113.1	Q3 T4	M1-Q3 PolarHBondContact O-N 3.13Å; M1-T4 PolarHBondContact O-N 2.74Å; M1-T4 PolarHBondContact O-OG1 3.45Å
2	V	42.9	Very low	49.6	Very low	142 Å²	142	145.7 Å²	145.7	86%	0.861	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.2	-29.4	-175.6	-179.4	0	0	0	0	114.5
3	Q	45	Very low	50.5	Low	178 Å²	178	138.3 Å²	138.3	83%	0.832	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-19.3	177.6	-71.8	173.3	-27.6	0	0	115.5	M1	M1-Q3 PolarHBondContact O-N 3.13Å
4	T	48	Very low	51	Low	109 Å²	109	133.7 Å²	133.7	67%	0.669	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-15.5	-170	43.2	0	0	0	0	114.6	M1	M1-T4 PolarHBondContact O-N 2.74Å; M1-T4 PolarHBondContact O-OG1 3.45Å
5	L	45	Very low	51.4	Low	134 Å²	134	129.3 Å²	129.3	70%	0.702	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-8.2	179.2	-76.3	163.1	0	0	0	114.3
6	R	48.9	Very low	51.6	Low	198 Å²	198	125 Å²	125	75%	0.747	65%	0.647	S	S	*	*	H	α-helix	trans	-81.2	-22.9	-170	-120.4	-179.3	-172.5	-179.6	2.8	115.5
7	R	48.4	Very low	51.7	Low	188 Å²	188	127.3 Å²	127.3	71%	0.709	65%	0.651	S	S	*	*	H	α-helix	trans	-69.7	-53	-175.4	-71.5	-173.6	176.6	-177.7	-2.1	115.2	W9 Q10 E11	R7-W9 PolarHBondContact O-N 3.2Å; R7-W9 VanDerWaalsContact O-N 3.16Å; R7-Q10 PolarHBondContact O-N 2.98Å; R7-E11 PolarHBondContact O-N 3.15Å
8	P	53.6	Low	51.8	Low	71 Å²	71	123.3 Å²	123.3	46%	0.461	64%	0.641	S	S	.	*	H	α-helix	trans	-63.4	-27.1	-175.2	23.8	-34.1	0	0	0	113.1	E11 A12	P8-E11 PolarHBondContact O-N 2.79Å; P8-A12 VanDerWaalsContact O-CB 3.32Å; P8-A12 WeakPolarHBondContact O-CB 3.48Å; P8-A12 PolarHBondContact O-N 3.32Å
9	W	50.9	Low	51.9	Low	205 Å²	205	122.1 Å²	122.1	78%	0.777	64%	0.639	S	S	*	*	H	α-helix	trans	-68	-30.6	172.9	-77.8	87.7	0	0	0	113.5	R7 A13	R7-W9 PolarHBondContact O-N 3.2Å; R7-W9 VanDerWaalsContact O-N 3.16Å; W9-A13 WeakPolarHBondContact O-CB 3.44Å; W9-A13 PolarHBondContact O-N 3.21Å
10	Q	53.9	Low	51.8	Low	135 Å²	135	119.2 Å²	119.2	63%	0.631	63%	0.633	S	S	*	*	H	α-helix	trans	-75.5	-37.3	174.6	-65.2	-174.5	-92.7	0	0	111.5	R7 A13 S14	R7-Q10 PolarHBondContact O-N 2.98Å; Q10-A13 PolarHBondContact O-N 3.46Å; Q10-S14 WeakPolarHBondContact O-CB 3.4Å; Q10-S14 PolarHBondContact O-N 3.12Å
11	E	57.7	Low	51.6	Low	128 Å²	128	118.2 Å²	118.2	60%	0.598	64%	0.636	S	S	*	*	H	α-helix	trans	-66.9	-46.8	175.7	-71.1	161.8	-169.1	0	0	110.8	R7 P8 A13 S14 S15	R7-E11 PolarHBondContact O-N 3.15Å; P8-E11 PolarHBondContact O-N 2.79Å; E11-A13 PolarHBondContact O-N 3.36Å; E11-S14 PolarHBondContact O-N 3.25Å; E11-S14 VanDerWaalsContact O-N 3.12Å; E11-S14 PolarHBondContact O-OG 2.86Å; E11-S15 PolarHBondContact O-N 3.14Å; E11-S15 VanDerWaalsContact O-N 3.09Å
12	A	62.3	Low	52	Low	55 Å²	55	112.2 Å²	112.2	46%	0.455	62%	0.619	S	S	.	*	H	α-helix	trans	-63.2	-37.5	174	0	0	0	0	0	113.4	P8 S14 S15 A16	P8-A12 VanDerWaalsContact O-CB 3.32Å; P8-A12 WeakPolarHBondContact O-CB 3.48Å; P8-A12 PolarHBondContact O-N 3.32Å; A12-S14 VanDerWaalsContact C-N 3.31Å; A12-S14 PolarHBondContact O-N 2.91Å; A12-S15 PolarHBondContact O-OG 3.4Å; A12-S15 VanDerWaalsContact O-OG 3.09Å; A12-A16 WeakPolarHBondContact O-CB 3.4Å; A12-A16 PolarHBondContact O-N 2.99Å
13	A	61.9	Low	51.7	Low	50 Å²	50	110.7 Å²	110.7	41%	0.413	61%	0.606	S	S	.	*	H	α-helix	trans	-64.8	-35.6	172.6	0	0	0	0	0	112.1	W9 Q10 E11 F17	W9-A13 WeakPolarHBondContact O-CB 3.44Å; W9-A13 PolarHBondContact O-N 3.21Å; Q10-A13 PolarHBondContact O-N 3.46Å; E11-A13 PolarHBondContact O-N 3.36Å; A13-F17 WeakPolarHBondContact O-CB 3.34Å; A13-F17 PolarHBondContact O-N 3.14Å
14	S	56.9	Low	51.7	Low	74 Å²	74	107.9 Å²	107.9	52%	0.517	60%	0.603	S	S	.	*	H	α-helix	trans	-70.8	-37.6	179.2	75.2	0	0	0	0	113.3	Q10 E11 A12 A18	Q10-S14 WeakPolarHBondContact O-CB 3.4Å; Q10-S14 PolarHBondContact O-N 3.12Å; E11-S14 PolarHBondContact O-N 3.25Å; E11-S14 VanDerWaalsContact O-N 3.12Å; E11-S14 PolarHBondContact O-OG 2.86Å; A12-S14 VanDerWaalsContact C-N 3.31Å; A12-S14 PolarHBondContact O-N 2.91Å; S14-A18 PolarHBondContact O-N 3.44Å
15	S	57.4	Low	51.7	Low	68 Å²	68	109.4 Å²	109.4	48%	0.476	61%	0.611	S	S	.	*	H	α-helix	trans	-72.3	-38.3	174.5	57	0	0	0	0	112	E11 A12 F17 A18 V19	E11-S15 PolarHBondContact O-N 3.14Å; E11-S15 VanDerWaalsContact O-N 3.09Å; A12-S15 PolarHBondContact O-OG 3.4Å; A12-S15 VanDerWaalsContact O-OG 3.09Å; S15-F17 PolarHBondContact O-N 3.41Å; S15-A18 PolarHBondContact O-N 3.26Å; S15-V19 WeakPolarHBondContact O-CG2 3.37Å; S15-V19 PolarHBondContact O-N 3.31Å
16	A	54.6	Low	52	Low	60 Å²	60	106.7 Å²	106.7	50%	0.496	60%	0.601	S	S	.	*	H	α-helix	trans	-59.8	-43.7	171.5	0	0	0	0	0	111.9	A12 V19 A20	A12-A16 WeakPolarHBondContact O-CB 3.4Å; A12-A16 PolarHBondContact O-N 2.99Å; A16-V19 PolarHBondContact O-N 3.18Å; A16-A20 VanDerWaalsContact O-CB 3.26Å; A16-A20 WeakPolarHBondContact O-CB 3.41Å; A16-A20 PolarHBondContact O-N 3.18Å
17	F	53.6	Low	52.4	Low	164 Å²	164	99.7 Å²	99.7	72%	0.719	58%	0.577	S	S	*	*	H	α-helix	trans	-62	-41.1	173.9	-108.5	-91.1	0	0	0	112.8	A13 S15 A20 S21	A13-F17 WeakPolarHBondContact O-CB 3.34Å; A13-F17 PolarHBondContact O-N 3.14Å; S15-F17 PolarHBondContact O-N 3.41Å; F17-A20 PolarHBondContact O-N 2.9Å; F17-S21 WeakPolarHBondContact O-CB 3.47Å; F17-S21 PolarHBondContact O-N 2.87Å; F17-S21 PolarHBondContact O-OG 3.01Å
18	A	52.3	Low	53.2	Low	56 Å²	56	95.1 Å²	95.1	46%	0.463	57%	0.567	S	S	.	*	H	α-helix	trans	-62.8	-46.1	178	0	0	0	0	0	111.8	S14 S15 S21	S14-A18 PolarHBondContact O-N 3.44Å; S15-A18 PolarHBondContact O-N 3.26Å; A18-S21 PolarHBondContact O-N 2.95Å; A18-S21 PolarHBondContact O-OG 3.16Å
19	V	54.5	Low	53.9	Low	100 Å²	100	96.6 Å²	96.6	61%	0.606	58%	0.579	S	S	*	*	H	α-helix	trans	-66.6	-42.7	177.3	176	0	0	0	0	111.5	S15 A16 S21 A22	S15-V19 WeakPolarHBondContact O-CG2 3.37Å; S15-V19 PolarHBondContact O-N 3.31Å; A16-V19 PolarHBondContact O-N 3.18Å; V19-S21 PolarHBondContact O-N 3.39Å; V19-A22 PolarHBondContact O-N 3.17Å
20	A	49.9	Very low	55	Low	64 Å²	64	90.7 Å²	90.7	53%	0.529	57%	0.566	S	S	.	*	H	α-helix	trans	-63.3	-25.8	176.6	0	0	0	0	0	113.3	A16 F17 A22	A16-A20 VanDerWaalsContact O-CB 3.26Å; A16-A20 WeakPolarHBondContact O-CB 3.41Å; A16-A20 PolarHBondContact O-N 3.18Å; F17-A20 PolarHBondContact O-N 2.9Å; A20-A22 VanDerWaalsContact C-N 3.3Å; A20-A22 PolarHBondContact O-N 3.43Å
21	S	48.7	Very low	55.8	Low	99 Å²	99	87.8 Å²	87.8	69%	0.692	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-6	178.1	73.6	0	0	0	0	115.1	F17 A18 V19	F17-S21 WeakPolarHBondContact O-CB 3.47Å; F17-S21 PolarHBondContact O-N 2.87Å; F17-S21 PolarHBondContact O-OG 3.01Å; A18-S21 PolarHBondContact O-N 2.95Å; A18-S21 PolarHBondContact O-OG 3.16Å; V19-S21 PolarHBondContact O-N 3.39Å
22	A	46.1	Very low	56.5	Low	79 Å²	79	83.8 Å²	83.8	65%	0.653	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	-1.8	-169.7	0	0	0	0	0	115.2	V19 A20	V19-A22 PolarHBondContact O-N 3.17Å; A20-A22 VanDerWaalsContact C-N 3.3Å; A20-A22 PolarHBondContact O-N 3.43Å
23	L	37	Very low	57.2	Low	110 Å²	110	83.7 Å²	83.7	58%	0.576	53%	0.533	S	S	*	.	S	Bend	trans	-106.7	123.2	-179.4	-70.9	170.2	0	0	0	110.9	V25 T26	L23-V25 PolarHBondContact O-N 2.91Å; L23-T26 HydrophobicContact CB-CG2 3.9Å
24	P	43.4	Very low	58	Low	118 Å²	118	85.3 Å²	85.3	77%	0.766	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	126.5	-176.4	29.2	-33.6	0	0	0	111.7	T26	P24-T26 PolarHBondContact O-N 3Å
25	V	48.9	Very low	59	Low	141 Å²	141	82.3 Å²	82.3	86%	0.855	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	50.1	173.8	-157	0	0	0	0	113.5	L23 M27	L23-V25 PolarHBondContact O-N 2.91Å; V25-M27 PolarHBondContact O-N 3.19Å
26	T	51.9	Low	60.3	Low	77 Å²	77	79.7 Å²	79.7	47%	0.472	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-55.3	124.1	157.2	42.6	0	0	0	0	109.7	L23 P24 N28	L23-T26 HydrophobicContact CB-CG2 3.9Å; P24-T26 PolarHBondContact O-N 3Å; T26-N28 PolarHBondContact O-N 3.44Å
27	M	57	Low	61.6	Low	51 Å²	51	81.7 Å²	81.7	25%	0.251	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-66.8	125.7	160.5	-61.7	-163.7	72.3	0	0	107.1	V25 Q31 I32 L35	V25-M27 PolarHBondContact O-N 3.19Å; M27-Q31 HydrophobicContact CB-CB 4.16Å; M27-Q31 HydrophobicContact CE-CB 4.01Å; M27-I32 HydrophobicContact CB-CD1 4.47Å; M27-I32 HydrophobicContact CB-CG1 3.8Å; M27-I32 WeakPolarHBondContact O-CD1 3.42Å; M27-L35 HydrophobicContact CE-CD1 3.46Å; M27-L35 VanDerWaalsContact CE-CD1 3.46Å; M27-L35 HydrophobicContact CE-CG 3.8Å; M27-L35 HydrophobicContact SD-CD1 3.53Å; M27-L35 VanDerWaalsContact SD-CD1 3.53Å; M27-L35 HydrophobicContact SD-CG 4.49Å
28	N	65.2	Low	62.9	Low	93 Å²	93	75.4 Å²	75.4	50%	0.497	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-58	156	178.2	-71.1	-58.5	0	0	0	110.2	T26 T30 Q31 I32	T26-N28 PolarHBondContact O-N 3.44Å; N28-T30 PolarHBondContact O-N 2.97Å; N28-T30 VanDerWaalsContact O-N 3.09Å; N28-Q31 HydrophobicContact CB-CB 4.38Å; N28-Q31 HydrophobicContact CB-CG 4.17Å; N28-Q31 PolarHBondContact ND2-OE1 2.87Å; N28-Q31 CarbonylContact O-C 3.56Å; N28-Q31 WeakPolarHBondContact O-CA 3.12Å; N28-Q31 WeakPolarHBondContact O-CB 3.39Å; N28-Q31 PolarHBondContact O-N 3.03Å; N28-I32 PolarHBondContact O-N 2.89Å
29	S	69.1	Low	64.2	Low	102 Å²	102	72.8 Å²	72.8	71%	0.713	44%	0.441	S	S	*	.	H	α-helix	trans	-55.6	-31.3	176	52.9	0	0	0	0	113	A33	S29-A33 WeakPolarHBondContact O-CB 3.36Å; S29-A33 PolarHBondContact O-N 3.22Å
30	T	73.7	Confident	65.5	Low	81 Å²	81	72.4 Å²	72.4	50%	0.497	43%	0.432	S	S	.	.	H	α-helix	trans	-69.4	-37.1	171	63.5	0	0	0	0	112.9	N28 A33 E34	N28-T30 PolarHBondContact O-N 2.97Å; N28-T30 VanDerWaalsContact O-N 3.09Å; T30-A33 PolarHBondContact O-N 3.44Å; T30-E34 WeakPolarHBondContact O-CB 3.24Å; T30-E34 WeakPolarHBondContact O-CG 3.31Å; T30-E34 PolarHBondContact O-N 3.15Å
31	Q	69.3	Low	66.8	Low	73 Å²	73	75.7 Å²	75.7	34%	0.341	44%	0.437	S	S	.	.	H	α-helix	trans	-75	-32.4	178.3	-68.9	171.4	-39.8	0	0	112.3	M27 N28 L35	M27-Q31 HydrophobicContact CB-CB 4.16Å; M27-Q31 HydrophobicContact CE-CB 4.01Å; N28-Q31 HydrophobicContact CB-CB 4.38Å; N28-Q31 HydrophobicContact CB-CG 4.17Å; N28-Q31 PolarHBondContact ND2-OE1 2.87Å; N28-Q31 CarbonylContact O-C 3.56Å; N28-Q31 WeakPolarHBondContact O-CA 3.12Å; N28-Q31 WeakPolarHBondContact O-CB 3.39Å; N28-Q31 PolarHBondContact O-N 3.03Å; Q31-L35 WeakPolarHBondContact O-CB 3.46Å; Q31-L35 WeakPolarHBondContact O-CG 3.42Å; Q31-L35 PolarHBondContact O-N 3.38Å
32	I	72.2	Confident	67.7	Low	44 Å²	44	72.6 Å²	72.6	23%	0.226	42%	0.42	C	S	.	.	H	α-helix	trans	-65.6	-48.2	169.6	-64.1	172.6	0	0	0	108.8	M27 N28 E34 L35 F36 L57	M27-I32 HydrophobicContact CB-CD1 4.47Å; M27-I32 HydrophobicContact CB-CG1 3.8Å; M27-I32 WeakPolarHBondContact O-CD1 3.42Å; N28-I32 PolarHBondContact O-N 2.89Å; I32-E34 PolarHBondContact O-N 3.31Å; I32-L35 PolarHBondContact O-N 3.24Å; I32-F36 HydrophobicContact CG2-CD2 3.75Å; I32-F36 HydrophobicContact CG2-CE2 3.8Å; I32-F36 WeakPolarHBondContact O-CD2 3.49Å; I32-F36 PolarHBondContact O-N 3.33Å; I32-L57 HydrophobicContact CD1-CD2 4.39Å
33	A	77.7	Confident	68.7	Low	53 Å²	53	71.5 Å²	71.5	44%	0.438	41%	0.405	S	S	.	.	H	α-helix	trans	-57.4	-49.4	173.8	0	0	0	0	0	111.9	S29 T30 L35 F36 E37	S29-A33 WeakPolarHBondContact O-CB 3.36Å; S29-A33 PolarHBondContact O-N 3.22Å; T30-A33 PolarHBondContact O-N 3.44Å; A33-L35 VanDerWaalsContact C-N 3.27Å; A33-L35 PolarHBondContact O-N 3.37Å; A33-F36 PolarHBondContact O-N 3.19Å; A33-E37 WeakPolarHBondContact O-CB 3.5Å; A33-E37 PolarHBondContact O-N 2.88Å
34	E	78	Confident	69.7	Low	84 Å²	84	71.5 Å²	71.5	39%	0.393	41%	0.41	S	S	.	.	H	α-helix	trans	-58.1	-33.9	175.9	-76.7	165.9	-136.3	0	0	112.7	T30 I32 Q38	T30-E34 WeakPolarHBondContact O-CB 3.24Å; T30-E34 WeakPolarHBondContact O-CG 3.31Å; T30-E34 PolarHBondContact O-N 3.15Å; I32-E34 PolarHBondContact O-N 3.31Å; E34-Q38 VanDerWaalsContact O-CB 3.31Å; E34-Q38 WeakPolarHBondContact O-CB 3.45Å; E34-Q38 VanDerWaalsContact O-CG 3.25Å; E34-Q38 WeakPolarHBondContact O-CG 3.23Å; E34-Q38 PolarHBondContact O-N 2.84Å; E34-Q38 PolarHBondContact O-NE2 3.5Å
35	L	79.7	Confident	70.6	Confident	11 Å²	11	74.1 Å²	74.1	6%	0.058	41%	0.412	C	S	.	.	H	α-helix	trans	-71.5	-48	174.7	-84.4	-170.5	0	0	0	112.1	M27 Q31 I32 A33 E37 Q38 V39 C48 I54	M27-L35 HydrophobicContact CE-CD1 3.46Å; M27-L35 VanDerWaalsContact CE-CD1 3.46Å; M27-L35 HydrophobicContact CE-CG 3.8Å; M27-L35 HydrophobicContact SD-CD1 3.53Å; M27-L35 VanDerWaalsContact SD-CD1 3.53Å; M27-L35 HydrophobicContact SD-CG 4.49Å; Q31-L35 WeakPolarHBondContact O-CB 3.46Å; Q31-L35 WeakPolarHBondContact O-CG 3.42Å; Q31-L35 PolarHBondContact O-N 3.38Å; I32-L35 PolarHBondContact O-N 3.24Å; A33-L35 VanDerWaalsContact C-N 3.27Å; A33-L35 PolarHBondContact O-N 3.37Å; L35-E37 VanDerWaalsContact C-N 3.29Å; L35-E37 PolarHBondContact O-N 3.05Å; L35-Q38 PolarHBondContact O-N 3.09Å; L35-V39 WeakPolarHBondContact O-CG2 3.28Å; L35-V39 PolarHBondContact O-N 3.26Å; L35-C48 HydrophobicContact CD2-CB 4.5Å; L35-I54 HydrophobicContact CD1-CG2 4.48Å
36	F	83.9	Confident	71.1	Confident	14 Å²	14	69 Å²	69	6%	0.061	38%	0.38	C	S	.	.	H	α-helix	trans	-62.5	-39.3	176.6	-84	-79.5	0	0	0	110.8	I32 A33 V39 E40 L57 N59 L65 V68	I32-F36 HydrophobicContact CG2-CD2 3.75Å; I32-F36 HydrophobicContact CG2-CE2 3.8Å; I32-F36 WeakPolarHBondContact O-CD2 3.49Å; I32-F36 PolarHBondContact O-N 3.33Å; A33-F36 PolarHBondContact O-N 3.19Å; F36-V39 PolarHBondContact O-N 3Å; F36-E40 VanDerWaalsContact O-CB 3.23Å; F36-E40 WeakPolarHBondContact O-CB 3.29Å; F36-E40 PolarHBondContact O-N 3.11Å; F36-L57 HydrophobicContact CE2-CB 4.33Å; F36-N59 HydrophobicContact CD1-CB 4.14Å; F36-N59 HydrophobicContact CD2-CB 4.14Å; F36-N59 HydrophobicContact CE1-CB 3.98Å; F36-N59 HydrophobicContact CE2-CB 4.02Å; F36-N59 HydrophobicContact CG-CB 4.21Å; F36-N59 HydrophobicContact CZ-CB 3.93Å; F36-L65 HydrophobicContact CD1-CD1 3.7Å; F36-L65 HydrophobicContact CD2-CD1 4.46Å; F36-L65 HydrophobicContact CE1-CB 4.24Å; F36-L65 HydrophobicContact CE1-CD1 3.66Å; F36-L65 HydrophobicContact CE2-CD1 4.4Å; F36-L65 HydrophobicContact CG-CD1 4.15Å; F36-L65 HydrophobicContact CZ-CB 4.3Å; F36-L65 HydrophobicContact CZ-CD1 4.01Å; F36-V68 HydrophobicContact CD1-CB 3.94Å; F36-V68 HydrophobicContact CD1-CG1 4.2Å; F36-V68 HydrophobicContact CD1-CG2 3.6Å; F36-V68 HydrophobicContact CE1-CB 4.23Å; F36-V68 HydrophobicContact CE1-CG2 3.72Å
37	E	82	Confident	71.2	Confident	101 Å²	101	75.5 Å²	75.5	47%	0.472	40%	0.396	S	S	.	.	H	α-helix	trans	-64.3	-40.8	173.5	-174.5	176.7	-155.6	0	0	112.3	A33 L35 E40 H41	A33-E37 WeakPolarHBondContact O-CB 3.5Å; A33-E37 PolarHBondContact O-N 2.88Å; L35-E37 VanDerWaalsContact C-N 3.29Å; L35-E37 PolarHBondContact O-N 3.05Å; E37-E40 PolarHBondContact O-N 2.96Å; E37-H41 VanDerWaalsContact O-CB 3.3Å; E37-H41 WeakPolarHBondContact O-CB 3.46Å; E37-H41 VanDerWaalsContact O-CG 3.31Å; E37-H41 PolarHBondContact O-N 3.27Å
38	Q	79.6	Confident	71.4	Confident	32 Å²	32	75.4 Å²	75.4	15%	0.15	40%	0.399	C	S	.	.	H	α-helix	trans	-61.2	-43.9	172	-86.2	162.4	84.5	0	0	112.3	E34 L35 G42 T43 L46	E34-Q38 VanDerWaalsContact O-CB 3.31Å; E34-Q38 WeakPolarHBondContact O-CB 3.45Å; E34-Q38 VanDerWaalsContact O-CG 3.25Å; E34-Q38 WeakPolarHBondContact O-CG 3.23Å; E34-Q38 PolarHBondContact O-N 2.84Å; E34-Q38 PolarHBondContact O-NE2 3.5Å; L35-Q38 PolarHBondContact O-N 3.09Å; Q38-G42 PolarHBondContact O-N 3.22Å; Q38-T43 PolarHBondContact O-N 2.99Å; Q38-T43 VanDerWaalsContact O-N 3.15Å; Q38-T43 PolarHBondContact O-OG1 3.36Å; Q38-L46 HydrophobicContact CB-CD2 4.17Å
39	V	80.6	Confident	71.2	Confident	1 Å²	1	75 Å²	75	1%	0.006	41%	0.41	C	S	.	.	H	α-helix	trans	-67.6	-40.2	176.7	174.3	0	0	0	0	111.4	L35 F36 G42 L46 L65 V68 A69 S72 V77	L35-V39 WeakPolarHBondContact O-CG2 3.28Å; L35-V39 PolarHBondContact O-N 3.26Å; F36-V39 PolarHBondContact O-N 3Å; V39-G42 PolarHBondContact O-N 2.89Å; V39-G42 VanDerWaalsContact O-N 3.12Å; V39-L46 HydrophobicContact CG2-CD1 4.38Å; V39-L46 HydrophobicContact CG2-CD2 3.84Å; V39-L65 HydrophobicContact CG2-CD1 4Å; V39-V68 HydrophobicContact CG1-CB 4.5Å; V39-V68 HydrophobicContact CG1-CG1 4.12Å; V39-A69 VanDerWaalsContact CG1-CA 3.47Å; V39-A69 HydrophobicContact CG1-CB 3.76Å; V39-S72 WeakPolarHBondContact O-CB 3.41Å; V39-S72 PolarHBondContact O-OG 3.19Å; V39-V77 HydrophobicContact CG2-CG1 4.43Å
40	E	81.7	Confident	71	Confident	92 Å²	92	71.8 Å²	71.8	43%	0.43	38%	0.384	S	S	.	.	H	α-helix	trans	-69.7	-34	179.1	-173.5	161.8	-124.2	0	0	112.8	F36 E37 G42 V68 R71	F36-E40 VanDerWaalsContact O-CB 3.23Å; F36-E40 WeakPolarHBondContact O-CB 3.29Å; F36-E40 PolarHBondContact O-N 3.11Å; E37-E40 PolarHBondContact O-N 2.96Å; E40-G42 PolarHBondContact O-N 3.04Å; E40-V68 HydrophobicContact CB-CG1 4.21Å; E40-R71 IonicContact OE1-CZ 3.86Å; E40-R71 VanDerWaalsContact OE1-CZ 3.29Å; E40-R71 IonicContact OE1-NH1 2.71Å; E40-R71 PolarHBondContact OE1-NH1 2.86Å; E40-R71 IonicContact OE1-NH2 2.79Å; E40-R71 PolarHBondContact OE1-NH2 3.29Å
41	H	77.3	Confident	70.7	Confident	134 Å²	134	70.7 Å²	70.7	62%	0.62	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	3.6	169.8	-69.7	-17.5	0	0	0	114.2	E37 T43	E37-H41 VanDerWaalsContact O-CB 3.3Å; E37-H41 WeakPolarHBondContact O-CB 3.46Å; E37-H41 VanDerWaalsContact O-CG 3.31Å; E37-H41 PolarHBondContact O-N 3.27Å; H41-T43 VanDerWaalsContact C-N 3.3Å; H41-T43 PolarHBondContact O-N 3.33Å
42	G	67	Low	70.4	Confident	34 Å²	34	69.9 Å²	69.9	35%	0.351	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	22.4	172.5	0	0	0	0	0	114.6	Q38 V39 E40 T44	Q38-G42 PolarHBondContact O-N 3.22Å; V39-G42 PolarHBondContact O-N 2.89Å; V39-G42 VanDerWaalsContact O-N 3.12Å; E40-G42 PolarHBondContact O-N 3.04Å; G42-T44 PolarHBondContact O-N 2.79Å
43	T	66.7	Low	70.1	Confident	55 Å²	55	75.6 Å²	75.6	34%	0.337	41%	0.409	S	S	.	.			trans	-68.2	118.2	178.8	60.3	0	0	0	0	110.2	Q38 H41 E45	Q38-T43 PolarHBondContact O-N 2.99Å; Q38-T43 VanDerWaalsContact O-N 3.15Å; Q38-T43 PolarHBondContact O-OG1 3.36Å; H41-T43 VanDerWaalsContact C-N 3.3Å; H41-T43 PolarHBondContact O-N 3.33Å; T43-E45 VanDerWaalsContact C-N 3.27Å; T43-E45 PolarHBondContact O-N 2.71Å
44	T	58.7	Low	69.7	Low	111 Å²	111	74.1 Å²	74.1	68%	0.681	39%	0.393	S	S	*	.	S	Bend	trans	-71.7	-21.3	178.5	47.8	0	0	0	0	113.1	G42	G42-T44 PolarHBondContact O-N 2.79Å
45	E	61.5	Low	69.3	Low	172 Å²	172	70.7 Å²	70.7	80%	0.804	38%	0.378	S	S	*	.	S	Bend	trans	-99.5	75.6	177.8	-65.2	-176.1	-178.2	0	0	110.7	T43 R47	T43-E45 VanDerWaalsContact C-N 3.27Å; T43-E45 PolarHBondContact O-N 2.71Å; E45-R47 PolarHBondContact O-N 3Å
46	L	60.3	Low	69.1	Low	35 Å²	35	73.1 Å²	73.1	18%	0.183	40%	0.4	C	S	.	.			trans	-62.3	129.9	170.6	-68.3	179.2	0	0	0	110.2	Q38 V39 C48 L50 V77	Q38-L46 HydrophobicContact CB-CD2 4.17Å; V39-L46 HydrophobicContact CG2-CD1 4.38Å; V39-L46 HydrophobicContact CG2-CD2 3.84Å; L46-C48 PolarHBondContact O-N 3.48Å; L46-L50 HydrophobicContact CD1-CD1 4.03Å; L46-L50 HydrophobicContact CD1-CD2 4.04Å; L46-L50 HydrophobicContact CD1-CG 4.11Å; L46-V77 HydrophobicContact CD1-CG1 4.02Å; L46-V77 HydrophobicContact CD1-CG2 3.66Å; L46-V77 HydrophobicContact CG-CG2 4.17Å
47	R	54.9	Low	68.8	Low	212 Å²	212	74.4 Å²	74.4	80%	0.8	41%	0.408	S	S	*	.	S	Bend	trans	-68.7	-13.2	-179.1	-68.9	179	173	171.6	0.7	114.4	E45	E45-R47 PolarHBondContact O-N 3Å
48	C	60.1	Low	68.8	Low	49 Å²	49	73.6 Å²	73.6	33%	0.331	40%	0.4	S	S	.	.	S	Bend	trans	-117.7	139.2	179.9	-63.5	0	0	0	0	109.7	L35 L46 L50	L35-C48 HydrophobicContact CD2-CB 4.5Å; L46-C48 PolarHBondContact O-N 3.48Å; C48-L50 PolarHBondContact O-N 3.34Å
49	A	60.9	Low	68.9	Low	86 Å²	86	73.9 Å²	73.9	71%	0.711	40%	0.403	S	S	*	.			trans	-67.5	129.2	167.5	0	0	0	0	0	109.1	I54	A49-I54 WeakPolarHBondContact O-CD1 3.45Å
50	L	64.3	Low	69	Low	34 Å²	34	78.6 Å²	78.6	18%	0.178	44%	0.441	C	S	.	.			trans	-67.7	130.6	177.4	-69.4	162.6	0	0	0	110.3	L46 C48 I54 L65 V77 Q80 L81 L84	L46-L50 HydrophobicContact CD1-CD1 4.03Å; L46-L50 HydrophobicContact CD1-CD2 4.04Å; L46-L50 HydrophobicContact CD1-CG 4.11Å; C48-L50 PolarHBondContact O-N 3.34Å; L50-I54 HydrophobicContact CD2-CG2 4.1Å; L50-L65 HydrophobicContact CD2-CD2 4.04Å; L50-V77 HydrophobicContact CD1-CG1 4.23Å; L50-Q80 HydrophobicContact CD1-CB 3.94Å; L50-L81 HydrophobicContact CD2-CD2 4.07Å; L50-L84 HydrophobicContact CB-CD1 4.02Å
51	T	67.8	Low	68.8	Low	58 Å²	58	78.5 Å²	78.5	36%	0.356	44%	0.444	S	S	.	.			trans	-133.2	163.3	176.9	63.2	0	0	0	0	109.7	E53 I54 S55	T51-E53 PolarHBondContact O-N 2.94Å; T51-E53 VanDerWaalsContact O-N 3.14Å; T51-I54 WeakPolarHBondContact O-CB 3.35Å; T51-I54 PolarHBondContact O-N 2.89Å; T51-S55 PolarHBondContact O-N 3.17Å; T51-S55 PolarHBondContact O-OG 3.37Å
52	A	63.4	Low	69.1	Low	55 Å²	55	72.8 Å²	72.8	46%	0.455	42%	0.421	S	S	.	.	H	α-helix	trans	-58.7	-23.6	176.8	0	0	0	0	0	113.7	I54 S55 A56	A52-I54 VanDerWaalsContact C-N 3.31Å; A52-S55 VanDerWaalsContact CA-OG 3.28Å; A52-S55 WeakPolarHBondContact CA-OG 3.35Å; A52-S55 PolarHBondContact O-OG 3.17Å; A52-S55 VanDerWaalsContact O-OG 3.11Å; A52-A56 PolarHBondContact O-N 3.02Å
53	E	66.3	Low	69.8	Low	164 Å²	164	71.6 Å²	71.6	77%	0.766	41%	0.407	S	S	*	.	H	α-helix	trans	-74.4	-22.5	174.7	-61.9	177.1	158	0	0	112.5	T51	T51-E53 PolarHBondContact O-N 2.94Å; T51-E53 VanDerWaalsContact O-N 3.14Å
54	I	69.8	Low	70.7	Confident	22 Å²	22	69.4 Å²	69.4	11%	0.113	39%	0.393	C	S	.	.	H	α-helix	trans	-91.5	-34.4	-178.5	-68.4	170.1	0	0	0	111.2	L35 A49 L50 T51 A52 A56 L57 L65	L35-I54 HydrophobicContact CD1-CG2 4.48Å; A49-I54 WeakPolarHBondContact O-CD1 3.45Å; L50-I54 HydrophobicContact CD2-CG2 4.1Å; T51-I54 WeakPolarHBondContact O-CB 3.35Å; T51-I54 PolarHBondContact O-N 2.89Å; A52-I54 VanDerWaalsContact C-N 3.31Å; I54-A56 VanDerWaalsContact C-N 3.3Å; I54-L57 HydrophobicContact CG2-CD1 4.34Å; I54-L57 VanDerWaalsContact O-CB 3.31Å; I54-L57 WeakPolarHBondContact O-CB 3.32Å; I54-L57 WeakPolarHBondContact O-CG 3.42Å; I54-L57 PolarHBondContact O-N 3.43Å; I54-L65 HydrophobicContact CG2-CD2 3.56Å
55	S	69.1	Low	72	Confident	12 Å²	12	64.2 Å²	64.2	8%	0.084	36%	0.362	C	S	.	.	H	α-helix	trans	-67.7	-28.5	171	39.5	0	0	0	0	113	T51 A52 L57 R58 D85	T51-S55 PolarHBondContact O-N 3.17Å; T51-S55 PolarHBondContact O-OG 3.37Å; A52-S55 VanDerWaalsContact CA-OG 3.28Å; A52-S55 WeakPolarHBondContact CA-OG 3.35Å; A52-S55 PolarHBondContact O-OG 3.17Å; A52-S55 VanDerWaalsContact O-OG 3.11Å; S55-L57 PolarHBondContact O-N 3.25Å; S55-R58 PolarHBondContact O-NH1 2.96Å; S55-D85 WeakPolarHBondContact CB-OD2 3.39Å; S55-D85 PolarHBondContact OG-OD2 3.37Å
56	A	74.4	Confident	73.2	Confident	62 Å²	62	56.7 Å²	56.7	51%	0.512	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-8.7	171.2	0	0	0	0	0	114.5	A52 I54 R58	A52-A56 PolarHBondContact O-N 3.02Å; I54-A56 VanDerWaalsContact C-N 3.3Å; A56-R58 VanDerWaalsContact C-NH1 3.33Å; A56-R58 PolarHBondContact O-NH1 3.37Å
57	L	79.1	Confident	74.5	Confident	42 Å²	42	55.2 Å²	55.2	22%	0.22	32%	0.319	C	S	.	.			trans	-71.2	143.9	176.3	-62.8	173.8	0	0	0	111.6	I32 F36 I54 S55	I32-L57 HydrophobicContact CD1-CD2 4.39Å; F36-L57 HydrophobicContact CE2-CB 4.33Å; I54-L57 HydrophobicContact CG2-CD1 4.34Å; I54-L57 VanDerWaalsContact O-CB 3.31Å; I54-L57 WeakPolarHBondContact O-CB 3.32Å; I54-L57 WeakPolarHBondContact O-CG 3.42Å; I54-L57 PolarHBondContact O-N 3.43Å; S55-L57 PolarHBondContact O-N 3.25Å
58	R	80.5	Confident	76.1	Confident	84 Å²	84	45.1 Å²	45.1	32%	0.317	28%	0.281	S	S	.	.	B	Isolated β-bridge	trans	-125.6	143.4	175.2	-57.3	-72.2	170.5	-85.3	1.9	108.9	S55 A56 G62 E63 E91	S55-R58 PolarHBondContact O-NH1 2.96Å; A56-R58 VanDerWaalsContact C-NH1 3.33Å; A56-R58 PolarHBondContact O-NH1 3.37Å; R58-G62 WeakPolarHBondContact CD-O 3.33Å; R58-E63 WeakPolarHBondContact CA-O 3.4Å; R58-E91 IonicContact CZ-OE2 2.68Å; R58-E91 IonicContact NE-OE2 2.79Å; R58-E91 PolarHBondContact NE-OE2 3Å; R58-E91 IonicContact NH2-OE1 3.19Å; R58-E91 PolarHBondContact NH2-OE1 3.3Å; R58-E91 VanDerWaalsContact NH2-OE1 3.1Å; R58-E91 IonicContact NH2-OE2 3.29Å; R58-E91 PolarHBondContact NH2-OE2 3.08Å
59	N	82.9	Confident	77.4	Confident	38 Å²	38	42.8 Å²	42.8	20%	0.203	27%	0.266	C	S	.	.			trans	-83.7	-173.9	175.2	79.6	-1.2	0	0	0	111.6	F36 N61 G62 E63	F36-N59 HydrophobicContact CD1-CB 4.14Å; F36-N59 HydrophobicContact CD2-CB 4.14Å; F36-N59 HydrophobicContact CE1-CB 3.98Å; F36-N59 HydrophobicContact CE2-CB 4.02Å; F36-N59 HydrophobicContact CG-CB 4.21Å; F36-N59 HydrophobicContact CZ-CB 3.93Å; N59-N61 PolarHBondContact O-N 3.34Å; N59-N61 WeakPolarHBondContact OD1-CA 3.28Å; N59-N61 WeakPolarHBondContact OD1-CB 3.3Å; N59-N61 PolarHBondContact OD1-N 2.79Å; N59-G62 PolarHBondContact O-N 3.43Å; N59-G62 VanDerWaalsContact O-N 3.13Å; N59-G62 PolarHBondContact OD1-N 2.85Å; N59-E63 PolarHBondContact N-O 2.87Å; N59-E63 PolarHBondContact ND2-OE1 3.45Å; N59-E63 WeakPolarHBondContact OD1-CB 3.39Å; N59-E63 PolarHBondContact OD1-N 3Å
60	A	82.5	Confident	78.8	Confident	99 Å²	99	38.7 Å²	38.7	82%	0.818	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-20.6	179.3	0	0	0	0	0	114.5
61	N	77.1	Confident	80	Confident	91 Å²	91	40.7 Å²	40.7	49%	0.487	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-2.3	179.1	-53.1	-18.2	0	0	0	112.3	N59 E63 N94	N59-N61 PolarHBondContact O-N 3.34Å; N59-N61 WeakPolarHBondContact OD1-CA 3.28Å; N59-N61 WeakPolarHBondContact OD1-CB 3.3Å; N59-N61 PolarHBondContact OD1-N 2.79Å; N61-E63 VanDerWaalsContact C-N 3.28Å; N61-E63 HydrophobicContact CB-CG 4.14Å; N61-E63 WeakPolarHBondContact CB-OE1 3.29Å; N61-E63 PolarHBondContact ND2-OE1 3.28Å; N61-N94 WeakPolarHBondContact O-CB 3.49Å; N61-N94 PolarHBondContact O-N 3.34Å; N61-N94 PolarHBondContact O-ND2 3.06Å; N61-N94 VanDerWaalsContact O-ND2 3.07Å
62	G	83.2	Confident	80.9	Confident	14 Å²	14	39.6 Å²	39.6	14%	0.144	23%	0.232	C	C	.	.			trans	81.3	1.1	-172.6	0	0	0	0	0	114.1	R58 N59 S64	R58-G62 WeakPolarHBondContact CD-O 3.33Å; N59-G62 PolarHBondContact O-N 3.43Å; N59-G62 VanDerWaalsContact O-N 3.13Å; N59-G62 PolarHBondContact OD1-N 2.85Å; G62-S64 PolarHBondContact O-N 3.39Å
63	E	83.4	Confident	82	Confident	8 Å²	8	38.1 Å²	38.1	4%	0.037	22%	0.221	C	C	.	.			trans	-63.5	133.4	176.5	-62	164.2	-98.3	0	0	110.1	R58 N59 N61 T67 V68 R71 D93	R58-E63 WeakPolarHBondContact CA-O 3.4Å; N59-E63 PolarHBondContact N-O 2.87Å; N59-E63 PolarHBondContact ND2-OE1 3.45Å; N59-E63 WeakPolarHBondContact OD1-CB 3.39Å; N59-E63 PolarHBondContact OD1-N 3Å; N61-E63 VanDerWaalsContact C-N 3.28Å; N61-E63 HydrophobicContact CB-CG 4.14Å; N61-E63 WeakPolarHBondContact CB-OE1 3.29Å; N61-E63 PolarHBondContact ND2-OE1 3.28Å; E63-T67 HydrophobicContact CB-CG2 4.23Å; E63-T67 HydrophobicContact CG-CG2 4.25Å; E63-V68 HydrophobicContact CB-CG2 3.83Å; E63-V68 WeakPolarHBondContact OE2-CG2 3.46Å; E63-R71 IonicContact OE1-NH2 3.19Å; E63-R71 IonicContact OE2-CZ 2.99Å; E63-R71 IonicContact OE2-NE 2.78Å; E63-R71 PolarHBondContact OE2-NE 2.91Å; E63-R71 IonicContact OE2-NH2 2.79Å; E63-R71 PolarHBondContact OE2-NH2 2.95Å; E63-D93 HydrophobicContact CG-CB 4.14Å
64	S	85.7	Confident	83	Confident	9 Å²	9	30.9 Å²	30.9	6%	0.063	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-72.9	160.9	168.8	77.9	0	0	0	0	111.1	G62 L66 T67 V68	G62-S64 PolarHBondContact O-N 3.39Å; S64-L66 PolarHBondContact O-N 3.41Å; S64-L66 PolarHBondContact OG-N 3.1Å; S64-T67 PolarHBondContact N-OG1 3.46Å; S64-T67 WeakPolarHBondContact O-CB 3.38Å; S64-T67 PolarHBondContact O-N 3.14Å; S64-T67 PolarHBondContact OG-N 3.23Å; S64-T67 PolarHBondContact OG-OG1 2.87Å; S64-V68 PolarHBondContact O-N 3.35Å
65	L	85	Confident	83.7	Confident	3 Å²	3	33 Å²	33	2%	0.016	20%	0.202	C	C	.	.	H	α-helix	trans	-61.4	-28.5	173.2	-163.1	65.4	0	0	0	111.9	F36 V39 L50 I54 A69 L81	F36-L65 HydrophobicContact CD1-CD1 3.7Å; F36-L65 HydrophobicContact CD2-CD1 4.46Å; F36-L65 HydrophobicContact CE1-CB 4.24Å; F36-L65 HydrophobicContact CE1-CD1 3.66Å; F36-L65 HydrophobicContact CE2-CD1 4.4Å; F36-L65 HydrophobicContact CG-CD1 4.15Å; F36-L65 HydrophobicContact CZ-CB 4.3Å; F36-L65 HydrophobicContact CZ-CD1 4.01Å; V39-L65 HydrophobicContact CG2-CD1 4Å; L50-L65 HydrophobicContact CD2-CD2 4.04Å; I54-L65 HydrophobicContact CG2-CD2 3.56Å; L65-A69 WeakPolarHBondContact O-CB 3.25Å; L65-A69 PolarHBondContact O-N 3.33Å; L65-L81 HydrophobicContact CB-CD1 4.28Å; L65-L81 HydrophobicContact CD2-CD1 4.41Å; L65-L81 HydrophobicContact CD2-CD2 4.32Å; L65-L81 HydrophobicContact CG-CD1 4.06Å; L65-L81 WeakPolarHBondContact O-CD1 3.5Å
66	L	87.2	Confident	84.5	Confident	14 Å²	14	34.7 Å²	34.7	7%	0.073	22%	0.217	C	C	.	.	H	α-helix	trans	-66	-47.5	170.6	176.9	62.9	0	0	0	110.6	S64 V68 A69 V70 A78 L81 A82 I89 A99 L115	S64-L66 PolarHBondContact O-N 3.41Å; S64-L66 PolarHBondContact OG-N 3.1Å; L66-V68 VanDerWaalsContact C-N 3.27Å; L66-V68 PolarHBondContact O-N 2.9Å; L66-A69 PolarHBondContact O-N 3.14Å; L66-V70 HydrophobicContact CD1-CG2 3.96Å; L66-V70 HydrophobicContact CG-CG2 4.19Å; L66-V70 WeakPolarHBondContact O-CB 3.48Å; L66-V70 WeakPolarHBondContact O-CG2 3.35Å; L66-V70 PolarHBondContact O-N 3.28Å; L66-A78 HydrophobicContact CD1-CB 4.44Å; L66-L81 HydrophobicContact CB-CB 4.28Å; L66-L81 HydrophobicContact CB-CD1 4.44Å; L66-L81 HydrophobicContact CD1-CB 3.92Å; L66-A82 HydrophobicContact CD1-CB 4.19Å; L66-I89 HydrophobicContact CD2-CG1 4.36Å; L66-A99 HydrophobicContact CD2-CB 4.26Å; L66-A99 HydrophobicContact CG-CB 4.4Å; L66-L115 HydrophobicContact CD2-CD2 4.45Å
67	T	87.8	Confident	84.9	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.018	19%	0.194	C	C	.	.	H	α-helix	trans	-55.3	-42.1	177.5	-46.1	0	0	0	0	111.3	E63 S64 R71 N102	E63-T67 HydrophobicContact CB-CG2 4.23Å; E63-T67 HydrophobicContact CG-CG2 4.25Å; S64-T67 PolarHBondContact N-OG1 3.46Å; S64-T67 WeakPolarHBondContact O-CB 3.38Å; S64-T67 PolarHBondContact O-N 3.14Å; S64-T67 PolarHBondContact OG-N 3.23Å; S64-T67 PolarHBondContact OG-OG1 2.87Å; T67-R71 VanDerWaalsContact O-CB 3.24Å; T67-R71 WeakPolarHBondContact O-CB 3.45Å; T67-R71 PolarHBondContact O-N 3.38Å; T67-N102 HydrophobicContact CG2-CB 4.48Å; T67-N102 VanDerWaalsContact CG2-ND2 3.35Å; T67-N102 WeakPolarHBondContact CG2-ND2 3.26Å
68	V	87.5	Confident	85.2	Confident	1 Å²	1	30 Å²	30	1%	0.006	18%	0.184	C	C	.	.	H	α-helix	trans	-74.7	-38.7	178.2	-176.9	0	0	0	0	112.6	F36 V39 E40 E63 S64 L66 V70 R71 S72	F36-V68 HydrophobicContact CD1-CB 3.94Å; F36-V68 HydrophobicContact CD1-CG1 4.2Å; F36-V68 HydrophobicContact CD1-CG2 3.6Å; F36-V68 HydrophobicContact CE1-CB 4.23Å; F36-V68 HydrophobicContact CE1-CG2 3.72Å; V39-V68 HydrophobicContact CG1-CB 4.5Å; V39-V68 HydrophobicContact CG1-CG1 4.12Å; E40-V68 HydrophobicContact CB-CG1 4.21Å; E63-V68 HydrophobicContact CB-CG2 3.83Å; E63-V68 WeakPolarHBondContact OE2-CG2 3.46Å; S64-V68 PolarHBondContact O-N 3.35Å; L66-V68 VanDerWaalsContact C-N 3.27Å; L66-V68 PolarHBondContact O-N 2.9Å; V68-V70 VanDerWaalsContact C-N 3.3Å; V68-V70 PolarHBondContact O-N 3.44Å; V68-R71 PolarHBondContact O-N 3.29Å; V68-S72 WeakPolarHBondContact O-CB 3.43Å; V68-S72 PolarHBondContact O-N 3.46Å; V68-S72 PolarHBondContact O-OG 2.99Å; V68-S72 VanDerWaalsContact O-OG 3.1Å
69	A	88	Confident	85.5	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-34.5	173.8	0	0	0	0	0	112.8	V39 L65 L66 S72 G73 N74 V77 A78 L81	V39-A69 VanDerWaalsContact CG1-CA 3.47Å; V39-A69 HydrophobicContact CG1-CB 3.76Å; L65-A69 WeakPolarHBondContact O-CB 3.25Å; L65-A69 PolarHBondContact O-N 3.33Å; L66-A69 PolarHBondContact O-N 3.14Å; A69-S72 PolarHBondContact O-OG 3.29Å; A69-G73 PolarHBondContact O-N 3.3Å; A69-N74 PolarHBondContact O-N 3.47Å; A69-V77 HydrophobicContact CB-CB 4.24Å; A69-V77 HydrophobicContact CB-CG1 3.74Å; A69-A78 HydrophobicContact CB-CB 4.24Å; A69-L81 HydrophobicContact CB-CD1 3.92Å
70	V	90	Very high	85.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.1	-55.2	169.8	168.2	0	0	0	0	109.6	L66 V68 S72 G73 A78 A99 N102 A103 H108 I111 L115	L66-V70 HydrophobicContact CD1-CG2 3.96Å; L66-V70 HydrophobicContact CG-CG2 4.19Å; L66-V70 WeakPolarHBondContact O-CB 3.48Å; L66-V70 WeakPolarHBondContact O-CG2 3.35Å; L66-V70 PolarHBondContact O-N 3.28Å; V68-V70 VanDerWaalsContact C-N 3.3Å; V68-V70 PolarHBondContact O-N 3.44Å; V70-S72 VanDerWaalsContact C-N 3.3Å; V70-S72 PolarHBondContact O-N 2.8Å; V70-G73 PolarHBondContact O-N 2.97Å; V70-A78 HydrophobicContact CG2-CB 4.5Å; V70-A99 WeakPolarHBondContact CG1-O 3.3Å; V70-A99 HydrophobicContact CG2-CB 4.41Å; V70-N102 HydrophobicContact CG1-CB 3.99Å; V70-A103 HydrophobicContact CG1-CB 3.59Å; V70-H108 PolarHBondContact O-CD2 2.99Å; V70-H108 PolarHBondContact O-NE2 3.33Å; V70-I111 HydrophobicContact CB-CG2 4.2Å; V70-I111 HydrophobicContact CG1-CG2 4.02Å; V70-I111 HydrophobicContact CG2-CG2 3.7Å; V70-L115 HydrophobicContact CG2-CD1 4.29Å
71	R	88.9	Confident	85.4	Confident	75 Å²	75	29.6 Å²	29.6	28%	0.283	17%	0.166	S	C	.	.	H	α-helix	trans	-57.8	-40.8	-176.3	-172	164.8	59.9	68.7	-7	112.1	E40 E63 T67 V68 G73 H108	E40-R71 IonicContact OE1-CZ 3.86Å; E40-R71 VanDerWaalsContact OE1-CZ 3.29Å; E40-R71 IonicContact OE1-NH1 2.71Å; E40-R71 PolarHBondContact OE1-NH1 2.86Å; E40-R71 IonicContact OE1-NH2 2.79Å; E40-R71 PolarHBondContact OE1-NH2 3.29Å; E63-R71 IonicContact OE1-NH2 3.19Å; E63-R71 IonicContact OE2-CZ 2.99Å; E63-R71 IonicContact OE2-NE 2.78Å; E63-R71 PolarHBondContact OE2-NE 2.91Å; E63-R71 IonicContact OE2-NH2 2.79Å; E63-R71 PolarHBondContact OE2-NH2 2.95Å; T67-R71 VanDerWaalsContact O-CB 3.24Å; T67-R71 WeakPolarHBondContact O-CB 3.45Å; T67-R71 PolarHBondContact O-N 3.38Å; V68-R71 PolarHBondContact O-N 3.29Å; R71-G73 VanDerWaalsContact C-N 3.31Å; R71-G73 PolarHBondContact O-N 3.04Å; R71-H108 PolarHBondContact O-NE2 2.92Å; R71-H108 VanDerWaalsContact O-NE2 3.14Å
72	S	86.3	Confident	85.7	Confident	36 Å²	36	25.5 Å²	25.5	25%	0.252	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-8.1	177	70.4	0	0	0	0	115.3	V39 V68 A69 V70 N74	V39-S72 WeakPolarHBondContact O-CB 3.41Å; V39-S72 PolarHBondContact O-OG 3.19Å; V68-S72 WeakPolarHBondContact O-CB 3.43Å; V68-S72 PolarHBondContact O-N 3.46Å; V68-S72 PolarHBondContact O-OG 2.99Å; V68-S72 VanDerWaalsContact O-OG 3.1Å; A69-S72 PolarHBondContact O-OG 3.29Å; V70-S72 VanDerWaalsContact C-N 3.3Å; V70-S72 PolarHBondContact O-N 2.8Å; S72-N74 VanDerWaalsContact C-N 3.32Å
73	G	87.3	Confident	85.5	Confident	23 Å²	23	30.9 Å²	30.9	24%	0.237	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	16	-179.8	0	0	0	0	0	114.3	A69 V70 R71 T75 H108	A69-G73 PolarHBondContact O-N 3.3Å; V70-G73 PolarHBondContact O-N 2.97Å; R71-G73 VanDerWaalsContact C-N 3.31Å; R71-G73 PolarHBondContact O-N 3.04Å; G73-T75 VanDerWaalsContact C-N 3.32Å; G73-T75 PolarHBondContact O-N 3.49Å; G73-H108 WeakPolarHBondContact CA-CE1 3.33Å; G73-H108 WeakPolarHBondContact CA-NE2 3.47Å; G73-H108 PolarHBondContact N-NE2 3.26Å
74	N	86.8	Confident	85.3	Confident	12 Å²	12	33.8 Å²	33.8	6%	0.064	18%	0.182	C	C	.	.			trans	-78.5	78.9	-177.2	-168.3	-24	0	0	0	111	A69 S72 A76 V77 A78	A69-N74 PolarHBondContact O-N 3.47Å; S72-N74 VanDerWaalsContact C-N 3.32Å; N74-A76 PolarHBondContact O-N 2.98Å; N74-A76 VanDerWaalsContact O-N 3.13Å; N74-V77 HydrophobicContact CB-CB 4.3Å; N74-V77 WeakPolarHBondContact ND2-CG2 3.35Å; N74-V77 PolarHBondContact O-N 3.47Å; N74-V77 VanDerWaalsContact O-N 3.14Å; N74-V77 WeakPolarHBondContact OD1-CG2 3.32Å; N74-V77 PolarHBondContact OD1-N 3.35Å; N74-A78 WeakPolarHBondContact O-CB 3.34Å; N74-A78 PolarHBondContact O-N 3Å
75	T	86	Confident	84.7	Confident	66 Å²	66	35.7 Å²	35.7	41%	0.405	19%	0.191	S	C	.	.	H	α-helix	trans	-53.3	-34.2	-176	56.8	0	0	0	0	113.8	G73 K79 D110 I111	G73-T75 VanDerWaalsContact C-N 3.32Å; G73-T75 PolarHBondContact O-N 3.49Å; T75-K79 WeakPolarHBondContact O-CB 3.13Å; T75-K79 PolarHBondContact O-N 3.32Å; T75-D110 HydrophobicContact CG2-CB 4.06Å; T75-I111 HydrophobicContact CG2-CD1 4.19Å; T75-I111 HydrophobicContact CG2-CG1 3.83Å
76	A	85.1	Confident	84.1	Confident	49 Å²	49	39.1 Å²	39.1	41%	0.405	21%	0.214	S	C	.	.	H	α-helix	trans	-68.9	-48.4	178.7	0	0	0	0	0	112	N74 Q80	N74-A76 PolarHBondContact O-N 2.98Å; N74-A76 VanDerWaalsContact O-N 3.13Å; A76-Q80 WeakPolarHBondContact O-CG 3.32Å; A76-Q80 PolarHBondContact O-N 3.43Å; A76-Q80 VanDerWaalsContact O-N 3.14Å
77	V	82.8	Confident	83.5	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.018	25%	0.253	C	S	.	.	H	α-helix	trans	-71.2	-42.5	179.3	174.6	0	0	0	0	110.9	V39 L46 L50 A69 N74 K79 Q80 L81	V39-V77 HydrophobicContact CG2-CG1 4.43Å; L46-V77 HydrophobicContact CD1-CG1 4.02Å; L46-V77 HydrophobicContact CD1-CG2 3.66Å; L46-V77 HydrophobicContact CG-CG2 4.17Å; L50-V77 HydrophobicContact CD1-CG1 4.23Å; A69-V77 HydrophobicContact CB-CB 4.24Å; A69-V77 HydrophobicContact CB-CG1 3.74Å; N74-V77 HydrophobicContact CB-CB 4.3Å; N74-V77 WeakPolarHBondContact ND2-CG2 3.35Å; N74-V77 PolarHBondContact O-N 3.47Å; N74-V77 VanDerWaalsContact O-N 3.14Å; N74-V77 WeakPolarHBondContact OD1-CG2 3.32Å; N74-V77 PolarHBondContact OD1-N 3.35Å; V77-K79 VanDerWaalsContact C-N 3.32Å; V77-K79 PolarHBondContact O-N 3.3Å; V77-Q80 PolarHBondContact O-N 2.88Å; V77-L81 HydrophobicContact CG1-CD1 3.69Å; V77-L81 HydrophobicContact CG1-CG 4.32Å; V77-L81 WeakPolarHBondContact O-CB 3.48Å; V77-L81 WeakPolarHBondContact O-CG 3.41Å; V77-L81 PolarHBondContact O-N 3.11Å
78	A	86.5	Confident	83	Confident	3 Å²	3	47.4 Å²	47.4	3%	0.025	26%	0.261	C	S	.	.	H	α-helix	trans	-59.6	-41.8	175.6	0	0	0	0	0	111.9	L66 A69 V70 N74 L81 A82 I111	L66-A78 HydrophobicContact CD1-CB 4.44Å; A69-A78 HydrophobicContact CB-CB 4.24Å; V70-A78 HydrophobicContact CG2-CB 4.5Å; N74-A78 WeakPolarHBondContact O-CB 3.34Å; N74-A78 PolarHBondContact O-N 3Å; A78-L81 PolarHBondContact O-N 3.17Å; A78-A82 WeakPolarHBondContact O-CB 3.46Å; A78-A82 PolarHBondContact O-N 3.18Å; A78-I111 HydrophobicContact CB-CD1 4.18Å; A78-I111 HydrophobicContact CB-CG2 4.35Å
79	K	84.8	Confident	82.8	Confident	102 Å²	102	47.5 Å²	47.5	44%	0.443	26%	0.261	S	S	.	.	H	α-helix	trans	-64.3	-38.1	175.1	-177.1	169.4	-176.8	170.7	0	113.1	T75 V77 Q83 L114	T75-K79 WeakPolarHBondContact O-CB 3.13Å; T75-K79 PolarHBondContact O-N 3.32Å; V77-K79 VanDerWaalsContact C-N 3.32Å; V77-K79 PolarHBondContact O-N 3.3Å; K79-Q83 WeakPolarHBondContact O-CB 3.37Å; K79-Q83 VanDerWaalsContact O-CG 3.24Å; K79-Q83 WeakPolarHBondContact O-CG 3.46Å; K79-Q83 PolarHBondContact O-N 3.12Å; K79-L114 HydrophobicContact CB-CD1 3.91Å; K79-L114 HydrophobicContact CB-CD2 4.44Å; K79-L114 HydrophobicContact CD-CD1 4.48Å; K79-L114 HydrophobicContact CD-CD2 4.04Å; K79-L114 HydrophobicContact CG-CD1 4.37Å; K79-L114 HydrophobicContact CG-CD2 4.03Å
80	Q	81.7	Confident	82.7	Confident	107 Å²	107	50.6 Å²	50.6	50%	0.5	28%	0.278	S	S	.	.	H	α-helix	trans	-70.2	-42.9	176.9	-74.5	176	-16	0	0	111.4	L50 A76 V77 Q83 L84	L50-Q80 HydrophobicContact CD1-CB 3.94Å; A76-Q80 WeakPolarHBondContact O-CG 3.32Å; A76-Q80 PolarHBondContact O-N 3.43Å; A76-Q80 VanDerWaalsContact O-N 3.14Å; V77-Q80 PolarHBondContact O-N 2.88Å; Q80-Q83 PolarHBondContact O-N 2.96Å; Q80-L84 WeakPolarHBondContact O-CG 3.38Å; Q80-L84 PolarHBondContact O-N 3.31Å
81	L	83.1	Confident	82.4	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-65.3	-47.1	178.6	-74.2	168.1	0	0	0	112.6	L50 L65 L66 A69 V77 A78 Q83 L84 D85	L50-L81 HydrophobicContact CD2-CD2 4.07Å; L65-L81 HydrophobicContact CB-CD1 4.28Å; L65-L81 HydrophobicContact CD2-CD1 4.41Å; L65-L81 HydrophobicContact CD2-CD2 4.32Å; L65-L81 HydrophobicContact CG-CD1 4.06Å; L65-L81 WeakPolarHBondContact O-CD1 3.5Å; L66-L81 HydrophobicContact CB-CB 4.28Å; L66-L81 HydrophobicContact CB-CD1 4.44Å; L66-L81 HydrophobicContact CD1-CB 3.92Å; A69-L81 HydrophobicContact CB-CD1 3.92Å; V77-L81 HydrophobicContact CG1-CD1 3.69Å; V77-L81 HydrophobicContact CG1-CG 4.32Å; V77-L81 WeakPolarHBondContact O-CB 3.48Å; V77-L81 WeakPolarHBondContact O-CG 3.41Å; V77-L81 PolarHBondContact O-N 3.11Å; A78-L81 PolarHBondContact O-N 3.17Å; L81-Q83 PolarHBondContact O-N 2.85Å; L81-Q83 VanDerWaalsContact O-N 3.16Å; L81-L84 PolarHBondContact O-N 2.93Å; L81-D85 PolarHBondContact O-N 2.94Å
82	A	82.3	Confident	82.4	Confident	4 Å²	4	54.3 Å²	54.3	3%	0.033	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-8.2	178.2	0	0	0	0	0	113.8	L66 A78 I89 N118	L66-A82 HydrophobicContact CD1-CB 4.19Å; A78-A82 WeakPolarHBondContact O-CB 3.46Å; A78-A82 PolarHBondContact O-N 3.18Å; A82-I89 HydrophobicContact CB-CD1 4.47Å; A82-N118 WeakPolarHBondContact CB-ND2 3.4Å; A82-N118 PolarHBondContact O-ND2 3.45Å
83	Q	80.2	Confident	82.4	Confident	128 Å²	128	53.5 Å²	53.5	60%	0.598	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-10.9	169.8	-74.7	-175.9	-18.7	0	0	113.6	K79 Q80 L81	K79-Q83 WeakPolarHBondContact O-CB 3.37Å; K79-Q83 VanDerWaalsContact O-CG 3.24Å; K79-Q83 WeakPolarHBondContact O-CG 3.46Å; K79-Q83 PolarHBondContact O-N 3.12Å; Q80-Q83 PolarHBondContact O-N 2.96Å; L81-Q83 PolarHBondContact O-N 2.85Å; L81-Q83 VanDerWaalsContact O-N 3.16Å
84	L	78.1	Confident	82.4	Confident	69 Å²	69	58.6 Å²	58.6	36%	0.361	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-53.5	176.7	-75.4	165.2	0	0	0	111	L50 Q80 L81 P86	L50-L84 HydrophobicContact CB-CD1 4.02Å; Q80-L84 WeakPolarHBondContact O-CG 3.38Å; Q80-L84 PolarHBondContact O-N 3.31Å; L81-L84 PolarHBondContact O-N 2.93Å; L84-P86 WeakPolarHBondContact O-CD 3.46Å
85	D	73.4	Confident	82.1	Confident	49 Å²	49	64.6 Å²	64.6	26%	0.262	35%	0.346	S	S	.	.			trans	-123.3	85.3	-176.9	-64.3	-44.6	0	0	0	111.4	S55 L81 D87 A88	S55-D85 WeakPolarHBondContact CB-OD2 3.39Å; S55-D85 PolarHBondContact OG-OD2 3.37Å; L81-D85 PolarHBondContact O-N 2.94Å; D85-D87 VanDerWaalsContact C-N 3.31Å; D85-D87 PolarHBondContact O-N 2.88Å; D85-A88 HydrophobicContact CB-CB 4.09Å; D85-A88 PolarHBondContact O-N 3.13Å
86	P	72.2	Confident	82.2	Confident	75 Å²	75	61.9 Å²	61.9	49%	0.487	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-67.4	-30.7	177.8	27.5	-34.5	0	0	0	112.8	L84 A88 I89	L84-P86 WeakPolarHBondContact O-CD 3.46Å; P86-A88 PolarHBondContact O-N 2.91Å; P86-I89 WeakPolarHBondContact O-CD1 3.49Å; P86-I89 WeakPolarHBondContact O-CG1 3.24Å; P86-I89 PolarHBondContact O-N 3Å
87	D	74.5	Confident	82.4	Confident	168 Å²	168	61.2 Å²	61.2	90%	0.898	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-70.1	-14.4	-178.2	-63.7	-18.8	0	0	0	113.3	D85	D85-D87 VanDerWaalsContact C-N 3.31Å; D85-D87 PolarHBondContact O-N 2.88Å
88	A	77.3	Confident	82.8	Confident	22 Å²	22	61 Å²	61	18%	0.182	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-100.8	6.5	-176.3	0	0	0	0	0	114.1	D85 P86 D90 E91	D85-A88 HydrophobicContact CB-CB 4.09Å; D85-A88 PolarHBondContact O-N 3.13Å; P86-A88 PolarHBondContact O-N 2.91Å; A88-D90 PolarHBondContact O-N 3.39Å; A88-E91 HydrophobicContact CB-CG 4.48Å; A88-E91 WeakPolarHBondContact O-CB 3.35Å; A88-E91 PolarHBondContact O-N 3.23Å
89	I	83.9	Confident	83	Confident	4 Å²	4	61 Å²	61	2%	0.021	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-35.3	-172.5	-71.9	175.2	0	0	0	113	L66 A82 P86 E91 L115 N118 A120	L66-I89 HydrophobicContact CD2-CG1 4.36Å; A82-I89 HydrophobicContact CB-CD1 4.47Å; P86-I89 WeakPolarHBondContact O-CD1 3.49Å; P86-I89 WeakPolarHBondContact O-CG1 3.24Å; P86-I89 PolarHBondContact O-N 3Å; I89-E91 VanDerWaalsContact C-N 3.34Å; I89-L115 HydrophobicContact CG2-CD2 4.04Å; I89-N118 HydrophobicContact CD1-CB 3.63Å; I89-A120 HydrophobicContact CG2-CB 3.56Å
90	D	85.1	Confident	83.4	Confident	64 Å²	64	56.2 Å²	56.2	34%	0.342	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	6.8	179.9	-68.5	-39	0	0	0	113.5	A88 S121 Q124	A88-D90 PolarHBondContact O-N 3.39Å; D90-S121 WeakPolarHBondContact OD1-CB 3.22Å; D90-S121 PolarHBondContact OD1-N 3.19Å; D90-S121 PolarHBondContact OD1-OG 2.68Å; D90-S121 PolarHBondContact OD2-OG 3.22Å; D90-Q124 PolarHBondContact O-NE2 3.04Å
91	E	84.8	Confident	83.9	Confident	85 Å²	85	51.1 Å²	51.1	40%	0.397	27%	0.272	S	S	.	.			trans	-63.3	137.5	173.8	-79.9	-168.8	-140.3	0	0	111.5	R58 A88 I89	R58-E91 IonicContact CZ-OE2 2.68Å; R58-E91 IonicContact NE-OE2 2.79Å; R58-E91 PolarHBondContact NE-OE2 3Å; R58-E91 IonicContact NH2-OE1 3.19Å; R58-E91 PolarHBondContact NH2-OE1 3.3Å; R58-E91 VanDerWaalsContact NH2-OE1 3.1Å; R58-E91 IonicContact NH2-OE2 3.29Å; R58-E91 PolarHBondContact NH2-OE2 3.08Å; A88-E91 HydrophobicContact CB-CG 4.48Å; A88-E91 WeakPolarHBondContact O-CB 3.35Å; A88-E91 PolarHBondContact O-N 3.23Å; I89-E91 VanDerWaalsContact C-N 3.34Å
92	T	88.1	Confident	84.4	Confident	69 Å²	69	51.4 Å²	51.4	42%	0.423	27%	0.273	S	S	.	.			trans	-104.3	146.5	177.2	60.5	0	0	0	0	111.8	G96 W97	T92-G96 WeakPolarHBondContact CG2-O 3.23Å; T92-W97 WeakPolarHBondContact CA-O 3.49Å
93	D	87.2	Confident	84.9	Confident	19 Å²	19	51.2 Å²	51.2	10%	0.102	27%	0.272	C	S	.	.			trans	-72.3	-174.9	167.7	62.5	27.9	0	0	0	113.1	E63 E95 G96 W97	E63-D93 HydrophobicContact CG-CB 4.14Å; D93-E95 PolarHBondContact O-N 2.84Å; D93-E95 WeakPolarHBondContact OD1-CA 3.35Å; D93-E95 PolarHBondContact OD1-N 3.24Å; D93-G96 PolarHBondContact O-N 2.92Å; D93-G96 PolarHBondContact OD1-N 3.01Å; D93-W97 PolarHBondContact N-O 2.93Å; D93-W97 VanDerWaalsContact N-O 3.16Å; D93-W97 PolarHBondContact OD1-N 3.24Å
94	N	86.7	Confident	85.6	Confident	130 Å²	130	45.1 Å²	45.1	70%	0.695	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.8	179.9	-66.8	-27.7	0	0	0	113.8	N61	N61-N94 WeakPolarHBondContact O-CB 3.49Å; N61-N94 PolarHBondContact O-N 3.34Å; N61-N94 PolarHBondContact O-ND2 3.06Å; N61-N94 VanDerWaalsContact O-ND2 3.07Å
95	E	81.2	Confident	86.3	Confident	138 Å²	138	44.3 Å²	44.3	65%	0.645	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.1	6.1	175	-66.2	-173.4	-168.7	0	0	111.8	D93 L127	D93-E95 PolarHBondContact O-N 2.84Å; D93-E95 WeakPolarHBondContact OD1-CA 3.35Å; D93-E95 PolarHBondContact OD1-N 3.24Å; E95-L127 VanDerWaalsContact O-CD1 3.22Å; E95-L127 WeakPolarHBondContact O-CD1 3.15Å
96	G	86.4	Confident	87.2	Confident	9 Å²	9	43.9 Å²	43.9	9%	0.093	24%	0.238	C	C	.	.			trans	80.2	12.3	176.2	0	0	0	0	0	115.1	T92 D93	T92-G96 WeakPolarHBondContact CG2-O 3.23Å; D93-G96 PolarHBondContact O-N 2.92Å; D93-G96 PolarHBondContact OD1-N 3.01Å
97	W	90.1	Very high	88.2	Confident	34 Å²	34	41.1 Å²	41.1	13%	0.129	22%	0.223	C	C	.	.			trans	-85.1	120.8	-179.4	-62.9	72.9	0	0	0	111.2	T92 D93 L101 N102 H105 W135	T92-W97 WeakPolarHBondContact CA-O 3.49Å; D93-W97 PolarHBondContact N-O 2.93Å; D93-W97 VanDerWaalsContact N-O 3.16Å; D93-W97 PolarHBondContact OD1-N 3.24Å; W97-L101 HydrophobicContact CE3-CB 3.84Å; W97-N102 VanDerWaalsContact CB-ND2 3.29Å; W97-N102 WeakPolarHBondContact CB-ND2 3.12Å; W97-H105 AromaticContact CH2-CD2 3.74Å; W97-H105 HydrophobicContact CZ3-CB 3.79Å; W97-H105 AromaticContact CZ3-CD2 3.87Å; W97-H105 AromaticContact CZ3-CG 3.96Å; W97-W135 AromaticContact CH2-CD2 3.82Å; W97-W135 HydrophobicContact CH2-CD2 3.82Å; W97-W135 AromaticContact CH2-CE2 3.39Å; W97-W135 HydrophobicContact CH2-CE3 4.15Å; W97-W135 AromaticContact CH2-CH2 3.73Å; W97-W135 HydrophobicContact CH2-CH2 3.73Å; W97-W135 AromaticContact CH2-CZ2 3.35Å; W97-W135 HydrophobicContact CH2-CZ2 3.35Å; W97-W135 HydrophobicContact CH2-CZ3 4.11Å; W97-W135 AromaticContact CH2-NE1 3.87Å; W97-W135 HydrophobicContact CZ2-CH2 4.19Å; W97-W135 AromaticContact CZ2-CZ2 3.74Å; W97-W135 HydrophobicContact CZ2-CZ2 3.74Å; W97-W135 HydrophobicContact CZ3-CD2 4.1Å; W97-W135 AromaticContact CZ3-CE2 3.93Å; W97-W135 HydrophobicContact CZ3-CG 4.37Å; W97-W135 HydrophobicContact CZ3-CZ2 4.32Å
98	S	90.9	Very high	89.1	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.192	C	C	.	.			trans	-74.9	169.8	169.1	72.4	0	0	0	0	112.2	L100 L101 N102 Q124	S98-L100 VanDerWaalsContact C-N 3.26Å; S98-L100 PolarHBondContact O-N 3.32Å; S98-L100 PolarHBondContact OG-N 3.27Å; S98-L101 PolarHBondContact O-N 3.42Å; S98-L101 PolarHBondContact OG-N 3.01Å; S98-N102 PolarHBondContact O-N 3.39Å; S98-N102 PolarHBondContact O-ND2 3.02Å; S98-Q124 PolarHBondContact OG-OE1 2.98Å
99	A	91.1	Very high	89.9	Confident	2 Å²	2	36.4 Å²	36.4	2%	0.017	19%	0.194	C	C	.	.	H	α-helix	trans	-57.8	-40	171.4	0	0	0	0	0	111.6	L66 V70 N102 A103 L115	L66-A99 HydrophobicContact CD2-CB 4.26Å; L66-A99 HydrophobicContact CG-CB 4.4Å; V70-A99 WeakPolarHBondContact CG1-O 3.3Å; V70-A99 HydrophobicContact CG2-CB 4.41Å; A99-N102 PolarHBondContact O-N 2.92Å; A99-A103 WeakPolarHBondContact O-CB 3.25Å; A99-A103 PolarHBondContact O-N 3.16Å; A99-L115 HydrophobicContact CB-CD1 4.14Å; A99-L115 HydrophobicContact CB-CD2 3.96Å
100	L	93.2	Very high	90.3	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-70.8	-39.1	-179.9	-172.4	61.8	0	0	0	112.4	S98 A103 A104 V112 L115 I116 A120 P132 L148	S98-L100 VanDerWaalsContact C-N 3.26Å; S98-L100 PolarHBondContact O-N 3.32Å; S98-L100 PolarHBondContact OG-N 3.27Å; L100-A103 PolarHBondContact O-N 2.97Å; L100-A104 VanDerWaalsContact O-CB 3.24Å; L100-A104 WeakPolarHBondContact O-CB 3.49Å; L100-A104 PolarHBondContact O-N 3.3Å; L100-V112 HydrophobicContact CD1-CG1 4.23Å; L100-L115 HydrophobicContact CD1-CB 4.21Å; L100-L115 HydrophobicContact CD1-CD1 4.32Å; L100-I116 HydrophobicContact CD1-CG1 4.35Å; L100-A120 HydrophobicContact CB-CB 4.39Å; L100-A120 HydrophobicContact CD2-CB 4.27Å; L100-P132 HydrophobicContact CD2-CB 4.35Å; L100-P132 HydrophobicContact CD2-CG 4.12Å; L100-P132 HydrophobicContact CG-CB 4.13Å; L100-P132 HydrophobicContact CG-CG 4.15Å; L100-L148 HydrophobicContact CD1-CD2 4.48Å; L100-L148 HydrophobicContact CD2-CD2 4.28Å
101	L	93	Very high	90.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.2	-46.2	172.9	-77.1	165.2	0	0	0	111.3	W97 S98 A104 H105 D126 P132	W97-L101 HydrophobicContact CE3-CB 3.84Å; S98-L101 PolarHBondContact O-N 3.42Å; S98-L101 PolarHBondContact OG-N 3.01Å; L101-A104 PolarHBondContact O-N 3.44Å; L101-H105 WeakPolarHBondContact O-CB 3.39Å; L101-H105 PolarHBondContact O-N 3.38Å; L101-D126 HydrophobicContact CD1-CB 4.18Å; L101-P132 HydrophobicContact CD2-CB 4.34Å; L101-P132 HydrophobicContact CD2-CG 3.85Å; L101-P132 HydrophobicContact CG-CG 4.1Å
102	N	92.2	Very high	91.1	Very high	10 Å²	10	33.7 Å²	33.7	5%	0.053	18%	0.183	C	C	.	.	H	α-helix	trans	-61.9	-45.1	175.1	-92	-79.6	0	0	0	112.6	T67 V70 W97 S98 A99 A104 H105 C106	T67-N102 HydrophobicContact CG2-CB 4.48Å; T67-N102 VanDerWaalsContact CG2-ND2 3.35Å; T67-N102 WeakPolarHBondContact CG2-ND2 3.26Å; V70-N102 HydrophobicContact CG1-CB 3.99Å; W97-N102 VanDerWaalsContact CB-ND2 3.29Å; W97-N102 WeakPolarHBondContact CB-ND2 3.12Å; S98-N102 PolarHBondContact O-N 3.39Å; S98-N102 PolarHBondContact O-ND2 3.02Å; A99-N102 PolarHBondContact O-N 2.92Å; N102-A104 PolarHBondContact O-N 2.96Å; N102-H105 PolarHBondContact O-N 3.41Å; N102-C106 WeakPolarHBondContact O-CB 3.48Å; N102-C106 PolarHBondContact O-N 3.1Å; N102-C106 PolarHBondContact O-SG 2.72Å; N102-C106 VanDerWaalsContact O-SG 3.38Å
103	A	93.7	Very high	91.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.8	-44.2	178.2	0	0	0	0	0	111.8	V70 A99 L100 C106 G107 H108 I111 V112 L115	V70-A103 HydrophobicContact CG1-CB 3.59Å; A99-A103 WeakPolarHBondContact O-CB 3.25Å; A99-A103 PolarHBondContact O-N 3.16Å; L100-A103 PolarHBondContact O-N 2.97Å; A103-C106 PolarHBondContact O-N 3.02Å; A103-G107 PolarHBondContact O-N 3.47Å; A103-H108 PolarHBondContact O-N 3.48Å; A103-I111 HydrophobicContact CB-CG2 4.2Å; A103-V112 HydrophobicContact CB-CG2 3.63Å; A103-L115 HydrophobicContact CB-CD1 3.68Å
104	A	94.4	Very high	91.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-71.2	-35.4	-179.3	0	0	0	0	0	112.9	L100 L101 N102 P132 A136 H141 V144 L148	L100-A104 VanDerWaalsContact O-CB 3.24Å; L100-A104 WeakPolarHBondContact O-CB 3.49Å; L100-A104 PolarHBondContact O-N 3.3Å; L101-A104 PolarHBondContact O-N 3.44Å; N102-A104 PolarHBondContact O-N 2.96Å; A104-P132 HydrophobicContact CB-CB 3.98Å; A104-P132 WeakPolarHBondContact CB-O 3.48Å; A104-A136 HydrophobicContact CB-CB 4.44Å; A104-H141 PolarHBondContact O-CD2 3.48Å; A104-V144 HydrophobicContact CB-CG1 4Å; A104-L148 HydrophobicContact CB-CD1 4.45Å
105	H	93.7	Very high	91.8	Very high	52 Å²	52	30.3 Å²	30.3	24%	0.241	15%	0.154	C	C	.	.	H	α-helix	trans	-66.3	-42.3	173.1	165.9	-83.5	0	0	0	112.5	W97 L101 N102 W135 K139 H141	W97-H105 AromaticContact CH2-CD2 3.74Å; W97-H105 HydrophobicContact CZ3-CB 3.79Å; W97-H105 AromaticContact CZ3-CD2 3.87Å; W97-H105 AromaticContact CZ3-CG 3.96Å; L101-H105 WeakPolarHBondContact O-CB 3.39Å; L101-H105 PolarHBondContact O-N 3.38Å; N102-H105 PolarHBondContact O-N 3.41Å; H105-W135 AromaticContact CD2-CE3 3.83Å; H105-W135 AromaticContact CD2-CZ3 3.97Å; H105-K139 WeakPolarHBondContact CD2-CE 3.32Å; H105-K139 PolarHBondContact CD2-NZ 3.23Å; H105-K139 VanDerWaalsContact CD2-NZ 3.27Å; H105-K139 WeakPolarHBondContact NE2-CE 3.43Å; H105-K139 PolarHBondContact NE2-NZ 3.42Å; H105-H141 PolarHBondContact O-NE2 2.89Å
106	C	92.4	Very high	92.3	Very high	40 Å²	40	25.5 Å²	25.5	27%	0.27	13%	0.132	S	C	.	.	H	α-helix	trans	-81	-21.5	-178.2	-66.3	0	0	0	0	113.8	N102 A103 H108	N102-C106 WeakPolarHBondContact O-CB 3.48Å; N102-C106 PolarHBondContact O-N 3.1Å; N102-C106 PolarHBondContact O-SG 2.72Å; N102-C106 VanDerWaalsContact O-SG 3.38Å; A103-C106 PolarHBondContact O-N 3.02Å; C106-H108 WeakPolarHBondContact CB-CD2 3.18Å; C106-H108 WeakPolarHBondContact CB-NE2 3.39Å
107	G	91.8	Very high	92.5	Very high	17 Å²	17	30.7 Å²	30.7	18%	0.175	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	90	18.7	176.9	0	0	0	0	0	114.7	A103 V109 H141	A103-G107 PolarHBondContact O-N 3.47Å; G107-V109 VanDerWaalsContact C-N 3.35Å; G107-V109 PolarHBondContact O-N 3.47Å; G107-H141 VanDerWaalsContact CA-CD2 3.46Å; G107-H141 WeakPolarHBondContact CA-CD2 3.37Å; G107-H141 VanDerWaalsContact CA-CE1 3.46Å; G107-H141 WeakPolarHBondContact CA-CE1 3.12Å; G107-H141 WeakPolarHBondContact CA-NE2 3.48Å; G107-H141 PolarHBondContact N-NE2 2.97Å
108	H	93.7	Very high	92.3	Very high	51 Å²	51	31.8 Å²	31.8	24%	0.236	17%	0.166	C	C	.	.			trans	-79.6	78.1	-171.7	-63.8	-51.8	0	0	0	111.7	V70 R71 G73 A103 C106 D110 I111 V112	V70-H108 PolarHBondContact O-CD2 2.99Å; V70-H108 PolarHBondContact O-NE2 3.33Å; R71-H108 PolarHBondContact O-NE2 2.92Å; R71-H108 VanDerWaalsContact O-NE2 3.14Å; G73-H108 WeakPolarHBondContact CA-CE1 3.33Å; G73-H108 WeakPolarHBondContact CA-NE2 3.47Å; G73-H108 PolarHBondContact N-NE2 3.26Å; A103-H108 PolarHBondContact O-N 3.48Å; C106-H108 WeakPolarHBondContact CB-CD2 3.18Å; C106-H108 WeakPolarHBondContact CB-NE2 3.39Å; H108-D110 VanDerWaalsContact C-N 3.33Å; H108-D110 PolarHBondContact O-N 2.92Å; H108-I111 HydrophobicContact CB-CB 3.86Å; H108-I111 HydrophobicContact CB-CD1 3.94Å; H108-I111 HydrophobicContact CB-CG1 3.94Å; H108-I111 CarbonylContact O-C 3.58Å; H108-I111 WeakPolarHBondContact O-CA 3.4Å; H108-I111 WeakPolarHBondContact O-CB 3.42Å; H108-I111 PolarHBondContact O-N 3.1Å; H108-V112 PolarHBondContact O-N 3.16Å
109	V	94.2	Very high	92.1	Very high	39 Å²	39	34.6 Å²	34.6	24%	0.236	20%	0.195	C	C	.	.	H	α-helix	trans	-45.7	-49	-173.2	-172.5	0	0	0	0	113.7	G107 I111 V112 R113 D143 V144 L147	G107-V109 VanDerWaalsContact C-N 3.35Å; G107-V109 PolarHBondContact O-N 3.47Å; V109-I111 VanDerWaalsContact C-N 3.32Å; V109-I111 PolarHBondContact O-N 3.18Å; V109-V112 PolarHBondContact O-N 3.26Å; V109-R113 PolarHBondContact O-N 3.41Å; V109-D143 HydrophobicContact CB-CB 4.48Å; V109-D143 HydrophobicContact CG1-CB 3.98Å; V109-D143 HydrophobicContact CG2-CB 3.6Å; V109-V144 HydrophobicContact CG2-CG2 4.24Å; V109-L147 HydrophobicContact CG1-CD1 3.71Å; V109-L147 VanDerWaalsContact O-CD1 3.31Å; V109-L147 WeakPolarHBondContact O-CD1 3.26Å
110	D	93.3	Very high	92	Very high	95 Å²	95	34.9 Å²	34.9	51%	0.508	20%	0.197	S	C	.	.	H	α-helix	trans	-66.5	-33	179.1	-74.1	-33.1	0	0	0	112.8	T75 H108 R113 L114	T75-D110 HydrophobicContact CG2-CB 4.06Å; H108-D110 VanDerWaalsContact C-N 3.33Å; H108-D110 PolarHBondContact O-N 2.92Å; D110-R113 IonicContact OD1-NH1 2.68Å; D110-L114 WeakPolarHBondContact O-CB 3.45Å; D110-L114 WeakPolarHBondContact O-CD1 3.28Å; D110-L114 VanDerWaalsContact O-CG 3.23Å; D110-L114 WeakPolarHBondContact O-CG 3.49Å; D110-L114 PolarHBondContact O-N 2.94Å
111	I	92.8	Very high	91.9	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-76.4	-40.4	178.5	-55.9	-172.8	0	0	0	110.4	V70 T75 A78 A103 H108 V109 R113 L114 L115	V70-I111 HydrophobicContact CB-CG2 4.2Å; V70-I111 HydrophobicContact CG1-CG2 4.02Å; V70-I111 HydrophobicContact CG2-CG2 3.7Å; T75-I111 HydrophobicContact CG2-CD1 4.19Å; T75-I111 HydrophobicContact CG2-CG1 3.83Å; A78-I111 HydrophobicContact CB-CD1 4.18Å; A78-I111 HydrophobicContact CB-CG2 4.35Å; A103-I111 HydrophobicContact CB-CG2 4.2Å; H108-I111 HydrophobicContact CB-CB 3.86Å; H108-I111 HydrophobicContact CB-CD1 3.94Å; H108-I111 HydrophobicContact CB-CG1 3.94Å; H108-I111 CarbonylContact O-C 3.58Å; H108-I111 WeakPolarHBondContact O-CA 3.4Å; H108-I111 WeakPolarHBondContact O-CB 3.42Å; H108-I111 PolarHBondContact O-N 3.1Å; V109-I111 VanDerWaalsContact C-N 3.32Å; V109-I111 PolarHBondContact O-N 3.18Å; I111-R113 VanDerWaalsContact C-N 3.31Å; I111-R113 PolarHBondContact O-N 3.04Å; I111-L114 PolarHBondContact O-N 3.49Å; I111-L115 HydrophobicContact CG2-CD1 4.04Å; I111-L115 HydrophobicContact CG2-CG 4.35Å; I111-L115 WeakPolarHBondContact O-CB 3.49Å; I111-L115 VanDerWaalsContact O-CG 3.29Å; I111-L115 WeakPolarHBondContact O-CG 3.45Å; I111-L115 PolarHBondContact O-N 2.95Å
112	V	94	Very high	91.8	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-56.7	-46.6	171.1	171.9	0	0	0	0	110.1	L100 A103 H108 V109 L115 I116 V144 L147	L100-V112 HydrophobicContact CD1-CG1 4.23Å; A103-V112 HydrophobicContact CB-CG2 3.63Å; H108-V112 PolarHBondContact O-N 3.16Å; V109-V112 PolarHBondContact O-N 3.26Å; V112-L115 PolarHBondContact O-N 3.3Å; V112-I116 HydrophobicContact CG1-CD1 3.71Å; V112-I116 VanDerWaalsContact O-CG1 3.28Å; V112-I116 WeakPolarHBondContact O-CG1 3.15Å; V112-I116 PolarHBondContact O-N 3.13Å; V112-V144 HydrophobicContact CG1-CG1 4.23Å; V112-V144 HydrophobicContact CG2-CG1 4.01Å; V112-V144 HydrophobicContact CG2-CG2 4.02Å; V112-L147 HydrophobicContact CB-CD1 4.11Å; V112-L147 HydrophobicContact CG1-CB 4.08Å; V112-L147 HydrophobicContact CG1-CD1 3.88Å
113	R	94.1	Very high	91.7	Very high	111 Å²	111	39.4 Å²	39.4	42%	0.419	23%	0.225	S	C	.	.	H	α-helix	trans	-60.5	-48	174.9	-175.5	179.8	-69.4	128.3	-1.8	111.8	V109 D110 I111 L115 I116 D117 L147	V109-R113 PolarHBondContact O-N 3.41Å; D110-R113 IonicContact OD1-NH1 2.68Å; I111-R113 VanDerWaalsContact C-N 3.31Å; I111-R113 PolarHBondContact O-N 3.04Å; R113-L115 VanDerWaalsContact C-N 3.32Å; R113-L115 PolarHBondContact O-N 3.42Å; R113-I116 PolarHBondContact O-N 3.28Å; R113-D117 WeakPolarHBondContact CG-OD2 3.46Å; R113-D117 VanDerWaalsContact O-CB 3.32Å; R113-D117 WeakPolarHBondContact O-CB 3.48Å; R113-D117 VanDerWaalsContact O-CG 3.24Å; R113-D117 PolarHBondContact O-N 3.22Å; R113-L147 HydrophobicContact CB-CD1 4.1Å; R113-L147 HydrophobicContact CB-CD2 4.43Å
114	L	91.1	Very high	91.5	Very high	34 Å²	34	41.6 Å²	41.6	18%	0.178	24%	0.235	C	C	.	.	H	α-helix	trans	-60.1	-37.2	178.5	-76.3	165.7	0	0	0	113.4	K79 D110 I111 N118	K79-L114 HydrophobicContact CB-CD1 3.91Å; K79-L114 HydrophobicContact CB-CD2 4.44Å; K79-L114 HydrophobicContact CD-CD1 4.48Å; K79-L114 HydrophobicContact CD-CD2 4.04Å; K79-L114 HydrophobicContact CG-CD1 4.37Å; K79-L114 HydrophobicContact CG-CD2 4.03Å; D110-L114 WeakPolarHBondContact O-CB 3.45Å; D110-L114 WeakPolarHBondContact O-CD1 3.28Å; D110-L114 VanDerWaalsContact O-CG 3.23Å; D110-L114 WeakPolarHBondContact O-CG 3.49Å; D110-L114 PolarHBondContact O-N 2.94Å; I111-L114 PolarHBondContact O-N 3.49Å; L114-N118 WeakPolarHBondContact O-CB 3.45Å; L114-N118 VanDerWaalsContact O-CG 3.23Å; L114-N118 PolarHBondContact O-N 2.77Å; L114-N118 PolarHBondContact O-ND2 2.95Å; L114-N118 VanDerWaalsContact O-ND2 3.15Å
115	L	91.3	Very high	91.3	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-70.9	-43.9	177.5	-69.5	169	0	0	0	111.4	L66 V70 I89 A99 L100 A103 I111 V112 R113 N118 G119 A120	L66-L115 HydrophobicContact CD2-CD2 4.45Å; V70-L115 HydrophobicContact CG2-CD1 4.29Å; I89-L115 HydrophobicContact CG2-CD2 4.04Å; A99-L115 HydrophobicContact CB-CD1 4.14Å; A99-L115 HydrophobicContact CB-CD2 3.96Å; L100-L115 HydrophobicContact CD1-CB 4.21Å; L100-L115 HydrophobicContact CD1-CD1 4.32Å; A103-L115 HydrophobicContact CB-CD1 3.68Å; I111-L115 HydrophobicContact CG2-CD1 4.04Å; I111-L115 HydrophobicContact CG2-CG 4.35Å; I111-L115 WeakPolarHBondContact O-CB 3.49Å; I111-L115 VanDerWaalsContact O-CG 3.29Å; I111-L115 WeakPolarHBondContact O-CG 3.45Å; I111-L115 PolarHBondContact O-N 2.95Å; V112-L115 PolarHBondContact O-N 3.3Å; R113-L115 VanDerWaalsContact C-N 3.32Å; R113-L115 PolarHBondContact O-N 3.42Å; L115-N118 CarbonylContact O-C 3.58Å; L115-N118 PolarHBondContact O-N 3.26Å; L115-G119 PolarHBondContact O-N 2.8Å; L115-A120 HydrophobicContact CB-CB 3.98Å; L115-A120 VanDerWaalsContact O-CB 3.23Å; L115-A120 WeakPolarHBondContact O-CB 3.45Å; L115-A120 PolarHBondContact O-N 2.84Å
116	I	91.1	Very high	91.1	Very high	37 Å²	37	42.9 Å²	42.9	19%	0.19	25%	0.248	C	C	.	.	H	α-helix	trans	-64.5	-44.9	176.1	-66	167	0	0	0	111.1	L100 V112 R113 N118 G119 L147 L148 A151	L100-I116 HydrophobicContact CD1-CG1 4.35Å; V112-I116 HydrophobicContact CG1-CD1 3.71Å; V112-I116 VanDerWaalsContact O-CG1 3.28Å; V112-I116 WeakPolarHBondContact O-CG1 3.15Å; V112-I116 PolarHBondContact O-N 3.13Å; R113-I116 PolarHBondContact O-N 3.28Å; I116-N118 PolarHBondContact O-N 3.28Å; I116-G119 PolarHBondContact O-N 3.22Å; I116-L147 HydrophobicContact CD1-CB 4.36Å; I116-L148 HydrophobicContact CD1-CD2 4.1Å; I116-A151 HydrophobicContact CD1-CB 4.14Å; I116-A151 HydrophobicContact CG2-CB 3.92Å
117	D	89.9	Confident	90.8	Very high	117 Å²	117	47.2 Å²	47.2	63%	0.626	27%	0.268	S	S	*	.	H	α-helix	trans	-61.5	-28.7	177.6	-74.6	-16.6	0	0	0	112.3	R113	R113-D117 WeakPolarHBondContact CG-OD2 3.46Å; R113-D117 VanDerWaalsContact O-CB 3.32Å; R113-D117 WeakPolarHBondContact O-CB 3.48Å; R113-D117 VanDerWaalsContact O-CG 3.24Å; R113-D117 PolarHBondContact O-N 3.22Å
118	N	86.8	Confident	90.4	Very high	58 Å²	58	49.9 Å²	49.9	31%	0.31	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	2.3	175.7	-69.4	-24.3	0	0	0	113.9	A82 I89 L114 L115 I116	A82-N118 WeakPolarHBondContact CB-ND2 3.4Å; A82-N118 PolarHBondContact O-ND2 3.45Å; I89-N118 HydrophobicContact CD1-CB 3.63Å; L114-N118 WeakPolarHBondContact O-CB 3.45Å; L114-N118 VanDerWaalsContact O-CG 3.23Å; L114-N118 PolarHBondContact O-N 2.77Å; L114-N118 PolarHBondContact O-ND2 2.95Å; L114-N118 VanDerWaalsContact O-ND2 3.15Å; L115-N118 CarbonylContact O-C 3.58Å; L115-N118 PolarHBondContact O-N 3.26Å; I116-N118 PolarHBondContact O-N 3.28Å
119	G	86.5	Confident	90	Very high	59 Å²	59	48.2 Å²	48.2	61%	0.608	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.4	15.3	170.4	0	0	0	0	0	117.3	L115 I116	L115-G119 PolarHBondContact O-N 2.8Å; I116-G119 PolarHBondContact O-N 3.22Å
120	A	89.3	Confident	89.8	Confident	7 Å²	7	47.9 Å²	47.9	6%	0.058	27%	0.268	C	S	.	.			trans	-55.2	143.2	177.5	0	0	0	0	0	113.4	I89 L100 L115 V122	I89-A120 HydrophobicContact CG2-CB 3.56Å; L100-A120 HydrophobicContact CB-CB 4.39Å; L100-A120 HydrophobicContact CD2-CB 4.27Å; L115-A120 HydrophobicContact CB-CB 3.98Å; L115-A120 VanDerWaalsContact O-CB 3.23Å; L115-A120 WeakPolarHBondContact O-CB 3.45Å; L115-A120 PolarHBondContact O-N 2.84Å; A120-V122 PolarHBondContact O-N 2.99Å; A120-V122 VanDerWaalsContact O-N 3.12Å
121	S	90.6	Very high	89.7	Confident	40 Å²	40	43.4 Å²	43.4	28%	0.28	24%	0.244	S	C	.	.			trans	-72.2	102.7	-178.7	60.7	0	0	0	0	112.5	D90 D123 Q124	D90-S121 WeakPolarHBondContact OD1-CB 3.22Å; D90-S121 PolarHBondContact OD1-N 3.19Å; D90-S121 PolarHBondContact OD1-OG 2.68Å; D90-S121 PolarHBondContact OD2-OG 3.22Å; S121-D123 VanDerWaalsContact C-N 3.27Å; S121-D123 PolarHBondContact O-N 2.99Å; S121-D123 VanDerWaalsContact O-N 3.14Å; S121-Q124 PolarHBondContact O-N 2.78Å; S121-Q124 WeakPolarHBondContact OG-CB 3.46Å; S121-Q124 PolarHBondContact OG-OE1 3.32Å
122	V	91.4	Very high	89.8	Confident	26 Å²	26	43.3 Å²	43.3	16%	0.158	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-31.7	-167.9	-178.1	0	0	0	0	114.6	A120 P132 L148 A151 A153	A120-V122 PolarHBondContact O-N 2.99Å; A120-V122 VanDerWaalsContact O-N 3.12Å; V122-P132 WeakPolarHBondContact O-CD 3.31Å; V122-P132 WeakPolarHBondContact O-CG 3.19Å; V122-L148 HydrophobicContact CG1-CD2 3.99Å; V122-A151 HydrophobicContact CG1-CB 4.3Å; V122-A151 HydrophobicContact CG2-CB 4.1Å; V122-A153 HydrophobicContact CG1-CB 3.59Å
123	D	90.6	Very high	89.8	Confident	40 Å²	40	43.3 Å²	43.3	21%	0.214	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	8	-171.9	-72.1	-52.5	0	0	0	114.4	S121 P125 A153 H154 L157	S121-D123 VanDerWaalsContact C-N 3.27Å; S121-D123 PolarHBondContact O-N 2.99Å; S121-D123 VanDerWaalsContact O-N 3.14Å; D123-P125 VanDerWaalsContact O-CD 3.29Å; D123-P125 WeakPolarHBondContact O-CD 3.45Å; D123-A153 WeakPolarHBondContact OD1-CA 3.48Å; D123-H154 PolarHBondContact OD1-N 2.79Å; D123-H154 IonicContact OD2-CD2 2.85Å; D123-H154 PolarHBondContact OD2-CD2 2.94Å; D123-H154 VanDerWaalsContact OD2-CD2 3.31Å; D123-H154 IonicContact OD2-CG 2.68Å; D123-H154 PolarHBondContact OD2-N 3.05Å; D123-L157 HydrophobicContact CB-CD1 4.09Å
124	Q	89.2	Confident	89.7	Confident	46 Å²	46	38.1 Å²	38.1	22%	0.215	22%	0.224	C	C	.	.			trans	-62.2	116	-178.8	-176.9	-172.2	29.1	0	0	111.4	D90 S98 S121 P132	D90-Q124 PolarHBondContact O-NE2 3.04Å; S98-Q124 PolarHBondContact OG-OE1 2.98Å; S121-Q124 PolarHBondContact O-N 2.78Å; S121-Q124 WeakPolarHBondContact OG-CB 3.46Å; S121-Q124 PolarHBondContact OG-OE1 3.32Å; Q124-P132 WeakPolarHBondContact O-CD 3.32Å
125	P	89.1	Confident	89.8	Confident	68 Å²	68	37.9 Å²	37.9	44%	0.442	22%	0.221	S	C	.	.			trans	-85	163.1	-178	35.3	-35.1	0	0	0	112.7	D123 W130	D123-P125 VanDerWaalsContact O-CD 3.29Å; D123-P125 WeakPolarHBondContact O-CD 3.45Å; P125-W130 WeakPolarHBondContact CA-O 3.47Å
126	D	89.2	Confident	90	Very high	11 Å²	11	37.8 Å²	37.8	6%	0.059	22%	0.22	C	C	.	.			trans	-78.4	-175.8	164.3	64.7	20	0	0	0	112.6	L101 M128 G129 W130 W135	L101-D126 HydrophobicContact CD1-CB 4.18Å; D126-M128 HydrophobicContact CB-CE 4.21Å; D126-M128 PolarHBondContact O-N 3.25Å; D126-M128 VanDerWaalsContact O-N 3.08Å; D126-M128 WeakPolarHBondContact OD1-CA 3.42Å; D126-M128 WeakPolarHBondContact OD1-CB 3.31Å; D126-M128 PolarHBondContact OD1-N 2.76Å; D126-M128 WeakPolarHBondContact OD2-CE 3.09Å; D126-G129 PolarHBondContact O-N 3.41Å; D126-G129 PolarHBondContact OD1-N 2.5Å; D126-W130 PolarHBondContact N-O 2.81Å; D126-W130 WeakPolarHBondContact OD1-CB 3.45Å; D126-W130 PolarHBondContact OD1-N 3.11Å; D126-W135 PolarHBondContact OD2-NE1 3.45Å
127	L	87.2	Confident	90.2	Very high	132 Å²	132	36 Å²	36	69%	0.691	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-11.2	178.2	-83	92.6	0	0	0	114.7	E95	E95-L127 VanDerWaalsContact O-CD1 3.22Å; E95-L127 WeakPolarHBondContact O-CD1 3.15Å
128	M	82	Confident	90.4	Very high	73 Å²	73	34.7 Å²	34.7	36%	0.36	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-0.4	178.2	-69.9	67.2	60.2	0	0	111.7	D126	D126-M128 HydrophobicContact CB-CE 4.21Å; D126-M128 PolarHBondContact O-N 3.25Å; D126-M128 VanDerWaalsContact O-N 3.08Å; D126-M128 WeakPolarHBondContact OD1-CA 3.42Å; D126-M128 WeakPolarHBondContact OD1-CB 3.31Å; D126-M128 PolarHBondContact OD1-N 2.76Å; D126-M128 WeakPolarHBondContact OD2-CE 3.09Å
129	G	86.5	Confident	90.8	Very high	16 Å²	16	35.5 Å²	35.5	17%	0.165	20%	0.199	C	C	.	.			trans	85.2	9	-176.5	0	0	0	0	0	114.3	D126 S131	D126-G129 PolarHBondContact O-N 3.41Å; D126-G129 PolarHBondContact OD1-N 2.5Å; G129-S131 PolarHBondContact O-N 2.76Å
130	W	90.2	Very high	91.2	Very high	32 Å²	32	36.1 Å²	36.1	12%	0.121	19%	0.188	C	C	.	.			trans	-85	116.8	-175.4	-73.7	58.8	0	0	0	111.5	P125 D126 M134 Y138 V169	P125-W130 WeakPolarHBondContact CA-O 3.47Å; D126-W130 PolarHBondContact N-O 2.81Å; D126-W130 WeakPolarHBondContact OD1-CB 3.45Å; D126-W130 PolarHBondContact OD1-N 3.11Å; W130-M134 HydrophobicContact CB-SD 4.3Å; W130-M134 HydrophobicContact CD2-CE 4.04Å; W130-M134 HydrophobicContact CD2-CG 4.06Å; W130-M134 HydrophobicContact CD2-SD 3.67Å; W130-M134 HydrophobicContact CE3-CB 3.88Å; W130-M134 HydrophobicContact CE3-CE 4.13Å; W130-M134 HydrophobicContact CE3-CG 3.45Å; W130-M134 VanDerWaalsContact CE3-CG 3.45Å; W130-M134 HydrophobicContact CE3-SD 3.73Å; W130-M134 HydrophobicContact CG-SD 3.94Å; W130-M134 HydrophobicContact CH2-CE 3.89Å; W130-M134 HydrophobicContact CH2-CG 4.44Å; W130-M134 HydrophobicContact CZ2-CE 3.85Å; W130-M134 HydrophobicContact CZ3-CB 4.42Å; W130-M134 HydrophobicContact CZ3-CE 4.02Å; W130-M134 HydrophobicContact CZ3-CG 3.64Å; W130-M134 HydrophobicContact CZ3-SD 4.14Å; W130-Y138 HydrophobicContact CE3-CD2 4.41Å; W130-Y138 AromaticContact CH2-CD2 3.72Å; W130-Y138 HydrophobicContact CH2-CD2 3.72Å; W130-Y138 HydrophobicContact CH2-CE2 4.23Å; W130-Y138 AromaticContact CZ3-CD2 3.49Å; W130-Y138 HydrophobicContact CZ3-CD2 3.49Å; W130-Y138 VanDerWaalsContact CZ3-CD2 3.49Å; W130-Y138 HydrophobicContact CZ3-CE2 4.34Å; W130-Y138 HydrophobicContact CZ3-CG 4.29Å; W130-V169 HydrophobicContact CH2-CG1 4.33Å; W130-V169 HydrophobicContact CH2-CG2 4.02Å; W130-V169 HydrophobicContact CZ3-CG1 4.26Å; W130-V169 HydrophobicContact CZ3-CG2 4.33Å
131	S	91.4	Very high	91.5	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.007	20%	0.196	C	C	.	.			trans	-73.7	163.6	176.8	73.1	0	0	0	0	112.8	G129 L133 M134 W135	G129-S131 PolarHBondContact O-N 2.76Å; S131-L133 PolarHBondContact O-N 3.27Å; S131-M134 WeakPolarHBondContact O-CA 3.49Å; S131-M134 WeakPolarHBondContact O-CB 3.13Å; S131-M134 PolarHBondContact O-N 3.38Å; S131-M134 PolarHBondContact OG-N 2.97Å; S131-W135 PolarHBondContact O-N 3.33Å
132	P	93.2	Very high	91.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.7	-33.8	175.9	-24.5	35.7	0	0	0	112.6	L100 L101 A104 V122 Q124 W135 A136 L148	L100-P132 HydrophobicContact CD2-CB 4.35Å; L100-P132 HydrophobicContact CD2-CG 4.12Å; L100-P132 HydrophobicContact CG-CB 4.13Å; L100-P132 HydrophobicContact CG-CG 4.15Å; L101-P132 HydrophobicContact CD2-CB 4.34Å; L101-P132 HydrophobicContact CD2-CG 3.85Å; L101-P132 HydrophobicContact CG-CG 4.1Å; A104-P132 HydrophobicContact CB-CB 3.98Å; A104-P132 WeakPolarHBondContact CB-O 3.48Å; V122-P132 WeakPolarHBondContact O-CD 3.31Å; V122-P132 WeakPolarHBondContact O-CG 3.19Å; Q124-P132 WeakPolarHBondContact O-CD 3.32Å; P132-W135 PolarHBondContact O-N 2.95Å; P132-A136 WeakPolarHBondContact O-CB 3.46Å; P132-A136 PolarHBondContact O-N 3.38Å; P132-L148 HydrophobicContact CB-CD1 4.18Å; P132-L148 HydrophobicContact CB-CD2 4.35Å
133	L	94	Very high	91.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.3	-44.8	172.9	-179.8	64.5	0	0	0	111.1	S131 W135 A136 V137 V145 L148 V149 A153 V155 P166 L182	S131-L133 PolarHBondContact O-N 3.27Å; L133-W135 VanDerWaalsContact C-N 3.32Å; L133-W135 PolarHBondContact O-N 3.31Å; L133-A136 PolarHBondContact O-N 3.39Å; L133-V137 HydrophobicContact CD1-CG2 4.33Å; L133-V137 HydrophobicContact CG-CG2 4.49Å; L133-V137 WeakPolarHBondContact O-CB 3.17Å; L133-V137 WeakPolarHBondContact O-CG2 3.47Å; L133-V137 PolarHBondContact O-N 3.07Å; L133-V145 HydrophobicContact CD1-CB 4.42Å; L133-V145 HydrophobicContact CD1-CG1 4Å; L133-V145 HydrophobicContact CD1-CG2 4.32Å; L133-L148 HydrophobicContact CB-CD1 4.31Å; L133-L148 HydrophobicContact CD1-CB 4.25Å; L133-V149 HydrophobicContact CD1-CG2 4.13Å; L133-A153 HydrophobicContact CB-CB 4.38Å; L133-A153 HydrophobicContact CD2-CB 4.14Å; L133-V155 HydrophobicContact CD2-CG2 4.26Å; L133-P166 HydrophobicContact CD2-CG 4.28Å; L133-L182 HydrophobicContact CD2-CD2 4.49Å
134	M	93	Very high	92	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-64.1	-37.2	179.7	-150.2	175.9	177.3	0	0	111.8	W130 S131 Y138 D159 L164 P166 V169	W130-M134 HydrophobicContact CB-SD 4.3Å; W130-M134 HydrophobicContact CD2-CE 4.04Å; W130-M134 HydrophobicContact CD2-CG 4.06Å; W130-M134 HydrophobicContact CD2-SD 3.67Å; W130-M134 HydrophobicContact CE3-CB 3.88Å; W130-M134 HydrophobicContact CE3-CE 4.13Å; W130-M134 HydrophobicContact CE3-CG 3.45Å; W130-M134 VanDerWaalsContact CE3-CG 3.45Å; W130-M134 HydrophobicContact CE3-SD 3.73Å; W130-M134 HydrophobicContact CG-SD 3.94Å; W130-M134 HydrophobicContact CH2-CE 3.89Å; W130-M134 HydrophobicContact CH2-CG 4.44Å; W130-M134 HydrophobicContact CZ2-CE 3.85Å; W130-M134 HydrophobicContact CZ3-CB 4.42Å; W130-M134 HydrophobicContact CZ3-CE 4.02Å; W130-M134 HydrophobicContact CZ3-CG 3.64Å; W130-M134 HydrophobicContact CZ3-SD 4.14Å; S131-M134 WeakPolarHBondContact O-CA 3.49Å; S131-M134 WeakPolarHBondContact O-CB 3.13Å; S131-M134 PolarHBondContact O-N 3.38Å; S131-M134 PolarHBondContact OG-N 2.97Å; M134-Y138 WeakPolarHBondContact O-CB 3.23Å; M134-Y138 PolarHBondContact O-N 3.35Å; M134-D159 HydrophobicContact CE-CB 4.02Å; M134-D159 HydrophobicContact SD-CB 4.42Å; M134-L164 HydrophobicContact CE-CB 3.9Å; M134-L164 WeakPolarHBondContact CE-O 3.37Å; M134-P166 HydrophobicContact CG-CG 4.48Å; M134-V169 HydrophobicContact CE-CG2 3.62Å; M134-V169 HydrophobicContact CG-CG2 4.33Å
135	W	93.6	Very high	92.3	Very high	30 Å²	30	37.4 Å²	37.4	11%	0.114	19%	0.189	C	C	.	.	H	α-helix	trans	-69	-44.7	172.5	-82.9	110.2	0	0	0	113.6	W97 H105 D126 S131 P132 L133 V137 Y138 K139	W97-W135 AromaticContact CH2-CD2 3.82Å; W97-W135 HydrophobicContact CH2-CD2 3.82Å; W97-W135 AromaticContact CH2-CE2 3.39Å; W97-W135 HydrophobicContact CH2-CE3 4.15Å; W97-W135 AromaticContact CH2-CH2 3.73Å; W97-W135 HydrophobicContact CH2-CH2 3.73Å; W97-W135 AromaticContact CH2-CZ2 3.35Å; W97-W135 HydrophobicContact CH2-CZ2 3.35Å; W97-W135 HydrophobicContact CH2-CZ3 4.11Å; W97-W135 AromaticContact CH2-NE1 3.87Å; W97-W135 HydrophobicContact CZ2-CH2 4.19Å; W97-W135 AromaticContact CZ2-CZ2 3.74Å; W97-W135 HydrophobicContact CZ2-CZ2 3.74Å; W97-W135 HydrophobicContact CZ3-CD2 4.1Å; W97-W135 AromaticContact CZ3-CE2 3.93Å; W97-W135 HydrophobicContact CZ3-CG 4.37Å; W97-W135 HydrophobicContact CZ3-CZ2 4.32Å; H105-W135 AromaticContact CD2-CE3 3.83Å; H105-W135 AromaticContact CD2-CZ3 3.97Å; D126-W135 PolarHBondContact OD2-NE1 3.45Å; S131-W135 PolarHBondContact O-N 3.33Å; P132-W135 PolarHBondContact O-N 2.95Å; L133-W135 VanDerWaalsContact C-N 3.32Å; L133-W135 PolarHBondContact O-N 3.31Å; W135-V137 VanDerWaalsContact C-N 3.3Å; W135-V137 PolarHBondContact O-N 3.49Å; W135-Y138 HydrophobicContact CE3-CG 4.47Å; W135-Y138 HydrophobicContact CZ3-CD1 4.44Å; W135-Y138 HydrophobicContact CZ3-CG 4.46Å; W135-Y138 WeakPolarHBondContact O-CB 3.4Å; W135-Y138 PolarHBondContact O-N 3.47Å; W135-K139 WeakPolarHBondContact O-CB 3.4Å; W135-K139 WeakPolarHBondContact O-CG 3.4Å; W135-K139 PolarHBondContact O-N 3.25Å
136	A	95.1	Very high	92.6	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.1	-42.9	174.5	0	0	0	0	0	111.6	A104 P132 L133 K139 N140 H141 V144 V145 L148	A104-A136 HydrophobicContact CB-CB 4.44Å; P132-A136 WeakPolarHBondContact O-CB 3.46Å; P132-A136 PolarHBondContact O-N 3.38Å; L133-A136 PolarHBondContact O-N 3.39Å; A136-K139 PolarHBondContact O-N 3.41Å; A136-N140 PolarHBondContact O-N 3.23Å; A136-N140 VanDerWaalsContact O-N 3.11Å; A136-H141 PolarHBondContact O-N 3.46Å; A136-V144 HydrophobicContact CB-CB 4.12Å; A136-V144 HydrophobicContact CB-CG1 3.52Å; A136-V145 HydrophobicContact CB-CG2 3.85Å; A136-L148 HydrophobicContact CB-CD1 4.13Å
137	V	94.9	Very high	92.8	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.5	-47.5	173.5	168.4	0	0	0	0	111.6	L133 W135 K139 N140 V145 P166 V169 A170 F175 I178 L182	L133-V137 HydrophobicContact CD1-CG2 4.33Å; L133-V137 HydrophobicContact CG-CG2 4.49Å; L133-V137 WeakPolarHBondContact O-CB 3.17Å; L133-V137 WeakPolarHBondContact O-CG2 3.47Å; L133-V137 PolarHBondContact O-N 3.07Å; W135-V137 VanDerWaalsContact C-N 3.3Å; W135-V137 PolarHBondContact O-N 3.49Å; V137-K139 PolarHBondContact O-N 3.06Å; V137-N140 PolarHBondContact O-N 2.89Å; V137-V145 HydrophobicContact CG2-CG2 3.77Å; V137-P166 HydrophobicContact CG2-CB 4.37Å; V137-V169 HydrophobicContact CG1-CB 4.16Å; V137-V169 HydrophobicContact CG1-CG1 4.01Å; V137-A170 HydrophobicContact CG1-CB 3.7Å; V137-F175 VanDerWaalsContact O-CD2 3.25Å; V137-F175 WeakPolarHBondContact O-CD2 3.43Å; V137-F175 WeakPolarHBondContact O-CE2 3.45Å; V137-I178 HydrophobicContact CB-CG2 4.37Å; V137-I178 HydrophobicContact CG1-CG2 4.11Å; V137-I178 HydrophobicContact CG2-CG2 3.76Å; V137-L182 HydrophobicContact CG2-CD1 4.28Å
138	Y	94.1	Very high	93.1	Very high	88 Å²	88	30.7 Å²	30.7	35%	0.345	15%	0.15	S	C	.	.	H	α-helix	trans	-56	-38.8	178.2	-175.3	-68.7	0	0	0	112.2	W130 M134 W135 R173	W130-Y138 HydrophobicContact CE3-CD2 4.41Å; W130-Y138 AromaticContact CH2-CD2 3.72Å; W130-Y138 HydrophobicContact CH2-CD2 3.72Å; W130-Y138 HydrophobicContact CH2-CE2 4.23Å; W130-Y138 AromaticContact CZ3-CD2 3.49Å; W130-Y138 HydrophobicContact CZ3-CD2 3.49Å; W130-Y138 VanDerWaalsContact CZ3-CD2 3.49Å; W130-Y138 HydrophobicContact CZ3-CE2 4.34Å; W130-Y138 HydrophobicContact CZ3-CG 4.29Å; M134-Y138 WeakPolarHBondContact O-CB 3.23Å; M134-Y138 PolarHBondContact O-N 3.35Å; W135-Y138 HydrophobicContact CE3-CG 4.47Å; W135-Y138 HydrophobicContact CZ3-CD1 4.44Å; W135-Y138 HydrophobicContact CZ3-CG 4.46Å; W135-Y138 WeakPolarHBondContact O-CB 3.4Å; W135-Y138 PolarHBondContact O-N 3.47Å; Y138-R173 VanDerWaalsContact CD2-NH2 3.31Å; Y138-R173 WeakPolarHBondContact O-CD 3.35Å; Y138-R173 PolarHBondContact O-NE 3.48Å
139	K	94.8	Very high	93.6	Very high	76 Å²	76	28.5 Å²	28.5	33%	0.33	14%	0.141	S	C	.	.	H	α-helix	trans	-92.9	-2.5	-172.4	-60.4	-82.2	167	157.4	0	113.8	H105 W135 A136 V137 H141	H105-K139 WeakPolarHBondContact CD2-CE 3.32Å; H105-K139 PolarHBondContact CD2-NZ 3.23Å; H105-K139 VanDerWaalsContact CD2-NZ 3.27Å; H105-K139 WeakPolarHBondContact NE2-CE 3.43Å; H105-K139 PolarHBondContact NE2-NZ 3.42Å; W135-K139 WeakPolarHBondContact O-CB 3.4Å; W135-K139 WeakPolarHBondContact O-CG 3.4Å; W135-K139 PolarHBondContact O-N 3.25Å; A136-K139 PolarHBondContact O-N 3.41Å; V137-K139 PolarHBondContact O-N 3.06Å; K139-H141 WeakPolarHBondContact CB-CD2 3.28Å; K139-H141 WeakPolarHBondContact CB-NE2 3.38Å
140	N	94.9	Very high	93.8	Very high	71 Å²	71	33.6 Å²	33.6	38%	0.38	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	33.2	-179	-162.1	58.4	0	0	0	115.3	A136 V137 L142 F175 I178	A136-N140 PolarHBondContact O-N 3.23Å; A136-N140 VanDerWaalsContact O-N 3.11Å; V137-N140 PolarHBondContact O-N 2.89Å; N140-L142 PolarHBondContact O-N 3.22Å; N140-F175 HydrophobicContact CB-CD1 4.28Å; N140-F175 HydrophobicContact CB-CD2 4.04Å; N140-F175 HydrophobicContact CB-CE1 3.94Å; N140-F175 HydrophobicContact CB-CE2 3.65Å; N140-F175 HydrophobicContact CB-CG 4.34Å; N140-F175 HydrophobicContact CB-CZ 3.61Å; N140-F175 WeakPolarHBondContact OD1-CB 3.42Å; N140-F175 VanDerWaalsContact OD1-CD1 3.26Å; N140-F175 WeakPolarHBondContact OD1-CD1 3.45Å; N140-F175 WeakPolarHBondContact OD1-CD2 3.2Å; N140-F175 WeakPolarHBondContact OD1-CG 3.42Å; N140-I178 WeakPolarHBondContact OD1-CD1 3.31Å
141	H	95.5	Very high	93.8	Very high	49 Å²	49	33.6 Å²	33.6	23%	0.227	17%	0.171	C	C	.	.			trans	-88.7	77.9	-179.2	-61.8	-51.8	0	0	0	111.4	A104 H105 G107 A136 K139 D143 V144 V145	A104-H141 PolarHBondContact O-CD2 3.48Å; H105-H141 PolarHBondContact O-NE2 2.89Å; G107-H141 VanDerWaalsContact CA-CD2 3.46Å; G107-H141 WeakPolarHBondContact CA-CD2 3.37Å; G107-H141 VanDerWaalsContact CA-CE1 3.46Å; G107-H141 WeakPolarHBondContact CA-CE1 3.12Å; G107-H141 WeakPolarHBondContact CA-NE2 3.48Å; G107-H141 PolarHBondContact N-NE2 2.97Å; A136-H141 PolarHBondContact O-N 3.46Å; K139-H141 WeakPolarHBondContact CB-CD2 3.28Å; K139-H141 WeakPolarHBondContact CB-NE2 3.38Å; H141-D143 PolarHBondContact O-N 3.38Å; H141-V144 HydrophobicContact CB-CB 3.85Å; H141-V144 HydrophobicContact CB-CG2 3.97Å; H141-V144 WeakPolarHBondContact O-CB 3.24Å; H141-V144 PolarHBondContact O-N 3.05Å; H141-V145 PolarHBondContact O-N 3.2Å
142	L	94.4	Very high	93.7	Very high	40 Å²	40	42 Å²	42	21%	0.209	21%	0.207	C	C	.	.	H	α-helix	trans	-51.7	-49.6	-175.9	-175.8	66.1	0	0	0	113	N140 V144 V145 D146 Q177 I178 R181	N140-L142 PolarHBondContact O-N 3.22Å; L142-V144 PolarHBondContact O-N 3.28Å; L142-V145 WeakPolarHBondContact O-CB 3.22Å; L142-V145 PolarHBondContact O-N 3.24Å; L142-V145 VanDerWaalsContact O-N 3.11Å; L142-D146 PolarHBondContact O-N 3.32Å; L142-Q177 HydrophobicContact CD1-CB 4.03Å; L142-Q177 HydrophobicContact CD2-CB 4.1Å; L142-I178 HydrophobicContact CD1-CG1 3.79Å; L142-R181 HydrophobicContact CD1-CG 4.04Å
143	D	95.3	Very high	93.6	Very high	98 Å²	98	42.3 Å²	42.3	52%	0.524	21%	0.21	S	C	.	.	H	α-helix	trans	-61.3	-30.9	-179.6	-59	-9.9	0	0	0	112.8	V109 H141 L147	V109-D143 HydrophobicContact CB-CB 4.48Å; V109-D143 HydrophobicContact CG1-CB 3.98Å; V109-D143 HydrophobicContact CG2-CB 3.6Å; H141-D143 PolarHBondContact O-N 3.38Å; D143-L147 WeakPolarHBondContact O-CG 3.43Å; D143-L147 PolarHBondContact O-N 2.92Å; D143-L147 VanDerWaalsContact O-N 3.09Å
144	V	95.5	Very high	93.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-77	-41	175.7	172.6	0	0	0	0	110.9	A104 V109 V112 A136 H141 L142 D146 L147 L148	A104-V144 HydrophobicContact CB-CG1 4Å; V109-V144 HydrophobicContact CG2-CG2 4.24Å; V112-V144 HydrophobicContact CG1-CG1 4.23Å; V112-V144 HydrophobicContact CG2-CG1 4.01Å; V112-V144 HydrophobicContact CG2-CG2 4.02Å; A136-V144 HydrophobicContact CB-CB 4.12Å; A136-V144 HydrophobicContact CB-CG1 3.52Å; H141-V144 HydrophobicContact CB-CB 3.85Å; H141-V144 HydrophobicContact CB-CG2 3.97Å; H141-V144 WeakPolarHBondContact O-CB 3.24Å; H141-V144 PolarHBondContact O-N 3.05Å; L142-V144 PolarHBondContact O-N 3.28Å; V144-D146 VanDerWaalsContact C-N 3.28Å; V144-D146 PolarHBondContact O-N 3.21Å; V144-L147 PolarHBondContact O-N 3.43Å; V144-L148 HydrophobicContact CG1-CD1 3.81Å; V144-L148 HydrophobicContact CG1-CG 4.36Å; V144-L148 WeakPolarHBondContact O-CG 3.21Å; V144-L148 PolarHBondContact O-N 2.89Å
145	V	95	Very high	93.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-57.2	-45.2	171.6	171.2	0	0	0	0	109.9	L133 A136 V137 H141 L142 L147 L148 V149 I178	L133-V145 HydrophobicContact CD1-CB 4.42Å; L133-V145 HydrophobicContact CD1-CG1 4Å; L133-V145 HydrophobicContact CD1-CG2 4.32Å; A136-V145 HydrophobicContact CB-CG2 3.85Å; V137-V145 HydrophobicContact CG2-CG2 3.77Å; H141-V145 PolarHBondContact O-N 3.2Å; L142-V145 WeakPolarHBondContact O-CB 3.22Å; L142-V145 PolarHBondContact O-N 3.24Å; L142-V145 VanDerWaalsContact O-N 3.11Å; V145-L147 PolarHBondContact O-N 3.46Å; V145-L148 PolarHBondContact O-N 3.34Å; V145-V149 HydrophobicContact CG1-CG2 4.22Å; V145-V149 WeakPolarHBondContact O-CB 3.43Å; V145-V149 VanDerWaalsContact O-CG2 3.29Å; V145-V149 WeakPolarHBondContact O-CG2 3.29Å; V145-V149 PolarHBondContact O-N 2.89Å; V145-I178 HydrophobicContact CG2-CD1 4.29Å; V145-I178 HydrophobicContact CG2-CG2 4.45Å
146	D	94.1	Very high	93.2	Very high	40 Å²	40	49.9 Å²	49.9	21%	0.214	25%	0.249	C	C	.	.	H	α-helix	trans	-61.4	-43.2	175.5	-89.4	-30.9	0	0	0	112.5	L142 V144 N150 R181	L142-D146 PolarHBondContact O-N 3.32Å; V144-D146 VanDerWaalsContact C-N 3.28Å; V144-D146 PolarHBondContact O-N 3.21Å; D146-N150 VanDerWaalsContact O-CB 3.3Å; D146-N150 WeakPolarHBondContact O-CB 3.41Å; D146-N150 PolarHBondContact O-N 3.14Å; D146-N150 PolarHBondContact O-ND2 2.79Å; D146-R181 IonicContact OD1-CZ 2.76Å; D146-R181 IonicContact OD1-NE 3.91Å; D146-R181 PolarHBondContact OD1-NE 2.89Å; D146-R181 IonicContact OD1-NH2 3.22Å; D146-R181 PolarHBondContact OD1-NH2 3.33Å; D146-R181 IonicContact OD2-NE 3.86Å
147	L	94.2	Very high	92.9	Very high	30 Å²	30	52.8 Å²	52.8	16%	0.157	27%	0.265	C	S	.	.	H	α-helix	trans	-61.6	-45.4	175.4	-75.5	174.7	0	0	0	112.3	V109 V112 R113 I116 D143 V144 V145 N150 A151	V109-L147 HydrophobicContact CG1-CD1 3.71Å; V109-L147 VanDerWaalsContact O-CD1 3.31Å; V109-L147 WeakPolarHBondContact O-CD1 3.26Å; V112-L147 HydrophobicContact CB-CD1 4.11Å; V112-L147 HydrophobicContact CG1-CB 4.08Å; V112-L147 HydrophobicContact CG1-CD1 3.88Å; R113-L147 HydrophobicContact CB-CD1 4.1Å; R113-L147 HydrophobicContact CB-CD2 4.43Å; I116-L147 HydrophobicContact CD1-CB 4.36Å; D143-L147 WeakPolarHBondContact O-CG 3.43Å; D143-L147 PolarHBondContact O-N 2.92Å; D143-L147 VanDerWaalsContact O-N 3.09Å; V144-L147 PolarHBondContact O-N 3.43Å; V145-L147 PolarHBondContact O-N 3.46Å; L147-N150 PolarHBondContact O-N 3.44Å; L147-A151 WeakPolarHBondContact O-CB 3.35Å; L147-A151 PolarHBondContact O-N 3.04Å
148	L	93.9	Very high	92.6	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-68.9	-41.5	-178.2	-68.2	168.8	0	0	0	112.2	L100 A104 I116 V122 P132 L133 A136 V144 V145 A151 K152 A153	L100-L148 HydrophobicContact CD1-CD2 4.48Å; L100-L148 HydrophobicContact CD2-CD2 4.28Å; A104-L148 HydrophobicContact CB-CD1 4.45Å; I116-L148 HydrophobicContact CD1-CD2 4.1Å; V122-L148 HydrophobicContact CG1-CD2 3.99Å; P132-L148 HydrophobicContact CB-CD1 4.18Å; P132-L148 HydrophobicContact CB-CD2 4.35Å; L133-L148 HydrophobicContact CB-CD1 4.31Å; L133-L148 HydrophobicContact CD1-CB 4.25Å; A136-L148 HydrophobicContact CB-CD1 4.13Å; V144-L148 HydrophobicContact CG1-CD1 3.81Å; V144-L148 HydrophobicContact CG1-CG 4.36Å; V144-L148 WeakPolarHBondContact O-CG 3.21Å; V144-L148 PolarHBondContact O-N 2.89Å; V145-L148 PolarHBondContact O-N 3.34Å; L148-A151 CarbonylContact O-C 3.45Å; L148-A151 WeakPolarHBondContact O-CA 3.49Å; L148-A151 WeakPolarHBondContact O-CB 3.46Å; L148-A151 PolarHBondContact O-N 3.05Å; L148-K152 PolarHBondContact O-N 2.95Å; L148-A153 HydrophobicContact CB-CB 4.13Å; L148-A153 VanDerWaalsContact O-CB 3.26Å; L148-A153 WeakPolarHBondContact O-CB 3.5Å; L148-A153 PolarHBondContact O-N 3.21Å
149	V	91.8	Very high	92.3	Very high	26 Å²	26	53.7 Å²	53.7	16%	0.158	27%	0.274	C	S	.	.	H	α-helix	trans	-65.6	-41.9	175.5	171.2	0	0	0	0	110.9	L133 V145 A151 K152 V155	L133-V149 HydrophobicContact CD1-CG2 4.13Å; V145-V149 HydrophobicContact CG1-CG2 4.22Å; V145-V149 WeakPolarHBondContact O-CB 3.43Å; V145-V149 VanDerWaalsContact O-CG2 3.29Å; V145-V149 WeakPolarHBondContact O-CG2 3.29Å; V145-V149 PolarHBondContact O-N 2.89Å; V149-A151 VanDerWaalsContact C-N 3.26Å; V149-A151 PolarHBondContact O-N 3.39Å; V149-K152 PolarHBondContact O-N 3.37Å; V149-V155 HydrophobicContact CG2-CG2 4.39Å
150	N	91.5	Very high	91.9	Very high	124 Å²	124	57.9 Å²	57.9	66%	0.663	30%	0.295	S	S	*	.	H	α-helix	trans	-64.7	-29.7	172.9	-76.5	-60.5	0	0	0	112.6	D146 L147 K152	D146-N150 VanDerWaalsContact O-CB 3.3Å; D146-N150 WeakPolarHBondContact O-CB 3.41Å; D146-N150 PolarHBondContact O-N 3.14Å; D146-N150 PolarHBondContact O-ND2 2.79Å; L147-N150 PolarHBondContact O-N 3.44Å; N150-K152 PolarHBondContact O-N 2.68Å
151	A	90.7	Very high	91.4	Very high	32 Å²	32	61 Å²	61	26%	0.264	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	3.5	171.9	0	0	0	0	0	114.2	I116 V122 L147 L148 V149	I116-A151 HydrophobicContact CD1-CB 4.14Å; I116-A151 HydrophobicContact CG2-CB 3.92Å; V122-A151 HydrophobicContact CG1-CB 4.3Å; V122-A151 HydrophobicContact CG2-CB 4.1Å; L147-A151 WeakPolarHBondContact O-CB 3.35Å; L147-A151 PolarHBondContact O-N 3.04Å; L148-A151 CarbonylContact O-C 3.45Å; L148-A151 WeakPolarHBondContact O-CA 3.49Å; L148-A151 WeakPolarHBondContact O-CB 3.46Å; L148-A151 PolarHBondContact O-N 3.05Å; V149-A151 VanDerWaalsContact C-N 3.26Å; V149-A151 PolarHBondContact O-N 3.39Å
152	K	88.5	Confident	90.9	Very high	176 Å²	176	61.9 Å²	61.9	77%	0.765	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	31.9	179.6	-49.8	177.7	-179.2	175.3	0	115.7	L148 V149 N150	L148-K152 PolarHBondContact O-N 2.95Å; V149-K152 PolarHBondContact O-N 3.37Å; N150-K152 PolarHBondContact O-N 2.68Å
153	A	90.6	Very high	90.7	Very high	7 Å²	7	60.7 Å²	60.7	6%	0.058	31%	0.311	C	S	.	.			trans	-49.4	144.1	169.2	0	0	0	0	0	112.2	V122 D123 L133 L148 V155	V122-A153 HydrophobicContact CG1-CB 3.59Å; D123-A153 WeakPolarHBondContact OD1-CA 3.48Å; L133-A153 HydrophobicContact CB-CB 4.38Å; L133-A153 HydrophobicContact CD2-CB 4.14Å; L148-A153 HydrophobicContact CB-CB 4.13Å; L148-A153 VanDerWaalsContact O-CB 3.26Å; L148-A153 WeakPolarHBondContact O-CB 3.5Å; L148-A153 PolarHBondContact O-N 3.21Å; A153-V155 PolarHBondContact O-N 3Å
154	H	90.1	Very high	90.6	Very high	123 Å²	123	57 Å²	57	57%	0.569	29%	0.291	S	S	*	.			trans	-76.7	88.5	179.6	-75	-42.3	0	0	0	111.9	D123 N156 L157	D123-H154 PolarHBondContact OD1-N 2.79Å; D123-H154 IonicContact OD2-CD2 2.85Å; D123-H154 PolarHBondContact OD2-CD2 2.94Å; D123-H154 VanDerWaalsContact OD2-CD2 3.31Å; D123-H154 IonicContact OD2-CG 2.68Å; D123-H154 PolarHBondContact OD2-N 3.05Å; H154-N156 PolarHBondContact O-N 2.98Å; H154-L157 HydrophobicContact CB-CD1 3.87Å; H154-L157 HydrophobicContact CB-CD2 4.35Å; H154-L157 HydrophobicContact CB-CG 3.72Å; H154-L157 WeakPolarHBondContact O-CG 3.36Å; H154-L157 PolarHBondContact O-N 3.15Å; H154-L157 VanDerWaalsContact O-N 3.1Å
155	V	90.7	Very high	90.4	Very high	13 Å²	13	57.2 Å²	57.2	8%	0.079	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-25.4	-177.9	179.2	0	0	0	0	115.1	L133 V149 A153 P166 L182 C187	L133-V155 HydrophobicContact CD2-CG2 4.26Å; V149-V155 HydrophobicContact CG2-CG2 4.39Å; A153-V155 PolarHBondContact O-N 3Å; V155-P166 WeakPolarHBondContact O-CD 3.41Å; V155-P166 WeakPolarHBondContact O-CG 3.21Å; V155-L182 HydrophobicContact CG1-CD2 3.87Å; V155-C187 HydrophobicContact CG1-CB 3.73Å
156	N	90.8	Very high	90.3	Very high	54 Å²	54	57.2 Å²	57.2	29%	0.289	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	19.5	-176.1	-59	-60.2	0	0	0	114	H154 D186 C187 Q188	H154-N156 PolarHBondContact O-N 2.98Å; N156-D186 PolarHBondContact ND2-O 3.46Å; N156-C187 WeakPolarHBondContact OD1-CA 3.46Å; N156-C187 PolarHBondContact OD1-SG 3.24Å; N156-C187 VanDerWaalsContact OD1-SG 3.4Å; N156-Q188 PolarHBondContact OD1-N 3.19Å
157	L	89.8	Confident	90.4	Very high	62 Å²	62	55.4 Å²	55.4	33%	0.325	28%	0.283	S	S	.	.			trans	-61.7	156.3	167.4	-71.9	171.7	0	0	0	111.4	D123 H154 P166	D123-L157 HydrophobicContact CB-CD1 4.09Å; H154-L157 HydrophobicContact CB-CD1 3.87Å; H154-L157 HydrophobicContact CB-CD2 4.35Å; H154-L157 HydrophobicContact CB-CG 3.72Å; H154-L157 WeakPolarHBondContact O-CG 3.36Å; H154-L157 PolarHBondContact O-N 3.15Å; H154-L157 VanDerWaalsContact O-N 3.1Å; L157-P166 WeakPolarHBondContact O-CD 3.41Å
158	I	89.6	Confident	90.4	Very high	99 Å²	99	54.1 Å²	54.1	51%	0.508	28%	0.276	S	S	.	.			trans	-131	149.7	178	55.7	171	0	0	0	110	L164 T165	I158-L164 WeakPolarHBondContact CA-O 3.35Å; I158-T165 HydrophobicContact CG2-CG2 3.74Å
159	D	87.4	Confident	90.4	Very high	7 Å²	7	54.4 Å²	54.4	4%	0.037	28%	0.278	C	S	.	.			trans	-75.9	161.1	169.4	74.1	-72	0	0	0	112	M134 E161 D162 G163 L164	M134-D159 HydrophobicContact CE-CB 4.02Å; M134-D159 HydrophobicContact SD-CB 4.42Å; D159-E161 WeakPolarHBondContact OD2-CA 3.34Å; D159-E161 PolarHBondContact OD2-N 3.36Å; D159-D162 PolarHBondContact OD2-N 3.15Å; D159-G163 PolarHBondContact O-N 2.88Å; D159-G163 PolarHBondContact OD1-N 2.85Å; D159-G163 VanDerWaalsContact OD1-N 3.13Å; D159-L164 WeakPolarHBondContact OD1-CB 3.39Å; D159-L164 WeakPolarHBondContact OD1-CG 3.38Å; D159-L164 PolarHBondContact OD1-N 3.35Å
160	E	85.1	Confident	90.6	Very high	165 Å²	165	53.2 Å²	53.2	77%	0.771	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-20.7	-177.9	-59.4	-159.2	157.5	0	0	113.7
161	E	85.4	Confident	90.8	Very high	137 Å²	137	47.3 Å²	47.3	64%	0.64	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-53.1	-173	-63.3	-155.6	135.7	0	0	113.2	D159 K194	D159-E161 WeakPolarHBondContact OD2-CA 3.34Å; D159-E161 PolarHBondContact OD2-N 3.36Å; E161-K194 VanDerWaalsContact O-CD 3.24Å; E161-K194 WeakPolarHBondContact O-CD 3.21Å; E161-K194 WeakPolarHBondContact O-CE 3.48Å; E161-K194 PolarHBondContact O-NZ 3.32Å
162	D	85.6	Confident	90.9	Very high	67 Å²	67	46.4 Å²	46.4	36%	0.358	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	-14	-174.1	-88.7	-22.2	0	0	0	113.8	D159 L164 K194	D159-D162 PolarHBondContact OD2-N 3.15Å; D162-L164 HydrophobicContact CB-CD1 4.02Å; D162-L164 HydrophobicContact CB-CD2 4.06Å; D162-L164 HydrophobicContact CB-CG 3.72Å; D162-K194 WeakPolarHBondContact O-CB 3.19Å; D162-K194 PolarHBondContact O-N 3.19Å
163	G	90	Very high	91.2	Very high	14 Å²	14	42.3 Å²	42.3	14%	0.144	21%	0.212	C	C	.	.			trans	74.4	31.9	177.9	0	0	0	0	0	114	D159	D159-G163 PolarHBondContact O-N 2.88Å; D159-G163 PolarHBondContact OD1-N 2.85Å; D159-G163 VanDerWaalsContact OD1-N 3.13Å
164	L	91.8	Very high	91.4	Very high	20 Å²	20	43 Å²	43	11%	0.105	22%	0.22	C	C	.	.			trans	-81.8	129.9	-177.2	-50.2	172.4	0	0	0	110.4	M134 I158 D159 D162 I168 V169 D193 W202	M134-L164 HydrophobicContact CE-CB 3.9Å; M134-L164 WeakPolarHBondContact CE-O 3.37Å; I158-L164 WeakPolarHBondContact CA-O 3.35Å; D159-L164 WeakPolarHBondContact OD1-CB 3.39Å; D159-L164 WeakPolarHBondContact OD1-CG 3.38Å; D159-L164 PolarHBondContact OD1-N 3.35Å; D162-L164 HydrophobicContact CB-CD1 4.02Å; D162-L164 HydrophobicContact CB-CD2 4.06Å; D162-L164 HydrophobicContact CB-CG 3.72Å; L164-I168 HydrophobicContact CB-CG2 4.35Å; L164-I168 HydrophobicContact CD2-CG2 3.78Å; L164-V169 HydrophobicContact CB-CG2 4.08Å; L164-V169 HydrophobicContact CD1-CG2 4.49Å; L164-D193 HydrophobicContact CD2-CB 3.93Å; L164-W202 HydrophobicContact CD2-CZ2 4.04Å
165	T	92.4	Very high	91.6	Very high	5 Å²	5	39.3 Å²	39.3	3%	0.031	20%	0.202	C	C	.	.			trans	-82.3	158.9	167.1	62.5	0	0	0	0	111.4	I158 L167 I168 V169 A191	I158-T165 HydrophobicContact CG2-CG2 3.74Å; T165-L167 PolarHBondContact O-N 2.87Å; T165-L167 VanDerWaalsContact O-N 3.15Å; T165-I168 WeakPolarHBondContact O-CA 3.33Å; T165-I168 WeakPolarHBondContact O-CB 3.34Å; T165-I168 PolarHBondContact O-N 2.87Å; T165-I168 WeakPolarHBondContact OG1-CG1 3.38Å; T165-I168 PolarHBondContact OG1-N 2.81Å; T165-V169 WeakPolarHBondContact O-CG2 3.34Å; T165-V169 PolarHBondContact O-N 3.31Å; T165-A191 HydrophobicContact CG2-CB 3.93Å
166	P	93.3	Very high	91.8	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	21%	0.213	C	C	.	.	H	α-helix	trans	-46.7	-39.7	168	-32.5	36.2	0	0	0	114.1	L133 M134 V137 V155 L157 V169 A170 L182	L133-P166 HydrophobicContact CD2-CG 4.28Å; M134-P166 HydrophobicContact CG-CG 4.48Å; V137-P166 HydrophobicContact CG2-CB 4.37Å; V155-P166 WeakPolarHBondContact O-CD 3.41Å; V155-P166 WeakPolarHBondContact O-CG 3.21Å; L157-P166 WeakPolarHBondContact O-CD 3.41Å; P166-V169 PolarHBondContact O-N 3.32Å; P166-A170 WeakPolarHBondContact O-CB 3.36Å; P166-A170 PolarHBondContact O-N 3.17Å; P166-L182 HydrophobicContact CB-CD1 4.32Å; P166-L182 HydrophobicContact CB-CD2 4.28Å
167	L	95	Very high	92.1	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-65.8	-38.8	175.6	-178.7	81.4	0	0	0	112.3	T165 S171 V179 L182 I183 C187 A199 L215	T165-L167 PolarHBondContact O-N 2.87Å; T165-L167 VanDerWaalsContact O-N 3.15Å; L167-S171 WeakPolarHBondContact O-CB 3.42Å; L167-S171 PolarHBondContact O-N 3.29Å; L167-S171 PolarHBondContact O-OG 2.89Å; L167-V179 HydrophobicContact CD1-CG1 4.12Å; L167-L182 HydrophobicContact CD1-CB 4.28Å; L167-I183 HydrophobicContact CD1-CG1 4.04Å; L167-C187 VanDerWaalsContact CB-SG 3.58Å; L167-A199 HydrophobicContact CD2-CB 3.91Å; L167-A199 HydrophobicContact CG-CB 4.01Å; L167-L215 HydrophobicContact CD1-CD2 4.24Å; L167-L215 HydrophobicContact CD2-CD2 4.19Å; L167-L215 HydrophobicContact CG-CD2 4.43Å
168	I	94.4	Very high	92.3	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.015	21%	0.209	C	C	.	.	H	α-helix	trans	-64.6	-43.7	173.4	-68.9	170.4	0	0	0	110.4	L164 T165 S171 G172 A199 W202	L164-I168 HydrophobicContact CB-CG2 4.35Å; L164-I168 HydrophobicContact CD2-CG2 3.78Å; T165-I168 WeakPolarHBondContact O-CA 3.33Å; T165-I168 WeakPolarHBondContact O-CB 3.34Å; T165-I168 PolarHBondContact O-N 2.87Å; T165-I168 WeakPolarHBondContact OG1-CG1 3.38Å; T165-I168 PolarHBondContact OG1-N 2.81Å; I168-S171 PolarHBondContact O-N 2.98Å; I168-G172 PolarHBondContact O-N 2.92Å; I168-A199 HydrophobicContact CG1-CB 4.15Å; I168-W202 HydrophobicContact CG2-CD2 4.18Å; I168-W202 HydrophobicContact CG2-CG 3.88Å
169	V	93.8	Very high	92.6	Very high	7 Å²	7	36 Å²	36	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-62.2	-46.9	177.8	179.3	0	0	0	0	111.5	W130 M134 V137 L164 T165 P166 R173	W130-V169 HydrophobicContact CH2-CG1 4.33Å; W130-V169 HydrophobicContact CH2-CG2 4.02Å; W130-V169 HydrophobicContact CZ3-CG1 4.26Å; W130-V169 HydrophobicContact CZ3-CG2 4.33Å; M134-V169 HydrophobicContact CE-CG2 3.62Å; M134-V169 HydrophobicContact CG-CG2 4.33Å; V137-V169 HydrophobicContact CG1-CB 4.16Å; V137-V169 HydrophobicContact CG1-CG1 4.01Å; L164-V169 HydrophobicContact CB-CG2 4.08Å; L164-V169 HydrophobicContact CD1-CG2 4.49Å; T165-V169 WeakPolarHBondContact O-CG2 3.34Å; T165-V169 PolarHBondContact O-N 3.31Å; P166-V169 PolarHBondContact O-N 3.32Å; V169-R173 WeakPolarHBondContact O-CB 3.39Å; V169-R173 WeakPolarHBondContact O-CG 3.32Å; V169-R173 PolarHBondContact O-N 3.42Å
170	A	95.4	Very high	92.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-43.9	176	0	0	0	0	0	111.6	V137 P166 R173 G174 F175 I178 V179 L182	V137-A170 HydrophobicContact CG1-CB 3.7Å; P166-A170 WeakPolarHBondContact O-CB 3.36Å; P166-A170 PolarHBondContact O-N 3.17Å; A170-R173 PolarHBondContact O-N 2.94Å; A170-G174 PolarHBondContact O-N 3.38Å; A170-F175 PolarHBondContact O-N 3.4Å; A170-F175 VanDerWaalsContact O-N 3.13Å; A170-I178 HydrophobicContact CB-CG2 3.85Å; A170-V179 HydrophobicContact CB-CG2 3.65Å; A170-L182 HydrophobicContact CB-CD1 3.93Å
171	S	95.6	Very high	93.4	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-70.5	-37.1	-176.9	-61.8	0	0	0	0	112.9	L167 I168 R173 H208	L167-S171 WeakPolarHBondContact O-CB 3.42Å; L167-S171 PolarHBondContact O-N 3.29Å; L167-S171 PolarHBondContact O-OG 2.89Å; I168-S171 PolarHBondContact O-N 2.98Å; S171-R173 VanDerWaalsContact C-N 3.32Å; S171-H208 PolarHBondContact O-CD2 2.77Å
172	G	93.3	Very high	93.7	Very high	13 Å²	13	29.4 Å²	29.4	13%	0.134	15%	0.151	C	C	.	.	H	α-helix	trans	-70.2	-26.2	173.4	0	0	0	0	0	113.6	I168 H208	I168-G172 PolarHBondContact O-N 2.92Å; G172-H208 PolarHBondContact O-NE2 2.89Å
173	R	95	Very high	94.1	Very high	90 Å²	90	28.4 Å²	28.4	34%	0.34	15%	0.145	S	C	.	.	H	α-helix	trans	-86.6	-24.5	174.5	-75.1	-174.7	163	63.5	10.6	114.2	Y138 V169 A170 S171 F175 H208	Y138-R173 VanDerWaalsContact CD2-NH2 3.31Å; Y138-R173 WeakPolarHBondContact O-CD 3.35Å; Y138-R173 PolarHBondContact O-NE 3.48Å; V169-R173 WeakPolarHBondContact O-CB 3.39Å; V169-R173 WeakPolarHBondContact O-CG 3.32Å; V169-R173 PolarHBondContact O-N 3.42Å; A170-R173 PolarHBondContact O-N 2.94Å; S171-R173 VanDerWaalsContact C-N 3.32Å; R173-F175 HydrophobicContact CB-CD1 4.13Å; R173-F175 HydrophobicContact CB-CD2 3.8Å; R173-F175 HydrophobicContact CB-CE1 3.94Å; R173-F175 HydrophobicContact CB-CE2 3.6Å; R173-F175 HydrophobicContact CB-CG 4.07Å; R173-F175 HydrophobicContact CB-CZ 3.67Å; R173-F175 HydrophobicContact CG-CE2 4.08Å; R173-F175 HydrophobicContact CG-CZ 4.18Å; R173-H208 VanDerWaalsContact C-NE2 3.29Å; R173-H208 PolarHBondContact O-CE1 3.29Å; R173-H208 VanDerWaalsContact O-CE1 3.32Å; R173-H208 PolarHBondContact O-NE2 3.15Å
174	G	94	Very high	94.1	Very high	21 Å²	21	32.8 Å²	32.8	22%	0.216	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.6	17.6	178.3	0	0	0	0	0	114.3	A170 S176 H208	A170-G174 PolarHBondContact O-N 3.38Å; G174-S176 VanDerWaalsContact C-N 3.33Å; G174-S176 PolarHBondContact O-N 2.67Å; G174-H208 VanDerWaalsContact CA-CG 3.48Å; G174-H208 PolarHBondContact N-NE2 3.01Å
175	F	96.1	Very high	93.8	Very high	47 Å²	47	32.9 Å²	32.9	21%	0.206	17%	0.168	C	C	.	.			trans	-79.2	77.5	-174.3	-58.9	-26.4	0	0	0	111.2	V137 N140 A170 R173 Q177 I178 V179	V137-F175 VanDerWaalsContact O-CD2 3.25Å; V137-F175 WeakPolarHBondContact O-CD2 3.43Å; V137-F175 WeakPolarHBondContact O-CE2 3.45Å; N140-F175 HydrophobicContact CB-CD1 4.28Å; N140-F175 HydrophobicContact CB-CD2 4.04Å; N140-F175 HydrophobicContact CB-CE1 3.94Å; N140-F175 HydrophobicContact CB-CE2 3.65Å; N140-F175 HydrophobicContact CB-CG 4.34Å; N140-F175 HydrophobicContact CB-CZ 3.61Å; N140-F175 WeakPolarHBondContact OD1-CB 3.42Å; N140-F175 VanDerWaalsContact OD1-CD1 3.26Å; N140-F175 WeakPolarHBondContact OD1-CD1 3.45Å; N140-F175 WeakPolarHBondContact OD1-CD2 3.2Å; N140-F175 WeakPolarHBondContact OD1-CG 3.42Å; A170-F175 PolarHBondContact O-N 3.4Å; A170-F175 VanDerWaalsContact O-N 3.13Å; R173-F175 HydrophobicContact CB-CD1 4.13Å; R173-F175 HydrophobicContact CB-CD2 3.8Å; R173-F175 HydrophobicContact CB-CE1 3.94Å; R173-F175 HydrophobicContact CB-CE2 3.6Å; R173-F175 HydrophobicContact CB-CG 4.07Å; R173-F175 HydrophobicContact CB-CZ 3.67Å; R173-F175 HydrophobicContact CG-CE2 4.08Å; R173-F175 HydrophobicContact CG-CZ 4.18Å; F175-Q177 VanDerWaalsContact C-N 3.34Å; F175-Q177 PolarHBondContact O-N 2.98Å; F175-I178 HydrophobicContact CB-CB 3.98Å; F175-I178 HydrophobicContact CB-CD1 4.18Å; F175-I178 HydrophobicContact CB-CG1 4.33Å; F175-I178 HydrophobicContact CD2-CD1 4.2Å; F175-I178 PolarHBondContact O-N 3.02Å; F175-V179 WeakPolarHBondContact O-CG2 3.32Å; F175-V179 PolarHBondContact O-N 3.28Å
176	S	94.9	Very high	93.4	Very high	43 Å²	43	40 Å²	40	30%	0.301	21%	0.206	S	C	.	.	H	α-helix	trans	-56.7	-40.5	-170.8	61.3	0	0	0	0	114.3	G174 V179 E180 L214	G174-S176 VanDerWaalsContact C-N 3.33Å; G174-S176 PolarHBondContact O-N 2.67Å; S176-V179 PolarHBondContact O-N 2.99Å; S176-E180 WeakPolarHBondContact O-CB 3.1Å; S176-E180 PolarHBondContact O-N 3.1Å; S176-L214 WeakPolarHBondContact O-CD1 3.36Å
177	Q	95.3	Very high	93.2	Very high	114 Å²	114	40.8 Å²	40.8	53%	0.533	21%	0.211	S	C	.	.	H	α-helix	trans	-63.6	-42.8	176	-68.6	174.8	-45	0	0	111.4	L142 F175 E180 R181	L142-Q177 HydrophobicContact CD1-CB 4.03Å; L142-Q177 HydrophobicContact CD2-CB 4.1Å; F175-Q177 VanDerWaalsContact C-N 3.34Å; F175-Q177 PolarHBondContact O-N 2.98Å; Q177-E180 PolarHBondContact O-N 3.43Å; Q177-R181 VanDerWaalsContact O-CG 3.28Å; Q177-R181 WeakPolarHBondContact O-CG 3.22Å; Q177-R181 PolarHBondContact O-N 3.45Å
178	I	95.5	Very high	93	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-67.3	-39.3	176.7	-67.3	179.5	0	0	0	110.6	V137 N140 L142 V145 A170 F175 R181 L182	V137-I178 HydrophobicContact CB-CG2 4.37Å; V137-I178 HydrophobicContact CG1-CG2 4.11Å; V137-I178 HydrophobicContact CG2-CG2 3.76Å; N140-I178 WeakPolarHBondContact OD1-CD1 3.31Å; L142-I178 HydrophobicContact CD1-CG1 3.79Å; V145-I178 HydrophobicContact CG2-CD1 4.29Å; V145-I178 HydrophobicContact CG2-CG2 4.45Å; A170-I178 HydrophobicContact CB-CG2 3.85Å; F175-I178 HydrophobicContact CB-CB 3.98Å; F175-I178 HydrophobicContact CB-CD1 4.18Å; F175-I178 HydrophobicContact CB-CG1 4.33Å; F175-I178 HydrophobicContact CD2-CD1 4.2Å; F175-I178 PolarHBondContact O-N 3.02Å; I178-R181 PolarHBondContact O-N 3.46Å; I178-L182 HydrophobicContact CG2-CD1 3.77Å; I178-L182 HydrophobicContact CG2-CG 4.25Å; I178-L182 WeakPolarHBondContact O-CB 3.43Å; I178-L182 WeakPolarHBondContact O-CG 3.45Å; I178-L182 PolarHBondContact O-N 3.36Å
179	V	95.4	Very high	93	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.9	-44	174	169	0	0	0	0	111.5	L167 A170 F175 S176 L182 I183 V211 L214	L167-V179 HydrophobicContact CD1-CG1 4.12Å; A170-V179 HydrophobicContact CB-CG2 3.65Å; F175-V179 WeakPolarHBondContact O-CG2 3.32Å; F175-V179 PolarHBondContact O-N 3.28Å; S176-V179 PolarHBondContact O-N 2.99Å; V179-L182 PolarHBondContact O-N 2.92Å; V179-I183 HydrophobicContact CG1-CD1 3.68Å; V179-I183 HydrophobicContact CG1-CG1 4.48Å; V179-I183 WeakPolarHBondContact O-CB 3.39Å; V179-I183 WeakPolarHBondContact O-CD1 3.41Å; V179-I183 VanDerWaalsContact O-CG1 3.22Å; V179-I183 WeakPolarHBondContact O-CG1 3.16Å; V179-I183 PolarHBondContact O-N 3.25Å; V179-V211 HydrophobicContact CG1-CG1 4.36Å; V179-V211 HydrophobicContact CG2-CG1 4.16Å; V179-V211 HydrophobicContact CG2-CG2 4.05Å; V179-L214 HydrophobicContact CB-CD1 4.4Å; V179-L214 HydrophobicContact CG1-CB 4.24Å; V179-L214 HydrophobicContact CG1-CD1 4.12Å
180	E	94.6	Very high	92.9	Very high	98 Å²	98	49.8 Å²	49.8	46%	0.458	26%	0.256	S	S	.	.	H	α-helix	trans	-59.2	-50.8	175.1	-174.9	170.3	-142.9	0	0	111.3	S176 Q177 L182 I183 D184 L214	S176-E180 WeakPolarHBondContact O-CB 3.1Å; S176-E180 PolarHBondContact O-N 3.1Å; Q177-E180 PolarHBondContact O-N 3.43Å; E180-L182 VanDerWaalsContact C-N 3.34Å; E180-L182 PolarHBondContact O-N 2.89Å; E180-I183 PolarHBondContact O-N 3.15Å; E180-D184 PolarHBondContact O-N 3.03Å; E180-L214 HydrophobicContact CB-CD1 4.2Å; E180-L214 HydrophobicContact CB-CD2 4.42Å; E180-L214 HydrophobicContact CG-CD2 4.49Å
181	R	93.7	Very high	92.8	Very high	74 Å²	74	50.6 Å²	50.6	28%	0.279	26%	0.262	S	S	.	.	H	α-helix	trans	-66.1	-29.5	178.8	-60.8	-60.6	-68.9	130.2	5.7	114.1	L142 D146 Q177 I178 D184 S185	L142-R181 HydrophobicContact CD1-CG 4.04Å; D146-R181 IonicContact OD1-CZ 2.76Å; D146-R181 IonicContact OD1-NE 3.91Å; D146-R181 PolarHBondContact OD1-NE 2.89Å; D146-R181 IonicContact OD1-NH2 3.22Å; D146-R181 PolarHBondContact OD1-NH2 3.33Å; D146-R181 IonicContact OD2-NE 3.86Å; Q177-R181 VanDerWaalsContact O-CG 3.28Å; Q177-R181 WeakPolarHBondContact O-CG 3.22Å; Q177-R181 PolarHBondContact O-N 3.45Å; I178-R181 PolarHBondContact O-N 3.46Å; R181-D184 IonicContact CZ-OD2 3.71Å; R181-D184 IonicContact NH1-OD2 3.83Å; R181-D184 PolarHBondContact NH1-OD2 2.96Å; R181-S185 PolarHBondContact O-OG 2.93Å
182	L	93.6	Very high	92.6	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-74.5	-36.8	172.8	-69.6	167.9	0	0	0	111.8	L133 V137 V155 P166 L167 A170 I178 V179 E180 D184 S185 C187	L133-L182 HydrophobicContact CD2-CD2 4.49Å; V137-L182 HydrophobicContact CG2-CD1 4.28Å; V155-L182 HydrophobicContact CG1-CD2 3.87Å; P166-L182 HydrophobicContact CB-CD1 4.32Å; P166-L182 HydrophobicContact CB-CD2 4.28Å; L167-L182 HydrophobicContact CD1-CB 4.28Å; A170-L182 HydrophobicContact CB-CD1 3.93Å; I178-L182 HydrophobicContact CG2-CD1 3.77Å; I178-L182 HydrophobicContact CG2-CG 4.25Å; I178-L182 WeakPolarHBondContact O-CB 3.43Å; I178-L182 WeakPolarHBondContact O-CG 3.45Å; I178-L182 PolarHBondContact O-N 3.36Å; V179-L182 PolarHBondContact O-N 2.92Å; E180-L182 VanDerWaalsContact C-N 3.34Å; E180-L182 PolarHBondContact O-N 2.89Å; L182-D184 VanDerWaalsContact C-N 3.33Å; L182-S185 PolarHBondContact O-N 3.38Å; L182-S185 VanDerWaalsContact O-N 3.16Å; L182-S185 PolarHBondContact O-OG 3.42Å; L182-C187 WeakPolarHBondContact O-CB 3.42Å
183	I	92.5	Very high	92.6	Very high	45 Å²	45	53.6 Å²	53.6	23%	0.231	28%	0.28	C	S	.	.	H	α-helix	trans	-66.1	-36.2	175.3	-72.1	165.3	0	0	0	111	L167 V179 E180 S185 L214 L215	L167-I183 HydrophobicContact CD1-CG1 4.04Å; V179-I183 HydrophobicContact CG1-CD1 3.68Å; V179-I183 HydrophobicContact CG1-CG1 4.48Å; V179-I183 WeakPolarHBondContact O-CB 3.39Å; V179-I183 WeakPolarHBondContact O-CD1 3.41Å; V179-I183 VanDerWaalsContact O-CG1 3.22Å; V179-I183 WeakPolarHBondContact O-CG1 3.16Å; V179-I183 PolarHBondContact O-N 3.25Å; E180-I183 PolarHBondContact O-N 3.15Å; I183-S185 PolarHBondContact O-N 2.89Å; I183-L214 HydrophobicContact CD1-CB 4.27Å; I183-L215 HydrophobicContact CD1-CD2 4.33Å
184	D	90.9	Very high	92.4	Very high	106 Å²	106	56 Å²	56	57%	0.567	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.6	172.1	-75	-21.2	0	0	0	113.5	E180 R181 L182	E180-D184 PolarHBondContact O-N 3.03Å; R181-D184 IonicContact CZ-OD2 3.71Å; R181-D184 IonicContact NH1-OD2 3.83Å; R181-D184 PolarHBondContact NH1-OD2 2.96Å; L182-D184 VanDerWaalsContact C-N 3.33Å
185	S	84.6	Confident	92.2	Very high	23 Å²	23	59.5 Å²	59.5	16%	0.161	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	68.6	-168.9	63.9	0	0	0	0	113.6	R181 L182 I183 C187	R181-S185 PolarHBondContact O-OG 2.93Å; L182-S185 PolarHBondContact O-N 3.38Å; L182-S185 VanDerWaalsContact O-N 3.16Å; L182-S185 PolarHBondContact O-OG 3.42Å; I183-S185 PolarHBondContact O-N 2.89Å; S185-C187 PolarHBondContact O-N 3.28Å
186	D	84.4	Confident	92	Very high	155 Å²	155	58.5 Å²	58.5	83%	0.829	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.4	34.3	170.5	-71.3	-24.2	0	0	0	115.4	N156	N156-D186 PolarHBondContact ND2-O 3.46Å
187	C	88.8	Confident	91.9	Very high	16 Å²	16	56.8 Å²	56.8	11%	0.108	29%	0.293	C	S	.	.			trans	-84.2	139.7	-175.6	-169.2	0	0	0	0	113	V155 N156 L167 L182 S185 V189	V155-C187 HydrophobicContact CG1-CB 3.73Å; N156-C187 WeakPolarHBondContact OD1-CA 3.46Å; N156-C187 PolarHBondContact OD1-SG 3.24Å; N156-C187 VanDerWaalsContact OD1-SG 3.4Å; L167-C187 VanDerWaalsContact CB-SG 3.58Å; L182-C187 WeakPolarHBondContact O-CB 3.42Å; S185-C187 PolarHBondContact O-N 3.28Å; C187-V189 PolarHBondContact O-N 2.77Å
188	Q	91.9	Very high	91.8	Very high	124 Å²	124	51.8 Å²	51.8	58%	0.579	27%	0.27	S	S	*	.			trans	-78.3	87.7	177.7	-65.3	-177.9	14.2	0	0	110.8	N156 N190 A191	N156-Q188 PolarHBondContact OD1-N 3.19Å; Q188-N190 PolarHBondContact O-N 3.34Å; Q188-N190 VanDerWaalsContact O-N 3.15Å; Q188-A191 HydrophobicContact CB-CB 3.97Å; Q188-A191 WeakPolarHBondContact O-CB 3.21Å; Q188-A191 PolarHBondContact O-N 2.98Å
189	V	92.8	Very high	91.8	Very high	22 Å²	22	51.8 Å²	51.8	13%	0.133	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-37.6	-177.3	179.6	0	0	0	0	113.6	C187 L215 A220	C187-V189 PolarHBondContact O-N 2.77Å; V189-L215 HydrophobicContact CG1-CD2 4.18Å; V189-A220 HydrophobicContact CG1-CB 3.73Å
190	N	93.4	Very high	91.9	Very high	55 Å²	55	51.9 Å²	51.9	29%	0.294	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	13.1	179.5	-65.4	-21.9	0	0	0	114	Q188 A220 E221	Q188-N190 PolarHBondContact O-N 3.34Å; Q188-N190 VanDerWaalsContact O-N 3.15Å; N190-A220 VanDerWaalsContact OD1-CA 3.27Å; N190-A220 WeakPolarHBondContact OD1-CA 3.5Å; N190-E221 WeakPolarHBondContact ND2-CG 3.19Å; N190-E221 PolarHBondContact ND2-OE1 3.16Å; N190-E221 PolarHBondContact OD1-N 3.35Å
191	A	92.1	Very high	91.9	Very high	17 Å²	17	47.3 Å²	47.3	14%	0.14	25%	0.25	C	S	.	.			trans	-59.1	144.6	168.2	0	0	0	0	0	110.5	T165 Q188 T198	T165-A191 HydrophobicContact CG2-CB 3.93Å; Q188-A191 HydrophobicContact CB-CB 3.97Å; Q188-A191 WeakPolarHBondContact O-CB 3.21Å; Q188-A191 PolarHBondContact O-N 2.98Å; A191-T198 WeakPolarHBondContact O-CA 3.48Å
192	C	92.4	Very high	92	Very high	68 Å²	68	46.3 Å²	46.3	46%	0.459	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-128.8	150.8	-174.7	60.7	0	0	0	0	111.9	S197 T198	C192-S197 WeakPolarHBondContact CA-O 3.35Å; C192-T198 HydrophobicContact CB-CG2 4.16Å
193	D	92.3	Very high	92.1	Very high	8 Å²	8	46.3 Å²	46.3	4%	0.043	25%	0.246	C	C	.	.			trans	-69.9	175.7	172.3	68.6	22.2	0	0	0	112.7	L164 F195 G196 S197 W202	L164-D193 HydrophobicContact CD2-CB 3.93Å; D193-F195 PolarHBondContact O-N 3.18Å; D193-F195 VanDerWaalsContact OD1-C 3.27Å; D193-F195 VanDerWaalsContact OD1-CA 3.24Å; D193-F195 WeakPolarHBondContact OD1-CA 3.41Å; D193-F195 WeakPolarHBondContact OD1-CB 3.42Å; D193-F195 PolarHBondContact OD1-N 2.81Å; D193-G196 PolarHBondContact O-N 2.85Å; D193-G196 PolarHBondContact OD1-N 3.09Å; D193-G196 VanDerWaalsContact OD1-N 3.08Å; D193-S197 PolarHBondContact N-O 3.36Å; D193-S197 WeakPolarHBondContact OD1-CB 3.4Å; D193-S197 PolarHBondContact OD1-N 3Å; D193-S197 PolarHBondContact OD1-OG 3.46Å; D193-S197 WeakPolarHBondContact OD2-CB 3.27Å; D193-S197 PolarHBondContact OD2-OG 3.46Å; D193-W202 PolarHBondContact OD2-NE1 2.77Å
194	K	92.1	Very high	92.2	Very high	140 Å²	140	44.1 Å²	44.1	61%	0.609	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-10	175.5	-171.6	170.2	-175	166.1	0	114.9	E161 D162	E161-K194 VanDerWaalsContact O-CD 3.24Å; E161-K194 WeakPolarHBondContact O-CD 3.21Å; E161-K194 WeakPolarHBondContact O-CE 3.48Å; E161-K194 PolarHBondContact O-NZ 3.32Å; D162-K194 WeakPolarHBondContact O-CB 3.19Å; D162-K194 PolarHBondContact O-N 3.19Å
195	F	89.5	Confident	92.4	Very high	94 Å²	94	45.2 Å²	45.2	41%	0.412	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	6.4	176.6	-48.3	-77.3	0	0	0	113.5	D193 G226 M227	D193-F195 PolarHBondContact O-N 3.18Å; D193-F195 VanDerWaalsContact OD1-C 3.27Å; D193-F195 VanDerWaalsContact OD1-CA 3.24Å; D193-F195 WeakPolarHBondContact OD1-CA 3.41Å; D193-F195 WeakPolarHBondContact OD1-CB 3.42Å; D193-F195 PolarHBondContact OD1-N 2.81Å; F195-G226 CarbonylContact O-C 3.56Å; F195-M227 HydrophobicContact CB-CB 3.92Å; F195-M227 HydrophobicContact CB-CG 4.04Å; F195-M227 HydrophobicContact CD1-CE 3.88Å; F195-M227 HydrophobicContact CD1-CG 4.47Å; F195-M227 HydrophobicContact CE1-CE 4.1Å; F195-M227 HydrophobicContact CG-CE 4.41Å; F195-M227 HydrophobicContact CG-CG 4.42Å; F195-M227 PolarHBondContact O-N 3.19Å; F195-M227 VanDerWaalsContact O-N 3.15Å
196	G	90.6	Very high	92.9	Very high	27 Å²	27	49.5 Å²	49.5	28%	0.278	25%	0.247	S	C	.	.	S	Bend	trans	82.7	8.2	-178.6	0	0	0	0	0	114.8	D193 G226	D193-G196 PolarHBondContact O-N 2.85Å; D193-G196 PolarHBondContact OD1-N 3.09Å; D193-G196 VanDerWaalsContact OD1-N 3.08Å; G196-G226 WeakPolarHBondContact O-CA 3.11Å
197	S	93	Very high	93.3	Very high	7 Å²	7	43.1 Å²	43.1	5%	0.049	22%	0.218	C	C	.	.			trans	-86	118	-175.1	-25.9	0	0	0	0	111.2	C192 D193	C192-S197 WeakPolarHBondContact CA-O 3.35Å; D193-S197 PolarHBondContact N-O 3.36Å; D193-S197 WeakPolarHBondContact OD1-CB 3.4Å; D193-S197 PolarHBondContact OD1-N 3Å; D193-S197 PolarHBondContact OD1-OG 3.46Å; D193-S197 WeakPolarHBondContact OD2-CB 3.27Å; D193-S197 PolarHBondContact OD2-OG 3.46Å
198	T	94.5	Very high	93.7	Very high	8 Å²	8	44.6 Å²	44.6	5%	0.049	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-78.5	167.1	176.9	63.5	0	0	0	0	112.5	A191 C192 L200 I201 W202 A224	A191-T198 WeakPolarHBondContact O-CA 3.48Å; C192-T198 HydrophobicContact CB-CG2 4.16Å; T198-L200 PolarHBondContact O-N 2.85Å; T198-L200 VanDerWaalsContact O-N 3.15Å; T198-I201 WeakPolarHBondContact O-CB 3.35Å; T198-I201 PolarHBondContact O-N 3.2Å; T198-W202 PolarHBondContact O-N 3.01Å; T198-W202 VanDerWaalsContact O-N 3.07Å; T198-A224 HydrophobicContact CG2-CB 3.99Å
199	A	95.2	Very high	93.9	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-51.6	-36.5	174.2	0	0	0	0	0	113.1	L167 I168 W202 A203 L215	L167-A199 HydrophobicContact CD2-CB 3.91Å; L167-A199 HydrophobicContact CG-CB 4.01Å; I168-A199 HydrophobicContact CG1-CB 4.15Å; A199-W202 PolarHBondContact O-N 2.77Å; A199-A203 WeakPolarHBondContact O-CB 3.42Å; A199-A203 PolarHBondContact O-N 3.03Å; A199-L215 HydrophobicContact CB-CD1 4.02Å; A199-L215 HydrophobicContact CB-CD2 4.09Å
200	L	96	Very high	94	Very high	1 Å²	1	43 Å²	43	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-64.8	-41.8	176.5	-174.4	70.8	0	0	0	112.1	T198 W202 A203 A204 V212 L215 L216 A220 A232 L248	T198-L200 PolarHBondContact O-N 2.85Å; T198-L200 VanDerWaalsContact O-N 3.15Å; L200-W202 VanDerWaalsContact C-N 3.35Å; L200-A203 PolarHBondContact O-N 3.29Å; L200-A204 WeakPolarHBondContact O-CB 3.37Å; L200-A204 PolarHBondContact O-N 3.3Å; L200-V212 HydrophobicContact CD1-CG1 3.87Å; L200-L215 HydrophobicContact CB-CD1 4.39Å; L200-L215 HydrophobicContact CD1-CB 4.04Å; L200-L215 HydrophobicContact CD1-CD1 4.46Å; L200-L216 HydrophobicContact CD1-CD2 3.87Å; L200-L216 HydrophobicContact CD1-CG 3.92Å; L200-L216 HydrophobicContact CD2-CD2 3.8Å; L200-A220 HydrophobicContact CB-CB 4.17Å; L200-A220 HydrophobicContact CD1-CB 4.46Å; L200-A220 HydrophobicContact CD2-CB 4.15Å; L200-A220 HydrophobicContact CG-CB 4.5Å; L200-A232 HydrophobicContact CD2-CB 4.14Å; L200-A232 HydrophobicContact CG-CB 4.04Å; L200-L248 HydrophobicContact CD2-CD2 4.44Å
201	I	95.3	Very high	94.2	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.015	21%	0.208	C	C	.	.	H	α-helix	trans	-65.6	-40	177.9	-64.2	176.2	0	0	0	110.2	T198 R205 A224 A232 L235	T198-I201 WeakPolarHBondContact O-CB 3.35Å; T198-I201 PolarHBondContact O-N 3.2Å; I201-R205 WeakPolarHBondContact O-CB 3.45Å; I201-R205 PolarHBondContact O-N 2.7Å; I201-A224 HydrophobicContact CD1-CB 3.99Å; I201-A224 WeakPolarHBondContact CD1-O 3.47Å; I201-A232 HydrophobicContact CG1-CB 4.13Å; I201-L235 HydrophobicContact CG2-CD1 3.44Å; I201-L235 VanDerWaalsContact CG2-CD1 3.44Å
202	W	95	Very high	94.4	Very high	52 Å²	52	39.6 Å²	39.6	20%	0.197	20%	0.201	C	C	.	.	H	α-helix	trans	-65.6	-44.4	174.3	-82.5	92.5	0	0	0	113.3	L164 I168 D193 T198 A199 L200 K206	L164-W202 HydrophobicContact CD2-CZ2 4.04Å; I168-W202 HydrophobicContact CG2-CD2 4.18Å; I168-W202 HydrophobicContact CG2-CG 3.88Å; D193-W202 PolarHBondContact OD2-NE1 2.77Å; T198-W202 PolarHBondContact O-N 3.01Å; T198-W202 VanDerWaalsContact O-N 3.07Å; A199-W202 PolarHBondContact O-N 2.77Å; L200-W202 VanDerWaalsContact C-N 3.35Å; W202-K206 WeakPolarHBondContact O-CG 3.44Å; W202-K206 PolarHBondContact O-N 3.1Å
203	A	96.2	Very high	94.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.2	-45	176.5	0	0	0	0	0	112.1	A199 L200 K206 G207 H208 V211 V212 L215	A199-A203 WeakPolarHBondContact O-CB 3.42Å; A199-A203 PolarHBondContact O-N 3.03Å; L200-A203 PolarHBondContact O-N 3.29Å; A203-K206 CarbonylContact O-C 3.5Å; A203-K206 PolarHBondContact O-N 3.45Å; A203-K206 VanDerWaalsContact O-N 3.15Å; A203-G207 PolarHBondContact O-N 3.21Å; A203-H208 PolarHBondContact O-N 2.96Å; A203-H208 VanDerWaalsContact O-N 3.15Å; A203-V211 HydrophobicContact CB-CB 4.24Å; A203-V211 HydrophobicContact CB-CG1 3.54Å; A203-V212 HydrophobicContact CB-CG2 3.69Å; A203-L215 HydrophobicContact CB-CD1 4.16Å
204	A	95.7	Very high	94.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.2	-39	178.6	0	0	0	0	0	112.7	L200 K206 G207 A232 A236 F241 V244 L248	L200-A204 WeakPolarHBondContact O-CB 3.37Å; L200-A204 PolarHBondContact O-N 3.3Å; A204-K206 PolarHBondContact O-N 3.34Å; A204-K206 VanDerWaalsContact O-N 3.17Å; A204-G207 PolarHBondContact O-N 3.16Å; A204-A232 HydrophobicContact CB-CB 3.93Å; A204-A232 WeakPolarHBondContact CB-O 3.35Å; A204-A236 HydrophobicContact CB-CB 4.33Å; A204-F241 WeakPolarHBondContact O-CD2 3.21Å; A204-V244 HydrophobicContact CB-CG1 4.31Å; A204-L248 HydrophobicContact CB-CD1 4.43Å
205	R	94.6	Very high	94.8	Very high	128 Å²	128	36 Å²	36	48%	0.483	18%	0.18	S	C	.	.	H	α-helix	trans	-61.1	-19.4	173.5	-174.5	-179	179.8	-178.6	-0.3	113.7	I201 L235	I201-R205 WeakPolarHBondContact O-CB 3.45Å; I201-R205 PolarHBondContact O-N 2.7Å; R205-L235 HydrophobicContact CB-CB 4.01Å; R205-L235 HydrophobicContact CB-CD1 3.86Å; R205-L235 HydrophobicContact CG-CB 4.46Å; R205-L235 HydrophobicContact CG-CD1 4.1Å
206	K	94.4	Very high	95.1	Very high	113 Å²	113	32 Å²	32	49%	0.491	16%	0.163	S	C	.	.	H	α-helix	trans	-112.6	-9.6	-177.6	-68	-71.6	-169.4	172.1	0	114.1	W202 A203 A204 H208 F241	W202-K206 WeakPolarHBondContact O-CG 3.44Å; W202-K206 PolarHBondContact O-N 3.1Å; A203-K206 CarbonylContact O-C 3.5Å; A203-K206 PolarHBondContact O-N 3.45Å; A203-K206 VanDerWaalsContact O-N 3.15Å; A204-K206 PolarHBondContact O-N 3.34Å; A204-K206 VanDerWaalsContact O-N 3.17Å; K206-H208 WeakPolarHBondContact CB-CD2 3.33Å; K206-H208 WeakPolarHBondContact CB-NE2 3.41Å; K206-F241 VanDerWaalsContact C-CE2 3.5Å; K206-F241 VanDerWaalsContact C-CZ 3.48Å; K206-F241 WeakPolarHBondContact O-CZ 3.42Å
207	G	94	Very high	95.2	Very high	21 Å²	21	35.8 Å²	35.8	22%	0.216	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	17.3	177.9	0	0	0	0	0	114.9	A203 A204 L209 F241	A203-G207 PolarHBondContact O-N 3.21Å; A204-G207 PolarHBondContact O-N 3.16Å; G207-L209 VanDerWaalsContact C-N 3.3Å; G207-L209 PolarHBondContact O-N 3.49Å; G207-F241 VanDerWaalsContact CA-CD2 3.48Å; G207-F241 VanDerWaalsContact CA-CG 3.43Å; G207-F241 VanDerWaalsContact N-CE2 3.31Å
208	H	96.5	Very high	95.2	Very high	47 Å²	47	37.3 Å²	37.3	22%	0.218	19%	0.187	C	C	.	.			trans	-76.6	72.5	-172	-65.4	-50.6	0	0	0	112.7	S171 G172 R173 G174 A203 K206 P210 V211 V212	S171-H208 PolarHBondContact O-CD2 2.77Å; G172-H208 PolarHBondContact O-NE2 2.89Å; R173-H208 VanDerWaalsContact C-NE2 3.29Å; R173-H208 PolarHBondContact O-CE1 3.29Å; R173-H208 VanDerWaalsContact O-CE1 3.32Å; R173-H208 PolarHBondContact O-NE2 3.15Å; G174-H208 VanDerWaalsContact CA-CG 3.48Å; G174-H208 PolarHBondContact N-NE2 3.01Å; A203-H208 PolarHBondContact O-N 2.96Å; A203-H208 VanDerWaalsContact O-N 3.15Å; K206-H208 WeakPolarHBondContact CB-CD2 3.33Å; K206-H208 WeakPolarHBondContact CB-NE2 3.41Å; H208-P210 VanDerWaalsContact C-CD 3.47Å; H208-V211 HydrophobicContact CB-CB 4.02Å; H208-V211 HydrophobicContact CB-CG2 4.28Å; H208-V211 WeakPolarHBondContact O-CB 3.33Å; H208-V211 PolarHBondContact O-N 3.22Å; H208-V212 PolarHBondContact O-N 3.33Å
209	L	95.4	Very high	95	Very high	45 Å²	45	39.4 Å²	39.4	24%	0.236	21%	0.211	C	C	.	.	H	α-helix	trans	-46.6	-46.5	-173.5	-173.3	72.2	0	0	0	115	G207 V211 V212 Q213 Q243 V244 L247	G207-L209 VanDerWaalsContact C-N 3.3Å; G207-L209 PolarHBondContact O-N 3.49Å; L209-V211 VanDerWaalsContact C-N 3.34Å; L209-V211 PolarHBondContact O-N 3.2Å; L209-V212 PolarHBondContact O-N 2.97Å; L209-Q213 WeakPolarHBondContact O-CB 3.38Å; L209-Q213 PolarHBondContact O-N 3.26Å; L209-Q243 HydrophobicContact CD1-CB 4.06Å; L209-Q243 WeakPolarHBondContact CD1-O 3.34Å; L209-Q243 HydrophobicContact CD2-CB 4.05Å; L209-V244 HydrophobicContact CB-CG2 4.13Å; L209-V244 HydrophobicContact CD1-CG2 3.84Å; L209-L247 HydrophobicContact CD1-CB 4.14Å; L209-L247 HydrophobicContact CD1-CD1 3.93Å; L209-L247 HydrophobicContact CD1-CG 4.45Å
210	P	96.1	Very high	95	Very high	69 Å²	69	39.8 Å²	39.8	45%	0.448	21%	0.214	S	C	.	.	H	α-helix	trans	-65.9	-36.4	-179.7	-19.8	33.8	0	0	0	112.7	H208 Q213 L214	H208-P210 VanDerWaalsContact C-CD 3.47Å; P210-Q213 PolarHBondContact O-N 3.39Å; P210-L214 WeakPolarHBondContact O-CG 3.48Å; P210-L214 PolarHBondContact O-N 3.01Å
211	V	96.6	Very high	94.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-68.3	-44.4	175.8	170.1	0	0	0	0	110.7	V179 A203 H208 L209 Q213 L214 L215	V179-V211 HydrophobicContact CG1-CG1 4.36Å; V179-V211 HydrophobicContact CG2-CG1 4.16Å; V179-V211 HydrophobicContact CG2-CG2 4.05Å; A203-V211 HydrophobicContact CB-CB 4.24Å; A203-V211 HydrophobicContact CB-CG1 3.54Å; H208-V211 HydrophobicContact CB-CB 4.02Å; H208-V211 HydrophobicContact CB-CG2 4.28Å; H208-V211 WeakPolarHBondContact O-CB 3.33Å; H208-V211 PolarHBondContact O-N 3.22Å; L209-V211 VanDerWaalsContact C-N 3.34Å; L209-V211 PolarHBondContact O-N 3.2Å; V211-Q213 VanDerWaalsContact C-N 3.27Å; V211-Q213 PolarHBondContact O-N 3.17Å; V211-L214 PolarHBondContact O-N 3.38Å; V211-L215 HydrophobicContact CG1-CD1 3.73Å; V211-L215 HydrophobicContact CG1-CG 4.29Å; V211-L215 WeakPolarHBondContact O-CB 3.5Å; V211-L215 VanDerWaalsContact O-CG 3.28Å; V211-L215 WeakPolarHBondContact O-CG 3.35Å; V211-L215 PolarHBondContact O-N 3.04Å
212	V	96.4	Very high	94.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-60	-41.2	175.5	179.9	0	0	0	0	110.3	L200 A203 H208 L209 L215 L216 V244 L247 L248	L200-V212 HydrophobicContact CD1-CG1 3.87Å; A203-V212 HydrophobicContact CB-CG2 3.69Å; H208-V212 PolarHBondContact O-N 3.33Å; L209-V212 PolarHBondContact O-N 2.97Å; V212-L215 PolarHBondContact O-N 3.15Å; V212-L216 HydrophobicContact CG1-CD1 3.98Å; V212-L216 HydrophobicContact CG1-CG 4.35Å; V212-L216 WeakPolarHBondContact O-CB 3.42Å; V212-L216 VanDerWaalsContact O-CG 3.31Å; V212-L216 WeakPolarHBondContact O-CG 3.11Å; V212-L216 PolarHBondContact O-N 3.06Å; V212-V244 HydrophobicContact CG1-CG1 4.25Å; V212-V244 HydrophobicContact CG2-CG1 4.03Å; V212-L247 HydrophobicContact CB-CD2 4.26Å; V212-L247 HydrophobicContact CG1-CD2 3.56Å; V212-L248 HydrophobicContact CG1-CD2 4.31Å; V212-L248 HydrophobicContact CG1-CG 4.42Å
213	Q	95.8	Very high	94.5	Very high	100 Å²	100	47.2 Å²	47.2	47%	0.467	26%	0.255	S	S	.	.	H	α-helix	trans	-64.7	-43.6	176.6	-171.5	174.7	7	0	0	112.6	L209 P210 V211 N217 L247	L209-Q213 WeakPolarHBondContact O-CB 3.38Å; L209-Q213 PolarHBondContact O-N 3.26Å; P210-Q213 PolarHBondContact O-N 3.39Å; V211-Q213 VanDerWaalsContact C-N 3.27Å; V211-Q213 PolarHBondContact O-N 3.17Å; Q213-N217 WeakPolarHBondContact O-CB 3.26Å; Q213-N217 PolarHBondContact O-N 3.44Å; Q213-N217 VanDerWaalsContact O-N 3.08Å; Q213-N217 PolarHBondContact O-ND2 3.03Å; Q213-L247 HydrophobicContact CB-CD1 4.04Å; Q213-L247 HydrophobicContact CG-CD1 4.17Å
214	L	95.5	Very high	94.3	Very high	40 Å²	40	47.8 Å²	47.8	21%	0.209	26%	0.259	C	S	.	.	H	α-helix	trans	-59.8	-50.2	174.3	-75.5	167.2	0	0	0	111.4	S176 V179 E180 I183 P210 V211 L216 N217 S218	S176-L214 WeakPolarHBondContact O-CD1 3.36Å; V179-L214 HydrophobicContact CB-CD1 4.4Å; V179-L214 HydrophobicContact CG1-CB 4.24Å; V179-L214 HydrophobicContact CG1-CD1 4.12Å; E180-L214 HydrophobicContact CB-CD1 4.2Å; E180-L214 HydrophobicContact CB-CD2 4.42Å; E180-L214 HydrophobicContact CG-CD2 4.49Å; I183-L214 HydrophobicContact CD1-CB 4.27Å; P210-L214 WeakPolarHBondContact O-CG 3.48Å; P210-L214 PolarHBondContact O-N 3.01Å; V211-L214 PolarHBondContact O-N 3.38Å; L214-L216 PolarHBondContact O-N 3.43Å; L214-N217 WeakPolarHBondContact O-CB 3.2Å; L214-N217 PolarHBondContact O-N 2.97Å; L214-N217 VanDerWaalsContact O-N 3.1Å; L214-S218 PolarHBondContact O-N 2.93Å; L214-S218 PolarHBondContact O-OG 3.02Å
215	L	95.4	Very high	94.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.8	-42.1	-178.8	-69.1	170.6	0	0	0	112.7	L167 I183 V189 A199 L200 A203 V211 V212 N217 S218 G219 A220	L167-L215 HydrophobicContact CD1-CD2 4.24Å; L167-L215 HydrophobicContact CD2-CD2 4.19Å; L167-L215 HydrophobicContact CG-CD2 4.43Å; I183-L215 HydrophobicContact CD1-CD2 4.33Å; V189-L215 HydrophobicContact CG1-CD2 4.18Å; A199-L215 HydrophobicContact CB-CD1 4.02Å; A199-L215 HydrophobicContact CB-CD2 4.09Å; L200-L215 HydrophobicContact CB-CD1 4.39Å; L200-L215 HydrophobicContact CD1-CB 4.04Å; L200-L215 HydrophobicContact CD1-CD1 4.46Å; A203-L215 HydrophobicContact CB-CD1 4.16Å; V211-L215 HydrophobicContact CG1-CD1 3.73Å; V211-L215 HydrophobicContact CG1-CG 4.29Å; V211-L215 WeakPolarHBondContact O-CB 3.5Å; V211-L215 VanDerWaalsContact O-CG 3.28Å; V211-L215 WeakPolarHBondContact O-CG 3.35Å; V211-L215 PolarHBondContact O-N 3.04Å; V212-L215 PolarHBondContact O-N 3.15Å; L215-N217 VanDerWaalsContact C-N 3.26Å; L215-N217 PolarHBondContact O-N 3.24Å; L215-S218 WeakPolarHBondContact CA-OG 3.5Å; L215-S218 CarbonylContact O-C 3.57Å; L215-S218 PolarHBondContact O-N 3.43Å; L215-S218 PolarHBondContact O-OG 3.1Å; L215-G219 PolarHBondContact O-N 3.25Å; L215-A220 HydrophobicContact CB-CB 3.96Å; L215-A220 WeakPolarHBondContact O-CB 3.29Å; L215-A220 PolarHBondContact O-N 3.03Å
216	L	94.5	Very high	93.9	Very high	11 Å²	11	45.8 Å²	45.8	6%	0.058	26%	0.262	C	S	.	.	H	α-helix	trans	-70.1	-22.9	175.4	-67.8	178.6	0	0	0	113.1	L200 V212 L214 V222 L247 L248 R251	L200-L216 HydrophobicContact CD1-CD2 3.87Å; L200-L216 HydrophobicContact CD1-CG 3.92Å; L200-L216 HydrophobicContact CD2-CD2 3.8Å; V212-L216 HydrophobicContact CG1-CD1 3.98Å; V212-L216 HydrophobicContact CG1-CG 4.35Å; V212-L216 WeakPolarHBondContact O-CB 3.42Å; V212-L216 VanDerWaalsContact O-CG 3.31Å; V212-L216 WeakPolarHBondContact O-CG 3.11Å; V212-L216 PolarHBondContact O-N 3.06Å; L214-L216 PolarHBondContact O-N 3.43Å; L216-V222 HydrophobicContact CD2-CB 4.5Å; L216-V222 HydrophobicContact CD2-CG1 4.26Å; L216-V222 HydrophobicContact CD2-CG2 3.77Å; L216-L247 HydrophobicContact CD1-CD2 3.56Å; L216-L248 HydrophobicContact CD1-CD2 4.02Å; L216-L248 HydrophobicContact CD2-CD2 4.43Å; L216-R251 HydrophobicContact CD1-CG 4.06Å; L216-R251 PolarHBondContact O-NH2 3.2Å
217	N	93.7	Very high	93.7	Very high	105 Å²	105	43.5 Å²	43.5	56%	0.561	25%	0.254	S	S	*	.	H	α-helix	trans	-79.2	-31.8	171.8	-71.2	-14	0	0	0	111.9	Q213 L214 L215 G219 R251	Q213-N217 WeakPolarHBondContact O-CB 3.26Å; Q213-N217 PolarHBondContact O-N 3.44Å; Q213-N217 VanDerWaalsContact O-N 3.08Å; Q213-N217 PolarHBondContact O-ND2 3.03Å; L214-N217 WeakPolarHBondContact O-CB 3.2Å; L214-N217 PolarHBondContact O-N 2.97Å; L214-N217 VanDerWaalsContact O-N 3.1Å; L215-N217 VanDerWaalsContact C-N 3.26Å; L215-N217 PolarHBondContact O-N 3.24Å; N217-G219 VanDerWaalsContact C-N 3.27Å; N217-G219 PolarHBondContact O-N 3.04Å; N217-R251 PolarHBondContact OD1-NH2 2.75Å
218	S	92.3	Very high	93.4	Very high	39 Å²	39	48.7 Å²	48.7	27%	0.273	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	13.1	174.7	66.6	0	0	0	0	114.5	L214 L215	L214-S218 PolarHBondContact O-N 2.93Å; L214-S218 PolarHBondContact O-OG 3.02Å; L215-S218 WeakPolarHBondContact CA-OG 3.5Å; L215-S218 CarbonylContact O-C 3.57Å; L215-S218 PolarHBondContact O-N 3.43Å; L215-S218 PolarHBondContact O-OG 3.1Å
219	G	90.4	Very high	93.2	Very high	53 Å²	53	48.3 Å²	48.3	55%	0.546	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	23.2	170.9	0	0	0	0	0	115.7	L215 N217	L215-G219 PolarHBondContact O-N 3.25Å; N217-G219 VanDerWaalsContact C-N 3.27Å; N217-G219 PolarHBondContact O-N 3.04Å
220	A	94.3	Very high	93	Very high	8 Å²	8	46.8 Å²	46.8	7%	0.066	26%	0.264	C	S	.	.			trans	-60.4	136.5	177.5	0	0	0	0	0	113.2	V189 N190 L200 L215 V222	V189-A220 HydrophobicContact CG1-CB 3.73Å; N190-A220 VanDerWaalsContact OD1-CA 3.27Å; N190-A220 WeakPolarHBondContact OD1-CA 3.5Å; L200-A220 HydrophobicContact CB-CB 4.17Å; L200-A220 HydrophobicContact CD1-CB 4.46Å; L200-A220 HydrophobicContact CD2-CB 4.15Å; L200-A220 HydrophobicContact CG-CB 4.5Å; L215-A220 HydrophobicContact CB-CB 3.96Å; L215-A220 WeakPolarHBondContact O-CB 3.29Å; L215-A220 PolarHBondContact O-N 3.03Å; A220-V222 PolarHBondContact O-N 2.91Å
221	E	93	Very high	92.9	Very high	116 Å²	116	43.7 Å²	43.7	54%	0.542	24%	0.244	S	C	.	.			trans	-68.7	109.8	178.8	-83.9	165.5	-129.9	0	0	112.1	N190 A224	N190-E221 WeakPolarHBondContact ND2-CG 3.19Å; N190-E221 PolarHBondContact ND2-OE1 3.16Å; N190-E221 PolarHBondContact OD1-N 3.35Å; E221-A224 HydrophobicContact CB-CB 4.15Å; E221-A224 VanDerWaalsContact O-CB 3.27Å; E221-A224 WeakPolarHBondContact O-CB 3.46Å; E221-A224 PolarHBondContact O-N 3.39Å
222	V	92.4	Very high	92.8	Very high	28 Å²	28	43.7 Å²	43.7	17%	0.17	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-38.7	-173.3	-154.7	0	0	0	0	112.9	L216 A220 A224 L248 R251 P253	L216-V222 HydrophobicContact CD2-CB 4.5Å; L216-V222 HydrophobicContact CD2-CG1 4.26Å; L216-V222 HydrophobicContact CD2-CG2 3.77Å; A220-V222 PolarHBondContact O-N 2.91Å; V222-A224 VanDerWaalsContact C-N 3.27Å; V222-A224 PolarHBondContact O-N 3.3Å; V222-L248 HydrophobicContact CG1-CD2 3.69Å; V222-R251 HydrophobicContact CG2-CB 4.16Å; V222-P253 HydrophobicContact CB-CB 4.38Å; V222-P253 HydrophobicContact CG1-CB 3.85Å; V222-P253 HydrophobicContact CG1-CG 4.45Å
223	D	92.1	Very high	92.8	Very high	69 Å²	69	43.9 Å²	43.9	37%	0.369	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	12.8	179.6	-75.5	-16.7	0	0	0	113	V225 P253 N254	D223-V225 WeakPolarHBondContact O-CG2 3.45Å; D223-P253 WeakPolarHBondContact OD1-CB 3.2Å; D223-N254 PolarHBondContact OD1-N 2.97Å; D223-N254 WeakPolarHBondContact OD2-CB 3.22Å; D223-N254 PolarHBondContact OD2-N 2.93Å; D223-N254 VanDerWaalsContact OD2-N 3.15Å
224	A	92.2	Very high	92.7	Very high	11 Å²	11	39.2 Å²	39.2	9%	0.091	22%	0.223	C	C	.	.			trans	-55	140.8	175.9	0	0	0	0	0	111.7	T198 I201 E221 V222 T231	T198-A224 HydrophobicContact CG2-CB 3.99Å; I201-A224 HydrophobicContact CD1-CB 3.99Å; I201-A224 WeakPolarHBondContact CD1-O 3.47Å; E221-A224 HydrophobicContact CB-CB 4.15Å; E221-A224 VanDerWaalsContact O-CB 3.27Å; E221-A224 WeakPolarHBondContact O-CB 3.46Å; E221-A224 PolarHBondContact O-N 3.39Å; V222-A224 VanDerWaalsContact C-N 3.27Å; V222-A224 PolarHBondContact O-N 3.3Å; A224-T231 WeakPolarHBondContact O-CA 3.45Å
225	V	91.9	Very high	92.7	Very high	82 Å²	82	38.5 Å²	38.5	50%	0.497	22%	0.219	S	C	.	.			trans	-115.1	97.8	-168.4	-178.2	0	0	0	0	109.9	D223 S229	D223-V225 WeakPolarHBondContact O-CG2 3.45Å; V225-S229 VanDerWaalsContact CG1-CA 3.48Å
226	G	89.6	Confident	92.7	Very high	5 Å²	5	38.5 Å²	38.5	5%	0.052	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-90.5	-157.7	179	0	0	0	0	0	113.7	F195 G196 Y228 S229 S230	F195-G226 CarbonylContact O-C 3.56Å; G196-G226 WeakPolarHBondContact O-CA 3.11Å; G226-Y228 PolarHBondContact O-N 3.07Å; G226-S229 VanDerWaalsContact O-CA 3.27Å; G226-S229 WeakPolarHBondContact O-CA 3.4Å; G226-S229 PolarHBondContact O-N 2.94Å; G226-S230 PolarHBondContact N-O 2.88Å; G226-S230 PolarHBondContact O-N 3.1Å
227	M	89.3	Confident	92.8	Very high	64 Å²	64	38 Å²	38	32%	0.315	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-45.6	135.1	-176.5	-160.4	-170.2	-158.2	0	0	113.1	F195 S229 S230	F195-M227 HydrophobicContact CB-CB 3.92Å; F195-M227 HydrophobicContact CB-CG 4.04Å; F195-M227 HydrophobicContact CD1-CE 3.88Å; F195-M227 HydrophobicContact CD1-CG 4.47Å; F195-M227 HydrophobicContact CE1-CE 4.1Å; F195-M227 HydrophobicContact CG-CE 4.41Å; F195-M227 HydrophobicContact CG-CG 4.42Å; F195-M227 PolarHBondContact O-N 3.19Å; F195-M227 VanDerWaalsContact O-N 3.15Å; M227-S229 PolarHBondContact O-N 3.33Å; M227-S230 VanDerWaalsContact O-CB 3.31Å; M227-S230 WeakPolarHBondContact O-CB 3.33Å; M227-S230 PolarHBondContact O-N 2.98Å; M227-S230 VanDerWaalsContact O-N 3.14Å; M227-S230 PolarHBondContact O-OG 3.3Å
228	Y	88.8	Confident	92.8	Very high	130 Å²	130	40.1 Å²	40.1	51%	0.51	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	59.9	24	-178.1	-52.3	-51.4	0	0	0	115.1	G226 S230 Q260	G226-Y228 PolarHBondContact O-N 3.07Å; Y228-S230 VanDerWaalsContact C-N 3.31Å; Y228-Q260 WeakPolarHBondContact O-CB 3.19Å; Y228-Q260 PolarHBondContact O-N 2.98Å; Y228-Q260 VanDerWaalsContact O-N 3.12Å
229	S	90.7	Very high	92.7	Very high	40 Å²	40	39.8 Å²	39.8	28%	0.28	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	53.8	42.6	-169.8	77.5	0	0	0	0	113.9	V225 G226 M227 Q260	V225-S229 VanDerWaalsContact CG1-CA 3.48Å; G226-S229 VanDerWaalsContact O-CA 3.27Å; G226-S229 WeakPolarHBondContact O-CA 3.4Å; G226-S229 PolarHBondContact O-N 2.94Å; M227-S229 PolarHBondContact O-N 3.33Å; S229-Q260 PolarHBondContact OG-N 3.34Å; S229-Q260 VanDerWaalsContact OG-N 3.08Å
230	S	91.9	Very high	93	Very high	12 Å²	12	40.4 Å²	40.4	8%	0.084	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-89	130	176	-47.2	0	0	0	0	110.9	G226 M227 Y228	G226-S230 PolarHBondContact N-O 2.88Å; G226-S230 PolarHBondContact O-N 3.1Å; M227-S230 VanDerWaalsContact O-CB 3.31Å; M227-S230 WeakPolarHBondContact O-CB 3.33Å; M227-S230 PolarHBondContact O-N 2.98Å; M227-S230 VanDerWaalsContact O-N 3.14Å; M227-S230 PolarHBondContact O-OG 3.3Å; Y228-S230 VanDerWaalsContact C-N 3.31Å
231	T	93.9	Very high	93.1	Very high	4 Å²	4	43.1 Å²	43.1	3%	0.025	22%	0.221	C	C	.	.			trans	-86.6	166.2	170.1	64.4	0	0	0	0	111.9	A224 L233 M234 L235 V257	A224-T231 WeakPolarHBondContact O-CA 3.45Å; T231-L233 PolarHBondContact O-N 3.18Å; T231-M234 PolarHBondContact O-N 3.38Å; T231-M234 VanDerWaalsContact O-N 3.12Å; T231-M234 PolarHBondContact OG1-N 3.48Å; T231-L235 PolarHBondContact O-N 3Å; T231-V257 HydrophobicContact CG2-CB 4.26Å; T231-V257 HydrophobicContact CG2-CG1 3.85Å
232	A	95	Very high	93.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-54.2	-40.7	173.2	0	0	0	0	0	111.8	L200 I201 A204 L235 A236 L248	L200-A232 HydrophobicContact CD2-CB 4.14Å; L200-A232 HydrophobicContact CG-CB 4.04Å; I201-A232 HydrophobicContact CG1-CB 4.13Å; A204-A232 HydrophobicContact CB-CB 3.93Å; A204-A232 WeakPolarHBondContact CB-O 3.35Å; A232-L235 PolarHBondContact O-N 2.95Å; A232-A236 WeakPolarHBondContact O-CB 3.33Å; A232-A236 PolarHBondContact O-N 3.12Å; A232-L248 HydrophobicContact CB-CD1 4.36Å; A232-L248 HydrophobicContact CB-CD2 4.32Å
233	L	95.8	Very high	93.3	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-59.9	-46.2	175.8	-173.9	65.6	0	0	0	112.2	T231 L235 A236 T237 V245 L248 L249 P253 V255 A265 L281	T231-L233 PolarHBondContact O-N 3.18Å; L233-L235 VanDerWaalsContact C-N 3.32Å; L233-L235 PolarHBondContact O-N 3.4Å; L233-A236 PolarHBondContact O-N 3.28Å; L233-T237 WeakPolarHBondContact O-CG2 3.35Å; L233-T237 PolarHBondContact O-N 2.62Å; L233-T237 PolarHBondContact O-OG1 3.46Å; L233-V245 HydrophobicContact CD1-CG1 4.02Å; L233-L248 HydrophobicContact CD1-CB 4.21Å; L233-L248 HydrophobicContact CD1-CD1 4.42Å; L233-L249 HydrophobicContact CD1-CD2 4.23Å; L233-L249 HydrophobicContact CD1-CG 4.24Å; L233-L249 HydrophobicContact CD2-CD2 4.2Å; L233-P253 HydrophobicContact CD2-CG 4.39Å; L233-V255 HydrophobicContact CD2-CG1 4.31Å; L233-A265 HydrophobicContact CD2-CB 4.09Å; L233-A265 HydrophobicContact CG-CB 4.15Å; L233-L281 HydrophobicContact CD1-CD2 4.44Å; L233-L281 HydrophobicContact CD2-CD2 4.15Å
234	M	94.7	Very high	93.5	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-62.9	-35.9	178.7	-69.1	175.4	-177.9	0	0	113.3	T231 T237 R238 V257 D259 A265 M268	T231-M234 PolarHBondContact O-N 3.38Å; T231-M234 VanDerWaalsContact O-N 3.12Å; T231-M234 PolarHBondContact OG1-N 3.48Å; M234-T237 PolarHBondContact O-OG1 3.35Å; M234-T237 VanDerWaalsContact O-OG1 3.1Å; M234-R238 VanDerWaalsContact O-CB 3.23Å; M234-R238 WeakPolarHBondContact O-CB 3.36Å; M234-R238 PolarHBondContact O-N 3.22Å; M234-V257 VanDerWaalsContact CE-C 3.42Å; M234-V257 HydrophobicContact CE-CB 4.19Å; M234-V257 HydrophobicContact CE-CG1 3.89Å; M234-V257 WeakPolarHBondContact CE-O 3.46Å; M234-D259 HydrophobicContact CE-CB 4.49Å; M234-D259 HydrophobicContact SD-CB 4.09Å; M234-A265 HydrophobicContact CG-CB 4.49Å; M234-M268 HydrophobicContact CB-CE 4.14Å; M234-M268 HydrophobicContact CB-SD 4.09Å; M234-M268 HydrophobicContact CG-CE 4.04Å; M234-M268 HydrophobicContact CG-SD 4.39Å; M234-M268 HydrophobicContact SD-CE 3.82Å
235	L	94.3	Very high	93.7	Very high	24 Å²	24	41 Å²	41	13%	0.126	21%	0.206	C	C	.	.	H	α-helix	trans	-76.9	-34.4	178.3	-60.2	-173.4	0	0	0	111.8	I201 R205 T231 A232 L233 G239	I201-L235 HydrophobicContact CG2-CD1 3.44Å; I201-L235 VanDerWaalsContact CG2-CD1 3.44Å; R205-L235 HydrophobicContact CB-CB 4.01Å; R205-L235 HydrophobicContact CB-CD1 3.86Å; R205-L235 HydrophobicContact CG-CB 4.46Å; R205-L235 HydrophobicContact CG-CD1 4.1Å; T231-L235 PolarHBondContact O-N 3Å; A232-L235 PolarHBondContact O-N 2.95Å; L233-L235 VanDerWaalsContact C-N 3.32Å; L233-L235 PolarHBondContact O-N 3.4Å; L235-G239 PolarHBondContact O-N 3.47Å
236	A	95.8	Very high	93.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.8	-44.2	171.3	0	0	0	0	0	112.2	A204 A232 L233 G239 N240 F241 V244 V245 L248	A204-A236 HydrophobicContact CB-CB 4.33Å; A232-A236 WeakPolarHBondContact O-CB 3.33Å; A232-A236 PolarHBondContact O-N 3.12Å; L233-A236 PolarHBondContact O-N 3.28Å; A236-G239 PolarHBondContact O-N 3.34Å; A236-N240 PolarHBondContact O-N 3.31Å; A236-F241 PolarHBondContact O-N 2.94Å; A236-V244 HydrophobicContact CB-CB 4.38Å; A236-V244 HydrophobicContact CB-CG1 3.8Å; A236-V245 HydrophobicContact CB-CG2 3.72Å; A236-L248 HydrophobicContact CB-CD1 3.94Å
237	T	95.9	Very high	94.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-67.4	-42.3	176.9	61.2	0	0	0	0	111.8	L233 M234 G239 N240 V245 A265 Y274 I277 L281	L233-T237 WeakPolarHBondContact O-CG2 3.35Å; L233-T237 PolarHBondContact O-N 2.62Å; L233-T237 PolarHBondContact O-OG1 3.46Å; M234-T237 PolarHBondContact O-OG1 3.35Å; M234-T237 VanDerWaalsContact O-OG1 3.1Å; T237-G239 VanDerWaalsContact C-N 3.26Å; T237-G239 PolarHBondContact O-N 3Å; T237-N240 PolarHBondContact O-N 2.83Å; T237-V245 HydrophobicContact CG2-CG1 4.16Å; T237-V245 HydrophobicContact CG2-CG2 3.67Å; T237-A265 HydrophobicContact CG2-CB 4.29Å; T237-Y274 VanDerWaalsContact O-CD2 3.26Å; T237-Y274 WeakPolarHBondContact O-CD2 3.31Å; T237-Y274 WeakPolarHBondContact O-CE2 3.13Å; T237-I277 HydrophobicContact CG2-CG2 3.59Å; T237-L281 HydrophobicContact CG2-CD1 4.11Å
238	R	93.8	Very high	94.4	Very high	150 Å²	150	39.8 Å²	39.8	57%	0.566	19%	0.194	S	C	*	.	H	α-helix	trans	-61.3	-33.4	175.9	-173.3	174.5	-179.4	174.2	-0.4	113	M234 N240 Y274	M234-R238 VanDerWaalsContact O-CB 3.23Å; M234-R238 WeakPolarHBondContact O-CB 3.36Å; M234-R238 PolarHBondContact O-N 3.22Å; R238-N240 VanDerWaalsContact C-N 3.32Å; R238-Y274 PolarHBondContact O-OH 2.99Å
239	G	91.6	Very high	94.7	Very high	32 Å²	32	34.5 Å²	34.5	33%	0.33	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-2.9	173.6	0	0	0	0	0	115.4	L235 A236 T237 F241	L235-G239 PolarHBondContact O-N 3.47Å; A236-G239 PolarHBondContact O-N 3.34Å; T237-G239 VanDerWaalsContact C-N 3.26Å; T237-G239 PolarHBondContact O-N 3Å; G239-F241 VanDerWaalsContact C-N 3.27Å; G239-F241 PolarHBondContact O-N 2.86Å
240	N	95.2	Very high	94.8	Very high	66 Å²	66	37.4 Å²	37.4	35%	0.353	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	33.6	-172.7	-162.7	34	0	0	0	114.4	A236 T237 R238 I242 Y274 I277	A236-N240 PolarHBondContact O-N 3.31Å; T237-N240 PolarHBondContact O-N 2.83Å; R238-N240 VanDerWaalsContact C-N 3.32Å; N240-I242 VanDerWaalsContact C-N 3.34Å; N240-I242 PolarHBondContact O-N 3.1Å; N240-Y274 HydrophobicContact CB-CD1 4.02Å; N240-Y274 HydrophobicContact CB-CD2 4.22Å; N240-Y274 HydrophobicContact CB-CE1 3.79Å; N240-Y274 HydrophobicContact CB-CE2 3.99Å; N240-Y274 HydrophobicContact CB-CG 4.23Å; N240-I277 WeakPolarHBondContact OD1-CD1 3.17Å
241	F	96.3	Very high	94.8	Very high	66 Å²	66	42.5 Å²	42.5	29%	0.289	21%	0.208	S	C	.	.			trans	-85.6	72.9	-177.8	-60	-57.4	0	0	0	111.4	A204 K206 G207 A236 G239 Q243 V244 V245	A204-F241 WeakPolarHBondContact O-CD2 3.21Å; K206-F241 VanDerWaalsContact C-CE2 3.5Å; K206-F241 VanDerWaalsContact C-CZ 3.48Å; K206-F241 WeakPolarHBondContact O-CZ 3.42Å; G207-F241 VanDerWaalsContact CA-CD2 3.48Å; G207-F241 VanDerWaalsContact CA-CG 3.43Å; G207-F241 VanDerWaalsContact N-CE2 3.31Å; A236-F241 PolarHBondContact O-N 2.94Å; G239-F241 VanDerWaalsContact C-N 3.27Å; G239-F241 PolarHBondContact O-N 2.86Å; F241-Q243 PolarHBondContact O-N 3.14Å; F241-V244 HydrophobicContact CB-CB 3.9Å; F241-V244 HydrophobicContact CB-CG2 4.09Å; F241-V244 WeakPolarHBondContact O-CA 3.27Å; F241-V244 WeakPolarHBondContact O-CB 3.44Å; F241-V244 PolarHBondContact O-N 3.4Å; F241-V245 PolarHBondContact O-N 2.71Å
242	I	95.3	Very high	94.6	Very high	48 Å²	48	51 Å²	51	25%	0.246	25%	0.247	C	C	.	.	H	α-helix	trans	-45.9	-54.8	-172.9	-57.4	170.1	0	0	0	112.3	N240 V244 V245 E246 D276 I277	N240-I242 VanDerWaalsContact C-N 3.34Å; N240-I242 PolarHBondContact O-N 3.1Å; I242-V244 VanDerWaalsContact C-N 3.26Å; I242-V244 PolarHBondContact O-N 3.45Å; I242-V245 WeakPolarHBondContact O-CA 3.36Å; I242-V245 WeakPolarHBondContact O-CB 3.42Å; I242-V245 PolarHBondContact O-N 3.37Å; I242-E246 HydrophobicContact CG2-CG 4.35Å; I242-E246 WeakPolarHBondContact O-CG 3.36Å; I242-E246 PolarHBondContact O-N 3.1Å; I242-D276 HydrophobicContact CD1-CB 4.22Å; I242-D276 WeakPolarHBondContact CD1-OD2 3.18Å; I242-I277 HydrophobicContact CG1-CD1 4.21Å; I242-I277 HydrophobicContact CG1-CG1 4.01Å
243	Q	95.9	Very high	94.4	Very high	127 Å²	127	51.5 Å²	51.5	59%	0.593	25%	0.251	S	S	*	.	H	α-helix	trans	-61.6	-31.2	-179.2	-67.1	175.5	-14.6	0	0	113.5	L209 F241 L247	L209-Q243 HydrophobicContact CD1-CB 4.06Å; L209-Q243 WeakPolarHBondContact CD1-O 3.34Å; L209-Q243 HydrophobicContact CD2-CB 4.05Å; F241-Q243 PolarHBondContact O-N 3.14Å; Q243-L247 WeakPolarHBondContact O-CB 3.38Å; Q243-L247 PolarHBondContact O-N 3.49Å
244	V	96.3	Very high	94.3	Very high	3 Å²	3	55.2 Å²	55.2	2%	0.018	27%	0.27	C	S	.	.	H	α-helix	trans	-76	-37.5	175.8	175.6	0	0	0	0	110.5	A204 L209 V212 A236 F241 I242 L248	A204-V244 HydrophobicContact CB-CG1 4.31Å; L209-V244 HydrophobicContact CB-CG2 4.13Å; L209-V244 HydrophobicContact CD1-CG2 3.84Å; V212-V244 HydrophobicContact CG1-CG1 4.25Å; V212-V244 HydrophobicContact CG2-CG1 4.03Å; A236-V244 HydrophobicContact CB-CB 4.38Å; A236-V244 HydrophobicContact CB-CG1 3.8Å; F241-V244 HydrophobicContact CB-CB 3.9Å; F241-V244 HydrophobicContact CB-CG2 4.09Å; F241-V244 WeakPolarHBondContact O-CA 3.27Å; F241-V244 WeakPolarHBondContact O-CB 3.44Å; F241-V244 PolarHBondContact O-N 3.4Å; I242-V244 VanDerWaalsContact C-N 3.26Å; I242-V244 PolarHBondContact O-N 3.45Å; V244-L248 HydrophobicContact CG1-CD1 3.95Å; V244-L248 HydrophobicContact CG1-CG 4.44Å; V244-L248 VanDerWaalsContact O-CB 3.32Å; V244-L248 WeakPolarHBondContact O-CB 3.47Å; V244-L248 WeakPolarHBondContact O-CD1 3.46Å; V244-L248 WeakPolarHBondContact O-CG 3.46Å; V244-L248 PolarHBondContact O-N 3.49Å
245	V	96.2	Very high	94.2	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-63.5	-48.7	172.9	172.9	0	0	0	0	110.5	L233 A236 T237 F241 I242 L248 L249 I277	L233-V245 HydrophobicContact CD1-CG1 4.02Å; A236-V245 HydrophobicContact CB-CG2 3.72Å; T237-V245 HydrophobicContact CG2-CG1 4.16Å; T237-V245 HydrophobicContact CG2-CG2 3.67Å; F241-V245 PolarHBondContact O-N 2.71Å; I242-V245 WeakPolarHBondContact O-CA 3.36Å; I242-V245 WeakPolarHBondContact O-CB 3.42Å; I242-V245 PolarHBondContact O-N 3.37Å; V245-L248 PolarHBondContact O-N 3.15Å; V245-L249 HydrophobicContact CG1-CD1 3.85Å; V245-L249 HydrophobicContact CG1-CG 4.39Å; V245-L249 WeakPolarHBondContact O-CB 3.2Å; V245-L249 VanDerWaalsContact O-CG 3.22Å; V245-L249 WeakPolarHBondContact O-CG 3.42Å; V245-L249 PolarHBondContact O-N 3.3Å; V245-I277 HydrophobicContact CG1-CG2 4.36Å; V245-I277 HydrophobicContact CG2-CD1 4.2Å
246	E	95.5	Very high	94.1	Very high	91 Å²	91	56.3 Å²	56.3	43%	0.425	28%	0.277	S	S	.	.	H	α-helix	trans	-56.1	-51.8	174.9	-70.5	170.5	162.4	0	0	111.3	I242 L248 L249 T250	I242-E246 HydrophobicContact CG2-CG 4.35Å; I242-E246 WeakPolarHBondContact O-CG 3.36Å; I242-E246 PolarHBondContact O-N 3.1Å; E246-L248 PolarHBondContact O-N 3.13Å; E246-L249 PolarHBondContact O-N 3.49Å; E246-L249 VanDerWaalsContact O-N 3.1Å; E246-T250 WeakPolarHBondContact O-CG2 3.41Å; E246-T250 PolarHBondContact O-N 3.48Å
247	L	95	Very high	93.9	Very high	35 Å²	35	58 Å²	58	18%	0.183	29%	0.287	C	S	.	.	H	α-helix	trans	-63.8	-37.8	-179	-178.5	138.4	0	0	0	112.5	L209 V212 Q213 L216 Q243 T250	L209-L247 HydrophobicContact CD1-CB 4.14Å; L209-L247 HydrophobicContact CD1-CD1 3.93Å; L209-L247 HydrophobicContact CD1-CG 4.45Å; V212-L247 HydrophobicContact CB-CD2 4.26Å; V212-L247 HydrophobicContact CG1-CD2 3.56Å; Q213-L247 HydrophobicContact CB-CD1 4.04Å; Q213-L247 HydrophobicContact CG-CD1 4.17Å; L216-L247 HydrophobicContact CD1-CD2 3.56Å; Q243-L247 WeakPolarHBondContact O-CB 3.38Å; Q243-L247 PolarHBondContact O-N 3.49Å; L247-T250 PolarHBondContact O-N 3.36Å; L247-T250 PolarHBondContact O-OG1 3.48Å
248	L	95.4	Very high	93.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-45.2	169.8	-75	165.8	0	0	0	111.5	L200 A204 V212 L216 V222 A232 L233 A236 V244 V245 E246 T250 R251 P253	L200-L248 HydrophobicContact CD2-CD2 4.44Å; A204-L248 HydrophobicContact CB-CD1 4.43Å; V212-L248 HydrophobicContact CG1-CD2 4.31Å; V212-L248 HydrophobicContact CG1-CG 4.42Å; L216-L248 HydrophobicContact CD1-CD2 4.02Å; L216-L248 HydrophobicContact CD2-CD2 4.43Å; V222-L248 HydrophobicContact CG1-CD2 3.69Å; A232-L248 HydrophobicContact CB-CD1 4.36Å; A232-L248 HydrophobicContact CB-CD2 4.32Å; L233-L248 HydrophobicContact CD1-CB 4.21Å; L233-L248 HydrophobicContact CD1-CD1 4.42Å; A236-L248 HydrophobicContact CB-CD1 3.94Å; V244-L248 HydrophobicContact CG1-CD1 3.95Å; V244-L248 HydrophobicContact CG1-CG 4.44Å; V244-L248 VanDerWaalsContact O-CB 3.32Å; V244-L248 WeakPolarHBondContact O-CB 3.47Å; V244-L248 WeakPolarHBondContact O-CD1 3.46Å; V244-L248 WeakPolarHBondContact O-CG 3.46Å; V244-L248 PolarHBondContact O-N 3.49Å; V245-L248 PolarHBondContact O-N 3.15Å; E246-L248 PolarHBondContact O-N 3.13Å; L248-T250 VanDerWaalsContact C-N 3.25Å; L248-T250 PolarHBondContact O-N 3.33Å; L248-R251 PolarHBondContact O-N 3.36Å; L248-P253 WeakPolarHBondContact O-CD 3.39Å
249	L	94.6	Very high	93.6	Very high	19 Å²	19	53.3 Å²	53.3	10%	0.099	28%	0.279	C	S	.	.	H	α-helix	trans	-63.4	-26.5	179.7	-71	172.2	0	0	0	113.1	L233 V245 E246 R251 E252 P253 V255 L281	L233-L249 HydrophobicContact CD1-CD2 4.23Å; L233-L249 HydrophobicContact CD1-CG 4.24Å; L233-L249 HydrophobicContact CD2-CD2 4.2Å; V245-L249 HydrophobicContact CG1-CD1 3.85Å; V245-L249 HydrophobicContact CG1-CG 4.39Å; V245-L249 WeakPolarHBondContact O-CB 3.2Å; V245-L249 VanDerWaalsContact O-CG 3.22Å; V245-L249 WeakPolarHBondContact O-CG 3.42Å; V245-L249 PolarHBondContact O-N 3.3Å; E246-L249 PolarHBondContact O-N 3.49Å; E246-L249 VanDerWaalsContact O-N 3.1Å; L249-R251 PolarHBondContact O-N 2.78Å; L249-R251 VanDerWaalsContact O-N 3.13Å; L249-E252 PolarHBondContact O-N 3.22Å; L249-P253 HydrophobicContact CD2-CG 4.16Å; L249-V255 HydrophobicContact CD2-CG2 3.74Å; L249-L281 HydrophobicContact CD1-CD2 4.26Å; L249-L281 HydrophobicContact CD2-CD2 4.27Å
250	T	93.2	Very high	93.6	Very high	101 Å²	101	55.9 Å²	55.9	62%	0.62	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-11.4	172	69.3	0	0	0	0	114.8	E246 L247 L248	E246-T250 WeakPolarHBondContact O-CG2 3.41Å; E246-T250 PolarHBondContact O-N 3.48Å; L247-T250 PolarHBondContact O-N 3.36Å; L247-T250 PolarHBondContact O-OG1 3.48Å; L248-T250 VanDerWaalsContact C-N 3.25Å; L248-T250 PolarHBondContact O-N 3.33Å
251	R	90.7	Very high	93.3	Very high	118 Å²	118	55.2 Å²	55.2	45%	0.445	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	16.2	177.7	-58.7	-56.2	-168.4	134.3	5.4	113.6	L216 N217 V222 L248 L249 P253	L216-R251 HydrophobicContact CD1-CG 4.06Å; L216-R251 PolarHBondContact O-NH2 3.2Å; N217-R251 PolarHBondContact OD1-NH2 2.75Å; V222-R251 HydrophobicContact CG2-CB 4.16Å; L248-R251 PolarHBondContact O-N 3.36Å; L249-R251 PolarHBondContact O-N 2.78Å; L249-R251 VanDerWaalsContact O-N 3.13Å; R251-P253 VanDerWaalsContact C-CD 3.47Å
252	E	90.4	Very high	93	Very high	184 Å²	184	52.9 Å²	52.9	86%	0.86	27%	0.273	S	S	*	.			trans	50.2	47.5	178.6	-56.9	-172.2	161.8	0	0	115.1	L249	L249-E252 PolarHBondContact O-N 3.22Å
253	P	91.7	Very high	92.8	Very high	10 Å²	10	51 Å²	51	7%	0.065	26%	0.263	C	S	.	.			trans	-66.8	160.2	177.8	31.3	-36.8	0	0	0	111.7	V222 D223 L233 L248 L249 R251 V255	V222-P253 HydrophobicContact CB-CB 4.38Å; V222-P253 HydrophobicContact CG1-CB 3.85Å; V222-P253 HydrophobicContact CG1-CG 4.45Å; D223-P253 WeakPolarHBondContact OD1-CB 3.2Å; L233-P253 HydrophobicContact CD2-CG 4.39Å; L248-P253 WeakPolarHBondContact O-CD 3.39Å; L249-P253 HydrophobicContact CD2-CG 4.16Å; R251-P253 VanDerWaalsContact C-CD 3.47Å; P253-V255 VanDerWaalsContact C-N 3.3Å; P253-V255 WeakPolarHBondContact O-CG2 3.4Å; P253-V255 PolarHBondContact O-N 2.98Å
254	N	92.2	Very high	92.6	Very high	83 Å²	83	45 Å²	45	44%	0.444	24%	0.235	S	C	.	.			trans	-73.8	83.4	175.5	-172.4	-4	0	0	0	111.5	D223 N256 V257	D223-N254 PolarHBondContact OD1-N 2.97Å; D223-N254 WeakPolarHBondContact OD2-CB 3.22Å; D223-N254 PolarHBondContact OD2-N 2.93Å; D223-N254 VanDerWaalsContact OD2-N 3.15Å; N254-N256 PolarHBondContact O-N 3.39Å; N254-N256 PolarHBondContact OD1-N 2.83Å; N254-V257 HydrophobicContact CB-CG2 3.85Å; N254-V257 WeakPolarHBondContact O-CG2 3.22Å; N254-V257 PolarHBondContact O-N 3.38Å; N254-V257 VanDerWaalsContact O-N 3.1Å
255	V	92.6	Very high	92.5	Very high	11 Å²	11	45 Å²	45	7%	0.067	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-22.3	179.8	-164.9	0	0	0	0	113.4	L233 L249 P253 L281 A286	L233-V255 HydrophobicContact CD2-CG1 4.31Å; L249-V255 HydrophobicContact CD2-CG2 3.74Å; P253-V255 VanDerWaalsContact C-N 3.3Å; P253-V255 WeakPolarHBondContact O-CG2 3.4Å; P253-V255 PolarHBondContact O-N 2.98Å; V255-L281 HydrophobicContact CG1-CB 4.42Å; V255-L281 HydrophobicContact CG1-CD2 3.57Å; V255-A286 HydrophobicContact CG1-CB 3.82Å
256	N	92.1	Very high	92.5	Very high	38 Å²	38	45 Å²	45	20%	0.203	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	7.6	-174	-65.3	-61.8	0	0	0	114.3	N254 G285 F287	N254-N256 PolarHBondContact O-N 3.39Å; N254-N256 PolarHBondContact OD1-N 2.83Å; N256-G285 PolarHBondContact ND2-O 2.75Å; N256-F287 HydrophobicContact CB-CD2 3.86Å; N256-F287 HydrophobicContact CB-CE2 4.13Å; N256-F287 VanDerWaalsContact OD1-CD2 3.25Å; N256-F287 WeakPolarHBondContact OD1-CD2 3.43Å; N256-F287 PolarHBondContact OD1-N 3.08Å
257	V	92.2	Very high	92.4	Very high	35 Å²	35	40.7 Å²	40.7	21%	0.212	22%	0.215	C	C	.	.			trans	-61.1	143.4	165.8	177.6	0	0	0	0	109.7	T231 M234 N254 T264	T231-V257 HydrophobicContact CG2-CB 4.26Å; T231-V257 HydrophobicContact CG2-CG1 3.85Å; M234-V257 VanDerWaalsContact CE-C 3.42Å; M234-V257 HydrophobicContact CE-CB 4.19Å; M234-V257 HydrophobicContact CE-CG1 3.89Å; M234-V257 WeakPolarHBondContact CE-O 3.46Å; N254-V257 HydrophobicContact CB-CG2 3.85Å; N254-V257 WeakPolarHBondContact O-CG2 3.22Å; N254-V257 PolarHBondContact O-N 3.38Å; N254-V257 VanDerWaalsContact O-N 3.1Å; V257-T264 WeakPolarHBondContact O-CA 3.09Å; V257-T264 WeakPolarHBondContact O-CG2 3.49Å
258	A	91.8	Very high	92.3	Very high	39 Å²	39	39.4 Å²	39.4	32%	0.322	21%	0.209	S	C	.	.	B	Isolated β-bridge	trans	-122.2	144.1	-179.7	0	0	0	0	0	111.5	L263 T264	A258-L263 WeakPolarHBondContact CA-O 3.34Å; A258-T264 HydrophobicContact CB-CG2 4.09Å
259	D	91.3	Very high	92.3	Very high	13 Å²	13	39.4 Å²	39.4	7%	0.07	21%	0.209	C	C	.	.			trans	-72.6	-178.7	-179.6	83	-15.9	0	0	0	112.9	M234 N261 G262 L263 M268	M234-D259 HydrophobicContact CE-CB 4.49Å; M234-D259 HydrophobicContact SD-CB 4.09Å; D259-N261 PolarHBondContact O-N 3Å; D259-N261 VanDerWaalsContact OD1-CA 3.22Å; D259-N261 WeakPolarHBondContact OD1-CA 3.46Å; D259-N261 WeakPolarHBondContact OD1-CB 3.41Å; D259-N261 PolarHBondContact OD1-N 3.5Å; D259-N261 PolarHBondContact OD2-ND2 3.46Å; D259-G262 PolarHBondContact O-N 3.2Å; D259-G262 PolarHBondContact OD1-N 3.3Å; D259-L263 PolarHBondContact N-O 3.13Å; D259-L263 WeakPolarHBondContact OD1-CB 3.5Å; D259-L263 PolarHBondContact OD1-N 3.22Å; D259-M268 HydrophobicContact CB-CE 3.81Å
260	Q	91.2	Very high	92.3	Very high	86 Å²	86	38.5 Å²	38.5	40%	0.402	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-18.7	175.7	69.6	176.3	0.7	0	0	114.6	Y228 S229 R293	Y228-Q260 WeakPolarHBondContact O-CB 3.19Å; Y228-Q260 PolarHBondContact O-N 2.98Å; Y228-Q260 VanDerWaalsContact O-N 3.12Å; S229-Q260 PolarHBondContact OG-N 3.34Å; S229-Q260 VanDerWaalsContact OG-N 3.08Å; Q260-R293 WeakPolarHBondContact O-CD 3.26Å; Q260-R293 PolarHBondContact O-NE 3.47Å; Q260-R293 PolarHBondContact O-NH1 3.26Å; Q260-R293 PolarHBondContact O-NH2 3.31Å
261	N	89.8	Confident	92.2	Very high	52 Å²	52	37.7 Å²	37.7	28%	0.278	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-9.2	177.1	-51.1	-74.3	0	0	0	112.7	D259 L263 R293 F294	D259-N261 PolarHBondContact O-N 3Å; D259-N261 VanDerWaalsContact OD1-CA 3.22Å; D259-N261 WeakPolarHBondContact OD1-CA 3.46Å; D259-N261 WeakPolarHBondContact OD1-CB 3.41Å; D259-N261 PolarHBondContact OD1-N 3.5Å; D259-N261 PolarHBondContact OD2-ND2 3.46Å; N261-L263 HydrophobicContact CB-CD1 4.23Å; N261-R293 VanDerWaalsContact O-CB 3.28Å; N261-R293 WeakPolarHBondContact O-CB 3.24Å; N261-R293 VanDerWaalsContact O-CG 3.26Å; N261-R293 WeakPolarHBondContact O-CG 3.45Å; N261-R293 PolarHBondContact O-N 2.92Å; N261-F294 HydrophobicContact CB-CE2 4.15Å
262	G	89.3	Confident	92.3	Very high	16 Å²	16	34.9 Å²	34.9	17%	0.165	18%	0.183	C	C	.	.	S	Bend	trans	87.5	9.9	-172.7	0	0	0	0	0	114.8	D259	D259-G262 PolarHBondContact O-N 3.2Å; D259-G262 PolarHBondContact OD1-N 3.3Å
263	L	90.8	Very high	92.4	Very high	8 Å²	8	27.1 Å²	27.1	4%	0.042	15%	0.153	C	C	.	.			trans	-81.1	124.3	176	-76.3	154.4	0	0	0	110.6	A258 D259 N261 M268 R271 D292	A258-L263 WeakPolarHBondContact CA-O 3.34Å; D259-L263 PolarHBondContact N-O 3.13Å; D259-L263 WeakPolarHBondContact OD1-CB 3.5Å; D259-L263 PolarHBondContact OD1-N 3.22Å; N261-L263 HydrophobicContact CB-CD1 4.23Å; L263-M268 HydrophobicContact CB-CE 3.95Å; L263-M268 HydrophobicContact CB-CG 4.07Å; L263-R271 VanDerWaalsContact CD1-NH1 3.29Å; L263-D292 WeakPolarHBondContact CD2-OD1 3.47Å
264	T	93.3	Very high	92.6	Very high	3 Å²	3	29.5 Å²	29.5	2%	0.018	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-81.8	169.4	166.2	58	0	0	0	0	111.9	V257 A258 L266 G267 M268	V257-T264 WeakPolarHBondContact O-CA 3.09Å; V257-T264 WeakPolarHBondContact O-CG2 3.49Å; A258-T264 HydrophobicContact CB-CG2 4.09Å; T264-L266 PolarHBondContact O-N 3.07Å; T264-G267 WeakPolarHBondContact O-CA 3.26Å; T264-G267 PolarHBondContact O-N 3.07Å; T264-G267 PolarHBondContact OG1-N 3.02Å; T264-M268 WeakPolarHBondContact O-CG 3.49Å; T264-M268 PolarHBondContact O-N 2.94Å
265	A	94.3	Very high	92.7	Very high	2 Å²	2	26.7 Å²	26.7	2%	0.017	15%	0.149	C	C	.	.	H	α-helix	trans	-53.2	-38.9	172.8	0	0	0	0	0	112.6	L233 M234 T237 A269 L281	L233-A265 HydrophobicContact CD2-CB 4.09Å; L233-A265 HydrophobicContact CG-CB 4.15Å; M234-A265 HydrophobicContact CG-CB 4.49Å; T237-A265 HydrophobicContact CG2-CB 4.29Å; A265-A269 PolarHBondContact O-N 3.18Å; A265-A269 VanDerWaalsContact O-N 3.08Å; A265-L281 HydrophobicContact CB-CD1 4.25Å; A265-L281 HydrophobicContact CB-CD2 4.05Å
266	L	94.9	Very high	92.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-70.1	-39.8	174.8	-178.4	65.1	0	0	0	111.9	T264 M268 A269 A270 C278 L281 I282 A286 V288 I298	T264-L266 PolarHBondContact O-N 3.07Å; L266-M268 VanDerWaalsContact C-N 3.34Å; L266-M268 PolarHBondContact O-N 3.19Å; L266-A269 PolarHBondContact O-N 2.94Å; L266-A270 WeakPolarHBondContact O-CB 3.25Å; L266-A270 PolarHBondContact O-N 3.21Å; L266-C278 HydrophobicContact CD1-CB 4.07Å; L266-L281 HydrophobicContact CB-CD1 4.31Å; L266-L281 HydrophobicContact CD1-CB 4.19Å; L266-L281 HydrophobicContact CD1-CD1 4.4Å; L266-I282 HydrophobicContact CD1-CD1 4.2Å; L266-I282 HydrophobicContact CD1-CG1 3.94Å; L266-I282 HydrophobicContact CD2-CG1 4.06Å; L266-A286 HydrophobicContact CB-CB 4Å; L266-A286 HydrophobicContact CD2-CB 3.79Å; L266-A286 HydrophobicContact CG-CB 4.41Å; L266-V288 HydrophobicContact CD2-CG2 4.39Å; L266-I298 HydrophobicContact CB-CD1 4.37Å; L266-I298 HydrophobicContact CD2-CD1 4.04Å; L266-I298 HydrophobicContact CD2-CG2 4.23Å; L266-I298 HydrophobicContact CG-CD1 4.24Å; L266-I298 HydrophobicContact CG-CG2 4.01Å
267	G	93.1	Very high	93	Very high	1 Å²	1	29 Å²	29	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-59	-42.3	173.8	0	0	0	0	0	112.9	T264 R271	T264-G267 WeakPolarHBondContact O-CA 3.26Å; T264-G267 PolarHBondContact O-N 3.07Å; T264-G267 PolarHBondContact OG1-N 3.02Å; G267-R271 VanDerWaalsContact O-CB 3.25Å; G267-R271 WeakPolarHBondContact O-CB 3.39Å; G267-R271 PolarHBondContact O-N 3.08Å; G267-R271 VanDerWaalsContact O-N 3.08Å
268	M	93.5	Very high	93.2	Very high	9 Å²	9	27.4 Å²	27.4	4%	0.044	15%	0.151	C	C	.	.	H	α-helix	trans	-65.2	-51.7	175.1	-62.4	-172.4	-165.2	0	0	111.8	M234 D259 L263 T264 L266 A270 R271 D272	M234-M268 HydrophobicContact CB-CE 4.14Å; M234-M268 HydrophobicContact CB-SD 4.09Å; M234-M268 HydrophobicContact CG-CE 4.04Å; M234-M268 HydrophobicContact CG-SD 4.39Å; M234-M268 HydrophobicContact SD-CE 3.82Å; D259-M268 HydrophobicContact CB-CE 3.81Å; L263-M268 HydrophobicContact CB-CE 3.95Å; L263-M268 HydrophobicContact CB-CG 4.07Å; T264-M268 WeakPolarHBondContact O-CG 3.49Å; T264-M268 PolarHBondContact O-N 2.94Å; L266-M268 VanDerWaalsContact C-N 3.34Å; L266-M268 PolarHBondContact O-N 3.19Å; M268-A270 VanDerWaalsContact C-N 3.32Å; M268-A270 PolarHBondContact O-N 3.06Å; M268-R271 PolarHBondContact O-N 3.31Å; M268-D272 WeakPolarHBondContact O-CB 3.47Å; M268-D272 PolarHBondContact O-N 3.29Å
269	A	95.1	Very high	93.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.5	-40.7	179.5	0	0	0	0	0	112.6	A265 L266 G273 Y274 I277 L281	A265-A269 PolarHBondContact O-N 3.18Å; A265-A269 VanDerWaalsContact O-N 3.08Å; L266-A269 PolarHBondContact O-N 2.94Å; A269-G273 PolarHBondContact O-N 3.22Å; A269-Y274 PolarHBondContact O-N 2.74Å; A269-I277 HydrophobicContact CB-CB 4.35Å; A269-I277 HydrophobicContact CB-CG2 3.62Å; A269-L281 HydrophobicContact CB-CD1 4.12Å
270	A	94.4	Very high	93.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-68.3	-37	178	0	0	0	0	0	113.1	L266 M268 C278 I298 A302 S305 I310 I314	L266-A270 WeakPolarHBondContact O-CB 3.25Å; L266-A270 PolarHBondContact O-N 3.21Å; M268-A270 VanDerWaalsContact C-N 3.32Å; M268-A270 PolarHBondContact O-N 3.06Å; A270-C278 PolarHBondContact N-SG 2.91Å; A270-I298 HydrophobicContact CB-CG2 3.84Å; A270-A302 HydrophobicContact CB-CB 4.26Å; A270-A302 WeakPolarHBondContact O-CA 3.24Å; A270-S305 VanDerWaalsContact O-CB 3.26Å; A270-S305 WeakPolarHBondContact O-CB 2.98Å; A270-S305 PolarHBondContact O-OG 3.5Å; A270-I310 HydrophobicContact CB-CG2 4.09Å; A270-I314 HydrophobicContact CB-CD1 4.26Å
271	R	92.5	Very high	93.6	Very high	83 Å²	83	27.1 Å²	27.1	31%	0.313	15%	0.146	S	C	.	.	H	α-helix	trans	-70.8	-38.5	176.9	-172.5	-163.8	69.4	-154.9	-10.1	112.5	L263 G267 M268 S305	L263-R271 VanDerWaalsContact CD1-NH1 3.29Å; G267-R271 VanDerWaalsContact O-CB 3.25Å; G267-R271 WeakPolarHBondContact O-CB 3.39Å; G267-R271 PolarHBondContact O-N 3.08Å; G267-R271 VanDerWaalsContact O-N 3.08Å; M268-R271 PolarHBondContact O-N 3.31Å; R271-S305 VanDerWaalsContact O-CB 3.24Å; R271-S305 WeakPolarHBondContact O-CB 3.47Å
272	D	92.2	Very high	93.8	Very high	59 Å²	59	25.3 Å²	25.3	32%	0.316	14%	0.136	S	C	.	.	H	α-helix	trans	-93	-16.8	-173.8	-61.7	-11.8	0	0	0	112.2	M268 Y274	M268-D272 WeakPolarHBondContact O-CB 3.47Å; M268-D272 PolarHBondContact O-N 3.29Å; D272-Y274 HydrophobicContact CB-CD2 4.27Å; D272-Y274 HydrophobicContact CB-CE2 3.75Å
273	G	93	Very high	94	Very high	21 Å²	21	29.3 Å²	29.3	22%	0.216	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	107.6	11.7	163.3	0	0	0	0	0	116.2	A269 A275 N307 I310	A269-G273 PolarHBondContact O-N 3.22Å; G273-A275 PolarHBondContact O-N 2.87Å; G273-N307 PolarHBondContact O-ND2 3.46Å; G273-I310 WeakPolarHBondContact O-CD1 3.23Å
274	Y	95.5	Very high	94.1	Very high	61 Å²	61	31.6 Å²	31.6	24%	0.239	17%	0.171	C	C	.	.			trans	-83	95.8	-171.1	-49.3	-40.8	0	0	0	112.5	T237 R238 N240 A269 D272 I277 C278	T237-Y274 VanDerWaalsContact O-CD2 3.26Å; T237-Y274 WeakPolarHBondContact O-CD2 3.31Å; T237-Y274 WeakPolarHBondContact O-CE2 3.13Å; R238-Y274 PolarHBondContact O-OH 2.99Å; N240-Y274 HydrophobicContact CB-CD1 4.02Å; N240-Y274 HydrophobicContact CB-CD2 4.22Å; N240-Y274 HydrophobicContact CB-CE1 3.79Å; N240-Y274 HydrophobicContact CB-CE2 3.99Å; N240-Y274 HydrophobicContact CB-CG 4.23Å; A269-Y274 PolarHBondContact O-N 2.74Å; D272-Y274 HydrophobicContact CB-CD2 4.27Å; D272-Y274 HydrophobicContact CB-CE2 3.75Å; Y274-I277 HydrophobicContact CD2-CD1 4.38Å; Y274-I277 HydrophobicContact CG-CD1 4.5Å; Y274-C278 PolarHBondContact O-N 3.13Å; Y274-C278 PolarHBondContact O-SG 3.46Å
275	A	94.2	Very high	93.9	Very high	23 Å²	23	33.5 Å²	33.5	19%	0.19	19%	0.191	C	C	.	.	H	α-helix	trans	-64.8	-51.8	-172.1	0	0	0	0	0	113.3	G273 I277 C278 E279 I310 M313	G273-A275 PolarHBondContact O-N 2.87Å; A275-I277 PolarHBondContact O-N 3.36Å; A275-C278 CarbonylContact O-C 3.56Å; A275-C278 WeakPolarHBondContact O-CA 3.41Å; A275-C278 WeakPolarHBondContact O-CB 3.41Å; A275-C278 PolarHBondContact O-N 2.79Å; A275-E279 PolarHBondContact O-N 3.04Å; A275-I310 HydrophobicContact CB-CD1 4.41Å; A275-I310 HydrophobicContact CB-CG1 4.03Å; A275-M313 HydrophobicContact CB-CE 4.24Å
276	D	95.1	Very high	93.9	Very high	97 Å²	97	33.9 Å²	33.9	52%	0.519	19%	0.194	S	C	.	.	H	α-helix	trans	-60.2	-38.5	-176.1	-37.3	-20.6	0	0	0	110.9	I242 E279 S280	I242-D276 HydrophobicContact CD1-CB 4.22Å; I242-D276 WeakPolarHBondContact CD1-OD2 3.18Å; D276-E279 PolarHBondContact O-N 2.88Å; D276-S280 PolarHBondContact O-N 3.3Å; D276-S280 PolarHBondContact O-OG 2.86Å
277	I	95.8	Very high	93.7	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-67.2	-42.9	173.6	-67.9	-178.1	0	0	0	111.4	T237 N240 I242 V245 A269 Y274 A275 E279 S280 L281	T237-I277 HydrophobicContact CG2-CG2 3.59Å; N240-I277 WeakPolarHBondContact OD1-CD1 3.17Å; I242-I277 HydrophobicContact CG1-CD1 4.21Å; I242-I277 HydrophobicContact CG1-CG1 4.01Å; V245-I277 HydrophobicContact CG1-CG2 4.36Å; V245-I277 HydrophobicContact CG2-CD1 4.2Å; A269-I277 HydrophobicContact CB-CB 4.35Å; A269-I277 HydrophobicContact CB-CG2 3.62Å; Y274-I277 HydrophobicContact CD2-CD1 4.38Å; Y274-I277 HydrophobicContact CG-CD1 4.5Å; A275-I277 PolarHBondContact O-N 3.36Å; I277-E279 VanDerWaalsContact C-N 3.31Å; I277-E279 PolarHBondContact O-N 3.42Å; I277-S280 PolarHBondContact O-N 2.89Å; I277-L281 HydrophobicContact CG2-CD1 3.64Å; I277-L281 HydrophobicContact CG2-CG 4.27Å; I277-L281 WeakPolarHBondContact O-CB 3.33Å; I277-L281 WeakPolarHBondContact O-CD1 3.38Å; I277-L281 WeakPolarHBondContact O-CG 3.24Å; I277-L281 PolarHBondContact O-N 3.37Å
278	C	95.1	Very high	93.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.5	-41.5	173	-77.2	0	0	0	0	111.9	L266 A270 Y274 A275 I282 I310 M313	L266-C278 HydrophobicContact CD1-CB 4.07Å; A270-C278 PolarHBondContact N-SG 2.91Å; Y274-C278 PolarHBondContact O-N 3.13Å; Y274-C278 PolarHBondContact O-SG 3.46Å; A275-C278 CarbonylContact O-C 3.56Å; A275-C278 WeakPolarHBondContact O-CA 3.41Å; A275-C278 WeakPolarHBondContact O-CB 3.41Å; A275-C278 PolarHBondContact O-N 2.79Å; C278-I282 WeakPolarHBondContact O-CB 3.17Å; C278-I282 WeakPolarHBondContact O-CD1 3.22Å; C278-I282 WeakPolarHBondContact O-CG1 3.41Å; C278-I282 PolarHBondContact O-N 2.96Å; C278-I310 HydrophobicContact CB-CG1 4.37Å; C278-I310 HydrophobicContact CB-CG2 4.43Å; C278-M313 HydrophobicContact CB-CE 4.14Å
279	E	94.8	Very high	93.4	Very high	102 Å²	102	43.4 Å²	43.4	48%	0.477	24%	0.24	S	C	.	.	H	α-helix	trans	-62	-51.1	177	-178.6	164	-165.2	0	0	111.5	A275 D276 I277 L281 I282 N283 M313	A275-E279 PolarHBondContact O-N 3.04Å; D276-E279 PolarHBondContact O-N 2.88Å; I277-E279 VanDerWaalsContact C-N 3.31Å; I277-E279 PolarHBondContact O-N 3.42Å; E279-L281 PolarHBondContact O-N 2.94Å; E279-I282 PolarHBondContact O-N 3.32Å; E279-N283 WeakPolarHBondContact CG-ND2 3.45Å; E279-N283 WeakPolarHBondContact O-CB 3.46Å; E279-N283 VanDerWaalsContact O-CG 3.28Å; E279-N283 PolarHBondContact O-N 3.49Å; E279-N283 PolarHBondContact O-ND2 3.08Å; E279-M313 HydrophobicContact CB-SD 3.91Å; E279-M313 HydrophobicContact CG-SD 4.47Å
280	S	94.7	Very high	93.1	Very high	30 Å²	30	46.2 Å²	46.2	21%	0.21	25%	0.252	C	S	.	.	H	α-helix	trans	-57.5	-47	177.4	-67	0	0	0	0	112.4	D276 I277 I282 N283 S284	D276-S280 PolarHBondContact O-N 3.3Å; D276-S280 PolarHBondContact O-OG 2.86Å; I277-S280 PolarHBondContact O-N 2.89Å; S280-I282 PolarHBondContact O-N 3.16Å; S280-N283 PolarHBondContact O-N 3.36Å; S280-S284 PolarHBondContact O-N 3.43Å; S280-S284 PolarHBondContact O-OG 2.94Å
281	L	95	Very high	92.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.1	-39.5	177.8	-66.5	166.3	0	0	0	112.7	L233 T237 L249 V255 A265 L266 A269 I277 E279 N283 S284 G285 A286	L233-L281 HydrophobicContact CD1-CD2 4.44Å; L233-L281 HydrophobicContact CD2-CD2 4.15Å; T237-L281 HydrophobicContact CG2-CD1 4.11Å; L249-L281 HydrophobicContact CD1-CD2 4.26Å; L249-L281 HydrophobicContact CD2-CD2 4.27Å; V255-L281 HydrophobicContact CG1-CB 4.42Å; V255-L281 HydrophobicContact CG1-CD2 3.57Å; A265-L281 HydrophobicContact CB-CD1 4.25Å; A265-L281 HydrophobicContact CB-CD2 4.05Å; L266-L281 HydrophobicContact CB-CD1 4.31Å; L266-L281 HydrophobicContact CD1-CB 4.19Å; L266-L281 HydrophobicContact CD1-CD1 4.4Å; A269-L281 HydrophobicContact CB-CD1 4.12Å; I277-L281 HydrophobicContact CG2-CD1 3.64Å; I277-L281 HydrophobicContact CG2-CG 4.27Å; I277-L281 WeakPolarHBondContact O-CB 3.33Å; I277-L281 WeakPolarHBondContact O-CD1 3.38Å; I277-L281 WeakPolarHBondContact O-CG 3.24Å; I277-L281 PolarHBondContact O-N 3.37Å; E279-L281 PolarHBondContact O-N 2.94Å; L281-N283 VanDerWaalsContact C-N 3.33Å; L281-S284 CarbonylContact O-C 3.6Å; L281-S284 PolarHBondContact O-N 3.01Å; L281-G285 PolarHBondContact O-N 3.08Å; L281-A286 HydrophobicContact CB-CB 4.23Å; L281-A286 WeakPolarHBondContact O-CB 3Å; L281-A286 PolarHBondContact O-N 3.21Å
282	I	93.8	Very high	92.7	Very high	14 Å²	14	45.8 Å²	45.8	7%	0.072	26%	0.261	C	S	.	.	H	α-helix	trans	-67.6	-33.7	176.8	-78.4	169.6	0	0	0	111.5	L266 C278 E279 S280 G285 M313 I314 K317	L266-I282 HydrophobicContact CD1-CD1 4.2Å; L266-I282 HydrophobicContact CD1-CG1 3.94Å; L266-I282 HydrophobicContact CD2-CG1 4.06Å; C278-I282 WeakPolarHBondContact O-CB 3.17Å; C278-I282 WeakPolarHBondContact O-CD1 3.22Å; C278-I282 WeakPolarHBondContact O-CG1 3.41Å; C278-I282 PolarHBondContact O-N 2.96Å; E279-I282 PolarHBondContact O-N 3.32Å; S280-I282 PolarHBondContact O-N 3.16Å; I282-G285 PolarHBondContact O-N 2.9Å; I282-M313 HydrophobicContact CD1-CB 4.35Å; I282-I314 HydrophobicContact CD1-CG1 4.31Å; I282-K317 HydrophobicContact CG2-CD 3.69Å; I282-K317 HydrophobicContact CG2-CG 3.71Å
283	N	92.7	Very high	92.5	Very high	101 Å²	101	52 Å²	52	54%	0.54	28%	0.28	S	S	.	.	H	α-helix	trans	-76.8	-30.7	176.1	-69.6	-24.8	0	0	0	111.8	E279 S280 L281 G285	E279-N283 WeakPolarHBondContact CG-ND2 3.45Å; E279-N283 WeakPolarHBondContact O-CB 3.46Å; E279-N283 VanDerWaalsContact O-CG 3.28Å; E279-N283 PolarHBondContact O-N 3.49Å; E279-N283 PolarHBondContact O-ND2 3.08Å; S280-N283 PolarHBondContact O-N 3.36Å; L281-N283 VanDerWaalsContact C-N 3.33Å; N283-G285 PolarHBondContact O-N 3.01Å
284	S	92.4	Very high	92.2	Very high	56 Å²	56	56.9 Å²	56.9	39%	0.392	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	13.4	168.1	-61.2	0	0	0	0	114.8	S280 L281	S280-S284 PolarHBondContact O-N 3.43Å; S280-S284 PolarHBondContact O-OG 2.94Å; L281-S284 CarbonylContact O-C 3.6Å; L281-S284 PolarHBondContact O-N 3.01Å
285	G	90	Very high	91.7	Very high	43 Å²	43	54.9 Å²	54.9	44%	0.443	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	24.6	169.6	0	0	0	0	0	116.5	N256 L281 I282 N283 F287	N256-G285 PolarHBondContact ND2-O 2.75Å; L281-G285 PolarHBondContact O-N 3.08Å; I282-G285 PolarHBondContact O-N 2.9Å; N283-G285 PolarHBondContact O-N 3.01Å; G285-F287 PolarHBondContact O-N 3Å
286	A	93.4	Very high	91.4	Very high	9 Å²	9	55 Å²	55	7%	0.074	29%	0.291	C	S	.	.			trans	-60	133.8	171.6	0	0	0	0	0	112.6	V255 L266 L281 V288	V255-A286 HydrophobicContact CG1-CB 3.82Å; L266-A286 HydrophobicContact CB-CB 4Å; L266-A286 HydrophobicContact CD2-CB 3.79Å; L266-A286 HydrophobicContact CG-CB 4.41Å; L281-A286 HydrophobicContact CB-CB 4.23Å; L281-A286 WeakPolarHBondContact O-CB 3Å; L281-A286 PolarHBondContact O-N 3.21Å; A286-V288 PolarHBondContact O-N 2.85Å
287	F	91.2	Very high	91.2	Very high	125 Å²	125	53.4 Å²	53.4	55%	0.548	28%	0.278	S	S	.	.			trans	-74	117.4	179.1	-65.2	-48.1	0	0	0	111.6	N256 G285 Q290 I298	N256-F287 HydrophobicContact CB-CD2 3.86Å; N256-F287 HydrophobicContact CB-CE2 4.13Å; N256-F287 VanDerWaalsContact OD1-CD2 3.25Å; N256-F287 WeakPolarHBondContact OD1-CD2 3.43Å; N256-F287 PolarHBondContact OD1-N 3.08Å; G285-F287 PolarHBondContact O-N 3Å; F287-Q290 HydrophobicContact CB-CG 4.01Å; F287-I298 WeakPolarHBondContact O-CD1 3.3Å
288	V	90	Very high	91.1	Very high	17 Å²	17	53.4 Å²	53.4	10%	0.103	28%	0.278	C	S	.	.	S	Bend	trans	-79.5	-34.5	-173.4	-171.3	0	0	0	0	113.2	L266 A286 Q290 I314 K317 A319	L266-V288 HydrophobicContact CD2-CG2 4.39Å; A286-V288 PolarHBondContact O-N 2.85Å; V288-Q290 PolarHBondContact O-N 2.81Å; V288-I314 HydrophobicContact CG1-CB 4.24Å; V288-I314 HydrophobicContact CG1-CG1 4.26Å; V288-I314 HydrophobicContact CG1-CG2 3.68Å; V288-K317 HydrophobicContact CG2-CB 4.1Å; V288-A319 HydrophobicContact CG1-CB 3.79Å
289	N	90.7	Very high	91	Very high	69 Å²	69	53.6 Å²	53.6	37%	0.369	28%	0.279	S	S	.	.	S	Bend	trans	-91.5	66.2	179.9	-72.7	-20.8	0	0	0	111.7	W297 F318 A319 D320	N289-W297 HydrophobicContact CB-CZ3 4.16Å; N289-F318 PolarHBondContact ND2-O 3.04Å; N289-A319 VanDerWaalsContact OD1-CA 3.24Å; N289-A319 WeakPolarHBondContact OD1-CA 3.46Å; N289-D320 PolarHBondContact ND2-OD2 2.78Å; N289-D320 PolarHBondContact OD1-N 2.65Å
290	Q	89.3	Confident	90.9	Very high	58 Å²	58	48.7 Å²	48.7	27%	0.271	26%	0.256	S	S	.	.			trans	-125.3	162.3	170.8	-67.5	-170.3	-15	0	0	111.2	F287 V288 W297 I298	F287-Q290 HydrophobicContact CB-CG 4.01Å; V288-Q290 PolarHBondContact O-N 2.81Å; Q290-W297 VanDerWaalsContact O-CA 3.28Å; Q290-W297 WeakPolarHBondContact O-CA 3.36Å; Q290-I298 HydrophobicContact CB-CD1 4.23Å; Q290-I298 PolarHBondContact O-N 3.47Å; Q290-I298 VanDerWaalsContact O-N 3.11Å
291	C	89	Confident	90.7	Very high	62 Å²	62	47.3 Å²	47.3	42%	0.419	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-140.6	144.4	176.4	66.8	0	0	0	0	113.8	N296 W297	C291-N296 CarbonylContact C-O 3.59Å; C291-N296 WeakPolarHBondContact CA-O 3.42Å; C291-N296 WeakPolarHBondContact CB-O 3.45Å; C291-W297 HydrophobicContact CB-CB 4.38Å; C291-W297 HydrophobicContact CB-CD2 4.19Å; C291-W297 HydrophobicContact CB-CG 3.86Å
292	D	88.4	Confident	90.7	Very high	13 Å²	13	47.3 Å²	47.3	7%	0.07	25%	0.246	C	C	.	.			trans	-60.4	165.4	174.5	-47.7	-17.6	0	0	0	111.6	L263 F294 G295 N296	L263-D292 WeakPolarHBondContact CD2-OD1 3.47Å; D292-F294 HydrophobicContact CB-CD2 4.28Å; D292-F294 PolarHBondContact O-N 2.87Å; D292-G295 PolarHBondContact O-N 2.88Å; D292-N296 HydrophobicContact CB-CB 4.42Å; D292-N296 PolarHBondContact N-O 3.09Å; D292-N296 WeakPolarHBondContact OD2-CB 3.43Å
293	R	89.5	Confident	90.7	Very high	189 Å²	189	46.7 Å²	46.7	71%	0.713	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-15.8	171.7	-64.2	177.3	-167.7	-152.5	9.3	113.8	Q260 N261	Q260-R293 WeakPolarHBondContact O-CD 3.26Å; Q260-R293 PolarHBondContact O-NE 3.47Å; Q260-R293 PolarHBondContact O-NH1 3.26Å; Q260-R293 PolarHBondContact O-NH2 3.31Å; N261-R293 VanDerWaalsContact O-CB 3.28Å; N261-R293 WeakPolarHBondContact O-CB 3.24Å; N261-R293 VanDerWaalsContact O-CG 3.26Å; N261-R293 WeakPolarHBondContact O-CG 3.45Å; N261-R293 PolarHBondContact O-N 2.92Å
294	F	85.2	Confident	90.7	Very high	123 Å²	123	45.2 Å²	45.2	54%	0.539	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-3.7	173.4	-56	-69.8	0	0	0	114.2	N261 D292 N296 S326	N261-F294 HydrophobicContact CB-CE2 4.15Å; D292-F294 HydrophobicContact CB-CD2 4.28Å; D292-F294 PolarHBondContact O-N 2.87Å; F294-N296 VanDerWaalsContact C-N 3.35Å; F294-S326 WeakPolarHBondContact O-CB 3.38Å; F294-S326 PolarHBondContact O-OG 2.91Å
295	G	85.3	Confident	90.6	Very high	20 Å²	20	44.5 Å²	44.5	21%	0.206	23%	0.225	C	C	.	.	S	Bend	trans	78.4	12	-173.4	0	0	0	0	0	114.4	D292 W297 D325	D292-G295 PolarHBondContact O-N 2.88Å; G295-W297 PolarHBondContact O-N 3.38Å; G295-D325 WeakPolarHBondContact O-CA 3.44Å
296	N	87.1	Confident	90.7	Very high	26 Å²	26	43.8 Å²	43.8	14%	0.139	22%	0.218	C	C	.	.			trans	-79.7	118.7	173.4	-71.4	-61.5	0	0	0	109.7	C291 D292 F294 T300 R304	C291-N296 CarbonylContact C-O 3.59Å; C291-N296 WeakPolarHBondContact CA-O 3.42Å; C291-N296 WeakPolarHBondContact CB-O 3.45Å; D292-N296 HydrophobicContact CB-CB 4.42Å; D292-N296 PolarHBondContact N-O 3.09Å; D292-N296 WeakPolarHBondContact OD2-CB 3.43Å; F294-N296 VanDerWaalsContact C-N 3.35Å; N296-T300 HydrophobicContact CB-CG2 4.44Å; N296-R304 VanDerWaalsContact CG-NH1 3.35Å; N296-R304 VanDerWaalsContact OD1-CZ 3.28Å; N296-R304 PolarHBondContact OD1-NH1 2.89Å; N296-R304 PolarHBondContact OD1-NH2 3.38Å
297	W	92	Very high	90.7	Very high	63 Å²	63	45.5 Å²	45.5	24%	0.239	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-77.3	157.6	172.6	-65.3	62.3	0	0	0	111.2	N289 Q290 C291 G295 L299 T300 S301 D320 C323 Q324	N289-W297 HydrophobicContact CB-CZ3 4.16Å; Q290-W297 VanDerWaalsContact O-CA 3.28Å; Q290-W297 WeakPolarHBondContact O-CA 3.36Å; C291-W297 HydrophobicContact CB-CB 4.38Å; C291-W297 HydrophobicContact CB-CD2 4.19Å; C291-W297 HydrophobicContact CB-CG 3.86Å; G295-W297 PolarHBondContact O-N 3.38Å; W297-L299 VanDerWaalsContact C-N 3.29Å; W297-L299 PolarHBondContact O-N 2.93Å; W297-T300 CarbonylContact O-C 3.52Å; W297-T300 WeakPolarHBondContact O-CA 3.25Å; W297-T300 VanDerWaalsContact O-CB 3.23Å; W297-T300 WeakPolarHBondContact O-CB 3.48Å; W297-T300 PolarHBondContact O-N 3.01Å; W297-S301 PolarHBondContact O-N 3.24Å; W297-D320 HydrophobicContact CZ3-CB 4.02Å; W297-C323 HydrophobicContact CB-CB 4.32Å; W297-C323 HydrophobicContact CD2-CB 3.4Å; W297-C323 HydrophobicContact CE3-CB 3.71Å; W297-C323 HydrophobicContact CG-CB 3.66Å; W297-C323 HydrophobicContact CH2-CB 4.36Å; W297-C323 HydrophobicContact CZ2-CB 4.1Å; W297-C323 HydrophobicContact CZ3-CB 4.17Å; W297-Q324 PolarHBondContact NE1-O 3.04Å
298	I	93.2	Very high	90.8	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-57.3	-42.2	178.5	-58.4	-178.2	0	0	0	111.4	L266 A270 F287 Q290 T300 S301 A302 I314	L266-I298 HydrophobicContact CB-CD1 4.37Å; L266-I298 HydrophobicContact CD2-CD1 4.04Å; L266-I298 HydrophobicContact CD2-CG2 4.23Å; L266-I298 HydrophobicContact CG-CD1 4.24Å; L266-I298 HydrophobicContact CG-CG2 4.01Å; A270-I298 HydrophobicContact CB-CG2 3.84Å; F287-I298 WeakPolarHBondContact O-CD1 3.3Å; Q290-I298 HydrophobicContact CB-CD1 4.23Å; Q290-I298 PolarHBondContact O-N 3.47Å; Q290-I298 VanDerWaalsContact O-N 3.11Å; I298-T300 VanDerWaalsContact C-N 3.33Å; I298-T300 PolarHBondContact O-N 3.25Å; I298-S301 PolarHBondContact O-N 2.97Å; I298-S301 VanDerWaalsContact O-N 3.15Å; I298-A302 PolarHBondContact O-N 2.96Å; I298-I314 HydrophobicContact CG2-CD1 3.94Å
299	L	94	Very high	91	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-59.6	-40.7	172.2	176.2	59	0	0	0	112.6	W297 S301 A302 V303 V311 I314 L315 A319 P331	W297-L299 VanDerWaalsContact C-N 3.29Å; W297-L299 PolarHBondContact O-N 2.93Å; L299-S301 VanDerWaalsContact C-N 3.3Å; L299-S301 PolarHBondContact O-N 3.32Å; L299-A302 PolarHBondContact O-N 2.85Å; L299-V303 HydrophobicContact CD1-CG2 4.37Å; L299-V303 WeakPolarHBondContact O-CG2 3.38Å; L299-V303 PolarHBondContact O-N 3.27Å; L299-V311 HydrophobicContact CD1-CG1 4.15Å; L299-I314 HydrophobicContact CB-CG2 3.85Å; L299-I314 HydrophobicContact CD1-CG2 3.77Å; L299-I314 HydrophobicContact CG-CG2 4.31Å; L299-L315 HydrophobicContact CD1-CD2 4.13Å; L299-L315 HydrophobicContact CD1-CG 4.14Å; L299-L315 HydrophobicContact CD2-CD2 3.89Å; L299-A319 HydrophobicContact CD2-CB 4.26Å; L299-P331 HydrophobicContact CD2-CB 4.39Å; L299-P331 HydrophobicContact CD2-CG 3.85Å; L299-P331 HydrophobicContact CG-CB 4.24Å; L299-P331 HydrophobicContact CG-CG 3.9Å
300	T	92.3	Very high	91.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.6	-35.5	175.4	-67.8	0	0	0	0	111.8	N296 W297 I298 R304 L334	N296-T300 HydrophobicContact CB-CG2 4.44Å; W297-T300 CarbonylContact O-C 3.52Å; W297-T300 WeakPolarHBondContact O-CA 3.25Å; W297-T300 VanDerWaalsContact O-CB 3.23Å; W297-T300 WeakPolarHBondContact O-CB 3.48Å; W297-T300 PolarHBondContact O-N 3.01Å; I298-T300 VanDerWaalsContact C-N 3.33Å; I298-T300 PolarHBondContact O-N 3.25Å; T300-R304 WeakPolarHBondContact O-CB 3.36Å; T300-R304 PolarHBondContact O-N 2.94Å; T300-R304 VanDerWaalsContact O-N 3.08Å; T300-L334 HydrophobicContact CG2-CD1 3.46Å; T300-L334 VanDerWaalsContact CG2-CD1 3.46Å
301	S	91.1	Very high	91.5	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.007	20%	0.195	C	C	.	.	H	α-helix	trans	-73.3	-37.2	173.5	-72.4	0	0	0	0	113.1	W297 I298 L299 R304 S305	W297-S301 PolarHBondContact O-N 3.24Å; I298-S301 PolarHBondContact O-N 2.97Å; I298-S301 VanDerWaalsContact O-N 3.15Å; L299-S301 VanDerWaalsContact C-N 3.3Å; L299-S301 PolarHBondContact O-N 3.32Å; S301-R304 CarbonylContact O-C 3.1Å; S301-R304 WeakPolarHBondContact O-CA 3.48Å; S301-R304 WeakPolarHBondContact O-CB 3.47Å; S301-R304 PolarHBondContact O-N 3.27Å; S301-R304 VanDerWaalsContact O-N 3.09Å; S301-S305 PolarHBondContact O-N 3.19Å
302	A	93.8	Very high	91.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64	-42.2	172.2	0	0	0	0	0	113	A270 I298 L299 R304 S305 G306 I310 V311 I314	A270-A302 HydrophobicContact CB-CB 4.26Å; A270-A302 WeakPolarHBondContact O-CA 3.24Å; I298-A302 PolarHBondContact O-N 2.96Å; L299-A302 PolarHBondContact O-N 2.85Å; A302-R304 PolarHBondContact O-N 3.04Å; A302-S305 PolarHBondContact O-N 3.35Å; A302-S305 PolarHBondContact O-OG 2.75Å; A302-G306 PolarHBondContact O-N 3.46Å; A302-I310 HydrophobicContact CB-CG2 3.72Å; A302-V311 HydrophobicContact CB-CG2 3.82Å; A302-I314 HydrophobicContact CB-CD1 3.64Å
303	V	94.2	Very high	92	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.4	-29.3	171.8	173	0	0	0	0	111.3	L299 V311 P331 L334 A335 F340 I343 L347	L299-V303 HydrophobicContact CD1-CG2 4.37Å; L299-V303 WeakPolarHBondContact O-CG2 3.38Å; L299-V303 PolarHBondContact O-N 3.27Å; V303-V311 HydrophobicContact CG2-CG1 4.37Å; V303-V311 HydrophobicContact CG2-CG2 3.85Å; V303-P331 HydrophobicContact CG2-CB 4.05Å; V303-L334 HydrophobicContact CG1-CB 4.09Å; V303-A335 HydrophobicContact CG1-CB 4.01Å; V303-F340 WeakPolarHBondContact O-CE2 3.45Å; V303-I343 HydrophobicContact CB-CG2 4.39Å; V303-I343 HydrophobicContact CG1-CG2 4.06Å; V303-I343 HydrophobicContact CG2-CG2 3.81Å; V303-L347 HydrophobicContact CG2-CD1 4.14Å
304	R	92.3	Very high	92.2	Very high	71 Å²	71	32 Å²	32	27%	0.268	17%	0.17	S	C	.	.	H	α-helix	trans	-74.3	-32.3	175.9	-171.8	173.9	-71.2	116.4	-8.8	113	N296 T300 S301 A302 K338	N296-R304 VanDerWaalsContact CG-NH1 3.35Å; N296-R304 VanDerWaalsContact OD1-CZ 3.28Å; N296-R304 PolarHBondContact OD1-NH1 2.89Å; N296-R304 PolarHBondContact OD1-NH2 3.38Å; T300-R304 WeakPolarHBondContact O-CB 3.36Å; T300-R304 PolarHBondContact O-N 2.94Å; T300-R304 VanDerWaalsContact O-N 3.08Å; S301-R304 CarbonylContact O-C 3.1Å; S301-R304 WeakPolarHBondContact O-CA 3.48Å; S301-R304 WeakPolarHBondContact O-CB 3.47Å; S301-R304 PolarHBondContact O-N 3.27Å; S301-R304 VanDerWaalsContact O-N 3.09Å; A302-R304 PolarHBondContact O-N 3.04Å; R304-K338 PolarHBondContact O-NZ 3.43Å
305	S	91	Very high	92.5	Very high	40 Å²	40	26.6 Å²	26.6	28%	0.28	15%	0.147	S	C	.	.	H	α-helix	trans	-73	-28.7	174	67.2	0	0	0	0	112.6	A270 R271 S301 A302	A270-S305 VanDerWaalsContact O-CB 3.26Å; A270-S305 WeakPolarHBondContact O-CB 2.98Å; A270-S305 PolarHBondContact O-OG 3.5Å; R271-S305 VanDerWaalsContact O-CB 3.24Å; R271-S305 WeakPolarHBondContact O-CB 3.47Å; S301-S305 PolarHBondContact O-N 3.19Å; A302-S305 PolarHBondContact O-N 3.35Å; A302-S305 PolarHBondContact O-OG 2.75Å
306	G	91.8	Very high	92.9	Very high	29 Å²	29	29.8 Å²	29.8	30%	0.299	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	7.7	179.2	0	0	0	0	0	114	A302 A308	A302-G306 PolarHBondContact O-N 3.46Å; G306-A308 PolarHBondContact O-N 3.01Å
307	N	93.4	Very high	93	Very high	45 Å²	45	33.2 Å²	33.2	24%	0.241	17%	0.173	C	C	.	.			trans	-83	101	176.2	-171.5	-23.9	0	0	0	110.9	G273 A309 I310 V311	G273-N307 PolarHBondContact O-ND2 3.46Å; N307-A309 PolarHBondContact O-N 2.82Å; N307-A309 WeakPolarHBondContact OD1-CB 3.13Å; N307-A309 PolarHBondContact OD1-N 3.06Å; N307-I310 HydrophobicContact CB-CB 4.28Å; N307-I310 HydrophobicContact CB-CD1 3.93Å; N307-I310 HydrophobicContact CB-CG1 4.11Å; N307-I310 PolarHBondContact O-N 2.74Å; N307-I310 PolarHBondContact OD1-N 3.3Å; N307-V311 PolarHBondContact O-N 2.8Å; N307-V311 VanDerWaalsContact O-N 3.16Å
308	A	93.6	Very high	92.8	Very high	32 Å²	32	38.9 Å²	38.9	26%	0.264	20%	0.2	S	C	.	.	H	α-helix	trans	-60.8	-27.1	179.9	0	0	0	0	0	114.2	G306 R312 I343 I346	G306-A308 PolarHBondContact O-N 3.01Å; A308-R312 PolarHBondContact O-N 3.4Å; A308-I343 HydrophobicContact CB-CG1 4.01Å; A308-I346 HydrophobicContact CB-CD1 3.93Å
309	A	94.5	Very high	92.6	Very high	46 Å²	46	39.1 Å²	39.1	38%	0.38	20%	0.202	S	C	.	.	H	α-helix	trans	-70	-44.9	176.5	0	0	0	0	0	111.2	N307 V311 R312 M313	N307-A309 PolarHBondContact O-N 2.82Å; N307-A309 WeakPolarHBondContact OD1-CB 3.13Å; N307-A309 PolarHBondContact OD1-N 3.06Å; A309-V311 PolarHBondContact O-N 3.47Å; A309-R312 PolarHBondContact O-N 2.97Å; A309-M313 WeakPolarHBondContact O-CG 3.41Å; A309-M313 PolarHBondContact O-N 2.92Å
310	I	94.8	Very high	92.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.7	-44.4	175.7	-63.8	177.2	0	0	0	110.7	A270 G273 A275 C278 A302 N307 R312 M313 I314	A270-I310 HydrophobicContact CB-CG2 4.09Å; G273-I310 WeakPolarHBondContact O-CD1 3.23Å; A275-I310 HydrophobicContact CB-CD1 4.41Å; A275-I310 HydrophobicContact CB-CG1 4.03Å; C278-I310 HydrophobicContact CB-CG1 4.37Å; C278-I310 HydrophobicContact CB-CG2 4.43Å; A302-I310 HydrophobicContact CB-CG2 3.72Å; N307-I310 HydrophobicContact CB-CB 4.28Å; N307-I310 HydrophobicContact CB-CD1 3.93Å; N307-I310 HydrophobicContact CB-CG1 4.11Å; N307-I310 PolarHBondContact O-N 2.74Å; N307-I310 PolarHBondContact OD1-N 3.3Å; I310-R312 VanDerWaalsContact C-N 3.3Å; I310-R312 PolarHBondContact O-N 3.49Å; I310-M313 HydrophobicContact CB-CE 4.49Å; I310-M313 HydrophobicContact CG1-CE 4.06Å; I310-M313 PolarHBondContact O-N 3.45Å; I310-I314 HydrophobicContact CG2-CD1 3.67Å; I310-I314 HydrophobicContact CG2-CG1 4.38Å; I310-I314 WeakPolarHBondContact O-CB 3.48Å; I310-I314 WeakPolarHBondContact O-CG1 3.49Å; I310-I314 PolarHBondContact O-N 3.02Å
311	V	94.9	Very high	92.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-57.9	-43.2	175.5	173.9	0	0	0	0	111.1	L299 A302 V303 N307 A309 L315 I343 I346	L299-V311 HydrophobicContact CD1-CG1 4.15Å; A302-V311 HydrophobicContact CB-CG2 3.82Å; V303-V311 HydrophobicContact CG2-CG1 4.37Å; V303-V311 HydrophobicContact CG2-CG2 3.85Å; N307-V311 PolarHBondContact O-N 2.8Å; N307-V311 VanDerWaalsContact O-N 3.16Å; A309-V311 PolarHBondContact O-N 3.47Å; V311-L315 HydrophobicContact CG1-CD1 3.61Å; V311-L315 HydrophobicContact CG1-CG 4.37Å; V311-L315 WeakPolarHBondContact O-CB 3.41Å; V311-L315 WeakPolarHBondContact O-CD1 3.27Å; V311-L315 WeakPolarHBondContact O-CG 2.97Å; V311-L315 PolarHBondContact O-N 3.46Å; V311-I343 HydrophobicContact CG1-CG2 4.33Å; V311-I343 HydrophobicContact CG2-CD1 4.35Å; V311-I343 HydrophobicContact CG2-CG2 4.32Å; V311-I346 HydrophobicContact CG1-CG2 4.3Å
312	R	94.8	Very high	92.5	Very high	128 Å²	128	47.9 Å²	47.9	48%	0.483	25%	0.248	S	C	.	.	H	α-helix	trans	-63.2	-51.2	176.3	-176.2	177.2	-67.6	142.6	-0.4	112.2	A308 A309 I310 I314 L315 D316	A308-R312 PolarHBondContact O-N 3.4Å; A309-R312 PolarHBondContact O-N 2.97Å; I310-R312 VanDerWaalsContact C-N 3.3Å; I310-R312 PolarHBondContact O-N 3.49Å; R312-I314 VanDerWaalsContact C-N 3.29Å; R312-I314 PolarHBondContact O-N 2.72Å; R312-L315 PolarHBondContact O-N 3.04Å; R312-L315 VanDerWaalsContact O-N 3.1Å; R312-D316 WeakPolarHBondContact CG-OD2 3.25Å; R312-D316 VanDerWaalsContact O-CG 3.31Å; R312-D316 PolarHBondContact O-N 3.25Å
313	M	93	Very high	92.4	Very high	42 Å²	42	48.2 Å²	48.2	21%	0.207	25%	0.251	C	S	.	.	H	α-helix	trans	-56.7	-41.4	179.4	-69.4	-172	-67.6	0	0	112.8	A275 C278 E279 I282 A309 I310 K317	A275-M313 HydrophobicContact CB-CE 4.24Å; C278-M313 HydrophobicContact CB-CE 4.14Å; E279-M313 HydrophobicContact CB-SD 3.91Å; E279-M313 HydrophobicContact CG-SD 4.47Å; I282-M313 HydrophobicContact CD1-CB 4.35Å; A309-M313 WeakPolarHBondContact O-CG 3.41Å; A309-M313 PolarHBondContact O-N 2.92Å; I310-M313 HydrophobicContact CB-CE 4.49Å; I310-M313 HydrophobicContact CG1-CE 4.06Å; I310-M313 PolarHBondContact O-N 3.45Å; M313-K317 WeakPolarHBondContact O-CG 3Å; M313-K317 PolarHBondContact O-N 2.85Å
314	I	93.6	Very high	92.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.1	-46.6	175.7	-76.8	173.7	0	0	0	111.2	A270 I282 V288 I298 L299 A302 I310 R312 D316 K317 A319	A270-I314 HydrophobicContact CB-CD1 4.26Å; I282-I314 HydrophobicContact CD1-CG1 4.31Å; V288-I314 HydrophobicContact CG1-CB 4.24Å; V288-I314 HydrophobicContact CG1-CG1 4.26Å; V288-I314 HydrophobicContact CG1-CG2 3.68Å; I298-I314 HydrophobicContact CG2-CD1 3.94Å; L299-I314 HydrophobicContact CB-CG2 3.85Å; L299-I314 HydrophobicContact CD1-CG2 3.77Å; L299-I314 HydrophobicContact CG-CG2 4.31Å; A302-I314 HydrophobicContact CB-CD1 3.64Å; I310-I314 HydrophobicContact CG2-CD1 3.67Å; I310-I314 HydrophobicContact CG2-CG1 4.38Å; I310-I314 WeakPolarHBondContact O-CB 3.48Å; I310-I314 WeakPolarHBondContact O-CG1 3.49Å; I310-I314 PolarHBondContact O-N 3.02Å; R312-I314 VanDerWaalsContact C-N 3.29Å; R312-I314 PolarHBondContact O-N 2.72Å; I314-D316 VanDerWaalsContact C-N 3.34Å; I314-D316 PolarHBondContact O-N 3.02Å; I314-K317 PolarHBondContact O-N 3.11Å; I314-A319 HydrophobicContact CG2-CB 3.39Å; I314-A319 VanDerWaalsContact O-CB 3.25Å; I314-A319 WeakPolarHBondContact O-CB 3.26Å; I314-A319 PolarHBondContact O-N 3.36Å
315	L	92.6	Very high	92	Very high	11 Å²	11	48.2 Å²	48.2	6%	0.058	25%	0.254	C	S	.	.	H	α-helix	trans	-68.5	-30.5	179.6	-70.1	167.1	0	0	0	113.3	L299 V311 R312 K317 F318 I321 I346 L347 K350	L299-L315 HydrophobicContact CD1-CD2 4.13Å; L299-L315 HydrophobicContact CD1-CG 4.14Å; L299-L315 HydrophobicContact CD2-CD2 3.89Å; V311-L315 HydrophobicContact CG1-CD1 3.61Å; V311-L315 HydrophobicContact CG1-CG 4.37Å; V311-L315 WeakPolarHBondContact O-CB 3.41Å; V311-L315 WeakPolarHBondContact O-CD1 3.27Å; V311-L315 WeakPolarHBondContact O-CG 2.97Å; V311-L315 PolarHBondContact O-N 3.46Å; R312-L315 PolarHBondContact O-N 3.04Å; R312-L315 VanDerWaalsContact O-N 3.1Å; L315-K317 PolarHBondContact O-N 2.98Å; L315-F318 PolarHBondContact O-N 2.8Å; L315-I321 HydrophobicContact CD2-CB 4.45Å; L315-I321 HydrophobicContact CD2-CG1 3.85Å; L315-I321 HydrophobicContact CD2-CG2 4.24Å; L315-I346 HydrophobicContact CD1-CG2 3.82Å; L315-L347 HydrophobicContact CD1-CD2 4.07Å; L315-L347 HydrophobicContact CD2-CD2 4.38Å; L315-K350 HydrophobicContact CB-CG 4.39Å; L315-K350 HydrophobicContact CD1-CG 4.26Å
316	D	92.2	Very high	91.9	Very high	86 Å²	86	49.7 Å²	49.7	46%	0.46	27%	0.265	S	S	.	.	H	α-helix	trans	-73.4	-17	175.6	-68.6	-25.9	0	0	0	112.7	R312 I314 F318 K350	R312-D316 WeakPolarHBondContact CG-OD2 3.25Å; R312-D316 VanDerWaalsContact O-CG 3.31Å; R312-D316 PolarHBondContact O-N 3.25Å; I314-D316 VanDerWaalsContact C-N 3.34Å; I314-D316 PolarHBondContact O-N 3.02Å; D316-F318 VanDerWaalsContact C-N 3.34Å; D316-K350 IonicContact OD1-NZ 3.31Å; D316-K350 PolarHBondContact OD1-NZ 2.83Å
317	K	90.5	Very high	91.7	Very high	98 Å²	98	52.5 Å²	52.5	43%	0.426	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	27.4	172	-60.6	-84.2	176.8	146.3	0	112.4	I282 V288 M313 I314 L315 A319	I282-K317 HydrophobicContact CG2-CD 3.69Å; I282-K317 HydrophobicContact CG2-CG 3.71Å; V288-K317 HydrophobicContact CG2-CB 4.1Å; M313-K317 WeakPolarHBondContact O-CG 3Å; M313-K317 PolarHBondContact O-N 2.85Å; I314-K317 PolarHBondContact O-N 3.11Å; L315-K317 PolarHBondContact O-N 2.98Å; K317-A319 PolarHBondContact O-N 3.01Å
318	F	86.7	Confident	91.5	Very high	183 Å²	183	55.8 Å²	55.8	80%	0.803	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	39	176.5	-55.2	-79.1	0	0	0	115.5	N289 L315 D316	N289-F318 PolarHBondContact ND2-O 3.04Å; L315-F318 PolarHBondContact O-N 2.8Å; D316-F318 VanDerWaalsContact C-N 3.34Å
319	A	90.5	Very high	91.4	Very high	7 Å²	7	56.3 Å²	56.3	6%	0.058	28%	0.277	C	S	.	.			trans	-63.2	144.9	173.2	0	0	0	0	0	113.5	V288 N289 L299 I314 K317 I321	V288-A319 HydrophobicContact CG1-CB 3.79Å; N289-A319 VanDerWaalsContact OD1-CA 3.24Å; N289-A319 WeakPolarHBondContact OD1-CA 3.46Å; L299-A319 HydrophobicContact CD2-CB 4.26Å; I314-A319 HydrophobicContact CG2-CB 3.39Å; I314-A319 VanDerWaalsContact O-CB 3.25Å; I314-A319 WeakPolarHBondContact O-CB 3.26Å; I314-A319 PolarHBondContact O-N 3.36Å; K317-A319 PolarHBondContact O-N 3.01Å; A319-I321 PolarHBondContact O-N 2.73Å
320	D	91.4	Very high	91.3	Very high	79 Å²	79	54.3 Å²	54.3	42%	0.422	26%	0.26	S	S	.	.			trans	-69.6	89.4	180	-80.1	-44.2	0	0	0	112.2	N289 W297 N322 C323	N289-D320 PolarHBondContact ND2-OD2 2.78Å; N289-D320 PolarHBondContact OD1-N 2.65Å; W297-D320 HydrophobicContact CZ3-CB 4.02Å; D320-N322 PolarHBondContact O-N 3.48Å; D320-N322 VanDerWaalsContact O-N 3.09Å; D320-C323 HydrophobicContact CB-CB 4.24Å; D320-C323 WeakPolarHBondContact O-CB 3.47Å; D320-C323 PolarHBondContact O-N 3.25Å; D320-C323 PolarHBondContact O-SG 3.23Å
321	I	91.4	Very high	91.3	Very high	34 Å²	34	54.3 Å²	54.3	17%	0.174	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-30.9	179.9	-33.3	164.1	0	0	0	112.7	L315 A319 C323 L347 K350 P352	L315-I321 HydrophobicContact CD2-CB 4.45Å; L315-I321 HydrophobicContact CD2-CG1 3.85Å; L315-I321 HydrophobicContact CD2-CG2 4.24Å; A319-I321 PolarHBondContact O-N 2.73Å; I321-C323 VanDerWaalsContact C-N 3.35Å; I321-L347 HydrophobicContact CG2-CD2 3.95Å; I321-K350 HydrophobicContact CD1-CB 3.56Å; I321-K350 VanDerWaalsContact CD1-O 3.3Å; I321-K350 WeakPolarHBondContact CD1-O 3.4Å; I321-K350 HydrophobicContact CG1-CB 4.49Å; I321-P352 HydrophobicContact CG2-CB 3.92Å
322	N	91.7	Very high	91.3	Very high	74 Å²	74	54.5 Å²	54.5	40%	0.396	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	9.3	-177.9	-66	-50	0	0	0	113.3	D320 N353 L356	D320-N322 PolarHBondContact O-N 3.48Å; D320-N322 VanDerWaalsContact O-N 3.09Å; N322-N353 WeakPolarHBondContact OD1-CB 3.22Å; N322-N353 PolarHBondContact OD1-N 3.03Å; N322-L356 HydrophobicContact CB-CD1 3.84Å
323	C	90.9	Very high	91.3	Very high	8 Å²	8	48.5 Å²	48.5	5%	0.054	24%	0.239	C	C	.	.			trans	-56.5	154.7	176.7	68.1	0	0	0	0	111.8	W297 D320 I321 T330 P331	W297-C323 HydrophobicContact CB-CB 4.32Å; W297-C323 HydrophobicContact CD2-CB 3.4Å; W297-C323 HydrophobicContact CE3-CB 3.71Å; W297-C323 HydrophobicContact CG-CB 3.66Å; W297-C323 HydrophobicContact CH2-CB 4.36Å; W297-C323 HydrophobicContact CZ2-CB 4.1Å; W297-C323 HydrophobicContact CZ3-CB 4.17Å; D320-C323 HydrophobicContact CB-CB 4.24Å; D320-C323 WeakPolarHBondContact O-CB 3.47Å; D320-C323 PolarHBondContact O-N 3.25Å; D320-C323 PolarHBondContact O-SG 3.23Å; I321-C323 VanDerWaalsContact C-N 3.35Å; C323-T330 VanDerWaalsContact O-CA 3.31Å; C323-T330 WeakPolarHBondContact O-CA 3.24Å; C323-P331 VanDerWaalsContact O-CD 3.32Å; C323-P331 WeakPolarHBondContact O-CD 3.49Å; C323-P331 VanDerWaalsContact SG-CD 3.6Å; C323-P331 WeakPolarHBondContact SG-CG 3.48Å
324	Q	90.2	Very high	91.3	Very high	63 Å²	63	47.1 Å²	47.1	29%	0.294	23%	0.232	S	C	.	.			trans	-127.6	136.7	-176.9	-76.1	-163.2	-26.5	0	0	111	W297 K328 R329 T330	W297-Q324 PolarHBondContact NE1-O 3.04Å; Q324-K328 PolarHBondContact NE2-O 3.32Å; Q324-K328 VanDerWaalsContact NE2-O 3.1Å; Q324-R329 WeakPolarHBondContact CA-O 3.36Å; Q324-T330 HydrophobicContact CG-CG2 4.14Å
325	D	88.6	Confident	91.3	Very high	8 Å²	8	47.1 Å²	47.1	4%	0.043	23%	0.232	C	C	.	.			trans	-80.1	-179.4	170.4	76.9	0.3	0	0	0	112.5	G295 E327 K328 R329	G295-D325 WeakPolarHBondContact O-CA 3.44Å; D325-E327 PolarHBondContact O-N 3.13Å; D325-E327 VanDerWaalsContact O-N 3.08Å; D325-E327 VanDerWaalsContact OD1-CA 3.28Å; D325-E327 WeakPolarHBondContact OD1-CA 3.49Å; D325-E327 WeakPolarHBondContact OD1-CB 3.34Å; D325-E327 PolarHBondContact OD1-N 2.93Å; D325-K328 WeakPolarHBondContact O-CA 3.43Å; D325-K328 PolarHBondContact O-N 3.27Å; D325-K328 PolarHBondContact OD1-N 2.93Å; D325-K328 VanDerWaalsContact OD1-N 3.12Å; D325-R329 PolarHBondContact N-O 2.72Å; D325-R329 WeakPolarHBondContact OD1-CB 3.46Å; D325-R329 PolarHBondContact OD1-N 2.85Å; D325-R329 IonicContact OD1-NE 2.65Å; D325-R329 IonicContact OD2-CZ 3.34Å; D325-R329 IonicContact OD2-NE 2.69Å; D325-R329 PolarHBondContact OD2-NE 2.92Å; D325-R329 IonicContact OD2-NH2 2.8Å; D325-R329 PolarHBondContact OD2-NH2 3.4Å
326	S	87.9	Confident	91.4	Very high	71 Å²	71	46.6 Å²	46.6	50%	0.497	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-7.6	177.7	46.5	0	0	0	0	114.6	F294 K359	F294-S326 WeakPolarHBondContact O-CB 3.38Å; F294-S326 PolarHBondContact O-OG 2.91Å; S326-K359 WeakPolarHBondContact O-CE 3.5Å; S326-K359 PolarHBondContact O-NZ 2.99Å
327	E	87.8	Confident	91.4	Very high	88 Å²	88	44.8 Å²	44.8	41%	0.411	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	5.5	170.1	-70.2	175.3	-121.8	0	0	113.3	D325 R329 K359	D325-E327 PolarHBondContact O-N 3.13Å; D325-E327 VanDerWaalsContact O-N 3.08Å; D325-E327 VanDerWaalsContact OD1-CA 3.28Å; D325-E327 WeakPolarHBondContact OD1-CA 3.49Å; D325-E327 WeakPolarHBondContact OD1-CB 3.34Å; D325-E327 PolarHBondContact OD1-N 2.93Å; E327-R329 HydrophobicContact CB-CG 4.2Å; E327-R329 PolarHBondContact O-N 3.08Å; E327-R329 IonicContact OE1-CZ 2.83Å; E327-R329 IonicContact OE1-NH1 3.64Å; E327-R329 PolarHBondContact OE1-NH1 3.33Å; E327-R329 VanDerWaalsContact OE1-NH1 3.08Å; E327-R329 IonicContact OE1-NH2 3.73Å; E327-R329 PolarHBondContact OE1-NH2 2.74Å; E327-R329 IonicContact OE2-CZ 3.12Å; E327-R329 VanDerWaalsContact OE2-CZ 3.23Å; E327-R329 IonicContact OE2-NE 2.73Å; E327-R329 IonicContact OE2-NH1 3.74Å; E327-R329 PolarHBondContact OE2-NH1 2.64Å; E327-R329 IonicContact OE2-NH2 2.78Å; E327-K359 WeakPolarHBondContact O-CG 3.27Å; E327-K359 PolarHBondContact O-N 3.12Å; E327-K359 VanDerWaalsContact O-N 3.07Å
328	K	89.9	Confident	91.4	Very high	114 Å²	114	44.3 Å²	44.3	50%	0.496	22%	0.218	S	C	.	.			trans	62	17.9	-170.8	-58.8	-171.5	176.8	-172.9	0	114.3	Q324 D325 K359	Q324-K328 PolarHBondContact NE2-O 3.32Å; Q324-K328 VanDerWaalsContact NE2-O 3.1Å; D325-K328 WeakPolarHBondContact O-CA 3.43Å; D325-K328 PolarHBondContact O-N 3.27Å; D325-K328 PolarHBondContact OD1-N 2.93Å; D325-K328 VanDerWaalsContact OD1-N 3.12Å; K328-K359 HydrophobicContact CG-CG 4.48Å
329	R	91.4	Very high	91.6	Very high	42 Å²	42	38.3 Å²	38.3	16%	0.158	20%	0.199	C	C	.	.			trans	-74.3	136.9	171.9	-65.2	-177.7	-63.1	-129.5	-12.1	109.3	Q324 D325 E327 H333 L334 D337 N358	Q324-R329 WeakPolarHBondContact CA-O 3.36Å; D325-R329 PolarHBondContact N-O 2.72Å; D325-R329 WeakPolarHBondContact OD1-CB 3.46Å; D325-R329 PolarHBondContact OD1-N 2.85Å; D325-R329 IonicContact OD1-NE 2.65Å; D325-R329 IonicContact OD2-CZ 3.34Å; D325-R329 IonicContact OD2-NE 2.69Å; D325-R329 PolarHBondContact OD2-NE 2.92Å; D325-R329 IonicContact OD2-NH2 2.8Å; D325-R329 PolarHBondContact OD2-NH2 3.4Å; E327-R329 HydrophobicContact CB-CG 4.2Å; E327-R329 PolarHBondContact O-N 3.08Å; E327-R329 IonicContact OE1-CZ 2.83Å; E327-R329 IonicContact OE1-NH1 3.64Å; E327-R329 PolarHBondContact OE1-NH1 3.33Å; E327-R329 VanDerWaalsContact OE1-NH1 3.08Å; E327-R329 IonicContact OE1-NH2 3.73Å; E327-R329 PolarHBondContact OE1-NH2 2.74Å; E327-R329 IonicContact OE2-CZ 3.12Å; E327-R329 VanDerWaalsContact OE2-CZ 3.23Å; E327-R329 IonicContact OE2-NE 2.73Å; E327-R329 IonicContact OE2-NH1 3.74Å; E327-R329 PolarHBondContact OE2-NH1 2.64Å; E327-R329 IonicContact OE2-NH2 2.78Å; R329-H333 HydrophobicContact CB-CB 3.89Å; R329-H333 HydrophobicContact CG-CB 4.2Å; R329-L334 HydrophobicContact CB-CG 4.47Å; R329-D337 WeakPolarHBondContact CD-OD2 3.44Å; R329-N358 HydrophobicContact CG-CB 4.35Å
330	T	93.1	Very high	91.8	Very high	5 Å²	5	41.1 Å²	41.1	3%	0.031	21%	0.209	C	C	.	.			trans	-85.3	163.6	167	64.9	0	0	0	0	110.8	C323 Q324 L332 H333 L334 L356	C323-T330 VanDerWaalsContact O-CA 3.31Å; C323-T330 WeakPolarHBondContact O-CA 3.24Å; Q324-T330 HydrophobicContact CG-CG2 4.14Å; T330-L332 PolarHBondContact O-N 3.36Å; T330-L332 VanDerWaalsContact O-N 3.1Å; T330-H333 PolarHBondContact N-ND1 2.95Å; T330-H333 WeakPolarHBondContact O-CB 3.32Å; T330-H333 PolarHBondContact O-N 2.93Å; T330-H333 PolarHBondContact OG1-ND1 2.95Å; T330-L334 PolarHBondContact O-N 3.48Å; T330-L356 HydrophobicContact CG2-CB 4.12Å; T330-L356 HydrophobicContact CG2-CD1 3.8Å
331	P	94.1	Very high	91.8	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-47.9	-37.3	171.2	-30.4	34.8	0	0	0	113.4	L299 V303 C323 H333 L334 A335 L347	L299-P331 HydrophobicContact CD2-CB 4.39Å; L299-P331 HydrophobicContact CD2-CG 3.85Å; L299-P331 HydrophobicContact CG-CB 4.24Å; L299-P331 HydrophobicContact CG-CG 3.9Å; V303-P331 HydrophobicContact CG2-CB 4.05Å; C323-P331 VanDerWaalsContact O-CD 3.32Å; C323-P331 WeakPolarHBondContact O-CD 3.49Å; C323-P331 VanDerWaalsContact SG-CD 3.6Å; C323-P331 WeakPolarHBondContact SG-CG 3.48Å; P331-H333 PolarHBondContact O-N 3.27Å; P331-L334 PolarHBondContact O-N 3.41Å; P331-A335 PolarHBondContact O-N 3.48Å; P331-L347 HydrophobicContact CB-CD1 4.13Å; P331-L347 HydrophobicContact CB-CD2 4.07Å
332	L	94.7	Very high	91.9	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-65	-36.9	176.5	-176.3	60.6	0	0	0	113	T330 L334 I336 A344 L347 L348 P352 L354 P364 L380	T330-L332 PolarHBondContact O-N 3.36Å; T330-L332 VanDerWaalsContact O-N 3.1Å; L332-L334 VanDerWaalsContact C-N 3.35Å; L332-I336 HydrophobicContact CD1-CD1 4.37Å; L332-I336 HydrophobicContact CG-CD1 4.16Å; L332-I336 VanDerWaalsContact O-CD1 3.28Å; L332-I336 WeakPolarHBondContact O-CD1 3.36Å; L332-I336 WeakPolarHBondContact O-CG1 3.13Å; L332-I336 PolarHBondContact O-N 3.08Å; L332-I336 VanDerWaalsContact O-N 3.12Å; L332-A344 HydrophobicContact CD1-CB 4.17Å; L332-L347 HydrophobicContact CB-CD1 4.44Å; L332-L347 HydrophobicContact CD1-CB 4.34Å; L332-L348 HydrophobicContact CD1-CD2 4.41Å; L332-L348 HydrophobicContact CD1-CG 4.16Å; L332-L348 HydrophobicContact CD2-CD2 3.99Å; L332-P352 HydrophobicContact CD2-CG 3.96Å; L332-L354 HydrophobicContact CD2-CD2 3.71Å; L332-P364 HydrophobicContact CD2-CB 4Å; L332-P364 HydrophobicContact CD2-CG 3.96Å; L332-P364 HydrophobicContact CG-CB 4.2Å; L332-P364 HydrophobicContact CG-CG 4.33Å; L332-L380 HydrophobicContact CD2-CD2 4.08Å
333	H	94.7	Very high	92.1	Very high	1 Å²	1	41 Å²	41	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-41.3	172.8	-71.4	85	0	0	0	111.3	R329 T330 P331 I336 D337 L356 E362 P364	R329-H333 HydrophobicContact CB-CB 3.89Å; R329-H333 HydrophobicContact CG-CB 4.2Å; T330-H333 PolarHBondContact N-ND1 2.95Å; T330-H333 WeakPolarHBondContact O-CB 3.32Å; T330-H333 PolarHBondContact O-N 2.93Å; T330-H333 PolarHBondContact OG1-ND1 2.95Å; P331-H333 PolarHBondContact O-N 3.27Å; H333-I336 WeakPolarHBondContact O-CB 3.39Å; H333-I336 PolarHBondContact O-N 2.95Å; H333-D337 VanDerWaalsContact O-CG 3.28Å; H333-D337 PolarHBondContact O-N 2.9Å; H333-L356 PolarHBondContact CE1-O 2.98Å; H333-E362 PolarHBondContact NE2-O 3.01Å; H333-P364 VanDerWaalsContact CE1-CD 3.49Å; H333-P364 WeakPolarHBondContact CE1-CD 3.28Å
334	L	92.7	Very high	92.2	Very high	13 Å²	13	40.6 Å²	40.6	7%	0.068	21%	0.207	C	C	.	.	H	α-helix	trans	-70.5	-35.4	179.2	-72.9	172.1	0	0	0	113.2	T300 V303 R329 T330 P331 L332 I336 D337 K338	T300-L334 HydrophobicContact CG2-CD1 3.46Å; T300-L334 VanDerWaalsContact CG2-CD1 3.46Å; V303-L334 HydrophobicContact CG1-CB 4.09Å; R329-L334 HydrophobicContact CB-CG 4.47Å; T330-L334 PolarHBondContact O-N 3.48Å; P331-L334 PolarHBondContact O-N 3.41Å; L332-L334 VanDerWaalsContact C-N 3.35Å; L334-I336 VanDerWaalsContact C-N 3.27Å; L334-I336 PolarHBondContact O-N 2.95Å; L334-D337 PolarHBondContact O-N 2.75Å; L334-K338 PolarHBondContact O-N 3.14Å
335	A	94.6	Very high	92.4	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.8	-38.2	170.9	0	0	0	0	0	111.2	V303 P331 S339 F340 I343 A344 L347	V303-A335 HydrophobicContact CG1-CB 4.01Å; P331-A335 PolarHBondContact O-N 3.48Å; A335-S339 CarbonylContact O-C 3.55Å; A335-S339 PolarHBondContact O-N 3.09Å; A335-S339 VanDerWaalsContact O-N 3.08Å; A335-F340 PolarHBondContact O-N 3.48Å; A335-I343 HydrophobicContact CB-CG2 4.04Å; A335-A344 HydrophobicContact CB-CB 4.1Å; A335-L347 HydrophobicContact CB-CD1 4.02Å
336	I	94.4	Very high	92.6	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-70.4	-42.1	174.7	-66.2	161.5	0	0	0	111.5	L332 H333 L334 K338 S339 P364 R367 A368 L376 L380	L332-I336 HydrophobicContact CD1-CD1 4.37Å; L332-I336 HydrophobicContact CG-CD1 4.16Å; L332-I336 VanDerWaalsContact O-CD1 3.28Å; L332-I336 WeakPolarHBondContact O-CD1 3.36Å; L332-I336 WeakPolarHBondContact O-CG1 3.13Å; L332-I336 PolarHBondContact O-N 3.08Å; L332-I336 VanDerWaalsContact O-N 3.12Å; H333-I336 WeakPolarHBondContact O-CB 3.39Å; H333-I336 PolarHBondContact O-N 2.95Å; L334-I336 VanDerWaalsContact C-N 3.27Å; L334-I336 PolarHBondContact O-N 2.95Å; I336-K338 VanDerWaalsContact C-N 3.27Å; I336-K338 PolarHBondContact O-N 3.3Å; I336-S339 PolarHBondContact O-N 3.15Å; I336-S339 VanDerWaalsContact O-N 3.13Å; I336-P364 HydrophobicContact CD1-CB 3.68Å; I336-R367 HydrophobicContact CG2-CB 4.5Å; I336-R367 HydrophobicContact CG2-CG 4.19Å; I336-A368 HydrophobicContact CG2-CB 3.89Å; I336-L376 HydrophobicContact CB-CD1 4.33Å; I336-L376 HydrophobicContact CG1-CD1 4.11Å; I336-L376 HydrophobicContact CG2-CD1 4.31Å; I336-L380 HydrophobicContact CD1-CD1 3.91Å
337	D	92.1	Very high	92.9	Very high	47 Å²	47	39.8 Å²	39.8	25%	0.251	19%	0.191	S	C	.	.	H	α-helix	trans	-60	-36.3	176.4	-75.1	-27.3	0	0	0	112.7	R329 H333 L334 R367	R329-D337 WeakPolarHBondContact CD-OD2 3.44Å; H333-D337 VanDerWaalsContact O-CG 3.28Å; H333-D337 PolarHBondContact O-N 2.9Å; L334-D337 PolarHBondContact O-N 2.75Å; D337-R367 IonicContact OD1-CZ 3.36Å; D337-R367 IonicContact OD1-NE 2.74Å; D337-R367 PolarHBondContact OD1-NE 2.96Å; D337-R367 IonicContact OD1-NH2 3.06Å; D337-R367 PolarHBondContact OD1-NH2 2.92Å
338	K	90.8	Very high	93.2	Very high	89 Å²	89	35.7 Å²	35.7	39%	0.387	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	0.3	176.8	-69.1	-162.8	165.6	-150.9	0	114.4	R304 L334 I336 F340	R304-K338 PolarHBondContact O-NZ 3.43Å; L334-K338 PolarHBondContact O-N 3.14Å; I336-K338 VanDerWaalsContact C-N 3.27Å; I336-K338 PolarHBondContact O-N 3.3Å; K338-F340 HydrophobicContact CB-CD1 3.96Å; K338-F340 HydrophobicContact CB-CD2 3.72Å; K338-F340 HydrophobicContact CB-CE1 4.01Å; K338-F340 HydrophobicContact CB-CE2 3.78Å; K338-F340 HydrophobicContact CB-CG 3.84Å; K338-F340 HydrophobicContact CB-CZ 3.95Å; K338-F340 HydrophobicContact CD-CD2 4.05Å; K338-F340 HydrophobicContact CD-CE2 3.36Å; K338-F340 HydrophobicContact CD-CZ 3.65Å; K338-F340 HydrophobicContact CG-CE2 4.21Å; K338-F340 HydrophobicContact CG-CZ 4.44Å; K338-F340 WeakPolarHBondContact O-CD1 3.39Å; K338-F340 PolarHBondContact O-N 3.25Å
339	S	91	Very high	93.3	Very high	57 Å²	57	35.5 Å²	35.5	40%	0.399	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	25.6	-174.5	70.8	0	0	0	0	115.3	A335 I336 N341	A335-S339 CarbonylContact O-C 3.55Å; A335-S339 PolarHBondContact O-N 3.09Å; A335-S339 VanDerWaalsContact O-N 3.08Å; I336-S339 PolarHBondContact O-N 3.15Å; I336-S339 VanDerWaalsContact O-N 3.13Å; S339-N341 VanDerWaalsContact C-N 3.34Å; S339-N341 PolarHBondContact O-N 3.45Å
340	F	93.8	Very high	93.2	Very high	65 Å²	65	37 Å²	37	29%	0.285	18%	0.18	S	C	.	.			trans	-77	79.4	-179.6	-67	-19.1	0	0	0	111.2	V303 A335 K338 D342 I343 A344	V303-F340 WeakPolarHBondContact O-CE2 3.45Å; A335-F340 PolarHBondContact O-N 3.48Å; K338-F340 HydrophobicContact CB-CD1 3.96Å; K338-F340 HydrophobicContact CB-CD2 3.72Å; K338-F340 HydrophobicContact CB-CE1 4.01Å; K338-F340 HydrophobicContact CB-CE2 3.78Å; K338-F340 HydrophobicContact CB-CG 3.84Å; K338-F340 HydrophobicContact CB-CZ 3.95Å; K338-F340 HydrophobicContact CD-CD2 4.05Å; K338-F340 HydrophobicContact CD-CE2 3.36Å; K338-F340 HydrophobicContact CD-CZ 3.65Å; K338-F340 HydrophobicContact CG-CE2 4.21Å; K338-F340 HydrophobicContact CG-CZ 4.44Å; K338-F340 WeakPolarHBondContact O-CD1 3.39Å; K338-F340 PolarHBondContact O-N 3.25Å; F340-D342 VanDerWaalsContact C-N 3.33Å; F340-D342 PolarHBondContact O-N 2.91Å; F340-I343 HydrophobicContact CB-CB 4.06Å; F340-I343 HydrophobicContact CB-CD1 4.28Å; F340-I343 HydrophobicContact CB-CG1 4.46Å; F340-I343 HydrophobicContact CD2-CD1 3.92Å; F340-I343 HydrophobicContact CG-CD1 4.39Å; F340-I343 PolarHBondContact O-N 3.35Å; F340-A344 WeakPolarHBondContact O-CB 3.35Å; F340-A344 PolarHBondContact O-N 3.46Å
341	N	92.2	Very high	93.1	Very high	61 Å²	61	45.4 Å²	45.4	33%	0.326	22%	0.216	S	C	.	.	H	α-helix	trans	-53	-45.5	-176.7	-61.8	-47.6	0	0	0	113.4	S339 A344 Y345 L376	S339-N341 VanDerWaalsContact C-N 3.34Å; S339-N341 PolarHBondContact O-N 3.45Å; N341-A344 PolarHBondContact O-N 3.15Å; N341-Y345 PolarHBondContact O-N 3.11Å; N341-L376 WeakPolarHBondContact OD1-CG 3.23Å
342	D	93.5	Very high	92.9	Very high	120 Å²	120	46.1 Å²	46.1	64%	0.642	22%	0.221	S	C	*	.	H	α-helix	trans	-69.7	-39.3	-174.2	-52.2	-9.9	0	0	0	111.3	F340 Y345 I346	F340-D342 VanDerWaalsContact C-N 3.33Å; F340-D342 PolarHBondContact O-N 2.91Å; D342-Y345 PolarHBondContact O-N 2.83Å; D342-I346 WeakPolarHBondContact O-CG1 3.23Å; D342-I346 PolarHBondContact O-N 3.36Å
343	I	94.7	Very high	92.8	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-68.8	-40.4	174.2	-68.2	177.6	0	0	0	110.6	V303 A308 V311 A335 F340 Y345 I346 L347	V303-I343 HydrophobicContact CB-CG2 4.39Å; V303-I343 HydrophobicContact CG1-CG2 4.06Å; V303-I343 HydrophobicContact CG2-CG2 3.81Å; A308-I343 HydrophobicContact CB-CG1 4.01Å; V311-I343 HydrophobicContact CG1-CG2 4.33Å; V311-I343 HydrophobicContact CG2-CD1 4.35Å; V311-I343 HydrophobicContact CG2-CG2 4.32Å; A335-I343 HydrophobicContact CB-CG2 4.04Å; F340-I343 HydrophobicContact CB-CB 4.06Å; F340-I343 HydrophobicContact CB-CD1 4.28Å; F340-I343 HydrophobicContact CB-CG1 4.46Å; F340-I343 HydrophobicContact CD2-CD1 3.92Å; F340-I343 HydrophobicContact CG-CD1 4.39Å; F340-I343 PolarHBondContact O-N 3.35Å; I343-Y345 VanDerWaalsContact C-N 3.28Å; I343-Y345 PolarHBondContact O-N 2.91Å; I343-I346 PolarHBondContact O-N 3.08Å; I343-L347 HydrophobicContact CG2-CD1 3.92Å; I343-L347 HydrophobicContact CG2-CG 4.38Å; I343-L347 WeakPolarHBondContact O-CB 3.3Å; I343-L347 VanDerWaalsContact O-CG 3.26Å; I343-L347 WeakPolarHBondContact O-CG 3.23Å; I343-L347 PolarHBondContact O-N 3.43Å
344	A	93.9	Very high	92.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-39.2	173.1	0	0	0	0	0	111.4	L332 A335 F340 N341 L347 L348 L376	L332-A344 HydrophobicContact CD1-CB 4.17Å; A335-A344 HydrophobicContact CB-CB 4.1Å; F340-A344 WeakPolarHBondContact O-CB 3.35Å; F340-A344 PolarHBondContact O-N 3.46Å; N341-A344 PolarHBondContact O-N 3.15Å; A344-L347 PolarHBondContact O-N 2.94Å; A344-L348 WeakPolarHBondContact O-CB 3.46Å; A344-L348 WeakPolarHBondContact O-CD1 3.36Å; A344-L348 WeakPolarHBondContact O-CG 3.45Å; A344-L348 PolarHBondContact O-N 3.3Å; A344-L376 HydrophobicContact CB-CD2 3.56Å
345	Y	93.7	Very high	92.5	Very high	114 Å²	114	52.5 Å²	52.5	45%	0.447	25%	0.253	S	S	.	.	H	α-helix	trans	-65	-48	175	-171.6	-88.9	0	0	0	112.4	N341 D342 I343 L347 L348 E349 Y379 F383	N341-Y345 PolarHBondContact O-N 3.11Å; D342-Y345 PolarHBondContact O-N 2.83Å; I343-Y345 VanDerWaalsContact C-N 3.28Å; I343-Y345 PolarHBondContact O-N 2.91Å; Y345-L347 VanDerWaalsContact C-N 3.3Å; Y345-L347 PolarHBondContact O-N 2.93Å; Y345-L348 PolarHBondContact O-N 2.8Å; Y345-L348 VanDerWaalsContact O-N 3.09Å; Y345-E349 PolarHBondContact O-N 3.12Å; Y345-Y379 HydrophobicContact CD2-CE2 4.47Å; Y345-F383 HydrophobicContact CD2-CE2 4.49Å; Y345-F383 HydrophobicContact CE2-CE2 4.36Å; Y345-F383 HydrophobicContact CE2-CZ 4.42Å
346	I	93.8	Very high	92.4	Very high	10 Å²	10	54.6 Å²	54.6	5%	0.051	26%	0.264	C	S	.	.	H	α-helix	trans	-59.7	-39.7	176.2	-69.2	164.8	0	0	0	111.4	A308 V311 L315 D342 I343	A308-I346 HydrophobicContact CB-CD1 3.93Å; V311-I346 HydrophobicContact CG1-CG2 4.3Å; L315-I346 HydrophobicContact CD1-CG2 3.82Å; D342-I346 WeakPolarHBondContact O-CG1 3.23Å; D342-I346 PolarHBondContact O-N 3.36Å; I343-I346 PolarHBondContact O-N 3.08Å
347	L	94.3	Very high	92.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.4	-40.6	174.3	-73.2	167.2	0	0	0	111.8	V303 L315 I321 P331 L332 A335 I343 A344 Y345 K350 P352	V303-L347 HydrophobicContact CG2-CD1 4.14Å; L315-L347 HydrophobicContact CD1-CD2 4.07Å; L315-L347 HydrophobicContact CD2-CD2 4.38Å; I321-L347 HydrophobicContact CG2-CD2 3.95Å; P331-L347 HydrophobicContact CB-CD1 4.13Å; P331-L347 HydrophobicContact CB-CD2 4.07Å; L332-L347 HydrophobicContact CB-CD1 4.44Å; L332-L347 HydrophobicContact CD1-CB 4.34Å; A335-L347 HydrophobicContact CB-CD1 4.02Å; I343-L347 HydrophobicContact CG2-CD1 3.92Å; I343-L347 HydrophobicContact CG2-CG 4.38Å; I343-L347 WeakPolarHBondContact O-CB 3.3Å; I343-L347 VanDerWaalsContact O-CG 3.26Å; I343-L347 WeakPolarHBondContact O-CG 3.23Å; I343-L347 PolarHBondContact O-N 3.43Å; A344-L347 PolarHBondContact O-N 2.94Å; Y345-L347 VanDerWaalsContact C-N 3.3Å; Y345-L347 PolarHBondContact O-N 2.93Å; L347-K350 PolarHBondContact O-N 2.99Å; L347-P352 VanDerWaalsContact O-CD 3.23Å; L347-P352 WeakPolarHBondContact O-CD 3.48Å; L347-P352 WeakPolarHBondContact O-CG 3.19Å
348	L	93.1	Very high	92.3	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-69.8	-36.1	179.5	-73.7	166.5	0	0	0	113.2	L332 A344 Y345 K350 K351 P352 L354 L380 F383	L332-L348 HydrophobicContact CD1-CD2 4.41Å; L332-L348 HydrophobicContact CD1-CG 4.16Å; L332-L348 HydrophobicContact CD2-CD2 3.99Å; A344-L348 WeakPolarHBondContact O-CB 3.46Å; A344-L348 WeakPolarHBondContact O-CD1 3.36Å; A344-L348 WeakPolarHBondContact O-CG 3.45Å; A344-L348 PolarHBondContact O-N 3.3Å; Y345-L348 PolarHBondContact O-N 2.8Å; Y345-L348 VanDerWaalsContact O-N 3.09Å; L348-K350 PolarHBondContact O-N 3.33Å; L348-K351 PolarHBondContact O-N 3.23Å; L348-P352 HydrophobicContact CD2-CG 4.11Å; L348-L354 HydrophobicContact CD2-CD2 3.53Å; L348-L380 HydrophobicContact CD1-CD2 4.37Å; L348-L380 HydrophobicContact CD2-CD2 3.94Å; L348-F383 HydrophobicContact CB-CD1 4.34Å; L348-F383 HydrophobicContact CB-CD2 3.78Å; L348-F383 HydrophobicContact CB-CE1 4.25Å; L348-F383 HydrophobicContact CB-CE2 3.67Å; L348-F383 HydrophobicContact CB-CG 4.12Å; L348-F383 HydrophobicContact CB-CZ 3.92Å; L348-F383 HydrophobicContact CD1-CD2 3.86Å; L348-F383 HydrophobicContact CD1-CE2 4.15Å; L348-F383 HydrophobicContact CD2-CB 4.23Å; L348-F383 HydrophobicContact CD2-CD2 4.27Å; L348-F383 HydrophobicContact CD2-CG 4.27Å; L348-F383 HydrophobicContact CG-CD2 4.18Å; L348-F383 HydrophobicContact CG-CE2 4.45Å
349	E	92.3	Very high	92.3	Very high	110 Å²	110	58.9 Å²	58.9	51%	0.514	28%	0.281	S	S	.	.	H	α-helix	trans	-54.3	-38.9	174.4	-174.5	-180	-171.8	0	0	111.8	Y345 K351	Y345-E349 PolarHBondContact O-N 3.12Å; E349-K351 PolarHBondContact O-N 3.12Å
350	K	90.5	Very high	92.1	Very high	73 Å²	73	60.1 Å²	60.1	32%	0.317	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	7.1	177.4	-56.3	-70	-174.1	171	0	114.4	L315 D316 I321 L347 L348	L315-K350 HydrophobicContact CB-CG 4.39Å; L315-K350 HydrophobicContact CD1-CG 4.26Å; D316-K350 IonicContact OD1-NZ 3.31Å; D316-K350 PolarHBondContact OD1-NZ 2.83Å; I321-K350 HydrophobicContact CD1-CB 3.56Å; I321-K350 VanDerWaalsContact CD1-O 3.3Å; I321-K350 WeakPolarHBondContact CD1-O 3.4Å; I321-K350 HydrophobicContact CG1-CB 4.49Å; L347-K350 PolarHBondContact O-N 2.99Å; L348-K350 PolarHBondContact O-N 3.33Å
351	K	89.7	Confident	91.8	Very high	182 Å²	182	57.2 Å²	57.2	79%	0.791	27%	0.272	S	S	*	.			trans	56.8	66.3	175.2	-60	177	-175.9	171.8	0	114.9	L348 E349	L348-K351 PolarHBondContact O-N 3.23Å; E349-K351 PolarHBondContact O-N 3.12Å
352	P	91.2	Very high	91.8	Very high	15 Å²	15	54.6 Å²	54.6	10%	0.097	26%	0.258	C	S	.	.			trans	-75.7	161.5	178	32.9	-30.5	0	0	0	111.3	I321 L332 L347 L348 L354	I321-P352 HydrophobicContact CG2-CB 3.92Å; L332-P352 HydrophobicContact CD2-CG 3.96Å; L347-P352 VanDerWaalsContact O-CD 3.23Å; L347-P352 WeakPolarHBondContact O-CD 3.48Å; L347-P352 WeakPolarHBondContact O-CG 3.19Å; L348-P352 HydrophobicContact CD2-CG 4.11Å; P352-L354 HydrophobicContact CG-CD2 3.97Å; P352-L354 PolarHBondContact O-N 3.09Å; P352-L354 VanDerWaalsContact O-N 3.11Å
353	N	92	Very high	91.8	Very high	77 Å²	77	49 Å²	49	41%	0.412	23%	0.228	S	C	.	.			trans	-77.7	100.6	176.3	-176.5	-4.4	0	0	0	111.1	N322 E355 L356	N322-N353 WeakPolarHBondContact OD1-CB 3.22Å; N322-N353 PolarHBondContact OD1-N 3.03Å; N353-E355 PolarHBondContact O-N 2.78Å; N353-E355 VanDerWaalsContact O-N 3.15Å; N353-E355 PolarHBondContact OD1-N 2.84Å; N353-E355 VanDerWaalsContact OD1-N 3.1Å; N353-L356 HydrophobicContact CB-CD1 3.9Å; N353-L356 HydrophobicContact CB-CG 3.9Å; N353-L356 PolarHBondContact O-N 2.75Å
354	L	92.2	Very high	91.8	Very high	18 Å²	18	48.8 Å²	48.8	9%	0.094	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-6.1	-177.5	-51.6	-178	0	0	0	114.5	L332 L348 P352 P364 L380 F383 A385	L332-L354 HydrophobicContact CD2-CD2 3.71Å; L348-L354 HydrophobicContact CD2-CD2 3.53Å; P352-L354 HydrophobicContact CG-CD2 3.97Å; P352-L354 PolarHBondContact O-N 3.09Å; P352-L354 VanDerWaalsContact O-N 3.11Å; L354-P364 WeakPolarHBondContact O-CD 3.32Å; L354-L380 HydrophobicContact CD2-CD2 4.08Å; L354-F383 HydrophobicContact CD1-CB 4.12Å; L354-F383 WeakPolarHBondContact CD1-O 3.22Å; L354-A385 HydrophobicContact CB-CB 4.15Å; L354-A385 HydrophobicContact CD1-CB 3.96Å
355	E	89.6	Confident	91.8	Very high	58 Å²	58	48.9 Å²	48.9	27%	0.271	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	1.6	-177.4	-54.6	-73.9	125.3	0	0	112.5	N353 K386	N353-E355 PolarHBondContact O-N 2.78Å; N353-E355 VanDerWaalsContact O-N 3.15Å; N353-E355 PolarHBondContact OD1-N 2.84Å; N353-E355 VanDerWaalsContact OD1-N 3.1Å; E355-K386 WeakPolarHBondContact OE1-CB 3.48Å; E355-K386 WeakPolarHBondContact OE1-CG 3.36Å; E355-K386 PolarHBondContact OE1-N 3.19Å; E355-K386 VanDerWaalsContact OE1-N 3.14Å; E355-K386 VanDerWaalsContact OE2-CD 3.28Å; E355-K386 WeakPolarHBondContact OE2-CD 3.43Å; E355-K386 IonicContact OE2-NZ 2.81Å; E355-K386 PolarHBondContact OE2-NZ 3.2Å
356	L	92.3	Very high	91.8	Very high	43 Å²	43	43.6 Å²	43.6	23%	0.225	21%	0.207	C	C	.	.			trans	-65.9	139	171.4	-71.1	174.1	0	0	0	110.9	N322 T330 H333 N353	N322-L356 HydrophobicContact CB-CD1 3.84Å; T330-L356 HydrophobicContact CG2-CB 4.12Å; T330-L356 HydrophobicContact CG2-CD1 3.8Å; H333-L356 PolarHBondContact CE1-O 2.98Å; N353-L356 HydrophobicContact CB-CD1 3.9Å; N353-L356 HydrophobicContact CB-CG 3.9Å; N353-L356 PolarHBondContact O-N 2.75Å
357	K	91.9	Very high	91.8	Very high	86 Å²	86	45.6 Å²	45.6	37%	0.374	21%	0.214	S	C	.	.			trans	-113.2	138.7	-173.6	-71.8	166.3	165.8	-92.9	0	112.6	G361 E362 T363 V390	K357-G361 WeakPolarHBondContact CG-O 3.46Å; K357-G361 PolarHBondContact NZ-O 3.06Å; K357-E362 VanDerWaalsContact CA-O 3.25Å; K357-E362 WeakPolarHBondContact CA-O 3.21Å; K357-T363 HydrophobicContact CG-CG2 4.09Å; K357-V390 PolarHBondContact NZ-O 2.82Å
358	N	91.7	Very high	91.8	Very high	16 Å²	16	45.6 Å²	45.6	9%	0.086	21%	0.214	C	C	.	.			trans	-72.7	-179.3	166.7	70.5	4.1	0	0	0	111.6	R329 D360 G361 E362	R329-N358 HydrophobicContact CG-CB 4.35Å; N358-D360 VanDerWaalsContact C-N 3.26Å; N358-D360 PolarHBondContact O-N 2.89Å; N358-D360 WeakPolarHBondContact OD1-CA 3.08Å; N358-D360 WeakPolarHBondContact OD1-CB 3.19Å; N358-D360 PolarHBondContact OD1-N 3.1Å; N358-D360 VanDerWaalsContact OD1-N 3.08Å; N358-G361 PolarHBondContact O-N 3.22Å; N358-G361 PolarHBondContact OD1-N 3.09Å; N358-G361 VanDerWaalsContact OD1-N 3.11Å; N358-E362 PolarHBondContact N-O 3.09Å; N358-E362 VanDerWaalsContact N-O 3.08Å; N358-E362 PolarHBondContact ND2-OE2 2.94Å; N358-E362 WeakPolarHBondContact OD1-CB 3.39Å; N358-E362 PolarHBondContact OD1-N 3.06Å; N358-E362 PolarHBondContact OD1-O 2.9Å
359	K	90.5	Very high	91.7	Very high	125 Å²	125	45.5 Å²	45.5	54%	0.543	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-36	174.6	-82.1	176.3	-175.4	169	0	114	S326 E327 K328 G361 N392	S326-K359 WeakPolarHBondContact O-CE 3.5Å; S326-K359 PolarHBondContact O-NZ 2.99Å; E327-K359 WeakPolarHBondContact O-CG 3.27Å; E327-K359 PolarHBondContact O-N 3.12Å; E327-K359 VanDerWaalsContact O-N 3.07Å; K328-K359 HydrophobicContact CG-CG 4.48Å; K359-G361 PolarHBondContact O-N 3.48Å; K359-N392 PolarHBondContact O-ND2 2.91Å; K359-N392 VanDerWaalsContact O-ND2 3.12Å
360	D	87.4	Confident	91.7	Very high	84 Å²	84	44.4 Å²	44.4	45%	0.449	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-5.9	178.1	-66.3	-3.4	0	0	0	112.9	N358 E362 K370 N392	N358-D360 VanDerWaalsContact C-N 3.26Å; N358-D360 PolarHBondContact O-N 2.89Å; N358-D360 WeakPolarHBondContact OD1-CA 3.08Å; N358-D360 WeakPolarHBondContact OD1-CB 3.19Å; N358-D360 PolarHBondContact OD1-N 3.1Å; N358-D360 VanDerWaalsContact OD1-N 3.08Å; D360-E362 VanDerWaalsContact C-N 3.29Å; D360-E362 HydrophobicContact CB-CG 3.87Å; D360-K370 IonicContact OD2-NZ 2.78Å; D360-K370 PolarHBondContact OD2-NZ 3.09Å; D360-N392 VanDerWaalsContact O-CB 3.3Å; D360-N392 WeakPolarHBondContact O-CB 3.43Å; D360-N392 PolarHBondContact O-N 3.39Å; D360-N392 PolarHBondContact O-ND2 3.27Å; D360-N392 VanDerWaalsContact O-ND2 3.12Å
361	G	87.7	Confident	91.6	Very high	4 Å²	4	42.6 Å²	42.6	4%	0.041	20%	0.203	C	C	.	.	S	Bend	trans	80.5	8.5	-176.4	0	0	0	0	0	113.4	K357 N358 K359	K357-G361 WeakPolarHBondContact CG-O 3.46Å; K357-G361 PolarHBondContact NZ-O 3.06Å; N358-G361 PolarHBondContact O-N 3.22Å; N358-G361 PolarHBondContact OD1-N 3.09Å; N358-G361 VanDerWaalsContact OD1-N 3.11Å; K359-G361 PolarHBondContact O-N 3.48Å
362	E	91.4	Very high	91.7	Very high	5 Å²	5	40.8 Å²	40.8	2%	0.023	19%	0.191	C	C	.	.			trans	-80.6	138.9	-178.9	-54.9	177.5	157.6	0	0	110.7	H333 K357 N358 D360 L366 R367 K370 D391	H333-E362 PolarHBondContact NE2-O 3.01Å; K357-E362 VanDerWaalsContact CA-O 3.25Å; K357-E362 WeakPolarHBondContact CA-O 3.21Å; N358-E362 PolarHBondContact N-O 3.09Å; N358-E362 VanDerWaalsContact N-O 3.08Å; N358-E362 PolarHBondContact ND2-OE2 2.94Å; N358-E362 WeakPolarHBondContact OD1-CB 3.39Å; N358-E362 PolarHBondContact OD1-N 3.06Å; N358-E362 PolarHBondContact OD1-O 2.9Å; D360-E362 VanDerWaalsContact C-N 3.29Å; D360-E362 HydrophobicContact CB-CG 3.87Å; E362-L366 HydrophobicContact CB-CB 4.04Å; E362-R367 WeakPolarHBondContact OE2-CD 3.21Å; E362-K370 WeakPolarHBondContact OE1-CD 3.38Å; E362-K370 VanDerWaalsContact OE1-CE 3.28Å; E362-K370 WeakPolarHBondContact OE1-CE 3.36Å; E362-K370 IonicContact OE1-NZ 2.68Å; E362-K370 PolarHBondContact OE1-NZ 3.41Å; E362-K370 IonicContact OE2-NZ 2.7Å; E362-D391 HydrophobicContact CG-CB 4.29Å
363	T	93.7	Very high	91.7	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.012	20%	0.2	C	C	.	.			trans	-85.2	166.6	163.9	60.7	0	0	0	0	109.9	K357 L365 L366 R367 A389	K357-T363 HydrophobicContact CG-CG2 4.09Å; T363-L365 PolarHBondContact O-N 3.16Å; T363-L365 VanDerWaalsContact O-N 3.11Å; T363-L366 PolarHBondContact O-N 3.13Å; T363-L366 PolarHBondContact OG1-N 3.42Å; T363-R367 PolarHBondContact O-N 3.08Å; T363-A389 HydrophobicContact CG2-CB 4.1Å
364	P	94.1	Very high	91.6	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-49.4	-37	172.6	-30.7	36.9	0	0	0	113.9	L332 H333 I336 L354 R367 A368 L380	L332-P364 HydrophobicContact CD2-CB 4Å; L332-P364 HydrophobicContact CD2-CG 3.96Å; L332-P364 HydrophobicContact CG-CB 4.2Å; L332-P364 HydrophobicContact CG-CG 4.33Å; H333-P364 VanDerWaalsContact CE1-CD 3.49Å; H333-P364 WeakPolarHBondContact CE1-CD 3.28Å; I336-P364 HydrophobicContact CD1-CB 3.68Å; L354-P364 WeakPolarHBondContact O-CD 3.32Å; P364-R367 PolarHBondContact O-N 3.22Å; P364-A368 WeakPolarHBondContact O-CB 3.47Å; P364-A368 PolarHBondContact O-N 3.37Å; P364-L380 HydrophobicContact CB-CD1 4.24Å; P364-L380 HydrophobicContact CB-CD2 4.01Å
365	L	94.1	Very high	91.6	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-68.9	-42.5	178	-177.4	63.6	0	0	0	112.6	T363 R367 A368 A369 C377 L380 M381 A385 L387	T363-L365 PolarHBondContact O-N 3.16Å; T363-L365 VanDerWaalsContact O-N 3.11Å; L365-R367 VanDerWaalsContact C-N 3.34Å; L365-A368 PolarHBondContact O-N 3.37Å; L365-A369 WeakPolarHBondContact O-CB 3.36Å; L365-A369 PolarHBondContact O-N 2.65Å; L365-C377 HydrophobicContact CD1-CB 4.32Å; L365-L380 HydrophobicContact CB-CD1 4.47Å; L365-L380 HydrophobicContact CD1-CB 4.04Å; L365-L380 HydrophobicContact CD1-CD1 4.47Å; L365-M381 HydrophobicContact CD1-CG 4.27Å; L365-A385 HydrophobicContact CB-CB 4.07Å; L365-A385 HydrophobicContact CD2-CB 3.99Å; L365-L387 HydrophobicContact CD2-CD2 4Å; L365-L387 HydrophobicContact CD2-CG 4.27Å
366	L	93.9	Very high	91.7	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-65.1	-40.1	174.4	-67.6	169.4	0	0	0	110.8	E362 T363 A369 K370 A389 D391 A397 L400	E362-L366 HydrophobicContact CB-CB 4.04Å; T363-L366 PolarHBondContact O-N 3.13Å; T363-L366 PolarHBondContact OG1-N 3.42Å; L366-A369 PolarHBondContact O-N 3.36Å; L366-K370 WeakPolarHBondContact O-CB 3.45Å; L366-K370 PolarHBondContact O-N 3.22Å; L366-A389 HydrophobicContact CD1-CB 4.44Å; L366-D391 HydrophobicContact CD1-CB 4.26Å; L366-A397 HydrophobicContact CD2-CB 4.29Å; L366-L400 HydrophobicContact CB-CD1 4.12Å; L366-L400 HydrophobicContact CD2-CD1 3.83Å; L366-L400 WeakPolarHBondContact O-CD1 3.32Å
367	R	93.7	Very high	91.7	Very high	53 Å²	53	41.5 Å²	41.5	20%	0.2	19%	0.191	C	C	.	.	H	α-helix	trans	-64.3	-45	176	-168.8	69	-169.4	127.1	12.9	112	I336 D337 E362 T363 P364 L365 A369 K370 C371	I336-R367 HydrophobicContact CG2-CB 4.5Å; I336-R367 HydrophobicContact CG2-CG 4.19Å; D337-R367 IonicContact OD1-CZ 3.36Å; D337-R367 IonicContact OD1-NE 2.74Å; D337-R367 PolarHBondContact OD1-NE 2.96Å; D337-R367 IonicContact OD1-NH2 3.06Å; D337-R367 PolarHBondContact OD1-NH2 2.92Å; E362-R367 WeakPolarHBondContact OE2-CD 3.21Å; T363-R367 PolarHBondContact O-N 3.08Å; P364-R367 PolarHBondContact O-N 3.22Å; L365-R367 VanDerWaalsContact C-N 3.34Å; R367-A369 VanDerWaalsContact C-N 3.32Å; R367-A369 PolarHBondContact O-N 2.85Å; R367-K370 PolarHBondContact O-N 3.25Å; R367-C371 PolarHBondContact O-N 3.32Å; R367-C371 PolarHBondContact O-SG 3.2Å; R367-C371 VanDerWaalsContact O-SG 3.41Å
368	A	93.8	Very high	91.7	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.5	-37.7	175.2	0	0	0	0	0	112.3	I336 P364 L365 C371 R372 H373 L376 L380	I336-A368 HydrophobicContact CG2-CB 3.89Å; P364-A368 WeakPolarHBondContact O-CB 3.47Å; P364-A368 PolarHBondContact O-N 3.37Å; L365-A368 PolarHBondContact O-N 3.37Å; A368-C371 CarbonylContact O-C 3.45Å; A368-C371 PolarHBondContact O-N 3.32Å; A368-R372 PolarHBondContact O-N 2.81Å; A368-H373 PolarHBondContact O-N 3.32Å; A368-L376 HydrophobicContact CB-CB 4.16Å; A368-L380 HydrophobicContact CB-CD1 3.84Å
369	A	92.6	Very high	91.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.8	-43.8	173.7	0	0	0	0	0	112.2	L365 L366 R367 C371 R372 A397 L400 L409	L365-A369 WeakPolarHBondContact O-CB 3.36Å; L365-A369 PolarHBondContact O-N 2.65Å; L366-A369 PolarHBondContact O-N 3.36Å; R367-A369 VanDerWaalsContact C-N 3.32Å; R367-A369 PolarHBondContact O-N 2.85Å; A369-C371 PolarHBondContact O-N 3.39Å; A369-R372 WeakPolarHBondContact O-CA 3.47Å; A369-R372 PolarHBondContact O-N 3.24Å; A369-A397 HydrophobicContact CB-CB 4.48Å; A369-L400 HydrophobicContact CB-CB 4.25Å; A369-L400 HydrophobicContact CB-CD1 4.42Å; A369-L409 HydrophobicContact CB-CD2 4.2Å
370	K	91.7	Very high	91.7	Very high	87 Å²	87	37.5 Å²	37.5	38%	0.378	18%	0.176	S	C	.	.	H	α-helix	trans	-61.4	-40.2	175.1	-172.8	169.6	175	-172.4	0	112	D360 E362 L366 R367 R372	D360-K370 IonicContact OD2-NZ 2.78Å; D360-K370 PolarHBondContact OD2-NZ 3.09Å; E362-K370 WeakPolarHBondContact OE1-CD 3.38Å; E362-K370 VanDerWaalsContact OE1-CE 3.28Å; E362-K370 WeakPolarHBondContact OE1-CE 3.36Å; E362-K370 IonicContact OE1-NZ 2.68Å; E362-K370 PolarHBondContact OE1-NZ 3.41Å; E362-K370 IonicContact OE2-NZ 2.7Å; L366-K370 WeakPolarHBondContact O-CB 3.45Å; L366-K370 PolarHBondContact O-N 3.22Å; R367-K370 PolarHBondContact O-N 3.25Å; K370-R372 VanDerWaalsContact C-N 3.26Å; K370-R372 PolarHBondContact O-N 3.09Å
371	C	89.5	Confident	91.8	Very high	35 Å²	35	35.1 Å²	35.1	24%	0.236	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-2.3	172.6	-61.9	0	0	0	0	114.1	R367 A368 A369 H373	R367-C371 PolarHBondContact O-N 3.32Å; R367-C371 PolarHBondContact O-SG 3.2Å; R367-C371 VanDerWaalsContact O-SG 3.41Å; A368-C371 CarbonylContact O-C 3.45Å; A368-C371 PolarHBondContact O-N 3.32Å; A369-C371 PolarHBondContact O-N 3.39Å; C371-H373 VanDerWaalsContact C-N 3.25Å; C371-H373 VanDerWaalsContact CB-CD2 3.42Å; C371-H373 WeakPolarHBondContact CB-CD2 3.4Å; C371-H373 PolarHBondContact O-N 3.15Å
372	R	90.5	Very high	91.9	Very high	144 Å²	144	39.3 Å²	39.3	54%	0.543	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	19.9	178.1	-48.4	179.2	-176	-167.5	-5.4	115.2	A368 A369 K370 V374 A404	A368-R372 PolarHBondContact O-N 2.81Å; A369-R372 WeakPolarHBondContact O-CA 3.47Å; A369-R372 PolarHBondContact O-N 3.24Å; K370-R372 VanDerWaalsContact C-N 3.26Å; K370-R372 PolarHBondContact O-N 3.09Å; R372-V374 PolarHBondContact O-N 2.89Å; R372-V374 VanDerWaalsContact O-N 3.09Å; R372-A404 HydrophobicContact CG-CB 4.09Å; R372-A404 PolarHBondContact NH1-O 2.87Å
373	H	91.4	Very high	91.7	Very high	59 Å²	59	42.9 Å²	42.9	27%	0.273	21%	0.206	S	C	.	.			trans	-82.4	86.2	-176	-66.6	-46.8	0	0	0	112.6	A368 C371 H375 L376 C377	A368-H373 PolarHBondContact O-N 3.32Å; C371-H373 VanDerWaalsContact C-N 3.25Å; C371-H373 VanDerWaalsContact CB-CD2 3.42Å; C371-H373 WeakPolarHBondContact CB-CD2 3.4Å; C371-H373 PolarHBondContact O-N 3.15Å; H373-H375 VanDerWaalsContact C-N 3.32Å; H373-H375 PolarHBondContact O-N 3.26Å; H373-L376 HydrophobicContact CB-CB 3.97Å; H373-L376 HydrophobicContact CB-CD1 3.79Å; H373-L376 HydrophobicContact CB-CG 4.17Å; H373-L376 PolarHBondContact O-N 3.08Å; H373-L376 VanDerWaalsContact O-N 3.13Å; H373-C377 PolarHBondContact O-N 2.86Å
374	V	90.7	Very high	91.4	Very high	35 Å²	35	45.4 Å²	45.4	21%	0.212	23%	0.233	C	C	.	.	H	α-helix	trans	-51.2	-45.5	-177.7	-173.7	0	0	0	0	112.9	R372 L376 C377 T378 R408 L409 A412	R372-V374 PolarHBondContact O-N 2.89Å; R372-V374 VanDerWaalsContact O-N 3.09Å; V374-L376 PolarHBondContact O-N 3.39Å; V374-C377 WeakPolarHBondContact O-CB 3.14Å; V374-C377 PolarHBondContact O-N 2.71Å; V374-T378 PolarHBondContact O-N 2.69Å; V374-T378 PolarHBondContact O-OG1 2.81Å; V374-R408 HydrophobicContact CG2-CB 4.11Å; V374-L409 HydrophobicContact CG2-CB 4.02Å; V374-L409 HydrophobicContact CG2-CD1 4.28Å; V374-L409 HydrophobicContact CG2-CG 4.36Å; V374-A412 HydrophobicContact CG1-CB 4.14Å
375	H	91.3	Very high	91.1	Very high	130 Å²	130	45.8 Å²	45.8	60%	0.602	24%	0.236	S	C	*	.	H	α-helix	trans	-63.3	-42	-179.4	-65.6	-72.5	0	0	0	113	H373 T378 Y379	H373-H375 VanDerWaalsContact C-N 3.32Å; H373-H375 PolarHBondContact O-N 3.26Å; H375-T378 WeakPolarHBondContact CA-OG1 3.42Å; H375-T378 PolarHBondContact O-N 3.34Å; H375-T378 PolarHBondContact O-OG1 3.19Å; H375-Y379 PolarHBondContact O-N 3.01Å
376	L	92.7	Very high	90.8	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-67	-39.5	175.9	-69.6	172.3	0	0	0	111.3	I336 N341 A344 A368 H373 V374 Y379 L380	I336-L376 HydrophobicContact CB-CD1 4.33Å; I336-L376 HydrophobicContact CG1-CD1 4.11Å; I336-L376 HydrophobicContact CG2-CD1 4.31Å; N341-L376 WeakPolarHBondContact OD1-CG 3.23Å; A344-L376 HydrophobicContact CB-CD2 3.56Å; A368-L376 HydrophobicContact CB-CB 4.16Å; H373-L376 HydrophobicContact CB-CB 3.97Å; H373-L376 HydrophobicContact CB-CD1 3.79Å; H373-L376 HydrophobicContact CB-CG 4.17Å; H373-L376 PolarHBondContact O-N 3.08Å; H373-L376 VanDerWaalsContact O-N 3.13Å; V374-L376 PolarHBondContact O-N 3.39Å; L376-Y379 PolarHBondContact O-N 3.07Å; L376-L380 WeakPolarHBondContact O-CB 3.47Å; L376-L380 WeakPolarHBondContact O-CD1 3.08Å; L376-L380 WeakPolarHBondContact O-CG 3.5Å; L376-L380 PolarHBondContact O-N 3.25Å
377	C	92	Very high	90.5	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-58.2	-47.1	170.2	-68.3	0	0	0	0	111.7	L365 H373 V374 Y379 L380 M381	L365-C377 HydrophobicContact CD1-CB 4.32Å; H373-C377 PolarHBondContact O-N 2.86Å; V374-C377 WeakPolarHBondContact O-CB 3.14Å; V374-C377 PolarHBondContact O-N 2.71Å; C377-Y379 PolarHBondContact O-N 3.06Å; C377-L380 PolarHBondContact O-N 3.45Å; C377-M381 WeakPolarHBondContact O-CB 3.44Å; C377-M381 VanDerWaalsContact O-CG 3.27Å; C377-M381 WeakPolarHBondContact O-CG 3.39Å; C377-M381 PolarHBondContact O-N 3.07Å
378	T	91	Very high	90.1	Very high	54 Å²	54	52.3 Å²	52.3	33%	0.331	28%	0.276	S	S	.	.	H	α-helix	trans	-65.3	-37.7	179.1	48.4	0	0	0	0	113.1	V374 H375 S382 A412	V374-T378 PolarHBondContact O-N 2.69Å; V374-T378 PolarHBondContact O-OG1 2.81Å; H375-T378 WeakPolarHBondContact CA-OG1 3.42Å; H375-T378 PolarHBondContact O-N 3.34Å; H375-T378 PolarHBondContact O-OG1 3.19Å; T378-S382 PolarHBondContact O-N 2.83Å; T378-S382 PolarHBondContact O-OG 3.12Å; T378-A412 HydrophobicContact CG2-CB 4.02Å
379	Y	91	Very high	89.9	Confident	87 Å²	87	53 Å²	53	34%	0.341	28%	0.281	S	S	.	.	H	α-helix	trans	-63.7	-51.2	173	-68.7	-17.1	0	0	0	110.9	Y345 H375 L376 C377 M381 S382 F383	Y345-Y379 HydrophobicContact CD2-CE2 4.47Å; H375-Y379 PolarHBondContact O-N 3.01Å; L376-Y379 PolarHBondContact O-N 3.07Å; C377-Y379 PolarHBondContact O-N 3.06Å; Y379-M381 VanDerWaalsContact C-N 3.27Å; Y379-M381 PolarHBondContact O-N 3.44Å; Y379-S382 WeakPolarHBondContact CA-OG 3.48Å; Y379-S382 PolarHBondContact O-N 2.71Å; Y379-S382 PolarHBondContact O-OG 3.44Å; Y379-F383 WeakPolarHBondContact O-CD2 3.48Å; Y379-F383 PolarHBondContact O-N 3.11Å
380	L	92.6	Very high	89.7	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-57.6	-38.8	178.4	-70.7	164.6	0	0	0	112.4	L332 I336 L348 L354 P364 L365 A368 L376 C377 F383 G384 A385	L332-L380 HydrophobicContact CD2-CD2 4.08Å; I336-L380 HydrophobicContact CD1-CD1 3.91Å; L348-L380 HydrophobicContact CD1-CD2 4.37Å; L348-L380 HydrophobicContact CD2-CD2 3.94Å; L354-L380 HydrophobicContact CD2-CD2 4.08Å; P364-L380 HydrophobicContact CB-CD1 4.24Å; P364-L380 HydrophobicContact CB-CD2 4.01Å; L365-L380 HydrophobicContact CB-CD1 4.47Å; L365-L380 HydrophobicContact CD1-CB 4.04Å; L365-L380 HydrophobicContact CD1-CD1 4.47Å; A368-L380 HydrophobicContact CB-CD1 3.84Å; L376-L380 WeakPolarHBondContact O-CB 3.47Å; L376-L380 WeakPolarHBondContact O-CD1 3.08Å; L376-L380 WeakPolarHBondContact O-CG 3.5Å; L376-L380 PolarHBondContact O-N 3.25Å; C377-L380 PolarHBondContact O-N 3.45Å; L380-F383 PolarHBondContact O-N 3.07Å; L380-G384 PolarHBondContact O-N 3.28Å; L380-G384 VanDerWaalsContact O-N 3.17Å; L380-A385 HydrophobicContact CB-CB 4.08Å; L380-A385 VanDerWaalsContact O-CB 3.25Å; L380-A385 WeakPolarHBondContact O-CB 3.27Å; L380-A385 PolarHBondContact O-N 3.4Å
381	M	89.1	Confident	89.6	Confident	34 Å²	34	51.9 Å²	51.9	17%	0.167	28%	0.282	C	S	.	.	H	α-helix	trans	-65	-44.5	172.5	-73.2	171	64.1	0	0	112.2	L365 C377 Y379 F383 G384 L387 A412 L413	L365-M381 HydrophobicContact CD1-CG 4.27Å; C377-M381 WeakPolarHBondContact O-CB 3.44Å; C377-M381 VanDerWaalsContact O-CG 3.27Å; C377-M381 WeakPolarHBondContact O-CG 3.39Å; C377-M381 PolarHBondContact O-N 3.07Å; Y379-M381 VanDerWaalsContact C-N 3.27Å; Y379-M381 PolarHBondContact O-N 3.44Å; M381-F383 VanDerWaalsContact C-N 3.27Å; M381-F383 PolarHBondContact O-N 3.09Å; M381-G384 PolarHBondContact O-N 3Å; M381-L387 HydrophobicContact CE-CD1 3.98Å; M381-L387 HydrophobicContact CG-CD2 4.43Å; M381-L387 HydrophobicContact SD-CD2 4.19Å; M381-A412 WeakPolarHBondContact CE-O 3.13Å; M381-L413 HydrophobicContact SD-CD2 3.89Å
382	S	88.6	Confident	89.5	Confident	91 Å²	91	54.6 Å²	54.6	64%	0.636	29%	0.294	S	S	*	.	H	α-helix	trans	-65.3	-28	177.5	67.6	0	0	0	0	113.9	T378 Y379 G384	T378-S382 PolarHBondContact O-N 2.83Å; T378-S382 PolarHBondContact O-OG 3.12Å; Y379-S382 WeakPolarHBondContact CA-OG 3.48Å; Y379-S382 PolarHBondContact O-N 2.71Å; Y379-S382 PolarHBondContact O-OG 3.44Å; S382-G384 VanDerWaalsContact C-N 3.34Å
383	F	88.5	Confident	89.1	Confident	80 Å²	80	50.4 Å²	50.4	35%	0.351	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	2.1	172	-75.9	-80.7	0	0	0	113.5	Y345 L348 L354 Y379 L380 M381	Y345-F383 HydrophobicContact CD2-CE2 4.49Å; Y345-F383 HydrophobicContact CE2-CE2 4.36Å; Y345-F383 HydrophobicContact CE2-CZ 4.42Å; L348-F383 HydrophobicContact CB-CD1 4.34Å; L348-F383 HydrophobicContact CB-CD2 3.78Å; L348-F383 HydrophobicContact CB-CE1 4.25Å; L348-F383 HydrophobicContact CB-CE2 3.67Å; L348-F383 HydrophobicContact CB-CG 4.12Å; L348-F383 HydrophobicContact CB-CZ 3.92Å; L348-F383 HydrophobicContact CD1-CD2 3.86Å; L348-F383 HydrophobicContact CD1-CE2 4.15Å; L348-F383 HydrophobicContact CD2-CB 4.23Å; L348-F383 HydrophobicContact CD2-CD2 4.27Å; L348-F383 HydrophobicContact CD2-CG 4.27Å; L348-F383 HydrophobicContact CG-CD2 4.18Å; L348-F383 HydrophobicContact CG-CE2 4.45Å; L354-F383 HydrophobicContact CD1-CB 4.12Å; L354-F383 WeakPolarHBondContact CD1-O 3.22Å; Y379-F383 WeakPolarHBondContact O-CD2 3.48Å; Y379-F383 PolarHBondContact O-N 3.11Å; L380-F383 PolarHBondContact O-N 3.07Å; M381-F383 VanDerWaalsContact C-N 3.27Å; M381-F383 PolarHBondContact O-N 3.09Å
384	G	86	Confident	88.7	Confident	55 Å²	55	47.9 Å²	47.9	57%	0.567	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.4	19.8	168.1	0	0	0	0	0	117.3	L380 M381 S382	L380-G384 PolarHBondContact O-N 3.28Å; L380-G384 VanDerWaalsContact O-N 3.17Å; M381-G384 PolarHBondContact O-N 3Å; S382-G384 VanDerWaalsContact C-N 3.34Å
385	A	89.7	Confident	88.6	Confident	9 Å²	9	46.4 Å²	46.4	7%	0.074	27%	0.267	C	S	.	.			trans	-63.1	137.9	175.5	0	0	0	0	0	112.5	L354 L365 L380 L387	L354-A385 HydrophobicContact CB-CB 4.15Å; L354-A385 HydrophobicContact CD1-CB 3.96Å; L365-A385 HydrophobicContact CB-CB 4.07Å; L365-A385 HydrophobicContact CD2-CB 3.99Å; L380-A385 HydrophobicContact CB-CB 4.08Å; L380-A385 VanDerWaalsContact O-CB 3.25Å; L380-A385 WeakPolarHBondContact O-CB 3.27Å; L380-A385 PolarHBondContact O-N 3.4Å; A385-L387 PolarHBondContact O-N 3.36Å
386	K	87.7	Confident	88.6	Confident	125 Å²	125	40.3 Å²	40.3	54%	0.543	24%	0.238	S	C	.	.			trans	-80.6	114.5	-172.9	-63.5	177.2	-153.2	146.6	0	113.1	E355 A388 A389	E355-K386 WeakPolarHBondContact OE1-CB 3.48Å; E355-K386 WeakPolarHBondContact OE1-CG 3.36Å; E355-K386 PolarHBondContact OE1-N 3.19Å; E355-K386 VanDerWaalsContact OE1-N 3.14Å; E355-K386 VanDerWaalsContact OE2-CD 3.28Å; E355-K386 WeakPolarHBondContact OE2-CD 3.43Å; E355-K386 IonicContact OE2-NZ 2.81Å; E355-K386 PolarHBondContact OE2-NZ 3.2Å; K386-A388 PolarHBondContact O-N 2.93Å; K386-A389 VanDerWaalsContact O-CB 3.23Å; K386-A389 WeakPolarHBondContact O-CB 3.28Å; K386-A389 PolarHBondContact O-N 3.13Å
387	L	86.5	Confident	88.5	Confident	18 Å²	18	40.2 Å²	40.2	9%	0.094	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-25.5	171.1	-71.7	161.2	0	0	0	113.8	L365 M381 A385 A389 A397 L413 D419 L422	L365-L387 HydrophobicContact CD2-CD2 4Å; L365-L387 HydrophobicContact CD2-CG 4.27Å; M381-L387 HydrophobicContact CE-CD1 3.98Å; M381-L387 HydrophobicContact CG-CD2 4.43Å; M381-L387 HydrophobicContact SD-CD2 4.19Å; A385-L387 PolarHBondContact O-N 3.36Å; L387-A389 VanDerWaalsContact C-N 3.28Å; L387-A389 PolarHBondContact O-N 3.46Å; L387-A397 HydrophobicContact CD2-CB 4.33Å; L387-L413 HydrophobicContact CD2-CB 4.18Å; L387-L413 HydrophobicContact CD2-CD2 3.41Å; L387-L413 VanDerWaalsContact CD2-CD2 3.41Å; L387-L413 HydrophobicContact CD2-CG 4.29Å; L387-D419 HydrophobicContact CD1-CB 4.13Å; L387-D419 WeakPolarHBondContact CD1-OD2 3.3Å; L387-L422 HydrophobicContact CB-CD1 4.03Å
388	A	85.8	Confident	88.5	Confident	51 Å²	51	40.3 Å²	40.3	42%	0.421	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-0.6	176.6	0	0	0	0	0	114.3	K386 L422	K386-A388 PolarHBondContact O-N 2.93Å; A388-L422 HydrophobicContact CB-CD2 4.25Å
389	A	88.6	Confident	88.5	Confident	14 Å²	14	37.8 Å²	37.8	12%	0.116	22%	0.223	C	C	.	.			trans	-65.1	142.7	171	0	0	0	0	0	110.7	T363 L366 K386 L387 N396	T363-A389 HydrophobicContact CG2-CB 4.1Å; L366-A389 HydrophobicContact CD1-CB 4.44Å; K386-A389 VanDerWaalsContact O-CB 3.23Å; K386-A389 WeakPolarHBondContact O-CB 3.28Å; K386-A389 PolarHBondContact O-N 3.13Å; L387-A389 VanDerWaalsContact C-N 3.28Å; L387-A389 PolarHBondContact O-N 3.46Å; A389-N396 WeakPolarHBondContact O-CA 3.37Å
390	V	89.5	Confident	88.5	Confident	47 Å²	47	34.5 Å²	34.5	29%	0.285	21%	0.211	S	C	.	.	B	Isolated β-bridge	trans	-125.6	150.2	178.6	-65.3	0	0	0	0	111.4	K357 G394 D395 N396	K357-V390 PolarHBondContact NZ-O 2.82Å; V390-G394 WeakPolarHBondContact CG1-O 3.27Å; V390-D395 VanDerWaalsContact CA-O 3.26Å; V390-D395 WeakPolarHBondContact CA-O 3.2Å; V390-N396 HydrophobicContact CG1-CB 4.09Å
391	D	89.1	Confident	88.5	Confident	18 Å²	18	34.4 Å²	34.4	10%	0.096	21%	0.211	C	C	.	.			trans	-79.3	-167.5	175.2	70.2	3.2	0	0	0	113.1	E362 L366 C393 G394 D395	E362-D391 HydrophobicContact CG-CB 4.29Å; L366-D391 HydrophobicContact CD1-CB 4.26Å; D391-C393 VanDerWaalsContact C-N 3.28Å; D391-C393 PolarHBondContact O-N 2.98Å; D391-C393 VanDerWaalsContact OD1-CA 3.27Å; D391-C393 WeakPolarHBondContact OD1-CA 3.41Å; D391-C393 VanDerWaalsContact OD1-CB 3.31Å; D391-C393 WeakPolarHBondContact OD1-CB 3.17Å; D391-C393 PolarHBondContact OD1-N 3.44Å; D391-G394 PolarHBondContact O-N 3.19Å; D391-G394 PolarHBondContact OD1-N 3.11Å; D391-D395 PolarHBondContact N-O 3.13Å; D391-D395 PolarHBondContact OD1-N 3.24Å
392	N	86.5	Confident	88.5	Confident	92 Å²	92	32.8 Å²	32.8	49%	0.492	20%	0.203	S	C	.	.	S	Bend	trans	-68.6	-21.8	174.4	-75.3	-17.5	0	0	0	113.9	K359 D360 K428	K359-N392 PolarHBondContact O-ND2 2.91Å; K359-N392 VanDerWaalsContact O-ND2 3.12Å; D360-N392 VanDerWaalsContact O-CB 3.3Å; D360-N392 WeakPolarHBondContact O-CB 3.43Å; D360-N392 PolarHBondContact O-N 3.39Å; D360-N392 PolarHBondContact O-ND2 3.27Å; D360-N392 VanDerWaalsContact O-ND2 3.12Å; N392-K428 PolarHBondContact O-NZ 2.99Å
393	C	82.5	Confident	88.6	Confident	55 Å²	55	33.8 Å²	33.8	37%	0.372	19%	0.193	S	C	.	.	S	Bend	trans	-82.5	-16.1	173.7	-66.4	0	0	0	0	112.8	D391 K428	D391-C393 VanDerWaalsContact C-N 3.28Å; D391-C393 PolarHBondContact O-N 2.98Å; D391-C393 VanDerWaalsContact OD1-CA 3.27Å; D391-C393 WeakPolarHBondContact OD1-CA 3.41Å; D391-C393 VanDerWaalsContact OD1-CB 3.31Å; D391-C393 WeakPolarHBondContact OD1-CB 3.17Å; D391-C393 PolarHBondContact OD1-N 3.44Å; C393-K428 VanDerWaalsContact O-CB 3.32Å; C393-K428 WeakPolarHBondContact O-CB 3.42Å; C393-K428 WeakPolarHBondContact O-CG 3.35Å; C393-K428 PolarHBondContact O-N 3.26Å
394	G	84.1	Confident	88.5	Confident	7 Å²	7	30.5 Å²	30.5	7%	0.072	18%	0.181	C	C	.	.			trans	88	7.4	-172.3	0	0	0	0	0	113.4	V390 D391 N427	V390-G394 WeakPolarHBondContact CG1-O 3.27Å; D391-G394 PolarHBondContact O-N 3.19Å; D391-G394 PolarHBondContact OD1-N 3.11Å; G394-N427 WeakPolarHBondContact O-CB 3.43Å
395	D	88.1	Confident	88.6	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.021	17%	0.172	C	C	.	.			trans	-75.7	133.6	175.6	-73	-45.5	0	0	0	110.1	V390 D391 H399 L400 R403 N427	V390-D395 VanDerWaalsContact CA-O 3.26Å; V390-D395 WeakPolarHBondContact CA-O 3.2Å; D391-D395 PolarHBondContact N-O 3.13Å; D391-D395 PolarHBondContact OD1-N 3.24Å; D395-H399 HydrophobicContact CB-CB 3.74Å; D395-H399 WeakPolarHBondContact OD1-CB 3.21Å; D395-H399 IonicContact OD1-CD2 3.18Å; D395-H399 PolarHBondContact OD1-CD2 3.12Å; D395-H399 IonicContact OD1-CG 3.67Å; D395-L400 HydrophobicContact CB-CD2 4.34Å; D395-R403 IonicContact OD1-CZ 2.72Å; D395-R403 IonicContact OD1-NH1 3.58Å; D395-R403 IonicContact OD1-NH2 3.17Å; D395-R403 PolarHBondContact OD1-NH2 3.17Å; D395-R403 IonicContact OD2-CZ 2.69Å; D395-R403 VanDerWaalsContact OD2-CZ 3.22Å; D395-R403 IonicContact OD2-NH1 3.52Å; D395-R403 PolarHBondContact OD2-NH1 3.34Å; D395-R403 IonicContact OD2-NH2 2.95Å; D395-R403 PolarHBondContact OD2-NH2 3.37Å; D395-N427 PolarHBondContact OD1-ND2 2.83Å
396	N	90.2	Very high	88.5	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-94.6	177.9	170.4	69.3	27	0	0	0	111.2	A389 V390 L398 H399 L400	A389-N396 WeakPolarHBondContact O-CA 3.37Å; V390-N396 HydrophobicContact CG1-CB 4.09Å; N396-L398 PolarHBondContact O-N 3.01Å; N396-L398 VanDerWaalsContact O-N 3.12Å; N396-L398 WeakPolarHBondContact OD1-CA 3.38Å; N396-L398 WeakPolarHBondContact OD1-CB 3.28Å; N396-L398 PolarHBondContact OD1-N 3.47Å; N396-H399 WeakPolarHBondContact CA-CE1 3.25Å; N396-H399 WeakPolarHBondContact CB-CE1 3.49Å; N396-H399 PolarHBondContact N-CE1 3.22Å; N396-H399 PolarHBondContact N-ND1 2.93Å; N396-H399 PolarHBondContact ND2-CE1 3.24Å; N396-H399 PolarHBondContact ND2-ND1 2.9Å; N396-H399 PolarHBondContact ND2-NE2 2.82Å; N396-H399 VanDerWaalsContact ND2-NE2 3.14Å; N396-H399 WeakPolarHBondContact O-CB 3.48Å; N396-H399 PolarHBondContact O-N 2.9Å; N396-H399 VanDerWaalsContact O-N 3.11Å; N396-H399 CovalentContact OD1-CE1 1.82Å; N396-H399 PolarHBondContact OD1-CE1 2.86Å; N396-H399 PolarHBondContact OD1-N 3.24Å; N396-H399 PolarHBondContact OD1-ND1 3.48Å; N396-L400 PolarHBondContact O-N 3.18Å
397	A	91.9	Very high	88.5	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-57	-31.2	-178.6	0	0	0	0	0	113.7	L366 A369 L387 A401 L413	L366-A397 HydrophobicContact CD2-CB 4.29Å; A369-A397 HydrophobicContact CB-CB 4.48Å; L387-A397 HydrophobicContact CD2-CB 4.33Å; A397-A401 WeakPolarHBondContact O-CB 3.31Å; A397-A401 PolarHBondContact O-N 3.11Å; A397-L413 VanDerWaalsContact C-CD1 3.49Å; A397-L413 HydrophobicContact CB-CD1 3.78Å; A397-L413 HydrophobicContact CB-CD2 4.07Å; A397-L413 VanDerWaalsContact O-CD1 3.29Å; A397-L413 WeakPolarHBondContact O-CD1 3.46Å
398	L	91.6	Very high	88.5	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-76.4	-36.5	178	-69.5	161.7	0	0	0	112.8	N396 L400 A401 L402 T410 L413 L414 L422 L423 P433	N396-L398 PolarHBondContact O-N 3.01Å; N396-L398 VanDerWaalsContact O-N 3.12Å; N396-L398 WeakPolarHBondContact OD1-CA 3.38Å; N396-L398 WeakPolarHBondContact OD1-CB 3.28Å; N396-L398 PolarHBondContact OD1-N 3.47Å; L398-L400 VanDerWaalsContact C-N 3.29Å; L398-L400 PolarHBondContact O-N 3.22Å; L398-A401 PolarHBondContact O-N 3.08Å; L398-L402 WeakPolarHBondContact O-CB 3.43Å; L398-L402 PolarHBondContact O-N 2.82Å; L398-T410 HydrophobicContact CD2-CG2 4.36Å; L398-L413 HydrophobicContact CD2-CB 3.63Å; L398-L413 HydrophobicContact CD2-CD1 3.87Å; L398-L413 HydrophobicContact CD2-CG 4.44Å; L398-L413 HydrophobicContact CG-CB 4.28Å; L398-L413 HydrophobicContact CG-CD1 4.14Å; L398-L414 HydrophobicContact CD1-CD2 3.85Å; L398-L414 HydrophobicContact CD2-CD1 4.4Å; L398-L414 HydrophobicContact CD2-CD2 3.68Å; L398-L414 HydrophobicContact CD2-CG 3.75Å; L398-L414 HydrophobicContact CG-CD2 4.44Å; L398-L422 HydrophobicContact CD1-CB 3.7Å; L398-L422 HydrophobicContact CD1-CD1 4.39Å; L398-L423 HydrophobicContact CD1-CD2 4.18Å; L398-L423 HydrophobicContact CD2-CD2 4.4Å; L398-P433 HydrophobicContact CB-CB 4.17Å; L398-P433 HydrophobicContact CB-CG 4.17Å
399	H	91.2	Very high	88.7	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-56.8	-47.5	170	-68.7	80	0	0	0	109.8	D395 N396 R403 R425 P433 I436	D395-H399 HydrophobicContact CB-CB 3.74Å; D395-H399 WeakPolarHBondContact OD1-CB 3.21Å; D395-H399 IonicContact OD1-CD2 3.18Å; D395-H399 PolarHBondContact OD1-CD2 3.12Å; D395-H399 IonicContact OD1-CG 3.67Å; N396-H399 WeakPolarHBondContact CA-CE1 3.25Å; N396-H399 WeakPolarHBondContact CB-CE1 3.49Å; N396-H399 PolarHBondContact N-CE1 3.22Å; N396-H399 PolarHBondContact N-ND1 2.93Å; N396-H399 PolarHBondContact ND2-CE1 3.24Å; N396-H399 PolarHBondContact ND2-ND1 2.9Å; N396-H399 PolarHBondContact ND2-NE2 2.82Å; N396-H399 VanDerWaalsContact ND2-NE2 3.14Å; N396-H399 WeakPolarHBondContact O-CB 3.48Å; N396-H399 PolarHBondContact O-N 2.9Å; N396-H399 VanDerWaalsContact O-N 3.11Å; N396-H399 CovalentContact OD1-CE1 1.82Å; N396-H399 PolarHBondContact OD1-CE1 2.86Å; N396-H399 PolarHBondContact OD1-N 3.24Å; N396-H399 PolarHBondContact OD1-ND1 3.48Å; H399-R403 WeakPolarHBondContact O-CB 3.34Å; H399-R403 PolarHBondContact O-N 2.99Å; H399-R425 PolarHBondContact NE2-O 2.76Å; H399-P433 VanDerWaalsContact CE1-CG 3.48Å; H399-P433 WeakPolarHBondContact CE1-CG 3.3Å; H399-P433 WeakPolarHBondContact ND1-CG 3.36Å; H399-I436 HydrophobicContact CB-CD1 4.21Å
400	L	90.8	Very high	88.8	Confident	17 Å²	17	38.4 Å²	38.4	9%	0.089	18%	0.177	C	C	.	.	H	α-helix	trans	-65.1	-42.5	177.8	-61.9	178.9	0	0	0	112	L366 A369 D395 N396 L398 A404	L366-L400 HydrophobicContact CB-CD1 4.12Å; L366-L400 HydrophobicContact CD2-CD1 3.83Å; L366-L400 WeakPolarHBondContact O-CD1 3.32Å; A369-L400 HydrophobicContact CB-CB 4.25Å; A369-L400 HydrophobicContact CB-CD1 4.42Å; D395-L400 HydrophobicContact CB-CD2 4.34Å; N396-L400 PolarHBondContact O-N 3.18Å; L398-L400 VanDerWaalsContact C-N 3.29Å; L398-L400 PolarHBondContact O-N 3.22Å; L400-A404 WeakPolarHBondContact O-CB 3.13Å; L400-A404 PolarHBondContact O-N 2.91Å
401	A	91.7	Very high	88.7	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.9	-43.4	-179.9	0	0	0	0	0	113.5	A397 L398 A404 R405 S406 L409 L413	A397-A401 WeakPolarHBondContact O-CB 3.31Å; A397-A401 PolarHBondContact O-N 3.11Å; L398-A401 PolarHBondContact O-N 3.08Å; A401-A404 CarbonylContact O-C 3.52Å; A401-A404 PolarHBondContact O-N 2.88Å; A401-R405 PolarHBondContact O-N 3.32Å; A401-R405 VanDerWaalsContact O-N 3.1Å; A401-S406 PolarHBondContact O-N 3.01Å; A401-L409 HydrophobicContact CB-CD2 3.52Å; A401-L413 HydrophobicContact CB-CD1 3.71Å
402	L	90.5	Very high	88.5	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-76.9	-39.3	179.9	-69	168.2	0	0	0	111.5	L398 A404 R405 T410 L423 P433 I436 D437 I444 L445	L398-L402 WeakPolarHBondContact O-CB 3.43Å; L398-L402 PolarHBondContact O-N 2.82Å; L402-A404 PolarHBondContact O-N 3.1Å; L402-R405 WeakPolarHBondContact O-CA 3.43Å; L402-R405 WeakPolarHBondContact O-CG 3.28Å; L402-R405 PolarHBondContact O-N 2.86Å; L402-T410 HydrophobicContact CD2-CG2 3.86Å; L402-T410 HydrophobicContact CG-CG2 4.27Å; L402-L423 HydrophobicContact CD1-CD2 4.23Å; L402-P433 HydrophobicContact CD1-CB 3.78Å; L402-P433 WeakPolarHBondContact CD1-O 3.47Å; L402-I436 HydrophobicContact CB-CG2 4.26Å; L402-D437 HydrophobicContact CD1-CB 4.27Å; L402-D437 HydrophobicContact CD2-CB 4.17Å; L402-I444 HydrophobicContact CD2-CB 4.23Å; L402-L445 HydrophobicContact CD1-CD1 4.24Å; L402-L445 HydrophobicContact CD1-CD2 4.36Å; L402-L445 HydrophobicContact CD1-CG 4.42Å; L402-L445 HydrophobicContact CD2-CD2 4.33Å; L402-L445 HydrophobicContact CD2-CG 4.28Å
403	R	89.2	Confident	88.6	Confident	112 Å²	112	36.4 Å²	36.4	42%	0.423	16%	0.163	S	C	.	.	H	α-helix	trans	-62.9	-31.3	170	-166	-177	-63.4	144.6	2.2	112.3	D395 H399 R405 I436	D395-R403 IonicContact OD1-CZ 2.72Å; D395-R403 IonicContact OD1-NH1 3.58Å; D395-R403 IonicContact OD1-NH2 3.17Å; D395-R403 PolarHBondContact OD1-NH2 3.17Å; D395-R403 IonicContact OD2-CZ 2.69Å; D395-R403 VanDerWaalsContact OD2-CZ 3.22Å; D395-R403 IonicContact OD2-NH1 3.52Å; D395-R403 PolarHBondContact OD2-NH1 3.34Å; D395-R403 IonicContact OD2-NH2 2.95Å; D395-R403 PolarHBondContact OD2-NH2 3.37Å; H399-R403 WeakPolarHBondContact O-CB 3.34Å; H399-R403 PolarHBondContact O-N 2.99Å; R403-R405 VanDerWaalsContact C-N 3.28Å; R403-I436 HydrophobicContact CB-CG2 4.19Å
404	A	86.8	Confident	88.8	Confident	12 Å²	12	34.7 Å²	34.7	10%	0.099	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-7.1	171	0	0	0	0	0	114.2	R372 L400 A401 L402 S406	R372-A404 HydrophobicContact CG-CB 4.09Å; R372-A404 PolarHBondContact NH1-O 2.87Å; L400-A404 WeakPolarHBondContact O-CB 3.13Å; L400-A404 PolarHBondContact O-N 2.91Å; A401-A404 CarbonylContact O-C 3.52Å; A401-A404 PolarHBondContact O-N 2.88Å; L402-A404 PolarHBondContact O-N 3.1Å; A404-S406 VanDerWaalsContact C-N 3.28Å; A404-S406 PolarHBondContact O-N 3.49Å
405	R	88	Confident	88.5	Confident	100 Å²	100	38.1 Å²	38.1	38%	0.377	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	38.2	-176.3	-62.9	-168.1	77.8	-176.6	-6.8	114.6	A401 L402 R403 N440 Q442 I444	A401-R405 PolarHBondContact O-N 3.32Å; A401-R405 VanDerWaalsContact O-N 3.1Å; L402-R405 WeakPolarHBondContact O-CA 3.43Å; L402-R405 WeakPolarHBondContact O-CG 3.28Å; L402-R405 PolarHBondContact O-N 2.86Å; R403-R405 VanDerWaalsContact C-N 3.28Å; R405-N440 VanDerWaalsContact CD-OD1 3.29Å; R405-N440 WeakPolarHBondContact CD-OD1 3.35Å; R405-N440 PolarHBondContact NE-OD1 3.08Å; R405-N440 PolarHBondContact NH1-OD1 2.85Å; R405-Q442 PolarHBondContact NH2-O 2.9Å; R405-I444 VanDerWaalsContact C-CD1 3.42Å; R405-I444 HydrophobicContact CB-CD1 3.71Å; R405-I444 HydrophobicContact CG-CD1 4.18Å; R405-I444 WeakPolarHBondContact O-CD1 3.12Å
406	S	88.3	Confident	87.5	Confident	25 Å²	25	41.4 Å²	41.4	18%	0.175	19%	0.191	C	C	.	.			trans	-99.6	90	-173.4	-171.7	0	0	0	0	113	A401 A404 R408 L409 T410	A401-S406 PolarHBondContact O-N 3.01Å; A404-S406 VanDerWaalsContact C-N 3.28Å; A404-S406 PolarHBondContact O-N 3.49Å; S406-R408 VanDerWaalsContact C-N 3.33Å; S406-R408 PolarHBondContact O-N 2.86Å; S406-L409 PolarHBondContact O-N 3.11Å; S406-L409 WeakPolarHBondContact OG-CB 3.37Å; S406-T410 PolarHBondContact O-N 3.1Å; S406-T410 PolarHBondContact O-OG1 3.45Å
407	R	87.1	Confident	86.2	Confident	122 Å²	122	46.5 Å²	46.5	46%	0.46	22%	0.224	S	C	.	.	H	α-helix	trans	-50	-47.1	-178.9	-170.7	174.5	77	91.8	-3.5	113.6	L409 T410 Q411 I444 I448	R407-L409 VanDerWaalsContact C-N 3.31Å; R407-L409 PolarHBondContact O-N 3.39Å; R407-T410 PolarHBondContact O-N 3Å; R407-Q411 VanDerWaalsContact O-CB 3.26Å; R407-Q411 WeakPolarHBondContact O-CB 3.39Å; R407-Q411 PolarHBondContact O-N 3.15Å; R407-I444 HydrophobicContact CB-CG2 3.78Å; R407-I444 HydrophobicContact CG-CG2 3.84Å; R407-I448 HydrophobicContact CG-CD1 4.12Å; R407-I448 HydrophobicContact CG-CG1 3.8Å
408	R	88	Confident	85	Confident	190 Å²	190	49.7 Å²	49.7	72%	0.717	25%	0.246	S	C	*	.	H	α-helix	trans	-63.5	-35	178.7	-71.9	-176.3	179.1	168.5	-0.2	112.6	V374 S406 A412	V374-R408 HydrophobicContact CG2-CB 4.11Å; S406-R408 VanDerWaalsContact C-N 3.33Å; S406-R408 PolarHBondContact O-N 2.86Å; R408-A412 WeakPolarHBondContact O-CB 3.26Å; R408-A412 PolarHBondContact O-N 3.49Å
409	L	90.1	Very high	84	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-76.2	-45.9	-180	-157.5	148.1	0	0	0	110.4	A369 V374 A401 S406 R407 Q411 A412 L413	A369-L409 HydrophobicContact CB-CD2 4.2Å; V374-L409 HydrophobicContact CG2-CB 4.02Å; V374-L409 HydrophobicContact CG2-CD1 4.28Å; V374-L409 HydrophobicContact CG2-CG 4.36Å; A401-L409 HydrophobicContact CB-CD2 3.52Å; S406-L409 PolarHBondContact O-N 3.11Å; S406-L409 WeakPolarHBondContact OG-CB 3.37Å; R407-L409 VanDerWaalsContact C-N 3.31Å; R407-L409 PolarHBondContact O-N 3.39Å; L409-Q411 VanDerWaalsContact C-N 3.3Å; L409-Q411 PolarHBondContact O-N 2.89Å; L409-A412 PolarHBondContact O-N 3.04Å; L409-A412 VanDerWaalsContact O-N 3.11Å; L409-L413 HydrophobicContact CD2-CD1 3.54Å; L409-L413 HydrophobicContact CD2-CD2 4.34Å; L409-L413 HydrophobicContact CD2-CG 3.84Å; L409-L413 WeakPolarHBondContact O-CG 3.15Å; L409-L413 PolarHBondContact O-N 2.93Å
410	T	90.1	Very high	83	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.3	-43.2	172.5	-54.9	0	0	0	0	111.5	L398 L402 S406 R407 A412 L413 L414 L445 I448	L398-T410 HydrophobicContact CD2-CG2 4.36Å; L402-T410 HydrophobicContact CD2-CG2 3.86Å; L402-T410 HydrophobicContact CG-CG2 4.27Å; S406-T410 PolarHBondContact O-N 3.1Å; S406-T410 PolarHBondContact O-OG1 3.45Å; R407-T410 PolarHBondContact O-N 3Å; T410-A412 VanDerWaalsContact C-N 3.34Å; T410-A412 PolarHBondContact O-N 3.12Å; T410-L413 PolarHBondContact O-N 3.36Å; T410-L414 HydrophobicContact CG2-CD1 3.72Å; T410-L414 HydrophobicContact CG2-CG 4.33Å; T410-L414 WeakPolarHBondContact O-CB 3.32Å; T410-L414 VanDerWaalsContact O-CG 3.31Å; T410-L414 WeakPolarHBondContact O-CG 3.23Å; T410-L414 PolarHBondContact O-N 2.91Å; T410-L445 HydrophobicContact CG2-CD2 4.04Å; T410-I448 HydrophobicContact CG2-CD1 3.56Å
411	Q	86.7	Confident	82.2	Confident	97 Å²	97	59.1 Å²	59.1	45%	0.453	29%	0.29	S	S	.	.	H	α-helix	trans	-63.5	-36.1	176	-173.1	178.1	6.7	0	0	112.7	R407 L409 S415 I448	R407-Q411 VanDerWaalsContact O-CB 3.26Å; R407-Q411 WeakPolarHBondContact O-CB 3.39Å; R407-Q411 PolarHBondContact O-N 3.15Å; L409-Q411 VanDerWaalsContact C-N 3.3Å; L409-Q411 PolarHBondContact O-N 2.89Å; Q411-S415 PolarHBondContact O-N 3.23Å; Q411-I448 HydrophobicContact CB-CD1 4.3Å; Q411-I448 HydrophobicContact CB-CG1 4.49Å; Q411-I448 HydrophobicContact CG-CG2 4.5Å
412	A	86	Confident	81.7	Confident	17 Å²	17	60.1 Å²	60.1	14%	0.14	30%	0.295	C	S	.	.	H	α-helix	trans	-70.4	-42	174.5	0	0	0	0	0	112.5	V374 T378 M381 R408 L409 T410 L414 S415	V374-A412 HydrophobicContact CG1-CB 4.14Å; T378-A412 HydrophobicContact CG2-CB 4.02Å; M381-A412 WeakPolarHBondContact CE-O 3.13Å; R408-A412 WeakPolarHBondContact O-CB 3.26Å; R408-A412 PolarHBondContact O-N 3.49Å; L409-A412 PolarHBondContact O-N 3.04Å; L409-A412 VanDerWaalsContact O-N 3.11Å; T410-A412 VanDerWaalsContact C-N 3.34Å; T410-A412 PolarHBondContact O-N 3.12Å; A412-L414 VanDerWaalsContact C-N 3.31Å; A412-L414 PolarHBondContact O-N 3.02Å; A412-S415 WeakPolarHBondContact O-CB 3.18Å; A412-S415 PolarHBondContact O-N 3.46Å; A412-S415 PolarHBondContact O-OG 3.49Å
413	L	88.4	Confident	81.3	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-68.9	-28.2	177.3	-61.4	178.1	0	0	0	112.9	M381 L387 A397 L398 A401 L409 T410	M381-L413 HydrophobicContact SD-CD2 3.89Å; L387-L413 HydrophobicContact CD2-CB 4.18Å; L387-L413 HydrophobicContact CD2-CD2 3.41Å; L387-L413 VanDerWaalsContact CD2-CD2 3.41Å; L387-L413 HydrophobicContact CD2-CG 4.29Å; A397-L413 VanDerWaalsContact C-CD1 3.49Å; A397-L413 HydrophobicContact CB-CD1 3.78Å; A397-L413 HydrophobicContact CB-CD2 4.07Å; A397-L413 VanDerWaalsContact O-CD1 3.29Å; A397-L413 WeakPolarHBondContact O-CD1 3.46Å; L398-L413 HydrophobicContact CD2-CB 3.63Å; L398-L413 HydrophobicContact CD2-CD1 3.87Å; L398-L413 HydrophobicContact CD2-CG 4.44Å; L398-L413 HydrophobicContact CG-CB 4.28Å; L398-L413 HydrophobicContact CG-CD1 4.14Å; A401-L413 HydrophobicContact CB-CD1 3.71Å; L409-L413 HydrophobicContact CD2-CD1 3.54Å; L409-L413 HydrophobicContact CD2-CD2 4.34Å; L409-L413 HydrophobicContact CD2-CG 3.84Å; L409-L413 WeakPolarHBondContact O-CG 3.15Å; L409-L413 PolarHBondContact O-N 2.93Å; T410-L413 PolarHBondContact O-N 3.36Å
414	L	85.8	Confident	80.8	Confident	19 Å²	19	62.7 Å²	62.7	10%	0.099	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	15.4	177.7	-63.4	177.3	0	0	0	113.3	L398 T410 A412 N416 L423 L445 F449	L398-L414 HydrophobicContact CD1-CD2 3.85Å; L398-L414 HydrophobicContact CD2-CD1 4.4Å; L398-L414 HydrophobicContact CD2-CD2 3.68Å; L398-L414 HydrophobicContact CD2-CG 3.75Å; L398-L414 HydrophobicContact CG-CD2 4.44Å; T410-L414 HydrophobicContact CG2-CD1 3.72Å; T410-L414 HydrophobicContact CG2-CG 4.33Å; T410-L414 WeakPolarHBondContact O-CB 3.32Å; T410-L414 VanDerWaalsContact O-CG 3.31Å; T410-L414 WeakPolarHBondContact O-CG 3.23Å; T410-L414 PolarHBondContact O-N 2.91Å; A412-L414 VanDerWaalsContact C-N 3.31Å; A412-L414 PolarHBondContact O-N 3.02Å; L414-N416 PolarHBondContact O-N 3.44Å; L414-L423 HydrophobicContact CD1-CD1 4.13Å; L414-L423 HydrophobicContact CD1-CD2 4.31Å; L414-L423 HydrophobicContact CD2-CD1 4.16Å; L414-L423 HydrophobicContact CD2-CD2 4.22Å; L414-L423 HydrophobicContact CD2-CG 4.14Å; L414-L445 HydrophobicContact CD1-CD2 3.92Å; L414-F449 HydrophobicContact CD1-CE2 3.85Å; L414-F449 HydrophobicContact CD1-CZ 3.85Å
415	S	77.5	Confident	80.4	Confident	80 Å²	80	68 Å²	68	56%	0.559	32%	0.324	S	S	*	.	S	Bend	trans	-64.7	-24.4	-179.6	68.7	0	0	0	0	113.6	Q411 A412	Q411-S415 PolarHBondContact O-N 3.23Å; A412-S415 WeakPolarHBondContact O-CB 3.18Å; A412-S415 PolarHBondContact O-N 3.46Å; A412-S415 PolarHBondContact O-OG 3.49Å
416	N	66.7	Low	80	Confident	72 Å²	72	66.7 Å²	66.7	39%	0.385	33%	0.328	S	S	.	.	S	Bend	trans	-100.9	131.8	172	-44.2	-53.6	0	0	0	109.8	L414 S418 D419	L414-N416 PolarHBondContact O-N 3.44Å; N416-S418 PolarHBondContact O-N 2.68Å; N416-D419 WeakPolarHBondContact CB-OD2 3.47Å; N416-D419 PolarHBondContact ND2-OD2 3.3Å; N416-D419 PolarHBondContact O-N 3.23Å; N416-D419 VanDerWaalsContact O-N 3.11Å
417	P	64	Low	79.5	Confident	109 Å²	109	66 Å²	66	71%	0.708	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-66.1	-21.2	179.9	26.3	-34.4	0	0	0	113.4	D419 S420	P417-D419 PolarHBondContact O-N 3Å; P417-S420 WeakPolarHBondContact O-CB 3.39Å; P417-S420 PolarHBondContact O-OG 3.31Å
418	S	66.1	Low	79	Confident	67 Å²	67	65.8 Å²	65.8	47%	0.469	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-57.4	-35.9	172.3	50.4	0	0	0	0	112.9	N416 S420 R421	N416-S418 PolarHBondContact O-N 2.68Å; S418-S420 VanDerWaalsContact C-N 3.33Å; S418-S420 PolarHBondContact O-N 3.4Å; S418-R421 WeakPolarHBondContact O-CB 3.26Å; S418-R421 WeakPolarHBondContact O-CG 3.47Å; S418-R421 PolarHBondContact O-N 3.37Å
419	D	70.4	Confident	78.2	Confident	28 Å²	28	59.7 Å²	59.7	15%	0.15	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-88.1	-12	-164.7	-53	-21.4	0	0	0	111	L387 N416 P417 R421 L422	L387-D419 HydrophobicContact CD1-CB 4.13Å; L387-D419 WeakPolarHBondContact CD1-OD2 3.3Å; N416-D419 WeakPolarHBondContact CB-OD2 3.47Å; N416-D419 PolarHBondContact ND2-OD2 3.3Å; N416-D419 PolarHBondContact O-N 3.23Å; N416-D419 VanDerWaalsContact O-N 3.11Å; P417-D419 PolarHBondContact O-N 3Å; D419-R421 PolarHBondContact O-N 2.93Å; D419-L422 VanDerWaalsContact O-CB 3.29Å; D419-L422 WeakPolarHBondContact O-CB 3.28Å; D419-L422 PolarHBondContact O-N 3.04Å
420	S	71.9	Confident	77.2	Confident	46 Å²	46	62.3 Å²	62.3	32%	0.322	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-53.8	-31.7	165.8	70	0	0	0	0	113.1	P417 S418 L422 L423	P417-S420 WeakPolarHBondContact O-CB 3.39Å; P417-S420 PolarHBondContact O-OG 3.31Å; S418-S420 VanDerWaalsContact C-N 3.33Å; S418-S420 PolarHBondContact O-N 3.4Å; S420-L422 PolarHBondContact O-N 2.95Å; S420-L422 VanDerWaalsContact O-N 3.13Å; S420-L423 VanDerWaalsContact O-CB 3.27Å; S420-L423 WeakPolarHBondContact O-CB 3.38Å; S420-L423 WeakPolarHBondContact O-CG 3.44Å; S420-L423 PolarHBondContact O-N 3.36Å
421	R	73.1	Confident	76.7	Confident	145 Å²	145	66 Å²	66	55%	0.547	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-58	-26.4	176.1	-64.8	178	173.3	-150.3	-1.8	112.5	S418 D419 L423 D465	S418-R421 WeakPolarHBondContact O-CB 3.26Å; S418-R421 WeakPolarHBondContact O-CG 3.47Å; S418-R421 PolarHBondContact O-N 3.37Å; D419-R421 PolarHBondContact O-N 2.93Å; R421-L423 VanDerWaalsContact C-N 3.27Å; R421-L423 PolarHBondContact O-N 2.84Å; R421-D465 IonicContact CZ-OD2 2.8Å; R421-D465 IonicContact NH2-OD2 3.18Å; R421-D465 PolarHBondContact NH2-OD2 3.48Å
422	L	80.2	Confident	76.6	Confident	21 Å²	21	62.7 Å²	62.7	11%	0.11	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-72.3	-16.4	177.5	-63.4	173.2	0	0	0	113.3	L387 A388 L398 D419 S420 Y424 R425 P433	L387-L422 HydrophobicContact CB-CD1 4.03Å; A388-L422 HydrophobicContact CB-CD2 4.25Å; L398-L422 HydrophobicContact CD1-CB 3.7Å; L398-L422 HydrophobicContact CD1-CD1 4.39Å; D419-L422 VanDerWaalsContact O-CB 3.29Å; D419-L422 WeakPolarHBondContact O-CB 3.28Å; D419-L422 PolarHBondContact O-N 3.04Å; S420-L422 PolarHBondContact O-N 2.95Å; S420-L422 VanDerWaalsContact O-N 3.13Å; L422-Y424 PolarHBondContact O-N 3.18Å; L422-R425 PolarHBondContact O-N 2.66Å; L422-P433 WeakPolarHBondContact O-CG 3.43Å
423	L	82.3	Confident	76.6	Confident	8 Å²	8	61.9 Å²	61.9	4%	0.042	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-65.8	-20.5	177.6	-65.9	174.3	0	0	0	113.7	L398 L402 L414 S420 R421 T432 P433 Y434 L445 F449	L398-L423 HydrophobicContact CD1-CD2 4.18Å; L398-L423 HydrophobicContact CD2-CD2 4.4Å; L402-L423 HydrophobicContact CD1-CD2 4.23Å; L414-L423 HydrophobicContact CD1-CD1 4.13Å; L414-L423 HydrophobicContact CD1-CD2 4.31Å; L414-L423 HydrophobicContact CD2-CD1 4.16Å; L414-L423 HydrophobicContact CD2-CD2 4.22Å; L414-L423 HydrophobicContact CD2-CG 4.14Å; S420-L423 VanDerWaalsContact O-CB 3.27Å; S420-L423 WeakPolarHBondContact O-CB 3.38Å; S420-L423 WeakPolarHBondContact O-CG 3.44Å; S420-L423 PolarHBondContact O-N 3.36Å; R421-L423 VanDerWaalsContact C-N 3.27Å; R421-L423 PolarHBondContact O-N 2.84Å; L423-T432 WeakPolarHBondContact O-CB 3.42Å; L423-P433 HydrophobicContact CD2-CB 4.03Å; L423-P433 VanDerWaalsContact O-CD 3.29Å; L423-P433 WeakPolarHBondContact O-CD 3.39Å; L423-Y434 WeakPolarHBondContact O-CB 3.32Å; L423-Y434 PolarHBondContact O-N 3.42Å; L423-L445 HydrophobicContact CD1-CD2 4.17Å; L423-L445 HydrophobicContact CD2-CD1 4.32Å; L423-L445 HydrophobicContact CD2-CD2 4.05Å; L423-F449 HydrophobicContact CD1-CE2 4.41Å
424	Y	79.3	Confident	76.3	Confident	157 Å²	157	66.9 Å²	66.9	62%	0.616	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-105.2	-1.6	179.1	-57.2	-75.7	0	0	0	113.3	L422 P426 T432 Y434	L422-Y424 PolarHBondContact O-N 3.18Å; Y424-P426 WeakPolarHBondContact O-CD 3.5Å; Y424-T432 VanDerWaalsContact O-CG2 3.26Å; Y424-T432 WeakPolarHBondContact O-CG2 3.47Å; Y424-Y434 HydrophobicContact CE1-CG 4.42Å
425	R	78.7	Confident	76.3	Confident	123 Å²	123	68 Å²	68	46%	0.464	36%	0.36	S	S	.	.			trans	-82.4	120.3	179.9	-173.5	177.3	-175.3	-178.6	2.5	110.2	H399 L422 P433	H399-R425 PolarHBondContact NE2-O 2.76Å; L422-R425 PolarHBondContact O-N 2.66Å; R425-P433 WeakPolarHBondContact O-CD 3.35Å
426	P	78.7	Confident	76.7	Confident	73 Å²	73	64.8 Å²	64.8	47%	0.474	34%	0.336	S	S	.	.			trans	-73.5	148.4	178.9	29.5	-34.7	0	0	0	112.5	Y424 Q431 T432	Y424-P426 WeakPolarHBondContact O-CD 3.5Å; P426-Q431 CarbonylContact C-O 3.59Å; P426-Q431 VanDerWaalsContact CA-O 3.32Å; P426-Q431 WeakPolarHBondContact CA-O 3.44Å; P426-T432 HydrophobicContact CB-CG2 4.27Å
427	N	79.2	Confident	77.6	Confident	12 Å²	12	61.5 Å²	61.5	6%	0.064	32%	0.319	C	S	.	.			trans	-77.2	-174.6	160.6	66.8	15.3	0	0	0	111.2	G394 D395 L429 G430 Q431	G394-N427 WeakPolarHBondContact O-CB 3.43Å; D395-N427 PolarHBondContact OD1-ND2 2.83Å; N427-L429 PolarHBondContact O-N 3.45Å; N427-L429 VanDerWaalsContact O-N 3.15Å; N427-L429 WeakPolarHBondContact OD1-CA 3.24Å; N427-L429 WeakPolarHBondContact OD1-CB 3.39Å; N427-L429 PolarHBondContact OD1-N 3.38Å; N427-G430 PolarHBondContact O-N 3.03Å; N427-G430 PolarHBondContact OD1-N 2.8Å; N427-Q431 PolarHBondContact N-O 3.06Å; N427-Q431 PolarHBondContact OD1-N 3.11Å; N427-Q431 PolarHBondContact OD1-O 3.36Å
428	K	74.9	Confident	78.5	Confident	117 Å²	117	61.7 Å²	61.7	51%	0.509	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.5	179.4	-62	176.8	-177.4	176.4	0	114.3	N392 C393 Y584	N392-K428 PolarHBondContact O-NZ 2.99Å; C393-K428 VanDerWaalsContact O-CB 3.32Å; C393-K428 WeakPolarHBondContact O-CB 3.42Å; C393-K428 WeakPolarHBondContact O-CG 3.35Å; C393-K428 PolarHBondContact O-N 3.26Å; K428-Y584 HydrophobicContact CB-CD1 3.68Å; K428-Y584 HydrophobicContact CB-CE1 3.28Å; K428-Y584 HydrophobicContact CD-CE1 4.38Å; K428-Y584 HydrophobicContact CG-CE1 4.48Å; K428-Y584 WeakPolarHBondContact O-CD1 3.48Å; K428-Y584 WeakPolarHBondContact O-CE1 3.45Å
429	L	71.1	Confident	79.3	Confident	61 Å²	61	63 Å²	63	32%	0.319	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	7.4	175.1	-60.3	168.6	0	0	0	112.1	N427 Q431 N582 Y584	N427-L429 PolarHBondContact O-N 3.45Å; N427-L429 VanDerWaalsContact O-N 3.15Å; N427-L429 WeakPolarHBondContact OD1-CA 3.24Å; N427-L429 WeakPolarHBondContact OD1-CB 3.39Å; N427-L429 PolarHBondContact OD1-N 3.38Å; L429-Q431 HydrophobicContact CB-CG 4.21Å; L429-Q431 PolarHBondContact O-N 3.11Å; L429-N582 HydrophobicContact CD2-CB 4.07Å; L429-Y584 HydrophobicContact CD2-CD1 4.44Å; L429-Y584 HydrophobicContact CD2-CE1 3.51Å; L429-Y584 HydrophobicContact CG-CE1 3.89Å
430	G	70.2	Confident	79.8	Confident	56 Å²	56	63.5 Å²	63.5	58%	0.577	33%	0.325	S	S	*	.	S	Bend	trans	74.4	-1.9	-175.4	0	0	0	0	0	114.5	N427	N427-G430 PolarHBondContact O-N 3.03Å; N427-G430 PolarHBondContact OD1-N 2.8Å
431	Q	78.6	Confident	79.9	Confident	77 Å²	77	67.1 Å²	67.1	36%	0.36	35%	0.347	S	S	.	.			trans	-78.4	126.9	-179.1	-60.1	175.2	-9.5	0	0	109.6	P426 N427 L429 I436	P426-Q431 CarbonylContact C-O 3.59Å; P426-Q431 VanDerWaalsContact CA-O 3.32Å; P426-Q431 WeakPolarHBondContact CA-O 3.44Å; N427-Q431 PolarHBondContact N-O 3.06Å; N427-Q431 PolarHBondContact OD1-N 3.11Å; N427-Q431 PolarHBondContact OD1-O 3.36Å; L429-Q431 HydrophobicContact CB-CG 4.21Å; L429-Q431 PolarHBondContact O-N 3.11Å; Q431-I436 HydrophobicContact CB-CD1 4.42Å; Q431-I436 HydrophobicContact CB-CG1 4.3Å
432	T	84.9	Confident	80.2	Confident	28 Å²	28	67 Å²	67	17%	0.172	35%	0.353	C	S	.	.			trans	-89.7	156.3	168	66.8	0	0	0	0	110.1	L423 Y424 P426 Y434 S435 I436	L423-T432 WeakPolarHBondContact O-CB 3.42Å; Y424-T432 VanDerWaalsContact O-CG2 3.26Å; Y424-T432 WeakPolarHBondContact O-CG2 3.47Å; P426-T432 HydrophobicContact CB-CG2 4.27Å; T432-Y434 PolarHBondContact O-N 2.83Å; T432-S435 PolarHBondContact N-OG 3.1Å; T432-S435 PolarHBondContact O-N 2.78Å; T432-S435 PolarHBondContact O-OG 2.88Å; T432-S435 PolarHBondContact OG1-N 2.72Å; T432-S435 VanDerWaalsContact OG1-N 3.1Å; T432-S435 PolarHBondContact OG1-OG 3.32Å; T432-I436 PolarHBondContact O-N 3.27Å; T432-I436 VanDerWaalsContact O-N 3.1Å
433	P	86.3	Confident	80.2	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-54.8	-37.2	172.8	-25.2	32.4	0	0	0	112.7	L398 H399 L402 L422 L423 R425 S435 I436 D437	L398-P433 HydrophobicContact CB-CB 4.17Å; L398-P433 HydrophobicContact CB-CG 4.17Å; H399-P433 VanDerWaalsContact CE1-CG 3.48Å; H399-P433 WeakPolarHBondContact CE1-CG 3.3Å; H399-P433 WeakPolarHBondContact ND1-CG 3.36Å; L402-P433 HydrophobicContact CD1-CB 3.78Å; L402-P433 WeakPolarHBondContact CD1-O 3.47Å; L422-P433 WeakPolarHBondContact O-CG 3.43Å; L423-P433 HydrophobicContact CD2-CB 4.03Å; L423-P433 VanDerWaalsContact O-CD 3.29Å; L423-P433 WeakPolarHBondContact O-CD 3.39Å; R425-P433 WeakPolarHBondContact O-CD 3.35Å; P433-S435 PolarHBondContact O-N 2.91Å; P433-I436 PolarHBondContact O-N 3.14Å; P433-D437 PolarHBondContact O-N 3.07Å; P433-D437 VanDerWaalsContact O-N 3.11Å
434	Y	83.2	Confident	80.2	Confident	106 Å²	106	68.2 Å²	68.2	42%	0.416	36%	0.362	S	S	.	.	H	α-helix	trans	-59.1	-43.7	173.2	-173.9	-95	0	0	0	112.6	L423 Y424 T432 I436 D437 L438 L445	L423-Y434 WeakPolarHBondContact O-CB 3.32Å; L423-Y434 PolarHBondContact O-N 3.42Å; Y424-Y434 HydrophobicContact CE1-CG 4.42Å; T432-Y434 PolarHBondContact O-N 2.83Å; Y434-I436 VanDerWaalsContact C-N 3.33Å; Y434-I436 PolarHBondContact O-N 3.5Å; Y434-D437 PolarHBondContact O-N 3.22Å; Y434-L438 HydrophobicContact CE1-CD2 4.15Å; Y434-L438 WeakPolarHBondContact O-CB 3.46Å; Y434-L438 PolarHBondContact O-N 2.81Å; Y434-L445 HydrophobicContact CD2-CD1 3.87Å
435	S	84.2	Confident	80.3	Confident	43 Å²	43	61.2 Å²	61.2	30%	0.301	34%	0.335	S	S	.	.	H	α-helix	trans	-67.3	-30.1	176.7	72.1	0	0	0	0	113.6	T432 P433 S439	T432-S435 PolarHBondContact N-OG 3.1Å; T432-S435 PolarHBondContact O-N 2.78Å; T432-S435 PolarHBondContact O-OG 2.88Å; T432-S435 PolarHBondContact OG1-N 2.72Å; T432-S435 VanDerWaalsContact OG1-N 3.1Å; T432-S435 PolarHBondContact OG1-OG 3.32Å; P433-S435 PolarHBondContact O-N 2.91Å; S435-S439 WeakPolarHBondContact O-CB 3.43Å; S435-S439 PolarHBondContact O-N 2.99Å; S435-S439 PolarHBondContact O-OG 3Å
436	I	86.8	Confident	80.1	Confident	12 Å²	12	58.8 Å²	58.8	6%	0.062	34%	0.335	C	S	.	.	H	α-helix	trans	-69.6	-35.4	174.3	-67	173.6	0	0	0	110.5	H399 L402 R403 Q431 T432 P433 Y434 S439 N440	H399-I436 HydrophobicContact CB-CD1 4.21Å; L402-I436 HydrophobicContact CB-CG2 4.26Å; R403-I436 HydrophobicContact CB-CG2 4.19Å; Q431-I436 HydrophobicContact CB-CD1 4.42Å; Q431-I436 HydrophobicContact CB-CG1 4.3Å; T432-I436 PolarHBondContact O-N 3.27Å; T432-I436 VanDerWaalsContact O-N 3.1Å; P433-I436 PolarHBondContact O-N 3.14Å; Y434-I436 VanDerWaalsContact C-N 3.33Å; Y434-I436 PolarHBondContact O-N 3.5Å; I436-S439 PolarHBondContact O-OG 3.23Å; I436-S439 VanDerWaalsContact O-OG 3.12Å; I436-N440 PolarHBondContact O-ND2 3.2Å
437	D	86.3	Confident	79.8	Confident	3 Å²	3	60.7 Å²	60.7	2%	0.016	34%	0.341	C	S	.	.	H	α-helix	trans	-74.4	-44.8	175.8	-160.5	49.8	0	0	0	111.9	L402 P433 Y434 S439 N440 P443 I444 L445	L402-D437 HydrophobicContact CD1-CB 4.27Å; L402-D437 HydrophobicContact CD2-CB 4.17Å; P433-D437 PolarHBondContact O-N 3.07Å; P433-D437 VanDerWaalsContact O-N 3.11Å; Y434-D437 PolarHBondContact O-N 3.22Å; D437-S439 VanDerWaalsContact C-N 3.29Å; D437-S439 PolarHBondContact O-N 3.27Å; D437-N440 WeakPolarHBondContact O-CB 3.49Å; D437-N440 PolarHBondContact O-N 3.3Å; D437-P443 WeakPolarHBondContact OD2-CA 3.48Å; D437-P443 VanDerWaalsContact OD2-CB 3.24Å; D437-P443 WeakPolarHBondContact OD2-CB 3.44Å; D437-I444 WeakPolarHBondContact OD1-CB 3.27Å; D437-I444 PolarHBondContact OD1-N 3.04Å; D437-I444 PolarHBondContact OD2-N 3.43Å; D437-L445 HydrophobicContact CB-CD1 3.95Å; D437-L445 HydrophobicContact CB-CG 4.25Å; D437-L445 WeakPolarHBondContact OD2-CB 3.48Å; D437-L445 VanDerWaalsContact OD2-CG 3.29Å; D437-L445 WeakPolarHBondContact OD2-CG 3.22Å; D437-L445 PolarHBondContact OD2-N 2.97Å
438	L	82.7	Confident	79.5	Confident	112 Å²	112	62 Å²	62	59%	0.586	35%	0.347	S	S	*	.	H	α-helix	trans	-66.6	-25.6	179.8	-171.8	63.8	0	0	0	113.7	Y434 N440	Y434-L438 HydrophobicContact CE1-CD2 4.15Å; Y434-L438 WeakPolarHBondContact O-CB 3.46Å; Y434-L438 PolarHBondContact O-N 2.81Å; L438-N440 PolarHBondContact O-N 3.12Å
439	S	82	Confident	79.2	Confident	94 Å²	94	61.4 Å²	61.4	66%	0.657	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-3	172.8	50.4	0	0	0	0	113.9	S435 I436 D437	S435-S439 WeakPolarHBondContact O-CB 3.43Å; S435-S439 PolarHBondContact O-N 2.99Å; S435-S439 PolarHBondContact O-OG 3Å; I436-S439 PolarHBondContact O-OG 3.23Å; I436-S439 VanDerWaalsContact O-OG 3.12Å; D437-S439 VanDerWaalsContact C-N 3.29Å; D437-S439 PolarHBondContact O-N 3.27Å
440	N	80.9	Confident	78.4	Confident	40 Å²	40	59.8 Å²	59.8	21%	0.214	34%	0.343	C	S	.	.	S	Bend	trans	-96.6	140.7	169.8	-78.1	-91.7	0	0	0	111.1	R405 I436 D437 L438 Q442	R405-N440 VanDerWaalsContact CD-OD1 3.29Å; R405-N440 WeakPolarHBondContact CD-OD1 3.35Å; R405-N440 PolarHBondContact NE-OD1 3.08Å; R405-N440 PolarHBondContact NH1-OD1 2.85Å; I436-N440 PolarHBondContact O-ND2 3.2Å; D437-N440 WeakPolarHBondContact O-CB 3.49Å; D437-N440 PolarHBondContact O-N 3.3Å; L438-N440 PolarHBondContact O-N 3.12Å; N440-Q442 PolarHBondContact O-N 3.25Å
441	P	74.5	Confident	77.2	Confident	121 Å²	121	63.7 Å²	63.7	79%	0.786	36%	0.359	S	S	*	.	S	Bend	trans	-69.7	-1.1	-177.6	29.9	-37.5	0	0	0	114.7
442	Q	78.8	Confident	75.2	Confident	143 Å²	143	65 Å²	65	67%	0.668	37%	0.367	S	S	*	.	S	Bend	trans	-142.9	90.8	171.2	-75.6	-179.4	-21.2	0	0	107.3	R405 N440	R405-Q442 PolarHBondContact NH2-O 2.9Å; N440-Q442 PolarHBondContact O-N 3.25Å
443	P	80.1	Confident	72.9	Confident	43 Å²	43	71.6 Å²	71.6	28%	0.279	40%	0.401	S	S	.	.			trans	-66.8	145.4	179	28.1	-35.4	0	0	0	110.9	D437 P446	D437-P443 WeakPolarHBondContact OD2-CA 3.48Å; D437-P443 VanDerWaalsContact OD2-CB 3.24Å; D437-P443 WeakPolarHBondContact OD2-CB 3.44Å; P443-P446 HydrophobicContact CB-CG 4.2Å; P443-P446 HydrophobicContact CG-CG 3.94Å
444	I	82.4	Confident	70.8	Confident	11 Å²	11	72.5 Å²	72.5	6%	0.056	41%	0.409	C	S	.	.	S	Bend	trans	-93.3	-28.8	-175.3	-59.6	177.8	0	0	0	111.1	L402 R405 R407 D437 L447 I448	L402-I444 HydrophobicContact CD2-CB 4.23Å; R405-I444 VanDerWaalsContact C-CD1 3.42Å; R405-I444 HydrophobicContact CB-CD1 3.71Å; R405-I444 HydrophobicContact CG-CD1 4.18Å; R405-I444 WeakPolarHBondContact O-CD1 3.12Å; R407-I444 HydrophobicContact CB-CG2 3.78Å; R407-I444 HydrophobicContact CG-CG2 3.84Å; D437-I444 WeakPolarHBondContact OD1-CB 3.27Å; D437-I444 PolarHBondContact OD1-N 3.04Å; D437-I444 PolarHBondContact OD2-N 3.43Å; I444-L447 CarbonylContact O-C 3.6Å; I444-L447 WeakPolarHBondContact O-CA 3.19Å; I444-L447 WeakPolarHBondContact O-CB 3.49Å; I444-L447 PolarHBondContact O-N 3.45Å; I444-I448 HydrophobicContact CG2-CD1 3.87Å; I444-I448 HydrophobicContact CG2-CG1 4.34Å; I444-I448 PolarHBondContact O-N 3.43Å
445	L	82	Confident	68.8	Low	10 Å²	10	74.9 Å²	74.9	5%	0.052	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-60.7	-42	179.6	-63.8	170.1	0	0	0	111.9	L402 T410 L414 L423 Y434 D437 L447 I448 F449	L402-L445 HydrophobicContact CD1-CD1 4.24Å; L402-L445 HydrophobicContact CD1-CD2 4.36Å; L402-L445 HydrophobicContact CD1-CG 4.42Å; L402-L445 HydrophobicContact CD2-CD2 4.33Å; L402-L445 HydrophobicContact CD2-CG 4.28Å; T410-L445 HydrophobicContact CG2-CD2 4.04Å; L414-L445 HydrophobicContact CD1-CD2 3.92Å; L423-L445 HydrophobicContact CD1-CD2 4.17Å; L423-L445 HydrophobicContact CD2-CD1 4.32Å; L423-L445 HydrophobicContact CD2-CD2 4.05Å; Y434-L445 HydrophobicContact CD2-CD1 3.87Å; D437-L445 HydrophobicContact CB-CD1 3.95Å; D437-L445 HydrophobicContact CB-CG 4.25Å; D437-L445 WeakPolarHBondContact OD2-CB 3.48Å; D437-L445 VanDerWaalsContact OD2-CG 3.29Å; D437-L445 WeakPolarHBondContact OD2-CG 3.22Å; D437-L445 PolarHBondContact OD2-N 2.97Å; L445-L447 PolarHBondContact O-N 2.8Å; L445-I448 PolarHBondContact O-N 3.13Å; L445-F449 HydrophobicContact CB-CD2 4.45Å; L445-F449 HydrophobicContact CD2-CE2 4.17Å; L445-F449 WeakPolarHBondContact O-CD2 3.15Å; L445-F449 PolarHBondContact O-N 3.02Å
446	P	73.8	Confident	67	Low	72 Å²	72	80.2 Å²	80.2	47%	0.468	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-66.4	-16.4	171.2	-23.1	36.7	0	0	0	114.9	P443 G450	P443-P446 HydrophobicContact CB-CG 4.2Å; P443-P446 HydrophobicContact CG-CG 3.94Å; P446-G450 WeakPolarHBondContact O-CA 3.45Å; P446-G450 PolarHBondContact O-N 3.22Å; P446-G450 VanDerWaalsContact O-N 3.09Å
447	L	73.7	Confident	64.7	Low	114 Å²	114	88 Å²	88	60%	0.597	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-92.1	-0.7	173.2	-61.3	173.7	0	0	0	113.1	I444 L445	I444-L447 CarbonylContact O-C 3.6Å; I444-L447 WeakPolarHBondContact O-CA 3.19Å; I444-L447 WeakPolarHBondContact O-CB 3.49Å; I444-L447 PolarHBondContact O-N 3.45Å; L445-L447 PolarHBondContact O-N 2.8Å
448	I	72.9	Confident	62.5	Low	38 Å²	38	91.2 Å²	91.2	20%	0.195	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-40.7	172.3	-66.5	171.7	0	0	0	109.5	R407 T410 Q411 I444 L445	R407-I448 HydrophobicContact CG-CD1 4.12Å; R407-I448 HydrophobicContact CG-CG1 3.8Å; T410-I448 HydrophobicContact CG2-CD1 3.56Å; Q411-I448 HydrophobicContact CB-CD1 4.3Å; Q411-I448 HydrophobicContact CB-CG1 4.49Å; Q411-I448 HydrophobicContact CG-CG2 4.5Å; I444-I448 HydrophobicContact CG2-CD1 3.87Å; I444-I448 HydrophobicContact CG2-CG1 4.34Å; I444-I448 PolarHBondContact O-N 3.43Å; L445-I448 PolarHBondContact O-N 3.13Å
449	F	67.6	Low	60.4	Low	105 Å²	105	91.7 Å²	91.7	46%	0.461	50%	0.501	S	S	.	.	S	Bend	trans	-106.7	43.8	174.4	-53.1	-68.8	0	0	0	111	L414 L423 L445	L414-F449 HydrophobicContact CD1-CE2 3.85Å; L414-F449 HydrophobicContact CD1-CZ 3.85Å; L423-F449 HydrophobicContact CD1-CE2 4.41Å; L445-F449 HydrophobicContact CB-CD2 4.45Å; L445-F449 HydrophobicContact CD2-CE2 4.17Å; L445-F449 WeakPolarHBondContact O-CD2 3.15Å; L445-F449 PolarHBondContact O-N 3.02Å
450	G	54.9	Low	58.6	Low	28 Å²	28	91.6 Å²	91.6	29%	0.289	50%	0.496	S	S	.	.			trans	-61.4	176	172.8	0	0	0	0	0	111.8	P446 I452	P446-G450 WeakPolarHBondContact O-CA 3.45Å; P446-G450 PolarHBondContact O-N 3.22Å; P446-G450 VanDerWaalsContact O-N 3.09Å; G450-I452 WeakPolarHBondContact O-CG1 3.39Å; G450-I452 PolarHBondContact O-N 3.4Å
451	P	43.7	Very low	56.7	Low	138 Å²	138	93.2 Å²	93.2	90%	0.896	52%	0.515	S	S	*	.	S	Bend	trans	-50.4	111.3	-178.1	22.3	-33.5	0	0	0	109.7
452	I	38.3	Very low	55.3	Low	105 Å²	105	91.7 Å²	91.7	54%	0.538	50%	0.499	S	S	.	.			trans	-88.1	125.4	-164.8	-47.1	176.5	0	0	0	107.8	G450 A454	G450-I452 WeakPolarHBondContact O-CG1 3.39Å; G450-I452 PolarHBondContact O-N 3.4Å; I452-A454 HydrophobicContact CB-CB 3.96Å; I452-A454 HydrophobicContact CG2-CB 3.84Å; I452-A454 WeakPolarHBondContact O-CB 3.06Å; I452-A454 PolarHBondContact O-N 3.01Å
453	D	36.6	Very low	54.1	Low	166 Å²	166	87.2 Å²	87.2	89%	0.888	49%	0.491	S	S	*	.			trans	-66.1	73.3	159.2	-53.4	-46.5	0	0	0	108.2
454	A	40.9	Very low	53	Low	19 Å²	19	87.6 Å²	87.6	16%	0.157	49%	0.487	C	S	.	.			trans	-86.5	-28.8	-152.1	0	0	0	0	0	114.8	I452 D456 K457 M458	I452-A454 HydrophobicContact CB-CB 3.96Å; I452-A454 HydrophobicContact CG2-CB 3.84Å; I452-A454 WeakPolarHBondContact O-CB 3.06Å; I452-A454 PolarHBondContact O-N 3.01Å; A454-D456 PolarHBondContact O-N 3.07Å; A454-K457 PolarHBondContact O-N 2.87Å; A454-K457 VanDerWaalsContact O-N 3.13Å; A454-M458 HydrophobicContact CB-CB 4.37Å; A454-M458 HydrophobicContact CB-CE 4.19Å; A454-M458 HydrophobicContact CB-SD 4.28Å; A454-M458 VanDerWaalsContact O-CB 3.3Å; A454-M458 WeakPolarHBondContact O-CB 3.4Å; A454-M458 PolarHBondContact O-N 3.2Å
455	E	42.9	Very low	51.8	Low	155 Å²	155	89.3 Å²	89.3	72%	0.724	50%	0.496	S	S	*	.	H	α-helix	trans	-64.8	-49.8	-147.6	-57.1	-176	146.1	0	0	111.4	K457	E455-K457 VanDerWaalsContact C-N 3.29Å; E455-K457 PolarHBondContact O-N 3.47Å
456	D	44.5	Very low	50.7	Low	155 Å²	155	91.1 Å²	91.1	83%	0.829	51%	0.508	S	S	*	.	H	α-helix	trans	-63.8	-24.2	179.2	-78.1	-24.1	0	0	0	115.7	A454	A454-D456 PolarHBondContact O-N 3.07Å
457	K	39.4	Very low	50.1	Low	175 Å²	175	93.9 Å²	93.9	76%	0.761	51%	0.51	S	S	*	.	H	α-helix	trans	-114.1	-20.4	-168.2	-74	172.5	-173.7	154.3	0	114.2	A454 E455	A454-K457 PolarHBondContact O-N 2.87Å; A454-K457 VanDerWaalsContact O-N 3.13Å; E455-K457 VanDerWaalsContact C-N 3.29Å; E455-K457 PolarHBondContact O-N 3.47Å
458	M	39.6	Very low	49.9	Very low	71 Å²	71	88.6 Å²	88.6	35%	0.35	48%	0.482	S	S	.	.	H	α-helix	trans	-81.9	-43.1	-178.1	-157.4	141.5	92.5	0	0	111.1	A454 T460 A461 M462	A454-M458 HydrophobicContact CB-CB 4.37Å; A454-M458 HydrophobicContact CB-CE 4.19Å; A454-M458 HydrophobicContact CB-SD 4.28Å; A454-M458 VanDerWaalsContact O-CB 3.3Å; A454-M458 WeakPolarHBondContact O-CB 3.4Å; A454-M458 PolarHBondContact O-N 3.2Å; M458-T460 VanDerWaalsContact C-N 3.3Å; M458-T460 PolarHBondContact O-N 3.48Å; M458-A461 PolarHBondContact O-N 3.47Å; M458-A461 VanDerWaalsContact O-N 3.08Å; M458-M462 HydrophobicContact CB-CG 4.46Å; M458-M462 HydrophobicContact CE-CE 4.39Å; M458-M462 HydrophobicContact CG-CE 3.64Å; M458-M462 HydrophobicContact CG-CG 3.43Å; M458-M462 VanDerWaalsContact CG-CG 3.43Å; M458-M462 HydrophobicContact CG-SD 4.32Å; M458-M462 VanDerWaalsContact O-CG 3.24Å; M458-M462 WeakPolarHBondContact O-CG 3.46Å; M458-M462 PolarHBondContact O-N 2.91Å; M458-M462 HydrophobicContact SD-CE 3.63Å
459	D	39.5	Very low	49.7	Very low	123 Å²	123	90.3 Å²	90.3	66%	0.658	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-24.5	-171.1	-73	5	0	0	0	114.6	A461	D459-A461 VanDerWaalsContact C-N 3.35Å
460	T	44	Very low	49.6	Very low	91 Å²	91	87.4 Å²	87.4	56%	0.558	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-4.5	176.9	55.1	0	0	0	0	114.2	M458	M458-T460 VanDerWaalsContact C-N 3.3Å; M458-T460 PolarHBondContact O-N 3.48Å
461	A	40.9	Very low	50.6	Low	74 Å²	74	86.7 Å²	86.7	61%	0.612	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.4	-25.6	-178.8	0	0	0	0	0	114.7	M458 D459 G463	M458-A461 PolarHBondContact O-N 3.47Å; M458-A461 VanDerWaalsContact O-N 3.08Å; D459-A461 VanDerWaalsContact C-N 3.35Å; A461-G463 PolarHBondContact O-N 3.36Å
462	M	44.7	Very low	52.2	Low	90 Å²	90	80.1 Å²	80.1	44%	0.443	43%	0.429	S	S	.	.			trans	-79.3	52.7	-171.2	-69.1	-62.8	-139.1	0	0	115.1	M458 Y464 V466	M458-M462 HydrophobicContact CB-CG 4.46Å; M458-M462 HydrophobicContact CE-CE 4.39Å; M458-M462 HydrophobicContact CG-CE 3.64Å; M458-M462 HydrophobicContact CG-CG 3.43Å; M458-M462 VanDerWaalsContact CG-CG 3.43Å; M458-M462 HydrophobicContact CG-SD 4.32Å; M458-M462 VanDerWaalsContact O-CG 3.24Å; M458-M462 WeakPolarHBondContact O-CG 3.46Å; M458-M462 PolarHBondContact O-N 2.91Å; M458-M462 HydrophobicContact SD-CE 3.63Å; M462-Y464 PolarHBondContact O-N 3.33Å; M462-V466 HydrophobicContact CB-CG2 4.12Å; M462-V466 HydrophobicContact CE-CG2 3.79Å; M462-V466 HydrophobicContact CG-CG2 4.16Å; M462-V466 HydrophobicContact SD-CG2 3.41Å; M462-V466 WeakPolarHBondContact SD-CG2 3.16Å
463	G	54.2	Low	54	Low	48 Å²	48	78 Å²	78	50%	0.495	42%	0.419	S	S	.	.			trans	-76.7	112.4	-179.4	0	0	0	0	0	114.6	A461 D465	A461-G463 PolarHBondContact O-N 3.36Å; G463-D465 PolarHBondContact O-N 2.88Å
464	Y	57.3	Low	55.9	Low	51 Å²	51	72.3 Å²	72.3	20%	0.2	39%	0.388	C	S	.	.	S	Bend	trans	61.3	-39.1	172.6	-63.9	-54.1	0	0	0	118.5	M462 V466 Y467 S468 S494 L499 L904 L909	M462-Y464 PolarHBondContact O-N 3.33Å; Y464-V466 VanDerWaalsContact C-N 3.33Å; Y464-V466 PolarHBondContact O-N 3.45Å; Y464-Y467 WeakPolarHBondContact O-CB 3.45Å; Y464-Y467 PolarHBondContact O-N 2.71Å; Y464-S468 PolarHBondContact O-N 2.79Å; Y464-S468 PolarHBondContact O-OG 3.44Å; Y464-S494 PolarHBondContact OH-O 3.47Å; Y464-L499 HydrophobicContact CD1-CD1 3.52Å; Y464-L499 HydrophobicContact CE1-CD1 4.15Å; Y464-L499 HydrophobicContact CG-CD1 4.17Å; Y464-L904 HydrophobicContact CD1-CD2 4.44Å; Y464-L904 HydrophobicContact CE1-CB 4.36Å; Y464-L904 HydrophobicContact CE1-CD2 4.21Å; Y464-L909 HydrophobicContact CE2-CD1 4.31Å
465	D	56.9	Low	57.8	Low	47 Å²	47	71.5 Å²	71.5	25%	0.251	38%	0.381	S	S	.	.	H	α-helix	trans	-58.5	-42	-175	-76.2	29.7	0	0	0	112.4	R421 G463 S468 N469 K502	R421-D465 IonicContact CZ-OD2 2.8Å; R421-D465 IonicContact NH2-OD2 3.18Å; R421-D465 PolarHBondContact NH2-OD2 3.48Å; G463-D465 PolarHBondContact O-N 2.88Å; D465-S468 WeakPolarHBondContact CA-OG 3.26Å; D465-S468 PolarHBondContact O-N 2.85Å; D465-S468 PolarHBondContact O-OG 2.79Å; D465-N469 WeakPolarHBondContact O-CB 3.36Å; D465-N469 PolarHBondContact O-N 2.89Å; D465-N469 PolarHBondContact O-OD1 3.03Å; D465-K502 WeakPolarHBondContact OD1-CD 3.48Å; D465-K502 WeakPolarHBondContact OD1-CE 3.39Å; D465-K502 IonicContact OD1-NZ 3.08Å; D465-K502 PolarHBondContact OD1-NZ 2.89Å
466	V	57.6	Low	59.5	Low	48 Å²	48	65.1 Å²	65.1	29%	0.291	35%	0.353	S	S	.	.	H	α-helix	trans	-65.5	-41	176.5	-177	0	0	0	0	111.3	M462 Y464 N469 V470	M462-V466 HydrophobicContact CB-CG2 4.12Å; M462-V466 HydrophobicContact CE-CG2 3.79Å; M462-V466 HydrophobicContact CG-CG2 4.16Å; M462-V466 HydrophobicContact SD-CG2 3.41Å; M462-V466 WeakPolarHBondContact SD-CG2 3.16Å; Y464-V466 VanDerWaalsContact C-N 3.33Å; Y464-V466 PolarHBondContact O-N 3.45Å; V466-N469 PolarHBondContact O-N 2.97Å; V466-V470 HydrophobicContact CG1-CG2 4.22Å; V466-V470 WeakPolarHBondContact O-CG2 3.29Å; V466-V470 PolarHBondContact O-N 3.29Å
467	Y	62.9	Low	61	Low	131 Å²	131	62.6 Å²	62.6	51%	0.514	34%	0.337	S	S	.	.	H	α-helix	trans	-63.6	-43.5	176.8	-80.7	-87.5	0	0	0	111.7	Y464 N469 L471	Y464-Y467 WeakPolarHBondContact O-CB 3.45Å; Y464-Y467 PolarHBondContact O-N 2.71Å; Y467-N469 VanDerWaalsContact C-N 3.32Å; Y467-N469 PolarHBondContact O-N 3.2Å; Y467-L471 WeakPolarHBondContact O-CB 3.39Å; Y467-L471 PolarHBondContact O-N 3Å
468	S	69.5	Low	62.4	Low	2 Å²	2	56.9 Å²	56.9	1%	0.014	32%	0.317	C	S	.	.	H	α-helix	trans	-64.2	-36.5	174.4	43.7	0	0	0	0	112.5	Y464 D465 A472 L503	Y464-S468 PolarHBondContact O-N 2.79Å; Y464-S468 PolarHBondContact O-OG 3.44Å; D465-S468 WeakPolarHBondContact CA-OG 3.26Å; D465-S468 PolarHBondContact O-N 2.85Å; D465-S468 PolarHBondContact O-OG 2.79Å; S468-A472 WeakPolarHBondContact O-CB 3.43Å; S468-A472 PolarHBondContact O-N 2.97Å; S468-L503 WeakPolarHBondContact O-CD1 3.45Å
469	N	67.3	Low	63.9	Low	74 Å²	74	57.4 Å²	57.4	40%	0.396	33%	0.328	S	S	.	.	H	α-helix	trans	-72.3	-44.1	179.5	-69.2	-4.8	0	0	0	112.4	D465 V466 Y467 L471 A472 D473 A506 F510	D465-N469 WeakPolarHBondContact O-CB 3.36Å; D465-N469 PolarHBondContact O-N 2.89Å; D465-N469 PolarHBondContact O-OD1 3.03Å; V466-N469 PolarHBondContact O-N 2.97Å; Y467-N469 VanDerWaalsContact C-N 3.32Å; Y467-N469 PolarHBondContact O-N 3.2Å; N469-L471 VanDerWaalsContact C-N 3.35Å; N469-A472 PolarHBondContact O-N 3.34Å; N469-D473 WeakPolarHBondContact O-CB 3.43Å; N469-D473 PolarHBondContact O-N 3.37Å; N469-A506 WeakPolarHBondContact OD1-CB 3.31Å; N469-F510 HydrophobicContact CB-CE2 4.26Å
470	V	65.6	Low	65.5	Low	44 Å²	44	53.4 Å²	53.4	27%	0.267	31%	0.306	S	S	.	.	H	α-helix	trans	-66.6	-37.8	176.5	173.5	0	0	0	0	111.2	V466 I474 P988	V466-V470 HydrophobicContact CG1-CG2 4.22Å; V466-V470 WeakPolarHBondContact O-CG2 3.29Å; V466-V470 PolarHBondContact O-N 3.29Å; V470-I474 HydrophobicContact CG1-CD1 4.16Å; V470-I474 VanDerWaalsContact O-CG1 3.31Å; V470-I474 WeakPolarHBondContact O-CG1 3.24Å; V470-I474 PolarHBondContact O-N 3.41Å; V470-I474 VanDerWaalsContact O-N 3.11Å; V470-P988 HydrophobicContact CG1-CB 4.29Å; V470-P988 HydrophobicContact CG2-CB 4.42Å
471	L	75.4	Confident	67.1	Low	13 Å²	13	53.6 Å²	53.6	7%	0.068	31%	0.312	C	S	.	.	H	α-helix	trans	-67.5	-42.4	174.7	-178	57.6	0	0	0	111.7	Y467 N469 I474 V475 I486 L488 L503 F902	Y467-L471 WeakPolarHBondContact O-CB 3.39Å; Y467-L471 PolarHBondContact O-N 3Å; N469-L471 VanDerWaalsContact C-N 3.35Å; L471-I474 PolarHBondContact O-N 3.07Å; L471-V475 HydrophobicContact CD1-CG2 4.17Å; L471-V475 WeakPolarHBondContact O-CB 3.34Å; L471-V475 WeakPolarHBondContact O-CG2 3.43Å; L471-V475 PolarHBondContact O-N 2.88Å; L471-I486 HydrophobicContact CD1-CD1 4.42Å; L471-L488 HydrophobicContact CD2-CD2 3.9Å; L471-L503 HydrophobicContact CB-CD1 4.06Å; L471-L503 HydrophobicContact CD2-CD1 3.91Å; L471-L503 HydrophobicContact CD2-CD2 3.69Å; L471-L503 HydrophobicContact CD2-CG 4.48Å; L471-L503 HydrophobicContact CG-CD1 3.92Å; L471-L503 HydrophobicContact CG-CD2 4.44Å; L471-F902 HydrophobicContact CD1-CD2 4.3Å; L471-F902 HydrophobicContact CD1-CE1 4.43Å; L471-F902 HydrophobicContact CD1-CE2 3.54Å; L471-F902 HydrophobicContact CD1-CZ 3.62Å
472	A	77.9	Confident	68.9	Low	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.4	-45.6	174.4	0	0	0	0	0	111.7	S468 N469 I474 V475 C476 L503 A506 M507 F510	S468-A472 WeakPolarHBondContact O-CB 3.43Å; S468-A472 PolarHBondContact O-N 2.97Å; N469-A472 PolarHBondContact O-N 3.34Å; A472-I474 PolarHBondContact O-N 2.77Å; A472-V475 CarbonylContact O-C 3.59Å; A472-V475 PolarHBondContact O-N 3.49Å; A472-V475 VanDerWaalsContact O-N 3.08Å; A472-C476 WeakPolarHBondContact O-CB 3.36Å; A472-C476 PolarHBondContact O-N 3.41Å; A472-C476 PolarHBondContact O-SG 2.93Å; A472-L503 HydrophobicContact CB-CD1 4.36Å; A472-A506 HydrophobicContact CB-CB 3.81Å; A472-M507 HydrophobicContact CB-CB 4.45Å; A472-M507 HydrophobicContact CB-CG 3.66Å; A472-F510 HydrophobicContact CB-CD2 3.66Å; A472-F510 HydrophobicContact CB-CE2 3.99Å
473	D	76.7	Confident	70.8	Confident	62 Å²	62	49 Å²	49	33%	0.332	28%	0.28	S	S	.	.	H	α-helix	trans	-58.4	-45	177.2	-178	56.9	0	0	0	112.5	N469 V475 C476 E477 F510 R992	N469-D473 WeakPolarHBondContact O-CB 3.43Å; N469-D473 PolarHBondContact O-N 3.37Å; D473-V475 VanDerWaalsContact C-N 3.33Å; D473-V475 PolarHBondContact O-N 3.47Å; D473-C476 WeakPolarHBondContact O-CB 3.41Å; D473-C476 PolarHBondContact O-N 2.69Å; D473-E477 PolarHBondContact O-N 3.28Å; D473-F510 HydrophobicContact CB-CZ 4.47Å; D473-R992 IonicContact OD2-CZ 2.71Å; D473-R992 IonicContact OD2-NH1 3.4Å; D473-R992 PolarHBondContact OD2-NH1 3.16Å; D473-R992 IonicContact OD2-NH2 3.85Å; D473-R992 PolarHBondContact OD2-NH2 3.28Å
474	I	75.3	Confident	72.3	Confident	45 Å²	45	47.5 Å²	47.5	23%	0.231	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-43.6	172.7	-66.2	164.5	0	0	0	110.9	V470 L471 A472 C476 E477	V470-I474 HydrophobicContact CG1-CD1 4.16Å; V470-I474 VanDerWaalsContact O-CG1 3.31Å; V470-I474 WeakPolarHBondContact O-CG1 3.24Å; V470-I474 PolarHBondContact O-N 3.41Å; V470-I474 VanDerWaalsContact O-N 3.11Å; L471-I474 PolarHBondContact O-N 3.07Å; A472-I474 PolarHBondContact O-N 2.77Å; I474-C476 PolarHBondContact O-N 2.9Å; I474-E477 PolarHBondContact O-N 3.38Å
475	V	81	Confident	73.7	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.012	26%	0.255	C	S	.	.	H	α-helix	trans	-75	-14.3	-178.1	176	0	0	0	0	112.6	L471 A472 D473 I486 M507 F625 R825 I861	L471-V475 HydrophobicContact CD1-CG2 4.17Å; L471-V475 WeakPolarHBondContact O-CB 3.34Å; L471-V475 WeakPolarHBondContact O-CG2 3.43Å; L471-V475 PolarHBondContact O-N 2.88Å; A472-V475 CarbonylContact O-C 3.59Å; A472-V475 PolarHBondContact O-N 3.49Å; A472-V475 VanDerWaalsContact O-N 3.08Å; D473-V475 VanDerWaalsContact C-N 3.33Å; D473-V475 PolarHBondContact O-N 3.47Å; V475-I486 HydrophobicContact CG2-CD1 3.62Å; V475-M507 HydrophobicContact CG1-CE 3.6Å; V475-M507 HydrophobicContact CG1-SD 4.42Å; V475-F625 HydrophobicContact CG1-CE1 3.89Å; V475-F625 HydrophobicContact CG1-CZ 4.17Å; V475-R825 PolarHBondContact O-NH1 3.44Å; V475-I861 HydrophobicContact CG1-CD1 3.52Å; V475-I861 HydrophobicContact CG1-CG1 4.49Å
476	C	79.4	Confident	75.1	Confident	21 Å²	21	43.5 Å²	43.5	14%	0.142	24%	0.244	C	C	.	.	H	α-helix	trans	-83.5	-15.4	171.6	-77.1	0	0	0	0	114.4	A472 D473 I474 F510 V623 F625	A472-C476 WeakPolarHBondContact O-CB 3.36Å; A472-C476 PolarHBondContact O-N 3.41Å; A472-C476 PolarHBondContact O-SG 2.93Å; D473-C476 WeakPolarHBondContact O-CB 3.41Å; D473-C476 PolarHBondContact O-N 2.69Å; I474-C476 PolarHBondContact O-N 2.9Å; C476-F510 WeakPolarHBondContact SG-CB 3.05Å; C476-V623 WeakPolarHBondContact O-CG2 3.47Å; C476-F625 WeakPolarHBondContact SG-CE2 3.43Å; C476-F625 VanDerWaalsContact SG-CZ 3.57Å
477	E	75	Confident	76.3	Confident	103 Å²	103	41.2 Å²	41.2	48%	0.481	23%	0.23	S	C	.	.			trans	-62.8	123.3	-172.5	-158.7	-171.4	146.5	0	0	111.2	D473 I474 S479 L480 R825	D473-E477 PolarHBondContact O-N 3.28Å; I474-E477 PolarHBondContact O-N 3.38Å; E477-S479 VanDerWaalsContact C-N 3.28Å; E477-S479 VanDerWaalsContact CG-OG 3.3Å; E477-S479 WeakPolarHBondContact CG-OG 3.37Å; E477-S479 PolarHBondContact O-N 3.45Å; E477-S479 PolarHBondContact OE1-OG 3Å; E477-L480 WeakPolarHBondContact O-CB 3.47Å; E477-L480 PolarHBondContact O-N 3Å; E477-R825 VanDerWaalsContact O-CZ 3.26Å; E477-R825 PolarHBondContact O-NH1 2.97Å; E477-R825 PolarHBondContact O-NH2 3.24Å
478	P	69.8	Low	77	Confident	54 Å²	54	35.2 Å²	35.2	35%	0.351	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-27.5	-171.6	25.2	-34.2	0	0	0	113.3	L480 A619 V623 R825	P478-L480 PolarHBondContact O-N 3.19Å; P478-A619 WeakPolarHBondContact CG-O 3.15Å; P478-V623 HydrophobicContact CB-CG2 4.44Å; P478-R825 PolarHBondContact O-NH2 3.32Å
479	S	70.1	Confident	77.3	Confident	83 Å²	83	35.3 Å²	35.3	58%	0.58	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-19.9	175.7	64.2	0	0	0	0	114.7	E477 S481	E477-S479 VanDerWaalsContact C-N 3.28Å; E477-S479 VanDerWaalsContact CG-OG 3.3Å; E477-S479 WeakPolarHBondContact CG-OG 3.37Å; E477-S479 PolarHBondContact O-N 3.45Å; E477-S479 PolarHBondContact OE1-OG 3Å; S479-S481 PolarHBondContact O-N 2.93Å
480	L	75	Confident	77.3	Confident	38 Å²	38	32 Å²	32	20%	0.199	19%	0.189	C	C	.	.			trans	-62.5	119.6	-165.6	-173	64.9	0	0	0	112.4	E477 P478 L482 L484	E477-L480 WeakPolarHBondContact O-CB 3.47Å; E477-L480 PolarHBondContact O-N 3Å; P478-L480 PolarHBondContact O-N 3.19Å; L480-L482 PolarHBondContact O-N 3.23Å; L480-L484 HydrophobicContact CD2-CD2 4.01Å
481	S	76.7	Confident	77.2	Confident	96 Å²	96	36 Å²	36	67%	0.671	20%	0.203	S	C	*	.			trans	-68.9	123.6	179.8	58.4	0	0	0	0	111.9	S479	S479-S481 PolarHBondContact O-N 2.93Å
482	L	78.4	Confident	76.2	Confident	34 Å²	34	44.6 Å²	44.6	18%	0.178	24%	0.235	C	C	.	.	S	Bend	trans	-109.5	148.1	177	-60.2	-178.8	0	0	0	111.5	L480 L484 R825 H857 R858 P859 I861	L480-L482 PolarHBondContact O-N 3.23Å; L482-L484 HydrophobicContact CD2-CB 3.86Å; L482-R825 HydrophobicContact CD1-CG 3.86Å; L482-H857 PolarHBondContact O-N 3.27Å; L482-R858 CarbonylContact C-O 3.58Å; L482-R858 WeakPolarHBondContact CB-O 3.23Å; L482-P859 HydrophobicContact CD1-CB 4.45Å; L482-I861 HydrophobicContact CD2-CG1 3.85Å
483	P	85.3	Confident	75.1	Confident	33 Å²	33	47.7 Å²	47.7	21%	0.214	27%	0.267	C	S	.	.	S	Bend	cis	-80.4	154	9.5	31.1	-34.3	0	0	0	114.7	S853 F860	P483-S853 VanDerWaalsContact CG-O 3.27Å; P483-S853 WeakPolarHBondContact CG-O 3.34Å; P483-F860 VanDerWaalsContact CA-O 3.28Å; P483-F860 WeakPolarHBondContact CA-O 3.35Å; P483-F860 HydrophobicContact CB-CB 4.29Å
484	L	86	Confident	74.1	Confident	16 Å²	16	45.2 Å²	45.2	8%	0.084	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	141.6	-178.1	-173	75.5	0	0	0	111.7	L480 L482 I486 F860 I861 T862 S899 M900	L480-L484 HydrophobicContact CD2-CD2 4.01Å; L482-L484 HydrophobicContact CD2-CB 3.86Å; L484-I486 HydrophobicContact CD2-CD1 3.91Å; L484-I486 HydrophobicContact CD2-CG1 3.93Å; L484-I486 HydrophobicContact CG-CG1 4.17Å; L484-F860 PolarHBondContact N-O 3.1Å; L484-I861 HydrophobicContact CB-CG1 4.47Å; L484-I861 HydrophobicContact CD2-CG2 4.48Å; L484-I861 CarbonylContact O-C 3.45Å; L484-I861 WeakPolarHBondContact O-CA 3.46Å; L484-T862 PolarHBondContact O-N 2.95Å; L484-S899 WeakPolarHBondContact CD1-OG 3.46Å; L484-M900 HydrophobicContact CD1-CG 4.03Å
485	T	86.8	Confident	73.3	Confident	13 Å²	13	44.7 Å²	44.7	8%	0.08	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	114.5	177.7	49.8	0	0	0	0	111.3	T862 I897 S899 M900	T485-T862 WeakPolarHBondContact CA-O 3.41Å; T485-I897 VanDerWaalsContact CB-O 3.26Å; T485-I897 WeakPolarHBondContact CB-O 3.48Å; T485-I897 PolarHBondContact OG1-O 3.34Å; T485-S899 PolarHBondContact N-OG 3.48Å; T485-S899 PolarHBondContact O-N 2.91Å; T485-S899 VanDerWaalsContact O-N 3.1Å; T485-S899 PolarHBondContact O-OG 2.68Å; T485-S899 PolarHBondContact OG1-N 3.25Å; T485-S899 PolarHBondContact OG1-OG 2.66Å; T485-M900 PolarHBondContact O-N 2.95Å
486	I	85.8	Confident	72.6	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	119.6	-174.8	-56.4	176.6	0	0	0	109.1	L471 V475 L484 L488 I861 T862 I863 I864 M900 F902	L471-I486 HydrophobicContact CD1-CD1 4.42Å; V475-I486 HydrophobicContact CG2-CD1 3.62Å; L484-I486 HydrophobicContact CD2-CD1 3.91Å; L484-I486 HydrophobicContact CD2-CG1 3.93Å; L484-I486 HydrophobicContact CG-CG1 4.17Å; I486-L488 HydrophobicContact CG2-CG 4.41Å; I486-I861 HydrophobicContact CD1-CG2 3.85Å; I486-I861 HydrophobicContact CG1-CG2 4.42Å; I486-T862 PolarHBondContact N-O 3.34Å; I486-I863 HydrophobicContact CB-CG1 4.42Å; I486-I863 HydrophobicContact CD1-CG1 4.33Å; I486-I863 WeakPolarHBondContact O-CA 3.49Å; I486-I864 PolarHBondContact O-N 2.9Å; I486-M900 WeakPolarHBondContact CA-O 3.42Å; I486-M900 HydrophobicContact CG1-CB 4.34Å; I486-F902 HydrophobicContact CG2-CD2 3.78Å; I486-F902 HydrophobicContact CG2-CE2 3.94Å
487	G	81.9	Confident	72	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	108.1	175.9	0	0	0	0	0	111.2	Y489 I864 M900 F902	G487-Y489 PolarHBondContact O-N 3.49Å; G487-I864 CarbonylContact C-O 3.38Å; G487-M900 PolarHBondContact N-O 2.88Å; G487-F902 PolarHBondContact O-N 2.76Å
488	L	78.7	Confident	71.5	Confident	5 Å²	5	45.6 Å²	45.6	3%	0.026	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	85.4	174	-69.2	173.6	0	0	0	109.4	L471 I486 L499 L500 L503 I863 I864 A865 V866 F902	L471-L488 HydrophobicContact CD2-CD2 3.9Å; I486-L488 HydrophobicContact CG2-CG 4.41Å; L488-L499 HydrophobicContact CD1-CD2 3.71Å; L488-L499 HydrophobicContact CD2-CD2 4.26Å; L488-L500 HydrophobicContact CD1-CD2 3.69Å; L488-L503 HydrophobicContact CD1-CD2 4.18Å; L488-I863 HydrophobicContact CD1-CG2 3.43Å; L488-I863 VanDerWaalsContact CD1-CG2 3.43Å; L488-I863 HydrophobicContact CG-CG2 4.09Å; L488-I864 PolarHBondContact N-O 3.48Å; L488-A865 HydrophobicContact CB-CB 4.18Å; L488-A865 WeakPolarHBondContact O-CA 3.48Å; L488-V866 PolarHBondContact O-N 3.33Å; L488-F902 HydrophobicContact CD2-CB 4.2Å
489	Y	75.4	Confident	71.6	Confident	3 Å²	3	43.3 Å²	43.3	1%	0.012	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	122.6	-178	-61.3	-47.8	0	0	0	111.7	G487 V866 P868 I871 L894 I898 P901 F902 Y903 L904	G487-Y489 PolarHBondContact O-N 3.49Å; Y489-V866 WeakPolarHBondContact CA-O 3.38Å; Y489-P868 HydrophobicContact CD1-CB 3.75Å; Y489-P868 HydrophobicContact CD1-CG 4.21Å; Y489-P868 HydrophobicContact CE1-CB 4.23Å; Y489-P868 HydrophobicContact CG-CB 4.01Å; Y489-P868 HydrophobicContact CG-CG 4.14Å; Y489-I871 HydrophobicContact CE1-CD1 4.49Å; Y489-L894 HydrophobicContact CE1-CD1 4.08Å; Y489-L894 WeakPolarHBondContact OH-CD2 3.43Å; Y489-L894 WeakPolarHBondContact OH-CG 3.39Å; Y489-I898 HydrophobicContact CE1-CD1 4.27Å; Y489-I898 WeakPolarHBondContact OH-CD1 3.42Å; Y489-P901 HydrophobicContact CD2-CB 4.29Å; Y489-P901 HydrophobicContact CE2-CB 3.61Å; Y489-F902 PolarHBondContact N-O 2.68Å; Y489-Y903 AromaticContact CD2-CD1 3.91Å; Y489-Y903 HydrophobicContact CD2-CD1 3.91Å; Y489-Y903 HydrophobicContact CD2-CD2 4.2Å; Y489-Y903 AromaticContact CD2-CE1 3.53Å; Y489-Y903 HydrophobicContact CD2-CE1 3.53Å; Y489-Y903 AromaticContact CD2-CE2 3.86Å; Y489-Y903 HydrophobicContact CD2-CE2 3.86Å; Y489-Y903 HydrophobicContact CD2-CG 4.23Å; Y489-Y903 AromaticContact CD2-CZ 3.51Å; Y489-Y903 HydrophobicContact CE2-CE1 4.36Å; Y489-Y903 HydrophobicContact CE2-CE2 4.31Å; Y489-Y903 AromaticContact CE2-CZ 3.97Å; Y489-Y903 HydrophobicContact CG-CD1 4.17Å; Y489-Y903 AromaticContact CG-CE1 3.96Å; Y489-Y903 HydrophobicContact CG-CE1 3.96Å; Y489-L904 PolarHBondContact O-N 2.92Å
490	A	67.3	Low	71.9	Confident	5 Å²	5	40.1 Å²	40.1	4%	0.041	24%	0.241	C	C	.	.			trans	-153.2	154	174.5	0	0	0	0	0	112	S494 K496 V866 D867 L904	A490-S494 WeakPolarHBondContact CB-OG 3.36Å; A490-K496 HydrophobicContact CB-CD 4.5Å; A490-K496 HydrophobicContact CB-CG 4.14Å; A490-K496 WeakPolarHBondContact O-CE 3.46Å; A490-K496 PolarHBondContact O-NZ 2.89Å; A490-V866 PolarHBondContact N-O 3.25Å; A490-D867 WeakPolarHBondContact O-CA 3.46Å; A490-L904 HydrophobicContact CB-CB 3.92Å; A490-L904 HydrophobicContact CB-CD1 4.08Å
491	K	63.3	Low	71.8	Confident	128 Å²	128	40.7 Å²	40.7	56%	0.557	25%	0.251	S	S	*	.			trans	-66.7	145.4	177.7	-168.9	161.2	-173.7	164.9	0	111.4	G493 S494 D867	K491-G493 PolarHBondContact O-N 3.43Å; K491-S494 VanDerWaalsContact O-CB 3.26Å; K491-S494 WeakPolarHBondContact O-CB 3.4Å; K491-S494 PolarHBondContact O-N 3.32Å; K491-S494 VanDerWaalsContact O-N 3.1Å; K491-S494 PolarHBondContact O-OG 2.99Å; K491-D867 VanDerWaalsContact CA-OD2 3.32Å; K491-D867 WeakPolarHBondContact CA-OD2 3.28Å
492	W	54.6	Low	71.7	Confident	193 Å²	193	39.2 Å²	39.2	73%	0.731	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.6	133.6	171.1	-165.4	85.4	0	0	0	111.8	D867	W492-D867 PolarHBondContact N-OD2 3.09Å
493	G	54	Low	71.7	Confident	65 Å²	65	37.7 Å²	37.7	67%	0.67	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.2	-3.1	-176.3	0	0	0	0	0	116.8	K491 G495	K491-G493 PolarHBondContact O-N 3.43Å; G493-G495 PolarHBondContact O-N 3.41Å; G493-G495 VanDerWaalsContact O-N 3.1Å
494	S	56.6	Low	71.7	Confident	10 Å²	10	39.3 Å²	39.3	7%	0.07	23%	0.228	C	C	.	.	S	Bend	trans	-75.5	11	-177	77.7	0	0	0	0	116.2	Y464 A490 K491	Y464-S494 PolarHBondContact OH-O 3.47Å; A490-S494 WeakPolarHBondContact CB-OG 3.36Å; K491-S494 VanDerWaalsContact O-CB 3.26Å; K491-S494 WeakPolarHBondContact O-CB 3.4Å; K491-S494 PolarHBondContact O-N 3.32Å; K491-S494 VanDerWaalsContact O-N 3.1Å; K491-S494 PolarHBondContact O-OG 2.99Å
495	G	58.6	Low	71.3	Confident	35 Å²	35	44.1 Å²	44.1	36%	0.361	25%	0.25	S	S	.	.			trans	76.1	27.5	-177.3	0	0	0	0	0	115.7	G493 S497 A498 L499	G493-G495 PolarHBondContact O-N 3.41Å; G493-G495 VanDerWaalsContact O-N 3.1Å; G495-S497 VanDerWaalsContact C-N 3.3Å; G495-S497 PolarHBondContact O-N 2.7Å; G495-A498 WeakPolarHBondContact O-CB 3.4Å; G495-A498 PolarHBondContact O-N 2.68Å; G495-L499 PolarHBondContact O-N 3.13Å
496	K	65.6	Low	70.8	Confident	18 Å²	18	43.8 Å²	43.8	8%	0.078	25%	0.249	C	C	.	.	H	α-helix	trans	-42.3	-51.3	-179.6	-51.5	-174.2	-174.1	-175.9	0	113.7	A490 A498 L499 L500 D834	A490-K496 HydrophobicContact CB-CD 4.5Å; A490-K496 HydrophobicContact CB-CG 4.14Å; A490-K496 WeakPolarHBondContact O-CE 3.46Å; A490-K496 PolarHBondContact O-NZ 2.89Å; K496-A498 VanDerWaalsContact C-N 3.31Å; K496-A498 PolarHBondContact O-N 2.9Å; K496-L499 PolarHBondContact O-N 2.76Å; K496-L499 VanDerWaalsContact O-N 3.14Å; K496-L500 PolarHBondContact O-N 3.04Å; K496-D834 IonicContact NZ-OD1 2.84Å; K496-D834 PolarHBondContact NZ-OD1 2.83Å; K496-D834 IonicContact NZ-OD2 2.74Å; K496-D834 PolarHBondContact NZ-OD2 3Å
497	S	66.3	Low	70.6	Confident	71 Å²	71	43.7 Å²	43.7	50%	0.497	25%	0.248	S	C	.	.	H	α-helix	trans	-63.9	-30.1	-179.3	52.4	0	0	0	0	114	G495 L500 A501	G495-S497 VanDerWaalsContact C-N 3.3Å; G495-S497 PolarHBondContact O-N 2.7Å; S497-L500 PolarHBondContact O-N 3.11Å; S497-A501 PolarHBondContact O-N 3.19Å
498	A	64.9	Low	70.4	Confident	56 Å²	56	47.8 Å²	47.8	46%	0.463	27%	0.267	S	S	.	.	H	α-helix	trans	-73	-31.8	174.9	0	0	0	0	0	112.2	G495 K496 K502	G495-A498 WeakPolarHBondContact O-CB 3.4Å; G495-A498 PolarHBondContact O-N 2.68Å; K496-A498 VanDerWaalsContact C-N 3.31Å; K496-A498 PolarHBondContact O-N 2.9Å; A498-K502 VanDerWaalsContact O-CG 3.31Å; A498-K502 WeakPolarHBondContact O-CG 3.26Å; A498-K502 PolarHBondContact O-N 3.47Å
499	L	71.5	Confident	69.9	Low	5 Å²	5	52.3 Å²	52.3	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-70.9	-39.5	169.5	177.8	142.6	0	0	0	111.3	Y464 L488 G495 K496 A501 K502 L503 L904	Y464-L499 HydrophobicContact CD1-CD1 3.52Å; Y464-L499 HydrophobicContact CE1-CD1 4.15Å; Y464-L499 HydrophobicContact CG-CD1 4.17Å; L488-L499 HydrophobicContact CD1-CD2 3.71Å; L488-L499 HydrophobicContact CD2-CD2 4.26Å; G495-L499 PolarHBondContact O-N 3.13Å; K496-L499 PolarHBondContact O-N 2.76Å; K496-L499 VanDerWaalsContact O-N 3.14Å; L499-A501 PolarHBondContact O-N 2.87Å; L499-K502 PolarHBondContact O-N 3.06Å; L499-L503 VanDerWaalsContact O-CB 3.3Å; L499-L503 WeakPolarHBondContact O-CB 3.28Å; L499-L503 PolarHBondContact O-N 3.03Å; L499-L904 HydrophobicContact CD1-CD1 3.86Å; L499-L904 HydrophobicContact CD1-CD2 3.69Å; L499-L904 HydrophobicContact CD1-CG 4.46Å; L499-L904 HydrophobicContact CD2-CD1 4.3Å
500	L	76.6	Confident	69.5	Low	16 Å²	16	56.5 Å²	56.5	8%	0.084	32%	0.318	C	S	.	.	H	α-helix	trans	-61.2	-41.4	176.7	-72.8	176.1	0	0	0	112.7	L488 K496 S497 L503 K504 V829 D831 I863 A865	L488-L500 HydrophobicContact CD1-CD2 3.69Å; K496-L500 PolarHBondContact O-N 3.04Å; S497-L500 PolarHBondContact O-N 3.11Å; L500-L503 PolarHBondContact O-N 3.49Å; L500-K504 PolarHBondContact O-N 3.08Å; L500-V829 HydrophobicContact CB-CG1 4.47Å; L500-V829 HydrophobicContact CD1-CG1 3.69Å; L500-V829 HydrophobicContact CD2-CG1 3.75Å; L500-V829 HydrophobicContact CG-CG1 4.18Å; L500-D831 HydrophobicContact CD1-CB 3.79Å; L500-I863 HydrophobicContact CD2-CG2 3.89Å; L500-A865 HydrophobicContact CD1-CB 3.79Å; L500-A865 HydrophobicContact CD2-CB 4.23Å; L500-A865 HydrophobicContact CG-CB 4.23Å
501	A	74	Confident	69.6	Low	50 Å²	50	56.8 Å²	56.8	41%	0.413	32%	0.32	S	S	.	.	H	α-helix	trans	-61.1	-50.6	173.8	0	0	0	0	0	111.6	S497 L499 L503 K504 E505	S497-A501 PolarHBondContact O-N 3.19Å; L499-A501 PolarHBondContact O-N 2.87Å; A501-L503 VanDerWaalsContact C-N 3.28Å; A501-L503 PolarHBondContact O-N 3.11Å; A501-K504 PolarHBondContact O-N 2.84Å; A501-K504 VanDerWaalsContact O-N 3.16Å; A501-E505 PolarHBondContact O-N 2.88Å
502	K	73.4	Confident	69.3	Low	65 Å²	65	59.9 Å²	59.9	28%	0.283	33%	0.328	S	S	.	.	H	α-helix	trans	-60.7	-34.3	176.5	-72.1	176.5	175.6	-166.7	0	113.3	D465 A498 L499 E505 A506	D465-K502 WeakPolarHBondContact OD1-CD 3.48Å; D465-K502 WeakPolarHBondContact OD1-CE 3.39Å; D465-K502 IonicContact OD1-NZ 3.08Å; D465-K502 PolarHBondContact OD1-NZ 2.89Å; A498-K502 VanDerWaalsContact O-CG 3.31Å; A498-K502 WeakPolarHBondContact O-CG 3.26Å; A498-K502 PolarHBondContact O-N 3.47Å; L499-K502 PolarHBondContact O-N 3.06Å; K502-E505 PolarHBondContact O-N 2.87Å; K502-A506 VanDerWaalsContact O-CB 3.29Å; K502-A506 WeakPolarHBondContact O-CB 3.19Å; K502-A506 PolarHBondContact O-N 3.44Å
503	L	79.3	Confident	69.4	Low	3 Å²	3	55.4 Å²	55.4	2%	0.016	32%	0.318	C	S	.	.	H	α-helix	trans	-69.5	-41.1	175.7	-177.5	61	0	0	0	111.5	S468 L471 A472 L488 L499 L500 A501 A506 M507 I863	S468-L503 WeakPolarHBondContact O-CD1 3.45Å; L471-L503 HydrophobicContact CB-CD1 4.06Å; L471-L503 HydrophobicContact CD2-CD1 3.91Å; L471-L503 HydrophobicContact CD2-CD2 3.69Å; L471-L503 HydrophobicContact CD2-CG 4.48Å; L471-L503 HydrophobicContact CG-CD1 3.92Å; L471-L503 HydrophobicContact CG-CD2 4.44Å; A472-L503 HydrophobicContact CB-CD1 4.36Å; L488-L503 HydrophobicContact CD1-CD2 4.18Å; L499-L503 VanDerWaalsContact O-CB 3.3Å; L499-L503 WeakPolarHBondContact O-CB 3.28Å; L499-L503 PolarHBondContact O-N 3.03Å; L500-L503 PolarHBondContact O-N 3.49Å; A501-L503 VanDerWaalsContact C-N 3.28Å; A501-L503 PolarHBondContact O-N 3.11Å; L503-A506 PolarHBondContact O-N 2.78Å; L503-M507 HydrophobicContact CD1-CG 4.22Å; L503-M507 HydrophobicContact CD1-SD 4.15Å; L503-M507 HydrophobicContact CG-SD 3.99Å; L503-M507 WeakPolarHBondContact O-CB 3.5Å; L503-M507 WeakPolarHBondContact O-CG 3.22Å; L503-M507 PolarHBondContact O-N 3.14Å; L503-I863 HydrophobicContact CD2-CD1 3.99Å
504	K	84.2	Confident	69.4	Low	66 Å²	66	58.5 Å²	58.5	29%	0.287	31%	0.31	S	S	.	.	H	α-helix	trans	-61.3	-43.9	171.6	-179.5	170.1	-177.9	178.9	0	111.3	L500 A501 H508 F627 D629	L500-K504 PolarHBondContact O-N 3.08Å; A501-K504 PolarHBondContact O-N 2.84Å; A501-K504 VanDerWaalsContact O-N 3.16Å; K504-H508 WeakPolarHBondContact O-CB 3.18Å; K504-H508 PolarHBondContact O-CD2 2.72Å; K504-H508 VanDerWaalsContact O-CD2 3.26Å; K504-H508 PolarHBondContact O-N 2.69Å; K504-F627 HydrophobicContact CB-CD1 4.37Å; K504-F627 HydrophobicContact CB-CE1 3.97Å; K504-F627 HydrophobicContact CB-CZ 4.19Å; K504-F627 HydrophobicContact CD-CB 4.28Å; K504-F627 HydrophobicContact CD-CD1 3.97Å; K504-F627 HydrophobicContact CD-CD2 4.28Å; K504-F627 HydrophobicContact CD-CE1 4.39Å; K504-F627 HydrophobicContact CD-CG 3.92Å; K504-F627 HydrophobicContact CG-CD1 3.9Å; K504-F627 HydrophobicContact CG-CD2 4.02Å; K504-F627 HydrophobicContact CG-CE1 3.82Å; K504-F627 HydrophobicContact CG-CE2 3.94Å; K504-F627 HydrophobicContact CG-CG 4.01Å; K504-F627 HydrophobicContact CG-CZ 3.85Å; K504-D629 IonicContact NZ-OD1 2.59Å; K504-D629 PolarHBondContact NZ-OD1 3.18Å
505	E	79.2	Confident	69.1	Low	117 Å²	117	60.6 Å²	60.6	55%	0.547	32%	0.32	S	S	.	.	H	α-helix	trans	-60.7	-48.8	174.2	-72.4	172.1	-160.9	0	0	112.2	A501 K502 H508 S509	A501-E505 PolarHBondContact O-N 2.88Å; K502-E505 PolarHBondContact O-N 2.87Å; E505-H508 PolarHBondContact O-N 3.38Å; E505-S509 WeakPolarHBondContact O-CB 3.37Å; E505-S509 PolarHBondContact O-N 3.46Å
506	A	76.4	Confident	68.7	Low	6 Å²	6	64 Å²	64	5%	0.05	33%	0.33	C	S	.	.	H	α-helix	trans	-60.9	-49.3	179	0	0	0	0	0	111.6	N469 A472 K502 L503 H508 S509 F510	N469-A506 WeakPolarHBondContact OD1-CB 3.31Å; A472-A506 HydrophobicContact CB-CB 3.81Å; K502-A506 VanDerWaalsContact O-CB 3.29Å; K502-A506 WeakPolarHBondContact O-CB 3.19Å; K502-A506 PolarHBondContact O-N 3.44Å; L503-A506 PolarHBondContact O-N 2.78Å; A506-H508 VanDerWaalsContact C-N 3.33Å; A506-H508 PolarHBondContact O-N 3.34Å; A506-S509 CarbonylContact O-C 3.54Å; A506-S509 WeakPolarHBondContact O-CA 3.28Å; A506-S509 WeakPolarHBondContact O-CB 3.33Å; A506-S509 PolarHBondContact O-N 3.04Å; A506-F510 WeakPolarHBondContact O-CD2 3.43Å; A506-F510 PolarHBondContact O-N 3.2Å
507	M	79.9	Confident	67.9	Low	0 Å²	0	66.3 Å²	66.3	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-59.5	-40.4	177.7	-72.7	174.7	67.7	0	0	112.4	A472 V475 L503 S509 F510 S511 F625 F627 V827	A472-M507 HydrophobicContact CB-CB 4.45Å; A472-M507 HydrophobicContact CB-CG 3.66Å; V475-M507 HydrophobicContact CG1-CE 3.6Å; V475-M507 HydrophobicContact CG1-SD 4.42Å; L503-M507 HydrophobicContact CD1-CG 4.22Å; L503-M507 HydrophobicContact CD1-SD 4.15Å; L503-M507 HydrophobicContact CG-SD 3.99Å; L503-M507 WeakPolarHBondContact O-CB 3.5Å; L503-M507 WeakPolarHBondContact O-CG 3.22Å; L503-M507 PolarHBondContact O-N 3.14Å; M507-S509 VanDerWaalsContact C-N 3.34Å; M507-F510 PolarHBondContact O-N 3.35Å; M507-S511 PolarHBondContact O-N 3.37Å; M507-S511 PolarHBondContact O-OG 3.1Å; M507-F625 HydrophobicContact CB-CD2 3.89Å; M507-F625 HydrophobicContact CB-CE2 3.97Å; M507-F625 HydrophobicContact CB-CG 4.49Å; M507-F625 HydrophobicContact CE-CD1 3.45Å; M507-F625 VanDerWaalsContact CE-CD1 3.45Å; M507-F625 HydrophobicContact CE-CD2 4.13Å; M507-F625 HydrophobicContact CE-CE1 3.47Å; M507-F625 VanDerWaalsContact CE-CE1 3.47Å; M507-F625 HydrophobicContact CE-CE2 4.14Å; M507-F625 HydrophobicContact CE-CG 3.79Å; M507-F625 HydrophobicContact CE-CZ 3.82Å; M507-F625 HydrophobicContact CG-CE2 4.46Å; M507-F625 WeakPolarHBondContact O-CD2 3.49Å; M507-F625 WeakPolarHBondContact O-CE2 3.45Å; M507-F627 HydrophobicContact CB-CZ 3.84Å; M507-F627 HydrophobicContact CE-CE1 4.27Å; M507-F627 HydrophobicContact CE-CZ 3.89Å; M507-F627 HydrophobicContact SD-CE1 4.17Å; M507-F627 HydrophobicContact SD-CZ 3.96Å; M507-V827 HydrophobicContact CE-CG1 4.32Å; M507-V827 HydrophobicContact CE-CG2 3.69Å
508	H	78	Confident	67.2	Low	86 Å²	86	65.4 Å²	65.4	40%	0.398	35%	0.35	S	S	.	.	H	α-helix	trans	-66.2	-33.6	171.5	-82.5	-57.9	0	0	0	113.1	K504 E505 A506 F510 S511 F627	K504-H508 WeakPolarHBondContact O-CB 3.18Å; K504-H508 PolarHBondContact O-CD2 2.72Å; K504-H508 VanDerWaalsContact O-CD2 3.26Å; K504-H508 PolarHBondContact O-N 2.69Å; E505-H508 PolarHBondContact O-N 3.38Å; A506-H508 VanDerWaalsContact C-N 3.33Å; A506-H508 PolarHBondContact O-N 3.34Å; H508-F510 VanDerWaalsContact C-N 3.32Å; H508-F510 PolarHBondContact O-N 3.35Å; H508-S511 WeakPolarHBondContact CA-OG 3.48Å; H508-S511 PolarHBondContact O-OG 2.85Å; H508-F627 AromaticContact CD2-CE2 3.7Å; H508-F627 AromaticContact CE1-CD2 3.74Å; H508-F627 AromaticContact CE1-CE2 3.71Å; H508-F627 AromaticContact NE2-CD2 3.28Å; H508-F627 VanDerWaalsContact NE2-CD2 3.28Å; H508-F627 WeakPolarHBondContact NE2-CD2 3.11Å; H508-F627 AromaticContact NE2-CE2 3.36Å; H508-F627 WeakPolarHBondContact NE2-CE2 3.13Å
509	S	69.9	Low	66.8	Low	101 Å²	101	67.2 Å²	67.2	71%	0.706	36%	0.359	S	S	*	.	H	α-helix	trans	-72.5	-21.2	175.8	-170.2	0	0	0	0	113.9	E505 A506 M507	E505-S509 WeakPolarHBondContact O-CB 3.37Å; E505-S509 PolarHBondContact O-N 3.46Å; A506-S509 CarbonylContact O-C 3.54Å; A506-S509 WeakPolarHBondContact O-CA 3.28Å; A506-S509 WeakPolarHBondContact O-CB 3.33Å; A506-S509 PolarHBondContact O-N 3.04Å; M507-S509 VanDerWaalsContact C-N 3.34Å
510	F	66.7	Low	66.2	Low	90 Å²	90	69 Å²	69	40%	0.395	37%	0.369	S	S	.	.	H	α-helix	trans	-94.9	-23	174	-75.1	-74	0	0	0	113.3	N469 A472 D473 C476 A506 M507 H508 R512	N469-F510 HydrophobicContact CB-CE2 4.26Å; A472-F510 HydrophobicContact CB-CD2 3.66Å; A472-F510 HydrophobicContact CB-CE2 3.99Å; D473-F510 HydrophobicContact CB-CZ 4.47Å; C476-F510 WeakPolarHBondContact SG-CB 3.05Å; A506-F510 WeakPolarHBondContact O-CD2 3.43Å; A506-F510 PolarHBondContact O-N 3.2Å; M507-F510 PolarHBondContact O-N 3.35Å; H508-F510 VanDerWaalsContact C-N 3.32Å; H508-F510 PolarHBondContact O-N 3.35Å; F510-R512 PolarHBondContact O-N 3Å
511	S	68.6	Low	65.6	Low	12 Å²	12	72.8 Å²	72.8	8%	0.084	40%	0.397	C	S	.	.	S	Bend	trans	-66.2	128.3	173.7	51.7	0	0	0	0	111.7	M507 H508 D513 V623	M507-S511 PolarHBondContact O-N 3.37Å; M507-S511 PolarHBondContact O-OG 3.1Å; H508-S511 WeakPolarHBondContact CA-OG 3.48Å; H508-S511 PolarHBondContact O-OG 2.85Å; S511-D513 PolarHBondContact O-N 2.85Å; S511-V623 WeakPolarHBondContact CA-O 3.38Å
512	R	57.6	Low	65	Low	192 Å²	192	73.6 Å²	73.6	73%	0.725	40%	0.396	S	S	*	.			trans	-85	98.1	175.3	-69.9	177.8	172.6	174	-2.2	109.5	F510 W514 P622	F510-R512 PolarHBondContact O-N 3Å; R512-W514 PolarHBondContact O-N 3.12Å; R512-P622 HydrophobicContact CB-CB 4.13Å
513	D	55.4	Low	64.7	Low	99 Å²	99	73.1 Å²	73.1	53%	0.529	40%	0.401	S	S	.	.			trans	-65.3	98.3	174.6	-86.1	-10.2	0	0	0	111.1	S511 L515 D516	S511-D513 PolarHBondContact O-N 2.85Å; D513-L515 PolarHBondContact O-N 3.08Å; D513-D516 PolarHBondContact O-N 2.88Å
514	W	55.7	Low	64.1	Low	130 Å²	130	80.7 Å²	80.7	49%	0.492	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-48.5	-29.5	-179.5	-92.2	109.3	0	0	0	114.8	R512 D516 G517 V518 P622 R821	R512-W514 PolarHBondContact O-N 3.12Å; W514-D516 PolarHBondContact O-N 2.92Å; W514-G517 PolarHBondContact O-N 2.98Å; W514-V518 WeakPolarHBondContact O-CG2 3.37Å; W514-P622 HydrophobicContact CD2-CG 4.42Å; W514-P622 HydrophobicContact CZ2-CG 3.68Å; W514-P622 VanDerWaalsContact NE1-CG 3.26Å; W514-R821 VanDerWaalsContact CZ2-O 3.32Å; W514-R821 WeakPolarHBondContact CZ2-O 3.22Å
515	L	50	Low	63.3	Low	54 Å²	54	80.8 Å²	80.8	28%	0.283	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-72.9	-22.7	-170.3	-75.2	169.9	0	0	0	114.4	D513 R595	D513-L515 PolarHBondContact O-N 3.08Å; L515-R595 HydrophobicContact CB-CG 4.28Å; L515-R595 HydrophobicContact CD2-CG 4.16Å; L515-R595 WeakPolarHBondContact O-CD 3.23Å; L515-R595 WeakPolarHBondContact O-CG 3.36Å
516	D	49.5	Very low	62.8	Low	108 Å²	108	77.3 Å²	77.3	58%	0.578	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-92.2	-10.2	-179.6	-74.6	-7.6	0	0	0	112.8	D513 W514 R595	D513-D516 PolarHBondContact O-N 2.88Å; W514-D516 PolarHBondContact O-N 2.92Å; D516-R595 IonicContact OD1-NH1 3.47Å; D516-R595 PolarHBondContact OD1-NH1 2.84Å
517	G	49.3	Very low	62.4	Low	66 Å²	66	80.7 Å²	80.7	68%	0.68	45%	0.446	S	S	*	.	S	Bend	trans	-88.2	-1.9	174.2	0	0	0	0	0	115.3	W514 S519	W514-G517 PolarHBondContact O-N 2.98Å; G517-S519 PolarHBondContact O-N 3.31Å; G517-S519 VanDerWaalsContact O-N 3.12Å
518	V	52.2	Low	62	Low	52 Å²	52	85.7 Å²	85.7	32%	0.315	47%	0.468	S	S	.	.			trans	-85.8	84.3	-173	-163.6	0	0	0	0	111.3	W514 A594	W514-V518 WeakPolarHBondContact O-CG2 3.37Å; V518-A594 HydrophobicContact CB-CB 4.08Å; V518-A594 HydrophobicContact CG1-CB 3.89Å; V518-A594 WeakPolarHBondContact O-CB 3.25Å
519	S	55.9	Low	61.6	Low	94 Å²	94	84.3 Å²	84.3	66%	0.657	47%	0.472	S	S	*	.			trans	-66.4	140.2	168.3	58.4	0	0	0	0	111.3	G517 S521	G517-S519 PolarHBondContact O-N 3.31Å; G517-S519 VanDerWaalsContact O-N 3.12Å; S519-S521 PolarHBondContact O-N 3.1Å
520	L	59.3	Low	61.7	Low	42 Å²	42	81 Å²	81	22%	0.22	45%	0.446	C	S	.	.			trans	-77.9	87	179.1	-171.7	84.6	0	0	0	110.3	V522 A590 F593 F597	L520-V522 HydrophobicContact CD2-CG2 4.47Å; L520-V522 PolarHBondContact O-N 3.18Å; L520-A590 HydrophobicContact CB-CB 4.32Å; L520-F593 HydrophobicContact CD1-CB 4.49Å; L520-F597 HydrophobicContact CD1-CD2 4.09Å; L520-F597 HydrophobicContact CD1-CE2 4.3Å
521	S	62.8	Low	61.9	Low	96 Å²	96	81.5 Å²	81.5	67%	0.671	45%	0.448	S	S	*	.			trans	-64.5	103.5	173.5	55.9	0	0	0	0	111.1	S519 S523	S519-S521 PolarHBondContact O-N 3.1Å; S521-S523 VanDerWaalsContact C-N 3.28Å; S521-S523 PolarHBondContact O-N 3.16Å
522	V	61.5	Low	62.2	Low	67 Å²	67	85.1 Å²	85.1	41%	0.406	47%	0.466	S	S	.	.			trans	-71.9	83.1	179.8	-174.6	0	0	0	0	109.8	L520 I572	L520-V522 HydrophobicContact CD2-CG2 4.47Å; L520-V522 PolarHBondContact O-N 3.18Å; V522-I572 HydrophobicContact CG1-CG2 3.76Å; V522-I572 HydrophobicContact CG2-CG2 4.45Å
523	S	67.7	Low	62.9	Low	55 Å²	55	81.9 Å²	81.9	39%	0.385	46%	0.457	S	S	.	.			trans	-82.2	144.3	175.1	64.6	0	0	0	0	111.6	S521 A525 L526 F527	S521-S523 VanDerWaalsContact C-N 3.28Å; S521-S523 PolarHBondContact O-N 3.16Å; S523-A525 PolarHBondContact O-N 3.35Å; S523-L526 PolarHBondContact O-N 3.18Å; S523-L526 PolarHBondContact OG-N 3.06Å; S523-F527 PolarHBondContact O-N 3.41Å
524	F	65.6	Low	63.8	Low	162 Å²	162	79.3 Å²	79.3	71%	0.711	44%	0.441	S	S	*	.	H	α-helix	trans	-57.8	-32.2	173.2	-176.7	-100.3	0	0	0	112.1	L526 F527 F528	F524-L526 VanDerWaalsContact C-N 3.35Å; F524-L526 PolarHBondContact O-N 2.91Å; F524-F527 PolarHBondContact O-N 3.1Å; F524-F528 HydrophobicContact CE1-CB 4.49Å; F524-F528 WeakPolarHBondContact O-CB 3.27Å; F524-F528 PolarHBondContact O-N 2.77Å
525	A	68.5	Low	64.5	Low	68 Å²	68	74.1 Å²	74.1	56%	0.562	43%	0.428	S	S	*	.	H	α-helix	trans	-61.1	-38	174.4	0	0	0	0	0	113.2	S523 A529	S523-A525 PolarHBondContact O-N 3.35Å; A525-A529 WeakPolarHBondContact O-CB 3.39Å; A525-A529 PolarHBondContact O-N 3.19Å
526	L	68.3	Low	65.7	Low	43 Å²	43	74.9 Å²	74.9	23%	0.225	43%	0.431	C	S	.	.	H	α-helix	trans	-67.2	-42.3	175.6	-178.5	148.7	0	0	0	111.1	S523 F524 I530 I572	S523-L526 PolarHBondContact O-N 3.18Å; S523-L526 PolarHBondContact OG-N 3.06Å; F524-L526 VanDerWaalsContact C-N 3.35Å; F524-L526 PolarHBondContact O-N 2.91Å; L526-I530 HydrophobicContact CD2-CD1 3.68Å; L526-I530 HydrophobicContact CG-CD1 4.06Å; L526-I530 WeakPolarHBondContact O-CB 3.13Å; L526-I530 VanDerWaalsContact O-CG1 3.28Å; L526-I530 WeakPolarHBondContact O-CG1 3.4Å; L526-I530 PolarHBondContact O-N 3.34Å; L526-I530 VanDerWaalsContact O-N 3.13Å; L526-I572 HydrophobicContact CD2-CD1 4.3Å
527	F	68.6	Low	66.8	Low	78 Å²	78	75.5 Å²	75.5	34%	0.342	43%	0.429	S	S	.	.	H	α-helix	trans	-61.3	-47.8	174.8	-174.2	-90.6	0	0	0	111.6	S523 F524 I530 F531 F565	S523-F527 PolarHBondContact O-N 3.41Å; F524-F527 PolarHBondContact O-N 3.1Å; F527-I530 PolarHBondContact O-N 3.46Å; F527-F531 WeakPolarHBondContact O-CB 3.44Å; F527-F531 PolarHBondContact O-N 3.25Å; F527-F565 HydrophobicContact CE1-CZ 4.44Å; F527-F565 AromaticContact CZ-CZ 3.92Å; F527-F565 HydrophobicContact CZ-CZ 3.92Å
528	F	70.3	Confident	67.9	Low	104 Å²	104	73.4 Å²	73.4	46%	0.456	40%	0.404	S	S	.	.	H	α-helix	trans	-66.6	-42.3	-179.5	-174.1	-106.8	0	0	0	113.1	F524 I530 F531 L532	F524-F528 HydrophobicContact CE1-CB 4.49Å; F524-F528 WeakPolarHBondContact O-CB 3.27Å; F524-F528 PolarHBondContact O-N 2.77Å; F528-I530 VanDerWaalsContact C-N 3.32Å; F528-I530 PolarHBondContact O-N 3.27Å; F528-F531 PolarHBondContact O-N 3.41Å; F528-L532 HydrophobicContact CD1-CD1 3.98Å; F528-L532 HydrophobicContact CD1-CG 4.42Å; F528-L532 HydrophobicContact CE1-CD1 3.52Å; F528-L532 HydrophobicContact CE1-CG 4.11Å; F528-L532 HydrophobicContact CZ-CD1 4.02Å; F528-L532 HydrophobicContact CZ-CD2 4.35Å; F528-L532 HydrophobicContact CZ-CG 4.22Å; F528-L532 WeakPolarHBondContact O-CG 3.43Å; F528-L532 PolarHBondContact O-N 3.5Å
529	A	69.4	Low	68.8	Low	58 Å²	58	74.7 Å²	74.7	48%	0.479	41%	0.409	S	S	.	.	H	α-helix	trans	-63	-38.4	176.5	0	0	0	0	0	112.2	A525 L532 F533	A525-A529 WeakPolarHBondContact O-CB 3.39Å; A525-A529 PolarHBondContact O-N 3.19Å; A529-L532 PolarHBondContact O-N 2.82Å; A529-F533 WeakPolarHBondContact O-CB 3.34Å; A529-F533 PolarHBondContact O-N 2.98Å
530	I	71.7	Confident	69.5	Low	32 Å²	32	71.8 Å²	71.8	16%	0.164	39%	0.387	C	S	.	.	H	α-helix	trans	-73.1	-37.9	177.1	-67.5	174.5	0	0	0	111	L526 F527 F528 F533 F534 F568	L526-I530 HydrophobicContact CD2-CD1 3.68Å; L526-I530 HydrophobicContact CG-CD1 4.06Å; L526-I530 WeakPolarHBondContact O-CB 3.13Å; L526-I530 VanDerWaalsContact O-CG1 3.28Å; L526-I530 WeakPolarHBondContact O-CG1 3.4Å; L526-I530 PolarHBondContact O-N 3.34Å; L526-I530 VanDerWaalsContact O-N 3.13Å; F527-I530 PolarHBondContact O-N 3.46Å; F528-I530 VanDerWaalsContact C-N 3.32Å; F528-I530 PolarHBondContact O-N 3.27Å; I530-F533 PolarHBondContact O-N 3.18Å; I530-F534 HydrophobicContact CG2-CD2 3.51Å; I530-F534 HydrophobicContact CG2-CE2 3.51Å; I530-F534 WeakPolarHBondContact O-CB 3.26Å; I530-F534 VanDerWaalsContact O-CD2 3.29Å; I530-F534 WeakPolarHBondContact O-CD2 3.45Å; I530-F534 PolarHBondContact O-N 2.87Å; I530-F568 HydrophobicContact CB-CE1 4.29Å; I530-F568 HydrophobicContact CD1-CE1 3.64Å; I530-F568 HydrophobicContact CD1-CZ 3.52Å; I530-F568 HydrophobicContact CG2-CD1 3.9Å; I530-F568 HydrophobicContact CG2-CE1 3.59Å; I530-F568 HydrophobicContact CG2-CZ 4.19Å
531	F	72.1	Confident	70.1	Confident	100 Å²	100	74.8 Å²	74.8	44%	0.439	40%	0.398	S	S	.	.	H	α-helix	trans	-58.4	-45.7	170.1	173.6	-100.3	0	0	0	112.2	F527 F528 F534 G535 F565	F527-F531 WeakPolarHBondContact O-CB 3.44Å; F527-F531 PolarHBondContact O-N 3.25Å; F528-F531 PolarHBondContact O-N 3.41Å; F531-F534 PolarHBondContact O-N 3.17Å; F531-G535 PolarHBondContact O-N 2.71Å; F531-F565 HydrophobicContact CB-CE2 4.2Å; F531-F565 AromaticContact CD2-CE2 3.82Å; F531-F565 HydrophobicContact CD2-CE2 3.82Å; F531-F565 AromaticContact CD2-CZ 3.77Å; F531-F565 HydrophobicContact CD2-CZ 3.77Å
532	L	73.9	Confident	70.4	Confident	88 Å²	88	71.2 Å²	71.2	46%	0.461	37%	0.372	S	S	.	.	H	α-helix	trans	-62.7	-45.1	175.3	-73.8	179.4	0	0	0	112.4	F528 A529 F534 G535 M536	F528-L532 HydrophobicContact CD1-CD1 3.98Å; F528-L532 HydrophobicContact CD1-CG 4.42Å; F528-L532 HydrophobicContact CE1-CD1 3.52Å; F528-L532 HydrophobicContact CE1-CG 4.11Å; F528-L532 HydrophobicContact CZ-CD1 4.02Å; F528-L532 HydrophobicContact CZ-CD2 4.35Å; F528-L532 HydrophobicContact CZ-CG 4.22Å; F528-L532 WeakPolarHBondContact O-CG 3.43Å; F528-L532 PolarHBondContact O-N 3.5Å; A529-L532 PolarHBondContact O-N 2.82Å; L532-F534 PolarHBondContact O-N 3.47Å; L532-G535 PolarHBondContact O-N 3.23Å; L532-M536 WeakPolarHBondContact O-CG 3.24Å; L532-M536 PolarHBondContact O-N 3.02Å
533	F	72.9	Confident	70.7	Confident	123 Å²	123	69.4 Å²	69.4	54%	0.539	36%	0.36	S	S	.	.	H	α-helix	trans	-57.3	-49.3	176.4	179.4	-92.2	0	0	0	111.2	A529 I530 M536 F537	A529-F533 WeakPolarHBondContact O-CB 3.34Å; A529-F533 PolarHBondContact O-N 2.98Å; I530-F533 PolarHBondContact O-N 3.18Å; F533-M536 PolarHBondContact O-N 2.75Å; F533-F537 HydrophobicContact CD1-CD2 4.3Å; F533-F537 HydrophobicContact CD2-CE2 4.32Å; F533-F537 AromaticContact CE1-CD2 3.93Å; F533-F537 HydrophobicContact CE1-CD2 3.93Å; F533-F537 AromaticContact CE1-CE2 3.97Å; F533-F537 HydrophobicContact CE1-CE2 3.97Å; F533-F537 HydrophobicContact CE2-CD2 4.18Å; F533-F537 AromaticContact CE2-CE2 3.63Å; F533-F537 HydrophobicContact CE2-CE2 3.63Å; F533-F537 AromaticContact CZ-CD2 3.87Å; F533-F537 HydrophobicContact CZ-CD2 3.87Å; F533-F537 AromaticContact CZ-CE2 3.42Å; F533-F537 HydrophobicContact CZ-CE2 3.42Å; F533-F537 VanDerWaalsContact CZ-CE2 3.42Å; F533-F537 HydrophobicContact CZ-CZ 4.25Å; F533-F537 WeakPolarHBondContact O-CD2 3.41Å; F533-F537 PolarHBondContact O-N 3.29Å
534	F	73.9	Confident	70.8	Confident	45 Å²	45	71.6 Å²	71.6	20%	0.197	37%	0.367	C	S	.	.	H	α-helix	trans	-61.9	-43.2	176.3	-87.7	-54.3	0	0	0	112.2	I530 F531 L532 M536 F537 S538 F561 I564 F565 F568	I530-F534 HydrophobicContact CG2-CD2 3.51Å; I530-F534 HydrophobicContact CG2-CE2 3.51Å; I530-F534 WeakPolarHBondContact O-CB 3.26Å; I530-F534 VanDerWaalsContact O-CD2 3.29Å; I530-F534 WeakPolarHBondContact O-CD2 3.45Å; I530-F534 PolarHBondContact O-N 2.87Å; F531-F534 PolarHBondContact O-N 3.17Å; L532-F534 PolarHBondContact O-N 3.47Å; F534-M536 PolarHBondContact O-N 3.09Å; F534-F537 PolarHBondContact O-N 3.49Å; F534-S538 PolarHBondContact O-N 3.5Å; F534-F561 HydrophobicContact CB-CE2 3.62Å; F534-F561 HydrophobicContact CB-CZ 3.92Å; F534-F561 HydrophobicContact CD1-CE2 4.17Å; F534-F561 HydrophobicContact CG-CE2 4.26Å; F534-F561 WeakPolarHBondContact O-CE2 3.06Å; F534-I564 HydrophobicContact CE1-CG2 3.73Å; F534-I564 HydrophobicContact CZ-CG2 3.9Å; F534-F565 HydrophobicContact CD2-CD2 4.36Å; F534-F568 HydrophobicContact CE2-CG 4.4Å
535	G	72.1	Confident	71	Confident	21 Å²	21	65.4 Å²	65.4	22%	0.216	34%	0.34	C	S	.	.	H	α-helix	trans	-61.6	-39.7	177	0	0	0	0	0	114	F531 L532 S538 L539	F531-G535 PolarHBondContact O-N 2.71Å; L532-G535 PolarHBondContact O-N 3.23Å; G535-S538 PolarHBondContact O-N 3.07Å; G535-S538 PolarHBondContact O-OG 3.49Å; G535-S538 VanDerWaalsContact O-OG 3.08Å; G535-L539 WeakPolarHBondContact O-CG 3.26Å; G535-L539 PolarHBondContact O-N 2.91Å; G535-L539 VanDerWaalsContact O-N 3.17Å
536	M	73.7	Confident	70.7	Confident	70 Å²	70	63.3 Å²	63.3	35%	0.345	32%	0.323	S	S	.	.	H	α-helix	trans	-64.4	-41	174.3	-69	-58.4	-61.8	0	0	111.6	L532 F533 F534 T540 L727 I728	L532-M536 WeakPolarHBondContact O-CG 3.24Å; L532-M536 PolarHBondContact O-N 3.02Å; F533-M536 PolarHBondContact O-N 2.75Å; F534-M536 PolarHBondContact O-N 3.09Å; M536-T540 WeakPolarHBondContact O-CG2 3.48Å; M536-T540 PolarHBondContact O-N 3.23Å; M536-L727 HydrophobicContact CE-CD2 3.41Å; M536-L727 VanDerWaalsContact CE-CD2 3.41Å; M536-I728 HydrophobicContact CE-CG1 4.07Å
537	F	72.1	Confident	70.7	Confident	121 Å²	121	66.1 Å²	66.1	53%	0.531	34%	0.337	S	S	.	.	H	α-helix	trans	-68.4	-39.7	177.2	-91	-87.4	0	0	0	113	F533 F534 L539 T540 F541	F533-F537 HydrophobicContact CD1-CD2 4.3Å; F533-F537 HydrophobicContact CD2-CE2 4.32Å; F533-F537 AromaticContact CE1-CD2 3.93Å; F533-F537 HydrophobicContact CE1-CD2 3.93Å; F533-F537 AromaticContact CE1-CE2 3.97Å; F533-F537 HydrophobicContact CE1-CE2 3.97Å; F533-F537 HydrophobicContact CE2-CD2 4.18Å; F533-F537 AromaticContact CE2-CE2 3.63Å; F533-F537 HydrophobicContact CE2-CE2 3.63Å; F533-F537 AromaticContact CZ-CD2 3.87Å; F533-F537 HydrophobicContact CZ-CD2 3.87Å; F533-F537 AromaticContact CZ-CE2 3.42Å; F533-F537 HydrophobicContact CZ-CE2 3.42Å; F533-F537 VanDerWaalsContact CZ-CE2 3.42Å; F533-F537 HydrophobicContact CZ-CZ 4.25Å; F533-F537 WeakPolarHBondContact O-CD2 3.41Å; F533-F537 PolarHBondContact O-N 3.29Å; F534-F537 PolarHBondContact O-N 3.49Å; F537-L539 PolarHBondContact O-N 2.92Å; F537-T540 PolarHBondContact O-N 3.15Å; F537-T540 PolarHBondContact O-OG1 3.45Å; F537-F541 PolarHBondContact O-N 3.42Å
538	S	73.6	Confident	70.6	Confident	22 Å²	22	65.6 Å²	65.6	15%	0.154	34%	0.344	C	S	.	.	H	α-helix	trans	-66.3	-35.6	177.8	65.7	0	0	0	0	113	F534 G535 F541 T542	F534-S538 PolarHBondContact O-N 3.5Å; G535-S538 PolarHBondContact O-N 3.07Å; G535-S538 PolarHBondContact O-OG 3.49Å; G535-S538 VanDerWaalsContact O-OG 3.08Å; S538-F541 PolarHBondContact O-N 3.45Å; S538-T542 WeakPolarHBondContact O-CB 3.13Å; S538-T542 WeakPolarHBondContact O-CG2 3.32Å; S538-T542 PolarHBondContact O-N 3.45Å; S538-T542 PolarHBondContact O-OG1 3.37Å
539	L	71.3	Confident	70.3	Confident	80 Å²	80	65.9 Å²	65.9	42%	0.419	35%	0.35	S	S	.	.	H	α-helix	trans	-59.4	-51.2	169.3	-70.2	171.3	0	0	0	110.8	G535 F537 F541 T542 M543 Q731	G535-L539 WeakPolarHBondContact O-CG 3.26Å; G535-L539 PolarHBondContact O-N 2.91Å; G535-L539 VanDerWaalsContact O-N 3.17Å; F537-L539 PolarHBondContact O-N 2.92Å; L539-F541 VanDerWaalsContact C-N 3.28Å; L539-F541 PolarHBondContact O-N 2.98Å; L539-T542 WeakPolarHBondContact CA-OG1 3.3Å; L539-T542 PolarHBondContact O-N 3.31Å; L539-T542 PolarHBondContact O-OG1 3.24Å; L539-M543 WeakPolarHBondContact O-CG 3.32Å; L539-M543 PolarHBondContact O-N 3.42Å; L539-Q731 HydrophobicContact CB-CG 4.44Å; L539-Q731 PolarHBondContact O-OE1 3.23Å; L539-Q731 VanDerWaalsContact O-OE1 3.1Å
540	T	70.8	Confident	70.5	Confident	32 Å²	32	65.3 Å²	65.3	20%	0.196	34%	0.342	C	S	.	.	H	α-helix	trans	-59.7	-36.7	179.2	63.3	0	0	0	0	113.3	M536 F537 L544 L727	M536-T540 WeakPolarHBondContact O-CG2 3.48Å; M536-T540 PolarHBondContact O-N 3.23Å; F537-T540 PolarHBondContact O-N 3.15Å; F537-T540 PolarHBondContact O-OG1 3.45Å; T540-L544 PolarHBondContact O-N 3.25Å; T540-L544 VanDerWaalsContact O-N 3.13Å; T540-L727 HydrophobicContact CG2-CD1 4.16Å; T540-L727 HydrophobicContact CG2-CD2 4.14Å; T540-L727 HydrophobicContact CG2-CG 4.2Å
541	F	72.1	Confident	70.6	Confident	106 Å²	106	69.2 Å²	69.2	47%	0.465	37%	0.367	S	S	.	.	H	α-helix	trans	-78.8	-35.5	-178.4	-165.6	-126	0	0	0	112.7	F537 S538 L539 L544 I545 S557	F537-F541 PolarHBondContact O-N 3.42Å; S538-F541 PolarHBondContact O-N 3.45Å; L539-F541 VanDerWaalsContact C-N 3.28Å; L539-F541 PolarHBondContact O-N 2.98Å; F541-L544 PolarHBondContact O-N 2.83Å; F541-I545 HydrophobicContact CD1-CD1 3.94Å; F541-I545 HydrophobicContact CD2-CD1 4.35Å; F541-I545 HydrophobicContact CE1-CD1 3.59Å; F541-I545 HydrophobicContact CE2-CD1 4.03Å; F541-I545 HydrophobicContact CG-CD1 4.3Å; F541-I545 HydrophobicContact CZ-CD1 3.64Å; F541-I545 WeakPolarHBondContact O-CB 3.47Å; F541-I545 WeakPolarHBondContact O-CG1 3.04Å; F541-I545 PolarHBondContact O-N 3.41Å; F541-I545 VanDerWaalsContact O-N 3.1Å; F541-S557 WeakPolarHBondContact CD1-OG 3.49Å
542	T	67.8	Low	70.7	Confident	20 Å²	20	69 Å²	69	12%	0.123	38%	0.375	C	S	.	.	H	α-helix	trans	-67.4	-36.1	171.5	50.9	0	0	0	0	111.9	S538 L539 I545 A546 Y554	S538-T542 WeakPolarHBondContact O-CB 3.13Å; S538-T542 WeakPolarHBondContact O-CG2 3.32Å; S538-T542 PolarHBondContact O-N 3.45Å; S538-T542 PolarHBondContact O-OG1 3.37Å; L539-T542 WeakPolarHBondContact CA-OG1 3.3Å; L539-T542 PolarHBondContact O-N 3.31Å; L539-T542 PolarHBondContact O-OG1 3.24Å; T542-I545 PolarHBondContact O-N 2.94Å; T542-A546 WeakPolarHBondContact O-CB 3.38Å; T542-A546 PolarHBondContact O-N 3.32Å; T542-Y554 HydrophobicContact CG2-CD2 4.06Å; T542-Y554 HydrophobicContact CG2-CE2 3.89Å
543	M	68.6	Low	70.6	Confident	29 Å²	29	66 Å²	66	14%	0.143	36%	0.362	C	S	.	.	H	α-helix	trans	-61.4	-47.6	171.1	-74	-60.9	162.5	0	0	112.8	L539 I545 A546 Q731 G734 T735 L738	L539-M543 WeakPolarHBondContact O-CG 3.32Å; L539-M543 PolarHBondContact O-N 3.42Å; M543-I545 PolarHBondContact O-N 2.91Å; M543-A546 PolarHBondContact O-N 3.45Å; M543-Q731 VanDerWaalsContact CG-OE1 3.25Å; M543-G734 VanDerWaalsContact SD-C 3.54Å; M543-T735 HydrophobicContact CE-CG2 3.31Å; M543-T735 VanDerWaalsContact CE-N 3.35Å; M543-L738 HydrophobicContact SD-CD1 4.47Å
544	L	69.5	Low	70.4	Confident	102 Å²	102	66 Å²	66	53%	0.534	36%	0.359	S	S	.	.	H	α-helix	trans	-61	-35.4	178.9	-165.7	70.7	0	0	0	111.8	T540 F541	T540-L544 PolarHBondContact O-N 3.25Å; T540-L544 VanDerWaalsContact O-N 3.13Å; F541-L544 PolarHBondContact O-N 2.83Å
545	I	69.1	Low	70.5	Confident	31 Å²	31	68.7 Å²	68.7	16%	0.159	38%	0.375	C	S	.	.	H	α-helix	trans	-81.3	-28.1	179.6	-74.3	171.7	0	0	0	112.9	F541 T542 M543 I547 S548 A553	F541-I545 HydrophobicContact CD1-CD1 3.94Å; F541-I545 HydrophobicContact CD2-CD1 4.35Å; F541-I545 HydrophobicContact CE1-CD1 3.59Å; F541-I545 HydrophobicContact CE2-CD1 4.03Å; F541-I545 HydrophobicContact CG-CD1 4.3Å; F541-I545 HydrophobicContact CZ-CD1 3.64Å; F541-I545 WeakPolarHBondContact O-CB 3.47Å; F541-I545 WeakPolarHBondContact O-CG1 3.04Å; F541-I545 PolarHBondContact O-N 3.41Å; F541-I545 VanDerWaalsContact O-N 3.1Å; T542-I545 PolarHBondContact O-N 2.94Å; M543-I545 PolarHBondContact O-N 2.91Å; I545-I547 PolarHBondContact O-N 2.8Å; I545-S548 WeakPolarHBondContact O-CB 3.39Å; I545-S548 PolarHBondContact O-N 3.2Å; I545-S548 PolarHBondContact O-OG 3.17Å; I545-A553 HydrophobicContact CG2-CB 3.46Å; I545-A553 VanDerWaalsContact CG2-CB 3.46Å
546	A	63.9	Low	70.8	Confident	24 Å²	24	72.7 Å²	72.7	20%	0.198	39%	0.391	C	S	.	.	H	α-helix	trans	-57.7	-30.9	176.1	0	0	0	0	0	112.7	T542 M543 S548 N549 L738	T542-A546 WeakPolarHBondContact O-CB 3.38Å; T542-A546 PolarHBondContact O-N 3.32Å; M543-A546 PolarHBondContact O-N 3.45Å; A546-S548 PolarHBondContact O-N 3.32Å; A546-N549 PolarHBondContact O-N 3.02Å; A546-N549 VanDerWaalsContact O-N 3.08Å; A546-L738 HydrophobicContact CB-CD1 3.59Å
547	I	67.2	Low	70.9	Confident	102 Å²	102	69.5 Å²	69.5	52%	0.523	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-29.9	173.8	-57.5	171.3	0	0	0	111.8	I545 N549	I545-I547 PolarHBondContact O-N 2.8Å; I547-N549 PolarHBondContact O-N 3Å
548	S	67.3	Low	71.1	Confident	68 Å²	68	70.1 Å²	70.1	48%	0.476	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-4.1	178.8	76.2	0	0	0	0	114.7	I545 A546 S550	I545-S548 WeakPolarHBondContact O-CB 3.39Å; I545-S548 PolarHBondContact O-N 3.2Å; I545-S548 PolarHBondContact O-OG 3.17Å; A546-S548 PolarHBondContact O-N 3.32Å; S548-S550 PolarHBondContact O-N 2.61Å; S548-S550 PolarHBondContact OG-OG 3.25Å
549	N	63.6	Low	71.5	Confident	110 Å²	110	72.1 Å²	72.1	59%	0.588	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	17.9	178.5	-158.7	12.6	0	0	0	115.3	A546 I547 R742	A546-N549 PolarHBondContact O-N 3.02Å; A546-N549 VanDerWaalsContact O-N 3.08Å; I547-N549 PolarHBondContact O-N 3Å; N549-R742 PolarHBondContact OD1-NH1 3.08Å
550	S	73.9	Confident	72	Confident	46 Å²	46	71.7 Å²	71.7	32%	0.322	39%	0.389	S	S	.	.			trans	-111.6	115.3	-172.8	64.8	0	0	0	0	112.7	S548 T552 A553 Y554	S548-S550 PolarHBondContact O-N 2.61Å; S548-S550 PolarHBondContact OG-OG 3.25Å; S550-T552 PolarHBondContact O-N 3.02Å; S550-A553 PolarHBondContact O-N 3.02Å; S550-A553 WeakPolarHBondContact OG-CB 3.44Å; S550-Y554 PolarHBondContact O-N 3.16Å
551	V	72.5	Confident	72.3	Confident	113 Å²	113	72 Å²	72	69%	0.685	39%	0.388	S	S	*	.	H	α-helix	trans	-61	-33.6	-180	-178.3	0	0	0	0	111.5	Y554 L555	V551-Y554 PolarHBondContact O-N 3.12Å; V551-L555 HydrophobicContact CG1-CD1 4.47Å; V551-L555 WeakPolarHBondContact O-CG 3.48Å; V551-L555 PolarHBondContact O-N 3.4Å
552	T	75.8	Confident	72.7	Confident	97 Å²	97	70.2 Å²	70.2	60%	0.595	38%	0.383	S	S	*	.	H	α-helix	trans	-61.9	-42.8	175.6	46.3	0	0	0	0	112.6	S550 Y554 L555 I556	S550-T552 PolarHBondContact O-N 3.02Å; T552-Y554 PolarHBondContact O-N 3.34Å; T552-L555 PolarHBondContact O-N 2.71Å; T552-I556 WeakPolarHBondContact O-CD1 3.44Å; T552-I556 VanDerWaalsContact O-CG1 3.28Å; T552-I556 WeakPolarHBondContact O-CG1 3.12Å; T552-I556 PolarHBondContact O-N 2.76Å
553	A	70.2	Confident	73.5	Confident	24 Å²	24	74.3 Å²	74.3	20%	0.198	40%	0.403	C	S	.	.	H	α-helix	trans	-69.8	-32.6	-179.7	0	0	0	0	0	112.4	I545 S550 I556 S557	I545-A553 HydrophobicContact CG2-CB 3.46Å; I545-A553 VanDerWaalsContact CG2-CB 3.46Å; S550-A553 PolarHBondContact O-N 3.02Å; S550-A553 WeakPolarHBondContact OG-CB 3.44Å; A553-I556 PolarHBondContact O-N 2.93Å; A553-S557 VanDerWaalsContact O-CB 3.27Å; A553-S557 WeakPolarHBondContact O-CB 3.43Å; A553-S557 PolarHBondContact O-N 3.07Å
554	Y	69	Low	74	Confident	122 Å²	122	76.7 Å²	76.7	48%	0.478	42%	0.416	S	S	.	.	H	α-helix	trans	-61	-46.2	170.9	176.3	-94.7	0	0	0	111.6	T542 S550 V551 T552 I556 S557 W558	T542-Y554 HydrophobicContact CG2-CD2 4.06Å; T542-Y554 HydrophobicContact CG2-CE2 3.89Å; S550-Y554 PolarHBondContact O-N 3.16Å; V551-Y554 PolarHBondContact O-N 3.12Å; T552-Y554 PolarHBondContact O-N 3.34Å; Y554-I556 PolarHBondContact O-N 2.94Å; Y554-S557 WeakPolarHBondContact O-CB 3.45Å; Y554-S557 PolarHBondContact O-N 3.18Å; Y554-W558 PolarHBondContact O-N 3.26Å
555	L	77	Confident	74.5	Confident	102 Å²	102	73.9 Å²	73.9	53%	0.534	40%	0.399	S	S	.	.	H	α-helix	trans	-65.3	-37.3	177.4	-67.5	171.4	0	0	0	112.6	V551 T552 S559	V551-L555 HydrophobicContact CG1-CD1 4.47Å; V551-L555 WeakPolarHBondContact O-CG 3.48Å; V551-L555 PolarHBondContact O-N 3.4Å; T552-L555 PolarHBondContact O-N 2.71Å; L555-S559 WeakPolarHBondContact O-CB 3.37Å; L555-S559 PolarHBondContact O-N 2.98Å; L555-S559 PolarHBondContact O-OG 3.32Å
556	I	78.7	Confident	75.1	Confident	105 Å²	105	77 Å²	77	54%	0.538	42%	0.415	S	S	.	.	H	α-helix	trans	-67	-43.7	174.6	-67.5	162.6	0	0	0	111	T552 A553 Y554 W558 S559 V560	T552-I556 WeakPolarHBondContact O-CD1 3.44Å; T552-I556 VanDerWaalsContact O-CG1 3.28Å; T552-I556 WeakPolarHBondContact O-CG1 3.12Å; T552-I556 PolarHBondContact O-N 2.76Å; A553-I556 PolarHBondContact O-N 2.93Å; Y554-I556 PolarHBondContact O-N 2.94Å; I556-W558 PolarHBondContact O-N 2.9Å; I556-S559 PolarHBondContact O-N 3.01Å; I556-S559 PolarHBondContact O-OG 3.09Å; I556-S559 VanDerWaalsContact O-OG 3.12Å; I556-V560 HydrophobicContact CG2-CG2 4.38Å; I556-V560 WeakPolarHBondContact O-CB 3.33Å; I556-V560 VanDerWaalsContact O-CG2 3.32Å; I556-V560 WeakPolarHBondContact O-CG2 3.3Å; I556-V560 PolarHBondContact O-N 3.43Å
557	S	74.2	Confident	76	Confident	4 Å²	4	80.5 Å²	80.5	3%	0.028	43%	0.43	C	S	.	.	H	α-helix	trans	-56.4	-49.1	175.5	-179	0	0	0	0	111.6	F541 A553 Y554 F561	F541-S557 WeakPolarHBondContact CD1-OG 3.49Å; A553-S557 VanDerWaalsContact O-CB 3.27Å; A553-S557 WeakPolarHBondContact O-CB 3.43Å; A553-S557 PolarHBondContact O-N 3.07Å; Y554-S557 WeakPolarHBondContact O-CB 3.45Å; Y554-S557 PolarHBondContact O-N 3.18Å; S557-F561 WeakPolarHBondContact O-CB 3.43Å; S557-F561 PolarHBondContact O-N 3.24Å; S557-F561 VanDerWaalsContact O-N 3.07Å
558	W	77.4	Confident	76.5	Confident	134 Å²	134	78.2 Å²	78.2	51%	0.508	42%	0.416	S	S	.	.	H	α-helix	trans	-70.4	-35.2	-179.1	-166.1	78.2	0	0	0	113.2	Y554 I556 L562	Y554-W558 PolarHBondContact O-N 3.26Å; I556-W558 PolarHBondContact O-N 2.9Å; W558-L562 HydrophobicContact CE3-CD1 4.41Å; W558-L562 HydrophobicContact CH2-CD1 3.64Å; W558-L562 HydrophobicContact CZ2-CD1 4.03Å; W558-L562 HydrophobicContact CZ3-CD1 3.85Å; W558-L562 VanDerWaalsContact O-CB 3.29Å; W558-L562 WeakPolarHBondContact O-CB 3.44Å; W558-L562 PolarHBondContact O-N 2.97Å
559	S	81.4	Confident	77	Confident	63 Å²	63	76.1 Å²	76.1	44%	0.441	40%	0.401	S	S	.	.	H	α-helix	trans	-72.6	-39.9	177.5	69.4	0	0	0	0	112.9	L555 I556 F561 L562 L563	L555-S559 WeakPolarHBondContact O-CB 3.37Å; L555-S559 PolarHBondContact O-N 2.98Å; L555-S559 PolarHBondContact O-OG 3.32Å; I556-S559 PolarHBondContact O-N 3.01Å; I556-S559 PolarHBondContact O-OG 3.09Å; I556-S559 VanDerWaalsContact O-OG 3.12Å; S559-F561 VanDerWaalsContact C-N 3.32Å; S559-F561 PolarHBondContact O-N 3.15Å; S559-L562 PolarHBondContact O-N 2.88Å; S559-L563 WeakPolarHBondContact O-CB 3.48Å; S559-L563 PolarHBondContact O-N 2.82Å
560	V	81.8	Confident	77.7	Confident	71 Å²	71	73.8 Å²	73.8	43%	0.43	39%	0.393	S	S	.	.	H	α-helix	trans	-62.5	-41.3	172.5	170.7	0	0	0	0	110.7	I556 L563 I564	I556-V560 HydrophobicContact CG2-CG2 4.38Å; I556-V560 WeakPolarHBondContact O-CB 3.33Å; I556-V560 VanDerWaalsContact O-CG2 3.32Å; I556-V560 WeakPolarHBondContact O-CG2 3.3Å; I556-V560 PolarHBondContact O-N 3.43Å; V560-L563 PolarHBondContact O-N 2.81Å; V560-I564 HydrophobicContact CG1-CD1 3.96Å; V560-I564 VanDerWaalsContact O-CG1 3.32Å; V560-I564 WeakPolarHBondContact O-CG1 3.49Å; V560-I564 PolarHBondContact O-N 3Å; V560-I564 VanDerWaalsContact O-N 3.1Å
561	F	77	Confident	77.8	Confident	40 Å²	40	74.7 Å²	74.7	18%	0.175	39%	0.394	C	S	.	.	H	α-helix	trans	-59.7	-51.5	174.2	174.1	-108.7	0	0	0	112.7	F534 S557 S559 L563 I564 F565	F534-F561 HydrophobicContact CB-CE2 3.62Å; F534-F561 HydrophobicContact CB-CZ 3.92Å; F534-F561 HydrophobicContact CD1-CE2 4.17Å; F534-F561 HydrophobicContact CG-CE2 4.26Å; F534-F561 WeakPolarHBondContact O-CE2 3.06Å; S557-F561 WeakPolarHBondContact O-CB 3.43Å; S557-F561 PolarHBondContact O-N 3.24Å; S557-F561 VanDerWaalsContact O-N 3.07Å; S559-F561 VanDerWaalsContact C-N 3.32Å; S559-F561 PolarHBondContact O-N 3.15Å; F561-L563 VanDerWaalsContact C-N 3.31Å; F561-L563 PolarHBondContact O-N 3.06Å; F561-I564 PolarHBondContact O-N 3.1Å; F561-F565 PolarHBondContact O-N 2.9Å
562	L	80.6	Confident	77.9	Confident	68 Å²	68	70.3 Å²	70.3	36%	0.356	37%	0.367	S	S	.	.	H	α-helix	trans	-63.8	-36.5	-178.8	-174.9	149	0	0	0	111.7	W558 S559 F565 I566	W558-L562 HydrophobicContact CE3-CD1 4.41Å; W558-L562 HydrophobicContact CH2-CD1 3.64Å; W558-L562 HydrophobicContact CZ2-CD1 4.03Å; W558-L562 HydrophobicContact CZ3-CD1 3.85Å; W558-L562 VanDerWaalsContact O-CB 3.29Å; W558-L562 WeakPolarHBondContact O-CB 3.44Å; W558-L562 PolarHBondContact O-N 2.97Å; S559-L562 PolarHBondContact O-N 2.88Å; L562-F565 PolarHBondContact O-N 2.85Å; L562-I566 HydrophobicContact CD2-CD1 3.55Å; L562-I566 HydrophobicContact CD2-CG1 4.39Å; L562-I566 HydrophobicContact CG-CD1 4.39Å; L562-I566 WeakPolarHBondContact O-CB 3.49Å; L562-I566 WeakPolarHBondContact O-CG1 3.44Å; L562-I566 PolarHBondContact O-N 3.05Å
563	L	84.4	Confident	77.9	Confident	106 Å²	106	69.3 Å²	69.3	56%	0.555	36%	0.36	S	S	*	.	H	α-helix	trans	-59.4	-51.2	172	-173.9	87.6	0	0	0	111.7	S559 V560 F561 F565 I566 I567	S559-L563 WeakPolarHBondContact O-CB 3.48Å; S559-L563 PolarHBondContact O-N 2.82Å; V560-L563 PolarHBondContact O-N 2.81Å; F561-L563 VanDerWaalsContact C-N 3.31Å; F561-L563 PolarHBondContact O-N 3.06Å; L563-F565 VanDerWaalsContact C-N 3.32Å; L563-F565 PolarHBondContact O-N 3.34Å; L563-I566 PolarHBondContact O-N 2.9Å; L563-I567 HydrophobicContact CD2-CD1 4.19Å; L563-I567 HydrophobicContact CG-CD1 3.89Å; L563-I567 VanDerWaalsContact O-CG1 3.32Å; L563-I567 WeakPolarHBondContact O-CG1 3.42Å; L563-I567 PolarHBondContact O-N 2.91Å
564	I	80.4	Confident	78.2	Confident	79 Å²	79	72.1 Å²	72.1	41%	0.405	38%	0.375	S	S	.	.	H	α-helix	trans	-61.2	-42.2	-179.6	-69	165.4	0	0	0	110.7	F534 V560 F561 I567 F568	F534-I564 HydrophobicContact CE1-CG2 3.73Å; F534-I564 HydrophobicContact CZ-CG2 3.9Å; V560-I564 HydrophobicContact CG1-CD1 3.96Å; V560-I564 VanDerWaalsContact O-CG1 3.32Å; V560-I564 WeakPolarHBondContact O-CG1 3.49Å; V560-I564 PolarHBondContact O-N 3Å; V560-I564 VanDerWaalsContact O-N 3.1Å; F561-I564 PolarHBondContact O-N 3.1Å; I564-I567 PolarHBondContact O-N 3.47Å; I564-F568 PolarHBondContact O-N 2.59Å
565	F	78.8	Confident	78.3	Confident	42 Å²	42	66.8 Å²	66.8	18%	0.184	36%	0.355	C	S	.	.	H	α-helix	trans	-63.5	-43.4	176.8	-176	-106.1	0	0	0	112.4	F527 F531 F534 F561 L562 L563 F568 C569	F527-F565 HydrophobicContact CE1-CZ 4.44Å; F527-F565 AromaticContact CZ-CZ 3.92Å; F527-F565 HydrophobicContact CZ-CZ 3.92Å; F531-F565 HydrophobicContact CB-CE2 4.2Å; F531-F565 AromaticContact CD2-CE2 3.82Å; F531-F565 HydrophobicContact CD2-CE2 3.82Å; F531-F565 AromaticContact CD2-CZ 3.77Å; F531-F565 HydrophobicContact CD2-CZ 3.77Å; F534-F565 HydrophobicContact CD2-CD2 4.36Å; F561-F565 PolarHBondContact O-N 2.9Å; L562-F565 PolarHBondContact O-N 2.85Å; L563-F565 VanDerWaalsContact C-N 3.32Å; L563-F565 PolarHBondContact O-N 3.34Å; F565-F568 PolarHBondContact O-N 2.96Å; F565-C569 PolarHBondContact O-N 3.31Å; F565-C569 PolarHBondContact O-SG 3.43Å
566	I	82.8	Confident	78.2	Confident	97 Å²	97	67 Å²	67	50%	0.497	35%	0.35	S	S	.	.	H	α-helix	trans	-64.5	-41.9	176.4	-73.4	177.7	0	0	0	111.8	L562 L563 F568 C569 S570	L562-I566 HydrophobicContact CD2-CD1 3.55Å; L562-I566 HydrophobicContact CD2-CG1 4.39Å; L562-I566 HydrophobicContact CG-CD1 4.39Å; L562-I566 WeakPolarHBondContact O-CB 3.49Å; L562-I566 WeakPolarHBondContact O-CG1 3.44Å; L562-I566 PolarHBondContact O-N 3.05Å; L563-I566 PolarHBondContact O-N 2.9Å; I566-F568 VanDerWaalsContact C-N 3.3Å; I566-F568 PolarHBondContact O-N 3.46Å; I566-C569 PolarHBondContact O-N 3.31Å; I566-S570 WeakPolarHBondContact O-CB 3.37Å; I566-S570 PolarHBondContact O-N 3.22Å; I566-S570 PolarHBondContact O-OG 2.66Å
567	I	82.8	Confident	77.9	Confident	98 Å²	98	68.2 Å²	68.2	50%	0.503	35%	0.348	S	S	.	.	H	α-helix	trans	-61.5	-40.6	176.1	-69.6	166.4	0	0	0	110.8	L563 I564 S570 L571	L563-I567 HydrophobicContact CD2-CD1 4.19Å; L563-I567 HydrophobicContact CG-CD1 3.89Å; L563-I567 VanDerWaalsContact O-CG1 3.32Å; L563-I567 WeakPolarHBondContact O-CG1 3.42Å; L563-I567 PolarHBondContact O-N 2.91Å; I564-I567 PolarHBondContact O-N 3.47Å; I567-S570 PolarHBondContact O-OG 2.98Å; I567-S570 VanDerWaalsContact O-OG 3.09Å; I567-L571 PolarHBondContact O-N 3.13Å; I567-L571 VanDerWaalsContact O-N 3.16Å
568	F	76.7	Confident	77.6	Confident	53 Å²	53	68 Å²	68	23%	0.232	35%	0.347	C	S	.	.	H	α-helix	trans	-67.7	-42	177	-170.4	-98.5	0	0	0	112.3	I530 F534 I564 F565 I566 L571 I572	I530-F568 HydrophobicContact CB-CE1 4.29Å; I530-F568 HydrophobicContact CD1-CE1 3.64Å; I530-F568 HydrophobicContact CD1-CZ 3.52Å; I530-F568 HydrophobicContact CG2-CD1 3.9Å; I530-F568 HydrophobicContact CG2-CE1 3.59Å; I530-F568 HydrophobicContact CG2-CZ 4.19Å; F534-F568 HydrophobicContact CE2-CG 4.4Å; I564-F568 PolarHBondContact O-N 2.59Å; F565-F568 PolarHBondContact O-N 2.96Å; I566-F568 VanDerWaalsContact C-N 3.3Å; I566-F568 PolarHBondContact O-N 3.46Å; F568-L571 PolarHBondContact O-N 3.5Å; F568-I572 HydrophobicContact CD1-CD1 4.06Å; F568-I572 HydrophobicContact CE1-CD1 3.39Å; F568-I572 HydrophobicContact CE1-CG1 4.28Å; F568-I572 HydrophobicContact CZ-CD1 3.87Å; F568-I572 HydrophobicContact CZ-CG1 4.48Å; F568-I572 PolarHBondContact O-N 3.02Å
569	C	77.7	Confident	77.1	Confident	25 Å²	25	66.1 Å²	66.1	17%	0.169	35%	0.347	C	S	.	.	H	α-helix	trans	-63.6	-43.9	176.1	-66.5	0	0	0	0	112.2	F565 I566 L571 I572 V573	F565-C569 PolarHBondContact O-N 3.31Å; F565-C569 PolarHBondContact O-SG 3.43Å; I566-C569 PolarHBondContact O-N 3.31Å; C569-L571 VanDerWaalsContact C-N 3.34Å; C569-L571 PolarHBondContact O-N 3.32Å; C569-I572 PolarHBondContact O-N 2.98Å; C569-V573 WeakPolarHBondContact O-CG2 3.08Å; C569-V573 PolarHBondContact O-N 3.31Å
570	S	78.8	Confident	76.3	Confident	61 Å²	61	71.6 Å²	71.6	43%	0.427	36%	0.358	S	S	.	.	H	α-helix	trans	-66.8	-34.9	-179.3	68.3	0	0	0	0	112.2	I566 I567 V573 V574	I566-S570 WeakPolarHBondContact O-CB 3.37Å; I566-S570 PolarHBondContact O-N 3.22Å; I566-S570 PolarHBondContact O-OG 2.66Å; I567-S570 PolarHBondContact O-OG 2.98Å; I567-S570 VanDerWaalsContact O-OG 3.09Å; S570-V573 PolarHBondContact O-N 2.89Å; S570-V574 WeakPolarHBondContact O-CG2 3.39Å; S570-V574 PolarHBondContact O-N 3.31Å
571	L	75.7	Confident	75.4	Confident	65 Å²	65	74.5 Å²	74.5	34%	0.34	37%	0.365	S	S	.	.	H	α-helix	trans	-61.9	-44.5	173.3	-170.9	153.1	0	0	0	111.9	I567 F568 C569 V573 V574 V575 F593	I567-L571 PolarHBondContact O-N 3.13Å; I567-L571 VanDerWaalsContact O-N 3.16Å; F568-L571 PolarHBondContact O-N 3.5Å; C569-L571 VanDerWaalsContact C-N 3.34Å; C569-L571 PolarHBondContact O-N 3.32Å; L571-V573 VanDerWaalsContact C-N 3.34Å; L571-V573 PolarHBondContact O-N 3.3Å; L571-V574 PolarHBondContact O-N 2.83Å; L571-V575 HydrophobicContact CD2-CG2 4.33Å; L571-V575 WeakPolarHBondContact O-CG2 3.39Å; L571-V575 PolarHBondContact O-N 3.2Å; L571-F593 HydrophobicContact CD1-CE2 4.42Å; L571-F593 HydrophobicContact CD2-CE2 3.87Å; L571-F593 HydrophobicContact CD2-CZ 4.44Å
572	I	73.8	Confident	74.6	Confident	21 Å²	21	77.7 Å²	77.7	11%	0.108	38%	0.383	C	S	.	.	H	α-helix	trans	-62	-42	175	-70.5	178.4	0	0	0	111.1	V522 L526 F568 C569 V575 Y576	V522-I572 HydrophobicContact CG1-CG2 3.76Å; V522-I572 HydrophobicContact CG2-CG2 4.45Å; L526-I572 HydrophobicContact CD2-CD1 4.3Å; F568-I572 HydrophobicContact CD1-CD1 4.06Å; F568-I572 HydrophobicContact CE1-CD1 3.39Å; F568-I572 HydrophobicContact CE1-CG1 4.28Å; F568-I572 HydrophobicContact CZ-CD1 3.87Å; F568-I572 HydrophobicContact CZ-CG1 4.48Å; F568-I572 PolarHBondContact O-N 3.02Å; C569-I572 PolarHBondContact O-N 2.98Å; I572-V575 PolarHBondContact O-N 3.12Å; I572-Y576 PolarHBondContact O-N 2.7Å
573	V	76.1	Confident	73.9	Confident	76 Å²	76	80.7 Å²	80.7	46%	0.461	39%	0.39	S	S	.	.	H	α-helix	trans	-64	-40.6	177.4	171.8	0	0	0	0	111.6	C569 S570 L571 Y576 Y577	C569-V573 WeakPolarHBondContact O-CG2 3.08Å; C569-V573 PolarHBondContact O-N 3.31Å; S570-V573 PolarHBondContact O-N 2.89Å; L571-V573 VanDerWaalsContact C-N 3.34Å; L571-V573 PolarHBondContact O-N 3.3Å; V573-Y576 PolarHBondContact O-N 3.47Å; V573-Y577 HydrophobicContact CG1-CD2 3.69Å; V573-Y577 HydrophobicContact CG1-CE2 3.9Å; V573-Y577 WeakPolarHBondContact O-CD2 3.33Å; V573-Y577 PolarHBondContact O-N 2.7Å
574	V	77.2	Confident	73	Confident	82 Å²	82	79.5 Å²	79.5	50%	0.497	38%	0.379	S	S	.	.	H	α-helix	trans	-62.9	-41.3	174.6	167.4	0	0	0	0	111.5	S570 L571 G578	S570-V574 WeakPolarHBondContact O-CG2 3.39Å; S570-V574 PolarHBondContact O-N 3.31Å; L571-V574 PolarHBondContact O-N 2.83Å; V574-G578 PolarHBondContact O-N 2.67Å
575	V	72.1	Confident	72.5	Confident	11 Å²	11	80.6 Å²	80.6	7%	0.067	39%	0.389	C	S	.	.	H	α-helix	trans	-62.5	-47.9	174.6	170.1	0	0	0	0	111.2	L571 I572 Y577 G578 D579 I589 A590	L571-V575 HydrophobicContact CD2-CG2 4.33Å; L571-V575 WeakPolarHBondContact O-CG2 3.39Å; L571-V575 PolarHBondContact O-N 3.2Å; I572-V575 PolarHBondContact O-N 3.12Å; V575-Y577 PolarHBondContact O-N 2.94Å; V575-G578 PolarHBondContact O-N 3.07Å; V575-D579 WeakPolarHBondContact O-CB 3.41Å; V575-D579 PolarHBondContact O-N 3.46Å; V575-I589 HydrophobicContact CG2-CG2 4.08Å; V575-A590 HydrophobicContact CG1-CB 3.89Å
576	Y	73.3	Confident	72.1	Confident	107 Å²	107	78.8 Å²	78.8	42%	0.42	38%	0.382	S	S	.	.	H	α-helix	trans	-62.6	-43.1	-179.5	-178.5	-94.4	0	0	0	113.6	I572 V573 R580	I572-Y576 PolarHBondContact O-N 2.7Å; V573-Y576 PolarHBondContact O-N 3.47Å; Y576-R580 PolarHBondContact O-N 3.08Å; Y576-R580 PolarHBondContact OH-NH2 2.86Å
577	Y	73.6	Confident	71.3	Confident	129 Å²	129	78.2 Å²	78.2	51%	0.506	38%	0.378	S	S	.	.	H	α-helix	trans	-74.4	-31.4	177	-88	-74.7	0	0	0	113.3	V573 V575 K581	V573-Y577 HydrophobicContact CG1-CD2 3.69Å; V573-Y577 HydrophobicContact CG1-CE2 3.9Å; V573-Y577 WeakPolarHBondContact O-CD2 3.33Å; V573-Y577 PolarHBondContact O-N 2.7Å; V575-Y577 PolarHBondContact O-N 2.94Å; Y577-K581 PolarHBondContact O-N 3.11Å
578	G	68.3	Low	70.6	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-72.2	-38.4	179.1	0	0	0	0	0	112.8	V574 V575 K581 N582 W583 S586	V574-G578 PolarHBondContact O-N 2.67Å; V575-G578 PolarHBondContact O-N 3.07Å; G578-K581 CarbonylContact O-C 3.14Å; G578-K581 PolarHBondContact O-N 3.08Å; G578-K581 VanDerWaalsContact O-N 3.09Å; G578-N582 PolarHBondContact O-N 3.07Å; G578-W583 PolarHBondContact O-N 3.25Å; G578-S586 VanDerWaalsContact C-OG 3.24Å; G578-S586 WeakPolarHBondContact CA-OG 3.28Å
579	D	65.6	Low	70.3	Confident	95 Å²	95	79.9 Å²	79.9	51%	0.508	39%	0.39	S	S	.	.	H	α-helix	trans	-56.9	-52.6	171	-172.7	61.7	0	0	0	111	V575 K581 N582	V575-D579 WeakPolarHBondContact O-CB 3.41Å; V575-D579 PolarHBondContact O-N 3.46Å; D579-K581 PolarHBondContact O-N 3.02Å; D579-N582 PolarHBondContact O-N 2.7Å; D579-N582 VanDerWaalsContact O-N 3.12Å; D579-N582 PolarHBondContact O-OD1 2.65Å
580	R	64.4	Low	69.9	Low	177 Å²	177	79.2 Å²	79.2	67%	0.668	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-14.1	173.7	-82.7	-171.7	169.2	-158.4	-2.2	115.6	Y576	Y576-R580 PolarHBondContact O-N 3.08Å; Y576-R580 PolarHBondContact OH-NH2 2.86Å
581	K	62.7	Low	69.3	Low	133 Å²	133	78.3 Å²	78.3	58%	0.578	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	11.3	-179.6	-69	-171.6	176.5	-176.5	0	113.5	Y577 G578 D579 W583	Y577-K581 PolarHBondContact O-N 3.11Å; G578-K581 CarbonylContact O-C 3.14Å; G578-K581 PolarHBondContact O-N 3.08Å; G578-K581 VanDerWaalsContact O-N 3.09Å; D579-K581 PolarHBondContact O-N 3.02Å; K581-W583 HydrophobicContact CB-CD2 4.45Å; K581-W583 HydrophobicContact CB-CG 4.27Å; K581-W583 HydrophobicContact CD-CZ2 4.03Å; K581-W583 PolarHBondContact O-N 3.3Å
582	N	60	Low	69.1	Low	107 Å²	107	80.7 Å²	80.7	57%	0.572	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.8	41.4	-176.7	-62.6	-17	0	0	0	113.4	L429 G578 D579 Y584	L429-N582 HydrophobicContact CD2-CB 4.07Å; G578-N582 PolarHBondContact O-N 3.07Å; D579-N582 PolarHBondContact O-N 2.7Å; D579-N582 VanDerWaalsContact O-N 3.12Å; D579-N582 PolarHBondContact O-OD1 2.65Å; N582-Y584 PolarHBondContact O-N 2.84Å
583	W	66.9	Low	69	Low	131 Å²	131	82.7 Å²	82.7	50%	0.496	39%	0.392	S	S	.	.			trans	-77.2	104.2	176.3	-71.1	0.4	0	0	0	110	G578 K581 T585 S586 M587	G578-W583 PolarHBondContact O-N 3.25Å; K581-W583 HydrophobicContact CB-CD2 4.45Å; K581-W583 HydrophobicContact CB-CG 4.27Å; K581-W583 HydrophobicContact CD-CZ2 4.03Å; K581-W583 PolarHBondContact O-N 3.3Å; W583-T585 PolarHBondContact O-N 3.15Å; W583-S586 PolarHBondContact O-N 3Å; W583-S586 PolarHBondContact O-OG 3.19Å; W583-M587 PolarHBondContact O-N 3.17Å
584	Y	65.5	Low	68.7	Low	80 Å²	80	79.3 Å²	79.3	31%	0.314	37%	0.372	S	S	.	.	H	α-helix	trans	-47.2	-43.2	-176.1	-59.7	-68.3	0	0	0	114	K428 L429 N582 S586 M587 D588	K428-Y584 HydrophobicContact CB-CD1 3.68Å; K428-Y584 HydrophobicContact CB-CE1 3.28Å; K428-Y584 HydrophobicContact CD-CE1 4.38Å; K428-Y584 HydrophobicContact CG-CE1 4.48Å; K428-Y584 WeakPolarHBondContact O-CD1 3.48Å; K428-Y584 WeakPolarHBondContact O-CE1 3.45Å; L429-Y584 HydrophobicContact CD2-CD1 4.44Å; L429-Y584 HydrophobicContact CD2-CE1 3.51Å; L429-Y584 HydrophobicContact CG-CE1 3.89Å; N582-Y584 PolarHBondContact O-N 2.84Å; Y584-S586 PolarHBondContact O-N 3.35Å; Y584-M587 PolarHBondContact O-N 3.18Å; Y584-D588 PolarHBondContact O-N 2.92Å
585	T	68.9	Low	68.3	Low	102 Å²	102	79.6 Å²	79.6	63%	0.626	36%	0.364	S	S	*	.	H	α-helix	trans	-65.3	-31.8	-179.1	49.5	0	0	0	0	114	W583 I589	W583-T585 PolarHBondContact O-N 3.15Å; T585-I589 VanDerWaalsContact O-CD1 3.3Å; T585-I589 WeakPolarHBondContact O-CD1 3.41Å; T585-I589 VanDerWaalsContact O-CG1 3.23Å; T585-I589 WeakPolarHBondContact O-CG1 3.48Å; T585-I589 PolarHBondContact O-N 3.1Å
586	S	71.8	Confident	68.4	Low	4 Å²	4	81.8 Å²	81.8	3%	0.028	38%	0.377	C	S	.	.	H	α-helix	trans	-75.3	-31.6	174.9	58.1	0	0	0	0	112.1	G578 W583 Y584 I589 A590	G578-S586 VanDerWaalsContact C-OG 3.24Å; G578-S586 WeakPolarHBondContact CA-OG 3.28Å; W583-S586 PolarHBondContact O-N 3Å; W583-S586 PolarHBondContact O-OG 3.19Å; Y584-S586 PolarHBondContact O-N 3.35Å; S586-I589 PolarHBondContact O-N 3.36Å; S586-A590 WeakPolarHBondContact O-CB 3.37Å; S586-A590 PolarHBondContact O-N 2.94Å
587	M	65.8	Low	68.3	Low	85 Å²	85	80.8 Å²	80.8	42%	0.419	38%	0.376	S	S	.	.	H	α-helix	trans	-72.6	-40.7	180	-154.4	173.4	-162.8	0	0	111.5	W583 Y584 I589 A590 N591	W583-M587 PolarHBondContact O-N 3.17Å; Y584-M587 PolarHBondContact O-N 3.18Å; M587-I589 VanDerWaalsContact C-N 3.29Å; M587-I589 PolarHBondContact O-N 3.31Å; M587-A590 PolarHBondContact O-N 3.26Å; M587-N591 WeakPolarHBondContact O-CB 3.45Å; M587-N591 VanDerWaalsContact O-CG 3.27Å; M587-N591 PolarHBondContact O-N 2.98Å
588	D	67.3	Low	68.1	Low	112 Å²	112	77 Å²	77	60%	0.599	37%	0.368	S	S	*	.	H	α-helix	trans	-56.9	-42.4	170.1	-80.2	-30.2	0	0	0	112	Y584 F592	Y584-D588 PolarHBondContact O-N 2.92Å; D588-F592 WeakPolarHBondContact O-CB 3.29Å; D588-F592 PolarHBondContact O-N 2.85Å
589	I	70.9	Confident	68.2	Low	74 Å²	74	82.7 Å²	82.7	38%	0.379	39%	0.389	S	S	.	.	H	α-helix	trans	-66.3	-45.1	177.3	-69.8	168.2	0	0	0	111	V575 T585 S586 M587 F592 F593	V575-I589 HydrophobicContact CG2-CG2 4.08Å; T585-I589 VanDerWaalsContact O-CD1 3.3Å; T585-I589 WeakPolarHBondContact O-CD1 3.41Å; T585-I589 VanDerWaalsContact O-CG1 3.23Å; T585-I589 WeakPolarHBondContact O-CG1 3.48Å; T585-I589 PolarHBondContact O-N 3.1Å; S586-I589 PolarHBondContact O-N 3.36Å; M587-I589 VanDerWaalsContact C-N 3.29Å; M587-I589 PolarHBondContact O-N 3.31Å; I589-F592 WeakPolarHBondContact O-CB 3.5Å; I589-F592 PolarHBondContact O-N 3.14Å; I589-F593 HydrophobicContact CG2-CD2 3.79Å; I589-F593 HydrophobicContact CG2-CE2 3.71Å; I589-F593 VanDerWaalsContact O-CD2 3.31Å; I589-F593 WeakPolarHBondContact O-CD2 2.92Å; I589-F593 PolarHBondContact O-N 3.04Å
590	A	68.7	Low	68.5	Low	11 Å²	11	83 Å²	83	9%	0.091	39%	0.39	C	S	.	.	H	α-helix	trans	-59	-49	176.6	0	0	0	0	0	111.6	L520 V575 S586 M587 F592 F593 A594	L520-A590 HydrophobicContact CB-CB 4.32Å; V575-A590 HydrophobicContact CG1-CB 3.89Å; S586-A590 WeakPolarHBondContact O-CB 3.37Å; S586-A590 PolarHBondContact O-N 2.94Å; M587-A590 PolarHBondContact O-N 3.26Å; A590-F592 VanDerWaalsContact C-N 3.27Å; A590-F592 PolarHBondContact O-N 2.7Å; A590-F593 PolarHBondContact O-N 3.38Å; A590-A594 WeakPolarHBondContact O-CB 3.4Å; A590-A594 PolarHBondContact O-N 3.04Å
591	N	67.7	Low	69	Low	42 Å²	42	83 Å²	83	23%	0.225	39%	0.39	C	S	.	.	H	α-helix	trans	-66.9	-26.8	179.3	-67.7	-8.7	0	0	0	112.3	M587 R595	M587-N591 WeakPolarHBondContact O-CB 3.45Å; M587-N591 VanDerWaalsContact O-CG 3.27Å; M587-N591 PolarHBondContact O-N 2.98Å; N591-R595 WeakPolarHBondContact O-CG 3.41Å; N591-R595 PolarHBondContact O-N 3Å; N591-R595 PolarHBondContact O-NE 3.25Å
592	F	71.1	Confident	69.5	Low	115 Å²	115	77.4 Å²	77.4	50%	0.504	37%	0.366	S	S	.	.	H	α-helix	trans	-67.5	-53.6	169.2	177.5	-99.4	0	0	0	111.7	D588 I589 A590 A594 R595 V596	D588-F592 WeakPolarHBondContact O-CB 3.29Å; D588-F592 PolarHBondContact O-N 2.85Å; I589-F592 WeakPolarHBondContact O-CB 3.5Å; I589-F592 PolarHBondContact O-N 3.14Å; A590-F592 VanDerWaalsContact C-N 3.27Å; A590-F592 PolarHBondContact O-N 2.7Å; F592-A594 PolarHBondContact O-N 3.29Å; F592-R595 PolarHBondContact O-N 2.8Å; F592-V596 HydrophobicContact CE1-CG2 4.17Å; F592-V596 HydrophobicContact CE2-CG2 4.39Å; F592-V596 HydrophobicContact CZ-CG2 4.07Å; F592-V596 WeakPolarHBondContact O-CG2 3.43Å; F592-V596 PolarHBondContact O-N 3.13Å
593	F	71.2	Confident	70.3	Confident	63 Å²	63	74.2 Å²	74.2	28%	0.276	35%	0.35	S	S	.	.	H	α-helix	trans	-62	-41.6	-179.5	-80.7	-68.3	0	0	0	112.7	L520 L571 I589 A590 R595 V596 F597	L520-F593 HydrophobicContact CD1-CB 4.49Å; L571-F593 HydrophobicContact CD1-CE2 4.42Å; L571-F593 HydrophobicContact CD2-CE2 3.87Å; L571-F593 HydrophobicContact CD2-CZ 4.44Å; I589-F593 HydrophobicContact CG2-CD2 3.79Å; I589-F593 HydrophobicContact CG2-CE2 3.71Å; I589-F593 VanDerWaalsContact O-CD2 3.31Å; I589-F593 WeakPolarHBondContact O-CD2 2.92Å; I589-F593 PolarHBondContact O-N 3.04Å; A590-F593 PolarHBondContact O-N 3.38Å; F593-R595 PolarHBondContact O-N 3.29Å; F593-V596 PolarHBondContact O-N 3.44Å; F593-V596 VanDerWaalsContact O-N 3.15Å; F593-F597 HydrophobicContact CB-CD2 4.4Å; F593-F597 HydrophobicContact CB-CE2 4.31Å; F593-F597 WeakPolarHBondContact O-CD2 3.44Å; F593-F597 PolarHBondContact O-N 2.95Å
594	A	69.2	Low	70.4	Confident	5 Å²	5	74.3 Å²	74.3	4%	0.041	35%	0.352	C	S	.	.	H	α-helix	trans	-58.9	-44.8	178.6	0	0	0	0	0	112.8	V518 A590 F592 V596 F597 S598	V518-A594 HydrophobicContact CB-CB 4.08Å; V518-A594 HydrophobicContact CG1-CB 3.89Å; V518-A594 WeakPolarHBondContact O-CB 3.25Å; A590-A594 WeakPolarHBondContact O-CB 3.4Å; A590-A594 PolarHBondContact O-N 3.04Å; F592-A594 PolarHBondContact O-N 3.29Å; A594-V596 VanDerWaalsContact C-N 3.33Å; A594-V596 PolarHBondContact O-N 2.91Å; A594-F597 PolarHBondContact O-N 3.23Å; A594-S598 WeakPolarHBondContact O-CB 3.41Å; A594-S598 PolarHBondContact O-N 3.43Å
595	R	70	Confident	70.6	Confident	89 Å²	89	72.1 Å²	72.1	34%	0.336	35%	0.345	S	S	.	.	H	α-helix	trans	-66.5	-31.9	176.4	-70	-179.7	-68.3	-170.3	0.3	112.7	L515 D516 N591 F592 F593 R599	L515-R595 HydrophobicContact CB-CG 4.28Å; L515-R595 HydrophobicContact CD2-CG 4.16Å; L515-R595 WeakPolarHBondContact O-CD 3.23Å; L515-R595 WeakPolarHBondContact O-CG 3.36Å; D516-R595 IonicContact OD1-NH1 3.47Å; D516-R595 PolarHBondContact OD1-NH1 2.84Å; N591-R595 WeakPolarHBondContact O-CG 3.41Å; N591-R595 PolarHBondContact O-N 3Å; N591-R595 PolarHBondContact O-NE 3.25Å; F592-R595 PolarHBondContact O-N 2.8Å; F593-R595 PolarHBondContact O-N 3.29Å; R595-R599 WeakPolarHBondContact O-CG 3.46Å; R595-R599 PolarHBondContact O-N 3.25Å
596	V	73.5	Confident	70.5	Confident	56 Å²	56	67.4 Å²	67.4	34%	0.339	32%	0.316	S	S	.	.	H	α-helix	trans	-68.6	-49.4	172.5	172.2	0	0	0	0	111.2	F592 F593 A594 S598 R599 I600	F592-V596 HydrophobicContact CE1-CG2 4.17Å; F592-V596 HydrophobicContact CE2-CG2 4.39Å; F592-V596 HydrophobicContact CZ-CG2 4.07Å; F592-V596 WeakPolarHBondContact O-CG2 3.43Å; F592-V596 PolarHBondContact O-N 3.13Å; F593-V596 PolarHBondContact O-N 3.44Å; F593-V596 VanDerWaalsContact O-N 3.15Å; A594-V596 VanDerWaalsContact C-N 3.33Å; A594-V596 PolarHBondContact O-N 2.91Å; V596-S598 VanDerWaalsContact C-N 3.34Å; V596-S598 PolarHBondContact O-N 3.5Å; V596-R599 PolarHBondContact O-N 3.49Å; V596-I600 HydrophobicContact CG1-CD1 3.78Å; V596-I600 WeakPolarHBondContact O-CG1 3.45Å; V596-I600 PolarHBondContact O-N 3.47Å
597	F	71.2	Confident	70.2	Confident	87 Å²	87	69.6 Å²	69.6	38%	0.382	33%	0.327	S	S	.	.	H	α-helix	trans	-60.7	-40.6	178.1	-77.9	-62.2	0	0	0	112.6	L520 F593 A594 R599 I600 R601	L520-F597 HydrophobicContact CD1-CD2 4.09Å; L520-F597 HydrophobicContact CD1-CE2 4.3Å; F593-F597 HydrophobicContact CB-CD2 4.4Å; F593-F597 HydrophobicContact CB-CE2 4.31Å; F593-F597 WeakPolarHBondContact O-CD2 3.44Å; F593-F597 PolarHBondContact O-N 2.95Å; A594-F597 PolarHBondContact O-N 3.23Å; F597-R599 PolarHBondContact O-N 3.18Å; F597-I600 PolarHBondContact O-N 3.25Å; F597-R601 WeakPolarHBondContact O-CB 3.25Å; F597-R601 PolarHBondContact O-N 2.7Å
598	S	68.8	Low	70.1	Confident	49 Å²	49	67.1 Å²	67.1	34%	0.343	32%	0.317	S	S	.	.	H	α-helix	trans	-57.8	-47.7	175.2	-177.9	0	0	0	0	112.1	A594 V596 I600 R601 L602	A594-S598 WeakPolarHBondContact O-CB 3.41Å; A594-S598 PolarHBondContact O-N 3.43Å; V596-S598 VanDerWaalsContact C-N 3.34Å; V596-S598 PolarHBondContact O-N 3.5Å; S598-I600 PolarHBondContact O-N 3.33Å; S598-R601 PolarHBondContact O-N 2.78Å; S598-L602 PolarHBondContact O-N 2.95Å
599	R	71.5	Confident	69.8	Low	119 Å²	119	67.6 Å²	67.6	45%	0.449	32%	0.319	S	S	.	.	H	α-helix	trans	-64.2	-39.2	177.8	-73.5	173.7	170.7	-175.4	-4.5	112.9	R595 V596 F597 L602 V603	R595-R599 WeakPolarHBondContact O-CG 3.46Å; R595-R599 PolarHBondContact O-N 3.25Å; V596-R599 PolarHBondContact O-N 3.49Å; F597-R599 PolarHBondContact O-N 3.18Å; R599-L602 PolarHBondContact O-N 3.41Å; R599-V603 WeakPolarHBondContact O-CG2 3.4Å; R599-V603 PolarHBondContact O-N 3.34Å; R599-V603 VanDerWaalsContact O-N 3.08Å
600	I	72.4	Confident	69.1	Low	103 Å²	103	70.4 Å²	70.4	53%	0.528	33%	0.331	S	S	.	.	H	α-helix	trans	-64.4	-44.8	175.4	-67.8	168.4	0	0	0	110.8	V596 F597 S598 L602 V603 Y604	V596-I600 HydrophobicContact CG1-CD1 3.78Å; V596-I600 WeakPolarHBondContact O-CG1 3.45Å; V596-I600 PolarHBondContact O-N 3.47Å; F597-I600 PolarHBondContact O-N 3.25Å; S598-I600 PolarHBondContact O-N 3.33Å; I600-L602 VanDerWaalsContact C-N 3.33Å; I600-L602 PolarHBondContact O-N 3.22Å; I600-V603 PolarHBondContact O-N 3.39Å; I600-Y604 PolarHBondContact O-N 3.31Å
601	R	73.6	Confident	68.5	Low	177 Å²	177	72.9 Å²	72.9	67%	0.668	35%	0.351	S	S	*	.	H	α-helix	trans	-59.1	-43.2	175.8	-174.6	-179.9	-176.6	-177.5	0.2	111.7	F597 S598 Y604 N605	F597-R601 WeakPolarHBondContact O-CB 3.25Å; F597-R601 PolarHBondContact O-N 2.7Å; S598-R601 PolarHBondContact O-N 2.78Å; R601-Y604 PolarHBondContact O-N 2.93Å; R601-N605 WeakPolarHBondContact O-CB 3.34Å; R601-N605 PolarHBondContact O-N 2.84Å; R601-N605 PolarHBondContact O-OD1 2.95Å
602	L	73.9	Confident	67.9	Low	15 Å²	15	73.1 Å²	73.1	8%	0.079	36%	0.355	C	S	.	.	H	α-helix	trans	-61.3	-47.7	177.2	-153	-180	0	0	0	111.3	S598 R599 I600 Y604 N605 I606 F657 P661 L816 T820	S598-L602 PolarHBondContact O-N 2.95Å; R599-L602 PolarHBondContact O-N 3.41Å; I600-L602 VanDerWaalsContact C-N 3.33Å; I600-L602 PolarHBondContact O-N 3.22Å; L602-Y604 PolarHBondContact O-N 3.22Å; L602-N605 PolarHBondContact O-N 3.28Å; L602-I606 HydrophobicContact CD2-CD1 3.46Å; L602-I606 VanDerWaalsContact CD2-CD1 3.46Å; L602-I606 HydrophobicContact CD2-CG1 4.01Å; L602-I606 WeakPolarHBondContact O-CG1 3.41Å; L602-I606 PolarHBondContact O-N 2.82Å; L602-I606 VanDerWaalsContact O-N 3.08Å; L602-F657 HydrophobicContact CD1-CD1 4.41Å; L602-P661 HydrophobicContact CD1-CG 4.41Å; L602-P661 HydrophobicContact CD2-CB 3.91Å; L602-P661 HydrophobicContact CD2-CG 4.07Å; L602-L816 HydrophobicContact CD2-CD2 3.9Å; L602-T820 HydrophobicContact CD1-CG2 3.95Å; L602-T820 HydrophobicContact CG-CG2 4.46Å
603	V	75.6	Confident	66.8	Low	39 Å²	39	75.8 Å²	75.8	24%	0.236	37%	0.371	C	S	.	.	H	α-helix	trans	-59.9	-43	175.5	170.8	0	0	0	0	111.9	R599 I600 I606 L607 L660 P661 L664	R599-V603 WeakPolarHBondContact O-CG2 3.4Å; R599-V603 PolarHBondContact O-N 3.34Å; R599-V603 VanDerWaalsContact O-N 3.08Å; I600-V603 PolarHBondContact O-N 3.39Å; V603-I606 PolarHBondContact O-N 3.48Å; V603-L607 WeakPolarHBondContact O-CB 3.04Å; V603-L607 PolarHBondContact O-N 3.34Å; V603-L660 HydrophobicContact CG2-CB 4.25Å; V603-P661 HydrophobicContact CG2-CG 3.78Å; V603-L664 HydrophobicContact CG1-CD1 3.9Å
604	Y	69.4	Low	65.8	Low	133 Å²	133	78 Å²	78	52%	0.522	39%	0.386	S	S	.	.	H	α-helix	trans	-63.3	-43.7	177.3	179	-93	0	0	0	112.4	I600 R601 L602 I606 L607 T608	I600-Y604 PolarHBondContact O-N 3.31Å; R601-Y604 PolarHBondContact O-N 2.93Å; L602-Y604 PolarHBondContact O-N 3.22Å; Y604-I606 VanDerWaalsContact C-N 3.35Å; Y604-I606 PolarHBondContact O-N 3.43Å; Y604-L607 PolarHBondContact O-N 3.4Å; Y604-T608 HydrophobicContact CD1-CG2 4.22Å; Y604-T608 HydrophobicContact CD2-CG2 4.4Å; Y604-T608 HydrophobicContact CE1-CG2 3.79Å; Y604-T608 HydrophobicContact CE2-CG2 3.98Å; Y604-T608 WeakPolarHBondContact O-CB 3.33Å; Y604-T608 WeakPolarHBondContact O-CG2 3.32Å; Y604-T608 PolarHBondContact O-N 3.02Å; Y604-T608 PolarHBondContact O-OG1 2.74Å
605	N	69.6	Low	64.6	Low	34 Å²	34	81.1 Å²	81.1	18%	0.182	41%	0.407	C	S	.	.	H	α-helix	trans	-62.5	-39.5	178.2	-70.9	-0.7	0	0	0	112.2	R601 L602 T608 H610 F819	R601-N605 WeakPolarHBondContact O-CB 3.34Å; R601-N605 PolarHBondContact O-N 2.84Å; R601-N605 PolarHBondContact O-OD1 2.95Å; L602-N605 PolarHBondContact O-N 3.28Å; N605-T608 PolarHBondContact O-OG1 3.02Å; N605-H610 PolarHBondContact O-N 3.23Å; N605-F819 HydrophobicContact CB-CD1 3.69Å; N605-F819 HydrophobicContact CB-CE1 3.61Å; N605-F819 HydrophobicContact CB-CZ 4.42Å
606	I	68	Low	63.5	Low	4 Å²	4	86.1 Å²	86.1	2%	0.021	43%	0.434	C	S	.	.	H	α-helix	trans	-65.2	-50.5	173.2	-68.7	171.1	0	0	0	110.5	L602 V603 Y604 T608 L609 P661 L664 M668 L816 F819	L602-I606 HydrophobicContact CD2-CD1 3.46Å; L602-I606 VanDerWaalsContact CD2-CD1 3.46Å; L602-I606 HydrophobicContact CD2-CG1 4.01Å; L602-I606 WeakPolarHBondContact O-CG1 3.41Å; L602-I606 PolarHBondContact O-N 2.82Å; L602-I606 VanDerWaalsContact O-N 3.08Å; V603-I606 PolarHBondContact O-N 3.48Å; Y604-I606 VanDerWaalsContact C-N 3.35Å; Y604-I606 PolarHBondContact O-N 3.43Å; I606-T608 VanDerWaalsContact C-N 3.27Å; I606-T608 PolarHBondContact O-N 3.41Å; I606-L609 PolarHBondContact O-N 3.28Å; I606-P661 HydrophobicContact CD1-CB 3.75Å; I606-L664 HydrophobicContact CG2-CB 4.13Å; I606-M668 HydrophobicContact CG2-CE 4.3Å; I606-M668 HydrophobicContact CG2-SD 4.05Å; I606-M668 WeakPolarHBondContact O-CE 3.24Å; I606-L816 HydrophobicContact CD1-CD2 3.87Å; I606-F819 HydrophobicContact CG1-CD2 4.24Å; I606-F819 HydrophobicContact CG1-CE2 3.9Å; I606-F819 HydrophobicContact CG1-CZ 4.44Å
607	L	65.3	Low	62.3	Low	49 Å²	49	89 Å²	89	26%	0.257	45%	0.447	S	S	.	.	H	α-helix	trans	-67.3	-26.1	-174.4	-171.4	136.8	0	0	0	113.3	V603 Y604 L609 I770	V603-L607 WeakPolarHBondContact O-CB 3.04Å; V603-L607 PolarHBondContact O-N 3.34Å; Y604-L607 PolarHBondContact O-N 3.4Å; L607-L609 VanDerWaalsContact C-N 3.3Å; L607-I770 HydrophobicContact CD1-CD1 4.24Å
608	T	62.6	Low	61.4	Low	34 Å²	34	86.6 Å²	86.6	21%	0.209	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-5.2	171.8	49.7	0	0	0	0	114	Y604 N605 I606 H610 V717	Y604-T608 HydrophobicContact CD1-CG2 4.22Å; Y604-T608 HydrophobicContact CD2-CG2 4.4Å; Y604-T608 HydrophobicContact CE1-CG2 3.79Å; Y604-T608 HydrophobicContact CE2-CG2 3.98Å; Y604-T608 WeakPolarHBondContact O-CB 3.33Å; Y604-T608 WeakPolarHBondContact O-CG2 3.32Å; Y604-T608 PolarHBondContact O-N 3.02Å; Y604-T608 PolarHBondContact O-OG1 2.74Å; N605-T608 PolarHBondContact O-OG1 3.02Å; I606-T608 VanDerWaalsContact C-N 3.27Å; I606-T608 PolarHBondContact O-N 3.41Å; T608-H610 PolarHBondContact O-N 3.37Å; T608-V717 HydrophobicContact CG2-CG2 4.31Å
609	L	61	Low	60.6	Low	122 Å²	122	88 Å²	88	64%	0.639	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	23.5	-176.8	-76.9	165.4	0	0	0	114.2	I606 L607 A611 M668	I606-L609 PolarHBondContact O-N 3.28Å; L607-L609 VanDerWaalsContact C-N 3.3Å; L609-A611 VanDerWaalsContact C-N 3.25Å; L609-A611 PolarHBondContact O-N 2.93Å; L609-M668 HydrophobicContact CD1-CE 4.26Å; L609-M668 HydrophobicContact CD2-CE 3.43Å; L609-M668 VanDerWaalsContact CD2-CE 3.43Å; L609-M668 HydrophobicContact CG-CE 3.62Å
610	H	57.8	Low	60.1	Low	133 Å²	133	87.4 Å²	87.4	62%	0.616	47%	0.47	S	S	*	.			trans	-80	69.2	-178.8	-174.6	79.6	0	0	0	110.9	N605 T608 P612 F819	N605-H610 PolarHBondContact O-N 3.23Å; T608-H610 PolarHBondContact O-N 3.37Å; H610-P612 WeakPolarHBondContact O-CD 3.18Å; H610-F819 WeakPolarHBondContact O-CE1 3.01Å
611	A	54.9	Low	59.9	Low	63 Å²	63	84.1 Å²	84.1	52%	0.521	45%	0.453	S	S	.	.			trans	-62.4	114.8	175.4	0	0	0	0	0	109.9	L609	L609-A611 VanDerWaalsContact C-N 3.25Å; L609-A611 PolarHBondContact O-N 2.93Å
612	P	54.6	Low	59.8	Low	47 Å²	47	77 Å²	77	31%	0.305	43%	0.43	S	S	.	.			trans	-67.8	142.8	175.1	28.7	-32.7	0	0	0	109.5	H610 A818 F819	H610-P612 WeakPolarHBondContact O-CD 3.18Å; P612-A818 HydrophobicContact CG-CB 3.9Å; P612-A818 WeakPolarHBondContact CG-O 3.49Å; P612-F819 HydrophobicContact CG-CD1 4.31Å
613	M	48.1	Very low	59.9	Low	171 Å²	171	76.9 Å²	76.9	84%	0.842	43%	0.429	S	S	*	.			trans	-74.4	132.7	164	-70.5	-70.1	126	0	0	108.1	S615	M613-S615 PolarHBondContact O-N 3.06Å
614	N	50.6	Low	60.3	Low	109 Å²	109	75.2 Å²	75.2	58%	0.583	42%	0.42	S	S	*	.			trans	-69.7	115.3	168.9	-68.8	12.5	0	0	0	107.9	A818	N614-A818 WeakPolarHBondContact OD1-CB 3.19Å
615	S	44.6	Very low	61.1	Low	70 Å²	70	69.2 Å²	69.2	49%	0.49	40%	0.396	S	S	.	.			trans	-74.4	163.1	161.6	53.6	0	0	0	0	110.2	M613 D617 S618	M613-S615 PolarHBondContact O-N 3.06Å; S615-D617 WeakPolarHBondContact CB-OD2 3.38Å; S615-D617 PolarHBondContact O-N 3.05Å; S615-D617 VanDerWaalsContact O-N 3.14Å; S615-D617 PolarHBondContact OG-OD2 3.36Å; S615-S618 PolarHBondContact O-OG 3.03Å
616	E	47.1	Very low	61.9	Low	195 Å²	195	68 Å²	68	91%	0.911	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-5.8	-171.6	-59.1	-173.4	139.3	0	0	113.1	S618	E616-S618 PolarHBondContact O-N 3.36Å
617	D	48	Very low	62.8	Low	115 Å²	115	68.3 Å²	68.3	62%	0.615	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	8.5	174.2	-44.3	-68.2	0	0	0	115.2	S615 A619	S615-D617 WeakPolarHBondContact CB-OD2 3.38Å; S615-D617 PolarHBondContact O-N 3.05Å; S615-D617 VanDerWaalsContact O-N 3.14Å; S615-D617 PolarHBondContact OG-OD2 3.36Å; D617-A619 PolarHBondContact O-N 2.85Å
618	S	51.3	Low	63.6	Low	37 Å²	37	66.2 Å²	66.2	26%	0.259	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-63.1	-7.8	-170.7	-66.9	0	0	0	0	114.7	S615 E616 H823	S615-S618 PolarHBondContact O-OG 3.03Å; E616-S618 PolarHBondContact O-N 3.36Å; S618-H823 PolarHBondContact O-NE2 2.77Å
619	A	52.4	Low	64	Low	78 Å²	78	69.2 Å²	69.2	65%	0.645	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-73.3	-23.4	-176	0	0	0	0	0	115.1	P478 D617	P478-A619 WeakPolarHBondContact CG-O 3.15Å; D617-A619 PolarHBondContact O-N 2.85Å
620	S	62.3	Low	64.1	Low	107 Å²	107	66.7 Å²	66.7	75%	0.748	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-103.2	-2.7	-171.6	63.2	0	0	0	0	115
621	M	66.6	Low	64.5	Low	35 Å²	35	63.3 Å²	63.3	17%	0.172	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-71.3	132	179.4	-68.2	159.2	53.7	0	0	110.9	S822	M621-S822 WeakPolarHBondContact CE-O 3.08Å
622	P	72	Confident	64.9	Low	28 Å²	28	67.6 Å²	67.6	18%	0.182	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-78.1	155.2	-177	34.3	-36.5	0	0	0	112	R512 W514 H823	R512-P622 HydrophobicContact CB-CB 4.13Å; W514-P622 HydrophobicContact CD2-CG 4.42Å; W514-P622 HydrophobicContact CZ2-CG 3.68Å; W514-P622 VanDerWaalsContact NE1-CG 3.26Å; P622-H823 PolarHBondContact O-N 2.92Å; P622-H823 VanDerWaalsContact O-N 3.1Å
623	V	77	Confident	65.3	Low	11 Å²	11	65.6 Å²	65.6	7%	0.067	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	138.2	-172.9	178.1	0	0	0	0	111.4	C476 P478 S511 F625 H823 R825	C476-V623 WeakPolarHBondContact O-CG2 3.47Å; P478-V623 HydrophobicContact CB-CG2 4.44Å; S511-V623 WeakPolarHBondContact CA-O 3.38Å; V623-F625 HydrophobicContact CG1-CE1 3.97Å; V623-F625 HydrophobicContact CG1-CE2 4.34Å; V623-F625 HydrophobicContact CG1-CZ 3.86Å; V623-H823 VanDerWaalsContact CA-O 3.3Å; V623-H823 WeakPolarHBondContact CA-O 3.43Å; V623-H823 HydrophobicContact CG2-CB 4.31Å; V623-R825 HydrophobicContact CG1-CG 3.95Å
624	S	82.3	Confident	65.9	Low	5 Å²	5	60.1 Å²	60.1	4%	0.035	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	160.2	162.6	89.3	0	0	0	0	112	H656 H823 T824 R825	S624-H656 PolarHBondContact OG-NE2 2.84Å; S624-H656 VanDerWaalsContact OG-NE2 3.11Å; S624-H823 PolarHBondContact N-O 3.02Å; S624-T824 WeakPolarHBondContact O-CA 3.4Å; S624-T824 VanDerWaalsContact OG-CG2 3.32Å; S624-T824 WeakPolarHBondContact OG-CG2 3.49Å; S624-R825 PolarHBondContact O-N 2.9Å
625	F	87	Confident	66.1	Low	6 Å²	6	56.8 Å²	56.8	3%	0.026	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.8	-174.4	-60	-73.7	0	0	0	112.2	V475 C476 M507 V623 F627 R825 V827 I861	V475-F625 HydrophobicContact CG1-CE1 3.89Å; V475-F625 HydrophobicContact CG1-CZ 4.17Å; C476-F625 WeakPolarHBondContact SG-CE2 3.43Å; C476-F625 VanDerWaalsContact SG-CZ 3.57Å; M507-F625 HydrophobicContact CB-CD2 3.89Å; M507-F625 HydrophobicContact CB-CE2 3.97Å; M507-F625 HydrophobicContact CB-CG 4.49Å; M507-F625 HydrophobicContact CE-CD1 3.45Å; M507-F625 VanDerWaalsContact CE-CD1 3.45Å; M507-F625 HydrophobicContact CE-CD2 4.13Å; M507-F625 HydrophobicContact CE-CE1 3.47Å; M507-F625 VanDerWaalsContact CE-CE1 3.47Å; M507-F625 HydrophobicContact CE-CE2 4.14Å; M507-F625 HydrophobicContact CE-CG 3.79Å; M507-F625 HydrophobicContact CE-CZ 3.82Å; M507-F625 HydrophobicContact CG-CE2 4.46Å; M507-F625 WeakPolarHBondContact O-CD2 3.49Å; M507-F625 WeakPolarHBondContact O-CE2 3.45Å; V623-F625 HydrophobicContact CG1-CE1 3.97Å; V623-F625 HydrophobicContact CG1-CE2 4.34Å; V623-F625 HydrophobicContact CG1-CZ 3.86Å; F625-F627 HydrophobicContact CB-CD2 4.23Å; F625-F627 HydrophobicContact CB-CE2 3.58Å; F625-F627 HydrophobicContact CB-CZ 4.12Å; F625-F627 HydrophobicContact CG-CE2 4.48Å; F625-R825 WeakPolarHBondContact CA-O 3.49Å; F625-R825 HydrophobicContact CD1-CB 3.86Å; F625-R825 HydrophobicContact CE1-CB 4.08Å; F625-V827 HydrophobicContact CB-CG2 4.1Å; F625-V827 HydrophobicContact CD1-CG2 3.75Å; F625-V827 HydrophobicContact CG-CG2 4.3Å; F625-I861 HydrophobicContact CD1-CD1 4.39Å; F625-I861 HydrophobicContact CE1-CD1 4.05Å
626	L	86.8	Confident	66.6	Low	10 Å²	10	60.4 Å²	60.4	5%	0.052	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	111.5	172.2	-56.9	178.4	0	0	0	108.8	A652 A653 H656 F657 R825 L826 V827	L626-A652 HydrophobicContact CB-CB 4.2Å; L626-A652 HydrophobicContact CD2-CB 4.49Å; L626-A653 HydrophobicContact CD1-CB 4.47Å; L626-H656 HydrophobicContact CD2-CB 3.66Å; L626-F657 HydrophobicContact CD1-CE2 4.32Å; L626-R825 PolarHBondContact N-O 3.46Å; L626-L826 HydrophobicContact CB-CD2 3.7Å; L626-L826 HydrophobicContact CD1-CD2 3.97Å; L626-L826 HydrophobicContact CG-CD2 4.35Å; L626-V827 PolarHBondContact O-N 3.24Å
627	F	85.9	Confident	67.4	Low	9 Å²	9	52.7 Å²	52.7	4%	0.039	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	143.2	-177	-68.9	-95.1	0	0	0	112	K504 M507 H508 F625 V827 V829	K504-F627 HydrophobicContact CB-CD1 4.37Å; K504-F627 HydrophobicContact CB-CE1 3.97Å; K504-F627 HydrophobicContact CB-CZ 4.19Å; K504-F627 HydrophobicContact CD-CB 4.28Å; K504-F627 HydrophobicContact CD-CD1 3.97Å; K504-F627 HydrophobicContact CD-CD2 4.28Å; K504-F627 HydrophobicContact CD-CE1 4.39Å; K504-F627 HydrophobicContact CD-CG 3.92Å; K504-F627 HydrophobicContact CG-CD1 3.9Å; K504-F627 HydrophobicContact CG-CD2 4.02Å; K504-F627 HydrophobicContact CG-CE1 3.82Å; K504-F627 HydrophobicContact CG-CE2 3.94Å; K504-F627 HydrophobicContact CG-CG 4.01Å; K504-F627 HydrophobicContact CG-CZ 3.85Å; M507-F627 HydrophobicContact CB-CZ 3.84Å; M507-F627 HydrophobicContact CE-CE1 4.27Å; M507-F627 HydrophobicContact CE-CZ 3.89Å; M507-F627 HydrophobicContact SD-CE1 4.17Å; M507-F627 HydrophobicContact SD-CZ 3.96Å; H508-F627 AromaticContact CD2-CE2 3.7Å; H508-F627 AromaticContact CE1-CD2 3.74Å; H508-F627 AromaticContact CE1-CE2 3.71Å; H508-F627 AromaticContact NE2-CD2 3.28Å; H508-F627 VanDerWaalsContact NE2-CD2 3.28Å; H508-F627 WeakPolarHBondContact NE2-CD2 3.11Å; H508-F627 AromaticContact NE2-CE2 3.36Å; H508-F627 WeakPolarHBondContact NE2-CE2 3.13Å; F625-F627 HydrophobicContact CB-CD2 4.23Å; F625-F627 HydrophobicContact CB-CE2 3.58Å; F625-F627 HydrophobicContact CB-CZ 4.12Å; F625-F627 HydrophobicContact CG-CE2 4.48Å; F627-V827 WeakPolarHBondContact CA-O 3.41Å; F627-V827 HydrophobicContact CD1-CB 3.65Å; F627-V827 HydrophobicContact CD1-CG1 3.75Å; F627-V827 HydrophobicContact CD1-CG2 4.31Å; F627-V827 HydrophobicContact CE1-CB 3.78Å; F627-V827 HydrophobicContact CE1-CG1 3.61Å; F627-V827 HydrophobicContact CE1-CG2 4.06Å; F627-V827 HydrophobicContact CG-CB 4.21Å; F627-V827 HydrophobicContact CZ-CB 4.42Å; F627-V827 HydrophobicContact CZ-CG2 4.23Å; F627-V829 HydrophobicContact CD1-CG2 4.34Å
628	A	83.2	Confident	68.4	Low	5 Å²	5	47.9 Å²	47.9	4%	0.041	28%	0.278	C	S	.	.			trans	-77	120.7	159.6	0	0	0	0	0	109.8	Y630 I645 L649 V827	A628-Y630 VanDerWaalsContact C-N 3.34Å; A628-I645 HydrophobicContact CB-CG2 3.92Å; A628-L649 HydrophobicContact CB-CD2 3.92Å; A628-L649 HydrophobicContact CB-CG 4.06Å; A628-V827 PolarHBondContact N-O 3.42Å
629	D	70.9	Confident	69.5	Low	98 Å²	98	49 Å²	49	52%	0.524	28%	0.279	S	S	.	.	S	Bend	trans	-74.6	-23.6	-179.6	-67.1	-45.8	0	0	0	113.3	K504 H631	K504-D629 IonicContact NZ-OD1 2.59Å; K504-D629 PolarHBondContact NZ-OD1 3.18Å; D629-H631 PolarHBondContact O-N 2.9Å; D629-H631 PolarHBondContact O-ND1 2.77Å
630	Y	63	Low	70.7	Confident	69 Å²	69	51 Å²	51	27%	0.271	28%	0.276	S	S	.	.			trans	-90.4	100.5	179.3	-162.7	-104.3	0	0	0	112	A628 A641 K644 I645	A628-Y630 VanDerWaalsContact C-N 3.34Å; Y630-A641 HydrophobicContact CD1-CB 4.31Å; Y630-A641 HydrophobicContact CE1-CB 3.78Å; Y630-K644 HydrophobicContact CD1-CB 4.15Å; Y630-K644 HydrophobicContact CD1-CD 3.75Å; Y630-K644 HydrophobicContact CD1-CG 4.07Å; Y630-K644 HydrophobicContact CD2-CD 3.79Å; Y630-K644 VanDerWaalsContact CD2-CE 3.45Å; Y630-K644 VanDerWaalsContact CD2-NZ 3.27Å; Y630-K644 HydrophobicContact CE1-CD 3.99Å; Y630-K644 HydrophobicContact CE2-CD 4.06Å; Y630-K644 HydrophobicContact CG-CD 3.62Å; Y630-K644 HydrophobicContact CG-CG 3.95Å; Y630-I645 WeakPolarHBondContact O-CG1 3.37Å
631	H	66.8	Low	71.5	Confident	62 Å²	62	46.2 Å²	46.2	29%	0.287	24%	0.242	S	C	.	.			trans	-107.3	-10	-168.2	53	-84.9	0	0	0	115.4	D629 V829 D831	D629-H631 PolarHBondContact O-N 2.9Å; D629-H631 PolarHBondContact O-ND1 2.77Å; H631-V829 VanDerWaalsContact CA-O 3.29Å; H631-V829 WeakPolarHBondContact CA-O 3.39Å; H631-V829 HydrophobicContact CB-CB 4.33Å; H631-V829 HydrophobicContact CB-CG1 4.23Å; H631-V829 WeakPolarHBondContact CB-O 3.49Å; H631-D831 PolarHBondContact O-N 3.22Å
632	R	63.3	Low	72.3	Confident	153 Å²	153	44.6 Å²	44.6	58%	0.577	23%	0.234	S	C	*	.	B	Isolated β-bridge	trans	-97.1	120	-171.4	-59.4	-171.6	-174.5	178.5	1.7	112.6
633	L	61.9	Low	72.8	Confident	5 Å²	5	43.3 Å²	43.3	3%	0.026	23%	0.226	C	C	.	.			trans	-96	95.3	168.7	-64.8	-177.6	0	0	0	110.4	A641 V830 D831 L833 L848	L633-A641 HydrophobicContact CD2-CB 3.56Å; L633-V830 HydrophobicContact CD1-CG1 3.54Å; L633-V830 HydrophobicContact CG-CG1 4.07Å; L633-D831 PolarHBondContact N-O 2.98Å; L633-L833 HydrophobicContact CB-CD2 4.45Å; L633-L833 HydrophobicContact CD1-CD2 3.77Å; L633-L833 HydrophobicContact CD1-CG 4.12Å; L633-L848 HydrophobicContact CD1-CD1 4.3Å
634	S	60.4	Low	73.1	Confident	56 Å²	56	47 Å²	47	39%	0.392	24%	0.241	S	C	.	.			trans	-84.5	156.2	172.8	50.1	0	0	0	0	112.5	I636	S634-I636 PolarHBondContact O-N 3.36Å; S634-I636 VanDerWaalsContact O-N 3.08Å
635	S	54.9	Low	73.3	Confident	39 Å²	39	46.8 Å²	46.8	27%	0.273	24%	0.239	S	C	.	.	S	Bend	trans	-52.2	-30.1	178.1	52.7	0	0	0	0	114.9	R840	S635-R840 PolarHBondContact O-NH1 3.39Å
636	I	56	Low	73.3	Confident	146 Å²	146	46.5 Å²	46.5	75%	0.749	24%	0.238	S	C	*	.	S	Bend	trans	-94.3	102.2	178.5	-54.8	172.7	0	0	0	109.5	S634	S634-I636 PolarHBondContact O-N 3.36Å; S634-I636 VanDerWaalsContact O-N 3.08Å
637	G	63.6	Low	73.2	Confident	33 Å²	33	46.2 Å²	46.2	34%	0.34	24%	0.238	S	C	.	.			trans	88.8	41.6	163.7	0	0	0	0	0	117.4	E639 Q640 A641	G637-E639 PolarHBondContact O-N 2.97Å; G637-E639 VanDerWaalsContact O-N 3.13Å; G637-Q640 WeakPolarHBondContact O-CA 3.46Å; G637-Q640 WeakPolarHBondContact O-CB 3.37Å; G637-Q640 PolarHBondContact O-N 3.16Å; G637-A641 PolarHBondContact O-N 2.95Å
638	G	68.8	Low	73.3	Confident	13 Å²	13	46.5 Å²	46.5	13%	0.134	24%	0.24	C	C	.	.	H	α-helix	trans	-50.1	-36	175.4	0	0	0	0	0	114.7	Q640 A641 L642	G638-Q640 VanDerWaalsContact C-N 3.33Å; G638-Q640 PolarHBondContact O-N 2.97Å; G638-A641 WeakPolarHBondContact O-CB 3.49Å; G638-A641 PolarHBondContact O-N 2.77Å; G638-A641 VanDerWaalsContact O-N 3.16Å; G638-L642 WeakPolarHBondContact O-CG 3.49Å; G638-L642 PolarHBondContact O-N 2.74Å
639	E	74.8	Confident	73.5	Confident	60 Å²	60	46.3 Å²	46.3	28%	0.28	24%	0.238	S	C	.	.	H	α-helix	trans	-53.1	-44	170.1	-75.5	-178.7	-154.4	0	0	113.9	G637 A643 F795 L798	G637-E639 PolarHBondContact O-N 2.97Å; G637-E639 VanDerWaalsContact O-N 3.13Å; E639-A643 PolarHBondContact O-N 3.11Å; E639-A643 VanDerWaalsContact O-N 3.1Å; E639-F795 HydrophobicContact CG-CD2 3.88Å; E639-F795 HydrophobicContact CG-CE2 4.27Å; E639-L798 HydrophobicContact CB-CD2 3.64Å; E639-L798 HydrophobicContact CG-CD2 3.89Å; E639-L798 WeakPolarHBondContact OE2-CD2 3.1Å
640	Q	77.5	Confident	74.3	Confident	122 Å²	122	41.7 Å²	41.7	57%	0.57	21%	0.214	S	C	*	.	H	α-helix	trans	-73.8	-32.7	179.2	-60.3	-172.6	13.6	0	0	111.1	G637 G638 A643 K644	G637-Q640 WeakPolarHBondContact O-CA 3.46Å; G637-Q640 WeakPolarHBondContact O-CB 3.37Å; G637-Q640 PolarHBondContact O-N 3.16Å; G638-Q640 VanDerWaalsContact C-N 3.33Å; G638-Q640 PolarHBondContact O-N 2.97Å; Q640-A643 PolarHBondContact O-N 3.43Å; Q640-K644 VanDerWaalsContact O-CB 3.25Å; Q640-K644 WeakPolarHBondContact O-CB 3.39Å; Q640-K644 PolarHBondContact O-N 3.48Å
641	A	78	Confident	75.5	Confident	6 Å²	6	41.9 Å²	41.9	5%	0.05	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-44.6	173.6	0	0	0	0	0	111.6	Y630 L633 G637 G638 K644 I645	Y630-A641 HydrophobicContact CD1-CB 4.31Å; Y630-A641 HydrophobicContact CE1-CB 3.78Å; L633-A641 HydrophobicContact CD2-CB 3.56Å; G637-A641 PolarHBondContact O-N 2.95Å; G638-A641 WeakPolarHBondContact O-CB 3.49Å; G638-A641 PolarHBondContact O-N 2.77Å; G638-A641 VanDerWaalsContact O-N 3.16Å; A641-K644 WeakPolarHBondContact O-CB 3.4Å; A641-K644 PolarHBondContact O-N 3.19Å; A641-K644 VanDerWaalsContact O-N 3.16Å; A641-I645 WeakPolarHBondContact O-CG1 2.87Å; A641-I645 PolarHBondContact O-N 3.26Å
642	L	83.2	Confident	76.4	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-60.1	-45.9	173.5	-69.4	169	0	0	0	111.9	G638 K644 I645 V646 M799 A847 L848 L851	G638-L642 WeakPolarHBondContact O-CG 3.49Å; G638-L642 PolarHBondContact O-N 2.74Å; L642-K644 VanDerWaalsContact C-N 3.28Å; L642-K644 PolarHBondContact O-N 3.14Å; L642-I645 WeakPolarHBondContact O-CB 3.29Å; L642-I645 PolarHBondContact O-N 3.2Å; L642-V646 WeakPolarHBondContact O-CG2 3.44Å; L642-V646 PolarHBondContact O-N 3.08Å; L642-V646 VanDerWaalsContact O-N 3.16Å; L642-M799 HydrophobicContact CD1-CE 3.91Å; L642-A847 HydrophobicContact CD1-CB 3.54Å; L642-L848 HydrophobicContact CD2-CD2 3.65Å; L642-L848 HydrophobicContact CD2-CG 4.17Å; L642-L851 HydrophobicContact CB-CD1 4.3Å; L642-L851 HydrophobicContact CD1-CD1 4.35Å; L642-L851 HydrophobicContact CD2-CD1 4.33Å
643	A	83.7	Confident	77.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.7	-35.8	174.8	0	0	0	0	0	112.5	E639 Q640 V646 A647 V783 A787 L802	E639-A643 PolarHBondContact O-N 3.11Å; E639-A643 VanDerWaalsContact O-N 3.1Å; Q640-A643 PolarHBondContact O-N 3.43Å; A643-V646 PolarHBondContact O-N 3.41Å; A643-A647 WeakPolarHBondContact O-CB 3.33Å; A643-A647 PolarHBondContact O-N 3.4Å; A643-V783 HydrophobicContact CB-CG1 4.38Å; A643-V783 WeakPolarHBondContact O-CG1 3.48Å; A643-A787 HydrophobicContact CB-CB 3.73Å; A643-L802 HydrophobicContact CB-CD1 4.25Å; A643-L802 HydrophobicContact CB-CD2 3.86Å
644	K	83.3	Confident	78.6	Confident	88 Å²	88	33.5 Å²	33.5	38%	0.383	19%	0.187	S	C	.	.	H	α-helix	trans	-70.3	-37	177.2	-170.7	172.7	176.5	-172.1	0	112.5	Y630 Q640 A641 L642 A647 T648	Y630-K644 HydrophobicContact CD1-CB 4.15Å; Y630-K644 HydrophobicContact CD1-CD 3.75Å; Y630-K644 HydrophobicContact CD1-CG 4.07Å; Y630-K644 HydrophobicContact CD2-CD 3.79Å; Y630-K644 VanDerWaalsContact CD2-CE 3.45Å; Y630-K644 VanDerWaalsContact CD2-NZ 3.27Å; Y630-K644 HydrophobicContact CE1-CD 3.99Å; Y630-K644 HydrophobicContact CE2-CD 4.06Å; Y630-K644 HydrophobicContact CG-CD 3.62Å; Y630-K644 HydrophobicContact CG-CG 3.95Å; Q640-K644 VanDerWaalsContact O-CB 3.25Å; Q640-K644 WeakPolarHBondContact O-CB 3.39Å; Q640-K644 PolarHBondContact O-N 3.48Å; A641-K644 WeakPolarHBondContact O-CB 3.4Å; A641-K644 PolarHBondContact O-N 3.19Å; A641-K644 VanDerWaalsContact O-N 3.16Å; L642-K644 VanDerWaalsContact C-N 3.28Å; L642-K644 PolarHBondContact O-N 3.14Å; K644-A647 PolarHBondContact O-N 3.11Å; K644-T648 PolarHBondContact O-N 3.39Å; K644-T648 PolarHBondContact O-OG1 2.72Å
645	I	85.5	Confident	79.7	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-56.3	-52.3	170.4	-75.3	161.6	0	0	0	110.1	A628 Y630 A641 L642 A647 T648 L649 V828 F852	A628-I645 HydrophobicContact CB-CG2 3.92Å; Y630-I645 WeakPolarHBondContact O-CG1 3.37Å; A641-I645 WeakPolarHBondContact O-CG1 2.87Å; A641-I645 PolarHBondContact O-N 3.26Å; L642-I645 WeakPolarHBondContact O-CB 3.29Å; L642-I645 PolarHBondContact O-N 3.2Å; I645-A647 VanDerWaalsContact C-N 3.28Å; I645-A647 PolarHBondContact O-N 3.41Å; I645-T648 PolarHBondContact O-N 3.47Å; I645-T648 VanDerWaalsContact O-N 3.16Å; I645-T648 PolarHBondContact O-OG1 3.02Å; I645-L649 HydrophobicContact CG2-CD1 4.15Å; I645-L649 WeakPolarHBondContact O-CG 3.28Å; I645-L649 PolarHBondContact O-N 2.97Å; I645-V828 HydrophobicContact CD1-CG1 4.4Å; I645-V828 HydrophobicContact CG2-CG1 3.92Å; I645-V828 HydrophobicContact CG2-CG2 4.12Å; I645-F852 HydrophobicContact CG2-CE2 4.44Å; I645-F852 HydrophobicContact CG2-CZ 3.88Å
646	V	86.9	Confident	80.9	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.2	-39.6	177.8	179.2	0	0	0	0	111.1	L642 A643 L649 F650 V783 V806 F852	L642-V646 WeakPolarHBondContact O-CG2 3.44Å; L642-V646 PolarHBondContact O-N 3.08Å; L642-V646 VanDerWaalsContact O-N 3.16Å; A643-V646 PolarHBondContact O-N 3.41Å; V646-L649 PolarHBondContact O-N 3.48Å; V646-F650 HydrophobicContact CG1-CD2 4.16Å; V646-F650 HydrophobicContact CG1-CE2 3.98Å; V646-F650 WeakPolarHBondContact O-CD2 3.49Å; V646-F650 PolarHBondContact O-N 3.17Å; V646-V783 HydrophobicContact CB-CG1 4.29Å; V646-V783 HydrophobicContact CG1-CG1 4.33Å; V646-V783 HydrophobicContact CG1-CG2 4.07Å; V646-V806 HydrophobicContact CB-CG2 4.48Å; V646-V806 HydrophobicContact CG1-CG2 4.01Å; V646-V806 HydrophobicContact CG2-CG2 3.55Å; V646-F852 HydrophobicContact CG2-CZ 4.41Å
647	A	85.6	Confident	82	Confident	5 Å²	5	29.9 Å²	29.9	4%	0.041	16%	0.163	C	C	.	.	H	α-helix	trans	-64.5	-38.9	175.8	0	0	0	0	0	113.4	A643 K644 I645 E651 V783	A643-A647 WeakPolarHBondContact O-CB 3.33Å; A643-A647 PolarHBondContact O-N 3.4Å; K644-A647 PolarHBondContact O-N 3.11Å; I645-A647 VanDerWaalsContact C-N 3.28Å; I645-A647 PolarHBondContact O-N 3.41Å; A647-E651 PolarHBondContact O-N 2.71Å; A647-V783 HydrophobicContact CB-CG1 4.06Å
648	T	87.1	Confident	82.7	Confident	15 Å²	15	28.9 Å²	28.9	9%	0.092	15%	0.153	C	C	.	.	H	α-helix	trans	-71.4	-31.4	176.1	52.5	0	0	0	0	112.6	K644 I645 E651 A652	K644-T648 PolarHBondContact O-N 3.39Å; K644-T648 PolarHBondContact O-OG1 2.72Å; I645-T648 PolarHBondContact O-N 3.47Å; I645-T648 VanDerWaalsContact O-N 3.16Å; I645-T648 PolarHBondContact O-OG1 3.02Å; T648-E651 WeakPolarHBondContact O-CB 3.47Å; T648-E651 PolarHBondContact O-N 3.25Å; T648-E651 VanDerWaalsContact O-N 3.15Å; T648-A652 PolarHBondContact O-N 3.39Å
649	L	88.9	Confident	83.2	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66.6	-37.7	174.8	-67	168.2	0	0	0	112.2	A628 I645 V646 E651 A653 L809 L826 V828 F860	A628-L649 HydrophobicContact CB-CD2 3.92Å; A628-L649 HydrophobicContact CB-CG 4.06Å; I645-L649 HydrophobicContact CG2-CD1 4.15Å; I645-L649 WeakPolarHBondContact O-CG 3.28Å; I645-L649 PolarHBondContact O-N 2.97Å; V646-L649 PolarHBondContact O-N 3.48Å; L649-E651 VanDerWaalsContact C-N 3.32Å; L649-A653 PolarHBondContact O-N 3.03Å; L649-L809 HydrophobicContact CB-CD2 3.84Å; L649-L809 HydrophobicContact CD1-CD2 4.22Å; L649-L826 HydrophobicContact CD1-CD1 4.46Å; L649-L826 HydrophobicContact CD2-CB 4.38Å; L649-L826 HydrophobicContact CD2-CD2 4.19Å; L649-V828 HydrophobicContact CD1-CG2 4.11Å; L649-F860 HydrophobicContact CD1-CE1 4.1Å
650	F	88.1	Confident	83.4	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.009	18%	0.177	C	C	.	.	H	α-helix	trans	-65	-34.6	169.9	-83.4	-70.1	0	0	0	112.6	V646 A653 E654 P779 V783 E805 L808 L809 M812	V646-F650 HydrophobicContact CG1-CD2 4.16Å; V646-F650 HydrophobicContact CG1-CE2 3.98Å; V646-F650 WeakPolarHBondContact O-CD2 3.49Å; V646-F650 PolarHBondContact O-N 3.17Å; F650-A653 PolarHBondContact O-N 3.4Å; F650-E654 PolarHBondContact O-N 2.92Å; F650-P779 HydrophobicContact CB-CG 4.47Å; F650-P779 HydrophobicContact CD1-CB 3.67Å; F650-P779 HydrophobicContact CD1-CG 3.71Å; F650-P779 HydrophobicContact CD2-CB 4.21Å; F650-P779 HydrophobicContact CE1-CB 3.69Å; F650-P779 HydrophobicContact CE1-CG 4.11Å; F650-P779 HydrophobicContact CE2-CB 4.22Å; F650-P779 HydrophobicContact CG-CB 3.95Å; F650-P779 HydrophobicContact CG-CG 4.13Å; F650-P779 HydrophobicContact CZ-CB 3.97Å; F650-V783 HydrophobicContact CD2-CG2 4.22Å; F650-V783 HydrophobicContact CE2-CG2 4.09Å; F650-E805 HydrophobicContact CE2-CB 4.45Å; F650-L808 HydrophobicContact CE1-CD2 4Å; F650-L808 HydrophobicContact CZ-CD2 3.92Å; F650-L809 HydrophobicContact CD1-CD1 3.96Å; F650-L809 HydrophobicContact CE1-CB 4.15Å; F650-L809 HydrophobicContact CE1-CD1 3.91Å; F650-L809 HydrophobicContact CE2-CB 4.24Å; F650-L809 HydrophobicContact CG-CD1 4.34Å; F650-L809 HydrophobicContact CZ-CB 3.77Å; F650-L809 HydrophobicContact CZ-CD1 4.25Å; F650-L809 HydrophobicContact CZ-CG 4.48Å; F650-M812 HydrophobicContact CD1-CE 4.45Å; F650-M812 HydrophobicContact CE1-CE 4.46Å
651	E	86.2	Confident	83.4	Confident	73 Å²	73	27.7 Å²	27.7	34%	0.341	15%	0.151	S	C	.	.	H	α-helix	trans	-69.1	-42.2	177.2	-167.9	157.7	-152.6	0	0	111.6	A647 T648 L649 A653 E654 T655 R780	A647-E651 PolarHBondContact O-N 2.71Å; T648-E651 WeakPolarHBondContact O-CB 3.47Å; T648-E651 PolarHBondContact O-N 3.25Å; T648-E651 VanDerWaalsContact O-N 3.15Å; L649-E651 VanDerWaalsContact C-N 3.32Å; E651-A653 PolarHBondContact O-N 3.02Å; E651-E654 PolarHBondContact O-N 2.72Å; E651-T655 PolarHBondContact O-N 2.68Å; E651-T655 VanDerWaalsContact O-N 3.12Å; E651-R780 VanDerWaalsContact CD-NH1 3.27Å; E651-R780 IonicContact OE1-CZ 3.44Å; E651-R780 IonicContact OE1-NH1 3.64Å; E651-R780 PolarHBondContact OE1-NH1 2.76Å; E651-R780 IonicContact OE1-NH2 2.77Å; E651-R780 PolarHBondContact OE1-NH2 2.85Å; E651-R780 IonicContact OE2-CZ 2.96Å; E651-R780 IonicContact OE2-NE 2.7Å; E651-R780 IonicContact OE2-NH1 3.01Å; E651-R780 PolarHBondContact OE2-NH1 2.84Å; E651-R780 IonicContact OE2-NH2 3.31Å; E651-R780 PolarHBondContact OE2-NH2 3.37Å
652	A	86.1	Confident	83.5	Confident	16 Å²	16	27.4 Å²	27.4	13%	0.132	15%	0.149	C	C	.	.	H	α-helix	trans	-63.1	-36.7	171.4	0	0	0	0	0	113	L626 T648 T655 H656	L626-A652 HydrophobicContact CB-CB 4.2Å; L626-A652 HydrophobicContact CD2-CB 4.49Å; T648-A652 PolarHBondContact O-N 3.39Å; A652-T655 PolarHBondContact O-N 2.85Å; A652-T655 PolarHBondContact O-OG1 3.4Å; A652-H656 WeakPolarHBondContact O-CB 3.29Å; A652-H656 PolarHBondContact O-N 3Å; A652-H656 VanDerWaalsContact O-N 3.09Å
653	A	85.8	Confident	83.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-66.7	-40.6	173.4	0	0	0	0	0	112.2	L626 L649 F650 E651 T655 F657 V662 M812	L626-A653 HydrophobicContact CD1-CB 4.47Å; L649-A653 PolarHBondContact O-N 3.03Å; F650-A653 PolarHBondContact O-N 3.4Å; E651-A653 PolarHBondContact O-N 3.02Å; A653-T655 VanDerWaalsContact C-N 3.3Å; A653-T655 PolarHBondContact O-N 2.93Å; A653-F657 PolarHBondContact O-N 3.44Å; A653-F657 VanDerWaalsContact O-N 3.17Å; A653-V662 HydrophobicContact CB-CG2 4.25Å; A653-M812 HydrophobicContact CB-CE 3.78Å
654	E	86.1	Confident	83	Confident	28 Å²	28	30.9 Å²	30.9	13%	0.131	16%	0.162	C	C	.	.	H	α-helix	trans	-65.4	-28.1	175.9	-78.5	-166.3	-176.6	0	0	113.1	F650 E651 G658 V659 V662 R663	F650-E654 PolarHBondContact O-N 2.92Å; E651-E654 PolarHBondContact O-N 2.72Å; E654-G658 CarbonylContact O-C 3.55Å; E654-G658 WeakPolarHBondContact O-CA 3.07Å; E654-G658 PolarHBondContact O-N 2.88Å; E654-V659 HydrophobicContact CB-CG2 4.38Å; E654-V659 PolarHBondContact O-N 3.04Å; E654-V662 HydrophobicContact CG-CB 3.99Å; E654-V662 HydrophobicContact CG-CG1 3.6Å; E654-V662 HydrophobicContact CG-CG2 4.46Å; E654-R663 WeakPolarHBondContact OE1-CG 3.45Å; E654-R663 IonicContact OE1-CZ 3.38Å; E654-R663 IonicContact OE1-NE 2.7Å; E654-R663 PolarHBondContact OE1-NE 3.25Å; E654-R663 IonicContact OE1-NH2 3.78Å; E654-R663 PolarHBondContact OE1-NH2 3.45Å; E654-R663 IonicContact OE2-CZ 3.16Å; E654-R663 IonicContact OE2-NE 2.78Å; E654-R663 IonicContact OE2-NH2 2.7Å; E654-R663 PolarHBondContact OE2-NH2 3.22Å
655	T	83	Confident	82.5	Confident	103 Å²	103	27.7 Å²	27.7	63%	0.632	15%	0.149	S	C	*	.	H	α-helix	trans	-80.5	-43.3	175.2	56.9	0	0	0	0	113	E651 A652 A653	E651-T655 PolarHBondContact O-N 2.68Å; E651-T655 VanDerWaalsContact O-N 3.12Å; A652-T655 PolarHBondContact O-N 2.85Å; A652-T655 PolarHBondContact O-OG1 3.4Å; A653-T655 VanDerWaalsContact C-N 3.3Å; A653-T655 PolarHBondContact O-N 2.93Å
656	H	80	Confident	81.9	Confident	53 Å²	53	27.9 Å²	27.9	25%	0.245	15%	0.15	C	C	.	.	H	α-helix	trans	-67.5	-62.4	-178.3	-178.2	-98.7	0	0	0	112.4	S624 L626 A652	S624-H656 PolarHBondContact OG-NE2 2.84Å; S624-H656 VanDerWaalsContact OG-NE2 3.11Å; L626-H656 HydrophobicContact CD2-CB 3.66Å; A652-H656 WeakPolarHBondContact O-CB 3.29Å; A652-H656 PolarHBondContact O-N 3Å; A652-H656 VanDerWaalsContact O-N 3.09Å
657	F	78.9	Confident	81	Confident	9 Å²	9	28.4 Å²	28.4	4%	0.039	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-22.9	-177.7	-61.9	-77.3	0	0	0	113	L602 L626 A653 V662 L816 T820 T824	L602-F657 HydrophobicContact CD1-CD1 4.41Å; L626-F657 HydrophobicContact CD1-CE2 4.32Å; A653-F657 PolarHBondContact O-N 3.44Å; A653-F657 VanDerWaalsContact O-N 3.17Å; F657-V662 HydrophobicContact CB-CG2 4.37Å; F657-L816 HydrophobicContact CB-CD1 4.27Å; F657-L816 HydrophobicContact CD1-CB 4.01Å; F657-L816 HydrophobicContact CD1-CD1 4.29Å; F657-L816 HydrophobicContact CD2-CD1 3.71Å; F657-L816 HydrophobicContact CE1-CB 3.72Å; F657-L816 HydrophobicContact CE2-CB 4.28Å; F657-L816 HydrophobicContact CE2-CD1 4.01Å; F657-L816 HydrophobicContact CG-CB 4.4Å; F657-L816 HydrophobicContact CG-CD1 3.84Å; F657-L816 HydrophobicContact CZ-CB 3.85Å; F657-L816 HydrophobicContact CZ-CD1 4.41Å; F657-T820 HydrophobicContact CD1-CG2 4.32Å; F657-T820 HydrophobicContact CE1-CG2 4.18Å; F657-T824 HydrophobicContact CE1-CG2 4.48Å; F657-T824 HydrophobicContact CE2-CG2 4.46Å; F657-T824 HydrophobicContact CZ-CG2 3.7Å
658	G	78.2	Confident	79.9	Confident	11 Å²	11	29.5 Å²	29.5	11%	0.113	16%	0.158	C	C	.	.			trans	102.2	147.9	-176.8	0	0	0	0	0	113.5	E654 L660 P661 V662	E654-G658 CarbonylContact O-C 3.55Å; E654-G658 WeakPolarHBondContact O-CA 3.07Å; E654-G658 PolarHBondContact O-N 2.88Å; G658-L660 VanDerWaalsContact C-N 3.32Å; G658-L660 PolarHBondContact O-N 2.92Å; G658-P661 WeakPolarHBondContact O-CD 3.46Å; G658-V662 PolarHBondContact O-N 3.27Å
659	V	81.3	Confident	78.7	Confident	64 Å²	64	32 Å²	32	39%	0.388	17%	0.168	S	C	.	.	H	α-helix	trans	-57.1	-39.5	-174.2	-177	0	0	0	0	113.4	E654 R663	E654-V659 HydrophobicContact CB-CG2 4.38Å; E654-V659 PolarHBondContact O-N 3.04Å; V659-R663 WeakPolarHBondContact O-CB 3.42Å; V659-R663 WeakPolarHBondContact O-CG 3.47Å; V659-R663 PolarHBondContact O-N 3.02Å
660	L	77.6	Confident	76.7	Confident	102 Å²	102	34.7 Å²	34.7	53%	0.534	19%	0.185	S	C	.	.	H	α-helix	trans	-70.8	-55	-177.5	-70.2	174.4	0	0	0	112.5	V603 G658 V662 R663 L664	V603-L660 HydrophobicContact CG2-CB 4.25Å; G658-L660 VanDerWaalsContact C-N 3.32Å; G658-L660 PolarHBondContact O-N 2.92Å; L660-V662 VanDerWaalsContact C-N 3.35Å; L660-V662 PolarHBondContact O-N 2.97Å; L660-R663 PolarHBondContact O-N 2.98Å; L660-L664 WeakPolarHBondContact O-CB 3.42Å; L660-L664 WeakPolarHBondContact O-CG 3.17Å; L660-L664 PolarHBondContact O-N 3.49Å
661	P	78.3	Confident	74.5	Confident	5 Å²	5	39.9 Å²	39.9	3%	0.032	22%	0.219	C	C	.	.	H	α-helix	trans	-46	-52.2	173	-35	38.4	0	0	0	114.8	L602 V603 I606 G658 L664 F665 L816	L602-P661 HydrophobicContact CD1-CG 4.41Å; L602-P661 HydrophobicContact CD2-CB 3.91Å; L602-P661 HydrophobicContact CD2-CG 4.07Å; V603-P661 HydrophobicContact CG2-CG 3.78Å; I606-P661 HydrophobicContact CD1-CB 3.75Å; G658-P661 WeakPolarHBondContact O-CD 3.46Å; P661-L664 PolarHBondContact O-N 3.11Å; P661-F665 PolarHBondContact O-N 3.23Å; P661-L816 HydrophobicContact CB-CD2 4.4Å
662	V	80.3	Confident	72.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.4	-48.4	-176.9	165.8	0	0	0	0	111.6	A653 E654 F657 G658 L660 F665 C666 M812 L816	A653-V662 HydrophobicContact CB-CG2 4.25Å; E654-V662 HydrophobicContact CG-CB 3.99Å; E654-V662 HydrophobicContact CG-CG1 3.6Å; E654-V662 HydrophobicContact CG-CG2 4.46Å; F657-V662 HydrophobicContact CB-CG2 4.37Å; G658-V662 PolarHBondContact O-N 3.27Å; L660-V662 VanDerWaalsContact C-N 3.35Å; L660-V662 PolarHBondContact O-N 2.97Å; V662-F665 PolarHBondContact O-N 2.93Å; V662-C666 WeakPolarHBondContact O-CB 3.2Å; V662-C666 PolarHBondContact O-N 3.03Å; V662-C666 PolarHBondContact O-SG 3.11Å; V662-M812 HydrophobicContact CB-SD 4.13Å; V662-M812 HydrophobicContact CG1-CE 4.05Å; V662-M812 HydrophobicContact CG1-SD 3.72Å; V662-M812 HydrophobicContact CG2-CE 4.13Å; V662-M812 HydrophobicContact CG2-SD 4.11Å; V662-L816 HydrophobicContact CG2-CD1 4.37Å
663	R	80.9	Confident	69.6	Low	62 Å²	62	51.4 Å²	51.4	23%	0.234	26%	0.264	C	S	.	.	H	α-helix	trans	-73.3	-31.7	-178.3	-65.8	-178	-171.6	168.7	10.6	113.2	E654 V659 L660 C667	E654-R663 WeakPolarHBondContact OE1-CG 3.45Å; E654-R663 IonicContact OE1-CZ 3.38Å; E654-R663 IonicContact OE1-NE 2.7Å; E654-R663 PolarHBondContact OE1-NE 3.25Å; E654-R663 IonicContact OE1-NH2 3.78Å; E654-R663 PolarHBondContact OE1-NH2 3.45Å; E654-R663 IonicContact OE2-CZ 3.16Å; E654-R663 IonicContact OE2-NE 2.78Å; E654-R663 IonicContact OE2-NH2 2.7Å; E654-R663 PolarHBondContact OE2-NH2 3.22Å; V659-R663 WeakPolarHBondContact O-CB 3.42Å; V659-R663 WeakPolarHBondContact O-CG 3.47Å; V659-R663 PolarHBondContact O-N 3.02Å; L660-R663 PolarHBondContact O-N 2.98Å; R663-C667 VanDerWaalsContact O-CB 3.3Å; R663-C667 WeakPolarHBondContact O-CB 3.49Å; R663-C667 PolarHBondContact O-N 3.04Å; R663-C667 VanDerWaalsContact O-N 3.13Å
664	L	74.3	Confident	67.2	Low	11 Å²	11	61.5 Å²	61.5	6%	0.058	30%	0.304	C	S	.	.	H	α-helix	trans	-64.5	-45.8	172.1	-71.4	171.2	0	0	0	111	V603 I606 L660 P661 C667 M668 I770	V603-L664 HydrophobicContact CG1-CD1 3.9Å; I606-L664 HydrophobicContact CG2-CB 4.13Å; L660-L664 WeakPolarHBondContact O-CB 3.42Å; L660-L664 WeakPolarHBondContact O-CG 3.17Å; L660-L664 PolarHBondContact O-N 3.49Å; P661-L664 PolarHBondContact O-N 3.11Å; L664-C667 WeakPolarHBondContact O-CB 3.39Å; L664-C667 PolarHBondContact O-N 3.18Å; L664-M668 VanDerWaalsContact O-CG 3.29Å; L664-M668 WeakPolarHBondContact O-CG 3.48Å; L664-M668 PolarHBondContact O-N 2.68Å; L664-M668 VanDerWaalsContact O-N 3.1Å; L664-I770 HydrophobicContact CD2-CG2 3.26Å
665	F	74.2	Confident	64.5	Low	22 Å²	22	66.3 Å²	66.3	10%	0.096	33%	0.329	C	S	.	.	H	α-helix	trans	-63.9	-45.9	176.9	-168.8	-86.5	0	0	0	112.4	P661 V662 C667 M668 K669 M812 S815	P661-F665 PolarHBondContact O-N 3.23Å; V662-F665 PolarHBondContact O-N 2.93Å; F665-C667 PolarHBondContact O-N 2.85Å; F665-C667 VanDerWaalsContact O-N 3.14Å; F665-M668 PolarHBondContact O-N 2.88Å; F665-M668 VanDerWaalsContact O-N 3.09Å; F665-K669 HydrophobicContact CE1-CD 3.73Å; F665-K669 HydrophobicContact CE1-CG 4.26Å; F665-K669 HydrophobicContact CZ-CD 3.6Å; F665-K669 VanDerWaalsContact CZ-CE 3.49Å; F665-K669 HydrophobicContact CZ-CG 4.16Å; F665-K669 PolarHBondContact O-N 3.26Å; F665-M812 HydrophobicContact CB-CG 4.24Å; F665-M812 HydrophobicContact CD1-CB 3.57Å; F665-M812 HydrophobicContact CD1-CG 3.57Å; F665-M812 HydrophobicContact CE1-CB 3.69Å; F665-M812 HydrophobicContact CE1-CG 4.16Å; F665-M812 HydrophobicContact CG-CB 4.45Å; F665-M812 HydrophobicContact CG-CG 4.02Å; F665-S815 WeakPolarHBondContact CE2-OG 3.29Å; F665-S815 VanDerWaalsContact CZ-OG 3.26Å; F665-S815 WeakPolarHBondContact CZ-OG 3.21Å
666	C	71.9	Confident	62	Low	5 Å²	5	68.2 Å²	68.2	3%	0.034	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-19	176.2	-68.4	0	0	0	0	114.2	V662	V662-C666 WeakPolarHBondContact O-CB 3.2Å; V662-C666 PolarHBondContact O-N 3.03Å; V662-C666 PolarHBondContact O-SG 3.11Å
667	C	67.8	Low	59.6	Low	11 Å²	11	72.4 Å²	72.4	7%	0.074	37%	0.365	C	S	.	.	H	α-helix	trans	-84.1	-40.6	173.8	160.8	0	0	0	0	111.9	R663 L664 F665 Y773	R663-C667 VanDerWaalsContact O-CB 3.3Å; R663-C667 WeakPolarHBondContact O-CB 3.49Å; R663-C667 PolarHBondContact O-N 3.04Å; R663-C667 VanDerWaalsContact O-N 3.13Å; L664-C667 WeakPolarHBondContact O-CB 3.39Å; L664-C667 PolarHBondContact O-N 3.18Å; F665-C667 PolarHBondContact O-N 2.85Å; F665-C667 VanDerWaalsContact O-N 3.14Å; C667-Y773 HydrophobicContact CB-CD1 3.88Å; C667-Y773 HydrophobicContact CB-CE1 4.37Å; C667-Y773 WeakPolarHBondContact SG-CD1 3.35Å
668	M	62.7	Low	57.1	Low	28 Å²	28	75.3 Å²	75.3	14%	0.138	40%	0.397	C	S	.	.	H	α-helix	trans	-85.4	-23.2	-166.1	-71	165.8	56.4	0	0	114.7	I606 L609 L664 F665 P670	I606-M668 HydrophobicContact CG2-CE 4.3Å; I606-M668 HydrophobicContact CG2-SD 4.05Å; I606-M668 WeakPolarHBondContact O-CE 3.24Å; L609-M668 HydrophobicContact CD1-CE 4.26Å; L609-M668 HydrophobicContact CD2-CE 3.43Å; L609-M668 VanDerWaalsContact CD2-CE 3.43Å; L609-M668 HydrophobicContact CG-CE 3.62Å; L664-M668 VanDerWaalsContact O-CG 3.29Å; L664-M668 WeakPolarHBondContact O-CG 3.48Å; L664-M668 PolarHBondContact O-N 2.68Å; L664-M668 VanDerWaalsContact O-N 3.1Å; F665-M668 PolarHBondContact O-N 2.88Å; F665-M668 VanDerWaalsContact O-N 3.09Å; M668-P670 WeakPolarHBondContact O-CD 3.45Å
669	K	62.1	Low	54.8	Low	68 Å²	68	85.3 Å²	85.3	30%	0.296	44%	0.438	S	S	.	.			trans	-93.4	112.8	169.9	-85.6	-167.6	177.7	175.7	0	111.5	F665 D811	F665-K669 HydrophobicContact CE1-CD 3.73Å; F665-K669 HydrophobicContact CE1-CG 4.26Å; F665-K669 HydrophobicContact CZ-CD 3.6Å; F665-K669 VanDerWaalsContact CZ-CE 3.49Å; F665-K669 HydrophobicContact CZ-CG 4.16Å; F665-K669 PolarHBondContact O-N 3.26Å; K669-D811 IonicContact NZ-OD2 2.65Å; K669-D811 PolarHBondContact NZ-OD2 2.88Å
670	P	46.5	Very low	52.2	Low	55 Å²	55	85.2 Å²	85.2	36%	0.357	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-71.3	156.9	162.2	32.2	-34.7	0	0	0	110.8	M668	M668-P670 WeakPolarHBondContact O-CD 3.45Å
671	P	42.5	Very low	50	Low	112 Å²	112	89.9 Å²	89.9	73%	0.727	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-68.3	139.2	-178.3	27.9	-35	0	0	0	112.4
672	Y	40.1	Very low	47.6	Very low	167 Å²	167	95.6 Å²	95.6	66%	0.655	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-74	127.6	170.2	-83.4	-94.4	0	0	0	110.4
673	Q	29.6	Very low	45.2	Very low	164 Å²	164	101.1 Å²	101.1	77%	0.766	54%	0.54	S	S	*	.			trans	-100.9	83.4	-177.6	-162.9	176.5	8.9	0	0	110.2	I675	Q673-I675 HydrophobicContact CG-CD1 4.1Å; Q673-I675 HydrophobicContact CG-CG1 4.03Å; Q673-I675 PolarHBondContact O-N 3.26Å
674	Y	35.5	Very low	42.7	Very low	212 Å²	212	103.8 Å²	103.8	83%	0.831	57%	0.565	S	S	*	*			trans	-68.8	115.3	166.4	-96.2	-89.1	0	0	0	109
675	I	29.6	Very low	40.6	Very low	128 Å²	128	113.2 Å²	113.2	66%	0.656	61%	0.606	S	S	*	*			trans	-117.7	102.2	169.9	-61.4	171.1	0	0	0	106.6	Q673	Q673-I675 HydrophobicContact CG-CD1 4.1Å; Q673-I675 HydrophobicContact CG-CG1 4.03Å; Q673-I675 PolarHBondContact O-N 3.26Å
676	D	29.1	Very low	38.6	Very low	144 Å²	144	117.5 Å²	117.5	77%	0.77	64%	0.639	S	S	*	*			trans	-143.5	148.3	164.4	-115.3	-40.4	0	0	0	109.3
677	T	30.5	Very low	36.4	Very low	140 Å²	140	128.7 Å²	128.7	86%	0.859	68%	0.68	S	S	*	*	S	Bend	trans	61.3	146.6	-158.6	76.7	0	0	0	0	113.4
678	G	26.7	Very low	34.7	Very low	70 Å²	70	133.8 Å²	133.8	72%	0.722	71%	0.711	S	S	*	*			trans	-152	142.4	-170.6	0	0	0	0	0	115.3
679	F	29.7	Very low	33.1	Very low	222 Å²	222	137.9 Å²	137.9	97%	0.974	74%	0.738	S	S	*	*			trans	-142.9	142.9	149.6	-118.8	-93	0	0	0	107.2
680	G	26	Very low	31.6	Very low	61 Å²	61	145 Å²	145	63%	0.629	77%	0.765	S	S	*	*			trans	-90.5	158.1	-166.7	0	0	0	0	0	114.6
681	F	31.3	Very low	30.7	Very low	200 Å²	200	154.1 Å²	154.1	88%	0.877	79%	0.792	S	S	*	*				-164	115.2	117.9	-112	-78.6	0	0	0	112.5
682	T	27.6	Very low	30.1	Very low	125 Å²	125	153.9 Å²	153.9	77%	0.767	79%	0.793	S	S	*	*			trans	26.4	117.2	153.8	59.9	0	0	0	0	121.7
683	S	30	Very low	29.5	Very low	116 Å²	116	153.7 Å²	153.7	81%	0.811	80%	0.802	S	S	*	*				-143.5	149.5	117.2	72	0	0	0	0	110
684	P	28.1	Very low	29.5	Very low	119 Å²	119	154.7 Å²	154.7	77%	0.773	81%	0.807	S	S	*	*			trans	-123.4	96.9	-161.6	36	-18.5	0	0	0	114.2
685	F	30.3	Very low	29	Very low	208 Å²	208	153.5 Å²	153.5	91%	0.912	81%	0.809	S	S	*	*			trans	-153.4	156.7	154.8	-132.9	-101	0	0	0	111
686	S	32.2	Very low	29	Very low	112 Å²	112	152.4 Å²	152.4	78%	0.783	81%	0.81	S	S	*	*			trans	57.5	73.7	-178.5	57.5	0	0	0	0	117.8
687	R	27.4	Very low	28.7	Very low	241 Å²	241	153.4 Å²	153.4	91%	0.909	82%	0.815	S	S	*	*				-74.7	157.6	128.3	-65.7	179.6	175.8	170.7	-1.1	106.7
688	T	30.7	Very low	28.6	Very low	117 Å²	117	151.4 Å²	151.4	72%	0.718	81%	0.814	S	S	*	*			cis	-159.8	165.2	49.3	41.9	0	0	0	0	112.6
689	T	30.3	Very low	28.5	Very low	115 Å²	115	156.4 Å²	156.4	71%	0.706	82%	0.818	S	S	*	*			trans	68.6	140	174.8	77.7	0	0	0	0	115
690	Y	31	Very low	28.3	Very low	218 Å²	218	153.8 Å²	153.8	86%	0.855	81%	0.809	S	S	*	*			cis	-119.7	165.8	0.7	-83.6	-94.1	0	0	0	112
691	R	26.4	Very low	28.2	Very low	245 Å²	245	160 Å²	160	93%	0.925	82%	0.821	S	S	*	*			trans	-152.4	91.7	-177.8	-175.3	-162.7	-169.6	-166.9	5.1	112.5
692	S	29.4	Very low	28	Very low	108 Å²	108	155.8 Å²	155.8	76%	0.755	82%	0.823	S	S	*	*			trans	-175.7	166.2	163.4	48	0	0	0	0	112.1
693	L	28.6	Very low	28.1	Very low	163 Å²	163	152.3 Å²	152.3	85%	0.853	81%	0.812	S	S	*	*			trans	68.6	57.6	161.6	-63.6	167.5	0	0	0	119.3	Q695	L693-Q695 PolarHBondContact O-N 3.28Å
694	Q	28.6	Very low	28.3	Very low	184 Å²	184	153.3 Å²	153.3	86%	0.86	81%	0.807	S	S	*	*				5.4	106.3	114.1	-179.5	-177.8	0	0	0	118
695	Q	26.5	Very low	28.6	Very low	188 Å²	188	153.8 Å²	153.8	88%	0.879	80%	0.799	S	S	*	*			trans	-172.1	143.9	137.1	-108.2	173.8	16.4	0	0	111.4	L693	L693-Q695 PolarHBondContact O-N 3.28Å
696	P	28.6	Very low	29.2	Very low	105 Å²	105	144.8 Å²	144.8	68%	0.682	77%	0.765	S	S	*	*			trans	-92	169.3	169.3	37.3	-33.8	0	0	0	112.4
697	N	23.8	Very low	29.9	Very low	164 Å²	164	141.4 Å²	141.4	88%	0.877	74%	0.741	S	S	*	*			trans	75.8	88.1	175.2	-50.6	-14.2	0	0	0	116.1
698	A	26.9	Very low	30.5	Very low	99 Å²	99	133 Å²	133	82%	0.818	71%	0.714	S	S	*	*			trans	-149.5	147.7	156.1	0	0	0	0	0	109.9
699	H	24.9	Very low	31.1	Very low	174 Å²	174	134.9 Å²	134.9	81%	0.806	71%	0.708	S	S	*	*			trans	-83.9	162.5	170.2	-72.5	-122	0	0	0	110.9
700	Q	25.5	Very low	31.8	Very low	168 Å²	168	138.7 Å²	138.7	79%	0.785	71%	0.709	S	S	*	*	S	Bend	trans	64.6	148.2	165.9	-83.5	124	-33.1	0	0	119.1
701	Q	24.5	Very low	32.4	Very low	190 Å²	190	136.2 Å²	136.2	89%	0.888	71%	0.705	S	S	*	*			trans	69.9	155.5	162.2	-63.9	166.9	16.7	0	0	118.3
702	A	26.3	Very low	33.2	Very low	112 Å²	112	128 Å²	128	93%	0.926	69%	0.685	S	S	*	*			trans	60.6	138.8	-176.3	0	0	0	0	0	117
703	G	30.9	Very low	34.1	Very low	52 Å²	52	125.6 Å²	125.6	54%	0.536	68%	0.676	S	S	.	*			cis	-171	97.8	-7	0	0	0	0	0	112.1	H705	G703-H705 VanDerWaalsContact C-N 3.33Å; G703-H705 PolarHBondContact O-N 3.4Å
704	I	33.8	Very low	35.3	Very low	137 Å²	137	121 Å²	121	70%	0.703	66%	0.655	S	S	*	*			trans	-75.3	81.2	-177.6	-52.1	177.5	0	0	0	110.7	G706	I704-G706 PolarHBondContact O-N 3.14Å
705	H	35	Very low	36.9	Very low	129 Å²	129	114.6 Å²	114.6	60%	0.597	63%	0.629	S	S	*	*			trans	-80.5	67	172.5	-78.2	-82	0	0	0	112	G703	G703-H705 VanDerWaalsContact C-N 3.33Å; G703-H705 PolarHBondContact O-N 3.4Å
706	G	42.3	Very low	38.4	Very low	19 Å²	19	107.9 Å²	107.9	20%	0.196	60%	0.598	C	S	.	*			trans	-56.3	142.1	170.3	0	0	0	0	0	112.1	I704 L708 R709	I704-G706 PolarHBondContact O-N 3.14Å; G706-L708 VanDerWaalsContact C-N 3.28Å; G706-L708 PolarHBondContact O-N 2.62Å; G706-R709 PolarHBondContact O-N 1.82Å
707	S	46.4	Very low	40	Very low	41 Å²	41	106.1 Å²	106.1	29%	0.287	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60	-31	-170.1	51.1	0	0	0	0	114.1	R709 R710 H711	S707-R709 VanDerWaalsContact C-N 3.3Å; S707-R709 PolarHBondContact O-N 3.43Å; S707-R710 PolarHBondContact O-N 3.2Å; S707-H711 PolarHBondContact O-ND1 3.13Å
708	L	39.5	Very low	42.2	Very low	64 Å²	64	102.5 Å²	102.5	34%	0.335	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.4	-36.3	175.1	-88	81.6	0	0	0	112.6	G706 R710 H711 C712	G706-L708 VanDerWaalsContact C-N 3.28Å; G706-L708 PolarHBondContact O-N 2.62Å; L708-R710 PolarHBondContact O-N 2.71Å; L708-H711 PolarHBondContact O-N 2.92Å; L708-C712 PolarHBondContact O-N 2.83Å
709	R	44.2	Very low	44.1	Very low	158 Å²	158	99.3 Å²	99.3	60%	0.596	53%	0.533	S	S	*	.	H	α-helix	trans	-64.5	-25.1	-178.6	-128	-177.1	-172.8	-170.4	2.7	112.3	G706 S707 G713	G706-R709 PolarHBondContact O-N 1.82Å; S707-R709 VanDerWaalsContact C-N 3.3Å; S707-R709 PolarHBondContact O-N 3.43Å; R709-G713 PolarHBondContact O-N 2.78Å
710	R	44.1	Very low	46.3	Very low	195 Å²	195	95.3 Å²	95.3	74%	0.736	52%	0.518	S	S	*	.	H	α-helix	trans	-76.7	-16.4	175.2	-63.5	-175.6	179.1	173	0.8	114.3	S707 L708	S707-R710 PolarHBondContact O-N 3.2Å; L708-R710 PolarHBondContact O-N 2.71Å
711	H	45	Very low	48.6	Very low	166 Å²	166	92.1 Å²	92.1	77%	0.769	51%	0.505	S	S	*	.	H	α-helix	trans	-109.7	-18.1	-172.9	-67.5	89.2	0	0	0	114.4	S707 L708	S707-H711 PolarHBondContact O-ND1 3.13Å; L708-H711 PolarHBondContact O-N 2.92Å
712	C	42.1	Very low	51.2	Low	73 Å²	73	85.9 Å²	85.9	49%	0.493	48%	0.48	S	S	.	.	H	α-helix	trans	-130.9	-17.7	-178.9	-158.8	0	0	0	0	114.5	L708 V714	L708-C712 PolarHBondContact O-N 2.83Å; C712-V714 PolarHBondContact O-N 3.05Å
713	G	48.3	Very low	53.6	Low	56 Å²	56	81 Å²	81	58%	0.577	44%	0.439	S	S	*	.			trans	68.9	-35.4	173.7	0	0	0	0	0	116.8	R709	R709-G713 PolarHBondContact O-N 2.78Å
714	V	54.9	Low	55.8	Low	67 Å²	67	81.9 Å²	81.9	41%	0.406	43%	0.434	S	S	.	.	S	Bend	trans	-91.5	130.3	-173.6	-177.2	0	0	0	0	110.6	C712 I718 L719	C712-V714 PolarHBondContact O-N 3.05Å; V714-I718 HydrophobicContact CG1-CB 3.73Å; V714-I718 HydrophobicContact CG1-CG2 3.7Å; V714-L719 HydrophobicContact CG1-CB 4.3Å
715	P	60.3	Low	58.2	Low	50 Å²	50	80.6 Å²	80.6	33%	0.325	42%	0.424	S	S	.	.			trans	-58.1	139.7	169.9	-20.9	31.4	0	0	0	111.3	V717 I718 L719	P715-V717 PolarHBondContact O-N 2.8Å; P715-V717 VanDerWaalsContact O-N 3.08Å; P715-I718 HydrophobicContact CB-CG1 4.29Å; P715-I718 HydrophobicContact CG-CD1 4Å; P715-I718 HydrophobicContact CG-CG1 4.16Å; P715-I718 PolarHBondContact O-N 3.47Å; P715-L719 PolarHBondContact O-N 3.36Å
716	H	58.8	Low	60.5	Low	47 Å²	47	75.6 Å²	75.6	22%	0.218	40%	0.401	C	S	.	.	H	α-helix	trans	-57.2	-27.9	177.5	-65.6	-38.5	0	0	0	113	L719 L720	H716-L719 PolarHBondContact O-N 2.86Å; H716-L720 VanDerWaalsContact O-CB 3.29Å; H716-L720 WeakPolarHBondContact O-CB 3.29Å; H716-L720 PolarHBondContact O-N 2.82Å
717	V	63	Low	62.5	Low	68 Å²	68	75.9 Å²	75.9	41%	0.412	40%	0.398	S	S	.	.	H	α-helix	trans	-61.8	-44.9	170.8	-179	0	0	0	0	112	T608 P715 L720 I721	T608-V717 HydrophobicContact CG2-CG2 4.31Å; P715-V717 PolarHBondContact O-N 2.8Å; P715-V717 VanDerWaalsContact O-N 3.08Å; V717-L720 PolarHBondContact O-N 2.8Å; V717-I721 HydrophobicContact CG1-CD1 3.95Å; V717-I721 VanDerWaalsContact O-CG1 3.24Å; V717-I721 WeakPolarHBondContact O-CG1 3.42Å; V717-I721 PolarHBondContact O-N 2.98Å
718	I	68.7	Low	64.1	Low	87 Å²	87	77.5 Å²	77.5	45%	0.446	40%	0.403	S	S	.	.	H	α-helix	trans	-68.6	-39.3	176.9	-63.2	-171.9	0	0	0	110.6	V714 P715 L720 I721 V722	V714-I718 HydrophobicContact CG1-CB 3.73Å; V714-I718 HydrophobicContact CG1-CG2 3.7Å; P715-I718 HydrophobicContact CB-CG1 4.29Å; P715-I718 HydrophobicContact CG-CD1 4Å; P715-I718 HydrophobicContact CG-CG1 4.16Å; P715-I718 PolarHBondContact O-N 3.47Å; I718-L720 VanDerWaalsContact C-N 3.31Å; I718-L720 PolarHBondContact O-N 3Å; I718-I721 PolarHBondContact O-N 2.87Å; I718-V722 HydrophobicContact CG2-CG2 4.45Å; I718-V722 WeakPolarHBondContact O-CG2 3.32Å; I718-V722 PolarHBondContact O-N 3.43Å
719	L	68.1	Low	66.2	Low	32 Å²	32	76.8 Å²	76.8	17%	0.168	40%	0.398	C	S	.	.	H	α-helix	trans	-63.1	-39	176.1	-165.9	155.7	0	0	0	111.4	V714 P715 H716 V722 A723 I762 P766	V714-L719 HydrophobicContact CG1-CB 4.3Å; P715-L719 PolarHBondContact O-N 3.36Å; H716-L719 PolarHBondContact O-N 2.86Å; L719-V722 PolarHBondContact O-N 3.12Å; L719-A723 WeakPolarHBondContact O-CB 3.16Å; L719-A723 PolarHBondContact O-N 2.81Å; L719-I762 HydrophobicContact CD2-CG2 3.59Å; L719-I762 HydrophobicContact CG-CG2 3.98Å; L719-P766 HydrophobicContact CD1-CG 4.42Å; L719-P766 HydrophobicContact CD2-CG 3.94Å
720	L	69.8	Low	68.1	Low	91 Å²	91	69.5 Å²	69.5	48%	0.476	37%	0.372	S	S	.	.	H	α-helix	trans	-67.9	-41.1	173.1	-177.8	148	0	0	0	112.4	H716 V717 I718 V722 A723 V724	H716-L720 VanDerWaalsContact O-CB 3.29Å; H716-L720 WeakPolarHBondContact O-CB 3.29Å; H716-L720 PolarHBondContact O-N 2.82Å; V717-L720 PolarHBondContact O-N 2.8Å; I718-L720 VanDerWaalsContact C-N 3.31Å; I718-L720 PolarHBondContact O-N 3Å; L720-V722 VanDerWaalsContact C-N 3.34Å; L720-V722 PolarHBondContact O-N 3.22Å; L720-A723 PolarHBondContact O-N 3.4Å; L720-V724 HydrophobicContact CD2-CG2 4.25Å; L720-V724 WeakPolarHBondContact O-CG2 3.48Å; L720-V724 PolarHBondContact O-N 3.26Å
721	I	75.3	Confident	69.7	Low	100 Å²	100	61 Å²	61	51%	0.513	34%	0.341	S	S	.	.	H	α-helix	trans	-60.5	-44	173.4	-72	163.3	0	0	0	110.6	V717 I718 V724 F725	V717-I721 HydrophobicContact CG1-CD1 3.95Å; V717-I721 VanDerWaalsContact O-CG1 3.24Å; V717-I721 WeakPolarHBondContact O-CG1 3.42Å; V717-I721 PolarHBondContact O-N 2.98Å; I718-I721 PolarHBondContact O-N 2.87Å; I721-V724 PolarHBondContact O-N 3.29Å; I721-F725 VanDerWaalsContact O-CB 3.31Å; I721-F725 WeakPolarHBondContact O-CB 3.42Å; I721-F725 PolarHBondContact O-N 3.12Å
722	V	78.3	Confident	71.4	Confident	60 Å²	60	56.3 Å²	56.3	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-44.5	174.8	168.7	0	0	0	0	110.8	I718 L719 L720 V724 F725 L726 I762	I718-V722 HydrophobicContact CG2-CG2 4.45Å; I718-V722 WeakPolarHBondContact O-CG2 3.32Å; I718-V722 PolarHBondContact O-N 3.43Å; L719-V722 PolarHBondContact O-N 3.12Å; L720-V722 VanDerWaalsContact C-N 3.34Å; L720-V722 PolarHBondContact O-N 3.22Å; V722-V724 PolarHBondContact O-N 3.31Å; V722-F725 PolarHBondContact O-N 2.82Å; V722-L726 HydrophobicContact CG1-CD1 3.79Å; V722-L726 HydrophobicContact CG1-CG 4.29Å; V722-L726 WeakPolarHBondContact O-CG 3.22Å; V722-L726 PolarHBondContact O-N 3.38Å; V722-I762 HydrophobicContact CG1-CD1 4.28Å
723	A	76.6	Confident	73.3	Confident	9 Å²	9	55.2 Å²	55.2	7%	0.074	31%	0.311	C	S	.	.	H	α-helix	trans	-59.7	-47.4	176	0	0	0	0	0	112.1	L719 L720 F725 L726 L727 F759 I762	L719-A723 WeakPolarHBondContact O-CB 3.16Å; L719-A723 PolarHBondContact O-N 2.81Å; L720-A723 PolarHBondContact O-N 3.4Å; A723-F725 PolarHBondContact O-N 3.33Å; A723-L726 PolarHBondContact O-N 2.84Å; A723-L727 PolarHBondContact O-N 3.48Å; A723-F759 HydrophobicContact CB-CD2 3.91Å; A723-F759 HydrophobicContact CB-CE2 4.11Å; A723-F759 VanDerWaalsContact O-CD2 3.23Å; A723-F759 WeakPolarHBondContact O-CD2 3.36Å; A723-I762 HydrophobicContact CB-CG2 4.36Å
724	V	77.6	Confident	74.7	Confident	71 Å²	71	52.9 Å²	52.9	43%	0.43	29%	0.286	S	S	.	.	H	α-helix	trans	-62	-42.1	176.4	170.9	0	0	0	0	111.4	L720 I721 V722 L727 I728	L720-V724 HydrophobicContact CD2-CG2 4.25Å; L720-V724 WeakPolarHBondContact O-CG2 3.48Å; L720-V724 PolarHBondContact O-N 3.26Å; I721-V724 PolarHBondContact O-N 3.29Å; V722-V724 PolarHBondContact O-N 3.31Å; V724-L727 PolarHBondContact O-N 3.45Å; V724-I728 HydrophobicContact CG1-CD1 3.79Å; V724-I728 HydrophobicContact CG1-CG1 4.46Å; V724-I728 VanDerWaalsContact O-CG1 3.32Å; V724-I728 WeakPolarHBondContact O-CG1 3.17Å; V724-I728 PolarHBondContact O-N 2.93Å
725	F	83.3	Confident	75.5	Confident	110 Å²	110	52.4 Å²	52.4	48%	0.482	28%	0.284	S	S	.	.	H	α-helix	trans	-61.1	-46.8	175.9	175.7	-98.1	0	0	0	112.2	I721 V722 A723 L727 I728 M729	I721-F725 VanDerWaalsContact O-CB 3.31Å; I721-F725 WeakPolarHBondContact O-CB 3.42Å; I721-F725 PolarHBondContact O-N 3.12Å; V722-F725 PolarHBondContact O-N 2.82Å; A723-F725 PolarHBondContact O-N 3.33Å; F725-L727 VanDerWaalsContact C-N 3.31Å; F725-L727 PolarHBondContact O-N 3.27Å; F725-I728 PolarHBondContact O-N 3.43Å; F725-M729 HydrophobicContact CD1-CG 4.18Å; F725-M729 HydrophobicContact CD2-CG 4.36Å; F725-M729 HydrophobicContact CE1-CE 4.47Å; F725-M729 HydrophobicContact CE1-CG 3.8Å; F725-M729 HydrophobicContact CE2-CG 4Å; F725-M729 HydrophobicContact CE2-SD 4.17Å; F725-M729 HydrophobicContact CG-CG 4.45Å; F725-M729 HydrophobicContact CZ-CE 3.92Å; F725-M729 HydrophobicContact CZ-CG 3.7Å; F725-M729 HydrophobicContact CZ-SD 3.98Å; F725-M729 VanDerWaalsContact O-CG 3.26Å; F725-M729 WeakPolarHBondContact O-CG 3.39Å; F725-M729 PolarHBondContact O-N 3.47Å
726	L	84.6	Confident	76.3	Confident	23 Å²	23	53.1 Å²	53.1	12%	0.12	29%	0.287	C	S	.	.	H	α-helix	trans	-61.1	-40.3	176.9	-66.1	165.8	0	0	0	111.4	V722 A723 M729 A730 F755 F759 I762	V722-L726 HydrophobicContact CG1-CD1 3.79Å; V722-L726 HydrophobicContact CG1-CG 4.29Å; V722-L726 WeakPolarHBondContact O-CG 3.22Å; V722-L726 PolarHBondContact O-N 3.38Å; A723-L726 PolarHBondContact O-N 2.84Å; L726-M729 PolarHBondContact O-N 3.06Å; L726-A730 WeakPolarHBondContact O-CB 3.43Å; L726-A730 PolarHBondContact O-N 3.47Å; L726-F755 HydrophobicContact CD2-CD1 3.54Å; L726-F755 HydrophobicContact CD2-CE1 3.94Å; L726-F759 HydrophobicContact CB-CB 4.18Å; L726-I762 HydrophobicContact CD1-CD1 3.54Å
727	L	82.7	Confident	77.1	Confident	26 Å²	26	52.9 Å²	52.9	14%	0.136	28%	0.284	C	S	.	.	H	α-helix	trans	-65.2	-43	175.6	-175.2	147.8	0	0	0	112.1	M536 T540 A723 V724 F725 A730 Q731 F759	M536-L727 HydrophobicContact CE-CD2 3.41Å; M536-L727 VanDerWaalsContact CE-CD2 3.41Å; T540-L727 HydrophobicContact CG2-CD1 4.16Å; T540-L727 HydrophobicContact CG2-CD2 4.14Å; T540-L727 HydrophobicContact CG2-CG 4.2Å; A723-L727 PolarHBondContact O-N 3.48Å; V724-L727 PolarHBondContact O-N 3.45Å; F725-L727 VanDerWaalsContact C-N 3.31Å; F725-L727 PolarHBondContact O-N 3.27Å; L727-A730 WeakPolarHBondContact O-CB 3.43Å; L727-A730 PolarHBondContact O-N 3.44Å; L727-Q731 HydrophobicContact CD2-CG 4.48Å; L727-Q731 WeakPolarHBondContact O-CG 3.29Å; L727-Q731 PolarHBondContact O-N 3.04Å; L727-F759 HydrophobicContact CB-CD2 4.03Å; L727-F759 HydrophobicContact CB-CE2 4.34Å; L727-F759 HydrophobicContact CB-CG 4.2Å; L727-F759 HydrophobicContact CD1-CD1 4.11Å; L727-F759 HydrophobicContact CD1-CD2 4.29Å; L727-F759 HydrophobicContact CD1-CE1 3.74Å; L727-F759 HydrophobicContact CD1-CE2 3.92Å; L727-F759 HydrophobicContact CD1-CG 4.37Å; L727-F759 HydrophobicContact CD1-CZ 3.63Å
728	I	81.7	Confident	77.4	Confident	75 Å²	75	53.4 Å²	53.4	39%	0.385	28%	0.284	S	S	.	.	H	α-helix	trans	-61.6	-45.8	174.9	-70	165.8	0	0	0	110.6	M536 V724 F725 A730 Q731 V732	M536-I728 HydrophobicContact CE-CG1 4.07Å; V724-I728 HydrophobicContact CG1-CD1 3.79Å; V724-I728 HydrophobicContact CG1-CG1 4.46Å; V724-I728 VanDerWaalsContact O-CG1 3.32Å; V724-I728 WeakPolarHBondContact O-CG1 3.17Å; V724-I728 PolarHBondContact O-N 2.93Å; F725-I728 PolarHBondContact O-N 3.43Å; I728-A730 VanDerWaalsContact C-N 3.33Å; I728-A730 PolarHBondContact O-N 2.89Å; I728-Q731 WeakPolarHBondContact O-CB 3.48Å; I728-Q731 PolarHBondContact O-N 3.14Å; I728-Q731 VanDerWaalsContact O-N 3.08Å; I728-V732 HydrophobicContact CG2-CG2 4.42Å; I728-V732 WeakPolarHBondContact O-CG2 3.41Å; I728-V732 PolarHBondContact O-N 3.26Å
729	M	83.8	Confident	77.5	Confident	48 Å²	48	56.4 Å²	56.4	24%	0.236	30%	0.3	C	S	.	.	H	α-helix	trans	-62.6	-40.1	177.7	-66.8	-68.4	-92	0	0	111.5	F725 L726 Q731 V732 F733 F755	F725-M729 HydrophobicContact CD1-CG 4.18Å; F725-M729 HydrophobicContact CD2-CG 4.36Å; F725-M729 HydrophobicContact CE1-CE 4.47Å; F725-M729 HydrophobicContact CE1-CG 3.8Å; F725-M729 HydrophobicContact CE2-CG 4Å; F725-M729 HydrophobicContact CE2-SD 4.17Å; F725-M729 HydrophobicContact CG-CG 4.45Å; F725-M729 HydrophobicContact CZ-CE 3.92Å; F725-M729 HydrophobicContact CZ-CG 3.7Å; F725-M729 HydrophobicContact CZ-SD 3.98Å; F725-M729 VanDerWaalsContact O-CG 3.26Å; F725-M729 WeakPolarHBondContact O-CG 3.39Å; F725-M729 PolarHBondContact O-N 3.47Å; L726-M729 PolarHBondContact O-N 3.06Å; M729-Q731 VanDerWaalsContact C-N 3.29Å; M729-Q731 PolarHBondContact O-N 3.36Å; M729-V732 PolarHBondContact O-N 2.98Å; M729-F733 HydrophobicContact CE-CE2 3.91Å; M729-F733 VanDerWaalsContact O-CD2 3.32Å; M729-F733 WeakPolarHBondContact O-CD2 3.35Å; M729-F733 PolarHBondContact O-N 3.4Å; M729-F733 HydrophobicContact SD-CE2 4.46Å; M729-F755 HydrophobicContact CB-CD1 4.17Å; M729-F755 HydrophobicContact CB-CD2 3.65Å; M729-F755 HydrophobicContact CB-CE1 4.27Å; M729-F755 HydrophobicContact CB-CE2 3.76Å; M729-F755 HydrophobicContact CB-CG 3.88Å; M729-F755 HydrophobicContact CB-CZ 4.08Å; M729-F755 HydrophobicContact CE-CE2 4.28Å; M729-F755 HydrophobicContact CE-CZ 4.1Å; M729-F755 HydrophobicContact CG-CZ 4.48Å
730	A	82.8	Confident	77.5	Confident	5 Å²	5	57.2 Å²	57.2	4%	0.041	31%	0.309	C	S	.	.	H	α-helix	trans	-59.2	-38.6	172.3	0	0	0	0	0	112.5	L726 L727 I728 G734 F755 L756	L726-A730 WeakPolarHBondContact O-CB 3.43Å; L726-A730 PolarHBondContact O-N 3.47Å; L727-A730 WeakPolarHBondContact O-CB 3.43Å; L727-A730 PolarHBondContact O-N 3.44Å; I728-A730 VanDerWaalsContact C-N 3.33Å; I728-A730 PolarHBondContact O-N 2.89Å; A730-G734 PolarHBondContact O-N 3.49Å; A730-F755 HydrophobicContact CB-CB 3.84Å; A730-L756 HydrophobicContact CB-CB 4.24Å
731	Q	78.3	Confident	77.1	Confident	17 Å²	17	59.3 Å²	59.3	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-67.4	-44.3	174.1	-63	-43.9	-74.9	0	0	112.4	L539 M543 L727 I728 M729 G734 T735	L539-Q731 HydrophobicContact CB-CG 4.44Å; L539-Q731 PolarHBondContact O-OE1 3.23Å; L539-Q731 VanDerWaalsContact O-OE1 3.1Å; M543-Q731 VanDerWaalsContact CG-OE1 3.25Å; L727-Q731 HydrophobicContact CD2-CG 4.48Å; L727-Q731 WeakPolarHBondContact O-CG 3.29Å; L727-Q731 PolarHBondContact O-N 3.04Å; I728-Q731 WeakPolarHBondContact O-CB 3.48Å; I728-Q731 PolarHBondContact O-N 3.14Å; I728-Q731 VanDerWaalsContact O-N 3.08Å; M729-Q731 VanDerWaalsContact C-N 3.29Å; M729-Q731 PolarHBondContact O-N 3.36Å; Q731-G734 PolarHBondContact O-N 2.87Å; Q731-T735 PolarHBondContact O-N 3.19Å; Q731-T735 PolarHBondContact O-OG1 2.95Å
732	V	81.4	Confident	76.5	Confident	68 Å²	68	61.9 Å²	61.9	41%	0.412	32%	0.323	S	S	.	.	H	α-helix	trans	-64.9	-48.3	-179.1	172.8	0	0	0	0	111.6	I728 M729 G734 T735 V736	I728-V732 HydrophobicContact CG2-CG2 4.42Å; I728-V732 WeakPolarHBondContact O-CG2 3.41Å; I728-V732 PolarHBondContact O-N 3.26Å; M729-V732 PolarHBondContact O-N 2.98Å; V732-G734 VanDerWaalsContact C-N 3.25Å; V732-G734 PolarHBondContact O-N 3.48Å; V732-T735 PolarHBondContact O-N 2.97Å; V732-T735 PolarHBondContact O-OG1 3.03Å; V732-V736 WeakPolarHBondContact O-CG2 3.44Å; V732-V736 PolarHBondContact O-N 3.08Å
733	F	82	Confident	75.9	Confident	50 Å²	50	63.3 Å²	63.3	22%	0.219	33%	0.329	C	S	.	.	H	α-helix	trans	-68.3	-28.5	176.9	-75.4	-78	0	0	0	112.2	M729 W737 I751 A752 F755	M729-F733 HydrophobicContact CE-CE2 3.91Å; M729-F733 VanDerWaalsContact O-CD2 3.32Å; M729-F733 WeakPolarHBondContact O-CD2 3.35Å; M729-F733 PolarHBondContact O-N 3.4Å; M729-F733 HydrophobicContact SD-CE2 4.46Å; F733-W737 WeakPolarHBondContact O-CB 3.27Å; F733-W737 PolarHBondContact O-N 2.99Å; F733-I751 HydrophobicContact CB-CB 4.3Å; F733-I751 HydrophobicContact CB-CG2 3.97Å; F733-I751 HydrophobicContact CD1-CB 4.06Å; F733-I751 HydrophobicContact CD1-CD1 3.97Å; F733-I751 HydrophobicContact CD1-CG2 3.68Å; F733-I751 HydrophobicContact CD2-CG2 3.44Å; F733-I751 VanDerWaalsContact CD2-CG2 3.44Å; F733-I751 HydrophobicContact CE1-CD1 3.87Å; F733-I751 HydrophobicContact CE1-CG2 4Å; F733-I751 HydrophobicContact CE2-CG2 3.79Å; F733-I751 HydrophobicContact CG-CB 4.04Å; F733-I751 HydrophobicContact CG-CG2 3.39Å; F733-I751 HydrophobicContact CZ-CG2 4.06Å; F733-A752 HydrophobicContact CB-CB 3.92Å; F733-F755 AromaticContact CD2-CD2 3.92Å; F733-F755 HydrophobicContact CD2-CD2 3.92Å; F733-F755 AromaticContact CD2-CE2 3.68Å; F733-F755 HydrophobicContact CD2-CE2 3.68Å; F733-F755 HydrophobicContact CE2-CD2 4.38Å; F733-F755 AromaticContact CE2-CE2 3.67Å; F733-F755 HydrophobicContact CE2-CE2 3.67Å
734	G	76.4	Confident	75.3	Confident	6 Å²	6	67.4 Å²	67.4	6%	0.062	36%	0.355	C	S	.	.	H	α-helix	trans	-61.9	-49.5	168.4	0	0	0	0	0	113.3	M543 A730 Q731 V732 V736 W737 L738	M543-G734 VanDerWaalsContact SD-C 3.54Å; A730-G734 PolarHBondContact O-N 3.49Å; Q731-G734 PolarHBondContact O-N 2.87Å; V732-G734 VanDerWaalsContact C-N 3.25Å; V732-G734 PolarHBondContact O-N 3.48Å; G734-V736 PolarHBondContact O-N 2.87Å; G734-W737 PolarHBondContact O-N 3.47Å; G734-L738 WeakPolarHBondContact O-CB 3.39Å; G734-L738 PolarHBondContact O-N 3.48Å
735	T	72.9	Confident	74.7	Confident	58 Å²	58	70.7 Å²	70.7	36%	0.356	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-40.4	177.2	53.7	0	0	0	0	111.8	M543 Q731 V732 L738 L739	M543-T735 HydrophobicContact CE-CG2 3.31Å; M543-T735 VanDerWaalsContact CE-N 3.35Å; Q731-T735 PolarHBondContact O-N 3.19Å; Q731-T735 PolarHBondContact O-OG1 2.95Å; V732-T735 PolarHBondContact O-N 2.97Å; V732-T735 PolarHBondContact O-OG1 3.03Å; T735-L738 PolarHBondContact O-N 3.18Å; T735-L739 WeakPolarHBondContact O-CB 3.37Å; T735-L739 WeakPolarHBondContact O-CG 3.46Å; T735-L739 PolarHBondContact O-N 3.47Å
736	V	76.7	Confident	74.2	Confident	64 Å²	64	66.7 Å²	66.7	39%	0.388	35%	0.354	S	S	.	.	H	α-helix	trans	-67.9	-36.1	179	177.6	0	0	0	0	111.6	V732 G734 S740	V732-V736 WeakPolarHBondContact O-CG2 3.44Å; V732-V736 PolarHBondContact O-N 3.08Å; G734-V736 PolarHBondContact O-N 2.87Å; V736-S740 WeakPolarHBondContact O-CB 3.48Å; V736-S740 PolarHBondContact O-N 3.16Å; V736-S740 VanDerWaalsContact O-N 3.07Å
737	W	75	Confident	74	Confident	43 Å²	43	73 Å²	73	16%	0.163	38%	0.38	C	S	.	.	H	α-helix	trans	-63.9	-41.8	170.1	174.1	66.9	0	0	0	112.3	F733 G734 L739 S740 N748 L749	F733-W737 WeakPolarHBondContact O-CB 3.27Å; F733-W737 PolarHBondContact O-N 2.99Å; G734-W737 PolarHBondContact O-N 3.47Å; W737-L739 VanDerWaalsContact C-N 3.28Å; W737-L739 PolarHBondContact O-N 3.04Å; W737-S740 PolarHBondContact O-N 3.47Å; W737-N748 HydrophobicContact CB-CB 3.98Å; W737-L749 HydrophobicContact CD2-CB 4.3Å; W737-L749 HydrophobicContact CD2-CD1 3.98Å; W737-L749 HydrophobicContact CE3-CD1 4.16Å; W737-L749 HydrophobicContact CG-CB 4Å; W737-L749 HydrophobicContact CG-CD1 4.45Å; W737-L749 HydrophobicContact CZ2-CD1 4.38Å; W737-L749 HydrophobicContact CZ2-CD2 4.11Å; W737-L749 HydrophobicContact CZ3-CD1 4.43Å
738	L	68.9	Low	73.7	Confident	78 Å²	78	73.4 Å²	73.4	41%	0.408	38%	0.383	S	S	.	.	H	α-helix	trans	-68.8	-26.4	-178.7	-152.1	158.3	0	0	0	112.6	M543 A546 G734 T735	M543-L738 HydrophobicContact SD-CD1 4.47Å; A546-L738 HydrophobicContact CB-CD1 3.59Å; G734-L738 WeakPolarHBondContact O-CB 3.39Å; G734-L738 PolarHBondContact O-N 3.48Å; T735-L738 PolarHBondContact O-N 3.18Å
739	L	70.7	Confident	73.5	Confident	150 Å²	150	71.5 Å²	71.5	79%	0.785	37%	0.373	S	S	*	.	H	α-helix	trans	-90.5	-16.1	175.9	-72.8	166.5	0	0	0	114.4	T735 W737	T735-L739 WeakPolarHBondContact O-CB 3.37Å; T735-L739 WeakPolarHBondContact O-CG 3.46Å; T735-L739 PolarHBondContact O-N 3.47Å; W737-L739 VanDerWaalsContact C-N 3.28Å; W737-L739 PolarHBondContact O-N 3.04Å
740	S	68.1	Low	73.4	Confident	50 Å²	50	75.4 Å²	75.4	35%	0.35	39%	0.389	S	S	.	.	S	Bend	trans	-84.2	164.5	176.9	-159.4	0	0	0	0	110.9	V736 W737	V736-S740 WeakPolarHBondContact O-CB 3.48Å; V736-S740 PolarHBondContact O-N 3.16Å; V736-S740 VanDerWaalsContact O-N 3.07Å; W737-S740 PolarHBondContact O-N 3.47Å
741	D	62.1	Low	73.4	Confident	134 Å²	134	76.8 Å²	76.8	72%	0.717	40%	0.395	S	S	*	.			trans	-60.7	142	175.3	-145.8	-22	0	0	0	109.7	D743 N746	D741-D743 PolarHBondContact O-N 3.24Å; D741-N746 PolarHBondContact O-ND2 2.85Å
742	R	63.5	Low	73.5	Confident	154 Å²	154	76.5 Å²	76.5	58%	0.581	40%	0.396	S	S	*	.			trans	-80.2	37.6	-153.3	-80.2	177.5	155.3	-151.7	-11.9	115.6	N549	N549-R742 PolarHBondContact OD1-NH1 3.08Å
743	D	64.7	Low	73.5	Confident	91 Å²	91	77.1 Å²	77.1	49%	0.487	40%	0.396	S	S	.	.			trans	-67.4	131.9	-179.3	-76.3	-31	0	0	0	112.4	D741 N745 N746	D741-D743 PolarHBondContact O-N 3.24Å; D743-N745 PolarHBondContact O-N 3.41Å; D743-N746 WeakPolarHBondContact O-CB 3.29Å; D743-N746 PolarHBondContact O-N 3.06Å; D743-N746 PolarHBondContact O-ND2 3.26Å
744	P	64.8	Low	73.7	Confident	94 Å²	94	77.7 Å²	77.7	61%	0.61	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-15.8	171.9	30.1	-35.4	0	0	0	112.3	N746	P744-N746 VanDerWaalsContact C-N 3.31Å
745	N	65.1	Low	74.3	Confident	141 Å²	141	79.7 Å²	79.7	75%	0.754	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	1.6	177.1	-63.5	-24	0	0	0	113.1	D743 F747	D743-N745 PolarHBondContact O-N 3.41Å; N745-F747 PolarHBondContact O-N 3.17Å
746	N	72.1	Confident	74.7	Confident	25 Å²	25	80 Å²	80	13%	0.134	42%	0.416	C	S	.	.			trans	-61.8	118.2	-179.2	-93.1	-34.2	0	0	0	112.4	D741 D743 P744 N748 L749	D741-N746 PolarHBondContact O-ND2 2.85Å; D743-N746 WeakPolarHBondContact O-CB 3.29Å; D743-N746 PolarHBondContact O-N 3.06Å; D743-N746 PolarHBondContact O-ND2 3.26Å; P744-N746 VanDerWaalsContact C-N 3.31Å; N746-N748 PolarHBondContact O-N 3.34Å; N746-N748 VanDerWaalsContact O-N 3.09Å; N746-L749 WeakPolarHBondContact O-CB 3.39Å; N746-L749 PolarHBondContact O-N 2.86Å
747	F	79.4	Confident	75.1	Confident	156 Å²	156	80.3 Å²	80.3	68%	0.684	42%	0.421	S	S	*	.	H	α-helix	trans	-52.1	-34.3	176.8	-169.8	-127.5	0	0	0	113	N745 L749 F750 I751	N745-F747 PolarHBondContact O-N 3.17Å; F747-L749 VanDerWaalsContact C-N 3.3Å; F747-L749 PolarHBondContact O-N 3.34Å; F747-F750 PolarHBondContact O-N 3.19Å; F747-I751 HydrophobicContact CD1-CD1 3.57Å; F747-I751 HydrophobicContact CD1-CG1 4.39Å; F747-I751 HydrophobicContact CE1-CD1 3.64Å; F747-I751 HydrophobicContact CE1-CG1 4.33Å; F747-I751 HydrophobicContact CG-CD1 4.16Å; F747-I751 HydrophobicContact CZ-CD1 4.27Å; F747-I751 HydrophobicContact CZ-CG1 4.49Å; F747-I751 WeakPolarHBondContact O-CG1 3.35Å; F747-I751 PolarHBondContact O-N 3.38Å; F747-I751 VanDerWaalsContact O-N 3.07Å
748	N	78.2	Confident	75.5	Confident	34 Å²	34	79.3 Å²	79.3	18%	0.182	42%	0.424	C	S	.	.	H	α-helix	trans	-58.6	-35.1	177.8	-62.2	-32.3	0	0	0	113.7	W737 N746 I751 A752	W737-N748 HydrophobicContact CB-CB 3.98Å; N746-N748 PolarHBondContact O-N 3.34Å; N746-N748 VanDerWaalsContact O-N 3.09Å; N748-I751 PolarHBondContact O-N 3.17Å; N748-A752 WeakPolarHBondContact O-CB 3.48Å; N748-A752 PolarHBondContact O-N 3.49Å
749	L	76.5	Confident	76.1	Confident	35 Å²	35	78.3 Å²	78.3	18%	0.183	42%	0.416	C	S	.	.	H	α-helix	trans	-68	-44.5	178	-179.7	60.2	0	0	0	111.2	W737 N746 F747 I751 A752 I753	W737-L749 HydrophobicContact CD2-CB 4.3Å; W737-L749 HydrophobicContact CD2-CD1 3.98Å; W737-L749 HydrophobicContact CE3-CD1 4.16Å; W737-L749 HydrophobicContact CG-CB 4Å; W737-L749 HydrophobicContact CG-CD1 4.45Å; W737-L749 HydrophobicContact CZ2-CD1 4.38Å; W737-L749 HydrophobicContact CZ2-CD2 4.11Å; W737-L749 HydrophobicContact CZ3-CD1 4.43Å; N746-L749 WeakPolarHBondContact O-CB 3.39Å; N746-L749 PolarHBondContact O-N 2.86Å; F747-L749 VanDerWaalsContact C-N 3.3Å; F747-L749 PolarHBondContact O-N 3.34Å; L749-I751 VanDerWaalsContact C-N 3.32Å; L749-I751 PolarHBondContact O-N 3.3Å; L749-A752 PolarHBondContact O-N 3.23Å; L749-I753 HydrophobicContact CD1-CD1 3.97Å; L749-I753 HydrophobicContact CD1-CG1 4.38Å; L749-I753 HydrophobicContact CG-CD1 3.96Å; L749-I753 WeakPolarHBondContact O-CG1 3.48Å; L749-I753 PolarHBondContact O-N 3.05Å
750	F	81.1	Confident	76.5	Confident	130 Å²	130	74.3 Å²	74.3	57%	0.57	40%	0.398	S	S	*	.	H	α-helix	trans	-62.1	-40.1	176.2	-69.7	-83.1	0	0	0	111.7	F747 A754	F747-F750 PolarHBondContact O-N 3.19Å; F750-A754 VanDerWaalsContact O-CB 3.29Å; F750-A754 WeakPolarHBondContact O-CB 3.17Å; F750-A754 PolarHBondContact O-N 3.3Å
751	I	83.8	Confident	77	Confident	34 Å²	34	78.4 Å²	78.4	17%	0.174	41%	0.413	C	S	.	.	H	α-helix	trans	-62.7	-47.7	174.6	-64.2	164.1	0	0	0	111.1	F733 F747 N748 L749 I753 A754 F755	F733-I751 HydrophobicContact CB-CB 4.3Å; F733-I751 HydrophobicContact CB-CG2 3.97Å; F733-I751 HydrophobicContact CD1-CB 4.06Å; F733-I751 HydrophobicContact CD1-CD1 3.97Å; F733-I751 HydrophobicContact CD1-CG2 3.68Å; F733-I751 HydrophobicContact CD2-CG2 3.44Å; F733-I751 VanDerWaalsContact CD2-CG2 3.44Å; F733-I751 HydrophobicContact CE1-CD1 3.87Å; F733-I751 HydrophobicContact CE1-CG2 4Å; F733-I751 HydrophobicContact CE2-CG2 3.79Å; F733-I751 HydrophobicContact CG-CB 4.04Å; F733-I751 HydrophobicContact CG-CG2 3.39Å; F733-I751 HydrophobicContact CZ-CG2 4.06Å; F747-I751 HydrophobicContact CD1-CD1 3.57Å; F747-I751 HydrophobicContact CD1-CG1 4.39Å; F747-I751 HydrophobicContact CE1-CD1 3.64Å; F747-I751 HydrophobicContact CE1-CG1 4.33Å; F747-I751 HydrophobicContact CG-CD1 4.16Å; F747-I751 HydrophobicContact CZ-CD1 4.27Å; F747-I751 HydrophobicContact CZ-CG1 4.49Å; F747-I751 WeakPolarHBondContact O-CG1 3.35Å; F747-I751 PolarHBondContact O-N 3.38Å; F747-I751 VanDerWaalsContact O-N 3.07Å; N748-I751 PolarHBondContact O-N 3.17Å; L749-I751 VanDerWaalsContact C-N 3.32Å; L749-I751 PolarHBondContact O-N 3.3Å; I751-I753 PolarHBondContact O-N 2.87Å; I751-A754 PolarHBondContact O-N 2.88Å; I751-F755 HydrophobicContact CG2-CD2 3.5Å; I751-F755 VanDerWaalsContact CG2-CD2 3.5Å; I751-F755 HydrophobicContact CG2-CE2 3.3Å; I751-F755 HydrophobicContact CG2-CZ 4.4Å; I751-F755 WeakPolarHBondContact O-CD2 3.34Å; I751-F755 PolarHBondContact O-N 3.02Å
752	A	81.1	Confident	77.7	Confident	11 Å²	11	74.9 Å²	74.9	9%	0.091	39%	0.394	C	S	.	.	H	α-helix	trans	-60.3	-44.4	-179.8	0	0	0	0	0	112.2	F733 N748 L749 F755 L756	F733-A752 HydrophobicContact CB-CB 3.92Å; N748-A752 WeakPolarHBondContact O-CB 3.48Å; N748-A752 PolarHBondContact O-N 3.49Å; L749-A752 PolarHBondContact O-N 3.23Å; A752-F755 PolarHBondContact O-N 3.34Å; A752-L756 WeakPolarHBondContact O-CB 3.46Å; A752-L756 PolarHBondContact O-N 3.39Å
753	I	81.5	Confident	78	Confident	81 Å²	81	68.9 Å²	68.9	42%	0.415	38%	0.376	S	S	.	.	H	α-helix	trans	-65.1	-43.4	176.6	-66.2	167.8	0	0	0	110.9	L749 I751 F755 L756 C757	L749-I753 HydrophobicContact CD1-CD1 3.97Å; L749-I753 HydrophobicContact CD1-CG1 4.38Å; L749-I753 HydrophobicContact CG-CD1 3.96Å; L749-I753 WeakPolarHBondContact O-CG1 3.48Å; L749-I753 PolarHBondContact O-N 3.05Å; I751-I753 PolarHBondContact O-N 2.87Å; I753-F755 PolarHBondContact O-N 2.98Å; I753-L756 PolarHBondContact O-N 3.33Å; I753-C757 PolarHBondContact O-N 3.45Å; I753-C757 PolarHBondContact O-SG 2.71Å
754	A	85.5	Confident	78.3	Confident	62 Å²	62	69.5 Å²	69.5	51%	0.512	38%	0.379	S	S	.	.	H	α-helix	trans	-61	-43.4	178.4	0	0	0	0	0	112.3	F750 I751 C757 G758	F750-A754 VanDerWaalsContact O-CB 3.29Å; F750-A754 WeakPolarHBondContact O-CB 3.17Å; F750-A754 PolarHBondContact O-N 3.3Å; I751-A754 PolarHBondContact O-N 2.88Å; A754-C757 PolarHBondContact O-N 3.19Å; A754-G758 PolarHBondContact O-N 2.87Å
755	F	87.8	Confident	78.7	Confident	49 Å²	49	72.4 Å²	72.4	22%	0.215	38%	0.379	C	S	.	.	H	α-helix	trans	-65.9	-39.3	175.5	-77.9	-50.8	0	0	0	112.9	L726 M729 A730 F733 I751 A752 I753 G758 F759	L726-F755 HydrophobicContact CD2-CD1 3.54Å; L726-F755 HydrophobicContact CD2-CE1 3.94Å; M729-F755 HydrophobicContact CB-CD1 4.17Å; M729-F755 HydrophobicContact CB-CD2 3.65Å; M729-F755 HydrophobicContact CB-CE1 4.27Å; M729-F755 HydrophobicContact CB-CE2 3.76Å; M729-F755 HydrophobicContact CB-CG 3.88Å; M729-F755 HydrophobicContact CB-CZ 4.08Å; M729-F755 HydrophobicContact CE-CE2 4.28Å; M729-F755 HydrophobicContact CE-CZ 4.1Å; M729-F755 HydrophobicContact CG-CZ 4.48Å; A730-F755 HydrophobicContact CB-CB 3.84Å; F733-F755 AromaticContact CD2-CD2 3.92Å; F733-F755 HydrophobicContact CD2-CD2 3.92Å; F733-F755 AromaticContact CD2-CE2 3.68Å; F733-F755 HydrophobicContact CD2-CE2 3.68Å; F733-F755 HydrophobicContact CE2-CD2 4.38Å; F733-F755 AromaticContact CE2-CE2 3.67Å; F733-F755 HydrophobicContact CE2-CE2 3.67Å; I751-F755 HydrophobicContact CG2-CD2 3.5Å; I751-F755 VanDerWaalsContact CG2-CD2 3.5Å; I751-F755 HydrophobicContact CG2-CE2 3.3Å; I751-F755 HydrophobicContact CG2-CZ 4.4Å; I751-F755 WeakPolarHBondContact O-CD2 3.34Å; I751-F755 PolarHBondContact O-N 3.02Å; A752-F755 PolarHBondContact O-N 3.34Å; I753-F755 PolarHBondContact O-N 2.98Å; F755-G758 PolarHBondContact O-N 2.99Å; F755-F759 PolarHBondContact O-N 3.47Å
756	L	82.7	Confident	78.8	Confident	63 Å²	63	66.8 Å²	66.8	33%	0.33	35%	0.35	S	S	.	.	H	α-helix	trans	-63	-45.4	175.9	-172.2	67.8	0	0	0	111.7	A730 A752 I753 G758 F759 V760	A730-L756 HydrophobicContact CB-CB 4.24Å; A752-L756 WeakPolarHBondContact O-CB 3.46Å; A752-L756 PolarHBondContact O-N 3.39Å; I753-L756 PolarHBondContact O-N 3.33Å; L756-G758 VanDerWaalsContact C-N 3.34Å; L756-G758 PolarHBondContact O-N 3.04Å; L756-F759 PolarHBondContact O-N 2.94Å; L756-V760 WeakPolarHBondContact O-CG2 3.26Å; L756-V760 PolarHBondContact O-N 2.81Å; L756-V760 VanDerWaalsContact O-N 3.08Å
757	C	84.6	Confident	78.5	Confident	72 Å²	72	70.2 Å²	70.2	49%	0.486	37%	0.368	S	S	.	.	H	α-helix	trans	-62.8	-39.6	174.7	-70.8	0	0	0	0	112.2	I753 A754 V760 M761	I753-C757 PolarHBondContact O-N 3.45Å; I753-C757 PolarHBondContact O-SG 2.71Å; A754-C757 PolarHBondContact O-N 3.19Å; C757-V760 PolarHBondContact O-N 3.45Å; C757-M761 WeakPolarHBondContact O-CG 3.41Å; C757-M761 PolarHBondContact O-N 3.27Å
758	G	82.7	Confident	78.1	Confident	22 Å²	22	65.1 Å²	65.1	23%	0.227	36%	0.355	C	S	.	.	H	α-helix	trans	-59.6	-46	174.2	0	0	0	0	0	112.7	A754 F755 L756 M761 I762	A754-G758 PolarHBondContact O-N 2.87Å; F755-G758 PolarHBondContact O-N 2.99Å; L756-G758 VanDerWaalsContact C-N 3.34Å; L756-G758 PolarHBondContact O-N 3.04Å; G758-M761 PolarHBondContact O-N 3.31Å; G758-I762 WeakPolarHBondContact O-CB 3.43Å; G758-I762 WeakPolarHBondContact O-CG1 3.27Å; G758-I762 PolarHBondContact O-N 2.85Å
759	F	82.6	Confident	77.6	Confident	57 Å²	57	67.3 Å²	67.3	25%	0.25	37%	0.366	C	S	.	.	H	α-helix	trans	-57.3	-50.4	174	166.6	-106.9	0	0	0	112.1	A723 L726 L727 F755 L756 M761 I762 A763	A723-F759 HydrophobicContact CB-CD2 3.91Å; A723-F759 HydrophobicContact CB-CE2 4.11Å; A723-F759 VanDerWaalsContact O-CD2 3.23Å; A723-F759 WeakPolarHBondContact O-CD2 3.36Å; L726-F759 HydrophobicContact CB-CB 4.18Å; L727-F759 HydrophobicContact CB-CD2 4.03Å; L727-F759 HydrophobicContact CB-CE2 4.34Å; L727-F759 HydrophobicContact CB-CG 4.2Å; L727-F759 HydrophobicContact CD1-CD1 4.11Å; L727-F759 HydrophobicContact CD1-CD2 4.29Å; L727-F759 HydrophobicContact CD1-CE1 3.74Å; L727-F759 HydrophobicContact CD1-CE2 3.92Å; L727-F759 HydrophobicContact CD1-CG 4.37Å; L727-F759 HydrophobicContact CD1-CZ 3.63Å; F755-F759 PolarHBondContact O-N 3.47Å; L756-F759 PolarHBondContact O-N 2.94Å; F759-M761 PolarHBondContact O-N 2.82Å; F759-I762 PolarHBondContact O-N 3.5Å; F759-A763 HydrophobicContact CE2-CB 4.33Å; F759-A763 VanDerWaalsContact O-CB 3.28Å; F759-A763 WeakPolarHBondContact O-CB 3.43Å; F759-A763 PolarHBondContact O-N 3.44Å
760	V	78.2	Confident	77.2	Confident	66 Å²	66	66.7 Å²	66.7	40%	0.4	36%	0.362	S	S	.	.	H	α-helix	trans	-59.3	-46.3	-178.8	171.7	0	0	0	0	111.5	L756 C757 I764	L756-V760 WeakPolarHBondContact O-CG2 3.26Å; L756-V760 PolarHBondContact O-N 2.81Å; L756-V760 VanDerWaalsContact O-N 3.08Å; C757-V760 PolarHBondContact O-N 3.45Å; V760-I764 HydrophobicContact CG1-CD1 3.68Å; V760-I764 WeakPolarHBondContact O-CB 3.46Å; V760-I764 VanDerWaalsContact O-CG1 3.32Å; V760-I764 WeakPolarHBondContact O-CG1 3.39Å; V760-I764 PolarHBondContact O-N 3.07Å; V760-I764 VanDerWaalsContact O-N 3.09Å
761	M	79.4	Confident	76.7	Confident	136 Å²	136	64.7 Å²	64.7	67%	0.67	36%	0.357	S	S	*	.	H	α-helix	trans	-63.8	-45	179	-72.2	-62.8	-65.9	0	0	112.6	C757 G758 F759 Y765	C757-M761 WeakPolarHBondContact O-CG 3.41Å; C757-M761 PolarHBondContact O-N 3.27Å; G758-M761 PolarHBondContact O-N 3.31Å; F759-M761 PolarHBondContact O-N 2.82Å; M761-Y765 WeakPolarHBondContact O-CB 3.3Å; M761-Y765 PolarHBondContact O-N 2.94Å
762	I	75.9	Confident	76.1	Confident	60 Å²	60	69 Å²	69	31%	0.308	38%	0.377	S	S	.	.	H	α-helix	trans	-72.8	-32.9	-176.9	-72.5	166.7	0	0	0	111.7	L719 V722 A723 L726 G758 F759 P766	L719-I762 HydrophobicContact CD2-CG2 3.59Å; L719-I762 HydrophobicContact CG-CG2 3.98Å; V722-I762 HydrophobicContact CG1-CD1 4.28Å; A723-I762 HydrophobicContact CB-CG2 4.36Å; L726-I762 HydrophobicContact CD1-CD1 3.54Å; G758-I762 WeakPolarHBondContact O-CB 3.43Å; G758-I762 WeakPolarHBondContact O-CG1 3.27Å; G758-I762 PolarHBondContact O-N 2.85Å; F759-I762 PolarHBondContact O-N 3.5Å; I762-P766 WeakPolarHBondContact O-CD 3.31Å; I762-P766 WeakPolarHBondContact O-CG 3.31Å
763	A	70.7	Confident	75.5	Confident	27 Å²	27	74.1 Å²	74.1	22%	0.223	40%	0.395	C	S	.	.	H	α-helix	trans	-73.2	-46.1	176.2	0	0	0	0	0	112.8	F759	F759-A763 HydrophobicContact CE2-CB 4.33Å; F759-A763 VanDerWaalsContact O-CB 3.28Å; F759-A763 WeakPolarHBondContact O-CB 3.43Å; F759-A763 PolarHBondContact O-N 3.44Å
764	I	70.9	Confident	74.8	Confident	105 Å²	105	70.5 Å²	70.5	54%	0.538	38%	0.377	S	S	.	.	H	α-helix	trans	-73.1	-42.8	-172.1	-67.7	176.5	0	0	0	112.2	V760 L767 A768	V760-I764 HydrophobicContact CG1-CD1 3.68Å; V760-I764 WeakPolarHBondContact O-CB 3.46Å; V760-I764 VanDerWaalsContact O-CG1 3.32Å; V760-I764 WeakPolarHBondContact O-CG1 3.39Å; V760-I764 PolarHBondContact O-N 3.07Å; V760-I764 VanDerWaalsContact O-N 3.09Å; I764-L767 PolarHBondContact O-N 3.44Å; I764-A768 WeakPolarHBondContact O-CB 3.18Å; I764-A768 PolarHBondContact O-N 3.12Å
765	Y	72.4	Confident	74.1	Confident	155 Å²	155	76.3 Å²	76.3	61%	0.608	39%	0.386	S	S	*	.	H	α-helix	trans	-56.2	-52.6	-172.4	-178.4	-102.5	0	0	0	115.1	M761 A768 L769	M761-Y765 WeakPolarHBondContact O-CB 3.3Å; M761-Y765 PolarHBondContact O-N 2.94Å; Y765-A768 PolarHBondContact O-N 2.78Å; Y765-L769 HydrophobicContact CD1-CD1 4.2Å; Y765-L769 HydrophobicContact CE1-CD1 3.61Å; Y765-L769 HydrophobicContact CE2-CD1 4.3Å; Y765-L769 PolarHBondContact O-N 3.1Å
766	P	67.2	Low	73.2	Confident	23 Å²	23	77.6 Å²	77.6	15%	0.149	40%	0.398	C	S	.	.	H	α-helix	trans	-68.9	-36	179.5	28.1	-35	0	0	0	112.4	L719 I762 L769 I770	L719-P766 HydrophobicContact CD1-CG 4.42Å; L719-P766 HydrophobicContact CD2-CG 3.94Å; I762-P766 WeakPolarHBondContact O-CD 3.31Å; I762-P766 WeakPolarHBondContact O-CG 3.31Å; P766-L769 PolarHBondContact O-N 3.24Å; P766-I770 WeakPolarHBondContact O-CB 3.3Å; P766-I770 VanDerWaalsContact O-CG1 3.27Å; P766-I770 WeakPolarHBondContact O-CG1 3.28Å; P766-I770 PolarHBondContact O-N 3.22Å
767	L	66.9	Low	72.3	Confident	97 Å²	97	77.2 Å²	77.2	51%	0.508	40%	0.396	S	S	.	.	H	α-helix	trans	-61.4	-45.7	174.9	-86.7	167.5	0	0	0	111.2	I764 L769 I770 I771	I764-L767 PolarHBondContact O-N 3.44Å; L767-L769 PolarHBondContact O-N 2.54Å; L767-I770 PolarHBondContact O-N 2.92Å; L767-I771 WeakPolarHBondContact O-CB 3.44Å; L767-I771 WeakPolarHBondContact O-CD1 3.45Å; L767-I771 VanDerWaalsContact O-CG1 3.23Å; L767-I771 WeakPolarHBondContact O-CG1 3.43Å; L767-I771 PolarHBondContact O-N 3.41Å
768	A	69.7	Low	71.7	Confident	49 Å²	49	74.5 Å²	74.5	41%	0.405	38%	0.378	S	S	.	.	H	α-helix	trans	-60.9	-42.8	178.2	0	0	0	0	0	112.5	I764 Y765 M772	I764-A768 WeakPolarHBondContact O-CB 3.18Å; I764-A768 PolarHBondContact O-N 3.12Å; Y765-A768 PolarHBondContact O-N 2.78Å; A768-M772 WeakPolarHBondContact O-CB 3.29Å; A768-M772 PolarHBondContact O-N 3.28Å
769	L	68.9	Low	71.3	Confident	79 Å²	79	73.5 Å²	73.5	41%	0.414	37%	0.367	S	S	.	.	H	α-helix	trans	-63.7	-45.8	175.9	-73.9	175.7	0	0	0	112.5	Y765 P766 L767 I771 M772 Y773	Y765-L769 HydrophobicContact CD1-CD1 4.2Å; Y765-L769 HydrophobicContact CE1-CD1 3.61Å; Y765-L769 HydrophobicContact CE2-CD1 4.3Å; Y765-L769 PolarHBondContact O-N 3.1Å; P766-L769 PolarHBondContact O-N 3.24Å; L767-L769 PolarHBondContact O-N 2.54Å; L769-I771 PolarHBondContact O-N 2.93Å; L769-M772 PolarHBondContact O-N 3.15Å; L769-Y773 WeakPolarHBondContact O-CB 3.28Å; L769-Y773 PolarHBondContact O-N 3.08Å
770	I	68.8	Low	71	Confident	22 Å²	22	75.9 Å²	75.9	11%	0.113	37%	0.374	C	S	.	.	H	α-helix	trans	-64.3	-40.7	180	-70	168.3	0	0	0	111	L607 L664 P766 L767 S774	L607-I770 HydrophobicContact CD1-CD1 4.24Å; L664-I770 HydrophobicContact CD2-CG2 3.26Å; P766-I770 WeakPolarHBondContact O-CB 3.3Å; P766-I770 VanDerWaalsContact O-CG1 3.27Å; P766-I770 WeakPolarHBondContact O-CG1 3.28Å; P766-I770 PolarHBondContact O-N 3.22Å; L767-I770 PolarHBondContact O-N 2.92Å; I770-S774 WeakPolarHBondContact O-CB 3.35Å; I770-S774 PolarHBondContact O-N 2.74Å; I770-S774 PolarHBondContact O-OG 2.99Å
771	I	69.2	Low	71	Confident	88 Å²	88	80.2 Å²	80.2	45%	0.451	38%	0.383	S	S	.	.	H	α-helix	trans	-64.4	-49.4	175	-68.9	165.3	0	0	0	110.5	L767 L769 Y773 S774 W775	L767-I771 WeakPolarHBondContact O-CB 3.44Å; L767-I771 WeakPolarHBondContact O-CD1 3.45Å; L767-I771 VanDerWaalsContact O-CG1 3.23Å; L767-I771 WeakPolarHBondContact O-CG1 3.43Å; L767-I771 PolarHBondContact O-N 3.41Å; L769-I771 PolarHBondContact O-N 2.93Å; I771-Y773 VanDerWaalsContact C-N 3.34Å; I771-Y773 PolarHBondContact O-N 2.69Å; I771-S774 PolarHBondContact O-N 3.1Å; I771-S774 PolarHBondContact O-OG 3.47Å; I771-S774 VanDerWaalsContact O-OG 3.06Å; I771-W775 WeakPolarHBondContact O-CB 3.39Å; I771-W775 PolarHBondContact O-N 2.69Å
772	M	71.1	Confident	71	Confident	124 Å²	124	76.9 Å²	76.9	61%	0.611	36%	0.363	S	S	*	.	H	α-helix	trans	-59	-43.4	179.4	-170.2	-156.3	-59.6	0	0	112.3	A768 L769 T776	A768-M772 WeakPolarHBondContact O-CB 3.29Å; A768-M772 PolarHBondContact O-N 3.28Å; L769-M772 PolarHBondContact O-N 3.15Å; M772-T776 WeakPolarHBondContact O-CG2 3.49Å; M772-T776 PolarHBondContact O-N 2.91Å; M772-T776 PolarHBondContact O-OG1 2.94Å
773	Y	68.5	Low	71.1	Confident	120 Å²	120	74 Å²	74	47%	0.471	35%	0.349	S	S	.	.	H	α-helix	trans	-72.6	-38.4	-177.8	-154.6	-84.9	0	0	0	112.6	C667 L769 I771 W775 T776 N777	C667-Y773 HydrophobicContact CB-CD1 3.88Å; C667-Y773 HydrophobicContact CB-CE1 4.37Å; C667-Y773 WeakPolarHBondContact SG-CD1 3.35Å; L769-Y773 WeakPolarHBondContact O-CB 3.28Å; L769-Y773 PolarHBondContact O-N 3.08Å; I771-Y773 VanDerWaalsContact C-N 3.34Å; I771-Y773 PolarHBondContact O-N 2.69Å; Y773-W775 VanDerWaalsContact C-N 3.34Å; Y773-W775 PolarHBondContact O-N 2.96Å; Y773-T776 WeakPolarHBondContact CA-OG1 3.35Å; Y773-T776 PolarHBondContact O-N 3.11Å; Y773-T776 PolarHBondContact O-OG1 3.38Å; Y773-T776 VanDerWaalsContact O-OG1 3.1Å; Y773-N777 HydrophobicContact CD1-CB 4.29Å; Y773-N777 WeakPolarHBondContact CD1-ND2 3.46Å; Y773-N777 HydrophobicContact CE1-CB 4.2Å; Y773-N777 WeakPolarHBondContact CE1-ND2 3.16Å; Y773-N777 VanDerWaalsContact CZ-ND2 3.25Å; Y773-N777 PolarHBondContact O-N 2.89Å
774	S	68.2	Low	71.6	Confident	5 Å²	5	75.8 Å²	75.8	4%	0.035	35%	0.354	C	S	.	.	H	α-helix	trans	-71.4	-24.7	176.6	58.5	0	0	0	0	113.7	I770 I771	I770-S774 WeakPolarHBondContact O-CB 3.35Å; I770-S774 PolarHBondContact O-N 2.74Å; I770-S774 PolarHBondContact O-OG 2.99Å; I771-S774 PolarHBondContact O-N 3.1Å; I771-S774 PolarHBondContact O-OG 3.47Å; I771-S774 VanDerWaalsContact O-OG 3.06Å
775	W	70.8	Confident	71.9	Confident	183 Å²	183	72.4 Å²	72.4	69%	0.693	34%	0.342	S	S	*	.	H	α-helix	trans	-80.9	-28.2	172.9	-81	49.1	0	0	0	113.5	I771 Y773	I771-W775 WeakPolarHBondContact O-CB 3.39Å; I771-W775 PolarHBondContact O-N 2.69Å; Y773-W775 VanDerWaalsContact C-N 3.34Å; Y773-W775 PolarHBondContact O-N 2.96Å
776	T	67.1	Low	72	Confident	76 Å²	76	65.6 Å²	65.6	47%	0.466	32%	0.318	S	S	.	.	H	α-helix	trans	-84.5	-50.4	179.8	44.6	0	0	0	0	111.8	M772 Y773 V778	M772-T776 WeakPolarHBondContact O-CG2 3.49Å; M772-T776 PolarHBondContact O-N 2.91Å; M772-T776 PolarHBondContact O-OG1 2.94Å; Y773-T776 WeakPolarHBondContact CA-OG1 3.35Å; Y773-T776 PolarHBondContact O-N 3.11Å; Y773-T776 PolarHBondContact O-OG1 3.38Å; Y773-T776 VanDerWaalsContact O-OG1 3.1Å; T776-V778 VanDerWaalsContact C-N 3.35Å; T776-V778 PolarHBondContact O-N 3.32Å; T776-V778 VanDerWaalsContact O-N 3.1Å
777	N	65.4	Low	72.3	Confident	55 Å²	55	65.3 Å²	65.3	29%	0.294	32%	0.317	S	S	.	.			trans	-88.2	57.2	-174.1	-73.6	-60.4	0	0	0	114.3	Y773	Y773-N777 HydrophobicContact CD1-CB 4.29Å; Y773-N777 WeakPolarHBondContact CD1-ND2 3.46Å; Y773-N777 HydrophobicContact CE1-CB 4.2Å; Y773-N777 WeakPolarHBondContact CE1-ND2 3.16Å; Y773-N777 VanDerWaalsContact CZ-ND2 3.25Å; Y773-N777 PolarHBondContact O-N 2.89Å
778	V	72.4	Confident	72.7	Confident	16 Å²	16	69.6 Å²	69.6	10%	0.097	33%	0.327	C	S	.	.			trans	-70.8	126.4	175.3	-176	0	0	0	0	110.5	T776 R780 R781 R782	T776-V778 VanDerWaalsContact C-N 3.35Å; T776-V778 PolarHBondContact O-N 3.32Å; T776-V778 VanDerWaalsContact O-N 3.1Å; V778-R780 VanDerWaalsContact C-N 3.35Å; V778-R780 HydrophobicContact CG1-CB 4.14Å; V778-R780 PolarHBondContact O-N 3.36Å; V778-R781 HydrophobicContact CB-CB 4.33Å; V778-R781 HydrophobicContact CB-CG 4.06Å; V778-R781 WeakPolarHBondContact O-CB 3.36Å; V778-R781 PolarHBondContact O-N 3.15Å; V778-R782 PolarHBondContact O-N 3.45Å
779	P	73.6	Confident	72.8	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-60.3	-41.6	-176.1	22.3	-32.8	0	0	0	112.4	F650 R781 R782 V783	F650-P779 HydrophobicContact CB-CG 4.47Å; F650-P779 HydrophobicContact CD1-CB 3.67Å; F650-P779 HydrophobicContact CD1-CG 3.71Å; F650-P779 HydrophobicContact CD2-CB 4.21Å; F650-P779 HydrophobicContact CE1-CB 3.69Å; F650-P779 HydrophobicContact CE1-CG 4.11Å; F650-P779 HydrophobicContact CE2-CB 4.22Å; F650-P779 HydrophobicContact CG-CB 3.95Å; F650-P779 HydrophobicContact CG-CG 4.13Å; F650-P779 HydrophobicContact CZ-CB 3.97Å; P779-R781 PolarHBondContact O-N 3.39Å; P779-R781 VanDerWaalsContact O-N 3.13Å; P779-R782 WeakPolarHBondContact O-CA 3.39Å; P779-R782 WeakPolarHBondContact O-CB 3.08Å; P779-R782 PolarHBondContact O-N 2.92Å; P779-V783 PolarHBondContact O-N 3.06Å
780	R	76.1	Confident	72.7	Confident	108 Å²	108	66.9 Å²	66.9	41%	0.408	31%	0.307	S	S	.	.	H	α-helix	trans	-53.4	-33	172.5	-168.4	-178.6	-170.5	171.5	12.3	113.4	E651 V778 N784	E651-R780 VanDerWaalsContact CD-NH1 3.27Å; E651-R780 IonicContact OE1-CZ 3.44Å; E651-R780 IonicContact OE1-NH1 3.64Å; E651-R780 PolarHBondContact OE1-NH1 2.76Å; E651-R780 IonicContact OE1-NH2 2.77Å; E651-R780 PolarHBondContact OE1-NH2 2.85Å; E651-R780 IonicContact OE2-CZ 2.96Å; E651-R780 IonicContact OE2-NE 2.7Å; E651-R780 IonicContact OE2-NH1 3.01Å; E651-R780 PolarHBondContact OE2-NH1 2.84Å; E651-R780 IonicContact OE2-NH2 3.31Å; E651-R780 PolarHBondContact OE2-NH2 3.37Å; V778-R780 VanDerWaalsContact C-N 3.35Å; V778-R780 HydrophobicContact CG1-CB 4.14Å; V778-R780 PolarHBondContact O-N 3.36Å; R780-N784 WeakPolarHBondContact O-CB 3.23Å; R780-N784 PolarHBondContact O-N 3.38Å; R780-N784 PolarHBondContact O-ND2 2.96Å
781	R	78.8	Confident	72.6	Confident	156 Å²	156	74.4 Å²	74.4	59%	0.589	34%	0.341	S	S	*	.	H	α-helix	trans	-72.3	-36.1	175.2	-73.2	-179.7	172.6	168.9	-3.3	112	V778 P779 A785	V778-R781 HydrophobicContact CB-CB 4.33Å; V778-R781 HydrophobicContact CB-CG 4.06Å; V778-R781 WeakPolarHBondContact O-CB 3.36Å; V778-R781 PolarHBondContact O-N 3.15Å; P779-R781 PolarHBondContact O-N 3.39Å; P779-R781 VanDerWaalsContact O-N 3.13Å; R781-A785 VanDerWaalsContact O-CB 3.23Å; R781-A785 WeakPolarHBondContact O-CB 3.33Å; R781-A785 PolarHBondContact O-N 3.07Å
782	R	78.8	Confident	72.4	Confident	67 Å²	67	78 Å²	78	25%	0.253	35%	0.353	S	S	.	.	H	α-helix	trans	-68.5	-49.7	176.3	-54.6	-164.2	-54.6	-130.2	-1.8	111.1	V778 P779 N784 A785 A786 E805	V778-R782 PolarHBondContact O-N 3.45Å; P779-R782 WeakPolarHBondContact O-CA 3.39Å; P779-R782 WeakPolarHBondContact O-CB 3.08Å; P779-R782 PolarHBondContact O-N 2.92Å; R782-N784 PolarHBondContact O-N 2.74Å; R782-A785 CarbonylContact O-C 3.48Å; R782-A785 WeakPolarHBondContact O-CA 3.42Å; R782-A785 WeakPolarHBondContact O-CB 3.44Å; R782-A785 PolarHBondContact O-N 3Å; R782-A786 PolarHBondContact O-N 2.91Å; R782-E805 WeakPolarHBondContact CB-OE1 3.39Å; R782-E805 IonicContact CZ-OE1 3.51Å; R782-E805 IonicContact CZ-OE2 2.76Å; R782-E805 IonicContact NE-OE1 2.7Å; R782-E805 PolarHBondContact NE-OE1 3.11Å; R782-E805 IonicContact NE-OE2 3.34Å; R782-E805 PolarHBondContact NE-OE2 3.28Å; R782-E805 IonicContact NH2-OE1 3.49Å; R782-E805 IonicContact NH2-OE2 3.48Å; R782-E805 PolarHBondContact NH2-OE2 2.83Å
783	V	78.6	Confident	72	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-58.9	-46.8	176	-178.9	0	0	0	0	111.2	A643 V646 A647 F650 P779 A785 A786 A787 L802 E805	A643-V783 HydrophobicContact CB-CG1 4.38Å; A643-V783 WeakPolarHBondContact O-CG1 3.48Å; V646-V783 HydrophobicContact CB-CG1 4.29Å; V646-V783 HydrophobicContact CG1-CG1 4.33Å; V646-V783 HydrophobicContact CG1-CG2 4.07Å; A647-V783 HydrophobicContact CB-CG1 4.06Å; F650-V783 HydrophobicContact CD2-CG2 4.22Å; F650-V783 HydrophobicContact CE2-CG2 4.09Å; P779-V783 PolarHBondContact O-N 3.06Å; V783-A785 PolarHBondContact O-N 2.9Å; V783-A786 WeakPolarHBondContact O-CB 3.27Å; V783-A786 PolarHBondContact O-N 2.98Å; V783-A786 VanDerWaalsContact O-N 3.16Å; V783-A787 PolarHBondContact O-N 2.98Å; V783-L802 HydrophobicContact CG1-CD2 4.27Å; V783-E805 HydrophobicContact CG2-CB 4.13Å; V783-E805 HydrophobicContact CG2-CG 4.01Å
784	N	79.7	Confident	72.2	Confident	63 Å²	63	78 Å²	78	34%	0.337	35%	0.349	S	S	.	.	H	α-helix	trans	-69.9	-16.2	175.6	-69.3	-5.4	0	0	0	113.7	R780 R782 R788	R780-N784 WeakPolarHBondContact O-CB 3.23Å; R780-N784 PolarHBondContact O-N 3.38Å; R780-N784 PolarHBondContact O-ND2 2.96Å; R782-N784 PolarHBondContact O-N 2.74Å; N784-R788 WeakPolarHBondContact O-CB 3.42Å; N784-R788 WeakPolarHBondContact O-CG 3.45Å; N784-R788 PolarHBondContact O-N 3.3Å; N784-R788 PolarHBondContact O-NE 2.6Å
785	A	78.7	Confident	72.5	Confident	34 Å²	34	81.3 Å²	81.3	28%	0.281	36%	0.363	S	S	.	.	H	α-helix	trans	-83.6	-33.6	169.7	0	0	0	0	0	111.9	R781 R782 V783 N789	R781-A785 VanDerWaalsContact O-CB 3.23Å; R781-A785 WeakPolarHBondContact O-CB 3.33Å; R781-A785 PolarHBondContact O-N 3.07Å; R782-A785 CarbonylContact O-C 3.48Å; R782-A785 WeakPolarHBondContact O-CA 3.42Å; R782-A785 WeakPolarHBondContact O-CB 3.44Å; R782-A785 PolarHBondContact O-N 3Å; V783-A785 PolarHBondContact O-N 2.9Å; A785-N789 WeakPolarHBondContact O-CB 3.36Å; A785-N789 PolarHBondContact O-N 3.37Å; A785-N789 PolarHBondContact O-ND2 3.4Å
786	A	74.2	Confident	72.8	Confident	12 Å²	12	78.3 Å²	78.3	10%	0.099	36%	0.357	C	S	.	.	H	α-helix	trans	-61.4	-52.8	167.1	0	0	0	0	0	110.5	R782 V783 R788 N789 A790 L798 K801	R782-A786 PolarHBondContact O-N 2.91Å; V783-A786 WeakPolarHBondContact O-CB 3.27Å; V783-A786 PolarHBondContact O-N 2.98Å; V783-A786 VanDerWaalsContact O-N 3.16Å; A786-R788 PolarHBondContact O-N 2.87Å; A786-N789 CarbonylContact O-C 3.6Å; A786-N789 WeakPolarHBondContact O-CA 3.26Å; A786-N789 PolarHBondContact O-N 3.42Å; A786-A790 PolarHBondContact O-N 2.9Å; A786-A790 VanDerWaalsContact O-N 3.16Å; A786-L798 HydrophobicContact CB-CD1 4.11Å; A786-K801 HydrophobicContact CB-CB 4.44Å
787	A	73.9	Confident	73.3	Confident	17 Å²	17	75.5 Å²	75.5	14%	0.14	34%	0.343	C	S	.	.	H	α-helix	trans	-55.7	-46	179.2	0	0	0	0	0	113.3	A643 V783 N789 A790	A643-A787 HydrophobicContact CB-CB 3.73Å; V783-A787 PolarHBondContact O-N 2.98Å; A787-N789 PolarHBondContact O-N 2.94Å; A787-A790 WeakPolarHBondContact O-CB 3.49Å; A787-A790 PolarHBondContact O-N 2.8Å; A787-A790 VanDerWaalsContact O-N 3.11Å
788	R	74.8	Confident	74.1	Confident	188 Å²	188	72.9 Å²	72.9	71%	0.709	33%	0.329	S	S	*	.	H	α-helix	trans	-68.1	-17.7	176.5	-76	179	-66	157.3	2.6	114	N784 A786	N784-R788 WeakPolarHBondContact O-CB 3.42Å; N784-R788 WeakPolarHBondContact O-CG 3.45Å; N784-R788 PolarHBondContact O-N 3.3Å; N784-R788 PolarHBondContact O-NE 2.6Å; A786-R788 PolarHBondContact O-N 2.87Å
789	N	71.9	Confident	74.5	Confident	65 Å²	65	72.3 Å²	72.3	35%	0.348	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	4.4	173.5	-75.4	-63.7	0	0	0	113.1	A785 A786 A787 H791 K792 L793	A785-N789 WeakPolarHBondContact O-CB 3.36Å; A785-N789 PolarHBondContact O-N 3.37Å; A785-N789 PolarHBondContact O-ND2 3.4Å; A786-N789 CarbonylContact O-C 3.6Å; A786-N789 WeakPolarHBondContact O-CA 3.26Å; A786-N789 PolarHBondContact O-N 3.42Å; A787-N789 PolarHBondContact O-N 2.94Å; N789-H791 PolarHBondContact O-N 3.44Å; N789-K792 WeakPolarHBondContact O-CA 3.21Å; N789-K792 PolarHBondContact O-N 3.03Å; N789-L793 HydrophobicContact CB-CD1 4.09Å; N789-L793 WeakPolarHBondContact O-CG 3.26Å; N789-L793 PolarHBondContact O-N 3.01Å
790	A	65.9	Low	75	Confident	6 Å²	6	78.5 Å²	78.5	5%	0.05	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-50.4	-52.3	178.3	0	0	0	0	0	112.1	A786 A787 K792 L793 L798	A786-A790 PolarHBondContact O-N 2.9Å; A786-A790 VanDerWaalsContact O-N 3.16Å; A787-A790 WeakPolarHBondContact O-CB 3.49Å; A787-A790 PolarHBondContact O-N 2.8Å; A787-A790 VanDerWaalsContact O-N 3.11Å; A790-K792 PolarHBondContact O-N 2.82Å; A790-L793 PolarHBondContact O-N 3.16Å; A790-L798 HydrophobicContact CB-CD1 4.5Å; A790-L798 HydrophobicContact CB-CD2 3.96Å
791	H	66.7	Low	75.2	Confident	180 Å²	180	77.8 Å²	77.8	83%	0.833	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-48.9	-29.4	172.7	165.9	-71.5	0	0	0	114.9	N789	N789-H791 PolarHBondContact O-N 3.44Å
792	K	66.1	Low	75.5	Confident	162 Å²	162	70.4 Å²	70.4	70%	0.704	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-97.1	-1.9	-176.4	-61.8	-175.7	179.9	178.9	0	113.4	N789 A790	N789-K792 WeakPolarHBondContact O-CA 3.21Å; N789-K792 PolarHBondContact O-N 3.03Å; A790-K792 PolarHBondContact O-N 2.82Å
793	L	62.8	Low	75.8	Confident	48 Å²	48	69 Å²	69	25%	0.251	32%	0.323	S	S	.	.	S	Bend	trans	-119.4	145.9	-177.9	-64.7	164.1	0	0	0	107.8	N789 A790 K801	N789-L793 HydrophobicContact CB-CD1 4.09Å; N789-L793 WeakPolarHBondContact O-CG 3.26Å; N789-L793 PolarHBondContact O-N 3.01Å; A790-L793 PolarHBondContact O-N 3.16Å; L793-K801 HydrophobicContact CD1-CD 4.06Å
794	R	72.2	Confident	75.9	Confident	198 Å²	198	72.8 Å²	72.8	75%	0.747	35%	0.346	S	S	*	.			trans	-64.8	152.3	158.6	-72.2	-176.5	177.9	170.3	-1.4	108.4	E796 G797 L798	R794-E796 PolarHBondContact O-N 2.95Å; R794-E796 VanDerWaalsContact O-N 3.12Å; R794-G797 WeakPolarHBondContact O-CA 3.31Å; R794-G797 PolarHBondContact O-N 3.26Å; R794-L798 PolarHBondContact O-N 3.05Å; R794-L798 VanDerWaalsContact O-N 3.12Å
795	F	73.4	Confident	76.1	Confident	74 Å²	74	70.9 Å²	70.9	33%	0.325	34%	0.335	S	S	.	.	H	α-helix	trans	-41.5	-47.8	173.9	176.2	-98.4	0	0	0	112.4	E639 G797 L798 M799 A847	E639-F795 HydrophobicContact CG-CD2 3.88Å; E639-F795 HydrophobicContact CG-CE2 4.27Å; F795-G797 VanDerWaalsContact C-N 3.35Å; F795-G797 PolarHBondContact O-N 3.41Å; F795-L798 PolarHBondContact O-N 3.35Å; F795-L798 VanDerWaalsContact O-N 3.11Å; F795-M799 HydrophobicContact CD1-CG 4.1Å; F795-M799 HydrophobicContact CD2-CE 4.28Å; F795-M799 HydrophobicContact CD2-CG 4.48Å; F795-M799 HydrophobicContact CE1-CG 3.89Å; F795-M799 HydrophobicContact CE2-CE 3.92Å; F795-M799 HydrophobicContact CE2-CG 4.28Å; F795-M799 HydrophobicContact CG-CG 4.41Å; F795-M799 HydrophobicContact CZ-CE 4.37Å; F795-M799 HydrophobicContact CZ-CG 4Å; F795-M799 HydrophobicContact CZ-SD 4.41Å; F795-M799 WeakPolarHBondContact O-CB 3.45Å; F795-M799 WeakPolarHBondContact O-CG 3.38Å; F795-M799 PolarHBondContact O-N 2.97Å; F795-A847 HydrophobicContact CE2-CB 4.48Å; F795-A847 HydrophobicContact CZ-CB 3.93Å
796	E	77.5	Confident	76.5	Confident	120 Å²	120	69.2 Å²	69.2	56%	0.561	32%	0.321	S	S	*	.	H	α-helix	trans	-49.1	-48.6	173	-56.7	163.5	146.8	0	0	113.4	R794 M799 Q800	R794-E796 PolarHBondContact O-N 2.95Å; R794-E796 VanDerWaalsContact O-N 3.12Å; E796-M799 PolarHBondContact O-N 3.27Å; E796-Q800 WeakPolarHBondContact O-CB 3.38Å; E796-Q800 VanDerWaalsContact O-CG 3.3Å; E796-Q800 WeakPolarHBondContact O-CG 3.31Å; E796-Q800 PolarHBondContact O-N 3.24Å
797	G	78.2	Confident	76.9	Confident	17 Å²	17	70.4 Å²	70.4	18%	0.175	33%	0.326	C	S	.	.	H	α-helix	trans	-79.1	-14.6	-177.7	0	0	0	0	0	114.4	R794 F795 K801	R794-G797 WeakPolarHBondContact O-CA 3.31Å; R794-G797 PolarHBondContact O-N 3.26Å; F795-G797 VanDerWaalsContact C-N 3.35Å; F795-G797 PolarHBondContact O-N 3.41Å; G797-K801 WeakPolarHBondContact O-CD 3.29Å; G797-K801 WeakPolarHBondContact O-CG 3.41Å
798	L	80.8	Confident	77.3	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-80.6	-46.9	162.7	-179.2	68.2	0	0	0	110.3	E639 A786 A790 R794 F795 Q800 K801 L802	E639-L798 HydrophobicContact CB-CD2 3.64Å; E639-L798 HydrophobicContact CG-CD2 3.89Å; E639-L798 WeakPolarHBondContact OE2-CD2 3.1Å; A786-L798 HydrophobicContact CB-CD1 4.11Å; A790-L798 HydrophobicContact CB-CD1 4.5Å; A790-L798 HydrophobicContact CB-CD2 3.96Å; R794-L798 PolarHBondContact O-N 3.05Å; R794-L798 VanDerWaalsContact O-N 3.12Å; F795-L798 PolarHBondContact O-N 3.35Å; F795-L798 VanDerWaalsContact O-N 3.11Å; L798-Q800 PolarHBondContact O-N 3.09Å; L798-K801 PolarHBondContact O-N 2.79Å; L798-K801 VanDerWaalsContact O-N 3.09Å; L798-L802 HydrophobicContact CD1-CD1 4.45Å; L798-L802 HydrophobicContact CD1-CG 4.44Å; L798-L802 HydrophobicContact CD2-CD1 4.4Å; L798-L802 HydrophobicContact CG-CD1 4.03Å; L798-L802 HydrophobicContact CG-CG 4.39Å; L798-L802 PolarHBondContact O-N 3.3Å
799	M	82.1	Confident	77.8	Confident	4 Å²	4	61.9 Å²	61.9	2%	0.02	29%	0.292	C	S	.	.	H	α-helix	trans	-60.4	-42.6	179.9	-71.9	-57.2	124.7	0	0	112.1	L642 F795 E796 K801 L802 Q803 A847 L850 L851	L642-M799 HydrophobicContact CD1-CE 3.91Å; F795-M799 HydrophobicContact CD1-CG 4.1Å; F795-M799 HydrophobicContact CD2-CE 4.28Å; F795-M799 HydrophobicContact CD2-CG 4.48Å; F795-M799 HydrophobicContact CE1-CG 3.89Å; F795-M799 HydrophobicContact CE2-CE 3.92Å; F795-M799 HydrophobicContact CE2-CG 4.28Å; F795-M799 HydrophobicContact CG-CG 4.41Å; F795-M799 HydrophobicContact CZ-CE 4.37Å; F795-M799 HydrophobicContact CZ-CG 4Å; F795-M799 HydrophobicContact CZ-SD 4.41Å; F795-M799 WeakPolarHBondContact O-CB 3.45Å; F795-M799 WeakPolarHBondContact O-CG 3.38Å; F795-M799 PolarHBondContact O-N 2.97Å; E796-M799 PolarHBondContact O-N 3.27Å; M799-K801 VanDerWaalsContact C-N 3.31Å; M799-K801 PolarHBondContact O-N 2.77Å; M799-L802 HydrophobicContact CE-CD1 3.93Å; M799-L802 PolarHBondContact O-N 2.9Å; M799-Q803 VanDerWaalsContact O-CB 3.25Å; M799-Q803 WeakPolarHBondContact O-CB 3.47Å; M799-Q803 PolarHBondContact O-N 3.25Å; M799-A847 HydrophobicContact SD-CB 4.09Å; M799-L850 HydrophobicContact CB-CD2 4.14Å; M799-L851 HydrophobicContact SD-CD1 3.87Å; M799-L851 HydrophobicContact SD-CD2 4.35Å; M799-L851 HydrophobicContact SD-CG 4.13Å
800	Q	82.9	Confident	78.4	Confident	130 Å²	130	58.9 Å²	58.9	61%	0.607	28%	0.276	S	S	*	.	H	α-helix	trans	-56.2	-43.6	172.5	-75.9	172.3	0.9	0	0	112.2	E796 L798 Q803 T804	E796-Q800 WeakPolarHBondContact O-CB 3.38Å; E796-Q800 VanDerWaalsContact O-CG 3.3Å; E796-Q800 WeakPolarHBondContact O-CG 3.31Å; E796-Q800 PolarHBondContact O-N 3.24Å; L798-Q800 PolarHBondContact O-N 3.09Å; Q800-Q803 PolarHBondContact O-N 3.34Å; Q800-T804 PolarHBondContact O-N 2.95Å
801	K	81.2	Confident	79	Confident	93 Å²	93	60.7 Å²	60.7	40%	0.404	29%	0.285	S	S	.	.	H	α-helix	trans	-68.8	-44.9	178.9	-71.2	174.8	-176.1	169.8	0	111.9	A786 L793 G797 L798 M799 Q803 T804 E805	A786-K801 HydrophobicContact CB-CB 4.44Å; L793-K801 HydrophobicContact CD1-CD 4.06Å; G797-K801 WeakPolarHBondContact O-CD 3.29Å; G797-K801 WeakPolarHBondContact O-CG 3.41Å; L798-K801 PolarHBondContact O-N 2.79Å; L798-K801 VanDerWaalsContact O-N 3.09Å; M799-K801 VanDerWaalsContact C-N 3.31Å; M799-K801 PolarHBondContact O-N 2.77Å; K801-Q803 VanDerWaalsContact C-N 3.3Å; K801-Q803 PolarHBondContact O-N 2.87Å; K801-T804 PolarHBondContact O-N 3.1Å; K801-T804 PolarHBondContact O-OG1 3.08Å; K801-E805 PolarHBondContact O-N 3.11Å; K801-E805 VanDerWaalsContact O-N 3.15Å
802	L	84.1	Confident	79.7	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.4	-39.7	174.4	-70.2	176.2	0	0	0	111.3	A643 V783 L798 M799 T804 E805 V806 L851	A643-L802 HydrophobicContact CB-CD1 4.25Å; A643-L802 HydrophobicContact CB-CD2 3.86Å; V783-L802 HydrophobicContact CG1-CD2 4.27Å; L798-L802 HydrophobicContact CD1-CD1 4.45Å; L798-L802 HydrophobicContact CD1-CG 4.44Å; L798-L802 HydrophobicContact CD2-CD1 4.4Å; L798-L802 HydrophobicContact CG-CD1 4.03Å; L798-L802 HydrophobicContact CG-CG 4.39Å; L798-L802 PolarHBondContact O-N 3.3Å; M799-L802 HydrophobicContact CE-CD1 3.93Å; M799-L802 PolarHBondContact O-N 2.9Å; L802-T804 VanDerWaalsContact C-N 3.35Å; L802-T804 PolarHBondContact O-N 2.95Å; L802-E805 PolarHBondContact O-N 3.33Å; L802-V806 WeakPolarHBondContact O-CB 3.26Å; L802-V806 VanDerWaalsContact O-CG2 3.29Å; L802-V806 WeakPolarHBondContact O-CG2 3.44Å; L802-V806 PolarHBondContact O-N 3.48Å; L802-L851 HydrophobicContact CB-CD1 4.46Å; L802-L851 HydrophobicContact CB-CD2 3.74Å; L802-L851 HydrophobicContact CD1-CD1 4.42Å
803	Q	85.4	Confident	80.5	Confident	39 Å²	39	44.4 Å²	44.4	18%	0.182	21%	0.211	C	C	.	.	H	α-helix	trans	-60.7	-41.4	175.5	-165.1	-177.5	64.9	0	0	111.6	M799 Q800 K801 E805 V806 D807 L851 R855	M799-Q803 VanDerWaalsContact O-CB 3.25Å; M799-Q803 WeakPolarHBondContact O-CB 3.47Å; M799-Q803 PolarHBondContact O-N 3.25Å; Q800-Q803 PolarHBondContact O-N 3.34Å; K801-Q803 VanDerWaalsContact C-N 3.3Å; K801-Q803 PolarHBondContact O-N 2.87Å; Q803-E805 PolarHBondContact O-N 3.05Å; Q803-V806 PolarHBondContact O-N 3.34Å; Q803-D807 WeakPolarHBondContact O-CB 3.36Å; Q803-D807 VanDerWaalsContact O-CG 3.25Å; Q803-D807 PolarHBondContact O-N 2.95Å; Q803-L851 HydrophobicContact CB-CD2 4.27Å; Q803-R855 VanDerWaalsContact OE1-NH2 3.14Å
804	T	81	Confident	81.2	Confident	79 Å²	79	47.2 Å²	47.2	49%	0.485	22%	0.219	S	C	.	.	H	α-helix	trans	-66.7	-33.7	175.3	57.9	0	0	0	0	114	Q800 K801 L802 L808	Q800-T804 PolarHBondContact O-N 2.95Å; K801-T804 PolarHBondContact O-N 3.1Å; K801-T804 PolarHBondContact O-OG1 3.08Å; L802-T804 VanDerWaalsContact C-N 3.35Å; L802-T804 PolarHBondContact O-N 2.95Å; T804-L808 WeakPolarHBondContact O-CB 3.31Å; T804-L808 PolarHBondContact O-N 2.99Å; T804-L808 VanDerWaalsContact O-N 3.16Å
805	E	85.2	Confident	81.3	Confident	22 Å²	22	39 Å²	39	10%	0.103	19%	0.191	C	C	.	.	H	α-helix	trans	-74.3	-36.2	174.8	-66.3	-72.1	-179.5	0	0	111.6	F650 R782 V783 K801 L802 Q803 L808 L809	F650-E805 HydrophobicContact CE2-CB 4.45Å; R782-E805 WeakPolarHBondContact CB-OE1 3.39Å; R782-E805 IonicContact CZ-OE1 3.51Å; R782-E805 IonicContact CZ-OE2 2.76Å; R782-E805 IonicContact NE-OE1 2.7Å; R782-E805 PolarHBondContact NE-OE1 3.11Å; R782-E805 IonicContact NE-OE2 3.34Å; R782-E805 PolarHBondContact NE-OE2 3.28Å; R782-E805 IonicContact NH2-OE1 3.49Å; R782-E805 IonicContact NH2-OE2 3.48Å; R782-E805 PolarHBondContact NH2-OE2 2.83Å; V783-E805 HydrophobicContact CG2-CB 4.13Å; V783-E805 HydrophobicContact CG2-CG 4.01Å; K801-E805 PolarHBondContact O-N 3.11Å; K801-E805 VanDerWaalsContact O-N 3.15Å; L802-E805 PolarHBondContact O-N 3.33Å; Q803-E805 PolarHBondContact O-N 3.05Å; E805-L808 PolarHBondContact O-N 3.37Å; E805-L809 WeakPolarHBondContact O-CB 3.36Å; E805-L809 PolarHBondContact O-N 3.29Å
806	V	86.8	Confident	81.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-70.4	-37.7	175.5	168.4	0	0	0	0	112	V646 L802 Q803 L809 A810 L851 F852 F860	V646-V806 HydrophobicContact CB-CG2 4.48Å; V646-V806 HydrophobicContact CG1-CG2 4.01Å; V646-V806 HydrophobicContact CG2-CG2 3.55Å; L802-V806 WeakPolarHBondContact O-CB 3.26Å; L802-V806 VanDerWaalsContact O-CG2 3.29Å; L802-V806 WeakPolarHBondContact O-CG2 3.44Å; L802-V806 PolarHBondContact O-N 3.48Å; Q803-V806 PolarHBondContact O-N 3.34Å; V806-L809 PolarHBondContact O-N 2.91Å; V806-A810 WeakPolarHBondContact O-CB 3.38Å; V806-A810 PolarHBondContact O-N 3.05Å; V806-L851 WeakPolarHBondContact CG1-O 3.15Å; V806-F852 HydrophobicContact CG2-CE1 4.36Å; V806-F860 HydrophobicContact CG1-CE2 3.59Å; V806-F860 HydrophobicContact CG1-CZ 3.68Å
807	D	82.4	Confident	81.5	Confident	37 Å²	37	30.3 Å²	30.3	20%	0.198	15%	0.152	C	C	.	.	H	α-helix	trans	-60.5	-47.2	170.2	-76.8	-29.4	0	0	0	110.8	Q803 L809 A810 D811 R855 R858	Q803-D807 WeakPolarHBondContact O-CB 3.36Å; Q803-D807 VanDerWaalsContact O-CG 3.25Å; Q803-D807 PolarHBondContact O-N 2.95Å; D807-L809 VanDerWaalsContact C-N 3.33Å; D807-L809 PolarHBondContact O-N 3.47Å; D807-A810 PolarHBondContact O-N 3.22Å; D807-D811 WeakPolarHBondContact O-CB 3.32Å; D807-D811 PolarHBondContact O-N 2.95Å; D807-R855 IonicContact OD1-CZ 2.7Å; D807-R855 IonicContact OD1-NH1 3.61Å; D807-R855 PolarHBondContact OD1-NH1 3.46Å; D807-R855 IonicContact OD2-CZ 4Å; D807-R855 IonicContact OD2-NH1 3.77Å; D807-R855 PolarHBondContact OD2-NH1 2.74Å; D807-R855 IonicContact OD2-NH2 3.39Å; D807-R855 PolarHBondContact OD2-NH2 2.94Å; D807-R858 IonicContact OD1-CZ 2.65Å; D807-R858 IonicContact OD1-NE 3.38Å; D807-R858 PolarHBondContact OD1-NE 2.86Å; D807-R858 IonicContact OD1-NH2 3.62Å; D807-R858 PolarHBondContact OD1-NH2 2.92Å
808	L	80.9	Confident	81.2	Confident	26 Å²	26	30.4 Å²	30.4	14%	0.136	15%	0.151	C	C	.	.	H	α-helix	trans	-62.8	-37.5	177.6	-178.5	146.7	0	0	0	112.4	F650 T804 E805 M812	F650-L808 HydrophobicContact CE1-CD2 4Å; F650-L808 HydrophobicContact CZ-CD2 3.92Å; T804-L808 WeakPolarHBondContact O-CB 3.31Å; T804-L808 PolarHBondContact O-N 2.99Å; T804-L808 VanDerWaalsContact O-N 3.16Å; E805-L808 PolarHBondContact O-N 3.37Å; L808-M812 VanDerWaalsContact O-CB 3.28Å; L808-M812 WeakPolarHBondContact O-CB 3.32Å; L808-M812 PolarHBondContact O-N 2.9Å
809	L	86.4	Confident	80.8	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.9	-48	173.7	177.3	61.8	0	0	0	111.8	L649 F650 E805 V806 D807 M812 I813 L826 F860	L649-L809 HydrophobicContact CB-CD2 3.84Å; L649-L809 HydrophobicContact CD1-CD2 4.22Å; F650-L809 HydrophobicContact CD1-CD1 3.96Å; F650-L809 HydrophobicContact CE1-CB 4.15Å; F650-L809 HydrophobicContact CE1-CD1 3.91Å; F650-L809 HydrophobicContact CE2-CB 4.24Å; F650-L809 HydrophobicContact CG-CD1 4.34Å; F650-L809 HydrophobicContact CZ-CB 3.77Å; F650-L809 HydrophobicContact CZ-CD1 4.25Å; F650-L809 HydrophobicContact CZ-CG 4.48Å; E805-L809 WeakPolarHBondContact O-CB 3.36Å; E805-L809 PolarHBondContact O-N 3.29Å; V806-L809 PolarHBondContact O-N 2.91Å; D807-L809 VanDerWaalsContact C-N 3.33Å; D807-L809 PolarHBondContact O-N 3.47Å; L809-M812 HydrophobicContact CD1-CE 3.97Å; L809-M812 PolarHBondContact O-N 3.16Å; L809-I813 HydrophobicContact CD1-CD1 3.91Å; L809-I813 HydrophobicContact CG-CD1 4.21Å; L809-I813 PolarHBondContact O-N 3.08Å; L809-L826 HydrophobicContact CD1-CD1 4.42Å; L809-L826 HydrophobicContact CD2-CD1 3.69Å; L809-L826 HydrophobicContact CG-CD1 3.82Å; L809-F860 HydrophobicContact CD2-CZ 4.49Å
810	A	83.9	Confident	80.4	Confident	2 Å²	2	34 Å²	34	2%	0.017	17%	0.17	C	C	.	.	H	α-helix	trans	-66.9	-34.9	177.4	0	0	0	0	0	112.7	V806 D807 R814 R858	V806-A810 WeakPolarHBondContact O-CB 3.38Å; V806-A810 PolarHBondContact O-N 3.05Å; D807-A810 PolarHBondContact O-N 3.22Å; A810-R814 VanDerWaalsContact O-CG 3.31Å; A810-R814 WeakPolarHBondContact O-CG 3.21Å; A810-R814 PolarHBondContact O-N 3.5Å; A810-R814 PolarHBondContact O-NE 3.2Å; A810-R858 HydrophobicContact CB-CG 4.38Å
811	D	77.9	Confident	79.8	Confident	43 Å²	43	36.8 Å²	36.8	23%	0.23	18%	0.176	C	C	.	.	H	α-helix	trans	-71.4	-31.8	174.7	-109.9	34.6	0	0	0	113.5	K669 D807 R814	K669-D811 IonicContact NZ-OD2 2.65Å; K669-D811 PolarHBondContact NZ-OD2 2.88Å; D807-D811 WeakPolarHBondContact O-CB 3.32Å; D807-D811 PolarHBondContact O-N 2.95Å; D811-R814 IonicContact OD1-CZ 3.17Å; D811-R814 IonicContact OD1-NH2 2.71Å; D811-R814 PolarHBondContact OD1-NH2 3.25Å
812	M	82	Confident	79.5	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-68.9	-52.5	173.7	179.9	-176.9	76.5	0	0	110.4	F650 A653 V662 F665 L808 L809 R814 S815 L816	F650-M812 HydrophobicContact CD1-CE 4.45Å; F650-M812 HydrophobicContact CE1-CE 4.46Å; A653-M812 HydrophobicContact CB-CE 3.78Å; V662-M812 HydrophobicContact CB-SD 4.13Å; V662-M812 HydrophobicContact CG1-CE 4.05Å; V662-M812 HydrophobicContact CG1-SD 3.72Å; V662-M812 HydrophobicContact CG2-CE 4.13Å; V662-M812 HydrophobicContact CG2-SD 4.11Å; F665-M812 HydrophobicContact CB-CG 4.24Å; F665-M812 HydrophobicContact CD1-CB 3.57Å; F665-M812 HydrophobicContact CD1-CG 3.57Å; F665-M812 HydrophobicContact CE1-CB 3.69Å; F665-M812 HydrophobicContact CE1-CG 4.16Å; F665-M812 HydrophobicContact CG-CB 4.45Å; F665-M812 HydrophobicContact CG-CG 4.02Å; L808-M812 VanDerWaalsContact O-CB 3.28Å; L808-M812 WeakPolarHBondContact O-CB 3.32Å; L808-M812 PolarHBondContact O-N 2.9Å; L809-M812 HydrophobicContact CD1-CE 3.97Å; L809-M812 PolarHBondContact O-N 3.16Å; M812-R814 PolarHBondContact O-N 3.31Å; M812-S815 PolarHBondContact O-N 3.03Å; M812-S815 VanDerWaalsContact O-N 3.09Å; M812-S815 PolarHBondContact O-OG 3.42Å; M812-L816 HydrophobicContact CE-CD1 4.37Å; M812-L816 HydrophobicContact CG-CD1 3.68Å; M812-L816 HydrophobicContact CG-CG 4.26Å; M812-L816 WeakPolarHBondContact O-CG 3.32Å; M812-L816 PolarHBondContact O-N 2.88Å; M812-L816 HydrophobicContact SD-CD1 4.31Å
813	I	84.1	Confident	79.3	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-57.8	-52.3	-178.2	-78.7	163.7	0	0	0	111.5	L809 S815 L816 D817 T824 L826 P859	L809-I813 HydrophobicContact CD1-CD1 3.91Å; L809-I813 HydrophobicContact CG-CD1 4.21Å; L809-I813 PolarHBondContact O-N 3.08Å; I813-S815 PolarHBondContact O-N 3.11Å; I813-L816 PolarHBondContact O-N 3Å; I813-D817 VanDerWaalsContact O-CB 3.28Å; I813-D817 WeakPolarHBondContact O-CB 3.46Å; I813-D817 VanDerWaalsContact O-CG 3.26Å; I813-D817 PolarHBondContact O-N 2.94Å; I813-T824 VanDerWaalsContact CG2-OG1 3.29Å; I813-T824 WeakPolarHBondContact CG2-OG1 3.33Å; I813-L826 HydrophobicContact CD1-CD1 3.52Å; I813-L826 HydrophobicContact CD1-CD2 3.45Å; I813-L826 VanDerWaalsContact CD1-CD2 3.45Å; I813-L826 HydrophobicContact CD1-CG 3.59Å; I813-P859 HydrophobicContact CG2-CG 3.99Å
814	R	77.3	Confident	79.3	Confident	108 Å²	108	32.8 Å²	32.8	41%	0.408	16%	0.159	S	C	.	.	H	α-helix	trans	-57.1	-26.3	178.7	-68.3	-177.8	-61.2	173.4	9.6	113.7	A810 D811 M812 A818 H857	A810-R814 VanDerWaalsContact O-CG 3.31Å; A810-R814 WeakPolarHBondContact O-CG 3.21Å; A810-R814 PolarHBondContact O-N 3.5Å; A810-R814 PolarHBondContact O-NE 3.2Å; D811-R814 IonicContact OD1-CZ 3.17Å; D811-R814 IonicContact OD1-NH2 2.71Å; D811-R814 PolarHBondContact OD1-NH2 3.25Å; M812-R814 PolarHBondContact O-N 3.31Å; R814-A818 WeakPolarHBondContact O-CB 3.4Å; R814-A818 PolarHBondContact O-N 2.71Å; R814-H857 PolarHBondContact NH1-O 3.16Å
815	S	74	Confident	79.7	Confident	24 Å²	24	29.5 Å²	29.5	17%	0.168	14%	0.137	C	C	.	.	H	α-helix	trans	-81.9	-39	173.5	77.2	0	0	0	0	113.5	F665 M812 I813 A818 F819	F665-S815 WeakPolarHBondContact CE2-OG 3.29Å; F665-S815 VanDerWaalsContact CZ-OG 3.26Å; F665-S815 WeakPolarHBondContact CZ-OG 3.21Å; M812-S815 PolarHBondContact O-N 3.03Å; M812-S815 VanDerWaalsContact O-N 3.09Å; M812-S815 PolarHBondContact O-OG 3.42Å; I813-S815 PolarHBondContact O-N 3.11Å; S815-A818 PolarHBondContact O-N 3.25Å; S815-F819 WeakPolarHBondContact O-CD2 3.38Å; S815-F819 PolarHBondContact O-N 3.31Å
816	L	78.4	Confident	79.9	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-68.6	-39.4	177.5	-67.3	172.4	0	0	0	111	L602 I606 F657 P661 V662 M812 I813 F819 T820	L602-L816 HydrophobicContact CD2-CD2 3.9Å; I606-L816 HydrophobicContact CD1-CD2 3.87Å; F657-L816 HydrophobicContact CB-CD1 4.27Å; F657-L816 HydrophobicContact CD1-CB 4.01Å; F657-L816 HydrophobicContact CD1-CD1 4.29Å; F657-L816 HydrophobicContact CD2-CD1 3.71Å; F657-L816 HydrophobicContact CE1-CB 3.72Å; F657-L816 HydrophobicContact CE2-CB 4.28Å; F657-L816 HydrophobicContact CE2-CD1 4.01Å; F657-L816 HydrophobicContact CG-CB 4.4Å; F657-L816 HydrophobicContact CG-CD1 3.84Å; F657-L816 HydrophobicContact CZ-CB 3.85Å; F657-L816 HydrophobicContact CZ-CD1 4.41Å; P661-L816 HydrophobicContact CB-CD2 4.4Å; V662-L816 HydrophobicContact CG2-CD1 4.37Å; M812-L816 HydrophobicContact CE-CD1 4.37Å; M812-L816 HydrophobicContact CG-CD1 3.68Å; M812-L816 HydrophobicContact CG-CG 4.26Å; M812-L816 WeakPolarHBondContact O-CG 3.32Å; M812-L816 PolarHBondContact O-N 2.88Å; M812-L816 HydrophobicContact SD-CD1 4.31Å; I813-L816 PolarHBondContact O-N 3Å; L816-F819 PolarHBondContact O-N 2.85Å; L816-T820 WeakPolarHBondContact O-CB 3.43Å; L816-T820 WeakPolarHBondContact O-CG2 3.33Å; L816-T820 PolarHBondContact O-N 2.81Å; L816-T820 PolarHBondContact O-OG1 3.5Å
817	D	77.1	Confident	80	Confident	12 Å²	12	28.4 Å²	28.4	6%	0.064	13%	0.132	C	C	.	.	H	α-helix	trans	-54.9	-50.8	170.4	-77.5	16.1	0	0	0	110.9	I813 F819 T820 R821 S822 T824	I813-D817 VanDerWaalsContact O-CB 3.28Å; I813-D817 WeakPolarHBondContact O-CB 3.46Å; I813-D817 VanDerWaalsContact O-CG 3.26Å; I813-D817 PolarHBondContact O-N 2.94Å; D817-F819 VanDerWaalsContact C-N 3.34Å; D817-F819 PolarHBondContact O-N 3.44Å; D817-T820 CarbonylContact O-C 3.55Å; D817-T820 PolarHBondContact O-N 3.34Å; D817-T820 VanDerWaalsContact O-N 3.17Å; D817-T820 PolarHBondContact O-OG1 3.37Å; D817-R821 WeakPolarHBondContact O-CA 3.24Å; D817-R821 PolarHBondContact O-N 2.92Å; D817-S822 CarbonylContact C-O 3.5Å; D817-S822 WeakPolarHBondContact CA-O 3.36Å; D817-S822 WeakPolarHBondContact CB-O 3.11Å; D817-S822 PolarHBondContact O-N 3.15Å; D817-T824 WeakPolarHBondContact OD1-CB 3.44Å; D817-T824 WeakPolarHBondContact OD1-CG2 3.22Å; D817-T824 PolarHBondContact OD1-N 3.29Å; D817-T824 PolarHBondContact OD1-OG1 3.43Å; D817-T824 PolarHBondContact OD2-N 3.38Å
818	A	71.5	Confident	80.3	Confident	19 Å²	19	26.7 Å²	26.7	16%	0.157	12%	0.123	C	C	.	.	H	α-helix	trans	-63.9	-34.3	176.4	0	0	0	0	0	113.2	P612 N614 R814 S815	P612-A818 HydrophobicContact CG-CB 3.9Å; P612-A818 WeakPolarHBondContact CG-O 3.49Å; N614-A818 WeakPolarHBondContact OD1-CB 3.19Å; R814-A818 WeakPolarHBondContact O-CB 3.4Å; R814-A818 PolarHBondContact O-N 2.71Å; S815-A818 PolarHBondContact O-N 3.25Å
819	F	72.7	Confident	80.5	Confident	36 Å²	36	26.2 Å²	26.2	16%	0.158	12%	0.121	C	C	.	.	H	α-helix	trans	-71.8	-30.8	172.9	-77.7	-58.3	0	0	0	114.1	N605 I606 H610 P612 S815 L816 D817	N605-F819 HydrophobicContact CB-CD1 3.69Å; N605-F819 HydrophobicContact CB-CE1 3.61Å; N605-F819 HydrophobicContact CB-CZ 4.42Å; I606-F819 HydrophobicContact CG1-CD2 4.24Å; I606-F819 HydrophobicContact CG1-CE2 3.9Å; I606-F819 HydrophobicContact CG1-CZ 4.44Å; H610-F819 WeakPolarHBondContact O-CE1 3.01Å; P612-F819 HydrophobicContact CG-CD1 4.31Å; S815-F819 WeakPolarHBondContact O-CD2 3.38Å; S815-F819 PolarHBondContact O-N 3.31Å; L816-F819 PolarHBondContact O-N 2.85Å; D817-F819 VanDerWaalsContact C-N 3.34Å; D817-F819 PolarHBondContact O-N 3.44Å
820	T	72.2	Confident	80.3	Confident	43 Å²	43	26.2 Å²	26.2	26%	0.264	12%	0.121	S	C	.	.	H	α-helix	trans	-100	-10.5	-175.4	54.5	0	0	0	0	114	L602 F657 L816 D817 S822	L602-T820 HydrophobicContact CD1-CG2 3.95Å; L602-T820 HydrophobicContact CG-CG2 4.46Å; F657-T820 HydrophobicContact CD1-CG2 4.32Å; F657-T820 HydrophobicContact CE1-CG2 4.18Å; L816-T820 WeakPolarHBondContact O-CB 3.43Å; L816-T820 WeakPolarHBondContact O-CG2 3.33Å; L816-T820 PolarHBondContact O-N 2.81Å; L816-T820 PolarHBondContact O-OG1 3.5Å; D817-T820 CarbonylContact O-C 3.55Å; D817-T820 PolarHBondContact O-N 3.34Å; D817-T820 VanDerWaalsContact O-N 3.17Å; D817-T820 PolarHBondContact O-OG1 3.37Å; T820-S822 VanDerWaalsContact C-N 3.31Å; T820-S822 PolarHBondContact OG1-OG 3.48Å
821	R	71.8	Confident	80	Confident	189 Å²	189	27.1 Å²	27.1	71%	0.713	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.9	41.4	-170.4	-61.3	-177.3	172.5	-172.9	-6.1	112.8	W514 D817	W514-R821 VanDerWaalsContact CZ2-O 3.32Å; W514-R821 WeakPolarHBondContact CZ2-O 3.22Å; D817-R821 WeakPolarHBondContact O-CA 3.24Å; D817-R821 PolarHBondContact O-N 2.92Å
822	S	75	Confident	79.4	Confident	3 Å²	3	25.7 Å²	25.7	2%	0.021	12%	0.121	C	C	.	.			trans	-122.8	160.2	175	67.1	0	0	0	0	111	M621 D817 T820	M621-S822 WeakPolarHBondContact CE-O 3.08Å; D817-S822 CarbonylContact C-O 3.5Å; D817-S822 WeakPolarHBondContact CA-O 3.36Å; D817-S822 WeakPolarHBondContact CB-O 3.11Å; D817-S822 PolarHBondContact O-N 3.15Å; T820-S822 VanDerWaalsContact C-N 3.31Å; T820-S822 PolarHBondContact OG1-OG 3.48Å
823	H	79.4	Confident	78.8	Confident	45 Å²	45	25.7 Å²	25.7	21%	0.208	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	113	165.3	-71.4	-62.1	0	0	0	108.8	S618 P622 V623 S624	S618-H823 PolarHBondContact O-NE2 2.77Å; P622-H823 PolarHBondContact O-N 2.92Å; P622-H823 VanDerWaalsContact O-N 3.1Å; V623-H823 VanDerWaalsContact CA-O 3.3Å; V623-H823 WeakPolarHBondContact CA-O 3.43Å; V623-H823 HydrophobicContact CG2-CB 4.31Å; S624-H823 PolarHBondContact N-O 3.02Å
824	T	86	Confident	78	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.006	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	125.1	178.6	69.2	0	0	0	0	111.7	S624 F657 I813 D817	S624-T824 WeakPolarHBondContact O-CA 3.4Å; S624-T824 VanDerWaalsContact OG-CG2 3.32Å; S624-T824 WeakPolarHBondContact OG-CG2 3.49Å; F657-T824 HydrophobicContact CE1-CG2 4.48Å; F657-T824 HydrophobicContact CE2-CG2 4.46Å; F657-T824 HydrophobicContact CZ-CG2 3.7Å; I813-T824 VanDerWaalsContact CG2-OG1 3.29Å; I813-T824 WeakPolarHBondContact CG2-OG1 3.33Å; D817-T824 WeakPolarHBondContact OD1-CB 3.44Å; D817-T824 WeakPolarHBondContact OD1-CG2 3.22Å; D817-T824 PolarHBondContact OD1-N 3.29Å; D817-T824 PolarHBondContact OD1-OG1 3.43Å; D817-T824 PolarHBondContact OD2-N 3.38Å
825	R	88.1	Confident	77.6	Confident	9 Å²	9	27.3 Å²	27.3	3%	0.034	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	126.2	-172.3	-60.2	-175	174	175.9	-6.3	110.3	V475 E477 P478 L482 V623 S624 F625 L626 I861	V475-R825 PolarHBondContact O-NH1 3.44Å; E477-R825 VanDerWaalsContact O-CZ 3.26Å; E477-R825 PolarHBondContact O-NH1 2.97Å; E477-R825 PolarHBondContact O-NH2 3.24Å; P478-R825 PolarHBondContact O-NH2 3.32Å; L482-R825 HydrophobicContact CD1-CG 3.86Å; V623-R825 HydrophobicContact CG1-CG 3.95Å; S624-R825 PolarHBondContact O-N 2.9Å; F625-R825 WeakPolarHBondContact CA-O 3.49Å; F625-R825 HydrophobicContact CD1-CB 3.86Å; F625-R825 HydrophobicContact CE1-CB 4.08Å; L626-R825 PolarHBondContact N-O 3.46Å; R825-I861 HydrophobicContact CB-CD1 3.88Å
826	L	90.5	Very high	77.4	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	117.3	179.1	-66.6	-169.4	0	0	0	110.7	L626 L649 L809 I813 P859 F860 I861	L626-L826 HydrophobicContact CB-CD2 3.7Å; L626-L826 HydrophobicContact CD1-CD2 3.97Å; L626-L826 HydrophobicContact CG-CD2 4.35Å; L649-L826 HydrophobicContact CD1-CD1 4.46Å; L649-L826 HydrophobicContact CD2-CB 4.38Å; L649-L826 HydrophobicContact CD2-CD2 4.19Å; L809-L826 HydrophobicContact CD1-CD1 4.42Å; L809-L826 HydrophobicContact CD2-CD1 3.69Å; L809-L826 HydrophobicContact CG-CD1 3.82Å; I813-L826 HydrophobicContact CD1-CD1 3.52Å; I813-L826 HydrophobicContact CD1-CD2 3.45Å; I813-L826 VanDerWaalsContact CD1-CD2 3.45Å; I813-L826 HydrophobicContact CD1-CG 3.59Å; L826-P859 PolarHBondContact N-O 3.45Å; L826-F860 HydrophobicContact CB-CD1 3.57Å; L826-F860 HydrophobicContact CB-CE1 3.64Å; L826-F860 HydrophobicContact CD1-CD1 4.09Å; L826-F860 HydrophobicContact CD1-CE1 3.32Å; L826-F860 HydrophobicContact CD1-CZ 3.62Å; L826-F860 HydrophobicContact CG-CD1 4.45Å; L826-F860 HydrophobicContact CG-CE1 4.13Å; L826-F860 WeakPolarHBondContact O-CA 3.37Å; L826-I861 PolarHBondContact O-N 2.58Å
827	V	89.2	Confident	77.1	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	112.6	-176.6	-168.3	0	0	0	0	110.3	M507 F625 L626 F627 A628 V829 I861 I863	M507-V827 HydrophobicContact CE-CG1 4.32Å; M507-V827 HydrophobicContact CE-CG2 3.69Å; F625-V827 HydrophobicContact CB-CG2 4.1Å; F625-V827 HydrophobicContact CD1-CG2 3.75Å; F625-V827 HydrophobicContact CG-CG2 4.3Å; L626-V827 PolarHBondContact O-N 3.24Å; F627-V827 WeakPolarHBondContact CA-O 3.41Å; F627-V827 HydrophobicContact CD1-CB 3.65Å; F627-V827 HydrophobicContact CD1-CG1 3.75Å; F627-V827 HydrophobicContact CD1-CG2 4.31Å; F627-V827 HydrophobicContact CE1-CB 3.78Å; F627-V827 HydrophobicContact CE1-CG1 3.61Å; F627-V827 HydrophobicContact CE1-CG2 4.06Å; F627-V827 HydrophobicContact CG-CB 4.21Å; F627-V827 HydrophobicContact CZ-CB 4.42Å; F627-V827 HydrophobicContact CZ-CG2 4.23Å; A628-V827 PolarHBondContact N-O 3.42Å; V827-V829 HydrophobicContact CG1-CG2 4.19Å; V827-I861 WeakPolarHBondContact CA-O 3.41Å; V827-I861 HydrophobicContact CG2-CD1 4.26Å; V827-I863 HydrophobicContact CG1-CD1 3.7Å; V827-I863 HydrophobicContact CG1-CG1 4.27Å
828	V	88.2	Confident	76.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	106.4	174.8	-179.9	0	0	0	0	108.4	I645 L649 V830 F852 F860 I861 T862 I863	I645-V828 HydrophobicContact CD1-CG1 4.4Å; I645-V828 HydrophobicContact CG2-CG1 3.92Å; I645-V828 HydrophobicContact CG2-CG2 4.12Å; L649-V828 HydrophobicContact CD1-CG2 4.11Å; V828-V830 HydrophobicContact CG1-CG2 4.04Å; V828-F852 HydrophobicContact CG1-CD2 4.4Å; V828-F852 HydrophobicContact CG1-CE2 4Å; V828-F852 HydrophobicContact CG1-CZ 4.47Å; V828-F852 HydrophobicContact CG2-CD1 4.29Å; V828-F852 HydrophobicContact CG2-CD2 4.35Å; V828-F852 HydrophobicContact CG2-CE1 4.08Å; V828-F852 HydrophobicContact CG2-CE2 4.13Å; V828-F852 HydrophobicContact CG2-CG 4.43Å; V828-F852 HydrophobicContact CG2-CZ 4Å; V828-F860 HydrophobicContact CG2-CD1 4.27Å; V828-I861 PolarHBondContact N-O 3.44Å; V828-T862 HydrophobicContact CB-CG2 4.43Å; V828-T862 HydrophobicContact CG1-CG2 4.44Å; V828-T862 CarbonylContact O-C 3.55Å; V828-T862 WeakPolarHBondContact O-CA 3.42Å; V828-I863 PolarHBondContact O-N 3.12Å
829	V	85.3	Confident	76.8	Confident	16 Å²	16	39.2 Å²	39.2	10%	0.097	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.7	175.1	-180	0	0	0	0	109.3	L500 F627 H631 V827 I863	L500-V829 HydrophobicContact CB-CG1 4.47Å; L500-V829 HydrophobicContact CD1-CG1 3.69Å; L500-V829 HydrophobicContact CD2-CG1 3.75Å; L500-V829 HydrophobicContact CG-CG1 4.18Å; F627-V829 HydrophobicContact CD1-CG2 4.34Å; H631-V829 VanDerWaalsContact CA-O 3.29Å; H631-V829 WeakPolarHBondContact CA-O 3.39Å; H631-V829 HydrophobicContact CB-CB 4.33Å; H631-V829 HydrophobicContact CB-CG1 4.23Å; H631-V829 WeakPolarHBondContact CB-O 3.49Å; V827-V829 HydrophobicContact CG1-CG2 4.19Å; V829-I863 HydrophobicContact CG2-CD1 4.47Å
830	V	80.9	Confident	76.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	111.1	-179.7	-175.5	0	0	0	0	109.1	L633 V828 L833 L848 T862 I863 A865	L633-V830 HydrophobicContact CD1-CG1 3.54Å; L633-V830 HydrophobicContact CG-CG1 4.07Å; V828-V830 HydrophobicContact CG1-CG2 4.04Å; V830-L833 HydrophobicContact CG1-CD1 3.63Å; V830-L833 HydrophobicContact CG1-CG 3.9Å; V830-L848 HydrophobicContact CG1-CD1 4.21Å; V830-L848 HydrophobicContact CG2-CD1 4.06Å; V830-L848 HydrophobicContact CG2-CD2 4.01Å; V830-T862 HydrophobicContact CG2-CG2 4.24Å; V830-I863 PolarHBondContact N-O 2.97Å; V830-A865 PolarHBondContact O-N 3.27Å
831	D	77.8	Confident	77.2	Confident	22 Å²	22	40.8 Å²	40.8	12%	0.118	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	155.5	178.7	-173.5	17.4	0	0	0	109.9	L500 H631 L633 L833	L500-D831 HydrophobicContact CD1-CB 3.79Å; H631-D831 PolarHBondContact O-N 3.22Å; L633-D831 PolarHBondContact N-O 2.98Å; D831-L833 PolarHBondContact O-N 3.17Å
832	G	66.8	Low	77.4	Confident	12 Å²	12	33 Å²	33	12%	0.124	16%	0.162	C	C	.	.			trans	76.2	13.6	175.7	0	0	0	0	0	115.9	D834 N835	G832-D834 PolarHBondContact O-N 2.73Å; G832-D834 VanDerWaalsContact O-N 3.16Å; G832-N835 WeakPolarHBondContact O-CB 3.37Å; G832-N835 PolarHBondContact O-N 3.08Å
833	L	68.7	Low	77.6	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-54.9	-27	167.1	-84.7	166.1	0	0	0	112.1	L633 V830 D831 N835 C836 M841 L845 I864 V866	L633-L833 HydrophobicContact CB-CD2 4.45Å; L633-L833 HydrophobicContact CD1-CD2 3.77Å; L633-L833 HydrophobicContact CD1-CG 4.12Å; V830-L833 HydrophobicContact CG1-CD1 3.63Å; V830-L833 HydrophobicContact CG1-CG 3.9Å; D831-L833 PolarHBondContact O-N 3.17Å; L833-N835 PolarHBondContact O-N 3.22Å; L833-C836 WeakPolarHBondContact O-CB 3.3Å; L833-C836 PolarHBondContact O-N 2.82Å; L833-M841 HydrophobicContact CD2-CG 4.28Å; L833-M841 WeakPolarHBondContact O-CE 3.4Å; L833-L845 HydrophobicContact CD1-CD2 4.18Å; L833-I864 HydrophobicContact CD1-CG2 4.16Å; L833-V866 HydrophobicContact CB-CG1 3.92Å; L833-V866 HydrophobicContact CB-CG2 3.79Å; L833-V866 HydrophobicContact CD1-CG2 3.74Å; L833-V866 HydrophobicContact CG-CG2 4.37Å
834	D	66.8	Low	77.6	Confident	31 Å²	31	36.4 Å²	36.4	17%	0.166	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-50.9	-23.7	168.5	-65.3	-13.5	0	0	0	113.3	K496 G832 V866 D867	K496-D834 IonicContact NZ-OD1 2.84Å; K496-D834 PolarHBondContact NZ-OD1 2.83Å; K496-D834 IonicContact NZ-OD2 2.74Å; K496-D834 PolarHBondContact NZ-OD2 3Å; G832-D834 PolarHBondContact O-N 2.73Å; G832-D834 VanDerWaalsContact O-N 3.16Å; D834-V866 WeakPolarHBondContact OD1-CG1 3.47Å; D834-D867 PolarHBondContact OD1-N 2.97Å
835	N	69.2	Low	77.3	Confident	111 Å²	111	36.7 Å²	36.7	59%	0.594	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-100.4	5.2	179.3	-59.9	-41.7	0	0	0	113.7	G832 L833	G832-N835 WeakPolarHBondContact O-CB 3.37Å; G832-N835 PolarHBondContact O-N 3.08Å; L833-N835 PolarHBondContact O-N 3.22Å
836	C	69.9	Low	77	Confident	15 Å²	15	39.6 Å²	39.6	10%	0.101	20%	0.196	C	C	.	.	S	Bend	trans	-80.9	147.8	176.4	-153.6	0	0	0	0	110.6	L833 Q838 M841	L833-C836 WeakPolarHBondContact O-CB 3.3Å; L833-C836 PolarHBondContact O-N 2.82Å; C836-Q838 PolarHBondContact O-N 2.99Å; C836-M841 HydrophobicContact CB-CB 4.37Å; C836-M841 HydrophobicContact CB-CE 4.34Å
837	E	71.8	Confident	76.7	Confident	80 Å²	80	39.6 Å²	39.6	37%	0.374	20%	0.197	S	C	.	.			trans	-62.1	134.6	168.8	-68.9	165	-158.4	0	0	108.9	E839 R840 M841	E837-E839 PolarHBondContact O-N 3.36Å; E837-E839 VanDerWaalsContact O-N 3.16Å; E837-R840 HydrophobicContact CB-CB 4.36Å; E837-R840 HydrophobicContact CB-CG 4.34Å; E837-R840 WeakPolarHBondContact O-CA 3.37Å; E837-R840 PolarHBondContact O-N 2.91Å; E837-R840 IonicContact OE1-CZ 3.4Å; E837-R840 IonicContact OE1-NH1 3.57Å; E837-R840 PolarHBondContact OE1-NH1 3.06Å; E837-R840 IonicContact OE1-NH2 2.76Å; E837-R840 WeakPolarHBondContact OE2-CD 3.19Å; E837-R840 IonicContact OE2-CZ 3.16Å; E837-R840 IonicContact OE2-NE 2.72Å; E837-R840 PolarHBondContact OE2-NE 2.9Å; E837-R840 IonicContact OE2-NH1 3.51Å; E837-R840 PolarHBondContact OE2-NH1 3.39Å; E837-R840 IonicContact OE2-NH2 2.71Å; E837-R840 PolarHBondContact OE2-NH2 3.17Å; E837-M841 PolarHBondContact O-N 3.25Å
838	Q	72.7	Confident	76.6	Confident	78 Å²	78	39.9 Å²	39.9	36%	0.364	20%	0.198	S	C	.	.	H	α-helix	trans	-55.5	-39.5	-171.8	-68.4	-176.1	-22.6	0	0	112.6	C836 R840 M841 A874 N878	C836-Q838 PolarHBondContact O-N 2.99Å; Q838-R840 PolarHBondContact O-N 3.5Å; Q838-M841 WeakPolarHBondContact O-CB 3.3Å; Q838-M841 PolarHBondContact O-N 2.94Å; Q838-A874 HydrophobicContact CB-CB 3.82Å; Q838-A874 HydrophobicContact CG-CB 3.88Å; Q838-N878 PolarHBondContact O-ND2 2.85Å
839	E	70.2	Confident	76.4	Confident	133 Å²	133	43.5 Å²	43.5	62%	0.621	22%	0.215	S	C	*	.	H	α-helix	trans	-60.9	-39.8	174.6	-62	-179.3	179.2	0	0	113.2	E837	E837-E839 PolarHBondContact O-N 3.36Å; E837-E839 VanDerWaalsContact O-N 3.16Å
840	R	74.6	Confident	76.4	Confident	108 Å²	108	46.1 Å²	46.1	41%	0.408	23%	0.228	S	C	.	.	H	α-helix	trans	-81.6	-19.8	179.9	-65	-172.6	-178.4	135.4	22.7	113	S635 E837 Q838 V842 Q843 T844	S635-R840 PolarHBondContact O-NH1 3.39Å; E837-R840 HydrophobicContact CB-CB 4.36Å; E837-R840 HydrophobicContact CB-CG 4.34Å; E837-R840 WeakPolarHBondContact O-CA 3.37Å; E837-R840 PolarHBondContact O-N 2.91Å; E837-R840 IonicContact OE1-CZ 3.4Å; E837-R840 IonicContact OE1-NH1 3.57Å; E837-R840 PolarHBondContact OE1-NH1 3.06Å; E837-R840 IonicContact OE1-NH2 2.76Å; E837-R840 WeakPolarHBondContact OE2-CD 3.19Å; E837-R840 IonicContact OE2-CZ 3.16Å; E837-R840 IonicContact OE2-NE 2.72Å; E837-R840 PolarHBondContact OE2-NE 2.9Å; E837-R840 IonicContact OE2-NH1 3.51Å; E837-R840 PolarHBondContact OE2-NH1 3.39Å; E837-R840 IonicContact OE2-NH2 2.71Å; E837-R840 PolarHBondContact OE2-NH2 3.17Å; Q838-R840 PolarHBondContact O-N 3.5Å; R840-V842 PolarHBondContact O-N 2.62Å; R840-Q843 PolarHBondContact O-N 2.83Å; R840-T844 PolarHBondContact O-N 2.84Å; R840-T844 PolarHBondContact O-OG1 3.31Å
841	M	77.7	Confident	76.6	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.015	23%	0.228	C	C	.	.	H	α-helix	trans	-61.7	-44.8	-178.7	-165.2	-179.8	-55.4	0	0	111.6	L833 C836 E837 Q838 T844 L845 V870 I871 A874	L833-M841 HydrophobicContact CD2-CG 4.28Å; L833-M841 WeakPolarHBondContact O-CE 3.4Å; C836-M841 HydrophobicContact CB-CB 4.37Å; C836-M841 HydrophobicContact CB-CE 4.34Å; E837-M841 PolarHBondContact O-N 3.25Å; Q838-M841 WeakPolarHBondContact O-CB 3.3Å; Q838-M841 PolarHBondContact O-N 2.94Å; M841-T844 PolarHBondContact O-N 2.76Å; M841-T844 PolarHBondContact O-OG1 3.1Å; M841-L845 WeakPolarHBondContact O-CG 3.46Å; M841-L845 PolarHBondContact O-N 2.68Å; M841-V870 HydrophobicContact CE-CG1 3.92Å; M841-V870 HydrophobicContact SD-CG1 4.49Å; M841-I871 HydrophobicContact SD-CG1 4.23Å; M841-A874 HydrophobicContact CB-CB 4.44Å; M841-A874 HydrophobicContact CE-CB 4.06Å; M841-A874 HydrophobicContact SD-CB 3.8Å
842	V	77.1	Confident	77	Confident	26 Å²	26	45.1 Å²	45.1	16%	0.158	22%	0.223	C	C	.	.	H	α-helix	trans	-63	-50.1	175.7	175.2	0	0	0	0	110.6	R840 T844 L845 D846 I875 N878	R840-V842 PolarHBondContact O-N 2.62Å; V842-T844 PolarHBondContact O-N 2.83Å; V842-T844 VanDerWaalsContact O-N 3.15Å; V842-L845 WeakPolarHBondContact O-CA 3.3Å; V842-L845 WeakPolarHBondContact O-CB 3.28Å; V842-L845 PolarHBondContact O-N 2.89Å; V842-D846 PolarHBondContact O-N 2.99Å; V842-I875 HydrophobicContact CG2-CG1 4.07Å; V842-N878 HydrophobicContact CG2-CB 4.35Å; V842-N878 VanDerWaalsContact CG2-ND2 3.28Å; V842-N878 WeakPolarHBondContact CG2-ND2 3.5Å
843	Q	78.1	Confident	77.7	Confident	109 Å²	109	45.9 Å²	45.9	51%	0.509	23%	0.226	S	C	.	.	H	α-helix	trans	-57.8	-32.9	178.7	-62.3	177.9	-1.3	0	0	113.5	R840 A847	R840-Q843 PolarHBondContact O-N 2.83Å; Q843-A847 WeakPolarHBondContact O-CB 3.29Å; Q843-A847 PolarHBondContact O-N 3.38Å; Q843-A847 VanDerWaalsContact O-N 3.14Å
844	T	80	Confident	78.1	Confident	11 Å²	11	48.5 Å²	48.5	7%	0.067	25%	0.248	C	C	.	.	H	α-helix	trans	-79.9	-28.7	176.1	50.2	0	0	0	0	113.2	R840 M841 V842 L848	R840-T844 PolarHBondContact O-N 2.84Å; R840-T844 PolarHBondContact O-OG1 3.31Å; M841-T844 PolarHBondContact O-N 2.76Å; M841-T844 PolarHBondContact O-OG1 3.1Å; V842-T844 PolarHBondContact O-N 2.83Å; V842-T844 VanDerWaalsContact O-N 3.15Å; T844-L848 VanDerWaalsContact O-CG 3.25Å; T844-L848 WeakPolarHBondContact O-CG 3.24Å; T844-L848 PolarHBondContact O-N 2.98Å; T844-L848 VanDerWaalsContact O-N 3.07Å
845	L	81	Confident	78.4	Confident	7 Å²	7	51.8 Å²	51.8	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-69	-47.1	169.3	-71.4	169.1	0	0	0	111.2	L833 M841 V842 A847 L848 E849 I864 I871 Y893 I897	L833-L845 HydrophobicContact CD1-CD2 4.18Å; M841-L845 WeakPolarHBondContact O-CG 3.46Å; M841-L845 PolarHBondContact O-N 2.68Å; V842-L845 WeakPolarHBondContact O-CA 3.3Å; V842-L845 WeakPolarHBondContact O-CB 3.28Å; V842-L845 PolarHBondContact O-N 2.89Å; L845-A847 PolarHBondContact O-N 2.95Å; L845-L848 HydrophobicContact CD2-CD1 4.48Å; L845-L848 WeakPolarHBondContact O-CB 3.27Å; L845-L848 PolarHBondContact O-N 2.96Å; L845-L848 VanDerWaalsContact O-N 3.11Å; L845-E849 PolarHBondContact O-N 3.42Å; L845-I864 HydrophobicContact CD2-CD1 4.34Å; L845-I871 HydrophobicContact CD1-CG2 4.38Å; L845-Y893 HydrophobicContact CD1-CE1 4.28Å; L845-I897 HydrophobicContact CB-CD1 4.18Å
846	D	81.5	Confident	78.3	Confident	69 Å²	69	55.1 Å²	55.1	37%	0.369	27%	0.267	S	S	.	.	H	α-helix	trans	-56.3	-39.2	173.8	-59.6	-33.6	0	0	0	111.3	V842 E849 L850 Y893	V842-D846 PolarHBondContact O-N 2.99Å; D846-E849 PolarHBondContact O-N 3.05Å; D846-L850 VanDerWaalsContact O-CB 3.3Å; D846-L850 WeakPolarHBondContact O-CB 3.5Å; D846-L850 PolarHBondContact O-N 3.15Å; D846-Y893 PolarHBondContact OD1-OH 2.89Å
847	A	83.9	Confident	78.2	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-66.4	-42.5	176.4	0	0	0	0	0	113.1	L642 F795 M799 Q843 L845 E849 L851	L642-A847 HydrophobicContact CD1-CB 3.54Å; F795-A847 HydrophobicContact CE2-CB 4.48Å; F795-A847 HydrophobicContact CZ-CB 3.93Å; M799-A847 HydrophobicContact SD-CB 4.09Å; Q843-A847 WeakPolarHBondContact O-CB 3.29Å; Q843-A847 PolarHBondContact O-N 3.38Å; Q843-A847 VanDerWaalsContact O-N 3.14Å; L845-A847 PolarHBondContact O-N 2.95Å; A847-E849 VanDerWaalsContact C-N 3.31Å; A847-L851 VanDerWaalsContact O-CB 3.3Å; A847-L851 WeakPolarHBondContact O-CB 3.42Å; A847-L851 VanDerWaalsContact O-CG 3.26Å; A847-L851 WeakPolarHBondContact O-CG 3.35Å; A847-L851 PolarHBondContact O-N 3.36Å
848	L	85.8	Confident	78.6	Confident	6 Å²	6	57.8 Å²	57.8	3%	0.031	28%	0.277	C	S	.	.	H	α-helix	trans	-62.6	-40.9	175.5	-73.9	166.5	0	0	0	110.6	L633 L642 V830 T844 L845 F852	L633-L848 HydrophobicContact CD1-CD1 4.3Å; L642-L848 HydrophobicContact CD2-CD2 3.65Å; L642-L848 HydrophobicContact CD2-CG 4.17Å; V830-L848 HydrophobicContact CG1-CD1 4.21Å; V830-L848 HydrophobicContact CG2-CD1 4.06Å; V830-L848 HydrophobicContact CG2-CD2 4.01Å; T844-L848 VanDerWaalsContact O-CG 3.25Å; T844-L848 WeakPolarHBondContact O-CG 3.24Å; T844-L848 PolarHBondContact O-N 2.98Å; T844-L848 VanDerWaalsContact O-N 3.07Å; L845-L848 HydrophobicContact CD2-CD1 4.48Å; L845-L848 WeakPolarHBondContact O-CB 3.27Å; L845-L848 PolarHBondContact O-N 2.96Å; L845-L848 VanDerWaalsContact O-N 3.11Å; L848-F852 HydrophobicContact CD2-CD2 3.91Å; L848-F852 HydrophobicContact CD2-CE2 3.8Å; L848-F852 WeakPolarHBondContact O-CB 3.47Å; L848-F852 PolarHBondContact O-N 3.37Å
849	E	85.2	Confident	79.3	Confident	75 Å²	75	54.7 Å²	54.7	35%	0.35	26%	0.264	S	S	.	.	I	π-helix	trans	-63.5	-54.4	176.4	-158.3	-169.3	144.1	0	0	111.2	L845 D846 A847 L851 F852 S853 A854	L845-E849 PolarHBondContact O-N 3.42Å; D846-E849 PolarHBondContact O-N 3.05Å; A847-E849 VanDerWaalsContact C-N 3.31Å; E849-L851 VanDerWaalsContact C-N 3.29Å; E849-L851 PolarHBondContact O-N 3.16Å; E849-F852 PolarHBondContact O-N 3.19Å; E849-S853 WeakPolarHBondContact CA-OG 3.33Å; E849-S853 WeakPolarHBondContact CG-OG 3.37Å; E849-S853 PolarHBondContact O-N 2.86Å; E849-S853 PolarHBondContact O-OG 3.09Å; E849-A854 WeakPolarHBondContact O-CB 3.21Å; E849-A854 PolarHBondContact O-N 2.8Å
850	L	85.5	Confident	80.2	Confident	72 Å²	72	48.3 Å²	48.3	38%	0.377	23%	0.234	S	C	.	.	I	π-helix	trans	-57.8	-38.2	-179.2	-177.7	64.8	0	0	0	113.4	M799 D846 R858	M799-L850 HydrophobicContact CB-CD2 4.14Å; D846-L850 VanDerWaalsContact O-CB 3.3Å; D846-L850 WeakPolarHBondContact O-CB 3.5Å; D846-L850 PolarHBondContact O-N 3.15Å; L850-R858 PolarHBondContact O-NH1 3.2Å
851	L	84.8	Confident	80.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.215	C	C	.	.	I	π-helix	trans	-80.5	-41.5	179.9	-69	176.7	0	0	0	112.8	L642 M799 L802 Q803 V806 A847 E849 R858	L642-L851 HydrophobicContact CB-CD1 4.3Å; L642-L851 HydrophobicContact CD1-CD1 4.35Å; L642-L851 HydrophobicContact CD2-CD1 4.33Å; M799-L851 HydrophobicContact SD-CD1 3.87Å; M799-L851 HydrophobicContact SD-CD2 4.35Å; M799-L851 HydrophobicContact SD-CG 4.13Å; L802-L851 HydrophobicContact CB-CD1 4.46Å; L802-L851 HydrophobicContact CB-CD2 3.74Å; L802-L851 HydrophobicContact CD1-CD1 4.42Å; Q803-L851 HydrophobicContact CB-CD2 4.27Å; V806-L851 WeakPolarHBondContact CG1-O 3.15Å; A847-L851 VanDerWaalsContact O-CB 3.3Å; A847-L851 WeakPolarHBondContact O-CB 3.42Å; A847-L851 VanDerWaalsContact O-CG 3.26Å; A847-L851 WeakPolarHBondContact O-CG 3.35Å; A847-L851 PolarHBondContact O-N 3.36Å; E849-L851 VanDerWaalsContact C-N 3.29Å; E849-L851 PolarHBondContact O-N 3.16Å; L851-R858 PolarHBondContact O-NH1 2.88Å
852	F	86.4	Confident	81.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.215	C	C	.	.	I	π-helix	trans	-110.7	-42.1	-167.9	-57.7	-54.7	0	0	0	114.9	I645 V646 V806 V828 L848 E849 F860	I645-F852 HydrophobicContact CG2-CE2 4.44Å; I645-F852 HydrophobicContact CG2-CZ 3.88Å; V646-F852 HydrophobicContact CG2-CZ 4.41Å; V806-F852 HydrophobicContact CG2-CE1 4.36Å; V828-F852 HydrophobicContact CG1-CD2 4.4Å; V828-F852 HydrophobicContact CG1-CE2 4Å; V828-F852 HydrophobicContact CG1-CZ 4.47Å; V828-F852 HydrophobicContact CG2-CD1 4.29Å; V828-F852 HydrophobicContact CG2-CD2 4.35Å; V828-F852 HydrophobicContact CG2-CE1 4.08Å; V828-F852 HydrophobicContact CG2-CE2 4.13Å; V828-F852 HydrophobicContact CG2-CG 4.43Å; V828-F852 HydrophobicContact CG2-CZ 4Å; L848-F852 HydrophobicContact CD2-CD2 3.91Å; L848-F852 HydrophobicContact CD2-CE2 3.8Å; L848-F852 WeakPolarHBondContact O-CB 3.47Å; L848-F852 PolarHBondContact O-N 3.37Å; E849-F852 PolarHBondContact O-N 3.19Å; F852-F860 HydrophobicContact CB-CB 4.22Å; F852-F860 HydrophobicContact CB-CD1 4.49Å; F852-F860 HydrophobicContact CB-CD2 4.3Å; F852-F860 HydrophobicContact CB-CG 4.09Å; F852-F860 AromaticContact CD1-CD1 3.62Å; F852-F860 HydrophobicContact CD1-CD1 3.62Å; F852-F860 HydrophobicContact CD1-CD2 4.02Å; F852-F860 AromaticContact CD1-CE1 3.51Å; F852-F860 HydrophobicContact CD1-CE1 3.51Å; F852-F860 AromaticContact CD1-CE2 3.96Å; F852-F860 HydrophobicContact CD1-CE2 3.96Å; F852-F860 AromaticContact CD1-CG 3.91Å; F852-F860 HydrophobicContact CD1-CG 3.91Å; F852-F860 AromaticContact CD1-CZ 3.73Å; F852-F860 HydrophobicContact CD1-CZ 3.73Å; F852-F860 HydrophobicContact CE1-CD1 4.26Å; F852-F860 AromaticContact CE1-CE1 3.78Å; F852-F860 HydrophobicContact CE1-CE1 3.78Å; F852-F860 HydrophobicContact CE1-CZ 4.05Å; F852-F860 HydrophobicContact CG-CD1 4.34Å; F852-F860 HydrophobicContact CG-CG 4.4Å; F852-F860 WeakPolarHBondContact O-CD2 3.4Å
853	S	81	Confident	82	Confident	29 Å²	29	42.1 Å²	42.1	20%	0.203	21%	0.208	C	C	.	.	I	π-helix	trans	-102.6	-25.7	-174.8	56	0	0	0	0	115.8	P483 E849 R855	P483-S853 VanDerWaalsContact CG-O 3.27Å; P483-S853 WeakPolarHBondContact CG-O 3.34Å; E849-S853 WeakPolarHBondContact CA-OG 3.33Å; E849-S853 WeakPolarHBondContact CG-OG 3.37Å; E849-S853 PolarHBondContact O-N 2.86Å; E849-S853 PolarHBondContact O-OG 3.09Å; S853-R855 PolarHBondContact O-N 3.13Å
854	A	76.2	Confident	82.3	Confident	54 Å²	54	37 Å²	37	45%	0.446	19%	0.185	S	C	.	.	S	Bend	trans	-64.1	-3.8	-170.1	0	0	0	0	0	116.6	E849	E849-A854 WeakPolarHBondContact O-CB 3.21Å; E849-A854 PolarHBondContact O-N 2.8Å
855	R	74.7	Confident	82.3	Confident	101 Å²	101	36.6 Å²	36.6	38%	0.381	18%	0.182	S	C	.	.	S	Bend	trans	-126.9	125.4	170.7	-61	-165.2	-167.8	161.7	14.1	111.3	Q803 D807 S853 R858	Q803-R855 VanDerWaalsContact OE1-NH2 3.14Å; D807-R855 IonicContact OD1-CZ 2.7Å; D807-R855 IonicContact OD1-NH1 3.61Å; D807-R855 PolarHBondContact OD1-NH1 3.46Å; D807-R855 IonicContact OD2-CZ 4Å; D807-R855 IonicContact OD2-NH1 3.77Å; D807-R855 PolarHBondContact OD2-NH1 2.74Å; D807-R855 IonicContact OD2-NH2 3.39Å; D807-R855 PolarHBondContact OD2-NH2 2.94Å; S853-R855 PolarHBondContact O-N 3.13Å; R855-R858 HydrophobicContact CB-CG 4.26Å
856	K	66.2	Low	82.1	Confident	181 Å²	181	36.2 Å²	36.2	79%	0.787	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	149.2	173.7	-60.1	-177.5	178.9	-177.1	0	111	R858	K856-R858 VanDerWaalsContact C-N 3.32Å; K856-R858 PolarHBondContact O-N 2.93Å
857	H	68.7	Low	81.7	Confident	142 Å²	142	33.7 Å²	33.7	66%	0.657	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.9	23.1	179.4	-39.3	-83.4	0	0	0	115.8	L482 R814	L482-H857 PolarHBondContact O-N 3.27Å; R814-H857 PolarHBondContact NH1-O 3.16Å
858	R	80.4	Confident	81.3	Confident	8 Å²	8	34.4 Å²	34.4	3%	0.03	17%	0.171	C	C	.	.			trans	-88.6	137.9	162.7	-71	179.8	168	161.2	-3.9	110.1	L482 D807 A810 L850 L851 R855 K856 F860	L482-R858 CarbonylContact C-O 3.58Å; L482-R858 WeakPolarHBondContact CB-O 3.23Å; D807-R858 IonicContact OD1-CZ 2.65Å; D807-R858 IonicContact OD1-NE 3.38Å; D807-R858 PolarHBondContact OD1-NE 2.86Å; D807-R858 IonicContact OD1-NH2 3.62Å; D807-R858 PolarHBondContact OD1-NH2 2.92Å; A810-R858 HydrophobicContact CB-CG 4.38Å; L850-R858 PolarHBondContact O-NH1 3.2Å; L851-R858 PolarHBondContact O-NH1 2.88Å; R855-R858 HydrophobicContact CB-CG 4.26Å; K856-R858 VanDerWaalsContact C-N 3.32Å; K856-R858 PolarHBondContact O-N 2.93Å; R858-F860 HydrophobicContact CB-CD2 3.75Å; R858-F860 HydrophobicContact CB-CE2 4.22Å; R858-F860 HydrophobicContact CG-CD2 4.48Å; R858-F860 PolarHBondContact O-N 3.07Å
859	P	85.9	Confident	80.8	Confident	13 Å²	13	40.9 Å²	40.9	8%	0.084	20%	0.201	C	C	.	.			trans	-83	45.3	-174.1	36	-37.7	0	0	0	113.5	L482 I813 L826	L482-P859 HydrophobicContact CD1-CB 4.45Å; I813-P859 HydrophobicContact CG2-CG 3.99Å; L826-P859 PolarHBondContact N-O 3.45Å
860	F	90.5	Very high	80.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	139.3	-176.9	-74	-69.4	0	0	0	113.7	P483 L484 L649 V806 L809 L826 V828 F852 R858	P483-F860 VanDerWaalsContact CA-O 3.28Å; P483-F860 WeakPolarHBondContact CA-O 3.35Å; P483-F860 HydrophobicContact CB-CB 4.29Å; L484-F860 PolarHBondContact N-O 3.1Å; L649-F860 HydrophobicContact CD1-CE1 4.1Å; V806-F860 HydrophobicContact CG1-CE2 3.59Å; V806-F860 HydrophobicContact CG1-CZ 3.68Å; L809-F860 HydrophobicContact CD2-CZ 4.49Å; L826-F860 HydrophobicContact CB-CD1 3.57Å; L826-F860 HydrophobicContact CB-CE1 3.64Å; L826-F860 HydrophobicContact CD1-CD1 4.09Å; L826-F860 HydrophobicContact CD1-CE1 3.32Å; L826-F860 HydrophobicContact CD1-CZ 3.62Å; L826-F860 HydrophobicContact CG-CD1 4.45Å; L826-F860 HydrophobicContact CG-CE1 4.13Å; L826-F860 WeakPolarHBondContact O-CA 3.37Å; V828-F860 HydrophobicContact CG2-CD1 4.27Å; F852-F860 HydrophobicContact CB-CB 4.22Å; F852-F860 HydrophobicContact CB-CD1 4.49Å; F852-F860 HydrophobicContact CB-CD2 4.3Å; F852-F860 HydrophobicContact CB-CG 4.09Å; F852-F860 AromaticContact CD1-CD1 3.62Å; F852-F860 HydrophobicContact CD1-CD1 3.62Å; F852-F860 HydrophobicContact CD1-CD2 4.02Å; F852-F860 AromaticContact CD1-CE1 3.51Å; F852-F860 HydrophobicContact CD1-CE1 3.51Å; F852-F860 AromaticContact CD1-CE2 3.96Å; F852-F860 HydrophobicContact CD1-CE2 3.96Å; F852-F860 AromaticContact CD1-CG 3.91Å; F852-F860 HydrophobicContact CD1-CG 3.91Å; F852-F860 AromaticContact CD1-CZ 3.73Å; F852-F860 HydrophobicContact CD1-CZ 3.73Å; F852-F860 HydrophobicContact CE1-CD1 4.26Å; F852-F860 AromaticContact CE1-CE1 3.78Å; F852-F860 HydrophobicContact CE1-CE1 3.78Å; F852-F860 HydrophobicContact CE1-CZ 4.05Å; F852-F860 HydrophobicContact CG-CD1 4.34Å; F852-F860 HydrophobicContact CG-CG 4.4Å; F852-F860 WeakPolarHBondContact O-CD2 3.4Å; R858-F860 HydrophobicContact CB-CD2 3.75Å; R858-F860 HydrophobicContact CB-CE2 4.22Å; R858-F860 HydrophobicContact CG-CD2 4.48Å; R858-F860 PolarHBondContact O-N 3.07Å
861	I	89.5	Confident	79.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	119	162.7	-59.3	154.5	0	0	0	107	V475 L482 L484 I486 F625 R825 L826 V827 V828 I863	V475-I861 HydrophobicContact CG1-CD1 3.52Å; V475-I861 HydrophobicContact CG1-CG1 4.49Å; L482-I861 HydrophobicContact CD2-CG1 3.85Å; L484-I861 HydrophobicContact CB-CG1 4.47Å; L484-I861 HydrophobicContact CD2-CG2 4.48Å; L484-I861 CarbonylContact O-C 3.45Å; L484-I861 WeakPolarHBondContact O-CA 3.46Å; I486-I861 HydrophobicContact CD1-CG2 3.85Å; I486-I861 HydrophobicContact CG1-CG2 4.42Å; F625-I861 HydrophobicContact CD1-CD1 4.39Å; F625-I861 HydrophobicContact CE1-CD1 4.05Å; R825-I861 HydrophobicContact CB-CD1 3.88Å; L826-I861 PolarHBondContact O-N 2.58Å; V827-I861 WeakPolarHBondContact CA-O 3.41Å; V827-I861 HydrophobicContact CG2-CD1 4.26Å; V828-I861 PolarHBondContact N-O 3.44Å; I861-I863 HydrophobicContact CG2-CG1 4.06Å
862	T	88.7	Confident	79.6	Confident	4 Å²	4	36.7 Å²	36.7	3%	0.025	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	122.9	175.8	-50	0	0	0	0	109.3	L484 T485 I486 V828 V830 I864	L484-T862 PolarHBondContact O-N 2.95Å; T485-T862 WeakPolarHBondContact CA-O 3.41Å; I486-T862 PolarHBondContact N-O 3.34Å; V828-T862 HydrophobicContact CB-CG2 4.43Å; V828-T862 HydrophobicContact CG1-CG2 4.44Å; V828-T862 CarbonylContact O-C 3.55Å; V828-T862 WeakPolarHBondContact O-CA 3.42Å; V830-T862 HydrophobicContact CG2-CG2 4.24Å; T862-I864 HydrophobicContact CG2-CD1 4.39Å; T862-I864 HydrophobicContact CG2-CG1 4.11Å
863	I	87.3	Confident	79.1	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	114.8	-178	-56.4	179.8	0	0	0	108.4	I486 L488 L500 L503 V827 V828 V829 V830 I861	I486-I863 HydrophobicContact CB-CG1 4.42Å; I486-I863 HydrophobicContact CD1-CG1 4.33Å; I486-I863 WeakPolarHBondContact O-CA 3.49Å; L488-I863 HydrophobicContact CD1-CG2 3.43Å; L488-I863 VanDerWaalsContact CD1-CG2 3.43Å; L488-I863 HydrophobicContact CG-CG2 4.09Å; L500-I863 HydrophobicContact CD2-CG2 3.89Å; L503-I863 HydrophobicContact CD2-CD1 3.99Å; V827-I863 HydrophobicContact CG1-CD1 3.7Å; V827-I863 HydrophobicContact CG1-CG1 4.27Å; V828-I863 PolarHBondContact O-N 3.12Å; V829-I863 HydrophobicContact CG2-CD1 4.47Å; V830-I863 PolarHBondContact N-O 2.97Å; I861-I863 HydrophobicContact CG2-CG1 4.06Å
864	I	84.8	Confident	78.8	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.015	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	107	-172.2	-65.9	174.3	0	0	0	108.6	I486 G487 L488 L833 L845 T862 V866 I898	I486-I864 PolarHBondContact O-N 2.9Å; G487-I864 CarbonylContact C-O 3.38Å; L488-I864 PolarHBondContact N-O 3.48Å; L833-I864 HydrophobicContact CD1-CG2 4.16Å; L845-I864 HydrophobicContact CD2-CD1 4.34Å; T862-I864 HydrophobicContact CG2-CD1 4.39Å; T862-I864 HydrophobicContact CG2-CG1 4.11Å; I864-V866 HydrophobicContact CG2-CG2 3.48Å; I864-V866 VanDerWaalsContact CG2-CG2 3.48Å; I864-I898 HydrophobicContact CB-CD1 4.42Å; I864-I898 HydrophobicContact CD1-CD1 4.17Å; I864-I898 HydrophobicContact CD1-CG1 4.28Å; I864-I898 HydrophobicContact CG2-CD1 4.24Å
865	A	81.2	Confident	78.7	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.008	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	97	-175.4	0	0	0	0	0	112.4	L488 L500 V830	L488-A865 HydrophobicContact CB-CB 4.18Å; L488-A865 WeakPolarHBondContact O-CA 3.48Å; L500-A865 HydrophobicContact CD1-CB 3.79Å; L500-A865 HydrophobicContact CD2-CB 4.23Å; L500-A865 HydrophobicContact CG-CB 4.23Å; V830-A865 PolarHBondContact O-N 3.27Å
866	V	75.6	Confident	78.8	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	160.7	-163.3	-159.8	0	0	0	0	110.7	L488 Y489 A490 L833 D834 I864 I871	L488-V866 PolarHBondContact O-N 3.33Å; Y489-V866 WeakPolarHBondContact CA-O 3.38Å; A490-V866 PolarHBondContact N-O 3.25Å; L833-V866 HydrophobicContact CB-CG1 3.92Å; L833-V866 HydrophobicContact CB-CG2 3.79Å; L833-V866 HydrophobicContact CD1-CG2 3.74Å; L833-V866 HydrophobicContact CG-CG2 4.37Å; D834-V866 WeakPolarHBondContact OD1-CG1 3.47Å; I864-V866 HydrophobicContact CG2-CG2 3.48Å; I864-V866 VanDerWaalsContact CG2-CG2 3.48Å; V866-I871 HydrophobicContact CB-CD1 3.58Å; V866-I871 HydrophobicContact CB-CG1 4.18Å; V866-I871 HydrophobicContact CG1-CD1 3.61Å; V866-I871 HydrophobicContact CG1-CG1 3.61Å; V866-I871 HydrophobicContact CG2-CD1 4.01Å
867	D	74.6	Confident	79.2	Confident	16 Å²	16	30.9 Å²	30.9	9%	0.086	16%	0.159	C	C	.	.			trans	-80.4	120.9	168.7	-166.1	-44.4	0	0	0	109.5	A490 K491 W492 D834 H869 V870 I871	A490-D867 WeakPolarHBondContact O-CA 3.46Å; K491-D867 VanDerWaalsContact CA-OD2 3.32Å; K491-D867 WeakPolarHBondContact CA-OD2 3.28Å; W492-D867 PolarHBondContact N-OD2 3.09Å; D834-D867 PolarHBondContact OD1-N 2.97Å; D867-H869 PolarHBondContact O-N 3.3Å; D867-H869 IonicContact OD1-CD2 3.95Å; D867-H869 IonicContact OD1-CG 3.92Å; D867-H869 PolarHBondContact OD1-N 2.77Å; D867-H869 VanDerWaalsContact OD1-N 3.15Å; D867-V870 HydrophobicContact CB-CB 4.15Å; D867-V870 HydrophobicContact CB-CG2 3.81Å; D867-V870 WeakPolarHBondContact O-CB 3.38Å; D867-V870 PolarHBondContact O-N 2.79Å; D867-I871 PolarHBondContact O-N 2.97Å
868	P	74.8	Confident	79.2	Confident	15 Å²	15	25.4 Å²	25.4	10%	0.097	14%	0.135	C	C	.	.	H	α-helix	trans	-62.9	-30.8	-175	25.8	-34.6	0	0	0	112.1	Y489 V870 I871 V872 Y903	Y489-P868 HydrophobicContact CD1-CB 3.75Å; Y489-P868 HydrophobicContact CD1-CG 4.21Å; Y489-P868 HydrophobicContact CE1-CB 4.23Å; Y489-P868 HydrophobicContact CG-CB 4.01Å; Y489-P868 HydrophobicContact CG-CG 4.14Å; P868-V870 VanDerWaalsContact C-N 3.31Å; P868-V870 PolarHBondContact O-N 3.29Å; P868-I871 PolarHBondContact O-N 3.21Å; P868-V872 WeakPolarHBondContact O-CB 3.44Å; P868-V872 VanDerWaalsContact O-CG2 3.28Å; P868-V872 WeakPolarHBondContact O-CG2 3.36Å; P868-V872 PolarHBondContact O-N 3.31Å; P868-Y903 HydrophobicContact CB-CE1 4.43Å; P868-Y903 HydrophobicContact CG-CE1 4.1Å
869	H	75.8	Confident	78.4	Confident	142 Å²	142	26.5 Å²	26.5	66%	0.657	14%	0.141	S	C	*	.	H	α-helix	trans	-70.2	-29.4	176.7	-62.8	-75.2	0	0	0	112.2	D867 S873	D867-H869 PolarHBondContact O-N 3.3Å; D867-H869 IonicContact OD1-CD2 3.95Å; D867-H869 IonicContact OD1-CG 3.92Å; D867-H869 PolarHBondContact OD1-N 2.77Å; D867-H869 VanDerWaalsContact OD1-N 3.15Å; H869-S873 WeakPolarHBondContact O-CB 3.42Å; H869-S873 PolarHBondContact O-N 2.83Å
870	V	75.5	Confident	77.1	Confident	45 Å²	45	33.9 Å²	33.9	27%	0.273	17%	0.174	S	C	.	.	H	α-helix	trans	-70	-44.8	175.4	173.6	0	0	0	0	110.2	M841 D867 P868 A874	M841-V870 HydrophobicContact CE-CG1 3.92Å; M841-V870 HydrophobicContact SD-CG1 4.49Å; D867-V870 HydrophobicContact CB-CB 4.15Å; D867-V870 HydrophobicContact CB-CG2 3.81Å; D867-V870 WeakPolarHBondContact O-CB 3.38Å; D867-V870 PolarHBondContact O-N 2.79Å; P868-V870 VanDerWaalsContact C-N 3.31Å; P868-V870 PolarHBondContact O-N 3.29Å; V870-A874 WeakPolarHBondContact O-CB 3.37Å; V870-A874 PolarHBondContact O-N 3.34Å
871	I	75.7	Confident	75.6	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-61	-53.2	174.5	-66.9	166.7	0	0	0	110.7	Y489 M841 L845 V866 D867 P868 S873 A874 I875 L894	Y489-I871 HydrophobicContact CE1-CD1 4.49Å; M841-I871 HydrophobicContact SD-CG1 4.23Å; L845-I871 HydrophobicContact CD1-CG2 4.38Å; V866-I871 HydrophobicContact CB-CD1 3.58Å; V866-I871 HydrophobicContact CB-CG1 4.18Å; V866-I871 HydrophobicContact CG1-CD1 3.61Å; V866-I871 HydrophobicContact CG1-CG1 3.61Å; V866-I871 HydrophobicContact CG2-CD1 4.01Å; D867-I871 PolarHBondContact O-N 2.97Å; P868-I871 PolarHBondContact O-N 3.21Å; I871-S873 VanDerWaalsContact C-N 3.32Å; I871-S873 PolarHBondContact O-N 3.24Å; I871-A874 PolarHBondContact O-N 3.06Å; I871-I875 HydrophobicContact CG2-CD1 3.37Å; I871-I875 HydrophobicContact CG2-CG1 4.16Å; I871-I875 WeakPolarHBondContact O-CD1 3.26Å; I871-I875 VanDerWaalsContact O-CG1 3.28Å; I871-I875 WeakPolarHBondContact O-CG1 3.39Å; I871-I875 PolarHBondContact O-N 2.91Å; I871-L894 HydrophobicContact CB-CD1 4.31Å; I871-L894 HydrophobicContact CD1-CD1 4.46Å; I871-L894 HydrophobicContact CG2-CD1 3.9Å
872	V	77.6	Confident	73.9	Confident	11 Å²	11	42.8 Å²	42.8	7%	0.067	24%	0.241	C	C	.	.	H	α-helix	trans	-62.5	-38.5	-177.8	172.2	0	0	0	0	111.7	P868 N876 L894	P868-V872 WeakPolarHBondContact O-CB 3.44Å; P868-V872 VanDerWaalsContact O-CG2 3.28Å; P868-V872 WeakPolarHBondContact O-CG2 3.36Å; P868-V872 PolarHBondContact O-N 3.31Å; V872-N876 VanDerWaalsContact O-CB 3.29Å; V872-N876 WeakPolarHBondContact O-CB 3.28Å; V872-N876 PolarHBondContact O-N 2.97Å; V872-N876 PolarHBondContact O-ND2 3.19Å; V872-N876 PolarHBondContact O-OD1 3.39Å; V872-L894 HydrophobicContact CG2-CD1 4.31Å
873	S	77.3	Confident	72.2	Confident	62 Å²	62	46.6 Å²	46.6	43%	0.434	26%	0.261	S	S	.	.	H	α-helix	trans	-64.8	-43.9	174.9	-173.9	0	0	0	0	112.2	H869 I871 N876 H877	H869-S873 WeakPolarHBondContact O-CB 3.42Å; H869-S873 PolarHBondContact O-N 2.83Å; I871-S873 VanDerWaalsContact C-N 3.32Å; I871-S873 PolarHBondContact O-N 3.24Å; S873-N876 PolarHBondContact O-N 2.95Å; S873-H877 WeakPolarHBondContact O-CB 3.4Å; S873-H877 PolarHBondContact O-N 2.95Å
874	A	74.7	Confident	70.4	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-64.7	-43.1	176.6	0	0	0	0	0	112.3	Q838 M841 V870 I871 N878	Q838-A874 HydrophobicContact CB-CB 3.82Å; Q838-A874 HydrophobicContact CG-CB 3.88Å; M841-A874 HydrophobicContact CB-CB 4.44Å; M841-A874 HydrophobicContact CE-CB 4.06Å; M841-A874 HydrophobicContact SD-CB 3.8Å; V870-A874 WeakPolarHBondContact O-CB 3.37Å; V870-A874 PolarHBondContact O-N 3.34Å; I871-A874 PolarHBondContact O-N 3.06Å; A874-N878 PolarHBondContact O-N 2.87Å; A874-N878 VanDerWaalsContact O-N 3.11Å; A874-N878 PolarHBondContact O-ND2 2.96Å
875	I	73.7	Confident	69.1	Low	3 Å²	3	55.9 Å²	55.9	2%	0.015	34%	0.338	C	S	.	.	H	α-helix	trans	-63.4	-51.1	175.7	-62.1	157.3	0	0	0	110.1	V842 I871 H877 N878 M879 G890 Y893	V842-I875 HydrophobicContact CG2-CG1 4.07Å; I871-I875 HydrophobicContact CG2-CD1 3.37Å; I871-I875 HydrophobicContact CG2-CG1 4.16Å; I871-I875 WeakPolarHBondContact O-CD1 3.26Å; I871-I875 VanDerWaalsContact O-CG1 3.28Å; I871-I875 WeakPolarHBondContact O-CG1 3.39Å; I871-I875 PolarHBondContact O-N 2.91Å; I875-H877 VanDerWaalsContact C-N 3.28Å; I875-H877 PolarHBondContact O-N 2.78Å; I875-N878 PolarHBondContact O-N 3.06Å; I875-N878 VanDerWaalsContact O-N 3.08Å; I875-M879 HydrophobicContact CG2-CG 3.52Å; I875-M879 HydrophobicContact CG2-SD 4.48Å; I875-M879 VanDerWaalsContact O-CB 3.3Å; I875-M879 WeakPolarHBondContact O-CB 3.25Å; I875-M879 WeakPolarHBondContact O-CG 3.14Å; I875-M879 PolarHBondContact O-N 3.35Å; I875-G890 WeakPolarHBondContact CD1-O 3.45Å; I875-Y893 HydrophobicContact CD1-CD1 3.36Å; I875-Y893 HydrophobicContact CD1-CE1 3.94Å; I875-Y893 HydrophobicContact CD1-CG 4.2Å; I875-Y893 HydrophobicContact CG1-CD1 3.88Å; I875-Y893 HydrophobicContact CG1-CE1 4.13Å; I875-Y893 HydrophobicContact CG2-CD1 4.37Å; I875-Y893 HydrophobicContact CG2-CG 4.27Å
876	N	76.1	Confident	68	Low	63 Å²	63	59 Å²	59	34%	0.337	36%	0.357	S	S	.	.	H	α-helix	trans	-57.8	-41.5	-179.4	-71.6	-9.3	0	0	0	111.6	V872 S873 N878 H880 G890	V872-N876 VanDerWaalsContact O-CB 3.29Å; V872-N876 WeakPolarHBondContact O-CB 3.28Å; V872-N876 PolarHBondContact O-N 2.97Å; V872-N876 PolarHBondContact O-ND2 3.19Å; V872-N876 PolarHBondContact O-OD1 3.39Å; S873-N876 PolarHBondContact O-N 2.95Å; N876-N878 PolarHBondContact O-N 3.25Å; N876-H880 PolarHBondContact O-CD2 2.96Å; N876-H880 PolarHBondContact O-N 3.06Å; N876-G890 WeakPolarHBondContact OD1-CA 3.43Å; N876-G890 PolarHBondContact OD1-N 3.01Å
877	H	74.1	Confident	67.2	Low	113 Å²	113	68.6 Å²	68.6	52%	0.523	40%	0.402	S	S	.	.	H	α-helix	trans	-60.5	-42.8	175.6	-172	-86.3	0	0	0	112.5	S873 I875	S873-H877 WeakPolarHBondContact O-CB 3.4Å; S873-H877 PolarHBondContact O-N 2.95Å; I875-H877 VanDerWaalsContact C-N 3.28Å; I875-H877 PolarHBondContact O-N 2.78Å
878	N	69.3	Low	66.6	Low	27 Å²	27	71.8 Å²	71.8	14%	0.144	42%	0.419	C	S	.	.	H	α-helix	trans	-78.5	-35.4	-179.5	-62.4	-17.1	0	0	0	113.2	Q838 V842 A874 I875 N876 H880 S881 A882	Q838-N878 PolarHBondContact O-ND2 2.85Å; V842-N878 HydrophobicContact CG2-CB 4.35Å; V842-N878 VanDerWaalsContact CG2-ND2 3.28Å; V842-N878 WeakPolarHBondContact CG2-ND2 3.5Å; A874-N878 PolarHBondContact O-N 2.87Å; A874-N878 VanDerWaalsContact O-N 3.11Å; A874-N878 PolarHBondContact O-ND2 2.96Å; I875-N878 PolarHBondContact O-N 3.06Å; I875-N878 VanDerWaalsContact O-N 3.08Å; N876-N878 PolarHBondContact O-N 3.25Å; N878-H880 VanDerWaalsContact C-N 3.28Å; N878-H880 PolarHBondContact O-N 2.86Å; N878-S881 VanDerWaalsContact O-CB 3.3Å; N878-S881 WeakPolarHBondContact O-CB 3.48Å; N878-S881 PolarHBondContact O-N 2.87Å; N878-A882 PolarHBondContact O-N 2.84Å
879	M	63.6	Low	66.4	Low	32 Å²	32	74.1 Å²	74.1	16%	0.158	43%	0.432	C	S	.	.	H	α-helix	trans	-60.4	-36.4	-178.3	-80.3	-70	-71.2	0	0	112.2	I875 S881 A882 L883 L888	I875-M879 HydrophobicContact CG2-CG 3.52Å; I875-M879 HydrophobicContact CG2-SD 4.48Å; I875-M879 VanDerWaalsContact O-CB 3.3Å; I875-M879 WeakPolarHBondContact O-CB 3.25Å; I875-M879 WeakPolarHBondContact O-CG 3.14Å; I875-M879 PolarHBondContact O-N 3.35Å; M879-S881 PolarHBondContact O-N 3.14Å; M879-S881 VanDerWaalsContact O-N 3.1Å; M879-A882 PolarHBondContact O-N 2.88Å; M879-A882 VanDerWaalsContact O-N 3.11Å; M879-L883 HydrophobicContact CE-CB 3.93Å; M879-L883 HydrophobicContact CE-CD1 3.64Å; M879-L883 HydrophobicContact CE-CG 4.42Å; M879-L883 PolarHBondContact O-N 3.25Å; M879-L883 HydrophobicContact SD-CB 4.45Å; M879-L883 HydrophobicContact SD-CD1 3.89Å; M879-L888 HydrophobicContact CE-CB 3.96Å; M879-L888 WeakPolarHBondContact CE-O 3.49Å
880	H	58.9	Low	66	Low	167 Å²	167	67.3 Å²	67.3	77%	0.773	40%	0.401	S	S	*	.	H	α-helix	trans	-59.6	-17.6	173	-73	-51.8	0	0	0	114.2	N876 N878	N876-H880 PolarHBondContact O-CD2 2.96Å; N876-H880 PolarHBondContact O-N 3.06Å; N878-H880 VanDerWaalsContact C-N 3.28Å; N878-H880 PolarHBondContact O-N 2.86Å
881	S	58.3	Low	65.9	Low	111 Å²	111	69.9 Å²	69.9	78%	0.776	41%	0.41	S	S	*	.	H	α-helix	trans	-94.2	-29.7	175.2	-163.9	0	0	0	0	113.1	N878 M879	N878-S881 VanDerWaalsContact O-CB 3.3Å; N878-S881 WeakPolarHBondContact O-CB 3.48Å; N878-S881 PolarHBondContact O-N 2.87Å; M879-S881 PolarHBondContact O-N 3.14Å; M879-S881 VanDerWaalsContact O-N 3.1Å
882	A	55	Low	65.9	Low	76 Å²	76	72.3 Å²	72.3	63%	0.628	42%	0.423	S	S	*	.	H	α-helix	trans	-103.7	-31.8	-168.6	0	0	0	0	0	115.3	N878 M879	N878-A882 PolarHBondContact O-N 2.84Å; M879-A882 PolarHBondContact O-N 2.88Å; M879-A882 VanDerWaalsContact O-N 3.11Å
883	L	51.9	Low	65.8	Low	84 Å²	84	73.9 Å²	73.9	44%	0.44	43%	0.428	S	S	.	.			trans	-135.4	63.8	-169	-80.4	170.5	0	0	0	112.3	M879 G885	M879-L883 HydrophobicContact CE-CB 3.93Å; M879-L883 HydrophobicContact CE-CD1 3.64Å; M879-L883 HydrophobicContact CE-CG 4.42Å; M879-L883 PolarHBondContact O-N 3.25Å; M879-L883 HydrophobicContact SD-CB 4.45Å; M879-L883 HydrophobicContact SD-CD1 3.89Å; L883-G885 PolarHBondContact O-N 3.27Å
884	S	50.5	Low	65.8	Low	124 Å²	124	71.6 Å²	71.6	87%	0.867	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	58.1	173.4	46.8	0	0	0	0	113.2
885	G	56.6	Low	65.8	Low	76 Å²	76	78.9 Å²	78.9	78%	0.784	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	175.1	1.4	178.6	0	0	0	0	0	117.4	L883	L883-G885 PolarHBondContact O-N 3.27Å
886	T	58.2	Low	66	Low	68 Å²	68	84.8 Å²	84.8	42%	0.417	47%	0.474	S	S	.	.			trans	-126.2	134.7	176.8	52.7	0	0	0	0	111.6	L888	T886-L888 PolarHBondContact O-N 3.43Å
887	E	59.3	Low	66.1	Low	201 Å²	201	82.5 Å²	82.5	94%	0.939	46%	0.461	S	S	*	.			trans	-78.2	27.3	-177.8	-57.7	-174.1	147.6	0	0	113.3	T889	E887-T889 PolarHBondContact O-N 2.94Å
888	L	62.3	Low	66.4	Low	83 Å²	83	77.7 Å²	77.7	44%	0.435	44%	0.439	S	S	.	.			trans	-73.6	110.9	177.7	-80.4	160.6	0	0	0	109.7	M879 T886 D892	M879-L888 HydrophobicContact CE-CB 3.96Å; M879-L888 WeakPolarHBondContact CE-O 3.49Å; T886-L888 PolarHBondContact O-N 3.43Å; L888-D892 HydrophobicContact CD2-CB 3.87Å
889	T	69.2	Low	66.7	Low	63 Å²	63	79.4 Å²	79.4	39%	0.387	45%	0.454	S	S	.	.			trans	-78.9	162.3	176.6	75.7	0	0	0	0	111	E887 H891 D892 Y893	E887-T889 PolarHBondContact O-N 2.94Å; T889-H891 PolarHBondContact O-N 2.94Å; T889-H891 VanDerWaalsContact O-N 3.09Å; T889-H891 PolarHBondContact OG1-N 3.07Å; T889-D892 WeakPolarHBondContact CB-OD2 3.37Å; T889-D892 PolarHBondContact N-OD2 3.02Å; T889-D892 PolarHBondContact O-N 2.91Å; T889-D892 PolarHBondContact OG1-N 3.16Å; T889-D892 PolarHBondContact OG1-OD2 3.38Å; T889-Y893 PolarHBondContact O-N 3.11Å
890	G	69.2	Low	67.3	Low	0 Å²	0	81.2 Å²	81.2	0%	0	46%	0.463	C	S	.	.	H	α-helix	trans	-58.7	-19.1	171	0	0	0	0	0	114.4	I875 N876 L894	I875-G890 WeakPolarHBondContact CD1-O 3.45Å; N876-G890 WeakPolarHBondContact OD1-CA 3.43Å; N876-G890 PolarHBondContact OD1-N 3.01Å; G890-L894 VanDerWaalsContact O-CB 3.3Å; G890-L894 WeakPolarHBondContact O-CB 3.5Å; G890-L894 PolarHBondContact O-N 3.15Å
891	H	72.2	Confident	68.1	Low	98 Å²	98	76.6 Å²	76.6	45%	0.454	45%	0.448	S	S	.	.	H	α-helix	trans	-74.3	-36.4	170.7	-71.4	-82.8	0	0	0	112.3	T889 L894 K895	T889-H891 PolarHBondContact O-N 2.94Å; T889-H891 VanDerWaalsContact O-N 3.09Å; T889-H891 PolarHBondContact OG1-N 3.07Å; H891-L894 PolarHBondContact O-N 3.34Å; H891-K895 VanDerWaalsContact O-CB 3.24Å; H891-K895 WeakPolarHBondContact O-CB 3.11Å; H891-K895 PolarHBondContact O-N 2.94Å
892	D	75.8	Confident	68.6	Low	55 Å²	55	73.8 Å²	73.8	29%	0.294	42%	0.422	S	S	.	.	H	α-helix	trans	-72	-40.8	-178.8	-57.5	-64.1	0	0	0	111.8	L888 T889 K895 N896	L888-D892 HydrophobicContact CD2-CB 3.87Å; T889-D892 WeakPolarHBondContact CB-OD2 3.37Å; T889-D892 PolarHBondContact N-OD2 3.02Å; T889-D892 PolarHBondContact O-N 2.91Å; T889-D892 PolarHBondContact OG1-N 3.16Å; T889-D892 PolarHBondContact OG1-OD2 3.38Å; D892-K895 PolarHBondContact O-N 3.16Å; D892-N896 PolarHBondContact O-N 3.32Å; D892-N896 PolarHBondContact O-ND2 3.38Å
893	Y	75.5	Confident	69.2	Low	44 Å²	44	77 Å²	77	17%	0.173	42%	0.419	C	S	.	.	H	α-helix	trans	-57.8	-49.4	170.3	175.6	-85	0	0	0	111.1	L845 D846 I875 T889 K895 N896 I897	L845-Y893 HydrophobicContact CD1-CE1 4.28Å; D846-Y893 PolarHBondContact OD1-OH 2.89Å; I875-Y893 HydrophobicContact CD1-CD1 3.36Å; I875-Y893 HydrophobicContact CD1-CE1 3.94Å; I875-Y893 HydrophobicContact CD1-CG 4.2Å; I875-Y893 HydrophobicContact CG1-CD1 3.88Å; I875-Y893 HydrophobicContact CG1-CE1 4.13Å; I875-Y893 HydrophobicContact CG2-CD1 4.37Å; I875-Y893 HydrophobicContact CG2-CG 4.27Å; T889-Y893 PolarHBondContact O-N 3.11Å; Y893-K895 VanDerWaalsContact C-N 3.31Å; Y893-K895 PolarHBondContact O-N 3.46Å; Y893-N896 PolarHBondContact O-N 2.87Å; Y893-N896 VanDerWaalsContact O-N 3.17Å; Y893-I897 HydrophobicContact CD1-CD1 4Å; Y893-I897 HydrophobicContact CE1-CD1 3.35Å; Y893-I897 HydrophobicContact CE1-CG1 4.45Å; Y893-I897 HydrophobicContact CE2-CD1 4.29Å; Y893-I897 PolarHBondContact O-N 3.16Å
894	L	77.2	Confident	69.6	Low	15 Å²	15	74.2 Å²	74.2	8%	0.079	40%	0.404	C	S	.	.	H	α-helix	trans	-61.7	-36.8	177.8	168.5	155.8	0	0	0	112.5	Y489 I871 V872 G890 H891 N896 I897 I898	Y489-L894 HydrophobicContact CE1-CD1 4.08Å; Y489-L894 WeakPolarHBondContact OH-CD2 3.43Å; Y489-L894 WeakPolarHBondContact OH-CG 3.39Å; I871-L894 HydrophobicContact CB-CD1 4.31Å; I871-L894 HydrophobicContact CD1-CD1 4.46Å; I871-L894 HydrophobicContact CG2-CD1 3.9Å; V872-L894 HydrophobicContact CG2-CD1 4.31Å; G890-L894 VanDerWaalsContact O-CB 3.3Å; G890-L894 WeakPolarHBondContact O-CB 3.5Å; G890-L894 PolarHBondContact O-N 3.15Å; H891-L894 PolarHBondContact O-N 3.34Å; L894-N896 VanDerWaalsContact C-N 3.35Å; L894-I897 PolarHBondContact O-N 3.1Å; L894-I898 PolarHBondContact O-N 3.47Å
895	K	74.5	Confident	69.8	Low	153 Å²	153	73.7 Å²	73.7	67%	0.665	39%	0.387	S	S	*	.	H	α-helix	trans	-67.5	-30.6	176.2	-179.1	-178.1	177.1	-175.3	0	113	H891 D892 Y893	H891-K895 VanDerWaalsContact O-CB 3.24Å; H891-K895 WeakPolarHBondContact O-CB 3.11Å; H891-K895 PolarHBondContact O-N 2.94Å; D892-K895 PolarHBondContact O-N 3.16Å; Y893-K895 VanDerWaalsContact C-N 3.31Å; Y893-K895 PolarHBondContact O-N 3.46Å
896	N	77.4	Confident	69.5	Low	128 Å²	128	71.8 Å²	71.8	68%	0.684	36%	0.359	S	S	*	.	H	α-helix	trans	-73.9	-36.1	174.8	-68.6	-24.2	0	0	0	112.2	D892 Y893 L894	D892-N896 PolarHBondContact O-N 3.32Å; D892-N896 PolarHBondContact O-ND2 3.38Å; Y893-N896 PolarHBondContact O-N 2.87Å; Y893-N896 VanDerWaalsContact O-N 3.17Å; L894-N896 VanDerWaalsContact C-N 3.35Å
897	I	78.7	Confident	69.2	Low	14 Å²	14	71.1 Å²	71.1	7%	0.072	36%	0.357	C	S	.	.	H	α-helix	trans	-78	-39.9	-179.5	-62.5	-176.2	0	0	0	112.2	T485 L845 Y893 L894	T485-I897 VanDerWaalsContact CB-O 3.26Å; T485-I897 WeakPolarHBondContact CB-O 3.48Å; T485-I897 PolarHBondContact OG1-O 3.34Å; L845-I897 HydrophobicContact CB-CD1 4.18Å; Y893-I897 HydrophobicContact CD1-CD1 4Å; Y893-I897 HydrophobicContact CE1-CD1 3.35Å; Y893-I897 HydrophobicContact CE1-CG1 4.45Å; Y893-I897 HydrophobicContact CE2-CD1 4.29Å; Y893-I897 PolarHBondContact O-N 3.16Å; L894-I897 PolarHBondContact O-N 3.1Å
898	I	80.6	Confident	68.6	Low	12 Å²	12	64.3 Å²	64.3	6%	0.062	34%	0.335	C	S	.	.			trans	-106.2	104.5	-167	-69.8	173.4	0	0	0	111.9	Y489 I864 L894 P901	Y489-I898 HydrophobicContact CE1-CD1 4.27Å; Y489-I898 WeakPolarHBondContact OH-CD1 3.42Å; I864-I898 HydrophobicContact CB-CD1 4.42Å; I864-I898 HydrophobicContact CD1-CD1 4.17Å; I864-I898 HydrophobicContact CD1-CG1 4.28Å; I864-I898 HydrophobicContact CG2-CD1 4.24Å; L894-I898 PolarHBondContact O-N 3.47Å; I898-P901 HydrophobicContact CG2-CB 4.41Å
899	S	76.8	Confident	67.7	Low	64 Å²	64	62.1 Å²	62.1	45%	0.448	32%	0.324	S	S	.	.	S	Bend	trans	-68.4	-31.3	-179.9	62.3	0	0	0	0	114.5	L484 T485	L484-S899 WeakPolarHBondContact CD1-OG 3.46Å; T485-S899 PolarHBondContact N-OG 3.48Å; T485-S899 PolarHBondContact O-N 2.91Å; T485-S899 VanDerWaalsContact O-N 3.1Å; T485-S899 PolarHBondContact O-OG 2.68Å; T485-S899 PolarHBondContact OG1-N 3.25Å; T485-S899 PolarHBondContact OG1-OG 2.66Å
900	M	74.6	Confident	66.7	Low	70 Å²	70	66.5 Å²	66.5	35%	0.345	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	90.9	-176	-72.5	-65.7	-72.1	0	0	110.9	L484 T485 I486 G487 F902	L484-M900 HydrophobicContact CD1-CG 4.03Å; T485-M900 PolarHBondContact O-N 2.95Å; I486-M900 WeakPolarHBondContact CA-O 3.42Å; I486-M900 HydrophobicContact CG1-CB 4.34Å; G487-M900 PolarHBondContact N-O 2.88Å; M900-F902 HydrophobicContact CB-CE2 3.96Å; M900-F902 HydrophobicContact CE-CE2 4.1Å; M900-F902 HydrophobicContact CE-CZ 3.8Å
901	P	75.4	Confident	65.8	Low	70 Å²	70	71.6 Å²	71.6	46%	0.455	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	126.6	178.2	32.4	-33.8	0	0	0	112.4	Y489 I898 Y903	Y489-P901 HydrophobicContact CD2-CB 4.29Å; Y489-P901 HydrophobicContact CE2-CB 3.61Å; I898-P901 HydrophobicContact CG2-CB 4.41Å; P901-Y903 HydrophobicContact CB-CE2 4.39Å
902	F	70.2	Confident	64.3	Low	52 Å²	52	71.1 Å²	71.1	23%	0.228	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	122.5	176.3	-69.4	-84.6	0	0	0	110.7	L471 I486 G487 L488 Y489 M900	L471-F902 HydrophobicContact CD1-CD2 4.3Å; L471-F902 HydrophobicContact CD1-CE1 4.43Å; L471-F902 HydrophobicContact CD1-CE2 3.54Å; L471-F902 HydrophobicContact CD1-CZ 3.62Å; I486-F902 HydrophobicContact CG2-CD2 3.78Å; I486-F902 HydrophobicContact CG2-CE2 3.94Å; G487-F902 PolarHBondContact O-N 2.76Å; L488-F902 HydrophobicContact CD2-CB 4.2Å; Y489-F902 PolarHBondContact N-O 2.68Å; M900-F902 HydrophobicContact CB-CE2 3.96Å; M900-F902 HydrophobicContact CE-CE2 4.1Å; M900-F902 HydrophobicContact CE-CZ 3.8Å
903	Y	66.7	Low	63	Low	144 Å²	144	73.9 Å²	73.9	57%	0.565	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	113.1	178	-66.4	-92	0	0	0	110.8	Y489 P868 P901 H905	Y489-Y903 AromaticContact CD2-CD1 3.91Å; Y489-Y903 HydrophobicContact CD2-CD1 3.91Å; Y489-Y903 HydrophobicContact CD2-CD2 4.2Å; Y489-Y903 AromaticContact CD2-CE1 3.53Å; Y489-Y903 HydrophobicContact CD2-CE1 3.53Å; Y489-Y903 AromaticContact CD2-CE2 3.86Å; Y489-Y903 HydrophobicContact CD2-CE2 3.86Å; Y489-Y903 HydrophobicContact CD2-CG 4.23Å; Y489-Y903 AromaticContact CD2-CZ 3.51Å; Y489-Y903 HydrophobicContact CE2-CE1 4.36Å; Y489-Y903 HydrophobicContact CE2-CE2 4.31Å; Y489-Y903 AromaticContact CE2-CZ 3.97Å; Y489-Y903 HydrophobicContact CG-CD1 4.17Å; Y489-Y903 AromaticContact CG-CE1 3.96Å; Y489-Y903 HydrophobicContact CG-CE1 3.96Å; P868-Y903 HydrophobicContact CB-CE1 4.43Å; P868-Y903 HydrophobicContact CG-CE1 4.1Å; P901-Y903 HydrophobicContact CB-CE2 4.39Å; Y903-H905 PolarHBondContact O-N 3.4Å
904	L	60.7	Low	61.8	Low	24 Å²	24	74.4 Å²	74.4	13%	0.126	38%	0.379	C	S	.	.			trans	-82	105.5	-177.3	-66.6	172.4	0	0	0	110.5	Y464 Y489 A490 L499	Y464-L904 HydrophobicContact CD1-CD2 4.44Å; Y464-L904 HydrophobicContact CE1-CB 4.36Å; Y464-L904 HydrophobicContact CE1-CD2 4.21Å; Y489-L904 PolarHBondContact O-N 2.92Å; A490-L904 HydrophobicContact CB-CB 3.92Å; A490-L904 HydrophobicContact CB-CD1 4.08Å; L499-L904 HydrophobicContact CD1-CD1 3.86Å; L499-L904 HydrophobicContact CD1-CD2 3.69Å; L499-L904 HydrophobicContact CD1-CG 4.46Å; L499-L904 HydrophobicContact CD2-CD1 4.3Å
905	H	54.4	Low	60.5	Low	113 Å²	113	78.9 Å²	78.9	52%	0.523	40%	0.397	S	S	.	.			trans	-67	136.5	-167.5	-133.6	109	0	0	0	113.3	Y903 S907	Y903-H905 PolarHBondContact O-N 3.4Å; H905-S907 PolarHBondContact CD2-OG 3.42Å
906	N	51.7	Low	59.1	Low	37 Å²	37	75.9 Å²	75.9	20%	0.198	39%	0.388	C	S	.	.	S	Bend	trans	-92.5	-4.9	-176	-146.7	-41.3	0	0	0	112.5	L909 R910	N906-L909 PolarHBondContact O-N 2.82Å; N906-R910 WeakPolarHBondContact O-CB 3.44Å; N906-R910 VanDerWaalsContact O-CG 3.23Å; N906-R910 WeakPolarHBondContact O-CG 3.38Å; N906-R910 PolarHBondContact O-N 2.89Å
907	S	50.3	Low	57.7	Low	54 Å²	54	77.3 Å²	77.3	38%	0.378	38%	0.384	S	S	.	.	H	α-helix	trans	-66.3	-55.5	-175	49.4	0	0	0	0	111.9	H905 L909 R910 Q911	H905-S907 PolarHBondContact CD2-OG 3.42Å; S907-L909 VanDerWaalsContact C-N 3.26Å; S907-L909 PolarHBondContact O-N 2.94Å; S907-R910 PolarHBondContact O-N 3.43Å; S907-R910 VanDerWaalsContact O-N 3.11Å; S907-Q911 PolarHBondContact O-N 3.29Å
908	A	47.5	Very low	56.5	Low	57 Å²	57	82.6 Å²	82.6	47%	0.471	41%	0.409	S	S	.	.	H	α-helix	trans	-56.7	-41.3	175	0	0	0	0	0	111.4	L912	A908-L912 WeakPolarHBondContact O-CB 3.3Å; A908-L912 PolarHBondContact O-N 3.46Å
909	L	43.4	Very low	55	Low	37 Å²	37	88.9 Å²	88.9	19%	0.194	44%	0.435	C	S	.	.	H	α-helix	trans	-69.3	-34.6	177.7	-130.4	179.6	0	0	0	112.4	Y464 N906 S907 Q913	Y464-L909 HydrophobicContact CE2-CD1 4.31Å; N906-L909 PolarHBondContact O-N 2.82Å; S907-L909 VanDerWaalsContact C-N 3.26Å; S907-L909 PolarHBondContact O-N 2.94Å; L909-Q913 HydrophobicContact CD2-CG 3.86Å; L909-Q913 WeakPolarHBondContact O-CB 3.32Å; L909-Q913 WeakPolarHBondContact O-CG 3.14Å; L909-Q913 PolarHBondContact O-N 3.07Å
910	R	47.6	Very low	53.5	Low	156 Å²	156	95.1 Å²	95.1	59%	0.589	45%	0.449	S	S	*	.	H	α-helix	trans	-69.5	-44.8	172.9	-75.5	174	-162.5	175.5	8.4	112.5	N906 S907 L912 Q913 S914	N906-R910 WeakPolarHBondContact O-CB 3.44Å; N906-R910 VanDerWaalsContact O-CG 3.23Å; N906-R910 WeakPolarHBondContact O-CG 3.38Å; N906-R910 PolarHBondContact O-N 2.89Å; S907-R910 PolarHBondContact O-N 3.43Å; S907-R910 VanDerWaalsContact O-N 3.11Å; R910-L912 VanDerWaalsContact C-N 3.34Å; R910-Q913 PolarHBondContact O-N 2.95Å; R910-S914 PolarHBondContact O-N 3.44Å; R910-S914 PolarHBondContact O-OG 3.24Å
911	Q	50.3	Low	52.1	Low	106 Å²	106	96.7 Å²	96.7	50%	0.495	46%	0.455	S	S	.	.	H	α-helix	trans	-66.2	-37.6	176.1	-68.7	-170.7	14.3	0	0	111.8	S907 S914 K915	S907-Q911 PolarHBondContact O-N 3.29Å; Q911-S914 PolarHBondContact O-OG 3.5Å; Q911-K915 WeakPolarHBondContact O-CB 3.39Å; Q911-K915 VanDerWaalsContact O-CG 3.3Å; Q911-K915 WeakPolarHBondContact O-CG 3.28Å; Q911-K915 PolarHBondContact O-N 3.34Å; Q911-K915 VanDerWaalsContact O-N 3.12Å
912	L	41.4	Very low	50.8	Low	88 Å²	88	96.6 Å²	96.6	46%	0.461	46%	0.456	S	S	.	.	H	α-helix	trans	-67.7	-41.1	171.6	-168	78.1	0	0	0	110.4	A908 R910 L916	A908-L912 WeakPolarHBondContact O-CB 3.3Å; A908-L912 PolarHBondContact O-N 3.46Å; R910-L912 VanDerWaalsContact C-N 3.34Å; L912-L916 HydrophobicContact CD1-CD1 4.41Å; L912-L916 HydrophobicContact CD1-CG 4.46Å; L912-L916 HydrophobicContact CD2-CD1 3.96Å; L912-L916 HydrophobicContact CG-CD1 3.72Å; L912-L916 HydrophobicContact CG-CG 4.1Å; L912-L916 WeakPolarHBondContact O-CA 3.42Å; L912-L916 WeakPolarHBondContact O-CB 3.17Å; L912-L916 WeakPolarHBondContact O-CG 3.44Å; L912-L916 PolarHBondContact O-N 3.31Å
913	Q	48.9	Very low	49.4	Very low	113 Å²	113	98.6 Å²	98.6	53%	0.528	47%	0.468	S	S	.	.	H	α-helix	trans	-66.8	-36.4	177.1	-83.6	178.7	0.7	0	0	113.1	L909 R910 R917	L909-Q913 HydrophobicContact CD2-CG 3.86Å; L909-Q913 WeakPolarHBondContact O-CB 3.32Å; L909-Q913 WeakPolarHBondContact O-CG 3.14Å; L909-Q913 PolarHBondContact O-N 3.07Å; R910-Q913 PolarHBondContact O-N 2.95Å; Q913-R917 WeakPolarHBondContact O-CA 3.48Å; Q913-R917 WeakPolarHBondContact O-CB 3.44Å; Q913-R917 PolarHBondContact O-N 3.48Å
914	S	50.3	Low	48.4	Very low	56 Å²	56	93.9 Å²	93.9	39%	0.392	46%	0.459	S	S	.	.	H	α-helix	trans	-66.9	-52.4	173.1	56.2	0	0	0	0	110.8	R910 Q911 L916 R917 E918	R910-S914 PolarHBondContact O-N 3.44Å; R910-S914 PolarHBondContact O-OG 3.24Å; Q911-S914 PolarHBondContact O-OG 3.5Å; S914-L916 VanDerWaalsContact C-N 3.32Å; S914-L916 PolarHBondContact O-N 3.22Å; S914-R917 CarbonylContact O-C 3.58Å; S914-R917 WeakPolarHBondContact O-CA 3.3Å; S914-R917 WeakPolarHBondContact O-CB 3.47Å; S914-R917 PolarHBondContact O-N 3.12Å; S914-E918 WeakPolarHBondContact O-CG 3.32Å; S914-E918 PolarHBondContact O-N 3Å
915	K	50.3	Low	47.6	Very low	108 Å²	108	98.9 Å²	98.9	47%	0.47	48%	0.481	S	S	.	.	H	α-helix	trans	-60.8	-36.8	177.4	-68.6	171.3	179.9	172	0	112.8	Q911 K919	Q911-K915 WeakPolarHBondContact O-CB 3.39Å; Q911-K915 VanDerWaalsContact O-CG 3.3Å; Q911-K915 WeakPolarHBondContact O-CG 3.28Å; Q911-K915 PolarHBondContact O-N 3.34Å; Q911-K915 VanDerWaalsContact O-N 3.12Å; K915-K919 WeakPolarHBondContact O-CB 3.42Å; K915-K919 WeakPolarHBondContact O-CG 3.41Å; K915-K919 PolarHBondContact O-N 2.94Å
916	L	45.1	Very low	46.8	Very low	90 Å²	90	100.9 Å²	100.9	47%	0.471	48%	0.484	S	S	.	.	H	α-helix	trans	-76.4	-23.2	173.1	-74.4	178.1	0	0	0	113.1	L912 S914 R920	L912-L916 HydrophobicContact CD1-CD1 4.41Å; L912-L916 HydrophobicContact CD1-CG 4.46Å; L912-L916 HydrophobicContact CD2-CD1 3.96Å; L912-L916 HydrophobicContact CG-CD1 3.72Å; L912-L916 HydrophobicContact CG-CG 4.1Å; L912-L916 WeakPolarHBondContact O-CA 3.42Å; L912-L916 WeakPolarHBondContact O-CB 3.17Å; L912-L916 WeakPolarHBondContact O-CG 3.44Å; L912-L916 PolarHBondContact O-N 3.31Å; S914-L916 VanDerWaalsContact C-N 3.32Å; S914-L916 PolarHBondContact O-N 3.22Å; L916-R920 WeakPolarHBondContact O-CA 3.43Å; L916-R920 WeakPolarHBondContact O-CB 3.3Å; L916-R920 VanDerWaalsContact O-CG 3.32Å; L916-R920 WeakPolarHBondContact O-CG 3.26Å; L916-R920 PolarHBondContact O-N 3.4Å
917	R	46.1	Very low	46.3	Very low	159 Å²	159	104.8 Å²	104.8	60%	0.6	50%	0.499	S	S	*	.	H	α-helix	trans	-76.7	-45.8	173.9	178.9	173.6	-179.2	-179.5	-2.5	110.6	Q913 S914 K919 R920 E921	Q913-R917 WeakPolarHBondContact O-CA 3.48Å; Q913-R917 WeakPolarHBondContact O-CB 3.44Å; Q913-R917 PolarHBondContact O-N 3.48Å; S914-R917 CarbonylContact O-C 3.58Å; S914-R917 WeakPolarHBondContact O-CA 3.3Å; S914-R917 WeakPolarHBondContact O-CB 3.47Å; S914-R917 PolarHBondContact O-N 3.12Å; R917-K919 VanDerWaalsContact C-N 3.34Å; R917-K919 PolarHBondContact O-N 3.5Å; R917-R920 CarbonylContact O-C 3.55Å; R917-R920 WeakPolarHBondContact O-CA 3.48Å; R917-R920 PolarHBondContact O-N 2.85Å; R917-E921 HydrophobicContact CG-CG 4.3Å; R917-E921 WeakPolarHBondContact CG-OE1 3.11Å; R917-E921 IonicContact CZ-OE1 3.41Å; R917-E921 IonicContact NE-OE1 2.69Å; R917-E921 PolarHBondContact NE-OE1 3.27Å; R917-E921 IonicContact NE-OE2 3.97Å; R917-E921 IonicContact NH2-OE1 3.18Å; R917-E921 PolarHBondContact NH2-OE1 2.92Å; R917-E921 WeakPolarHBondContact O-CB 3.3Å; R917-E921 WeakPolarHBondContact O-CG 3.47Å; R917-E921 PolarHBondContact O-N 3.1Å
918	E	54.2	Low	45.8	Very low	125 Å²	125	107.6 Å²	107.6	58%	0.584	51%	0.507	S	S	*	.	H	α-helix	trans	-56.8	-47	170	-68	164.4	170.3	0	0	110.9	S914 R920 E921 S922	S914-E918 WeakPolarHBondContact O-CG 3.32Å; S914-E918 PolarHBondContact O-N 3Å; E918-R920 VanDerWaalsContact C-N 3.34Å; E918-R920 PolarHBondContact O-N 3.45Å; E918-E921 PolarHBondContact O-N 3.48Å; E918-S922 WeakPolarHBondContact O-CB 3.38Å; E918-S922 PolarHBondContact O-N 3.39Å; E918-S922 VanDerWaalsContact O-N 3.1Å; E918-S922 PolarHBondContact O-OG 2.89Å
919	K	48.7	Very low	45.5	Very low	144 Å²	144	113.4 Å²	113.4	63%	0.626	52%	0.517	S	S	*	.	H	α-helix	trans	-67	-27.2	172	-79.4	-169.9	174.1	-176.6	0	113.9	K915 R917 S922 M923	K915-K919 WeakPolarHBondContact O-CB 3.42Å; K915-K919 WeakPolarHBondContact O-CG 3.41Å; K915-K919 PolarHBondContact O-N 2.94Å; R917-K919 VanDerWaalsContact C-N 3.34Å; R917-K919 PolarHBondContact O-N 3.5Å; K919-S922 WeakPolarHBondContact CA-OG 3.45Å; K919-S922 PolarHBondContact O-OG 2.97Å; K919-M923 WeakPolarHBondContact O-CB 3.37Å; K919-M923 PolarHBondContact O-N 2.67Å; K919-M923 VanDerWaalsContact O-N 3.14Å
920	R	45.9	Very low	45.4	Very low	195 Å²	195	117 Å²	117	74%	0.736	53%	0.53	S	S	*	.	H	α-helix	trans	-78.6	-38.1	175	-95.3	-174.1	169.3	-169.8	-1.3	112.4	L916 R917 E918 M923 A924	L916-R920 WeakPolarHBondContact O-CA 3.43Å; L916-R920 WeakPolarHBondContact O-CB 3.3Å; L916-R920 VanDerWaalsContact O-CG 3.32Å; L916-R920 WeakPolarHBondContact O-CG 3.26Å; L916-R920 PolarHBondContact O-N 3.4Å; R917-R920 CarbonylContact O-C 3.55Å; R917-R920 WeakPolarHBondContact O-CA 3.48Å; R917-R920 PolarHBondContact O-N 2.85Å; E918-R920 VanDerWaalsContact C-N 3.34Å; E918-R920 PolarHBondContact O-N 3.45Å; R920-M923 CarbonylContact O-C 3.5Å; R920-A924 WeakPolarHBondContact O-CA 3.47Å; R920-A924 WeakPolarHBondContact O-CB 3.49Å; R920-A924 PolarHBondContact O-N 2.85Å
921	E	44.5	Very low	44.9	Very low	102 Å²	102	116.6 Å²	116.6	48%	0.477	53%	0.533	S	S	.	.	H	α-helix	trans	-72.4	-46.1	-177.7	-72	171.7	173.4	0	0	109.2	R917 E918 M923 A924 E925	R917-E921 HydrophobicContact CG-CG 4.3Å; R917-E921 WeakPolarHBondContact CG-OE1 3.11Å; R917-E921 IonicContact CZ-OE1 3.41Å; R917-E921 IonicContact NE-OE1 2.69Å; R917-E921 PolarHBondContact NE-OE1 3.27Å; R917-E921 IonicContact NE-OE2 3.97Å; R917-E921 IonicContact NH2-OE1 3.18Å; R917-E921 PolarHBondContact NH2-OE1 2.92Å; R917-E921 WeakPolarHBondContact O-CB 3.3Å; R917-E921 WeakPolarHBondContact O-CG 3.47Å; R917-E921 PolarHBondContact O-N 3.1Å; E918-E921 PolarHBondContact O-N 3.48Å; E921-M923 PolarHBondContact O-N 3.11Å; E921-A924 PolarHBondContact O-N 3.44Å; E921-E925 PolarHBondContact O-N 2.93Å; E921-E925 VanDerWaalsContact O-N 3.13Å
922	S	48.9	Very low	44.2	Very low	68 Å²	68	120.5 Å²	120.5	48%	0.476	54%	0.543	S	S	.	.	H	α-helix	trans	-61.7	-42.3	170.5	54.8	0	0	0	0	113.7	E918 K919 A924 W926	E918-S922 WeakPolarHBondContact O-CB 3.38Å; E918-S922 PolarHBondContact O-N 3.39Å; E918-S922 VanDerWaalsContact O-N 3.1Å; E918-S922 PolarHBondContact O-OG 2.89Å; K919-S922 WeakPolarHBondContact CA-OG 3.45Å; K919-S922 PolarHBondContact O-OG 2.97Å; S922-A924 VanDerWaalsContact C-N 3.32Å; S922-A924 PolarHBondContact O-N 3.41Å; S922-W926 PolarHBondContact O-N 3.4Å
923	M	41.4	Very low	44	Very low	95 Å²	95	123.7 Å²	123.7	47%	0.468	56%	0.556	S	S	.	*	H	α-helix	trans	-80.1	-10.5	177.2	-168.6	163.6	29.1	0	0	113.4	K919 R920 E921 K927	K919-M923 WeakPolarHBondContact O-CB 3.37Å; K919-M923 PolarHBondContact O-N 2.67Å; K919-M923 VanDerWaalsContact O-N 3.14Å; R920-M923 CarbonylContact O-C 3.5Å; E921-M923 PolarHBondContact O-N 3.11Å; M923-K927 VanDerWaalsContact O-CB 3.27Å; M923-K927 WeakPolarHBondContact O-CB 3.45Å; M923-K927 WeakPolarHBondContact O-CG 3.39Å; M923-K927 PolarHBondContact O-N 2.86Å
924	A	44.2	Very low	43.4	Very low	45 Å²	45	124.8 Å²	124.8	37%	0.372	57%	0.566	S	S	.	*	H	α-helix	trans	-81.2	-42.8	170.7	0	0	0	0	0	110.9	R920 E921 S922 W926 K927 E928	R920-A924 WeakPolarHBondContact O-CA 3.47Å; R920-A924 WeakPolarHBondContact O-CB 3.49Å; R920-A924 PolarHBondContact O-N 2.85Å; E921-A924 PolarHBondContact O-N 3.44Å; S922-A924 VanDerWaalsContact C-N 3.32Å; S922-A924 PolarHBondContact O-N 3.41Å; A924-W926 PolarHBondContact O-N 3.05Å; A924-K927 PolarHBondContact O-N 3.45Å; A924-E928 WeakPolarHBondContact O-CB 3.49Å; A924-E928 PolarHBondContact O-N 3.26Å
925	E	44.2	Very low	42.7	Very low	128 Å²	128	127.5 Å²	127.5	60%	0.598	58%	0.58	S	S	*	*	H	α-helix	trans	-55	-42.9	168.3	-74.5	-161.2	102.9	0	0	111.2	E921 R929	E921-E925 PolarHBondContact O-N 2.93Å; E921-E925 VanDerWaalsContact O-N 3.13Å; E925-R929 WeakPolarHBondContact O-CG 3.45Å; E925-R929 PolarHBondContact O-N 2.97Å
926	W	38.5	Very low	41.8	Very low	155 Å²	155	131.3 Å²	131.3	59%	0.587	60%	0.597	S	S	*	*	H	α-helix	trans	-66	-45.7	176.3	-166.4	83.7	0	0	0	112.4	S922 A924 R929 F930	S922-W926 PolarHBondContact O-N 3.4Å; A924-W926 PolarHBondContact O-N 3.05Å; W926-R929 PolarHBondContact O-N 3.4Å; W926-F930 HydrophobicContact CD2-CD2 4.35Å; W926-F930 AromaticContact CE2-CE2 3.92Å; W926-F930 HydrophobicContact CH2-CD2 4.43Å; W926-F930 HydrophobicContact CZ2-CD2 4.12Å; W926-F930 AromaticContact CZ2-CE2 3.88Å; W926-F930 HydrophobicContact CZ2-CE2 3.88Å; W926-F930 PolarHBondContact O-N 2.84Å
927	K	40.3	Very low	41.3	Very low	119 Å²	119	138.1 Å²	138.1	52%	0.517	62%	0.618	S	S	.	*	H	α-helix	trans	-70.3	-29.1	178	-84.3	-175.4	171	177.6	0	114.3	M923 A924 R929 F930 K931	M923-K927 VanDerWaalsContact O-CB 3.27Å; M923-K927 WeakPolarHBondContact O-CB 3.45Å; M923-K927 WeakPolarHBondContact O-CG 3.39Å; M923-K927 PolarHBondContact O-N 2.86Å; A924-K927 PolarHBondContact O-N 3.45Å; K927-R929 VanDerWaalsContact C-N 3.33Å; K927-F930 PolarHBondContact O-N 2.97Å; K927-K931 WeakPolarHBondContact O-CB 3.5Å; K927-K931 WeakPolarHBondContact O-CG 3.25Å; K927-K931 PolarHBondContact O-N 2.94Å
928	E	39.7	Very low	40.6	Very low	113 Å²	113	134.6 Å²	134.6	53%	0.528	63%	0.63	S	S	.	*	H	α-helix	trans	-73.1	-24.2	175.1	-81.5	-155.1	-167.9	0	0	113.3	A924 R932	A924-E928 WeakPolarHBondContact O-CB 3.49Å; A924-E928 PolarHBondContact O-N 3.26Å; E928-R932 PolarHBondContact O-NH1 3.43Å; E928-R932 VanDerWaalsContact O-NH1 3.16Å; E928-R932 IonicContact OE2-NH1 3.73Å; E928-R932 IonicContact OE2-NH2 3.13Å
929	R	41	Very low	39.6	Very low	180 Å²	180	134.2 Å²	134.2	68%	0.679	64%	0.642	S	S	*	*	H	α-helix	trans	-70.8	-47.1	170.4	-70.3	178.6	-172.8	172.4	7.7	110.9	E925 W926 K927	E925-R929 WeakPolarHBondContact O-CG 3.45Å; E925-R929 PolarHBondContact O-N 2.97Å; W926-R929 PolarHBondContact O-N 3.4Å; K927-R929 VanDerWaalsContact C-N 3.33Å
930	F	41.2	Very low	38.7	Very low	111 Å²	111	135.2 Å²	135.2	49%	0.487	65%	0.648	S	S	.	*	H	α-helix	trans	-76.8	-36.3	-179.7	-83.7	-82.2	0	0	0	114.7	W926 K927 R932 Q933	W926-F930 HydrophobicContact CD2-CD2 4.35Å; W926-F930 AromaticContact CE2-CE2 3.92Å; W926-F930 HydrophobicContact CH2-CD2 4.43Å; W926-F930 HydrophobicContact CZ2-CD2 4.12Å; W926-F930 AromaticContact CZ2-CE2 3.88Å; W926-F930 HydrophobicContact CZ2-CE2 3.88Å; W926-F930 PolarHBondContact O-N 2.84Å; K927-F930 PolarHBondContact O-N 2.97Å; F930-R932 PolarHBondContact O-N 3.26Å; F930-Q933 PolarHBondContact O-N 3.35Å
931	K	38.6	Very low	38	Very low	149 Å²	149	133.8 Å²	133.8	65%	0.648	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-12.9	-179.2	-92.2	-166.9	162.9	-164.1	0	115.1	K927 Q933	K927-K931 WeakPolarHBondContact O-CB 3.5Å; K927-K931 WeakPolarHBondContact O-CG 3.25Å; K927-K931 PolarHBondContact O-N 2.94Å; K931-Q933 VanDerWaalsContact C-N 3.3Å; K931-Q933 PolarHBondContact O-N 3.17Å
932	R	34.6	Very low	37.3	Very low	188 Å²	188	132.3 Å²	132.3	71%	0.709	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-0.7	-179.5	-74.7	-175.7	173.5	105.6	2.8	114.4	E928 F930	E928-R932 PolarHBondContact O-NH1 3.43Å; E928-R932 VanDerWaalsContact O-NH1 3.16Å; E928-R932 IonicContact OE2-NH1 3.73Å; E928-R932 IonicContact OE2-NH2 3.13Å; F930-R932 PolarHBondContact O-N 3.26Å
933	Q	38.7	Very low	36.4	Very low	154 Å²	154	137.1 Å²	137.1	72%	0.72	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	-31.1	-177.2	-65.8	-176.2	-74.5	0	0	115.3	F930 K931	F930-Q933 PolarHBondContact O-N 3.35Å; K931-Q933 VanDerWaalsContact C-N 3.3Å; K931-Q933 PolarHBondContact O-N 3.17Å
934	D	35.9	Very low	35.9	Very low	137 Å²	137	143.6 Å²	143.6	73%	0.733	69%	0.694	S	S	*	*	S	Bend	trans	-101.3	-6.7	-165.3	-60.5	-36.3	0	0	0	116.5	F936	D934-F936 PolarHBondContact O-N 2.95Å
935	T	34.8	Very low	35.1	Very low	112 Å²	112	149.8 Å²	149.8	69%	0.687	72%	0.716	S	S	*	*			trans	-97.9	50.6	-165.6	65.6	0	0	0	0	115
936	F	32.2	Very low	34.5	Very low	188 Å²	188	148.3 Å²	148.3	83%	0.825	73%	0.725	S	S	*	*	S	Bend	trans	-117.5	-4.7	-175.7	-123.1	-84.3	0	0	0	117.2	D934	D934-F936 PolarHBondContact O-N 2.95Å
937	Y	34.1	Very low	34	Very low	234 Å²	234	149 Å²	149	92%	0.918	74%	0.74	S	S	*	*	S	Bend	trans	-137.4	115.7	171.7	-81.1	-93.8	0	0	0	110
938	G	32	Very low	33.5	Very low	84 Å²	84	146.9 Å²	146.9	87%	0.866	75%	0.752	S	S	*	*			trans	155.9	57.9	-176.7	0	0	0	0	0	115.5
939	S	32.8	Very low	32.8	Very low	118 Å²	118	152.5 Å²	152.5	83%	0.825	77%	0.768	S	S	*	*			trans	-58.8	161.3	177.3	45.6	0	0	0	0	115.4
940	H	29.4	Very low	32.3	Very low	164 Å²	164	150.8 Å²	150.8	76%	0.759	78%	0.778	S	S	*	*			cis	-179.7	107.5	-17.6	170.4	-80.5	0	0	0	108.5
941	L	31.3	Very low	31.6	Very low	166 Å²	166	151.3 Å²	151.3	87%	0.869	80%	0.795	S	S	*	*			trans	-148.6	94.1	167.7	-148.7	74.5	0	0	0	113.5
942	S	30.5	Very low	31	Very low	71 Å²	71	155.1 Å²	155.1	50%	0.497	81%	0.806	S	S	.	*			trans	-24.7	142.4	152.2	47.5	0	0	0	0	115
943	L	28.8	Very low	30.6	Very low	169 Å²	169	155.2 Å²	155.2	89%	0.885	81%	0.811	S	S	*	*			cis	51.5	82	18.2	-128.8	-176.5	0	0	0	113.6
944	R	30.8	Very low	29.9	Very low	231 Å²	231	152.9 Å²	152.9	87%	0.872	81%	0.812	S	S	*	*			trans	-141.4	128.3	172.3	179.3	174.2	166.6	114.1	0.7	110.5
945	E	27.9	Very low	29.4	Very low	175 Å²	175	154.7 Å²	154.7	82%	0.818	81%	0.813	S	S	*	*			trans	-82.1	155.1	177.8	-62.3	152.2	110.9	0	0	112
946	A	31.7	Very low	28.9	Very low	96 Å²	96	156.8 Å²	156.8	79%	0.793	82%	0.816	S	S	*	*			trans	-158.4	92.1	164.3	0	0	0	0	0	111.6
947	D	27.5	Very low	28.5	Very low	170 Å²	170	157.7 Å²	157.7	91%	0.909	82%	0.819	S	S	*	*			trans	19.7	117.5	155.8	-60.9	-53	0	0	0	121.9
948	G	29.6	Very low	28	Very low	74 Å²	74	151.5 Å²	151.5	76%	0.763	81%	0.81	S	S	*	*			trans	-129.6	-17.7	175.1	0	0	0	0	0	118.3
949	R	26.4	Very low	27.7	Very low	232 Å²	232	153.5 Å²	153.5	88%	0.875	81%	0.806	S	S	*	*			trans	67.5	148	179.2	-58.8	178.2	168.9	146.8	-1.7	118.3
950	T	28.9	Very low	27.7	Very low	144 Å²	144	154.5 Å²	154.5	88%	0.883	81%	0.807	S	S	*	*			trans	62.4	138.5	171.6	75.3	0	0	0	0	117.3
951	S	28	Very low	27.6	Very low	121 Å²	121	151.9 Å²	151.9	85%	0.846	80%	0.804	S	S	*	*			cis	-143.4	152.1	-15.8	-166.6	0	0	0	0	111.2
952	R	24.4	Very low	27.2	Very low	229 Å²	229	150.6 Å²	150.6	86%	0.864	80%	0.798	S	S	*	*			trans	-83.1	143.4	-179.8	-68.3	171.7	169.3	153.9	-6.2	112.2
953	K	27.3	Very low	26.9	Very low	191 Å²	191	154.9 Å²	154.9	83%	0.83	81%	0.812	S	S	*	*			trans	163.9	114.5	131.7	-91	158.7	-172	-176.7	0	109.1
954	S	24	Very low	26.8	Very low	105 Å²	105	154 Å²	154	73%	0.734	81%	0.809	S	S	*	*				71	141.9	92.3	80.6	0	0	0	0	113.4
955	F	24.2	Very low	26.4	Very low	174 Å²	174	147.4 Å²	147.4	76%	0.763	80%	0.797	S	S	*	*			cis	-164.3	178.3	15.6	-158.7	-151.6	0	0	0	111.9
956	Q	24.7	Very low	26.2	Very low	157 Å²	157	146 Å²	146	73%	0.734	80%	0.795	S	S	*	*			trans	60.8	125.7	152.7	-91.2	164.8	-28.2	0	0	123.2
957	K	25.3	Very low	25.9	Very low	206 Å²	206	147.2 Å²	147.2	90%	0.896	80%	0.799	S	S	*	*			trans	-63.5	146.5	146.8	-58.4	166.9	173.2	177.1	0	110.2
958	S	23.5	Very low	25.7	Very low	105 Å²	105	145.5 Å²	145.5	73%	0.734	79%	0.794	S	S	*	*			trans	-163	144.6	144.5	55.5	0	0	0	0	114
959	T	25.5	Very low	25.5	Very low	125 Å²	125	148.8 Å²	148.8	77%	0.767	80%	0.799	S	S	*	*			trans	38.3	123.9	152.2	42.9	0	0	0	0	123.1
960	V	31.3	Very low	25.6	Very low	140 Å²	140	141.1 Å²	141.1	85%	0.848	79%	0.792	S	S	*	*			trans	-70.9	141.6	143.5	-177.2	0	0	0	0	108.9
961	P	28	Very low	25.4	Very low	108 Å²	108	145.9 Å²	145.9	70%	0.701	79%	0.794	S	S	*	*				-147.3	147.8	129.7	35.8	-19.8	0	0	0	116.3
962	N	23.8	Very low	25.3	Very low	140 Å²	140	146.8 Å²	146.8	75%	0.749	79%	0.789	S	S	*	*			trans	15.8	122.9	146	-81.3	11.6	0	0	0	122
963	M	23.1	Very low	25.5	Very low	160 Å²	160	144 Å²	144	79%	0.788	79%	0.788	S	S	*	*				45.8	109.1	104.5	173.5	-179.2	150.8	0	0	117.8
964	N	26.1	Very low	25.9	Very low	152 Å²	152	140.6 Å²	140.6	81%	0.813	78%	0.779	S	S	*	*			trans	-158.1	161.1	131.2	-110.9	-21.5	0	0	0	113.4
965	S	23.3	Very low	26.3	Very low	91 Å²	91	143.1 Å²	143.1	64%	0.636	78%	0.784	S	S	*	*			trans	-80.3	171.2	-171.2	52.2	0	0	0	0	115.2
966	N	23.7	Very low	26.6	Very low	145 Å²	145	136.5 Å²	136.5	78%	0.775	77%	0.765	S	S	*	*			trans	78.8	80.8	159.7	-57.8	-17.7	0	0	0	118.9
967	S	25	Very low	27	Very low	123 Å²	123	133 Å²	133	86%	0.86	75%	0.751	S	S	*	*			trans	-121	99.5	136.3	54.8	0	0	0	0	109.9
968	V	24.5	Very low	27.7	Very low	133 Å²	133	129.9 Å²	129.9	81%	0.806	74%	0.743	S	S	*	*			trans	-84	114.5	174.9	174.5	0	0	0	0	109.2
969	V	24.9	Very low	28.5	Very low	144 Å²	144	127.3 Å²	127.3	87%	0.873	73%	0.732	S	S	*	*			trans	176.5	142.4	151.6	141.8	0	0	0	0	107.7
970	G	27.6	Very low	29.2	Very low	70 Å²	70	130.1 Å²	130.1	72%	0.722	74%	0.737	S	S	*	*			trans	96.4	24.3	164.9	0	0	0	0	0	118.9	N972	G970-N972 PolarHBondContact O-N 3.43Å
971	R	24.3	Very low	29.9	Very low	245 Å²	245	128.7 Å²	128.7	93%	0.925	73%	0.725	S	S	*	*			trans	-71	103.8	169.8	-83.2	-178.6	166.6	161.3	-4.4	111.4
972	N	27.5	Very low	30.9	Very low	139 Å²	139	127.7 Å²	127.7	74%	0.743	71%	0.708	S	S	*	*			trans	-137.7	114.2	171.3	-88.5	-23.1	0	0	0	113.2	G970 N974	G970-N972 PolarHBondContact O-N 3.43Å; N972-N974 PolarHBondContact O-N 3.09Å
973	M	28	Very low	32	Very low	172 Å²	172	127.2 Å²	127.2	85%	0.847	70%	0.699	S	S	*	*	S	Bend	trans	61.9	-38.1	152.6	-59.2	-173.7	172.9	0	0	122.1
974	N	35.2	Very low	33.2	Very low	119 Å²	119	122.2 Å²	122.2	64%	0.636	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-22.2	-165.3	-81.4	7.8	0	0	0	117.6	N972 G976	N972-N974 PolarHBondContact O-N 3.09Å; N974-G976 PolarHBondContact O-N 3.23Å; N974-G976 VanDerWaalsContact O-N 3.13Å
975	D	32.1	Very low	34.4	Very low	157 Å²	157	120.8 Å²	120.8	84%	0.84	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-10.9	179.7	-70.3	-26.9	0	0	0	113.7
976	G	31.2	Very low	35.9	Very low	36 Å²	36	117.8 Å²	117.8	37%	0.371	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.2	-45.9	-172	0	0	0	0	0	115.3	N974 G1083	N974-G976 PolarHBondContact O-N 3.23Å; N974-G976 VanDerWaalsContact O-N 3.13Å; G976-G1083 VanDerWaalsContact C-CA 3.5Å; G976-G1083 VanDerWaalsContact CA-CA 3.45Å; G976-G1083 WeakPolarHBondContact O-CA 3.36Å
977	I	33.8	Very low	37.4	Very low	84 Å²	84	115 Å²	115	43%	0.431	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.1	-16.2	-172.3	-61.4	177.6	0	0	0	111.6	M1015 G1083	I977-M1015 HydrophobicContact CD1-CE 4.26Å; I977-M1015 HydrophobicContact CG2-CE 4.06Å; I977-G1083 WeakPolarHBondContact CG1-O 3.48Å
978	L	40	Very low	38.8	Very low	140 Å²	140	111.6 Å²	111.6	73%	0.733	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	18.6	-177.3	-62.6	170.9	0	0	0	112.9	E980	L978-E980 VanDerWaalsContact C-N 3.32Å; L978-E980 PolarHBondContact O-N 3.26Å
979	G	39.8	Very low	40.4	Very low	50 Å²	50	114.9 Å²	114.9	52%	0.515	61%	0.606	S	S	.	*			trans	-70.7	75.8	-177.9	0	0	0	0	0	114.6	D981	G979-D981 VanDerWaalsContact C-N 3.3Å; G979-D981 PolarHBondContact O-N 3.01Å
980	E	39.9	Very low	42.2	Very low	184 Å²	184	108.6 Å²	108.6	86%	0.86	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.6	-43.1	161.7	-55.1	-157.5	110.3	0	0	120.4	L978	L978-E980 VanDerWaalsContact C-N 3.32Å; L978-E980 PolarHBondContact O-N 3.26Å
981	D	46.6	Very low	43.8	Very low	111 Å²	111	109 Å²	109	59%	0.594	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.6	-22.8	-163.1	-76.9	-47.2	0	0	0	117.5	G979 F983 S984	G979-D981 VanDerWaalsContact C-N 3.3Å; G979-D981 PolarHBondContact O-N 3.01Å; D981-F983 VanDerWaalsContact C-N 3.32Å; D981-F983 PolarHBondContact O-N 3.01Å; D981-S984 WeakPolarHBondContact O-CB 3.32Å; D981-S984 PolarHBondContact O-N 3.49Å; D981-S984 PolarHBondContact O-OG 3.44Å
982	Y	47.3	Very low	45.6	Very low	87 Å²	87	101.9 Å²	101.9	34%	0.341	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-36.6	-163.6	174.1	-120.8	0	0	0	116.1	S1022 F1078	Y982-S1022 WeakPolarHBondContact OH-CB 3.35Å; Y982-S1022 PolarHBondContact OH-OG 3.44Å; Y982-F1078 HydrophobicContact CD2-CD2 4.1Å; Y982-F1078 AromaticContact CD2-CE2 3.6Å; Y982-F1078 HydrophobicContact CD2-CE2 3.6Å; Y982-F1078 HydrophobicContact CD2-CZ 4.27Å; Y982-F1078 AromaticContact CE2-CD2 3.94Å; Y982-F1078 HydrophobicContact CE2-CD2 3.94Å; Y982-F1078 HydrophobicContact CE2-CE1 4.29Å; Y982-F1078 AromaticContact CE2-CE2 3.13Å; Y982-F1078 HydrophobicContact CE2-CE2 3.13Å; Y982-F1078 AromaticContact CE2-CZ 3.34Å; Y982-F1078 HydrophobicContact CE2-CZ 3.34Å; Y982-F1078 HydrophobicContact CG-CE2 4.49Å; Y982-F1078 AromaticContact CZ-CE2 3.69Å; Y982-F1078 AromaticContact CZ-CZ 3.62Å; Y982-F1078 WeakPolarHBondContact OH-CZ 3.46Å
983	F	47.6	Very low	47.6	Very low	130 Å²	130	100.2 Å²	100.2	57%	0.57	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	1.3	176.6	-68.5	-69.7	0	0	0	114	D981 M986 M991	D981-F983 VanDerWaalsContact C-N 3.32Å; D981-F983 PolarHBondContact O-N 3.01Å; F983-M986 HydrophobicContact CD1-CE 4.04Å; F983-M986 HydrophobicContact CD1-SD 3.64Å; F983-M986 HydrophobicContact CE1-CE 4.27Å; F983-M986 HydrophobicContact CE1-SD 4.1Å; F983-M991 HydrophobicContact CD1-CE 4.07Å
984	S	49.1	Very low	49.7	Very low	55 Å²	55	92.9 Å²	92.9	39%	0.385	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-38.5	-172.4	68.9	0	0	0	0	112.6	D981	D981-S984 WeakPolarHBondContact O-CB 3.32Å; D981-S984 PolarHBondContact O-N 3.49Å; D981-S984 PolarHBondContact O-OG 3.44Å
985	N	50.4	Low	51.2	Low	121 Å²	121	90.8 Å²	90.8	65%	0.647	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	11.1	-175.2	-59.9	-25.6	0	0	0	113.7
986	M	56	Low	53.2	Low	28 Å²	28	87.7 Å²	87.7	14%	0.138	45%	0.449	C	S	.	.			trans	-88.8	113.2	-176.5	-85.7	-178.3	48.6	0	0	113.1	F983 M991 I994	F983-M986 HydrophobicContact CD1-CE 4.04Å; F983-M986 HydrophobicContact CD1-SD 3.64Å; F983-M986 HydrophobicContact CE1-CE 4.27Å; F983-M986 HydrophobicContact CE1-SD 4.1Å; M986-M991 HydrophobicContact CE-CB 4.07Å; M986-M991 HydrophobicContact CE-CE 4.33Å; M986-I994 HydrophobicContact CE-CD1 3.7Å; M986-I994 HydrophobicContact SD-CD1 4.37Å
987	N	54.6	Low	55.4	Low	86 Å²	86	86.6 Å²	86.6	46%	0.46	44%	0.436	S	S	.	.			trans	-53.6	133.9	171	-175.8	-39.3	0	0	0	111.5	R989 A990 M991	N987-R989 PolarHBondContact O-N 3.12Å; N987-R989 WeakPolarHBondContact OD1-CB 3.27Å; N987-R989 PolarHBondContact OD1-N 3.17Å; N987-A990 HydrophobicContact CB-CB 4.31Å; N987-A990 WeakPolarHBondContact O-CA 3.05Å; N987-A990 WeakPolarHBondContact O-CB 3.31Å; N987-A990 PolarHBondContact O-N 2.83Å; N987-M991 PolarHBondContact O-N 3.22Å
988	P	54	Low	57.5	Low	52 Å²	52	84.5 Å²	84.5	34%	0.338	43%	0.425	S	S	.	.	H	α-helix	trans	-54.1	-27.4	177.5	-28.7	35.7	0	0	0	115.3	V470 R992	V470-P988 HydrophobicContact CG1-CB 4.29Å; V470-P988 HydrophobicContact CG2-CB 4.42Å; P988-R992 PolarHBondContact O-N 3.43Å
989	R	57.9	Low	59.2	Low	203 Å²	203	80.9 Å²	80.9	77%	0.766	41%	0.41	S	S	*	.	H	α-helix	trans	-68.5	-42.8	171.6	-68.2	-178.4	175.9	166.3	-2.2	112.2	N987 M991 R992 R993	N987-R989 PolarHBondContact O-N 3.12Å; N987-R989 WeakPolarHBondContact OD1-CB 3.27Å; N987-R989 PolarHBondContact OD1-N 3.17Å; R989-M991 VanDerWaalsContact C-N 3.35Å; R989-R992 PolarHBondContact O-N 3Å; R989-R993 PolarHBondContact O-N 3.12Å
990	A	62.6	Low	61	Low	12 Å²	12	82.1 Å²	82.1	10%	0.099	40%	0.404	C	S	.	.	H	α-helix	trans	-65.4	-39.9	174.6	0	0	0	0	0	110.7	N987 R992 R993 I994	N987-A990 HydrophobicContact CB-CB 4.31Å; N987-A990 WeakPolarHBondContact O-CA 3.05Å; N987-A990 WeakPolarHBondContact O-CB 3.31Å; N987-A990 PolarHBondContact O-N 2.83Å; A990-R992 PolarHBondContact O-N 3.33Å; A990-R993 PolarHBondContact O-N 3.11Å; A990-I994 WeakPolarHBondContact O-CB 3.34Å; A990-I994 WeakPolarHBondContact O-CG1 3.47Å; A990-I994 PolarHBondContact O-N 3.31Å
991	M	61.4	Low	63	Low	77 Å²	77	73.4 Å²	73.4	38%	0.379	36%	0.363	S	S	.	.	H	α-helix	trans	-59.9	-42.7	171.8	-177.1	172.1	-82.6	0	0	112.1	F983 M986 N987 R989 I994 V995	F983-M991 HydrophobicContact CD1-CE 4.07Å; M986-M991 HydrophobicContact CE-CB 4.07Å; M986-M991 HydrophobicContact CE-CE 4.33Å; N987-M991 PolarHBondContact O-N 3.22Å; R989-M991 VanDerWaalsContact C-N 3.35Å; M991-I994 PolarHBondContact O-N 3.28Å; M991-V995 HydrophobicContact CG-CG2 4.49Å; M991-V995 WeakPolarHBondContact O-CB 3.42Å; M991-V995 VanDerWaalsContact O-CG2 3.31Å; M991-V995 WeakPolarHBondContact O-CG2 3.45Å; M991-V995 PolarHBondContact O-N 2.96Å
992	R	61.8	Low	64.5	Low	96 Å²	96	68.2 Å²	68.2	36%	0.362	34%	0.336	S	S	.	.	H	α-helix	trans	-63.6	-43	174.1	-171.9	177.9	-66.5	-177.3	2.3	112.1	D473 P988 R989 A990 V995 N996	D473-R992 IonicContact OD2-CZ 2.71Å; D473-R992 IonicContact OD2-NH1 3.4Å; D473-R992 PolarHBondContact OD2-NH1 3.16Å; D473-R992 IonicContact OD2-NH2 3.85Å; D473-R992 PolarHBondContact OD2-NH2 3.28Å; P988-R992 PolarHBondContact O-N 3.43Å; R989-R992 PolarHBondContact O-N 3Å; A990-R992 PolarHBondContact O-N 3.33Å; R992-V995 PolarHBondContact O-N 3.11Å; R992-N996 WeakPolarHBondContact O-CB 3.36Å; R992-N996 VanDerWaalsContact O-CG 3.24Å; R992-N996 PolarHBondContact O-N 3.16Å; R992-N996 PolarHBondContact O-OD1 3.03Å
993	R	70.5	Confident	66	Low	104 Å²	104	73.3 Å²	73.3	39%	0.392	35%	0.354	S	S	.	.	H	α-helix	trans	-60.3	-48	174.7	-77	-168.9	174.4	-179.8	1	111.8	R989 A990 V995 N996 A997 E1025 D1363	R989-R993 PolarHBondContact O-N 3.12Å; A990-R993 PolarHBondContact O-N 3.11Å; R993-V995 PolarHBondContact O-N 2.91Å; R993-N996 PolarHBondContact O-N 3.49Å; R993-A997 VanDerWaalsContact O-CB 3.29Å; R993-A997 WeakPolarHBondContact O-CB 3.36Å; R993-A997 PolarHBondContact O-N 3.28Å; R993-E1025 HydrophobicContact CB-CG 4.25Å; R993-E1025 WeakPolarHBondContact CD-OE1 3.44Å; R993-D1363 IonicContact CZ-OD1 3.21Å; R993-D1363 IonicContact CZ-OD2 3.11Å; R993-D1363 IonicContact NH2-OD1 3.23Å; R993-D1363 PolarHBondContact NH2-OD1 2.95Å; R993-D1363 IonicContact NH2-OD2 2.66Å; R993-D1363 PolarHBondContact NH2-OD2 2.72Å
994	I	71.7	Confident	67.6	Low	18 Å²	18	69.8 Å²	69.8	9%	0.092	34%	0.341	C	S	.	.	H	α-helix	trans	-61.1	-42.6	177.5	-69.2	175.8	0	0	0	111.6	M986 A990 M991 L998 V1021 E1025	M986-I994 HydrophobicContact CE-CD1 3.7Å; M986-I994 HydrophobicContact SD-CD1 4.37Å; A990-I994 WeakPolarHBondContact O-CB 3.34Å; A990-I994 WeakPolarHBondContact O-CG1 3.47Å; A990-I994 PolarHBondContact O-N 3.31Å; M991-I994 PolarHBondContact O-N 3.28Å; I994-L998 WeakPolarHBondContact O-CB 3.21Å; I994-L998 PolarHBondContact O-N 3.35Å; I994-V1021 HydrophobicContact CG2-CG1 4.41Å; I994-E1025 HydrophobicContact CD1-CG 4.27Å; I994-E1025 HydrophobicContact CG1-CB 3.96Å; I994-E1025 HydrophobicContact CG1-CG 3.59Å
995	V	66.9	Low	69.1	Low	75 Å²	75	67.2 Å²	67.2	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-66.5	-41.7	177	169.9	0	0	0	0	111.6	M991 R992 R993 L998 T999	M991-V995 HydrophobicContact CG-CG2 4.49Å; M991-V995 WeakPolarHBondContact O-CB 3.42Å; M991-V995 VanDerWaalsContact O-CG2 3.31Å; M991-V995 WeakPolarHBondContact O-CG2 3.45Å; M991-V995 PolarHBondContact O-N 2.96Å; R992-V995 PolarHBondContact O-N 3.11Å; R993-V995 PolarHBondContact O-N 2.91Å; V995-L998 PolarHBondContact O-N 3.31Å; V995-T999 HydrophobicContact CG1-CG2 4.5Å; V995-T999 WeakPolarHBondContact O-CB 3.41Å; V995-T999 WeakPolarHBondContact O-CG2 3.48Å; V995-T999 PolarHBondContact O-N 2.85Å; V995-T999 PolarHBondContact O-OG1 3.47Å
996	N	74.7	Confident	70.5	Confident	93 Å²	93	69.2 Å²	69.2	50%	0.497	32%	0.322	S	S	.	.	H	α-helix	trans	-66.6	-44.4	177.3	-71.8	11.4	0	0	0	111.2	R992 R993 T999 L1000	R992-N996 WeakPolarHBondContact O-CB 3.36Å; R992-N996 VanDerWaalsContact O-CG 3.24Å; R992-N996 PolarHBondContact O-N 3.16Å; R992-N996 PolarHBondContact O-OD1 3.03Å; R993-N996 PolarHBondContact O-N 3.49Å; N996-T999 PolarHBondContact O-N 3.36Å; N996-T999 PolarHBondContact O-OG1 2.88Å; N996-L1000 WeakPolarHBondContact O-CB 3.3Å; N996-L1000 PolarHBondContact O-N 3.48Å
997	A	77	Confident	71.6	Confident	13 Å²	13	71.6 Å²	71.6	11%	0.107	35%	0.346	C	S	.	.	H	α-helix	trans	-63.9	-44	175.2	0	0	0	0	0	111.8	R993 T999 L1000 T1001 V1021	R993-A997 VanDerWaalsContact O-CB 3.29Å; R993-A997 WeakPolarHBondContact O-CB 3.36Å; R993-A997 PolarHBondContact O-N 3.28Å; A997-T999 PolarHBondContact O-N 2.95Å; A997-L1000 PolarHBondContact O-N 3.28Å; A997-T1001 WeakPolarHBondContact O-CB 3.23Å; A997-T1001 VanDerWaalsContact O-CG2 3.27Å; A997-T1001 WeakPolarHBondContact O-CG2 3.29Å; A997-T1001 PolarHBondContact O-N 3.3Å; A997-T1001 PolarHBondContact O-OG1 3.23Å; A997-V1021 HydrophobicContact CB-CG1 3.62Å
998	L	78.1	Confident	72.7	Confident	39 Å²	39	72.2 Å²	72.2	20%	0.204	35%	0.345	C	S	.	.	H	α-helix	trans	-65.2	-39.1	178.2	-179.5	60.2	0	0	0	112.4	I994 V995 T1001 G1002 W1014 L1017 V1021	I994-L998 WeakPolarHBondContact O-CB 3.21Å; I994-L998 PolarHBondContact O-N 3.35Å; V995-L998 PolarHBondContact O-N 3.31Å; L998-T1001 PolarHBondContact O-OG1 3.4Å; L998-G1002 WeakPolarHBondContact O-CA 3.43Å; L998-G1002 PolarHBondContact O-N 3.09Å; L998-W1014 HydrophobicContact CD1-CE3 4.17Å; L998-W1014 HydrophobicContact CD1-CZ3 4.3Å; L998-W1014 HydrophobicContact CG-CE3 4.39Å; L998-W1014 HydrophobicContact CG-CZ3 4.31Å; L998-L1017 HydrophobicContact CD1-CB 4.19Å; L998-L1017 HydrophobicContact CD1-CD2 3.79Å; L998-L1017 HydrophobicContact CD1-CG 3.73Å; L998-V1021 HydrophobicContact CB-CG1 4.39Å; L998-V1021 HydrophobicContact CD1-CG2 4.44Å
999	T	74.7	Confident	74	Confident	65 Å²	65	78.1 Å²	78.1	40%	0.399	37%	0.368	S	S	.	.	H	α-helix	trans	-75.4	-30.7	176.9	52.3	0	0	0	0	112.7	V995 N996 A997 R1003	V995-T999 HydrophobicContact CG1-CG2 4.5Å; V995-T999 WeakPolarHBondContact O-CB 3.41Å; V995-T999 WeakPolarHBondContact O-CG2 3.48Å; V995-T999 PolarHBondContact O-N 2.85Å; V995-T999 PolarHBondContact O-OG1 3.47Å; N996-T999 PolarHBondContact O-N 3.36Å; N996-T999 PolarHBondContact O-OG1 2.88Å; A997-T999 PolarHBondContact O-N 2.95Å; T999-R1003 WeakPolarHBondContact O-CB 3.33Å; T999-R1003 WeakPolarHBondContact O-CD 3.05Å; T999-R1003 WeakPolarHBondContact O-CG 3.44Å; T999-R1003 PolarHBondContact O-N 3Å; T999-R1003 VanDerWaalsContact O-N 3.1Å
1000	L	78.7	Confident	74.9	Confident	76 Å²	76	70.5 Å²	70.5	40%	0.398	34%	0.342	S	S	.	.	H	α-helix	trans	-76.9	-49	175.4	-177.1	145.8	0	0	0	112	N996 A997 G1002 R1003 L1004 S1103	N996-L1000 WeakPolarHBondContact O-CB 3.3Å; N996-L1000 PolarHBondContact O-N 3.48Å; A997-L1000 PolarHBondContact O-N 3.28Å; L1000-G1002 VanDerWaalsContact C-N 3.33Å; L1000-G1002 PolarHBondContact O-N 3.41Å; L1000-R1003 WeakPolarHBondContact O-CB 3.49Å; L1000-R1003 PolarHBondContact O-N 3.35Å; L1000-R1003 VanDerWaalsContact O-N 3.07Å; L1000-L1004 HydrophobicContact CD2-CD1 3.63Å; L1000-L1004 HydrophobicContact CD2-CG 4.39Å; L1000-L1004 PolarHBondContact O-N 3.21Å; L1000-S1103 VanDerWaalsContact CD2-OG 3.24Å; L1000-S1103 WeakPolarHBondContact CD2-OG 2.96Å
1001	T	81.8	Confident	75.6	Confident	1 Å²	1	76.7 Å²	76.7	1%	0.006	37%	0.373	C	S	.	.	H	α-helix	trans	-60.1	-42.7	172.8	55.1	0	0	0	0	111	A997 L998 R1003 L1004 M1005 V1021	A997-T1001 WeakPolarHBondContact O-CB 3.23Å; A997-T1001 VanDerWaalsContact O-CG2 3.27Å; A997-T1001 WeakPolarHBondContact O-CG2 3.29Å; A997-T1001 PolarHBondContact O-N 3.3Å; A997-T1001 PolarHBondContact O-OG1 3.23Å; L998-T1001 PolarHBondContact O-OG1 3.4Å; T1001-R1003 PolarHBondContact O-N 2.96Å; T1001-L1004 PolarHBondContact O-N 3.28Å; T1001-M1005 WeakPolarHBondContact O-CB 3.27Å; T1001-M1005 WeakPolarHBondContact O-CG 3.49Å; T1001-M1005 PolarHBondContact O-N 3.14Å; T1001-V1021 HydrophobicContact CG2-CG2 4.23Å
1002	G	77.8	Confident	76.4	Confident	2 Å²	2	75 Å²	75	2%	0.021	36%	0.364	C	S	.	.	H	α-helix	trans	-68	-18.1	175	0	0	0	0	0	114.7	L998 L1000 R1006	L998-G1002 WeakPolarHBondContact O-CA 3.43Å; L998-G1002 PolarHBondContact O-N 3.09Å; L1000-G1002 VanDerWaalsContact C-N 3.33Å; L1000-G1002 PolarHBondContact O-N 3.41Å; G1002-R1006 WeakPolarHBondContact O-CD 3.36Å; G1002-R1006 VanDerWaalsContact O-CG 3.32Å; G1002-R1006 WeakPolarHBondContact O-CG 3.32Å
1003	R	78.2	Confident	77.2	Confident	193 Å²	193	72.4 Å²	72.4	73%	0.728	36%	0.36	S	S	*	.	H	α-helix	trans	-82.4	-45.9	167.8	-80.1	168.9	-174.3	-167.2	4.5	111.4	T999 L1000 T1001 R1006 A1007	T999-R1003 WeakPolarHBondContact O-CB 3.33Å; T999-R1003 WeakPolarHBondContact O-CD 3.05Å; T999-R1003 WeakPolarHBondContact O-CG 3.44Å; T999-R1003 PolarHBondContact O-N 3Å; T999-R1003 VanDerWaalsContact O-N 3.1Å; L1000-R1003 WeakPolarHBondContact O-CB 3.49Å; L1000-R1003 PolarHBondContact O-N 3.35Å; L1000-R1003 VanDerWaalsContact O-N 3.07Å; T1001-R1003 PolarHBondContact O-N 2.96Å; R1003-R1006 PolarHBondContact O-N 3.05Å; R1003-A1007 PolarHBondContact O-N 3.48Å
1004	L	81.8	Confident	77.4	Confident	56 Å²	56	73.1 Å²	73.1	29%	0.293	36%	0.363	S	S	.	.	H	α-helix	trans	-58.7	-51.6	176.4	-72.7	170.2	0	0	0	111.2	L1000 T1001 R1006 A1007 F1008 C1101	L1000-L1004 HydrophobicContact CD2-CD1 3.63Å; L1000-L1004 HydrophobicContact CD2-CG 4.39Å; L1000-L1004 PolarHBondContact O-N 3.21Å; T1001-L1004 PolarHBondContact O-N 3.28Å; L1004-R1006 PolarHBondContact O-N 3.41Å; L1004-R1006 VanDerWaalsContact O-N 3.16Å; L1004-A1007 WeakPolarHBondContact O-CA 3.31Å; L1004-A1007 WeakPolarHBondContact O-CB 3.34Å; L1004-A1007 PolarHBondContact O-N 2.83Å; L1004-F1008 HydrophobicContact CB-CD2 4.38Å; L1004-F1008 HydrophobicContact CB-CE2 4.24Å; L1004-F1008 HydrophobicContact CD2-CE2 4.13Å; L1004-F1008 WeakPolarHBondContact O-CD2 3.47Å; L1004-F1008 PolarHBondContact O-N 2.78Å; L1004-C1101 HydrophobicContact CB-CB 4.11Å; L1004-C1101 WeakPolarHBondContact CD1-O 3.21Å
1005	M	81.6	Confident	77.4	Confident	1 Å²	1	76.6 Å²	76.6	1%	0.005	38%	0.38	C	S	.	.	H	α-helix	trans	-53.8	-36.9	176.1	-70.1	-77.2	-66.8	0	0	112.5	T1001 E1009 I1010 F1012 F1098 C1101	T1001-M1005 WeakPolarHBondContact O-CB 3.27Å; T1001-M1005 WeakPolarHBondContact O-CG 3.49Å; T1001-M1005 PolarHBondContact O-N 3.14Å; M1005-E1009 PolarHBondContact O-N 3.32Å; M1005-I1010 HydrophobicContact CE-CB 3.76Å; M1005-I1010 HydrophobicContact CE-CG2 3.42Å; M1005-I1010 VanDerWaalsContact CE-CG2 3.42Å; M1005-I1010 PolarHBondContact O-N 2.95Å; M1005-I1010 HydrophobicContact SD-CB 4.13Å; M1005-I1010 HydrophobicContact SD-CD1 4.02Å; M1005-I1010 HydrophobicContact SD-CG2 4.17Å; M1005-F1012 HydrophobicContact CB-CD1 3.64Å; M1005-F1012 HydrophobicContact CB-CE1 3.5Å; M1005-F1012 VanDerWaalsContact CB-CE1 3.5Å; M1005-F1012 HydrophobicContact CB-CZ 4.41Å; M1005-F1012 HydrophobicContact CE-CB 3.71Å; M1005-F1012 HydrophobicContact CE-CD1 3.76Å; M1005-F1012 HydrophobicContact CE-CG 4.02Å; M1005-F1012 HydrophobicContact CG-CD1 4.25Å; M1005-F1012 HydrophobicContact CG-CE1 4.38Å; M1005-F1098 HydrophobicContact CE-CD1 3.47Å; M1005-F1098 VanDerWaalsContact CE-CD1 3.47Å; M1005-F1098 HydrophobicContact CE-CE1 3.59Å; M1005-F1098 HydrophobicContact SD-CD1 4.01Å; M1005-C1101 HydrophobicContact CG-CB 4.04Å; M1005-C1101 HydrophobicContact SD-CB 3.89Å
1006	R	78.8	Confident	77.9	Confident	163 Å²	163	73.3 Å²	73.3	62%	0.615	36%	0.36	S	S	*	.	H	α-helix	trans	-76	-30.1	175	-77.7	178.3	170.1	-175.5	-5.5	114	G1002 R1003 L1004 E1009 F1012	G1002-R1006 WeakPolarHBondContact O-CD 3.36Å; G1002-R1006 VanDerWaalsContact O-CG 3.32Å; G1002-R1006 WeakPolarHBondContact O-CG 3.32Å; R1003-R1006 PolarHBondContact O-N 3.05Å; L1004-R1006 PolarHBondContact O-N 3.41Å; L1004-R1006 VanDerWaalsContact O-N 3.16Å; R1006-E1009 PolarHBondContact O-N 2.8Å; R1006-F1012 HydrophobicContact CG-CE1 4.15Å
1007	A	78.9	Confident	78.3	Confident	79 Å²	79	68.9 Å²	68.9	65%	0.653	34%	0.337	S	S	*	.	H	α-helix	trans	-73	-30.8	175	0	0	0	0	0	111.9	R1003 L1004 E1009	R1003-A1007 PolarHBondContact O-N 3.48Å; L1004-A1007 WeakPolarHBondContact O-CA 3.31Å; L1004-A1007 WeakPolarHBondContact O-CB 3.34Å; L1004-A1007 PolarHBondContact O-N 2.83Å; A1007-E1009 VanDerWaalsContact C-N 3.34Å
1008	F	78.4	Confident	78.3	Confident	99 Å²	99	69 Å²	69	43%	0.434	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	11.1	173	-61.6	-61.1	0	0	0	113.9	L1004 I1010 C1101 H1294	L1004-F1008 HydrophobicContact CB-CD2 4.38Å; L1004-F1008 HydrophobicContact CB-CE2 4.24Å; L1004-F1008 HydrophobicContact CD2-CE2 4.13Å; L1004-F1008 WeakPolarHBondContact O-CD2 3.47Å; L1004-F1008 PolarHBondContact O-N 2.78Å; F1008-I1010 HydrophobicContact CB-CD1 3.97Å; F1008-I1010 HydrophobicContact CB-CG1 3.91Å; F1008-I1010 WeakPolarHBondContact O-CG1 3.34Å; F1008-I1010 PolarHBondContact O-N 2.98Å; F1008-C1101 VanDerWaalsContact CD2-SG 3.56Å; F1008-H1294 AromaticContact CE1-NE2 3.61Å
1009	E	80.6	Confident	78.3	Confident	176 Å²	176	68.1 Å²	68.1	82%	0.822	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	26.9	-178.4	-54.2	-157.2	142.7	0	0	115.8	M1005 R1006 A1007	M1005-E1009 PolarHBondContact O-N 3.32Å; R1006-E1009 PolarHBondContact O-N 2.8Å; A1007-E1009 VanDerWaalsContact C-N 3.34Å
1010	I	76.5	Confident	78.8	Confident	43 Å²	43	65 Å²	65	22%	0.221	32%	0.315	C	S	.	.			trans	-84.6	118.1	-179.6	-50.4	175.3	0	0	0	110.5	M1005 F1008 F1012 K1097	M1005-I1010 HydrophobicContact CE-CB 3.76Å; M1005-I1010 HydrophobicContact CE-CG2 3.42Å; M1005-I1010 VanDerWaalsContact CE-CG2 3.42Å; M1005-I1010 PolarHBondContact O-N 2.95Å; M1005-I1010 HydrophobicContact SD-CB 4.13Å; M1005-I1010 HydrophobicContact SD-CD1 4.02Å; M1005-I1010 HydrophobicContact SD-CG2 4.17Å; F1008-I1010 HydrophobicContact CB-CD1 3.97Å; F1008-I1010 HydrophobicContact CB-CG1 3.91Å; F1008-I1010 WeakPolarHBondContact O-CG1 3.34Å; F1008-I1010 PolarHBondContact O-N 2.98Å; I1010-F1012 WeakPolarHBondContact O-CD1 3.29Å; I1010-K1097 HydrophobicContact CG2-CB 4.4Å; I1010-K1097 HydrophobicContact CG2-CD 4.23Å; I1010-K1097 HydrophobicContact CG2-CG 4.42Å
1011	D	78.6	Confident	79	Confident	141 Å²	141	61.4 Å²	61.4	75%	0.754	30%	0.296	S	S	*	.			trans	-66.1	133.1	172.8	-83.1	-38.3	0	0	0	113.5
1012	F	77.4	Confident	78.9	Confident	43 Å²	43	61.4 Å²	61.4	19%	0.189	30%	0.296	C	S	.	.			trans	-148.3	153.4	177	66.3	-86.8	0	0	0	113.7	M1005 R1006 I1010 W1014 L1017 F1098	M1005-F1012 HydrophobicContact CB-CD1 3.64Å; M1005-F1012 HydrophobicContact CB-CE1 3.5Å; M1005-F1012 VanDerWaalsContact CB-CE1 3.5Å; M1005-F1012 HydrophobicContact CB-CZ 4.41Å; M1005-F1012 HydrophobicContact CE-CB 3.71Å; M1005-F1012 HydrophobicContact CE-CD1 3.76Å; M1005-F1012 HydrophobicContact CE-CG 4.02Å; M1005-F1012 HydrophobicContact CG-CD1 4.25Å; M1005-F1012 HydrophobicContact CG-CE1 4.38Å; R1006-F1012 HydrophobicContact CG-CE1 4.15Å; I1010-F1012 WeakPolarHBondContact O-CD1 3.29Å; F1012-W1014 AromaticContact CE2-CD2 3.71Å; F1012-W1014 HydrophobicContact CE2-CD2 3.71Å; F1012-W1014 AromaticContact CE2-CE2 3.77Å; F1012-W1014 AromaticContact CE2-CE3 3.84Å; F1012-W1014 HydrophobicContact CE2-CE3 3.84Å; F1012-W1014 HydrophobicContact CE2-CG 4.23Å; F1012-W1014 HydrophobicContact CE2-CH2 4.12Å; F1012-W1014 AromaticContact CE2-CZ2 4Å; F1012-W1014 HydrophobicContact CE2-CZ2 4Å; F1012-W1014 HydrophobicContact CE2-CZ3 4.04Å; F1012-W1014 HydrophobicContact CZ-CD2 4.44Å; F1012-W1014 HydrophobicContact CZ-CH2 4Å; F1012-W1014 AromaticContact CZ-CZ2 3.89Å; F1012-W1014 HydrophobicContact CZ-CZ2 3.89Å; F1012-W1014 HydrophobicContact CZ-CZ3 4.33Å; F1012-L1017 HydrophobicContact CD2-CB 3.86Å; F1012-L1017 HydrophobicContact CD2-CD2 3.68Å; F1012-L1017 HydrophobicContact CD2-CG 4.35Å; F1012-L1017 HydrophobicContact CE2-CB 4.34Å; F1012-L1017 HydrophobicContact CE2-CD2 3.43Å; F1012-L1017 VanDerWaalsContact CE2-CD2 3.43Å; F1012-L1017 HydrophobicContact CG-CD2 4.43Å; F1012-L1017 HydrophobicContact CZ-CD2 4Å; F1012-F1098 HydrophobicContact CB-CE1 3.95Å; F1012-F1098 HydrophobicContact CB-CZ 4.43Å
1013	S	78.1	Confident	79.1	Confident	40 Å²	40	61.3 Å²	61.3	28%	0.28	30%	0.295	S	S	.	.			trans	-86.1	134.7	161	167.3	0	0	0	0	110.4	M1015 S1016 L1017 E1088	S1013-M1015 PolarHBondContact O-N 2.82Å; S1013-M1015 PolarHBondContact OG-N 3.01Å; S1013-M1015 VanDerWaalsContact OG-N 3.08Å; S1013-S1016 PolarHBondContact N-OG 2.95Å; S1013-S1016 PolarHBondContact O-N 2.99Å; S1013-S1016 VanDerWaalsContact O-N 3.15Å; S1013-S1016 PolarHBondContact O-OG 3.36Å; S1013-L1017 PolarHBondContact O-N 3.29Å; S1013-E1088 WeakPolarHBondContact CB-OE1 3.31Å; S1013-E1088 PolarHBondContact OG-OE1 3.46Å
1014	W	74.1	Confident	79.3	Confident	119 Å²	119	52.2 Å²	52.2	45%	0.451	26%	0.261	S	S	.	.	H	α-helix	trans	-57.3	-28.6	172	-72.1	101.3	0	0	0	113.4	L998 F1012 L1017 G1018	L998-W1014 HydrophobicContact CD1-CE3 4.17Å; L998-W1014 HydrophobicContact CD1-CZ3 4.3Å; L998-W1014 HydrophobicContact CG-CE3 4.39Å; L998-W1014 HydrophobicContact CG-CZ3 4.31Å; F1012-W1014 AromaticContact CE2-CD2 3.71Å; F1012-W1014 HydrophobicContact CE2-CD2 3.71Å; F1012-W1014 AromaticContact CE2-CE2 3.77Å; F1012-W1014 AromaticContact CE2-CE3 3.84Å; F1012-W1014 HydrophobicContact CE2-CE3 3.84Å; F1012-W1014 HydrophobicContact CE2-CG 4.23Å; F1012-W1014 HydrophobicContact CE2-CH2 4.12Å; F1012-W1014 AromaticContact CE2-CZ2 4Å; F1012-W1014 HydrophobicContact CE2-CZ2 4Å; F1012-W1014 HydrophobicContact CE2-CZ3 4.04Å; F1012-W1014 HydrophobicContact CZ-CD2 4.44Å; F1012-W1014 HydrophobicContact CZ-CH2 4Å; F1012-W1014 AromaticContact CZ-CZ2 3.89Å; F1012-W1014 HydrophobicContact CZ-CZ2 3.89Å; F1012-W1014 HydrophobicContact CZ-CZ3 4.33Å; W1014-L1017 HydrophobicContact CZ3-CD2 4.44Å; W1014-G1018 PolarHBondContact O-N 3.32Å
1015	M	72	Confident	79.3	Confident	92 Å²	92	51 Å²	51	45%	0.453	25%	0.254	S	S	.	.	H	α-helix	trans	-71	-47.1	175.4	-61.5	-58	-65.1	0	0	110.8	I977 S1013 L1017 G1018 H1019 E1088	I977-M1015 HydrophobicContact CD1-CE 4.26Å; I977-M1015 HydrophobicContact CG2-CE 4.06Å; S1013-M1015 PolarHBondContact O-N 2.82Å; S1013-M1015 PolarHBondContact OG-N 3.01Å; S1013-M1015 VanDerWaalsContact OG-N 3.08Å; M1015-L1017 PolarHBondContact O-N 2.96Å; M1015-G1018 PolarHBondContact O-N 2.88Å; M1015-H1019 WeakPolarHBondContact O-CB 3.14Å; M1015-H1019 PolarHBondContact O-N 2.82Å; M1015-E1088 WeakPolarHBondContact CB-OE2 3.28Å
1016	S	77.1	Confident	79.1	Confident	5 Å²	5	52 Å²	52	4%	0.035	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-41.9	176.5	65.7	0	0	0	0	112.2	S1013 W1020	S1013-S1016 PolarHBondContact N-OG 2.95Å; S1013-S1016 PolarHBondContact O-N 2.99Å; S1013-S1016 VanDerWaalsContact O-N 3.15Å; S1013-S1016 PolarHBondContact O-OG 3.36Å; S1016-W1020 VanDerWaalsContact O-CB 3.26Å; S1016-W1020 WeakPolarHBondContact O-CB 3.49Å; S1016-W1020 PolarHBondContact O-N 3.31Å
1017	L	83.3	Confident	79.3	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-69.4	-39.3	176.6	-172	68.5	0	0	0	111.7	L998 F1012 S1013 W1014 M1015 W1020 V1021 F1098	L998-L1017 HydrophobicContact CD1-CB 4.19Å; L998-L1017 HydrophobicContact CD1-CD2 3.79Å; L998-L1017 HydrophobicContact CD1-CG 3.73Å; F1012-L1017 HydrophobicContact CD2-CB 3.86Å; F1012-L1017 HydrophobicContact CD2-CD2 3.68Å; F1012-L1017 HydrophobicContact CD2-CG 4.35Å; F1012-L1017 HydrophobicContact CE2-CB 4.34Å; F1012-L1017 HydrophobicContact CE2-CD2 3.43Å; F1012-L1017 VanDerWaalsContact CE2-CD2 3.43Å; F1012-L1017 HydrophobicContact CG-CD2 4.43Å; F1012-L1017 HydrophobicContact CZ-CD2 4Å; S1013-L1017 PolarHBondContact O-N 3.29Å; W1014-L1017 HydrophobicContact CZ3-CD2 4.44Å; M1015-L1017 PolarHBondContact O-N 2.96Å; L1017-W1020 PolarHBondContact O-N 2.77Å; L1017-V1021 HydrophobicContact CD1-CG2 4.37Å; L1017-V1021 HydrophobicContact CG-CG2 4.36Å; L1017-V1021 WeakPolarHBondContact O-CB 3.37Å; L1017-V1021 VanDerWaalsContact O-CG2 3.31Å; L1017-V1021 WeakPolarHBondContact O-CG2 3.49Å; L1017-V1021 PolarHBondContact O-N 3.01Å; L1017-F1098 HydrophobicContact CD1-CD1 4.49Å
1018	G	77.2	Confident	79.6	Confident	16 Å²	16	41.8 Å²	41.8	17%	0.165	21%	0.206	C	C	.	.	H	α-helix	trans	-65.3	-41	176.7	0	0	0	0	0	113.2	W1014 M1015 S1022	W1014-G1018 PolarHBondContact O-N 3.32Å; M1015-G1018 PolarHBondContact O-N 2.88Å; G1018-S1022 WeakPolarHBondContact O-CB 3.33Å; G1018-S1022 PolarHBondContact O-N 3.37Å
1019	H	78.7	Confident	79.7	Confident	20 Å²	20	37.1 Å²	37.1	9%	0.093	19%	0.186	C	C	.	.	H	α-helix	trans	-66.3	-42.7	174.3	-173.5	74.8	0	0	0	111.2	M1015 S1022 L1023 F1078	M1015-H1019 WeakPolarHBondContact O-CB 3.14Å; M1015-H1019 PolarHBondContact O-N 2.82Å; H1019-S1022 PolarHBondContact O-N 3.22Å; H1019-L1023 WeakPolarHBondContact O-CG 3.2Å; H1019-L1023 PolarHBondContact O-N 2.79Å; H1019-F1078 AromaticContact CE1-CD1 3.77Å; H1019-F1078 AromaticContact CE1-CD2 3.96Å; H1019-F1078 AromaticContact CE1-CE1 3.49Å; H1019-F1078 VanDerWaalsContact CE1-CE1 3.49Å; H1019-F1078 WeakPolarHBondContact CE1-CE1 3.48Å; H1019-F1078 AromaticContact CE1-CE2 3.66Å; H1019-F1078 AromaticContact CE1-CZ 3.43Å; H1019-F1078 VanDerWaalsContact CE1-CZ 3.43Å; H1019-F1078 WeakPolarHBondContact CE1-CZ 3.43Å; H1019-F1078 PolarHBondContact CE1-O 3.45Å; H1019-F1078 AromaticContact ND1-CE1 3.49Å; H1019-F1078 WeakPolarHBondContact ND1-CE1 3.46Å; H1019-F1078 AromaticContact ND1-CE2 3.48Å; H1019-F1078 WeakPolarHBondContact ND1-CE2 3.49Å; H1019-F1078 AromaticContact ND1-CZ 3.06Å; H1019-F1078 WeakPolarHBondContact ND1-CZ 3.46Å
1020	W	84.7	Confident	79.8	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.1	-50.3	175	169.6	-105.4	0	0	0	113.8	S1016 L1017 S1022 L1023 L1024 M1031 I1035 L1090 V1095 F1098 V1099 T1102	S1016-W1020 VanDerWaalsContact O-CB 3.26Å; S1016-W1020 WeakPolarHBondContact O-CB 3.49Å; S1016-W1020 PolarHBondContact O-N 3.31Å; L1017-W1020 PolarHBondContact O-N 2.77Å; W1020-S1022 VanDerWaalsContact C-N 3.28Å; W1020-S1022 PolarHBondContact O-N 3.17Å; W1020-L1023 WeakPolarHBondContact O-CB 3.44Å; W1020-L1023 PolarHBondContact O-N 3.4Å; W1020-L1024 HydrophobicContact CD2-CD1 4.21Å; W1020-L1024 HydrophobicContact CG-CD1 4.45Å; W1020-L1024 HydrophobicContact CZ2-CD1 4.03Å; W1020-L1024 HydrophobicContact CZ2-CD2 4.49Å; W1020-L1024 WeakPolarHBondContact O-CG 3.16Å; W1020-L1024 PolarHBondContact O-N 3.44Å; W1020-L1024 VanDerWaalsContact O-N 3.08Å; W1020-M1031 HydrophobicContact CE3-CE 3.73Å; W1020-M1031 HydrophobicContact CH2-CE 4.29Å; W1020-M1031 HydrophobicContact CZ3-CE 3.45Å; W1020-M1031 VanDerWaalsContact CZ3-CE 3.45Å; W1020-I1035 HydrophobicContact CH2-CD1 3.46Å; W1020-I1035 VanDerWaalsContact CH2-CD1 3.46Å; W1020-I1035 HydrophobicContact CH2-CG1 3.75Å; W1020-I1035 HydrophobicContact CZ2-CD1 4.24Å; W1020-I1035 HydrophobicContact CZ3-CD1 4.09Å; W1020-I1035 HydrophobicContact CZ3-CG1 4.14Å; W1020-L1090 HydrophobicContact CB-CD1 4.14Å; W1020-L1090 HydrophobicContact CB-CD2 4.19Å; W1020-L1090 HydrophobicContact CE3-CD1 4.08Å; W1020-V1095 HydrophobicContact CH2-CB 4.49Å; W1020-V1095 HydrophobicContact CH2-CG1 3.99Å; W1020-V1095 HydrophobicContact CH2-CG2 4.39Å; W1020-V1095 HydrophobicContact CZ3-CB 4.47Å; W1020-V1095 HydrophobicContact CZ3-CG1 4.32Å; W1020-V1095 HydrophobicContact CZ3-CG2 3.91Å; W1020-F1098 HydrophobicContact CB-CD2 3.95Å; W1020-F1098 HydrophobicContact CB-CE2 4.21Å; W1020-F1098 AromaticContact CD1-CD2 3.74Å; W1020-F1098 HydrophobicContact CD2-CB 4.22Å; W1020-F1098 AromaticContact CD2-CD2 3.89Å; W1020-F1098 HydrophobicContact CD2-CD2 3.89Å; W1020-F1098 HydrophobicContact CG-CB 4.33Å; W1020-F1098 AromaticContact CG-CD2 3.59Å; W1020-F1098 HydrophobicContact CG-CD2 3.59Å; W1020-F1098 HydrophobicContact CG-CE2 4.34Å; W1020-F1098 HydrophobicContact CG-CG 4.36Å; W1020-F1098 HydrophobicContact CZ2-CB 3.98Å; W1020-F1098 VanDerWaalsContact NE1-CB 3.34Å; W1020-V1099 HydrophobicContact CH2-CG2 3.74Å; W1020-V1099 HydrophobicContact CZ2-CG2 3.76Å; W1020-T1102 HydrophobicContact CZ2-CG2 3.99Å
1021	V	84	Confident	80.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63	-36.8	177.6	169.5	0	0	0	0	111.2	I994 A997 L998 T1001 L1017 L1024 E1025	I994-V1021 HydrophobicContact CG2-CG1 4.41Å; A997-V1021 HydrophobicContact CB-CG1 3.62Å; L998-V1021 HydrophobicContact CB-CG1 4.39Å; L998-V1021 HydrophobicContact CD1-CG2 4.44Å; T1001-V1021 HydrophobicContact CG2-CG2 4.23Å; L1017-V1021 HydrophobicContact CD1-CG2 4.37Å; L1017-V1021 HydrophobicContact CG-CG2 4.36Å; L1017-V1021 WeakPolarHBondContact O-CB 3.37Å; L1017-V1021 VanDerWaalsContact O-CG2 3.31Å; L1017-V1021 WeakPolarHBondContact O-CG2 3.49Å; L1017-V1021 PolarHBondContact O-N 3.01Å; V1021-L1024 PolarHBondContact O-N 2.91Å; V1021-E1025 PolarHBondContact O-N 3.35Å
1022	S	79.2	Confident	80.6	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-67	-42	175.4	-169.9	0	0	0	0	112.6	Y982 G1018 H1019 W1020 L1024 E1025 Q1026	Y982-S1022 WeakPolarHBondContact OH-CB 3.35Å; Y982-S1022 PolarHBondContact OH-OG 3.44Å; G1018-S1022 WeakPolarHBondContact O-CB 3.33Å; G1018-S1022 PolarHBondContact O-N 3.37Å; H1019-S1022 PolarHBondContact O-N 3.22Å; W1020-S1022 VanDerWaalsContact C-N 3.28Å; W1020-S1022 PolarHBondContact O-N 3.17Å; S1022-L1024 VanDerWaalsContact C-N 3.3Å; S1022-L1024 PolarHBondContact O-N 3.23Å; S1022-E1025 PolarHBondContact O-N 3.41Å; S1022-Q1026 VanDerWaalsContact O-CB 3.3Å; S1022-Q1026 WeakPolarHBondContact O-CB 3.46Å; S1022-Q1026 WeakPolarHBondContact O-CG 3.44Å; S1022-Q1026 PolarHBondContact O-N 2.83Å; S1022-Q1026 PolarHBondContact OG-NE2 3.47Å
1023	L	81.7	Confident	80.9	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-56.9	-44.1	172.8	-82.1	167.7	0	0	0	111.7	H1019 W1020 W1027 M1031 F1075 F1078 L1079 L1090	H1019-L1023 WeakPolarHBondContact O-CG 3.2Å; H1019-L1023 PolarHBondContact O-N 2.79Å; W1020-L1023 WeakPolarHBondContact O-CB 3.44Å; W1020-L1023 PolarHBondContact O-N 3.4Å; L1023-W1027 HydrophobicContact CD2-CE3 4.03Å; L1023-W1027 HydrophobicContact CD2-CZ3 4.23Å; L1023-W1027 PolarHBondContact O-N 2.96Å; L1023-M1031 HydrophobicContact CB-CE 3.87Å; L1023-M1031 HydrophobicContact CB-CG 4.09Å; L1023-M1031 HydrophobicContact CB-SD 3.78Å; L1023-M1031 HydrophobicContact CD1-CE 4.19Å; L1023-M1031 HydrophobicContact CD1-SD 4.19Å; L1023-M1031 HydrophobicContact CD2-SD 4.19Å; L1023-M1031 HydrophobicContact CG-SD 4.28Å; L1023-F1075 HydrophobicContact CD2-CD2 4.22Å; L1023-F1075 HydrophobicContact CD2-CE2 3.79Å; L1023-F1078 HydrophobicContact CD2-CD1 3.67Å; L1023-F1078 HydrophobicContact CD2-CE1 4.02Å; L1023-F1078 HydrophobicContact CG-CD1 4.07Å; L1023-F1078 HydrophobicContact CG-CE1 3.88Å; L1023-L1079 HydrophobicContact CD1-CD2 4.01Å; L1023-L1079 HydrophobicContact CD2-CD2 3.91Å; L1023-L1079 HydrophobicContact CD2-CG 4.43Å; L1023-L1090 HydrophobicContact CD1-CD1 3.54Å
1024	L	83.4	Confident	81.2	Confident	2 Å²	2	18 Å²	18	1%	0.01	9%	0.086	C	C	.	.	H	α-helix	trans	-67.6	-44.9	-179.9	-67.6	171.2	0	0	0	113.6	W1020 V1021 S1022 Q1026 M1031 I1035 T1102 L1105	W1020-L1024 HydrophobicContact CD2-CD1 4.21Å; W1020-L1024 HydrophobicContact CG-CD1 4.45Å; W1020-L1024 HydrophobicContact CZ2-CD1 4.03Å; W1020-L1024 HydrophobicContact CZ2-CD2 4.49Å; W1020-L1024 WeakPolarHBondContact O-CG 3.16Å; W1020-L1024 PolarHBondContact O-N 3.44Å; W1020-L1024 VanDerWaalsContact O-N 3.08Å; V1021-L1024 PolarHBondContact O-N 2.91Å; S1022-L1024 VanDerWaalsContact C-N 3.3Å; S1022-L1024 PolarHBondContact O-N 3.23Å; L1024-Q1026 VanDerWaalsContact C-N 3.33Å; L1024-M1031 HydrophobicContact CD2-CB 4.01Å; L1024-M1031 HydrophobicContact CD2-CE 4.24Å; L1024-M1031 HydrophobicContact CD2-CG 4.44Å; L1024-I1035 HydrophobicContact CD2-CD1 3.95Å; L1024-T1102 HydrophobicContact CD1-CG2 3.51Å; L1024-L1105 HydrophobicContact CD2-CD1 3.94Å
1025	E	79.8	Confident	81.8	Confident	32 Å²	32	12.4 Å²	12.4	15%	0.15	6%	0.064	C	C	.	.	H	α-helix	trans	-81.2	-10.1	-178	175.6	64.8	-142.6	0	0	112.8	R993 I994 V1021 S1022 R1070	R993-E1025 HydrophobicContact CB-CG 4.25Å; R993-E1025 WeakPolarHBondContact CD-OE1 3.44Å; I994-E1025 HydrophobicContact CD1-CG 4.27Å; I994-E1025 HydrophobicContact CG1-CB 3.96Å; I994-E1025 HydrophobicContact CG1-CG 3.59Å; V1021-E1025 PolarHBondContact O-N 3.35Å; S1022-E1025 PolarHBondContact O-N 3.41Å; E1025-R1070 PolarHBondContact O-NH1 2.98Å; E1025-R1070 IonicContact OE1-CZ 3.1Å; E1025-R1070 IonicContact OE1-NH1 2.68Å; E1025-R1070 PolarHBondContact OE1-NH1 3.28Å; E1025-R1070 IonicContact OE1-NH2 3.18Å; E1025-R1070 PolarHBondContact OE1-NH2 3.38Å; E1025-R1070 VanDerWaalsContact OE1-NH2 3.17Å
1026	Q	78.5	Confident	82.2	Confident	20 Å²	20	9.2 Å²	9.2	9%	0.093	5%	0.049	C	C	.	.	H	α-helix	trans	-104.2	-41.1	173.5	-67.7	-168.5	77.8	0	0	113.7	S1022 L1024 P1028 R1070	S1022-Q1026 VanDerWaalsContact O-CB 3.3Å; S1022-Q1026 WeakPolarHBondContact O-CB 3.46Å; S1022-Q1026 WeakPolarHBondContact O-CG 3.44Å; S1022-Q1026 PolarHBondContact O-N 2.83Å; S1022-Q1026 PolarHBondContact OG-NE2 3.47Å; L1024-Q1026 VanDerWaalsContact C-N 3.33Å; Q1026-P1028 VanDerWaalsContact C-CD 3.47Å; Q1026-R1070 WeakPolarHBondContact O-CB 3.38Å; Q1026-R1070 PolarHBondContact O-N 3.3Å
1027	W	83.2	Confident	82.3	Confident	5 Å²	5	14 Å²	14	2%	0.019	7%	0.066	C	C	.	.			trans	-129.2	59.9	-176.4	-56.9	-85.7	0	0	0	112.7	L1023 S1029 R1030 M1031 D1069 R1070 N1071 N1074 F1075 F1078	L1023-W1027 HydrophobicContact CD2-CE3 4.03Å; L1023-W1027 HydrophobicContact CD2-CZ3 4.23Å; L1023-W1027 PolarHBondContact O-N 2.96Å; W1027-S1029 VanDerWaalsContact C-N 3.27Å; W1027-S1029 PolarHBondContact O-N 3.18Å; W1027-R1030 HydrophobicContact CB-CB 4.5Å; W1027-M1031 VanDerWaalsContact O-CB 3.32Å; W1027-M1031 WeakPolarHBondContact O-CB 3.33Å; W1027-M1031 VanDerWaalsContact O-CG 3.24Å; W1027-M1031 WeakPolarHBondContact O-CG 3.47Å; W1027-M1031 PolarHBondContact O-N 3.43Å; W1027-D1069 WeakPolarHBondContact CA-OD1 3.25Å; W1027-R1070 PolarHBondContact NE1-O 2.96Å; W1027-N1071 PolarHBondContact NE1-O 3Å; W1027-N1074 HydrophobicContact CZ2-CB 4.12Å; W1027-F1075 HydrophobicContact CB-CD2 3.66Å; W1027-F1075 HydrophobicContact CB-CE2 3.77Å; W1027-F1075 AromaticContact CD1-CD2 3.89Å; W1027-F1075 HydrophobicContact CD2-CB 4.27Å; W1027-F1075 AromaticContact CD2-CD2 3.48Å; W1027-F1075 HydrophobicContact CD2-CD2 3.48Å; W1027-F1075 VanDerWaalsContact CD2-CD2 3.48Å; W1027-F1075 HydrophobicContact CD2-CE2 4.29Å; W1027-F1075 HydrophobicContact CD2-CG 4.35Å; W1027-F1075 AromaticContact CE3-CD2 3.83Å; W1027-F1075 HydrophobicContact CE3-CD2 3.83Å; W1027-F1075 HydrophobicContact CE3-CE2 4.4Å; W1027-F1075 HydrophobicContact CG-CB 4.28Å; W1027-F1075 AromaticContact CG-CD2 3.39Å; W1027-F1075 HydrophobicContact CG-CD2 3.39Å; W1027-F1075 HydrophobicContact CG-CE2 4.04Å; W1027-F1075 HydrophobicContact CG-CG 4.19Å; W1027-F1075 HydrophobicContact CZ2-CB 4.49Å; W1027-F1078 HydrophobicContact CE3-CD1 4.45Å; W1027-F1078 HydrophobicContact CH2-CB 4.14Å; W1027-F1078 AromaticContact CH2-CD1 3.87Å; W1027-F1078 HydrophobicContact CH2-CD1 3.87Å; W1027-F1078 HydrophobicContact CH2-CG 4.19Å; W1027-F1078 HydrophobicContact CZ3-CB 4.47Å; W1027-F1078 AromaticContact CZ3-CD1 3.45Å; W1027-F1078 HydrophobicContact CZ3-CD1 3.45Å; W1027-F1078 VanDerWaalsContact CZ3-CD1 3.45Å; W1027-F1078 AromaticContact CZ3-CE1 3.94Å; W1027-F1078 HydrophobicContact CZ3-CE1 3.94Å; W1027-F1078 HydrophobicContact CZ3-CG 4.22Å
1028	P	84.7	Confident	82.3	Confident	24 Å²	24	14 Å²	14	16%	0.156	7%	0.066	C	C	.	.	H	α-helix	trans	-60.3	-32.8	-173.5	25.5	-35.6	0	0	0	113.6	Q1026 C1032 L1068 L1105	Q1026-P1028 VanDerWaalsContact C-CD 3.47Å; P1028-C1032 PolarHBondContact O-N 3.38Å; P1028-L1068 WeakPolarHBondContact CD-O 3.09Å; P1028-L1068 HydrophobicContact CG-CB 3.97Å; P1028-L1068 WeakPolarHBondContact CG-O 3.48Å; P1028-L1105 HydrophobicContact CB-CD1 4.39Å
1029	S	80.3	Confident	82.5	Confident	1 Å²	1	16.1 Å²	16.1	1%	0.007	7%	0.074	C	C	.	.	H	α-helix	trans	-73.5	-50.1	-176.6	74.1	0	0	0	0	111.6	W1027 M1031 C1032 W1033 L1065 D1069	W1027-S1029 VanDerWaalsContact C-N 3.27Å; W1027-S1029 PolarHBondContact O-N 3.18Å; S1029-M1031 VanDerWaalsContact C-N 3.3Å; S1029-M1031 PolarHBondContact O-N 3.31Å; S1029-C1032 PolarHBondContact O-N 3.15Å; S1029-W1033 PolarHBondContact O-N 2.9Å; S1029-L1065 VanDerWaalsContact CB-O 3.23Å; S1029-L1065 WeakPolarHBondContact CB-O 3.35Å; S1029-L1065 PolarHBondContact OG-O 2.92Å; S1029-D1069 WeakPolarHBondContact CB-OD1 3.46Å; S1029-D1069 PolarHBondContact N-OD1 3.46Å; S1029-D1069 PolarHBondContact OG-OD1 3.3Å
1030	R	82.6	Confident	82.5	Confident	21 Å²	21	20.3 Å²	20.3	8%	0.079	9%	0.093	C	C	.	.	H	α-helix	trans	-60.7	-40	173.6	-71.9	177.6	-152.6	-142.9	7.8	111.8	W1027 W1033 L1034 Y1052 D1069 L1072 F1075	W1027-R1030 HydrophobicContact CB-CB 4.5Å; R1030-W1033 PolarHBondContact O-N 2.72Å; R1030-L1034 VanDerWaalsContact O-CB 3.26Å; R1030-L1034 WeakPolarHBondContact O-CB 3.44Å; R1030-L1034 PolarHBondContact O-N 3.29Å; R1030-Y1052 PolarHBondContact NH1-OH 3.13Å; R1030-D1069 WeakPolarHBondContact CD-OD2 3.39Å; R1030-D1069 WeakPolarHBondContact CG-OD2 3.39Å; R1030-D1069 IonicContact CZ-OD2 3.82Å; R1030-D1069 IonicContact NE-OD2 3.22Å; R1030-D1069 PolarHBondContact NE-OD2 3.07Å; R1030-L1072 PolarHBondContact NH2-O 3.17Å; R1030-F1075 HydrophobicContact CB-CE1 4.09Å; R1030-F1075 HydrophobicContact CB-CE2 4.14Å; R1030-F1075 HydrophobicContact CB-CZ 3.77Å; R1030-F1075 VanDerWaalsContact CD-CD1 3.46Å; R1030-F1075 HydrophobicContact CG-CE1 4.44Å
1031	M	87	Confident	82.2	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-64.6	-37.7	177.6	-73.3	-60.8	-68.2	0	0	112.2	W1020 L1023 L1024 W1027 S1029 L1034 I1035 F1075	W1020-M1031 HydrophobicContact CE3-CE 3.73Å; W1020-M1031 HydrophobicContact CH2-CE 4.29Å; W1020-M1031 HydrophobicContact CZ3-CE 3.45Å; W1020-M1031 VanDerWaalsContact CZ3-CE 3.45Å; L1023-M1031 HydrophobicContact CB-CE 3.87Å; L1023-M1031 HydrophobicContact CB-CG 4.09Å; L1023-M1031 HydrophobicContact CB-SD 3.78Å; L1023-M1031 HydrophobicContact CD1-CE 4.19Å; L1023-M1031 HydrophobicContact CD1-SD 4.19Å; L1023-M1031 HydrophobicContact CD2-SD 4.19Å; L1023-M1031 HydrophobicContact CG-SD 4.28Å; L1024-M1031 HydrophobicContact CD2-CB 4.01Å; L1024-M1031 HydrophobicContact CD2-CE 4.24Å; L1024-M1031 HydrophobicContact CD2-CG 4.44Å; W1027-M1031 VanDerWaalsContact O-CB 3.32Å; W1027-M1031 WeakPolarHBondContact O-CB 3.33Å; W1027-M1031 VanDerWaalsContact O-CG 3.24Å; W1027-M1031 WeakPolarHBondContact O-CG 3.47Å; W1027-M1031 PolarHBondContact O-N 3.43Å; S1029-M1031 VanDerWaalsContact C-N 3.3Å; S1029-M1031 PolarHBondContact O-N 3.31Å; M1031-L1034 HydrophobicContact CE-CD2 4.01Å; M1031-L1034 PolarHBondContact O-N 2.97Å; M1031-L1034 HydrophobicContact SD-CD2 3.86Å; M1031-I1035 HydrophobicContact CB-CD1 4.36Å; M1031-I1035 HydrophobicContact CE-CD1 4.27Å; M1031-I1035 HydrophobicContact CE-CG1 4.43Å; M1031-I1035 VanDerWaalsContact O-CB 3.28Å; M1031-I1035 WeakPolarHBondContact O-CB 3.37Å; M1031-I1035 VanDerWaalsContact O-CD1 3.29Å; M1031-I1035 WeakPolarHBondContact O-CD1 3.32Å; M1031-I1035 WeakPolarHBondContact O-CG1 3.23Å; M1031-I1035 PolarHBondContact O-N 3.02Å; M1031-F1075 HydrophobicContact SD-CE2 4.3Å; M1031-F1075 HydrophobicContact SD-CZ 4.41Å
1032	C	85.4	Confident	81.6	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.007	14%	0.136	C	C	.	.	H	α-helix	trans	-58	-51.8	172.3	-87.5	0	0	0	0	112.7	P1028 S1029 L1034 I1035 D1036 I1113	P1028-C1032 PolarHBondContact O-N 3.38Å; S1029-C1032 PolarHBondContact O-N 3.15Å; C1032-L1034 PolarHBondContact O-N 3.34Å; C1032-I1035 PolarHBondContact O-N 3.29Å; C1032-D1036 PolarHBondContact O-N 3.01Å; C1032-I1113 HydrophobicContact CB-CD1 3.34Å
1033	W	83	Confident	81.7	Confident	20 Å²	20	33 Å²	33	8%	0.076	16%	0.157	C	C	.	.	H	α-helix	trans	-54.9	-50.1	176.8	-81.1	103.9	0	0	0	112.1	S1029 R1030 D1036 R1037 L1055 P1060 I1113 L1120	S1029-W1033 PolarHBondContact O-N 2.9Å; R1030-W1033 PolarHBondContact O-N 2.72Å; W1033-D1036 PolarHBondContact O-N 3.47Å; W1033-R1037 PolarHBondContact O-N 2.96Å; W1033-L1055 HydrophobicContact CB-CD2 3.97Å; W1033-L1055 WeakPolarHBondContact O-CD2 3.41Å; W1033-P1060 HydrophobicContact CZ2-CG 4.08Å; W1033-I1113 HydrophobicContact CD2-CG2 3.69Å; W1033-I1113 HydrophobicContact CE3-CG2 3.92Å; W1033-I1113 HydrophobicContact CG-CD1 4.33Å; W1033-I1113 HydrophobicContact CG-CG2 4.06Å; W1033-I1113 HydrophobicContact CZ2-CG2 4.33Å; W1033-I1113 HydrophobicContact CZ3-CG2 4.34Å; W1033-L1120 HydrophobicContact CH2-CD1 4.36Å
1034	L	85.3	Confident	81.5	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-68.4	-33.1	-177.3	164.8	154.3	0	0	0	113	R1030 M1031 C1032 A1038 L1048 Y1052 F1075 L1079	R1030-L1034 VanDerWaalsContact O-CB 3.26Å; R1030-L1034 WeakPolarHBondContact O-CB 3.44Å; R1030-L1034 PolarHBondContact O-N 3.29Å; M1031-L1034 HydrophobicContact CE-CD2 4.01Å; M1031-L1034 PolarHBondContact O-N 2.97Å; M1031-L1034 HydrophobicContact SD-CD2 3.86Å; C1032-L1034 PolarHBondContact O-N 3.34Å; L1034-A1038 VanDerWaalsContact O-CB 3.29Å; L1034-A1038 WeakPolarHBondContact O-CB 3.23Å; L1034-A1038 PolarHBondContact O-N 3.4Å; L1034-L1048 HydrophobicContact CD1-CD1 4.39Å; L1034-L1048 HydrophobicContact CD1-CG 4.18Å; L1034-L1048 HydrophobicContact CD2-CD1 3.54Å; L1034-L1048 HydrophobicContact CD2-CD2 3.97Å; L1034-L1048 HydrophobicContact CD2-CG 3.81Å; L1034-L1048 HydrophobicContact CG-CD1 4.02Å; L1034-L1048 HydrophobicContact CG-CG 4.31Å; L1034-Y1052 HydrophobicContact CD1-CD2 4.04Å; L1034-Y1052 HydrophobicContact CD1-CG 4.31Å; L1034-F1075 HydrophobicContact CD1-CZ 4.46Å; L1034-L1079 HydrophobicContact CD1-CD1 4.35Å
1035	I	85.7	Confident	81.3	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-72.8	-42.5	175.8	-68.2	163	0	0	0	111.2	W1020 L1024 M1031 C1032 R1037 A1038 L1039 V1095 V1099 L1105	W1020-I1035 HydrophobicContact CH2-CD1 3.46Å; W1020-I1035 VanDerWaalsContact CH2-CD1 3.46Å; W1020-I1035 HydrophobicContact CH2-CG1 3.75Å; W1020-I1035 HydrophobicContact CZ2-CD1 4.24Å; W1020-I1035 HydrophobicContact CZ3-CD1 4.09Å; W1020-I1035 HydrophobicContact CZ3-CG1 4.14Å; L1024-I1035 HydrophobicContact CD2-CD1 3.95Å; M1031-I1035 HydrophobicContact CB-CD1 4.36Å; M1031-I1035 HydrophobicContact CE-CD1 4.27Å; M1031-I1035 HydrophobicContact CE-CG1 4.43Å; M1031-I1035 VanDerWaalsContact O-CB 3.28Å; M1031-I1035 WeakPolarHBondContact O-CB 3.37Å; M1031-I1035 VanDerWaalsContact O-CD1 3.29Å; M1031-I1035 WeakPolarHBondContact O-CD1 3.32Å; M1031-I1035 WeakPolarHBondContact O-CG1 3.23Å; M1031-I1035 PolarHBondContact O-N 3.02Å; C1032-I1035 PolarHBondContact O-N 3.29Å; I1035-R1037 VanDerWaalsContact C-N 3.27Å; I1035-R1037 PolarHBondContact O-N 3.39Å; I1035-A1038 PolarHBondContact O-N 3.28Å; I1035-L1039 HydrophobicContact CG2-CD1 4.15Å; I1035-L1039 HydrophobicContact CG2-CG 4.26Å; I1035-L1039 WeakPolarHBondContact O-CG 3.29Å; I1035-L1039 PolarHBondContact O-N 3.41Å; I1035-V1095 HydrophobicContact CB-CG1 4.49Å; I1035-V1095 HydrophobicContact CG1-CG1 4.18Å; I1035-V1095 HydrophobicContact CG2-CG1 4.01Å; I1035-V1099 HydrophobicContact CD1-CG2 4.49Å; I1035-V1099 HydrophobicContact CG2-CG2 3.67Å; I1035-L1105 HydrophobicContact CD1-CD2 4.23Å
1036	D	81	Confident	81.3	Confident	26 Å²	26	44.9 Å²	44.9	14%	0.139	22%	0.216	C	C	.	.	H	α-helix	trans	-60.3	-42.8	-179	-144.8	39.1	0	0	0	110.3	C1032 W1033 L1039 E1040 R1114	C1032-D1036 PolarHBondContact O-N 3.01Å; W1033-D1036 PolarHBondContact O-N 3.47Å; D1036-L1039 PolarHBondContact O-N 2.83Å; D1036-E1040 PolarHBondContact O-N 3.09Å; D1036-R1114 IonicContact OD1-CZ 3.09Å; D1036-R1114 IonicContact OD1-NE 3.74Å; D1036-R1114 PolarHBondContact OD1-NE 3.37Å; D1036-R1114 IonicContact OD1-NH2 3.48Å; D1036-R1114 PolarHBondContact OD1-NH2 2.85Å; D1036-R1114 WeakPolarHBondContact OD2-CG 3.36Å; D1036-R1114 IonicContact OD2-NE 3.25Å; D1036-R1114 PolarHBondContact OD2-NE 3.5Å
1037	R	80.2	Confident	81.6	Confident	105 Å²	105	46.4 Å²	46.4	40%	0.396	22%	0.224	S	C	.	.	H	α-helix	trans	-64.5	-40.1	171.7	-171.3	53.9	165.4	-174	-9.6	113.5	W1033 I1035 L1039 E1040 V1041 V1051 L1055	W1033-R1037 PolarHBondContact O-N 2.96Å; I1035-R1037 VanDerWaalsContact C-N 3.27Å; I1035-R1037 PolarHBondContact O-N 3.39Å; R1037-L1039 VanDerWaalsContact C-N 3.26Å; R1037-L1039 PolarHBondContact O-N 3.37Å; R1037-E1040 WeakPolarHBondContact CD-OE2 3.32Å; R1037-E1040 IonicContact CZ-OE2 2.72Å; R1037-E1040 IonicContact NE-OE2 2.91Å; R1037-E1040 IonicContact NH1-OE2 3.99Å; R1037-E1040 PolarHBondContact NH1-OE2 2.92Å; R1037-E1040 PolarHBondContact O-N 3.07Å; R1037-V1041 WeakPolarHBondContact O-CG2 3.32Å; R1037-V1041 PolarHBondContact O-N 3.44Å; R1037-V1051 HydrophobicContact CB-CG1 4.3Å; R1037-V1051 HydrophobicContact CG-CG1 3.97Å; R1037-L1055 HydrophobicContact CB-CD1 4.23Å; R1037-L1055 HydrophobicContact CB-CD2 4.15Å; R1037-L1055 HydrophobicContact CG-CD1 4.23Å
1038	A	82.3	Confident	81.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.7	-25.4	177.9	0	0	0	0	0	113.4	L1034 I1035 L1048 V1092 V1095	L1034-A1038 VanDerWaalsContact O-CB 3.29Å; L1034-A1038 WeakPolarHBondContact O-CB 3.23Å; L1034-A1038 PolarHBondContact O-N 3.4Å; I1035-A1038 PolarHBondContact O-N 3.28Å; A1038-L1048 HydrophobicContact CB-CD1 4.43Å; A1038-V1092 HydrophobicContact CB-CG2 4.44Å; A1038-V1092 WeakPolarHBondContact O-CG1 3.24Å; A1038-V1095 HydrophobicContact CB-CB 4.38Å; A1038-V1095 HydrophobicContact CB-CG1 4.03Å; A1038-V1095 HydrophobicContact CB-CG2 4.4Å
1039	L	80.8	Confident	81.4	Confident	62 Å²	62	46.2 Å²	46.2	33%	0.325	22%	0.224	S	C	.	.	H	α-helix	trans	-71.6	-35.9	173.7	-68.7	171.8	0	0	0	111.9	I1035 D1036 R1037 K1096	I1035-L1039 HydrophobicContact CG2-CD1 4.15Å; I1035-L1039 HydrophobicContact CG2-CG 4.26Å; I1035-L1039 WeakPolarHBondContact O-CG 3.29Å; I1035-L1039 PolarHBondContact O-N 3.41Å; D1036-L1039 PolarHBondContact O-N 2.83Å; R1037-L1039 VanDerWaalsContact C-N 3.26Å; R1037-L1039 PolarHBondContact O-N 3.37Å; L1039-K1096 HydrophobicContact CD2-CG 4.22Å
1040	E	79.5	Confident	81.4	Confident	107 Å²	107	50.4 Å²	50.4	50%	0.5	24%	0.243	S	C	.	.	H	α-helix	trans	-68.5	-33.5	175.3	-60.3	-177.6	134.8	0	0	113.4	D1036 R1037 H1042	D1036-E1040 PolarHBondContact O-N 3.09Å; R1037-E1040 WeakPolarHBondContact CD-OE2 3.32Å; R1037-E1040 IonicContact CZ-OE2 2.72Å; R1037-E1040 IonicContact NE-OE2 2.91Å; R1037-E1040 IonicContact NH1-OE2 3.99Å; R1037-E1040 PolarHBondContact NH1-OE2 2.92Å; R1037-E1040 PolarHBondContact O-N 3.07Å; E1040-H1042 PolarHBondContact O-N 3.41Å
1041	V	77.7	Confident	81.4	Confident	25 Å²	25	49.4 Å²	49.4	15%	0.152	24%	0.239	C	C	.	.			trans	-70.2	110.8	-176.2	172.2	0	0	0	0	110.6	R1037 N1043 V1092 K1096	R1037-V1041 WeakPolarHBondContact O-CG2 3.32Å; R1037-V1041 PolarHBondContact O-N 3.44Å; V1041-N1043 VanDerWaalsContact C-N 3.29Å; V1041-N1043 HydrophobicContact CG1-CB 4.32Å; V1041-N1043 PolarHBondContact O-N 3.33Å; V1041-V1092 HydrophobicContact CB-CG1 4.4Å; V1041-V1092 HydrophobicContact CB-CG2 4.4Å; V1041-V1092 HydrophobicContact CG1-CG1 4.36Å; V1041-V1092 HydrophobicContact CG1-CG2 4.1Å; V1041-V1092 WeakPolarHBondContact O-CG1 3.46Å; V1041-K1096 PolarHBondContact O-NZ 2.86Å
1042	H	73	Confident	81.2	Confident	162 Å²	162	50 Å²	50	75%	0.75	24%	0.241	S	C	*	.			trans	-65.8	-26.6	178.6	-61.5	-34.5	0	0	0	113.8	E1040 N1044 K1237	E1040-H1042 PolarHBondContact O-N 3.41Å; H1042-N1044 PolarHBondContact O-N 2.78Å; H1042-N1044 VanDerWaalsContact O-N 3.17Å; H1042-K1237 PolarHBondContact NE2-NZ 3.1Å
1043	N	80	Confident	81.1	Confident	81 Å²	81	54.9 Å²	54.9	43%	0.433	26%	0.261	S	S	.	.			trans	-79	100.3	-178.4	-174.4	-1	0	0	0	112	V1041 Q1045 L1046 V1092	V1041-N1043 VanDerWaalsContact C-N 3.29Å; V1041-N1043 HydrophobicContact CG1-CB 4.32Å; V1041-N1043 PolarHBondContact O-N 3.33Å; N1043-Q1045 PolarHBondContact O-N 3.2Å; N1043-Q1045 VanDerWaalsContact O-N 3.16Å; N1043-Q1045 WeakPolarHBondContact OD1-CB 3.35Å; N1043-Q1045 PolarHBondContact OD1-N 3.15Å; N1043-L1046 HydrophobicContact CB-CD1 4.18Å; N1043-L1046 PolarHBondContact O-N 3.43Å; N1043-V1092 WeakPolarHBondContact O-CB 3.43Å
1044	N	79.1	Confident	80.7	Confident	82 Å²	82	58.9 Å²	58.9	44%	0.439	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-13.5	179	-65.9	-16.9	0	0	0	114.7	H1042 G1093 K1096	H1042-N1044 PolarHBondContact O-N 2.78Å; H1042-N1044 VanDerWaalsContact O-N 3.17Å; N1044-G1093 PolarHBondContact O-N 3.22Å; N1044-K1096 WeakPolarHBondContact OD1-CD 3.44Å; N1044-K1096 PolarHBondContact OD1-NZ 2.88Å
1045	Q	78.6	Confident	80.3	Confident	168 Å²	168	59.7 Å²	59.7	79%	0.785	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-11	-179.6	-63.3	-175.6	-6.8	0	0	114.2	N1043	N1043-Q1045 PolarHBondContact O-N 3.2Å; N1043-Q1045 VanDerWaalsContact O-N 3.16Å; N1043-Q1045 WeakPolarHBondContact OD1-CB 3.35Å; N1043-Q1045 PolarHBondContact OD1-N 3.15Å
1046	L	80.4	Confident	79.9	Confident	33 Å²	33	63.4 Å²	63.4	17%	0.173	30%	0.301	C	S	.	.	S	Bend	trans	-60.6	139.9	179	-123.2	89.7	0	0	0	111.1	N1043 E1050 V1051 T1091 V1092	N1043-L1046 HydrophobicContact CB-CD1 4.18Å; N1043-L1046 PolarHBondContact O-N 3.43Å; L1046-E1050 HydrophobicContact CD2-CB 4.22Å; L1046-V1051 HydrophobicContact CB-CG2 4.38Å; L1046-V1051 HydrophobicContact CD2-CG2 3.75Å; L1046-T1091 CarbonylContact O-C 3.59Å; L1046-T1091 WeakPolarHBondContact O-CA 3.42Å; L1046-T1091 WeakPolarHBondContact O-CB 3.44Å; L1046-V1092 HydrophobicContact CB-CG2 3.83Å; L1046-V1092 PolarHBondContact O-N 3.39Å
1047	L	83	Confident	79.4	Confident	51 Å²	51	69.2 Å²	69.2	27%	0.267	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-74.6	146.7	174.9	-74	162.7	0	0	0	110.8	S1049 E1050 V1051 R1089 T1091	L1047-S1049 VanDerWaalsContact C-N 3.27Å; L1047-S1049 PolarHBondContact O-N 3.23Å; L1047-E1050 HydrophobicContact CB-CB 4.39Å; L1047-E1050 HydrophobicContact CB-CG 3.93Å; L1047-E1050 PolarHBondContact N-OE2 2.77Å; L1047-E1050 WeakPolarHBondContact O-CB 3.39Å; L1047-E1050 PolarHBondContact O-N 3.31Å; L1047-V1051 PolarHBondContact O-N 3.32Å; L1047-V1051 VanDerWaalsContact O-N 3.17Å; L1047-R1089 HydrophobicContact CD2-CB 3.92Å; L1047-T1091 HydrophobicContact CD2-CG2 4.46Å
1048	L	81.8	Confident	78.8	Confident	4 Å²	4	68.9 Å²	68.9	2%	0.021	33%	0.334	C	S	.	.	H	α-helix	trans	-67.7	-28.1	-176.1	-161.7	56.2	0	0	0	113	L1034 A1038 Y1052 L1090 V1095	L1034-L1048 HydrophobicContact CD1-CD1 4.39Å; L1034-L1048 HydrophobicContact CD1-CG 4.18Å; L1034-L1048 HydrophobicContact CD2-CD1 3.54Å; L1034-L1048 HydrophobicContact CD2-CD2 3.97Å; L1034-L1048 HydrophobicContact CD2-CG 3.81Å; L1034-L1048 HydrophobicContact CG-CD1 4.02Å; L1034-L1048 HydrophobicContact CG-CG 4.31Å; A1038-L1048 HydrophobicContact CB-CD1 4.43Å; L1048-Y1052 PolarHBondContact O-N 2.92Å; L1048-L1090 HydrophobicContact CB-CB 3.91Å; L1048-L1090 WeakPolarHBondContact CB-O 3.32Å; L1048-L1090 HydrophobicContact CD2-CB 3.63Å; L1048-L1090 HydrophobicContact CD2-CD1 3.74Å; L1048-L1090 HydrophobicContact CD2-CG 4.36Å; L1048-L1090 HydrophobicContact CG-CB 4.44Å; L1048-L1090 PolarHBondContact N-O 3.45Å; L1048-V1095 HydrophobicContact CD1-CG2 3.59Å; L1048-V1095 HydrophobicContact CD2-CG2 3.94Å; L1048-V1095 HydrophobicContact CG-CG2 4.4Å
1049	S	82.3	Confident	78.4	Confident	21 Å²	21	70.1 Å²	70.1	15%	0.147	34%	0.341	C	S	.	.	H	α-helix	trans	-71.6	-33	170.5	56.6	0	0	0	0	113	L1047 V1051 Y1052 Y1053 D1080	L1047-S1049 VanDerWaalsContact C-N 3.27Å; L1047-S1049 PolarHBondContact O-N 3.23Å; S1049-V1051 VanDerWaalsContact C-N 3.33Å; S1049-V1051 PolarHBondContact O-N 2.9Å; S1049-Y1052 WeakPolarHBondContact O-CB 3.1Å; S1049-Y1052 PolarHBondContact O-N 2.75Å; S1049-Y1053 WeakPolarHBondContact O-CD2 3.34Å; S1049-Y1053 PolarHBondContact O-N 2.98Å; S1049-D1080 WeakPolarHBondContact CB-OD1 3.23Å; S1049-D1080 PolarHBondContact OG-OD1 2.7Å
1050	E	81.6	Confident	77.6	Confident	89 Å²	89	69.5 Å²	69.5	42%	0.416	34%	0.34	S	S	.	.	H	α-helix	trans	-65.1	-37.7	173.4	-65	170.3	153.7	0	0	111.4	L1046 L1047 Q1054	L1046-E1050 HydrophobicContact CD2-CB 4.22Å; L1047-E1050 HydrophobicContact CB-CB 4.39Å; L1047-E1050 HydrophobicContact CB-CG 3.93Å; L1047-E1050 PolarHBondContact N-OE2 2.77Å; L1047-E1050 WeakPolarHBondContact O-CB 3.39Å; L1047-E1050 PolarHBondContact O-N 3.31Å; E1050-Q1054 WeakPolarHBondContact O-CG 3.28Å; E1050-Q1054 PolarHBondContact O-N 3.34Å
1051	V	81.1	Confident	76.7	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-66.6	-41.4	171.5	-178.7	0	0	0	0	110.9	R1037 L1046 L1047 S1049 Q1054 L1055 V1092	R1037-V1051 HydrophobicContact CB-CG1 4.3Å; R1037-V1051 HydrophobicContact CG-CG1 3.97Å; L1046-V1051 HydrophobicContact CB-CG2 4.38Å; L1046-V1051 HydrophobicContact CD2-CG2 3.75Å; L1047-V1051 PolarHBondContact O-N 3.32Å; L1047-V1051 VanDerWaalsContact O-N 3.17Å; S1049-V1051 VanDerWaalsContact C-N 3.33Å; S1049-V1051 PolarHBondContact O-N 2.9Å; V1051-Q1054 PolarHBondContact O-N 2.76Å; V1051-L1055 PolarHBondContact O-N 2.8Å; V1051-L1055 VanDerWaalsContact O-N 3.12Å; V1051-V1092 HydrophobicContact CG2-CG2 3.72Å
1052	Y	83.6	Confident	75.9	Confident	12 Å²	12	77.1 Å²	77.1	5%	0.047	39%	0.392	C	S	.	.	H	α-helix	trans	-60.6	-46	175.5	-174.4	-117.9	0	0	0	112.2	R1030 L1034 L1048 S1049 Q1054 L1055 K1056 I1059 F1075 E1076 L1079	R1030-Y1052 PolarHBondContact NH1-OH 3.13Å; L1034-Y1052 HydrophobicContact CD1-CD2 4.04Å; L1034-Y1052 HydrophobicContact CD1-CG 4.31Å; L1048-Y1052 PolarHBondContact O-N 2.92Å; S1049-Y1052 WeakPolarHBondContact O-CB 3.1Å; S1049-Y1052 PolarHBondContact O-N 2.75Å; Y1052-Q1054 PolarHBondContact O-N 2.7Å; Y1052-L1055 CarbonylContact O-C 3.55Å; Y1052-L1055 PolarHBondContact O-N 3.12Å; Y1052-K1056 HydrophobicContact CE1-CD 4.31Å; Y1052-K1056 WeakPolarHBondContact O-CB 3.47Å; Y1052-K1056 PolarHBondContact O-N 2.87Å; Y1052-I1059 HydrophobicContact CD2-CD1 4.41Å; Y1052-I1059 HydrophobicContact CE2-CD1 3.72Å; Y1052-F1075 HydrophobicContact CD1-CE1 4.32Å; Y1052-F1075 AromaticContact CD2-CE1 3.89Å; Y1052-F1075 HydrophobicContact CD2-CE1 3.89Å; Y1052-F1075 HydrophobicContact CE1-CD1 4.15Å; Y1052-F1075 HydrophobicContact CE1-CE1 4.02Å; Y1052-F1075 HydrophobicContact CE2-CD1 4.28Å; Y1052-F1075 AromaticContact CE2-CE1 3.58Å; Y1052-F1075 HydrophobicContact CE2-CE1 3.58Å; Y1052-F1075 HydrophobicContact CG-CE1 4.25Å; Y1052-F1075 AromaticContact CZ-CD1 3.88Å; Y1052-F1075 AromaticContact CZ-CE1 3.64Å; Y1052-E1076 HydrophobicContact CE1-CG 3.98Å; Y1052-L1079 HydrophobicContact CD1-CD1 3.88Å; Y1052-L1079 HydrophobicContact CD2-CD1 4.48Å; Y1052-L1079 HydrophobicContact CG-CD1 3.83Å
1053	Y	82.2	Confident	75.3	Confident	105 Å²	105	70.5 Å²	70.5	41%	0.412	36%	0.361	S	S	.	.	H	α-helix	trans	-67.5	-21.3	179.1	-75.2	-58.8	0	0	0	113.8	S1049 K1056	S1049-Y1053 WeakPolarHBondContact O-CD2 3.34Å; S1049-Y1053 PolarHBondContact O-N 2.98Å; Y1053-K1056 HydrophobicContact CD1-CD 4.29Å; Y1053-K1056 HydrophobicContact CE1-CD 4.41Å
1054	Q	75.9	Confident	74.5	Confident	103 Å²	103	72.2 Å²	72.2	48%	0.481	37%	0.371	S	S	.	.	H	α-helix	trans	-77.7	-29.2	168	-69.9	170.1	31.9	0	0	112.9	E1050 V1051 Y1052	E1050-Q1054 WeakPolarHBondContact O-CG 3.28Å; E1050-Q1054 PolarHBondContact O-N 3.34Å; V1051-Q1054 PolarHBondContact O-N 2.76Å; Y1052-Q1054 PolarHBondContact O-N 2.7Å
1055	L	77.6	Confident	74.1	Confident	17 Å²	17	69.3 Å²	69.3	9%	0.089	36%	0.355	C	S	.	.	H	α-helix	trans	-91.5	-23.3	-177	-164.6	66.5	0	0	0	113.3	W1033 R1037 V1051 Y1052 D1057 H1058 I1059	W1033-L1055 HydrophobicContact CB-CD2 3.97Å; W1033-L1055 WeakPolarHBondContact O-CD2 3.41Å; R1037-L1055 HydrophobicContact CB-CD1 4.23Å; R1037-L1055 HydrophobicContact CB-CD2 4.15Å; R1037-L1055 HydrophobicContact CG-CD1 4.23Å; V1051-L1055 PolarHBondContact O-N 2.8Å; V1051-L1055 VanDerWaalsContact O-N 3.12Å; Y1052-L1055 CarbonylContact O-C 3.55Å; Y1052-L1055 PolarHBondContact O-N 3.12Å; L1055-D1057 VanDerWaalsContact C-N 3.26Å; L1055-D1057 PolarHBondContact O-N 3.39Å; L1055-D1057 VanDerWaalsContact O-N 3.09Å; L1055-H1058 HydrophobicContact CD1-CB 4.43Å; L1055-H1058 WeakPolarHBondContact O-CA 3.39Å; L1055-H1058 WeakPolarHBondContact O-CB 3.47Å; L1055-H1058 PolarHBondContact O-N 2.96Å; L1055-I1059 HydrophobicContact CD2-CD1 4.33Å; L1055-I1059 HydrophobicContact CD2-CG1 4.42Å; L1055-I1059 HydrophobicContact CG-CD1 4.33Å; L1055-I1059 HydrophobicContact CG-CG1 4.12Å; L1055-I1059 PolarHBondContact O-N 2.78Å
1056	K	76.9	Confident	73.5	Confident	79 Å²	79	62.8 Å²	62.8	34%	0.343	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-49.9	-40.1	-169.9	-178.5	166.7	175.2	166.9	0	114.2	Y1052 Y1053 H1058 E1076	Y1052-K1056 HydrophobicContact CE1-CD 4.31Å; Y1052-K1056 WeakPolarHBondContact O-CB 3.47Å; Y1052-K1056 PolarHBondContact O-N 2.87Å; Y1053-K1056 HydrophobicContact CD1-CD 4.29Å; Y1053-K1056 HydrophobicContact CE1-CD 4.41Å; K1056-H1058 VanDerWaalsContact C-N 3.26Å; K1056-H1058 PolarHBondContact O-N 2.94Å; K1056-E1076 VanDerWaalsContact CE-OE1 3.27Å; K1056-E1076 WeakPolarHBondContact CE-OE1 3.49Å; K1056-E1076 IonicContact NZ-OE1 2.74Å; K1056-E1076 PolarHBondContact NZ-OE1 3.03Å; K1056-E1076 IonicContact NZ-OE2 3.1Å; K1056-E1076 PolarHBondContact NZ-OE2 2.99Å
1057	D	70.7	Confident	72.8	Confident	148 Å²	148	68.5 Å²	68.5	79%	0.791	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-75.1	-11.3	-179	-59.7	-24.6	0	0	0	113.9	L1055	L1055-D1057 VanDerWaalsContact C-N 3.26Å; L1055-D1057 PolarHBondContact O-N 3.39Å; L1055-D1057 VanDerWaalsContact O-N 3.09Å
1058	H	67.8	Low	72.2	Confident	98 Å²	98	70.1 Å²	70.1	45%	0.454	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-104.3	-9.3	-177	-55.9	79.1	0	0	0	113.3	L1055 K1056	L1055-H1058 HydrophobicContact CD1-CB 4.43Å; L1055-H1058 WeakPolarHBondContact O-CA 3.39Å; L1055-H1058 WeakPolarHBondContact O-CB 3.47Å; L1055-H1058 PolarHBondContact O-N 2.96Å; K1056-H1058 VanDerWaalsContact C-N 3.26Å; K1056-H1058 PolarHBondContact O-N 2.94Å
1059	I	72.1	Confident	71.7	Confident	25 Å²	25	70.3 Å²	70.3	13%	0.128	36%	0.36	C	S	.	.	S	Bend	trans	-82.9	124.4	179.3	-56.3	174.7	0	0	0	108.9	Y1052 L1055 A1061	Y1052-I1059 HydrophobicContact CD2-CD1 4.41Å; Y1052-I1059 HydrophobicContact CE2-CD1 3.72Å; L1055-I1059 HydrophobicContact CD2-CD1 4.33Å; L1055-I1059 HydrophobicContact CD2-CG1 4.42Å; L1055-I1059 HydrophobicContact CG-CD1 4.33Å; L1055-I1059 HydrophobicContact CG-CG1 4.12Å; L1055-I1059 PolarHBondContact O-N 2.78Å; I1059-A1061 PolarHBondContact O-N 3.18Å
1060	P	65.1	Low	70.9	Confident	49 Å²	49	73.9 Å²	73.9	32%	0.318	37%	0.371	S	S	.	.			trans	-66	119.3	-179.3	26	-33.7	0	0	0	111.6	W1033 Q1062 D1063	W1033-P1060 HydrophobicContact CZ2-CG 4.08Å; P1060-Q1062 PolarHBondContact O-N 3.2Å; P1060-D1063 HydrophobicContact CB-CB 4.41Å; P1060-D1063 HydrophobicContact CG-CB 4.14Å
1061	A	61	Low	70.1	Confident	100 Å²	100	73 Å²	73	83%	0.826	37%	0.369	S	S	*	.	S	Bend	trans	-72.7	-9.6	-176.1	0	0	0	0	0	114.9	I1059	I1059-A1061 PolarHBondContact O-N 3.18Å
1062	Q	59.5	Low	69.3	Low	193 Å²	193	77.1 Å²	77.1	90%	0.902	39%	0.39	S	S	*	.	S	Bend	trans	-132.5	101.9	172.4	-72.5	-175.9	-22.9	0	0	108.4	P1060	P1060-Q1062 PolarHBondContact O-N 3.2Å
1063	D	61	Low	68.4	Low	22 Å²	22	85.2 Å²	85.2	12%	0.118	43%	0.429	C	S	.	.			trans	-155.1	139.6	-179.7	-168.1	1	0	0	0	109.6	P1060 L1065 M1066 R1116	P1060-D1063 HydrophobicContact CB-CB 4.41Å; P1060-D1063 HydrophobicContact CG-CB 4.14Å; D1063-L1065 PolarHBondContact O-N 3.39Å; D1063-M1066 HydrophobicContact CB-CG 4.36Å; D1063-M1066 VanDerWaalsContact O-CB 3.3Å; D1063-M1066 WeakPolarHBondContact O-CB 3.38Å; D1063-M1066 PolarHBondContact O-N 2.92Å; D1063-R1116 IonicContact OD1-CZ 2.62Å; D1063-R1116 IonicContact OD1-NH1 3.05Å; D1063-R1116 PolarHBondContact OD1-NH1 3.23Å; D1063-R1116 IonicContact OD1-NH2 3.6Å; D1063-R1116 PolarHBondContact OD1-NH2 3.43Å; D1063-R1116 IonicContact OD2-CZ 3.21Å; D1063-R1116 IonicContact OD2-NH1 2.91Å; D1063-R1116 PolarHBondContact OD2-NH1 3.05Å; D1063-R1116 IonicContact OD2-NH2 3.92Å
1064	D	63.5	Low	67.8	Low	118 Å²	118	84.2 Å²	84.2	63%	0.631	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-63.5	-25.9	-177.1	-67.4	-50.5	0	0	0	112.5	M1066 Q1067	D1064-M1066 PolarHBondContact O-N 3.46Å; D1064-Q1067 VanDerWaalsContact O-CB 3.32Å; D1064-Q1067 WeakPolarHBondContact O-CB 3.41Å; D1064-Q1067 WeakPolarHBondContact O-CG 3.46Å; D1064-Q1067 PolarHBondContact O-N 3.43Å; D1064-Q1067 VanDerWaalsContact O-N 3.08Å; D1064-Q1067 PolarHBondContact OD1-NE2 3.5Å; D1064-Q1067 VanDerWaalsContact OD1-NE2 3.1Å
1065	L	70.1	Confident	67.9	Low	21 Å²	21	79.3 Å²	79.3	11%	0.11	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-60.8	-25.6	173.4	-63.7	178.4	0	0	0	113.1	S1029 D1063 Q1067 L1068 L1109 L1112 I1113	S1029-L1065 VanDerWaalsContact CB-O 3.23Å; S1029-L1065 WeakPolarHBondContact CB-O 3.35Å; S1029-L1065 PolarHBondContact OG-O 2.92Å; D1063-L1065 PolarHBondContact O-N 3.39Å; L1065-Q1067 PolarHBondContact O-N 3.33Å; L1065-L1068 VanDerWaalsContact O-CD1 3.25Å; L1065-L1068 WeakPolarHBondContact O-CD1 3.31Å; L1065-L1068 PolarHBondContact O-N 3.43Å; L1065-L1109 HydrophobicContact CD2-CD1 4.16Å; L1065-L1112 HydrophobicContact CD2-CD1 4.44Å; L1065-I1113 HydrophobicContact CD1-CD1 4.41Å; L1065-I1113 HydrophobicContact CD1-CG1 4.01Å
1066	M	65.8	Low	67.7	Low	31 Å²	31	81.2 Å²	81.2	15%	0.153	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-69	-14.2	177	-64.5	-69.3	-67.8	0	0	112.8	D1063 D1064 L1068 D1069 L1072	D1063-M1066 HydrophobicContact CB-CG 4.36Å; D1063-M1066 VanDerWaalsContact O-CB 3.3Å; D1063-M1066 WeakPolarHBondContact O-CB 3.38Å; D1063-M1066 PolarHBondContact O-N 2.92Å; D1064-M1066 PolarHBondContact O-N 3.46Å; M1066-L1068 PolarHBondContact O-N 3.17Å; M1066-D1069 PolarHBondContact O-N 3.4Å; M1066-L1072 HydrophobicContact CE-CD2 4.01Å
1067	Q	65.2	Low	67.4	Low	153 Å²	153	80.2 Å²	80.2	72%	0.715	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-71.8	-13.5	175.3	-57	-177.2	38.8	0	0	112.9	D1064 L1065	D1064-Q1067 VanDerWaalsContact O-CB 3.32Å; D1064-Q1067 WeakPolarHBondContact O-CB 3.41Å; D1064-Q1067 WeakPolarHBondContact O-CG 3.46Å; D1064-Q1067 PolarHBondContact O-N 3.43Å; D1064-Q1067 VanDerWaalsContact O-N 3.08Å; D1064-Q1067 PolarHBondContact OD1-NE2 3.5Å; D1064-Q1067 VanDerWaalsContact OD1-NE2 3.1Å; L1065-Q1067 PolarHBondContact O-N 3.33Å
1068	L	70.5	Confident	67.5	Low	84 Å²	84	74.3 Å²	74.3	44%	0.44	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-81.7	-14.2	174.6	-68.3	89.2	0	0	0	113.1	P1028 L1065 M1066 L1109	P1028-L1068 WeakPolarHBondContact CD-O 3.09Å; P1028-L1068 HydrophobicContact CG-CB 3.97Å; P1028-L1068 WeakPolarHBondContact CG-O 3.48Å; L1065-L1068 VanDerWaalsContact O-CD1 3.25Å; L1065-L1068 WeakPolarHBondContact O-CD1 3.31Å; L1065-L1068 PolarHBondContact O-N 3.43Å; M1066-L1068 PolarHBondContact O-N 3.17Å; L1068-L1109 HydrophobicContact CD2-CD1 3.97Å; L1068-L1109 HydrophobicContact CD2-CD2 4.48Å
1069	D	72.7	Confident	67.8	Low	9 Å²	9	70.8 Å²	70.8	5%	0.048	38%	0.38	C	S	.	.	S	Bend	trans	-83.4	121.1	179.3	-87.5	25.4	0	0	0	111.7	W1027 S1029 R1030 M1066 L1072	W1027-D1069 WeakPolarHBondContact CA-OD1 3.25Å; S1029-D1069 WeakPolarHBondContact CB-OD1 3.46Å; S1029-D1069 PolarHBondContact N-OD1 3.46Å; S1029-D1069 PolarHBondContact OG-OD1 3.3Å; R1030-D1069 WeakPolarHBondContact CD-OD2 3.39Å; R1030-D1069 WeakPolarHBondContact CG-OD2 3.39Å; R1030-D1069 IonicContact CZ-OD2 3.82Å; R1030-D1069 IonicContact NE-OD2 3.22Å; R1030-D1069 PolarHBondContact NE-OD2 3.07Å; M1066-D1069 PolarHBondContact O-N 3.4Å; D1069-L1072 HydrophobicContact CB-CD1 4.4Å; D1069-L1072 WeakPolarHBondContact O-CD1 3.3Å
1070	R	64.8	Low	67.6	Low	95 Å²	95	72.8 Å²	72.8	36%	0.358	39%	0.391	S	S	.	.	S	Bend	trans	-77.3	128.4	172.1	-62.2	177.2	176.3	144.5	-0.3	109.7	E1025 Q1026 W1027	E1025-R1070 PolarHBondContact O-NH1 2.98Å; E1025-R1070 IonicContact OE1-CZ 3.1Å; E1025-R1070 IonicContact OE1-NH1 2.68Å; E1025-R1070 PolarHBondContact OE1-NH1 3.28Å; E1025-R1070 IonicContact OE1-NH2 3.18Å; E1025-R1070 PolarHBondContact OE1-NH2 3.38Å; E1025-R1070 VanDerWaalsContact OE1-NH2 3.17Å; Q1026-R1070 WeakPolarHBondContact O-CB 3.38Å; Q1026-R1070 PolarHBondContact O-N 3.3Å; W1027-R1070 PolarHBondContact NE1-O 2.96Å
1071	N	65	Low	67.5	Low	72 Å²	72	71.9 Å²	71.9	39%	0.385	39%	0.386	S	S	.	.			trans	55.7	76.9	177.6	-59.3	-33.7	0	0	0	113.8	W1027 E1073 N1074	W1027-N1071 PolarHBondContact NE1-O 3Å; N1071-E1073 PolarHBondContact O-N 3.48Å; N1071-E1073 VanDerWaalsContact O-N 3.07Å; N1071-N1074 HydrophobicContact CB-CB 4.39Å; N1071-N1074 PolarHBondContact O-N 3.12Å
1072	L	64.9	Low	67	Low	86 Å²	86	75.9 Å²	75.9	45%	0.45	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-25.4	-176.8	-84.1	79.7	0	0	0	115	R1030 M1066 D1069	R1030-L1072 PolarHBondContact NH2-O 3.17Å; M1066-L1072 HydrophobicContact CE-CD2 4.01Å; D1069-L1072 HydrophobicContact CB-CD1 4.4Å; D1069-L1072 WeakPolarHBondContact O-CD1 3.3Å
1073	E	64	Low	66.7	Low	181 Å²	181	67.6 Å²	67.6	85%	0.846	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-31.4	-176.6	-59.2	-172.6	163.9	0	0	113.1	N1071 F1075	N1071-E1073 PolarHBondContact O-N 3.48Å; N1071-E1073 VanDerWaalsContact O-N 3.07Å; E1073-F1075 PolarHBondContact O-N 3.5Å
1074	N	70.6	Confident	66.6	Low	85 Å²	85	67.9 Å²	67.9	46%	0.455	35%	0.352	S	S	.	.	H	α-helix	trans	-83.9	-10.5	-168	-71.9	-24.9	0	0	0	114.4	W1027 N1071 E1076 G1077 F1078	W1027-N1074 HydrophobicContact CZ2-CB 4.12Å; N1071-N1074 HydrophobicContact CB-CB 4.39Å; N1071-N1074 PolarHBondContact O-N 3.12Å; N1074-E1076 PolarHBondContact O-N 2.92Å; N1074-G1077 PolarHBondContact O-N 3.27Å; N1074-F1078 PolarHBondContact O-N 2.93Å; N1074-F1078 VanDerWaalsContact O-N 3.07Å
1075	F	76.7	Confident	66.4	Low	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-57.9	-48.4	-176.6	-176.1	-110.3	0	0	0	113.1	L1023 W1027 R1030 M1031 L1034 Y1052 E1073 F1078 L1079	L1023-F1075 HydrophobicContact CD2-CD2 4.22Å; L1023-F1075 HydrophobicContact CD2-CE2 3.79Å; W1027-F1075 HydrophobicContact CB-CD2 3.66Å; W1027-F1075 HydrophobicContact CB-CE2 3.77Å; W1027-F1075 AromaticContact CD1-CD2 3.89Å; W1027-F1075 HydrophobicContact CD2-CB 4.27Å; W1027-F1075 AromaticContact CD2-CD2 3.48Å; W1027-F1075 HydrophobicContact CD2-CD2 3.48Å; W1027-F1075 VanDerWaalsContact CD2-CD2 3.48Å; W1027-F1075 HydrophobicContact CD2-CE2 4.29Å; W1027-F1075 HydrophobicContact CD2-CG 4.35Å; W1027-F1075 AromaticContact CE3-CD2 3.83Å; W1027-F1075 HydrophobicContact CE3-CD2 3.83Å; W1027-F1075 HydrophobicContact CE3-CE2 4.4Å; W1027-F1075 HydrophobicContact CG-CB 4.28Å; W1027-F1075 AromaticContact CG-CD2 3.39Å; W1027-F1075 HydrophobicContact CG-CD2 3.39Å; W1027-F1075 HydrophobicContact CG-CE2 4.04Å; W1027-F1075 HydrophobicContact CG-CG 4.19Å; W1027-F1075 HydrophobicContact CZ2-CB 4.49Å; R1030-F1075 HydrophobicContact CB-CE1 4.09Å; R1030-F1075 HydrophobicContact CB-CE2 4.14Å; R1030-F1075 HydrophobicContact CB-CZ 3.77Å; R1030-F1075 VanDerWaalsContact CD-CD1 3.46Å; R1030-F1075 HydrophobicContact CG-CE1 4.44Å; M1031-F1075 HydrophobicContact SD-CE2 4.3Å; M1031-F1075 HydrophobicContact SD-CZ 4.41Å; L1034-F1075 HydrophobicContact CD1-CZ 4.46Å; Y1052-F1075 HydrophobicContact CD1-CE1 4.32Å; Y1052-F1075 AromaticContact CD2-CE1 3.89Å; Y1052-F1075 HydrophobicContact CD2-CE1 3.89Å; Y1052-F1075 HydrophobicContact CE1-CD1 4.15Å; Y1052-F1075 HydrophobicContact CE1-CE1 4.02Å; Y1052-F1075 HydrophobicContact CE2-CD1 4.28Å; Y1052-F1075 AromaticContact CE2-CE1 3.58Å; Y1052-F1075 HydrophobicContact CE2-CE1 3.58Å; Y1052-F1075 HydrophobicContact CG-CE1 4.25Å; Y1052-F1075 AromaticContact CZ-CD1 3.88Å; Y1052-F1075 AromaticContact CZ-CE1 3.64Å; E1073-F1075 PolarHBondContact O-N 3.5Å; F1075-F1078 PolarHBondContact O-N 3.18Å; F1075-L1079 HydrophobicContact CD1-CD1 3.98Å; F1075-L1079 HydrophobicContact CE1-CD1 3.36Å; F1075-L1079 HydrophobicContact CE1-CG 4.17Å; F1075-L1079 HydrophobicContact CE2-CD1 4.34Å; F1075-L1079 HydrophobicContact CE2-CG 4.41Å; F1075-L1079 HydrophobicContact CZ-CD1 3.6Å; F1075-L1079 HydrophobicContact CZ-CG 4.13Å; F1075-L1079 PolarHBondContact O-N 3.34Å
1076	E	74.7	Confident	65.9	Low	57 Å²	57	69.6 Å²	69.6	27%	0.266	37%	0.374	S	S	.	.	H	α-helix	trans	-68.6	-41.4	-176.3	-55	-162.1	177	0	0	111.1	Y1052 K1056 N1074 F1078 L1079 D1080	Y1052-E1076 HydrophobicContact CE1-CG 3.98Å; K1056-E1076 VanDerWaalsContact CE-OE1 3.27Å; K1056-E1076 WeakPolarHBondContact CE-OE1 3.49Å; K1056-E1076 IonicContact NZ-OE1 2.74Å; K1056-E1076 PolarHBondContact NZ-OE1 3.03Å; K1056-E1076 IonicContact NZ-OE2 3.1Å; K1056-E1076 PolarHBondContact NZ-OE2 2.99Å; N1074-E1076 PolarHBondContact O-N 2.92Å; E1076-F1078 PolarHBondContact O-N 3.48Å; E1076-L1079 PolarHBondContact O-N 3.31Å; E1076-D1080 WeakPolarHBondContact O-CB 3.41Å; E1076-D1080 PolarHBondContact O-N 2.73Å
1077	G	69.6	Low	65.7	Low	58 Å²	58	72.1 Å²	72.1	60%	0.598	40%	0.4	S	S	*	.	H	α-helix	trans	-63	-26.1	174.3	0	0	0	0	0	113.8	N1074 S1081	N1074-G1077 PolarHBondContact O-N 3.27Å; G1077-S1081 PolarHBondContact O-N 2.99Å
1078	F	72.8	Confident	65.8	Low	24 Å²	24	67.1 Å²	67.1	11%	0.105	38%	0.376	C	S	.	.	H	α-helix	trans	-82.7	-42.3	175.7	-168.7	-126.8	0	0	0	112.7	Y982 H1019 L1023 W1027 N1074 F1075 E1076 S1081	Y982-F1078 HydrophobicContact CD2-CD2 4.1Å; Y982-F1078 AromaticContact CD2-CE2 3.6Å; Y982-F1078 HydrophobicContact CD2-CE2 3.6Å; Y982-F1078 HydrophobicContact CD2-CZ 4.27Å; Y982-F1078 AromaticContact CE2-CD2 3.94Å; Y982-F1078 HydrophobicContact CE2-CD2 3.94Å; Y982-F1078 HydrophobicContact CE2-CE1 4.29Å; Y982-F1078 AromaticContact CE2-CE2 3.13Å; Y982-F1078 HydrophobicContact CE2-CE2 3.13Å; Y982-F1078 AromaticContact CE2-CZ 3.34Å; Y982-F1078 HydrophobicContact CE2-CZ 3.34Å; Y982-F1078 HydrophobicContact CG-CE2 4.49Å; Y982-F1078 AromaticContact CZ-CE2 3.69Å; Y982-F1078 AromaticContact CZ-CZ 3.62Å; Y982-F1078 WeakPolarHBondContact OH-CZ 3.46Å; H1019-F1078 AromaticContact CE1-CD1 3.77Å; H1019-F1078 AromaticContact CE1-CD2 3.96Å; H1019-F1078 AromaticContact CE1-CE1 3.49Å; H1019-F1078 VanDerWaalsContact CE1-CE1 3.49Å; H1019-F1078 WeakPolarHBondContact CE1-CE1 3.48Å; H1019-F1078 AromaticContact CE1-CE2 3.66Å; H1019-F1078 AromaticContact CE1-CZ 3.43Å; H1019-F1078 VanDerWaalsContact CE1-CZ 3.43Å; H1019-F1078 WeakPolarHBondContact CE1-CZ 3.43Å; H1019-F1078 PolarHBondContact CE1-O 3.45Å; H1019-F1078 AromaticContact ND1-CE1 3.49Å; H1019-F1078 WeakPolarHBondContact ND1-CE1 3.46Å; H1019-F1078 AromaticContact ND1-CE2 3.48Å; H1019-F1078 WeakPolarHBondContact ND1-CE2 3.49Å; H1019-F1078 AromaticContact ND1-CZ 3.06Å; H1019-F1078 WeakPolarHBondContact ND1-CZ 3.46Å; L1023-F1078 HydrophobicContact CD2-CD1 3.67Å; L1023-F1078 HydrophobicContact CD2-CE1 4.02Å; L1023-F1078 HydrophobicContact CG-CD1 4.07Å; L1023-F1078 HydrophobicContact CG-CE1 3.88Å; W1027-F1078 HydrophobicContact CE3-CD1 4.45Å; W1027-F1078 HydrophobicContact CH2-CB 4.14Å; W1027-F1078 AromaticContact CH2-CD1 3.87Å; W1027-F1078 HydrophobicContact CH2-CD1 3.87Å; W1027-F1078 HydrophobicContact CH2-CG 4.19Å; W1027-F1078 HydrophobicContact CZ3-CB 4.47Å; W1027-F1078 AromaticContact CZ3-CD1 3.45Å; W1027-F1078 HydrophobicContact CZ3-CD1 3.45Å; W1027-F1078 VanDerWaalsContact CZ3-CD1 3.45Å; W1027-F1078 AromaticContact CZ3-CE1 3.94Å; W1027-F1078 HydrophobicContact CZ3-CE1 3.94Å; W1027-F1078 HydrophobicContact CZ3-CG 4.22Å; N1074-F1078 PolarHBondContact O-N 2.93Å; N1074-F1078 VanDerWaalsContact O-N 3.07Å; F1075-F1078 PolarHBondContact O-N 3.18Å; E1076-F1078 PolarHBondContact O-N 3.48Å; F1078-S1081 WeakPolarHBondContact O-CB 3.05Å; F1078-S1081 PolarHBondContact O-N 3.32Å; F1078-S1081 PolarHBondContact O-OG 3.07Å
1079	L	74.6	Confident	65.9	Low	23 Å²	23	67.3 Å²	67.3	12%	0.12	37%	0.371	C	S	.	.	H	α-helix	trans	-61.9	-44.6	173.7	-78.5	-177.2	0	0	0	112.4	L1023 L1034 Y1052 F1075 E1076 S1081	L1023-L1079 HydrophobicContact CD1-CD2 4.01Å; L1023-L1079 HydrophobicContact CD2-CD2 3.91Å; L1023-L1079 HydrophobicContact CD2-CG 4.43Å; L1034-L1079 HydrophobicContact CD1-CD1 4.35Å; Y1052-L1079 HydrophobicContact CD1-CD1 3.88Å; Y1052-L1079 HydrophobicContact CD2-CD1 4.48Å; Y1052-L1079 HydrophobicContact CG-CD1 3.83Å; F1075-L1079 HydrophobicContact CD1-CD1 3.98Å; F1075-L1079 HydrophobicContact CE1-CD1 3.36Å; F1075-L1079 HydrophobicContact CE1-CG 4.17Å; F1075-L1079 HydrophobicContact CE2-CD1 4.34Å; F1075-L1079 HydrophobicContact CE2-CG 4.41Å; F1075-L1079 HydrophobicContact CZ-CD1 3.6Å; F1075-L1079 HydrophobicContact CZ-CG 4.13Å; F1075-L1079 PolarHBondContact O-N 3.34Å; E1076-L1079 PolarHBondContact O-N 3.31Å; L1079-S1081 PolarHBondContact O-N 3.45Å
1080	D	68.4	Low	66.3	Low	68 Å²	68	67.2 Å²	67.2	36%	0.364	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	11.9	179.8	-103	25.4	0	0	0	113.2	S1049 E1076 K1082	S1049-D1080 WeakPolarHBondContact CB-OD1 3.23Å; S1049-D1080 PolarHBondContact OG-OD1 2.7Å; E1076-D1080 WeakPolarHBondContact O-CB 3.41Å; E1076-D1080 PolarHBondContact O-N 2.73Å; D1080-K1082 WeakPolarHBondContact O-CG 3.43Å; D1080-K1082 PolarHBondContact O-N 3.37Å
1081	S	61.2	Low	67.1	Low	30 Å²	30	64 Å²	64	21%	0.21	36%	0.362	C	S	.	.			trans	-58.4	102.4	-171.8	58.3	0	0	0	0	112.5	G1077 F1078 L1079 G1083 I1084	G1077-S1081 PolarHBondContact O-N 2.99Å; F1078-S1081 WeakPolarHBondContact O-CB 3.05Å; F1078-S1081 PolarHBondContact O-N 3.32Å; F1078-S1081 PolarHBondContact O-OG 3.07Å; L1079-S1081 PolarHBondContact O-N 3.45Å; S1081-G1083 PolarHBondContact O-N 3.25Å; S1081-I1084 PolarHBondContact O-N 3.24Å; S1081-I1084 WeakPolarHBondContact OG-CD1 3.29Å
1082	K	52.6	Low	68	Low	183 Å²	183	60.6 Å²	60.6	80%	0.796	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-10.6	-170.7	-63	-179.6	-177.8	170.6	0	114.2	D1080	D1080-K1082 WeakPolarHBondContact O-CG 3.43Å; D1080-K1082 PolarHBondContact O-N 3.37Å
1083	G	53.1	Low	68.9	Low	20 Å²	20	57.2 Å²	57.2	21%	0.206	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-24.3	177.6	0	0	0	0	0	115.6	G976 I977 S1081	G976-G1083 VanDerWaalsContact C-CA 3.5Å; G976-G1083 VanDerWaalsContact CA-CA 3.45Å; G976-G1083 WeakPolarHBondContact O-CA 3.36Å; I977-G1083 WeakPolarHBondContact CG1-O 3.48Å; S1081-G1083 PolarHBondContact O-N 3.25Å
1084	I	58.3	Low	69.9	Low	28 Å²	28	51 Å²	51	14%	0.144	30%	0.3	C	S	.	.	S	Bend	trans	-74.9	125	-177.7	-55.6	178.1	0	0	0	109.6	S1081 E1088 R1089	S1081-I1084 PolarHBondContact O-N 3.24Å; S1081-I1084 WeakPolarHBondContact OG-CD1 3.29Å; I1084-E1088 HydrophobicContact CG2-CB 4.02Å; I1084-R1089 HydrophobicContact CB-CG 4.16Å; I1084-R1089 HydrophobicContact CG2-CG 3.85Å; I1084-R1089 PolarHBondContact O-NE 2.56Å; I1084-R1089 PolarHBondContact O-NH2 3.38Å
1085	P	60	Low	70.6	Confident	61 Å²	61	46.9 Å²	46.9	40%	0.396	28%	0.279	S	S	.	.			trans	-60.7	145.6	177	26.1	-34.9	0	0	0	110.4	A1087 E1088	P1085-A1087 PolarHBondContact O-N 3.01Å; P1085-E1088 HydrophobicContact CG-CB 4.18Å; P1085-E1088 HydrophobicContact CG-CG 4.05Å; P1085-E1088 PolarHBondContact O-N 3.01Å
1086	S	59.2	Low	70.8	Confident	113 Å²	113	50 Å²	50	79%	0.79	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-26	-169.9	46.9	0	0	0	0	114.8
1087	A	61.6	Low	71.3	Confident	85 Å²	85	52.1 Å²	52.1	70%	0.702	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-20.9	176.4	0	0	0	0	0	114.5	P1085	P1085-A1087 PolarHBondContact O-N 3.01Å
1088	E	65.9	Low	72.1	Confident	48 Å²	48	49.5 Å²	49.5	22%	0.224	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	0.4	-175.2	-58.9	-162.9	119.2	0	0	113.8	S1013 M1015 I1084 P1085	S1013-E1088 WeakPolarHBondContact CB-OE1 3.31Å; S1013-E1088 PolarHBondContact OG-OE1 3.46Å; M1015-E1088 WeakPolarHBondContact CB-OE2 3.28Å; I1084-E1088 HydrophobicContact CG2-CB 4.02Å; P1085-E1088 HydrophobicContact CG-CB 4.18Å; P1085-E1088 HydrophobicContact CG-CG 4.05Å; P1085-E1088 PolarHBondContact O-N 3.01Å
1089	R	73.3	Confident	72.6	Confident	87 Å²	87	49.2 Å²	49.2	33%	0.328	27%	0.273	S	S	.	.	S	Bend	trans	-66.5	147.3	174.3	-65.3	-176.7	-177.4	-159.8	-4.1	110.6	L1047 I1084 T1091 H1094	L1047-R1089 HydrophobicContact CD2-CB 3.92Å; I1084-R1089 HydrophobicContact CB-CG 4.16Å; I1084-R1089 HydrophobicContact CG2-CG 3.85Å; I1084-R1089 PolarHBondContact O-NE 2.56Å; I1084-R1089 PolarHBondContact O-NH2 3.38Å; R1089-T1091 PolarHBondContact O-N 3.25Å; R1089-H1094 PolarHBondContact O-CE1 3.19Å; R1089-H1094 PolarHBondContact O-ND1 3.14Å
1090	L	80.2	Confident	72.7	Confident	8 Å²	8	52.9 Å²	52.9	4%	0.042	30%	0.298	C	S	.	.			trans	-72.4	132	177.7	-64.4	176.9	0	0	0	110.7	W1020 L1023 L1048 H1094 F1098	W1020-L1090 HydrophobicContact CB-CD1 4.14Å; W1020-L1090 HydrophobicContact CB-CD2 4.19Å; W1020-L1090 HydrophobicContact CE3-CD1 4.08Å; L1023-L1090 HydrophobicContact CD1-CD1 3.54Å; L1048-L1090 HydrophobicContact CB-CB 3.91Å; L1048-L1090 WeakPolarHBondContact CB-O 3.32Å; L1048-L1090 HydrophobicContact CD2-CB 3.63Å; L1048-L1090 HydrophobicContact CD2-CD1 3.74Å; L1048-L1090 HydrophobicContact CD2-CG 4.36Å; L1048-L1090 HydrophobicContact CG-CB 4.44Å; L1048-L1090 PolarHBondContact N-O 3.45Å; L1090-H1094 HydrophobicContact CD2-CB 4.06Å; L1090-F1098 HydrophobicContact CD2-CD2 4.39Å; L1090-F1098 HydrophobicContact CD2-CE2 3.82Å
1091	T	83.5	Confident	73.1	Confident	27 Å²	27	49.8 Å²	49.8	17%	0.166	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-119.5	166.3	174.9	60.7	0	0	0	0	109.4	L1046 L1047 R1089 G1093 H1094 V1095	L1046-T1091 CarbonylContact O-C 3.59Å; L1046-T1091 WeakPolarHBondContact O-CA 3.42Å; L1046-T1091 WeakPolarHBondContact O-CB 3.44Å; L1047-T1091 HydrophobicContact CD2-CG2 4.46Å; R1089-T1091 PolarHBondContact O-N 3.25Å; T1091-G1093 PolarHBondContact O-N 3Å; T1091-G1093 PolarHBondContact OG1-N 3.29Å; T1091-H1094 WeakPolarHBondContact O-CA 3.5Å; T1091-H1094 WeakPolarHBondContact O-CB 3.49Å; T1091-H1094 PolarHBondContact O-N 2.82Å; T1091-H1094 PolarHBondContact OG1-N 3.48Å; T1091-H1094 PolarHBondContact OG1-ND1 3.28Å; T1091-V1095 PolarHBondContact O-N 3.04Å
1092	V	83.8	Confident	73.9	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-54.1	-36	171	170.8	0	0	0	0	111.9	A1038 V1041 N1043 L1046 V1051 V1095 K1096	A1038-V1092 HydrophobicContact CB-CG2 4.44Å; A1038-V1092 WeakPolarHBondContact O-CG1 3.24Å; V1041-V1092 HydrophobicContact CB-CG1 4.4Å; V1041-V1092 HydrophobicContact CB-CG2 4.4Å; V1041-V1092 HydrophobicContact CG1-CG1 4.36Å; V1041-V1092 HydrophobicContact CG1-CG2 4.1Å; V1041-V1092 WeakPolarHBondContact O-CG1 3.46Å; N1043-V1092 WeakPolarHBondContact O-CB 3.43Å; L1046-V1092 HydrophobicContact CB-CG2 3.83Å; L1046-V1092 PolarHBondContact O-N 3.39Å; V1051-V1092 HydrophobicContact CG2-CG2 3.72Å; V1092-V1095 PolarHBondContact O-N 3.41Å; V1092-K1096 HydrophobicContact CG1-CD 4.29Å; V1092-K1096 WeakPolarHBondContact O-CG 3.26Å; V1092-K1096 PolarHBondContact O-N 2.88Å
1093	G	82.1	Confident	74.7	Confident	16 Å²	16	44.5 Å²	44.5	17%	0.165	27%	0.267	C	S	.	.	H	α-helix	trans	-64.6	-37.6	173.2	0	0	0	0	0	113.8	N1044 T1091 K1097	N1044-G1093 PolarHBondContact O-N 3.22Å; T1091-G1093 PolarHBondContact O-N 3Å; T1091-G1093 PolarHBondContact OG1-N 3.29Å; G1093-K1097 PolarHBondContact O-N 3.31Å
1094	H	85.6	Confident	75.3	Confident	49 Å²	49	45.4 Å²	45.4	23%	0.227	27%	0.27	C	S	.	.	H	α-helix	trans	-67.2	-40.4	173.1	-64.4	154.7	0	0	0	111.6	R1089 L1090 T1091 K1097 F1098	R1089-H1094 PolarHBondContact O-CE1 3.19Å; R1089-H1094 PolarHBondContact O-ND1 3.14Å; L1090-H1094 HydrophobicContact CD2-CB 4.06Å; T1091-H1094 WeakPolarHBondContact O-CA 3.5Å; T1091-H1094 WeakPolarHBondContact O-CB 3.49Å; T1091-H1094 PolarHBondContact O-N 2.82Å; T1091-H1094 PolarHBondContact OG1-N 3.48Å; T1091-H1094 PolarHBondContact OG1-ND1 3.28Å; H1094-K1097 PolarHBondContact O-N 3.09Å; H1094-F1098 HydrophobicContact CB-CD2 4.41Å; H1094-F1098 HydrophobicContact CB-CE2 3.96Å; H1094-F1098 HydrophobicContact CB-CZ 4.31Å; H1094-F1098 WeakPolarHBondContact O-CD2 3.13Å; H1094-F1098 WeakPolarHBondContact O-CG 3.48Å; H1094-F1098 PolarHBondContact O-N 3.27Å
1095	V	84.8	Confident	75.9	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59	-50.5	175.1	177.3	0	0	0	0	111.4	W1020 I1035 A1038 L1048 T1091 V1092 K1097 F1098 V1099	W1020-V1095 HydrophobicContact CH2-CB 4.49Å; W1020-V1095 HydrophobicContact CH2-CG1 3.99Å; W1020-V1095 HydrophobicContact CH2-CG2 4.39Å; W1020-V1095 HydrophobicContact CZ3-CB 4.47Å; W1020-V1095 HydrophobicContact CZ3-CG1 4.32Å; W1020-V1095 HydrophobicContact CZ3-CG2 3.91Å; I1035-V1095 HydrophobicContact CB-CG1 4.49Å; I1035-V1095 HydrophobicContact CG1-CG1 4.18Å; I1035-V1095 HydrophobicContact CG2-CG1 4.01Å; A1038-V1095 HydrophobicContact CB-CB 4.38Å; A1038-V1095 HydrophobicContact CB-CG1 4.03Å; A1038-V1095 HydrophobicContact CB-CG2 4.4Å; L1048-V1095 HydrophobicContact CD1-CG2 3.59Å; L1048-V1095 HydrophobicContact CD2-CG2 3.94Å; L1048-V1095 HydrophobicContact CG-CG2 4.4Å; T1091-V1095 PolarHBondContact O-N 3.04Å; V1092-V1095 PolarHBondContact O-N 3.41Å; V1095-K1097 VanDerWaalsContact C-N 3.27Å; V1095-K1097 PolarHBondContact O-N 3.46Å; V1095-F1098 PolarHBondContact O-N 3.48Å; V1095-V1099 HydrophobicContact CG1-CG2 3.8Å; V1095-V1099 WeakPolarHBondContact O-CB 3.38Å; V1095-V1099 VanDerWaalsContact O-CG2 3.23Å; V1095-V1099 WeakPolarHBondContact O-CG2 3.32Å; V1095-V1099 PolarHBondContact O-N 3.16Å
1096	K	82.7	Confident	76.2	Confident	64 Å²	64	45.6 Å²	45.6	28%	0.278	27%	0.268	S	S	.	.	H	α-helix	trans	-61.3	-33.3	180	-70.9	174.3	-173.7	173.4	0	113	L1039 V1041 N1044 V1092 P1100	L1039-K1096 HydrophobicContact CD2-CG 4.22Å; V1041-K1096 PolarHBondContact O-NZ 2.86Å; N1044-K1096 WeakPolarHBondContact OD1-CD 3.44Å; N1044-K1096 PolarHBondContact OD1-NZ 2.88Å; V1092-K1096 HydrophobicContact CG1-CD 4.29Å; V1092-K1096 WeakPolarHBondContact O-CG 3.26Å; V1092-K1096 PolarHBondContact O-N 2.88Å; K1096-P1100 WeakPolarHBondContact O-CD 3.48Å
1097	K	83.6	Confident	76.7	Confident	102 Å²	102	45.1 Å²	45.1	44%	0.443	26%	0.262	S	S	.	.	H	α-helix	trans	-70.8	-42.4	173.3	-79.1	-173.7	168.4	-163.9	0	113.6	I1010 G1093 H1094 V1095	I1010-K1097 HydrophobicContact CG2-CB 4.4Å; I1010-K1097 HydrophobicContact CG2-CD 4.23Å; I1010-K1097 HydrophobicContact CG2-CG 4.42Å; G1093-K1097 PolarHBondContact O-N 3.31Å; H1094-K1097 PolarHBondContact O-N 3.09Å; V1095-K1097 VanDerWaalsContact C-N 3.27Å; V1095-K1097 PolarHBondContact O-N 3.46Å
1098	F	86.6	Confident	77.3	Confident	3 Å²	3	47.5 Å²	47.5	1%	0.013	25%	0.254	C	S	.	.	H	α-helix	trans	-86.1	-29.8	-170.1	-58.5	-24	0	0	0	113.8	M1005 F1012 L1017 W1020 L1090 H1094 V1095 C1101 T1102	M1005-F1098 HydrophobicContact CE-CD1 3.47Å; M1005-F1098 VanDerWaalsContact CE-CD1 3.47Å; M1005-F1098 HydrophobicContact CE-CE1 3.59Å; M1005-F1098 HydrophobicContact SD-CD1 4.01Å; F1012-F1098 HydrophobicContact CB-CE1 3.95Å; F1012-F1098 HydrophobicContact CB-CZ 4.43Å; L1017-F1098 HydrophobicContact CD1-CD1 4.49Å; W1020-F1098 HydrophobicContact CB-CD2 3.95Å; W1020-F1098 HydrophobicContact CB-CE2 4.21Å; W1020-F1098 AromaticContact CD1-CD2 3.74Å; W1020-F1098 HydrophobicContact CD2-CB 4.22Å; W1020-F1098 AromaticContact CD2-CD2 3.89Å; W1020-F1098 HydrophobicContact CD2-CD2 3.89Å; W1020-F1098 HydrophobicContact CG-CB 4.33Å; W1020-F1098 AromaticContact CG-CD2 3.59Å; W1020-F1098 HydrophobicContact CG-CD2 3.59Å; W1020-F1098 HydrophobicContact CG-CE2 4.34Å; W1020-F1098 HydrophobicContact CG-CG 4.36Å; W1020-F1098 HydrophobicContact CZ2-CB 3.98Å; W1020-F1098 VanDerWaalsContact NE1-CB 3.34Å; L1090-F1098 HydrophobicContact CD2-CD2 4.39Å; L1090-F1098 HydrophobicContact CD2-CE2 3.82Å; H1094-F1098 HydrophobicContact CB-CD2 4.41Å; H1094-F1098 HydrophobicContact CB-CE2 3.96Å; H1094-F1098 HydrophobicContact CB-CZ 4.31Å; H1094-F1098 WeakPolarHBondContact O-CD2 3.13Å; H1094-F1098 WeakPolarHBondContact O-CG 3.48Å; H1094-F1098 PolarHBondContact O-N 3.27Å; V1095-F1098 PolarHBondContact O-N 3.48Å; F1098-C1101 PolarHBondContact O-N 3.31Å; F1098-T1102 WeakPolarHBondContact O-CG2 3.48Å; F1098-T1102 PolarHBondContact O-N 2.7Å
1099	V	84.2	Confident	77.7	Confident	19 Å²	19	46 Å²	46	12%	0.115	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-56.4	-39.7	-175.8	160.8	0	0	0	0	115.1	W1020 I1035 V1095 C1101 T1102	W1020-V1099 HydrophobicContact CH2-CG2 3.74Å; W1020-V1099 HydrophobicContact CZ2-CG2 3.76Å; I1035-V1099 HydrophobicContact CD1-CG2 4.49Å; I1035-V1099 HydrophobicContact CG2-CG2 3.67Å; V1095-V1099 HydrophobicContact CG1-CG2 3.8Å; V1095-V1099 WeakPolarHBondContact O-CB 3.38Å; V1095-V1099 VanDerWaalsContact O-CG2 3.23Å; V1095-V1099 WeakPolarHBondContact O-CG2 3.32Å; V1095-V1099 PolarHBondContact O-N 3.16Å; V1099-C1101 PolarHBondContact O-N 3.45Å; V1099-T1102 PolarHBondContact O-OG1 2.97Å
1100	P	76.3	Confident	77.6	Confident	99 Å²	99	44 Å²	44	64%	0.643	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-63.6	-22.2	175.8	-24.7	35.9	0	0	0	114.1	K1096	K1096-P1100 WeakPolarHBondContact O-CD 3.48Å
1101	C	76.7	Confident	77.5	Confident	4 Å²	4	49.3 Å²	49.3	3%	0.027	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-104.2	3.5	-174.3	-55.7	0	0	0	0	113.9	L1004 M1005 F1008 F1098 V1099	L1004-C1101 HydrophobicContact CB-CB 4.11Å; L1004-C1101 WeakPolarHBondContact CD1-O 3.21Å; M1005-C1101 HydrophobicContact CG-CB 4.04Å; M1005-C1101 HydrophobicContact SD-CB 3.89Å; F1008-C1101 VanDerWaalsContact CD2-SG 3.56Å; F1098-C1101 PolarHBondContact O-N 3.31Å; V1099-C1101 PolarHBondContact O-N 3.45Å
1102	T	77	Confident	77	Confident	18 Å²	18	50.4 Å²	50.4	11%	0.11	27%	0.267	C	S	.	.			trans	-92.2	101.7	-179.3	49.3	0	0	0	0	112.6	W1020 L1024 F1098 V1099 S1104	W1020-T1102 HydrophobicContact CZ2-CG2 3.99Å; L1024-T1102 HydrophobicContact CD1-CG2 3.51Å; F1098-T1102 WeakPolarHBondContact O-CG2 3.48Å; F1098-T1102 PolarHBondContact O-N 2.7Å; V1099-T1102 PolarHBondContact O-OG1 2.97Å; T1102-S1104 VanDerWaalsContact C-N 3.3Å
1103	S	71.3	Confident	76.5	Confident	84 Å²	84	50.5 Å²	50.5	59%	0.587	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-4.7	171.4	75.5	0	0	0	0	114.2	L1000	L1000-S1103 VanDerWaalsContact CD2-OG 3.24Å; L1000-S1103 WeakPolarHBondContact CD2-OG 2.96Å
1104	S	65.6	Low	76	Confident	39 Å²	39	55 Å²	55	27%	0.273	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	1.2	-174	63.8	0	0	0	0	114.1	T1102	T1102-S1104 VanDerWaalsContact C-N 3.3Å
1105	L	70.2	Confident	75.3	Confident	13 Å²	13	57.3 Å²	57.3	7%	0.068	29%	0.29	C	S	.	.	S	Bend	trans	-118.4	116.4	-179.6	-168	82.4	0	0	0	108.8	L1024 P1028 I1035 P1107 R1110	L1024-L1105 HydrophobicContact CD2-CD1 3.94Å; P1028-L1105 HydrophobicContact CB-CD1 4.39Å; I1035-L1105 HydrophobicContact CD1-CD2 4.23Å; L1105-P1107 WeakPolarHBondContact O-CD 3.26Å; L1105-R1110 HydrophobicContact CD2-CG 4.2Å; L1105-R1110 VanDerWaalsContact CD2-NE 3.32Å
1106	D	66.8	Low	74.3	Confident	80 Å²	80	62.9 Å²	62.9	43%	0.428	31%	0.311	S	S	.	.			trans	-61.7	122.4	-179.2	172.2	19.6	0	0	0	111.6	Y1108 L1109	D1106-Y1108 PolarHBondContact O-N 2.69Å; D1106-Y1108 WeakPolarHBondContact OD1-CB 3.03Å; D1106-Y1108 PolarHBondContact OD1-N 3.09Å; D1106-L1109 HydrophobicContact CB-CB 4.26Å; D1106-L1109 PolarHBondContact O-N 3.41Å; D1106-L1109 PolarHBondContact OD2-N 2.97Å
1107	P	69.8	Low	73.3	Confident	103 Å²	103	61.6 Å²	61.6	67%	0.669	31%	0.311	S	S	*	.	H	α-helix	trans	-56.5	-31.3	173.6	-25.3	35.3	0	0	0	113.8	L1105 R1110 K1111	L1105-P1107 WeakPolarHBondContact O-CD 3.26Å; P1107-R1110 PolarHBondContact O-N 3.29Å; P1107-K1111 PolarHBondContact O-N 3.47Å
1108	Y	73.3	Confident	72.1	Confident	135 Å²	135	63.3 Å²	63.3	53%	0.529	32%	0.318	S	S	.	.	H	α-helix	trans	-69.1	-38	179	-179.5	-111.3	0	0	0	112	D1106 R1110 K1111 L1112	D1106-Y1108 PolarHBondContact O-N 2.69Å; D1106-Y1108 WeakPolarHBondContact OD1-CB 3.03Å; D1106-Y1108 PolarHBondContact OD1-N 3.09Å; Y1108-R1110 VanDerWaalsContact C-N 3.27Å; Y1108-R1110 PolarHBondContact O-N 2.92Å; Y1108-K1111 WeakPolarHBondContact O-CA 3.42Å; Y1108-K1111 WeakPolarHBondContact O-CB 3.4Å; Y1108-K1111 PolarHBondContact O-N 3.44Å; Y1108-L1112 HydrophobicContact CD1-CD1 3.99Å; Y1108-L1112 HydrophobicContact CD1-CG 4.4Å; Y1108-L1112 HydrophobicContact CE1-CD1 3.61Å; Y1108-L1112 HydrophobicContact CE1-CD2 4.4Å; Y1108-L1112 HydrophobicContact CE1-CG 4.05Å; Y1108-L1112 HydrophobicContact CE2-CD2 4.44Å; Y1108-L1112 HydrophobicContact CE2-CG 4.39Å; Y1108-L1112 PolarHBondContact O-N 3.48Å
1109	L	73.5	Confident	70.4	Confident	15 Å²	15	65.4 Å²	65.4	8%	0.079	34%	0.34	C	S	.	.	H	α-helix	trans	-59.4	-37.3	173.5	-144.2	84.2	0	0	0	112.3	L1065 L1068 D1106 I1113	L1065-L1109 HydrophobicContact CD2-CD1 4.16Å; L1068-L1109 HydrophobicContact CD2-CD1 3.97Å; L1068-L1109 HydrophobicContact CD2-CD2 4.48Å; D1106-L1109 HydrophobicContact CB-CB 4.26Å; D1106-L1109 PolarHBondContact O-N 3.41Å; D1106-L1109 PolarHBondContact OD2-N 2.97Å; L1109-I1113 PolarHBondContact O-N 3.41Å
1110	R	73	Confident	68.6	Low	47 Å²	47	67.9 Å²	67.9	18%	0.177	35%	0.352	C	S	.	.	H	α-helix	trans	-68.2	-38.9	171.5	-76.8	-171.2	176.2	165.4	7.4	112.7	L1105 P1107 Y1108 I1113 R1114	L1105-R1110 HydrophobicContact CD2-CG 4.2Å; L1105-R1110 VanDerWaalsContact CD2-NE 3.32Å; P1107-R1110 PolarHBondContact O-N 3.29Å; Y1108-R1110 VanDerWaalsContact C-N 3.27Å; Y1108-R1110 PolarHBondContact O-N 2.92Å; R1110-I1113 PolarHBondContact O-N 3.01Å; R1110-R1114 WeakPolarHBondContact O-CB 3.32Å; R1110-R1114 WeakPolarHBondContact O-CG 3.28Å; R1110-R1114 PolarHBondContact O-N 2.68Å
1111	K	77.3	Confident	67.2	Low	119 Å²	119	66.9 Å²	66.9	52%	0.517	34%	0.344	S	S	.	.	H	α-helix	trans	-61.2	-47.6	177.2	-174.2	177.7	176.4	-179.5	0	111	P1107 Y1108 I1113 R1114 E1115	P1107-K1111 PolarHBondContact O-N 3.47Å; Y1108-K1111 WeakPolarHBondContact O-CA 3.42Å; Y1108-K1111 WeakPolarHBondContact O-CB 3.4Å; Y1108-K1111 PolarHBondContact O-N 3.44Å; K1111-I1113 PolarHBondContact O-N 3.32Å; K1111-R1114 PolarHBondContact O-N 3.03Å; K1111-E1115 WeakPolarHBondContact CE-OE1 3.45Å; K1111-E1115 WeakPolarHBondContact CG-OE1 3.35Å; K1111-E1115 WeakPolarHBondContact O-CG 3.42Å; K1111-E1115 PolarHBondContact O-N 2.93Å
1112	L	73.3	Confident	65.5	Low	49 Å²	49	72.4 Å²	72.4	26%	0.257	37%	0.374	S	S	.	.	H	α-helix	trans	-57.2	-45.8	175.3	-71.7	173.9	0	0	0	112.8	L1065 Y1108 E1115 R1116	L1065-L1112 HydrophobicContact CD2-CD1 4.44Å; Y1108-L1112 HydrophobicContact CD1-CD1 3.99Å; Y1108-L1112 HydrophobicContact CD1-CG 4.4Å; Y1108-L1112 HydrophobicContact CE1-CD1 3.61Å; Y1108-L1112 HydrophobicContact CE1-CD2 4.4Å; Y1108-L1112 HydrophobicContact CE1-CG 4.05Å; Y1108-L1112 HydrophobicContact CE2-CD2 4.44Å; Y1108-L1112 HydrophobicContact CE2-CG 4.39Å; Y1108-L1112 PolarHBondContact O-N 3.48Å; L1112-E1115 PolarHBondContact O-N 3.25Å; L1112-R1116 PolarHBondContact O-N 2.65Å
1113	I	73.4	Confident	63.7	Low	2 Å²	2	76.8 Å²	76.8	1%	0.01	40%	0.395	C	S	.	.	H	α-helix	trans	-68.2	-36.2	179.4	-74.7	164.7	0	0	0	111.3	C1032 W1033 L1065 L1109 R1110 K1111 R1116 S1117	C1032-I1113 HydrophobicContact CB-CD1 3.34Å; W1033-I1113 HydrophobicContact CD2-CG2 3.69Å; W1033-I1113 HydrophobicContact CE3-CG2 3.92Å; W1033-I1113 HydrophobicContact CG-CD1 4.33Å; W1033-I1113 HydrophobicContact CG-CG2 4.06Å; W1033-I1113 HydrophobicContact CZ2-CG2 4.33Å; W1033-I1113 HydrophobicContact CZ3-CG2 4.34Å; L1065-I1113 HydrophobicContact CD1-CD1 4.41Å; L1065-I1113 HydrophobicContact CD1-CG1 4.01Å; L1109-I1113 PolarHBondContact O-N 3.41Å; R1110-I1113 PolarHBondContact O-N 3.01Å; K1111-I1113 PolarHBondContact O-N 3.32Å; I1113-R1116 PolarHBondContact O-N 2.87Å; I1113-S1117 VanDerWaalsContact O-CB 3.22Å; I1113-S1117 WeakPolarHBondContact O-CB 3.43Å; I1113-S1117 PolarHBondContact O-N 2.99Å
1114	R	70.7	Confident	62.1	Low	111 Å²	111	78.4 Å²	78.4	42%	0.419	39%	0.394	S	S	.	.	H	α-helix	trans	-65.7	-35.4	171.6	-78.2	172.6	175.3	-174	-2.4	113.4	D1036 R1110 K1111 S1117 K1118	D1036-R1114 IonicContact OD1-CZ 3.09Å; D1036-R1114 IonicContact OD1-NE 3.74Å; D1036-R1114 PolarHBondContact OD1-NE 3.37Å; D1036-R1114 IonicContact OD1-NH2 3.48Å; D1036-R1114 PolarHBondContact OD1-NH2 2.85Å; D1036-R1114 WeakPolarHBondContact OD2-CG 3.36Å; D1036-R1114 IonicContact OD2-NE 3.25Å; D1036-R1114 PolarHBondContact OD2-NE 3.5Å; R1110-R1114 WeakPolarHBondContact O-CB 3.32Å; R1110-R1114 WeakPolarHBondContact O-CG 3.28Å; R1110-R1114 PolarHBondContact O-N 2.68Å; K1111-R1114 PolarHBondContact O-N 3.03Å; R1114-S1117 PolarHBondContact O-N 3.44Å; R1114-K1118 WeakPolarHBondContact O-CG 3.41Å; R1114-K1118 PolarHBondContact O-N 3.08Å; R1114-K1118 VanDerWaalsContact O-N 3.1Å
1115	E	70.6	Confident	60.6	Low	97 Å²	97	80.4 Å²	80.4	45%	0.453	41%	0.413	S	S	.	.	H	α-helix	trans	-72.1	-37.9	177.3	-74.7	168.6	-173.3	0	0	111.6	K1111 L1112	K1111-E1115 WeakPolarHBondContact CE-OE1 3.45Å; K1111-E1115 WeakPolarHBondContact CG-OE1 3.35Å; K1111-E1115 WeakPolarHBondContact O-CG 3.42Å; K1111-E1115 PolarHBondContact O-N 2.93Å; L1112-E1115 PolarHBondContact O-N 3.25Å
1116	R	64.9	Low	58.9	Low	117 Å²	117	88 Å²	88	44%	0.442	45%	0.448	S	S	.	.	H	α-helix	trans	-67.1	-40.4	167.9	-88.6	176	165.8	160.8	-15.6	113.5	D1063 L1112 I1113 K1118 G1119	D1063-R1116 IonicContact OD1-CZ 2.62Å; D1063-R1116 IonicContact OD1-NH1 3.05Å; D1063-R1116 PolarHBondContact OD1-NH1 3.23Å; D1063-R1116 IonicContact OD1-NH2 3.6Å; D1063-R1116 PolarHBondContact OD1-NH2 3.43Å; D1063-R1116 IonicContact OD2-CZ 3.21Å; D1063-R1116 IonicContact OD2-NH1 2.91Å; D1063-R1116 PolarHBondContact OD2-NH1 3.05Å; D1063-R1116 IonicContact OD2-NH2 3.92Å; L1112-R1116 PolarHBondContact O-N 2.65Å; I1113-R1116 PolarHBondContact O-N 2.87Å; R1116-K1118 VanDerWaalsContact C-N 3.33Å; R1116-K1118 PolarHBondContact O-N 3.16Å; R1116-G1119 PolarHBondContact O-N 3.13Å
1117	S	62.2	Low	57.3	Low	38 Å²	38	89.6 Å²	89.6	27%	0.266	46%	0.46	S	S	.	.	H	α-helix	trans	-56.7	-43.8	176.1	172.3	0	0	0	0	112.1	I1113 R1114 G1119 L1120 V1121	I1113-S1117 VanDerWaalsContact O-CB 3.22Å; I1113-S1117 WeakPolarHBondContact O-CB 3.43Å; I1113-S1117 PolarHBondContact O-N 2.99Å; R1114-S1117 PolarHBondContact O-N 3.44Å; S1117-G1119 PolarHBondContact O-N 3Å; S1117-L1120 WeakPolarHBondContact O-CB 3.3Å; S1117-L1120 PolarHBondContact O-N 2.92Å; S1117-V1121 PolarHBondContact O-N 3.23Å
1118	K	57.8	Low	55.3	Low	138 Å²	138	88.1 Å²	88.1	60%	0.6	46%	0.464	S	S	*	.	H	α-helix	trans	-55.3	-35.5	174.4	-73.6	168.7	-176.1	173.4	0	113.2	R1114 R1116 L1120 V1121	R1114-K1118 WeakPolarHBondContact O-CG 3.41Å; R1114-K1118 PolarHBondContact O-N 3.08Å; R1114-K1118 VanDerWaalsContact O-N 3.1Å; R1116-K1118 VanDerWaalsContact C-N 3.33Å; R1116-K1118 PolarHBondContact O-N 3.16Å; K1118-L1120 VanDerWaalsContact C-N 3.26Å; K1118-L1120 PolarHBondContact O-N 3.13Å; K1118-V1121 PolarHBondContact O-N 3.43Å
1119	G	49.8	Very low	53.3	Low	46 Å²	46	87 Å²	87	47%	0.474	48%	0.475	S	S	.	.	H	α-helix	trans	-69	-18.5	176.3	0	0	0	0	0	114.8	R1116 S1117	R1116-G1119 PolarHBondContact O-N 3.13Å; S1117-G1119 PolarHBondContact O-N 3Å
1120	L	47.9	Very low	51.3	Low	71 Å²	71	90.8 Å²	90.8	37%	0.372	51%	0.509	S	S	.	.	H	α-helix	trans	-87.4	-35.5	172.8	-74.2	149.5	0	0	0	111.7	W1033 S1117 K1118 D1122 I1123 E1124	W1033-L1120 HydrophobicContact CH2-CD1 4.36Å; S1117-L1120 WeakPolarHBondContact O-CB 3.3Å; S1117-L1120 PolarHBondContact O-N 2.92Å; K1118-L1120 VanDerWaalsContact C-N 3.26Å; K1118-L1120 PolarHBondContact O-N 3.13Å; L1120-D1122 VanDerWaalsContact C-N 3.29Å; L1120-D1122 PolarHBondContact O-N 3.32Å; L1120-I1123 WeakPolarHBondContact O-CA 3.34Å; L1120-I1123 WeakPolarHBondContact O-CB 3.2Å; L1120-I1123 PolarHBondContact O-N 3.31Å; L1120-E1124 PolarHBondContact O-N 3.01Å
1121	V	46.3	Very low	49.5	Very low	78 Å²	78	91.4 Å²	91.4	47%	0.473	53%	0.53	S	S	.	.	H	α-helix	trans	-60.1	-36	179.9	175.8	0	0	0	0	112.5	S1117 K1118 I1123 E1124 A1125	S1117-V1121 PolarHBondContact O-N 3.23Å; K1118-V1121 PolarHBondContact O-N 3.43Å; V1121-I1123 PolarHBondContact O-N 3.1Å; V1121-E1124 PolarHBondContact O-N 3.4Å; V1121-A1125 WeakPolarHBondContact O-CB 3.34Å; V1121-A1125 PolarHBondContact O-N 3.18Å
1122	D	40.7	Very low	47.9	Very low	120 Å²	120	90.9 Å²	90.9	64%	0.642	53%	0.531	S	S	*	.	H	α-helix	trans	-69.4	-19.6	175.3	-75.5	-22.3	0	0	0	113.5	L1120	L1120-D1122 VanDerWaalsContact C-N 3.29Å; L1120-D1122 PolarHBondContact O-N 3.32Å
1123	I	38.5	Very low	46.9	Very low	110 Å²	110	93 Å²	93	56%	0.564	56%	0.555	S	S	*	*	H	α-helix	trans	-84.4	-43.7	174	-57.2	175.1	0	0	0	109.8	L1120 V1121 A1125 Q1126	L1120-I1123 WeakPolarHBondContact O-CA 3.34Å; L1120-I1123 WeakPolarHBondContact O-CB 3.2Å; L1120-I1123 PolarHBondContact O-N 3.31Å; V1121-I1123 PolarHBondContact O-N 3.1Å; I1123-A1125 PolarHBondContact O-N 3.05Å; I1123-Q1126 PolarHBondContact O-N 3.5Å
1124	E	37.9	Very low	46.1	Very low	119 Å²	119	94.4 Å²	94.4	56%	0.556	56%	0.562	S	S	*	*	H	α-helix	trans	-58.9	-33.9	172.9	-67.5	-174	171	0	0	112.1	L1120 V1121 Q1126 V1127	L1120-E1124 PolarHBondContact O-N 3.01Å; V1121-E1124 PolarHBondContact O-N 3.4Å; E1124-Q1126 PolarHBondContact O-N 3.42Å; E1124-Q1126 VanDerWaalsContact O-N 3.12Å; E1124-V1127 PolarHBondContact O-N 2.98Å; E1124-V1127 VanDerWaalsContact O-N 3.1Å
1125	A	35.6	Very low	45.6	Very low	81 Å²	81	91.8 Å²	91.8	67%	0.669	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	-20.7	174.7	0	0	0	0	0	114.3	V1121 I1123	V1121-A1125 WeakPolarHBondContact O-CB 3.34Å; V1121-A1125 PolarHBondContact O-N 3.18Å; I1123-A1125 PolarHBondContact O-N 3.05Å
1126	Q	33.8	Very low	45.1	Very low	173 Å²	173	92 Å²	92	81%	0.808	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-15.5	177	-60.2	-168.6	10.7	0	0	113.8	I1123 E1124	I1123-Q1126 PolarHBondContact O-N 3.5Å; E1124-Q1126 PolarHBondContact O-N 3.42Å; E1124-Q1126 VanDerWaalsContact O-N 3.12Å
1127	V	32.7	Very low	45.3	Very low	113 Å²	113	92 Å²	92	69%	0.685	58%	0.578	S	S	*	*			trans	-105.9	58	-176.7	-167.5	0	0	0	0	110.8	E1124 S1129	E1124-V1127 PolarHBondContact O-N 2.98Å; E1124-V1127 VanDerWaalsContact O-N 3.1Å; V1127-S1129 PolarHBondContact O-N 2.8Å
1128	G	28.7	Very low	45.6	Very low	72 Å²	72	90.2 Å²	90.2	74%	0.742	57%	0.566	S	S	*	*			trans	-78.8	83.5	-173.7	0	0	0	0	0	115.3
1129	S	30.6	Very low	46.2	Very low	111 Å²	111	89.9 Å²	89.9	78%	0.776	56%	0.561	S	S	*	*			trans	-161.1	137.7	157.9	-167.2	0	0	0	0	113.5	V1127	V1127-S1129 PolarHBondContact O-N 2.8Å
1130	A	31	Very low	47.2	Very low	95 Å²	95	95 Å²	95	79%	0.785	58%	0.576	S	S	*	*			trans	54.7	130.3	170	0	0	0	0	0	118.3
1131	G	36.4	Very low	48.5	Very low	60 Å²	60	92 Å²	92	62%	0.619	56%	0.561	S	S	*	*			cis	179	161	-3.2	0	0	0	0	0	111.4
1132	M	43.9	Very low	50	Low	108 Å²	108	89 Å²	89	53%	0.532	54%	0.541	S	S	.	.	S	Bend	trans	-58.4	140.3	174.8	-75	164.6	61.9	0	0	110.5	I1134 F1226	M1132-I1134 VanDerWaalsContact C-N 3.34Å; M1132-I1134 PolarHBondContact O-N 3.1Å; M1132-F1226 HydrophobicContact CE-CD1 4.22Å; M1132-F1226 HydrophobicContact CE-CE1 4.12Å
1133	A	50.9	Low	51.4	Low	93 Å²	93	88 Å²	88	77%	0.769	54%	0.543	S	S	*	.			trans	-74	80.5	-169	0	0	0	0	0	112.9	P1135	A1133-P1135 WeakPolarHBondContact O-CD 3.45Å
1134	I	57.6	Low	52.8	Low	31 Å²	31	87.5 Å²	87.5	16%	0.159	54%	0.542	C	S	.	.			trans	-52.7	119.7	155.6	-56.8	164.9	0	0	0	106.2	M1132 A1138 R1139 W1148	M1132-I1134 VanDerWaalsContact C-N 3.34Å; M1132-I1134 PolarHBondContact O-N 3.1Å; I1134-A1138 HydrophobicContact CG2-CB 3.84Å; I1134-R1139 HydrophobicContact CB-CG 3.98Å; I1134-R1139 HydrophobicContact CG2-CG 3.7Å; I1134-W1148 HydrophobicContact CD1-CB 4.02Å; I1134-W1148 HydrophobicContact CD1-CD2 4.46Å; I1134-W1148 HydrophobicContact CD1-CG 3.79Å
1135	P	60.1	Low	54.3	Low	57 Å²	57	86.4 Å²	86.4	37%	0.37	54%	0.54	S	S	.	.			trans	-60.5	147.5	-177.9	22.4	-30.6	0	0	0	109.8	A1133 N1137 A1138 R1139 T1222	A1133-P1135 WeakPolarHBondContact O-CD 3.45Å; P1135-N1137 PolarHBondContact O-N 3.32Å; P1135-A1138 HydrophobicContact CG-CB 3.86Å; P1135-A1138 WeakPolarHBondContact O-CA 3.46Å; P1135-A1138 WeakPolarHBondContact O-CB 3.21Å; P1135-A1138 PolarHBondContact O-N 3.01Å; P1135-R1139 PolarHBondContact O-N 3.16Å; P1135-T1222 HydrophobicContact CG-CG2 3.55Å
1136	P	60.8	Low	55.9	Low	102 Å²	102	88.8 Å²	88.8	66%	0.662	54%	0.541	S	S	*	.	H	α-helix	trans	-57.1	-35.4	-167.8	20.2	-32.7	0	0	0	112.9	A1138	P1136-A1138 PolarHBondContact O-N 3.41Å
1137	N	68.5	Low	57.8	Low	116 Å²	116	81.3 Å²	81.3	62%	0.62	51%	0.507	S	S	*	.	H	α-helix	trans	-66	-19.4	177.5	-52.1	-9.3	0	0	0	113.5	P1135 L1218	P1135-N1137 PolarHBondContact O-N 3.32Å; N1137-L1218 HydrophobicContact CB-CD1 3.98Å
1138	A	68.3	Low	59.8	Low	0 Å²	0	76.3 Å²	76.3	0%	0	48%	0.476	C	S	.	.	H	α-helix	trans	-103.6	-13.4	-175.6	0	0	0	0	0	114.6	I1134 P1135 P1136 L1140 L1141 W1148 L1218 T1222	I1134-A1138 HydrophobicContact CG2-CB 3.84Å; P1135-A1138 HydrophobicContact CG-CB 3.86Å; P1135-A1138 WeakPolarHBondContact O-CA 3.46Å; P1135-A1138 WeakPolarHBondContact O-CB 3.21Å; P1135-A1138 PolarHBondContact O-N 3.01Å; P1136-A1138 PolarHBondContact O-N 3.41Å; A1138-L1140 PolarHBondContact O-N 3.15Å; A1138-L1141 WeakPolarHBondContact O-CB 3.22Å; A1138-L1141 PolarHBondContact O-N 3.34Å; A1138-W1148 HydrophobicContact CB-CZ2 4.45Å; A1138-W1148 PolarHBondContact O-NE1 3Å; A1138-L1218 HydrophobicContact CB-CD2 3.5Å; A1138-T1222 HydrophobicContact CB-CG2 3.49Å; A1138-T1222 VanDerWaalsContact CB-CG2 3.49Å
1139	R	69.5	Low	61.7	Low	132 Å²	132	79.4 Å²	79.4	50%	0.498	47%	0.473	S	S	.	.	H	α-helix	trans	-62.2	-26.9	166.7	-72.7	-172.3	175.2	168.3	-2.5	111.5	I1134 P1135 L1141	I1134-R1139 HydrophobicContact CB-CG 3.98Å; I1134-R1139 HydrophobicContact CG2-CG 3.7Å; P1135-R1139 PolarHBondContact O-N 3.16Å; R1139-L1141 VanDerWaalsContact C-N 3.32Å; R1139-L1141 PolarHBondContact O-N 2.93Å
1140	L	72.6	Confident	63.6	Low	153 Å²	153	76.7 Å²	76.7	80%	0.801	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	7.7	179.7	-60.6	170.1	0	0	0	114.6	A1138	A1138-L1140 PolarHBondContact O-N 3.15Å
1141	L	74.4	Confident	65.6	Low	9 Å²	9	72.7 Å²	72.7	5%	0.047	42%	0.419	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-22.6	-175.9	-113.5	169.3	0	0	0	114.6	A1138 R1139 W1148 I1170 L1215 L1218 L1219	A1138-L1141 WeakPolarHBondContact O-CB 3.22Å; A1138-L1141 PolarHBondContact O-N 3.34Å; R1139-L1141 VanDerWaalsContact C-N 3.32Å; R1139-L1141 PolarHBondContact O-N 2.93Å; L1141-W1148 HydrophobicContact CB-CZ2 4.29Å; L1141-W1148 HydrophobicContact CD1-CZ2 4.37Å; L1141-I1170 HydrophobicContact CD2-CG2 3.95Å; L1141-L1215 HydrophobicContact CD2-CB 4.46Å; L1141-L1215 HydrophobicContact CD2-CD2 4.31Å; L1141-L1218 HydrophobicContact CD1-CB 4.35Å; L1141-L1218 HydrophobicContact CD1-CD2 3.57Å; L1141-L1218 HydrophobicContact CG-CD2 4.3Å; L1141-L1219 HydrophobicContact CD1-CB 3.86Å; L1141-L1219 HydrophobicContact CD1-CD1 4.39Å; L1141-L1219 HydrophobicContact CD2-CB 4.46Å
1142	F	76.9	Confident	67.3	Low	14 Å²	14	76 Å²	76	6%	0.061	42%	0.423	C	S	.	.	B	Isolated β-bridge	trans	-131	152.7	-179.9	-61	-57.8	0	0	0	109.4	T1147 W1148 K1169 I1170 L1219	F1142-T1147 HydrophobicContact CB-CG2 4.39Å; F1142-T1147 WeakPolarHBondContact CB-OG1 3.43Å; F1142-T1147 WeakPolarHBondContact CD2-OG1 3.5Å; F1142-T1147 VanDerWaalsContact CG-OG1 3.23Å; F1142-T1147 WeakPolarHBondContact CG-OG1 3.36Å; F1142-W1148 HydrophobicContact CD2-CD2 4.09Å; F1142-W1148 AromaticContact CD2-CE2 3.63Å; F1142-W1148 HydrophobicContact CD2-CG 4.34Å; F1142-W1148 AromaticContact CD2-CZ2 3.97Å; F1142-W1148 HydrophobicContact CD2-CZ2 3.97Å; F1142-W1148 AromaticContact CD2-NE1 3.62Å; F1142-W1148 AromaticContact CE2-CD2 3.92Å; F1142-W1148 HydrophobicContact CE2-CD2 3.92Å; F1142-W1148 AromaticContact CE2-CE2 3.67Å; F1142-W1148 HydrophobicContact CE2-CE3 4.18Å; F1142-W1148 AromaticContact CE2-CH2 4Å; F1142-W1148 HydrophobicContact CE2-CH2 4Å; F1142-W1148 AromaticContact CE2-CZ2 3.72Å; F1142-W1148 HydrophobicContact CE2-CZ2 3.72Å; F1142-W1148 HydrophobicContact CE2-CZ3 4.22Å; F1142-K1169 HydrophobicContact CD1-CB 3.87Å; F1142-K1169 WeakPolarHBondContact CD1-O 3.23Å; F1142-K1169 HydrophobicContact CE1-CB 3.77Å; F1142-I1170 HydrophobicContact CD1-CG1 4.44Å; F1142-I1170 HydrophobicContact CE1-CG1 3.88Å; F1142-L1219 HydrophobicContact CE1-CD1 4.11Å; F1142-L1219 HydrophobicContact CE2-CD1 4.22Å; F1142-L1219 HydrophobicContact CZ-CD1 3.52Å
1143	S	71.2	Confident	68.8	Low	98 Å²	98	73.8 Å²	73.8	69%	0.685	42%	0.415	S	S	*	.	S	Bend	trans	-70.2	-32.7	179.1	57.1	0	0	0	0	113.6
1144	D	68.2	Low	70	Confident	100 Å²	100	70.4 Å²	70.4	54%	0.535	39%	0.386	S	S	.	.			trans	-114.6	120.1	179	-59.1	-44.1	0	0	0	110.2	L1146 T1147	D1144-L1146 PolarHBondContact O-N 3.23Å; D1144-L1146 VanDerWaalsContact O-N 3.08Å; D1144-T1147 HydrophobicContact CB-CG2 4.25Å; D1144-T1147 WeakPolarHBondContact O-CB 3.15Å; D1144-T1147 WeakPolarHBondContact O-CG2 3.28Å; D1144-T1147 PolarHBondContact O-N 3.44Å; D1144-T1147 PolarHBondContact O-OG1 2.99Å
1145	D	68.4	Low	70.9	Confident	96 Å²	96	69.5 Å²	69.5	51%	0.513	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-54.7	-28.6	174	-100.2	-37.8	0	0	0	112.4	T1147 W1148	D1145-T1147 PolarHBondContact O-N 3.14Å; D1145-T1147 VanDerWaalsContact O-N 3.16Å; D1145-W1148 PolarHBondContact O-N 3.15Å
1146	L	69.7	Low	71.9	Confident	131 Å²	131	70.3 Å²	70.3	69%	0.686	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-60.5	-20.4	175.4	-68.7	174	0	0	0	113.5	D1144 W1148 M1149 S1150	D1144-L1146 PolarHBondContact O-N 3.23Å; D1144-L1146 VanDerWaalsContact O-N 3.08Å; L1146-W1148 VanDerWaalsContact C-N 3.3Å; L1146-W1148 PolarHBondContact O-N 3.19Å; L1146-M1149 HydrophobicContact CD2-SD 4.48Å; L1146-M1149 PolarHBondContact O-N 3.26Å; L1146-M1149 VanDerWaalsContact O-N 3.13Å; L1146-S1150 PolarHBondContact O-N 3.43Å
1147	T	73	Confident	72.8	Confident	17 Å²	17	72 Å²	72	10%	0.104	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-63	-35.8	176.2	54	0	0	0	0	112.5	F1142 D1144 D1145 M1149 S1150 I1151 K1169	F1142-T1147 HydrophobicContact CB-CG2 4.39Å; F1142-T1147 WeakPolarHBondContact CB-OG1 3.43Å; F1142-T1147 WeakPolarHBondContact CD2-OG1 3.5Å; F1142-T1147 VanDerWaalsContact CG-OG1 3.23Å; F1142-T1147 WeakPolarHBondContact CG-OG1 3.36Å; D1144-T1147 HydrophobicContact CB-CG2 4.25Å; D1144-T1147 WeakPolarHBondContact O-CB 3.15Å; D1144-T1147 WeakPolarHBondContact O-CG2 3.28Å; D1144-T1147 PolarHBondContact O-N 3.44Å; D1144-T1147 PolarHBondContact O-OG1 2.99Å; D1145-T1147 PolarHBondContact O-N 3.14Å; D1145-T1147 VanDerWaalsContact O-N 3.16Å; T1147-M1149 VanDerWaalsContact C-N 3.25Å; T1147-M1149 PolarHBondContact O-N 3.37Å; T1147-S1150 PolarHBondContact O-N 3.27Å; T1147-S1150 PolarHBondContact O-OG 3.05Å; T1147-I1151 WeakPolarHBondContact O-CG1 3.38Å; T1147-K1169 HydrophobicContact CG2-CD 4.03Å
1148	W	74.9	Confident	73.4	Confident	8 Å²	8	67 Å²	67	3%	0.03	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-64.1	-30.6	174.5	-72.3	111.9	0	0	0	112.4	I1134 A1138 L1141 F1142 D1145 L1146 S1150 I1151 T1222 L1223 F1226 P1231	I1134-W1148 HydrophobicContact CD1-CB 4.02Å; I1134-W1148 HydrophobicContact CD1-CD2 4.46Å; I1134-W1148 HydrophobicContact CD1-CG 3.79Å; A1138-W1148 HydrophobicContact CB-CZ2 4.45Å; A1138-W1148 PolarHBondContact O-NE1 3Å; L1141-W1148 HydrophobicContact CB-CZ2 4.29Å; L1141-W1148 HydrophobicContact CD1-CZ2 4.37Å; F1142-W1148 HydrophobicContact CD2-CD2 4.09Å; F1142-W1148 AromaticContact CD2-CE2 3.63Å; F1142-W1148 HydrophobicContact CD2-CG 4.34Å; F1142-W1148 AromaticContact CD2-CZ2 3.97Å; F1142-W1148 HydrophobicContact CD2-CZ2 3.97Å; F1142-W1148 AromaticContact CD2-NE1 3.62Å; F1142-W1148 AromaticContact CE2-CD2 3.92Å; F1142-W1148 HydrophobicContact CE2-CD2 3.92Å; F1142-W1148 AromaticContact CE2-CE2 3.67Å; F1142-W1148 HydrophobicContact CE2-CE3 4.18Å; F1142-W1148 AromaticContact CE2-CH2 4Å; F1142-W1148 HydrophobicContact CE2-CH2 4Å; F1142-W1148 AromaticContact CE2-CZ2 3.72Å; F1142-W1148 HydrophobicContact CE2-CZ2 3.72Å; F1142-W1148 HydrophobicContact CE2-CZ3 4.22Å; D1145-W1148 PolarHBondContact O-N 3.15Å; L1146-W1148 VanDerWaalsContact C-N 3.3Å; L1146-W1148 PolarHBondContact O-N 3.19Å; W1148-S1150 VanDerWaalsContact C-N 3.26Å; W1148-S1150 PolarHBondContact O-N 3.35Å; W1148-I1151 HydrophobicContact CE3-CD1 3.8Å; W1148-I1151 HydrophobicContact CZ3-CD1 4.16Å; W1148-T1222 WeakPolarHBondContact CH2-OG1 3.5Å; W1148-L1223 HydrophobicContact CZ3-CD2 4.25Å; W1148-F1226 HydrophobicContact CE3-CE2 4.43Å; W1148-F1226 HydrophobicContact CZ3-CE2 4.32Å; W1148-P1231 VanDerWaalsContact O-CG 3.28Å; W1148-P1231 WeakPolarHBondContact O-CG 3.42Å
1149	M	68.5	Low	74.2	Confident	136 Å²	136	74.9 Å²	74.9	67%	0.67	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-80.9	-0.2	174	-61.8	-171.9	-179.8	0	0	113.7	L1146 T1147	L1146-M1149 HydrophobicContact CD2-SD 4.48Å; L1146-M1149 PolarHBondContact O-N 3.26Å; L1146-M1149 VanDerWaalsContact O-N 3.13Å; T1147-M1149 VanDerWaalsContact C-N 3.25Å; T1147-M1149 PolarHBondContact O-N 3.37Å
1150	S	71.9	Confident	74.9	Confident	55 Å²	55	69.8 Å²	69.8	39%	0.385	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-103.8	20.7	176.3	71.5	0	0	0	0	113.5	L1146 T1147 W1148 K1169	L1146-S1150 PolarHBondContact O-N 3.43Å; T1147-S1150 PolarHBondContact O-N 3.27Å; T1147-S1150 PolarHBondContact O-OG 3.05Å; W1148-S1150 VanDerWaalsContact C-N 3.26Å; W1148-S1150 PolarHBondContact O-N 3.35Å; S1150-K1169 PolarHBondContact OG-NZ 3.1Å
1151	I	72.1	Confident	75.4	Confident	11 Å²	11	66.8 Å²	66.8	6%	0.056	36%	0.358	C	S	.	.			trans	-110.6	71.5	-176.4	-46.9	-172.6	0	0	0	109.6	T1147 W1148 T1153 L1166 L1223 P1231	T1147-I1151 WeakPolarHBondContact O-CG1 3.38Å; W1148-I1151 HydrophobicContact CE3-CD1 3.8Å; W1148-I1151 HydrophobicContact CZ3-CD1 4.16Å; I1151-T1153 VanDerWaalsContact C-N 3.3Å; I1151-T1153 PolarHBondContact O-N 3.44Å; I1151-L1166 HydrophobicContact CD1-CD1 4.21Å; I1151-L1166 HydrophobicContact CD1-CD2 3.94Å; I1151-L1166 HydrophobicContact CG1-CD2 4.09Å; I1151-L1223 HydrophobicContact CD1-CD2 4.26Å; I1151-L1223 HydrophobicContact CG2-CD2 4.48Å; I1151-P1231 HydrophobicContact CB-CG 4.46Å
1152	D	72.2	Confident	75.8	Confident	130 Å²	130	68 Å²	68	70%	0.695	37%	0.369	S	S	*	.			trans	-69.5	-27.2	-174.2	-50.3	-5	0	0	0	112.8	P1230	D1152-P1230 WeakPolarHBondContact O-CB 3.32Å
1153	T	74.9	Confident	76.1	Confident	60 Å²	60	67.7 Å²	67.7	37%	0.368	37%	0.369	S	S	.	.	S	Bend	trans	-98.8	128.5	-175.7	55.7	0	0	0	0	111.9	I1151	I1151-T1153 VanDerWaalsContact C-N 3.3Å; I1151-T1153 PolarHBondContact O-N 3.44Å
1154	P	75.4	Confident	76.7	Confident	23 Å²	23	63 Å²	63	15%	0.149	34%	0.336	C	S	.	.			trans	-66.7	153	175.1	29.8	-35.1	0	0	0	111.5	V1156 E1157 M1158	P1154-V1156 PolarHBondContact O-N 3.23Å; P1154-E1157 HydrophobicContact CG-CB 4.4Å; P1154-E1157 HydrophobicContact CG-CG 4.08Å; P1154-E1157 PolarHBondContact O-N 3.22Å; P1154-M1158 WeakPolarHBondContact O-CG 3.33Å
1155	L	78.1	Confident	77.4	Confident	12 Å²	12	62.1 Å²	62.1	6%	0.063	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-52.8	-36.8	-172.5	-178.3	63.4	0	0	0	113.1	E1157 M1158 G1191 A1195 L1223 K1224	L1155-E1157 PolarHBondContact O-N 3.13Å; L1155-M1158 HydrophobicContact CD1-SD 4.39Å; L1155-M1158 PolarHBondContact O-N 3.15Å; L1155-G1191 CarbonylContact O-C 3.58Å; L1155-G1191 WeakPolarHBondContact O-CA 3.27Å; L1155-A1195 HydrophobicContact CD2-CB 4.19Å; L1155-A1195 HydrophobicContact CG-CB 4.38Å; L1155-L1223 HydrophobicContact CD1-CB 4.32Å; L1155-L1223 HydrophobicContact CD1-CD1 4.39Å; L1155-L1223 HydrophobicContact CD2-CB 4.11Å; L1155-K1224 HydrophobicContact CD2-CG 3.94Å
1156	V	79.6	Confident	78	Confident	74 Å²	74	58 Å²	58	45%	0.448	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-58.2	-32.4	179.7	-176.6	0	0	0	0	112.8	P1154 L1192 A1195	P1154-V1156 PolarHBondContact O-N 3.23Å; V1156-L1192 HydrophobicContact CG1-CD1 3.83Å; V1156-A1195 HydrophobicContact CG2-CB 4.48Å
1157	E	80.3	Confident	78.7	Confident	138 Å²	138	51.9 Å²	51.9	65%	0.645	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-96.8	-7.7	-175.1	-62.5	-174.6	160.8	0	0	113.6	P1154 L1155 K1159	P1154-E1157 HydrophobicContact CG-CB 4.4Å; P1154-E1157 HydrophobicContact CG-CG 4.08Å; P1154-E1157 PolarHBondContact O-N 3.22Å; L1155-E1157 PolarHBondContact O-N 3.13Å; E1157-K1159 PolarHBondContact O-N 2.95Å; E1157-K1159 VanDerWaalsContact O-N 3.14Å
1158	M	81.6	Confident	79.2	Confident	11 Å²	11	57 Å²	57	5%	0.054	30%	0.295	C	S	.	.			trans	-69.7	113.2	-173.4	-60.9	-164.4	78.1	0	0	112.2	P1154 L1155 A1162 V1163 L1166 G1191	P1154-M1158 WeakPolarHBondContact O-CG 3.33Å; L1155-M1158 HydrophobicContact CD1-SD 4.39Å; L1155-M1158 PolarHBondContact O-N 3.15Å; M1158-A1162 HydrophobicContact CB-CB 4.41Å; M1158-A1162 HydrophobicContact CE-CB 3.71Å; M1158-V1163 HydrophobicContact CB-CG2 3.8Å; M1158-L1166 HydrophobicContact CE-CD1 3.68Å; M1158-L1166 HydrophobicContact CE-CG 4.08Å; M1158-L1166 HydrophobicContact SD-CD1 4.07Å; M1158-G1191 WeakPolarHBondContact O-CA 3.47Å; M1158-G1191 PolarHBondContact O-N 3.5Å
1159	K	83.9	Confident	79.4	Confident	165 Å²	165	60.8 Å²	60.8	72%	0.717	31%	0.311	S	S	*	.			trans	-63.9	157.5	168	-65.2	179.7	-178.3	175.2	0	110.9	E1157 D1161 A1162 V1163	E1157-K1159 PolarHBondContact O-N 2.95Å; E1157-K1159 VanDerWaalsContact O-N 3.14Å; K1159-D1161 VanDerWaalsContact C-N 3.28Å; K1159-D1161 PolarHBondContact O-N 3.14Å; K1159-A1162 WeakPolarHBondContact O-CA 3.29Å; K1159-A1162 WeakPolarHBondContact O-CB 3.33Å; K1159-A1162 PolarHBondContact O-N 3.08Å; K1159-V1163 PolarHBondContact O-N 3.43Å
1160	L	84.9	Confident	79.9	Confident	24 Å²	24	54.7 Å²	54.7	13%	0.126	28%	0.281	C	S	.	.	H	α-helix	trans	-47.1	-47.3	-179.8	-168.5	68	0	0	0	113.2	A1162 V1163 V1164 Y1185	L1160-A1162 VanDerWaalsContact C-N 3.3Å; L1160-A1162 PolarHBondContact O-N 3.45Å; L1160-V1163 PolarHBondContact O-N 3.32Å; L1160-V1164 WeakPolarHBondContact O-CB 3.34Å; L1160-V1164 WeakPolarHBondContact O-CG2 3.41Å; L1160-V1164 PolarHBondContact O-N 3.47Å; L1160-Y1185 HydrophobicContact CD2-CD1 3.49Å; L1160-Y1185 VanDerWaalsContact CD2-CD1 3.49Å; L1160-Y1185 HydrophobicContact CD2-CE1 3.77Å; L1160-Y1185 HydrophobicContact CD2-CG 4.49Å; L1160-Y1185 HydrophobicContact CG-CD1 4.3Å; L1160-Y1185 HydrophobicContact CG-CE1 4.28Å
1161	D	84	Confident	80.1	Confident	90 Å²	90	59.2 Å²	59.2	48%	0.481	30%	0.301	S	S	.	.	H	α-helix	trans	-65.7	-28.9	179.9	-59.8	-56.6	0	0	0	113.7	K1159 N1165 Y1185	K1159-D1161 VanDerWaalsContact C-N 3.28Å; K1159-D1161 PolarHBondContact O-N 3.14Å; D1161-N1165 VanDerWaalsContact O-CB 3.26Å; D1161-N1165 WeakPolarHBondContact O-CB 3.43Å; D1161-N1165 PolarHBondContact O-N 3.32Å; D1161-N1165 PolarHBondContact O-ND2 3.33Å; D1161-Y1185 PolarHBondContact OD1-OH 3.41Å; D1161-Y1185 VanDerWaalsContact OD1-OH 3.11Å
1162	A	82.8	Confident	80.2	Confident	34 Å²	34	59.2 Å²	59.2	28%	0.281	30%	0.301	S	S	.	.	H	α-helix	trans	-73.1	-40.9	175.7	0	0	0	0	0	111.1	M1158 K1159 L1160 N1165 L1166	M1158-A1162 HydrophobicContact CB-CB 4.41Å; M1158-A1162 HydrophobicContact CE-CB 3.71Å; K1159-A1162 WeakPolarHBondContact O-CA 3.29Å; K1159-A1162 WeakPolarHBondContact O-CB 3.33Å; K1159-A1162 PolarHBondContact O-N 3.08Å; L1160-A1162 VanDerWaalsContact C-N 3.3Å; L1160-A1162 PolarHBondContact O-N 3.45Å; A1162-N1165 PolarHBondContact O-N 2.92Å; A1162-L1166 PolarHBondContact O-N 3.3Å
1163	V	81.8	Confident	80.5	Confident	8 Å²	8	56.6 Å²	56.6	5%	0.048	29%	0.291	C	S	.	.	H	α-helix	trans	-63.1	-47	172.6	179.4	0	0	0	0	110.5	M1158 K1159 L1160 N1165 L1166 I1167 F1184 L1194	M1158-V1163 HydrophobicContact CB-CG2 3.8Å; K1159-V1163 PolarHBondContact O-N 3.43Å; L1160-V1163 PolarHBondContact O-N 3.32Å; V1163-N1165 VanDerWaalsContact C-N 3.29Å; V1163-N1165 PolarHBondContact O-N 3.43Å; V1163-L1166 PolarHBondContact O-N 3.01Å; V1163-L1166 VanDerWaalsContact O-N 3.11Å; V1163-I1167 HydrophobicContact CG1-CD1 3.9Å; V1163-I1167 WeakPolarHBondContact O-CG1 3.12Å; V1163-I1167 PolarHBondContact O-N 3.42Å; V1163-F1184 HydrophobicContact CG1-CD1 4.2Å; V1163-F1184 HydrophobicContact CG1-CE1 4.03Å; V1163-L1194 HydrophobicContact CG1-CD1 3.66Å; V1163-L1194 HydrophobicContact CG2-CD1 4.22Å
1164	V	84	Confident	80.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.3	-39.1	174.5	160.5	0	0	0	0	111.8	L1160 I1167 R1168 L1181 F1184 Y1185	L1160-V1164 WeakPolarHBondContact O-CB 3.34Å; L1160-V1164 WeakPolarHBondContact O-CG2 3.41Å; L1160-V1164 PolarHBondContact O-N 3.47Å; V1164-I1167 PolarHBondContact O-N 3.48Å; V1164-R1168 VanDerWaalsContact CG1-CZ 3.43Å; V1164-R1168 WeakPolarHBondContact O-CG 3.33Å; V1164-R1168 PolarHBondContact O-N 2.94Å; V1164-L1181 HydrophobicContact CB-CD2 4.39Å; V1164-L1181 HydrophobicContact CG1-CD1 4.45Å; V1164-L1181 HydrophobicContact CG1-CD2 3.89Å; V1164-L1181 HydrophobicContact CG2-CD2 4.25Å; V1164-F1184 HydrophobicContact CG2-CB 4.45Å; V1164-Y1185 HydrophobicContact CG1-CE2 4.23Å; V1164-Y1185 HydrophobicContact CG2-CE2 4.04Å
1165	N	83.5	Confident	80.4	Confident	81 Å²	81	63 Å²	63	43%	0.433	33%	0.328	S	S	.	.	H	α-helix	trans	-72.3	-24.5	176.7	-74.5	-21.2	0	0	0	113.9	D1161 A1162 V1163 R1168	D1161-N1165 VanDerWaalsContact O-CB 3.26Å; D1161-N1165 WeakPolarHBondContact O-CB 3.43Å; D1161-N1165 PolarHBondContact O-N 3.32Å; D1161-N1165 PolarHBondContact O-ND2 3.33Å; A1162-N1165 PolarHBondContact O-N 2.92Å; V1163-N1165 VanDerWaalsContact C-N 3.29Å; V1163-N1165 PolarHBondContact O-N 3.43Å; N1165-R1168 PolarHBondContact OD1-NH1 2.95Å
1166	L	81.8	Confident	80.4	Confident	11 Å²	11	67.5 Å²	67.5	6%	0.058	34%	0.344	C	S	.	.	H	α-helix	trans	-71.7	-42.6	165.4	-70.9	-174.6	0	0	0	111.4	I1151 M1158 A1162 V1163 R1168 K1169 L1223	I1151-L1166 HydrophobicContact CD1-CD1 4.21Å; I1151-L1166 HydrophobicContact CD1-CD2 3.94Å; I1151-L1166 HydrophobicContact CG1-CD2 4.09Å; M1158-L1166 HydrophobicContact CE-CD1 3.68Å; M1158-L1166 HydrophobicContact CE-CG 4.08Å; M1158-L1166 HydrophobicContact SD-CD1 4.07Å; A1162-L1166 PolarHBondContact O-N 3.3Å; V1163-L1166 PolarHBondContact O-N 3.01Å; V1163-L1166 VanDerWaalsContact O-N 3.11Å; L1166-R1168 VanDerWaalsContact C-N 3.29Å; L1166-R1168 PolarHBondContact O-N 3.26Å; L1166-K1169 WeakPolarHBondContact O-CB 3.45Å; L1166-K1169 PolarHBondContact O-N 2.98Å; L1166-L1223 HydrophobicContact CD1-CD1 3.99Å
1167	I	82.9	Confident	80.5	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-63	-37	179.4	-65.3	158.6	0	0	0	111.1	V1163 V1164 K1169 I1170 L1177 I1180 L1181 F1184	V1163-I1167 HydrophobicContact CG1-CD1 3.9Å; V1163-I1167 WeakPolarHBondContact O-CG1 3.12Å; V1163-I1167 PolarHBondContact O-N 3.42Å; V1164-I1167 PolarHBondContact O-N 3.48Å; I1167-K1169 PolarHBondContact O-N 3.23Å; I1167-I1170 PolarHBondContact O-N 3.42Å; I1167-I1170 VanDerWaalsContact O-N 3.09Å; I1167-L1177 HydrophobicContact CG2-CD1 4.04Å; I1167-I1180 HydrophobicContact CG2-CG2 4.2Å; I1167-L1181 HydrophobicContact CB-CD2 4.16Å; I1167-L1181 HydrophobicContact CG2-CD2 3.78Å; I1167-F1184 HydrophobicContact CD1-CD1 3.65Å; I1167-F1184 HydrophobicContact CD1-CD2 3.72Å; I1167-F1184 HydrophobicContact CD1-CE1 3.48Å; I1167-F1184 VanDerWaalsContact CD1-CE1 3.48Å; I1167-F1184 HydrophobicContact CD1-CE2 3.51Å; I1167-F1184 HydrophobicContact CD1-CG 3.79Å; I1167-F1184 HydrophobicContact CD1-CZ 3.4Å; I1167-F1184 VanDerWaalsContact CD1-CZ 3.4Å; I1167-F1184 HydrophobicContact CG1-CZ 4.46Å
1168	R	83.2	Confident	80.5	Confident	125 Å²	125	63.2 Å²	63.2	47%	0.472	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.1	171.6	-75.2	175.4	179.5	141.2	3	114.9	V1164 N1165 L1166 L1181	V1164-R1168 VanDerWaalsContact CG1-CZ 3.43Å; V1164-R1168 WeakPolarHBondContact O-CG 3.33Å; V1164-R1168 PolarHBondContact O-N 2.94Å; N1165-R1168 PolarHBondContact OD1-NH1 2.95Å; L1166-R1168 VanDerWaalsContact C-N 3.29Å; L1166-R1168 PolarHBondContact O-N 3.26Å; R1168-L1181 HydrophobicContact CG-CD1 3.99Å
1169	K	80.5	Confident	80.5	Confident	87 Å²	87	65.2 Å²	65.2	38%	0.378	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-12.1	173.5	-68.1	177	177.5	178.6	0	113.2	F1142 T1147 S1150 L1166 I1167	F1142-K1169 HydrophobicContact CD1-CB 3.87Å; F1142-K1169 WeakPolarHBondContact CD1-O 3.23Å; F1142-K1169 HydrophobicContact CE1-CB 3.77Å; T1147-K1169 HydrophobicContact CG2-CD 4.03Å; S1150-K1169 PolarHBondContact OG-NZ 3.1Å; L1166-K1169 WeakPolarHBondContact O-CB 3.45Å; L1166-K1169 PolarHBondContact O-N 2.98Å; I1167-K1169 PolarHBondContact O-N 3.23Å
1170	I	79	Confident	80.3	Confident	9 Å²	9	57.4 Å²	57.4	5%	0.046	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-77.7	136.4	177.7	-48.5	173.9	0	0	0	108.6	L1141 F1142 I1167 I1172 L1219	L1141-I1170 HydrophobicContact CD2-CG2 3.95Å; F1142-I1170 HydrophobicContact CD1-CG1 4.44Å; F1142-I1170 HydrophobicContact CE1-CG1 3.88Å; I1167-I1170 PolarHBondContact O-N 3.42Å; I1167-I1170 VanDerWaalsContact O-N 3.09Å; I1170-I1172 HydrophobicContact CB-CD1 4.3Å; I1170-I1172 HydrophobicContact CB-CG1 4.31Å; I1170-I1172 HydrophobicContact CG2-CD1 4.01Å; I1170-I1172 HydrophobicContact CG2-CG1 3.9Å; I1170-I1172 PolarHBondContact O-N 2.99Å; I1170-L1219 HydrophobicContact CD1-CD1 4.06Å; I1170-L1219 HydrophobicContact CD1-CD2 4.4Å; I1170-L1219 HydrophobicContact CG1-CD1 4.37Å
1171	D	75	Confident	80.3	Confident	149 Å²	149	56.7 Å²	56.7	80%	0.797	30%	0.3	S	S	*	.			trans	-75.4	68.9	-174.1	-161.8	11.5	0	0	0	112.8
1172	I	75.5	Confident	80.2	Confident	12 Å²	12	57 Å²	57	6%	0.062	30%	0.302	C	S	.	.			trans	-113.2	130.5	-179.6	-58	178	0	0	0	109	I1170 S1174 R1176 L1177 I1180 L1215	I1170-I1172 HydrophobicContact CB-CD1 4.3Å; I1170-I1172 HydrophobicContact CB-CG1 4.31Å; I1170-I1172 HydrophobicContact CG2-CD1 4.01Å; I1170-I1172 HydrophobicContact CG2-CG1 3.9Å; I1170-I1172 PolarHBondContact O-N 2.99Å; I1172-S1174 PolarHBondContact O-N 3.35Å; I1172-R1176 HydrophobicContact CG2-CB 4.07Å; I1172-L1177 HydrophobicContact CB-CD1 4.28Å; I1172-L1177 HydrophobicContact CG2-CB 4.48Å; I1172-I1180 HydrophobicContact CD1-CD1 3.99Å; I1172-I1180 HydrophobicContact CG2-CD1 4.18Å; I1172-L1215 HydrophobicContact CG1-CD1 4.48Å
1173	P	78.8	Confident	80.2	Confident	75 Å²	75	59.1 Å²	59.1	49%	0.487	30%	0.303	S	S	.	.			trans	-54.5	132.3	177.6	-27.1	34.7	0	0	0	112.9	N1175 R1176 L1177	P1173-N1175 VanDerWaalsContact C-N 3.31Å; P1173-N1175 PolarHBondContact O-N 3.14Å; P1173-N1175 VanDerWaalsContact O-N 3.11Å; P1173-R1176 WeakPolarHBondContact O-CA 3.42Å; P1173-R1176 PolarHBondContact O-N 3.21Å; P1173-L1177 PolarHBondContact O-N 3.3Å
1174	S	73.7	Confident	80.3	Confident	73 Å²	73	58.9 Å²	58.9	51%	0.51	30%	0.301	S	S	.	.	H	α-helix	trans	-43.9	-49.1	-172.7	53.2	0	0	0	0	114.4	I1172 R1176 L1177 D1178	I1172-S1174 PolarHBondContact O-N 3.35Å; S1174-R1176 PolarHBondContact O-N 3.4Å; S1174-L1177 WeakPolarHBondContact O-CB 3.41Å; S1174-L1177 PolarHBondContact O-N 3.09Å; S1174-D1178 PolarHBondContact O-N 3.1Å
1175	N	74.5	Confident	80.4	Confident	144 Å²	144	63.1 Å²	63.1	77%	0.77	32%	0.318	S	S	*	.	H	α-helix	trans	-58.6	-22.5	-178.8	-60.6	11.2	0	0	0	113.9	P1173	P1173-N1175 VanDerWaalsContact C-N 3.31Å; P1173-N1175 PolarHBondContact O-N 3.14Å; P1173-N1175 VanDerWaalsContact O-N 3.11Å
1176	R	77	Confident	80.4	Confident	107 Å²	107	66.3 Å²	66.3	40%	0.404	33%	0.33	S	S	.	.	H	α-helix	trans	-96.7	-37.4	172.7	-66.2	-167.5	-68.9	145.8	-1.9	111.6	I1172 P1173 S1174 D1178 S1179 I1180 D1212	I1172-R1176 HydrophobicContact CG2-CB 4.07Å; P1173-R1176 WeakPolarHBondContact O-CA 3.42Å; P1173-R1176 PolarHBondContact O-N 3.21Å; S1174-R1176 PolarHBondContact O-N 3.4Å; R1176-D1178 VanDerWaalsContact C-N 3.32Å; R1176-D1178 PolarHBondContact O-N 2.94Å; R1176-S1179 PolarHBondContact O-N 2.94Å; R1176-S1179 VanDerWaalsContact O-N 3.15Å; R1176-S1179 PolarHBondContact O-OG 3.04Å; R1176-I1180 WeakPolarHBondContact O-CG1 3.29Å; R1176-I1180 PolarHBondContact O-N 2.89Å; R1176-I1180 VanDerWaalsContact O-N 3.08Å; R1176-D1212 IonicContact CZ-OD1 3.9Å; R1176-D1212 IonicContact CZ-OD2 3.55Å; R1176-D1212 IonicContact NH1-OD1 2.7Å; R1176-D1212 PolarHBondContact NH1-OD1 2.78Å; R1176-D1212 IonicContact NH1-OD2 3.35Å; R1176-D1212 PolarHBondContact NH1-OD2 3.06Å
1177	L	81.1	Confident	80.3	Confident	25 Å²	25	69.3 Å²	69.3	13%	0.131	35%	0.346	C	S	.	.	H	α-helix	trans	-52.4	-49.1	175	-171.1	74.5	0	0	0	111.4	I1167 I1172 P1173 S1174 S1179 I1180 L1181	I1167-L1177 HydrophobicContact CG2-CD1 4.04Å; I1172-L1177 HydrophobicContact CB-CD1 4.28Å; I1172-L1177 HydrophobicContact CG2-CB 4.48Å; P1173-L1177 PolarHBondContact O-N 3.3Å; S1174-L1177 WeakPolarHBondContact O-CB 3.41Å; S1174-L1177 PolarHBondContact O-N 3.09Å; L1177-S1179 VanDerWaalsContact C-N 3.31Å; L1177-S1179 PolarHBondContact O-N 2.88Å; L1177-I1180 WeakPolarHBondContact O-CA 3.43Å; L1177-I1180 WeakPolarHBondContact O-CB 3.39Å; L1177-I1180 PolarHBondContact O-N 3.43Å; L1177-L1181 HydrophobicContact CG-CD1 4.31Å; L1177-L1181 HydrophobicContact CG-CG 4.36Å; L1177-L1181 WeakPolarHBondContact O-CG 3.38Å; L1177-L1181 PolarHBondContact O-N 3.49Å
1178	D	80.7	Confident	80.4	Confident	96 Å²	96	73.8 Å²	73.8	51%	0.513	37%	0.369	S	S	.	.	H	α-helix	trans	-59.7	-40.7	179.8	-65.8	-30.3	0	0	0	111.9	S1174 R1176 I1180 L1181 D1182	S1174-D1178 PolarHBondContact O-N 3.1Å; R1176-D1178 VanDerWaalsContact C-N 3.32Å; R1176-D1178 PolarHBondContact O-N 2.94Å; D1178-I1180 VanDerWaalsContact C-N 3.27Å; D1178-I1180 PolarHBondContact O-N 3.1Å; D1178-L1181 PolarHBondContact O-N 2.81Å; D1178-D1182 WeakPolarHBondContact O-CB 3.22Å; D1178-D1182 PolarHBondContact O-N 3.37Å
1179	S	80.9	Confident	80.3	Confident	54 Å²	54	68.3 Å²	68.3	38%	0.378	35%	0.349	S	S	.	.	H	α-helix	trans	-68.4	-22.9	176.5	77.2	0	0	0	0	114.3	R1176 L1177 R1183	R1176-S1179 PolarHBondContact O-N 2.94Å; R1176-S1179 VanDerWaalsContact O-N 3.15Å; R1176-S1179 PolarHBondContact O-OG 3.04Å; L1177-S1179 VanDerWaalsContact C-N 3.31Å; L1177-S1179 PolarHBondContact O-N 2.88Å; S1179-R1183 WeakPolarHBondContact O-CD 3.47Å; S1179-R1183 WeakPolarHBondContact O-CG 3.45Å
1180	I	80.4	Confident	80.4	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-79.8	-47	171.9	-67.3	162.2	0	0	0	109.1	I1167 I1172 R1176 L1177 D1178 D1182 R1183 F1184 L1208 D1212 I1216	I1167-I1180 HydrophobicContact CG2-CG2 4.2Å; I1172-I1180 HydrophobicContact CD1-CD1 3.99Å; I1172-I1180 HydrophobicContact CG2-CD1 4.18Å; R1176-I1180 WeakPolarHBondContact O-CG1 3.29Å; R1176-I1180 PolarHBondContact O-N 2.89Å; R1176-I1180 VanDerWaalsContact O-N 3.08Å; L1177-I1180 WeakPolarHBondContact O-CA 3.43Å; L1177-I1180 WeakPolarHBondContact O-CB 3.39Å; L1177-I1180 PolarHBondContact O-N 3.43Å; D1178-I1180 VanDerWaalsContact C-N 3.27Å; D1178-I1180 PolarHBondContact O-N 3.1Å; I1180-D1182 PolarHBondContact O-N 3.31Å; I1180-R1183 WeakPolarHBondContact O-CB 3.43Å; I1180-R1183 PolarHBondContact O-N 2.92Å; I1180-F1184 HydrophobicContact CG2-CD2 3.8Å; I1180-F1184 HydrophobicContact CG2-CE2 3.79Å; I1180-F1184 WeakPolarHBondContact O-CD2 3.44Å; I1180-F1184 PolarHBondContact O-N 3.4Å; I1180-L1208 HydrophobicContact CG1-CD2 3.8Å; I1180-D1212 HydrophobicContact CD1-CB 4.31Å; I1180-I1216 HydrophobicContact CD1-CD1 4.46Å; I1180-I1216 HydrophobicContact CG2-CD1 3.84Å
1181	L	84.1	Confident	80.4	Confident	10 Å²	10	65.4 Å²	65.4	5%	0.052	34%	0.34	C	S	.	.	H	α-helix	trans	-59.9	-43.7	178.8	-65.8	-173.3	0	0	0	111.7	V1164 I1167 R1168 L1177 D1178 R1183 F1184 Y1185	V1164-L1181 HydrophobicContact CB-CD2 4.39Å; V1164-L1181 HydrophobicContact CG1-CD1 4.45Å; V1164-L1181 HydrophobicContact CG1-CD2 3.89Å; V1164-L1181 HydrophobicContact CG2-CD2 4.25Å; I1167-L1181 HydrophobicContact CB-CD2 4.16Å; I1167-L1181 HydrophobicContact CG2-CD2 3.78Å; R1168-L1181 HydrophobicContact CG-CD1 3.99Å; L1177-L1181 HydrophobicContact CG-CD1 4.31Å; L1177-L1181 HydrophobicContact CG-CG 4.36Å; L1177-L1181 WeakPolarHBondContact O-CG 3.38Å; L1177-L1181 PolarHBondContact O-N 3.49Å; D1178-L1181 PolarHBondContact O-N 2.81Å; L1181-R1183 PolarHBondContact O-N 2.97Å; L1181-F1184 PolarHBondContact O-N 3.49Å; L1181-F1184 VanDerWaalsContact O-N 3.14Å; L1181-Y1185 VanDerWaalsContact O-CD2 3.24Å; L1181-Y1185 WeakPolarHBondContact O-CD2 3.36Å; L1181-Y1185 PolarHBondContact O-N 2.91Å
1182	D	83.3	Confident	80.7	Confident	97 Å²	97	63 Å²	63	52%	0.519	33%	0.327	S	S	.	.	H	α-helix	trans	-55.8	-37.9	173.1	-94.6	-1.5	0	0	0	112.2	D1178 I1180 Y1185 Q1186	D1178-D1182 WeakPolarHBondContact O-CB 3.22Å; D1178-D1182 PolarHBondContact O-N 3.37Å; I1180-D1182 PolarHBondContact O-N 3.31Å; D1182-Y1185 PolarHBondContact O-N 2.78Å; D1182-Q1186 VanDerWaalsContact O-CB 3.27Å; D1182-Q1186 WeakPolarHBondContact O-CB 3.46Å; D1182-Q1186 WeakPolarHBondContact O-CG 3.32Å; D1182-Q1186 PolarHBondContact O-N 3.5Å
1183	R	81.4	Confident	81	Confident	77 Å²	77	65.1 Å²	65.1	29%	0.291	34%	0.34	S	S	.	.	H	α-helix	trans	-72.5	-39.1	176.7	-69.7	173.8	-175.3	-164.8	2	112.4	S1179 I1180 L1181 Y1185 Q1186 L1187 M1206 Q1207	S1179-R1183 WeakPolarHBondContact O-CD 3.47Å; S1179-R1183 WeakPolarHBondContact O-CG 3.45Å; I1180-R1183 WeakPolarHBondContact O-CB 3.43Å; I1180-R1183 PolarHBondContact O-N 2.92Å; L1181-R1183 PolarHBondContact O-N 2.97Å; R1183-Y1185 VanDerWaalsContact C-N 3.33Å; R1183-Y1185 PolarHBondContact O-N 2.94Å; R1183-Q1186 PolarHBondContact O-N 2.91Å; R1183-L1187 WeakPolarHBondContact O-CB 3.47Å; R1183-L1187 WeakPolarHBondContact O-CG 3.14Å; R1183-L1187 PolarHBondContact O-N 2.93Å; R1183-M1206 HydrophobicContact CB-SD 4.35Å; R1183-M1206 WeakPolarHBondContact CD-O 3.29Å; R1183-M1206 PolarHBondContact NH1-O 3.36Å; R1183-Q1207 PolarHBondContact NH1-O 2.91Å
1184	F	84.2	Confident	81.2	Confident	3 Å²	3	61.7 Å²	61.7	1%	0.013	32%	0.318	C	S	.	.	H	α-helix	trans	-62.1	-40	172.1	-88.3	-94	0	0	0	111.9	V1163 V1164 I1167 I1180 L1181 N1188 L1189 L1194 M1206 I1216	V1163-F1184 HydrophobicContact CG1-CD1 4.2Å; V1163-F1184 HydrophobicContact CG1-CE1 4.03Å; V1164-F1184 HydrophobicContact CG2-CB 4.45Å; I1167-F1184 HydrophobicContact CD1-CD1 3.65Å; I1167-F1184 HydrophobicContact CD1-CD2 3.72Å; I1167-F1184 HydrophobicContact CD1-CE1 3.48Å; I1167-F1184 VanDerWaalsContact CD1-CE1 3.48Å; I1167-F1184 HydrophobicContact CD1-CE2 3.51Å; I1167-F1184 HydrophobicContact CD1-CG 3.79Å; I1167-F1184 HydrophobicContact CD1-CZ 3.4Å; I1167-F1184 VanDerWaalsContact CD1-CZ 3.4Å; I1167-F1184 HydrophobicContact CG1-CZ 4.46Å; I1180-F1184 HydrophobicContact CG2-CD2 3.8Å; I1180-F1184 HydrophobicContact CG2-CE2 3.79Å; I1180-F1184 WeakPolarHBondContact O-CD2 3.44Å; I1180-F1184 PolarHBondContact O-N 3.4Å; L1181-F1184 PolarHBondContact O-N 3.49Å; L1181-F1184 VanDerWaalsContact O-N 3.14Å; F1184-N1188 WeakPolarHBondContact O-CA 3.34Å; F1184-N1188 PolarHBondContact O-N 3.19Å; F1184-L1189 HydrophobicContact CD1-CB 3.71Å; F1184-L1189 HydrophobicContact CD1-CD1 3.92Å; F1184-L1189 HydrophobicContact CD1-CG 4.46Å; F1184-L1189 HydrophobicContact CE1-CB 4.11Å; F1184-L1189 HydrophobicContact CE1-CD1 4.03Å; F1184-L1189 HydrophobicContact CG-CD1 4.34Å; F1184-L1189 PolarHBondContact O-N 2.96Å; F1184-L1194 HydrophobicContact CE1-CD1 4.21Å; F1184-L1194 HydrophobicContact CE1-CD2 4.47Å; F1184-M1206 HydrophobicContact CD1-CE 4.42Å; F1184-M1206 HydrophobicContact CD2-CE 3.79Å; F1184-M1206 HydrophobicContact CE1-CE 3.96Å; F1184-M1206 HydrophobicContact CE2-CE 3.28Å; F1184-M1206 HydrophobicContact CE2-SD 4.46Å; F1184-M1206 HydrophobicContact CG-CE 4.34Å; F1184-M1206 HydrophobicContact CZ-CE 3.36Å; F1184-I1216 HydrophobicContact CE2-CD1 4.3Å; F1184-I1216 HydrophobicContact CZ-CG2 4.08Å
1185	Y	85.7	Confident	81.6	Confident	90 Å²	90	59.7 Å²	59.7	35%	0.353	31%	0.306	S	S	.	.	H	α-helix	trans	-69	-44.4	173.9	-79	-65.9	0	0	0	112.6	L1160 D1161 V1164 L1181 D1182 R1183 L1187 N1188	L1160-Y1185 HydrophobicContact CD2-CD1 3.49Å; L1160-Y1185 VanDerWaalsContact CD2-CD1 3.49Å; L1160-Y1185 HydrophobicContact CD2-CE1 3.77Å; L1160-Y1185 HydrophobicContact CD2-CG 4.49Å; L1160-Y1185 HydrophobicContact CG-CD1 4.3Å; L1160-Y1185 HydrophobicContact CG-CE1 4.28Å; D1161-Y1185 PolarHBondContact OD1-OH 3.41Å; D1161-Y1185 VanDerWaalsContact OD1-OH 3.11Å; V1164-Y1185 HydrophobicContact CG1-CE2 4.23Å; V1164-Y1185 HydrophobicContact CG2-CE2 4.04Å; L1181-Y1185 VanDerWaalsContact O-CD2 3.24Å; L1181-Y1185 WeakPolarHBondContact O-CD2 3.36Å; L1181-Y1185 PolarHBondContact O-N 2.91Å; D1182-Y1185 PolarHBondContact O-N 2.78Å; R1183-Y1185 VanDerWaalsContact C-N 3.33Å; R1183-Y1185 PolarHBondContact O-N 2.94Å; Y1185-L1187 PolarHBondContact O-N 3.29Å; Y1185-N1188 PolarHBondContact O-N 3.47Å
1186	Q	84	Confident	81.8	Confident	148 Å²	148	57.9 Å²	57.9	69%	0.692	30%	0.3	S	S	*	.	H	α-helix	trans	-64.2	-37.4	178.5	-76	167	27.3	0	0	113.3	D1182 R1183	D1182-Q1186 VanDerWaalsContact O-CB 3.27Å; D1182-Q1186 WeakPolarHBondContact O-CB 3.46Å; D1182-Q1186 WeakPolarHBondContact O-CG 3.32Å; D1182-Q1186 PolarHBondContact O-N 3.5Å; R1183-Q1186 PolarHBondContact O-N 2.91Å
1187	L	81.3	Confident	81.8	Confident	74 Å²	74	54.5 Å²	54.5	39%	0.387	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-2.2	178.7	-63.2	175.7	0	0	0	113.4	R1183 Y1185 L1189 M1206	R1183-L1187 WeakPolarHBondContact O-CB 3.47Å; R1183-L1187 WeakPolarHBondContact O-CG 3.14Å; R1183-L1187 PolarHBondContact O-N 2.93Å; Y1185-L1187 PolarHBondContact O-N 3.29Å; L1187-L1189 VanDerWaalsContact C-N 3.3Å; L1187-L1189 HydrophobicContact CB-CD1 3.96Å; L1187-L1189 HydrophobicContact CB-CD2 4.23Å; L1187-L1189 HydrophobicContact CB-CG 3.71Å; L1187-L1189 HydrophobicContact CD1-CD1 4.18Å; L1187-L1189 PolarHBondContact O-N 2.96Å; L1187-M1206 HydrophobicContact CD1-SD 4.22Å
1188	N	83.6	Confident	81.8	Confident	94 Å²	94	56.3 Å²	56.3	50%	0.503	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.2	47.3	-178.9	-169.8	22.4	0	0	0	113.9	F1184 Y1185 C1190	F1184-N1188 WeakPolarHBondContact O-CA 3.34Å; F1184-N1188 PolarHBondContact O-N 3.19Å; Y1185-N1188 PolarHBondContact O-N 3.47Å; N1188-C1190 VanDerWaalsContact C-N 3.29Å; N1188-C1190 PolarHBondContact O-N 3.38Å
1189	L	82.3	Confident	81.7	Confident	10 Å²	10	53.3 Å²	53.3	5%	0.052	29%	0.29	C	S	.	.			trans	-76.8	73.7	-172.3	-67.5	171.4	0	0	0	112.7	F1184 L1187 V1193 L1194 L1202 M1206	F1184-L1189 HydrophobicContact CD1-CB 3.71Å; F1184-L1189 HydrophobicContact CD1-CD1 3.92Å; F1184-L1189 HydrophobicContact CD1-CG 4.46Å; F1184-L1189 HydrophobicContact CE1-CB 4.11Å; F1184-L1189 HydrophobicContact CE1-CD1 4.03Å; F1184-L1189 HydrophobicContact CG-CD1 4.34Å; F1184-L1189 PolarHBondContact O-N 2.96Å; L1187-L1189 VanDerWaalsContact C-N 3.3Å; L1187-L1189 HydrophobicContact CB-CD1 3.96Å; L1187-L1189 HydrophobicContact CB-CD2 4.23Å; L1187-L1189 HydrophobicContact CB-CG 3.71Å; L1187-L1189 HydrophobicContact CD1-CD1 4.18Å; L1187-L1189 PolarHBondContact O-N 2.96Å; L1189-V1193 HydrophobicContact CD2-CG1 4.13Å; L1189-L1194 HydrophobicContact CB-CD1 4.42Å; L1189-L1194 HydrophobicContact CB-CD2 4.19Å; L1189-L1194 HydrophobicContact CB-CG 4.29Å; L1189-L1194 HydrophobicContact CD2-CD2 4.34Å; L1189-L1194 WeakPolarHBondContact O-CD1 3.39Å; L1189-L1202 HydrophobicContact CD1-CD1 3.87Å; L1189-L1202 HydrophobicContact CD2-CD1 3.72Å; L1189-L1202 HydrophobicContact CG-CD1 4.47Å; L1189-M1206 HydrophobicContact CD1-CE 3.26Å; L1189-M1206 HydrophobicContact CD1-SD 4.21Å
1190	C	81.6	Confident	81.6	Confident	35 Å²	35	54.9 Å²	54.9	24%	0.236	30%	0.299	C	S	.	.			trans	-65	155.7	169.2	-64.9	0	0	0	0	111.5	N1188 L1192 V1193 L1194	N1188-C1190 VanDerWaalsContact C-N 3.29Å; N1188-C1190 PolarHBondContact O-N 3.38Å; C1190-L1192 VanDerWaalsContact C-N 3.29Å; C1190-L1192 PolarHBondContact O-N 2.99Å; C1190-V1193 HydrophobicContact CB-CG2 4.43Å; C1190-V1193 WeakPolarHBondContact O-CA 3.36Å; C1190-V1193 WeakPolarHBondContact O-CB 3.43Å; C1190-V1193 PolarHBondContact O-N 3.31Å; C1190-L1194 PolarHBondContact O-N 3.19Å
1191	G	79.4	Confident	81.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-57.3	-36.5	-178.3	0	0	0	0	0	114.3	L1155 M1158 V1193 L1194 A1195	L1155-G1191 CarbonylContact O-C 3.58Å; L1155-G1191 WeakPolarHBondContact O-CA 3.27Å; M1158-G1191 WeakPolarHBondContact O-CA 3.47Å; M1158-G1191 PolarHBondContact O-N 3.5Å; G1191-V1193 VanDerWaalsContact C-N 3.34Å; G1191-V1193 PolarHBondContact O-N 3.07Å; G1191-L1194 PolarHBondContact O-N 3.03Å; G1191-A1195 WeakPolarHBondContact O-CB 3.33Å; G1191-A1195 PolarHBondContact O-N 3.34Å
1192	L	80.5	Confident	81.4	Confident	100 Å²	100	61 Å²	61	52%	0.524	33%	0.327	S	S	.	.	H	α-helix	trans	-57.2	-42.9	171.4	-176.1	66.8	0	0	0	112.8	V1156 C1190 A1195 T1196	V1156-L1192 HydrophobicContact CG1-CD1 3.83Å; C1190-L1192 VanDerWaalsContact C-N 3.29Å; C1190-L1192 PolarHBondContact O-N 2.99Å; L1192-A1195 PolarHBondContact O-N 3.36Å; L1192-T1196 PolarHBondContact O-N 3.46Å; L1192-T1196 PolarHBondContact O-OG1 3.38Å
1193	V	82.4	Confident	81.3	Confident	55 Å²	55	61 Å²	61	33%	0.333	32%	0.323	S	S	.	.	H	α-helix	trans	-68.8	-42.3	177.6	-177.9	0	0	0	0	110	L1189 C1190 G1191 A1195 T1196 C1197	L1189-V1193 HydrophobicContact CD2-CG1 4.13Å; C1190-V1193 HydrophobicContact CB-CG2 4.43Å; C1190-V1193 WeakPolarHBondContact O-CA 3.36Å; C1190-V1193 WeakPolarHBondContact O-CB 3.43Å; C1190-V1193 PolarHBondContact O-N 3.31Å; G1191-V1193 VanDerWaalsContact C-N 3.34Å; G1191-V1193 PolarHBondContact O-N 3.07Å; V1193-A1195 VanDerWaalsContact C-N 3.31Å; V1193-A1195 PolarHBondContact O-N 2.95Å; V1193-T1196 PolarHBondContact O-N 3.42Å; V1193-T1196 PolarHBondContact O-OG1 3.17Å; V1193-C1197 VanDerWaalsContact O-CB 3.27Å; V1193-C1197 WeakPolarHBondContact O-CB 3.46Å; V1193-C1197 PolarHBondContact O-N 3.12Å; V1193-C1197 PolarHBondContact O-SG 3.46Å; V1193-C1197 VanDerWaalsContact O-SG 3.38Å
1194	L	82.8	Confident	81.3	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-65.4	-34.6	178	-68	167.9	0	0	0	112.2	V1163 F1184 L1189 C1190 G1191 L1202 L1220 K1224	V1163-L1194 HydrophobicContact CG1-CD1 3.66Å; V1163-L1194 HydrophobicContact CG2-CD1 4.22Å; F1184-L1194 HydrophobicContact CE1-CD1 4.21Å; F1184-L1194 HydrophobicContact CE1-CD2 4.47Å; L1189-L1194 HydrophobicContact CB-CD1 4.42Å; L1189-L1194 HydrophobicContact CB-CD2 4.19Å; L1189-L1194 HydrophobicContact CB-CG 4.29Å; L1189-L1194 HydrophobicContact CD2-CD2 4.34Å; L1189-L1194 WeakPolarHBondContact O-CD1 3.39Å; C1190-L1194 PolarHBondContact O-N 3.19Å; G1191-L1194 PolarHBondContact O-N 3.03Å; L1194-L1202 HydrophobicContact CD2-CD1 4.35Å; L1194-L1202 HydrophobicContact CD2-CD2 3.73Å; L1194-L1220 HydrophobicContact CB-CD2 4Å; L1194-L1220 HydrophobicContact CD1-CD2 4.06Å; L1194-L1220 HydrophobicContact CD2-CD1 4.14Å; L1194-L1220 HydrophobicContact CD2-CD2 3.97Å; L1194-L1220 HydrophobicContact CG-CD2 4.23Å; L1194-K1224 WeakPolarHBondContact O-CE 3.41Å; L1194-K1224 PolarHBondContact O-NZ 3.26Å
1195	A	81.3	Confident	81	Confident	31 Å²	31	65.4 Å²	65.4	26%	0.256	36%	0.357	S	S	.	.	H	α-helix	trans	-65.2	-46.4	173.8	0	0	0	0	0	112.1	L1155 V1156 G1191 L1192 V1193 K1224	L1155-A1195 HydrophobicContact CD2-CB 4.19Å; L1155-A1195 HydrophobicContact CG-CB 4.38Å; V1156-A1195 HydrophobicContact CG2-CB 4.48Å; G1191-A1195 WeakPolarHBondContact O-CB 3.33Å; G1191-A1195 PolarHBondContact O-N 3.34Å; L1192-A1195 PolarHBondContact O-N 3.36Å; V1193-A1195 VanDerWaalsContact C-N 3.31Å; V1193-A1195 PolarHBondContact O-N 2.95Å; A1195-K1224 WeakPolarHBondContact O-CE 3.43Å; A1195-K1224 PolarHBondContact O-NZ 3.44Å
1196	T	80.3	Confident	80.5	Confident	106 Å²	106	61.2 Å²	61.2	65%	0.65	34%	0.341	S	S	*	.	H	α-helix	trans	-81.8	-35.7	-176	55.8	0	0	0	0	114.5	L1192 V1193	L1192-T1196 PolarHBondContact O-N 3.46Å; L1192-T1196 PolarHBondContact O-OG1 3.38Å; V1193-T1196 PolarHBondContact O-N 3.42Å; V1193-T1196 PolarHBondContact O-OG1 3.17Å
1197	C	76.9	Confident	80.2	Confident	37 Å²	37	61.5 Å²	61.5	25%	0.25	34%	0.342	C	S	.	.	S	Bend	trans	-65.7	138.7	-175.2	-78.6	0	0	0	0	113.1	V1193 K1224	V1193-C1197 VanDerWaalsContact O-CB 3.27Å; V1193-C1197 WeakPolarHBondContact O-CB 3.46Å; V1193-C1197 PolarHBondContact O-N 3.12Å; V1193-C1197 PolarHBondContact O-SG 3.46Å; V1193-C1197 VanDerWaalsContact O-SG 3.38Å; C1197-K1224 PolarHBondContact O-NZ 3.26Å
1198	P	79.9	Confident	79.9	Confident	62 Å²	62	59.2 Å²	59.2	40%	0.403	33%	0.33	S	S	.	.			trans	-75.1	138.5	171.4	33.6	-35.2	0	0	0	110.3	E1201 L1202	P1198-E1201 WeakPolarHBondContact CD-OE2 3.15Å; P1198-E1201 HydrophobicContact CG-CB 4.21Å; P1198-E1201 VanDerWaalsContact CG-CD 3.42Å; P1198-E1201 HydrophobicContact CG-CG 3.89Å; P1198-E1201 VanDerWaalsContact CG-OE2 3.26Å; P1198-E1201 WeakPolarHBondContact CG-OE2 3.29Å; P1198-E1201 PolarHBondContact O-N 2.9Å; P1198-L1202 PolarHBondContact O-N 3.44Å
1199	L	79.3	Confident	79.7	Confident	33 Å²	33	58.2 Å²	58.2	17%	0.173	33%	0.329	C	S	.	.	H	α-helix	trans	-58.3	-30.6	-173.8	-68.9	167.2	0	0	0	115.8	K1203 W1213 R1217 L1220 E1221	L1199-K1203 PolarHBondContact O-N 3.41Å; L1199-K1203 VanDerWaalsContact O-N 3.11Å; L1199-W1213 HydrophobicContact CD2-CH2 4.39Å; L1199-W1213 WeakPolarHBondContact O-CZ2 3.41Å; L1199-R1217 HydrophobicContact CD1-CG 4.37Å; L1199-L1220 HydrophobicContact CD2-CB 4.36Å; L1199-L1220 HydrophobicContact CD2-CD1 4.41Å; L1199-E1221 HydrophobicContact CD1-CG 3.61Å; L1199-E1221 VanDerWaalsContact CD1-OE1 3.3Å; L1199-E1221 WeakPolarHBondContact CD1-OE1 3.42Å
1200	P	78.1	Confident	79.5	Confident	88 Å²	88	64 Å²	64	57%	0.571	36%	0.359	S	S	*	.	H	α-helix	trans	-63.2	-45.7	174.6	-24.7	35.9	0	0	0	113.7	L1202 K1203 D1204	P1200-L1202 VanDerWaalsContact C-N 3.32Å; P1200-L1202 PolarHBondContact O-N 3.49Å; P1200-K1203 WeakPolarHBondContact O-CB 3.27Å; P1200-K1203 PolarHBondContact O-N 2.95Å; P1200-K1203 VanDerWaalsContact O-N 3.14Å; P1200-D1204 PolarHBondContact O-N 3.17Å; P1200-D1204 VanDerWaalsContact O-N 3.15Å
1201	E	79.8	Confident	79.4	Confident	130 Å²	130	64.3 Å²	64.3	61%	0.607	37%	0.368	S	S	*	.	H	α-helix	trans	-66.7	-36.4	-178.8	-64.9	175.1	178.8	0	0	111.5	P1198 K1203 D1204 S1205	P1198-E1201 WeakPolarHBondContact CD-OE2 3.15Å; P1198-E1201 HydrophobicContact CG-CB 4.21Å; P1198-E1201 VanDerWaalsContact CG-CD 3.42Å; P1198-E1201 HydrophobicContact CG-CG 3.89Å; P1198-E1201 VanDerWaalsContact CG-OE2 3.26Å; P1198-E1201 WeakPolarHBondContact CG-OE2 3.29Å; P1198-E1201 PolarHBondContact O-N 2.9Å; E1201-K1203 VanDerWaalsContact C-N 3.33Å; E1201-D1204 PolarHBondContact O-N 3.42Å; E1201-S1205 WeakPolarHBondContact O-CB 3.43Å; E1201-S1205 PolarHBondContact O-N 2.85Å; E1201-S1205 VanDerWaalsContact O-N 3.11Å; E1201-S1205 PolarHBondContact O-OG 3.48Å
1202	L	81.8	Confident	79.5	Confident	8 Å²	8	64.8 Å²	64.8	4%	0.042	37%	0.37	C	S	.	.	H	α-helix	trans	-66.2	-35.2	174.1	-170.3	66.8	0	0	0	111.9	L1189 L1194 P1198 P1200 S1205 M1206 W1213 L1220	L1189-L1202 HydrophobicContact CD1-CD1 3.87Å; L1189-L1202 HydrophobicContact CD2-CD1 3.72Å; L1189-L1202 HydrophobicContact CG-CD1 4.47Å; L1194-L1202 HydrophobicContact CD2-CD1 4.35Å; L1194-L1202 HydrophobicContact CD2-CD2 3.73Å; P1198-L1202 PolarHBondContact O-N 3.44Å; P1200-L1202 VanDerWaalsContact C-N 3.32Å; P1200-L1202 PolarHBondContact O-N 3.49Å; L1202-S1205 WeakPolarHBondContact CA-OG 3.37Å; L1202-S1205 PolarHBondContact O-OG 3.47Å; L1202-M1206 HydrophobicContact CD1-CE 4.43Å; L1202-M1206 HydrophobicContact CD1-CG 4.36Å; L1202-M1206 HydrophobicContact CG-CG 4.31Å; L1202-M1206 WeakPolarHBondContact O-CB 3.28Å; L1202-M1206 WeakPolarHBondContact O-CG 3.49Å; L1202-M1206 PolarHBondContact O-N 3.08Å; L1202-W1213 HydrophobicContact CB-CH2 4.03Å; L1202-W1213 HydrophobicContact CB-CZ3 4.47Å; L1202-W1213 HydrophobicContact CD2-CH2 4.08Å; L1202-W1213 HydrophobicContact CD2-CZ3 4.2Å; L1202-W1213 HydrophobicContact CG-CH2 4.04Å; L1202-W1213 HydrophobicContact CG-CZ3 4.05Å; L1202-L1220 HydrophobicContact CD2-CD1 3.56Å
1203	K	81.5	Confident	79.7	Confident	97 Å²	97	60.7 Å²	60.7	42%	0.422	35%	0.348	S	S	.	.	H	α-helix	trans	-64.1	-47.9	175.9	-174.6	-164.3	171.3	-146.3	0	111.7	L1199 P1200 E1201 M1206 Q1207 W1213	L1199-K1203 PolarHBondContact O-N 3.41Å; L1199-K1203 VanDerWaalsContact O-N 3.11Å; P1200-K1203 WeakPolarHBondContact O-CB 3.27Å; P1200-K1203 PolarHBondContact O-N 2.95Å; P1200-K1203 VanDerWaalsContact O-N 3.14Å; E1201-K1203 VanDerWaalsContact C-N 3.33Å; K1203-M1206 PolarHBondContact O-N 3.27Å; K1203-Q1207 PolarHBondContact O-N 2.93Å; K1203-W1213 HydrophobicContact CB-CD2 4.18Å; K1203-W1213 HydrophobicContact CB-CH2 4Å; K1203-W1213 HydrophobicContact CB-CZ2 3.59Å; K1203-W1213 HydrophobicContact CB-CZ3 4.45Å; K1203-W1213 HydrophobicContact CG-CD2 3.98Å; K1203-W1213 HydrophobicContact CG-CG 4.21Å; K1203-W1213 HydrophobicContact CG-CZ2 4.17Å
1204	D	80.6	Confident	79.7	Confident	113 Å²	113	61.5 Å²	61.5	60%	0.604	35%	0.353	S	S	*	.	H	α-helix	trans	-74.2	-30.9	-172.5	-67.6	-11.7	0	0	0	111.9	P1200 E1201	P1200-D1204 PolarHBondContact O-N 3.17Å; P1200-D1204 VanDerWaalsContact O-N 3.15Å; E1201-D1204 PolarHBondContact O-N 3.42Å
1205	S	78	Confident	79.8	Confident	60 Å²	60	64.5 Å²	64.5	42%	0.42	37%	0.369	S	S	.	.	H	α-helix	trans	-74	-35	169.7	51.9	0	0	0	0	113.5	E1201 L1202	E1201-S1205 WeakPolarHBondContact O-CB 3.43Å; E1201-S1205 PolarHBondContact O-N 2.85Å; E1201-S1205 VanDerWaalsContact O-N 3.11Å; E1201-S1205 PolarHBondContact O-OG 3.48Å; L1202-S1205 WeakPolarHBondContact CA-OG 3.37Å; L1202-S1205 PolarHBondContact O-OG 3.47Å
1206	M	74.4	Confident	79.9	Confident	2 Å²	2	63 Å²	63	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-70.7	-30.2	179.9	-83.5	-73.1	-156.5	0	0	114.9	R1183 F1184 L1187 L1189 L1202 K1203 L1208 W1213	R1183-M1206 HydrophobicContact CB-SD 4.35Å; R1183-M1206 WeakPolarHBondContact CD-O 3.29Å; R1183-M1206 PolarHBondContact NH1-O 3.36Å; F1184-M1206 HydrophobicContact CD1-CE 4.42Å; F1184-M1206 HydrophobicContact CD2-CE 3.79Å; F1184-M1206 HydrophobicContact CE1-CE 3.96Å; F1184-M1206 HydrophobicContact CE2-CE 3.28Å; F1184-M1206 HydrophobicContact CE2-SD 4.46Å; F1184-M1206 HydrophobicContact CG-CE 4.34Å; F1184-M1206 HydrophobicContact CZ-CE 3.36Å; L1187-M1206 HydrophobicContact CD1-SD 4.22Å; L1189-M1206 HydrophobicContact CD1-CE 3.26Å; L1189-M1206 HydrophobicContact CD1-SD 4.21Å; L1202-M1206 HydrophobicContact CD1-CE 4.43Å; L1202-M1206 HydrophobicContact CD1-CG 4.36Å; L1202-M1206 HydrophobicContact CG-CG 4.31Å; L1202-M1206 WeakPolarHBondContact O-CB 3.28Å; L1202-M1206 WeakPolarHBondContact O-CG 3.49Å; L1202-M1206 PolarHBondContact O-N 3.08Å; K1203-M1206 PolarHBondContact O-N 3.27Å; M1206-L1208 HydrophobicContact CB-CD1 4.07Å; M1206-L1208 HydrophobicContact CB-CG 4.09Å; M1206-L1208 HydrophobicContact CG-CD1 4.32Å; M1206-L1208 PolarHBondContact O-N 3.22Å; M1206-L1208 VanDerWaalsContact O-N 3.12Å; M1206-L1208 HydrophobicContact SD-CD1 4.02Å; M1206-W1213 HydrophobicContact CG-CZ3 4.3Å
1207	Q	78.5	Confident	80.1	Confident	154 Å²	154	63.1 Å²	63.1	72%	0.72	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	35.3	-176.8	-57.2	-171	2.2	0	0	114.9	R1183 K1203	R1183-Q1207 PolarHBondContact NH1-O 2.91Å; K1203-Q1207 PolarHBondContact O-N 2.93Å
1208	L	75	Confident	80.4	Confident	26 Å²	26	63.8 Å²	63.8	14%	0.136	35%	0.346	C	S	.	.			trans	-85.4	151.7	-177.4	-74.5	171.1	0	0	0	112.3	I1180 M1206 W1213 I1216	I1180-L1208 HydrophobicContact CG1-CD2 3.8Å; M1206-L1208 HydrophobicContact CB-CD1 4.07Å; M1206-L1208 HydrophobicContact CB-CG 4.09Å; M1206-L1208 HydrophobicContact CG-CD1 4.32Å; M1206-L1208 PolarHBondContact O-N 3.22Å; M1206-L1208 VanDerWaalsContact O-N 3.12Å; M1206-L1208 HydrophobicContact SD-CD1 4.02Å; L1208-W1213 HydrophobicContact CB-CB 4.2Å; L1208-I1216 HydrophobicContact CD1-CD1 3.64Å
1209	P	79.7	Confident	80.7	Confident	73 Å²	73	61.1 Å²	61.1	47%	0.474	33%	0.328	S	S	.	.			trans	-63.7	150.9	171.3	30	-35.7	0	0	0	110.5	G1211 D1212 W1213	P1209-G1211 VanDerWaalsContact C-N 3.29Å; P1209-G1211 PolarHBondContact O-N 3.2Å; P1209-G1211 VanDerWaalsContact O-N 3.12Å; P1209-D1212 HydrophobicContact CG-CB 4.07Å; P1209-D1212 VanDerWaalsContact CG-OD2 3.28Å; P1209-D1212 WeakPolarHBondContact CG-OD2 3.38Å; P1209-D1212 PolarHBondContact O-N 2.87Å; P1209-W1213 PolarHBondContact O-N 2.75Å
1210	L	77.1	Confident	80.8	Confident	131 Å²	131	59.8 Å²	59.8	69%	0.686	32%	0.321	S	S	*	.	H	α-helix	trans	-52.5	-42.8	-167.9	-165.6	81.1	0	0	0	113.6	T1214	L1210-T1214 WeakPolarHBondContact O-CG2 3.24Å; L1210-T1214 PolarHBondContact O-N 3.21Å; L1210-T1214 PolarHBondContact O-OG1 2.97Å; L1210-T1214 VanDerWaalsContact O-OG1 3.11Å
1211	G	79.2	Confident	81	Confident	41 Å²	41	58.9 Å²	58.9	42%	0.423	31%	0.309	S	S	.	.	H	α-helix	trans	-63.3	-50.9	-179.3	0	0	0	0	0	113.4	P1209 W1213 T1214 L1215	P1209-G1211 VanDerWaalsContact C-N 3.29Å; P1209-G1211 PolarHBondContact O-N 3.2Å; P1209-G1211 VanDerWaalsContact O-N 3.12Å; G1211-W1213 VanDerWaalsContact C-N 3.31Å; G1211-W1213 PolarHBondContact O-N 2.87Å; G1211-T1214 WeakPolarHBondContact CA-OG1 3.28Å; G1211-T1214 PolarHBondContact O-N 3.01Å; G1211-T1214 PolarHBondContact O-OG1 3.08Å; G1211-L1215 PolarHBondContact O-N 3.41Å; G1211-L1215 VanDerWaalsContact O-N 3.07Å
1212	D	81.5	Confident	80.9	Confident	11 Å²	11	53 Å²	53	6%	0.059	28%	0.283	C	S	.	.	H	α-helix	trans	-68.2	-35.8	-178.1	-57.1	-18	0	0	0	110.4	R1176 I1180 P1209 L1215 I1216	R1176-D1212 IonicContact CZ-OD1 3.9Å; R1176-D1212 IonicContact CZ-OD2 3.55Å; R1176-D1212 IonicContact NH1-OD1 2.7Å; R1176-D1212 PolarHBondContact NH1-OD1 2.78Å; R1176-D1212 IonicContact NH1-OD2 3.35Å; R1176-D1212 PolarHBondContact NH1-OD2 3.06Å; I1180-D1212 HydrophobicContact CD1-CB 4.31Å; P1209-D1212 HydrophobicContact CG-CB 4.07Å; P1209-D1212 VanDerWaalsContact CG-OD2 3.28Å; P1209-D1212 WeakPolarHBondContact CG-OD2 3.38Å; P1209-D1212 PolarHBondContact O-N 2.87Å; D1212-L1215 PolarHBondContact O-N 3.46Å; D1212-I1216 WeakPolarHBondContact O-CD1 3.38Å; D1212-I1216 WeakPolarHBondContact O-CG1 3.31Å; D1212-I1216 PolarHBondContact O-N 2.97Å; D1212-I1216 VanDerWaalsContact O-N 3.13Å
1213	W	85.1	Confident	80.8	Confident	14 Å²	14	53.2 Å²	53.2	5%	0.053	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-42.1	168.3	173.7	-107.8	0	0	0	112.6	L1199 L1202 K1203 M1206 L1208 P1209 G1211 L1215 I1216 R1217	L1199-W1213 HydrophobicContact CD2-CH2 4.39Å; L1199-W1213 WeakPolarHBondContact O-CZ2 3.41Å; L1202-W1213 HydrophobicContact CB-CH2 4.03Å; L1202-W1213 HydrophobicContact CB-CZ3 4.47Å; L1202-W1213 HydrophobicContact CD2-CH2 4.08Å; L1202-W1213 HydrophobicContact CD2-CZ3 4.2Å; L1202-W1213 HydrophobicContact CG-CH2 4.04Å; L1202-W1213 HydrophobicContact CG-CZ3 4.05Å; K1203-W1213 HydrophobicContact CB-CD2 4.18Å; K1203-W1213 HydrophobicContact CB-CH2 4Å; K1203-W1213 HydrophobicContact CB-CZ2 3.59Å; K1203-W1213 HydrophobicContact CB-CZ3 4.45Å; K1203-W1213 HydrophobicContact CG-CD2 3.98Å; K1203-W1213 HydrophobicContact CG-CG 4.21Å; K1203-W1213 HydrophobicContact CG-CZ2 4.17Å; M1206-W1213 HydrophobicContact CG-CZ3 4.3Å; L1208-W1213 HydrophobicContact CB-CB 4.2Å; P1209-W1213 PolarHBondContact O-N 2.75Å; G1211-W1213 VanDerWaalsContact C-N 3.31Å; G1211-W1213 PolarHBondContact O-N 2.87Å; W1213-L1215 VanDerWaalsContact C-N 3.34Å; W1213-L1215 PolarHBondContact O-N 3.01Å; W1213-I1216 PolarHBondContact O-N 3.49Å; W1213-R1217 HydrophobicContact CZ2-CB 4.2Å; W1213-R1217 HydrophobicContact CZ2-CG 4.48Å; W1213-R1217 WeakPolarHBondContact O-CB 3.32Å; W1213-R1217 PolarHBondContact O-N 2.97Å
1214	T	83.1	Confident	80.6	Confident	72 Å²	72	51.8 Å²	51.8	44%	0.442	28%	0.277	S	S	.	.	H	α-helix	trans	-64.8	-35.7	178.5	43.4	0	0	0	0	113.1	L1210 G1211 L1218	L1210-T1214 WeakPolarHBondContact O-CG2 3.24Å; L1210-T1214 PolarHBondContact O-N 3.21Å; L1210-T1214 PolarHBondContact O-OG1 2.97Å; L1210-T1214 VanDerWaalsContact O-OG1 3.11Å; G1211-T1214 WeakPolarHBondContact CA-OG1 3.28Å; G1211-T1214 PolarHBondContact O-N 3.01Å; G1211-T1214 PolarHBondContact O-OG1 3.08Å; T1214-L1218 VanDerWaalsContact O-CB 3.27Å; T1214-L1218 WeakPolarHBondContact O-CB 3.35Å; T1214-L1218 PolarHBondContact O-N 3.2Å
1215	L	84.8	Confident	80.3	Confident	65 Å²	65	52.4 Å²	52.4	34%	0.34	29%	0.285	S	S	.	.	H	α-helix	trans	-65.9	-50.1	174.7	-68.7	171.8	0	0	0	111.4	L1141 I1172 G1211 D1212 W1213 R1217 L1218 L1219	L1141-L1215 HydrophobicContact CD2-CB 4.46Å; L1141-L1215 HydrophobicContact CD2-CD2 4.31Å; I1172-L1215 HydrophobicContact CG1-CD1 4.48Å; G1211-L1215 PolarHBondContact O-N 3.41Å; G1211-L1215 VanDerWaalsContact O-N 3.07Å; D1212-L1215 PolarHBondContact O-N 3.46Å; W1213-L1215 VanDerWaalsContact C-N 3.34Å; W1213-L1215 PolarHBondContact O-N 3.01Å; L1215-R1217 VanDerWaalsContact C-N 3.34Å; L1215-R1217 PolarHBondContact O-N 3.04Å; L1215-L1218 PolarHBondContact O-N 2.87Å; L1215-L1219 PolarHBondContact O-N 3.34Å
1216	I	84	Confident	79.9	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-63.4	-40.9	178.6	-68.9	161.2	0	0	0	111	I1180 F1184 L1208 D1212 W1213 L1218 L1219 L1220	I1180-I1216 HydrophobicContact CD1-CD1 4.46Å; I1180-I1216 HydrophobicContact CG2-CD1 3.84Å; F1184-I1216 HydrophobicContact CE2-CD1 4.3Å; F1184-I1216 HydrophobicContact CZ-CG2 4.08Å; L1208-I1216 HydrophobicContact CD1-CD1 3.64Å; D1212-I1216 WeakPolarHBondContact O-CD1 3.38Å; D1212-I1216 WeakPolarHBondContact O-CG1 3.31Å; D1212-I1216 PolarHBondContact O-N 2.97Å; D1212-I1216 VanDerWaalsContact O-N 3.13Å; W1213-I1216 PolarHBondContact O-N 3.49Å; I1216-L1218 PolarHBondContact O-N 3.38Å; I1216-L1219 PolarHBondContact O-N 3.19Å; I1216-L1220 HydrophobicContact CG2-CD1 3.9Å; I1216-L1220 HydrophobicContact CG2-CG 4.39Å; I1216-L1220 WeakPolarHBondContact O-CB 3.23Å; I1216-L1220 VanDerWaalsContact O-CG 3.26Å; I1216-L1220 WeakPolarHBondContact O-CG 3.42Å; I1216-L1220 PolarHBondContact O-N 3.42Å
1217	R	84.3	Confident	79.4	Confident	108 Å²	108	52.6 Å²	52.6	41%	0.408	29%	0.288	S	S	.	.	H	α-helix	trans	-59.3	-45	174.4	177.1	179.3	172.7	177.5	1.1	111.4	L1199 W1213 L1215 L1219 L1220 E1221	L1199-R1217 HydrophobicContact CD1-CG 4.37Å; W1213-R1217 HydrophobicContact CZ2-CB 4.2Å; W1213-R1217 HydrophobicContact CZ2-CG 4.48Å; W1213-R1217 WeakPolarHBondContact O-CB 3.32Å; W1213-R1217 PolarHBondContact O-N 2.97Å; L1215-R1217 VanDerWaalsContact C-N 3.34Å; L1215-R1217 PolarHBondContact O-N 3.04Å; R1217-L1219 VanDerWaalsContact C-N 3.35Å; R1217-L1220 PolarHBondContact O-N 3.31Å; R1217-E1221 HydrophobicContact CG-CG 4.26Å; R1217-E1221 IonicContact CZ-OE1 3.57Å; R1217-E1221 VanDerWaalsContact NE-CD 3.33Å; R1217-E1221 IonicContact NE-OE1 2.76Å; R1217-E1221 PolarHBondContact NE-OE1 3.33Å; R1217-E1221 IonicContact NE-OE2 2.95Å; R1217-E1221 PolarHBondContact NE-OE2 3.09Å; R1217-E1221 IonicContact NH2-OE1 2.88Å; R1217-E1221 PolarHBondContact NH2-OE1 3.3Å; R1217-E1221 WeakPolarHBondContact O-CB 3.4Å; R1217-E1221 WeakPolarHBondContact O-CG 3.5Å; R1217-E1221 PolarHBondContact O-N 3.49Å
1218	L	83.7	Confident	78.4	Confident	50 Å²	50	50.6 Å²	50.6	26%	0.262	29%	0.291	S	S	.	.	H	α-helix	trans	-70.2	-33.4	-176.9	-159	149.4	0	0	0	111.6	N1137 A1138 L1141 T1214 L1215 I1216 T1222	N1137-L1218 HydrophobicContact CB-CD1 3.98Å; A1138-L1218 HydrophobicContact CB-CD2 3.5Å; L1141-L1218 HydrophobicContact CD1-CB 4.35Å; L1141-L1218 HydrophobicContact CD1-CD2 3.57Å; L1141-L1218 HydrophobicContact CG-CD2 4.3Å; T1214-L1218 VanDerWaalsContact O-CB 3.27Å; T1214-L1218 WeakPolarHBondContact O-CB 3.35Å; T1214-L1218 PolarHBondContact O-N 3.2Å; L1215-L1218 PolarHBondContact O-N 2.87Å; I1216-L1218 PolarHBondContact O-N 3.38Å; L1218-T1222 WeakPolarHBondContact O-CG2 3.05Å; L1218-T1222 PolarHBondContact O-N 2.87Å; L1218-T1222 VanDerWaalsContact O-N 3.09Å; L1218-T1222 PolarHBondContact O-OG1 2.85Å
1219	L	84.4	Confident	77.7	Confident	6 Å²	6	52.2 Å²	52.2	3%	0.031	30%	0.304	C	S	.	.	H	α-helix	trans	-64.9	-43.6	168.4	-176.4	111.2	0	0	0	111.6	L1141 F1142 I1170 L1215 I1216 R1217 T1222 L1223	L1141-L1219 HydrophobicContact CD1-CB 3.86Å; L1141-L1219 HydrophobicContact CD1-CD1 4.39Å; L1141-L1219 HydrophobicContact CD2-CB 4.46Å; F1142-L1219 HydrophobicContact CE1-CD1 4.11Å; F1142-L1219 HydrophobicContact CE2-CD1 4.22Å; F1142-L1219 HydrophobicContact CZ-CD1 3.52Å; I1170-L1219 HydrophobicContact CD1-CD1 4.06Å; I1170-L1219 HydrophobicContact CD1-CD2 4.4Å; I1170-L1219 HydrophobicContact CG1-CD1 4.37Å; L1215-L1219 PolarHBondContact O-N 3.34Å; I1216-L1219 PolarHBondContact O-N 3.19Å; R1217-L1219 VanDerWaalsContact C-N 3.35Å; L1219-T1222 WeakPolarHBondContact CA-OG1 3.48Å; L1219-T1222 PolarHBondContact O-OG1 3.38Å; L1219-L1223 HydrophobicContact CD2-CD1 3.83Å; L1219-L1223 HydrophobicContact CG-CD1 3.9Å; L1219-L1223 WeakPolarHBondContact O-CB 3.39Å; L1219-L1223 VanDerWaalsContact O-CG 3.28Å; L1219-L1223 WeakPolarHBondContact O-CG 3.43Å; L1219-L1223 PolarHBondContact O-N 3.04Å
1220	L	83.2	Confident	76.6	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-69.4	-40	178.8	-71	172.7	0	0	0	112.8	L1194 L1199 L1202 I1216 R1217 L1223 K1224	L1194-L1220 HydrophobicContact CB-CD2 4Å; L1194-L1220 HydrophobicContact CD1-CD2 4.06Å; L1194-L1220 HydrophobicContact CD2-CD1 4.14Å; L1194-L1220 HydrophobicContact CD2-CD2 3.97Å; L1194-L1220 HydrophobicContact CG-CD2 4.23Å; L1199-L1220 HydrophobicContact CD2-CB 4.36Å; L1199-L1220 HydrophobicContact CD2-CD1 4.41Å; L1202-L1220 HydrophobicContact CD2-CD1 3.56Å; I1216-L1220 HydrophobicContact CG2-CD1 3.9Å; I1216-L1220 HydrophobicContact CG2-CG 4.39Å; I1216-L1220 WeakPolarHBondContact O-CB 3.23Å; I1216-L1220 VanDerWaalsContact O-CG 3.26Å; I1216-L1220 WeakPolarHBondContact O-CG 3.42Å; I1216-L1220 PolarHBondContact O-N 3.42Å; R1217-L1220 PolarHBondContact O-N 3.31Å; L1220-L1223 PolarHBondContact O-N 2.86Å; L1220-K1224 WeakPolarHBondContact O-CB 3.43Å; L1220-K1224 WeakPolarHBondContact O-CG 3.49Å; L1220-K1224 PolarHBondContact O-N 3.03Å
1221	E	81.2	Confident	75.4	Confident	69 Å²	69	45.7 Å²	45.7	32%	0.322	27%	0.27	S	S	.	.	H	α-helix	trans	-64.4	-40.7	175.7	-75.7	175.7	158	0	0	111.2	L1199 R1217 V1225	L1199-E1221 HydrophobicContact CD1-CG 3.61Å; L1199-E1221 VanDerWaalsContact CD1-OE1 3.3Å; L1199-E1221 WeakPolarHBondContact CD1-OE1 3.42Å; R1217-E1221 HydrophobicContact CG-CG 4.26Å; R1217-E1221 IonicContact CZ-OE1 3.57Å; R1217-E1221 VanDerWaalsContact NE-CD 3.33Å; R1217-E1221 IonicContact NE-OE1 2.76Å; R1217-E1221 PolarHBondContact NE-OE1 3.33Å; R1217-E1221 IonicContact NE-OE2 2.95Å; R1217-E1221 PolarHBondContact NE-OE2 3.09Å; R1217-E1221 IonicContact NH2-OE1 2.88Å; R1217-E1221 PolarHBondContact NH2-OE1 3.3Å; R1217-E1221 WeakPolarHBondContact O-CB 3.4Å; R1217-E1221 WeakPolarHBondContact O-CG 3.5Å; R1217-E1221 PolarHBondContact O-N 3.49Å; E1221-V1225 WeakPolarHBondContact O-CG2 3.35Å; E1221-V1225 PolarHBondContact O-N 2.88Å
1222	T	78.9	Confident	74.1	Confident	8 Å²	8	46.9 Å²	46.9	5%	0.049	28%	0.282	C	S	.	.	H	α-helix	trans	-70.1	-42	174.7	46.1	0	0	0	0	113.5	P1135 A1138 W1148 L1218 L1219 K1224 V1225 F1226	P1135-T1222 HydrophobicContact CG-CG2 3.55Å; A1138-T1222 HydrophobicContact CB-CG2 3.49Å; A1138-T1222 VanDerWaalsContact CB-CG2 3.49Å; W1148-T1222 WeakPolarHBondContact CH2-OG1 3.5Å; L1218-T1222 WeakPolarHBondContact O-CG2 3.05Å; L1218-T1222 PolarHBondContact O-N 2.87Å; L1218-T1222 VanDerWaalsContact O-N 3.09Å; L1218-T1222 PolarHBondContact O-OG1 2.85Å; L1219-T1222 WeakPolarHBondContact CA-OG1 3.48Å; L1219-T1222 PolarHBondContact O-OG1 3.38Å; T1222-K1224 VanDerWaalsContact C-N 3.31Å; T1222-K1224 PolarHBondContact O-N 2.88Å; T1222-V1225 PolarHBondContact O-N 3.39Å; T1222-V1225 VanDerWaalsContact O-N 3.15Å; T1222-F1226 WeakPolarHBondContact O-CD2 3.43Å; T1222-F1226 PolarHBondContact O-N 2.93Å
1223	L	78.4	Confident	72.3	Confident	11 Å²	11	52.7 Å²	52.7	6%	0.058	31%	0.312	C	S	.	.	H	α-helix	trans	-65	-32.6	175.1	-71.1	171.4	0	0	0	112.8	W1148 I1151 L1155 L1166 L1219 L1220 F1226	W1148-L1223 HydrophobicContact CZ3-CD2 4.25Å; I1151-L1223 HydrophobicContact CD1-CD2 4.26Å; I1151-L1223 HydrophobicContact CG2-CD2 4.48Å; L1155-L1223 HydrophobicContact CD1-CB 4.32Å; L1155-L1223 HydrophobicContact CD1-CD1 4.39Å; L1155-L1223 HydrophobicContact CD2-CB 4.11Å; L1166-L1223 HydrophobicContact CD1-CD1 3.99Å; L1219-L1223 HydrophobicContact CD2-CD1 3.83Å; L1219-L1223 HydrophobicContact CG-CD1 3.9Å; L1219-L1223 WeakPolarHBondContact O-CB 3.39Å; L1219-L1223 VanDerWaalsContact O-CG 3.28Å; L1219-L1223 WeakPolarHBondContact O-CG 3.43Å; L1219-L1223 PolarHBondContact O-N 3.04Å; L1220-L1223 PolarHBondContact O-N 2.86Å; L1223-F1226 PolarHBondContact O-N 3.5Å
1224	K	78.3	Confident	69.8	Low	68 Å²	68	63.1 Å²	63.1	30%	0.296	35%	0.351	S	S	.	.	H	α-helix	trans	-67.2	-32	171.9	-75.6	-168.6	-168.5	-146.5	0	113.1	L1155 L1194 A1195 C1197 L1220 T1222 F1226 G1227	L1155-K1224 HydrophobicContact CD2-CG 3.94Å; L1194-K1224 WeakPolarHBondContact O-CE 3.41Å; L1194-K1224 PolarHBondContact O-NZ 3.26Å; A1195-K1224 WeakPolarHBondContact O-CE 3.43Å; A1195-K1224 PolarHBondContact O-NZ 3.44Å; C1197-K1224 PolarHBondContact O-NZ 3.26Å; L1220-K1224 WeakPolarHBondContact O-CB 3.43Å; L1220-K1224 WeakPolarHBondContact O-CG 3.49Å; L1220-K1224 PolarHBondContact O-N 3.03Å; T1222-K1224 VanDerWaalsContact C-N 3.31Å; T1222-K1224 PolarHBondContact O-N 2.88Å; K1224-F1226 VanDerWaalsContact C-N 3.31Å; K1224-F1226 PolarHBondContact O-N 3.46Å; K1224-G1227 PolarHBondContact O-N 3.32Å
1225	V	73.4	Confident	67.5	Low	126 Å²	126	65.5 Å²	65.5	76%	0.764	37%	0.366	S	S	*	.	H	α-helix	trans	-67.1	-28.8	178.2	166.1	0	0	0	0	112.8	E1221 T1222 G1227	E1221-V1225 WeakPolarHBondContact O-CG2 3.35Å; E1221-V1225 PolarHBondContact O-N 2.88Å; T1222-V1225 PolarHBondContact O-N 3.39Å; T1222-V1225 VanDerWaalsContact O-N 3.15Å; V1225-G1227 VanDerWaalsContact C-N 3.35Å
1226	F	68.9	Low	65.2	Low	32 Å²	32	69.2 Å²	69.2	14%	0.14	39%	0.386	C	S	.	.	H	α-helix	trans	-75.9	-20.7	175.2	-65.5	-66.2	0	0	0	113.7	M1132 W1148 T1222 L1223 K1224 S1228 S1229 P1231	M1132-F1226 HydrophobicContact CE-CD1 4.22Å; M1132-F1226 HydrophobicContact CE-CE1 4.12Å; W1148-F1226 HydrophobicContact CE3-CE2 4.43Å; W1148-F1226 HydrophobicContact CZ3-CE2 4.32Å; T1222-F1226 WeakPolarHBondContact O-CD2 3.43Å; T1222-F1226 PolarHBondContact O-N 2.93Å; L1223-F1226 PolarHBondContact O-N 3.5Å; K1224-F1226 VanDerWaalsContact C-N 3.31Å; K1224-F1226 PolarHBondContact O-N 3.46Å; F1226-S1228 PolarHBondContact O-N 2.9Å; F1226-S1228 VanDerWaalsContact O-N 3.13Å; F1226-S1229 PolarHBondContact O-N 2.93Å; F1226-S1229 VanDerWaalsContact O-N 3.08Å; F1226-S1229 VanDerWaalsContact O-O 3.12Å; F1226-S1229 PolarHBondContact O-OG 3.49Å; F1226-P1231 HydrophobicContact CD1-CB 4.39Å; F1226-P1231 HydrophobicContact CE1-CB 4.11Å; F1226-P1231 HydrophobicContact CZ-CB 4.47Å
1227	G	64.1	Low	62.8	Low	34 Å²	34	75.2 Å²	75.2	35%	0.351	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	-113.2	170.3	0	0	0	0	0	114	K1224 V1225	K1224-G1227 PolarHBondContact O-N 3.32Å; V1225-G1227 VanDerWaalsContact C-N 3.35Å
1228	S	59.1	Low	60.4	Low	112 Å²	112	81.8 Å²	81.8	78%	0.783	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-6.3	-178.8	53	0	0	0	0	114.8	F1226	F1226-S1228 PolarHBondContact O-N 2.9Å; F1226-S1228 VanDerWaalsContact O-N 3.13Å
1229	S	58.5	Low	57.8	Low	60 Å²	60	88.3 Å²	88.3	42%	0.42	46%	0.463	S	S	.	.	S	Bend	trans	-114.7	116.5	-178.4	54.6	0	0	0	0	111.5	F1226	F1226-S1229 PolarHBondContact O-N 2.93Å; F1226-S1229 VanDerWaalsContact O-N 3.08Å; F1226-S1229 VanDerWaalsContact O-O 3.12Å; F1226-S1229 PolarHBondContact O-OG 3.49Å
1230	P	56.6	Low	55.3	Low	32 Å²	32	91.3 Å²	91.3	21%	0.208	49%	0.489	C	S	.	.			trans	-64.4	153	173.2	28.4	-34.7	0	0	0	110.9	D1152 G1232	D1152-P1230 WeakPolarHBondContact O-CB 3.32Å; P1230-G1232 VanDerWaalsContact C-N 3.28Å; P1230-G1232 PolarHBondContact O-N 3.02Å
1231	P	52.2	Low	52.8	Low	35 Å²	35	97.4 Å²	97.4	23%	0.227	52%	0.521	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	76.9	-177.9	29.9	-37.1	0	0	0	112.6	W1148 I1151 F1226	W1148-P1231 VanDerWaalsContact O-CG 3.28Å; W1148-P1231 WeakPolarHBondContact O-CG 3.42Å; I1151-P1231 HydrophobicContact CB-CG 4.46Å; F1226-P1231 HydrophobicContact CD1-CB 4.39Å; F1226-P1231 HydrophobicContact CE1-CB 4.11Å; F1226-P1231 HydrophobicContact CZ-CB 4.47Å
1232	G	53.1	Low	50.5	Low	65 Å²	65	99.4 Å²	99.4	67%	0.67	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-177.5	-21.8	177.1	0	0	0	0	0	117.2	P1230	P1230-G1232 VanDerWaalsContact C-N 3.28Å; P1230-G1232 PolarHBondContact O-N 3.02Å
1233	L	42.5	Very low	48.3	Very low	134 Å²	134	106.3 Å²	106.3	70%	0.702	57%	0.573	S	S	*	*			trans	-87.6	127.3	-176.7	-106.1	72.1	0	0	0	113.7
1234	R	33.9	Very low	46.1	Very low	232 Å²	232	113.3 Å²	113.3	88%	0.875	60%	0.599	S	S	*	*			trans	-81.3	139.1	164.4	-74.4	178.4	168.8	170	-5.7	110.4
1235	V	34.3	Very low	44.1	Very low	122 Å²	122	117.7 Å²	117.7	74%	0.739	62%	0.62	S	S	*	*			trans	-137.7	120.1	168.5	-178.5	0	0	0	0	109.5	K1237	V1235-K1237 PolarHBondContact O-N 3.48Å
1236	D	35.4	Very low	42.3	Very low	144 Å²	144	120.2 Å²	120.2	77%	0.77	62%	0.624	S	S	*	*			trans	-78.3	99	-174	-65.1	-46.5	0	0	0	112.4	R1238	D1236-R1238 PolarHBondContact O-N 3.36Å
1237	K	33.2	Very low	40.7	Very low	127 Å²	127	124.5 Å²	124.5	55%	0.552	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-62.3	-13.8	-175.5	-68.7	-168.8	174.5	-166.8	0	115.8	H1042 V1235 K1239 A1240	H1042-K1237 PolarHBondContact NE2-NZ 3.1Å; V1235-K1237 PolarHBondContact O-N 3.48Å; K1237-K1239 PolarHBondContact O-N 3.18Å; K1237-A1240 PolarHBondContact O-N 2.95Å; K1237-A1240 VanDerWaalsContact O-N 3.11Å
1238	R	33.9	Very low	39.7	Very low	245 Å²	245	127.2 Å²	127.2	93%	0.925	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-63.8	-5.3	-176	-90	-171.9	178.2	169	2.8	115.9	D1236	D1236-R1238 PolarHBondContact O-N 3.36Å
1239	K	31.1	Very low	38.6	Very low	188 Å²	188	128.8 Å²	128.8	82%	0.817	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-112.4	0.9	174	-77.7	-171.9	172.3	-176	0	115.2	K1237	K1237-K1239 PolarHBondContact O-N 3.18Å
1240	A	30.2	Very low	37.6	Very low	69 Å²	69	133.7 Å²	133.7	57%	0.57	66%	0.663	S	S	*	*	S	Bend	trans	-98.8	-7.7	-173.6	0	0	0	0	0	114.7	K1237	K1237-A1240 PolarHBondContact O-N 2.95Å; K1237-A1240 VanDerWaalsContact O-N 3.11Å
1241	L	31.9	Very low	36.9	Very low	133 Å²	133	139.6 Å²	139.6	70%	0.696	69%	0.688	S	S	*	*	S	Bend	trans	-103.8	7.4	-167.3	-78.3	163.2	0	0	0	114.8
1242	T	33.1	Very low	36.6	Very low	110 Å²	110	143.6 Å²	143.6	68%	0.675	71%	0.706	S	S	*	*	S	Bend	trans	-128.3	16.1	-171.1	65.1	0	0	0	0	113.9
1243	L	32	Very low	35.9	Very low	153 Å²	153	147.5 Å²	147.5	80%	0.801	71%	0.707	S	S	*	*	S	Bend	trans	-150.1	32.9	-171.8	-73.7	176	0	0	0	112.1
1244	R	33.1	Very low	36.1	Very low	159 Å²	159	148.8 Å²	148.8	60%	0.6	71%	0.71	S	S	*	*	S	Bend	trans	-144.8	-6.4	-176	-158.2	176.8	168.1	87.2	17.7	114.9	E1246 E1248	R1244-E1246 VanDerWaalsContact C-N 3.29Å; R1244-E1246 PolarHBondContact O-N 3.3Å; R1244-E1248 IonicContact CZ-OE1 3.31Å; R1244-E1248 IonicContact NE-OE1 3.8Å; R1244-E1248 PolarHBondContact NE-OE1 2.99Å; R1244-E1248 IonicContact NH2-OE1 2.7Å; R1244-E1248 PolarHBondContact NH2-OE1 2.82Å
1245	E	34.9	Very low	36.6	Very low	159 Å²	159	140.6 Å²	140.6	74%	0.743	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-2.1	-177.4	-61.1	-176.5	150.4	0	0	113.1
1246	E	35.3	Very low	36.8	Very low	179 Å²	179	137.6 Å²	137.6	84%	0.836	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-25.9	179	-62.7	-176.5	146.8	0	0	113.3	R1244	R1244-E1246 VanDerWaalsContact C-N 3.29Å; R1244-E1246 PolarHBondContact O-N 3.3Å
1247	D	37.1	Very low	37.2	Very low	123 Å²	123	136.8 Å²	136.8	66%	0.658	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-25.5	-176.9	-64.7	-39.1	0	0	0	113.5	E1249	D1247-E1249 PolarHBondContact O-N 2.88Å
1248	E	41.2	Very low	37.9	Very low	91 Å²	91	134 Å²	134	43%	0.425	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.9	-3.9	-170.2	-64.8	-172.3	177	0	0	113.9	R1244 I1252	R1244-E1248 IonicContact CZ-OE1 3.31Å; R1244-E1248 IonicContact NE-OE1 3.8Å; R1244-E1248 PolarHBondContact NE-OE1 2.99Å; R1244-E1248 IonicContact NH2-OE1 2.7Å; R1244-E1248 PolarHBondContact NH2-OE1 2.82Å; E1248-I1252 VanDerWaalsContact O-CD1 3.27Å; E1248-I1252 WeakPolarHBondContact O-CD1 3.4Å; E1248-I1252 WeakPolarHBondContact O-CG1 3.4Å
1249	E	37.5	Very low	38.3	Very low	145 Å²	145	125 Å²	125	68%	0.678	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-37.8	175.1	-66.7	-168	148.9	0	0	112.9	D1247 I1252 E1253	D1247-E1249 PolarHBondContact O-N 2.88Å; E1249-I1252 PolarHBondContact O-N 3.28Å; E1249-E1253 PolarHBondContact O-N 3.23Å
1250	E	36.5	Very low	38.6	Very low	162 Å²	162	121 Å²	121	76%	0.757	64%	0.637	S	S	*	*	H	α-helix	trans	-69.5	-41.1	180	-70.9	-165.5	152.6	0	0	113	I1252 E1253 E1254	E1250-I1252 PolarHBondContact O-N 3.42Å; E1250-E1253 PolarHBondContact O-N 3.42Å; E1250-E1254 PolarHBondContact O-N 3.25Å
1251	E	42.8	Very low	39.2	Very low	156 Å²	156	122.1 Å²	122.1	73%	0.729	63%	0.633	S	S	*	*	H	α-helix	trans	-62.5	-27.6	177.4	-75.1	-161.7	154.2	0	0	112.4	A1255	E1251-A1255 VanDerWaalsContact O-CB 3.23Å; E1251-A1255 WeakPolarHBondContact O-CB 3.33Å; E1251-A1255 PolarHBondContact O-N 3.22Å; E1251-A1255 VanDerWaalsContact O-N 3.09Å
1252	I	44.7	Very low	39.8	Very low	120 Å²	120	120 Å²	120	62%	0.615	63%	0.629	S	S	*	*	H	α-helix	trans	-76.6	-35.5	179	-67	175.5	0	0	0	111.3	E1248 E1249 E1250 A1256	E1248-I1252 VanDerWaalsContact O-CD1 3.27Å; E1248-I1252 WeakPolarHBondContact O-CD1 3.4Å; E1248-I1252 WeakPolarHBondContact O-CG1 3.4Å; E1249-I1252 PolarHBondContact O-N 3.28Å; E1250-I1252 PolarHBondContact O-N 3.42Å; I1252-A1256 VanDerWaalsContact O-CB 3.32Å; I1252-A1256 WeakPolarHBondContact O-CB 3.15Å; I1252-A1256 PolarHBondContact O-N 3.37Å
1253	E	39.4	Very low	40	Very low	146 Å²	146	122.7 Å²	122.7	68%	0.682	63%	0.634	S	S	*	*	H	α-helix	trans	-68.2	-45.7	173.1	-82.8	-157.1	134.9	0	0	112.3	E1249 E1250 A1255 A1256 E1257	E1249-E1253 PolarHBondContact O-N 3.23Å; E1250-E1253 PolarHBondContact O-N 3.42Å; E1253-A1255 VanDerWaalsContact C-N 3.32Å; E1253-A1255 PolarHBondContact O-N 2.76Å; E1253-A1256 PolarHBondContact O-N 3.43Å; E1253-A1256 VanDerWaalsContact O-N 3.17Å; E1253-E1257 PolarHBondContact O-N 3.37Å
1254	E	46.2	Very low	40.1	Very low	162 Å²	162	122 Å²	122	76%	0.757	63%	0.625	S	S	*	*	H	α-helix	trans	-61.4	-40.3	175.2	-82.2	-150.2	139.1	0	0	111.9	E1250 A1256 E1257 A1258	E1250-E1254 PolarHBondContact O-N 3.25Å; E1254-A1256 VanDerWaalsContact C-N 3.33Å; E1254-A1256 PolarHBondContact O-N 3.34Å; E1254-E1257 PolarHBondContact O-N 3.1Å; E1254-A1258 VanDerWaalsContact O-CB 3.29Å; E1254-A1258 WeakPolarHBondContact O-CB 3.32Å; E1254-A1258 PolarHBondContact O-N 3.45Å
1255	A	44.5	Very low	40.3	Very low	60 Å²	60	123.1 Å²	123.1	50%	0.496	64%	0.637	S	S	.	*	H	α-helix	trans	-64	-37.4	175.6	0	0	0	0	0	112.5	E1251 E1253 A1259	E1251-A1255 VanDerWaalsContact O-CB 3.23Å; E1251-A1255 WeakPolarHBondContact O-CB 3.33Å; E1251-A1255 PolarHBondContact O-N 3.22Å; E1251-A1255 VanDerWaalsContact O-N 3.09Å; E1253-A1255 VanDerWaalsContact C-N 3.32Å; E1253-A1255 PolarHBondContact O-N 2.76Å; A1255-A1259 WeakPolarHBondContact O-CB 3.4Å; A1255-A1259 PolarHBondContact O-N 2.9Å
1256	A	39.2	Very low	40.2	Very low	59 Å²	59	127.2 Å²	127.2	49%	0.488	65%	0.645	S	S	.	*	H	α-helix	trans	-68.5	-44	176	0	0	0	0	0	112.2	I1252 E1253 E1254 A1259 L1260	I1252-A1256 VanDerWaalsContact O-CB 3.32Å; I1252-A1256 WeakPolarHBondContact O-CB 3.15Å; I1252-A1256 PolarHBondContact O-N 3.37Å; E1253-A1256 PolarHBondContact O-N 3.43Å; E1253-A1256 VanDerWaalsContact O-N 3.17Å; E1254-A1256 VanDerWaalsContact C-N 3.33Å; E1254-A1256 PolarHBondContact O-N 3.34Å; A1256-A1259 PolarHBondContact O-N 3.18Å; A1256-L1260 VanDerWaalsContact O-CB 3.28Å; A1256-L1260 WeakPolarHBondContact O-CB 3.19Å; A1256-L1260 PolarHBondContact O-N 2.92Å
1257	E	42.9	Very low	39.9	Very low	127 Å²	127	123 Å²	123	59%	0.593	64%	0.641	S	S	*	*	H	α-helix	trans	-63.2	-41.1	174.7	-77	-122.9	120.7	0	0	112.2	E1253 E1254 L1260 N1261	E1253-E1257 PolarHBondContact O-N 3.37Å; E1254-E1257 PolarHBondContact O-N 3.1Å; E1257-L1260 PolarHBondContact O-N 2.66Å; E1257-N1261 PolarHBondContact O-N 3.39Å; E1257-N1261 VanDerWaalsContact O-N 3.12Å; E1257-N1261 PolarHBondContact O-ND2 3.3Å
1258	A	48.1	Very low	39.8	Very low	68 Å²	68	122.5 Å²	122.5	56%	0.562	65%	0.645	S	S	*	*	H	α-helix	trans	-61.6	-44.8	175.9	0	0	0	0	0	111.7	E1254 N1261 S1262	E1254-A1258 VanDerWaalsContact O-CB 3.29Å; E1254-A1258 WeakPolarHBondContact O-CB 3.32Å; E1254-A1258 PolarHBondContact O-N 3.45Å; A1258-N1261 PolarHBondContact O-N 3.13Å; A1258-S1262 PolarHBondContact O-N 2.88Å
1259	A	42.2	Very low	39.3	Very low	56 Å²	56	125.2 Å²	125.2	46%	0.463	66%	0.661	S	S	.	*	H	α-helix	trans	-61.8	-47.8	174.1	0	0	0	0	0	111.8	A1255 A1256 N1261 S1262	A1255-A1259 WeakPolarHBondContact O-CB 3.4Å; A1255-A1259 PolarHBondContact O-N 2.9Å; A1256-A1259 PolarHBondContact O-N 3.18Å; A1259-N1261 PolarHBondContact O-N 3.17Å; A1259-S1262 WeakPolarHBondContact O-CB 3.26Å; A1259-S1262 PolarHBondContact O-N 3.05Å; A1259-S1262 PolarHBondContact O-OG 3.08Å
1260	L	37.6	Very low	38.8	Very low	105 Å²	105	126.1 Å²	126.1	55%	0.55	67%	0.67	S	S	.	*	H	α-helix	trans	-61.9	-24.7	-177.3	-169.1	69.9	0	0	0	113.8	A1256 E1257 K1264	A1256-L1260 VanDerWaalsContact O-CB 3.28Å; A1256-L1260 WeakPolarHBondContact O-CB 3.19Å; A1256-L1260 PolarHBondContact O-N 2.92Å; E1257-L1260 PolarHBondContact O-N 2.66Å; L1260-K1264 WeakPolarHBondContact O-CE 3.46Å
1261	N	42.7	Very low	38.6	Very low	92 Å²	92	122 Å²	122	49%	0.492	67%	0.672	S	S	.	*	H	α-helix	trans	-84.8	-21.7	175.1	-74	-46.5	0	0	0	113.7	E1257 A1258 A1259 K1264	E1257-N1261 PolarHBondContact O-N 3.39Å; E1257-N1261 VanDerWaalsContact O-N 3.12Å; E1257-N1261 PolarHBondContact O-ND2 3.3Å; A1258-N1261 PolarHBondContact O-N 3.13Å; A1259-N1261 PolarHBondContact O-N 3.17Å; N1261-K1264 PolarHBondContact OD1-NZ 3.29Å
1262	S	44.6	Very low	38.1	Very low	88 Å²	88	119.6 Å²	119.6	62%	0.615	67%	0.672	S	S	*	*	H	α-helix	trans	-75.2	-32.9	-178.8	74.7	0	0	0	0	114.6	A1258 A1259 K1264	A1258-S1262 PolarHBondContact O-N 2.88Å; A1259-S1262 WeakPolarHBondContact O-CB 3.26Å; A1259-S1262 PolarHBondContact O-N 3.05Å; A1259-S1262 PolarHBondContact O-OG 3.08Å; S1262-K1264 VanDerWaalsContact C-N 3.33Å; S1262-K1264 PolarHBondContact O-N 3.37Å
1263	E	38.3	Very low	37.7	Very low	167 Å²	167	118 Å²	118	78%	0.78	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-77.8	-11.3	-174.3	-67.8	-158.6	124.6	0	0	114.7	E1265	E1263-E1265 VanDerWaalsContact C-N 3.31Å; E1263-E1265 PolarHBondContact O-N 3.48Å
1264	K	34.1	Very low	37.3	Very low	139 Å²	139	121.6 Å²	121.6	60%	0.604	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-71.8	-15.2	-168.1	-73.4	169.3	-173.3	157.6	0	115.2	L1260 N1261 S1262	L1260-K1264 WeakPolarHBondContact O-CE 3.46Å; N1261-K1264 PolarHBondContact OD1-NZ 3.29Å; S1262-K1264 VanDerWaalsContact C-N 3.33Å; S1262-K1264 PolarHBondContact O-N 3.37Å
1265	E	37.2	Very low	36.7	Very low	181 Å²	181	117 Å²	117	85%	0.846	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-97.3	-1.4	-170	-65.6	-154	134.3	0	0	116.5	E1263	E1263-E1265 VanDerWaalsContact C-N 3.31Å; E1263-E1265 PolarHBondContact O-N 3.48Å
1266	R	33.1	Very low	36.2	Very low	245 Å²	245	118.8 Å²	118.8	93%	0.925	66%	0.663	S	S	*	*			trans	-127.1	78.3	-175.6	-67.5	-170.8	-178.9	174.5	3.6	114.8
1267	A	29.3	Very low	36.1	Very low	91 Å²	91	122 Å²	122	75%	0.752	67%	0.667	S	S	*	*			trans	-135.5	169.2	166.9	0	0	0	0	0	109.3
1268	P	34.7	Very low	35.6	Very low	112 Å²	112	125.6 Å²	125.6	73%	0.727	68%	0.676	S	S	*	*			cis	-131.1	178.4	2.8	43	-28.8	0	0	0	114.5
1269	L	29.6	Very low	34.8	Very low	148 Å²	148	130.2 Å²	130.2	78%	0.775	68%	0.679	S	S	*	*				-168	112.1	116.1	-99	-178.6	0	0	0	111.4
1270	L	28.2	Very low	34.5	Very low	164 Å²	164	136.3 Å²	136.3	86%	0.859	69%	0.69	S	S	*	*			trans	58.1	130.2	154.2	-56.9	165.6	0	0	0	119.1
1271	G	31.7	Very low	34.2	Very low	77 Å²	77	134.4 Å²	134.4	79%	0.794	69%	0.685	S	S	*	*			cis	168.6	34.5	1.6	0	0	0	0	0	117.2
1272	S	32.2	Very low	33.8	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	68%	0.683	S	S	*	*	S	Bend	trans	-128	-28.9	-177.4	56.8	0	0	0	0	116.4	R1274	S1272-R1274 PolarHBondContact O-N 2.95Å
1273	V	35.9	Very low	33.4	Very low	87 Å²	87	134.2 Å²	134.2	53%	0.527	68%	0.679	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.6	-1	-165.6	-175.1	0	0	0	0	114.9	A1275 E1276 Q1277	V1273-A1275 PolarHBondContact O-N 2.9Å; V1273-E1276 HydrophobicContact CG1-CB 4.28Å; V1273-E1276 PolarHBondContact O-N 3.3Å; V1273-E1276 VanDerWaalsContact O-N 3.14Å; V1273-Q1277 HydrophobicContact CG1-CG 4.4Å; V1273-Q1277 PolarHBondContact O-N 3.34Å
1274	R	31.8	Very low	33.3	Very low	221 Å²	221	130.9 Å²	130.9	83%	0.834	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-6.4	-172.3	-122.9	177.1	-173.1	172	2.4	115.6	S1272	S1272-R1274 PolarHBondContact O-N 2.95Å
1275	A	32.5	Very low	33.2	Very low	66 Å²	66	130.8 Å²	130.8	55%	0.545	67%	0.671	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.2	-45	170.9	0	0	0	0	0	112.3	V1273 Q1277 R1278	V1273-A1275 PolarHBondContact O-N 2.9Å; A1275-Q1277 PolarHBondContact O-N 2.92Å; A1275-R1278 PolarHBondContact O-N 3.43Å
1276	E	33.9	Very low	32.9	Very low	97 Å²	97	126.4 Å²	126.4	45%	0.453	65%	0.654	S	S	.	*	H	α-helix	trans	-61.1	-41.8	179.7	-112.4	58.8	-116.3	0	0	112.7	V1273 R1278 R1279 R1280	V1273-E1276 HydrophobicContact CG1-CB 4.28Å; V1273-E1276 PolarHBondContact O-N 3.3Å; V1273-E1276 VanDerWaalsContact O-N 3.14Å; E1276-R1278 PolarHBondContact O-N 3.41Å; E1276-R1279 WeakPolarHBondContact O-CB 3.5Å; E1276-R1279 PolarHBondContact O-N 2.88Å; E1276-R1279 IonicContact OE1-NH1 2.68Å; E1276-R1279 PolarHBondContact OE1-NH1 3.44Å; E1276-R1280 PolarHBondContact O-N 3.25Å
1277	Q	37.1	Very low	33	Very low	125 Å²	125	117.3 Å²	117.3	58%	0.584	63%	0.631	S	S	*	*	H	α-helix	trans	-62.6	-29.7	-179.9	-75	175.4	-61.3	0	0	113.1	V1273 A1275 R1279 R1280 S1281	V1273-Q1277 HydrophobicContact CG1-CG 4.4Å; V1273-Q1277 PolarHBondContact O-N 3.34Å; A1275-Q1277 PolarHBondContact O-N 2.92Å; Q1277-R1279 VanDerWaalsContact C-N 3.35Å; Q1277-R1280 PolarHBondContact O-N 2.94Å; Q1277-S1281 PolarHBondContact O-N 3.24Å; Q1277-S1281 VanDerWaalsContact O-N 3.15Å; Q1277-S1281 PolarHBondContact O-OG 2.87Å
1278	R	32.9	Very low	33.2	Very low	204 Å²	204	117.1 Å²	117.1	77%	0.77	62%	0.621	S	S	*	*	H	α-helix	trans	-76.2	-18.4	174.4	-85.9	-173.6	170.2	-176.5	-3.6	114.2	A1275 E1276 S1281 T1282	A1275-R1278 PolarHBondContact O-N 3.43Å; E1276-R1278 PolarHBondContact O-N 3.41Å; R1278-S1281 PolarHBondContact O-OG 3.38Å; R1278-T1282 PolarHBondContact O-OG1 2.95Å
1279	R	31.2	Very low	33.2	Very low	165 Å²	165	118.3 Å²	118.3	62%	0.623	62%	0.616	S	S	*	*	H	α-helix	trans	-80.6	-42.8	167.2	-76	178.2	167.7	156.7	-7.6	110.9	E1276 Q1277 S1281 T1282 I1283	E1276-R1279 WeakPolarHBondContact O-CB 3.5Å; E1276-R1279 PolarHBondContact O-N 2.88Å; E1276-R1279 IonicContact OE1-NH1 2.68Å; E1276-R1279 PolarHBondContact OE1-NH1 3.44Å; Q1277-R1279 VanDerWaalsContact C-N 3.35Å; R1279-S1281 VanDerWaalsContact C-N 3.29Å; R1279-S1281 PolarHBondContact O-N 3.3Å; R1279-T1282 PolarHBondContact O-N 3.06Å; R1279-T1282 PolarHBondContact O-OG1 3.49Å; R1279-I1283 HydrophobicContact CB-CD1 4.4Å; R1279-I1283 WeakPolarHBondContact O-CD1 3.45Å; R1279-I1283 VanDerWaalsContact O-CG1 3.26Å; R1279-I1283 WeakPolarHBondContact O-CG1 3.44Å; R1279-I1283 PolarHBondContact O-N 3.05Å
1280	R	35.5	Very low	33.4	Very low	184 Å²	184	116.6 Å²	116.6	69%	0.694	61%	0.607	S	S	*	*	H	α-helix	trans	-58.7	-39.5	178	-74.3	-173.6	168.6	-170.8	-6.7	112.3	E1276 Q1277 T1282 I1283 V1284	E1276-R1280 PolarHBondContact O-N 3.25Å; Q1277-R1280 PolarHBondContact O-N 2.94Å; R1280-T1282 PolarHBondContact O-N 3.08Å; R1280-I1283 PolarHBondContact O-N 3.07Å; R1280-V1284 WeakPolarHBondContact O-CG2 3.47Å; R1280-V1284 PolarHBondContact O-N 3.27Å; R1280-V1284 VanDerWaalsContact O-N 3.07Å
1281	S	32.5	Very low	33.7	Very low	64 Å²	64	112 Å²	112	45%	0.448	59%	0.589	S	S	.	*	H	α-helix	trans	-63.5	-36.5	176.4	55	0	0	0	0	114.3	Q1277 R1278 R1279	Q1277-S1281 PolarHBondContact O-N 3.24Å; Q1277-S1281 VanDerWaalsContact O-N 3.15Å; Q1277-S1281 PolarHBondContact O-OG 2.87Å; R1278-S1281 PolarHBondContact O-OG 3.38Å; R1279-S1281 VanDerWaalsContact C-N 3.29Å; R1279-S1281 PolarHBondContact O-N 3.3Å
1282	T	34.1	Very low	33.9	Very low	73 Å²	73	114.2 Å²	114.2	45%	0.448	58%	0.581	S	S	.	*	H	α-helix	trans	-79.3	-31	174.4	29.6	0	0	0	0	112.7	R1278 R1279 R1280 V1284 Q1285 N1286	R1278-T1282 PolarHBondContact O-OG1 2.95Å; R1279-T1282 PolarHBondContact O-N 3.06Å; R1279-T1282 PolarHBondContact O-OG1 3.49Å; R1280-T1282 PolarHBondContact O-N 3.08Å; T1282-V1284 VanDerWaalsContact C-N 3.32Å; T1282-V1284 PolarHBondContact O-N 3.3Å; T1282-Q1285 PolarHBondContact O-N 3.26Å; T1282-N1286 PolarHBondContact O-N 3.22Å; T1282-N1286 VanDerWaalsContact O-N 3.1Å; T1282-N1286 PolarHBondContact O-OD1 3.33Å
1283	I	35.9	Very low	34.1	Very low	103 Å²	103	114.3 Å²	114.3	53%	0.528	57%	0.574	S	S	.	*	H	α-helix	trans	-61.9	-40.4	173.9	-69.4	162.8	0	0	0	110.9	R1279 R1280 N1286 A1287	R1279-I1283 HydrophobicContact CB-CD1 4.4Å; R1279-I1283 WeakPolarHBondContact O-CD1 3.45Å; R1279-I1283 VanDerWaalsContact O-CG1 3.26Å; R1279-I1283 WeakPolarHBondContact O-CG1 3.44Å; R1279-I1283 PolarHBondContact O-N 3.05Å; R1280-I1283 PolarHBondContact O-N 3.07Å; I1283-N1286 PolarHBondContact O-N 3.05Å; I1283-A1287 WeakPolarHBondContact O-CB 3.34Å; I1283-A1287 PolarHBondContact O-N 3.08Å
1284	V	36.4	Very low	34.1	Very low	98 Å²	98	114.6 Å²	114.6	59%	0.594	57%	0.569	S	S	*	*	H	α-helix	trans	-63.5	-40.6	176.7	171.7	0	0	0	0	112.2	R1280 T1282 N1286 A1287	R1280-V1284 WeakPolarHBondContact O-CG2 3.47Å; R1280-V1284 PolarHBondContact O-N 3.27Å; R1280-V1284 VanDerWaalsContact O-N 3.07Å; T1282-V1284 VanDerWaalsContact C-N 3.32Å; T1282-V1284 PolarHBondContact O-N 3.3Å; V1284-N1286 VanDerWaalsContact C-N 3.34Å; V1284-N1286 PolarHBondContact O-N 3.49Å; V1284-A1287 PolarHBondContact O-N 3Å
1285	Q	32	Very low	34.2	Very low	136 Å²	136	111.2 Å²	111.2	64%	0.636	56%	0.561	S	S	*	*	H	α-helix	trans	-69.2	-30.6	177.1	-65.1	-169.9	-78.4	0	0	113.1	T1282 T1288	T1282-Q1285 PolarHBondContact O-N 3.26Å; Q1285-T1288 PolarHBondContact O-OG1 2.95Å
1286	N	31.2	Very low	34.2	Very low	89 Å²	89	109.9 Å²	109.9	48%	0.476	55%	0.547	S	S	.	.	H	α-helix	trans	-76.6	-28.4	172.9	-74.8	55.1	0	0	0	112.5	T1282 I1283 V1284 T1288 E1289 L1290	T1282-N1286 PolarHBondContact O-N 3.22Å; T1282-N1286 VanDerWaalsContact O-N 3.1Å; T1282-N1286 PolarHBondContact O-OD1 3.33Å; I1283-N1286 PolarHBondContact O-N 3.05Å; V1284-N1286 VanDerWaalsContact C-N 3.34Å; V1284-N1286 PolarHBondContact O-N 3.49Å; N1286-T1288 VanDerWaalsContact C-N 3.31Å; N1286-T1288 PolarHBondContact O-N 3.42Å; N1286-E1289 PolarHBondContact O-N 3.3Å; N1286-L1290 VanDerWaalsContact O-CD1 3.31Å; N1286-L1290 WeakPolarHBondContact O-CD1 3.46Å; N1286-L1290 PolarHBondContact O-N 2.89Å
1287	A	34.5	Very low	34.1	Very low	55 Å²	55	110.2 Å²	110.2	46%	0.455	55%	0.551	S	S	.	*	H	α-helix	trans	-65.2	-33.6	-179	0	0	0	0	0	112.8	I1283 V1284 L1290 S1291	I1283-A1287 WeakPolarHBondContact O-CB 3.34Å; I1283-A1287 PolarHBondContact O-N 3.08Å; V1284-A1287 PolarHBondContact O-N 3Å; A1287-L1290 PolarHBondContact O-N 2.96Å; A1287-S1291 PolarHBondContact O-N 3.49Å
1288	T	33.9	Very low	34	Very low	87 Å²	87	109.7 Å²	109.7	53%	0.534	55%	0.55	S	S	.	*	H	α-helix	trans	-72.5	-30.5	175.8	46.2	0	0	0	0	113.4	Q1285 N1286 S1291	Q1285-T1288 PolarHBondContact O-OG1 2.95Å; N1286-T1288 VanDerWaalsContact C-N 3.31Å; N1286-T1288 PolarHBondContact O-N 3.42Å; T1288-S1291 PolarHBondContact O-OG 2.94Å; T1288-S1291 VanDerWaalsContact O-OG 3.05Å
1289	E	34.2	Very low	34.2	Very low	136 Å²	136	106.5 Å²	106.5	64%	0.636	54%	0.544	S	S	*	.	H	α-helix	trans	-74	-37.3	172.1	-66.3	-176.3	150.3	0	0	110.8	N1286 S1291 I1292 D1293	N1286-E1289 PolarHBondContact O-N 3.3Å; E1289-S1291 VanDerWaalsContact C-N 3.29Å; E1289-S1291 PolarHBondContact O-N 3.49Å; E1289-I1292 PolarHBondContact O-N 3.38Å; E1289-D1293 PolarHBondContact O-N 2.96Å
1290	L	33.5	Very low	34.2	Very low	112 Å²	112	105.2 Å²	105.2	59%	0.586	54%	0.543	S	S	*	.	H	α-helix	trans	-62.8	-27.1	176.9	-102.1	104.4	0	0	0	114.2	N1286 A1287 H1294	N1286-L1290 VanDerWaalsContact O-CD1 3.31Å; N1286-L1290 WeakPolarHBondContact O-CD1 3.46Å; N1286-L1290 PolarHBondContact O-N 2.89Å; A1287-L1290 PolarHBondContact O-N 2.96Å; L1290-H1294 WeakPolarHBondContact O-CB 3.32Å; L1290-H1294 PolarHBondContact O-N 3.01Å
1291	S	34.9	Very low	34.1	Very low	68 Å²	68	102.3 Å²	102.3	48%	0.476	54%	0.541	S	S	.	.	H	α-helix	trans	-69.8	-34.5	-179.2	69.2	0	0	0	0	112.7	A1287 T1288 E1289 H1294 K1295	A1287-S1291 PolarHBondContact O-N 3.49Å; T1288-S1291 PolarHBondContact O-OG 2.94Å; T1288-S1291 VanDerWaalsContact O-OG 3.05Å; E1289-S1291 VanDerWaalsContact C-N 3.29Å; E1289-S1291 PolarHBondContact O-N 3.49Å; S1291-H1294 PolarHBondContact O-N 3.27Å; S1291-K1295 PolarHBondContact O-N 3.02Å
1292	I	36.7	Very low	34.4	Very low	123 Å²	123	103.6 Å²	103.6	63%	0.631	55%	0.549	S	S	*	.	H	α-helix	trans	-68	-46.3	176.5	-58.1	174.2	0	0	0	109.5	E1289 H1294 K1295 C1296	E1289-I1292 PolarHBondContact O-N 3.38Å; I1292-H1294 VanDerWaalsContact C-N 3.27Å; I1292-H1294 PolarHBondContact O-N 3.22Å; I1292-K1295 PolarHBondContact O-N 3.37Å; I1292-C1296 VanDerWaalsContact O-CB 3.29Å; I1292-C1296 WeakPolarHBondContact O-CB 3.42Å; I1292-C1296 PolarHBondContact O-N 2.99Å
1293	D	35	Very low	34.3	Very low	108 Å²	108	102.8 Å²	102.8	58%	0.578	56%	0.556	S	S	*	*	H	α-helix	trans	-61.1	-36.3	170.5	-90.1	-17	0	0	0	111.4	E1289 K1295 C1296 L1297	E1289-D1293 PolarHBondContact O-N 2.96Å; D1293-K1295 PolarHBondContact O-N 3.48Å; D1293-C1296 PolarHBondContact O-N 3.46Å; D1293-L1297 VanDerWaalsContact O-CB 3.24Å; D1293-L1297 WeakPolarHBondContact O-CB 3.29Å; D1293-L1297 PolarHBondContact O-N 3.44Å
1294	H	35.4	Very low	34	Very low	92 Å²	92	105.7 Å²	105.7	43%	0.426	57%	0.569	S	S	.	*	H	α-helix	trans	-68.3	-33.9	179.4	-145.9	-48.8	0	0	0	113.4	F1008 L1290 S1291 I1292 M1298	F1008-H1294 AromaticContact CE1-NE2 3.61Å; L1290-H1294 WeakPolarHBondContact O-CB 3.32Å; L1290-H1294 PolarHBondContact O-N 3.01Å; S1291-H1294 PolarHBondContact O-N 3.27Å; I1292-H1294 VanDerWaalsContact C-N 3.27Å; I1292-H1294 PolarHBondContact O-N 3.22Å; H1294-M1298 VanDerWaalsContact O-CB 3.32Å; H1294-M1298 WeakPolarHBondContact O-CB 3.32Å; H1294-M1298 WeakPolarHBondContact O-CG 3.44Å; H1294-M1298 PolarHBondContact O-N 3.02Å
1295	K	34.7	Very low	33.5	Very low	151 Å²	151	107.4 Å²	107.4	66%	0.657	58%	0.575	S	S	*	*	H	α-helix	trans	-67.6	-51.7	167.6	-98.1	175.3	175.6	167.4	0	110.4	S1291 I1292 D1293 L1297 M1298 E1299	S1291-K1295 PolarHBondContact O-N 3.02Å; I1292-K1295 PolarHBondContact O-N 3.37Å; D1293-K1295 PolarHBondContact O-N 3.48Å; K1295-L1297 VanDerWaalsContact C-N 3.33Å; K1295-L1297 PolarHBondContact O-N 2.98Å; K1295-M1298 PolarHBondContact O-N 3.39Å; K1295-M1298 VanDerWaalsContact O-N 3.14Å; K1295-E1299 WeakPolarHBondContact O-CG 3.35Å; K1295-E1299 PolarHBondContact O-N 3.45Å
1296	C	33.2	Very low	33.2	Very low	38 Å²	38	108.7 Å²	108.7	26%	0.257	59%	0.585	S	S	.	*	H	α-helix	trans	-57.4	-38.5	-179.2	-178.2	0	0	0	0	113.8	I1292 D1293 K1300	I1292-C1296 VanDerWaalsContact O-CB 3.29Å; I1292-C1296 WeakPolarHBondContact O-CB 3.42Å; I1292-C1296 PolarHBondContact O-N 2.99Å; D1293-C1296 PolarHBondContact O-N 3.46Å; C1296-K1300 WeakPolarHBondContact O-CB 3.41Å; C1296-K1300 WeakPolarHBondContact O-CD 3.47Å; C1296-K1300 VanDerWaalsContact O-CG 3.23Å; C1296-K1300 WeakPolarHBondContact O-CG 3.34Å; C1296-K1300 PolarHBondContact O-N 2.72Å; C1296-K1300 PolarHBondContact SG-NZ 3.27Å
1297	L	31.7	Very low	33.1	Very low	104 Å²	104	110.7 Å²	110.7	55%	0.545	60%	0.601	S	S	.	*	H	α-helix	trans	-78.4	-34	179	-141.5	170.7	0	0	0	111.3	D1293 K1295 K1300 L1301	D1293-L1297 VanDerWaalsContact O-CB 3.24Å; D1293-L1297 WeakPolarHBondContact O-CB 3.29Å; D1293-L1297 PolarHBondContact O-N 3.44Å; K1295-L1297 VanDerWaalsContact C-N 3.33Å; K1295-L1297 PolarHBondContact O-N 2.98Å; L1297-K1300 PolarHBondContact O-N 2.95Å; L1297-L1301 HydrophobicContact CD2-CD1 3.48Å; L1297-L1301 VanDerWaalsContact CD2-CD1 3.48Å; L1297-L1301 HydrophobicContact CD2-CG 3.84Å; L1297-L1301 WeakPolarHBondContact O-CB 3.34Å; L1297-L1301 VanDerWaalsContact O-CG 3.31Å; L1297-L1301 WeakPolarHBondContact O-CG 3.49Å; L1297-L1301 PolarHBondContact O-N 3.31Å
1298	M	34.8	Very low	32.7	Very low	114 Å²	114	117 Å²	117	56%	0.562	62%	0.621	S	S	*	*	H	α-helix	trans	-70.2	-36.6	171.9	-69.7	-76	-82.4	0	0	111.9	H1294 K1295 L1301 S1302	H1294-M1298 VanDerWaalsContact O-CB 3.32Å; H1294-M1298 WeakPolarHBondContact O-CB 3.32Å; H1294-M1298 WeakPolarHBondContact O-CG 3.44Å; H1294-M1298 PolarHBondContact O-N 3.02Å; K1295-M1298 PolarHBondContact O-N 3.39Å; K1295-M1298 VanDerWaalsContact O-N 3.14Å; M1298-L1301 PolarHBondContact O-N 2.98Å; M1298-S1302 WeakPolarHBondContact O-CB 3.37Å; M1298-S1302 PolarHBondContact O-N 3.28Å; M1298-S1302 PolarHBondContact O-OG 3.07Å
1299	E	36.1	Very low	32.4	Very low	136 Å²	136	119.1 Å²	119.1	64%	0.636	63%	0.634	S	S	*	*	H	α-helix	trans	-65.5	-43.1	170.5	-73.7	-179.3	142	0	0	111.1	K1295 L1301 S1302 G1303	K1295-E1299 WeakPolarHBondContact O-CG 3.35Å; K1295-E1299 PolarHBondContact O-N 3.45Å; E1299-L1301 VanDerWaalsContact C-N 3.33Å; E1299-L1301 PolarHBondContact O-N 3.07Å; E1299-S1302 PolarHBondContact O-N 3.45Å; E1299-S1302 PolarHBondContact O-OG 3.3Å; E1299-G1303 WeakPolarHBondContact O-CA 3.36Å; E1299-G1303 PolarHBondContact O-N 3.01Å
1300	K	31.2	Very low	32.2	Very low	139 Å²	139	122 Å²	122	60%	0.604	65%	0.647	S	S	*	*	H	α-helix	trans	-66.2	-31.1	175.1	-75.7	166.2	-178.3	166.7	0	113.7	C1296 L1297	C1296-K1300 WeakPolarHBondContact O-CB 3.41Å; C1296-K1300 WeakPolarHBondContact O-CD 3.47Å; C1296-K1300 VanDerWaalsContact O-CG 3.23Å; C1296-K1300 WeakPolarHBondContact O-CG 3.34Å; C1296-K1300 PolarHBondContact O-N 2.72Å; C1296-K1300 PolarHBondContact SG-NZ 3.27Å; L1297-K1300 PolarHBondContact O-N 2.95Å
1301	L	33.7	Very low	32	Very low	123 Å²	123	120 Å²	120	64%	0.644	66%	0.655	S	S	*	*	H	α-helix	trans	-83.7	-17.3	175.4	-73.4	171.5	0	0	0	114.1	L1297 M1298 E1299	L1297-L1301 HydrophobicContact CD2-CD1 3.48Å; L1297-L1301 VanDerWaalsContact CD2-CD1 3.48Å; L1297-L1301 HydrophobicContact CD2-CG 3.84Å; L1297-L1301 WeakPolarHBondContact O-CB 3.34Å; L1297-L1301 VanDerWaalsContact O-CG 3.31Å; L1297-L1301 WeakPolarHBondContact O-CG 3.49Å; L1297-L1301 PolarHBondContact O-N 3.31Å; M1298-L1301 PolarHBondContact O-N 2.98Å; E1299-L1301 VanDerWaalsContact C-N 3.33Å; E1299-L1301 PolarHBondContact O-N 3.07Å
1302	S	39.7	Very low	31.8	Very low	90 Å²	90	124 Å²	124	63%	0.629	67%	0.671	S	S	*	*	H	α-helix	trans	-101.1	-14.7	173.2	55.4	0	0	0	0	113.7	M1298 E1299	M1298-S1302 WeakPolarHBondContact O-CB 3.37Å; M1298-S1302 PolarHBondContact O-N 3.28Å; M1298-S1302 PolarHBondContact O-OG 3.07Å; E1299-S1302 PolarHBondContact O-N 3.45Å; E1299-S1302 PolarHBondContact O-OG 3.3Å
1303	G	32.3	Very low	31.4	Very low	57 Å²	57	123.6 Å²	123.6	59%	0.588	67%	0.674	S	S	*	*			trans	-89	3.3	175.6	0	0	0	0	0	115.4	E1299 D1305	E1299-G1303 WeakPolarHBondContact O-CA 3.36Å; E1299-G1303 PolarHBondContact O-N 3.01Å; G1303-D1305 PolarHBondContact O-N 3.09Å; G1303-D1305 VanDerWaalsContact O-N 3.09Å
1304	M	29	Very low	31.1	Very low	163 Å²	163	123.8 Å²	123.8	80%	0.803	67%	0.674	S	S	*	*			trans	-83.7	47.9	172	-70.1	-169.5	73.8	0	0	112.2
1305	D	26.8	Very low	30.7	Very low	134 Å²	134	126.8 Å²	126.8	72%	0.717	69%	0.689	S	S	*	*	S	Bend	trans	-139.7	105.5	173	-106.9	-31.2	0	0	0	109.6	G1303	G1303-D1305 PolarHBondContact O-N 3.09Å; G1303-D1305 VanDerWaalsContact O-N 3.09Å
1306	L	24.7	Very low	30.4	Very low	164 Å²	164	127.1 Å²	127.1	86%	0.859	69%	0.694	S	S	*	*			trans	60.9	85.7	154.1	-56.4	170.5	0	0	0	121.5
1307	T	28.6	Very low	30.1	Very low	131 Å²	131	132.8 Å²	132.8	80%	0.804	72%	0.717	S	S	*	*			trans	-151.4	117.9	149.4	51.9	0	0	0	0	109.6
1308	E	26.2	Very low	29.8	Very low	187 Å²	187	136.5 Å²	136.5	87%	0.874	73%	0.729	S	S	*	*				75.2	93.2	76.9	-72.3	-164.8	160.8	0	0	117
1309	T	28.8	Very low	29.4	Very low	132 Å²	132	134.2 Å²	134.2	81%	0.81	72%	0.724	S	S	*	*			trans	-163.8	116.2	146.5	45.5	0	0	0	0	107.1
1310	E	28.5	Very low	29.1	Very low	195 Å²	195	135.7 Å²	135.7	91%	0.911	73%	0.731	S	S	*	*				91.4	120.5	64.2	-79.5	-161.2	149.2	0	0	114.8
1311	G	29.5	Very low	28.9	Very low	72 Å²	72	137.5 Å²	137.5	74%	0.742	74%	0.739	S	S	*	*			trans	84.2	132.5	175.2	0	0	0	0	0	115.8
1312	D	30.6	Very low	28.5	Very low	152 Å²	152	136 Å²	136	81%	0.813	74%	0.739	S	S	*	*			cis	-158.3	147.3	-0	-115.6	-15.5	0	0	0	111.2
1313	V	28.4	Very low	27.8	Very low	114 Å²	114	136.6 Å²	136.6	69%	0.691	74%	0.743	S	S	*	*			trans	45.7	121.6	139.6	177.9	0	0	0	0	118.6
1314	N	29.2	Very low	27.5	Very low	111 Å²	111	138.8 Å²	138.8	59%	0.594	75%	0.75	S	S	*	*			cis	-167.7	160.1	16.8	-127.5	21.2	0	0	0	112.6
1315	E	27.6	Very low	27.5	Very low	155 Å²	155	136.8 Å²	136.8	72%	0.724	75%	0.747	S	S	*	*			trans	57.3	136.7	143.8	-70.1	169.4	163.2	0	0	120.7
1316	M	27.7	Very low	27.7	Very low	158 Å²	158	138 Å²	138	78%	0.778	75%	0.753	S	S	*	*			cis	-149	146.9	20.3	-66.2	-174.4	-158.5	0	0	114.3
1317	H	27.9	Very low	28	Very low	158 Å²	158	133.6 Å²	133.6	73%	0.731	75%	0.747	S	S	*	*			trans	38.7	144.6	136.5	-63.9	-70.3	0	0	0	124.9
1318	F	25.6	Very low	28.4	Very low	181 Å²	181	132.9 Å²	132.9	79%	0.794	75%	0.745	S	S	*	*			cis	-169.9	172.3	-26.6	-137.9	-103.4	0	0	0	109.2
1319	S	24.6	Very low	28.7	Very low	67 Å²	67	129.2 Å²	129.2	47%	0.469	74%	0.74	S	S	.	*			trans	-61.8	161.9	-172.2	58	0	0	0	0	119
1320	H	30	Very low	29.1	Very low	167 Å²	167	127.6 Å²	127.6	77%	0.773	73%	0.731	S	S	*	*				158.2	152.5	127.6	-83.5	-57.4	0	0	0	111.5
1321	F	27.9	Very low	29.3	Very low	176 Å²	176	127 Å²	127	77%	0.772	73%	0.731	S	S	*	*			cis	-177.8	137.1	-25.4	-139	-108.1	0	0	0	107
1322	S	24.5	Very low	29.5	Very low	91 Å²	91	127.6 Å²	127.6	64%	0.636	73%	0.729	S	S	*	*			trans	17	130.5	161.4	65.1	0	0	0	0	125
1323	S	25.6	Very low	29.4	Very low	104 Å²	104	128 Å²	128	73%	0.727	73%	0.731	S	S	*	*				78.3	137.7	125.7	68.5	0	0	0	0	125.3
1324	S	26.3	Very low	29.5	Very low	103 Å²	103	125.2 Å²	125.2	72%	0.72	73%	0.725	S	S	*	*			trans	98.8	122.9	138.2	69.9	0	0	0	0	123.3
1325	T	29.1	Very low	29.5	Very low	121 Å²	121	129 Å²	129	74%	0.742	74%	0.737	S	S	*	*			trans	80.4	137.5	138.4	41	0	0	0	0	124.9
1326	D	30.5	Very low	29.6	Very low	160 Å²	160	128.7 Å²	128.7	86%	0.856	74%	0.739	S	S	*	*			trans	82.9	143.4	151.9	-57.7	-14.8	0	0	0	123.4
1327	G	31.2	Very low	29.9	Very low	71 Å²	71	126.6 Å²	126.6	73%	0.732	74%	0.738	S	S	*	*			trans	-118.4	-127.3	-177.5	0	0	0	0	0	112.4
1328	P	37.3	Very low	29.8	Very low	115 Å²	115	123.5 Å²	123.5	75%	0.747	74%	0.74	S	S	*	*			cis	-144.5	156.4	-8.2	41.2	-22.8	0	0	0	117.8
1329	S	32.8	Very low	29.8	Very low	111 Å²	111	120.4 Å²	120.4	78%	0.776	74%	0.741	S	S	*	*			trans	58.5	-172.2	142.7	81.4	0	0	0	0	119.8
1330	P	36.5	Very low	29.9	Very low	97 Å²	97	123.2 Å²	123.2	63%	0.63	75%	0.754	S	S	*	*			cis	-137.2	178.1	-13.6	39.6	-21.7	0	0	0	117.1
1331	M	32.6	Very low	29.7	Very low	182 Å²	182	120.6 Å²	120.6	90%	0.897	76%	0.755	S	S	*	*			trans	67.8	150.2	162.1	-50.4	-161	-152.3	0	0	118.5
1332	A	33.6	Very low	29.7	Very low	85 Å²	85	117.1 Å²	117.1	70%	0.702	76%	0.759	S	S	*	*			cis	-176.7	163.2	-20	0	0	0	0	0	106.2
1333	D	29.6	Very low	30.1	Very low	160 Å²	160	117 Å²	117	86%	0.856	76%	0.763	S	S	*	*			cis	-156.6	-178	-6.3	-126.7	-62.4	0	0	0	106.1
1334	G	29.6	Very low	30.3	Very low	56 Å²	56	118.5 Å²	118.5	58%	0.577	77%	0.771	S	S	*	*			cis	173.6	179.9	4.4	0	0	0	0	0	112.6
1335	F	30	Very low	30.5	Very low	190 Å²	190	118.8 Å²	118.8	83%	0.833	77%	0.773	S	S	*	*			trans	41.3	92.8	167.4	-81.6	-91.8	0	0	0	121.4
1336	L	28.8	Very low	30.4	Very low	149 Å²	149	119.8 Å²	119.8	78%	0.78	78%	0.778	S	S	*	*				42	149.5	116.9	-61.6	174.8	0	0	0	122.3
1337	P	34.2	Very low	30.2	Very low	114 Å²	114	121.8 Å²	121.8	74%	0.74	77%	0.774	S	S	*	*			cis	-145.2	130.2	-43	35.9	-17	0	0	0	115
1338	A	25.2	Very low	30	Very low	94 Å²	94	128.4 Å²	128.4	78%	0.777	78%	0.783	S	S	*	*			trans	-163.8	115.9	158.7	0	0	0	0	0	115.3
1339	S	26.5	Very low	29.5	Very low	116 Å²	116	129 Å²	129	81%	0.811	78%	0.78	S	S	*	*			trans	65.4	156.7	158.7	72.9	0	0	0	0	120.5
1340	V	26.5	Very low	29.4	Very low	125 Å²	125	130.6 Å²	130.6	76%	0.758	78%	0.78	S	S	*	*			trans	71.3	100.4	164.7	-170.5	0	0	0	0	119.2
1341	S	26.1	Very low	28.9	Very low	112 Å²	112	133.1 Å²	133.1	78%	0.783	79%	0.788	S	S	*	*			trans	44.4	128.4	146.9	71.7	0	0	0	0	122.8
1342	A	27.4	Very low	28.8	Very low	103 Å²	103	131.5 Å²	131.5	85%	0.851	78%	0.781	S	S	*	*			trans	-155.3	153.2	138.6	0	0	0	0	0	111.7
1343	A	32.3	Very low	28.5	Very low	89 Å²	89	133.1 Å²	133.1	74%	0.736	78%	0.778	S	S	*	*			trans	-83.1	-162.8	173.1	0	0	0	0	0	111.9
1344	P	31.4	Very low	28.5	Very low	135 Å²	135	132.8 Å²	132.8	88%	0.877	78%	0.777	S	S	*	*				-139.9	179.9	92.8	38.1	-24.2	0	0	0	114.7
1345	S	28.8	Very low	28.5	Very low	110 Å²	110	137.5 Å²	137.5	77%	0.769	79%	0.787	S	S	*	*			trans	-126.1	166.1	-170.7	56.8	0	0	0	0	113.5
1346	V	27.4	Very low	28.6	Very low	142 Å²	142	137.6 Å²	137.6	86%	0.861	79%	0.791	S	S	*	*			trans	-128.4	148.1	162.2	-179.4	0	0	0	0	108.4
1347	R	25.9	Very low	28.6	Very low	201 Å²	201	140.3 Å²	140.3	76%	0.758	79%	0.791	S	S	*	*			trans	-100.1	150.3	177.1	-78.9	-177.6	165.4	104	-6	111.4
1348	F	27.4	Very low	28.2	Very low	210 Å²	210	143.9 Å²	143.9	92%	0.921	80%	0.797	S	S	*	*			trans	-140.1	153.5	132.9	-97.4	-81.2	0	0	0	109.2
1349	D	28.2	Very low	28.5	Very low	127 Å²	127	144.2 Å²	144.2	68%	0.679	80%	0.8	S	S	*	*			trans	-110.4	154.5	-176.8	-65.8	-65.9	0	0	0	111.1
1350	D	29.3	Very low	28.6	Very low	145 Å²	145	143.6 Å²	143.6	78%	0.775	80%	0.795	S	S	*	*	S	Bend	trans	42.9	128.9	159.4	-65.8	-19.4	0	0	0	121.7
1351	N	27.1	Very low	28.7	Very low	150 Å²	150	144.2 Å²	144.2	80%	0.802	80%	0.795	S	S	*	*			trans	84.2	75.4	168.2	-45.3	-66.9	0	0	0	117.8
1352	I	29.5	Very low	28.9	Very low	148 Å²	148	143.5 Å²	143.5	76%	0.759	80%	0.796	S	S	*	*				-141.4	119.5	129.2	-96.6	143.4	0	0	0	106.5
1353	N	27.6	Very low	28.8	Very low	120 Å²	120	144.4 Å²	144.4	64%	0.642	79%	0.786	S	S	*	*			trans	-92.5	176.1	154.2	-66.5	-72.4	0	0	0	107.3	L1355	N1353-L1355 PolarHBondContact O-N 3.23Å
1354	D	29.5	Very low	28.6	Very low	153 Å²	153	144.9 Å²	144.9	82%	0.818	78%	0.784	S	S	*	*	S	Bend	trans	83.4	3.3	157.4	-42	-36.7	0	0	0	119.3
1355	L	30.2	Very low	28.3	Very low	154 Å²	154	145.8 Å²	145.8	81%	0.806	79%	0.787	S	S	*	*	S	Bend	trans	-132.9	-20.3	172.4	-75.4	176.2	0	0	0	118.3	N1353	N1353-L1355 PolarHBondContact O-N 3.23Å
1356	E	31.4	Very low	28.2	Very low	192 Å²	192	149 Å²	149	90%	0.897	79%	0.79	S	S	*	*	S	Bend	trans	-101.1	37	178.7	-67.1	-167.6	138.1	0	0	113.4
1357	R	28.7	Very low	28.2	Very low	207 Å²	207	147.4 Å²	147.4	78%	0.781	79%	0.785	S	S	*	*	S	Bend	trans	-116.2	0.4	-174.8	-138.4	-174.2	-168	97.3	9	116.2
1358	E	26.5	Very low	28.2	Very low	189 Å²	189	149.1 Å²	149.1	88%	0.883	79%	0.792	S	S	*	*	S	Bend	trans	-120	-1.7	-170.5	-57.9	-168.9	139.2	0	0	113.9
1359	A	31.1	Very low	28.2	Very low	101 Å²	101	151 Å²	151	84%	0.835	79%	0.794	S	S	*	*	S	Bend	trans	-102.7	7.6	-172.3	0	0	0	0	0	115.7
1360	S	29.3	Very low	28.1	Very low	102 Å²	102	152 Å²	152	71%	0.713	80%	0.8	S	S	*	*	S	Bend	trans	-122.3	-4.9	-176.8	65.9	0	0	0	0	116.4	A1362	S1360-A1362 VanDerWaalsContact C-N 3.28Å; S1360-A1362 PolarHBondContact O-N 3.35Å
1361	D	28.5	Very low	28	Very low	139 Å²	139	149.4 Å²	149.4	74%	0.743	79%	0.793	S	S	*	*			trans	-91.9	22.1	-174	-77.1	0.7	0	0	0	113.4
1362	A	29.3	Very low	27.9	Very low	97 Å²	97	151.4 Å²	151.4	80%	0.802	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	25.5	-166.1	0	0	0	0	0	116.6	S1360	S1360-A1362 VanDerWaalsContact C-N 3.28Å; S1360-A1362 PolarHBondContact O-N 3.35Å
1363	D	25.9	Very low	27.8	Very low	122 Å²	122	152.3 Å²	152.3	65%	0.652	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143	36.6	169.5	-158.1	6.4	0	0	0	114.5	R993	R993-D1363 IonicContact CZ-OD1 3.21Å; R993-D1363 IonicContact CZ-OD2 3.11Å; R993-D1363 IonicContact NH2-OD1 3.23Å; R993-D1363 PolarHBondContact NH2-OD1 2.95Å; R993-D1363 IonicContact NH2-OD2 2.66Å; R993-D1363 PolarHBondContact NH2-OD2 2.72Å
1364	S	26.9	Very low	27.8	Very low	99 Å²	99	152.2 Å²	152.2	69%	0.692	80%	0.795	S	S	*	*			trans	-155.7	74.8	166.8	64.5	0	0	0	0	114.3	Q1366	S1364-Q1366 VanDerWaalsContact C-N 3.34Å; S1364-Q1366 PolarHBondContact O-N 2.79Å
1365	T	25.8	Very low	27.6	Very low	153 Å²	153	152.3 Å²	152.3	94%	0.939	80%	0.795	S	S	*	*			trans	-71.2	83.4	173.5	55.4	0	0	0	0	111.8
1366	Q	27.4	Very low	27.6	Very low	177 Å²	177	151.6 Å²	151.6	83%	0.827	79%	0.791	S	S	*	*			trans	-126	103.1	175.8	-124.8	-177.6	12.1	0	0	112.7	S1364	S1364-Q1366 VanDerWaalsContact C-N 3.34Å; S1364-Q1366 PolarHBondContact O-N 2.79Å
1367	S	26.6	Very low	27.5	Very low	109 Å²	109	150.5 Å²	150.5	76%	0.762	79%	0.786	S	S	*	*			trans	49.4	89.3	156.7	60.6	0	0	0	0	118.7
1368	R	25.6	Very low	27.5	Very low	238 Å²	238	147.2 Å²	147.2	90%	0.898	78%	0.784	S	S	*	*			trans	-163	104.9	143.8	-118.1	173.7	-178.3	170	-0.2	112.8
1369	Y	27.7	Very low	27.5	Very low	248 Å²	248	144 Å²	144	97%	0.973	77%	0.769	S	S	*	*			trans	-141.6	117.1	153.8	-93.5	-77.8	0	0	0	107.4
1370	D	26.8	Very low	27.3	Very low	148 Å²	148	148.6 Å²	148.6	79%	0.791	77%	0.765	S	S	*	*			trans	-143.8	95.7	179.8	-166.2	4.4	0	0	0	110.2
1371	S	27.7	Very low	27.2	Very low	92 Å²	92	149.4 Å²	149.4	64%	0.643	77%	0.771	S	S	*	*	S	Bend	trans	69.9	126.3	168.6	81.4	0	0	0	0	119.6
1372	K	24.3	Very low	27.3	Very low	191 Å²	191	147 Å²	147	83%	0.83	77%	0.77	S	S	*	*			trans	70.5	116.3	157.9	-54.6	165.2	-173.6	167	0	118.3
1373	E	26.8	Very low	27.2	Very low	167 Å²	167	147.7 Å²	147.7	78%	0.78	77%	0.769	S	S	*	*				-164.3	157.6	100.2	-109.9	174.5	-148.8	0	0	111.9
1374	N	28	Very low	27.7	Very low	119 Å²	119	147.5 Å²	147.5	64%	0.636	77%	0.774	S	S	*	*			trans	50.5	123.6	157	-50.1	-28.4	0	0	0	119.3
1375	L	26.1	Very low	28	Very low	154 Å²	154	148.5 Å²	148.5	81%	0.806	78%	0.779	S	S	*	*			cis	107.7	156.5	39	-85.3	168.3	0	0	0	111.4
1376	L	30	Very low	28.3	Very low	139 Å²	139	145.3 Å²	145.3	73%	0.728	77%	0.767	S	S	*	*			trans	72.9	101.2	-166.8	-45.6	179.3	0	0	0	111.8
1377	E	27.8	Very low	28.4	Very low	169 Å²	169	144.8 Å²	144.8	79%	0.79	77%	0.765	S	S	*	*				85.4	131.7	83.1	-75.1	159.7	-166.6	0	0	111
1378	D	29.4	Very low	28.6	Very low	139 Å²	139	145.1 Å²	145.1	74%	0.743	76%	0.762	S	S	*	*			cis	-151.9	161.4	32.3	-140.1	-7.6	0	0	0	117.5
1379	E	26	Very low	28.8	Very low	121 Å²	121	140.2 Å²	140.2	57%	0.565	75%	0.754	S	S	*	*			trans	43.1	99.3	144.7	-74.9	-102	76.9	0	0	123.8
1380	R	27.6	Very low	28.6	Very low	197 Å²	197	135.7 Å²	135.7	74%	0.743	75%	0.745	S	S	*	*				147.6	124	100.1	-86.4	164.6	-171.7	-176.4	10.8	118.9
1381	S	26.8	Very low	28.7	Very low	120 Å²	120	136 Å²	136	84%	0.839	74%	0.744	S	S	*	*			trans	65.2	137	145.7	70.2	0	0	0	0	121.1
1382	A	30	Very low	28.5	Very low	88 Å²	88	141.2 Å²	141.2	73%	0.727	75%	0.749	S	S	*	*			cis	-159.7	149.6	-12.9	0	0	0	0	0	113.5
1383	S	28.9	Very low	28.8	Very low	111 Å²	111	141.3 Å²	141.3	78%	0.776	75%	0.75	S	S	*	*			trans	64.3	116	159.5	52.4	0	0	0	0	121.2
1384	P	35	Very low	28.7	Very low	119 Å²	119	139 Å²	139	77%	0.773	74%	0.743	S	S	*	*			trans	-94.1	-150	160.4	45.5	-38	0	0	0	109.3
1385	P	32.9	Very low	28.6	Very low	120 Å²	120	139.5 Å²	139.5	78%	0.779	76%	0.756	S	S	*	*			cis	-98.8	-145.5	19.9	36.7	-21.7	0	0	0	111.3
1386	A	33.1	Very low	28.6	Very low	85 Å²	85	135.6 Å²	135.6	70%	0.702	75%	0.753	S	S	*	*			cis	-166.6	159.8	7.4	0	0	0	0	0	108.1
1387	H	29.3	Very low	28.4	Very low	167 Å²	167	137.2 Å²	137.2	77%	0.773	76%	0.762	S	S	*	*			cis	-167.1	171.2	-17.3	-149.9	-83.9	0	0	0	108.3
1388	V	30.8	Very low	28.4	Very low	115 Å²	115	135.8 Å²	135.8	70%	0.697	77%	0.765	S	S	*	*			trans	70.6	126.1	166.4	-179.9	0	0	0	0	116.8
1389	D	29.9	Very low	28.1	Very low	136 Å²	136	134.2 Å²	134.2	73%	0.727	77%	0.766	S	S	*	*			cis	-153.7	160.9	-13	-111.1	-6	0	0	0	111.6
1390	L	23.8	Very low	28	Very low	153 Å²	153	133.4 Å²	133.4	80%	0.801	77%	0.773	S	S	*	*			trans	-131.1	125.2	-179.9	-144.7	170.9	0	0	0	108.7
1391	M	29	Very low	27.8	Very low	153 Å²	153	130.8 Å²	130.8	75%	0.754	77%	0.774	S	S	*	*			trans	-127.7	93.4	176.6	-86.9	-77.4	-170.4	0	0	110.6	F1393	M1391-F1393 HydrophobicContact SD-CD2 4.18Å; M1391-F1393 HydrophobicContact SD-CE2 3.71Å
1392	R	23.9	Very low	27.8	Very low	203 Å²	203	134.7 Å²	134.7	77%	0.766	78%	0.776	S	S	*	*			trans	-74.9	154.7	148.6	-78.7	178.9	167.8	158	-9.5	108.2
1393	F	29.5	Very low	27.6	Very low	193 Å²	193	135.3 Å²	135.3	85%	0.846	77%	0.771	S	S	*	*			trans	-130.9	120	154.2	-104.6	-80.4	0	0	0	108.7	M1391	M1391-F1393 HydrophobicContact SD-CD2 4.18Å; M1391-F1393 HydrophobicContact SD-CE2 3.71Å
1394	D	24.6	Very low	27.3	Very low	118 Å²	118	141.3 Å²	141.3	63%	0.631	78%	0.776	S	S	*	*			trans	-115.6	154.1	179.5	-86.7	-62.3	0	0	0	110
1395	S	26.2	Very low	27	Very low	129 Å²	129	140.8 Å²	140.8	90%	0.902	78%	0.776	S	S	*	*			trans	66.3	144.6	163.6	76.4	0	0	0	0	119
1396	G	26.6	Very low	26.5	Very low	73 Å²	73	139.6 Å²	139.6	75%	0.753	77%	0.77	S	S	*	*			trans	156.6	95.8	173.2	0	0	0	0	0	113.2	T1398	G1396-T1398 PolarHBondContact O-N 3.22Å
1397	N	25.4	Very low	26	Very low	172 Å²	172	145.5 Å²	145.5	92%	0.92	78%	0.775	S	S	*	*			trans	-71.8	119.5	174.4	-84.8	-26.8	0	0	0	111.5
1398	T	27.4	Very low	25.8	Very low	139 Å²	139	148.6 Å²	148.6	85%	0.853	78%	0.78	S	S	*	*			trans	-136.9	123.5	153.6	42.8	0	0	0	0	111.1	G1396	G1396-T1398 PolarHBondContact O-N 3.22Å
1399	S	22.8	Very low	25.5	Very low	107 Å²	107	149.2 Å²	149.2	75%	0.748	79%	0.785	S	S	*	*			trans	-85.7	166.3	169.3	51.9	0	0	0	0	111.3
1400	S	24.3	Very low	25.1	Very low	103 Å²	103	148.4 Å²	148.4	72%	0.72	79%	0.789	S	S	*	*			trans	62.1	140.6	178	52.6	0	0	0	0	115.3
1401	D	23.9	Very low	25.1	Very low	143 Å²	143	145.4 Å²	145.4	77%	0.765	78%	0.781	S	S	*	*			cis	-154.4	-176.6	-1.6	-115.5	-28.7	0	0	0	110.8
1402	F	26.9	Very low	24.7	Very low	202 Å²	202	148.1 Å²	148.1	89%	0.886	78%	0.783	S	S	*	*			trans	75.2	135.2	179.3	-82.9	-101.4	0	0	0	118
1403	V	25	Very low	24.7	Very low	101 Å²	101	147.5 Å²	147.5	61%	0.612	78%	0.782	S	S	*	*				177.6	131.7	-50.4	147.2	0	0	0	0	107.4
1404	R	24.2	Very low	24.4	Very low	237 Å²	237	147.7 Å²	147.7	89%	0.894	78%	0.777	S	S	*	*			trans	63	140.6	178.5	-67.3	165.1	177	163.8	-1	115.4
1405	S	27.2	Very low	24.3	Very low	108 Å²	108	152.3 Å²	152.3	76%	0.755	79%	0.786	S	S	*	*			cis	-152.3	135.7	-6.5	44.2	0	0	0	0	108.5
1406	S	22.8	Very low	24.1	Very low	94 Å²	94	154.2 Å²	154.2	66%	0.657	78%	0.783	S	S	*	*			cis	85.1	98.1	45.2	-65.6	0	0	0	0	115.5
1407	Y	23.9	Very low	24	Very low	210 Å²	210	155.6 Å²	155.6	82%	0.824	78%	0.78	S	S	*	*			trans	71.5	135.5	137.2	-68	-66.6	0	0	0	123.5
1408	R	23.4	Very low	23.9	Very low	232 Å²	232	159.4 Å²	159.4	88%	0.875	78%	0.782	S	S	*	*			trans	69.9	144.8	154	-65.2	163.3	-179.1	-175.6	-0.5	116.2
1409	T	24.3	Very low	23.9	Very low	128 Å²	128	155.6 Å²	155.6	79%	0.785	77%	0.771	S	S	*	*			cis	-124	154.9	-1.5	52.3	0	0	0	0	109.3
1410	S	22.4	Very low	24.1	Very low	118 Å²	118	157.8 Å²	157.8	83%	0.825	77%	0.774	S	S	*	*			cis	79	150.1	21.2	-151.6	0	0	0	0	117.2
1411	S	22.7	Very low	24.1	Very low	91 Å²	91	159.2 Å²	159.2	64%	0.636	77%	0.773	S	S	*	*			trans	-116.7	176.2	-155	65.3	0	0	0	0	114.9
1412	R	21.9	Very low	24.3	Very low	209 Å²	209	158.9 Å²	158.9	79%	0.789	77%	0.768	S	S	*	*			trans	80.6	141.7	157.8	-67.1	172	173.7	-170.3	-2.3	120.3
1413	Y	24	Very low	24.2	Very low	191 Å²	191	160.3 Å²	160.3	75%	0.749	77%	0.768	S	S	*	*			trans	65.5	153.2	158.1	-66	-54	0	0	0	118.1
1414	R	22.2	Very low	24.3	Very low	196 Å²	196	158.8 Å²	158.8	74%	0.74	77%	0.773	S	S	*	*			cis	-152.9	147.8	-1.9	-134.8	174.3	-149.3	-179.3	5.6	111.8
1415	R	22	Very low	24.3	Very low	216 Å²	216	156.1 Å²	156.1	82%	0.815	77%	0.773	S	S	*	*			trans	23	118.7	150.7	-72.9	-176	-175.6	163.5	1.4	122.5
1416	M	22.7	Very low	24.4	Very low	169 Å²	169	158.4 Å²	158.4	83%	0.833	77%	0.771	S	S	*	*				85.8	146.8	106.2	-160.4	164.6	172.4	0	0	122.9
1417	S	25.2	Very low	24.6	Very low	101 Å²	101	161.4 Å²	161.4	71%	0.706	78%	0.775	S	S	*	*			trans	60.1	101.9	164.8	49.6	0	0	0	0	119.3
1418	R	23.6	Very low	24.7	Very low	252 Å²	252	157.3 Å²	157.3	95%	0.951	77%	0.767	S	S	*	*				83.1	111.4	78.2	-176	-178.4	-171.3	153.2	3.4	113.7
1419	G	27.2	Very low	24.8	Very low	60 Å²	60	151.8 Å²	151.8	62%	0.619	76%	0.755	S	S	*	*			trans	162.8	106.8	166.6	0	0	0	0	0	113.1
1420	D	26.5	Very low	24.8	Very low	152 Å²	152	151.7 Å²	151.7	81%	0.813	75%	0.754	S	S	*	*				41.8	140.2	124.9	-48.6	-19.9	0	0	0	120.5
1421	L	25.1	Very low	25.2	Very low	133 Å²	133	153.5 Å²	153.5	70%	0.696	75%	0.753	S	S	*	*			cis	-161.3	148.1	-5	-144.9	92.9	0	0	0	110.5
1422	M	26.8	Very low	25.4	Very low	137 Å²	137	159.7 Å²	159.7	68%	0.675	76%	0.763	S	S	*	*			trans	38.6	147.1	149.5	-76.1	-168	-173.7	0	0	124.9
1423	R	25.5	Very low	25.7	Very low	231 Å²	231	154 Å²	154	87%	0.872	76%	0.755	S	S	*	*			trans	75.1	142.8	152.2	-78.6	173.5	-96.7	-164.8	-6.2	117.1
1424	G	26.8	Very low	26	Very low	70 Å²	70	150.2 Å²	150.2	72%	0.722	76%	0.756	S	S	*	*			cis	-156.7	168.3	1.9	0	0	0	0	0	113.5
1425	M	23.7	Very low	26.2	Very low	181 Å²	181	148 Å²	148	89%	0.892	76%	0.756	S	S	*	*			trans	-68.7	153.7	177.4	-61.1	146.1	86.4	0	0	111.1
1426	H	28.9	Very low	26.6	Very low	155 Å²	155	143.3 Å²	143.3	72%	0.718	75%	0.747	S	S	*	*				173.1	133.9	121.8	-103.1	-93.6	0	0	0	111.1
1427	Q	27.7	Very low	26.8	Very low	158 Å²	158	142.4 Å²	142.4	74%	0.738	74%	0.741	S	S	*	*			trans	58.3	159.8	144.4	-77.9	156.7	-32.1	0	0	120.6
1428	N	25.2	Very low	26.9	Very low	123 Å²	123	143.3 Å²	143.3	66%	0.658	75%	0.747	S	S	*	*			cis	-161.3	173.9	-37.1	-127.6	35.2	0	0	0	109.6
1429	D	25.6	Very low	27.2	Very low	116 Å²	116	134.2 Å²	134.2	62%	0.62	73%	0.732	S	S	*	*			trans	57.2	105.5	144.3	-59.9	-28.3	0	0	0	123.7
1430	T	25.8	Very low	27.2	Very low	127 Å²	127	138.5 Å²	138.5	78%	0.779	75%	0.746	S	S	*	*				75.5	-178.2	128.2	72.3	0	0	0	0	120.5
1431	I	30.4	Very low	27.2	Very low	155 Å²	155	134.7 Å²	134.7	80%	0.795	74%	0.743	S	S	*	*			trans	78.3	129.8	177.2	-54.4	177.2	0	0	0	115.6
1432	R	26.4	Very low	27.5	Very low	222 Å²	222	133.7 Å²	133.7	84%	0.838	75%	0.754	S	S	*	*			cis	-166.3	156.9	-34.3	-134.8	178.5	-174.8	164.5	0.9	110.4
1433	S	27.6	Very low	27.6	Very low	90 Å²	90	131.6 Å²	131.6	63%	0.629	76%	0.758	S	S	*	*			trans	12.3	134.5	147.8	59.3	0	0	0	0	122.1
1434	S	30.2	Very low	28	Very low	111 Å²	111	125.7 Å²	125.7	78%	0.776	75%	0.75	S	S	*	*				171.8	146.9	128.3	37.8	0	0	0	0	110.1
1435	M	27.7	Very low	28	Very low	150 Å²	150	127.6 Å²	127.6	74%	0.739	75%	0.752	S	S	*	*			cis	-161	155.1	-16.5	-138.3	92.7	166.3	0	0	107.8
1436	D	29.3	Very low	28.2	Very low	116 Å²	116	123.6 Å²	123.6	62%	0.62	74%	0.742	S	S	*	*			trans	49.6	153.1	133.1	-64.6	1.6	0	0	0	122.8
1437	Q	28.7	Very low	28	Very low	151 Å²	151	120.6 Å²	120.6	71%	0.706	74%	0.738	S	S	*	*			cis	-167	157.2	-5.3	-114.7	173.1	51.9	0	0	110.7
1438	S	26.5	Very low	27.9	Very low	120 Å²	120	118 Å²	118	84%	0.839	74%	0.738	S	S	*	*			trans	70	158.6	148.2	78.3	0	0	0	0	122.2
1439	G	30.2	Very low	27.9	Very low	61 Å²	61	120.6 Å²	120.6	63%	0.629	75%	0.751	S	S	*	*			trans	105.8	84	166.9	0	0	0	0	0	115.7
1440	T	26.9	Very low	27.9	Very low	149 Å²	149	123.9 Å²	123.9	91%	0.914	77%	0.765	S	S	*	*				42.4	124.2	84	71.1	0	0	0	0	115
1441	G	27.4	Very low	28.1	Very low	72 Å²	72	122.1 Å²	122.1	74%	0.742	76%	0.763	S	S	*	*			cis	170.1	-160.7	1.2	0	0	0	0	0	111.5
1442	A	29.6	Very low	27.9	Very low	112 Å²	112	119.4 Å²	119.4	93%	0.926	76%	0.757	S	S	*	*			trans	74.7	128.4	175.5	0	0	0	0	0	119
1443	A	29.9	Very low	28	Very low	93 Å²	93	116 Å²	116	77%	0.769	76%	0.756	S	S	*	*			trans	-110.6	-144.6	163.8	0	0	0	0	0	107
1444	P	33.9	Very low	28	Very low	108 Å²	108	120.4 Å²	120.4	70%	0.701	77%	0.767	S	S	*	*			cis	-139.3	178.3	0.4	42	-22.4	0	0	0	116.5
1445	S	26.4	Very low	27.9	Very low	110 Å²	110	122.3 Å²	122.3	77%	0.769	77%	0.768	S	S	*	*			trans	47.7	157.7	139.2	72.8	0	0	0	0	122
1446	S	27.6	Very low	27.8	Very low	96 Å²	96	121.7 Å²	121.7	67%	0.671	77%	0.767	S	S	*	*			cis	-162.2	171.6	28.6	60.9	0	0	0	0	114
1447	S	26.2	Very low	27.8	Very low	92 Å²	92	122.1 Å²	122.1	64%	0.643	77%	0.769	S	S	*	*			trans	44.2	118.2	146.8	58.5	0	0	0	0	120.4
1448	S	24.5	Very low	27.8	Very low	105 Å²	105	121.6 Å²	121.6	73%	0.734	77%	0.767	S	S	*	*				67.5	107.1	51.5	83.5	0	0	0	0	116.2
1449	L	26.3	Very low	27.9	Very low	176 Å²	176	123.6 Å²	123.6	92%	0.921	76%	0.763	S	S	*	*				176.7	172.7	126.3	-97	162.4	0	0	0	112.3
1450	M	25.4	Very low	27.8	Very low	186 Å²	186	126.4 Å²	126.4	92%	0.916	77%	0.768	S	S	*	*			trans	-106.4	136.4	-173.1	-54.7	171.9	94.7	0	0	112.5
1451	A	29.6	Very low	28	Very low	90 Å²	90	125 Å²	125	74%	0.744	76%	0.759	S	S	*	*			trans	-172.2	107	160.8	0	0	0	0	0	106
1452	S	26.3	Very low	28.1	Very low	97 Å²	97	129.6 Å²	129.6	68%	0.678	76%	0.761	S	S	*	*				80	105.6	75.9	71.2	0	0	0	0	114
1453	D	27.1	Very low	27.9	Very low	151 Å²	151	135.9 Å²	135.9	81%	0.807	76%	0.761	S	S	*	*			trans	78.4	150	142.8	-49.8	-33.9	0	0	0	122.8
1454	E	27.5	Very low	27.8	Very low	183 Å²	183	143.4 Å²	143.4	86%	0.855	77%	0.769	S	S	*	*			trans	62.2	89.4	158.1	-70.1	176.8	-176.2	0	0	121.5
1455	D	28.6	Very low	27.6	Very low	151 Å²	151	141.9 Å²	141.9	81%	0.807	77%	0.773	S	S	*	*				67.9	154.7	112.7	-94.4	-24.7	0	0	0	124.6
1456	L	27.1	Very low	27.6	Very low	137 Å²	137	140 Å²	140	72%	0.717	77%	0.771	S	S	*	*			trans	73.3	119.5	160.3	-109.5	73.2	0	0	0	120.8
1457	N	28.5	Very low	27.6	Very low	124 Å²	124	142.9 Å²	142.9	66%	0.663	78%	0.779	S	S	*	*			trans	56.3	127.8	136.3	-76.1	-25.9	0	0	0	119.7
1458	Q	29.1	Very low	27.8	Very low	141 Å²	141	144.5 Å²	144.5	66%	0.659	78%	0.78	S	S	*	*			cis	-167.7	150.1	28.4	-112.2	153.9	34.4	0	0	112.2
1459	Q	28.1	Very low	28.1	Very low	162 Å²	162	148.6 Å²	148.6	76%	0.757	79%	0.785	S	S	*	*			trans	37.2	125.7	140.1	-54.4	170.8	10.5	0	0	118.9
1460	T	28.7	Very low	28.5	Very low	120 Å²	120	148.4 Å²	148.4	74%	0.736	78%	0.78	S	S	*	*				-171.6	135.9	72.3	28.3	0	0	0	0	114.2
1461	V	30.3	Very low	28.9	Very low	119 Å²	119	148.6 Å²	148.6	72%	0.721	77%	0.77	S	S	*	*				51.6	134	126.9	-179	0	0	0	0	120
1462	Q	29.4	Very low	29	Very low	168 Å²	168	150 Å²	150	79%	0.785	76%	0.764	S	S	*	*			cis	177.5	154.1	-15.6	-106.7	170.1	-6.9	0	0	105.9
1463	R	26.3	Very low	29.4	Very low	245 Å²	245	151.8 Å²	151.8	93%	0.925	76%	0.762	S	S	*	*			trans	166.4	84.7	138.1	-93.8	172.6	-172.8	-161	4.2	114.4
1464	R	27.5	Very low	29.8	Very low	250 Å²	250	150.1 Å²	150.1	94%	0.943	75%	0.752	S	S	*	*			trans	-159.6	144.1	148.8	-90.8	176.1	-166.4	-179.2	4	103.5
1465	G	28.4	Very low	30	Very low	76 Å²	76	148.6 Å²	148.6	78%	0.784	75%	0.745	S	S	*	*			cis	94.6	98.3	22.3	0	0	0	0	0	109.1
1466	G	26.7	Very low	30.3	Very low	70 Å²	70	148.5 Å²	148.5	72%	0.722	74%	0.74	S	S	*	*			cis	-172	52.4	3.8	0	0	0	0	0	113.8
1467	D	28.1	Very low	30.6	Very low	157 Å²	157	148.3 Å²	148.3	84%	0.84	74%	0.739	S	S	*	*			trans	-123.7	177.9	-177.9	-60.5	-81.7	0	0	0	110.9
1468	D	29.8	Very low	31	Very low	126 Å²	126	151 Å²	151	67%	0.674	75%	0.745	S	S	*	*			trans	71.5	99.3	-176.9	-72.9	-34.4	0	0	0	117.9
1469	F	31.5	Very low	31.4	Very low	191 Å²	191	150.9 Å²	150.9	84%	0.838	75%	0.749	S	S	*	*			trans	-133	-6	157.7	-131	-90.2	0	0	0	115
1470	E	34.1	Very low	31.8	Very low	173 Å²	173	153.7 Å²	153.7	81%	0.808	75%	0.753	S	S	*	*	S	Bend	trans	-91.5	-11.5	-177.6	-68.8	-159	123.8	0	0	115.1
1471	R	33.4	Very low	32	Very low	189 Å²	189	157.7 Å²	157.7	71%	0.713	76%	0.763	S	S	*	*	S	Bend	trans	-87.7	-26.7	-174.9	-82.5	-177.6	162.7	-173.9	-6.1	116.1	Q1473	R1471-Q1473 PolarHBondContact O-N 3.27Å
1472	I	33.5	Very low	32	Very low	119 Å²	119	156.2 Å²	156.2	61%	0.61	76%	0.758	S	S	*	*	H	α-helix	trans	-81.1	-17.5	-168	-64.9	176.4	0	0	0	113.7
1473	Q	34.2	Very low	32	Very low	136 Å²	136	156 Å²	156	64%	0.636	76%	0.762	S	S	*	*	H	α-helix	trans	-83.9	-16.9	177	-72.8	-175.9	14	0	0	114.3	R1471	R1471-Q1473 PolarHBondContact O-N 3.27Å
1474	L	34.3	Very low	32.2	Very low	116 Å²	116	153 Å²	153	61%	0.607	79%	0.79	S	S	*	*	H	α-helix	trans	-84.7	-34.4	-177.9	-74.9	165.9	0	0	0	113	L1477	L1474-L1477 PolarHBondContact O-N 3.18Å
1475	E	32.6	Very low	32.4	Very low	151 Å²	151	148.2 Å²	148.2	71%	0.706	78%	0.783	S	S	*	*	H	α-helix	trans	-73.8	-27.2	177.5	-65.5	-174.7	138.9	0	0	113.1
1476	Q	35.1	Very low	32.6	Very low	148 Å²	148	152 Å²	152	69%	0.692	78%	0.783	S	S	*	*	H	α-helix	trans	-80.5	-14.7	176.6	-65.9	-165.8	-2.5	0	0	114.1
1477	L	33.4	Very low	32.9	Very low	134 Å²	134	156.6 Å²	156.6	70%	0.702	79%	0.786	S	S	*	*	H	α-helix	trans	-85.9	-21.2	175.1	-82.1	167.9	0	0	0	113.4	L1474	L1474-L1477 PolarHBondContact O-N 3.18Å
1478	F	36.3	Very low	33.2	Very low	181 Å²	181	156.5 Å²	156.5	79%	0.794	78%	0.783	S	S	*	*	H	α-helix	trans	-81.9	-18.1	-180	-101.2	-86.6	0	0	0	114.8
1479	N	38.5	Very low	33.4	Very low	138 Å²	138	158.4 Å²	158.4	74%	0.738	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	30.6	-174.4	-80.5	-29.3	0	0	0	114.1
1480	R	34.8	Very low	33.6	Very low	221 Å²	221	156.3 Å²	156.3	83%	0.834	79%	0.786	S	S	*	*			trans	-139.9	35	177.7	-83.2	-167.6	170.6	179.7	-2.2	114.6
1481	Q	32.8	Very low	33.5	Very low	203 Å²	203	155.1 Å²	155.1	95%	0.949	79%	0.785	S	S	*	*	S	Bend	trans	-111.4	19.3	166.8	-90.2	-169.6	-30.5	0	0	113.3
1482	S	30.9	Very low	33.5	Very low	89 Å²	89	152.5 Å²	152.5	62%	0.622	79%	0.79	S	S	*	*	S	Bend	trans	-122.5	133.1	166.5	55	0	0	0	0	109.1
1483	D	30.8	Very low	33.6	Very low	162 Å²	162	155.3 Å²	155.3	87%	0.866	81%	0.805	S	S	*	*			trans	70.6	111	179	-53	-25	0	0	0	117.1
1484	A	28.9	Very low	33.5	Very low	184 Å²	184	157 Å²	157	100%	1.521	82%	0.821	S	S	*	*			trans	75.8	0	175.9	0	0	0	0	0	117.6

Retrieved 1,484 of 1,484 residues in 988.3 ms (Link to these results)

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