A0A5K4F300_SCHMA Loading...

Origin recognition complex subunit 3

AlphaFold DB , UniProt , Accession A0A5K4F300, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 912 aa.

						>A0A5K4F300_SCHMA|A0A5K4F300
MTEFSVYHGDQKGLQPPSNHRYDQFLSVWKSIISRVETQLRFLTSSVFTEVFNFIENSHTSWLSLHNLEAKSIVNLEQIPTALLLAGVNTPDHSVIYGHLRNLILESGGHVAVVSPGANTTSVRSLVALVVQQLLDDSCHQSKGFRNDEGSDENLRVPSQDLKESKYTLVQNFTPATRSSYLALIEWYYSGTKKYCGPSAPEWNPEFKTPAPPTTPRPRSQRSTSQPRSQKSHQPCPMSSASPRLSTPTRRNQRFSLRSNEVSNTLKSELADSVSASPGSGVLSDLKQSSASLRPLVIILTEIESIPVQVLCDFIELTSLYVSGQIRGRSCSLPINFVFGLSTIPEIGFEPRFSASILSRLTIRRFSVPSPSAFLNVVLKEIIQFPGLHPTYSVLNYLMDGIFLCLDYSVKNFLQRLKFCMLEHYLKTPHPELLQLPELAHKYLTSINSRDLAQIVTLDYPSLANCVLDNTTSTLTVSHPTLPIIDNSSPQTAQQTTHTSSSSSSVNSRLVNKIVEHLENHLKLQYLIPYVLNWLLIIMTPVSARPLGKNIGDLYRLWLKNGLVNAEEFNLTINLLGGVPKEHLLNSVQDAYDFLLKESASLIQSQHPTSLWWSPSTLSEGRKCLNSLADSTLSWYTKLSMACQEASMNKQLSQCHQEQSTDNDTLTTTAEISVNNQDTVPAKPVEFNTKRKISLRNLRQHLQEYATSSPNRPLSAITSTIHKTQWDITRKEFLSWIQLKLNELIPSFHQLPLHEVFYGPSMIENGIHSSSSSSSFTYDDSSIHSQLALSIRRRLNPPFQRCLHQALVNPGVYLQITDLKLSNSSSISSKLFDLCILYKLLIETNKMVNLYDWLMAFASILGEAVDSENPPSQETQCRFLQGLAELQYLGCIKSTRRKVDHVIRLTWISGLL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.4	Very low	30.7	Very low	245 Å²	245	163 Å²	163	100%	1.207	84%	0.844	S	S	*	*				0	91	0	-82.9	172.4	170.1	0	0	107.6
2	T	28.4	Very low	30.7	Very low	126 Å²	126	167.4 Å²	167.4	77%	0.773	85%	0.852	S	S	*	*			trans	-150.9	108.8	160.8	18.3	0	0	0	0	102.1	F4	T2-F4 PolarHBondContact O-N 3.03Å
3	E	29.2	Very low	30.5	Very low	192 Å²	192	160.5 Å²	160.5	90%	0.897	85%	0.848	S	S	*	*			trans	-59	114.9	176.4	-71	170.9	145.9	0	0	108.6	S5	E3-S5 VanDerWaalsContact C-N 3.25Å; E3-S5 PolarHBondContact O-N 3.47Å
4	F	34.3	Very low	30.6	Very low	178 Å²	178	160.9 Å²	160.9	78%	0.781	85%	0.849	S	S	*	*			trans	-82.7	83.2	154.9	-90.2	-86.5	0	0	0	106.8	T2 V6	T2-F4 PolarHBondContact O-N 3.03Å; F4-V6 HydrophobicContact CD1-CG2 4.38Å; F4-V6 PolarHBondContact O-N 3.32Å
5	S	28.7	Very low	30.5	Very low	109 Å²	109	162 Å²	162	76%	0.762	85%	0.848	S	S	*	*			trans	-77.2	99	157.1	179.4	0	0	0	0	107	E3	E3-S5 VanDerWaalsContact C-N 3.25Å; E3-S5 PolarHBondContact O-N 3.47Å
6	V	34.6	Very low	30.7	Very low	108 Å²	108	158.9 Å²	158.9	66%	0.655	84%	0.84	S	S	*	*			trans	-104.1	108	162.7	176.7	0	0	0	0	105.8	F4	F4-V6 HydrophobicContact CD1-CG2 4.38Å; F4-V6 PolarHBondContact O-N 3.32Å
7	Y	30.3	Very low	31.2	Very low	222 Å²	222	155.6 Å²	155.6	87%	0.871	83%	0.83	S	S	*	*			trans	31.8	91.5	157.2	-81.6	-93.3	0	0	0	116.1
8	H	31.1	Very low	32.3	Very low	192 Å²	192	152.8 Å²	152.8	89%	0.889	83%	0.825	S	S	*	*			trans	-92.6	97.3	150.1	-87.9	4.8	0	0	0	108.4
9	G	31.5	Very low	34.3	Very low	66 Å²	66	149.8 Å²	149.8	68%	0.68	81%	0.809	S	S	*	*			trans	-70.6	132.8	152.8	0	0	0	0	0	108.5	Q11	G9-Q11 PolarHBondContact O-N 3.46Å; G9-Q11 VanDerWaalsContact O-N 3.11Å
10	D	28.7	Very low	36.7	Very low	166 Å²	166	147.4 Å²	147.4	89%	0.888	79%	0.792	S	S	*	*			trans	-46.3	107.1	-176.6	-72.8	-49.8	0	0	0	114.2
11	Q	32.8	Very low	39.1	Very low	189 Å²	189	144.8 Å²	144.8	88%	0.883	77%	0.771	S	S	*	*			trans	-137.8	111.3	149.8	-72.1	-164.5	2.7	0	0	109.9	G9 G13	G9-Q11 PolarHBondContact O-N 3.46Å; G9-Q11 VanDerWaalsContact O-N 3.11Å; Q11-G13 PolarHBondContact O-N 3.3Å
12	K	30.9	Very low	41.9	Very low	216 Å²	216	138 Å²	138	94%	0.939	73%	0.732	S	S	*	*			trans	-55.1	126.4	170.9	-66.9	172.6	175.4	175.9	0	110.2
13	G	28	Very low	44.8	Very low	77 Å²	77	136.1 Å²	136.1	79%	0.794	72%	0.717	S	S	*	*			trans	96.1	30.1	144.2	0	0	0	0	0	120.7	Q11	Q11-G13 PolarHBondContact O-N 3.3Å
14	L	31.1	Very low	47.5	Very low	167 Å²	167	127.7 Å²	127.7	87%	0.874	68%	0.678	S	S	*	*			trans	-111.5	127.2	167.8	-112.3	75.6	0	0	0	111.3
15	Q	29.9	Very low	50.2	Low	177 Å²	177	119.3 Å²	119.3	83%	0.827	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-51.2	144.1	167.9	-73.9	-158.7	-7.7	0	0	110.3
16	P	33	Very low	53.2	Low	112 Å²	112	115.9 Å²	115.9	73%	0.727	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-59.1	131.3	176.3	26.1	-31.9	0	0	0	107.7	S18	P16-S18 PolarHBondContact O-N 2.74Å
17	P	39.3	Very low	55.7	Low	103 Å²	103	114.7 Å²	114.7	67%	0.669	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-54.5	123.4	175.2	23.3	-31.7	0	0	0	107.2	N19	P17-N19 VanDerWaalsContact C-N 3.35Å; P17-N19 PolarHBondContact O-N 3.01Å
18	S	51	Low	58.5	Low	105 Å²	105	105.3 Å²	105.3	73%	0.734	58%	0.576	S	S	*	*			trans	-52.6	101.1	174.8	51.1	0	0	0	0	107.8	P16 H20	P16-S18 PolarHBondContact O-N 2.74Å; S18-H20 PolarHBondContact O-N 3.17Å
19	N	70.3	Confident	61.5	Low	96 Å²	96	97 Å²	97	51%	0.513	54%	0.538	S	S	.	.			trans	-74.8	78.8	-174.6	-94	-28.3	0	0	0	108.1	P17 R21 Y22 D23	P17-N19 VanDerWaalsContact C-N 3.35Å; P17-N19 PolarHBondContact O-N 3.01Å; N19-R21 PolarHBondContact O-N 3.4Å; N19-Y22 WeakPolarHBondContact O-CA 3.46Å; N19-Y22 WeakPolarHBondContact O-CB 3.44Å; N19-Y22 PolarHBondContact O-N 2.99Å; N19-D23 PolarHBondContact O-N 3.11Å; N19-D23 VanDerWaalsContact O-N 3.15Å
20	H	82.5	Confident	64.4	Low	101 Å²	101	100.7 Å²	100.7	47%	0.468	54%	0.535	S	S	.	.	H	α-helix	trans	-47.8	-36.4	179.4	-173.9	60.9	0	0	0	112	S18 Y22 D23 Q24 E432	S18-H20 PolarHBondContact O-N 3.17Å; H20-Y22 PolarHBondContact O-N 3.46Å; H20-D23 PolarHBondContact O-N 3.38Å; H20-Q24 WeakPolarHBondContact O-CB 3.26Å; H20-Q24 PolarHBondContact O-N 3.32Å; H20-E432 IonicContact CD2-OE1 2.69Å
21	R	86.4	Confident	67.2	Low	94 Å²	94	95 Å²	95	36%	0.355	51%	0.508	S	S	.	.	H	α-helix	trans	-58.6	-43.5	174.2	-51.3	-168.6	176.7	-175.8	-1.6	113.4	N19 F25 L426 P431	N19-R21 PolarHBondContact O-N 3.4Å; R21-F25 PolarHBondContact O-N 2.91Å; R21-L426 PolarHBondContact NH1-O 3.49Å; R21-P431 HydrophobicContact CB-CG 4.09Å; R21-P431 HydrophobicContact CG-CG 3.66Å
22	Y	89.1	Confident	70	Confident	101 Å²	101	86.4 Å²	86.4	40%	0.396	47%	0.468	S	S	.	.	H	α-helix	trans	-71.4	-39.6	179.6	179.3	-108.1	0	0	0	111.5	N19 H20 F25 L26 L422	N19-Y22 WeakPolarHBondContact O-CA 3.46Å; N19-Y22 WeakPolarHBondContact O-CB 3.44Å; N19-Y22 PolarHBondContact O-N 2.99Å; H20-Y22 PolarHBondContact O-N 3.46Å; Y22-F25 HydrophobicContact CD2-CD1 4.07Å; Y22-F25 HydrophobicContact CE2-CD1 4.13Å; Y22-F25 HydrophobicContact CE2-CE1 4.3Å; Y22-F25 WeakPolarHBondContact O-CB 3.32Å; Y22-F25 PolarHBondContact O-N 3.37Å; Y22-L26 HydrophobicContact CD1-CD1 3.77Å; Y22-L26 HydrophobicContact CD1-CG 4.21Å; Y22-L26 HydrophobicContact CE1-CD1 3.19Å; Y22-L26 HydrophobicContact CE1-CD2 4.45Å; Y22-L26 HydrophobicContact CE1-CG 3.8Å; Y22-L26 HydrophobicContact CE2-CD1 4.39Å; Y22-L26 HydrophobicContact CE2-CD2 4.31Å; Y22-L26 HydrophobicContact CE2-CG 4.11Å; Y22-L26 WeakPolarHBondContact O-CB 3.44Å; Y22-L26 WeakPolarHBondContact O-CG 3.43Å; Y22-L26 PolarHBondContact O-N 3.05Å; Y22-L422 HydrophobicContact CD2-CD1 3.82Å; Y22-L422 HydrophobicContact CE2-CD1 4.09Å
23	D	88.6	Confident	72.9	Confident	87 Å²	87	77.6 Å²	77.6	47%	0.465	43%	0.431	S	S	.	.	H	α-helix	trans	-65.2	-40.7	176.7	-65.9	-31.1	0	0	0	111.4	N19 H20 L26 S27	N19-D23 PolarHBondContact O-N 3.11Å; N19-D23 VanDerWaalsContact O-N 3.15Å; H20-D23 PolarHBondContact O-N 3.38Å; D23-L26 PolarHBondContact O-N 3.31Å; D23-S27 WeakPolarHBondContact O-CB 3.5Å; D23-S27 PolarHBondContact O-N 3.49Å
24	Q	85.7	Confident	75.9	Confident	16 Å²	16	77.3 Å²	77.3	8%	0.075	42%	0.417	C	S	.	.	H	α-helix	trans	-60.6	-48.5	173.1	-172.1	-175.8	-9.4	0	0	111.3	H20 L26 S27 V28 Y425 P431 Q435	H20-Q24 WeakPolarHBondContact O-CB 3.26Å; H20-Q24 PolarHBondContact O-N 3.32Å; Q24-L26 PolarHBondContact O-N 3.49Å; Q24-S27 PolarHBondContact O-N 3.23Å; Q24-V28 WeakPolarHBondContact O-CG2 3.36Å; Q24-V28 PolarHBondContact O-N 3.39Å; Q24-V28 VanDerWaalsContact O-N 3.07Å; Q24-Y425 HydrophobicContact CB-CE1 4.47Å; Q24-Y425 HydrophobicContact CG-CE1 3.91Å; Q24-P431 PolarHBondContact NE2-O 3.15Å; Q24-P431 PolarHBondContact OE1-O 3.25Å; Q24-Q435 HydrophobicContact CG-CG 4.46Å
25	F	90.5	Very high	78.7	Confident	1 Å²	1	71.3 Å²	71.3	0%	0.004	38%	0.382	C	S	.	.	H	α-helix	trans	-56.5	-47.3	174.4	158.5	-101.6	0	0	0	112.1	R21 Y22 S27 V28 W29 K418 M421 L422 Y425	R21-F25 PolarHBondContact O-N 2.91Å; Y22-F25 HydrophobicContact CD2-CD1 4.07Å; Y22-F25 HydrophobicContact CE2-CD1 4.13Å; Y22-F25 HydrophobicContact CE2-CE1 4.3Å; Y22-F25 WeakPolarHBondContact O-CB 3.32Å; Y22-F25 PolarHBondContact O-N 3.37Å; F25-S27 VanDerWaalsContact C-N 3.35Å; F25-S27 PolarHBondContact O-N 3.44Å; F25-V28 PolarHBondContact O-N 2.95Å; F25-W29 HydrophobicContact CE2-CB 4.09Å; F25-W29 HydrophobicContact CE2-CG 4.46Å; F25-W29 HydrophobicContact CZ-CB 4.18Å; F25-W29 HydrophobicContact CZ-CG 4.29Å; F25-W29 VanDerWaalsContact O-CB 3.3Å; F25-W29 WeakPolarHBondContact O-CB 3.39Å; F25-W29 PolarHBondContact O-N 3.2Å; F25-K418 HydrophobicContact CZ-CG 3.79Å; F25-M421 HydrophobicContact CD2-CB 4.32Å; F25-M421 HydrophobicContact CE2-CB 3.9Å; F25-L422 HydrophobicContact CD1-CD1 3.65Å; F25-L422 HydrophobicContact CD2-CB 4.37Å; F25-L422 HydrophobicContact CE1-CB 4.07Å; F25-L422 HydrophobicContact CE1-CD1 3.75Å; F25-L422 HydrophobicContact CE1-CG 4.37Å; F25-L422 HydrophobicContact CE2-CB 3.91Å; F25-L422 HydrophobicContact CG-CD1 4.13Å; F25-L422 HydrophobicContact CZ-CB 3.74Å; F25-L422 HydrophobicContact CZ-CD1 4.31Å; F25-Y425 HydrophobicContact CB-CD1 4.07Å; F25-Y425 HydrophobicContact CB-CD2 4.14Å; F25-Y425 HydrophobicContact CB-CG 3.79Å; F25-Y425 HydrophobicContact CD2-CD2 4.04Å; F25-Y425 HydrophobicContact CD2-CG 4.47Å
26	L	91.5	Very high	81.6	Confident	38 Å²	38	62.9 Å²	62.9	20%	0.199	34%	0.343	C	S	.	.	H	α-helix	trans	-63.3	-41.3	-178.2	-81.9	-177.2	0	0	0	112.1	Y22 D23 Q24 K30	Y22-L26 HydrophobicContact CD1-CD1 3.77Å; Y22-L26 HydrophobicContact CD1-CG 4.21Å; Y22-L26 HydrophobicContact CE1-CD1 3.19Å; Y22-L26 HydrophobicContact CE1-CD2 4.45Å; Y22-L26 HydrophobicContact CE1-CG 3.8Å; Y22-L26 HydrophobicContact CE2-CD1 4.39Å; Y22-L26 HydrophobicContact CE2-CD2 4.31Å; Y22-L26 HydrophobicContact CE2-CG 4.11Å; Y22-L26 WeakPolarHBondContact O-CB 3.44Å; Y22-L26 WeakPolarHBondContact O-CG 3.43Å; Y22-L26 PolarHBondContact O-N 3.05Å; D23-L26 PolarHBondContact O-N 3.31Å; Q24-L26 PolarHBondContact O-N 3.49Å; L26-K30 WeakPolarHBondContact O-CB 3.31Å; L26-K30 VanDerWaalsContact O-CG 3.27Å; L26-K30 WeakPolarHBondContact O-CG 3.37Å; L26-K30 PolarHBondContact O-N 3.47Å
27	S	88.5	Confident	84.3	Confident	83 Å²	83	61.8 Å²	61.8	58%	0.58	33%	0.328	S	S	*	.	H	α-helix	trans	-60.5	-49.9	176.6	-176.6	0	0	0	0	111	D23 Q24 F25 K30 S31	D23-S27 WeakPolarHBondContact O-CB 3.5Å; D23-S27 PolarHBondContact O-N 3.49Å; Q24-S27 PolarHBondContact O-N 3.23Å; F25-S27 VanDerWaalsContact C-N 3.35Å; F25-S27 PolarHBondContact O-N 3.44Å; S27-K30 PolarHBondContact O-N 2.98Å; S27-S31 PolarHBondContact O-N 2.63Å
28	V	89.2	Confident	86.7	Confident	24 Å²	24	59.4 Å²	59.4	15%	0.145	31%	0.312	C	S	.	.	H	α-helix	trans	-60.8	-48.6	177.4	165.7	0	0	0	0	111.4	Q24 F25 K30 S31 I32 F385 M421	Q24-V28 WeakPolarHBondContact O-CG2 3.36Å; Q24-V28 PolarHBondContact O-N 3.39Å; Q24-V28 VanDerWaalsContact O-N 3.07Å; F25-V28 PolarHBondContact O-N 2.95Å; V28-K30 PolarHBondContact O-N 3.21Å; V28-S31 WeakPolarHBondContact O-CB 3.38Å; V28-S31 PolarHBondContact O-N 3Å; V28-I32 HydrophobicContact CG1-CD1 3.9Å; V28-I32 WeakPolarHBondContact O-CG1 3.38Å; V28-I32 PolarHBondContact O-N 2.89Å; V28-I32 VanDerWaalsContact O-N 3.08Å; V28-F385 HydrophobicContact CB-CZ 4.43Å; V28-F385 HydrophobicContact CG1-CE1 3.51Å; V28-F385 HydrophobicContact CG1-CZ 3.62Å; V28-M421 HydrophobicContact CG1-CE 4.14Å
29	W	92.3	Very high	88.5	Confident	19 Å²	19	56.5 Å²	56.5	7%	0.072	29%	0.287	C	S	.	.	H	α-helix	trans	-61.8	-41	-179.2	-178.1	-96.3	0	0	0	112.5	F25 S31 I32 I33 L414 L417 K418 M421	F25-W29 HydrophobicContact CE2-CB 4.09Å; F25-W29 HydrophobicContact CE2-CG 4.46Å; F25-W29 HydrophobicContact CZ-CB 4.18Å; F25-W29 HydrophobicContact CZ-CG 4.29Å; F25-W29 VanDerWaalsContact O-CB 3.3Å; F25-W29 WeakPolarHBondContact O-CB 3.39Å; F25-W29 PolarHBondContact O-N 3.2Å; W29-S31 VanDerWaalsContact C-N 3.31Å; W29-S31 PolarHBondContact O-N 3.2Å; W29-I32 PolarHBondContact O-N 3.27Å; W29-I33 HydrophobicContact CZ2-CD1 4.25Å; W29-I33 WeakPolarHBondContact O-CB 3.47Å; W29-I33 VanDerWaalsContact O-CG2 3.29Å; W29-I33 WeakPolarHBondContact O-CG2 3.34Å; W29-I33 PolarHBondContact O-N 2.91Å; W29-L414 WeakPolarHBondContact CH2-O 3.42Å; W29-L417 HydrophobicContact CZ3-CD2 4.44Å; W29-L417 HydrophobicContact CZ3-CG 4.35Å; W29-K418 HydrophobicContact CD2-CB 4.15Å; W29-K418 HydrophobicContact CD2-CD 4.28Å; W29-K418 HydrophobicContact CD2-CG 3.75Å; W29-K418 HydrophobicContact CE3-CB 4.17Å; W29-K418 HydrophobicContact CE3-CG 4.13Å; W29-K418 HydrophobicContact CG-CG 4.29Å; W29-K418 HydrophobicContact CH2-CB 3.51Å; W29-K418 HydrophobicContact CH2-CG 4.2Å; W29-K418 HydrophobicContact CZ2-CB 3.47Å; W29-K418 VanDerWaalsContact CZ2-CB 3.47Å; W29-K418 HydrophobicContact CZ2-CD 4.06Å; W29-K418 HydrophobicContact CZ2-CG 3.82Å; W29-K418 VanDerWaalsContact CZ3-CA 3.49Å; W29-K418 HydrophobicContact CZ3-CB 3.86Å; W29-K418 HydrophobicContact CZ3-CG 4.34Å; W29-M421 HydrophobicContact CE3-SD 3.64Å; W29-M421 HydrophobicContact CZ3-SD 3.6Å
30	K	92.3	Very high	89.4	Confident	143 Å²	143	53.3 Å²	53.3	62%	0.622	27%	0.27	S	S	*	.	H	α-helix	trans	-61.7	-39	176.4	-78.4	176.7	-179.6	179.9	0	112	L26 S27 V28 I33 S34	L26-K30 WeakPolarHBondContact O-CB 3.31Å; L26-K30 VanDerWaalsContact O-CG 3.27Å; L26-K30 WeakPolarHBondContact O-CG 3.37Å; L26-K30 PolarHBondContact O-N 3.47Å; S27-K30 PolarHBondContact O-N 2.98Å; V28-K30 PolarHBondContact O-N 3.21Å; K30-I33 WeakPolarHBondContact O-CG2 3.48Å; K30-S34 VanDerWaalsContact O-CB 3.29Å; K30-S34 WeakPolarHBondContact O-CB 3.28Å; K30-S34 PolarHBondContact O-N 2.87Å; K30-S34 VanDerWaalsContact O-N 3.14Å
31	S	89	Confident	89.6	Confident	47 Å²	47	55.3 Å²	55.3	33%	0.329	27%	0.273	S	S	.	.	H	α-helix	trans	-64.6	-49.1	176.6	-171.1	0	0	0	0	111.7	S27 V28 W29 R35 W612	S27-S31 PolarHBondContact O-N 2.63Å; V28-S31 WeakPolarHBondContact O-CB 3.38Å; V28-S31 PolarHBondContact O-N 3Å; W29-S31 VanDerWaalsContact C-N 3.31Å; W29-S31 PolarHBondContact O-N 3.2Å; S31-R35 PolarHBondContact O-N 3.36Å; S31-W612 PolarHBondContact OG-NE1 3.32Å
32	I	90.3	Very high	89.7	Confident	7 Å²	7	57.2 Å²	57.2	4%	0.036	28%	0.284	C	S	.	.	H	α-helix	trans	-61.4	-50.4	178.5	-63.7	167.3	0	0	0	111	V28 W29 S34 R35 V36 F385 M421	V28-I32 HydrophobicContact CG1-CD1 3.9Å; V28-I32 WeakPolarHBondContact O-CG1 3.38Å; V28-I32 PolarHBondContact O-N 2.89Å; V28-I32 VanDerWaalsContact O-N 3.08Å; W29-I32 PolarHBondContact O-N 3.27Å; I32-S34 PolarHBondContact O-N 3.12Å; I32-R35 WeakPolarHBondContact O-CB 3.48Å; I32-R35 PolarHBondContact O-N 3.33Å; I32-V36 HydrophobicContact CG2-CG2 4.11Å; I32-V36 WeakPolarHBondContact O-CG2 3.35Å; I32-V36 PolarHBondContact O-N 3.07Å; I32-F385 HydrophobicContact CD1-CD1 3.59Å; I32-F385 HydrophobicContact CD1-CD2 4.17Å; I32-F385 HydrophobicContact CD1-CE1 3.7Å; I32-F385 HydrophobicContact CD1-CE2 4.27Å; I32-F385 HydrophobicContact CD1-CG 3.84Å; I32-F385 HydrophobicContact CD1-CZ 4.07Å; I32-F385 HydrophobicContact CG1-CB 4.32Å; I32-F385 HydrophobicContact CG1-CD1 3.81Å; I32-F385 HydrophobicContact CG1-CD2 3.41Å; I32-F385 VanDerWaalsContact CG1-CD2 3.41Å; I32-F385 HydrophobicContact CG1-CE1 3.94Å; I32-F385 HydrophobicContact CG1-CE2 3.57Å; I32-F385 HydrophobicContact CG1-CG 3.55Å; I32-F385 HydrophobicContact CG1-CZ 3.85Å; I32-M421 HydrophobicContact CD1-CE 3.67Å; I32-M421 HydrophobicContact CD1-SD 4.22Å
33	I	92.3	Very high	89.6	Confident	31 Å²	31	54.7 Å²	54.7	16%	0.159	28%	0.277	C	S	.	.	H	α-helix	trans	-67.6	-38.5	-172.9	-163.5	62.3	0	0	0	112.1	W29 K30 R35 V36 E37 L414	W29-I33 HydrophobicContact CZ2-CD1 4.25Å; W29-I33 WeakPolarHBondContact O-CB 3.47Å; W29-I33 VanDerWaalsContact O-CG2 3.29Å; W29-I33 WeakPolarHBondContact O-CG2 3.34Å; W29-I33 PolarHBondContact O-N 2.91Å; K30-I33 WeakPolarHBondContact O-CG2 3.48Å; I33-R35 PolarHBondContact O-N 3.07Å; I33-V36 PolarHBondContact O-N 3.18Å; I33-E37 HydrophobicContact CD1-CG 4.41Å; I33-E37 HydrophobicContact CG1-CG 4.21Å; I33-E37 WeakPolarHBondContact O-CB 3.37Å; I33-E37 VanDerWaalsContact O-CG 3.32Å; I33-E37 WeakPolarHBondContact O-CG 3.42Å; I33-E37 PolarHBondContact O-N 2.82Å; I33-L414 HydrophobicContact CD1-CD1 3.94Å; I33-L414 HydrophobicContact CD1-CD2 4.37Å
34	S	90.9	Very high	89.5	Confident	72 Å²	72	51.1 Å²	51.1	50%	0.503	26%	0.258	S	S	.	.	H	α-helix	trans	-58.3	-40.8	176	177.8	0	0	0	0	111	K30 I32 T38	K30-S34 VanDerWaalsContact O-CB 3.29Å; K30-S34 WeakPolarHBondContact O-CB 3.28Å; K30-S34 PolarHBondContact O-N 2.87Å; K30-S34 VanDerWaalsContact O-N 3.14Å; I32-S34 PolarHBondContact O-N 3.12Å; S34-T38 WeakPolarHBondContact O-CB 3.43Å; S34-T38 PolarHBondContact O-N 3.2Å; S34-T38 VanDerWaalsContact O-N 3.15Å; S34-T38 PolarHBondContact O-OG1 3.07Å
35	R	89.2	Confident	89.6	Confident	40 Å²	40	52.2 Å²	52.2	15%	0.151	27%	0.268	C	S	.	.	H	α-helix	trans	-69.9	-47.9	177.6	-178.1	64.4	-177.7	164.9	-0.8	112.3	S31 I32 I33 E37 T38 Q39 E381 P608 W612	S31-R35 PolarHBondContact O-N 3.36Å; I32-R35 WeakPolarHBondContact O-CB 3.48Å; I32-R35 PolarHBondContact O-N 3.33Å; I33-R35 PolarHBondContact O-N 3.07Å; R35-E37 PolarHBondContact O-N 3.35Å; R35-T38 WeakPolarHBondContact O-CB 3.23Å; R35-T38 PolarHBondContact O-N 3.1Å; R35-Q39 VanDerWaalsContact NH1-NE2 3.16Å; R35-Q39 PolarHBondContact O-N 2.9Å; R35-E381 HydrophobicContact CG-CG 4.44Å; R35-E381 WeakPolarHBondContact CG-OE2 3.31Å; R35-E381 IonicContact CZ-OE2 2.73Å; R35-E381 IonicContact NE-OE2 3.26Å; R35-E381 PolarHBondContact NE-OE2 2.96Å; R35-E381 IonicContact NH2-OE2 2.92Å; R35-P608 VanDerWaalsContact NH1-CG 3.32Å; R35-W612 HydrophobicContact CB-CH2 3.98Å; R35-W612 HydrophobicContact CB-CZ2 3.66Å; R35-W612 HydrophobicContact CG-CH2 3.68Å; R35-W612 HydrophobicContact CG-CZ2 3.77Å
36	V	91.1	Very high	89.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-57.9	-49.6	177.6	168.6	0	0	0	0	110.7	I32 I33 T38 Q39 L40 V378 E381 L414	I32-V36 HydrophobicContact CG2-CG2 4.11Å; I32-V36 WeakPolarHBondContact O-CG2 3.35Å; I32-V36 PolarHBondContact O-N 3.07Å; I33-V36 PolarHBondContact O-N 3.18Å; V36-T38 VanDerWaalsContact C-N 3.27Å; V36-T38 PolarHBondContact O-N 3.42Å; V36-Q39 PolarHBondContact O-N 3.31Å; V36-L40 HydrophobicContact CG1-CD1 3.7Å; V36-L40 HydrophobicContact CG1-CG 4.16Å; V36-L40 VanDerWaalsContact O-CG 3.25Å; V36-L40 WeakPolarHBondContact O-CG 2.87Å; V36-L40 PolarHBondContact O-N 2.79Å; V36-V378 HydrophobicContact CG1-CG2 3.85Å; V36-E381 HydrophobicContact CG2-CB 3.95Å; V36-L414 HydrophobicContact CG1-CD1 4.16Å; V36-L414 HydrophobicContact CG1-CD2 4.22Å
37	E	90	Very high	89.4	Confident	90 Å²	90	54.3 Å²	54.3	42%	0.421	29%	0.285	S	S	.	.	H	α-helix	trans	-59.4	-38.9	178.2	-74.1	179.7	-179.3	0	0	112.2	I33 R35 L40 R41	I33-E37 HydrophobicContact CD1-CG 4.41Å; I33-E37 HydrophobicContact CG1-CG 4.21Å; I33-E37 WeakPolarHBondContact O-CB 3.37Å; I33-E37 VanDerWaalsContact O-CG 3.32Å; I33-E37 WeakPolarHBondContact O-CG 3.42Å; I33-E37 PolarHBondContact O-N 2.82Å; R35-E37 PolarHBondContact O-N 3.35Å; E37-L40 PolarHBondContact O-N 3.06Å; E37-R41 VanDerWaalsContact O-CG 3.29Å; E37-R41 WeakPolarHBondContact O-CG 3.47Å; E37-R41 PolarHBondContact O-N 3.27Å
38	T	89.4	Confident	89.5	Confident	52 Å²	52	50.4 Å²	50.4	32%	0.319	26%	0.258	S	S	.	.	H	α-helix	trans	-62.2	-47.2	175.9	-61.4	0	0	0	0	111.4	S34 R35 V36 R41 F42	S34-T38 WeakPolarHBondContact O-CB 3.43Å; S34-T38 PolarHBondContact O-N 3.2Å; S34-T38 VanDerWaalsContact O-N 3.15Å; S34-T38 PolarHBondContact O-OG1 3.07Å; R35-T38 WeakPolarHBondContact O-CB 3.23Å; R35-T38 PolarHBondContact O-N 3.1Å; V36-T38 VanDerWaalsContact C-N 3.27Å; V36-T38 PolarHBondContact O-N 3.42Å; T38-R41 PolarHBondContact O-N 3.38Å; T38-F42 HydrophobicContact CG2-CD2 3.97Å; T38-F42 HydrophobicContact CG2-CE2 3.5Å; T38-F42 VanDerWaalsContact CG2-CE2 3.5Å; T38-F42 HydrophobicContact CG2-CZ 4.44Å; T38-F42 WeakPolarHBondContact O-CD2 3.37Å; T38-F42 PolarHBondContact O-N 3.49Å; T38-F42 VanDerWaalsContact O-N 3.12Å
39	Q	89.1	Confident	89.6	Confident	45 Å²	45	52.1 Å²	52.1	21%	0.21	27%	0.268	C	S	.	.	H	α-helix	trans	-67.7	-36.7	178.4	-66.9	-56.5	-49.5	0	0	112.9	R35 V36 F42 L43 V377 E381	R35-Q39 VanDerWaalsContact NH1-NE2 3.16Å; R35-Q39 PolarHBondContact O-N 2.9Å; V36-Q39 PolarHBondContact O-N 3.31Å; Q39-F42 PolarHBondContact O-N 3.2Å; Q39-L43 PolarHBondContact O-N 3Å; Q39-V377 HydrophobicContact CB-CG1 3.6Å; Q39-E381 HydrophobicContact CB-CG 4.35Å; Q39-E381 HydrophobicContact CG-CG 3.9Å
40	L	89.5	Confident	89.6	Confident	29 Å²	29	56.5 Å²	56.5	15%	0.152	29%	0.29	C	S	.	.	H	α-helix	trans	-64	-40.3	174.3	-67.5	173.5	0	0	0	111.6	V36 E37 L43 T44 F374 V377 V378 V410	V36-L40 HydrophobicContact CG1-CD1 3.7Å; V36-L40 HydrophobicContact CG1-CG 4.16Å; V36-L40 VanDerWaalsContact O-CG 3.25Å; V36-L40 WeakPolarHBondContact O-CG 2.87Å; V36-L40 PolarHBondContact O-N 2.79Å; E37-L40 PolarHBondContact O-N 3.06Å; L40-L43 PolarHBondContact O-N 3.29Å; L40-T44 PolarHBondContact O-N 3.1Å; L40-T44 PolarHBondContact O-OG1 2.94Å; L40-F374 HydrophobicContact CD2-CB 4.15Å; L40-F374 HydrophobicContact CD2-CD1 3.72Å; L40-F374 HydrophobicContact CD2-CG 4.45Å; L40-V377 HydrophobicContact CD2-CG1 4.39Å; L40-V378 HydrophobicContact CD1-CG2 4.29Å; L40-V378 HydrophobicContact CD2-CG2 4.06Å; L40-V410 HydrophobicContact CD1-CG1 4.36Å
41	R	86.9	Confident	89.6	Confident	143 Å²	143	49.7 Å²	49.7	54%	0.54	26%	0.26	S	S	.	.	H	α-helix	trans	-61.1	-45.1	174.1	-74.1	176.1	-166.7	-164.6	6.7	111.6	E37 T38 L43 T44 S45	E37-R41 VanDerWaalsContact O-CG 3.29Å; E37-R41 WeakPolarHBondContact O-CG 3.47Å; E37-R41 PolarHBondContact O-N 3.27Å; T38-R41 PolarHBondContact O-N 3.38Å; R41-L43 VanDerWaalsContact C-N 3.3Å; R41-L43 PolarHBondContact O-N 3.48Å; R41-T44 PolarHBondContact O-N 3.29Å; R41-T44 VanDerWaalsContact O-N 3.17Å; R41-T44 PolarHBondContact O-OG1 3.47Å; R41-S45 WeakPolarHBondContact O-CB 3.3Å; R41-S45 PolarHBondContact O-N 3.35Å
42	F	88.3	Confident	89.8	Confident	133 Å²	133	49.4 Å²	49.4	58%	0.583	25%	0.253	S	S	*	.	H	α-helix	trans	-58.8	-41	176.1	-76.5	-57.9	0	0	0	112.4	T38 Q39 T44 S45	T38-F42 HydrophobicContact CG2-CD2 3.97Å; T38-F42 HydrophobicContact CG2-CE2 3.5Å; T38-F42 VanDerWaalsContact CG2-CE2 3.5Å; T38-F42 HydrophobicContact CG2-CZ 4.44Å; T38-F42 WeakPolarHBondContact O-CD2 3.37Å; T38-F42 PolarHBondContact O-N 3.49Å; T38-F42 VanDerWaalsContact O-N 3.12Å; Q39-F42 PolarHBondContact O-N 3.2Å; F42-T44 VanDerWaalsContact C-N 3.3Å; F42-T44 PolarHBondContact O-N 2.9Å; F42-S45 PolarHBondContact O-N 2.98Å
43	L	87.3	Confident	89.9	Confident	49 Å²	49	52.3 Å²	52.3	26%	0.257	27%	0.269	S	S	.	.	H	α-helix	trans	-62.3	-36.7	177.5	-179.9	61	0	0	0	112.4	Q39 L40 R41 P369 F374 V377	Q39-L43 PolarHBondContact O-N 3Å; L40-L43 PolarHBondContact O-N 3.29Å; R41-L43 VanDerWaalsContact C-N 3.3Å; R41-L43 PolarHBondContact O-N 3.48Å; L43-P369 HydrophobicContact CD1-CB 4.42Å; L43-P369 HydrophobicContact CD1-CG 4.02Å; L43-P369 HydrophobicContact CD2-CB 4.46Å; L43-P369 HydrophobicContact CG-CB 4.45Å; L43-P369 HydrophobicContact CG-CG 4.08Å; L43-F374 HydrophobicContact CD2-CD1 3.46Å; L43-F374 VanDerWaalsContact CD2-CD1 3.46Å; L43-F374 HydrophobicContact CD2-CE1 3.7Å; L43-F374 HydrophobicContact CD2-CG 3.99Å; L43-F374 HydrophobicContact CD2-CZ 4.43Å; L43-F374 HydrophobicContact CG-CD1 4.37Å; L43-F374 HydrophobicContact CG-CE1 4.15Å; L43-V377 HydrophobicContact CD2-CG2 3.99Å
44	T	86.3	Confident	89.9	Confident	11 Å²	11	52.3 Å²	52.3	7%	0.067	27%	0.267	C	S	.	.	H	α-helix	trans	-86	-20.1	178.2	57.8	0	0	0	0	114.4	L40 R41 F42 S46 V47 F48 F374	L40-T44 PolarHBondContact O-N 3.1Å; L40-T44 PolarHBondContact O-OG1 2.94Å; R41-T44 PolarHBondContact O-N 3.29Å; R41-T44 VanDerWaalsContact O-N 3.17Å; R41-T44 PolarHBondContact O-OG1 3.47Å; F42-T44 VanDerWaalsContact C-N 3.3Å; F42-T44 PolarHBondContact O-N 2.9Å; T44-S46 VanDerWaalsContact C-N 3.3Å; T44-S46 PolarHBondContact O-N 3.08Å; T44-V47 PolarHBondContact O-N 3Å; T44-F48 HydrophobicContact CG2-CE2 4.04Å; T44-F48 WeakPolarHBondContact O-CD2 3.44Å; T44-F48 PolarHBondContact O-N 2.96Å; T44-F48 VanDerWaalsContact O-N 3.12Å; T44-F374 HydrophobicContact CG2-CE1 3.55Å; T44-F374 HydrophobicContact CG2-CZ 3.77Å
45	S	88.1	Confident	90	Very high	40 Å²	40	49 Å²	49	28%	0.28	24%	0.244	S	C	.	.	H	α-helix	trans	-59.3	-40.1	-170.3	-173.8	0	0	0	0	112.1	R41 F42 V47 F48 T49	R41-S45 WeakPolarHBondContact O-CB 3.3Å; R41-S45 PolarHBondContact O-N 3.35Å; F42-S45 PolarHBondContact O-N 2.98Å; S45-V47 PolarHBondContact O-N 2.96Å; S45-F48 PolarHBondContact O-N 3.45Å; S45-T49 WeakPolarHBondContact O-CB 3.34Å; S45-T49 PolarHBondContact O-N 2.87Å; S45-T49 PolarHBondContact O-OG1 2.98Å
46	S	88	Confident	90	Very high	69 Å²	69	51.7 Å²	51.7	48%	0.483	26%	0.259	S	S	.	.	H	α-helix	trans	-59.8	-50.2	-179.6	55.5	0	0	0	0	112	T44 F48 T49 E50	T44-S46 VanDerWaalsContact C-N 3.3Å; T44-S46 PolarHBondContact O-N 3.08Å; S46-F48 VanDerWaalsContact C-N 3.34Å; S46-F48 PolarHBondContact O-N 3.36Å; S46-T49 PolarHBondContact O-N 3.43Å; S46-E50 WeakPolarHBondContact O-CG 3.4Å; S46-E50 PolarHBondContact O-N 3.18Å
47	V	90	Very high	89.9	Confident	14 Å²	14	56.5 Å²	56.5	9%	0.085	28%	0.284	C	S	.	.	H	α-helix	trans	-63.6	-41.5	-179.6	-179.1	0	0	0	0	110.8	T44 S45 E50 V51 L84 F366 S367	T44-V47 PolarHBondContact O-N 3Å; S45-V47 PolarHBondContact O-N 2.96Å; V47-E50 WeakPolarHBondContact O-CB 3.48Å; V47-E50 PolarHBondContact O-N 3.48Å; V47-V51 WeakPolarHBondContact O-CG2 3.27Å; V47-V51 PolarHBondContact O-N 3.2Å; V47-L84 HydrophobicContact CG1-CD1 4.04Å; V47-F366 HydrophobicContact CG1-CB 4.48Å; V47-S367 WeakPolarHBondContact CG2-O 3.46Å
48	F	90.5	Very high	89.8	Confident	1 Å²	1	53.4 Å²	53.4	0%	0.004	27%	0.273	C	S	.	.	H	α-helix	trans	-73	-32.9	179.7	-64	-44.8	0	0	0	113.5	T44 S45 S46 E50 V51 F52 L84 I96 H99 L100 L103	T44-F48 HydrophobicContact CG2-CE2 4.04Å; T44-F48 WeakPolarHBondContact O-CD2 3.44Å; T44-F48 PolarHBondContact O-N 2.96Å; T44-F48 VanDerWaalsContact O-N 3.12Å; S45-F48 PolarHBondContact O-N 3.45Å; S46-F48 VanDerWaalsContact C-N 3.34Å; S46-F48 PolarHBondContact O-N 3.36Å; F48-E50 VanDerWaalsContact C-N 3.32Å; F48-V51 PolarHBondContact O-N 2.76Å; F48-F52 WeakPolarHBondContact O-CB 3.29Å; F48-F52 PolarHBondContact O-N 3Å; F48-L84 HydrophobicContact CE1-CD2 4.21Å; F48-I96 HydrophobicContact CE1-CG2 4.04Å; F48-I96 WeakPolarHBondContact CE2-O 3.36Å; F48-I96 HydrophobicContact CZ-CB 4.19Å; F48-I96 HydrophobicContact CZ-CG2 3.48Å; F48-I96 VanDerWaalsContact CZ-CG2 3.48Å; F48-I96 WeakPolarHBondContact CZ-O 3.46Å; F48-H99 HydrophobicContact CD2-CB 4.36Å; F48-H99 AromaticContact CD2-CD2 3.27Å; F48-H99 WeakPolarHBondContact CD2-CD2 3.19Å; F48-H99 HydrophobicContact CE2-CB 4.05Å; F48-H99 AromaticContact CE2-CD2 3.81Å; F48-L100 HydrophobicContact CB-CD1 4.41Å; F48-L100 HydrophobicContact CD1-CB 4.03Å; F48-L100 HydrophobicContact CD1-CD1 4.29Å; F48-L100 HydrophobicContact CD1-CD2 4.49Å; F48-L100 HydrophobicContact CE1-CB 4.21Å; F48-L100 HydrophobicContact CG-CB 4.48Å; F48-L103 HydrophobicContact CB-CD1 3.81Å
49	T	91	Very high	89.7	Confident	59 Å²	59	51.7 Å²	51.7	36%	0.362	26%	0.261	S	S	.	.	H	α-helix	trans	-63.6	-39.8	169.5	-60	0	0	0	0	110.8	S45 S46 F52 N53	S45-T49 WeakPolarHBondContact O-CB 3.34Å; S45-T49 PolarHBondContact O-N 2.87Å; S45-T49 PolarHBondContact O-OG1 2.98Å; S46-T49 PolarHBondContact O-N 3.43Å; T49-F52 PolarHBondContact O-N 3.44Å; T49-N53 WeakPolarHBondContact O-CB 3.12Å; T49-N53 PolarHBondContact O-N 3.48Å; T49-N53 PolarHBondContact O-ND2 3.1Å; T49-N53 PolarHBondContact O-OD1 3.35Å
50	E	92.4	Very high	89.5	Confident	111 Å²	111	53 Å²	53	52%	0.519	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-44.2	174.1	-72.4	174.6	-159.2	0	0	112.7	S46 V47 F48 N53 F54 F366	S46-E50 WeakPolarHBondContact O-CG 3.4Å; S46-E50 PolarHBondContact O-N 3.18Å; V47-E50 WeakPolarHBondContact O-CB 3.48Å; V47-E50 PolarHBondContact O-N 3.48Å; F48-E50 VanDerWaalsContact C-N 3.32Å; E50-N53 PolarHBondContact O-N 2.84Å; E50-F54 PolarHBondContact O-N 2.78Å; E50-F366 HydrophobicContact CB-CD1 4.37Å; E50-F366 HydrophobicContact CB-CE1 4.11Å
51	V	92.9	Very high	89.2	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-63.8	-42.4	175.4	173.7	0	0	0	0	110.9	V47 F48 F54 I55 A82 L100 F366	V47-V51 WeakPolarHBondContact O-CG2 3.27Å; V47-V51 PolarHBondContact O-N 3.2Å; F48-V51 PolarHBondContact O-N 2.76Å; V51-F54 WeakPolarHBondContact O-CB 3.4Å; V51-F54 PolarHBondContact O-N 3.49Å; V51-I55 HydrophobicContact CG1-CD1 4.06Å; V51-I55 WeakPolarHBondContact O-CG1 3.35Å; V51-I55 PolarHBondContact O-N 3.32Å; V51-A82 HydrophobicContact CG1-CB 4.3Å; V51-L100 HydrophobicContact CB-CD1 4.43Å; V51-L100 HydrophobicContact CG1-CD1 4.05Å; V51-L100 HydrophobicContact CG1-CD2 4.09Å; V51-F366 HydrophobicContact CG2-CB 4.03Å; V51-F366 HydrophobicContact CG2-CD1 3.69Å; V51-F366 HydrophobicContact CG2-CD2 3.86Å; V51-F366 HydrophobicContact CG2-CE1 4.06Å; V51-F366 HydrophobicContact CG2-CE2 4.21Å; V51-F366 HydrophobicContact CG2-CG 3.58Å; V51-F366 HydrophobicContact CG2-CZ 4.3Å
52	F	92.4	Very high	89.1	Confident	40 Å²	40	48.6 Å²	48.6	18%	0.175	26%	0.263	C	S	.	.	H	α-helix	trans	-61.6	-48.3	176.6	178.6	-94.2	0	0	0	111.5	F48 T49 F54 I55 E56 I104 S107	F48-F52 WeakPolarHBondContact O-CB 3.29Å; F48-F52 PolarHBondContact O-N 3Å; T49-F52 PolarHBondContact O-N 3.44Å; F52-F54 PolarHBondContact O-N 2.93Å; F52-I55 PolarHBondContact O-N 3.37Å; F52-I55 VanDerWaalsContact O-N 3.07Å; F52-E56 PolarHBondContact O-N 3Å; F52-I104 HydrophobicContact CD2-CG1 4.21Å; F52-S107 WeakPolarHBondContact CE2-OG 3.47Å; F52-S107 VanDerWaalsContact CZ-CB 3.49Å
53	N	92.5	Very high	88.8	Confident	69 Å²	69	44 Å²	44	37%	0.369	25%	0.245	S	C	.	.	H	α-helix	trans	-58.9	-37.8	175.8	-70.4	-16	0	0	0	111.5	T49 E50 N57	T49-N53 WeakPolarHBondContact O-CB 3.12Å; T49-N53 PolarHBondContact O-N 3.48Å; T49-N53 PolarHBondContact O-ND2 3.1Å; T49-N53 PolarHBondContact O-OD1 3.35Å; E50-N53 PolarHBondContact O-N 2.84Å; N53-N57 VanDerWaalsContact O-CB 3.25Å; N53-N57 WeakPolarHBondContact O-CB 3.34Å; N53-N57 PolarHBondContact O-N 3.13Å; N53-N57 PolarHBondContact O-ND2 3.1Å
54	F	93.4	Very high	88.3	Confident	30 Å²	30	44.7 Å²	44.7	13%	0.132	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-47.2	173.6	168.2	-102.3	0	0	0	112	E50 V51 F52 E56 N57 S58 P80 A82 R364 F366	E50-F54 PolarHBondContact O-N 2.78Å; V51-F54 WeakPolarHBondContact O-CB 3.4Å; V51-F54 PolarHBondContact O-N 3.49Å; F52-F54 PolarHBondContact O-N 2.93Å; F54-E56 PolarHBondContact O-N 2.77Å; F54-N57 PolarHBondContact O-N 3.17Å; F54-S58 WeakPolarHBondContact O-CB 3.31Å; F54-S58 PolarHBondContact O-N 2.83Å; F54-S58 PolarHBondContact O-OG 2.83Å; F54-P80 HydrophobicContact CE1-CB 4.36Å; F54-P80 HydrophobicContact CZ-CB 3.95Å; F54-A82 HydrophobicContact CD1-CB 4.01Å; F54-A82 HydrophobicContact CE1-CB 3.97Å; F54-R364 HydrophobicContact CD2-CB 4.25Å; F54-R364 HydrophobicContact CD2-CG 3.83Å; F54-R364 HydrophobicContact CE2-CB 3.95Å; F54-R364 HydrophobicContact CE2-CG 3.41Å; F54-R364 VanDerWaalsContact CE2-CG 3.41Å; F54-R364 HydrophobicContact CZ-CB 4.16Å; F54-R364 HydrophobicContact CZ-CG 4.02Å; F54-F366 HydrophobicContact CB-CZ 3.8Å; F54-F366 HydrophobicContact CD1-CE2 4.29Å; F54-F366 HydrophobicContact CD1-CZ 4.36Å; F54-F366 HydrophobicContact CG-CE2 4.35Å; F54-F366 HydrophobicContact CG-CZ 4.01Å
55	I	91.4	Very high	87.7	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.015	27%	0.268	C	S	.	.	H	α-helix	trans	-62.1	-44.2	178.1	-65.7	164.4	0	0	0	111	V51 F52 S58 H59 I104 P295 V297 V338	V51-I55 HydrophobicContact CG1-CD1 4.06Å; V51-I55 WeakPolarHBondContact O-CG1 3.35Å; V51-I55 PolarHBondContact O-N 3.32Å; F52-I55 PolarHBondContact O-N 3.37Å; F52-I55 VanDerWaalsContact O-N 3.07Å; I55-S58 PolarHBondContact O-N 3.44Å; I55-H59 WeakPolarHBondContact O-CB 3.47Å; I55-H59 PolarHBondContact O-N 3.49Å; I55-I104 HydrophobicContact CD1-CD1 4Å; I55-I104 HydrophobicContact CD1-CG1 4.48Å; I55-P295 HydrophobicContact CG2-CB 4.2Å; I55-P295 HydrophobicContact CG2-CG 4.39Å; I55-V297 HydrophobicContact CD1-CG1 4.23Å; I55-V297 HydrophobicContact CD1-CG2 4.29Å; I55-V297 HydrophobicContact CG2-CG2 3.86Å; I55-V338 HydrophobicContact CD1-CG2 4.26Å
56	E	89.6	Confident	86.9	Confident	97 Å²	97	47.7 Å²	47.7	45%	0.453	26%	0.264	S	S	.	.	H	α-helix	trans	-63.9	-47	178.7	-171.3	176.7	-164.1	0	0	111.2	F52 F54 S58 H59 T60	F52-E56 PolarHBondContact O-N 3Å; F54-E56 PolarHBondContact O-N 2.77Å; E56-S58 PolarHBondContact O-N 2.88Å; E56-H59 PolarHBondContact O-N 3Å; E56-H59 VanDerWaalsContact O-N 3.15Å; E56-T60 WeakPolarHBondContact O-CG2 3.43Å; E56-T60 PolarHBondContact O-N 2.86Å; E56-T60 PolarHBondContact O-OG1 3.25Å
57	N	90.1	Very high	85.7	Confident	101 Å²	101	48.3 Å²	48.3	54%	0.54	26%	0.262	S	S	.	.	H	α-helix	trans	-59.5	-44.7	175.8	-72.7	-34.5	0	0	0	111.9	N53 F54 H59 T60 S61	N53-N57 VanDerWaalsContact O-CB 3.25Å; N53-N57 WeakPolarHBondContact O-CB 3.34Å; N53-N57 PolarHBondContact O-N 3.13Å; N53-N57 PolarHBondContact O-ND2 3.1Å; F54-N57 PolarHBondContact O-N 3.17Å; N57-H59 VanDerWaalsContact C-N 3.33Å; N57-H59 PolarHBondContact O-N 2.93Å; N57-T60 WeakPolarHBondContact CA-OG1 3.35Å; N57-T60 PolarHBondContact O-N 3.3Å; N57-T60 PolarHBondContact O-OG1 3.01Å; N57-S61 WeakPolarHBondContact O-CB 3.4Å; N57-S61 PolarHBondContact O-N 3.4Å
58	S	87.4	Confident	84.2	Confident	25 Å²	25	53.3 Å²	53.3	18%	0.175	29%	0.288	C	S	.	.	H	α-helix	trans	-60.9	-41.1	174.8	-70.7	0	0	0	0	112.4	F54 I55 E56 W62 N336	F54-S58 WeakPolarHBondContact O-CB 3.31Å; F54-S58 PolarHBondContact O-N 2.83Å; F54-S58 PolarHBondContact O-OG 2.83Å; I55-S58 PolarHBondContact O-N 3.44Å; E56-S58 PolarHBondContact O-N 2.88Å; S58-W62 WeakPolarHBondContact O-CB 3.46Å; S58-W62 PolarHBondContact O-N 3.31Å; S58-N336 WeakPolarHBondContact CB-OD1 3.31Å
59	H	86.7	Confident	82.2	Confident	16 Å²	16	60.9 Å²	60.9	7%	0.074	32%	0.323	C	S	.	.	H	α-helix	trans	-67.3	-43	177.2	-178	-104.1	0	0	0	112.9	I55 E56 N57 S61 W62 L63 L293 P295	I55-H59 WeakPolarHBondContact O-CB 3.47Å; I55-H59 PolarHBondContact O-N 3.49Å; E56-H59 PolarHBondContact O-N 3Å; E56-H59 VanDerWaalsContact O-N 3.15Å; N57-H59 VanDerWaalsContact C-N 3.33Å; N57-H59 PolarHBondContact O-N 2.93Å; H59-S61 VanDerWaalsContact C-N 3.34Å; H59-S61 PolarHBondContact O-N 2.77Å; H59-W62 WeakPolarHBondContact O-CB 3.48Å; H59-W62 PolarHBondContact O-N 3.36Å; H59-L63 WeakPolarHBondContact CE1-CD1 3.32Å; H59-L63 WeakPolarHBondContact O-CG 3.33Å; H59-L63 PolarHBondContact O-N 3.21Å; H59-L293 PolarHBondContact CE1-O 2.83Å; H59-L293 VanDerWaalsContact CE1-O 3.3Å; H59-P295 HydrophobicContact CB-CB 4.18Å
60	T	85.7	Confident	79.8	Confident	71 Å²	71	61.5 Å²	61.5	44%	0.436	34%	0.335	S	S	.	.	H	α-helix	trans	-62.9	-40.5	175.9	59	0	0	0	0	112	E56 N57 W62 L63 S64	E56-T60 WeakPolarHBondContact O-CG2 3.43Å; E56-T60 PolarHBondContact O-N 2.86Å; E56-T60 PolarHBondContact O-OG1 3.25Å; N57-T60 WeakPolarHBondContact CA-OG1 3.35Å; N57-T60 PolarHBondContact O-N 3.3Å; N57-T60 PolarHBondContact O-OG1 3.01Å; T60-W62 VanDerWaalsContact C-N 3.34Å; T60-W62 PolarHBondContact O-N 3.05Å; T60-L63 PolarHBondContact O-N 3.28Å; T60-S64 PolarHBondContact O-N 3.19Å
61	S	83.3	Confident	77.3	Confident	65 Å²	65	66.4 Å²	66.4	46%	0.455	35%	0.354	S	S	.	.	H	α-helix	trans	-60	-45.2	172.6	-171.5	0	0	0	0	111	N57 H59 S64 L65	N57-S61 WeakPolarHBondContact O-CB 3.4Å; N57-S61 PolarHBondContact O-N 3.4Å; H59-S61 VanDerWaalsContact C-N 3.34Å; H59-S61 PolarHBondContact O-N 2.77Å; S61-S64 PolarHBondContact O-N 2.9Å; S61-S64 PolarHBondContact O-OG 3.06Å; S61-L65 WeakPolarHBondContact O-CG 3.49Å; S61-L65 PolarHBondContact O-N 3.31Å
62	W	84.2	Confident	74.6	Confident	15 Å²	15	70.1 Å²	70.1	6%	0.057	38%	0.38	C	S	.	.	H	α-helix	trans	-62.2	-45.2	175.8	-179.2	92.1	0	0	0	112.4	S58 H59 T60 S64 L65 H66 L293 S332 P334	S58-W62 WeakPolarHBondContact O-CB 3.46Å; S58-W62 PolarHBondContact O-N 3.31Å; H59-W62 WeakPolarHBondContact O-CB 3.48Å; H59-W62 PolarHBondContact O-N 3.36Å; T60-W62 VanDerWaalsContact C-N 3.34Å; T60-W62 PolarHBondContact O-N 3.05Å; W62-S64 VanDerWaalsContact C-N 3.3Å; W62-S64 PolarHBondContact O-N 2.65Å; W62-L65 PolarHBondContact O-N 3.36Å; W62-H66 HydrophobicContact CD2-CB 4.4Å; W62-H66 HydrophobicContact CE3-CB 4.32Å; W62-H66 HydrophobicContact CH2-CB 4.21Å; W62-H66 AromaticContact CH2-CD2 3.36Å; W62-H66 WeakPolarHBondContact CH2-CD2 3.45Å; W62-H66 AromaticContact CH2-CG 3.79Å; W62-H66 AromaticContact CH2-NE2 3.9Å; W62-H66 HydrophobicContact CZ2-CB 4.31Å; W62-H66 AromaticContact CZ2-CD2 3.33Å; W62-H66 WeakPolarHBondContact CZ2-CD2 3.42Å; W62-H66 HydrophobicContact CZ3-CB 4.23Å; W62-H66 VanDerWaalsContact O-CB 3.32Å; W62-H66 WeakPolarHBondContact O-CB 3.34Å; W62-H66 PolarHBondContact O-N 2.79Å; W62-L293 HydrophobicContact CH2-CD1 4.26Å; W62-L293 HydrophobicContact CZ3-CD1 4.21Å; W62-S332 WeakPolarHBondContact CZ2-O 3.44Å; W62-P334 HydrophobicContact CD2-CB 3.67Å; W62-P334 HydrophobicContact CD2-CG 4.41Å; W62-P334 HydrophobicContact CE3-CB 3.82Å; W62-P334 HydrophobicContact CE3-CG 4.24Å; W62-P334 HydrophobicContact CG-CB 4.09Å; W62-P334 HydrophobicContact CH2-CB 4.35Å; W62-P334 HydrophobicContact CH2-CG 4.06Å; W62-P334 HydrophobicContact CZ2-CB 4.19Å; W62-P334 HydrophobicContact CZ2-CG 4.21Å; W62-P334 HydrophobicContact CZ3-CB 4.16Å; W62-P334 HydrophobicContact CZ3-CG 4.07Å
63	L	81.4	Confident	72.2	Confident	37 Å²	37	75.7 Å²	75.7	19%	0.194	41%	0.41	C	S	.	.	H	α-helix	trans	-59.9	-40.6	176.9	-78.3	174	0	0	0	112	H59 T60 L65 H66 N67 L293	H59-L63 WeakPolarHBondContact CE1-CD1 3.32Å; H59-L63 WeakPolarHBondContact O-CG 3.33Å; H59-L63 PolarHBondContact O-N 3.21Å; T60-L63 PolarHBondContact O-N 3.28Å; L63-L65 VanDerWaalsContact C-N 3.33Å; L63-L65 PolarHBondContact O-N 3.3Å; L63-H66 PolarHBondContact O-N 3.04Å; L63-N67 WeakPolarHBondContact O-CB 3.4Å; L63-N67 VanDerWaalsContact O-CG 3.28Å; L63-N67 PolarHBondContact O-N 3.45Å; L63-N67 PolarHBondContact O-ND2 3.49Å; L63-N67 VanDerWaalsContact O-ND2 3.16Å; L63-L293 HydrophobicContact CD2-CB 4.21Å
64	S	78.3	Confident	69.6	Low	64 Å²	64	76.8 Å²	76.8	45%	0.448	42%	0.419	S	S	.	.	H	α-helix	trans	-62.6	-41.3	178.4	76.4	0	0	0	0	111.7	T60 S61 W62 L68	T60-S64 PolarHBondContact O-N 3.19Å; S61-S64 PolarHBondContact O-N 2.9Å; S61-S64 PolarHBondContact O-OG 3.06Å; W62-S64 VanDerWaalsContact C-N 3.3Å; W62-S64 PolarHBondContact O-N 2.65Å; S64-L68 WeakPolarHBondContact O-CD1 3.49Å
65	L	73.5	Confident	67.6	Low	71 Å²	71	82 Å²	82	37%	0.372	45%	0.448	S	S	.	.	H	α-helix	trans	-72.9	-39.6	177.2	-68.5	169.2	0	0	0	111.9	S61 W62 L63 N67 L68 L76	S61-L65 WeakPolarHBondContact O-CG 3.49Å; S61-L65 PolarHBondContact O-N 3.31Å; W62-L65 PolarHBondContact O-N 3.36Å; L63-L65 VanDerWaalsContact C-N 3.33Å; L63-L65 PolarHBondContact O-N 3.3Å; L65-N67 VanDerWaalsContact C-N 3.29Å; L65-N67 PolarHBondContact O-N 3.35Å; L65-L68 PolarHBondContact O-N 3.01Å; L65-L76 HydrophobicContact CB-CD1 4.25Å; L65-L76 HydrophobicContact CD1-CD1 4.35Å; L65-L76 HydrophobicContact CD1-CD2 4.03Å; L65-L76 HydrophobicContact CD1-CG 4.05Å
66	H	69.6	Low	65.8	Low	43 Å²	43	84.6 Å²	84.6	20%	0.199	46%	0.462	C	S	.	.	H	α-helix	trans	-67.1	-29.8	179.9	-173.1	-75.9	0	0	0	112.5	W62 L63 Y189	W62-H66 HydrophobicContact CD2-CB 4.4Å; W62-H66 HydrophobicContact CE3-CB 4.32Å; W62-H66 HydrophobicContact CH2-CB 4.21Å; W62-H66 AromaticContact CH2-CD2 3.36Å; W62-H66 WeakPolarHBondContact CH2-CD2 3.45Å; W62-H66 AromaticContact CH2-CG 3.79Å; W62-H66 AromaticContact CH2-NE2 3.9Å; W62-H66 HydrophobicContact CZ2-CB 4.31Å; W62-H66 AromaticContact CZ2-CD2 3.33Å; W62-H66 WeakPolarHBondContact CZ2-CD2 3.42Å; W62-H66 HydrophobicContact CZ3-CB 4.23Å; W62-H66 VanDerWaalsContact O-CB 3.32Å; W62-H66 WeakPolarHBondContact O-CB 3.34Å; W62-H66 PolarHBondContact O-N 2.79Å; L63-H66 PolarHBondContact O-N 3.04Å; H66-Y189 AromaticContact NE2-CE1 3.97Å; H66-Y189 PolarHBondContact NE2-OH 3.3Å
67	N	63.3	Low	64.7	Low	82 Å²	82	85.2 Å²	85.2	44%	0.439	47%	0.465	S	S	.	.	H	α-helix	trans	-80.8	-18.1	178.6	-72.9	-29.1	0	0	0	113.8	L63 L65 E69	L63-N67 WeakPolarHBondContact O-CB 3.4Å; L63-N67 VanDerWaalsContact O-CG 3.28Å; L63-N67 PolarHBondContact O-N 3.45Å; L63-N67 PolarHBondContact O-ND2 3.49Å; L63-N67 VanDerWaalsContact O-ND2 3.16Å; L65-N67 VanDerWaalsContact C-N 3.29Å; L65-N67 PolarHBondContact O-N 3.35Å; N67-E69 PolarHBondContact O-N 3.03Å
68	L	58.1	Low	64.5	Low	119 Å²	119	84.8 Å²	84.8	62%	0.623	46%	0.46	S	S	*	.			trans	-81	98.1	173.6	-74.3	158.7	0	0	0	108.5	S64 L65 A70	S64-L68 WeakPolarHBondContact O-CD1 3.49Å; L65-L68 PolarHBondContact O-N 3.01Å; L68-A70 PolarHBondContact O-N 2.9Å
69	E	48.5	Very low	64.7	Low	159 Å²	159	83.6 Å²	83.6	74%	0.743	45%	0.451	S	S	*	.			trans	-65	26.2	178.9	-73.6	-176.6	167.3	0	0	115	N67 K194	N67-E69 PolarHBondContact O-N 3.03Å; E69-K194 IonicContact OE1-NZ 3.72Å; E69-K194 PolarHBondContact OE1-NZ 3.41Å
70	A	40.5	Very low	65	Low	73 Å²	73	84.1 Å²	84.1	60%	0.603	46%	0.456	S	S	*	.			trans	-95	123.1	-177.6	0	0	0	0	0	111.4	L68 S72	L68-A70 PolarHBondContact O-N 2.9Å; A70-S72 PolarHBondContact O-N 3.45Å
71	K	40	Very low	65.4	Low	213 Å²	213	80.7 Å²	80.7	93%	0.926	44%	0.435	S	S	*	.			trans	-55.7	38.8	172.6	-67.8	168.8	170.6	171.1	0	115.7
72	S	36.6	Very low	66	Low	80 Å²	80	77.7 Å²	77.7	56%	0.559	41%	0.414	S	S	*	.			trans	-99.5	108.8	178	154.2	0	0	0	0	108.7	A70 V74	A70-S72 PolarHBondContact O-N 3.45Å; S72-V74 PolarHBondContact O-N 3.07Å; S72-V74 VanDerWaalsContact OG-CG2 3.28Å; S72-V74 WeakPolarHBondContact OG-CG2 3.42Å
73	I	42	Very low	66.5	Low	156 Å²	156	77 Å²	77	80%	0.8	41%	0.412	S	S	*	.			trans	-63.8	26.3	-178.7	-67.6	160.3	0	0	0	113
74	V	38.3	Very low	67.1	Low	92 Å²	92	75.3 Å²	75.3	56%	0.558	40%	0.403	S	S	*	.			trans	-111.1	107.8	-157.8	-170.9	0	0	0	0	112	S72	S72-V74 PolarHBondContact O-N 3.07Å; S72-V74 VanDerWaalsContact OG-CG2 3.28Å; S72-V74 WeakPolarHBondContact OG-CG2 3.42Å
75	N	50.7	Low	67.7	Low	140 Å²	140	74.5 Å²	74.5	75%	0.749	39%	0.393	S	S	*	.	S	Bend	trans	78.4	31.1	155.4	-60.2	-7.9	0	0	0	121.2
76	L	55.2	Low	68	Low	58 Å²	58	71.3 Å²	71.3	30%	0.304	38%	0.377	S	S	.	.			trans	-96.6	20	163.6	-85.6	160.9	0	0	0	113.3	L65 Q78	L65-L76 HydrophobicContact CB-CD1 4.25Å; L65-L76 HydrophobicContact CD1-CD1 4.35Å; L65-L76 HydrophobicContact CD1-CD2 4.03Å; L65-L76 HydrophobicContact CD1-CG 4.05Å; L76-Q78 VanDerWaalsContact C-N 3.3Å; L76-Q78 PolarHBondContact O-N 3.19Å
77	E	65.5	Low	68.5	Low	110 Å²	110	70.3 Å²	70.3	51%	0.514	38%	0.378	S	S	.	.			trans	-74.5	-19.5	-171.9	-64.6	-166.9	157.4	0	0	114.1
78	Q	85.7	Confident	69.4	Low	92 Å²	92	70.5 Å²	70.5	43%	0.43	38%	0.382	S	S	.	.	S	Bend	trans	-103.1	134.5	-172.7	-59.6	-171.7	-15.2	0	0	112.7	L76 S359 R360 T362	L76-Q78 VanDerWaalsContact C-N 3.3Å; L76-Q78 PolarHBondContact O-N 3.19Å; Q78-S359 WeakPolarHBondContact CG-O 3.34Å; Q78-S359 PolarHBondContact NE2-O 2.67Å; Q78-R360 CarbonylContact C-O 3.56Å; Q78-R360 VanDerWaalsContact CA-O 3.29Å; Q78-R360 WeakPolarHBondContact CA-O 3.4Å; Q78-T362 WeakPolarHBondContact CB-OG1 3.28Å; Q78-T362 PolarHBondContact OE1-OG1 3.29Å
79	I	91.3	Very high	70.6	Confident	0 Å²	0	65 Å²	65	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	121.2	177.2	-51.2	171.6	0	0	0	108.8	T81 T318 V322 F337 R360 L361 T362	I79-T81 PolarHBondContact O-N 2.93Å; I79-T81 PolarHBondContact O-OG1 3.48Å; I79-T318 HydrophobicContact CD1-CG2 4.05Å; I79-V322 HydrophobicContact CG1-CB 4.39Å; I79-V322 HydrophobicContact CG1-CG1 4.49Å; I79-V322 HydrophobicContact CG1-CG2 4.2Å; I79-F337 HydrophobicContact CB-CD2 4.16Å; I79-F337 HydrophobicContact CB-CE2 4.21Å; I79-F337 HydrophobicContact CD1-CD2 4.29Å; I79-F337 HydrophobicContact CD1-CE2 3.5Å; I79-F337 VanDerWaalsContact CD1-CE2 3.5Å; I79-F337 HydrophobicContact CD1-CZ 4.15Å; I79-F337 HydrophobicContact CG1-CE2 4.46Å; I79-F337 HydrophobicContact CG2-CD2 3.46Å; I79-F337 VanDerWaalsContact CG2-CD2 3.46Å; I79-F337 HydrophobicContact CG2-CE2 3.69Å; I79-F337 HydrophobicContact CG2-CG 4.13Å; I79-F337 HydrophobicContact CG2-CZ 4.49Å; I79-R360 PolarHBondContact N-O 3.1Å; I79-L361 HydrophobicContact CB-CD2 4.1Å; I79-L361 HydrophobicContact CD1-CD2 4.35Å; I79-T362 PolarHBondContact O-N 3.28Å
80	P	93.6	Very high	71.8	Confident	26 Å²	26	60.3 Å²	60.3	17%	0.169	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	123.9	173.9	-14.7	27.1	0	0	0	110	F54 N336 F337	F54-P80 HydrophobicContact CE1-CB 4.36Å; F54-P80 HydrophobicContact CZ-CB 3.95Å; P80-N336 WeakPolarHBondContact CB-OD1 3.25Å; P80-N336 WeakPolarHBondContact CG-OD1 3.1Å; P80-F337 PolarHBondContact O-N 2.89Å
81	T	94.9	Very high	73.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	112.5	-172.4	-57	0	0	0	0	110.4	I79 F337 F339 T362 I363 R364	I79-T81 PolarHBondContact O-N 2.93Å; I79-T81 PolarHBondContact O-OG1 3.48Å; T81-F337 CarbonylContact C-O 3.59Å; T81-F337 WeakPolarHBondContact CA-O 3.31Å; T81-F337 HydrophobicContact CG2-CB 3.86Å; T81-F339 HydrophobicContact CG2-CD2 3.37Å; T81-F339 HydrophobicContact CG2-CE2 3.51Å; T81-F339 HydrophobicContact CG2-CG 4.01Å; T81-F339 HydrophobicContact CG2-CZ 4.23Å; T81-T362 PolarHBondContact N-O 3.15Å; T81-I363 CarbonylContact O-C 3.39Å; T81-I363 WeakPolarHBondContact O-CA 3.48Å; T81-R364 PolarHBondContact O-N 3.39Å
82	A	95.4	Very high	75.7	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.008	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	117.4	169.4	0	0	0	0	0	109.6	V51 F54 F337 V338 F339 R364 F366	V51-A82 HydrophobicContact CG1-CB 4.3Å; F54-A82 HydrophobicContact CD1-CB 4.01Å; F54-A82 HydrophobicContact CE1-CB 3.97Å; A82-F337 PolarHBondContact N-O 3.1Å; A82-V338 HydrophobicContact CB-CG2 4.3Å; A82-V338 CarbonylContact O-C 3.54Å; A82-V338 VanDerWaalsContact O-CA 3.32Å; A82-V338 WeakPolarHBondContact O-CA 3.46Å; A82-F339 PolarHBondContact O-N 3.3Å; A82-R364 CarbonylContact C-O 3.52Å; A82-F366 HydrophobicContact CB-CD2 3.88Å; A82-F366 HydrophobicContact CB-CE2 3.65Å
83	L	94.2	Very high	78	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	105.9	176.4	-166.2	65.8	0	0	0	109	F339 L341 P345 F349 I363 R364 R365 F366	L83-F339 HydrophobicContact CD1-CB 3.74Å; L83-F339 HydrophobicContact CD1-CD2 4.49Å; L83-L341 HydrophobicContact CD1-CD1 3.37Å; L83-L341 HydrophobicContact CD1-CG 3.75Å; L83-L341 HydrophobicContact CD2-CD1 3.61Å; L83-L341 HydrophobicContact CG-CD1 3.54Å; L83-L341 HydrophobicContact CG-CG 4.31Å; L83-P345 HydrophobicContact CD2-CB 3.87Å; L83-P345 HydrophobicContact CD2-CG 3.79Å; L83-F349 HydrophobicContact CD1-CD2 4.03Å; L83-F349 HydrophobicContact CD1-CE2 4.15Å; L83-F349 HydrophobicContact CD1-CG 4.36Å; L83-I363 HydrophobicContact CB-CG2 3.94Å; L83-I363 HydrophobicContact CD2-CG2 4.16Å; L83-R364 PolarHBondContact N-O 2.94Å; L83-R365 HydrophobicContact CD2-CG 4.31Å; L83-F366 PolarHBondContact O-N 3.43Å
84	L	93.3	Very high	80	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	113.5	-177.2	-171.2	69.6	0	0	0	110.8	V47 F48 A86 Y97 F339 G340 L341 F366 V368	V47-L84 HydrophobicContact CG1-CD1 4.04Å; F48-L84 HydrophobicContact CE1-CD2 4.21Å; L84-A86 PolarHBondContact O-N 3.35Å; L84-Y97 HydrophobicContact CD2-CD1 4.43Å; L84-Y97 HydrophobicContact CD2-CE1 3.57Å; L84-F339 PolarHBondContact N-O 2.94Å; L84-G340 WeakPolarHBondContact O-CA 3.33Å; L84-L341 PolarHBondContact O-N 3.17Å; L84-F366 HydrophobicContact CD1-CB 3.79Å; L84-V368 HydrophobicContact CD1-CG2 3.64Å; L84-V368 HydrophobicContact CD2-CG2 3.98Å; L84-V368 HydrophobicContact CG-CG2 3.8Å
85	L	91.8	Very high	82.2	Confident	47 Å²	47	42.3 Å²	42.3	25%	0.246	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	96.5	171.4	-59.1	170.7	0	0	0	108.7	L341 T343 P345 F366 V368	L85-L341 HydrophobicContact CD2-CB 3.93Å; L85-L341 HydrophobicContact CD2-CD1 4.12Å; L85-T343 WeakPolarHBondContact CD2-O 3.44Å; L85-P345 HydrophobicContact CD2-CG 3.92Å; L85-F366 PolarHBondContact N-O 3.39Å; L85-V368 WeakPolarHBondContact O-CB 3.48Å; L85-V368 PolarHBondContact O-N 3.28Å
86	A	80.6	Confident	83.8	Confident	5 Å²	5	36.2 Å²	36.2	4%	0.041	21%	0.211	C	C	.	.			trans	-94.4	-14.6	-173.6	0	0	0	0	0	113.7	L84 N89 L341	L84-A86 PolarHBondContact O-N 3.35Å; A86-N89 PolarHBondContact O-OD1 2.87Å; A86-N89 VanDerWaalsContact O-OD1 3.09Å; A86-L341 PolarHBondContact N-O 3.29Å
87	G	80	Confident	85.4	Confident	21 Å²	21	33.6 Å²	33.6	22%	0.216	20%	0.197	C	C	.	.			trans	90.3	-178	-177	0	0	0	0	0	113.1	N89 H93 S342	G87-N89 VanDerWaalsContact C-N 3.33Å; G87-H93 PolarHBondContact O-NE2 3.09Å; G87-S342 WeakPolarHBondContact O-CA 3.38Å; G87-S342 WeakPolarHBondContact O-CB 3.43Å; G87-S342 PolarHBondContact O-OG 3.07Å
88	V	82.3	Confident	86.4	Confident	87 Å²	87	29.5 Å²	29.5	53%	0.527	18%	0.184	S	C	.	.	S	Bend	trans	-86.1	-1.1	-177	-66.4	0	0	0	0	113.9	T90 Y408	V88-T90 VanDerWaalsContact C-N 3.28Å; V88-T90 PolarHBondContact O-N 3.14Å; V88-Y408 HydrophobicContact CG2-CD2 4.21Å
89	N	82	Confident	86.4	Confident	2 Å²	2	27 Å²	27	1%	0.011	17%	0.172	C	C	.	.			trans	-83.6	63.4	-174.4	55.7	-44.7	0	0	0	112.2	A86 G87 P91 D92 H93 Y408	A86-N89 PolarHBondContact O-OD1 2.87Å; A86-N89 VanDerWaalsContact O-OD1 3.09Å; G87-N89 VanDerWaalsContact C-N 3.33Å; N89-P91 VanDerWaalsContact C-N 3.3Å; N89-P91 WeakPolarHBondContact O-CD 3.48Å; N89-P91 VanDerWaalsContact O-N 3.11Å; N89-D92 PolarHBondContact ND2-OD2 3.31Å; N89-D92 WeakPolarHBondContact O-CB 3.44Å; N89-D92 PolarHBondContact O-N 3.48Å; N89-H93 PolarHBondContact O-CD2 3.41Å; N89-Y408 WeakPolarHBondContact CB-O 3.23Å
90	T	74.7	Confident	86.4	Confident	62 Å²	62	27 Å²	27	38%	0.38	17%	0.172	S	C	.	.	H	α-helix	trans	-49.2	-35.2	-178.9	66.6	0	0	0	0	115.7	V88 D92 H93 E302	V88-T90 VanDerWaalsContact C-N 3.28Å; V88-T90 PolarHBondContact O-N 3.14Å; T90-D92 PolarHBondContact O-N 3.26Å; T90-H93 WeakPolarHBondContact O-CB 3.42Å; T90-H93 PolarHBondContact O-N 3.1Å; T90-E302 WeakPolarHBondContact CB-OE1 3.25Å; T90-E302 WeakPolarHBondContact CG2-OE1 3.19Å
91	P	77.9	Confident	86.2	Confident	43 Å²	43	29 Å²	29	28%	0.279	18%	0.176	S	C	.	.	H	α-helix	trans	-64.4	-25.2	178.6	-21.3	34.9	0	0	0	113.7	N89 S94	N89-P91 VanDerWaalsContact C-N 3.3Å; N89-P91 WeakPolarHBondContact O-CD 3.48Å; N89-P91 VanDerWaalsContact O-N 3.11Å; P91-S94 PolarHBondContact O-OG 3.02Å
92	D	84.1	Confident	85.9	Confident	14 Å²	14	32.7 Å²	32.7	8%	0.075	20%	0.196	C	C	.	.	H	α-helix	trans	-86.4	-18.8	-176.6	-58.3	-10.2	0	0	0	111.5	N89 T90 S94 V95 I96 S409 V410 K411	N89-D92 PolarHBondContact ND2-OD2 3.31Å; N89-D92 WeakPolarHBondContact O-CB 3.44Å; N89-D92 PolarHBondContact O-N 3.48Å; T90-D92 PolarHBondContact O-N 3.26Å; D92-S94 PolarHBondContact O-N 2.8Å; D92-S94 VanDerWaalsContact O-N 3.16Å; D92-V95 PolarHBondContact O-N 2.78Å; D92-I96 HydrophobicContact CB-CD1 4.26Å; D92-I96 WeakPolarHBondContact O-CG1 3.32Å; D92-I96 PolarHBondContact O-N 2.76Å; D92-I96 VanDerWaalsContact O-N 3.14Å; D92-S409 PolarHBondContact OD1-OG 2.98Å; D92-V410 PolarHBondContact OD2-N 3.22Å; D92-K411 WeakPolarHBondContact OD1-CB 3.38Å; D92-K411 PolarHBondContact OD1-N 3.16Å; D92-K411 VanDerWaalsContact OD1-N 3.14Å
93	H	84.3	Confident	85.6	Confident	3 Å²	3	34.6 Å²	34.6	1%	0.014	21%	0.206	C	C	.	.	H	α-helix	trans	-54.7	-37.1	179.3	-70.1	-178.3	0	0	0	112.2	G87 N89 T90 V95 I96 Y97 E302	G87-H93 PolarHBondContact O-NE2 3.09Å; N89-H93 PolarHBondContact O-CD2 3.41Å; T90-H93 WeakPolarHBondContact O-CB 3.42Å; T90-H93 PolarHBondContact O-N 3.1Å; H93-V95 VanDerWaalsContact C-N 3.27Å; H93-V95 PolarHBondContact O-N 3.28Å; H93-I96 PolarHBondContact O-N 2.85Å; H93-Y97 HydrophobicContact CB-CD2 3.85Å; H93-Y97 HydrophobicContact CB-CE2 3.83Å; H93-Y97 AromaticContact CG-CE2 3.97Å; H93-Y97 WeakPolarHBondContact O-CD2 3.47Å; H93-Y97 PolarHBondContact O-N 3.25Å; H93-E302 IonicContact CE1-OE1 2.62Å; H93-E302 IonicContact ND1-OE1 2.91Å; H93-E302 PolarHBondContact ND1-OE1 3.26Å
94	S	84.3	Confident	85.3	Confident	76 Å²	76	34.5 Å²	34.5	53%	0.531	21%	0.206	S	C	.	.	H	α-helix	trans	-56.5	-38.4	176.9	58.5	0	0	0	0	113.6	P91 D92 G98	P91-S94 PolarHBondContact O-OG 3.02Å; D92-S94 PolarHBondContact O-N 2.8Å; D92-S94 VanDerWaalsContact O-N 3.16Å; S94-G98 WeakPolarHBondContact O-CA 3.34Å; S94-G98 PolarHBondContact O-N 2.93Å; S94-G98 VanDerWaalsContact O-N 3.11Å
95	V	83.9	Confident	85.1	Confident	100 Å²	100	36.3 Å²	36.3	61%	0.606	22%	0.215	S	C	*	.	H	α-helix	trans	-79.9	-42.2	179.7	-177.8	0	0	0	0	110.4	D92 H93 G98 H99	D92-V95 PolarHBondContact O-N 2.78Å; H93-V95 VanDerWaalsContact C-N 3.27Å; H93-V95 PolarHBondContact O-N 3.28Å; V95-G98 PolarHBondContact O-N 3.43Å; V95-H99 PolarHBondContact O-N 3.25Å
96	I	85.1	Confident	84.8	Confident	12 Å²	12	41.6 Å²	41.6	6%	0.062	24%	0.239	C	C	.	.	H	α-helix	trans	-58.9	-59.1	178.8	-69.5	172.2	0	0	0	110.4	F48 D92 H93 G98 H99 L100	F48-I96 HydrophobicContact CE1-CG2 4.04Å; F48-I96 WeakPolarHBondContact CE2-O 3.36Å; F48-I96 HydrophobicContact CZ-CB 4.19Å; F48-I96 HydrophobicContact CZ-CG2 3.48Å; F48-I96 VanDerWaalsContact CZ-CG2 3.48Å; F48-I96 WeakPolarHBondContact CZ-O 3.46Å; D92-I96 HydrophobicContact CB-CD1 4.26Å; D92-I96 WeakPolarHBondContact O-CG1 3.32Å; D92-I96 PolarHBondContact O-N 2.76Å; D92-I96 VanDerWaalsContact O-N 3.14Å; H93-I96 PolarHBondContact O-N 2.85Å; I96-G98 VanDerWaalsContact C-N 3.31Å; I96-G98 PolarHBondContact O-N 2.88Å; I96-H99 PolarHBondContact O-N 3.27Å; I96-L100 PolarHBondContact O-N 3.45Å
97	Y	88.7	Confident	85	Confident	3 Å²	3	43.2 Å²	43.2	1%	0.012	25%	0.25	C	C	.	.	H	α-helix	trans	-71.9	-25.8	179.5	-64.5	-68.6	0	0	0	112.7	L84 H93 H99 L100 R101 I299 T301 G340	L84-Y97 HydrophobicContact CD2-CD1 4.43Å; L84-Y97 HydrophobicContact CD2-CE1 3.57Å; H93-Y97 HydrophobicContact CB-CD2 3.85Å; H93-Y97 HydrophobicContact CB-CE2 3.83Å; H93-Y97 AromaticContact CG-CE2 3.97Å; H93-Y97 WeakPolarHBondContact O-CD2 3.47Å; H93-Y97 PolarHBondContact O-N 3.25Å; Y97-H99 VanDerWaalsContact C-N 3.32Å; Y97-H99 PolarHBondContact O-N 2.93Å; Y97-L100 PolarHBondContact O-N 3.29Å; Y97-R101 VanDerWaalsContact O-CB 3.31Å; Y97-R101 WeakPolarHBondContact O-CB 3.39Å; Y97-R101 PolarHBondContact O-N 2.85Å; Y97-I299 HydrophobicContact CD1-CG2 3.47Å; Y97-I299 VanDerWaalsContact CD1-CG2 3.47Å; Y97-I299 HydrophobicContact CE1-CG2 3.87Å; Y97-I299 HydrophobicContact CG-CG2 4.06Å; Y97-T301 HydrophobicContact CD2-CG2 3.43Å; Y97-T301 VanDerWaalsContact CD2-CG2 3.43Å; Y97-T301 HydrophobicContact CE2-CG2 3.8Å; Y97-T301 HydrophobicContact CG-CG2 3.9Å; Y97-G340 WeakPolarHBondContact OH-CA 3.27Å
98	G	87.2	Confident	84.9	Confident	24 Å²	24	43.1 Å²	43.1	25%	0.247	25%	0.249	C	C	.	.	H	α-helix	trans	-61	-40.6	172.2	0	0	0	0	0	112.4	S94 V95 I96 R101 N102	S94-G98 WeakPolarHBondContact O-CA 3.34Å; S94-G98 PolarHBondContact O-N 2.93Å; S94-G98 VanDerWaalsContact O-N 3.11Å; V95-G98 PolarHBondContact O-N 3.43Å; I96-G98 VanDerWaalsContact C-N 3.31Å; I96-G98 PolarHBondContact O-N 2.88Å; G98-R101 PolarHBondContact O-N 3.41Å; G98-N102 VanDerWaalsContact O-CG 3.22Å; G98-N102 PolarHBondContact O-N 2.87Å; G98-N102 PolarHBondContact O-ND2 3.26Å
99	H	85.7	Confident	85	Confident	38 Å²	38	39 Å²	39	18%	0.176	22%	0.223	C	C	.	.	H	α-helix	trans	-65.2	-46.9	174.9	-173	78.7	0	0	0	111.9	F48 V95 I96 Y97 R101 N102 L103	F48-H99 HydrophobicContact CD2-CB 4.36Å; F48-H99 AromaticContact CD2-CD2 3.27Å; F48-H99 WeakPolarHBondContact CD2-CD2 3.19Å; F48-H99 HydrophobicContact CE2-CB 4.05Å; F48-H99 AromaticContact CE2-CD2 3.81Å; V95-H99 PolarHBondContact O-N 3.25Å; I96-H99 PolarHBondContact O-N 3.27Å; Y97-H99 VanDerWaalsContact C-N 3.32Å; Y97-H99 PolarHBondContact O-N 2.93Å; H99-R101 VanDerWaalsContact C-N 3.33Å; H99-R101 PolarHBondContact O-N 3.42Å; H99-N102 PolarHBondContact O-N 2.85Å; H99-L103 WeakPolarHBondContact O-CG 3.38Å; H99-L103 PolarHBondContact O-N 2.94Å; H99-L103 VanDerWaalsContact O-N 3.09Å
100	L	89.6	Confident	85.4	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.9	-41.5	176.1	-179.6	60.9	0	0	0	112.1	F48 V51 I96 Y97 N102 L103 I104 I299 V338	F48-L100 HydrophobicContact CB-CD1 4.41Å; F48-L100 HydrophobicContact CD1-CB 4.03Å; F48-L100 HydrophobicContact CD1-CD1 4.29Å; F48-L100 HydrophobicContact CD1-CD2 4.49Å; F48-L100 HydrophobicContact CE1-CB 4.21Å; F48-L100 HydrophobicContact CG-CB 4.48Å; V51-L100 HydrophobicContact CB-CD1 4.43Å; V51-L100 HydrophobicContact CG1-CD1 4.05Å; V51-L100 HydrophobicContact CG1-CD2 4.09Å; I96-L100 PolarHBondContact O-N 3.45Å; Y97-L100 PolarHBondContact O-N 3.29Å; L100-N102 PolarHBondContact O-N 2.72Å; L100-L103 PolarHBondContact O-N 3.38Å; L100-I104 HydrophobicContact CD1-CD1 4.07Å; L100-I104 HydrophobicContact CD1-CG1 4.42Å; L100-I104 HydrophobicContact CG-CD1 3.95Å; L100-I104 WeakPolarHBondContact O-CD1 3.17Å; L100-I104 WeakPolarHBondContact O-CG1 2.99Å; L100-I104 PolarHBondContact O-N 3.14Å; L100-I104 VanDerWaalsContact O-N 3.14Å; L100-I299 HydrophobicContact CD2-CD1 4.08Å; L100-I299 HydrophobicContact CG-CD1 4.36Å; L100-V338 HydrophobicContact CD2-CG1 4.13Å
101	R	90.9	Very high	86.2	Confident	68 Å²	68	37.1 Å²	37.1	26%	0.257	21%	0.21	S	C	.	.	H	α-helix	trans	-58.5	-47.1	175.5	177.7	177.2	-179.5	-94.7	3.3	111.1	Y97 G98 H99 L103 I104 L105 V111 V113 D137	Y97-R101 VanDerWaalsContact O-CB 3.31Å; Y97-R101 WeakPolarHBondContact O-CB 3.39Å; Y97-R101 PolarHBondContact O-N 2.85Å; G98-R101 PolarHBondContact O-N 3.41Å; H99-R101 VanDerWaalsContact C-N 3.33Å; H99-R101 PolarHBondContact O-N 3.42Å; R101-L103 PolarHBondContact O-N 2.8Å; R101-I104 PolarHBondContact O-N 3.27Å; R101-L105 HydrophobicContact CG-CD1 3.84Å; R101-L105 HydrophobicContact CG-CG 4.3Å; R101-L105 VanDerWaalsContact O-CG 3.31Å; R101-L105 WeakPolarHBondContact O-CG 3.33Å; R101-L105 PolarHBondContact O-N 3.06Å; R101-V111 HydrophobicContact CB-CG1 4.45Å; R101-V111 HydrophobicContact CG-CB 4.21Å; R101-V111 HydrophobicContact CG-CG1 4.19Å; R101-V113 HydrophobicContact CB-CG2 4.44Å; R101-V113 HydrophobicContact CG-CG2 4.46Å; R101-D137 IonicContact CZ-OD1 3.59Å; R101-D137 IonicContact NH2-OD1 3.62Å; R101-D137 PolarHBondContact NH2-OD1 3Å; R101-D137 IonicContact NH2-OD2 3.59Å
102	N	88.6	Confident	87	Confident	79 Å²	79	35 Å²	35	42%	0.422	20%	0.197	S	C	.	.	H	α-helix	trans	-62.7	-42.8	-179.9	-68.2	-15.1	0	0	0	111.7	G98 H99 L100 I104 L105 E106	G98-N102 VanDerWaalsContact O-CG 3.22Å; G98-N102 PolarHBondContact O-N 2.87Å; G98-N102 PolarHBondContact O-ND2 3.26Å; H99-N102 PolarHBondContact O-N 2.85Å; L100-N102 PolarHBondContact O-N 2.72Å; N102-I104 VanDerWaalsContact C-N 3.32Å; N102-I104 PolarHBondContact O-N 2.91Å; N102-L105 PolarHBondContact O-N 3.34Å; N102-E106 WeakPolarHBondContact O-CB 3.45Å; N102-E106 VanDerWaalsContact O-CG 3.26Å; N102-E106 WeakPolarHBondContact O-CG 3.42Å; N102-E106 PolarHBondContact O-N 3.03Å
103	L	87.6	Confident	87.3	Confident	40 Å²	40	35.4 Å²	35.4	21%	0.209	20%	0.2	C	C	.	.	H	α-helix	trans	-58.2	-42	175.9	-70.7	172.7	0	0	0	112.6	F48 H99 L100 R101 S107	F48-L103 HydrophobicContact CB-CD1 3.81Å; H99-L103 WeakPolarHBondContact O-CG 3.38Å; H99-L103 PolarHBondContact O-N 2.94Å; H99-L103 VanDerWaalsContact O-N 3.09Å; L100-L103 PolarHBondContact O-N 3.38Å; R101-L103 PolarHBondContact O-N 2.8Å; L103-S107 PolarHBondContact O-N 3.41Å
104	I	89.1	Confident	87.7	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-73	-36.1	179.4	-60.8	160.1	0	0	0	111.6	F52 I55 L100 R101 N102 S107 G108 G109 V111 V297	F52-I104 HydrophobicContact CD2-CG1 4.21Å; I55-I104 HydrophobicContact CD1-CD1 4Å; I55-I104 HydrophobicContact CD1-CG1 4.48Å; L100-I104 HydrophobicContact CD1-CD1 4.07Å; L100-I104 HydrophobicContact CD1-CG1 4.42Å; L100-I104 HydrophobicContact CG-CD1 3.95Å; L100-I104 WeakPolarHBondContact O-CD1 3.17Å; L100-I104 WeakPolarHBondContact O-CG1 2.99Å; L100-I104 PolarHBondContact O-N 3.14Å; L100-I104 VanDerWaalsContact O-N 3.14Å; R101-I104 PolarHBondContact O-N 3.27Å; N102-I104 VanDerWaalsContact C-N 3.32Å; N102-I104 PolarHBondContact O-N 2.91Å; I104-S107 PolarHBondContact O-N 3Å; I104-S107 PolarHBondContact O-OG 3.25Å; I104-G108 PolarHBondContact O-N 3.17Å; I104-G109 WeakPolarHBondContact O-CA 3.15Å; I104-G109 PolarHBondContact O-N 3.17Å; I104-V111 HydrophobicContact CB-CG2 3.57Å; I104-V111 HydrophobicContact CD1-CG2 3.97Å; I104-V111 HydrophobicContact CG1-CG2 4.39Å; I104-V111 HydrophobicContact CG2-CG2 3.3Å; I104-V297 HydrophobicContact CD1-CB 4.34Å; I104-V297 HydrophobicContact CD1-CG1 4.07Å; I104-V297 HydrophobicContact CD1-CG2 4.25Å; I104-V297 HydrophobicContact CG2-CG2 4.09Å
105	L	88.4	Confident	87.7	Confident	38 Å²	38	35.3 Å²	35.3	20%	0.199	20%	0.199	C	C	.	.	H	α-helix	trans	-67.6	-38.4	176	-72.2	173.9	0	0	0	111.7	R101 N102 S107 G108	R101-L105 HydrophobicContact CG-CD1 3.84Å; R101-L105 HydrophobicContact CG-CG 4.3Å; R101-L105 VanDerWaalsContact O-CG 3.31Å; R101-L105 WeakPolarHBondContact O-CG 3.33Å; R101-L105 PolarHBondContact O-N 3.06Å; N102-L105 PolarHBondContact O-N 3.34Å; L105-S107 VanDerWaalsContact C-N 3.26Å; L105-S107 PolarHBondContact O-N 3.01Å; L105-G108 WeakPolarHBondContact O-CA 3.35Å; L105-G108 PolarHBondContact O-N 3.5Å
106	E	86.9	Confident	87.3	Confident	158 Å²	158	33.4 Å²	33.4	74%	0.738	19%	0.189	S	C	*	.	H	α-helix	trans	-61.3	-33.4	175.5	-76.2	170.1	-169.2	0	0	112.1	N102 G108	N102-E106 WeakPolarHBondContact O-CB 3.45Å; N102-E106 VanDerWaalsContact O-CG 3.26Å; N102-E106 WeakPolarHBondContact O-CG 3.42Å; N102-E106 PolarHBondContact O-N 3.03Å; E106-G108 PolarHBondContact O-N 3.48Å
107	S	83	Confident	87	Confident	39 Å²	39	36.7 Å²	36.7	27%	0.273	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	1.9	173.7	76.5	0	0	0	0	114.3	F52 L103 I104 L105 R294	F52-S107 WeakPolarHBondContact CE2-OG 3.47Å; F52-S107 VanDerWaalsContact CZ-CB 3.49Å; L103-S107 PolarHBondContact O-N 3.41Å; I104-S107 PolarHBondContact O-N 3Å; I104-S107 PolarHBondContact O-OG 3.25Å; L105-S107 VanDerWaalsContact C-N 3.26Å; L105-S107 PolarHBondContact O-N 3.01Å; S107-R294 PolarHBondContact O-NH1 2.93Å
108	G	79.4	Confident	86.8	Confident	19 Å²	19	38.1 Å²	38.1	20%	0.196	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.9	15.3	-178.3	0	0	0	0	0	115.1	I104 L105 E106 R294	I104-G108 PolarHBondContact O-N 3.17Å; L105-G108 WeakPolarHBondContact O-CA 3.35Å; L105-G108 PolarHBondContact O-N 3.5Å; E106-G108 PolarHBondContact O-N 3.48Å; G108-R294 VanDerWaalsContact O-CB 3.26Å; G108-R294 WeakPolarHBondContact O-CB 3.43Å; G108-R294 WeakPolarHBondContact O-CG 3.37Å
109	G	84.5	Confident	86.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.25	C	S	.	.			trans	-74.3	168.8	171.2	0	0	0	0	0	112.8	I104	I104-G109 WeakPolarHBondContact O-CA 3.15Å; I104-G109 PolarHBondContact O-N 3.17Å
110	H	89.7	Confident	86.8	Confident	23 Å²	23	40.4 Å²	40.4	11%	0.106	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	136.3	173.5	-60	-71.3	0	0	0	110.2	L134 W187 P295 L296 V297	H110-L134 HydrophobicContact CB-CD2 3.96Å; H110-W187 AromaticContact CD2-CH2 3.73Å; H110-W187 AromaticContact CE1-CH2 3.7Å; H110-W187 AromaticContact CG-CH2 3.91Å; H110-W187 AromaticContact ND1-CH2 3.88Å; H110-W187 AromaticContact NE2-CH2 3.6Å; H110-P295 PolarHBondContact N-O 3.04Å; H110-L296 HydrophobicContact CB-CD2 3.82Å; H110-V297 PolarHBondContact O-N 3.32Å
111	V	92.4	Very high	86.8	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	118.9	-170.7	-172.3	0	0	0	0	112.2	R101 I104 V113 D137 V297 I299	R101-V111 HydrophobicContact CB-CG1 4.45Å; R101-V111 HydrophobicContact CG-CB 4.21Å; R101-V111 HydrophobicContact CG-CG1 4.19Å; I104-V111 HydrophobicContact CB-CG2 3.57Å; I104-V111 HydrophobicContact CD1-CG2 3.97Å; I104-V111 HydrophobicContact CG1-CG2 4.39Å; I104-V111 HydrophobicContact CG2-CG2 3.3Å; V111-V113 HydrophobicContact CG1-CG2 3.87Å; V111-D137 PolarHBondContact N-OD2 2.86Å; V111-V297 WeakPolarHBondContact CA-O 3.44Å; V111-V297 HydrophobicContact CG2-CB 4.34Å; V111-I299 HydrophobicContact CG1-CD1 3.63Å; V111-I299 HydrophobicContact CG1-CG1 3.87Å
112	A	92.8	Very high	86.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129.6	164.2	0	0	0	0	0	110.4	V130 Q133 L134 V297 I299	A112-V130 HydrophobicContact CB-CB 4.39Å; A112-V130 HydrophobicContact CB-CG1 3.97Å; A112-Q133 HydrophobicContact CB-CB 4.01Å; A112-L134 HydrophobicContact CB-CD2 4.08Å; A112-L134 HydrophobicContact CB-CG 3.98Å; A112-V297 PolarHBondContact N-O 3.08Å; A112-I299 PolarHBondContact O-N 3.13Å
113	V	92.1	Very high	87.1	Confident	22 Å²	22	42 Å²	42	13%	0.133	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	109.4	174.7	-172.8	0	0	0	0	109.8	R101 V111 S115 Q133 I299 T301	R101-V113 HydrophobicContact CB-CG2 4.44Å; R101-V113 HydrophobicContact CG-CG2 4.46Å; V111-V113 HydrophobicContact CG1-CG2 3.87Å; V113-S115 PolarHBondContact O-N 3.36Å; V113-Q133 PolarHBondContact O-NE2 2.99Å; V113-Q133 VanDerWaalsContact O-NE2 3.16Å; V113-Q133 PolarHBondContact O-OE1 3.16Å; V113-Q133 VanDerWaalsContact O-OE1 3.08Å; V113-I299 HydrophobicContact CG1-CB 4.44Å; V113-I299 HydrophobicContact CG1-CG2 4.46Å; V113-I299 HydrophobicContact CG2-CB 4.23Å; V113-I299 HydrophobicContact CG2-CD1 4.12Å; V113-I299 HydrophobicContact CG2-CG1 4.41Å; V113-T301 HydrophobicContact CG1-CG2 3.77Å
114	V	91.4	Very high	87.3	Confident	7 Å²	7	48.3 Å²	48.3	4%	0.042	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	105	175.4	-176.3	0	0	0	0	108.6	A118 T120 L126 V130 I299 L300 T301	V114-A118 HydrophobicContact CG1-CB 4.05Å; V114-T120 HydrophobicContact CG1-CG2 3.87Å; V114-L126 HydrophobicContact CG1-CD1 4.31Å; V114-L126 HydrophobicContact CG2-CD1 4.18Å; V114-V130 HydrophobicContact CG2-CG2 3.91Å; V114-I299 PolarHBondContact N-O 3.31Å; V114-L300 HydrophobicContact CB-CD2 3.75Å; V114-L300 HydrophobicContact CG1-CD2 4.4Å; V114-L300 HydrophobicContact CG2-CD2 3.61Å; V114-T301 PolarHBondContact O-N 2.92Å; V114-T301 PolarHBondContact O-OG1 3.45Å; V114-T301 VanDerWaalsContact O-OG1 3.06Å
115	S	84.7	Confident	87.4	Confident	70 Å²	70	49.3 Å²	49.3	49%	0.49	30%	0.296	S	S	.	.			trans	-73.8	154.2	-179.5	-65	0	0	0	0	112.5	V113 G117 A118	V113-S115 PolarHBondContact O-N 3.36Å; S115-G117 PolarHBondContact O-N 2.8Å; S115-A118 WeakPolarHBondContact O-CB 3.19Å; S115-A118 PolarHBondContact O-N 3.18Å; S115-A118 VanDerWaalsContact O-N 3.16Å
116	P	74.8	Confident	87.5	Confident	60 Å²	60	47.5 Å²	47.5	39%	0.39	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	127.5	176.2	30.2	-32.3	0	0	0	109.8	T301 E302	P116-T301 WeakPolarHBondContact CD-OG1 3.46Å; P116-E302 HydrophobicContact CB-CB 4.39Å; P116-E302 VanDerWaalsContact CB-CD 3.41Å; P116-E302 HydrophobicContact CB-CG 4.24Å; P116-E302 WeakPolarHBondContact CB-OE1 3.38Å; P116-E302 WeakPolarHBondContact CB-OE2 3.3Å; P116-E302 WeakPolarHBondContact CG-OE1 3.4Å
117	G	79.9	Confident	87.8	Confident	80 Å²	80	40.4 Å²	40.4	83%	0.825	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.6	-2.5	-174	0	0	0	0	0	115.4	S115	S115-G117 PolarHBondContact O-N 2.8Å
118	A	84.7	Confident	88.2	Confident	33 Å²	33	39.7 Å²	39.7	27%	0.273	25%	0.25	S	S	.	.	S	Bend	trans	-62.3	153.7	167.7	0	0	0	0	0	111.2	V114 S115 T120 L129	V114-A118 HydrophobicContact CG1-CB 4.05Å; S115-A118 WeakPolarHBondContact O-CB 3.19Å; S115-A118 PolarHBondContact O-N 3.18Å; S115-A118 VanDerWaalsContact O-N 3.16Å; A118-T120 VanDerWaalsContact C-N 3.34Å; A118-T120 HydrophobicContact CB-CG2 4.49Å; A118-T120 PolarHBondContact O-N 3.36Å; A118-L129 HydrophobicContact CB-CD1 4.17Å
119	N	85.8	Confident	88.7	Confident	96 Å²	96	41 Å²	41	51%	0.513	25%	0.253	S	S	.	.			trans	-74	84.4	-178.6	-174.3	4.5	0	0	0	112	T121 S125	N119-T121 WeakPolarHBondContact OD1-CB 3.48Å; N119-T121 WeakPolarHBondContact OD1-CG2 3.49Å; N119-T121 PolarHBondContact OD1-N 3.41Å; N119-T121 PolarHBondContact OD1-OG1 3.01Å; N119-S125 VanDerWaalsContact O-CB 3.28Å; N119-S125 WeakPolarHBondContact O-CB 3.43Å; N119-S125 PolarHBondContact O-OG 2.87Å
120	T	87	Confident	89	Confident	14 Å²	14	41 Å²	41	9%	0.086	25%	0.253	C	S	.	.			trans	-101.2	27.3	177.3	63.2	0	0	0	0	112.5	V114 A118 S122 L126 I306 P307	V114-T120 HydrophobicContact CG1-CG2 3.87Å; A118-T120 VanDerWaalsContact C-N 3.34Å; A118-T120 HydrophobicContact CB-CG2 4.49Å; A118-T120 PolarHBondContact O-N 3.36Å; T120-S122 VanDerWaalsContact C-N 3.29Å; T120-S122 PolarHBondContact O-N 3.36Å; T120-L126 HydrophobicContact CG2-CD1 3.94Å; T120-I306 HydrophobicContact CG2-CG1 4.26Å; T120-P307 WeakPolarHBondContact O-CD 3.48Å
121	T	89.5	Confident	89.1	Confident	104 Å²	104	40 Å²	40	64%	0.638	25%	0.248	S	C	*	.	S	Bend	trans	-71.5	-23	-177.3	57.2	0	0	0	0	113.4	N119 V310	N119-T121 WeakPolarHBondContact OD1-CB 3.48Å; N119-T121 WeakPolarHBondContact OD1-CG2 3.49Å; N119-T121 PolarHBondContact OD1-N 3.41Å; N119-T121 PolarHBondContact OD1-OG1 3.01Å; T121-V310 WeakPolarHBondContact O-CG2 3.47Å
122	S	92.5	Very high	88.8	Confident	47 Å²	47	44.1 Å²	44.1	33%	0.329	27%	0.267	S	S	.	.	S	Bend	trans	-137.2	155.8	179	73.8	0	0	0	0	111.5	T120 R124 S125 L126	T120-S122 VanDerWaalsContact C-N 3.29Å; T120-S122 PolarHBondContact O-N 3.36Å; S122-R124 VanDerWaalsContact C-N 3.26Å; S122-R124 PolarHBondContact O-N 2.97Å; S122-S125 PolarHBondContact N-OG 2.79Å; S122-S125 PolarHBondContact O-N 3.47Å; S122-S125 PolarHBondContact O-OG 3.46Å; S122-S125 WeakPolarHBondContact OG-CB 3.43Å; S122-S125 PolarHBondContact OG-N 3.49Å; S122-S125 VanDerWaalsContact OG-N 3.1Å; S122-S125 PolarHBondContact OG-OG 3.35Å; S122-S125 VanDerWaalsContact OG-OG 3.06Å; S122-L126 PolarHBondContact O-N 2.95Å
123	V	92.5	Very high	88.6	Confident	30 Å²	30	47.1 Å²	47.1	18%	0.182	28%	0.281	C	S	.	.	H	α-helix	trans	-60.7	-39.8	175.4	-176.1	0	0	0	0	110.7	S125 L126 V127 V310 D313 L317	V123-S125 VanDerWaalsContact C-N 3.33Å; V123-S125 PolarHBondContact O-N 3.27Å; V123-L126 PolarHBondContact O-N 2.93Å; V123-V127 HydrophobicContact CG1-CG2 4.09Å; V123-V127 WeakPolarHBondContact O-CB 3.44Å; V123-V127 VanDerWaalsContact O-CG2 3.26Å; V123-V127 WeakPolarHBondContact O-CG2 3.16Å; V123-V127 PolarHBondContact O-N 3.2Å; V123-V310 HydrophobicContact CG2-CB 4.44Å; V123-V310 HydrophobicContact CG2-CG1 4.08Å; V123-D313 HydrophobicContact CG2-CB 3.47Å; V123-D313 VanDerWaalsContact CG2-CB 3.47Å; V123-L317 HydrophobicContact CG1-CD2 4.21Å
124	R	91.5	Very high	88.4	Confident	173 Å²	173	46 Å²	46	65%	0.653	28%	0.275	S	S	*	.	H	α-helix	trans	-58.4	-44.5	177.8	-177.1	-180	175.6	78.6	11.3	111.7	S122 A128 A176	S122-R124 VanDerWaalsContact C-N 3.26Å; S122-R124 PolarHBondContact O-N 2.97Å; R124-A128 WeakPolarHBondContact O-CB 3.27Å; R124-A128 PolarHBondContact O-N 2.97Å; R124-A176 PolarHBondContact NH2-O 3.12Å
125	S	91	Very high	88	Confident	21 Å²	21	46.9 Å²	46.9	15%	0.147	28%	0.279	C	S	.	.	H	α-helix	trans	-70.8	-41.4	179.9	63.4	0	0	0	0	111.8	N119 S122 V123 A128 L129	N119-S125 VanDerWaalsContact O-CB 3.28Å; N119-S125 WeakPolarHBondContact O-CB 3.43Å; N119-S125 PolarHBondContact O-OG 2.87Å; S122-S125 PolarHBondContact N-OG 2.79Å; S122-S125 PolarHBondContact O-N 3.47Å; S122-S125 PolarHBondContact O-OG 3.46Å; S122-S125 WeakPolarHBondContact OG-CB 3.43Å; S122-S125 PolarHBondContact OG-N 3.49Å; S122-S125 VanDerWaalsContact OG-N 3.1Å; S122-S125 PolarHBondContact OG-OG 3.35Å; S122-S125 VanDerWaalsContact OG-OG 3.06Å; V123-S125 VanDerWaalsContact C-N 3.33Å; V123-S125 PolarHBondContact O-N 3.27Å; S125-A128 PolarHBondContact O-N 3.39Å; S125-L129 VanDerWaalsContact O-CG 3.28Å; S125-L129 WeakPolarHBondContact O-CG 3.45Å; S125-L129 PolarHBondContact O-N 3.42Å
126	L	92.4	Very high	87.5	Confident	0 Å²	0	49 Å²	49	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61.8	-48.8	177.1	178.4	59.7	0	0	0	111.8	V114 T120 S122 V123 A128 L129 V130 L300 V310 F314	V114-L126 HydrophobicContact CG1-CD1 4.31Å; V114-L126 HydrophobicContact CG2-CD1 4.18Å; T120-L126 HydrophobicContact CG2-CD1 3.94Å; S122-L126 PolarHBondContact O-N 2.95Å; V123-L126 PolarHBondContact O-N 2.93Å; L126-A128 VanDerWaalsContact C-N 3.34Å; L126-A128 PolarHBondContact O-N 3.36Å; L126-L129 PolarHBondContact O-N 3.06Å; L126-V130 HydrophobicContact CD1-CG2 4.41Å; L126-V130 WeakPolarHBondContact O-CG2 3.44Å; L126-V130 PolarHBondContact O-N 3.32Å; L126-L300 HydrophobicContact CD1-CD2 4.44Å; L126-V310 HydrophobicContact CD2-CG1 4.13Å; L126-F314 HydrophobicContact CD2-CB 3.89Å; L126-F314 HydrophobicContact CD2-CD1 3.95Å; L126-F314 HydrophobicContact CD2-CD2 3.69Å; L126-F314 HydrophobicContact CD2-CE1 4.4Å; L126-F314 HydrophobicContact CD2-CE2 4.17Å; L126-F314 HydrophobicContact CD2-CG 3.56Å; L126-F314 HydrophobicContact CD2-CZ 4.5Å; L126-F314 HydrophobicContact CG-CD2 3.93Å; L126-F314 HydrophobicContact CG-CE2 4.04Å; L126-F314 HydrophobicContact CG-CG 4.31Å
127	V	92.4	Very high	86.9	Confident	10 Å²	10	46.7 Å²	46.7	6%	0.061	27%	0.269	C	S	.	.	H	α-helix	trans	-62.4	-43.5	177	173.8	0	0	0	0	110.9	V123 L129 V130 V131 Y181 F314 L317	V123-V127 HydrophobicContact CG1-CG2 4.09Å; V123-V127 WeakPolarHBondContact O-CB 3.44Å; V123-V127 VanDerWaalsContact O-CG2 3.26Å; V123-V127 WeakPolarHBondContact O-CG2 3.16Å; V123-V127 PolarHBondContact O-N 3.2Å; V127-L129 VanDerWaalsContact C-N 3.33Å; V127-L129 PolarHBondContact O-N 2.79Å; V127-V130 PolarHBondContact O-N 2.97Å; V127-V131 HydrophobicContact CG1-CG2 4.02Å; V127-V131 WeakPolarHBondContact O-CB 3.34Å; V127-V131 VanDerWaalsContact O-CG2 3.28Å; V127-V131 WeakPolarHBondContact O-CG2 3.39Å; V127-V131 PolarHBondContact O-N 3.2Å; V127-Y181 HydrophobicContact CB-CE2 4.33Å; V127-Y181 HydrophobicContact CG1-CD2 3.69Å; V127-Y181 HydrophobicContact CG1-CE2 3.67Å; V127-Y181 HydrophobicContact CG2-CD2 4.34Å; V127-Y181 HydrophobicContact CG2-CE2 3.69Å; V127-F314 HydrophobicContact CG2-CD2 3.8Å; V127-F314 HydrophobicContact CG2-CE2 3.98Å; V127-L317 HydrophobicContact CG2-CD2 3.95Å
128	A	90.7	Very high	85.6	Confident	23 Å²	23	44.3 Å²	44.3	19%	0.19	24%	0.24	C	C	.	.	H	α-helix	trans	-60.5	-43.8	179.5	0	0	0	0	0	112	R124 S125 L126 Q132	R124-A128 WeakPolarHBondContact O-CB 3.27Å; R124-A128 PolarHBondContact O-N 2.97Å; S125-A128 PolarHBondContact O-N 3.39Å; L126-A128 VanDerWaalsContact C-N 3.34Å; L126-A128 PolarHBondContact O-N 3.36Å; A128-Q132 VanDerWaalsContact O-CB 3.28Å; A128-Q132 WeakPolarHBondContact O-CB 3.33Å; A128-Q132 WeakPolarHBondContact O-CG 3.27Å; A128-Q132 PolarHBondContact O-N 3.03Å
129	L	90.1	Very high	83.2	Confident	48 Å²	48	46.7 Å²	46.7	25%	0.251	25%	0.254	S	S	.	.	H	α-helix	trans	-61.7	-47.1	176.6	-73.7	170	0	0	0	112.1	A118 S125 L126 V127 Q133	A118-L129 HydrophobicContact CB-CD1 4.17Å; S125-L129 VanDerWaalsContact O-CG 3.28Å; S125-L129 WeakPolarHBondContact O-CG 3.45Å; S125-L129 PolarHBondContact O-N 3.42Å; L126-L129 PolarHBondContact O-N 3.06Å; V127-L129 VanDerWaalsContact C-N 3.33Å; V127-L129 PolarHBondContact O-N 2.79Å; L129-Q133 WeakPolarHBondContact O-CG 3.37Å; L129-Q133 PolarHBondContact O-N 3.47Å; L129-Q133 VanDerWaalsContact O-N 3.13Å
130	V	91.9	Very high	81.1	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-49.3	179.3	168.6	0	0	0	0	110.9	A112 V114 L126 V127 Q132 Q133 L134 I298 F314	A112-V130 HydrophobicContact CB-CB 4.39Å; A112-V130 HydrophobicContact CB-CG1 3.97Å; V114-V130 HydrophobicContact CG2-CG2 3.91Å; L126-V130 HydrophobicContact CD1-CG2 4.41Å; L126-V130 WeakPolarHBondContact O-CG2 3.44Å; L126-V130 PolarHBondContact O-N 3.32Å; V127-V130 PolarHBondContact O-N 2.97Å; V130-Q132 PolarHBondContact O-N 3.41Å; V130-Q133 PolarHBondContact O-N 2.92Å; V130-L134 HydrophobicContact CG1-CD1 3.98Å; V130-L134 HydrophobicContact CG1-CG 4.5Å; V130-L134 WeakPolarHBondContact O-CG 3.27Å; V130-L134 PolarHBondContact O-N 3.16Å; V130-I298 HydrophobicContact CG1-CD1 3.68Å; V130-I298 HydrophobicContact CG1-CG1 3.78Å; V130-I298 HydrophobicContact CG1-CG2 4.31Å; V130-I298 HydrophobicContact CG2-CG2 4.06Å; V130-F314 HydrophobicContact CG2-CZ 4.34Å
131	V	90.4	Very high	78.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-66	-41.2	-177.5	174.5	0	0	0	0	111	V127 Q133 L134 L135 L184	V127-V131 HydrophobicContact CG1-CG2 4.02Å; V127-V131 WeakPolarHBondContact O-CB 3.34Å; V127-V131 VanDerWaalsContact O-CG2 3.28Å; V127-V131 WeakPolarHBondContact O-CG2 3.39Å; V127-V131 PolarHBondContact O-N 3.2Å; V131-Q133 PolarHBondContact O-N 3.11Å; V131-L134 PolarHBondContact O-N 2.86Å; V131-L135 HydrophobicContact CG1-CD1 3.77Å; V131-L135 HydrophobicContact CG1-CG 4.26Å; V131-L135 WeakPolarHBondContact O-CB 3.37Å; V131-L135 WeakPolarHBondContact O-CG 3.46Å; V131-L135 PolarHBondContact O-N 3.29Å; V131-L184 HydrophobicContact CG1-CB 4.29Å; V131-L184 HydrophobicContact CG2-CB 4.45Å; V131-L184 HydrophobicContact CG2-CD2 4.42Å
132	Q	87.3	Confident	76.1	Confident	88 Å²	88	52.3 Å²	52.3	41%	0.411	28%	0.278	S	S	.	.	H	α-helix	trans	-58.9	-46.5	176.1	-76.4	170.9	-2.7	0	0	111.8	A128 V130 L135 D136 S179	A128-Q132 VanDerWaalsContact O-CB 3.28Å; A128-Q132 WeakPolarHBondContact O-CB 3.33Å; A128-Q132 WeakPolarHBondContact O-CG 3.27Å; A128-Q132 PolarHBondContact O-N 3.03Å; V130-Q132 PolarHBondContact O-N 3.41Å; Q132-L135 PolarHBondContact O-N 3.4Å; Q132-D136 WeakPolarHBondContact O-CB 3.49Å; Q132-D136 PolarHBondContact O-N 3.04Å; Q132-S179 WeakPolarHBondContact CG-OG 3.41Å; Q132-S179 PolarHBondContact NE2-OG 2.99Å; Q132-S179 VanDerWaalsContact NE2-OG 3.07Å
133	Q	88.2	Confident	73.1	Confident	63 Å²	63	58.9 Å²	58.9	29%	0.294	30%	0.3	S	S	.	.	H	α-helix	trans	-65.4	-40.4	178.7	-70.3	-175.7	14.3	0	0	112.9	A112 V113 L129 V130 V131 L135 D136 D137	A112-Q133 HydrophobicContact CB-CB 4.01Å; V113-Q133 PolarHBondContact O-NE2 2.99Å; V113-Q133 VanDerWaalsContact O-NE2 3.16Å; V113-Q133 PolarHBondContact O-OE1 3.16Å; V113-Q133 VanDerWaalsContact O-OE1 3.08Å; L129-Q133 WeakPolarHBondContact O-CG 3.37Å; L129-Q133 PolarHBondContact O-N 3.47Å; L129-Q133 VanDerWaalsContact O-N 3.13Å; V130-Q133 PolarHBondContact O-N 2.92Å; V131-Q133 PolarHBondContact O-N 3.11Å; Q133-L135 VanDerWaalsContact C-N 3.29Å; Q133-L135 PolarHBondContact O-N 3.37Å; Q133-D136 PolarHBondContact O-N 3.48Å; Q133-D137 PolarHBondContact O-N 2.76Å; Q133-D137 VanDerWaalsContact O-N 3.12Å
134	L	86.8	Confident	70.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64	-35.2	176.7	-70.5	174.8	0	0	0	112.4	H110 A112 V130 V131 L184	H110-L134 HydrophobicContact CB-CD2 3.96Å; A112-L134 HydrophobicContact CB-CD2 4.08Å; A112-L134 HydrophobicContact CB-CG 3.98Å; V130-L134 HydrophobicContact CG1-CD1 3.98Å; V130-L134 HydrophobicContact CG1-CG 4.5Å; V130-L134 WeakPolarHBondContact O-CG 3.27Å; V130-L134 PolarHBondContact O-N 3.16Å; V131-L134 PolarHBondContact O-N 2.86Å; L134-L184 HydrophobicContact CB-CD1 4.1Å; L134-L184 HydrophobicContact CD1-CD1 4.1Å; L134-L184 HydrophobicContact CD1-CD2 3.93Å
135	L	83.2	Confident	67.1	Low	24 Å²	24	62.4 Å²	62.4	13%	0.126	34%	0.336	C	S	.	.	H	α-helix	trans	-72.8	-45.3	176.7	-68.5	170.7	0	0	0	111.5	V131 Q132 Q133 D137 S138 W187	V131-L135 HydrophobicContact CG1-CD1 3.77Å; V131-L135 HydrophobicContact CG1-CG 4.26Å; V131-L135 WeakPolarHBondContact O-CB 3.37Å; V131-L135 WeakPolarHBondContact O-CG 3.46Å; V131-L135 PolarHBondContact O-N 3.29Å; Q132-L135 PolarHBondContact O-N 3.4Å; Q133-L135 VanDerWaalsContact C-N 3.29Å; Q133-L135 PolarHBondContact O-N 3.37Å; L135-D137 PolarHBondContact O-N 3.14Å; L135-S138 PolarHBondContact O-N 3.39Å; L135-S138 PolarHBondContact O-OG 2.71Å; L135-W187 HydrophobicContact CD2-CB 3.73Å; L135-W187 HydrophobicContact CD2-CD2 3.6Å; L135-W187 HydrophobicContact CD2-CE3 4.21Å; L135-W187 HydrophobicContact CD2-CG 3.35Å
136	D	75.1	Confident	63.9	Low	116 Å²	116	72.3 Å²	72.3	62%	0.62	37%	0.371	S	S	*	.	H	α-helix	trans	-67.8	-31.2	-176.5	-77.4	-15	0	0	0	113.5	Q132 Q133 S138 C139	Q132-D136 WeakPolarHBondContact O-CB 3.49Å; Q132-D136 PolarHBondContact O-N 3.04Å; Q133-D136 PolarHBondContact O-N 3.48Å; D136-S138 PolarHBondContact O-N 3.12Å; D136-C139 WeakPolarHBondContact O-CB 3.47Å; D136-C139 PolarHBondContact O-N 3.08Å
137	D	62.1	Low	60.8	Low	10 Å²	10	80.6 Å²	80.6	5%	0.053	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-58.1	-18.5	-179.9	-97.6	0.6	0	0	0	113.5	R101 V111 Q133 L135 C139 H140	R101-D137 IonicContact CZ-OD1 3.59Å; R101-D137 IonicContact NH2-OD1 3.62Å; R101-D137 PolarHBondContact NH2-OD1 3Å; R101-D137 IonicContact NH2-OD2 3.59Å; V111-D137 PolarHBondContact N-OD2 2.86Å; Q133-D137 PolarHBondContact O-N 2.76Å; Q133-D137 VanDerWaalsContact O-N 3.12Å; L135-D137 PolarHBondContact O-N 3.14Å; D137-C139 PolarHBondContact O-N 2.53Å; D137-H140 PolarHBondContact O-N 2.94Å
138	S	51.5	Low	58	Low	30 Å²	30	86.8 Å²	86.8	21%	0.21	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-74.8	-6.7	175.9	56.9	0	0	0	0	114.9	L135 D136 Y167	L135-S138 PolarHBondContact O-N 3.39Å; L135-S138 PolarHBondContact O-OG 2.71Å; D136-S138 PolarHBondContact O-N 3.12Å; S138-Y167 PolarHBondContact OG-OH 2.84Å
139	C	35.3	Very low	55.1	Low	84 Å²	84	95.2 Å²	95.2	57%	0.568	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-83	-29.4	174	-160.7	0	0	0	0	113.1	D136 D137 S142	D136-C139 WeakPolarHBondContact O-CB 3.47Å; D136-C139 PolarHBondContact O-N 3.08Å; D137-C139 PolarHBondContact O-N 2.53Å; C139-S142 PolarHBondContact O-OG 3.44Å
140	H	41.2	Very low	52.2	Low	135 Å²	135	95.8 Å²	95.8	63%	0.625	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-82.2	-19.9	-173	-77	-64.7	0	0	0	115.3	D137 S142 K143	D137-H140 PolarHBondContact O-N 2.94Å; H140-S142 PolarHBondContact O-N 3.46Å; H140-K143 PolarHBondContact O-N 3.04Å
141	Q	40	Very low	49.1	Very low	112 Å²	112	100.9 Å²	100.9	52%	0.523	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-67.4	-6.1	179	-69.4	-178.3	-1.1	0	0	114.2
142	S	32.9	Very low	46.4	Very low	84 Å²	84	108.4 Å²	108.4	59%	0.587	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-106	-4.6	-179.4	69.2	0	0	0	0	115.7	C139 H140	C139-S142 PolarHBondContact O-OG 3.44Å; H140-S142 PolarHBondContact O-N 3.46Å
143	K	29.5	Very low	43.8	Very low	185 Å²	185	112.7 Å²	112.7	80%	0.804	60%	0.596	S	S	*	*			trans	-105.6	64.2	173.2	-72.1	-172	178.1	-177.6	0	110.6	H140 F145	H140-K143 PolarHBondContact O-N 3.04Å; K143-F145 PolarHBondContact O-N 2.92Å
144	G	28.1	Very low	41	Very low	63 Å²	63	116.7 Å²	116.7	65%	0.649	62%	0.619	S	S	*	*			trans	-67.5	124.4	161.4	0	0	0	0	0	109.5	R146	G144-R146 PolarHBondContact O-N 3.49Å
145	F	28.3	Very low	38.5	Very low	214 Å²	214	125 Å²	125	94%	0.939	66%	0.663	S	S	*	*	S	Bend	trans	31.2	82.4	158.5	-75.4	-90.9	0	0	0	117.2	K143	K143-F145 PolarHBondContact O-N 2.92Å
146	R	24.6	Very low	35.9	Very low	230 Å²	230	135.1 Å²	135.1	87%	0.868	70%	0.699	S	S	*	*			trans	-141.4	82.8	147.1	-85.7	-164.8	175.1	-150.6	-1	109.2	G144 D148	G144-R146 PolarHBondContact O-N 3.49Å; R146-D148 VanDerWaalsContact C-N 3.27Å; R146-D148 PolarHBondContact O-N 3.39Å
147	N	27.1	Very low	33.9	Very low	173 Å²	173	135.1 Å²	135.1	93%	0.925	70%	0.703	S	S	*	*			trans	-83.8	86.5	146.7	-72.5	-13.1	0	0	0	105.2
148	D	32.6	Very low	32.4	Very low	140 Å²	140	139.8 Å²	139.8	75%	0.749	73%	0.734	S	S	*	*			trans	-144.4	109.5	158.7	-135.3	0.8	0	0	0	106.4	R146 G150	R146-D148 VanDerWaalsContact C-N 3.27Å; R146-D148 PolarHBondContact O-N 3.39Å; D148-G150 PolarHBondContact O-N 3.01Å
149	E	30	Very low	31.5	Very low	201 Å²	201	143.7 Å²	143.7	94%	0.939	76%	0.761	S	S	*	*			trans	-69	113.2	164.8	-68.3	-156.6	155.2	0	0	107.2
150	G	29.1	Very low	31.4	Very low	59 Å²	59	144.7 Å²	144.7	61%	0.608	76%	0.758	S	S	*	*			trans	161.7	104.7	177	0	0	0	0	0	113	D148	D148-G150 PolarHBondContact O-N 3.01Å
151	S	28.4	Very low	31	Very low	107 Å²	107	145.3 Å²	145.3	75%	0.748	77%	0.766	S	S	*	*			trans	17	111.3	146.6	54	0	0	0	0	118.2
152	D	33.3	Very low	30.9	Very low	159 Å²	159	147.2 Å²	147.2	85%	0.85	78%	0.779	S	S	*	*				176.9	112.9	108.1	-95.5	-18.2	0	0	0	110.2	N154	D152-N154 PolarHBondContact O-N 3.46Å
153	E	31.7	Very low	31	Very low	177 Å²	177	150.4 Å²	150.4	83%	0.827	78%	0.782	S	S	*	*			trans	-69.7	121.5	159.2	-68.3	-159.4	149.4	0	0	108.1
154	N	30.5	Very low	31.4	Very low	147 Å²	147	147.4 Å²	147.4	79%	0.786	77%	0.771	S	S	*	*			trans	153.3	92.2	139.9	-78.9	-42.5	0	0	0	111	D152	D152-N154 PolarHBondContact O-N 3.46Å
155	L	33.7	Very low	31.9	Very low	175 Å²	175	147.8 Å²	147.8	92%	0.916	76%	0.763	S	S	*	*			trans	-177	90.5	147	-100.6	141.1	0	0	0	109
156	R	29.6	Very low	32.9	Very low	236 Å²	236	142 Å²	142	89%	0.891	74%	0.738	S	S	*	*			trans	-91.3	119.3	167.3	-91.7	-177.6	177.9	177.4	0.7	109.2
157	V	33.1	Very low	34.1	Very low	116 Å²	116	135.9 Å²	135.9	70%	0.703	72%	0.716	S	S	*	*			trans	-106.4	133.5	160.3	179.4	0	0	0	0	107.1	S159	V157-S159 PolarHBondContact O-N 3.3Å
158	P	30.5	Very low	35.2	Very low	108 Å²	108	131 Å²	131	70%	0.701	69%	0.692	S	S	*	*			trans	-85	119.1	-170.9	31.5	-29.8	0	0	0	111.7
159	S	31.3	Very low	36.4	Very low	112 Å²	112	127.4 Å²	127.4	78%	0.783	67%	0.673	S	S	*	*			trans	-126.2	40.1	165.3	-50.4	0	0	0	0	110.8	V157	V157-S159 PolarHBondContact O-N 3.3Å
160	Q	34.4	Very low	37.7	Very low	106 Å²	106	118.7 Å²	118.7	50%	0.495	63%	0.633	S	S	.	*			trans	-89.3	-17.5	-165.8	-84.4	176.5	-63.8	0	0	116.2	L162	Q160-L162 PolarHBondContact O-N 3.48Å
161	D	32	Very low	39.2	Very low	147 Å²	147	121.6 Å²	121.6	79%	0.786	63%	0.631	S	S	*	*	H	α-helix	trans	-74	-21.6	-162.1	-63.1	-29.2	0	0	0	116.6
162	L	37.4	Very low	40.7	Very low	153 Å²	153	123 Å²	123	80%	0.801	63%	0.63	S	S	*	*	H	α-helix	trans	-92.6	-22	-179.5	-95.6	116.2	0	0	0	114.8	Q160	Q160-L162 PolarHBondContact O-N 3.48Å
163	K	36.6	Very low	42.2	Very low	150 Å²	150	117.4 Å²	117.4	65%	0.652	60%	0.598	S	S	*	*	H	α-helix	trans	-84.9	-32.5	-175.5	-76.7	-178.6	178.7	177.8	0	112.3	S165 Y167	K163-S165 VanDerWaalsContact C-N 3.32Å; K163-S165 PolarHBondContact O-N 3.33Å; K163-Y167 WeakPolarHBondContact O-CD2 3.41Å
164	E	36.8	Very low	44.1	Very low	123 Å²	123	112.9 Å²	112.9	58%	0.575	58%	0.582	S	S	*	*	H	α-helix	trans	-65.2	-36.4	176.9	-76	-179.2	168.2	0	0	111.9	K166 Y167 T168	E164-K166 VanDerWaalsContact C-N 3.34Å; E164-K166 PolarHBondContact O-N 3.43Å; E164-Y167 PolarHBondContact O-N 2.83Å; E164-T168 PolarHBondContact O-N 3.46Å; E164-T168 PolarHBondContact O-OG1 2.85Å
165	S	38.3	Very low	45.9	Very low	70 Å²	70	110.8 Å²	110.8	49%	0.49	58%	0.577	S	S	.	*	H	α-helix	trans	-63.9	-30.8	-175.6	-162.7	0	0	0	0	114.7	K163 T168	K163-S165 VanDerWaalsContact C-N 3.32Å; K163-S165 PolarHBondContact O-N 3.33Å; S165-T168 VanDerWaalsContact C-OG1 3.31Å; S165-T168 VanDerWaalsContact CA-OG1 3.25Å; S165-T168 WeakPolarHBondContact CA-OG1 3.26Å; S165-T168 PolarHBondContact O-OG1 3.29Å
166	K	49.7	Very low	47.4	Very low	93 Å²	93	105.1 Å²	105.1	40%	0.404	56%	0.555	S	S	.	*	H	α-helix	trans	-70.4	-34.5	-179.7	-70.6	-163.5	175.4	-175.2	0	112.7	E164 S190	E164-K166 VanDerWaalsContact C-N 3.34Å; E164-K166 PolarHBondContact O-N 3.43Å; K166-S190 WeakPolarHBondContact CG-OG 3.49Å
167	Y	49.7	Very low	49.5	Very low	102 Å²	102	96.3 Å²	96.3	40%	0.4	53%	0.528	S	S	.	.	H	α-helix	trans	-84.3	-31.6	-177.6	-71.9	-84.8	0	0	0	112.2	S138 K163 E164 L169 V170 Q171	S138-Y167 PolarHBondContact OG-OH 2.84Å; K163-Y167 WeakPolarHBondContact O-CD2 3.41Å; E164-Y167 PolarHBondContact O-N 2.83Å; Y167-L169 VanDerWaalsContact C-N 3.34Å; Y167-L169 PolarHBondContact O-N 3.46Å; Y167-V170 PolarHBondContact O-N 3.42Å; Y167-Q171 WeakPolarHBondContact O-CG 3.3Å; Y167-Q171 PolarHBondContact O-N 3.3Å; Y167-Q171 VanDerWaalsContact O-N 3.1Å
168	T	50.4	Low	51.6	Low	70 Å²	70	95.5 Å²	95.5	43%	0.429	51%	0.512	S	S	.	.	H	α-helix	trans	-60.4	-37.4	176.9	25.7	0	0	0	0	113.6	E164 S165 Q171	E164-T168 PolarHBondContact O-N 3.46Å; E164-T168 PolarHBondContact O-OG1 2.85Å; S165-T168 VanDerWaalsContact C-OG1 3.31Å; S165-T168 VanDerWaalsContact CA-OG1 3.25Å; S165-T168 WeakPolarHBondContact CA-OG1 3.26Å; S165-T168 PolarHBondContact O-OG1 3.29Å; T168-Q171 PolarHBondContact O-N 3.09Å
169	L	57	Low	54	Low	65 Å²	65	91.4 Å²	91.4	34%	0.34	49%	0.486	S	S	.	.	H	α-helix	trans	-69.6	-35.2	179.2	-113.1	113.8	0	0	0	112.8	Y167 N172	Y167-L169 VanDerWaalsContact C-N 3.34Å; Y167-L169 PolarHBondContact O-N 3.46Å; L169-N172 PolarHBondContact O-N 3.48Å
170	V	58.8	Low	56.7	Low	18 Å²	18	87.6 Å²	87.6	11%	0.109	46%	0.459	C	S	.	.	H	α-helix	trans	-74.3	-30.6	178	-177.2	0	0	0	0	111.2	Y167 N172 F173 W187	Y167-V170 PolarHBondContact O-N 3.42Å; V170-N172 PolarHBondContact O-N 3.35Å; V170-F173 PolarHBondContact O-N 3.44Å; V170-W187 HydrophobicContact CG2-CB 3.85Å; V170-W187 HydrophobicContact CG2-CG 4.44Å
171	Q	59.4	Low	59.2	Low	119 Å²	119	82.7 Å²	82.7	56%	0.556	44%	0.436	S	S	*	.	H	α-helix	trans	-65.3	-22.6	176.7	-75.4	178.9	5.4	0	0	113.5	Y167 T168 F173 R178	Y167-Q171 WeakPolarHBondContact O-CG 3.3Å; Y167-Q171 PolarHBondContact O-N 3.3Å; Y167-Q171 VanDerWaalsContact O-N 3.1Å; T168-Q171 PolarHBondContact O-N 3.09Å; Q171-F173 PolarHBondContact O-N 2.95Å; Q171-R178 PolarHBondContact O-NH2 3.49Å
172	N	61.2	Low	61.7	Low	136 Å²	136	79.1 Å²	79.1	73%	0.727	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-15.8	176	-66.5	-20.5	0	0	0	113.6	L169 V170	L169-N172 PolarHBondContact O-N 3.48Å; V170-N172 PolarHBondContact O-N 3.35Å
173	F	64.9	Low	64	Low	43 Å²	43	71.9 Å²	71.9	19%	0.189	38%	0.379	C	S	.	.	S	Bend	trans	-78.6	144.5	174	-72.8	-83.1	0	0	0	111.1	V170 Q171 T177 R178 L182 A183 E186	V170-F173 PolarHBondContact O-N 3.44Å; Q171-F173 PolarHBondContact O-N 2.95Å; F173-T177 WeakPolarHBondContact CB-OG1 3.45Å; F173-R178 HydrophobicContact CB-CG 3.73Å; F173-R178 WeakPolarHBondContact O-CG 3.28Å; F173-R178 PolarHBondContact O-NE 2.85Å; F173-L182 HydrophobicContact CE1-CD2 3.97Å; F173-L182 HydrophobicContact CE1-CG 4.45Å; F173-A183 HydrophobicContact CD2-CB 4.4Å; F173-E186 HydrophobicContact CE2-CB 4.31Å; F173-E186 HydrophobicContact CE2-CG 4.05Å; F173-E186 HydrophobicContact CZ-CG 3.93Å
174	T	70.7	Confident	66.4	Low	81 Å²	81	64.8 Å²	64.8	50%	0.497	35%	0.348	S	S	.	.			trans	-62	153.4	171.4	65	0	0	0	0	109.6	A176 T177 R178	T174-A176 PolarHBondContact O-N 2.98Å; T174-T177 PolarHBondContact N-OG1 3.21Å; T174-T177 VanDerWaalsContact N-OG1 3.13Å; T174-T177 PolarHBondContact O-N 3.26Å; T174-T177 PolarHBondContact O-OG1 3.3Å; T174-T177 PolarHBondContact OG1-OG1 3.11Å; T174-T177 VanDerWaalsContact OG1-OG1 3.04Å; T174-R178 WeakPolarHBondContact O-CG 3.46Å; T174-R178 PolarHBondContact O-N 3.33Å
175	P	67.9	Low	68.6	Low	104 Å²	104	59.5 Å²	59.5	68%	0.675	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-31.6	179.1	-26.5	33.5	0	0	0	113.3
176	A	65.8	Low	70.7	Confident	55 Å²	55	58.1 Å²	58.1	46%	0.455	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-22.6	178.6	0	0	0	0	0	114.9	R124 T174	R124-A176 PolarHBondContact NH2-O 3.12Å; T174-A176 PolarHBondContact O-N 2.98Å
177	T	73.2	Confident	72.3	Confident	52 Å²	52	54.5 Å²	54.5	32%	0.319	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-15	179.9	54.9	0	0	0	0	113.4	F173 T174 S179 S180 A183	F173-T177 WeakPolarHBondContact CB-OG1 3.45Å; T174-T177 PolarHBondContact N-OG1 3.21Å; T174-T177 VanDerWaalsContact N-OG1 3.13Å; T174-T177 PolarHBondContact O-N 3.26Å; T174-T177 PolarHBondContact O-OG1 3.3Å; T174-T177 PolarHBondContact OG1-OG1 3.11Å; T174-T177 VanDerWaalsContact OG1-OG1 3.04Å; T177-S179 PolarHBondContact O-N 2.58Å; T177-S180 VanDerWaalsContact O-CB 3.31Å; T177-S180 WeakPolarHBondContact O-CB 3.48Å; T177-S180 PolarHBondContact O-N 3.11Å; T177-S180 VanDerWaalsContact O-N 3.15Å; T177-S180 PolarHBondContact O-OG 2.96Å; T177-A183 WeakPolarHBondContact O-CB 3.31Å
178	R	78	Confident	73.9	Confident	99 Å²	99	50.5 Å²	50.5	37%	0.374	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-30	173.6	-77.3	178.6	-171	179.1	-1.7	113.7	Q171 F173 T174 A183	Q171-R178 PolarHBondContact O-NH2 3.49Å; F173-R178 HydrophobicContact CB-CG 3.73Å; F173-R178 WeakPolarHBondContact O-CG 3.28Å; F173-R178 PolarHBondContact O-NE 2.85Å; T174-R178 WeakPolarHBondContact O-CG 3.46Å; T174-R178 PolarHBondContact O-N 3.33Å; R178-A183 WeakPolarHBondContact O-CB 3.42Å
179	S	81.2	Confident	75.4	Confident	21 Å²	21	47.8 Å²	47.8	15%	0.147	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	34.5	179.4	-45	0	0	0	0	112.4	Q132 T177	Q132-S179 WeakPolarHBondContact CG-OG 3.41Å; Q132-S179 PolarHBondContact NE2-OG 2.99Å; Q132-S179 VanDerWaalsContact NE2-OG 3.07Å; T177-S179 PolarHBondContact O-N 2.58Å
180	S	87.4	Confident	76.2	Confident	32 Å²	32	46.7 Å²	46.7	22%	0.224	26%	0.258	C	S	.	.	S	Bend	trans	-107.6	157.1	175.9	71.1	0	0	0	0	111.3	T177 L182 A183 L184	T177-S180 VanDerWaalsContact O-CB 3.31Å; T177-S180 WeakPolarHBondContact O-CB 3.48Å; T177-S180 PolarHBondContact O-N 3.11Å; T177-S180 VanDerWaalsContact O-N 3.15Å; T177-S180 PolarHBondContact O-OG 2.96Å; S180-L182 PolarHBondContact O-N 2.89Å; S180-A183 WeakPolarHBondContact O-CB 3.43Å; S180-A183 PolarHBondContact O-N 3.41Å; S180-A183 PolarHBondContact OG-N 2.87Å; S180-L184 PolarHBondContact O-N 2.98Å; S180-L184 VanDerWaalsContact O-N 3.11Å
181	Y	87.3	Confident	76.1	Confident	3 Å²	3	48.1 Å²	48.1	1%	0.012	28%	0.276	C	S	.	.	H	α-helix	trans	-57.9	-27.3	173	-81.6	-73.3	0	0	0	113.3	V127 L184 I185 F314 L317 T318 Y321 L333 I335	V127-Y181 HydrophobicContact CB-CE2 4.33Å; V127-Y181 HydrophobicContact CG1-CD2 3.69Å; V127-Y181 HydrophobicContact CG1-CE2 3.67Å; V127-Y181 HydrophobicContact CG2-CD2 4.34Å; V127-Y181 HydrophobicContact CG2-CE2 3.69Å; Y181-L184 HydrophobicContact CD1-CD2 3.97Å; Y181-L184 HydrophobicContact CE1-CD2 4.24Å; Y181-L184 WeakPolarHBondContact O-CB 3.47Å; Y181-L184 PolarHBondContact O-N 3.38Å; Y181-I185 WeakPolarHBondContact O-CG1 3.18Å; Y181-I185 PolarHBondContact O-N 2.88Å; Y181-F314 VanDerWaalsContact OH-CE2 3.23Å; Y181-F314 WeakPolarHBondContact OH-CE2 3.42Å; Y181-L317 HydrophobicContact CD2-CD2 3.97Å; Y181-L317 HydrophobicContact CD2-CG 4.19Å; Y181-L317 HydrophobicContact CE2-CD2 3.93Å; Y181-L317 HydrophobicContact CE2-CG 4.2Å; Y181-T318 PolarHBondContact OH-OG1 2.98Å; Y181-Y321 VanDerWaalsContact CB-CE1 3.42Å; Y181-Y321 VanDerWaalsContact CB-CE2 3.47Å; Y181-Y321 HydrophobicContact CD1-CD2 4.2Å; Y181-Y321 HydrophobicContact CD1-CG 4.21Å; Y181-Y321 AromaticContact CD2-CD2 3.88Å; Y181-Y321 HydrophobicContact CD2-CD2 3.88Å; Y181-Y321 AromaticContact CD2-CE2 3.84Å; Y181-Y321 HydrophobicContact CD2-CE2 3.84Å; Y181-Y321 HydrophobicContact CG-CD1 4.35Å; Y181-Y321 AromaticContact CG-CD2 3.68Å; Y181-Y321 HydrophobicContact CG-CD2 3.68Å; Y181-Y321 HydrophobicContact CG-CE1 4.43Å; Y181-Y321 AromaticContact CG-CE2 3.8Å; Y181-Y321 HydrophobicContact CG-CE2 3.8Å; Y181-Y321 HydrophobicContact CG-CG 4.02Å; Y181-L333 HydrophobicContact CD1-CD1 4.29Å; Y181-I335 HydrophobicContact CD1-CD1 4.49Å; Y181-I335 HydrophobicContact CE1-CD1 3.85Å
182	L	84.8	Confident	76	Confident	73 Å²	73	43.3 Å²	43.3	38%	0.382	26%	0.255	S	S	.	.	H	α-helix	trans	-63.5	-44.4	174.6	-173.6	72.8	0	0	0	111.4	F173 S180 L184 I185 E186	F173-L182 HydrophobicContact CE1-CD2 3.97Å; F173-L182 HydrophobicContact CE1-CG 4.45Å; S180-L182 PolarHBondContact O-N 2.89Å; L182-L184 VanDerWaalsContact C-N 3.3Å; L182-L184 PolarHBondContact O-N 3.17Å; L182-I185 PolarHBondContact O-N 3.33Å; L182-E186 PolarHBondContact O-N 3.07Å
183	A	85	Confident	75.2	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.7	-36	175	0	0	0	0	0	111.5	F173 T177 R178 S180 E186 W187	F173-A183 HydrophobicContact CD2-CB 4.4Å; T177-A183 WeakPolarHBondContact O-CB 3.31Å; R178-A183 WeakPolarHBondContact O-CB 3.42Å; S180-A183 WeakPolarHBondContact O-CB 3.43Å; S180-A183 PolarHBondContact O-N 3.41Å; S180-A183 PolarHBondContact OG-N 2.87Å; A183-E186 PolarHBondContact O-N 3.03Å; A183-W187 WeakPolarHBondContact O-CB 3.15Å; A183-W187 PolarHBondContact O-N 3.28Å
184	L	86.5	Confident	74.2	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-41.3	174.8	-174.2	66	0	0	0	112.1	V131 L134 S180 Y181 L182 W187 Y188 L296 L333	V131-L184 HydrophobicContact CG1-CB 4.29Å; V131-L184 HydrophobicContact CG2-CB 4.45Å; V131-L184 HydrophobicContact CG2-CD2 4.42Å; L134-L184 HydrophobicContact CB-CD1 4.1Å; L134-L184 HydrophobicContact CD1-CD1 4.1Å; L134-L184 HydrophobicContact CD1-CD2 3.93Å; S180-L184 PolarHBondContact O-N 2.98Å; S180-L184 VanDerWaalsContact O-N 3.11Å; Y181-L184 HydrophobicContact CD1-CD2 3.97Å; Y181-L184 HydrophobicContact CE1-CD2 4.24Å; Y181-L184 WeakPolarHBondContact O-CB 3.47Å; Y181-L184 PolarHBondContact O-N 3.38Å; L182-L184 VanDerWaalsContact C-N 3.3Å; L182-L184 PolarHBondContact O-N 3.17Å; L184-W187 HydrophobicContact CD1-CE3 3.93Å; L184-W187 HydrophobicContact CD1-CZ3 4.19Å; L184-Y188 WeakPolarHBondContact O-CB 3.49Å; L184-Y188 PolarHBondContact O-N 2.89Å; L184-L296 HydrophobicContact CD2-CD1 4.24Å; L184-L296 HydrophobicContact CG-CD1 4.49Å; L184-L333 HydrophobicContact CD2-CD1 3.91Å; L184-L333 HydrophobicContact CG-CD1 4.25Å
185	I	84.1	Confident	72.8	Confident	12 Å²	12	50.6 Å²	50.6	6%	0.062	27%	0.271	C	S	.	.	H	α-helix	trans	-60.8	-52.2	174.8	-72	170.8	0	0	0	111	Y181 L182 W187 Y188 Y189 Y321 I326 C331 L333	Y181-I185 WeakPolarHBondContact O-CG1 3.18Å; Y181-I185 PolarHBondContact O-N 2.88Å; L182-I185 PolarHBondContact O-N 3.33Å; I185-W187 VanDerWaalsContact C-N 3.28Å; I185-W187 PolarHBondContact O-N 3.27Å; I185-Y188 PolarHBondContact O-N 3.22Å; I185-Y189 HydrophobicContact CG2-CD2 3.85Å; I185-Y189 HydrophobicContact CG2-CE2 4.3Å; I185-Y189 WeakPolarHBondContact O-CD2 3.5Å; I185-Y189 PolarHBondContact O-N 2.97Å; I185-Y321 HydrophobicContact CD1-CD1 3.5Å; I185-Y321 HydrophobicContact CD1-CE1 3.78Å; I185-Y321 HydrophobicContact CG1-CD1 4.37Å; I185-I326 HydrophobicContact CD1-CD1 4.25Å; I185-C331 HydrophobicContact CG2-CB 4.14Å; I185-L333 HydrophobicContact CG1-CD1 3.85Å; I185-L333 HydrophobicContact CG1-CD2 3.99Å; I185-L333 HydrophobicContact CG1-CG 3.92Å
186	E	81.2	Confident	70.9	Confident	42 Å²	42	51 Å²	51	20%	0.196	28%	0.275	C	S	.	.	H	α-helix	trans	-58.4	-43.6	-178.8	-69.3	-73.6	168.5	0	0	110.8	F173 L182 A183 S190 R329	F173-E186 HydrophobicContact CE2-CB 4.31Å; F173-E186 HydrophobicContact CE2-CG 4.05Å; F173-E186 HydrophobicContact CZ-CG 3.93Å; L182-E186 PolarHBondContact O-N 3.07Å; A183-E186 PolarHBondContact O-N 3.03Å; E186-S190 WeakPolarHBondContact O-CA 2.96Å; E186-S190 VanDerWaalsContact O-CB 3.24Å; E186-S190 WeakPolarHBondContact O-CB 3.07Å; E186-S190 PolarHBondContact O-N 3.39Å; E186-R329 IonicContact OE1-CZ 2.81Å; E186-R329 IonicContact OE1-NH1 3.1Å; E186-R329 PolarHBondContact OE1-NH1 3.03Å; E186-R329 IonicContact OE1-NH2 3.21Å; E186-R329 PolarHBondContact OE1-NH2 3.14Å
187	W	83.9	Confident	69	Low	16 Å²	16	51 Å²	51	6%	0.061	28%	0.28	C	S	.	.	H	α-helix	trans	-62.3	-47.9	174.7	173.9	84.1	0	0	0	112.4	H110 L135 V170 A183 L184 I185 Y189 S190 L296	H110-W187 AromaticContact CD2-CH2 3.73Å; H110-W187 AromaticContact CE1-CH2 3.7Å; H110-W187 AromaticContact CG-CH2 3.91Å; H110-W187 AromaticContact ND1-CH2 3.88Å; H110-W187 AromaticContact NE2-CH2 3.6Å; L135-W187 HydrophobicContact CD2-CB 3.73Å; L135-W187 HydrophobicContact CD2-CD2 3.6Å; L135-W187 HydrophobicContact CD2-CE3 4.21Å; L135-W187 HydrophobicContact CD2-CG 3.35Å; V170-W187 HydrophobicContact CG2-CB 3.85Å; V170-W187 HydrophobicContact CG2-CG 4.44Å; A183-W187 WeakPolarHBondContact O-CB 3.15Å; A183-W187 PolarHBondContact O-N 3.28Å; L184-W187 HydrophobicContact CD1-CE3 3.93Å; L184-W187 HydrophobicContact CD1-CZ3 4.19Å; I185-W187 VanDerWaalsContact C-N 3.28Å; I185-W187 PolarHBondContact O-N 3.27Å; W187-Y189 PolarHBondContact O-N 3.41Å; W187-S190 PolarHBondContact O-N 3.03Å; W187-S190 PolarHBondContact O-OG 2.83Å; W187-L296 HydrophobicContact CZ3-CD2 4.3Å
188	Y	83.7	Confident	66.8	Low	19 Å²	19	55.1 Å²	55.1	8%	0.075	31%	0.308	C	S	.	.	H	α-helix	trans	-63.3	-41	-175.9	-171.4	-105.5	0	0	0	112	L184 I185 L293 R294 L296 L333 P334	L184-Y188 WeakPolarHBondContact O-CB 3.49Å; L184-Y188 PolarHBondContact O-N 2.89Å; I185-Y188 PolarHBondContact O-N 3.22Å; Y188-L293 HydrophobicContact CD1-CD2 4.38Å; Y188-L293 HydrophobicContact CE1-CD2 3.72Å; Y188-R294 WeakPolarHBondContact CE2-O 3.4Å; Y188-R294 PolarHBondContact OH-N 3.36Å; Y188-R294 PolarHBondContact OH-O 3.46Å; Y188-L296 HydrophobicContact CD2-CD1 4.08Å; Y188-L296 HydrophobicContact CD2-CD2 4Å; Y188-L296 HydrophobicContact CD2-CG 4.23Å; Y188-L296 HydrophobicContact CE2-CD1 4.3Å; Y188-L296 HydrophobicContact CE2-CD2 4Å; Y188-L296 HydrophobicContact CE2-CG 4.05Å; Y188-L333 HydrophobicContact CD1-CD2 3.83Å; Y188-L333 HydrophobicContact CG-CD2 4.02Å; Y188-P334 HydrophobicContact CE1-CG 4.06Å; Y188-P334 HydrophobicContact CE2-CG 4.43Å; Y188-P334 WeakPolarHBondContact OH-CG 3.45Å
189	Y	81.3	Confident	64.5	Low	13 Å²	13	55.4 Å²	55.4	5%	0.051	33%	0.325	C	S	.	.	H	α-helix	trans	-91.9	-7	-178.9	-73.3	-76.4	0	0	0	114.9	H66 I185 W187 G191 T192 Y195 C331 S332 L333	H66-Y189 AromaticContact NE2-CE1 3.97Å; H66-Y189 PolarHBondContact NE2-OH 3.3Å; I185-Y189 HydrophobicContact CG2-CD2 3.85Å; I185-Y189 HydrophobicContact CG2-CE2 4.3Å; I185-Y189 WeakPolarHBondContact O-CD2 3.5Å; I185-Y189 PolarHBondContact O-N 2.97Å; W187-Y189 PolarHBondContact O-N 3.41Å; Y189-G191 PolarHBondContact O-N 3.33Å; Y189-T192 WeakPolarHBondContact CD1-OG1 3.32Å; Y189-T192 PolarHBondContact O-N 3.21Å; Y189-T192 PolarHBondContact O-OG1 2.97Å; Y189-Y195 AromaticContact CD1-CD2 3.95Å; Y189-Y195 HydrophobicContact CD1-CD2 3.95Å; Y189-Y195 HydrophobicContact CD1-CE2 4.11Å; Y189-Y195 HydrophobicContact CE1-CD2 4.28Å; Y189-Y195 AromaticContact CE1-CE2 3.96Å; Y189-Y195 HydrophobicContact CE1-CE2 3.96Å; Y189-Y195 HydrophobicContact CG-CD2 4.47Å; Y189-C331 HydrophobicContact CD2-CB 4.36Å; Y189-C331 HydrophobicContact CE2-CB 3.79Å; Y189-S332 PolarHBondContact OH-N 3.29Å; Y189-S332 PolarHBondContact OH-O 2.97Å; Y189-L333 HydrophobicContact CE2-CD2 4.38Å
190	S	72.9	Confident	61.8	Low	42 Å²	42	58.6 Å²	58.6	29%	0.294	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-23.8	179.1	62.3	0	0	0	0	114.5	K166 E186 W187	K166-S190 WeakPolarHBondContact CG-OG 3.49Å; E186-S190 WeakPolarHBondContact O-CA 2.96Å; E186-S190 VanDerWaalsContact O-CB 3.24Å; E186-S190 WeakPolarHBondContact O-CB 3.07Å; E186-S190 PolarHBondContact O-N 3.39Å; W187-S190 PolarHBondContact O-N 3.03Å; W187-S190 PolarHBondContact O-OG 2.83Å
191	G	57.8	Low	58.8	Low	48 Å²	48	61.7 Å²	61.7	50%	0.495	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-11	175.9	0	0	0	0	0	115.2	Y189	Y189-G191 PolarHBondContact O-N 3.33Å
192	T	58	Low	55.8	Low	18 Å²	18	69.7 Å²	69.7	11%	0.11	41%	0.41	C	S	.	.			trans	-107.6	115.7	-175.5	61.7	0	0	0	0	110.2	Y189 K194 L293	Y189-T192 WeakPolarHBondContact CD1-OG1 3.32Å; Y189-T192 PolarHBondContact O-N 3.21Å; Y189-T192 PolarHBondContact O-OG1 2.97Å; T192-K194 PolarHBondContact O-N 3.39Å; T192-L293 HydrophobicContact CG2-CD2 4.07Å
193	K	43.2	Very low	52.9	Low	211 Å²	211	77.4 Å²	77.4	92%	0.917	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-2	177.6	-72.5	-177.1	177	179.2	0	114.5	Y195	K193-Y195 PolarHBondContact O-N 2.97Å
194	K	43.9	Very low	50.1	Low	101 Å²	101	82.6 Å²	82.6	44%	0.439	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-14.2	-174.4	-92.5	-163.1	177.6	-164.6	0	115.3	E69 T192	E69-K194 IonicContact OE1-NZ 3.72Å; E69-K194 PolarHBondContact OE1-NZ 3.41Å; T192-K194 PolarHBondContact O-N 3.39Å
195	Y	41.5	Very low	47.4	Very low	100 Å²	100	88.6 Å²	88.6	39%	0.392	50%	0.5	S	S	.	.	S	Bend	trans	-125.1	0.3	-172.6	-72.5	-81.3	0	0	0	116.4	Y189 K193 G197 S330 C331	Y189-Y195 AromaticContact CD1-CD2 3.95Å; Y189-Y195 HydrophobicContact CD1-CD2 3.95Å; Y189-Y195 HydrophobicContact CD1-CE2 4.11Å; Y189-Y195 HydrophobicContact CE1-CD2 4.28Å; Y189-Y195 AromaticContact CE1-CE2 3.96Å; Y189-Y195 HydrophobicContact CE1-CE2 3.96Å; Y189-Y195 HydrophobicContact CG-CD2 4.47Å; K193-Y195 PolarHBondContact O-N 2.97Å; Y195-G197 PolarHBondContact O-N 2.79Å; Y195-S330 WeakPolarHBondContact CE1-O 3.31Å; Y195-S330 PolarHBondContact OH-O 3.36Å; Y195-C331 WeakPolarHBondContact CD1-SG 3.43Å; Y195-C331 WeakPolarHBondContact CE1-SG 3.49Å
196	C	27.1	Very low	44.6	Very low	113 Å²	113	96.1 Å²	96.1	76%	0.764	54%	0.535	S	S	*	.			trans	-86.8	75.7	168.1	-75.8	0	0	0	0	110.6
197	G	27.5	Very low	42	Very low	54 Å²	54	103.9 Å²	103.9	56%	0.557	57%	0.569	S	S	*	*			trans	-92.1	136.4	161.2	0	0	0	0	0	110	Y195 S199	Y195-G197 PolarHBondContact O-N 2.79Å; G197-S199 VanDerWaalsContact C-N 3.27Å; G197-S199 PolarHBondContact O-N 3Å
198	P	27.2	Very low	39.4	Very low	140 Å²	140	112.3 Å²	112.3	91%	0.909	61%	0.606	S	S	*	*	S	Bend	trans	-74.4	85.2	175.2	32.2	-31.1	0	0	0	108.6
199	S	28	Very low	36.6	Very low	104 Å²	104	117.8 Å²	117.8	73%	0.727	64%	0.642	S	S	*	*			trans	-140	57.2	161.9	68.9	0	0	0	0	108.7	G197 P201	G197-S199 VanDerWaalsContact C-N 3.27Å; G197-S199 PolarHBondContact O-N 3Å; S199-P201 WeakPolarHBondContact O-CD 3.44Å
200	A	25	Very low	34.2	Very low	89 Å²	89	123 Å²	123	74%	0.736	68%	0.677	S	S	*	*			trans	-62.5	120.4	148.8	0	0	0	0	0	105.5	E202	A200-E202 PolarHBondContact O-N 3.06Å; A200-E202 VanDerWaalsContact O-N 3.13Å
201	P	25.5	Very low	32.3	Very low	97 Å²	97	125 Å²	125	63%	0.63	70%	0.696	S	S	*	*			trans	-60.2	122.1	163.6	26.1	-27.5	0	0	0	105.3	S199 W203	S199-P201 WeakPolarHBondContact O-CD 3.44Å; P201-W203 VanDerWaalsContact C-N 3.34Å; P201-W203 PolarHBondContact O-N 3.15Å
202	E	23.9	Very low	31.3	Very low	171 Å²	171	128.1 Å²	128.1	80%	0.799	71%	0.707	S	S	*	*			trans	-46	106.8	163.1	-81.9	177.6	147.6	0	0	107.1	A200 N204	A200-E202 PolarHBondContact O-N 3.06Å; A200-E202 VanDerWaalsContact O-N 3.13Å; E202-N204 PolarHBondContact O-N 3.32Å
203	W	23.8	Very low	30.4	Very low	235 Å²	235	133.2 Å²	133.2	89%	0.89	74%	0.741	S	S	*	*			trans	-72.7	82.1	163.7	-91.4	60.1	0	0	0	105.9	P201 P205	P201-W203 VanDerWaalsContact C-N 3.34Å; P201-W203 PolarHBondContact O-N 3.15Å; W203-P205 VanDerWaalsContact O-CD 3.29Å; W203-P205 WeakPolarHBondContact O-CD 3.39Å
204	N	25.7	Very low	29.9	Very low	109 Å²	109	129.4 Å²	129.4	58%	0.583	74%	0.736	S	S	*	*			trans	-62.4	118.3	160.8	-81.7	-20.3	0	0	0	107.4	E202 E206	E202-N204 PolarHBondContact O-N 3.32Å; N204-E206 PolarHBondContact O-N 3.07Å
205	P	30	Very low	29.4	Very low	127 Å²	127	131 Å²	131	83%	0.825	75%	0.754	S	S	*	*	S	Bend	trans	-79.5	52.9	170	35.9	-31.7	0	0	0	109	W203	W203-P205 VanDerWaalsContact O-CD 3.29Å; W203-P205 WeakPolarHBondContact O-CD 3.39Å
206	E	25.4	Very low	29	Very low	169 Å²	169	132.2 Å²	132.2	79%	0.79	77%	0.774	S	S	*	*			trans	-143	60	177.7	-73.4	-164.5	164.7	0	0	110.5	N204	N204-E206 PolarHBondContact O-N 3.07Å
207	F	27.5	Very low	29.1	Very low	206 Å²	206	138.1 Å²	138.1	90%	0.904	78%	0.78	S	S	*	*			trans	-95.8	97.5	156.5	-97.2	-85.7	0	0	0	109	T209	F207-T209 PolarHBondContact O-N 3.37Å
208	K	27.5	Very low	29.5	Very low	192 Å²	192	141.2 Å²	141.2	84%	0.835	79%	0.791	S	S	*	*			trans	-40.3	119.7	162	-78	171.4	175.7	170.6	0	109.5	P210	K208-P210 VanDerWaalsContact O-CD 3.28Å; K208-P210 WeakPolarHBondContact O-CD 3.48Å
209	T	26.8	Very low	29.6	Very low	135 Å²	135	146.2 Å²	146.2	83%	0.828	79%	0.791	S	S	*	*			trans	-44.7	115.7	166.2	-3.8	0	0	0	0	109.9	F207 A211	F207-T209 PolarHBondContact O-N 3.37Å; T209-A211 PolarHBondContact O-N 3.44Å
210	P	30.4	Very low	29.9	Very low	122 Å²	122	145.9 Å²	145.9	79%	0.792	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-75	123.1	157.4	0	18.7	0	0	0	106.3	K208	K208-P210 VanDerWaalsContact O-CD 3.28Å; K208-P210 WeakPolarHBondContact O-CD 3.48Å
211	A	31.9	Very low	30.3	Very low	85 Å²	85	150.6 Å²	150.6	70%	0.702	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-46.5	147.1	176.5	0	0	0	0	0	112.4	T209	T209-A211 PolarHBondContact O-N 3.44Å
212	P	37.4	Very low	30.6	Very low	112 Å²	112	157.3 Å²	157.3	73%	0.727	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-65	138.1	178.9	29.5	-32.4	0	0	0	108.9	T214	P212-T214 PolarHBondContact O-N 3.25Å; P212-T214 VanDerWaalsContact O-N 3.09Å
213	P	38.4	Very low	31.1	Very low	126 Å²	126	154.2 Å²	154.2	82%	0.818	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-65.9	120.1	174.7	27.1	-29.2	0	0	0	108.1	T215	P213-T215 PolarHBondContact O-N 3.29Å
214	T	33.1	Very low	31.6	Very low	131 Å²	131	149 Å²	149	80%	0.804	80%	0.8	S	S	*	*			trans	-40.9	127.8	170.9	23.2	0	0	0	0	112.5	P212	P212-T214 PolarHBondContact O-N 3.25Å; P212-T214 VanDerWaalsContact O-N 3.09Å
215	T	32.8	Very low	32.1	Very low	133 Å²	133	149 Å²	149	82%	0.816	81%	0.809	S	S	*	*			trans	-41.3	137.8	162.3	46.6	0	0	0	0	113	P213	P213-T215 PolarHBondContact O-N 3.29Å
216	P	33.7	Very low	32.5	Very low	127 Å²	127	151.2 Å²	151.2	83%	0.825	81%	0.808	S	S	*	*			trans	-106.4	106.1	149.3	19	-0.7	0	0	0	110.3
217	R	30.7	Very low	33	Very low	236 Å²	236	149 Å²	149	89%	0.891	81%	0.808	S	S	*	*			trans	43.9	136	141.6	-85.2	178.7	170.3	-177.5	-2.4	122.3
218	P	34.6	Very low	33.2	Very low	120 Å²	120	150.2 Å²	150.2	78%	0.779	81%	0.807	S	S	*	*			trans	-87.4	144	168.3	36.6	-30.9	0	0	0	112.1
219	R	30.3	Very low	33.5	Very low	244 Å²	244	146.3 Å²	146.3	92%	0.921	80%	0.804	S	S	*	*			trans	177	137.8	161.7	-103.5	171.2	178.3	-174.9	-1.3	106.4
220	S	32.8	Very low	33.6	Very low	98 Å²	98	147.8 Å²	147.8	69%	0.685	80%	0.802	S	S	*	*			cis	-175.6	137.9	-2.5	44.6	0	0	0	0	107
221	Q	33.1	Very low	33.6	Very low	188 Å²	188	151 Å²	151	88%	0.879	80%	0.803	S	S	*	*			trans	46	113.8	144.2	-61.8	-172.7	-10.6	0	0	121.7
222	R	33.8	Very low	33.6	Very low	238 Å²	238	152.4 Å²	152.4	90%	0.898	81%	0.808	S	S	*	*				176.5	111.7	111.1	-114.7	173.4	171	-175.1	-2.7	108
223	S	34.4	Very low	33.2	Very low	106 Å²	106	155.7 Å²	155.7	74%	0.741	81%	0.813	S	S	*	*				54.8	122.1	85.7	-75.5	0	0	0	0	111.4
224	T	33.4	Very low	32.9	Very low	124 Å²	124	158.9 Å²	158.9	76%	0.761	82%	0.817	S	S	*	*			cis	-172.2	157.3	40.5	29.1	0	0	0	0	112.1
225	S	36.3	Very low	32.9	Very low	109 Å²	109	158 Å²	158	76%	0.762	81%	0.814	S	S	*	*			trans	74.5	98.8	141.8	59.9	0	0	0	0	121.7
226	Q	38.1	Very low	32.7	Very low	174 Å²	174	157.6 Å²	157.6	81%	0.813	81%	0.814	S	S	*	*			trans	-29.7	162.8	130	-94.4	-173.1	13	0	0	115.1
227	P	36.1	Very low	32.7	Very low	122 Å²	122	157.2 Å²	157.2	79%	0.792	81%	0.812	S	S	*	*				-153.6	168.1	56.7	38	-14.4	0	0	0	120.5
228	R	31.1	Very low	32.8	Very low	232 Å²	232	154.7 Å²	154.7	88%	0.875	81%	0.813	S	S	*	*			trans	-57.9	146.2	163.8	-86.5	171.5	158.9	172.2	-5.7	113.4
229	S	33.5	Very low	32.7	Very low	110 Å²	110	153.8 Å²	153.8	77%	0.769	81%	0.809	S	S	*	*			trans	-178.3	113.9	131.1	47.4	0	0	0	0	108.4
230	Q	30.2	Very low	32.6	Very low	167 Å²	167	147.1 Å²	147.1	78%	0.78	80%	0.8	S	S	*	*				77.6	125.7	94.4	-87.7	-164.5	-1.5	0	0	116.1
231	K	29.2	Very low	32.5	Very low	188 Å²	188	147.1 Å²	147.1	82%	0.817	81%	0.806	S	S	*	*			trans	75	130.5	160.7	-58.1	169.9	-176.6	180	0	114.1
232	S	31.9	Very low	32.4	Very low	115 Å²	115	143.4 Å²	143.4	80%	0.804	80%	0.801	S	S	*	*				-168.2	160.5	50.1	48.5	0	0	0	0	112.1
233	H	29.8	Very low	32.5	Very low	182 Å²	182	138.4 Å²	138.4	84%	0.843	80%	0.799	S	S	*	*			trans	-53.7	139.9	172.1	-64.1	-95.9	0	0	0	113.9
234	Q	32	Very low	32.2	Very low	193 Å²	193	144.4 Å²	144.4	90%	0.902	81%	0.805	S	S	*	*				-172.8	123.9	126.9	-109.4	173.6	-3.6	0	0	111.3
235	P	33.8	Very low	31.9	Very low	113 Å²	113	146.4 Å²	146.4	73%	0.734	81%	0.811	S	S	*	*			trans	-94	156	162.3	35.5	-27.2	0	0	0	110.3
236	C	29	Very low	31.7	Very low	123 Å²	123	146.3 Å²	146.3	83%	0.831	81%	0.81	S	S	*	*			trans	132.5	159.5	157.7	-72.4	0	0	0	0	112.7
237	P	33.4	Very low	31.1	Very low	119 Å²	119	143.9 Å²	143.9	77%	0.773	81%	0.807	S	S	*	*			cis	-135.7	172.9	-30.9	32	-12.6	0	0	0	113.4
238	M	32.2	Very low	30.9	Very low	184 Å²	184	144 Å²	144	91%	0.906	81%	0.808	S	S	*	*			trans	-46.8	140.1	161.9	-68.8	-103.3	-72.3	0	0	113.5
239	S	32.1	Very low	30.8	Very low	101 Å²	101	139 Å²	139	71%	0.706	80%	0.803	S	S	*	*			trans	-151	98.1	152.3	178	0	0	0	0	107.1
240	S	28.3	Very low	30.5	Very low	104 Å²	104	144 Å²	144	73%	0.727	81%	0.805	S	S	*	*				37.6	102.9	98.5	65.4	0	0	0	0	114.1
241	A	31.8	Very low	30.4	Very low	97 Å²	97	145.9 Å²	145.9	80%	0.802	81%	0.805	S	S	*	*			trans	-166	111.3	148.7	0	0	0	0	0	110
242	S	29.6	Very low	30.2	Very low	111 Å²	111	144.6 Å²	144.6	78%	0.776	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-52.1	156.5	164.9	-35.8	0	0	0	0	112
243	P	35.9	Very low	30.1	Very low	132 Å²	132	147.3 Å²	147.3	86%	0.857	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-103.3	116.2	144	9.2	10.3	0	0	0	108.8
244	R	27.8	Very low	29.9	Very low	232 Å²	232	149.8 Å²	149.8	88%	0.875	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-54.9	149.2	167.4	-73.2	173.1	172	-170.4	-3.8	111	S246	R244-S246 PolarHBondContact O-N 3.13Å
245	L	28.3	Very low	29.7	Very low	167 Å²	167	149 Å²	149	87%	0.874	80%	0.803	S	S	*	*			trans	-38.6	126.7	154.9	-86.3	79.6	0	0	0	111.2
246	S	31	Very low	29.2	Very low	107 Å²	107	148.6 Å²	148.6	75%	0.748	80%	0.803	S	S	*	*			trans	-139	96.1	151	50.9	0	0	0	0	108.8	R244 P248	R244-S246 PolarHBondContact O-N 3.13Å; S246-P248 WeakPolarHBondContact O-CD 3.34Å
247	T	26.4	Very low	29.3	Very low	123 Å²	123	150.4 Å²	150.4	76%	0.755	80%	0.803	S	S	*	*			trans	-58.5	135.2	156.5	41.6	0	0	0	0	110
248	P	32.4	Very low	28.9	Very low	124 Å²	124	155.8 Å²	155.8	81%	0.805	81%	0.808	S	S	*	*			trans	-109.6	101.1	148.5	29.9	-15.4	0	0	0	108.8	S246 R250	S246-P248 WeakPolarHBondContact O-CD 3.34Å; P248-R250 PolarHBondContact O-N 3.42Å
249	T	27.2	Very low	28.5	Very low	127 Å²	127	151.6 Å²	151.6	78%	0.779	80%	0.797	S	S	*	*			trans	-49	119.1	145.5	32.6	0	0	0	0	109.9
250	R	29	Very low	28.3	Very low	214 Å²	214	154 Å²	154	81%	0.808	80%	0.802	S	S	*	*				174.5	137.6	125.4	-105.8	179	168.7	-170.8	-1.2	114.1	P248	P248-R250 PolarHBondContact O-N 3.42Å
251	R	26.6	Very low	28.2	Very low	208 Å²	208	157.5 Å²	157.5	79%	0.785	81%	0.807	S	S	*	*			trans	83.4	92.5	142.6	-106.1	172.2	174	158.3	-2.5	118.2	Q253	R251-Q253 PolarHBondContact O-N 3.38Å
252	N	26	Very low	27.8	Very low	160 Å²	160	158.4 Å²	158.4	86%	0.856	80%	0.802	S	S	*	*				-2.4	108.5	125.2	-68.8	-15.4	0	0	0	114.6
253	Q	30.6	Very low	27.8	Very low	172 Å²	172	159 Å²	159	80%	0.804	81%	0.807	S	S	*	*			trans	-133.7	117.7	137.9	-78.1	-169.1	-10.8	0	0	108.7	R251	R251-Q253 PolarHBondContact O-N 3.38Å
254	R	23.9	Very low	27.4	Very low	235 Å²	235	159.9 Å²	159.9	89%	0.887	80%	0.804	S	S	*	*			trans	-56	130.6	166	-75.1	169.7	165.5	166.8	-6.7	108.9
255	F	27.6	Very low	27.4	Very low	175 Å²	175	154.8 Å²	154.8	77%	0.768	80%	0.799	S	S	*	*			trans	-133.1	94.7	144.5	-88.8	-78.7	0	0	0	108.6
256	S	25	Very low	27.3	Very low	105 Å²	105	155 Å²	155	73%	0.734	80%	0.8	S	S	*	*			trans	-72.4	124	150.2	55.3	0	0	0	0	107.6
257	L	31.1	Very low	27.2	Very low	161 Å²	161	159.7 Å²	159.7	84%	0.843	81%	0.807	S	S	*	*			trans	-138.7	115.3	154.2	-78.7	176.6	0	0	0	109.5
258	R	23.2	Very low	27.2	Very low	232 Å²	232	159.3 Å²	159.3	88%	0.875	81%	0.809	S	S	*	*			trans	-62.2	158.7	166.1	-69.7	172.9	159.2	-177.3	-6.8	110.4
259	S	24.3	Very low	26.9	Very low	97 Å²	97	161.8 Å²	161.8	68%	0.678	81%	0.81	S	S	*	*			trans	55.9	126.8	139	57.3	0	0	0	0	119.7
260	N	27.8	Very low	27	Very low	151 Å²	151	163.9 Å²	163.9	81%	0.807	82%	0.815	S	S	*	*			trans	175.4	105.8	134.1	-85.4	-8.4	0	0	0	105.4
261	E	26.2	Very low	27.1	Very low	177 Å²	177	158.3 Å²	158.3	83%	0.827	82%	0.815	S	S	*	*				43.5	128.6	68.8	-93.7	-175.6	-170.9	0	0	114
262	V	25.1	Very low	27.1	Very low	117 Å²	117	155.8 Å²	155.8	71%	0.709	82%	0.818	S	S	*	*			trans	85.1	101	167.8	-160.8	0	0	0	0	117
263	S	29.1	Very low	27.2	Very low	124 Å²	124	153.5 Å²	153.5	87%	0.867	81%	0.814	S	S	*	*			trans	-149.7	61	143.4	-75.1	0	0	0	0	109.4
264	N	27.3	Very low	27.3	Very low	149 Å²	149	151.8 Å²	151.8	80%	0.797	82%	0.815	S	S	*	*			trans	-122.3	91.3	163.5	-83.9	-15.3	0	0	0	106.8
265	T	26.5	Very low	27.4	Very low	125 Å²	125	146 Å²	146	77%	0.767	81%	0.81	S	S	*	*			trans	175.2	108.6	158.2	37.6	0	0	0	0	107
266	L	26.8	Very low	27.6	Very low	172 Å²	172	142.3 Å²	142.3	90%	0.901	81%	0.812	S	S	*	*			trans	174.5	130.9	141.7	-93	163.1	0	0	0	108.1
267	K	28.5	Very low	27.8	Very low	206 Å²	206	143 Å²	143	90%	0.896	82%	0.817	S	S	*	*			trans	96.4	55.6	177.1	-53.6	178.4	-179.4	-179.2	0	116.1
268	S	26.7	Very low	27.9	Very low	114 Å²	114	141.7 Å²	141.7	80%	0.797	82%	0.818	S	S	*	*			trans	-87.3	153.4	133.9	179.2	0	0	0	0	107.4
269	E	26.9	Very low	28.2	Very low	176 Å²	176	133.7 Å²	133.7	82%	0.822	81%	0.808	S	S	*	*			trans	90	86.5	-176.8	-56.5	-177.7	154.1	0	0	115.3
270	L	28.5	Very low	28.5	Very low	171 Å²	171	135.3 Å²	135.3	90%	0.895	82%	0.82	S	S	*	*				-172.2	131.8	116	-121.2	81.7	0	0	0	111.3
271	A	31.3	Very low	28.6	Very low	98 Å²	98	130.9 Å²	130.9	81%	0.81	81%	0.809	S	S	*	*			trans	82.4	86.1	154.1	0	0	0	0	0	118.7
272	D	26.3	Very low	28.9	Very low	155 Å²	155	127.6 Å²	127.6	83%	0.829	80%	0.801	S	S	*	*			trans	-46.1	158.5	144.2	-76.8	-51.5	0	0	0	113.9
273	S	28.2	Very low	29.1	Very low	111 Å²	111	128.6 Å²	128.6	78%	0.776	80%	0.802	S	S	*	*			trans	81.7	108.6	160.5	72.7	0	0	0	0	117.5
274	V	32.4	Very low	29.2	Very low	137 Å²	137	126.5 Å²	126.5	83%	0.83	79%	0.787	S	S	*	*				174.6	123.1	100.7	163.1	0	0	0	0	108.7
275	S	27.2	Very low	29.4	Very low	112 Å²	112	125.2 Å²	125.2	78%	0.783	78%	0.78	S	S	*	*			trans	-70.2	137.6	175.5	50.3	0	0	0	0	113.6
276	A	30.8	Very low	29.7	Very low	98 Å²	98	123.1 Å²	123.1	81%	0.81	76%	0.764	S	S	*	*			trans	-176.9	115.7	136.8	0	0	0	0	0	110.7
277	S	29.8	Very low	29.8	Very low	121 Å²	121	123.2 Å²	123.2	85%	0.846	76%	0.757	S	S	*	*			trans	-72	153.3	167.7	-46.8	0	0	0	0	110.6
278	P	33.8	Very low	29.9	Very low	132 Å²	132	121 Å²	121	86%	0.857	75%	0.75	S	S	*	*				-149.4	153.5	103.1	33.5	-15	0	0	0	115.7
279	G	28.8	Very low	30.3	Very low	64 Å²	64	118 Å²	118	66%	0.66	73%	0.729	S	S	*	*			trans	110.4	60.8	147.7	0	0	0	0	0	118.4	G281	G279-G281 VanDerWaalsContact C-N 3.3Å; G279-G281 PolarHBondContact O-N 2.85Å
280	S	30.8	Very low	31.1	Very low	132 Å²	132	111.1 Å²	111.1	92%	0.923	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	83.4	164.7	175	0	0	0	0	110.6
281	G	29.4	Very low	32.1	Very low	57 Å²	57	106.5 Å²	106.5	59%	0.588	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-158.8	-11	175.8	0	0	0	0	0	116	G279	G279-G281 VanDerWaalsContact C-N 3.3Å; G279-G281 PolarHBondContact O-N 2.85Å
282	V	32.1	Very low	33.7	Very low	109 Å²	109	105.2 Å²	105.2	66%	0.661	67%	0.672	S	S	*	*	S	Bend	trans	-113.6	-9.3	-174.5	-174.9	0	0	0	0	112.7
283	L	30.8	Very low	36	Very low	137 Å²	137	98.6 Å²	98.6	72%	0.717	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-14.4	-172.4	-94.8	150.4	0	0	0	115.2
284	S	31.1	Very low	38.7	Very low	81 Å²	81	98.8 Å²	98.8	57%	0.566	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-35.2	177.8	47	0	0	0	0	112.8
285	D	31.4	Very low	41.4	Very low	121 Å²	121	92.9 Å²	92.9	65%	0.647	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-23	-177	-67.4	-10	0	0	0	112.6	K287	D285-K287 VanDerWaalsContact C-N 3.35Å
286	L	31.5	Very low	44.4	Very low	82 Å²	82	87.6 Å²	87.6	43%	0.429	55%	0.547	S	S	.	.	H	α-helix	trans	-74.8	-20.9	178.6	-80	158.5	0	0	0	113.6
287	K	29.5	Very low	47.4	Very low	174 Å²	174	82.9 Å²	82.9	76%	0.757	51%	0.509	S	S	*	.	H	α-helix	trans	-79.8	-17.2	176.5	-93.4	-179.6	174.8	178.8	0	113.8	D285	D285-K287 VanDerWaalsContact C-N 3.35Å
288	Q	30.3	Very low	50.5	Low	158 Å²	158	77.1 Å²	77.1	74%	0.738	47%	0.469	S	S	*	.	H	α-helix	trans	-89.6	-21.3	-177.8	-77.2	-179.8	-3.9	0	0	114.1
289	S	35.1	Very low	53.4	Low	51 Å²	51	70.9 Å²	70.9	36%	0.357	43%	0.428	S	S	.	.	H	α-helix	trans	-87.1	-21.6	-175.9	88.9	0	0	0	0	114.8	S292	S289-S292 PolarHBondContact O-OG 3.4Å
290	S	43.4	Very low	56.5	Low	32 Å²	32	67.9 Å²	67.9	22%	0.224	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-78.8	-14.5	-179.8	57.1	0	0	0	0	114.3	S292	S290-S292 PolarHBondContact O-N 2.98Å
291	A	50	Low	59.4	Low	74 Å²	74	61.8 Å²	61.8	61%	0.612	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-73.6	-3.3	-179.9	0	0	0	0	0	114.6
292	S	64.6	Low	62.1	Low	72 Å²	72	60.5 Å²	60.5	50%	0.503	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-98.3	-11.5	-174.4	65.8	0	0	0	0	115.1	S289 S290	S289-S292 PolarHBondContact O-OG 3.4Å; S290-S292 PolarHBondContact O-N 2.98Å
293	L	75.7	Confident	64.9	Low	16 Å²	16	55.3 Å²	55.3	8%	0.084	30%	0.301	C	S	.	.			trans	-80.7	136.5	-177.8	-64.9	178.1	0	0	0	111	H59 W62 L63 Y188 T192	H59-L293 PolarHBondContact CE1-O 2.83Å; H59-L293 VanDerWaalsContact CE1-O 3.3Å; W62-L293 HydrophobicContact CH2-CD1 4.26Å; W62-L293 HydrophobicContact CZ3-CD1 4.21Å; L63-L293 HydrophobicContact CD2-CB 4.21Å; Y188-L293 HydrophobicContact CD1-CD2 4.38Å; Y188-L293 HydrophobicContact CE1-CD2 3.72Å; T192-L293 HydrophobicContact CG2-CD2 4.07Å
294	R	84	Confident	67.6	Low	115 Å²	115	52 Å²	52	43%	0.434	28%	0.282	S	S	.	.			trans	-133.6	148.7	-170.1	-63.6	-69.7	179.1	178.3	-4.8	110.4	S107 G108 Y188	S107-R294 PolarHBondContact O-NH1 2.93Å; G108-R294 VanDerWaalsContact O-CB 3.26Å; G108-R294 WeakPolarHBondContact O-CB 3.43Å; G108-R294 WeakPolarHBondContact O-CG 3.37Å; Y188-R294 WeakPolarHBondContact CE2-O 3.4Å; Y188-R294 PolarHBondContact OH-N 3.36Å; Y188-R294 PolarHBondContact OH-O 3.46Å
295	P	88.7	Confident	70.3	Confident	13 Å²	13	51.1 Å²	51.1	8%	0.084	28%	0.276	C	S	.	.			trans	-65.1	143.2	-175.6	26	-33.7	0	0	0	112	I55 H59 H110 V297	I55-P295 HydrophobicContact CG2-CB 4.2Å; I55-P295 HydrophobicContact CG2-CG 4.39Å; H59-P295 HydrophobicContact CB-CB 4.18Å; H110-P295 PolarHBondContact N-O 3.04Å; P295-V297 HydrophobicContact CB-CG2 4.49Å
296	L	91.7	Very high	73.1	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	117.6	168.9	-58.4	179.4	0	0	0	108	H110 L184 W187 Y188 L333 P334 I335 N336	H110-L296 HydrophobicContact CB-CD2 3.82Å; L184-L296 HydrophobicContact CD2-CD1 4.24Å; L184-L296 HydrophobicContact CG-CD1 4.49Å; W187-L296 HydrophobicContact CZ3-CD2 4.3Å; Y188-L296 HydrophobicContact CD2-CD1 4.08Å; Y188-L296 HydrophobicContact CD2-CD2 4Å; Y188-L296 HydrophobicContact CD2-CG 4.23Å; Y188-L296 HydrophobicContact CE2-CD1 4.3Å; Y188-L296 HydrophobicContact CE2-CD2 4Å; Y188-L296 HydrophobicContact CE2-CG 4.05Å; L296-L333 HydrophobicContact CD1-CB 4.41Å; L296-L333 HydrophobicContact CD1-CD2 4.22Å; L296-P334 PolarHBondContact N-O 3.41Å; L296-I335 HydrophobicContact CB-CG1 4.24Å; L296-I335 HydrophobicContact CD1-CG1 4.31Å; L296-I335 CarbonylContact O-C 3.53Å; L296-I335 VanDerWaalsContact O-CA 3.31Å; L296-I335 WeakPolarHBondContact O-CA 3.28Å; L296-N336 PolarHBondContact O-N 3.3Å
297	V	93.6	Very high	76	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.3	-177.8	-174.2	0	0	0	0	109.8	I55 I104 H110 V111 A112 P295 I299 N336 V338	I55-V297 HydrophobicContact CD1-CG1 4.23Å; I55-V297 HydrophobicContact CD1-CG2 4.29Å; I55-V297 HydrophobicContact CG2-CG2 3.86Å; I104-V297 HydrophobicContact CD1-CB 4.34Å; I104-V297 HydrophobicContact CD1-CG1 4.07Å; I104-V297 HydrophobicContact CD1-CG2 4.25Å; I104-V297 HydrophobicContact CG2-CG2 4.09Å; H110-V297 PolarHBondContact O-N 3.32Å; V111-V297 WeakPolarHBondContact CA-O 3.44Å; V111-V297 HydrophobicContact CG2-CB 4.34Å; A112-V297 PolarHBondContact N-O 3.08Å; P295-V297 HydrophobicContact CB-CG2 4.49Å; V297-I299 HydrophobicContact CG1-CG1 4.08Å; V297-N336 WeakPolarHBondContact CA-O 3.49Å; V297-V338 HydrophobicContact CG1-CG2 3.79Å
298	I	95.1	Very high	79	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	112.6	176.6	-58.3	169.4	0	0	0	108.1	V130 L300 F314 I335 N336 F337 V338	V130-I298 HydrophobicContact CG1-CD1 3.68Å; V130-I298 HydrophobicContact CG1-CG1 3.78Å; V130-I298 HydrophobicContact CG1-CG2 4.31Å; V130-I298 HydrophobicContact CG2-CG2 4.06Å; I298-L300 HydrophobicContact CG2-CD2 4.11Å; I298-L300 HydrophobicContact CG2-CG 4.47Å; I298-F314 HydrophobicContact CD1-CZ 4.28Å; I298-F314 HydrophobicContact CG2-CZ 4.41Å; I298-I335 HydrophobicContact CD1-CG2 3.54Å; I298-I335 HydrophobicContact CG1-CG2 4.15Å; I298-N336 PolarHBondContact N-O 3.46Å; I298-F337 HydrophobicContact CB-CD1 3.92Å; I298-F337 HydrophobicContact CB-CE1 4.13Å; I298-F337 HydrophobicContact CD1-CD1 4.43Å; I298-F337 HydrophobicContact CD1-CE1 3.87Å; I298-F337 HydrophobicContact CG2-CD1 4.28Å; I298-F337 HydrophobicContact CG2-CE1 4.29Å; I298-V338 PolarHBondContact O-N 3.18Å
299	I	94.7	Very high	82	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	113.3	179	-50.5	-171.5	0	0	0	108.9	Y97 L100 V111 A112 V113 V114 V297 T301 V338	Y97-I299 HydrophobicContact CD1-CG2 3.47Å; Y97-I299 VanDerWaalsContact CD1-CG2 3.47Å; Y97-I299 HydrophobicContact CE1-CG2 3.87Å; Y97-I299 HydrophobicContact CG-CG2 4.06Å; L100-I299 HydrophobicContact CD2-CD1 4.08Å; L100-I299 HydrophobicContact CG-CD1 4.36Å; V111-I299 HydrophobicContact CG1-CD1 3.63Å; V111-I299 HydrophobicContact CG1-CG1 3.87Å; A112-I299 PolarHBondContact O-N 3.13Å; V113-I299 HydrophobicContact CG1-CB 4.44Å; V113-I299 HydrophobicContact CG1-CG2 4.46Å; V113-I299 HydrophobicContact CG2-CB 4.23Å; V113-I299 HydrophobicContact CG2-CD1 4.12Å; V113-I299 HydrophobicContact CG2-CG1 4.41Å; V114-I299 PolarHBondContact N-O 3.31Å; V297-I299 HydrophobicContact CG1-CG1 4.08Å; I299-T301 HydrophobicContact CG2-CG2 4.29Å; I299-V338 CarbonylContact C-O 3.59Å; I299-V338 WeakPolarHBondContact CA-O 3.42Å; I299-V338 HydrophobicContact CB-CB 4.4Å; I299-V338 HydrophobicContact CG1-CB 4.05Å; I299-V338 HydrophobicContact CG1-CG2 4.3Å; I299-V338 HydrophobicContact CG2-CB 4.3Å; I299-V338 HydrophobicContact CG2-CG1 4.37Å
300	L	93.5	Very high	84.8	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	102.6	169.8	-56	-176.2	0	0	0	107.7	V114 L126 I298 E302 I306 L311 V338 F339 G340	V114-L300 HydrophobicContact CB-CD2 3.75Å; V114-L300 HydrophobicContact CG1-CD2 4.4Å; V114-L300 HydrophobicContact CG2-CD2 3.61Å; L126-L300 HydrophobicContact CD1-CD2 4.44Å; I298-L300 HydrophobicContact CG2-CD2 4.11Å; I298-L300 HydrophobicContact CG2-CG 4.47Å; L300-E302 VanDerWaalsContact C-N 3.31Å; L300-E302 PolarHBondContact O-N 2.92Å; L300-I306 HydrophobicContact CB-CD1 4.46Å; L300-I306 HydrophobicContact CD1-CD1 3.94Å; L300-I306 HydrophobicContact CD2-CD1 4.25Å; L300-I306 HydrophobicContact CG-CD1 4.45Å; L300-L311 HydrophobicContact CD1-CD1 3.98Å; L300-V338 PolarHBondContact N-O 2.89Å; L300-F339 HydrophobicContact CB-CD1 4.08Å; L300-F339 HydrophobicContact CD1-CD1 3.86Å; L300-F339 HydrophobicContact CD1-CE1 3.52Å; L300-F339 HydrophobicContact CD1-CZ 4.43Å; L300-F339 HydrophobicContact CG-CD1 4.07Å; L300-F339 HydrophobicContact CG-CE1 4.04Å; L300-G340 PolarHBondContact O-N 3.21Å
301	T	91	Very high	87.2	Confident	5 Å²	5	35.7 Å²	35.7	3%	0.031	20%	0.201	C	C	.	.	S	Bend	trans	-68.4	-29.8	-169.6	61.5	0	0	0	0	113.4	Y97 V113 V114 P116 I299 G340	Y97-T301 HydrophobicContact CD2-CG2 3.43Å; Y97-T301 VanDerWaalsContact CD2-CG2 3.43Å; Y97-T301 HydrophobicContact CE2-CG2 3.8Å; Y97-T301 HydrophobicContact CG-CG2 3.9Å; V113-T301 HydrophobicContact CG1-CG2 3.77Å; V114-T301 PolarHBondContact O-N 2.92Å; V114-T301 PolarHBondContact O-OG1 3.45Å; V114-T301 VanDerWaalsContact O-OG1 3.06Å; P116-T301 WeakPolarHBondContact CD-OG1 3.46Å; I299-T301 HydrophobicContact CG2-CG2 4.29Å; T301-G340 WeakPolarHBondContact O-CA 3.49Å
302	E	86.9	Confident	89.3	Confident	30 Å²	30	33.1 Å²	33.1	14%	0.14	18%	0.178	C	C	.	.			trans	-140.8	83.6	-179.5	-74.4	177.2	-150.3	0	0	110.1	T90 H93 P116 L300 E304 S305	T90-E302 WeakPolarHBondContact CB-OE1 3.25Å; T90-E302 WeakPolarHBondContact CG2-OE1 3.19Å; H93-E302 IonicContact CE1-OE1 2.62Å; H93-E302 IonicContact ND1-OE1 2.91Å; H93-E302 PolarHBondContact ND1-OE1 3.26Å; P116-E302 HydrophobicContact CB-CB 4.39Å; P116-E302 VanDerWaalsContact CB-CD 3.41Å; P116-E302 HydrophobicContact CB-CG 4.24Å; P116-E302 WeakPolarHBondContact CB-OE1 3.38Å; P116-E302 WeakPolarHBondContact CB-OE2 3.3Å; P116-E302 WeakPolarHBondContact CG-OE1 3.4Å; L300-E302 VanDerWaalsContact C-N 3.31Å; L300-E302 PolarHBondContact O-N 2.92Å; E302-E304 PolarHBondContact O-N 3.36Å; E302-S305 WeakPolarHBondContact O-CB 3.27Å; E302-S305 PolarHBondContact O-N 2.83Å; E302-S305 VanDerWaalsContact O-N 3.08Å; E302-S305 PolarHBondContact O-OG 3.15Å
303	I	90.4	Very high	90.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-60.9	-28	-178.9	-165.6	160	0	0	0	112.6	S305 I306 L311 F339 G340 L341 F349 R352	I303-S305 PolarHBondContact O-N 3.32Å; I303-I306 PolarHBondContact O-N 2.76Å; I303-L311 HydrophobicContact CD1-CD1 4.32Å; I303-L311 HydrophobicContact CD1-CD2 3.83Å; I303-L311 HydrophobicContact CG1-CD1 4.25Å; I303-L311 HydrophobicContact CG1-CD2 3.41Å; I303-L311 VanDerWaalsContact CG1-CD2 3.41Å; I303-L311 HydrophobicContact CG1-CG 4.45Å; I303-F339 HydrophobicContact CD1-CB 3.98Å; I303-F339 HydrophobicContact CD1-CD1 4.04Å; I303-F339 HydrophobicContact CD1-CD2 3.52Å; I303-F339 HydrophobicContact CD1-CE1 4.39Å; I303-F339 HydrophobicContact CD1-CE2 3.91Å; I303-F339 HydrophobicContact CD1-CG 3.59Å; I303-F339 HydrophobicContact CD1-CZ 4.33Å; I303-G340 WeakPolarHBondContact CG2-O 3.44Å; I303-G340 PolarHBondContact N-O 3.29Å; I303-G340 VanDerWaalsContact N-O 3.14Å; I303-L341 HydrophobicContact CG2-CD2 3.24Å; I303-L341 HydrophobicContact CG2-CG 4.01Å; I303-F349 HydrophobicContact CD1-CD2 3.9Å; I303-F349 HydrophobicContact CD1-CE2 3.61Å; I303-R352 PolarHBondContact O-NH1 2.82Å
304	E	86.7	Confident	91.6	Very high	68 Å²	68	32.8 Å²	32.8	32%	0.318	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-60.8	-28.6	176.6	-66.8	174	-176.4	0	0	113	E302 L341 T343 R352	E302-E304 PolarHBondContact O-N 3.36Å; E304-L341 HydrophobicContact CG-CD2 4.37Å; E304-T343 VanDerWaalsContact OE1-CB 3.31Å; E304-T343 WeakPolarHBondContact OE1-CB 3.46Å; E304-T343 WeakPolarHBondContact OE1-CG2 2.89Å; E304-T343 PolarHBondContact OE1-N 2.99Å; E304-T343 PolarHBondContact OE1-OG1 3.14Å; E304-R352 VanDerWaalsContact CA-NH1 3.34Å
305	S	87.6	Confident	92	Very high	62 Å²	62	27.3 Å²	27.3	43%	0.434	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-77.3	-21.1	179.9	71.9	0	0	0	0	114	E302 I303	E302-S305 WeakPolarHBondContact O-CB 3.27Å; E302-S305 PolarHBondContact O-N 2.83Å; E302-S305 VanDerWaalsContact O-N 3.08Å; E302-S305 PolarHBondContact O-OG 3.15Å; I303-S305 PolarHBondContact O-N 3.32Å
306	I	90.9	Very high	92.2	Very high	3 Å²	3	31 Å²	31	2%	0.015	17%	0.166	C	C	.	.	S	Bend	trans	-85.6	131.1	-175.4	-57	175.6	0	0	0	109.3	T120 L300 I303 V308 V310 L311 R352	T120-I306 HydrophobicContact CG2-CG1 4.26Å; L300-I306 HydrophobicContact CB-CD1 4.46Å; L300-I306 HydrophobicContact CD1-CD1 3.94Å; L300-I306 HydrophobicContact CD2-CD1 4.25Å; L300-I306 HydrophobicContact CG-CD1 4.45Å; I303-I306 PolarHBondContact O-N 2.76Å; I306-V308 PolarHBondContact O-N 3.02Å; I306-V310 HydrophobicContact CG2-CB 4.41Å; I306-V310 HydrophobicContact CG2-CG1 4.32Å; I306-L311 HydrophobicContact CG2-CB 4.06Å; I306-R352 PolarHBondContact O-NH2 3.22Å
307	P	92.2	Very high	92.1	Very high	62 Å²	62	33.5 Å²	33.5	40%	0.403	18%	0.18	S	C	.	.			trans	-55.6	138.4	175.6	-24.7	33.8	0	0	0	112.7	T120 Q309 V310 L311	T120-P307 WeakPolarHBondContact O-CD 3.48Å; P307-Q309 VanDerWaalsContact C-N 3.34Å; P307-Q309 PolarHBondContact O-N 3.26Å; P307-V310 HydrophobicContact CB-CB 4.41Å; P307-V310 HydrophobicContact CB-CG2 4.11Å; P307-V310 HydrophobicContact CG-CG2 4.39Å; P307-V310 PolarHBondContact O-N 3.49Å; P307-L311 PolarHBondContact O-N 3.39Å; P307-L311 VanDerWaalsContact O-N 3.09Å
308	V	92.7	Very high	92	Very high	57 Å²	57	33.5 Å²	33.5	35%	0.345	18%	0.18	S	C	.	.	H	α-helix	trans	-56.1	-46.5	-174.6	177	0	0	0	0	112	I306 V310 L311 C312 R352	I306-V308 PolarHBondContact O-N 3.02Å; V308-V310 PolarHBondContact O-N 3.39Å; V308-L311 PolarHBondContact O-N 3.06Å; V308-C312 WeakPolarHBondContact O-CB 3.29Å; V308-C312 PolarHBondContact O-N 3.27Å; V308-C312 PolarHBondContact O-SG 3.11Å; V308-R352 WeakPolarHBondContact CG1-O 3.44Å; V308-R352 HydrophobicContact CG2-CB 4.3Å
309	Q	93	Very high	91.8	Very high	159 Å²	159	33.7 Å²	33.7	74%	0.743	18%	0.181	S	C	*	.	H	α-helix	trans	-59	-46.2	-179.4	-68.5	175.6	-12.2	0	0	111.9	P307 L311 C312 D313	P307-Q309 VanDerWaalsContact C-N 3.34Å; P307-Q309 PolarHBondContact O-N 3.26Å; Q309-L311 VanDerWaalsContact C-N 3.3Å; Q309-L311 PolarHBondContact O-N 3.3Å; Q309-C312 PolarHBondContact O-N 3.45Å; Q309-D313 WeakPolarHBondContact O-CB 3.49Å; Q309-D313 PolarHBondContact O-N 3.29Å
310	V	94.3	Very high	91.4	Very high	13 Å²	13	36.8 Å²	36.8	8%	0.079	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-41.1	178.7	176.1	0	0	0	0	111.2	T121 V123 L126 I306 P307 V308 F314	T121-V310 WeakPolarHBondContact O-CG2 3.47Å; V123-V310 HydrophobicContact CG2-CB 4.44Å; V123-V310 HydrophobicContact CG2-CG1 4.08Å; L126-V310 HydrophobicContact CD2-CG1 4.13Å; I306-V310 HydrophobicContact CG2-CB 4.41Å; I306-V310 HydrophobicContact CG2-CG1 4.32Å; P307-V310 HydrophobicContact CB-CB 4.41Å; P307-V310 HydrophobicContact CB-CG2 4.11Å; P307-V310 HydrophobicContact CG-CG2 4.39Å; P307-V310 PolarHBondContact O-N 3.49Å; V308-V310 PolarHBondContact O-N 3.39Å; V310-F314 WeakPolarHBondContact O-CB 3.48Å; V310-F314 PolarHBondContact O-N 3.48Å
311	L	93.3	Very high	91.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-69.9	-41.8	-179	-173.7	59.5	0	0	0	112.3	L300 I303 I306 P307 V308 Q309 F314 I315 F353	L300-L311 HydrophobicContact CD1-CD1 3.98Å; I303-L311 HydrophobicContact CD1-CD1 4.32Å; I303-L311 HydrophobicContact CD1-CD2 3.83Å; I303-L311 HydrophobicContact CG1-CD1 4.25Å; I303-L311 HydrophobicContact CG1-CD2 3.41Å; I303-L311 VanDerWaalsContact CG1-CD2 3.41Å; I303-L311 HydrophobicContact CG1-CG 4.45Å; I306-L311 HydrophobicContact CG2-CB 4.06Å; P307-L311 PolarHBondContact O-N 3.39Å; P307-L311 VanDerWaalsContact O-N 3.09Å; V308-L311 PolarHBondContact O-N 3.06Å; Q309-L311 VanDerWaalsContact C-N 3.3Å; Q309-L311 PolarHBondContact O-N 3.3Å; L311-F314 PolarHBondContact O-N 2.9Å; L311-I315 HydrophobicContact CD1-CD1 4.3Å; L311-I315 HydrophobicContact CG-CD1 4.13Å; L311-I315 WeakPolarHBondContact O-CD1 3.41Å; L311-I315 VanDerWaalsContact O-CG1 3.29Å; L311-I315 WeakPolarHBondContact O-CG1 3.36Å; L311-I315 PolarHBondContact O-N 2.83Å; L311-F353 HydrophobicContact CD2-CE1 3.85Å; L311-F353 HydrophobicContact CD2-CZ 3.43Å; L311-F353 VanDerWaalsContact CD2-CZ 3.43Å; L311-F353 HydrophobicContact CG-CE1 3.84Å; L311-F353 HydrophobicContact CG-CZ 3.8Å
312	C	93.9	Very high	90.9	Very high	19 Å²	19	38.8 Å²	38.8	13%	0.128	21%	0.205	C	C	.	.	H	α-helix	trans	-58.1	-53.3	174.1	-69.5	0	0	0	0	111.4	V308 Q309 F314 I315 E316 I357	V308-C312 WeakPolarHBondContact O-CB 3.29Å; V308-C312 PolarHBondContact O-N 3.27Å; V308-C312 PolarHBondContact O-SG 3.11Å; Q309-C312 PolarHBondContact O-N 3.45Å; C312-F314 VanDerWaalsContact C-N 3.28Å; C312-F314 PolarHBondContact O-N 3.35Å; C312-I315 PolarHBondContact O-N 3.27Å; C312-E316 PolarHBondContact O-N 3.2Å; C312-I357 HydrophobicContact CB-CD1 3.46Å; C312-I357 VanDerWaalsContact CB-CD1 3.46Å; C312-I357 WeakPolarHBondContact SG-CD1 3.03Å
313	D	94.2	Very high	90.5	Very high	82 Å²	82	38.6 Å²	38.6	44%	0.439	21%	0.207	S	C	.	.	H	α-helix	trans	-62.7	-37.2	179.6	-66	-8	0	0	0	111.3	V123 Q309 L317	V123-D313 HydrophobicContact CG2-CB 3.47Å; V123-D313 VanDerWaalsContact CG2-CB 3.47Å; Q309-D313 WeakPolarHBondContact O-CB 3.49Å; Q309-D313 PolarHBondContact O-N 3.29Å; D313-L317 WeakPolarHBondContact O-CB 3.26Å; D313-L317 PolarHBondContact O-N 2.95Å
314	F	94.5	Very high	89.6	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.4	-43.8	176.4	176.4	-104.4	0	0	0	112.5	L126 V127 V130 Y181 I298 V310 L311 C312 T318 F337	L126-F314 HydrophobicContact CD2-CB 3.89Å; L126-F314 HydrophobicContact CD2-CD1 3.95Å; L126-F314 HydrophobicContact CD2-CD2 3.69Å; L126-F314 HydrophobicContact CD2-CE1 4.4Å; L126-F314 HydrophobicContact CD2-CE2 4.17Å; L126-F314 HydrophobicContact CD2-CG 3.56Å; L126-F314 HydrophobicContact CD2-CZ 4.5Å; L126-F314 HydrophobicContact CG-CD2 3.93Å; L126-F314 HydrophobicContact CG-CE2 4.04Å; L126-F314 HydrophobicContact CG-CG 4.31Å; V127-F314 HydrophobicContact CG2-CD2 3.8Å; V127-F314 HydrophobicContact CG2-CE2 3.98Å; V130-F314 HydrophobicContact CG2-CZ 4.34Å; Y181-F314 VanDerWaalsContact OH-CE2 3.23Å; Y181-F314 WeakPolarHBondContact OH-CE2 3.42Å; I298-F314 HydrophobicContact CD1-CZ 4.28Å; I298-F314 HydrophobicContact CG2-CZ 4.41Å; V310-F314 WeakPolarHBondContact O-CB 3.48Å; V310-F314 PolarHBondContact O-N 3.48Å; L311-F314 PolarHBondContact O-N 2.9Å; C312-F314 VanDerWaalsContact C-N 3.28Å; C312-F314 PolarHBondContact O-N 3.35Å; F314-T318 WeakPolarHBondContact O-CB 3.29Å; F314-T318 PolarHBondContact O-N 3.46Å; F314-T318 PolarHBondContact O-OG1 3.01Å; F314-F337 HydrophobicContact CD1-CZ 4.39Å; F314-F337 AromaticContact CE1-CE1 3.65Å; F314-F337 HydrophobicContact CE1-CE1 3.65Å; F314-F337 AromaticContact CE1-CZ 3.81Å; F314-F337 HydrophobicContact CE1-CZ 3.81Å; F314-F337 HydrophobicContact CZ-CE1 4.17Å
315	I	93.8	Very high	88.6	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.8	-44.8	176.4	-69.7	161.7	0	0	0	110.3	L311 C312 T318 S319 F337 F353 I357 L361	L311-I315 HydrophobicContact CD1-CD1 4.3Å; L311-I315 HydrophobicContact CG-CD1 4.13Å; L311-I315 WeakPolarHBondContact O-CD1 3.41Å; L311-I315 VanDerWaalsContact O-CG1 3.29Å; L311-I315 WeakPolarHBondContact O-CG1 3.36Å; L311-I315 PolarHBondContact O-N 2.83Å; C312-I315 PolarHBondContact O-N 3.27Å; I315-T318 PolarHBondContact O-N 2.96Å; I315-S319 VanDerWaalsContact O-CB 3.24Å; I315-S319 WeakPolarHBondContact O-CB 3.47Å; I315-S319 PolarHBondContact O-N 3.33Å; I315-F337 HydrophobicContact CG1-CE2 4.38Å; I315-F353 HydrophobicContact CD1-CD1 4.4Å; I315-F353 HydrophobicContact CD1-CE1 3.62Å; I315-F353 HydrophobicContact CD1-CZ 3.85Å; I315-I357 HydrophobicContact CB-CG2 4.3Å; I315-I357 HydrophobicContact CD1-CG2 4.07Å; I315-I357 HydrophobicContact CG2-CG2 3.93Å; I315-L361 HydrophobicContact CD1-CD1 4.29Å; I315-L361 HydrophobicContact CG2-CD2 3.76Å; I315-L361 HydrophobicContact CG2-CG 4.29Å
316	E	91.6	Very high	87.3	Confident	89 Å²	89	41.6 Å²	41.6	42%	0.416	22%	0.22	S	C	.	.	H	α-helix	trans	-61.5	-48	177.4	177.6	164.1	-151.1	0	0	111.5	C312 T318 S319 L320 R360	C312-E316 PolarHBondContact O-N 3.2Å; E316-T318 PolarHBondContact O-N 3.29Å; E316-S319 WeakPolarHBondContact O-CB 3.35Å; E316-S319 PolarHBondContact O-N 3.44Å; E316-L320 WeakPolarHBondContact O-CG 3.13Å; E316-L320 PolarHBondContact O-N 2.89Å; E316-R360 IonicContact OE1-NH2 3.52Å; E316-R360 PolarHBondContact OE1-NH2 3.04Å
317	L	91.3	Very high	85.4	Confident	54 Å²	54	53.7 Å²	53.7	28%	0.283	27%	0.266	S	S	.	.	H	α-helix	trans	-58.8	-49.4	176.9	-174.8	66.8	0	0	0	110.8	V123 V127 Y181 D313 S319 L320 Y321	V123-L317 HydrophobicContact CG1-CD2 4.21Å; V127-L317 HydrophobicContact CG2-CD2 3.95Å; Y181-L317 HydrophobicContact CD2-CD2 3.97Å; Y181-L317 HydrophobicContact CD2-CG 4.19Å; Y181-L317 HydrophobicContact CE2-CD2 3.93Å; Y181-L317 HydrophobicContact CE2-CG 4.2Å; D313-L317 WeakPolarHBondContact O-CB 3.26Å; D313-L317 PolarHBondContact O-N 2.95Å; L317-S319 VanDerWaalsContact C-N 3.3Å; L317-S319 PolarHBondContact O-N 3.44Å; L317-L320 WeakPolarHBondContact O-CB 3.43Å; L317-L320 PolarHBondContact O-N 3.07Å; L317-Y321 HydrophobicContact CD1-CD2 4.48Å; L317-Y321 HydrophobicContact CD1-CE2 3.8Å; L317-Y321 HydrophobicContact CG-CD2 4.39Å; L317-Y321 HydrophobicContact CG-CE2 4.05Å; L317-Y321 WeakPolarHBondContact O-CD2 3.38Å; L317-Y321 PolarHBondContact O-N 3.22Å
318	T	91.5	Very high	83.4	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.3	-39.6	179.6	-52.3	0	0	0	0	111.4	I79 Y181 F314 I315 E316 L320 Y321 V322 I335 F337	I79-T318 HydrophobicContact CD1-CG2 4.05Å; Y181-T318 PolarHBondContact OH-OG1 2.98Å; F314-T318 WeakPolarHBondContact O-CB 3.29Å; F314-T318 PolarHBondContact O-N 3.46Å; F314-T318 PolarHBondContact O-OG1 3.01Å; I315-T318 PolarHBondContact O-N 2.96Å; E316-T318 PolarHBondContact O-N 3.29Å; T318-L320 VanDerWaalsContact C-N 3.27Å; T318-L320 PolarHBondContact O-N 3.45Å; T318-Y321 PolarHBondContact O-N 3.09Å; T318-V322 HydrophobicContact CG2-CG2 4.2Å; T318-V322 WeakPolarHBondContact O-CG2 3.35Å; T318-V322 PolarHBondContact O-N 3.5Å; T318-I335 HydrophobicContact CG2-CB 4.33Å; T318-I335 HydrophobicContact CG2-CD1 3.68Å; T318-I335 HydrophobicContact CG2-CG2 3.92Å; T318-F337 HydrophobicContact CG2-CE1 4.26Å; T318-F337 HydrophobicContact CG2-CE2 4.44Å; T318-F337 HydrophobicContact CG2-CZ 3.67Å
319	S	89.3	Confident	81.5	Confident	4 Å²	4	58 Å²	58	3%	0.028	29%	0.294	C	S	.	.	H	α-helix	trans	-59.7	-36.5	178.8	172.3	0	0	0	0	111.9	I315 E316 L317 Y321 V322 S323 R360	I315-S319 VanDerWaalsContact O-CB 3.24Å; I315-S319 WeakPolarHBondContact O-CB 3.47Å; I315-S319 PolarHBondContact O-N 3.33Å; E316-S319 WeakPolarHBondContact O-CB 3.35Å; E316-S319 PolarHBondContact O-N 3.44Å; L317-S319 VanDerWaalsContact C-N 3.3Å; L317-S319 PolarHBondContact O-N 3.44Å; S319-Y321 PolarHBondContact O-N 3.37Å; S319-V322 PolarHBondContact O-N 3.42Å; S319-S323 WeakPolarHBondContact O-CB 3.48Å; S319-S323 PolarHBondContact O-N 2.97Å; S319-S323 PolarHBondContact O-OG 3.29Å; S319-S323 VanDerWaalsContact O-OG 3.12Å; S319-R360 PolarHBondContact OG-NH1 3.11Å
320	L	87.4	Confident	80	Confident	64 Å²	64	55.4 Å²	55.4	34%	0.335	29%	0.293	S	S	.	.	H	α-helix	trans	-65.1	-36.7	174.9	-64.1	170.7	0	0	0	113	E316 L317 T318 S323 G324 Q325	E316-L320 WeakPolarHBondContact O-CG 3.13Å; E316-L320 PolarHBondContact O-N 2.89Å; L317-L320 WeakPolarHBondContact O-CB 3.43Å; L317-L320 PolarHBondContact O-N 3.07Å; T318-L320 VanDerWaalsContact C-N 3.27Å; T318-L320 PolarHBondContact O-N 3.45Å; L320-S323 PolarHBondContact O-OG 2.89Å; L320-G324 PolarHBondContact O-N 2.91Å; L320-Q325 PolarHBondContact O-N 3.28Å
321	Y	86.8	Confident	78.6	Confident	43 Å²	43	55.3 Å²	55.3	17%	0.169	29%	0.293	C	S	.	.	H	α-helix	trans	-78.6	-27.2	177.8	-73.3	-82.3	0	0	0	112.9	Y181 I185 L317 T318 S319 I326 L333	Y181-Y321 VanDerWaalsContact CB-CE1 3.42Å; Y181-Y321 VanDerWaalsContact CB-CE2 3.47Å; Y181-Y321 HydrophobicContact CD1-CD2 4.2Å; Y181-Y321 HydrophobicContact CD1-CG 4.21Å; Y181-Y321 AromaticContact CD2-CD2 3.88Å; Y181-Y321 HydrophobicContact CD2-CD2 3.88Å; Y181-Y321 AromaticContact CD2-CE2 3.84Å; Y181-Y321 HydrophobicContact CD2-CE2 3.84Å; Y181-Y321 HydrophobicContact CG-CD1 4.35Å; Y181-Y321 AromaticContact CG-CD2 3.68Å; Y181-Y321 HydrophobicContact CG-CD2 3.68Å; Y181-Y321 HydrophobicContact CG-CE1 4.43Å; Y181-Y321 AromaticContact CG-CE2 3.8Å; Y181-Y321 HydrophobicContact CG-CE2 3.8Å; Y181-Y321 HydrophobicContact CG-CG 4.02Å; I185-Y321 HydrophobicContact CD1-CD1 3.5Å; I185-Y321 HydrophobicContact CD1-CE1 3.78Å; I185-Y321 HydrophobicContact CG1-CD1 4.37Å; L317-Y321 HydrophobicContact CD1-CD2 4.48Å; L317-Y321 HydrophobicContact CD1-CE2 3.8Å; L317-Y321 HydrophobicContact CG-CD2 4.39Å; L317-Y321 HydrophobicContact CG-CE2 4.05Å; L317-Y321 WeakPolarHBondContact O-CD2 3.38Å; L317-Y321 PolarHBondContact O-N 3.22Å; T318-Y321 PolarHBondContact O-N 3.09Å; S319-Y321 PolarHBondContact O-N 3.37Å; Y321-I326 HydrophobicContact CD1-CD1 3.33Å; Y321-I326 HydrophobicContact CE1-CD1 3.35Å; Y321-I326 HydrophobicContact CG-CD1 4.07Å; Y321-L333 PolarHBondContact O-N 2.95Å
322	V	85.8	Confident	78.1	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.03	30%	0.298	C	S	.	.	H	α-helix	trans	-76.1	-42.1	173.8	173.9	0	0	0	0	111.1	I79 T318 S319 G324 S332 I335	I79-V322 HydrophobicContact CG1-CB 4.39Å; I79-V322 HydrophobicContact CG1-CG1 4.49Å; I79-V322 HydrophobicContact CG1-CG2 4.2Å; T318-V322 HydrophobicContact CG2-CG2 4.2Å; T318-V322 WeakPolarHBondContact O-CG2 3.35Å; T318-V322 PolarHBondContact O-N 3.5Å; S319-V322 PolarHBondContact O-N 3.42Å; V322-G324 PolarHBondContact O-N 3.06Å; V322-S332 VanDerWaalsContact O-CB 3.26Å; V322-S332 WeakPolarHBondContact O-CB 3.41Å; V322-I335 HydrophobicContact CG2-CB 3.79Å; V322-I335 HydrophobicContact CG2-CD1 4.19Å; V322-I335 HydrophobicContact CG2-CG1 4.24Å
323	S	78.6	Confident	77.7	Confident	26 Å²	26	55.2 Å²	55.2	18%	0.182	29%	0.292	C	S	.	.	H	α-helix	trans	-73.2	-16	179.7	69.9	0	0	0	0	113.7	S319 L320 Q325	S319-S323 WeakPolarHBondContact O-CB 3.48Å; S319-S323 PolarHBondContact O-N 2.97Å; S319-S323 PolarHBondContact O-OG 3.29Å; S319-S323 VanDerWaalsContact O-OG 3.12Å; L320-S323 PolarHBondContact O-OG 2.89Å; S323-Q325 PolarHBondContact O-N 3.42Å; S323-Q325 WeakPolarHBondContact OG-CG 3.5Å; S323-Q325 PolarHBondContact OG-N 3.21Å
324	G	73.1	Confident	77.5	Confident	17 Å²	17	51.6 Å²	51.6	18%	0.175	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	15.8	-177.4	0	0	0	0	0	114	L320 V322 I326	L320-G324 PolarHBondContact O-N 2.91Å; V322-G324 PolarHBondContact O-N 3.06Å; G324-I326 PolarHBondContact O-N 3.15Å
325	Q	64	Low	77.3	Confident	115 Å²	115	51.7 Å²	51.7	54%	0.537	27%	0.273	S	S	.	.			trans	-81.6	44.1	-176.8	-69.3	179.7	-9.9	0	0	113.3	L320 S323	L320-Q325 PolarHBondContact O-N 3.28Å; S323-Q325 PolarHBondContact O-N 3.42Å; S323-Q325 WeakPolarHBondContact OG-CG 3.5Å; S323-Q325 PolarHBondContact OG-N 3.21Å
326	I	62.3	Low	77.3	Confident	61 Å²	61	51.8 Å²	51.8	31%	0.313	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-99.5	123.5	-178.6	-56.1	172.3	0	0	0	108.9	I185 Y321 G324 G328 R329	I185-I326 HydrophobicContact CD1-CD1 4.25Å; Y321-I326 HydrophobicContact CD1-CD1 3.33Å; Y321-I326 HydrophobicContact CE1-CD1 3.35Å; Y321-I326 HydrophobicContact CG-CD1 4.07Å; G324-I326 PolarHBondContact O-N 3.15Å; I326-G328 PolarHBondContact O-N 2.82Å; I326-R329 PolarHBondContact O-N 2.91Å
327	R	49.5	Very low	77.5	Confident	258 Å²	258	47.6 Å²	47.6	97%	0.974	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	109.9	-178.7	-72.7	-173.1	178.2	-168.6	0.2	110.9
328	G	51.7	Low	77.7	Confident	83 Å²	83	45 Å²	45	86%	0.856	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	99.6	-3.2	171.2	0	0	0	0	0	117.2	I326	I326-G328 PolarHBondContact O-N 2.82Å
329	R	52.5	Low	77.8	Confident	127 Å²	127	45 Å²	45	48%	0.479	24%	0.241	S	C	.	.	B	Isolated β-bridge	trans	-142.8	125.9	175.2	-71.1	-177.1	178.4	-174.9	-7.6	111.9	E186 I326 C331	E186-R329 IonicContact OE1-CZ 2.81Å; E186-R329 IonicContact OE1-NH1 3.1Å; E186-R329 PolarHBondContact OE1-NH1 3.03Å; E186-R329 IonicContact OE1-NH2 3.21Å; E186-R329 PolarHBondContact OE1-NH2 3.14Å; I326-R329 PolarHBondContact O-N 2.91Å; R329-C331 PolarHBondContact O-N 3.32Å
330	S	59.8	Low	78	Confident	104 Å²	104	44.8 Å²	44.8	73%	0.727	24%	0.239	S	C	*	.			trans	-91.7	68.1	177.4	-49.8	0	0	0	0	111.1	Y195	Y195-S330 WeakPolarHBondContact CE1-O 3.31Å; Y195-S330 PolarHBondContact OH-O 3.36Å
331	C	66.7	Low	78.2	Confident	11 Å²	11	41.8 Å²	41.8	7%	0.074	22%	0.224	C	C	.	.			trans	-128.5	123.3	-179.3	-53.6	0	0	0	0	109.7	I185 Y189 Y195 R329	I185-C331 HydrophobicContact CG2-CB 4.14Å; Y189-C331 HydrophobicContact CD2-CB 4.36Å; Y189-C331 HydrophobicContact CE2-CB 3.79Å; Y195-C331 WeakPolarHBondContact CD1-SG 3.43Å; Y195-C331 WeakPolarHBondContact CE1-SG 3.49Å; R329-C331 PolarHBondContact O-N 3.32Å
332	S	82.5	Confident	78.2	Confident	17 Å²	17	40.8 Å²	40.8	12%	0.119	22%	0.223	C	C	.	.			trans	-112.7	143.7	-179.1	56.1	0	0	0	0	111	W62 Y189 V322	W62-S332 WeakPolarHBondContact CZ2-O 3.44Å; Y189-S332 PolarHBondContact OH-N 3.29Å; Y189-S332 PolarHBondContact OH-O 2.97Å; V322-S332 VanDerWaalsContact O-CB 3.26Å; V322-S332 WeakPolarHBondContact O-CB 3.41Å
333	L	86	Confident	78.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.238	C	C	.	.			trans	-101.8	134.1	176.6	-67.1	178.4	0	0	0	111.2	Y181 L184 I185 Y188 Y189 L296 Y321 I335	Y181-L333 HydrophobicContact CD1-CD1 4.29Å; L184-L333 HydrophobicContact CD2-CD1 3.91Å; L184-L333 HydrophobicContact CG-CD1 4.25Å; I185-L333 HydrophobicContact CG1-CD1 3.85Å; I185-L333 HydrophobicContact CG1-CD2 3.99Å; I185-L333 HydrophobicContact CG1-CG 3.92Å; Y188-L333 HydrophobicContact CD1-CD2 3.83Å; Y188-L333 HydrophobicContact CG-CD2 4.02Å; Y189-L333 HydrophobicContact CE2-CD2 4.38Å; L296-L333 HydrophobicContact CD1-CB 4.41Å; L296-L333 HydrophobicContact CD1-CD2 4.22Å; Y321-L333 PolarHBondContact O-N 2.95Å; L333-I335 HydrophobicContact CB-CD1 3.89Å; L333-I335 HydrophobicContact CB-CG1 3.81Å; L333-I335 HydrophobicContact CD1-CD1 4.06Å; L333-I335 PolarHBondContact O-N 2.98Å
334	P	88.1	Confident	78.7	Confident	5 Å²	5	47 Å²	47	3%	0.032	26%	0.255	C	S	.	.			trans	-81.4	67.6	176.3	31.6	-31.9	0	0	0	111.3	W62 Y188 L296	W62-P334 HydrophobicContact CD2-CB 3.67Å; W62-P334 HydrophobicContact CD2-CG 4.41Å; W62-P334 HydrophobicContact CE3-CB 3.82Å; W62-P334 HydrophobicContact CE3-CG 4.24Å; W62-P334 HydrophobicContact CG-CB 4.09Å; W62-P334 HydrophobicContact CH2-CB 4.35Å; W62-P334 HydrophobicContact CH2-CG 4.06Å; W62-P334 HydrophobicContact CZ2-CB 4.19Å; W62-P334 HydrophobicContact CZ2-CG 4.21Å; W62-P334 HydrophobicContact CZ3-CB 4.16Å; W62-P334 HydrophobicContact CZ3-CG 4.07Å; Y188-P334 HydrophobicContact CE1-CG 4.06Å; Y188-P334 HydrophobicContact CE2-CG 4.43Å; Y188-P334 WeakPolarHBondContact OH-CG 3.45Å; L296-P334 PolarHBondContact N-O 3.41Å
335	I	91.7	Very high	79.5	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	128	-179.3	-59.9	172.9	0	0	0	110	Y181 L296 I298 T318 V322 L333 F337	Y181-I335 HydrophobicContact CD1-CD1 4.49Å; Y181-I335 HydrophobicContact CE1-CD1 3.85Å; L296-I335 HydrophobicContact CB-CG1 4.24Å; L296-I335 HydrophobicContact CD1-CG1 4.31Å; L296-I335 CarbonylContact O-C 3.53Å; L296-I335 VanDerWaalsContact O-CA 3.31Å; L296-I335 WeakPolarHBondContact O-CA 3.28Å; I298-I335 HydrophobicContact CD1-CG2 3.54Å; I298-I335 HydrophobicContact CG1-CG2 4.15Å; T318-I335 HydrophobicContact CG2-CB 4.33Å; T318-I335 HydrophobicContact CG2-CD1 3.68Å; T318-I335 HydrophobicContact CG2-CG2 3.92Å; V322-I335 HydrophobicContact CG2-CB 3.79Å; V322-I335 HydrophobicContact CG2-CD1 4.19Å; V322-I335 HydrophobicContact CG2-CG1 4.24Å; L333-I335 HydrophobicContact CB-CD1 3.89Å; L333-I335 HydrophobicContact CB-CG1 3.81Å; L333-I335 HydrophobicContact CD1-CD1 4.06Å; L333-I335 PolarHBondContact O-N 2.98Å; I335-F337 HydrophobicContact CG2-CE1 4.3Å
336	N	93.2	Very high	80.6	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.016	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	137.1	171.2	-64	-90	0	0	0	109.7	S58 P80 L296 V297 I298	S58-N336 WeakPolarHBondContact CB-OD1 3.31Å; P80-N336 WeakPolarHBondContact CB-OD1 3.25Å; P80-N336 WeakPolarHBondContact CG-OD1 3.1Å; L296-N336 PolarHBondContact O-N 3.3Å; V297-N336 WeakPolarHBondContact CA-O 3.49Å; I298-N336 PolarHBondContact N-O 3.46Å
337	F	95.8	Very high	81.6	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	140.1	174.9	-73.4	-41.9	0	0	0	111.8	I79 P80 T81 A82 I298 F314 I315 T318 I335 F339 L361	I79-F337 HydrophobicContact CB-CD2 4.16Å; I79-F337 HydrophobicContact CB-CE2 4.21Å; I79-F337 HydrophobicContact CD1-CD2 4.29Å; I79-F337 HydrophobicContact CD1-CE2 3.5Å; I79-F337 VanDerWaalsContact CD1-CE2 3.5Å; I79-F337 HydrophobicContact CD1-CZ 4.15Å; I79-F337 HydrophobicContact CG1-CE2 4.46Å; I79-F337 HydrophobicContact CG2-CD2 3.46Å; I79-F337 VanDerWaalsContact CG2-CD2 3.46Å; I79-F337 HydrophobicContact CG2-CE2 3.69Å; I79-F337 HydrophobicContact CG2-CG 4.13Å; I79-F337 HydrophobicContact CG2-CZ 4.49Å; P80-F337 PolarHBondContact O-N 2.89Å; T81-F337 CarbonylContact C-O 3.59Å; T81-F337 WeakPolarHBondContact CA-O 3.31Å; T81-F337 HydrophobicContact CG2-CB 3.86Å; A82-F337 PolarHBondContact N-O 3.1Å; I298-F337 HydrophobicContact CB-CD1 3.92Å; I298-F337 HydrophobicContact CB-CE1 4.13Å; I298-F337 HydrophobicContact CD1-CD1 4.43Å; I298-F337 HydrophobicContact CD1-CE1 3.87Å; I298-F337 HydrophobicContact CG2-CD1 4.28Å; I298-F337 HydrophobicContact CG2-CE1 4.29Å; F314-F337 HydrophobicContact CD1-CZ 4.39Å; F314-F337 AromaticContact CE1-CE1 3.65Å; F314-F337 HydrophobicContact CE1-CE1 3.65Å; F314-F337 AromaticContact CE1-CZ 3.81Å; F314-F337 HydrophobicContact CE1-CZ 3.81Å; F314-F337 HydrophobicContact CZ-CE1 4.17Å; I315-F337 HydrophobicContact CG1-CE2 4.38Å; T318-F337 HydrophobicContact CG2-CE1 4.26Å; T318-F337 HydrophobicContact CG2-CE2 4.44Å; T318-F337 HydrophobicContact CG2-CZ 3.67Å; I335-F337 HydrophobicContact CG2-CE1 4.3Å; F337-F339 HydrophobicContact CB-CD1 4.04Å; F337-F339 HydrophobicContact CB-CE1 3.56Å; F337-F339 HydrophobicContact CB-CE2 4.42Å; F337-F339 HydrophobicContact CB-CZ 3.79Å; F337-F339 AromaticContact CD1-CE1 3.78Å; F337-F339 HydrophobicContact CD1-CE1 3.78Å; F337-F339 HydrophobicContact CD1-CZ 4.16Å; F337-F339 AromaticContact CD2-CE1 3.98Å; F337-F339 HydrophobicContact CD2-CE1 3.98Å; F337-F339 HydrophobicContact CD2-CE2 4.34Å; F337-F339 AromaticContact CD2-CZ 3.52Å; F337-F339 HydrophobicContact CD2-CZ 3.52Å; F337-F339 HydrophobicContact CE1-CE1 4.48Å; F337-F339 HydrophobicContact CE2-CZ 4.07Å; F337-F339 HydrophobicContact CG-CD1 4.46Å; F337-F339 AromaticContact CG-CE1 3.53Å; F337-F339 HydrophobicContact CG-CE1 3.53Å; F337-F339 AromaticContact CG-CZ 3.58Å; F337-F339 HydrophobicContact CG-CZ 3.58Å; F337-L361 HydrophobicContact CD2-CD2 4.07Å; F337-L361 HydrophobicContact CE2-CD2 4.19Å
338	V	95.1	Very high	83	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	109	163.2	-176.2	0	0	0	0	107.7	I55 A82 L100 V297 I298 I299 L300	I55-V338 HydrophobicContact CD1-CG2 4.26Å; A82-V338 HydrophobicContact CB-CG2 4.3Å; A82-V338 CarbonylContact O-C 3.54Å; A82-V338 VanDerWaalsContact O-CA 3.32Å; A82-V338 WeakPolarHBondContact O-CA 3.46Å; L100-V338 HydrophobicContact CD2-CG1 4.13Å; V297-V338 HydrophobicContact CG1-CG2 3.79Å; I298-V338 PolarHBondContact O-N 3.18Å; I299-V338 CarbonylContact C-O 3.59Å; I299-V338 WeakPolarHBondContact CA-O 3.42Å; I299-V338 HydrophobicContact CB-CB 4.4Å; I299-V338 HydrophobicContact CG1-CB 4.05Å; I299-V338 HydrophobicContact CG1-CG2 4.3Å; I299-V338 HydrophobicContact CG2-CB 4.3Å; I299-V338 HydrophobicContact CG2-CG1 4.37Å; L300-V338 PolarHBondContact N-O 2.89Å
339	F	94.3	Very high	84.7	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	116.5	-179	-66.3	-17.6	0	0	0	110.3	T81 A82 L83 L84 L300 I303 F337 F349 L361	T81-F339 HydrophobicContact CG2-CD2 3.37Å; T81-F339 HydrophobicContact CG2-CE2 3.51Å; T81-F339 HydrophobicContact CG2-CG 4.01Å; T81-F339 HydrophobicContact CG2-CZ 4.23Å; A82-F339 PolarHBondContact O-N 3.3Å; L83-F339 HydrophobicContact CD1-CB 3.74Å; L83-F339 HydrophobicContact CD1-CD2 4.49Å; L84-F339 PolarHBondContact N-O 2.94Å; L300-F339 HydrophobicContact CB-CD1 4.08Å; L300-F339 HydrophobicContact CD1-CD1 3.86Å; L300-F339 HydrophobicContact CD1-CE1 3.52Å; L300-F339 HydrophobicContact CD1-CZ 4.43Å; L300-F339 HydrophobicContact CG-CD1 4.07Å; L300-F339 HydrophobicContact CG-CE1 4.04Å; I303-F339 HydrophobicContact CD1-CB 3.98Å; I303-F339 HydrophobicContact CD1-CD1 4.04Å; I303-F339 HydrophobicContact CD1-CD2 3.52Å; I303-F339 HydrophobicContact CD1-CE1 4.39Å; I303-F339 HydrophobicContact CD1-CE2 3.91Å; I303-F339 HydrophobicContact CD1-CG 3.59Å; I303-F339 HydrophobicContact CD1-CZ 4.33Å; F337-F339 HydrophobicContact CB-CD1 4.04Å; F337-F339 HydrophobicContact CB-CE1 3.56Å; F337-F339 HydrophobicContact CB-CE2 4.42Å; F337-F339 HydrophobicContact CB-CZ 3.79Å; F337-F339 AromaticContact CD1-CE1 3.78Å; F337-F339 HydrophobicContact CD1-CE1 3.78Å; F337-F339 HydrophobicContact CD1-CZ 4.16Å; F337-F339 AromaticContact CD2-CE1 3.98Å; F337-F339 HydrophobicContact CD2-CE1 3.98Å; F337-F339 HydrophobicContact CD2-CE2 4.34Å; F337-F339 AromaticContact CD2-CZ 3.52Å; F337-F339 HydrophobicContact CD2-CZ 3.52Å; F337-F339 HydrophobicContact CE1-CE1 4.48Å; F337-F339 HydrophobicContact CE2-CZ 4.07Å; F337-F339 HydrophobicContact CG-CD1 4.46Å; F337-F339 AromaticContact CG-CE1 3.53Å; F337-F339 HydrophobicContact CG-CE1 3.53Å; F337-F339 AromaticContact CG-CZ 3.58Å; F337-F339 HydrophobicContact CG-CZ 3.58Å; F339-F349 AromaticContact CD2-CE2 3.55Å; F339-F349 HydrophobicContact CD2-CE2 3.55Å; F339-F349 HydrophobicContact CD2-CZ 4.02Å; F339-F349 AromaticContact CE2-CE2 3.98Å; F339-F349 HydrophobicContact CE2-CE2 3.98Å; F339-F349 HydrophobicContact CE2-CZ 4.21Å; F339-L361 HydrophobicContact CE2-CD1 4.17Å
340	G	92.8	Very high	86.5	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	123.8	169.9	0	0	0	0	0	111.6	L84 Y97 L300 T301 I303	L84-G340 WeakPolarHBondContact O-CA 3.33Å; Y97-G340 WeakPolarHBondContact OH-CA 3.27Å; L300-G340 PolarHBondContact O-N 3.21Å; T301-G340 WeakPolarHBondContact O-CA 3.49Å; I303-G340 WeakPolarHBondContact CG2-O 3.44Å; I303-G340 PolarHBondContact N-O 3.29Å; I303-G340 VanDerWaalsContact N-O 3.14Å
341	L	91.7	Very high	87.9	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	136.1	174.5	-80.9	178.1	0	0	0	110.6	L83 L84 L85 A86 I303 E304 P345 F349	L83-L341 HydrophobicContact CD1-CD1 3.37Å; L83-L341 HydrophobicContact CD1-CG 3.75Å; L83-L341 HydrophobicContact CD2-CD1 3.61Å; L83-L341 HydrophobicContact CG-CD1 3.54Å; L83-L341 HydrophobicContact CG-CG 4.31Å; L84-L341 PolarHBondContact O-N 3.17Å; L85-L341 HydrophobicContact CD2-CB 3.93Å; L85-L341 HydrophobicContact CD2-CD1 4.12Å; A86-L341 PolarHBondContact N-O 3.29Å; I303-L341 HydrophobicContact CG2-CD2 3.24Å; I303-L341 HydrophobicContact CG2-CG 4.01Å; E304-L341 HydrophobicContact CG-CD2 4.37Å; L341-P345 HydrophobicContact CD1-CB 4.32Å; L341-P345 HydrophobicContact CD1-CG 4.16Å; L341-F349 HydrophobicContact CD1-CB 3.83Å; L341-F349 HydrophobicContact CD1-CG 4.33Å; L341-F349 HydrophobicContact CD2-CB 3.99Å; L341-F349 HydrophobicContact CD2-CD2 4.39Å
342	S	87.3	Confident	88.9	Confident	23 Å²	23	31.2 Å²	31.2	16%	0.161	17%	0.168	C	C	.	.	S	Bend	trans	-89.6	-30.6	172.7	-50.8	0	0	0	0	111.5	G87	G87-S342 WeakPolarHBondContact O-CA 3.38Å; G87-S342 WeakPolarHBondContact O-CB 3.43Å; G87-S342 PolarHBondContact O-OG 3.07Å
343	T	86.8	Confident	89.3	Confident	55 Å²	55	31.2 Å²	31.2	34%	0.337	17%	0.166	S	C	.	.	S	Bend	trans	-107.3	174.8	-179	66.1	0	0	0	0	113	L85 E304 G348	L85-T343 WeakPolarHBondContact CD2-O 3.44Å; E304-T343 VanDerWaalsContact OE1-CB 3.31Å; E304-T343 WeakPolarHBondContact OE1-CB 3.46Å; E304-T343 WeakPolarHBondContact OE1-CG2 2.89Å; E304-T343 PolarHBondContact OE1-N 2.99Å; E304-T343 PolarHBondContact OE1-OG1 3.14Å; T343-G348 VanDerWaalsContact OG1-CA 3.27Å; T343-G348 WeakPolarHBondContact OG1-CA 3.44Å
344	I	88.9	Confident	89.5	Confident	105 Å²	105	34.3 Å²	34.3	54%	0.538	19%	0.188	S	C	.	.			trans	-66.3	135.3	177.5	-57	175.8	0	0	0	109.3	E346 I347 G348	I344-E346 HydrophobicContact CG2-CB 4.5Å; I344-E346 WeakPolarHBondContact CG2-OE2 3.3Å; I344-E346 PolarHBondContact O-N 2.93Å; I344-E346 VanDerWaalsContact O-N 3.14Å; I344-I347 PolarHBondContact O-N 3.26Å; I344-G348 PolarHBondContact O-N 3.49Å
345	P	87.9	Confident	89.6	Confident	5 Å²	5	38 Å²	38	3%	0.032	22%	0.219	C	C	.	.	H	α-helix	trans	-53.5	-37.2	-174	-28.6	36.2	0	0	0	114.9	L83 L85 L341 I347 F349 E350	L83-P345 HydrophobicContact CD2-CB 3.87Å; L83-P345 HydrophobicContact CD2-CG 3.79Å; L85-P345 HydrophobicContact CD2-CG 3.92Å; L341-P345 HydrophobicContact CD1-CB 4.32Å; L341-P345 HydrophobicContact CD1-CG 4.16Å; P345-I347 PolarHBondContact O-N 3.02Å; P345-F349 WeakPolarHBondContact O-CB 3.21Å; P345-F349 PolarHBondContact O-N 3.26Å; P345-E350 PolarHBondContact O-N 3.37Å
346	E	87.8	Confident	89.5	Confident	100 Å²	100	41.5 Å²	41.5	47%	0.467	24%	0.243	S	C	.	.	H	α-helix	trans	-64.8	-20.6	-178.3	-68.5	79.7	177.6	0	0	113	I344 P351	I344-E346 HydrophobicContact CG2-CB 4.5Å; I344-E346 WeakPolarHBondContact CG2-OE2 3.3Å; I344-E346 PolarHBondContact O-N 2.93Å; I344-E346 VanDerWaalsContact O-N 3.14Å; E346-P351 WeakPolarHBondContact O-CD 3.44Å; E346-P351 WeakPolarHBondContact O-CG 3.3Å
347	I	82.9	Confident	89.4	Confident	125 Å²	125	42.3 Å²	42.3	64%	0.641	25%	0.248	S	C	*	.	H	α-helix	trans	-108.4	-47.8	180	-59.8	173.8	0	0	0	110.5	I344 P345	I344-I347 PolarHBondContact O-N 3.26Å; P345-I347 PolarHBondContact O-N 3.02Å
348	G	79.4	Confident	89.2	Confident	9 Å²	9	44.5 Å²	44.5	9%	0.093	26%	0.259	C	S	.	.	H	α-helix	trans	-90.3	-15.8	-170	0	0	0	0	0	115.8	T343 I344 R352	T343-G348 VanDerWaalsContact OG1-CA 3.27Å; T343-G348 WeakPolarHBondContact OG1-CA 3.44Å; I344-G348 PolarHBondContact O-N 3.49Å; G348-R352 WeakPolarHBondContact O-CD 3.31Å
349	F	88.4	Confident	89	Confident	1 Å²	1	47.7 Å²	47.7	0%	0.004	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.9	-62.7	-171.6	-177.2	-92.5	0	0	0	112.3	L83 I303 F339 L341 P345 R352 F353 L358 L361 I363	L83-F349 HydrophobicContact CD1-CD2 4.03Å; L83-F349 HydrophobicContact CD1-CE2 4.15Å; L83-F349 HydrophobicContact CD1-CG 4.36Å; I303-F349 HydrophobicContact CD1-CD2 3.9Å; I303-F349 HydrophobicContact CD1-CE2 3.61Å; F339-F349 AromaticContact CD2-CE2 3.55Å; F339-F349 HydrophobicContact CD2-CE2 3.55Å; F339-F349 HydrophobicContact CD2-CZ 4.02Å; F339-F349 AromaticContact CE2-CE2 3.98Å; F339-F349 HydrophobicContact CE2-CE2 3.98Å; F339-F349 HydrophobicContact CE2-CZ 4.21Å; L341-F349 HydrophobicContact CD1-CB 3.83Å; L341-F349 HydrophobicContact CD1-CG 4.33Å; L341-F349 HydrophobicContact CD2-CB 3.99Å; L341-F349 HydrophobicContact CD2-CD2 4.39Å; P345-F349 WeakPolarHBondContact O-CB 3.21Å; P345-F349 PolarHBondContact O-N 3.26Å; F349-R352 WeakPolarHBondContact O-CB 3.27Å; F349-R352 PolarHBondContact O-N 3.21Å; F349-F353 HydrophobicContact CD1-CD2 4.36Å; F349-F353 HydrophobicContact CD1-CE2 4.31Å; F349-F353 HydrophobicContact CD2-CD2 4.5Å; F349-F353 AromaticContact CD2-CE2 3.69Å; F349-F353 HydrophobicContact CD2-CE2 3.69Å; F349-F353 HydrophobicContact CE1-CD2 4.1Å; F349-F353 HydrophobicContact CE1-CE2 4.03Å; F349-F353 HydrophobicContact CE2-CD2 4.26Å; F349-F353 AromaticContact CE2-CE2 3.39Å; F349-F353 HydrophobicContact CE2-CE2 3.39Å; F349-F353 HydrophobicContact CE2-CZ 4.13Å; F349-F353 HydrophobicContact CG-CE2 4.14Å; F349-F353 HydrophobicContact CZ-CD2 4.05Å; F349-F353 AromaticContact CZ-CE2 3.57Å; F349-F353 HydrophobicContact CZ-CE2 3.57Å; F349-F353 HydrophobicContact CZ-CZ 4.46Å; F349-F353 VanDerWaalsContact O-CD2 3.24Å; F349-F353 WeakPolarHBondContact O-CD2 3.17Å; F349-L358 HydrophobicContact CE1-CD2 3.85Å; F349-L361 HydrophobicContact CZ-CD1 4.06Å; F349-I363 HydrophobicContact CE1-CD1 3.58Å; F349-I363 HydrophobicContact CZ-CD1 4.12Å
350	E	88.8	Confident	88.8	Confident	66 Å²	66	50.3 Å²	50.3	31%	0.308	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-58.7	-42.2	-173.3	-63.6	179	-178.7	0	0	113.3	P345 R352 F353 R365	P345-E350 PolarHBondContact O-N 3.37Å; E350-R352 PolarHBondContact O-N 3.46Å; E350-R352 VanDerWaalsContact O-N 3.16Å; E350-F353 PolarHBondContact O-N 3.08Å; E350-R365 IonicContact OE1-NH2 3.24Å; E350-R365 PolarHBondContact OE1-NH2 3.47Å
351	P	89.6	Confident	88.8	Confident	91 Å²	91	50.8 Å²	50.8	59%	0.591	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-67.4	-15.4	178.7	-21.8	35	0	0	0	114.6	E346 F353	E346-P351 WeakPolarHBondContact O-CD 3.44Å; E346-P351 WeakPolarHBondContact O-CG 3.3Å; P351-F353 VanDerWaalsContact C-N 3.31Å
352	R	88.6	Confident	88.8	Confident	49 Å²	49	53.5 Å²	53.5	19%	0.185	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-81.3	-14.8	-178.1	-57.9	-175.2	67.8	-158.8	-1.3	112.4	I303 E304 I306 V308 G348 F349 E350	I303-R352 PolarHBondContact O-NH1 2.82Å; E304-R352 VanDerWaalsContact CA-NH1 3.34Å; I306-R352 PolarHBondContact O-NH2 3.22Å; V308-R352 WeakPolarHBondContact CG1-O 3.44Å; V308-R352 HydrophobicContact CG2-CB 4.3Å; G348-R352 WeakPolarHBondContact O-CD 3.31Å; F349-R352 WeakPolarHBondContact O-CB 3.27Å; F349-R352 PolarHBondContact O-N 3.21Å; E350-R352 PolarHBondContact O-N 3.46Å; E350-R352 VanDerWaalsContact O-N 3.16Å
353	F	90.3	Very high	89.1	Confident	16 Å²	16	55 Å²	55	7%	0.07	32%	0.316	C	S	.	.	S	Bend	trans	-119.2	146.7	-174.2	-60.9	-65.1	0	0	0	112.2	L311 I315 F349 E350 P351 I357 L358	L311-F353 HydrophobicContact CD2-CE1 3.85Å; L311-F353 HydrophobicContact CD2-CZ 3.43Å; L311-F353 VanDerWaalsContact CD2-CZ 3.43Å; L311-F353 HydrophobicContact CG-CE1 3.84Å; L311-F353 HydrophobicContact CG-CZ 3.8Å; I315-F353 HydrophobicContact CD1-CD1 4.4Å; I315-F353 HydrophobicContact CD1-CE1 3.62Å; I315-F353 HydrophobicContact CD1-CZ 3.85Å; F349-F353 HydrophobicContact CD1-CD2 4.36Å; F349-F353 HydrophobicContact CD1-CE2 4.31Å; F349-F353 HydrophobicContact CD2-CD2 4.5Å; F349-F353 AromaticContact CD2-CE2 3.69Å; F349-F353 HydrophobicContact CD2-CE2 3.69Å; F349-F353 HydrophobicContact CE1-CD2 4.1Å; F349-F353 HydrophobicContact CE1-CE2 4.03Å; F349-F353 HydrophobicContact CE2-CD2 4.26Å; F349-F353 AromaticContact CE2-CE2 3.39Å; F349-F353 HydrophobicContact CE2-CE2 3.39Å; F349-F353 HydrophobicContact CE2-CZ 4.13Å; F349-F353 HydrophobicContact CG-CE2 4.14Å; F349-F353 HydrophobicContact CZ-CD2 4.05Å; F349-F353 AromaticContact CZ-CE2 3.57Å; F349-F353 HydrophobicContact CZ-CE2 3.57Å; F349-F353 HydrophobicContact CZ-CZ 4.46Å; F349-F353 VanDerWaalsContact O-CD2 3.24Å; F349-F353 WeakPolarHBondContact O-CD2 3.17Å; E350-F353 PolarHBondContact O-N 3.08Å; P351-F353 VanDerWaalsContact C-N 3.31Å; F353-I357 HydrophobicContact CB-CB 4.31Å; F353-I357 HydrophobicContact CB-CG2 4.37Å; F353-I357 HydrophobicContact CD1-CB 4.4Å; F353-I357 HydrophobicContact CD1-CD1 4.49Å; F353-I357 HydrophobicContact CD1-CG2 3.73Å; F353-I357 HydrophobicContact CE1-CG2 4.34Å; F353-I357 HydrophobicContact CG-CG2 4.25Å; F353-L358 HydrophobicContact CB-CD1 4.33Å; F353-L358 HydrophobicContact CB-CD2 3.86Å; F353-L358 HydrophobicContact CB-CG 3.73Å; F353-L358 HydrophobicContact CD2-CD2 3.95Å; F353-L358 HydrophobicContact CG-CD2 4.24Å
354	S	89.8	Confident	89.4	Confident	65 Å²	65	60 Å²	60	46%	0.455	33%	0.329	S	S	.	.			trans	-74.3	158.7	166.8	70.6	0	0	0	0	110.4	S356 I357 L358	S354-S356 PolarHBondContact O-N 3.09Å; S354-S356 VanDerWaalsContact O-N 3.13Å; S354-I357 PolarHBondContact O-N 2.96Å; S354-L358 PolarHBondContact O-N 3.41Å; S354-L358 VanDerWaalsContact O-N 3.12Å
355	A	89.9	Confident	89.7	Confident	84 Å²	84	61.7 Å²	61.7	69%	0.694	33%	0.328	S	S	*	.	H	α-helix	trans	-55.2	-32.3	176	0	0	0	0	0	112.7	I357 S359	A355-I357 VanDerWaalsContact C-N 3.32Å; A355-I357 PolarHBondContact O-N 3.03Å; A355-S359 WeakPolarHBondContact O-CB 3.21Å; A355-S359 PolarHBondContact O-N 3.39Å; A355-S359 PolarHBondContact O-OG 3.16Å
356	S	90.3	Very high	89.9	Confident	74 Å²	74	62.8 Å²	62.8	52%	0.517	33%	0.333	S	S	.	.	H	α-helix	trans	-68.2	-26.5	177.7	-178	0	0	0	0	114	S354 S359	S354-S356 PolarHBondContact O-N 3.09Å; S354-S356 VanDerWaalsContact O-N 3.13Å; S356-S359 PolarHBondContact O-OG 2.92Å
357	I	91.7	Very high	90.1	Very high	20 Å²	20	61.7 Å²	61.7	10%	0.103	34%	0.336	C	S	.	.	H	α-helix	trans	-86.8	-42.9	177.9	-63.6	172	0	0	0	109.1	C312 I315 F353 S354 A355 S359 R360	C312-I357 HydrophobicContact CB-CD1 3.46Å; C312-I357 VanDerWaalsContact CB-CD1 3.46Å; C312-I357 WeakPolarHBondContact SG-CD1 3.03Å; I315-I357 HydrophobicContact CB-CG2 4.3Å; I315-I357 HydrophobicContact CD1-CG2 4.07Å; I315-I357 HydrophobicContact CG2-CG2 3.93Å; F353-I357 HydrophobicContact CB-CB 4.31Å; F353-I357 HydrophobicContact CB-CG2 4.37Å; F353-I357 HydrophobicContact CD1-CB 4.4Å; F353-I357 HydrophobicContact CD1-CD1 4.49Å; F353-I357 HydrophobicContact CD1-CG2 3.73Å; F353-I357 HydrophobicContact CE1-CG2 4.34Å; F353-I357 HydrophobicContact CG-CG2 4.25Å; S354-I357 PolarHBondContact O-N 2.96Å; A355-I357 VanDerWaalsContact C-N 3.32Å; A355-I357 PolarHBondContact O-N 3.03Å; I357-S359 PolarHBondContact O-N 2.9Å; I357-R360 WeakPolarHBondContact O-CB 3.32Å; I357-R360 PolarHBondContact O-N 3.17Å
358	L	91.7	Very high	90.5	Very high	46 Å²	46	56.1 Å²	56.1	24%	0.241	31%	0.308	C	S	.	.	H	α-helix	trans	-59.3	-35.3	175.2	-68.5	174.3	0	0	0	112	F349 F353 S354 R360 L361 I363	F349-L358 HydrophobicContact CE1-CD2 3.85Å; F353-L358 HydrophobicContact CB-CD1 4.33Å; F353-L358 HydrophobicContact CB-CD2 3.86Å; F353-L358 HydrophobicContact CB-CG 3.73Å; F353-L358 HydrophobicContact CD2-CD2 3.95Å; F353-L358 HydrophobicContact CG-CD2 4.24Å; S354-L358 PolarHBondContact O-N 3.41Å; S354-L358 VanDerWaalsContact O-N 3.12Å; L358-R360 PolarHBondContact O-N 2.95Å; L358-L361 PolarHBondContact O-N 3.48Å; L358-L361 VanDerWaalsContact O-N 3.09Å; L358-I363 HydrophobicContact CD2-CD1 4.34Å
359	S	90.4	Very high	91	Very high	67 Å²	67	57.2 Å²	57.2	47%	0.469	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-15	176.5	66.9	0	0	0	0	114.3	Q78 A355 S356 I357	Q78-S359 WeakPolarHBondContact CG-O 3.34Å; Q78-S359 PolarHBondContact NE2-O 2.67Å; A355-S359 WeakPolarHBondContact O-CB 3.21Å; A355-S359 PolarHBondContact O-N 3.39Å; A355-S359 PolarHBondContact O-OG 3.16Å; S356-S359 PolarHBondContact O-OG 2.92Å; I357-S359 PolarHBondContact O-N 2.9Å
360	R	90.2	Very high	91	Very high	56 Å²	56	60.4 Å²	60.4	21%	0.211	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-3.1	175.1	-62.4	177.1	179.4	-111	13.5	113	Q78 I79 E316 S319 I357 L358	Q78-R360 CarbonylContact C-O 3.56Å; Q78-R360 VanDerWaalsContact CA-O 3.29Å; Q78-R360 WeakPolarHBondContact CA-O 3.4Å; I79-R360 PolarHBondContact N-O 3.1Å; E316-R360 IonicContact OE1-NH2 3.52Å; E316-R360 PolarHBondContact OE1-NH2 3.04Å; S319-R360 PolarHBondContact OG-NH1 3.11Å; I357-R360 WeakPolarHBondContact O-CB 3.32Å; I357-R360 PolarHBondContact O-N 3.17Å; L358-R360 PolarHBondContact O-N 2.95Å
361	L	92.5	Very high	91	Very high	9 Å²	9	58.3 Å²	58.3	5%	0.047	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.7	-177.9	-57.1	179.4	0	0	0	110.3	I79 I315 F337 F339 F349 L358 I363	I79-L361 HydrophobicContact CB-CD2 4.1Å; I79-L361 HydrophobicContact CD1-CD2 4.35Å; I315-L361 HydrophobicContact CD1-CD1 4.29Å; I315-L361 HydrophobicContact CG2-CD2 3.76Å; I315-L361 HydrophobicContact CG2-CG 4.29Å; F337-L361 HydrophobicContact CD2-CD2 4.07Å; F337-L361 HydrophobicContact CE2-CD2 4.19Å; F339-L361 HydrophobicContact CE2-CD1 4.17Å; F349-L361 HydrophobicContact CZ-CD1 4.06Å; L358-L361 PolarHBondContact O-N 3.48Å; L358-L361 VanDerWaalsContact O-N 3.09Å; L361-I363 HydrophobicContact CB-CD1 4.25Å; L361-I363 HydrophobicContact CB-CG1 3.85Å
362	T	92.4	Very high	91	Very high	58 Å²	58	56.3 Å²	56.3	36%	0.356	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	97.9	165.9	-50.8	0	0	0	0	108.5	Q78 I79 T81	Q78-T362 WeakPolarHBondContact CB-OG1 3.28Å; Q78-T362 PolarHBondContact OE1-OG1 3.29Å; I79-T362 PolarHBondContact O-N 3.28Å; T81-T362 PolarHBondContact N-O 3.15Å
363	I	92.6	Very high	91.1	Very high	54 Å²	54	55.3 Å²	55.3	28%	0.277	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	127.2	-170.7	-58.2	166.8	0	0	0	111.2	T81 L83 F349 L358 L361 R365	T81-I363 CarbonylContact O-C 3.39Å; T81-I363 WeakPolarHBondContact O-CA 3.48Å; L83-I363 HydrophobicContact CB-CG2 3.94Å; L83-I363 HydrophobicContact CD2-CG2 4.16Å; F349-I363 HydrophobicContact CE1-CD1 3.58Å; F349-I363 HydrophobicContact CZ-CD1 4.12Å; L358-I363 HydrophobicContact CD2-CD1 4.34Å; L361-I363 HydrophobicContact CB-CD1 4.25Å; L361-I363 HydrophobicContact CB-CG1 3.85Å; I363-R365 HydrophobicContact CG2-CG 4.5Å
364	R	94.5	Very high	91.1	Very high	159 Å²	159	55.2 Å²	55.2	60%	0.6	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.5	165.5	-76.3	-68.9	-173	155.3	-0.7	109.7	F54 T81 A82 L83 F366	F54-R364 HydrophobicContact CD2-CB 4.25Å; F54-R364 HydrophobicContact CD2-CG 3.83Å; F54-R364 HydrophobicContact CE2-CB 3.95Å; F54-R364 HydrophobicContact CE2-CG 3.41Å; F54-R364 VanDerWaalsContact CE2-CG 3.41Å; F54-R364 HydrophobicContact CZ-CB 4.16Å; F54-R364 HydrophobicContact CZ-CG 4.02Å; T81-R364 PolarHBondContact O-N 3.39Å; A82-R364 CarbonylContact C-O 3.52Å; L83-R364 PolarHBondContact N-O 2.94Å; R364-F366 HydrophobicContact CB-CE2 3.72Å; R364-F366 HydrophobicContact CB-CZ 4.11Å; R364-F366 WeakPolarHBondContact O-CD2 3.47Å
365	R	93.8	Very high	91.2	Very high	142 Å²	142	52.4 Å²	52.4	54%	0.536	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	133.2	-176.4	-57.9	-177.9	-177.7	131.6	-6.8	110.5	L83 E350 I363	L83-R365 HydrophobicContact CD2-CG 4.31Å; E350-R365 IonicContact OE1-NH2 3.24Å; E350-R365 PolarHBondContact OE1-NH2 3.47Å; I363-R365 HydrophobicContact CG2-CG 4.5Å
366	F	93.5	Very high	91.3	Very high	27 Å²	27	50.3 Å²	50.3	12%	0.118	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	144.7	175.8	-59.9	-86.5	0	0	0	108.8	V47 E50 V51 F54 A82 L83 L84 L85 R364	V47-F366 HydrophobicContact CG1-CB 4.48Å; E50-F366 HydrophobicContact CB-CD1 4.37Å; E50-F366 HydrophobicContact CB-CE1 4.11Å; V51-F366 HydrophobicContact CG2-CB 4.03Å; V51-F366 HydrophobicContact CG2-CD1 3.69Å; V51-F366 HydrophobicContact CG2-CD2 3.86Å; V51-F366 HydrophobicContact CG2-CE1 4.06Å; V51-F366 HydrophobicContact CG2-CE2 4.21Å; V51-F366 HydrophobicContact CG2-CG 3.58Å; V51-F366 HydrophobicContact CG2-CZ 4.3Å; F54-F366 HydrophobicContact CB-CZ 3.8Å; F54-F366 HydrophobicContact CD1-CE2 4.29Å; F54-F366 HydrophobicContact CD1-CZ 4.36Å; F54-F366 HydrophobicContact CG-CE2 4.35Å; F54-F366 HydrophobicContact CG-CZ 4.01Å; A82-F366 HydrophobicContact CB-CD2 3.88Å; A82-F366 HydrophobicContact CB-CE2 3.65Å; L83-F366 PolarHBondContact O-N 3.43Å; L84-F366 HydrophobicContact CD1-CB 3.79Å; L85-F366 PolarHBondContact N-O 3.39Å; R364-F366 HydrophobicContact CB-CE2 3.72Å; R364-F366 HydrophobicContact CB-CZ 4.11Å; R364-F366 WeakPolarHBondContact O-CD2 3.47Å
367	S	91.1	Very high	91.4	Very high	77 Å²	77	48.4 Å²	48.4	54%	0.538	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	126.7	178.9	-168.8	0	0	0	0	110.3	V47	V47-S367 WeakPolarHBondContact CG2-O 3.46Å
368	V	90.4	Very high	91.4	Very high	9 Å²	9	47.4 Å²	47.4	6%	0.055	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-73.5	148.6	166	-176.6	0	0	0	0	108.1	L84 L85 F374	L84-V368 HydrophobicContact CD1-CG2 3.64Å; L84-V368 HydrophobicContact CD2-CG2 3.98Å; L84-V368 HydrophobicContact CG-CG2 3.8Å; L85-V368 WeakPolarHBondContact O-CB 3.48Å; L85-V368 PolarHBondContact O-N 3.28Å; V368-F374 HydrophobicContact CG1-CE2 3.78Å; V368-F374 HydrophobicContact CG1-CZ 3.59Å
369	P	90.5	Very high	91.5	Very high	32 Å²	32	45.4 Å²	45.4	21%	0.208	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-54	151.7	172.1	-28.2	37.3	0	0	0	112.4	L43 A373 F374	L43-P369 HydrophobicContact CD1-CB 4.42Å; L43-P369 HydrophobicContact CD1-CG 4.02Å; L43-P369 HydrophobicContact CD2-CB 4.46Å; L43-P369 HydrophobicContact CG-CB 4.45Å; L43-P369 HydrophobicContact CG-CG 4.08Å; P369-A373 HydrophobicContact CB-CB 4.07Å; P369-F374 HydrophobicContact CB-CE2 4.18Å; P369-F374 HydrophobicContact CB-CZ 4.39Å; P369-F374 WeakPolarHBondContact O-CE2 3.4Å
370	S	88.8	Confident	91.5	Very high	67 Å²	67	47 Å²	47	47%	0.469	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-62	151.7	178.2	66.5	0	0	0	0	112.1	S372 A373 F374	S370-S372 PolarHBondContact O-N 3.44Å; S370-S372 VanDerWaalsContact O-N 3.1Å; S370-A373 WeakPolarHBondContact O-CA 3.25Å; S370-A373 VanDerWaalsContact O-CB 3.29Å; S370-A373 WeakPolarHBondContact O-CB 3.48Å; S370-A373 PolarHBondContact O-N 2.97Å; S370-A373 PolarHBondContact OG-N 3.06Å; S370-F374 WeakPolarHBondContact O-CD2 3.11Å; S370-F374 PolarHBondContact O-N 3.16Å
371	P	89.5	Confident	91.4	Very high	22 Å²	22	44.7 Å²	44.7	14%	0.143	23%	0.234	C	C	.	.	H	α-helix	trans	-50.1	-36.4	174.3	-30.4	36.9	0	0	0	114.4	A373 F374 L375 F403 Y408	P371-A373 VanDerWaalsContact C-N 3.28Å; P371-A373 PolarHBondContact O-N 3.09Å; P371-F374 WeakPolarHBondContact O-CB 3.34Å; P371-F374 PolarHBondContact O-N 3.41Å; P371-L375 PolarHBondContact O-N 3.36Å; P371-F403 HydrophobicContact CB-CZ 4.01Å; P371-Y408 HydrophobicContact CB-CD1 4.17Å; P371-Y408 HydrophobicContact CB-CG 4.44Å
372	S	89.1	Confident	91.3	Very high	49 Å²	49	45 Å²	45	34%	0.343	24%	0.236	S	C	.	.	H	α-helix	trans	-64.1	-30.5	176.5	-50.9	0	0	0	0	113.3	S370 L375 N376	S370-S372 PolarHBondContact O-N 3.44Å; S370-S372 VanDerWaalsContact O-N 3.1Å; S372-L375 PolarHBondContact O-N 2.97Å; S372-N376 VanDerWaalsContact O-CG 3.25Å; S372-N376 PolarHBondContact O-N 3.42Å; S372-N376 PolarHBondContact O-ND2 3.03Å
373	A	90.2	Very high	91.1	Very high	29 Å²	29	42.4 Å²	42.4	24%	0.24	22%	0.22	C	C	.	.	H	α-helix	trans	-68.8	-42.4	175.3	0	0	0	0	0	111	P369 S370 P371 N376 V377	P369-A373 HydrophobicContact CB-CB 4.07Å; S370-A373 WeakPolarHBondContact O-CA 3.25Å; S370-A373 VanDerWaalsContact O-CB 3.29Å; S370-A373 WeakPolarHBondContact O-CB 3.48Å; S370-A373 PolarHBondContact O-N 2.97Å; S370-A373 PolarHBondContact OG-N 3.06Å; P371-A373 VanDerWaalsContact C-N 3.28Å; P371-A373 PolarHBondContact O-N 3.09Å; A373-N376 PolarHBondContact O-N 3.09Å; A373-V377 PolarHBondContact O-N 3.17Å
374	F	90.9	Very high	90.8	Very high	14 Å²	14	41 Å²	41	6%	0.061	21%	0.212	C	C	.	.	H	α-helix	trans	-62.4	-43.9	173.4	-66.7	-78.4	0	0	0	111.7	L40 L43 T44 V368 P369 S370 P371 N376 V377 V378 V410	L40-F374 HydrophobicContact CD2-CB 4.15Å; L40-F374 HydrophobicContact CD2-CD1 3.72Å; L40-F374 HydrophobicContact CD2-CG 4.45Å; L43-F374 HydrophobicContact CD2-CD1 3.46Å; L43-F374 VanDerWaalsContact CD2-CD1 3.46Å; L43-F374 HydrophobicContact CD2-CE1 3.7Å; L43-F374 HydrophobicContact CD2-CG 3.99Å; L43-F374 HydrophobicContact CD2-CZ 4.43Å; L43-F374 HydrophobicContact CG-CD1 4.37Å; L43-F374 HydrophobicContact CG-CE1 4.15Å; T44-F374 HydrophobicContact CG2-CE1 3.55Å; T44-F374 HydrophobicContact CG2-CZ 3.77Å; V368-F374 HydrophobicContact CG1-CE2 3.78Å; V368-F374 HydrophobicContact CG1-CZ 3.59Å; P369-F374 HydrophobicContact CB-CE2 4.18Å; P369-F374 HydrophobicContact CB-CZ 4.39Å; P369-F374 WeakPolarHBondContact O-CE2 3.4Å; S370-F374 WeakPolarHBondContact O-CD2 3.11Å; S370-F374 PolarHBondContact O-N 3.16Å; P371-F374 WeakPolarHBondContact O-CB 3.34Å; P371-F374 PolarHBondContact O-N 3.41Å; F374-N376 VanDerWaalsContact C-N 3.31Å; F374-N376 PolarHBondContact O-N 3.02Å; F374-V377 PolarHBondContact O-N 3.28Å; F374-V378 WeakPolarHBondContact O-CG2 3.27Å; F374-V378 PolarHBondContact O-N 3.38Å; F374-V410 HydrophobicContact CB-CG2 3.61Å; F374-V410 HydrophobicContact CG-CG2 4.48Å
375	L	92.3	Very high	90.4	Very high	6 Å²	6	34.1 Å²	34.1	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-58.3	-43.4	175.9	-173.7	69.1	0	0	0	111.8	P371 S372 V377 V378 L379 M399 F403 F413	P371-L375 PolarHBondContact O-N 3.36Å; S372-L375 PolarHBondContact O-N 2.97Å; L375-V377 VanDerWaalsContact C-N 3.32Å; L375-V377 PolarHBondContact O-N 2.9Å; L375-V378 WeakPolarHBondContact O-CB 3.43Å; L375-V378 PolarHBondContact O-N 3.39Å; L375-L379 HydrophobicContact CG-CD1 4.24Å; L375-L379 HydrophobicContact CG-CG 4.44Å; L375-L379 WeakPolarHBondContact O-CG 3.24Å; L375-L379 PolarHBondContact O-N 3.47Å; L375-M399 HydrophobicContact CD1-SD 3.9Å; L375-M399 HydrophobicContact CD2-CE 3.99Å; L375-M399 HydrophobicContact CD2-SD 3.38Å; L375-M399 WeakPolarHBondContact CD2-SD 3.25Å; L375-M399 HydrophobicContact CG-SD 3.81Å; L375-F403 HydrophobicContact CB-CE1 4.01Å; L375-F403 HydrophobicContact CB-CZ 3.99Å; L375-F403 HydrophobicContact CD1-CD1 4.33Å; L375-F403 HydrophobicContact CD1-CD2 4.38Å; L375-F403 HydrophobicContact CD1-CE1 4.34Å; L375-F403 HydrophobicContact CD1-CE2 4.35Å; L375-F403 HydrophobicContact CD1-CG 4.35Å; L375-F403 HydrophobicContact CD1-CZ 4.33Å; L375-F403 HydrophobicContact CD2-CD1 3.57Å; L375-F403 HydrophobicContact CD2-CE1 3.56Å; L375-F403 HydrophobicContact CD2-CG 4.33Å; L375-F403 HydrophobicContact CD2-CZ 4.29Å; L375-F403 HydrophobicContact CG-CD1 4.41Å; L375-F403 HydrophobicContact CG-CE1 4.19Å; L375-F403 HydrophobicContact CG-CZ 4.44Å; L375-F413 HydrophobicContact CD1-CD1 4.02Å; L375-F413 HydrophobicContact CD1-CD2 4Å; L375-F413 HydrophobicContact CD1-CE1 3.96Å; L375-F413 HydrophobicContact CD1-CE2 3.93Å; L375-F413 HydrophobicContact CD1-CG 4.05Å; L375-F413 HydrophobicContact CD1-CZ 3.91Å
376	N	91.8	Very high	89.9	Confident	40 Å²	40	28.3 Å²	28.3	21%	0.214	17%	0.167	C	C	.	.	H	α-helix	trans	-61.1	-38.9	177.3	-76.3	-24.1	0	0	0	112.8	S372 A373 F374 K380 N550	S372-N376 VanDerWaalsContact O-CG 3.25Å; S372-N376 PolarHBondContact O-N 3.42Å; S372-N376 PolarHBondContact O-ND2 3.03Å; A373-N376 PolarHBondContact O-N 3.09Å; F374-N376 VanDerWaalsContact C-N 3.31Å; F374-N376 PolarHBondContact O-N 3.02Å; N376-K380 WeakPolarHBondContact O-CB 3.47Å; N376-K380 PolarHBondContact O-N 3.29Å; N376-N550 VanDerWaalsContact ND2-CG 3.27Å; N376-N550 PolarHBondContact ND2-ND2 3.45Å; N376-N550 PolarHBondContact OD1-ND2 3.45Å
377	V	91.7	Very high	89.4	Confident	33 Å²	33	27 Å²	27	20%	0.2	16%	0.162	C	C	.	.	H	α-helix	trans	-64.4	-45.8	174.3	173.1	0	0	0	0	110.6	Q39 L40 L43 A373 F374 L375 L379 K380 E381	Q39-V377 HydrophobicContact CB-CG1 3.6Å; L40-V377 HydrophobicContact CD2-CG1 4.39Å; L43-V377 HydrophobicContact CD2-CG2 3.99Å; A373-V377 PolarHBondContact O-N 3.17Å; F374-V377 PolarHBondContact O-N 3.28Å; L375-V377 VanDerWaalsContact C-N 3.32Å; L375-V377 PolarHBondContact O-N 2.9Å; V377-L379 PolarHBondContact O-N 2.86Å; V377-K380 PolarHBondContact O-N 3.01Å; V377-E381 PolarHBondContact O-N 3.35Å; V377-E381 VanDerWaalsContact O-N 3.16Å
378	V	92.6	Very high	89.1	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.6	-48.6	176.6	172.2	0	0	0	0	111.2	V36 L40 F374 L375 K380 E381 I382 V410 F413 L414	V36-V378 HydrophobicContact CG1-CG2 3.85Å; L40-V378 HydrophobicContact CD1-CG2 4.29Å; L40-V378 HydrophobicContact CD2-CG2 4.06Å; F374-V378 WeakPolarHBondContact O-CG2 3.27Å; F374-V378 PolarHBondContact O-N 3.38Å; L375-V378 WeakPolarHBondContact O-CB 3.43Å; L375-V378 PolarHBondContact O-N 3.39Å; V378-K380 VanDerWaalsContact C-N 3.34Å; V378-K380 PolarHBondContact O-N 3.43Å; V378-E381 PolarHBondContact O-N 3.16Å; V378-I382 HydrophobicContact CG1-CD1 3.47Å; V378-I382 VanDerWaalsContact CG1-CD1 3.47Å; V378-I382 HydrophobicContact CG1-CG1 4.38Å; V378-I382 WeakPolarHBondContact O-CD1 3.37Å; V378-I382 VanDerWaalsContact O-CG1 3.26Å; V378-I382 WeakPolarHBondContact O-CG1 3.46Å; V378-I382 PolarHBondContact O-N 3.28Å; V378-V410 HydrophobicContact CG2-CG1 3.72Å; V378-F413 HydrophobicContact CG1-CD1 4.18Å; V378-F413 HydrophobicContact CG1-CE1 3.9Å; V378-L414 HydrophobicContact CG1-CD2 3.71Å
379	L	92.2	Very high	88.9	Confident	3 Å²	3	23.6 Å²	23.6	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-61.8	-41.7	178.4	-69.2	173.7	0	0	0	112	L375 V377 E381 I382 I383 L395 M399 F413	L375-L379 HydrophobicContact CG-CD1 4.24Å; L375-L379 HydrophobicContact CG-CG 4.44Å; L375-L379 WeakPolarHBondContact O-CG 3.24Å; L375-L379 PolarHBondContact O-N 3.47Å; V377-L379 PolarHBondContact O-N 2.86Å; L379-E381 VanDerWaalsContact C-N 3.33Å; L379-E381 PolarHBondContact O-N 3.45Å; L379-I382 PolarHBondContact O-N 3.43Å; L379-I383 HydrophobicContact CB-CD1 4.39Å; L379-I383 WeakPolarHBondContact O-CB 3.26Å; L379-I383 WeakPolarHBondContact O-CD1 3.38Å; L379-I383 WeakPolarHBondContact O-CG1 3.38Å; L379-I383 PolarHBondContact O-N 3.11Å; L379-L395 HydrophobicContact CD2-CD1 3.87Å; L379-M399 HydrophobicContact CD1-CE 3.56Å; L379-M399 HydrophobicContact CD1-SD 3.64Å; L379-M399 HydrophobicContact CD2-SD 4.02Å; L379-M399 HydrophobicContact CG-SD 4.24Å; L379-F413 HydrophobicContact CD2-CZ 4.34Å
380	K	90.9	Very high	88.6	Confident	102 Å²	102	22.9 Å²	22.9	44%	0.443	13%	0.132	S	C	.	.	H	α-helix	trans	-58.2	-46.4	178.5	-175.3	-178.7	176.9	-176.6	0	111.3	N376 V377 V378 I383 Q384	N376-K380 WeakPolarHBondContact O-CB 3.47Å; N376-K380 PolarHBondContact O-N 3.29Å; V377-K380 PolarHBondContact O-N 3.01Å; V378-K380 VanDerWaalsContact C-N 3.34Å; V378-K380 PolarHBondContact O-N 3.43Å; K380-I383 PolarHBondContact O-N 2.84Å; K380-Q384 WeakPolarHBondContact O-CB 3.22Å; K380-Q384 VanDerWaalsContact O-CG 3.28Å; K380-Q384 WeakPolarHBondContact O-CG 3.32Å; K380-Q384 PolarHBondContact O-N 2.88Å; K380-Q384 VanDerWaalsContact O-N 3.13Å
381	E	89.3	Confident	88.3	Confident	6 Å²	6	20.6 Å²	20.6	3%	0.028	12%	0.116	C	C	.	.	H	α-helix	trans	-70.3	-35.6	179.2	-61.7	-59.5	130.4	0	0	112.3	R35 V36 Q39 V377 V378 L379 Q384 F385	R35-E381 HydrophobicContact CG-CG 4.44Å; R35-E381 WeakPolarHBondContact CG-OE2 3.31Å; R35-E381 IonicContact CZ-OE2 2.73Å; R35-E381 IonicContact NE-OE2 3.26Å; R35-E381 PolarHBondContact NE-OE2 2.96Å; R35-E381 IonicContact NH2-OE2 2.92Å; V36-E381 HydrophobicContact CG2-CB 3.95Å; Q39-E381 HydrophobicContact CB-CG 4.35Å; Q39-E381 HydrophobicContact CG-CG 3.9Å; V377-E381 PolarHBondContact O-N 3.35Å; V377-E381 VanDerWaalsContact O-N 3.16Å; V378-E381 PolarHBondContact O-N 3.16Å; L379-E381 VanDerWaalsContact C-N 3.33Å; L379-E381 PolarHBondContact O-N 3.45Å; E381-Q384 PolarHBondContact O-N 3.45Å; E381-F385 PolarHBondContact O-N 3.34Å
382	I	89.8	Confident	88.2	Confident	16 Å²	16	22.8 Å²	22.8	8%	0.082	12%	0.122	C	C	.	.	H	α-helix	trans	-66.3	-41.3	175	-66.1	159.3	0	0	0	111.3	V378 L379 Q384 F385 H389 F413 L417	V378-I382 HydrophobicContact CG1-CD1 3.47Å; V378-I382 VanDerWaalsContact CG1-CD1 3.47Å; V378-I382 HydrophobicContact CG1-CG1 4.38Å; V378-I382 WeakPolarHBondContact O-CD1 3.37Å; V378-I382 VanDerWaalsContact O-CG1 3.26Å; V378-I382 WeakPolarHBondContact O-CG1 3.46Å; V378-I382 PolarHBondContact O-N 3.28Å; L379-I382 PolarHBondContact O-N 3.43Å; I382-Q384 VanDerWaalsContact C-N 3.25Å; I382-Q384 PolarHBondContact O-N 3.17Å; I382-F385 PolarHBondContact O-N 3.12Å; I382-H389 PolarHBondContact O-CE1 3.28Å; I382-H389 VanDerWaalsContact O-CE1 3.28Å; I382-F413 HydrophobicContact CD1-CE1 4.45Å; I382-L417 HydrophobicContact CD1-CD2 3.26Å; I382-L417 HydrophobicContact CG1-CD2 4Å
383	I	88.5	Confident	87.8	Confident	3 Å²	3	22.9 Å²	22.9	2%	0.015	12%	0.122	C	C	.	.	H	α-helix	trans	-67.6	-29	178.8	-64.7	162.1	0	0	0	110.9	L379 K380 H389 I528 P529 Y555	L379-I383 HydrophobicContact CB-CD1 4.39Å; L379-I383 WeakPolarHBondContact O-CB 3.26Å; L379-I383 WeakPolarHBondContact O-CD1 3.38Å; L379-I383 WeakPolarHBondContact O-CG1 3.38Å; L379-I383 PolarHBondContact O-N 3.11Å; K380-I383 PolarHBondContact O-N 2.84Å; I383-H389 PolarHBondContact O-CE1 3.29Å; I383-I528 HydrophobicContact CG2-CG2 3.89Å; I383-P529 HydrophobicContact CG2-CB 4.46Å; I383-P529 HydrophobicContact CG2-CG 4.05Å; I383-Y555 HydrophobicContact CD1-CD1 3.76Å; I383-Y555 HydrophobicContact CD1-CD2 4.28Å; I383-Y555 HydrophobicContact CD1-CE1 4.42Å; I383-Y555 HydrophobicContact CD1-CG 3.66Å; I383-Y555 HydrophobicContact CG1-CD1 3.69Å; I383-Y555 HydrophobicContact CG1-CD2 4.13Å; I383-Y555 HydrophobicContact CG1-CE1 3.84Å; I383-Y555 HydrophobicContact CG1-CE2 4.28Å; I383-Y555 HydrophobicContact CG1-CG 3.83Å; I383-Y555 HydrophobicContact CG2-CD2 3.91Å; I383-Y555 HydrophobicContact CG2-CE2 4Å; I383-Y555 HydrophobicContact CG2-CG 4.38Å
384	Q	85.7	Confident	87.6	Confident	24 Å²	24	21.9 Å²	21.9	11%	0.112	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-10.8	177.3	-74.6	-179.3	-7	0	0	114.3	K380 E381 I382 P529 W612 W613	K380-Q384 WeakPolarHBondContact O-CB 3.22Å; K380-Q384 VanDerWaalsContact O-CG 3.28Å; K380-Q384 WeakPolarHBondContact O-CG 3.32Å; K380-Q384 PolarHBondContact O-N 2.88Å; K380-Q384 VanDerWaalsContact O-N 3.13Å; E381-Q384 PolarHBondContact O-N 3.45Å; I382-Q384 VanDerWaalsContact C-N 3.25Å; I382-Q384 PolarHBondContact O-N 3.17Å; Q384-P529 HydrophobicContact CG-CB 3.92Å; Q384-P529 HydrophobicContact CG-CG 3.71Å; Q384-W612 HydrophobicContact CB-CZ3 4.4Å; Q384-W613 WeakPolarHBondContact O-CZ2 2.98Å
385	F	85.6	Confident	87.5	Confident	15 Å²	15	21.4 Å²	21.4	7%	0.066	11%	0.111	C	C	.	.	S	Bend	trans	-81.8	131	-177.5	-175.2	-96	0	0	0	111.2	V28 I32 E381 I382 H389 W612	V28-F385 HydrophobicContact CB-CZ 4.43Å; V28-F385 HydrophobicContact CG1-CE1 3.51Å; V28-F385 HydrophobicContact CG1-CZ 3.62Å; I32-F385 HydrophobicContact CD1-CD1 3.59Å; I32-F385 HydrophobicContact CD1-CD2 4.17Å; I32-F385 HydrophobicContact CD1-CE1 3.7Å; I32-F385 HydrophobicContact CD1-CE2 4.27Å; I32-F385 HydrophobicContact CD1-CG 3.84Å; I32-F385 HydrophobicContact CD1-CZ 4.07Å; I32-F385 HydrophobicContact CG1-CB 4.32Å; I32-F385 HydrophobicContact CG1-CD1 3.81Å; I32-F385 HydrophobicContact CG1-CD2 3.41Å; I32-F385 VanDerWaalsContact CG1-CD2 3.41Å; I32-F385 HydrophobicContact CG1-CE1 3.94Å; I32-F385 HydrophobicContact CG1-CE2 3.57Å; I32-F385 HydrophobicContact CG1-CG 3.55Å; I32-F385 HydrophobicContact CG1-CZ 3.85Å; E381-F385 PolarHBondContact O-N 3.34Å; I382-F385 PolarHBondContact O-N 3.12Å; F385-H389 PolarHBondContact O-CE1 3.32Å; F385-H389 PolarHBondContact O-NE2 3.33Å; F385-W612 HydrophobicContact CB-CE3 4.21Å; F385-W612 HydrophobicContact CB-CH2 4.29Å; F385-W612 HydrophobicContact CB-CZ3 3.85Å; F385-W612 AromaticContact CD2-CD2 3.66Å; F385-W612 HydrophobicContact CD2-CD2 3.66Å; F385-W612 AromaticContact CD2-CE2 3.67Å; F385-W612 AromaticContact CD2-CE3 3.72Å; F385-W612 HydrophobicContact CD2-CE3 3.72Å; F385-W612 HydrophobicContact CD2-CG 4.3Å; F385-W612 AromaticContact CD2-CH2 3.8Å; F385-W612 HydrophobicContact CD2-CH2 3.8Å; F385-W612 AromaticContact CD2-CZ2 3.75Å; F385-W612 HydrophobicContact CD2-CZ2 3.75Å; F385-W612 AromaticContact CD2-CZ3 3.79Å; F385-W612 HydrophobicContact CD2-CZ3 3.79Å; F385-W612 HydrophobicContact CE2-CD2 4.1Å; F385-W612 AromaticContact CE2-CE2 3.96Å; F385-W612 HydrophobicContact CE2-CG 4.34Å; F385-W612 HydrophobicContact CE2-CZ2 4.31Å; F385-W612 HydrophobicContact CG-CE3 4.41Å; F385-W612 HydrophobicContact CG-CZ3 4.33Å
386	P	83.2	Confident	87.3	Confident	20 Å²	20	23.2 Å²	23.2	13%	0.13	12%	0.121	C	C	.	.	S	Bend	trans	-73.1	137.2	176.3	26.8	-31.5	0	0	0	112.3	L522 W612 W613	P386-L522 HydrophobicContact CB-CD2 4.06Å; P386-W612 HydrophobicContact CG-CB 3.67Å; P386-W612 WeakPolarHBondContact CG-O 3.37Å; P386-W613 HydrophobicContact CB-CD2 4.41Å; P386-W613 HydrophobicContact CB-CE3 3.96Å; P386-W613 HydrophobicContact CB-CH2 3.77Å; P386-W613 HydrophobicContact CB-CZ2 4.24Å; P386-W613 HydrophobicContact CB-CZ3 3.61Å; P386-W613 HydrophobicContact CG-CD2 4.45Å; P386-W613 HydrophobicContact CG-CE3 4.45Å; P386-W613 HydrophobicContact CG-CZ3 4.47Å
387	G	84	Confident	87.1	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.01	12%	0.116	C	C	.	.	S	Bend	trans	115.5	-124.7	173.5	0	0	0	0	0	112.4	H389 Q525 F757	G387-H389 PolarHBondContact O-CD2 3.39Å; G387-H389 PolarHBondContact O-N 3.06Å; G387-Q525 PolarHBondContact O-NE2 2.96Å; G387-F757 WeakPolarHBondContact O-CD1 3.34Å
388	L	84.6	Confident	87	Confident	10 Å²	10	21.1 Å²	21.1	5%	0.052	11%	0.107	C	C	.	.			trans	-73.1	122.9	-171.2	176.3	61.4	0	0	0	112	M421 H424 Y425 L434 F757	L388-M421 HydrophobicContact CB-CE 4.47Å; L388-M421 HydrophobicContact CD2-CB 4.09Å; L388-M421 HydrophobicContact CD2-CE 4.24Å; L388-M421 HydrophobicContact CD2-CG 4.04Å; L388-H424 HydrophobicContact CD1-CB 4.3Å; L388-H424 WeakPolarHBondContact CD1-CD2 3.24Å; L388-H424 VanDerWaalsContact CD1-NE2 3.3Å; L388-H424 WeakPolarHBondContact CD1-NE2 2.88Å; L388-H424 HydrophobicContact CD2-CB 3.65Å; L388-Y425 HydrophobicContact CB-CE2 4.16Å; L388-Y425 HydrophobicContact CD2-CD2 3.85Å; L388-Y425 HydrophobicContact CD2-CE2 3.7Å; L388-L434 HydrophobicContact CB-CD1 4.33Å; L388-L434 HydrophobicContact CB-CD2 4.41Å; L388-F757 WeakPolarHBondContact CD1-O 3.35Å
389	H	85.9	Confident	86.8	Confident	3 Å²	3	21.5 Å²	21.5	1%	0.014	11%	0.109	C	C	.	.			trans	-112.4	144.7	167.5	-68.7	-88.9	0	0	0	111.5	I382 I383 F385 G387 Q525 Y555 F757 Y758	I382-H389 PolarHBondContact O-CE1 3.28Å; I382-H389 VanDerWaalsContact O-CE1 3.28Å; I383-H389 PolarHBondContact O-CE1 3.29Å; F385-H389 PolarHBondContact O-CE1 3.32Å; F385-H389 PolarHBondContact O-NE2 3.33Å; G387-H389 PolarHBondContact O-CD2 3.39Å; G387-H389 PolarHBondContact O-N 3.06Å; H389-Q525 PolarHBondContact CD2-NE2 3.26Å; H389-Y555 VanDerWaalsContact CB-OH 3.27Å; H389-Y555 WeakPolarHBondContact CB-OH 3.3Å; H389-Y555 PolarHBondContact ND1-OH 2.76Å; H389-F757 PolarHBondContact N-O 3.36Å; H389-Y758 HydrophobicContact CB-CD1 3.93Å; H389-Y758 HydrophobicContact CB-CE1 3.9Å
390	P	83.9	Confident	86.6	Confident	17 Å²	17	24.1 Å²	24.1	11%	0.11	12%	0.123	C	C	.	.			trans	-66.5	140.5	174.7	28.4	-33.7	0	0	0	111.1	V394 L395 L417 L559	P390-V394 HydrophobicContact CB-CG1 4.34Å; P390-L395 HydrophobicContact CB-CB 4.27Å; P390-L395 HydrophobicContact CG-CB 4.18Å; P390-L395 HydrophobicContact CG-CD1 4.14Å; P390-L395 HydrophobicContact CG-CD2 4.39Å; P390-L395 HydrophobicContact CG-CG 4.47Å; P390-L417 HydrophobicContact CB-CD1 4.42Å; P390-L417 HydrophobicContact CG-CD1 4.3Å; P390-L559 WeakPolarHBondContact O-CD1 3.25Å
391	T	83.5	Confident	86.3	Confident	20 Å²	20	20.7 Å²	20.7	12%	0.123	12%	0.116	C	C	.	.			trans	-56.5	157.4	170.7	55.5	0	0	0	0	111.4	S393 V394 L395 Y758	T391-S393 VanDerWaalsContact C-N 3.29Å; T391-S393 PolarHBondContact O-N 2.97Å; T391-S393 PolarHBondContact OG1-OG 2.84Å; T391-V394 PolarHBondContact O-N 3.3Å; T391-V394 WeakPolarHBondContact OG1-CB 3.38Å; T391-V394 VanDerWaalsContact OG1-CG2 3.22Å; T391-V394 WeakPolarHBondContact OG1-CG2 3.36Å; T391-V394 PolarHBondContact OG1-N 2.96Å; T391-L395 WeakPolarHBondContact O-CB 3.29Å; T391-L395 PolarHBondContact O-N 3.39Å; T391-Y758 WeakPolarHBondContact CG2-O 3.34Å
392	Y	85.8	Confident	86.2	Confident	67 Å²	67	20.4 Å²	20.4	26%	0.263	12%	0.115	S	C	.	.	H	α-helix	trans	-50.4	-48.9	171.2	172.8	-109.1	0	0	0	112.2	V394 L395 N396 R556 L559 K560	Y392-V394 PolarHBondContact O-N 3.36Å; Y392-L395 PolarHBondContact O-N 3.17Å; Y392-N396 HydrophobicContact CE2-CB 4.27Å; Y392-N396 WeakPolarHBondContact O-CB 3.47Å; Y392-N396 PolarHBondContact O-N 2.91Å; Y392-R556 HydrophobicContact CD2-CB 4.25Å; Y392-R556 WeakPolarHBondContact CD2-O 3.31Å; Y392-R556 HydrophobicContact CE2-CB 4.19Å; Y392-R556 WeakPolarHBondContact CE2-O 3.48Å; Y392-L559 WeakPolarHBondContact CB-O 3.2Å; Y392-K560 HydrophobicContact CD1-CB 4.24Å; Y392-K560 HydrophobicContact CD1-CG 4.18Å; Y392-K560 HydrophobicContact CD2-CB 4.05Å; Y392-K560 HydrophobicContact CE1-CB 4.27Å; Y392-K560 HydrophobicContact CE1-CD 4.17Å; Y392-K560 HydrophobicContact CE1-CG 3.95Å; Y392-K560 HydrophobicContact CE2-CB 4.08Å; Y392-K560 HydrophobicContact CG-CB 4.12Å
393	S	82.4	Confident	86.3	Confident	51 Å²	51	19.7 Å²	19.7	36%	0.357	11%	0.111	S	C	.	.	H	α-helix	trans	-59.8	-43.9	-178.1	64.7	0	0	0	0	112.8	T391 Y397 A788	T391-S393 VanDerWaalsContact C-N 3.29Å; T391-S393 PolarHBondContact O-N 2.97Å; T391-S393 PolarHBondContact OG1-OG 2.84Å; S393-Y397 WeakPolarHBondContact O-CB 3.33Å; S393-Y397 PolarHBondContact O-N 3.41Å; S393-A788 WeakPolarHBondContact OG-CB 3.3Å
394	V	85.9	Confident	86.4	Confident	8 Å²	8	22.4 Å²	22.4	5%	0.048	13%	0.125	C	C	.	.	H	α-helix	trans	-69.2	-49.1	178.3	172.5	0	0	0	0	110.3	P390 T391 Y392 N396 Y397 L398 C420 I791	P390-V394 HydrophobicContact CB-CG1 4.34Å; T391-V394 PolarHBondContact O-N 3.3Å; T391-V394 WeakPolarHBondContact OG1-CB 3.38Å; T391-V394 VanDerWaalsContact OG1-CG2 3.22Å; T391-V394 WeakPolarHBondContact OG1-CG2 3.36Å; T391-V394 PolarHBondContact OG1-N 2.96Å; Y392-V394 PolarHBondContact O-N 3.36Å; V394-N396 PolarHBondContact O-N 3.09Å; V394-Y397 PolarHBondContact O-N 3.49Å; V394-L398 HydrophobicContact CG1-CD1 3.99Å; V394-L398 HydrophobicContact CG1-CG 4.3Å; V394-L398 WeakPolarHBondContact O-CB 3.46Å; V394-L398 VanDerWaalsContact O-CG 3.29Å; V394-L398 WeakPolarHBondContact O-CG 3.18Å; V394-L398 PolarHBondContact O-N 3.43Å; V394-C420 HydrophobicContact CG1-CB 4.04Å; V394-I791 HydrophobicContact CG2-CD1 3.74Å
395	L	87.9	Confident	86.5	Confident	5 Å²	5	25.8 Å²	25.8	3%	0.026	15%	0.151	C	C	.	.	H	α-helix	trans	-62.8	-44.3	-178.6	-174.6	58.5	0	0	0	111.6	L379 P390 T391 Y392 Y397 L398 M399 F413 Y555 R556 L559	L379-L395 HydrophobicContact CD2-CD1 3.87Å; P390-L395 HydrophobicContact CB-CB 4.27Å; P390-L395 HydrophobicContact CG-CB 4.18Å; P390-L395 HydrophobicContact CG-CD1 4.14Å; P390-L395 HydrophobicContact CG-CD2 4.39Å; P390-L395 HydrophobicContact CG-CG 4.47Å; T391-L395 WeakPolarHBondContact O-CB 3.29Å; T391-L395 PolarHBondContact O-N 3.39Å; Y392-L395 PolarHBondContact O-N 3.17Å; L395-Y397 VanDerWaalsContact C-N 3.34Å; L395-Y397 PolarHBondContact O-N 3.31Å; L395-L398 PolarHBondContact O-N 2.89Å; L395-M399 HydrophobicContact CD1-CG 4.06Å; L395-M399 HydrophobicContact CG-CG 4.34Å; L395-M399 VanDerWaalsContact O-CB 3.29Å; L395-M399 WeakPolarHBondContact O-CB 3.26Å; L395-M399 WeakPolarHBondContact O-CG 3.35Å; L395-M399 PolarHBondContact O-N 2.98Å; L395-F413 HydrophobicContact CD1-CZ 4.42Å; L395-Y555 HydrophobicContact CD2-CD1 4.01Å; L395-Y555 HydrophobicContact CD2-CE1 4.06Å; L395-R556 HydrophobicContact CD2-CG 3.82Å; L395-R556 HydrophobicContact CG-CG 4.19Å; L395-L559 HydrophobicContact CD2-CD1 4.22Å
396	N	87.7	Confident	86.5	Confident	43 Å²	43	29.9 Å²	29.9	23%	0.23	17%	0.173	C	C	.	.	H	α-helix	trans	-62.9	-40.5	177	-160.8	74.1	0	0	0	111.5	Y392 V394 D400	Y392-N396 HydrophobicContact CE2-CB 4.27Å; Y392-N396 WeakPolarHBondContact O-CB 3.47Å; Y392-N396 PolarHBondContact O-N 2.91Å; V394-N396 PolarHBondContact O-N 3.09Å; N396-D400 WeakPolarHBondContact O-CB 3.49Å; N396-D400 PolarHBondContact O-N 2.9Å; N396-D400 PolarHBondContact OD1-OD2 3.38Å; N396-D400 VanDerWaalsContact OD1-OD2 3.12Å
397	Y	87.4	Confident	86.6	Confident	29 Å²	29	30.5 Å²	30.5	11%	0.114	18%	0.175	C	C	.	.	I	π-helix	trans	-67.2	-42.7	176.2	178.7	-109.4	0	0	0	112.9	S393 V394 L395 M399 G401 I402 R792 L795 N796	S393-Y397 WeakPolarHBondContact O-CB 3.33Å; S393-Y397 PolarHBondContact O-N 3.41Å; V394-Y397 PolarHBondContact O-N 3.49Å; L395-Y397 VanDerWaalsContact C-N 3.34Å; L395-Y397 PolarHBondContact O-N 3.31Å; Y397-M399 VanDerWaalsContact C-N 3.33Å; Y397-M399 PolarHBondContact O-N 3.24Å; Y397-G401 CarbonylContact O-C 3.48Å; Y397-G401 WeakPolarHBondContact O-CA 3.35Å; Y397-G401 PolarHBondContact O-N 2.96Å; Y397-I402 HydrophobicContact CD1-CD1 4.14Å; Y397-I402 HydrophobicContact CE1-CD1 3.42Å; Y397-I402 VanDerWaalsContact CE1-CD1 3.42Å; Y397-I402 HydrophobicContact CE1-CG1 4.01Å; Y397-I402 HydrophobicContact CE2-CG1 4.36Å; Y397-I402 PolarHBondContact O-N 3.37Å; Y397-I402 VanDerWaalsContact O-N 3.12Å; Y397-R792 HydrophobicContact CD1-CB 4.3Å; Y397-R792 HydrophobicContact CD2-CG 4.31Å; Y397-R792 HydrophobicContact CE1-CB 3.92Å; Y397-R792 HydrophobicContact CE1-CG 4.03Å; Y397-R792 HydrophobicContact CE2-CB 4.38Å; Y397-R792 HydrophobicContact CE2-CG 3.7Å; Y397-L795 HydrophobicContact CE1-CB 4.35Å; Y397-L795 HydrophobicContact CE1-CD1 4.42Å; Y397-N796 WeakPolarHBondContact OH-CB 3.44Å
398	L	89.8	Confident	87	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.191	C	C	.	.	I	π-helix	trans	-63.9	-39.2	176.8	-69.9	179.9	0	0	0	112.1	V394 L395 I402 F403 F413 R416 L417 L795	V394-L398 HydrophobicContact CG1-CD1 3.99Å; V394-L398 HydrophobicContact CG1-CG 4.3Å; V394-L398 WeakPolarHBondContact O-CB 3.46Å; V394-L398 VanDerWaalsContact O-CG 3.29Å; V394-L398 WeakPolarHBondContact O-CG 3.18Å; V394-L398 PolarHBondContact O-N 3.43Å; L395-L398 PolarHBondContact O-N 2.89Å; L398-I402 HydrophobicContact CD2-CD1 4.48Å; L398-F403 VanDerWaalsContact O-CB 3.32Å; L398-F403 WeakPolarHBondContact O-CB 3.43Å; L398-F403 PolarHBondContact O-N 3.39Å; L398-F413 HydrophobicContact CB-CD2 4.23Å; L398-F413 HydrophobicContact CB-CE2 3.75Å; L398-R416 HydrophobicContact CD2-CB 3.61Å; L398-R416 HydrophobicContact CD2-CG 4.49Å; L398-L417 HydrophobicContact CD1-CB 4.48Å; L398-L417 HydrophobicContact CD1-CD1 4.25Å; L398-L795 HydrophobicContact CD2-CD1 3.5Å
399	M	89.8	Confident	87.4	Confident	7 Å²	7	34.1 Å²	34.1	3%	0.034	19%	0.188	C	C	.	.	I	π-helix	trans	-78	-68.4	-179.1	-66.6	-98	-67.7	0	0	111.8	L375 L379 L395 Y397 F403 L404 F413 R556	L375-M399 HydrophobicContact CD1-SD 3.9Å; L375-M399 HydrophobicContact CD2-CE 3.99Å; L375-M399 HydrophobicContact CD2-SD 3.38Å; L375-M399 WeakPolarHBondContact CD2-SD 3.25Å; L375-M399 HydrophobicContact CG-SD 3.81Å; L379-M399 HydrophobicContact CD1-CE 3.56Å; L379-M399 HydrophobicContact CD1-SD 3.64Å; L379-M399 HydrophobicContact CD2-SD 4.02Å; L379-M399 HydrophobicContact CG-SD 4.24Å; L395-M399 HydrophobicContact CD1-CG 4.06Å; L395-M399 HydrophobicContact CG-CG 4.34Å; L395-M399 VanDerWaalsContact O-CB 3.29Å; L395-M399 WeakPolarHBondContact O-CB 3.26Å; L395-M399 WeakPolarHBondContact O-CG 3.35Å; L395-M399 PolarHBondContact O-N 2.98Å; Y397-M399 VanDerWaalsContact C-N 3.33Å; Y397-M399 PolarHBondContact O-N 3.24Å; M399-F403 WeakPolarHBondContact O-CB 3.25Å; M399-F403 PolarHBondContact O-N 3.34Å; M399-L404 WeakPolarHBondContact O-CG 3.31Å; M399-L404 PolarHBondContact O-N 2.9Å; M399-F413 HydrophobicContact CG-CE2 4.15Å; M399-F413 HydrophobicContact SD-CE2 4.3Å; M399-F413 HydrophobicContact SD-CZ 4.45Å; M399-R556 VanDerWaalsContact CE-NH1 3.29Å
400	D	86.9	Confident	87.7	Confident	58 Å²	58	34.4 Å²	34.4	31%	0.31	19%	0.19	S	C	.	.	I	π-helix	trans	-80.7	-37.8	-170.2	-62.4	-11.2	0	0	0	111	N396 C405	N396-D400 WeakPolarHBondContact O-CB 3.49Å; N396-D400 PolarHBondContact O-N 2.9Å; N396-D400 PolarHBondContact OD1-OD2 3.38Å; N396-D400 VanDerWaalsContact OD1-OD2 3.12Å; D400-C405 PolarHBondContact O-SG 3.5Å
401	G	84.3	Confident	88	Confident	30 Å²	30	37.7 Å²	37.7	31%	0.309	20%	0.203	S	C	.	.	I	π-helix	trans	-78.6	-28.2	-176.6	0	0	0	0	0	114.5	Y397	Y397-G401 CarbonylContact O-C 3.48Å; Y397-G401 WeakPolarHBondContact O-CA 3.35Å; Y397-G401 PolarHBondContact O-N 2.96Å
402	I	88.4	Confident	88.4	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.005	21%	0.206	C	C	.	.	I	π-helix	trans	-122.7	-62.2	-173.4	-63.8	-176.9	0	0	0	111.5	Y397 L398 C405 L406 L795	Y397-I402 HydrophobicContact CD1-CD1 4.14Å; Y397-I402 HydrophobicContact CE1-CD1 3.42Å; Y397-I402 VanDerWaalsContact CE1-CD1 3.42Å; Y397-I402 HydrophobicContact CE1-CG1 4.01Å; Y397-I402 HydrophobicContact CE2-CG1 4.36Å; Y397-I402 PolarHBondContact O-N 3.37Å; Y397-I402 VanDerWaalsContact O-N 3.12Å; L398-I402 HydrophobicContact CD2-CD1 4.48Å; I402-C405 PolarHBondContact O-N 3.29Å; I402-L406 HydrophobicContact CB-CD1 4.33Å; I402-L406 HydrophobicContact CG1-CD1 4.26Å; I402-L406 HydrophobicContact CG2-CD1 4.12Å; I402-L406 WeakPolarHBondContact O-CA 3.26Å; I402-L406 WeakPolarHBondContact O-CB 3.39Å; I402-L406 PolarHBondContact O-N 3.34Å; I402-L795 HydrophobicContact CD1-CB 4.1Å; I402-L795 HydrophobicContact CD1-CD1 4.4Å
403	F	91.6	Very high	88.7	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.194	C	C	.	.	I	π-helix	trans	-63.2	-51	-171.3	179.3	-91.2	0	0	0	112.4	P371 L375 L398 M399 Y408 V410 F413	P371-F403 HydrophobicContact CB-CZ 4.01Å; L375-F403 HydrophobicContact CB-CE1 4.01Å; L375-F403 HydrophobicContact CB-CZ 3.99Å; L375-F403 HydrophobicContact CD1-CD1 4.33Å; L375-F403 HydrophobicContact CD1-CD2 4.38Å; L375-F403 HydrophobicContact CD1-CE1 4.34Å; L375-F403 HydrophobicContact CD1-CE2 4.35Å; L375-F403 HydrophobicContact CD1-CG 4.35Å; L375-F403 HydrophobicContact CD1-CZ 4.33Å; L375-F403 HydrophobicContact CD2-CD1 3.57Å; L375-F403 HydrophobicContact CD2-CE1 3.56Å; L375-F403 HydrophobicContact CD2-CG 4.33Å; L375-F403 HydrophobicContact CD2-CZ 4.29Å; L375-F403 HydrophobicContact CG-CD1 4.41Å; L375-F403 HydrophobicContact CG-CE1 4.19Å; L375-F403 HydrophobicContact CG-CZ 4.44Å; L398-F403 VanDerWaalsContact O-CB 3.32Å; L398-F403 WeakPolarHBondContact O-CB 3.43Å; L398-F403 PolarHBondContact O-N 3.39Å; M399-F403 WeakPolarHBondContact O-CB 3.25Å; M399-F403 PolarHBondContact O-N 3.34Å; F403-Y408 HydrophobicContact CD1-CD1 4.38Å; F403-Y408 AromaticContact CE1-CD1 3.98Å; F403-Y408 HydrophobicContact CE1-CD1 3.98Å; F403-Y408 WeakPolarHBondContact CE2-O 3.05Å; F403-Y408 HydrophobicContact CZ-CD1 4.49Å; F403-Y408 WeakPolarHBondContact O-CA 2.91Å; F403-Y408 PolarHBondContact O-N 2.95Å; F403-V410 HydrophobicContact CE2-CG2 3.99Å; F403-V410 HydrophobicContact CZ-CG2 4.27Å; F403-F413 HydrophobicContact CB-CD2 4.23Å; F403-F413 HydrophobicContact CD2-CB 4Å; F403-F413 HydrophobicContact CD2-CD2 4.44Å; F403-F413 HydrophobicContact CD2-CG 4.49Å
404	L	89.5	Confident	89.3	Confident	60 Å²	60	33.9 Å²	33.9	31%	0.314	18%	0.182	S	C	.	.	I	π-helix	trans	-75.6	-27.2	-178.7	-64.6	177.7	0	0	0	113.4	M399 Y408	M399-L404 WeakPolarHBondContact O-CG 3.31Å; M399-L404 PolarHBondContact O-N 2.9Å; L404-Y408 HydrophobicContact CD2-CD1 4.39Å; L404-Y408 HydrophobicContact CD2-CE1 3.77Å; L404-Y408 VanDerWaalsContact O-CZ 3.29Å; L404-Y408 PolarHBondContact O-OH 3.45Å; L404-Y408 VanDerWaalsContact O-OH 3.11Å
405	C	87.6	Confident	89.6	Confident	95 Å²	95	38.9 Å²	38.9	64%	0.642	21%	0.205	S	C	*	.	I	π-helix	trans	-96.4	-24.9	-175.9	-75.5	0	0	0	0	114.9	D400 I402	D400-C405 PolarHBondContact O-SG 3.5Å; I402-C405 PolarHBondContact O-N 3.29Å
406	L	86.3	Confident	89.8	Confident	102 Å²	102	40.8 Å²	40.8	53%	0.534	21%	0.212	S	C	.	.	I	π-helix	trans	-114.5	-60.9	-170.3	-58.1	176.8	0	0	0	113.8	I402	I402-L406 HydrophobicContact CB-CD1 4.33Å; I402-L406 HydrophobicContact CG1-CD1 4.26Å; I402-L406 HydrophobicContact CG2-CD1 4.12Å; I402-L406 WeakPolarHBondContact O-CA 3.26Å; I402-L406 WeakPolarHBondContact O-CB 3.39Å; I402-L406 PolarHBondContact O-N 3.34Å
407	D	86.5	Confident	89.9	Confident	32 Å²	32	38.8 Å²	38.8	17%	0.171	20%	0.201	C	C	.	.	I	π-helix	trans	-131.8	-14.6	-162.9	66.2	5.2	0	0	0	117.4	S409 N412 R416	D407-S409 PolarHBondContact O-N 3.3Å; D407-S409 PolarHBondContact OD1-N 3.34Å; D407-N412 WeakPolarHBondContact OD2-CB 3.45Å; D407-N412 PolarHBondContact OD2-ND2 3.24Å; D407-R416 IonicContact OD1-NH1 3.78Å; D407-R416 PolarHBondContact OD1-NH1 2.94Å; D407-R416 IonicContact OD2-CZ 3.64Å; D407-R416 VanDerWaalsContact OD2-CZ 3.29Å; D407-R416 IonicContact OD2-NH1 3.47Å; D407-R416 PolarHBondContact OD2-NH1 3.45Å; D407-R416 IonicContact OD2-NH2 2.74Å; D407-R416 PolarHBondContact OD2-NH2 3.27Å
408	Y	91.9	Very high	90.2	Very high	88 Å²	88	41.3 Å²	41.3	35%	0.345	21%	0.212	S	C	.	.			trans	48.8	19.7	-173.7	-69	-74.2	0	0	0	114.5	V88 N89 P371 F403 L404	V88-Y408 HydrophobicContact CG2-CD2 4.21Å; N89-Y408 WeakPolarHBondContact CB-O 3.23Å; P371-Y408 HydrophobicContact CB-CD1 4.17Å; P371-Y408 HydrophobicContact CB-CG 4.44Å; F403-Y408 HydrophobicContact CD1-CD1 4.38Å; F403-Y408 AromaticContact CE1-CD1 3.98Å; F403-Y408 HydrophobicContact CE1-CD1 3.98Å; F403-Y408 WeakPolarHBondContact CE2-O 3.05Å; F403-Y408 HydrophobicContact CZ-CD1 4.49Å; F403-Y408 WeakPolarHBondContact O-CA 2.91Å; F403-Y408 PolarHBondContact O-N 2.95Å; L404-Y408 HydrophobicContact CD2-CD1 4.39Å; L404-Y408 HydrophobicContact CD2-CE1 3.77Å; L404-Y408 VanDerWaalsContact O-CZ 3.29Å; L404-Y408 PolarHBondContact O-OH 3.45Å; L404-Y408 VanDerWaalsContact O-OH 3.11Å
409	S	91.7	Very high	90.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.226	C	C	.	.			trans	-93.7	118.9	-174.7	169.4	0	0	0	0	110.8	D92 D407 K411 N412 F413	D92-S409 PolarHBondContact OD1-OG 2.98Å; D407-S409 PolarHBondContact O-N 3.3Å; D407-S409 PolarHBondContact OD1-N 3.34Å; S409-K411 VanDerWaalsContact C-N 3.33Å; S409-K411 PolarHBondContact OG-N 3.48Å; S409-N412 PolarHBondContact O-N 3.14Å; S409-N412 PolarHBondContact OG-N 3.27Å; S409-N412 VanDerWaalsContact OG-N 3.16Å; S409-F413 WeakPolarHBondContact O-CB 3.34Å; S409-F413 PolarHBondContact O-N 2.99Å
410	V	92.2	Very high	90.2	Very high	8 Å²	8	44.7 Å²	44.7	5%	0.048	23%	0.228	C	C	.	.	H	α-helix	trans	-70.4	-36.2	178.5	-179.6	0	0	0	0	110	L40 D92 F374 V378 F403 N412 F413 L414	L40-V410 HydrophobicContact CD1-CG1 4.36Å; D92-V410 PolarHBondContact OD2-N 3.22Å; F374-V410 HydrophobicContact CB-CG2 3.61Å; F374-V410 HydrophobicContact CG-CG2 4.48Å; V378-V410 HydrophobicContact CG2-CG1 3.72Å; F403-V410 HydrophobicContact CE2-CG2 3.99Å; F403-V410 HydrophobicContact CZ-CG2 4.27Å; V410-N412 PolarHBondContact O-N 3.29Å; V410-F413 WeakPolarHBondContact O-CB 3.39Å; V410-F413 PolarHBondContact O-N 3.27Å; V410-L414 HydrophobicContact CG1-CD1 4.13Å; V410-L414 HydrophobicContact CG1-CG 4.41Å; V410-L414 WeakPolarHBondContact O-CB 3.04Å; V410-L414 WeakPolarHBondContact O-CG 3.28Å; V410-L414 PolarHBondContact O-N 2.96Å
411	K	90.9	Very high	90.2	Very high	86 Å²	86	42.4 Å²	42.4	37%	0.374	22%	0.216	S	C	.	.	H	α-helix	trans	-58.8	-48.3	174.3	-177.5	179.2	179.8	177.4	0	111.4	D92 S409 L414 Q415	D92-K411 WeakPolarHBondContact OD1-CB 3.38Å; D92-K411 PolarHBondContact OD1-N 3.16Å; D92-K411 VanDerWaalsContact OD1-N 3.14Å; S409-K411 VanDerWaalsContact C-N 3.33Å; S409-K411 PolarHBondContact OG-N 3.48Å; K411-L414 PolarHBondContact O-N 2.98Å; K411-Q415 WeakPolarHBondContact O-CG 3.43Å; K411-Q415 PolarHBondContact O-N 2.99Å
412	N	91.9	Very high	90.5	Very high	38 Å²	38	43 Å²	43	20%	0.203	21%	0.212	C	C	.	.	H	α-helix	trans	-67.6	-39	178.1	-67.7	-12.1	0	0	0	111.4	D407 S409 V410 L414 Q415 R416	D407-N412 WeakPolarHBondContact OD2-CB 3.45Å; D407-N412 PolarHBondContact OD2-ND2 3.24Å; S409-N412 PolarHBondContact O-N 3.14Å; S409-N412 PolarHBondContact OG-N 3.27Å; S409-N412 VanDerWaalsContact OG-N 3.16Å; V410-N412 PolarHBondContact O-N 3.29Å; N412-L414 PolarHBondContact O-N 2.85Å; N412-Q415 PolarHBondContact O-N 3.35Å; N412-R416 WeakPolarHBondContact O-CG 3.4Å; N412-R416 PolarHBondContact O-N 2.97Å
413	F	93.1	Very high	90.3	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	21%	0.214	C	C	.	.	H	α-helix	trans	-56.7	-48.6	173.3	179.1	-91.9	0	0	0	111.9	L375 V378 L379 I382 L395 L398 M399 F403 S409 V410 Q415 R416 L417	L375-F413 HydrophobicContact CD1-CD1 4.02Å; L375-F413 HydrophobicContact CD1-CD2 4Å; L375-F413 HydrophobicContact CD1-CE1 3.96Å; L375-F413 HydrophobicContact CD1-CE2 3.93Å; L375-F413 HydrophobicContact CD1-CG 4.05Å; L375-F413 HydrophobicContact CD1-CZ 3.91Å; V378-F413 HydrophobicContact CG1-CD1 4.18Å; V378-F413 HydrophobicContact CG1-CE1 3.9Å; L379-F413 HydrophobicContact CD2-CZ 4.34Å; I382-F413 HydrophobicContact CD1-CE1 4.45Å; L395-F413 HydrophobicContact CD1-CZ 4.42Å; L398-F413 HydrophobicContact CB-CD2 4.23Å; L398-F413 HydrophobicContact CB-CE2 3.75Å; M399-F413 HydrophobicContact CG-CE2 4.15Å; M399-F413 HydrophobicContact SD-CE2 4.3Å; M399-F413 HydrophobicContact SD-CZ 4.45Å; F403-F413 HydrophobicContact CB-CD2 4.23Å; F403-F413 HydrophobicContact CD2-CB 4Å; F403-F413 HydrophobicContact CD2-CD2 4.44Å; F403-F413 HydrophobicContact CD2-CG 4.49Å; S409-F413 WeakPolarHBondContact O-CB 3.34Å; S409-F413 PolarHBondContact O-N 2.99Å; V410-F413 WeakPolarHBondContact O-CB 3.39Å; V410-F413 PolarHBondContact O-N 3.27Å; F413-Q415 PolarHBondContact O-N 3.15Å; F413-R416 PolarHBondContact O-N 3.38Å; F413-L417 WeakPolarHBondContact O-CB 3.04Å; F413-L417 PolarHBondContact O-N 3.36Å
414	L	93.1	Very high	89.9	Confident	19 Å²	19	44.3 Å²	44.3	10%	0.099	22%	0.218	C	C	.	.	H	α-helix	trans	-62.7	-39.4	177.5	-71.3	170.2	0	0	0	112.2	W29 I33 V36 V378 V410 K411 N412 L417 K418	W29-L414 WeakPolarHBondContact CH2-O 3.42Å; I33-L414 HydrophobicContact CD1-CD1 3.94Å; I33-L414 HydrophobicContact CD1-CD2 4.37Å; V36-L414 HydrophobicContact CG1-CD1 4.16Å; V36-L414 HydrophobicContact CG1-CD2 4.22Å; V378-L414 HydrophobicContact CG1-CD2 3.71Å; V410-L414 HydrophobicContact CG1-CD1 4.13Å; V410-L414 HydrophobicContact CG1-CG 4.41Å; V410-L414 WeakPolarHBondContact O-CB 3.04Å; V410-L414 WeakPolarHBondContact O-CG 3.28Å; V410-L414 PolarHBondContact O-N 2.96Å; K411-L414 PolarHBondContact O-N 2.98Å; N412-L414 PolarHBondContact O-N 2.85Å; L414-L417 PolarHBondContact O-N 2.82Å; L414-K418 WeakPolarHBondContact O-CB 2.94Å; L414-K418 PolarHBondContact O-N 2.64Å
415	Q	92.5	Very high	89.7	Confident	114 Å²	114	41.6 Å²	41.6	53%	0.533	20%	0.204	S	C	.	.	H	α-helix	trans	-64.7	-39.8	174.9	-73.1	-178.6	-3.5	0	0	112.7	K411 N412 F413 K418 F419	K411-Q415 WeakPolarHBondContact O-CG 3.43Å; K411-Q415 PolarHBondContact O-N 2.99Å; N412-Q415 PolarHBondContact O-N 3.35Å; F413-Q415 PolarHBondContact O-N 3.15Å; Q415-K418 WeakPolarHBondContact O-CB 3.25Å; Q415-K418 PolarHBondContact O-N 3.1Å; Q415-F419 PolarHBondContact O-N 3.18Å
416	R	92.1	Very high	89.6	Confident	44 Å²	44	41 Å²	41	17%	0.166	19%	0.194	C	C	.	.	H	α-helix	trans	-68.9	-40.3	176.6	-65.9	167.1	-175.4	133.5	-0.7	111.3	L398 D407 N412 F413 F419 C420 L795	L398-R416 HydrophobicContact CD2-CB 3.61Å; L398-R416 HydrophobicContact CD2-CG 4.49Å; D407-R416 IonicContact OD1-NH1 3.78Å; D407-R416 PolarHBondContact OD1-NH1 2.94Å; D407-R416 IonicContact OD2-CZ 3.64Å; D407-R416 VanDerWaalsContact OD2-CZ 3.29Å; D407-R416 IonicContact OD2-NH1 3.47Å; D407-R416 PolarHBondContact OD2-NH1 3.45Å; D407-R416 IonicContact OD2-NH2 2.74Å; D407-R416 PolarHBondContact OD2-NH2 3.27Å; N412-R416 WeakPolarHBondContact O-CG 3.4Å; N412-R416 PolarHBondContact O-N 2.97Å; F413-R416 PolarHBondContact O-N 3.38Å; R416-F419 WeakPolarHBondContact O-CB 2.94Å; R416-F419 PolarHBondContact O-N 3.24Å; R416-C420 PolarHBondContact O-N 3.01Å; R416-C420 PolarHBondContact O-SG 3.47Å; R416-L795 HydrophobicContact CB-CD1 4.1Å; R416-L795 HydrophobicContact CB-CD2 4.22Å; R416-L795 HydrophobicContact CG-CD1 4.39Å; R416-L795 HydrophobicContact CG-CD2 4.04Å
417	L	91.4	Very high	89.3	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-62.6	-44	173.1	-177.2	67.9	0	0	0	111.3	W29 I382 P390 L398 F413 L414 F419 C420 M421	W29-L417 HydrophobicContact CZ3-CD2 4.44Å; W29-L417 HydrophobicContact CZ3-CG 4.35Å; I382-L417 HydrophobicContact CD1-CD2 3.26Å; I382-L417 HydrophobicContact CG1-CD2 4Å; P390-L417 HydrophobicContact CB-CD1 4.42Å; P390-L417 HydrophobicContact CG-CD1 4.3Å; L398-L417 HydrophobicContact CD1-CB 4.48Å; L398-L417 HydrophobicContact CD1-CD1 4.25Å; F413-L417 WeakPolarHBondContact O-CB 3.04Å; F413-L417 PolarHBondContact O-N 3.36Å; L414-L417 PolarHBondContact O-N 2.82Å; L417-F419 VanDerWaalsContact C-N 3.25Å; L417-F419 PolarHBondContact O-N 2.68Å; L417-C420 WeakPolarHBondContact O-CB 3.46Å; L417-C420 PolarHBondContact O-N 3.43Å; L417-C420 VanDerWaalsContact O-N 3.09Å; L417-M421 HydrophobicContact CG-SD 4.45Å; L417-M421 WeakPolarHBondContact O-CG 3.42Å; L417-M421 PolarHBondContact O-N 3.34Å
418	K	92.8	Very high	89	Confident	81 Å²	81	40.3 Å²	40.3	35%	0.352	19%	0.186	S	C	.	.	H	α-helix	trans	-52.8	-46.4	173.3	-172	180	-179.8	-178.5	0	111.3	F25 W29 L414 Q415 M421 L422	F25-K418 HydrophobicContact CZ-CG 3.79Å; W29-K418 HydrophobicContact CD2-CB 4.15Å; W29-K418 HydrophobicContact CD2-CD 4.28Å; W29-K418 HydrophobicContact CD2-CG 3.75Å; W29-K418 HydrophobicContact CE3-CB 4.17Å; W29-K418 HydrophobicContact CE3-CG 4.13Å; W29-K418 HydrophobicContact CG-CG 4.29Å; W29-K418 HydrophobicContact CH2-CB 3.51Å; W29-K418 HydrophobicContact CH2-CG 4.2Å; W29-K418 HydrophobicContact CZ2-CB 3.47Å; W29-K418 VanDerWaalsContact CZ2-CB 3.47Å; W29-K418 HydrophobicContact CZ2-CD 4.06Å; W29-K418 HydrophobicContact CZ2-CG 3.82Å; W29-K418 VanDerWaalsContact CZ3-CA 3.49Å; W29-K418 HydrophobicContact CZ3-CB 3.86Å; W29-K418 HydrophobicContact CZ3-CG 4.34Å; L414-K418 WeakPolarHBondContact O-CB 2.94Å; L414-K418 PolarHBondContact O-N 2.64Å; Q415-K418 WeakPolarHBondContact O-CB 3.25Å; Q415-K418 PolarHBondContact O-N 3.1Å; K418-M421 PolarHBondContact O-N 3.5Å; K418-L422 VanDerWaalsContact O-CB 3.31Å; K418-L422 WeakPolarHBondContact O-CB 3.1Å; K418-L422 PolarHBondContact O-N 3.43Å
419	F	91.3	Very high	88	Confident	68 Å²	68	38 Å²	38	30%	0.298	18%	0.181	S	C	.	.	H	α-helix	trans	-62.6	-44.4	177.7	178.4	-93.8	0	0	0	111.8	Q415 R416 L417 L422 E423 R794 L795	Q415-F419 PolarHBondContact O-N 3.18Å; R416-F419 WeakPolarHBondContact O-CB 2.94Å; R416-F419 PolarHBondContact O-N 3.24Å; L417-F419 VanDerWaalsContact C-N 3.25Å; L417-F419 PolarHBondContact O-N 2.68Å; F419-L422 PolarHBondContact O-N 3.43Å; F419-E423 VanDerWaalsContact CE1-OE2 3.28Å; F419-E423 WeakPolarHBondContact CE1-OE2 3.43Å; F419-E423 WeakPolarHBondContact O-CB 3.34Å; F419-E423 PolarHBondContact O-N 2.9Å; F419-R794 HydrophobicContact CE1-CB 4.22Å; F419-R794 HydrophobicContact CZ-CB 4.31Å; F419-L795 HydrophobicContact CD1-CD2 3.84Å; F419-L795 HydrophobicContact CD1-CG 4.46Å; F419-L795 HydrophobicContact CG-CD2 4.34Å
420	C	87.6	Confident	87.6	Confident	11 Å²	11	39.4 Å²	39.4	7%	0.074	19%	0.188	C	C	.	.	H	α-helix	trans	-62.6	-43.4	177.6	-61.5	0	0	0	0	112	V394 R416 L417 E423 H424 I791	V394-C420 HydrophobicContact CG1-CB 4.04Å; R416-C420 PolarHBondContact O-N 3.01Å; R416-C420 PolarHBondContact O-SG 3.47Å; L417-C420 WeakPolarHBondContact O-CB 3.46Å; L417-C420 PolarHBondContact O-N 3.43Å; L417-C420 VanDerWaalsContact O-N 3.09Å; C420-E423 PolarHBondContact O-N 2.97Å; C420-H424 PolarHBondContact O-N 2.88Å; C420-I791 HydrophobicContact CB-CD1 4.48Å; C420-I791 VanDerWaalsContact SG-CG2 3.57Å
421	M	88.6	Confident	87.1	Confident	11 Å²	11	39 Å²	39	5%	0.054	19%	0.186	C	C	.	.	H	α-helix	trans	-64.2	-46.6	176.1	-69.8	-174.3	74	0	0	111.4	F25 V28 W29 I32 L388 L417 K418 E423 H424 Y425	F25-M421 HydrophobicContact CD2-CB 4.32Å; F25-M421 HydrophobicContact CE2-CB 3.9Å; V28-M421 HydrophobicContact CG1-CE 4.14Å; W29-M421 HydrophobicContact CE3-SD 3.64Å; W29-M421 HydrophobicContact CZ3-SD 3.6Å; I32-M421 HydrophobicContact CD1-CE 3.67Å; I32-M421 HydrophobicContact CD1-SD 4.22Å; L388-M421 HydrophobicContact CB-CE 4.47Å; L388-M421 HydrophobicContact CD2-CB 4.09Å; L388-M421 HydrophobicContact CD2-CE 4.24Å; L388-M421 HydrophobicContact CD2-CG 4.04Å; L417-M421 HydrophobicContact CG-SD 4.45Å; L417-M421 WeakPolarHBondContact O-CG 3.42Å; L417-M421 PolarHBondContact O-N 3.34Å; K418-M421 PolarHBondContact O-N 3.5Å; M421-E423 VanDerWaalsContact C-N 3.3Å; M421-E423 PolarHBondContact O-N 3.05Å; M421-H424 WeakPolarHBondContact O-CB 3.45Å; M421-H424 PolarHBondContact O-N 3.48Å; M421-Y425 WeakPolarHBondContact O-CD2 3.41Å; M421-Y425 PolarHBondContact O-N 2.67Å
422	L	88.9	Confident	86.7	Confident	42 Å²	42	36 Å²	36	22%	0.22	17%	0.173	C	C	.	.	H	α-helix	trans	-56.6	-46.1	175.6	175.6	62.4	0	0	0	111.1	Y22 F25 K418 F419 H424 Y425 L426	Y22-L422 HydrophobicContact CD2-CD1 3.82Å; Y22-L422 HydrophobicContact CE2-CD1 4.09Å; F25-L422 HydrophobicContact CD1-CD1 3.65Å; F25-L422 HydrophobicContact CD2-CB 4.37Å; F25-L422 HydrophobicContact CE1-CB 4.07Å; F25-L422 HydrophobicContact CE1-CD1 3.75Å; F25-L422 HydrophobicContact CE1-CG 4.37Å; F25-L422 HydrophobicContact CE2-CB 3.91Å; F25-L422 HydrophobicContact CG-CD1 4.13Å; F25-L422 HydrophobicContact CZ-CB 3.74Å; F25-L422 HydrophobicContact CZ-CD1 4.31Å; K418-L422 VanDerWaalsContact O-CB 3.31Å; K418-L422 WeakPolarHBondContact O-CB 3.1Å; K418-L422 PolarHBondContact O-N 3.43Å; F419-L422 PolarHBondContact O-N 3.43Å; L422-H424 VanDerWaalsContact C-N 3.32Å; L422-H424 PolarHBondContact O-N 3.11Å; L422-Y425 PolarHBondContact O-N 2.8Å; L422-L426 HydrophobicContact CD1-CD1 3.81Å; L422-L426 HydrophobicContact CD1-CG 4Å; L422-L426 HydrophobicContact CG-CD1 3.91Å; L422-L426 HydrophobicContact CG-CG 4.44Å; L422-L426 WeakPolarHBondContact O-CB 3.22Å; L422-L426 VanDerWaalsContact O-CG 3.24Å; L422-L426 WeakPolarHBondContact O-CG 3.39Å; L422-L426 PolarHBondContact O-N 3.18Å
423	E	84.8	Confident	86.3	Confident	10 Å²	10	34.1 Å²	34.1	5%	0.047	16%	0.163	C	C	.	.	H	α-helix	trans	-60.7	-40.2	178.4	-175.1	174	162.7	0	0	112.1	F419 C420 M421 K427 L787 I791 R794	F419-E423 VanDerWaalsContact CE1-OE2 3.28Å; F419-E423 WeakPolarHBondContact CE1-OE2 3.43Å; F419-E423 WeakPolarHBondContact O-CB 3.34Å; F419-E423 PolarHBondContact O-N 2.9Å; C420-E423 PolarHBondContact O-N 2.97Å; M421-E423 VanDerWaalsContact C-N 3.3Å; M421-E423 PolarHBondContact O-N 3.05Å; E423-K427 HydrophobicContact CG-CD 3.88Å; E423-K427 HydrophobicContact CG-CG 4.46Å; E423-K427 WeakPolarHBondContact O-CB 3.42Å; E423-K427 WeakPolarHBondContact O-CG 3.46Å; E423-K427 PolarHBondContact O-N 3.11Å; E423-K427 VanDerWaalsContact OE1-CE 3.31Å; E423-K427 WeakPolarHBondContact OE1-CE 3.31Å; E423-K427 IonicContact OE1-NZ 2.78Å; E423-K427 PolarHBondContact OE1-NZ 2.91Å; E423-L787 HydrophobicContact CG-CD1 4.37Å; E423-L787 VanDerWaalsContact OE1-CD1 3.24Å; E423-L787 WeakPolarHBondContact OE1-CD1 3.33Å; E423-I791 WeakPolarHBondContact OE2-CG1 3.15Å; E423-R794 IonicContact OE1-CZ 2.83Å; E423-R794 IonicContact OE1-NH2 3.81Å; E423-R794 PolarHBondContact OE1-NH2 3.21Å; E423-R794 IonicContact OE2-CZ 3.78Å; E423-R794 IonicContact OE2-NE 2.84Å; E423-R794 PolarHBondContact OE2-NE 3.33Å; E423-R794 IonicContact OE2-NH2 2.68Å; E423-R794 PolarHBondContact OE2-NH2 3.35Å
424	H	83.8	Confident	85.8	Confident	19 Å²	19	34.8 Å²	34.8	9%	0.088	17%	0.166	C	C	.	.	H	α-helix	trans	-62.6	-53.5	174.2	-172.9	88.6	0	0	0	111.7	L388 C420 M421 L422 L426 K427 T428 V756	L388-H424 HydrophobicContact CD1-CB 4.3Å; L388-H424 WeakPolarHBondContact CD1-CD2 3.24Å; L388-H424 VanDerWaalsContact CD1-NE2 3.3Å; L388-H424 WeakPolarHBondContact CD1-NE2 2.88Å; L388-H424 HydrophobicContact CD2-CB 3.65Å; C420-H424 PolarHBondContact O-N 2.88Å; M421-H424 WeakPolarHBondContact O-CB 3.45Å; M421-H424 PolarHBondContact O-N 3.48Å; L422-H424 VanDerWaalsContact C-N 3.32Å; L422-H424 PolarHBondContact O-N 3.11Å; H424-L426 PolarHBondContact O-N 3.13Å; H424-L426 VanDerWaalsContact O-N 3.16Å; H424-K427 PolarHBondContact O-N 3.32Å; H424-K427 VanDerWaalsContact O-N 3.09Å; H424-T428 PolarHBondContact CD2-OG1 3.37Å; H424-T428 VanDerWaalsContact CD2-OG1 3.26Å; H424-T428 PolarHBondContact CE1-OG1 3.48Å; H424-T428 PolarHBondContact ND1-OG1 3.22Å; H424-T428 PolarHBondContact NE2-OG1 3.29Å; H424-T428 VanDerWaalsContact NE2-OG1 3.08Å; H424-T428 VanDerWaalsContact O-CB 3.31Å; H424-T428 WeakPolarHBondContact O-CB 3.22Å; H424-T428 PolarHBondContact O-N 3.34Å; H424-T428 PolarHBondContact O-OG1 2.86Å; H424-V756 PolarHBondContact NE2-O 3.3Å
425	Y	85.4	Confident	85.2	Confident	3 Å²	3	36.2 Å²	36.2	1%	0.012	17%	0.173	C	C	.	.	H	α-helix	trans	-59	-31.3	-179.6	-88.7	-91.7	0	0	0	113.4	Q24 F25 L388 M421 L422 P431 L434	Q24-Y425 HydrophobicContact CB-CE1 4.47Å; Q24-Y425 HydrophobicContact CG-CE1 3.91Å; F25-Y425 HydrophobicContact CB-CD1 4.07Å; F25-Y425 HydrophobicContact CB-CD2 4.14Å; F25-Y425 HydrophobicContact CB-CG 3.79Å; F25-Y425 HydrophobicContact CD2-CD2 4.04Å; F25-Y425 HydrophobicContact CD2-CG 4.47Å; L388-Y425 HydrophobicContact CB-CE2 4.16Å; L388-Y425 HydrophobicContact CD2-CD2 3.85Å; L388-Y425 HydrophobicContact CD2-CE2 3.7Å; M421-Y425 WeakPolarHBondContact O-CD2 3.41Å; M421-Y425 PolarHBondContact O-N 2.67Å; L422-Y425 PolarHBondContact O-N 2.8Å; Y425-P431 HydrophobicContact CD1-CB 3.91Å; Y425-P431 HydrophobicContact CE1-CB 4.37Å; Y425-L434 HydrophobicContact CE1-CD1 3.91Å; Y425-L434 HydrophobicContact CE2-CD1 4.24Å
426	L	84.7	Confident	84.6	Confident	82 Å²	82	34.8 Å²	34.8	43%	0.429	17%	0.168	S	C	.	.	H	α-helix	trans	-78	-35.1	177	-67.8	176.6	0	0	0	112.8	R21 L422 H424	R21-L426 PolarHBondContact NH1-O 3.49Å; L422-L426 HydrophobicContact CD1-CD1 3.81Å; L422-L426 HydrophobicContact CD1-CG 4Å; L422-L426 HydrophobicContact CG-CD1 3.91Å; L422-L426 HydrophobicContact CG-CG 4.44Å; L422-L426 WeakPolarHBondContact O-CB 3.22Å; L422-L426 VanDerWaalsContact O-CG 3.24Å; L422-L426 WeakPolarHBondContact O-CG 3.39Å; L422-L426 PolarHBondContact O-N 3.18Å; H424-L426 PolarHBondContact O-N 3.13Å; H424-L426 VanDerWaalsContact O-N 3.16Å
427	K	80.5	Confident	84	Confident	107 Å²	107	32.9 Å²	32.9	47%	0.465	16%	0.162	S	C	.	.	H	α-helix	trans	-90.2	-31.4	-175.9	-73.9	-177.5	171.4	-176.2	0	114.5	E423 H424 L787	E423-K427 HydrophobicContact CG-CD 3.88Å; E423-K427 HydrophobicContact CG-CG 4.46Å; E423-K427 WeakPolarHBondContact O-CB 3.42Å; E423-K427 WeakPolarHBondContact O-CG 3.46Å; E423-K427 PolarHBondContact O-N 3.11Å; E423-K427 VanDerWaalsContact OE1-CE 3.31Å; E423-K427 WeakPolarHBondContact OE1-CE 3.31Å; E423-K427 IonicContact OE1-NZ 2.78Å; E423-K427 PolarHBondContact OE1-NZ 2.91Å; H424-K427 PolarHBondContact O-N 3.32Å; H424-K427 VanDerWaalsContact O-N 3.09Å; K427-L787 HydrophobicContact CD-CD1 3.63Å
428	T	79.1	Confident	83.6	Confident	12 Å²	12	39.3 Å²	39.3	7%	0.074	19%	0.191	C	C	.	.	S	Bend	trans	-65.9	125.3	-176.6	-62.8	0	0	0	0	109.4	H424 H430	H424-T428 PolarHBondContact CD2-OG1 3.37Å; H424-T428 VanDerWaalsContact CD2-OG1 3.26Å; H424-T428 PolarHBondContact CE1-OG1 3.48Å; H424-T428 PolarHBondContact ND1-OG1 3.22Å; H424-T428 PolarHBondContact NE2-OG1 3.29Å; H424-T428 VanDerWaalsContact NE2-OG1 3.08Å; H424-T428 VanDerWaalsContact O-CB 3.31Å; H424-T428 WeakPolarHBondContact O-CB 3.22Å; H424-T428 PolarHBondContact O-N 3.34Å; H424-T428 PolarHBondContact O-OG1 2.86Å; T428-H430 PolarHBondContact O-N 3.31Å
429	P	72.4	Confident	83.1	Confident	39 Å²	39	38.8 Å²	38.8	25%	0.253	19%	0.192	S	C	.	.	S	Bend	trans	-61.7	137	167.7	27.8	-32.3	0	0	0	107.2	D459 Y460	P429-D459 HydrophobicContact CB-CB 4.02Å; P429-D459 HydrophobicContact CG-CB 3.63Å; P429-Y460 HydrophobicContact CG-CE1 4.24Å; P429-Y460 PolarHBondContact O-OH 3.12Å
430	H	81.7	Confident	82.8	Confident	31 Å²	31	35.6 Å²	35.6	14%	0.144	18%	0.178	C	C	.	.			trans	54.2	61.6	177.7	-51.4	-72.4	0	0	0	116.9	T428 E432 L433 Y443 I455 D459	T428-H430 PolarHBondContact O-N 3.31Å; H430-E432 VanDerWaalsContact C-OE2 3.23Å; H430-E432 VanDerWaalsContact CA-OE2 3.25Å; H430-E432 WeakPolarHBondContact CA-OE2 3.41Å; H430-E432 PolarHBondContact O-N 3.26Å; H430-L433 HydrophobicContact CB-CD1 4.3Å; H430-L433 HydrophobicContact CB-CG 4.2Å; H430-L433 PolarHBondContact O-N 3.31Å; H430-Y443 HydrophobicContact CB-CE1 4.11Å; H430-Y443 AromaticContact ND1-CE1 3.7Å; H430-Y443 AromaticContact ND1-CZ 3.67Å; H430-Y443 PolarHBondContact ND1-OH 2.72Å; H430-I455 VanDerWaalsContact CD2-CG1 3.42Å; H430-I455 WeakPolarHBondContact CD2-CG1 3.34Å; H430-I455 WeakPolarHBondContact NE2-CG1 3.41Å; H430-D459 IonicContact CD2-OD2 3.29Å; H430-D459 IonicContact NE2-OD2 2.8Å
431	P	82.4	Confident	82.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-61.1	-15	174.8	28	-35.2	0	0	0	113.5	R21 Q24 Y425 L433 L434	R21-P431 HydrophobicContact CB-CG 4.09Å; R21-P431 HydrophobicContact CG-CG 3.66Å; Q24-P431 PolarHBondContact NE2-O 3.15Å; Q24-P431 PolarHBondContact OE1-O 3.25Å; Y425-P431 HydrophobicContact CD1-CB 3.91Å; Y425-P431 HydrophobicContact CE1-CB 4.37Å; P431-L433 PolarHBondContact O-N 2.89Å; P431-L433 VanDerWaalsContact O-N 3.17Å; P431-L434 WeakPolarHBondContact O-CB 3.28Å; P431-L434 PolarHBondContact O-N 3.08Å
432	E	82.3	Confident	82.6	Confident	21 Å²	21	44.4 Å²	44.4	10%	0.098	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-59.1	-23.1	174.8	-61.2	85	173.7	0	0	112.6	H20 H430 L434 Q435 Y443	H20-E432 IonicContact CD2-OE1 2.69Å; H430-E432 VanDerWaalsContact C-OE2 3.23Å; H430-E432 VanDerWaalsContact CA-OE2 3.25Å; H430-E432 WeakPolarHBondContact CA-OE2 3.41Å; H430-E432 PolarHBondContact O-N 3.26Å; E432-L434 PolarHBondContact O-N 3.39Å; E432-Q435 WeakPolarHBondContact O-CB 3.2Å; E432-Q435 WeakPolarHBondContact O-CG 3.23Å; E432-Q435 PolarHBondContact O-N 2.92Å; E432-Y443 HydrophobicContact CB-CD1 3.6Å; E432-Y443 HydrophobicContact CB-CD2 3.87Å; E432-Y443 HydrophobicContact CB-CE1 3.75Å; E432-Y443 HydrophobicContact CB-CE2 4.01Å; E432-Y443 HydrophobicContact CB-CG 3.65Å; E432-Y443 VanDerWaalsContact CD-CZ 3.5Å; E432-Y443 HydrophobicContact CG-CD1 4.32Å; E432-Y443 HydrophobicContact CG-CD2 3.78Å; E432-Y443 HydrophobicContact CG-CE1 4.2Å; E432-Y443 HydrophobicContact CG-CE2 3.63Å; E432-Y443 HydrophobicContact CG-CG 4.12Å; E432-Y443 PolarHBondContact OE2-OH 2.68Å
433	L	83.3	Confident	82.4	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-69.5	-16.7	174.3	-58.7	-175.5	0	0	0	113.9	H430 P431 Q435 A440 Y443 L444 Y460 L518 V756	H430-L433 HydrophobicContact CB-CD1 4.3Å; H430-L433 HydrophobicContact CB-CG 4.2Å; H430-L433 PolarHBondContact O-N 3.31Å; P431-L433 PolarHBondContact O-N 2.89Å; P431-L433 VanDerWaalsContact O-N 3.17Å; L433-Q435 PolarHBondContact O-N 3.24Å; L433-A440 HydrophobicContact CD2-CB 4.48Å; L433-Y443 HydrophobicContact CD2-CD1 4.39Å; L433-L444 HydrophobicContact CD2-CD1 4.02Å; L433-L444 HydrophobicContact CD2-CD2 3.85Å; L433-L444 HydrophobicContact CD2-CG 3.87Å; L433-Y460 HydrophobicContact CD1-CE2 3.57Å; L433-L518 HydrophobicContact CB-CD1 4.38Å; L433-L518 HydrophobicContact CB-CD2 4.39Å; L433-L518 HydrophobicContact CD2-CD1 4.25Å; L433-V756 HydrophobicContact CB-CG1 3.91Å; L433-V756 HydrophobicContact CD1-CG2 4.26Å
434	L	82.8	Confident	82.4	Confident	14 Å²	14	44.7 Å²	44.7	7%	0.073	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-78.8	-6.9	173.1	-71.6	167	0	0	0	113.1	L388 Y425 P431 E432 V756 F757	L388-L434 HydrophobicContact CB-CD1 4.33Å; L388-L434 HydrophobicContact CB-CD2 4.41Å; Y425-L434 HydrophobicContact CE1-CD1 3.91Å; Y425-L434 HydrophobicContact CE2-CD1 4.24Å; P431-L434 WeakPolarHBondContact O-CB 3.28Å; P431-L434 PolarHBondContact O-N 3.08Å; E432-L434 PolarHBondContact O-N 3.39Å; L434-V756 HydrophobicContact CD2-CG1 3.8Å; L434-V756 WeakPolarHBondContact CD2-O 3.29Å; L434-V756 HydrophobicContact CG-CG1 3.82Å; L434-F757 HydrophobicContact CD2-CD1 3.76Å; L434-F757 HydrophobicContact CD2-CE1 4.12Å; L434-F757 HydrophobicContact CD2-CG 4.39Å
435	Q	81.1	Confident	82.4	Confident	50 Å²	50	48.1 Å²	48.1	23%	0.234	24%	0.237	C	C	.	.	S	Bend	trans	-77.1	177.9	177.7	-57.7	-174.2	15.2	0	0	111.4	Q24 E432 L433 L439	Q24-Q435 HydrophobicContact CG-CG 4.46Å; E432-Q435 WeakPolarHBondContact O-CB 3.2Å; E432-Q435 WeakPolarHBondContact O-CG 3.23Å; E432-Q435 PolarHBondContact O-N 2.92Å; L433-Q435 PolarHBondContact O-N 3.24Å; Q435-L439 HydrophobicContact CB-CB 4.04Å; Q435-L439 HydrophobicContact CB-CD1 4.34Å
436	L	80.5	Confident	82.4	Confident	83 Å²	83	52.1 Å²	52.1	44%	0.435	27%	0.265	S	S	.	.			trans	-54	145.3	171.8	-72.3	161.6	0	0	0	110.6	E438 L439 A440	L436-E438 PolarHBondContact O-N 3.32Å; L436-L439 PolarHBondContact O-N 3.45Å; L436-A440 PolarHBondContact O-N 3.49Å
437	P	79.8	Confident	82.3	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.032	25%	0.251	C	S	.	.	H	α-helix	trans	-58	-30.3	-173.2	22	-33.2	0	0	0	112.9	A440 H441 V515 E519 L522	P437-A440 PolarHBondContact O-N 3.23Å; P437-H441 VanDerWaalsContact O-CB 3.31Å; P437-H441 WeakPolarHBondContact O-CB 3.42Å; P437-H441 PolarHBondContact O-N 2.97Å; P437-V515 HydrophobicContact CB-CG1 4.14Å; P437-E519 HydrophobicContact CB-CG 3.76Å; P437-E519 HydrophobicContact CG-CG 4.09Å; P437-L522 HydrophobicContact CG-CD1 4.36Å
438	E	82.3	Confident	82.3	Confident	136 Å²	136	49.8 Å²	49.8	64%	0.636	26%	0.258	S	S	*	.	H	α-helix	trans	-64.6	-39.5	174.9	-60.7	178.5	-170.6	0	0	113.2	L436 K442	L436-E438 PolarHBondContact O-N 3.32Å; E438-K442 WeakPolarHBondContact O-CG 2.88Å; E438-K442 PolarHBondContact O-N 3.2Å; E438-K442 VanDerWaalsContact O-N 3.12Å
439	L	82.5	Confident	82.2	Confident	71 Å²	71	52.8 Å²	52.8	37%	0.372	28%	0.279	S	S	.	.	H	α-helix	trans	-76.7	-39.7	178.3	-63.4	177.8	0	0	0	110.5	Q435 L436 H441 K442 Y443	Q435-L439 HydrophobicContact CB-CB 4.04Å; Q435-L439 HydrophobicContact CB-CD1 4.34Å; L436-L439 PolarHBondContact O-N 3.45Å; L439-H441 VanDerWaalsContact C-N 3.3Å; L439-H441 PolarHBondContact O-N 3.48Å; L439-K442 HydrophobicContact CD2-CD 4.46Å; L439-K442 PolarHBondContact O-N 3.23Å; L439-Y443 WeakPolarHBondContact O-CB 3.31Å; L439-Y443 PolarHBondContact O-N 3.33Å
440	A	84	Confident	82.5	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.3	-41.6	171.4	0	0	0	0	0	111.3	L433 L436 P437 Y443 L444 L518	L433-A440 HydrophobicContact CD2-CB 4.48Å; L436-A440 PolarHBondContact O-N 3.49Å; P437-A440 PolarHBondContact O-N 3.23Å; A440-Y443 PolarHBondContact O-N 2.74Å; A440-L444 WeakPolarHBondContact O-CB 3.35Å; A440-L444 VanDerWaalsContact O-CG 3.28Å; A440-L444 WeakPolarHBondContact O-CG 3.39Å; A440-L444 PolarHBondContact O-N 3.39Å; A440-L518 HydrophobicContact CB-CD1 3.83Å
441	H	86.2	Confident	82.4	Confident	71 Å²	71	61.7 Å²	61.7	33%	0.329	31%	0.311	S	S	.	.	H	α-helix	trans	-62.4	-47.4	175	-173.8	77.3	0	0	0	111.7	P437 L439 Y443 L444 T445 N512 V515	P437-H441 VanDerWaalsContact O-CB 3.31Å; P437-H441 WeakPolarHBondContact O-CB 3.42Å; P437-H441 PolarHBondContact O-N 2.97Å; L439-H441 VanDerWaalsContact C-N 3.3Å; L439-H441 PolarHBondContact O-N 3.48Å; H441-Y443 VanDerWaalsContact C-N 3.28Å; H441-Y443 PolarHBondContact O-N 3.25Å; H441-L444 PolarHBondContact O-N 3.05Å; H441-T445 WeakPolarHBondContact O-CB 3.35Å; H441-T445 PolarHBondContact O-N 3.15Å; H441-T445 PolarHBondContact O-OG1 2.96Å; H441-N512 PolarHBondContact CE1-OD1 3.05Å; H441-V515 HydrophobicContact CB-CG2 3.98Å
442	K	86.5	Confident	82.3	Confident	137 Å²	137	61.9 Å²	61.9	60%	0.596	31%	0.312	S	S	*	.	H	α-helix	trans	-58.5	-40.8	175.8	-74.1	173.9	-175.4	173.5	0	112.1	E438 L439 S446	E438-K442 WeakPolarHBondContact O-CG 2.88Å; E438-K442 PolarHBondContact O-N 3.2Å; E438-K442 VanDerWaalsContact O-N 3.12Å; L439-K442 HydrophobicContact CD2-CD 4.46Å; L439-K442 PolarHBondContact O-N 3.23Å; K442-S446 PolarHBondContact O-N 2.89Å
443	Y	85.2	Confident	82	Confident	55 Å²	55	63.3 Å²	63.3	22%	0.216	33%	0.327	C	S	.	.	H	α-helix	trans	-66.4	-50.2	176.7	179.7	-107	0	0	0	111.9	H430 E432 L433 L439 A440 H441 T445 S446 I447	H430-Y443 HydrophobicContact CB-CE1 4.11Å; H430-Y443 AromaticContact ND1-CE1 3.7Å; H430-Y443 AromaticContact ND1-CZ 3.67Å; H430-Y443 PolarHBondContact ND1-OH 2.72Å; E432-Y443 HydrophobicContact CB-CD1 3.6Å; E432-Y443 HydrophobicContact CB-CD2 3.87Å; E432-Y443 HydrophobicContact CB-CE1 3.75Å; E432-Y443 HydrophobicContact CB-CE2 4.01Å; E432-Y443 HydrophobicContact CB-CG 3.65Å; E432-Y443 VanDerWaalsContact CD-CZ 3.5Å; E432-Y443 HydrophobicContact CG-CD1 4.32Å; E432-Y443 HydrophobicContact CG-CD2 3.78Å; E432-Y443 HydrophobicContact CG-CE1 4.2Å; E432-Y443 HydrophobicContact CG-CE2 3.63Å; E432-Y443 HydrophobicContact CG-CG 4.12Å; E432-Y443 PolarHBondContact OE2-OH 2.68Å; L433-Y443 HydrophobicContact CD2-CD1 4.39Å; L439-Y443 WeakPolarHBondContact O-CB 3.31Å; L439-Y443 PolarHBondContact O-N 3.33Å; A440-Y443 PolarHBondContact O-N 2.74Å; H441-Y443 VanDerWaalsContact C-N 3.28Å; H441-Y443 PolarHBondContact O-N 3.25Å; Y443-T445 PolarHBondContact O-N 3.36Å; Y443-S446 PolarHBondContact O-N 3.46Å; Y443-S446 PolarHBondContact O-OG 2.88Å; Y443-I447 HydrophobicContact CD1-CD1 3.5Å; Y443-I447 VanDerWaalsContact CD1-CD1 3.5Å; Y443-I447 HydrophobicContact CD1-CG1 4.39Å; Y443-I447 HydrophobicContact CE1-CD1 3.14Å; Y443-I447 HydrophobicContact CE1-CG1 4.09Å; Y443-I447 HydrophobicContact CE2-CD1 4.3Å; Y443-I447 HydrophobicContact CE2-CG1 4.4Å; Y443-I447 HydrophobicContact CG-CD1 4.2Å; Y443-I447 VanDerWaalsContact O-CG1 3.3Å; Y443-I447 WeakPolarHBondContact O-CG1 3.47Å; Y443-I447 PolarHBondContact O-N 3.09Å
444	L	83.7	Confident	81.8	Confident	2 Å²	2	67.4 Å²	67.4	1%	0.01	35%	0.346	C	S	.	.	H	α-helix	trans	-61.2	-30	178.1	-73.2	169.5	0	0	0	112.8	L433 A440 H441 I447 I455 V511 I514 V515	L433-L444 HydrophobicContact CD2-CD1 4.02Å; L433-L444 HydrophobicContact CD2-CD2 3.85Å; L433-L444 HydrophobicContact CD2-CG 3.87Å; A440-L444 WeakPolarHBondContact O-CB 3.35Å; A440-L444 VanDerWaalsContact O-CG 3.28Å; A440-L444 WeakPolarHBondContact O-CG 3.39Å; A440-L444 PolarHBondContact O-N 3.39Å; H441-L444 PolarHBondContact O-N 3.05Å; L444-I447 HydrophobicContact CD2-CD1 4.28Å; L444-I455 HydrophobicContact CD2-CD1 4.34Å; L444-V511 HydrophobicContact CB-CG1 3.79Å; L444-V511 HydrophobicContact CB-CG2 4.16Å; L444-V511 HydrophobicContact CD1-CG1 4.31Å; L444-I514 HydrophobicContact CD1-CB 4.18Å; L444-I514 HydrophobicContact CD1-CG2 3.5Å; L444-I514 HydrophobicContact CD2-CG2 4.49Å; L444-V515 HydrophobicContact CD1-CG2 3.93Å
445	T	85.2	Confident	81.6	Confident	92 Å²	92	66.8 Å²	66.8	56%	0.564	34%	0.343	S	S	*	.	H	α-helix	trans	-77.4	-23.9	176.5	-41.8	0	0	0	0	112.5	H441 Y443	H441-T445 WeakPolarHBondContact O-CB 3.35Å; H441-T445 PolarHBondContact O-N 3.15Å; H441-T445 PolarHBondContact O-OG1 2.96Å; Y443-T445 PolarHBondContact O-N 3.36Å
446	S	85.3	Confident	81.5	Confident	87 Å²	87	64.7 Å²	64.7	61%	0.608	33%	0.333	S	S	*	.	H	α-helix	trans	-86.5	-15.6	177.7	72	0	0	0	0	113.7	K442 Y443	K442-S446 PolarHBondContact O-N 2.89Å; Y443-S446 PolarHBondContact O-N 3.46Å; Y443-S446 PolarHBondContact O-OG 2.88Å
447	I	82	Confident	81.2	Confident	26 Å²	26	65.9 Å²	65.9	13%	0.133	34%	0.344	C	S	.	.	S	Bend	trans	-76	143.1	-179.7	-69.1	165.2	0	0	0	111.5	Y443 L444 D451 L452 I455	Y443-I447 HydrophobicContact CD1-CD1 3.5Å; Y443-I447 VanDerWaalsContact CD1-CD1 3.5Å; Y443-I447 HydrophobicContact CD1-CG1 4.39Å; Y443-I447 HydrophobicContact CE1-CD1 3.14Å; Y443-I447 HydrophobicContact CE1-CG1 4.09Å; Y443-I447 HydrophobicContact CE2-CD1 4.3Å; Y443-I447 HydrophobicContact CE2-CG1 4.4Å; Y443-I447 HydrophobicContact CG-CD1 4.2Å; Y443-I447 VanDerWaalsContact O-CG1 3.3Å; Y443-I447 WeakPolarHBondContact O-CG1 3.47Å; Y443-I447 PolarHBondContact O-N 3.09Å; L444-I447 HydrophobicContact CD2-CD1 4.28Å; I447-D451 HydrophobicContact CG2-CB 3.37Å; I447-L452 HydrophobicContact CG2-CB 4.47Å; I447-I455 HydrophobicContact CD1-CD1 3.92Å
448	N	80	Confident	81	Confident	113 Å²	113	71.5 Å²	71.5	60%	0.604	37%	0.374	S	S	*	.			trans	-66.2	150.6	175.6	-64.1	-46.1	0	0	0	111.6	R450 D451 L452	N448-R450 PolarHBondContact O-N 3.43Å; N448-D451 PolarHBondContact O-N 2.99Å; N448-D451 VanDerWaalsContact O-N 3.08Å; N448-L452 PolarHBondContact O-N 3.32Å
449	S	77.3	Confident	80.6	Confident	75 Å²	75	66.9 Å²	66.9	52%	0.524	35%	0.353	S	S	.	.	H	α-helix	trans	-58.8	-26.8	-179.5	61.9	0	0	0	0	114.4	A453 N507	S449-A453 PolarHBondContact O-N 2.86Å; S449-A453 VanDerWaalsContact O-N 3.1Å; S449-N507 WeakPolarHBondContact CB-ND2 3.49Å
450	R	78.8	Confident	80.5	Confident	201 Å²	201	63.6 Å²	63.6	76%	0.758	34%	0.336	S	S	*	.	H	α-helix	trans	-71.1	-46.1	176.1	-177.3	-178.6	-69.9	157.3	-1.9	111.8	N448 L452 A453 Q454	N448-R450 PolarHBondContact O-N 3.43Å; R450-L452 VanDerWaalsContact C-N 3.27Å; R450-L452 PolarHBondContact O-N 2.85Å; R450-A453 WeakPolarHBondContact O-CB 3.45Å; R450-A453 PolarHBondContact O-N 3.47Å; R450-Q454 PolarHBondContact O-N 3.33Å
451	D	80.2	Confident	80.1	Confident	56 Å²	56	67.6 Å²	67.6	30%	0.299	36%	0.361	S	S	.	.	H	α-helix	trans	-67	-36.1	179.3	-58.5	-22.5	0	0	0	109.5	I447 N448 A453 Q454 I455	I447-D451 HydrophobicContact CG2-CB 3.37Å; N448-D451 PolarHBondContact O-N 2.99Å; N448-D451 VanDerWaalsContact O-N 3.08Å; D451-A453 PolarHBondContact O-N 3.05Å; D451-Q454 WeakPolarHBondContact O-CB 3.35Å; D451-Q454 PolarHBondContact O-N 2.84Å; D451-Q454 VanDerWaalsContact O-N 3.14Å; D451-I455 WeakPolarHBondContact O-CG1 3.49Å; D451-I455 PolarHBondContact O-N 3.44Å
452	L	79.8	Confident	79.8	Confident	5 Å²	5	65.3 Å²	65.3	3%	0.026	35%	0.354	C	S	.	.	H	α-helix	trans	-62.8	-40.3	172	-162.6	156.5	0	0	0	112.2	I447 N448 R450 Q454 I455 V456 L510 V511	I447-L452 HydrophobicContact CG2-CB 4.47Å; N448-L452 PolarHBondContact O-N 3.32Å; R450-L452 VanDerWaalsContact C-N 3.27Å; R450-L452 PolarHBondContact O-N 2.85Å; L452-Q454 VanDerWaalsContact C-N 3.32Å; L452-I455 WeakPolarHBondContact O-CB 3.32Å; L452-I455 PolarHBondContact O-N 3.29Å; L452-V456 WeakPolarHBondContact O-CG2 3.36Å; L452-V456 PolarHBondContact O-N 3.03Å; L452-L510 HydrophobicContact CD2-CD2 3.25Å; L452-L510 HydrophobicContact CD2-CG 3.87Å; L452-V511 HydrophobicContact CD1-CG2 3.62Å
453	A	75.9	Confident	79.4	Confident	50 Å²	50	59 Å²	59	41%	0.413	33%	0.326	S	S	.	.	H	α-helix	trans	-65.9	-35.5	172.7	0	0	0	0	0	112.2	S449 R450 D451 V456 T457	S449-A453 PolarHBondContact O-N 2.86Å; S449-A453 VanDerWaalsContact O-N 3.1Å; R450-A453 WeakPolarHBondContact O-CB 3.45Å; R450-A453 PolarHBondContact O-N 3.47Å; D451-A453 PolarHBondContact O-N 3.05Å; A453-V456 PolarHBondContact O-N 3.2Å; A453-T457 WeakPolarHBondContact O-CB 3.18Å; A453-T457 PolarHBondContact O-N 3.43Å; A453-T457 PolarHBondContact O-OG1 3.19Å
454	Q	79.2	Confident	78.8	Confident	87 Å²	87	58.7 Å²	58.7	41%	0.407	34%	0.335	S	S	.	.	H	α-helix	trans	-65.5	-41.3	175	-180	167.4	-7.7	0	0	112	R450 D451 L452 V456 T457 L458 D459	R450-Q454 PolarHBondContact O-N 3.33Å; D451-Q454 WeakPolarHBondContact O-CB 3.35Å; D451-Q454 PolarHBondContact O-N 2.84Å; D451-Q454 VanDerWaalsContact O-N 3.14Å; L452-Q454 VanDerWaalsContact C-N 3.32Å; Q454-V456 VanDerWaalsContact C-N 3.26Å; Q454-V456 PolarHBondContact O-N 3.01Å; Q454-T457 PolarHBondContact O-N 3.4Å; Q454-L458 HydrophobicContact CG-CB 4.1Å; Q454-L458 HydrophobicContact CG-CD1 3.83Å; Q454-L458 WeakPolarHBondContact O-CB 3.27Å; Q454-L458 PolarHBondContact O-N 3.19Å; Q454-D459 PolarHBondContact O-N 3.4Å; Q454-D459 VanDerWaalsContact O-N 3.16Å
455	I	79.2	Confident	78	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	37%	0.366	C	S	.	.	I	π-helix	trans	-53	-45.5	174.4	-75.3	171.3	0	0	0	111.1	H430 L444 I447 D451 L452 Y460	H430-I455 VanDerWaalsContact CD2-CG1 3.42Å; H430-I455 WeakPolarHBondContact CD2-CG1 3.34Å; H430-I455 WeakPolarHBondContact NE2-CG1 3.41Å; L444-I455 HydrophobicContact CD2-CD1 4.34Å; I447-I455 HydrophobicContact CD1-CD1 3.92Å; D451-I455 WeakPolarHBondContact O-CG1 3.49Å; D451-I455 PolarHBondContact O-N 3.44Å; L452-I455 WeakPolarHBondContact O-CB 3.32Å; L452-I455 PolarHBondContact O-N 3.29Å; I455-Y460 HydrophobicContact CG2-CD2 3.67Å; I455-Y460 HydrophobicContact CG2-CE2 3.81Å; I455-Y460 WeakPolarHBondContact O-CD2 3.5Å; I455-Y460 PolarHBondContact O-N 3.33Å; I455-Y460 VanDerWaalsContact O-N 3.08Å
456	V	77.8	Confident	76.9	Confident	6 Å²	6	60.7 Å²	60.7	4%	0.036	34%	0.344	C	S	.	.	I	π-helix	trans	-78.8	-33.5	-175.9	178	0	0	0	0	113	L452 A453 Q454 L463 V467 L510 I514	L452-V456 WeakPolarHBondContact O-CG2 3.36Å; L452-V456 PolarHBondContact O-N 3.03Å; A453-V456 PolarHBondContact O-N 3.2Å; Q454-V456 VanDerWaalsContact C-N 3.26Å; Q454-V456 PolarHBondContact O-N 3.01Å; V456-L463 HydrophobicContact CG1-CB 4.13Å; V456-L463 HydrophobicContact CG2-CD1 4.21Å; V456-V467 HydrophobicContact CG1-CG2 3.27Å; V456-L510 HydrophobicContact CG2-CD1 4.38Å; V456-L510 HydrophobicContact CG2-CD2 4.14Å; V456-I514 HydrophobicContact CG2-CD1 4.31Å
457	T	74	Confident	75.6	Confident	108 Å²	108	60 Å²	60	66%	0.663	34%	0.336	S	S	*	.	I	π-helix	trans	-95.9	-38.2	-170.5	-40.3	0	0	0	0	113.1	A453 Q454	A453-T457 WeakPolarHBondContact O-CB 3.18Å; A453-T457 PolarHBondContact O-N 3.43Å; A453-T457 PolarHBondContact O-OG1 3.19Å; Q454-T457 PolarHBondContact O-N 3.4Å
458	L	75	Confident	74.3	Confident	124 Å²	124	64.8 Å²	64.8	65%	0.649	36%	0.361	S	S	*	.	I	π-helix	trans	-111.2	-46.3	-170.5	-79	149.2	0	0	0	111.8	Q454	Q454-L458 HydrophobicContact CG-CB 4.1Å; Q454-L458 HydrophobicContact CG-CD1 3.83Å; Q454-L458 WeakPolarHBondContact O-CB 3.27Å; Q454-L458 PolarHBondContact O-N 3.19Å
459	D	74.5	Confident	73	Confident	38 Å²	38	64.8 Å²	64.8	20%	0.203	36%	0.361	C	S	.	.	I	π-helix	trans	-80.7	-37.6	-169.2	-62.8	-29.2	0	0	0	112.8	P429 H430 Q454	P429-D459 HydrophobicContact CB-CB 4.02Å; P429-D459 HydrophobicContact CG-CB 3.63Å; H430-D459 IonicContact CD2-OD2 3.29Å; H430-D459 IonicContact NE2-OD2 2.8Å; Q454-D459 PolarHBondContact O-N 3.4Å; Q454-D459 VanDerWaalsContact O-N 3.16Å
460	Y	81	Confident	71.6	Confident	3 Å²	3	65.3 Å²	65.3	1%	0.012	36%	0.358	C	S	.	.			trans	-129.8	86.6	-178.7	-51.6	-58	0	0	0	112.6	P429 L433 I455 S462 L463 L753 E755 V756	P429-Y460 HydrophobicContact CG-CE1 4.24Å; P429-Y460 PolarHBondContact O-OH 3.12Å; L433-Y460 HydrophobicContact CD1-CE2 3.57Å; I455-Y460 HydrophobicContact CG2-CD2 3.67Å; I455-Y460 HydrophobicContact CG2-CE2 3.81Å; I455-Y460 WeakPolarHBondContact O-CD2 3.5Å; I455-Y460 PolarHBondContact O-N 3.33Å; I455-Y460 VanDerWaalsContact O-N 3.08Å; Y460-S462 PolarHBondContact O-N 3.4Å; Y460-S462 VanDerWaalsContact O-N 3.12Å; Y460-L463 WeakPolarHBondContact O-CB 3.1Å; Y460-L463 PolarHBondContact O-N 3.17Å; Y460-L753 HydrophobicContact CD1-CD2 4.42Å; Y460-L753 HydrophobicContact CD2-CD2 3.56Å; Y460-L753 HydrophobicContact CE2-CD2 4.14Å; Y460-L753 HydrophobicContact CG-CD2 3.7Å; Y460-E755 HydrophobicContact CD1-CB 3.99Å; Y460-V756 HydrophobicContact CD1-CG2 3.98Å; Y460-V756 HydrophobicContact CE1-CG2 3.46Å; Y460-V756 VanDerWaalsContact CE1-CG2 3.46Å; Y460-V756 HydrophobicContact CE2-CG2 4.1Å; Y460-V756 HydrophobicContact CG-CG2 4.5Å
461	P	76.1	Confident	69.7	Low	83 Å²	83	61.9 Å²	61.9	54%	0.539	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-55.3	-28.9	179.9	-27	35.1	0	0	0	114.7	L463 A464 E755	P461-L463 PolarHBondContact O-N 3.28Å; P461-L463 VanDerWaalsContact O-N 3.16Å; P461-A464 WeakPolarHBondContact O-CB 3.31Å; P461-A464 PolarHBondContact O-N 3.06Å; P461-E755 WeakPolarHBondContact CD-OE1 3.49Å
462	S	79.1	Confident	67.3	Low	24 Å²	24	64.3 Å²	64.3	17%	0.168	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-61.3	-20.6	177	67	0	0	0	0	114.1	Y460 A464 L753 E755	Y460-S462 PolarHBondContact O-N 3.4Å; Y460-S462 VanDerWaalsContact O-N 3.12Å; S462-A464 VanDerWaalsContact C-N 3.34Å; S462-L753 WeakPolarHBondContact OG-CA 3.42Å; S462-L753 PolarHBondContact OG-N 3.38Å; S462-E755 WeakPolarHBondContact CB-OE1 3.35Å; S462-E755 VanDerWaalsContact CB-OE2 3.27Å; S462-E755 WeakPolarHBondContact CB-OE2 3.48Å; S462-E755 PolarHBondContact N-OE1 3.28Å; S462-E755 PolarHBondContact OG-OE1 3.41Å; S462-E755 VanDerWaalsContact OG-OE1 3.14Å; S462-E755 PolarHBondContact OG-OE2 3.11Å
463	L	78.7	Confident	64.9	Low	3 Å²	3	69.5 Å²	69.5	2%	0.016	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-81.9	-8.7	174.6	-74.9	179.4	0	0	0	113.7	V456 Y460 P461 N465 C466 I514 P752 L753	V456-L463 HydrophobicContact CG1-CB 4.13Å; V456-L463 HydrophobicContact CG2-CD1 4.21Å; Y460-L463 WeakPolarHBondContact O-CB 3.1Å; Y460-L463 PolarHBondContact O-N 3.17Å; P461-L463 PolarHBondContact O-N 3.28Å; P461-L463 VanDerWaalsContact O-N 3.16Å; L463-N465 PolarHBondContact O-N 3.43Å; L463-N465 VanDerWaalsContact O-N 3.15Å; L463-C466 HydrophobicContact CD2-CB 4.37Å; L463-C466 WeakPolarHBondContact O-CB 3.48Å; L463-C466 PolarHBondContact O-N 3.31Å; L463-I514 HydrophobicContact CD1-CD1 4.45Å; L463-I514 HydrophobicContact CD1-CG1 4.22Å; L463-P752 HydrophobicContact CD2-CB 4.02Å; L463-L753 HydrophobicContact CD1-CD1 4.09Å; L463-L753 HydrophobicContact CD1-CD2 3.51Å; L463-L753 HydrophobicContact CD1-CG 3.76Å; L463-L753 HydrophobicContact CD2-CD1 3.97Å; L463-L753 HydrophobicContact CD2-CD2 4.43Å; L463-L753 HydrophobicContact CD2-CG 3.75Å; L463-L753 HydrophobicContact CG-CD1 4.31Å; L463-L753 HydrophobicContact CG-CD2 3.87Å; L463-L753 HydrophobicContact CG-CG 3.7Å
464	A	71.6	Confident	62.5	Low	49 Å²	49	72.7 Å²	72.7	41%	0.405	43%	0.428	S	S	.	.	H	α-helix	trans	-55.9	-37.6	-176.2	0	0	0	0	0	112.3	P461 S462 C466 V467	P461-A464 WeakPolarHBondContact O-CB 3.31Å; P461-A464 PolarHBondContact O-N 3.06Å; S462-A464 VanDerWaalsContact C-N 3.34Å; A464-C466 PolarHBondContact O-N 3.31Å; A464-V467 PolarHBondContact O-N 3.5Å
465	N	67.9	Low	60	Low	122 Å²	122	75.9 Å²	75.9	65%	0.652	45%	0.446	S	S	*	.	H	α-helix	trans	-70	-29.8	177.8	-68	-12.9	0	0	0	112.9	L463 V467 L468 D469	L463-N465 PolarHBondContact O-N 3.43Å; L463-N465 VanDerWaalsContact O-N 3.15Å; N465-V467 PolarHBondContact O-N 3.39Å; N465-L468 PolarHBondContact O-N 3Å; N465-L468 VanDerWaalsContact O-N 3.07Å; N465-D469 PolarHBondContact O-N 2.86Å
466	C	60.7	Low	57.5	Low	15 Å²	15	81.1 Å²	81.1	10%	0.101	48%	0.479	C	S	.	.	H	α-helix	trans	-66.3	-20	179	-67.7	0	0	0	0	112.7	L463 A464	L463-C466 HydrophobicContact CD2-CB 4.37Å; L463-C466 WeakPolarHBondContact O-CB 3.48Å; L463-C466 PolarHBondContact O-N 3.31Å; A464-C466 PolarHBondContact O-N 3.31Å
467	V	58	Low	55.1	Low	72 Å²	72	88.6 Å²	88.6	44%	0.436	52%	0.524	S	S	.	.	H	α-helix	trans	-77.5	-34.8	174.4	-174.7	0	0	0	0	111.2	V456 A464 N465	V456-V467 HydrophobicContact CG1-CG2 3.27Å; A464-V467 PolarHBondContact O-N 3.5Å; N465-V467 PolarHBondContact O-N 3.39Å
468	L	56.1	Low	52.8	Low	127 Å²	127	87.8 Å²	87.8	67%	0.665	52%	0.523	S	S	*	.	H	α-helix	trans	-68.7	-35	179.6	-98.8	84.7	0	0	0	112.6	N465 N470 T471	N465-L468 PolarHBondContact O-N 3Å; N465-L468 VanDerWaalsContact O-N 3.07Å; L468-N470 PolarHBondContact O-N 3.35Å; L468-T471 PolarHBondContact O-OG1 2.97Å
469	D	51.6	Low	50.3	Low	113 Å²	113	90.4 Å²	90.4	60%	0.604	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-69.4	-4.2	-177.3	-73.2	-20.5	0	0	0	114.4	N465 T471	N465-D469 PolarHBondContact O-N 2.86Å; D469-T471 PolarHBondContact O-N 3.38Å
470	N	47.7	Very low	48.2	Very low	86 Å²	86	94.9 Å²	94.9	46%	0.46	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-71.7	-5.3	179.4	-75.7	-22.4	0	0	0	114.3	L468 K513	L468-N470 PolarHBondContact O-N 3.35Å; N470-K513 PolarHBondContact OD1-NZ 3.44Å
471	T	39.8	Very low	45.5	Very low	129 Å²	129	100.6 Å²	100.6	79%	0.791	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-100.6	-5.1	-179.1	49.5	0	0	0	0	115.9	L468 D469	L468-T471 PolarHBondContact O-OG1 2.97Å; D469-T471 PolarHBondContact O-N 3.38Å
472	T	30.4	Very low	43	Very low	106 Å²	106	104.7 Å²	104.7	65%	0.65	61%	0.614	S	S	*	*			trans	-135.3	98.9	-174.9	8	0	0	0	0	111.6
473	S	29.6	Very low	40.6	Very low	114 Å²	114	108.9 Å²	108.9	80%	0.797	64%	0.641	S	S	*	*			trans	-65.2	134	161.6	-62	0	0	0	0	108.5
474	T	25.1	Very low	38	Very low	118 Å²	118	116 Å²	116	72%	0.724	68%	0.678	S	S	*	*			trans	73.6	116.2	177.8	73.1	0	0	0	0	115.3
475	L	26.1	Very low	36.2	Very low	153 Å²	153	121.2 Å²	121.2	80%	0.801	70%	0.697	S	S	*	*				162	115.1	125.2	-81.7	162.2	0	0	0	110.3
476	T	26.3	Very low	34.3	Very low	110 Å²	110	122.1 Å²	122.1	68%	0.675	70%	0.702	S	S	*	*			trans	27.5	118.4	140.8	54.8	0	0	0	0	118.7	S478	T476-S478 PolarHBondContact O-N 3.5Å
477	V	27.1	Very low	32.7	Very low	163 Å²	163	129.5 Å²	129.5	99%	0.988	74%	0.74	S	S	*	*			trans	-57.5	97.2	163.3	-179.9	0	0	0	0	109.5
478	S	25.5	Very low	31.7	Very low	91 Å²	91	131.1 Å²	131.1	64%	0.636	76%	0.755	S	S	*	*			trans	-130.6	134	160.9	43.6	0	0	0	0	108.3	T476	T476-S478 PolarHBondContact O-N 3.5Å
479	H	24.4	Very low	30.6	Very low	179 Å²	179	130.6 Å²	130.6	83%	0.829	76%	0.762	S	S	*	*			trans	-35.6	125.2	-175.2	-65.6	-83.2	0	0	0	115	T481	H479-T481 PolarHBondContact O-N 3.48Å; H479-T481 VanDerWaalsContact O-N 3.11Å
480	P	30.3	Very low	29.8	Very low	132 Å²	132	130.9 Å²	130.9	86%	0.857	77%	0.77	S	S	*	*			trans	-78.8	103.3	170.1	27.7	-23.3	0	0	0	108.8
481	T	23.2	Very low	29.1	Very low	123 Å²	123	135.9 Å²	135.9	76%	0.755	79%	0.79	S	S	*	*			trans	-79	129.6	156	-40.2	0	0	0	0	106.1	H479 P483	H479-T481 PolarHBondContact O-N 3.48Å; H479-T481 VanDerWaalsContact O-N 3.11Å; T481-P483 WeakPolarHBondContact O-CD 3.34Å
482	L	24.7	Very low	28.8	Very low	169 Å²	169	136.4 Å²	136.4	89%	0.885	79%	0.793	S	S	*	*			trans	-51.3	128	179.1	-70.7	156	0	0	0	111.7
483	P	28.4	Very low	28.8	Very low	112 Å²	112	136.2 Å²	136.2	73%	0.727	80%	0.803	S	S	*	*			trans	-105.7	122.9	163.6	19.9	-1.6	0	0	0	111.3	T481	T481-P483 WeakPolarHBondContact O-CD 3.34Å
484	I	23.8	Very low	29	Very low	154 Å²	154	138.9 Å²	138.9	79%	0.79	80%	0.802	S	S	*	*			trans	-69.8	122.7	162.1	-62.5	158.7	0	0	0	107.3
485	I	33.7	Very low	29.3	Very low	157 Å²	157	140.8 Å²	140.8	81%	0.805	80%	0.803	S	S	*	*			trans	-140.2	124.2	161.7	-57.9	-177.7	0	0	0	110.2
486	D	28.3	Very low	29.4	Very low	142 Å²	142	140.3 Å²	140.3	76%	0.759	81%	0.807	S	S	*	*			trans	-64	151	178.8	-71.1	-51.1	0	0	0	114.6
487	N	27.7	Very low	29.4	Very low	170 Å²	170	140.6 Å²	140.6	91%	0.909	81%	0.808	S	S	*	*			trans	-67.8	123.7	173.4	-76.2	-40.1	0	0	0	112.5
488	S	36	Very low	29.4	Very low	106 Å²	106	141.2 Å²	141.2	74%	0.741	80%	0.8	S	S	*	*			trans	-152.4	107.8	148.8	51.1	0	0	0	0	112.2
489	S	32.9	Very low	29.6	Very low	116 Å²	116	141.6 Å²	141.6	81%	0.811	80%	0.799	S	S	*	*			trans	36.6	134.9	146.8	44.7	0	0	0	0	122.7
490	P	35.7	Very low	30.2	Very low	119 Å²	119	139 Å²	139	77%	0.773	80%	0.801	S	S	*	*			trans	-100	150.4	-175.4	38.6	-31.8	0	0	0	113.7
491	Q	33.2	Very low	30.8	Very low	191 Å²	191	136.8 Å²	136.8	89%	0.893	79%	0.788	S	S	*	*			trans	-156.7	142.3	150.5	-69.3	-163.8	-9.5	0	0	112.9
492	T	31.4	Very low	32.1	Very low	139 Å²	139	134.2 Å²	134.2	85%	0.853	78%	0.776	S	S	*	*			trans	90.8	98.5	154.2	-13.2	0	0	0	0	119.5
493	A	31.7	Very low	33.4	Very low	103 Å²	103	130 Å²	130	85%	0.851	76%	0.76	S	S	*	*				172.2	107.7	123.2	0	0	0	0	0	110.4
494	Q	32.6	Very low	35	Very low	169 Å²	169	128.6 Å²	128.6	79%	0.79	75%	0.753	S	S	*	*			trans	-83.1	150	173.1	-81.4	176.5	-18.1	0	0	111.6
495	Q	31.3	Very low	37	Very low	159 Å²	159	123.4 Å²	123.4	74%	0.743	73%	0.73	S	S	*	*			trans	66.8	98.7	143.2	-71.1	169.3	16.3	0	0	119.5
496	T	29	Very low	38.8	Very low	142 Å²	142	119.3 Å²	119.3	87%	0.871	71%	0.713	S	S	*	*			trans	-141.9	116	134.1	43.9	0	0	0	0	109.4
497	T	26.7	Very low	41	Very low	116 Å²	116	115.3 Å²	115.3	71%	0.712	69%	0.691	S	S	*	*			trans	-98.4	98.5	-178.5	44.6	0	0	0	0	111.6
498	H	27.7	Very low	43.4	Very low	177 Å²	177	110 Å²	110	82%	0.819	67%	0.668	S	S	*	*			trans	-162.7	121.5	159.7	-63.4	-67.3	0	0	0	103.7
499	T	29.9	Very low	45.6	Very low	98 Å²	98	113.4 Å²	113.4	60%	0.601	66%	0.664	S	S	*	*				-171.3	135.8	52.5	41.7	0	0	0	0	107.4	S501	T499-S501 PolarHBondContact O-N 3.25Å
500	S	36.8	Very low	48	Very low	126 Å²	126	109.1 Å²	109.1	88%	0.881	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	12.1	-178.8	30.8	0	0	0	0	115.7
501	S	41.4	Very low	50.2	Low	84 Å²	84	103.8 Å²	103.8	59%	0.587	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-1.1	-179.6	50.1	0	0	0	0	114.7	T499	T499-S501 PolarHBondContact O-N 3.25Å
502	S	51.6	Low	52.7	Low	70 Å²	70	98.9 Å²	98.9	49%	0.49	58%	0.577	S	S	.	*	H	α-helix	trans	-80.5	-29.9	-171.1	50.4	0	0	0	0	114.6	S504 S505 V506	S502-S504 PolarHBondContact O-N 3.14Å; S502-S505 PolarHBondContact O-N 2.85Å; S502-S505 PolarHBondContact O-OG 3.05Å; S502-V506 WeakPolarHBondContact O-CG2 3.21Å; S502-V506 PolarHBondContact O-N 3.43Å
503	S	51.5	Low	55.3	Low	79 Å²	79	95.2 Å²	95.2	55%	0.552	55%	0.55	S	S	*	.	H	α-helix	trans	-67.5	-38.4	-170.1	59.1	0	0	0	0	114.5	S505 V506 N507	S503-S505 VanDerWaalsContact C-N 3.33Å; S503-S505 PolarHBondContact O-N 3.38Å; S503-V506 PolarHBondContact O-N 3.47Å; S503-N507 PolarHBondContact O-N 2.84Å
504	S	61	Low	57.8	Low	84 Å²	84	90.4 Å²	90.4	59%	0.587	51%	0.509	S	S	*	.	H	α-helix	trans	-66	-36.6	177.5	57.9	0	0	0	0	112.2	S502 V506 N507 S508	S502-S504 PolarHBondContact O-N 3.14Å; S504-V506 VanDerWaalsContact C-N 3.35Å; S504-V506 PolarHBondContact O-N 2.99Å; S504-N507 PolarHBondContact O-N 3.07Å; S504-S508 PolarHBondContact O-N 3.38Å; S504-S508 VanDerWaalsContact O-N 3.11Å; S504-S508 PolarHBondContact O-OG 3.45Å
505	S	67.4	Low	60.3	Low	44 Å²	44	83 Å²	83	31%	0.308	48%	0.476	S	S	.	.	H	α-helix	trans	-69.1	-31.3	179.1	77.9	0	0	0	0	113.2	S502 S503 S508 R509	S502-S505 PolarHBondContact O-N 2.85Å; S502-S505 PolarHBondContact O-OG 3.05Å; S503-S505 VanDerWaalsContact C-N 3.33Å; S503-S505 PolarHBondContact O-N 3.38Å; S505-S508 PolarHBondContact O-OG 2.82Å; S505-R509 VanDerWaalsContact O-CG 3.26Å; S505-R509 WeakPolarHBondContact O-CG 3.34Å; S505-R509 PolarHBondContact O-N 3.41Å; S505-R509 VanDerWaalsContact O-N 3.17Å
506	V	70	Confident	62.9	Low	72 Å²	72	80.7 Å²	80.7	44%	0.436	47%	0.465	S	S	.	.	H	α-helix	trans	-71.9	-44.4	178.1	176	0	0	0	0	109.9	S502 S503 S504 S508 R509 L510	S502-V506 WeakPolarHBondContact O-CG2 3.21Å; S502-V506 PolarHBondContact O-N 3.43Å; S503-V506 PolarHBondContact O-N 3.47Å; S504-V506 VanDerWaalsContact C-N 3.35Å; S504-V506 PolarHBondContact O-N 2.99Å; V506-S508 PolarHBondContact O-N 2.73Å; V506-R509 PolarHBondContact O-N 2.88Å; V506-L510 WeakPolarHBondContact O-CB 3.25Å; V506-L510 PolarHBondContact O-N 3.5Å
507	N	75.7	Confident	65.6	Low	57 Å²	57	75.7 Å²	75.7	31%	0.305	43%	0.432	S	S	.	.	H	α-helix	trans	-62.1	-44.9	177.1	-69	-12.3	0	0	0	111.4	S449 S503 S504 R509 L510 V511	S449-N507 WeakPolarHBondContact CB-ND2 3.49Å; S503-N507 PolarHBondContact O-N 2.84Å; S504-N507 PolarHBondContact O-N 3.07Å; N507-R509 VanDerWaalsContact C-N 3.33Å; N507-R509 PolarHBondContact O-N 2.91Å; N507-L510 PolarHBondContact O-N 3.42Å; N507-V511 VanDerWaalsContact O-CG2 3.32Å; N507-V511 WeakPolarHBondContact O-CG2 3.5Å; N507-V511 PolarHBondContact O-N 3.3Å
508	S	78.3	Confident	68.5	Low	60 Å²	60	70.3 Å²	70.3	42%	0.42	40%	0.398	S	S	.	.	H	α-helix	trans	-63.3	-38.1	178.8	65.6	0	0	0	0	112.6	S504 S505 V506 N512	S504-S508 PolarHBondContact O-N 3.38Å; S504-S508 VanDerWaalsContact O-N 3.11Å; S504-S508 PolarHBondContact O-OG 3.45Å; S505-S508 PolarHBondContact O-OG 2.82Å; V506-S508 PolarHBondContact O-N 2.73Å; S508-N512 PolarHBondContact O-N 2.99Å; S508-N512 PolarHBondContact O-ND2 2.85Å
509	R	81.6	Confident	71.2	Confident	176 Å²	176	64.7 Å²	64.7	66%	0.664	37%	0.373	S	S	*	.	H	α-helix	trans	-65.8	-41	175.5	-75.5	174.9	-177.5	-175.1	2	112	S505 V506 N507 N512 K513	S505-R509 VanDerWaalsContact O-CG 3.26Å; S505-R509 WeakPolarHBondContact O-CG 3.34Å; S505-R509 PolarHBondContact O-N 3.41Å; S505-R509 VanDerWaalsContact O-N 3.17Å; V506-R509 PolarHBondContact O-N 2.88Å; N507-R509 VanDerWaalsContact C-N 3.33Å; N507-R509 PolarHBondContact O-N 2.91Å; R509-N512 PolarHBondContact O-N 2.97Å; R509-K513 WeakPolarHBondContact O-CG 3.45Å; R509-K513 PolarHBondContact O-N 2.92Å
510	L	82.8	Confident	73.9	Confident	26 Å²	26	62.9 Å²	62.9	14%	0.136	36%	0.359	C	S	.	.	H	α-helix	trans	-66.7	-42.9	178.4	-176.1	57.8	0	0	0	111.5	L452 V456 V506 N507 N512 K513 I514	L452-L510 HydrophobicContact CD2-CD2 3.25Å; L452-L510 HydrophobicContact CD2-CG 3.87Å; V456-L510 HydrophobicContact CG2-CD1 4.38Å; V456-L510 HydrophobicContact CG2-CD2 4.14Å; V506-L510 WeakPolarHBondContact O-CB 3.25Å; V506-L510 PolarHBondContact O-N 3.5Å; N507-L510 PolarHBondContact O-N 3.42Å; L510-N512 VanDerWaalsContact C-N 3.32Å; L510-N512 PolarHBondContact O-N 3.25Å; L510-K513 PolarHBondContact O-N 3.41Å; L510-I514 HydrophobicContact CD1-CD1 4.5Å; L510-I514 HydrophobicContact CG-CD1 4.26Å; L510-I514 WeakPolarHBondContact O-CG1 3.48Å; L510-I514 PolarHBondContact O-N 3.41Å
511	V	83.5	Confident	76.3	Confident	8 Å²	8	57 Å²	57	5%	0.048	32%	0.318	C	S	.	.	H	α-helix	trans	-57.1	-46.8	172.5	171.7	0	0	0	0	110.7	L444 L452 N507 K513 I514 V515	L444-V511 HydrophobicContact CB-CG1 3.79Å; L444-V511 HydrophobicContact CB-CG2 4.16Å; L444-V511 HydrophobicContact CD1-CG1 4.31Å; L452-V511 HydrophobicContact CD1-CG2 3.62Å; N507-V511 VanDerWaalsContact O-CG2 3.32Å; N507-V511 WeakPolarHBondContact O-CG2 3.5Å; N507-V511 PolarHBondContact O-N 3.3Å; V511-K513 PolarHBondContact O-N 2.92Å; V511-I514 PolarHBondContact O-N 2.85Å; V511-V515 HydrophobicContact CG1-CG2 4.43Å; V511-V515 WeakPolarHBondContact O-CG2 3.15Å; V511-V515 PolarHBondContact O-N 2.95Å
512	N	84.9	Confident	78.3	Confident	88 Å²	88	53.6 Å²	53.6	47%	0.471	29%	0.293	S	S	.	.	H	α-helix	trans	-63.4	-41.6	179.5	-69.4	-13.3	0	0	0	112.3	H441 S508 R509 L510 V515 E516	H441-N512 PolarHBondContact CE1-OD1 3.05Å; S508-N512 PolarHBondContact O-N 2.99Å; S508-N512 PolarHBondContact O-ND2 2.85Å; R509-N512 PolarHBondContact O-N 2.97Å; L510-N512 VanDerWaalsContact C-N 3.32Å; L510-N512 PolarHBondContact O-N 3.25Å; N512-V515 PolarHBondContact O-N 3.12Å; N512-E516 WeakPolarHBondContact O-CB 3.43Å; N512-E516 PolarHBondContact O-N 3.44Å
513	K	85.6	Confident	80	Confident	62 Å²	62	51.7 Å²	51.7	27%	0.27	28%	0.276	S	S	.	.	H	α-helix	trans	-60.8	-44.7	174	-76.3	-177.8	173	-172.3	0	111.9	N470 R509 L510 V511 V515 E516 H517	N470-K513 PolarHBondContact OD1-NZ 3.44Å; R509-K513 WeakPolarHBondContact O-CG 3.45Å; R509-K513 PolarHBondContact O-N 2.92Å; L510-K513 PolarHBondContact O-N 3.41Å; V511-K513 PolarHBondContact O-N 2.92Å; K513-V515 PolarHBondContact O-N 3.02Å; K513-E516 WeakPolarHBondContact O-CB 3.46Å; K513-E516 PolarHBondContact O-N 3.49Å; K513-H517 PolarHBondContact O-CD2 3.36Å; K513-H517 PolarHBondContact O-N 2.84Å
514	I	83.8	Confident	81.7	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-59.3	-48.1	177.2	-71.1	168.6	0	0	0	110.1	L444 V456 L463 L510 V511 E516 H517 L518 L753	L444-I514 HydrophobicContact CD1-CB 4.18Å; L444-I514 HydrophobicContact CD1-CG2 3.5Å; L444-I514 HydrophobicContact CD2-CG2 4.49Å; V456-I514 HydrophobicContact CG2-CD1 4.31Å; L463-I514 HydrophobicContact CD1-CD1 4.45Å; L463-I514 HydrophobicContact CD1-CG1 4.22Å; L510-I514 HydrophobicContact CD1-CD1 4.5Å; L510-I514 HydrophobicContact CG-CD1 4.26Å; L510-I514 WeakPolarHBondContact O-CG1 3.48Å; L510-I514 PolarHBondContact O-N 3.41Å; V511-I514 PolarHBondContact O-N 2.85Å; I514-E516 VanDerWaalsContact C-N 3.34Å; I514-E516 PolarHBondContact O-N 3.44Å; I514-H517 PolarHBondContact O-N 3.15Å; I514-L518 HydrophobicContact CG2-CD1 4.34Å; I514-L518 WeakPolarHBondContact O-CG 3.39Å; I514-L518 PolarHBondContact O-N 3.42Å; I514-L753 HydrophobicContact CB-CD1 4.39Å; I514-L753 HydrophobicContact CG2-CD1 3.79Å
515	V	85.8	Confident	83	Confident	13 Å²	13	44.5 Å²	44.5	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-40.6	178.7	174.8	0	0	0	0	111.5	P437 H441 L444 V511 N512 K513 H517 L518 E519	P437-V515 HydrophobicContact CB-CG1 4.14Å; H441-V515 HydrophobicContact CB-CG2 3.98Å; L444-V515 HydrophobicContact CD1-CG2 3.93Å; V511-V515 HydrophobicContact CG1-CG2 4.43Å; V511-V515 WeakPolarHBondContact O-CG2 3.15Å; V511-V515 PolarHBondContact O-N 2.95Å; N512-V515 PolarHBondContact O-N 3.12Å; K513-V515 PolarHBondContact O-N 3.02Å; V515-H517 VanDerWaalsContact C-N 3.34Å; V515-H517 PolarHBondContact O-N 2.93Å; V515-L518 WeakPolarHBondContact O-CB 3.38Å; V515-L518 PolarHBondContact O-N 2.7Å; V515-E519 HydrophobicContact CG1-CG 4.49Å; V515-E519 WeakPolarHBondContact O-CG 3.47Å; V515-E519 PolarHBondContact O-N 3.32Å
516	E	86.5	Confident	83.9	Confident	111 Å²	111	42.5 Å²	42.5	52%	0.519	21%	0.21	S	C	.	.	H	α-helix	trans	-59.4	-42.9	174.6	-175.3	-178.7	176.4	0	0	111.9	N512 K513 I514 E519 N520	N512-E516 WeakPolarHBondContact O-CB 3.43Å; N512-E516 PolarHBondContact O-N 3.44Å; K513-E516 WeakPolarHBondContact O-CB 3.46Å; K513-E516 PolarHBondContact O-N 3.49Å; I514-E516 VanDerWaalsContact C-N 3.34Å; I514-E516 PolarHBondContact O-N 3.44Å; E516-E519 PolarHBondContact O-N 2.83Å; E516-N520 VanDerWaalsContact O-CG 3.24Å; E516-N520 PolarHBondContact O-N 3.45Å; E516-N520 PolarHBondContact O-ND2 2.66Å
517	H	85.7	Confident	84.7	Confident	38 Å²	38	39.6 Å²	39.6	18%	0.176	19%	0.192	C	C	.	.	H	α-helix	trans	-65.1	-39.7	174.4	-68.2	-55	0	0	0	112.6	K513 I514 V515 N520 H521 L753	K513-H517 PolarHBondContact O-CD2 3.36Å; K513-H517 PolarHBondContact O-N 2.84Å; I514-H517 PolarHBondContact O-N 3.15Å; V515-H517 VanDerWaalsContact C-N 3.34Å; V515-H517 PolarHBondContact O-N 2.93Å; H517-N520 PolarHBondContact O-N 3.26Å; H517-H521 PolarHBondContact O-CD2 3.36Å; H517-H521 VanDerWaalsContact O-CD2 3.26Å; H517-H521 PolarHBondContact O-N 2.94Å; H517-H521 VanDerWaalsContact O-N 3.09Å; H517-L753 HydrophobicContact CB-CD1 4.03Å
518	L	86.1	Confident	85.4	Confident	2 Å²	2	37 Å²	37	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-62.2	-43.2	174.1	-64.9	176.2	0	0	0	111.4	L433 A440 I514 V515 N520 H521 L522 L753 F757	L433-L518 HydrophobicContact CB-CD1 4.38Å; L433-L518 HydrophobicContact CB-CD2 4.39Å; L433-L518 HydrophobicContact CD2-CD1 4.25Å; A440-L518 HydrophobicContact CB-CD1 3.83Å; I514-L518 HydrophobicContact CG2-CD1 4.34Å; I514-L518 WeakPolarHBondContact O-CG 3.39Å; I514-L518 PolarHBondContact O-N 3.42Å; V515-L518 WeakPolarHBondContact O-CB 3.38Å; V515-L518 PolarHBondContact O-N 2.7Å; L518-N520 VanDerWaalsContact C-N 3.31Å; L518-N520 PolarHBondContact O-N 2.69Å; L518-H521 PolarHBondContact O-N 3.39Å; L518-L522 WeakPolarHBondContact O-CG 3.24Å; L518-L522 PolarHBondContact O-N 3.38Å; L518-L753 HydrophobicContact CD2-CD1 4.18Å; L518-L753 HydrophobicContact CG-CD1 4.39Å; L518-F757 HydrophobicContact CB-CZ 4.46Å; L518-F757 HydrophobicContact CD2-CE2 3.56Å; L518-F757 HydrophobicContact CD2-CZ 3.78Å
519	E	85.6	Confident	85.9	Confident	60 Å²	60	34.4 Å²	34.4	28%	0.28	16%	0.16	S	C	.	.	H	α-helix	trans	-61.7	-39.1	175.7	-73.9	-176.4	178.2	0	0	111.9	P437 V515 E516 L522 K523	P437-E519 HydrophobicContact CB-CG 3.76Å; P437-E519 HydrophobicContact CG-CG 4.09Å; V515-E519 HydrophobicContact CG1-CG 4.49Å; V515-E519 WeakPolarHBondContact O-CG 3.47Å; V515-E519 PolarHBondContact O-N 3.32Å; E516-E519 PolarHBondContact O-N 2.83Å; E519-L522 PolarHBondContact O-N 3.49Å; E519-K523 VanDerWaalsContact O-CG 3.23Å; E519-K523 WeakPolarHBondContact O-CG 3.49Å; E519-K523 PolarHBondContact O-N 3.2Å
520	N	85.9	Confident	86.3	Confident	59 Å²	59	26.5 Å²	26.5	32%	0.316	13%	0.13	S	C	.	.	H	α-helix	trans	-64.9	-38.1	176.3	-69.9	-25.3	0	0	0	112.5	E516 H517 L518 K523 L524	E516-N520 VanDerWaalsContact O-CG 3.24Å; E516-N520 PolarHBondContact O-N 3.45Å; E516-N520 PolarHBondContact O-ND2 2.66Å; H517-N520 PolarHBondContact O-N 3.26Å; L518-N520 VanDerWaalsContact C-N 3.31Å; L518-N520 PolarHBondContact O-N 2.69Å; N520-K523 PolarHBondContact O-N 2.87Å; N520-K523 PolarHBondContact OD1-NZ 3.39Å; N520-L524 WeakPolarHBondContact O-CB 3.43Å; N520-L524 PolarHBondContact O-N 3.18Å
521	H	86.9	Confident	86.7	Confident	2 Å²	2	25.2 Å²	25.2	1%	0.009	12%	0.124	C	C	.	.	H	α-helix	trans	-63.6	-43.8	171.6	-82.5	-70.6	0	0	0	112.3	H517 L518 K523 L524 Q525 L751 P752 F757 Y758	H517-H521 PolarHBondContact O-CD2 3.36Å; H517-H521 VanDerWaalsContact O-CD2 3.26Å; H517-H521 PolarHBondContact O-N 2.94Å; H517-H521 VanDerWaalsContact O-N 3.09Å; L518-H521 PolarHBondContact O-N 3.39Å; H521-K523 PolarHBondContact O-N 3.4Å; H521-L524 WeakPolarHBondContact O-CB 3.49Å; H521-L524 PolarHBondContact O-N 2.94Å; H521-Q525 WeakPolarHBondContact O-CB 3.31Å; H521-Q525 VanDerWaalsContact O-CG 3.28Å; H521-Q525 WeakPolarHBondContact O-CG 3.48Å; H521-Q525 PolarHBondContact O-N 2.9Å; H521-L751 VanDerWaalsContact CE1-CB 3.44Å; H521-L751 WeakPolarHBondContact CE1-CB 3.24Å; H521-P752 PolarHBondContact CD2-O 3.1Å; H521-P752 PolarHBondContact NE2-O 3.37Å; H521-F757 HydrophobicContact CB-CD2 3.59Å; H521-F757 HydrophobicContact CB-CE1 4.37Å; H521-F757 HydrophobicContact CB-CE2 3.34Å; H521-F757 HydrophobicContact CB-CG 4.2Å; H521-F757 HydrophobicContact CB-CZ 3.77Å; H521-F757 AromaticContact CD2-CD2 3.76Å; H521-F757 AromaticContact CD2-CE2 3.69Å; H521-F757 AromaticContact CG-CD2 3.49Å; H521-F757 VanDerWaalsContact CG-CD2 3.49Å; H521-F757 AromaticContact CG-CE2 3.58Å; H521-F757 AromaticContact ND1-CD2 3.98Å; H521-Y758 AromaticContact ND1-CE2 3.82Å
522	L	85	Confident	87.1	Confident	13 Å²	13	24.9 Å²	24.9	7%	0.068	12%	0.121	C	C	.	.	H	α-helix	trans	-63.2	-41.7	176.9	-67.3	172.2	0	0	0	111.5	P386 P437 L518 E519 Q525 Y526 W613 T617 F757	P386-L522 HydrophobicContact CB-CD2 4.06Å; P437-L522 HydrophobicContact CG-CD1 4.36Å; L518-L522 WeakPolarHBondContact O-CG 3.24Å; L518-L522 PolarHBondContact O-N 3.38Å; E519-L522 PolarHBondContact O-N 3.49Å; L522-Q525 PolarHBondContact O-N 3.42Å; L522-Y526 WeakPolarHBondContact O-CB 3.45Å; L522-Y526 PolarHBondContact O-N 3.05Å; L522-W613 WeakPolarHBondContact O-CZ3 3.34Å; L522-T617 HydrophobicContact CB-CG2 4.44Å; L522-F757 HydrophobicContact CD2-CE1 4.14Å
523	K	85.3	Confident	87.4	Confident	31 Å²	31	22.9 Å²	22.9	14%	0.135	11%	0.111	C	C	.	.	H	α-helix	trans	-60.3	-45.2	173.5	-69	168.1	-157	-176.6	0	111.4	E519 N520 H521 Y526 L527 T617 E620	E519-K523 VanDerWaalsContact O-CG 3.23Å; E519-K523 WeakPolarHBondContact O-CG 3.49Å; E519-K523 PolarHBondContact O-N 3.2Å; N520-K523 PolarHBondContact O-N 2.87Å; N520-K523 PolarHBondContact OD1-NZ 3.39Å; H521-K523 PolarHBondContact O-N 3.4Å; K523-Y526 WeakPolarHBondContact O-CB 3.41Å; K523-Y526 PolarHBondContact O-N 3.41Å; K523-L527 WeakPolarHBondContact O-CG 3.47Å; K523-L527 PolarHBondContact O-N 3.49Å; K523-T617 HydrophobicContact CG-CG2 4.27Å; K523-E620 VanDerWaalsContact CD-CD 3.48Å; K523-E620 HydrophobicContact CD-CG 4.25Å; K523-E620 WeakPolarHBondContact CD-OE1 3.26Å; K523-E620 WeakPolarHBondContact CE-OE1 3.46Å; K523-E620 WeakPolarHBondContact CE-OE2 3.44Å; K523-E620 IonicContact NZ-OE1 2.76Å; K523-E620 PolarHBondContact NZ-OE1 3.1Å; K523-E620 IonicContact NZ-OE2 2.78Å; K523-E620 PolarHBondContact NZ-OE2 3.3Å
524	L	87.7	Confident	87.7	Confident	10 Å²	10	20 Å²	20	5%	0.052	10%	0.098	C	C	.	.	H	α-helix	trans	-60.7	-49.8	177.2	173.7	63.9	0	0	0	111.4	N520 H521 Y526 L527 I528 W558 L744 I745 L751	N520-L524 WeakPolarHBondContact O-CB 3.43Å; N520-L524 PolarHBondContact O-N 3.18Å; H521-L524 WeakPolarHBondContact O-CB 3.49Å; H521-L524 PolarHBondContact O-N 2.94Å; L524-Y526 PolarHBondContact O-N 3.45Å; L524-L527 PolarHBondContact O-N 2.88Å; L524-I528 HydrophobicContact CD1-CD1 4.22Å; L524-I528 HydrophobicContact CD1-CG1 4.09Å; L524-I528 HydrophobicContact CG-CD1 3.95Å; L524-I528 HydrophobicContact CG-CG1 4.32Å; L524-I528 VanDerWaalsContact O-CG1 3.31Å; L524-I528 WeakPolarHBondContact O-CG1 3.45Å; L524-I528 PolarHBondContact O-N 2.75Å; L524-W558 HydrophobicContact CD2-CH2 4.27Å; L524-W558 HydrophobicContact CD2-CZ2 3.99Å; L524-L744 WeakPolarHBondContact CD1-O 3.44Å; L524-I745 HydrophobicContact CD1-CB 4.21Å; L524-I745 HydrophobicContact CD1-CG1 4.41Å; L524-I745 HydrophobicContact CD1-CG2 3.79Å; L524-L751 HydrophobicContact CD2-CD1 3.35Å
525	Q	87.8	Confident	88.1	Confident	1 Å²	1	20.1 Å²	20.1	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-57	-38.9	178.1	-72.9	176.8	-0.3	0	0	112	G387 H389 H521 L522 P529 W613 F757 Y758	G387-Q525 PolarHBondContact O-NE2 2.96Å; H389-Q525 PolarHBondContact CD2-NE2 3.26Å; H521-Q525 WeakPolarHBondContact O-CB 3.31Å; H521-Q525 VanDerWaalsContact O-CG 3.28Å; H521-Q525 WeakPolarHBondContact O-CG 3.48Å; H521-Q525 PolarHBondContact O-N 2.9Å; L522-Q525 PolarHBondContact O-N 3.42Å; Q525-P529 WeakPolarHBondContact O-CD 3.33Å; Q525-W613 HydrophobicContact CB-CH2 3.88Å; Q525-W613 HydrophobicContact CB-CZ3 4.42Å; Q525-F757 VanDerWaalsContact NE2-CD1 3.26Å; Q525-Y758 VanDerWaalsContact CG-OH 3.3Å; Q525-Y758 WeakPolarHBondContact CG-OH 3.31Å
526	Y	86.5	Confident	88.3	Confident	2 Å²	2	20.7 Å²	20.7	1%	0.008	10%	0.102	C	C	.	.	H	α-helix	trans	-63.8	-43.8	174.5	-179	-103.1	0	0	0	112.4	L522 K523 L524 P529 Y530 L602 W613 L618 L625	L522-Y526 WeakPolarHBondContact O-CB 3.45Å; L522-Y526 PolarHBondContact O-N 3.05Å; K523-Y526 WeakPolarHBondContact O-CB 3.41Å; K523-Y526 PolarHBondContact O-N 3.41Å; L524-Y526 PolarHBondContact O-N 3.45Å; Y526-P529 WeakPolarHBondContact O-CD 3.49Å; Y526-Y530 HydrophobicContact CD2-CE2 4.36Å; Y526-Y530 HydrophobicContact CE1-CE2 4.23Å; Y526-Y530 AromaticContact CE2-CE2 3.95Å; Y526-Y530 HydrophobicContact CE2-CE2 3.95Å; Y526-Y530 AromaticContact CZ-CE2 3.89Å; Y526-Y530 WeakPolarHBondContact O-CD2 3.33Å; Y526-Y530 WeakPolarHBondContact O-CE2 3.44Å; Y526-L602 WeakPolarHBondContact OH-CD1 3.37Å; Y526-L602 WeakPolarHBondContact OH-CD2 3.38Å; Y526-W613 VanDerWaalsContact CA-CH2 3.49Å; Y526-W613 AromaticContact CD2-CD1 3.98Å; Y526-W613 AromaticContact CD2-CD2 3.66Å; Y526-W613 HydrophobicContact CD2-CD2 3.66Å; Y526-W613 AromaticContact CD2-CE2 3.52Å; Y526-W613 HydrophobicContact CD2-CE3 4.16Å; Y526-W613 AromaticContact CD2-CG 3.98Å; Y526-W613 HydrophobicContact CD2-CG 3.98Å; Y526-W613 HydrophobicContact CD2-CH2 4.36Å; Y526-W613 AromaticContact CD2-CZ2 3.88Å; Y526-W613 HydrophobicContact CD2-CZ2 3.88Å; Y526-W613 HydrophobicContact CD2-CZ3 4.48Å; Y526-W613 AromaticContact CD2-NE1 3.73Å; Y526-W613 HydrophobicContact CE2-CD2 4.44Å; Y526-W613 HydrophobicContact CE2-CG 4.31Å; Y526-W613 HydrophobicContact CG-CD2 4.44Å; Y526-W613 HydrophobicContact CG-CZ2 4.49Å; Y526-W613 VanDerWaalsContact N-CH2 3.31Å; Y526-L618 HydrophobicContact CD2-CD2 4.43Å; Y526-L618 HydrophobicContact CE2-CD2 3.62Å; Y526-L625 HydrophobicContact CE1-CD1 4.3Å
527	L	88.1	Confident	88.5	Confident	12 Å²	12	16.8 Å²	16.8	6%	0.063	8%	0.084	C	C	.	.	H	α-helix	trans	-72.9	-33.1	-176.1	-70.3	173.7	0	0	0	113.5	K523 L524 Y530 V531 C624 L625	K523-L527 WeakPolarHBondContact O-CG 3.47Å; K523-L527 PolarHBondContact O-N 3.49Å; L524-L527 PolarHBondContact O-N 2.88Å; L527-Y530 PolarHBondContact O-N 2.71Å; L527-Y530 VanDerWaalsContact O-N 3.17Å; L527-V531 HydrophobicContact CB-CG2 4.42Å; L527-V531 WeakPolarHBondContact O-CG2 2.99Å; L527-V531 PolarHBondContact O-N 2.74Å; L527-C624 HydrophobicContact CD1-CB 4.21Å; L527-C624 HydrophobicContact CD2-CB 3.95Å; L527-L625 HydrophobicContact CD2-CD2 3.96Å; L527-L625 HydrophobicContact CD2-CG 3.93Å
528	I	90.3	Very high	88.7	Confident	1 Å²	1	15 Å²	15	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-48.2	-58	-175.3	-77.1	164.4	0	0	0	112.6	I383 L524 Y530 V531 L532 Y555 W558 I745	I383-I528 HydrophobicContact CG2-CG2 3.89Å; L524-I528 HydrophobicContact CD1-CD1 4.22Å; L524-I528 HydrophobicContact CD1-CG1 4.09Å; L524-I528 HydrophobicContact CG-CD1 3.95Å; L524-I528 HydrophobicContact CG-CG1 4.32Å; L524-I528 VanDerWaalsContact O-CG1 3.31Å; L524-I528 WeakPolarHBondContact O-CG1 3.45Å; L524-I528 PolarHBondContact O-N 2.75Å; I528-Y530 PolarHBondContact O-N 3.3Å; I528-V531 PolarHBondContact O-N 3.13Å; I528-L532 HydrophobicContact CG2-CD1 3.69Å; I528-L532 HydrophobicContact CG2-CG 4.07Å; I528-L532 WeakPolarHBondContact O-CB 3.25Å; I528-L532 WeakPolarHBondContact O-CG 3.2Å; I528-L532 PolarHBondContact O-N 2.95Å; I528-Y555 HydrophobicContact CD1-CE2 4.47Å; I528-Y555 HydrophobicContact CG2-CD2 3.68Å; I528-Y555 HydrophobicContact CG2-CE2 3.91Å; I528-W558 HydrophobicContact CD1-CE3 4.06Å; I528-W558 HydrophobicContact CD1-CH2 3.37Å; I528-W558 HydrophobicContact CD1-CZ2 3.88Å; I528-W558 HydrophobicContact CD1-CZ3 3.48Å; I528-W558 VanDerWaalsContact CD1-CZ3 3.48Å; I528-I745 HydrophobicContact CD1-CG2 4.5Å; I528-I745 HydrophobicContact CG1-CD1 4.23Å; I528-I745 HydrophobicContact CG1-CG1 4.4Å; I528-I745 HydrophobicContact CG1-CG2 3.9Å
529	P	89.3	Confident	88.8	Confident	6 Å²	6	15 Å²	15	4%	0.039	8%	0.076	C	C	.	.	H	α-helix	trans	-56.3	-38.9	-176	-12.4	10.9	0	0	0	113.8	I383 Q384 Q525 Y526 N533 I551	I383-P529 HydrophobicContact CG2-CB 4.46Å; I383-P529 HydrophobicContact CG2-CG 4.05Å; Q384-P529 HydrophobicContact CG-CB 3.92Å; Q384-P529 HydrophobicContact CG-CG 3.71Å; Q525-P529 WeakPolarHBondContact O-CD 3.33Å; Y526-P529 WeakPolarHBondContact O-CD 3.49Å; P529-N533 WeakPolarHBondContact O-CB 3.39Å; P529-N533 PolarHBondContact O-N 3.11Å; P529-N533 VanDerWaalsContact O-N 3.16Å; P529-I551 HydrophobicContact CB-CD1 4.27Å; P529-I551 WeakPolarHBondContact O-CD1 3.06Å
530	Y	89.2	Confident	88.9	Confident	10 Å²	10	15.5 Å²	15.5	4%	0.039	8%	0.083	C	C	.	.	H	α-helix	trans	-76.5	-44.9	-175.9	-59.9	-75.1	0	0	0	111.9	Y526 L527 I528 N533 W534 E598 L625	Y526-Y530 HydrophobicContact CD2-CE2 4.36Å; Y526-Y530 HydrophobicContact CE1-CE2 4.23Å; Y526-Y530 AromaticContact CE2-CE2 3.95Å; Y526-Y530 HydrophobicContact CE2-CE2 3.95Å; Y526-Y530 AromaticContact CZ-CE2 3.89Å; Y526-Y530 WeakPolarHBondContact O-CD2 3.33Å; Y526-Y530 WeakPolarHBondContact O-CE2 3.44Å; L527-Y530 PolarHBondContact O-N 2.71Å; L527-Y530 VanDerWaalsContact O-N 3.17Å; I528-Y530 PolarHBondContact O-N 3.3Å; Y530-N533 PolarHBondContact O-N 3.39Å; Y530-W534 WeakPolarHBondContact O-CB 3.45Å; Y530-W534 PolarHBondContact O-N 3.21Å; Y530-E598 HydrophobicContact CD1-CB 4.02Å; Y530-E598 HydrophobicContact CD1-CG 4.1Å; Y530-E598 HydrophobicContact CE1-CB 4.05Å; Y530-E598 HydrophobicContact CE1-CG 4.18Å; Y530-E598 WeakPolarHBondContact CE1-OE2 3.46Å; Y530-L625 HydrophobicContact CD1-CD1 4.49Å; Y530-L625 HydrophobicContact CD2-CD1 4.02Å; Y530-L625 HydrophobicContact CG-CD1 3.98Å; Y530-L625 HydrophobicContact CG-CD2 4.39Å
531	V	91.2	Very high	88.9	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-69.7	-37.4	179.3	174.4	0	0	0	0	111	L527 I528 N533 W534 L535 L628 L741 L744 I745	L527-V531 HydrophobicContact CB-CG2 4.42Å; L527-V531 WeakPolarHBondContact O-CG2 2.99Å; L527-V531 PolarHBondContact O-N 2.74Å; I528-V531 PolarHBondContact O-N 3.13Å; V531-N533 VanDerWaalsContact C-N 3.35Å; V531-W534 HydrophobicContact CG1-CE3 4.17Å; V531-W534 WeakPolarHBondContact O-CB 3.07Å; V531-W534 PolarHBondContact O-N 3.34Å; V531-L535 PolarHBondContact O-N 3.33Å; V531-L628 HydrophobicContact CG2-CD2 4.14Å; V531-L741 HydrophobicContact CG1-CD2 3.75Å; V531-L744 HydrophobicContact CG2-CB 4.49Å; V531-L744 HydrophobicContact CG2-CD1 4.08Å; V531-I745 HydrophobicContact CB-CD1 3.67Å; V531-I745 HydrophobicContact CB-CG1 4.19Å; V531-I745 HydrophobicContact CG1-CD1 3.5Å; V531-I745 HydrophobicContact CG1-CG1 3.94Å
532	L	91.8	Very high	88.9	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-64.7	-39.1	173.4	-67.5	-170.6	0	0	0	112	I528 L535 L536 I551 L554 Y555 L563 I745	I528-L532 HydrophobicContact CG2-CD1 3.69Å; I528-L532 HydrophobicContact CG2-CG 4.07Å; I528-L532 WeakPolarHBondContact O-CB 3.25Å; I528-L532 WeakPolarHBondContact O-CG 3.2Å; I528-L532 PolarHBondContact O-N 2.95Å; L532-L535 PolarHBondContact O-N 3.49Å; L532-L536 WeakPolarHBondContact O-CB 3.43Å; L532-L536 PolarHBondContact O-N 3.43Å; L532-I551 HydrophobicContact CB-CD1 4.43Å; L532-I551 HydrophobicContact CB-CG1 3.99Å; L532-I551 HydrophobicContact CD1-CG1 4.25Å; L532-L554 HydrophobicContact CD1-CB 4.24Å; L532-L554 HydrophobicContact CD2-CB 4.16Å; L532-L554 HydrophobicContact CD2-CD2 4.46Å; L532-Y555 HydrophobicContact CD1-CD2 4.18Å; L532-L563 HydrophobicContact CD2-CD1 3.55Å; L532-I745 HydrophobicContact CD2-CD1 4Å; L532-I745 HydrophobicContact CG-CD1 4.33Å
533	N	91.2	Very high	88.8	Confident	47 Å²	47	20 Å²	20	25%	0.251	12%	0.119	S	C	.	.	H	α-helix	trans	-71	-37.1	176.9	-158.6	46.1	0	0	0	112	P529 Y530 V531 L535 L536 I537 F594	P529-N533 WeakPolarHBondContact O-CB 3.39Å; P529-N533 PolarHBondContact O-N 3.11Å; P529-N533 VanDerWaalsContact O-N 3.16Å; Y530-N533 PolarHBondContact O-N 3.39Å; V531-N533 VanDerWaalsContact C-N 3.35Å; N533-L535 VanDerWaalsContact C-N 3.34Å; N533-L535 PolarHBondContact O-N 3.02Å; N533-L536 PolarHBondContact O-N 3.23Å; N533-I537 VanDerWaalsContact O-CG1 3.27Å; N533-I537 WeakPolarHBondContact O-CG1 3.08Å; N533-I537 PolarHBondContact O-N 3.05Å; N533-F594 HydrophobicContact CB-CE1 3.84Å; N533-F594 HydrophobicContact CB-CZ 3.81Å; N533-F594 WeakPolarHBondContact ND2-CE2 3.39Å; N533-F594 WeakPolarHBondContact ND2-CZ 3.22Å
534	W	92.5	Very high	88.6	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-55.8	-48.2	169.8	165.1	83.2	0	0	0	111.5	Y530 V531 L536 I537 I538 L595 L628 T632 W736 I737 L741	Y530-W534 WeakPolarHBondContact O-CB 3.45Å; Y530-W534 PolarHBondContact O-N 3.21Å; V531-W534 HydrophobicContact CG1-CE3 4.17Å; V531-W534 WeakPolarHBondContact O-CB 3.07Å; V531-W534 PolarHBondContact O-N 3.34Å; W534-L536 PolarHBondContact O-N 3.31Å; W534-I537 PolarHBondContact O-N 2.9Å; W534-I538 HydrophobicContact CD2-CD1 3.9Å; W534-I538 HydrophobicContact CE3-CD1 4.48Å; W534-I538 HydrophobicContact CG-CD1 4.4Å; W534-I538 HydrophobicContact CH2-CD1 4.08Å; W534-I538 HydrophobicContact CZ2-CD1 3.42Å; W534-I538 VanDerWaalsContact CZ2-CD1 3.42Å; W534-I538 WeakPolarHBondContact O-CG1 3.28Å; W534-I538 PolarHBondContact O-N 3.15Å; W534-I538 VanDerWaalsContact O-N 3.1Å; W534-L595 HydrophobicContact CB-CD2 4.2Å; W534-L595 HydrophobicContact CB-CG 4.43Å; W534-L595 VanDerWaalsContact CD1-CD1 3.41Å; W534-L595 HydrophobicContact CG-CD1 4.12Å; W534-L595 HydrophobicContact CG-CG 4.47Å; W534-L628 HydrophobicContact CD2-CD2 4.21Å; W534-L628 HydrophobicContact CG-CD2 4.34Å; W534-L628 HydrophobicContact CH2-CD1 4.45Å; W534-L628 HydrophobicContact CZ2-CD1 4.12Å; W534-T632 PolarHBondContact NE1-OG1 3.37Å; W534-W736 HydrophobicContact CH2-CH2 4.46Å; W534-W736 HydrophobicContact CH2-CZ3 4.31Å; W534-W736 AromaticContact CZ2-CH2 3.94Å; W534-W736 HydrophobicContact CZ2-CH2 3.94Å; W534-W736 AromaticContact CZ2-CZ3 3.9Å; W534-W736 HydrophobicContact CZ2-CZ3 3.9Å; W534-I737 HydrophobicContact CH2-CG1 4.22Å; W534-I737 HydrophobicContact CH2-CG2 4.23Å; W534-L741 HydrophobicContact CE3-CD2 4.48Å; W534-L741 HydrophobicContact CZ3-CD2 3.88Å; W534-L741 HydrophobicContact CZ3-CG 4.17Å
535	L	91.2	Very high	88.4	Confident	4 Å²	4	25.4 Å²	25.4	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-62.8	-42.4	176.5	-178.4	60.7	0	0	0	111.6	V531 L532 N533 I537 I538 M539 L547 L554 L563 F569 I737 L741	V531-L535 PolarHBondContact O-N 3.33Å; L532-L535 PolarHBondContact O-N 3.49Å; N533-L535 VanDerWaalsContact C-N 3.34Å; N533-L535 PolarHBondContact O-N 3.02Å; L535-I537 VanDerWaalsContact C-N 3.3Å; L535-I537 PolarHBondContact O-N 3.5Å; L535-I538 PolarHBondContact O-N 3.27Å; L535-M539 HydrophobicContact CD1-CG 4.24Å; L535-M539 HydrophobicContact CD1-SD 4.08Å; L535-M539 HydrophobicContact CD2-SD 4.37Å; L535-M539 HydrophobicContact CG-CG 4.42Å; L535-M539 HydrophobicContact CG-SD 3.82Å; L535-M539 WeakPolarHBondContact O-CB 3.23Å; L535-M539 VanDerWaalsContact O-CG 3.22Å; L535-M539 WeakPolarHBondContact O-CG 3.05Å; L535-M539 PolarHBondContact O-N 3.41Å; L535-L547 HydrophobicContact CD2-CD2 3.96Å; L535-L554 HydrophobicContact CB-CD2 4.4Å; L535-L554 HydrophobicContact CD2-CD2 4.04Å; L535-L554 HydrophobicContact CG-CD2 4.28Å; L535-L563 HydrophobicContact CD2-CD1 4.1Å; L535-F569 HydrophobicContact CD2-CE2 4.37Å; L535-I737 HydrophobicContact CD1-CG2 4.3Å; L535-L741 HydrophobicContact CD1-CD1 4.17Å; L535-L741 HydrophobicContact CD2-CD1 3.94Å; L535-L741 HydrophobicContact CD2-CD2 4.36Å
536	L	91.3	Very high	88.3	Confident	26 Å²	26	27.5 Å²	27.5	14%	0.136	17%	0.167	C	C	.	.	H	α-helix	trans	-60.5	-39.7	178.1	-172.5	64.9	0	0	0	111.9	L532 N533 W534 M539 T540 L554	L532-L536 WeakPolarHBondContact O-CB 3.43Å; L532-L536 PolarHBondContact O-N 3.43Å; N533-L536 PolarHBondContact O-N 3.23Å; W534-L536 PolarHBondContact O-N 3.31Å; L536-M539 PolarHBondContact O-N 3.39Å; L536-T540 PolarHBondContact O-N 3.01Å; L536-T540 PolarHBondContact O-OG1 3.38Å; L536-L554 HydrophobicContact CB-CD2 4.48Å; L536-L554 HydrophobicContact CD1-CD1 4.29Å
537	I	89.8	Confident	88.1	Confident	28 Å²	28	27.5 Å²	27.5	14%	0.144	17%	0.167	C	C	.	.	H	α-helix	trans	-65.5	-47.4	176.8	-65.9	163.3	0	0	0	110.5	N533 W534 L535 M539 T540 D590 A591 F594	N533-I537 VanDerWaalsContact O-CG1 3.27Å; N533-I537 WeakPolarHBondContact O-CG1 3.08Å; N533-I537 PolarHBondContact O-N 3.05Å; W534-I537 PolarHBondContact O-N 2.9Å; L535-I537 VanDerWaalsContact C-N 3.3Å; L535-I537 PolarHBondContact O-N 3.5Å; I537-M539 PolarHBondContact O-N 3.41Å; I537-T540 WeakPolarHBondContact CA-OG1 3.39Å; I537-T540 WeakPolarHBondContact O-CB 3.36Å; I537-T540 PolarHBondContact O-N 3.19Å; I537-T540 PolarHBondContact O-OG1 2.96Å; I537-D590 HydrophobicContact CG2-CB 3.74Å; I537-A591 HydrophobicContact CB-CB 4.23Å; I537-A591 HydrophobicContact CG2-CB 3.88Å; I537-F594 HydrophobicContact CD1-CB 3.47Å; I537-F594 VanDerWaalsContact CD1-CB 3.47Å; I537-F594 HydrophobicContact CD1-CD1 3.62Å; I537-F594 HydrophobicContact CD1-CD2 3.96Å; I537-F594 HydrophobicContact CD1-CE1 4.41Å; I537-F594 HydrophobicContact CD1-CG 3.36Å
538	I	89.4	Confident	88	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.3	-35.7	176.2	-68	174	0	0	0	111.5	W534 L535 T540 P541 L576 A591 I737	W534-I538 HydrophobicContact CD2-CD1 3.9Å; W534-I538 HydrophobicContact CE3-CD1 4.48Å; W534-I538 HydrophobicContact CG-CD1 4.4Å; W534-I538 HydrophobicContact CH2-CD1 4.08Å; W534-I538 HydrophobicContact CZ2-CD1 3.42Å; W534-I538 VanDerWaalsContact CZ2-CD1 3.42Å; W534-I538 WeakPolarHBondContact O-CG1 3.28Å; W534-I538 PolarHBondContact O-N 3.15Å; W534-I538 VanDerWaalsContact O-N 3.1Å; L535-I538 PolarHBondContact O-N 3.27Å; I538-T540 VanDerWaalsContact C-N 3.32Å; I538-T540 PolarHBondContact O-N 2.88Å; I538-P541 VanDerWaalsContact O-CD 3.28Å; I538-P541 WeakPolarHBondContact O-CD 3.44Å; I538-L576 HydrophobicContact CG2-CD2 3.9Å; I538-A591 HydrophobicContact CD1-CB 4.33Å; I538-A591 HydrophobicContact CG1-CB 3.72Å; I538-I737 HydrophobicContact CG2-CD1 4.2Å
539	M	88.5	Confident	87.7	Confident	4 Å²	4	34.3 Å²	34.3	2%	0.02	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-7.9	-179.9	-71.5	178.5	59.6	0	0	114.6	L535 L536 I537 P541 V542 L547 T572	L535-M539 HydrophobicContact CD1-CG 4.24Å; L535-M539 HydrophobicContact CD1-SD 4.08Å; L535-M539 HydrophobicContact CD2-SD 4.37Å; L535-M539 HydrophobicContact CG-CG 4.42Å; L535-M539 HydrophobicContact CG-SD 3.82Å; L535-M539 WeakPolarHBondContact O-CB 3.23Å; L535-M539 VanDerWaalsContact O-CG 3.22Å; L535-M539 WeakPolarHBondContact O-CG 3.05Å; L535-M539 PolarHBondContact O-N 3.41Å; L536-M539 PolarHBondContact O-N 3.39Å; I537-M539 PolarHBondContact O-N 3.41Å; M539-P541 VanDerWaalsContact C-N 3.3Å; M539-P541 VanDerWaalsContact O-N 3.15Å; M539-V542 PolarHBondContact O-N 3.3Å; M539-L547 HydrophobicContact CE-CB 3.46Å; M539-L547 VanDerWaalsContact CE-CB 3.46Å; M539-L547 HydrophobicContact CE-CD2 3.9Å; M539-L547 HydrophobicContact CE-CG 4.34Å; M539-L547 HydrophobicContact SD-CB 4.33Å; M539-L547 HydrophobicContact SD-CD2 3.62Å; M539-T572 HydrophobicContact CE-CG2 3.21Å; M539-T572 HydrophobicContact CG-CG2 3.83Å; M539-T572 HydrophobicContact SD-CG2 3.72Å
540	T	89	Confident	87.7	Confident	69 Å²	69	36.9 Å²	36.9	42%	0.423	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-40.1	-176.8	-57.2	0	0	0	0	114.5	L536 I537 I538 V542 R545	L536-T540 PolarHBondContact O-N 3.01Å; L536-T540 PolarHBondContact O-OG1 3.38Å; I537-T540 WeakPolarHBondContact CA-OG1 3.39Å; I537-T540 WeakPolarHBondContact O-CB 3.36Å; I537-T540 PolarHBondContact O-N 3.19Å; I537-T540 PolarHBondContact O-OG1 2.96Å; I538-T540 VanDerWaalsContact C-N 3.32Å; I538-T540 PolarHBondContact O-N 2.88Å; T540-V542 VanDerWaalsContact C-N 3.27Å; T540-V542 PolarHBondContact O-N 2.75Å; T540-R545 PolarHBondContact O-NH2 3.4Å; T540-R545 VanDerWaalsContact O-NH2 3.1Å
541	P	85.5	Confident	87.7	Confident	39 Å²	39	37.5 Å²	37.5	25%	0.253	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-20.1	179.7	-24.5	36.5	0	0	0	115.4	I538 M539 S543 V579 H583 S587	I538-P541 VanDerWaalsContact O-CD 3.28Å; I538-P541 WeakPolarHBondContact O-CD 3.44Å; M539-P541 VanDerWaalsContact C-N 3.3Å; M539-P541 VanDerWaalsContact O-N 3.15Å; P541-S543 PolarHBondContact O-N 3.17Å; P541-V579 HydrophobicContact CB-CG1 3.61Å; P541-V579 HydrophobicContact CB-CG2 4.2Å; P541-V579 HydrophobicContact CG-CG1 4.3Å; P541-H583 HydrophobicContact CB-CB 4.19Å; P541-H583 HydrophobicContact CG-CB 4.31Å; P541-S587 VanDerWaalsContact CD-OG 3.23Å; P541-S587 WeakPolarHBondContact CD-OG 3.48Å; P541-S587 WeakPolarHBondContact CG-OG 3.31Å
542	V	86.8	Confident	87.5	Confident	6 Å²	6	37.5 Å²	37.5	4%	0.036	22%	0.217	C	C	.	.			trans	-77.6	115.9	-177.4	-177.6	0	0	0	0	108.4	M539 T540 R545 L575 L576 V579	M539-V542 PolarHBondContact O-N 3.3Å; T540-V542 VanDerWaalsContact C-N 3.27Å; T540-V542 PolarHBondContact O-N 2.75Å; V542-R545 WeakPolarHBondContact O-CG 3.29Å; V542-L575 HydrophobicContact CG1-CB 3.85Å; V542-L575 HydrophobicContact CG1-CD1 3.78Å; V542-L575 HydrophobicContact CG1-CG 4.45Å; V542-L575 HydrophobicContact CG2-CB 4.5Å; V542-L576 HydrophobicContact CG2-CD1 3.98Å; V542-V579 HydrophobicContact CG2-CG2 4.19Å
543	S	82.4	Confident	87.4	Confident	125 Å²	125	39 Å²	39	87%	0.874	23%	0.226	S	C	*	.	S	Bend	trans	-70.5	-33.4	-176.8	57.5	0	0	0	0	113.7	P541	P541-S543 PolarHBondContact O-N 3.17Å
544	A	82.2	Confident	87.3	Confident	70 Å²	70	36.8 Å²	36.8	58%	0.579	21%	0.214	S	C	*	.	S	Bend	trans	-78.4	-27.2	-175.7	0	0	0	0	0	114.2	L575	A544-L575 HydrophobicContact CB-CD1 4.11Å
545	R	83.3	Confident	87.2	Confident	83 Å²	83	36.9 Å²	36.9	31%	0.313	21%	0.214	S	C	.	.			trans	37.8	63.4	-180	-56.9	-170.2	-179.4	-179.5	-0.9	114.8	T540 V542 L547 G548	T540-R545 PolarHBondContact O-NH2 3.4Å; T540-R545 VanDerWaalsContact O-NH2 3.1Å; V542-R545 WeakPolarHBondContact O-CG 3.29Å; R545-L547 VanDerWaalsContact C-N 3.27Å; R545-L547 PolarHBondContact O-N 3.23Å; R545-G548 PolarHBondContact O-N 3.25Å; R545-G548 VanDerWaalsContact O-N 3.12Å
546	P	84.1	Confident	87.1	Confident	46 Å²	46	38.3 Å²	38.3	30%	0.299	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-27.5	-176.3	26.4	-31.9	0	0	0	113.2	G548 E568 L571 T572 L575	P546-G548 PolarHBondContact O-N 3.33Å; P546-E568 HydrophobicContact CB-CB 4.48Å; P546-L571 HydrophobicContact CG-CB 4.28Å; P546-T572 WeakPolarHBondContact CG-OG1 3.37Å; P546-L575 HydrophobicContact CG-CD1 4.25Å
547	L	84	Confident	86.9	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.01	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-11.8	176.5	-151.3	72.7	0	0	0	113.8	L535 M539 R545 L554 L557 L563 E568 F569	L535-L547 HydrophobicContact CD2-CD2 3.96Å; M539-L547 HydrophobicContact CE-CB 3.46Å; M539-L547 VanDerWaalsContact CE-CB 3.46Å; M539-L547 HydrophobicContact CE-CD2 3.9Å; M539-L547 HydrophobicContact CE-CG 4.34Å; M539-L547 HydrophobicContact SD-CB 4.33Å; M539-L547 HydrophobicContact SD-CD2 3.62Å; R545-L547 VanDerWaalsContact C-N 3.27Å; R545-L547 PolarHBondContact O-N 3.23Å; L547-L554 HydrophobicContact CB-CD1 4.45Å; L547-L554 HydrophobicContact CD2-CD1 4.24Å; L547-L554 HydrophobicContact CD2-CD2 4.05Å; L547-L554 HydrophobicContact CD2-CG 3.71Å; L547-L554 HydrophobicContact CG-CD1 4.26Å; L547-L554 HydrophobicContact CG-CG 4.05Å; L547-L557 HydrophobicContact CB-CD1 4.46Å; L547-L557 HydrophobicContact CD1-CD1 3.66Å; L547-L557 HydrophobicContact CG-CD1 3.86Å; L547-L557 VanDerWaalsContact O-CD1 3.23Å; L547-L557 WeakPolarHBondContact O-CD1 3.43Å; L547-L563 HydrophobicContact CD1-CD2 4.47Å; L547-L563 HydrophobicContact CD2-CD2 4.39Å; L547-E568 HydrophobicContact CD1-CB 4.17Å; L547-F569 HydrophobicContact CD1-CB 3.87Å; L547-F569 HydrophobicContact CD1-CD2 4.43Å; L547-F569 HydrophobicContact CD2-CD2 4.31Å
548	G	84.1	Confident	86.9	Confident	14 Å²	14	37 Å²	37	14%	0.144	21%	0.212	C	C	.	.			trans	115	174.4	-177.3	0	0	0	0	0	114.1	R545 P546	R545-G548 PolarHBondContact O-N 3.25Å; R545-G548 VanDerWaalsContact O-N 3.12Å; P546-G548 PolarHBondContact O-N 3.33Å
549	K	85.7	Confident	86.7	Confident	142 Å²	142	37.1 Å²	37.1	62%	0.617	21%	0.213	S	C	*	.	S	Bend	trans	-107	-23.5	-175.1	-65.6	179.1	-177.8	175	0	112.7	D553	K549-D553 PolarHBondContact N-OD2 3.45Å
550	N	87.7	Confident	86.5	Confident	59 Å²	59	41.2 Å²	41.2	32%	0.316	23%	0.231	S	C	.	.	S	Bend	trans	-121	157.3	-172	-54.1	-38.3	0	0	0	110.2	N376 G552 D553 L554	N376-N550 VanDerWaalsContact ND2-CG 3.27Å; N376-N550 PolarHBondContact ND2-ND2 3.45Å; N376-N550 PolarHBondContact OD1-ND2 3.45Å; N550-G552 PolarHBondContact O-N 2.85Å; N550-G552 VanDerWaalsContact O-N 3.15Å; N550-D553 PolarHBondContact N-OD2 3.01Å; N550-D553 WeakPolarHBondContact O-CB 3.5Å; N550-D553 PolarHBondContact O-N 3.12Å; N550-L554 PolarHBondContact O-N 2.78Å
551	I	89.5	Confident	86	Confident	23 Å²	23	40.8 Å²	40.8	12%	0.118	23%	0.226	C	C	.	.	H	α-helix	trans	-53.6	-35.3	174.5	-166.1	169.6	0	0	0	112.7	P529 L532 D553 L554 Y555	P529-I551 HydrophobicContact CB-CD1 4.27Å; P529-I551 WeakPolarHBondContact O-CD1 3.06Å; L532-I551 HydrophobicContact CB-CD1 4.43Å; L532-I551 HydrophobicContact CB-CG1 3.99Å; L532-I551 HydrophobicContact CD1-CG1 4.25Å; I551-D553 VanDerWaalsContact C-N 3.29Å; I551-D553 PolarHBondContact O-N 2.92Å; I551-L554 PolarHBondContact O-N 2.98Å; I551-Y555 VanDerWaalsContact O-CB 3.31Å; I551-Y555 WeakPolarHBondContact O-CB 3.29Å; I551-Y555 PolarHBondContact O-N 3.5Å
552	G	88.5	Confident	85.9	Confident	1 Å²	1	39 Å²	39	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-64.9	-28.3	177.7	0	0	0	0	0	113.8	N550 R556	N550-G552 PolarHBondContact O-N 2.85Å; N550-G552 VanDerWaalsContact O-N 3.15Å; G552-R556 VanDerWaalsContact O-CG 3.3Å; G552-R556 WeakPolarHBondContact O-CG 3.33Å; G552-R556 PolarHBondContact O-N 2.84Å; G552-R556 VanDerWaalsContact O-N 3.08Å; G552-R556 PolarHBondContact O-NH1 3.04Å
553	D	88.2	Confident	85.8	Confident	32 Å²	32	39 Å²	39	17%	0.171	22%	0.215	C	C	.	.	H	α-helix	trans	-73.8	-48.1	177.8	-58.9	-33.5	0	0	0	110.6	K549 N550 I551 Y555 R556 L557	K549-D553 PolarHBondContact N-OD2 3.45Å; N550-D553 PolarHBondContact N-OD2 3.01Å; N550-D553 WeakPolarHBondContact O-CB 3.5Å; N550-D553 PolarHBondContact O-N 3.12Å; I551-D553 VanDerWaalsContact C-N 3.29Å; I551-D553 PolarHBondContact O-N 2.92Å; D553-Y555 VanDerWaalsContact C-N 3.28Å; D553-Y555 PolarHBondContact O-N 3.26Å; D553-R556 PolarHBondContact O-N 3.41Å; D553-R556 IonicContact OD1-CZ 3.95Å; D553-R556 VanDerWaalsContact OD1-CZ 3.28Å; D553-R556 IonicContact OD1-NH1 2.71Å; D553-R556 PolarHBondContact OD1-NH1 3.37Å; D553-R556 IonicContact OD1-NH2 2.73Å; D553-R556 PolarHBondContact OD1-NH2 2.8Å; D553-L557 PolarHBondContact O-N 3Å
554	L	90.2	Very high	85.9	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.2	-42.3	174.4	-83.8	68.8	0	0	0	110.9	L532 L535 L536 L547 N550 I551 L557 W558 L563	L532-L554 HydrophobicContact CD1-CB 4.24Å; L532-L554 HydrophobicContact CD2-CB 4.16Å; L532-L554 HydrophobicContact CD2-CD2 4.46Å; L535-L554 HydrophobicContact CB-CD2 4.4Å; L535-L554 HydrophobicContact CD2-CD2 4.04Å; L535-L554 HydrophobicContact CG-CD2 4.28Å; L536-L554 HydrophobicContact CB-CD2 4.48Å; L536-L554 HydrophobicContact CD1-CD1 4.29Å; L547-L554 HydrophobicContact CB-CD1 4.45Å; L547-L554 HydrophobicContact CD2-CD1 4.24Å; L547-L554 HydrophobicContact CD2-CD2 4.05Å; L547-L554 HydrophobicContact CD2-CG 3.71Å; L547-L554 HydrophobicContact CG-CD1 4.26Å; L547-L554 HydrophobicContact CG-CG 4.05Å; N550-L554 PolarHBondContact O-N 2.78Å; I551-L554 PolarHBondContact O-N 2.98Å; L554-L557 PolarHBondContact O-N 2.84Å; L554-W558 WeakPolarHBondContact O-CB 3.38Å; L554-W558 PolarHBondContact O-N 3.35Å; L554-L563 WeakPolarHBondContact O-CD2 3.4Å
555	Y	90.9	Very high	85.9	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.008	18%	0.178	C	C	.	.	H	α-helix	trans	-63.9	-42	178.1	-177.1	-106.4	0	0	0	112.6	I383 H389 L395 I528 L532 I551 D553 W558 L559	I383-Y555 HydrophobicContact CD1-CD1 3.76Å; I383-Y555 HydrophobicContact CD1-CD2 4.28Å; I383-Y555 HydrophobicContact CD1-CE1 4.42Å; I383-Y555 HydrophobicContact CD1-CG 3.66Å; I383-Y555 HydrophobicContact CG1-CD1 3.69Å; I383-Y555 HydrophobicContact CG1-CD2 4.13Å; I383-Y555 HydrophobicContact CG1-CE1 3.84Å; I383-Y555 HydrophobicContact CG1-CE2 4.28Å; I383-Y555 HydrophobicContact CG1-CG 3.83Å; I383-Y555 HydrophobicContact CG2-CD2 3.91Å; I383-Y555 HydrophobicContact CG2-CE2 4Å; I383-Y555 HydrophobicContact CG2-CG 4.38Å; H389-Y555 VanDerWaalsContact CB-OH 3.27Å; H389-Y555 WeakPolarHBondContact CB-OH 3.3Å; H389-Y555 PolarHBondContact ND1-OH 2.76Å; L395-Y555 HydrophobicContact CD2-CD1 4.01Å; L395-Y555 HydrophobicContact CD2-CE1 4.06Å; I528-Y555 HydrophobicContact CD1-CE2 4.47Å; I528-Y555 HydrophobicContact CG2-CD2 3.68Å; I528-Y555 HydrophobicContact CG2-CE2 3.91Å; L532-Y555 HydrophobicContact CD1-CD2 4.18Å; I551-Y555 VanDerWaalsContact O-CB 3.31Å; I551-Y555 WeakPolarHBondContact O-CB 3.29Å; I551-Y555 PolarHBondContact O-N 3.5Å; D553-Y555 VanDerWaalsContact C-N 3.28Å; D553-Y555 PolarHBondContact O-N 3.26Å; Y555-W558 AromaticContact CD2-CE3 3.97Å; Y555-W558 HydrophobicContact CD2-CE3 3.97Å; Y555-W558 HydrophobicContact CD2-CZ3 4.42Å; Y555-W558 AromaticContact CE2-CE3 3.77Å; Y555-W558 HydrophobicContact CE2-CE3 3.77Å; Y555-W558 AromaticContact CE2-CZ3 3.76Å; Y555-W558 HydrophobicContact CE2-CZ3 3.76Å; Y555-W558 PolarHBondContact O-N 3.12Å; Y555-L559 HydrophobicContact CD1-CD1 3.82Å; Y555-L559 HydrophobicContact CD1-CG 4.35Å; Y555-L559 HydrophobicContact CE1-CD1 3.26Å; Y555-L559 HydrophobicContact CE1-CG 3.94Å; Y555-L559 HydrophobicContact CE2-CG 4.35Å; Y555-L559 WeakPolarHBondContact O-CG 3.46Å; Y555-L559 PolarHBondContact O-N 3.31Å
556	R	88.2	Confident	86	Confident	33 Å²	33	32.4 Å²	32.4	13%	0.125	17%	0.169	C	C	.	.	H	α-helix	trans	-62.4	-43.2	174.3	-74.5	-167.4	-41.6	-74.8	9.3	111.5	Y392 L395 M399 G552 D553 W558 L559 K560	Y392-R556 HydrophobicContact CD2-CB 4.25Å; Y392-R556 WeakPolarHBondContact CD2-O 3.31Å; Y392-R556 HydrophobicContact CE2-CB 4.19Å; Y392-R556 WeakPolarHBondContact CE2-O 3.48Å; L395-R556 HydrophobicContact CD2-CG 3.82Å; L395-R556 HydrophobicContact CG-CG 4.19Å; M399-R556 VanDerWaalsContact CE-NH1 3.29Å; G552-R556 VanDerWaalsContact O-CG 3.3Å; G552-R556 WeakPolarHBondContact O-CG 3.33Å; G552-R556 PolarHBondContact O-N 2.84Å; G552-R556 VanDerWaalsContact O-N 3.08Å; G552-R556 PolarHBondContact O-NH1 3.04Å; D553-R556 PolarHBondContact O-N 3.41Å; D553-R556 IonicContact OD1-CZ 3.95Å; D553-R556 VanDerWaalsContact OD1-CZ 3.28Å; D553-R556 IonicContact OD1-NH1 2.71Å; D553-R556 PolarHBondContact OD1-NH1 3.37Å; D553-R556 IonicContact OD1-NH2 2.73Å; D553-R556 PolarHBondContact OD1-NH2 2.8Å; R556-W558 VanDerWaalsContact C-N 3.35Å; R556-L559 PolarHBondContact O-N 3.01Å; R556-K560 PolarHBondContact O-N 3.32Å; R556-K560 VanDerWaalsContact O-N 3.11Å
557	L	87	Confident	86.2	Confident	27 Å²	27	37.7 Å²	37.7	14%	0.141	19%	0.189	C	C	.	.	H	α-helix	trans	-64.4	-40.5	176.7	-71.9	172.7	0	0	0	111.9	L547 D553 L554 K560 L563	L547-L557 HydrophobicContact CB-CD1 4.46Å; L547-L557 HydrophobicContact CD1-CD1 3.66Å; L547-L557 HydrophobicContact CG-CD1 3.86Å; L547-L557 VanDerWaalsContact O-CD1 3.23Å; L547-L557 WeakPolarHBondContact O-CD1 3.43Å; D553-L557 PolarHBondContact O-N 3Å; L554-L557 PolarHBondContact O-N 2.84Å; L557-K560 WeakPolarHBondContact O-CB 3.49Å; L557-K560 PolarHBondContact O-N 3.32Å; L557-K560 VanDerWaalsContact O-N 3.13Å; L557-L563 HydrophobicContact CB-CD2 4.15Å
558	W	89.6	Confident	86.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.3	-46.5	173.4	176.2	69.6	0	0	0	112	L524 I528 L554 Y555 R556 K560 G562 L563 I745 P746 F748 Y758	L524-W558 HydrophobicContact CD2-CH2 4.27Å; L524-W558 HydrophobicContact CD2-CZ2 3.99Å; I528-W558 HydrophobicContact CD1-CE3 4.06Å; I528-W558 HydrophobicContact CD1-CH2 3.37Å; I528-W558 HydrophobicContact CD1-CZ2 3.88Å; I528-W558 HydrophobicContact CD1-CZ3 3.48Å; I528-W558 VanDerWaalsContact CD1-CZ3 3.48Å; L554-W558 WeakPolarHBondContact O-CB 3.38Å; L554-W558 PolarHBondContact O-N 3.35Å; Y555-W558 AromaticContact CD2-CE3 3.97Å; Y555-W558 HydrophobicContact CD2-CE3 3.97Å; Y555-W558 HydrophobicContact CD2-CZ3 4.42Å; Y555-W558 AromaticContact CE2-CE3 3.77Å; Y555-W558 HydrophobicContact CE2-CE3 3.77Å; Y555-W558 AromaticContact CE2-CZ3 3.76Å; Y555-W558 HydrophobicContact CE2-CZ3 3.76Å; Y555-W558 PolarHBondContact O-N 3.12Å; R556-W558 VanDerWaalsContact C-N 3.35Å; W558-K560 PolarHBondContact O-N 2.84Å; W558-G562 WeakPolarHBondContact O-CA 3.5Å; W558-G562 PolarHBondContact O-N 2.91Å; W558-L563 HydrophobicContact CB-CD2 4.13Å; W558-L563 HydrophobicContact CB-CG 3.91Å; W558-I745 HydrophobicContact CD2-CG2 4.06Å; W558-I745 HydrophobicContact CG-CG2 4.15Å; W558-I745 HydrophobicContact CZ2-CG2 3.86Å; W558-P746 PolarHBondContact NE1-O 3.4Å; W558-F748 HydrophobicContact CH2-CB 3.97Å; W558-F748 HydrophobicContact CZ2-CB 3.94Å; W558-Y758 AromaticContact CH2-CE1 3.95Å; W558-Y758 HydrophobicContact CH2-CE1 3.95Å; W558-Y758 AromaticContact CH2-CZ 3.78Å; W558-Y758 AromaticContact CZ3-CE1 3.95Å; W558-Y758 HydrophobicContact CZ3-CE1 3.95Å
559	L	85.7	Confident	86.5	Confident	2 Å²	2	40 Å²	40	1%	0.01	20%	0.196	C	C	.	.	H	α-helix	trans	-65.3	-14	175.7	-76.2	178.9	0	0	0	114	P390 Y392 L395 Y555 R556 F748 Y758	P390-L559 WeakPolarHBondContact O-CD1 3.25Å; Y392-L559 WeakPolarHBondContact CB-O 3.2Å; L395-L559 HydrophobicContact CD2-CD1 4.22Å; Y555-L559 HydrophobicContact CD1-CD1 3.82Å; Y555-L559 HydrophobicContact CD1-CG 4.35Å; Y555-L559 HydrophobicContact CE1-CD1 3.26Å; Y555-L559 HydrophobicContact CE1-CG 3.94Å; Y555-L559 HydrophobicContact CE2-CG 4.35Å; Y555-L559 WeakPolarHBondContact O-CG 3.46Å; Y555-L559 PolarHBondContact O-N 3.31Å; R556-L559 PolarHBondContact O-N 3.01Å; L559-F748 HydrophobicContact CD2-CD1 4.46Å; L559-F748 HydrophobicContact CD2-CE1 4.39Å; L559-F748 WeakPolarHBondContact O-CE1 3.2Å; L559-F748 WeakPolarHBondContact O-CZ 3.36Å; L559-Y758 HydrophobicContact CD2-CD1 3.77Å; L559-Y758 HydrophobicContact CD2-CE1 4.05Å
560	K	83.5	Confident	86.6	Confident	91 Å²	91	36.6 Å²	36.6	40%	0.396	19%	0.185	S	C	.	.	H	α-helix	trans	-75.3	-62.5	177.6	-173.6	-179.5	176.2	-174.9	0	110.7	Y392 R556 L557 W558	Y392-K560 HydrophobicContact CD1-CB 4.24Å; Y392-K560 HydrophobicContact CD1-CG 4.18Å; Y392-K560 HydrophobicContact CD2-CB 4.05Å; Y392-K560 HydrophobicContact CE1-CB 4.27Å; Y392-K560 HydrophobicContact CE1-CD 4.17Å; Y392-K560 HydrophobicContact CE1-CG 3.95Å; Y392-K560 HydrophobicContact CE2-CB 4.08Å; Y392-K560 HydrophobicContact CG-CB 4.12Å; R556-K560 PolarHBondContact O-N 3.32Å; R556-K560 VanDerWaalsContact O-N 3.11Å; L557-K560 WeakPolarHBondContact O-CB 3.49Å; L557-K560 PolarHBondContact O-N 3.32Å; L557-K560 VanDerWaalsContact O-N 3.13Å; W558-K560 PolarHBondContact O-N 2.84Å
561	N	79.4	Confident	86.7	Confident	59 Å²	59	38.4 Å²	38.4	32%	0.316	19%	0.194	S	C	.	.	H	α-helix	trans	-150.6	15	-177.7	-79.1	-34.3	0	0	0	112.9	N565 S747	N561-N565 PolarHBondContact O-ND2 3.18Å; N561-S747 PolarHBondContact O-OG 2.7Å
562	G	82.6	Confident	86.7	Confident	3 Å²	3	37.4 Å²	37.4	3%	0.031	19%	0.189	C	C	.	.			trans	87.1	158.1	-165.8	0	0	0	0	0	112.9	W558 S747	W558-G562 WeakPolarHBondContact O-CA 3.5Å; W558-G562 PolarHBondContact O-N 2.91Å; G562-S747 WeakPolarHBondContact CA-OG 3.34Å
563	L	85.6	Confident	86.7	Confident	6 Å²	6	38.1 Å²	38.1	3%	0.031	19%	0.192	C	C	.	.	S	Bend	trans	-72.2	-43.6	-176.3	-71.5	172	0	0	0	112.7	L532 L535 L547 L554 L557 W558 N565 A566 F569	L532-L563 HydrophobicContact CD2-CD1 3.55Å; L535-L563 HydrophobicContact CD2-CD1 4.1Å; L547-L563 HydrophobicContact CD1-CD2 4.47Å; L547-L563 HydrophobicContact CD2-CD2 4.39Å; L554-L563 WeakPolarHBondContact O-CD2 3.4Å; L557-L563 HydrophobicContact CB-CD2 4.15Å; W558-L563 HydrophobicContact CB-CD2 4.13Å; W558-L563 HydrophobicContact CB-CG 3.91Å; L563-N565 VanDerWaalsContact C-N 3.26Å; L563-N565 PolarHBondContact O-N 3.49Å; L563-A566 VanDerWaalsContact O-CB 3.28Å; L563-A566 WeakPolarHBondContact O-CB 3.29Å; L563-A566 PolarHBondContact O-N 2.62Å; L563-A566 VanDerWaalsContact O-N 3.11Å; L563-F569 WeakPolarHBondContact O-CB 3.5Å; L563-F569 WeakPolarHBondContact O-CG 3.41Å
564	V	83.6	Confident	86.7	Confident	21 Å²	21	42.2 Å²	42.2	13%	0.127	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-28.1	-172.1	-178.8	0	0	0	0	112.1	A566 F569 Q738 L741 N742	V564-A566 VanDerWaalsContact C-N 3.28Å; V564-A566 PolarHBondContact O-N 2.83Å; V564-F569 HydrophobicContact CB-CD1 4.49Å; V564-F569 HydrophobicContact CB-CE1 4.32Å; V564-F569 HydrophobicContact CG1-CE1 4.22Å; V564-F569 HydrophobicContact CG2-CE1 4.06Å; V564-F569 HydrophobicContact CG2-CZ 4.37Å; V564-Q738 HydrophobicContact CG1-CB 4.49Å; V564-L741 HydrophobicContact CG2-CB 4.15Å; V564-N742 VanDerWaalsContact CB-OD1 3.31Å; V564-N742 WeakPolarHBondContact CB-OD1 3.42Å; V564-N742 WeakPolarHBondContact CG2-OD1 3.21Å
565	N	82.6	Confident	86.6	Confident	105 Å²	105	45.9 Å²	45.9	56%	0.561	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-11	176.9	-61.4	-27.1	0	0	0	113.1	N561 L563	N561-N565 PolarHBondContact O-ND2 3.18Å; L563-N565 VanDerWaalsContact C-N 3.26Å; L563-N565 PolarHBondContact O-N 3.49Å
566	A	85.5	Confident	86.4	Confident	13 Å²	13	45.9 Å²	45.9	11%	0.107	23%	0.234	C	C	.	.			trans	-75.7	135	-178	0	0	0	0	0	111.3	L563 V564 E568 F569 N570	L563-A566 VanDerWaalsContact O-CB 3.28Å; L563-A566 WeakPolarHBondContact O-CB 3.29Å; L563-A566 PolarHBondContact O-N 2.62Å; L563-A566 VanDerWaalsContact O-N 3.11Å; V564-A566 VanDerWaalsContact C-N 3.28Å; V564-A566 PolarHBondContact O-N 2.83Å; A566-E568 WeakPolarHBondContact CB-OE2 3.11Å; A566-E568 PolarHBondContact O-N 3.24Å; A566-F569 HydrophobicContact CB-CB 4.21Å; A566-F569 WeakPolarHBondContact O-CB 3.17Å; A566-F569 PolarHBondContact O-N 3.46Å; A566-F569 VanDerWaalsContact O-N 3.11Å; A566-N570 PolarHBondContact O-N 2.89Å
567	E	87.9	Confident	86.3	Confident	156 Å²	156	45.5 Å²	45.5	73%	0.729	24%	0.24	S	C	*	.	H	α-helix	trans	-60.6	-36.1	175.5	-65.1	-174.6	174.7	0	0	111	F569 N570 L571	E567-F569 VanDerWaalsContact C-N 3.25Å; E567-F569 PolarHBondContact O-N 2.96Å; E567-N570 PolarHBondContact O-N 2.93Å; E567-L571 WeakPolarHBondContact O-CG 3.43Å; E567-L571 PolarHBondContact O-N 3.26Å
568	E	87.4	Confident	86.2	Confident	65 Å²	65	47.2 Å²	47.2	30%	0.304	26%	0.264	S	S	.	.	H	α-helix	trans	-62.7	-32	177.9	-58.3	88.6	162.3	0	0	112.3	P546 L547 A566 T572	P546-E568 HydrophobicContact CB-CB 4.48Å; L547-E568 HydrophobicContact CD1-CB 4.17Å; A566-E568 WeakPolarHBondContact CB-OE2 3.11Å; A566-E568 PolarHBondContact O-N 3.24Å; E568-T572 WeakPolarHBondContact O-CB 3.15Å; E568-T572 PolarHBondContact O-N 3.1Å; E568-T572 PolarHBondContact O-OG1 3.15Å
569	F	88.1	Confident	86.1	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-72.5	-44.8	175.5	179.5	-100.2	0	0	0	111.4	L535 L547 L563 V564 A566 E567 L571 T572 I573 Q738 L741	L535-F569 HydrophobicContact CD2-CE2 4.37Å; L547-F569 HydrophobicContact CD1-CB 3.87Å; L547-F569 HydrophobicContact CD1-CD2 4.43Å; L547-F569 HydrophobicContact CD2-CD2 4.31Å; L563-F569 WeakPolarHBondContact O-CB 3.5Å; L563-F569 WeakPolarHBondContact O-CG 3.41Å; V564-F569 HydrophobicContact CB-CD1 4.49Å; V564-F569 HydrophobicContact CB-CE1 4.32Å; V564-F569 HydrophobicContact CG1-CE1 4.22Å; V564-F569 HydrophobicContact CG2-CE1 4.06Å; V564-F569 HydrophobicContact CG2-CZ 4.37Å; A566-F569 HydrophobicContact CB-CB 4.21Å; A566-F569 WeakPolarHBondContact O-CB 3.17Å; A566-F569 PolarHBondContact O-N 3.46Å; A566-F569 VanDerWaalsContact O-N 3.11Å; E567-F569 VanDerWaalsContact C-N 3.25Å; E567-F569 PolarHBondContact O-N 2.96Å; F569-L571 VanDerWaalsContact C-N 3.3Å; F569-L571 PolarHBondContact O-N 3.36Å; F569-T572 WeakPolarHBondContact O-CA 3.43Å; F569-T572 VanDerWaalsContact O-CB 3.31Å; F569-T572 WeakPolarHBondContact O-CB 3.45Å; F569-T572 PolarHBondContact O-N 3.47Å; F569-I573 HydrophobicContact CD1-CG1 4.19Å; F569-I573 HydrophobicContact CE1-CD1 4.34Å; F569-I573 HydrophobicContact CE1-CG1 3.8Å; F569-I573 HydrophobicContact CE2-CD1 4.18Å; F569-I573 HydrophobicContact CE2-CG1 4.21Å; F569-I573 HydrophobicContact CZ-CD1 3.84Å; F569-I573 HydrophobicContact CZ-CG1 3.79Å; F569-I573 WeakPolarHBondContact O-CG1 3.42Å; F569-I573 PolarHBondContact O-N 2.79Å; F569-Q738 HydrophobicContact CE1-CB 4.42Å; F569-Q738 HydrophobicContact CE1-CG 3.73Å; F569-Q738 HydrophobicContact CZ-CG 4.02Å; F569-L741 HydrophobicContact CE2-CD1 3.57Å; F569-L741 HydrophobicContact CZ-CD1 3.66Å
570	N	88.1	Confident	86.2	Confident	71 Å²	71	51.5 Å²	51.5	38%	0.38	29%	0.292	S	S	.	.	H	α-helix	trans	-60.4	-41.1	174.9	-72.9	-38.4	0	0	0	111.8	A566 E567 T572 I573 N574	A566-N570 PolarHBondContact O-N 2.89Å; E567-N570 PolarHBondContact O-N 2.93Å; N570-T572 VanDerWaalsContact C-N 3.35Å; N570-T572 PolarHBondContact O-N 2.86Å; N570-I573 PolarHBondContact O-N 3.21Å; N570-N574 WeakPolarHBondContact O-CB 3.46Å; N570-N574 PolarHBondContact O-N 3.03Å; N570-N574 PolarHBondContact O-ND2 3.19Å; N570-N574 VanDerWaalsContact O-ND2 3.14Å
571	L	89	Confident	86.4	Confident	97 Å²	97	50.3 Å²	50.3	51%	0.508	29%	0.286	S	S	.	.	H	α-helix	trans	-61	-42.6	172	-70.9	173.2	0	0	0	112.1	P546 E567 F569 N574 L575	P546-L571 HydrophobicContact CG-CB 4.28Å; E567-L571 WeakPolarHBondContact O-CG 3.43Å; E567-L571 PolarHBondContact O-N 3.26Å; F569-L571 VanDerWaalsContact C-N 3.3Å; F569-L571 PolarHBondContact O-N 3.36Å; L571-N574 PolarHBondContact O-N 3.05Å; L571-L575 VanDerWaalsContact O-CG 3.28Å; L571-L575 WeakPolarHBondContact O-CG 3.49Å; L571-L575 PolarHBondContact O-N 3.22Å
572	T	88.7	Confident	86.7	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.012	30%	0.303	C	S	.	.	H	α-helix	trans	-60	-49.2	176.1	-60.4	0	0	0	0	111.7	M539 P546 E568 F569 N570 N574 L575 L576	M539-T572 HydrophobicContact CE-CG2 3.21Å; M539-T572 HydrophobicContact CG-CG2 3.83Å; M539-T572 HydrophobicContact SD-CG2 3.72Å; P546-T572 WeakPolarHBondContact CG-OG1 3.37Å; E568-T572 WeakPolarHBondContact O-CB 3.15Å; E568-T572 PolarHBondContact O-N 3.1Å; E568-T572 PolarHBondContact O-OG1 3.15Å; F569-T572 WeakPolarHBondContact O-CA 3.43Å; F569-T572 VanDerWaalsContact O-CB 3.31Å; F569-T572 WeakPolarHBondContact O-CB 3.45Å; F569-T572 PolarHBondContact O-N 3.47Å; N570-T572 VanDerWaalsContact C-N 3.35Å; N570-T572 PolarHBondContact O-N 2.86Å; T572-N574 VanDerWaalsContact C-N 3.29Å; T572-N574 PolarHBondContact O-N 3.35Å; T572-L575 PolarHBondContact O-N 2.94Å; T572-L575 VanDerWaalsContact O-N 3.15Å; T572-L576 WeakPolarHBondContact O-CB 3.44Å; T572-L576 PolarHBondContact O-N 3.4Å
573	I	89	Confident	87.1	Confident	15 Å²	15	59 Å²	59	8%	0.077	32%	0.324	C	S	.	.	H	α-helix	trans	-61.7	-40.5	-179.4	-66.9	-64	0	0	0	110.6	F569 N570 L575 L576 G577 L734 I737	F569-I573 HydrophobicContact CD1-CG1 4.19Å; F569-I573 HydrophobicContact CE1-CD1 4.34Å; F569-I573 HydrophobicContact CE1-CG1 3.8Å; F569-I573 HydrophobicContact CE2-CD1 4.18Å; F569-I573 HydrophobicContact CE2-CG1 4.21Å; F569-I573 HydrophobicContact CZ-CD1 3.84Å; F569-I573 HydrophobicContact CZ-CG1 3.79Å; F569-I573 WeakPolarHBondContact O-CG1 3.42Å; F569-I573 PolarHBondContact O-N 2.79Å; N570-I573 PolarHBondContact O-N 3.21Å; I573-L575 PolarHBondContact O-N 3.48Å; I573-L576 PolarHBondContact O-N 3.27Å; I573-G577 PolarHBondContact O-N 3.28Å; I573-L734 HydrophobicContact CD1-CD2 4.36Å; I573-L734 HydrophobicContact CG2-CB 4.07Å; I573-L734 HydrophobicContact CG2-CD1 4.26Å; I573-L734 HydrophobicContact CG2-CD2 4.41Å; I573-L734 HydrophobicContact CG2-CG 4.47Å; I573-I737 HydrophobicContact CD1-CG2 4.49Å
574	N	87.8	Confident	87.2	Confident	119 Å²	119	58.7 Å²	58.7	64%	0.636	32%	0.323	S	S	*	.	H	α-helix	trans	-62.4	-42.1	174.3	-71.8	-28	0	0	0	112.4	N570 L571 T572 G577	N570-N574 WeakPolarHBondContact O-CB 3.46Å; N570-N574 PolarHBondContact O-N 3.03Å; N570-N574 PolarHBondContact O-ND2 3.19Å; N570-N574 VanDerWaalsContact O-ND2 3.14Å; L571-N574 PolarHBondContact O-N 3.05Å; T572-N574 VanDerWaalsContact C-N 3.29Å; T572-N574 PolarHBondContact O-N 3.35Å; N574-G577 PolarHBondContact O-N 3.26Å
575	L	89.3	Confident	87.5	Confident	77 Å²	77	58.6 Å²	58.6	40%	0.403	32%	0.321	S	S	.	.	H	α-helix	trans	-67.4	-36.9	175.9	-70.1	173.3	0	0	0	112.2	V542 A544 P546 L571 T572 I573 G577 G578 V579	V542-L575 HydrophobicContact CG1-CB 3.85Å; V542-L575 HydrophobicContact CG1-CD1 3.78Å; V542-L575 HydrophobicContact CG1-CG 4.45Å; V542-L575 HydrophobicContact CG2-CB 4.5Å; A544-L575 HydrophobicContact CB-CD1 4.11Å; P546-L575 HydrophobicContact CG-CD1 4.25Å; L571-L575 VanDerWaalsContact O-CG 3.28Å; L571-L575 WeakPolarHBondContact O-CG 3.49Å; L571-L575 PolarHBondContact O-N 3.22Å; T572-L575 PolarHBondContact O-N 2.94Å; T572-L575 VanDerWaalsContact O-N 3.15Å; I573-L575 PolarHBondContact O-N 3.48Å; L575-G577 PolarHBondContact O-N 3.3Å; L575-G578 WeakPolarHBondContact O-CA 3.39Å; L575-G578 PolarHBondContact O-N 3Å; L575-V579 PolarHBondContact O-N 3.49Å
576	L	86.8	Confident	87.9	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-64.7	-31.6	175.1	-160.4	61.3	0	0	0	111.1	I538 V542 T572 I573 G578 V579 L584 L734	I538-L576 HydrophobicContact CG2-CD2 3.9Å; V542-L576 HydrophobicContact CG2-CD1 3.98Å; T572-L576 WeakPolarHBondContact O-CB 3.44Å; T572-L576 PolarHBondContact O-N 3.4Å; I573-L576 PolarHBondContact O-N 3.27Å; L576-G578 PolarHBondContact O-N 2.99Å; L576-V579 HydrophobicContact CD1-CG2 4.08Å; L576-V579 PolarHBondContact O-N 2.89Å; L576-L584 HydrophobicContact CD1-CD1 3.79Å; L576-L584 HydrophobicContact CD2-CD1 4.39Å; L576-L584 HydrophobicContact CG-CD1 4.02Å; L576-L734 HydrophobicContact CB-CD2 3.98Å; L576-L734 HydrophobicContact CD2-CD2 3.5Å; L576-L734 VanDerWaalsContact CD2-CD2 3.5Å; L576-L734 HydrophobicContact CG-CD2 3.84Å
577	G	86	Confident	88.2	Confident	25 Å²	25	57.4 Å²	57.4	26%	0.258	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-13.6	166.9	0	0	0	0	0	114.9	I573 N574 L575 R730	I573-G577 PolarHBondContact O-N 3.28Å; N574-G577 PolarHBondContact O-N 3.26Å; L575-G577 PolarHBondContact O-N 3.3Å; G577-R730 PolarHBondContact O-NH1 2.96Å; G577-R730 PolarHBondContact O-NH2 3.43Å
578	G	85.1	Confident	88.3	Confident	62 Å²	62	50 Å²	50	64%	0.639	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-6	175.7	0	0	0	0	0	115.2	L575 L576	L575-G578 WeakPolarHBondContact O-CA 3.39Å; L575-G578 PolarHBondContact O-N 3Å; L576-G578 PolarHBondContact O-N 2.99Å
579	V	86.7	Confident	88.5	Confident	13 Å²	13	50.4 Å²	50.4	8%	0.079	28%	0.281	C	S	.	.	S	Bend	trans	-73.9	140.9	-173.5	174.5	0	0	0	0	111.5	P541 V542 L575 L576 H583 L584	P541-V579 HydrophobicContact CB-CG1 3.61Å; P541-V579 HydrophobicContact CB-CG2 4.2Å; P541-V579 HydrophobicContact CG-CG1 4.3Å; V542-V579 HydrophobicContact CG2-CG2 4.19Å; L575-V579 PolarHBondContact O-N 3.49Å; L576-V579 HydrophobicContact CD1-CG2 4.08Å; L576-V579 PolarHBondContact O-N 2.89Å; V579-H583 HydrophobicContact CG1-CB 3.94Å; V579-L584 HydrophobicContact CG1-CB 4.32Å
580	P	86.6	Confident	88.7	Confident	80 Å²	80	54.7 Å²	54.7	52%	0.519	30%	0.304	S	S	.	.			trans	-58.6	148.7	173.9	-24.3	34.6	0	0	0	113.1	E582 H583 L584	P580-E582 PolarHBondContact O-N 3.23Å; P580-H583 PolarHBondContact O-N 3.36Å; P580-L584 PolarHBondContact O-N 3.46Å
581	K	88	Confident	88.8	Confident	66 Å²	66	51.3 Å²	51.3	29%	0.287	29%	0.286	S	S	.	.	H	α-helix	trans	-56.5	-46.4	-171.3	-49.1	-167.6	178.5	-176.8	0	113.6	L584 L585 W726	K581-L584 PolarHBondContact O-N 3.49Å; K581-L585 WeakPolarHBondContact O-CG 3.35Å; K581-L585 PolarHBondContact O-N 3.49Å; K581-W726 HydrophobicContact CB-CD2 4.5Å; K581-W726 HydrophobicContact CB-CH2 3.83Å; K581-W726 HydrophobicContact CB-CZ2 3.73Å; K581-W726 HydrophobicContact CB-CZ3 4.26Å; K581-W726 HydrophobicContact CD-CD2 3.73Å; K581-W726 HydrophobicContact CD-CE3 4.14Å; K581-W726 HydrophobicContact CD-CG 3.95Å; K581-W726 HydrophobicContact CD-CZ2 4.41Å; K581-W726 HydrophobicContact CG-CD2 3.94Å; K581-W726 HydrophobicContact CG-CE3 4.45Å; K581-W726 HydrophobicContact CG-CG 4.42Å; K581-W726 HydrophobicContact CG-CH2 4.23Å; K581-W726 HydrophobicContact CG-CZ2 3.71Å
582	E	86.9	Confident	88.9	Confident	141 Å²	141	48.9 Å²	48.9	66%	0.659	27%	0.27	S	S	*	.	H	α-helix	trans	-63.3	-43.7	-177.1	-63.2	174.5	-169.1	0	0	112.1	P580 L584 L585 N586	P580-E582 PolarHBondContact O-N 3.23Å; E582-L584 PolarHBondContact O-N 2.86Å; E582-L585 PolarHBondContact O-N 2.92Å; E582-N586 VanDerWaalsContact O-CG 3.24Å; E582-N586 PolarHBondContact O-N 2.98Å; E582-N586 PolarHBondContact O-OD1 2.77Å
583	H	89.4	Confident	88.9	Confident	103 Å²	103	52.2 Å²	52.2	48%	0.477	29%	0.288	S	S	.	.	H	α-helix	trans	-67.3	-37.3	179.8	-65.7	-51.4	0	0	0	112.4	P541 V579 P580 S587	P541-H583 HydrophobicContact CB-CB 4.19Å; P541-H583 HydrophobicContact CG-CB 4.31Å; V579-H583 HydrophobicContact CG1-CB 3.94Å; P580-H583 PolarHBondContact O-N 3.36Å; H583-S587 WeakPolarHBondContact O-CB 3.44Å; H583-S587 PolarHBondContact O-N 3.18Å; H583-S587 VanDerWaalsContact O-N 3.09Å; H583-S587 PolarHBondContact O-OG 3Å
584	L	89.7	Confident	89	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-66.2	-46.1	175.4	-175.1	62.7	0	0	0	110.8	L576 V579 P580 K581 E582 N586 S587 V588 W726 R730 F733	L576-L584 HydrophobicContact CD1-CD1 3.79Å; L576-L584 HydrophobicContact CD2-CD1 4.39Å; L576-L584 HydrophobicContact CG-CD1 4.02Å; V579-L584 HydrophobicContact CG1-CB 4.32Å; P580-L584 PolarHBondContact O-N 3.46Å; K581-L584 PolarHBondContact O-N 3.49Å; E582-L584 PolarHBondContact O-N 2.86Å; L584-N586 PolarHBondContact O-N 3.16Å; L584-S587 PolarHBondContact O-N 3.49Å; L584-V588 HydrophobicContact CD1-CG2 4.46Å; L584-V588 VanDerWaalsContact O-CG2 3.3Å; L584-V588 WeakPolarHBondContact O-CG2 3.33Å; L584-V588 PolarHBondContact O-N 3.14Å; L584-W726 HydrophobicContact CD2-CH2 4.08Å; L584-W726 HydrophobicContact CD2-CZ2 3.99Å; L584-R730 HydrophobicContact CD2-CG 4.19Å; L584-F733 HydrophobicContact CD1-CE1 4.41Å
585	L	89.7	Confident	89	Confident	18 Å²	18	47.5 Å²	47.5	9%	0.094	26%	0.261	C	S	.	.	H	α-helix	trans	-59.7	-47.3	178.2	-76.6	169.1	0	0	0	112.3	K581 E582 S587 V588 Q589 Y636 L639 C643 W726	K581-L585 WeakPolarHBondContact O-CG 3.35Å; K581-L585 PolarHBondContact O-N 3.49Å; E582-L585 PolarHBondContact O-N 2.92Å; L585-S587 VanDerWaalsContact C-N 3.31Å; L585-S587 PolarHBondContact O-N 3.23Å; L585-V588 PolarHBondContact O-N 3.16Å; L585-Q589 PolarHBondContact O-N 3.2Å; L585-Y636 HydrophobicContact CB-CE2 4.49Å; L585-Y636 HydrophobicContact CD2-CD2 4.28Å; L585-Y636 HydrophobicContact CD2-CE2 4.32Å; L585-L639 HydrophobicContact CD2-CB 3.65Å; L585-C643 HydrophobicContact CD1-CB 3.95Å; L585-W726 HydrophobicContact CG-CH2 4.44Å; L585-W726 HydrophobicContact CG-CZ3 4.48Å
586	N	91.2	Very high	89	Confident	86 Å²	86	47.7 Å²	47.7	46%	0.46	26%	0.262	S	S	.	.	H	α-helix	trans	-60.8	-42	177.6	-68	-6.1	0	0	0	111.3	E582 L584 V588 Q589 D590	E582-N586 VanDerWaalsContact O-CG 3.24Å; E582-N586 PolarHBondContact O-N 2.98Å; E582-N586 PolarHBondContact O-OD1 2.77Å; L584-N586 PolarHBondContact O-N 3.16Å; N586-V588 VanDerWaalsContact C-N 3.34Å; N586-V588 PolarHBondContact O-N 3.14Å; N586-Q589 WeakPolarHBondContact O-CB 3.42Å; N586-Q589 PolarHBondContact O-N 2.97Å; N586-D590 WeakPolarHBondContact O-CB 3.37Å; N586-D590 PolarHBondContact O-N 2.86Å
587	S	90.2	Very high	89	Confident	8 Å²	8	54.8 Å²	54.8	6%	0.056	29%	0.293	C	S	.	.	H	α-helix	trans	-68.5	-33.5	-179.5	-54.4	0	0	0	0	112.9	P541 H583 L584 L585 A591	P541-S587 VanDerWaalsContact CD-OG 3.23Å; P541-S587 WeakPolarHBondContact CD-OG 3.48Å; P541-S587 WeakPolarHBondContact CG-OG 3.31Å; H583-S587 WeakPolarHBondContact O-CB 3.44Å; H583-S587 PolarHBondContact O-N 3.18Å; H583-S587 VanDerWaalsContact O-N 3.09Å; H583-S587 PolarHBondContact O-OG 3Å; L584-S587 PolarHBondContact O-N 3.49Å; L585-S587 VanDerWaalsContact C-N 3.31Å; L585-S587 PolarHBondContact O-N 3.23Å; S587-A591 VanDerWaalsContact O-CB 3.28Å; S587-A591 WeakPolarHBondContact O-CB 3.5Å; S587-A591 PolarHBondContact O-N 3.29Å
588	V	91.1	Very high	88.8	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-70.4	-37.6	174.1	176.7	0	0	0	0	110.7	L584 L585 N586 A591 Y592 T632 Y636 L639 F733	L584-V588 HydrophobicContact CD1-CG2 4.46Å; L584-V588 VanDerWaalsContact O-CG2 3.3Å; L584-V588 WeakPolarHBondContact O-CG2 3.33Å; L584-V588 PolarHBondContact O-N 3.14Å; L585-V588 PolarHBondContact O-N 3.16Å; N586-V588 VanDerWaalsContact C-N 3.34Å; N586-V588 PolarHBondContact O-N 3.14Å; V588-A591 PolarHBondContact O-N 3.03Å; V588-Y592 PolarHBondContact O-N 2.78Å; V588-T632 HydrophobicContact CG1-CG2 3.86Å; V588-Y636 HydrophobicContact CG1-CD2 4.42Å; V588-L639 HydrophobicContact CG2-CD1 4.46Å; V588-F733 HydrophobicContact CG2-CE1 4.02Å; V588-F733 HydrophobicContact CG2-CE2 4.46Å; V588-F733 HydrophobicContact CG2-CZ 3.61Å
589	Q	91	Very high	88.4	Confident	73 Å²	73	53 Å²	53	34%	0.341	26%	0.262	S	S	.	.	H	α-helix	trans	-64.8	-48.5	173.9	-174.8	173.8	-15.6	0	0	111.8	L585 N586 A591 Y592 D593 Y636	L585-Q589 PolarHBondContact O-N 3.2Å; N586-Q589 WeakPolarHBondContact O-CB 3.42Å; N586-Q589 PolarHBondContact O-N 2.97Å; Q589-A591 PolarHBondContact O-N 3.27Å; Q589-Y592 WeakPolarHBondContact O-CB 3.22Å; Q589-Y592 PolarHBondContact O-N 3.19Å; Q589-D593 PolarHBondContact O-N 3.28Å; Q589-Y636 HydrophobicContact CB-CD2 4.1Å; Q589-Y636 HydrophobicContact CB-CE2 3.74Å; Q589-Y636 HydrophobicContact CG-CE2 4.36Å; Q589-Y636 PolarHBondContact OE1-OH 2.87Å
590	D	91.4	Very high	87.9	Confident	91 Å²	91	54.6 Å²	54.6	49%	0.487	28%	0.277	S	S	.	.	H	α-helix	trans	-58.1	-37.4	176	-67.9	-23.2	0	0	0	111.3	I537 N586 F594	I537-D590 HydrophobicContact CG2-CB 3.74Å; N586-D590 WeakPolarHBondContact O-CB 3.37Å; N586-D590 PolarHBondContact O-N 2.86Å; D590-F594 WeakPolarHBondContact O-CB 3.43Å; D590-F594 PolarHBondContact O-N 3.47Å
591	A	91.3	Very high	87.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-68.4	-37.8	177.1	0	0	0	0	0	112.4	I537 I538 S587 V588 Q589 L595	I537-A591 HydrophobicContact CB-CB 4.23Å; I537-A591 HydrophobicContact CG2-CB 3.88Å; I538-A591 HydrophobicContact CD1-CB 4.33Å; I538-A591 HydrophobicContact CG1-CB 3.72Å; S587-A591 VanDerWaalsContact O-CB 3.28Å; S587-A591 WeakPolarHBondContact O-CB 3.5Å; S587-A591 PolarHBondContact O-N 3.29Å; V588-A591 PolarHBondContact O-N 3.03Å; Q589-A591 PolarHBondContact O-N 3.27Å; A591-L595 WeakPolarHBondContact O-CG 3.44Å; A591-L595 PolarHBondContact O-N 3.08Å; A591-L595 VanDerWaalsContact O-N 3.14Å
592	Y	90.5	Very high	85.8	Confident	46 Å²	46	49.5 Å²	49.5	18%	0.18	25%	0.25	C	S	.	.	H	α-helix	trans	-65.6	-48.9	172.6	165.2	-100.3	0	0	0	111.6	V588 Q589 F594 L595 L596 A629 L633	V588-Y592 PolarHBondContact O-N 2.78Å; Q589-Y592 WeakPolarHBondContact O-CB 3.22Å; Q589-Y592 PolarHBondContact O-N 3.19Å; Y592-F594 VanDerWaalsContact C-N 3.25Å; Y592-F594 PolarHBondContact O-N 2.93Å; Y592-L595 PolarHBondContact O-N 3.13Å; Y592-L595 VanDerWaalsContact O-N 3.13Å; Y592-L596 HydrophobicContact CE1-CD2 4.4Å; Y592-L596 PolarHBondContact O-N 3.36Å; Y592-A629 HydrophobicContact CD2-CB 4.24Å; Y592-A629 WeakPolarHBondContact CD2-O 3.47Å; Y592-A629 HydrophobicContact CE2-CB 4.32Å; Y592-L633 HydrophobicContact CD1-CD1 4.41Å; Y592-L633 HydrophobicContact CD2-CB 3.83Å; Y592-L633 HydrophobicContact CD2-CD1 4.49Å; Y592-L633 HydrophobicContact CE1-CD1 4.26Å; Y592-L633 HydrophobicContact CE2-CB 3.81Å; Y592-L633 HydrophobicContact CE2-CD1 4.33Å; Y592-L633 HydrophobicContact CE2-CD2 4.05Å; Y592-L633 HydrophobicContact CE2-CG 4.28Å
593	D	90.1	Very high	84.5	Confident	72 Å²	72	48.4 Å²	48.4	39%	0.385	25%	0.248	S	C	.	.	H	α-helix	trans	-61.1	-37	-179.9	-71.7	-22.7	0	0	0	111.4	Q589 K597	Q589-D593 PolarHBondContact O-N 3.28Å; D593-K597 WeakPolarHBondContact O-CB 3.48Å; D593-K597 PolarHBondContact O-N 3.36Å
594	F	90.5	Very high	82.7	Confident	34 Å²	34	49.6 Å²	49.6	15%	0.149	25%	0.254	C	S	.	.	H	α-helix	trans	-61.5	-51.7	172.2	170.5	-102.7	0	0	0	112.3	N533 I537 D590 Y592 L596 K597 E598	N533-F594 HydrophobicContact CB-CE1 3.84Å; N533-F594 HydrophobicContact CB-CZ 3.81Å; N533-F594 WeakPolarHBondContact ND2-CE2 3.39Å; N533-F594 WeakPolarHBondContact ND2-CZ 3.22Å; I537-F594 HydrophobicContact CD1-CB 3.47Å; I537-F594 VanDerWaalsContact CD1-CB 3.47Å; I537-F594 HydrophobicContact CD1-CD1 3.62Å; I537-F594 HydrophobicContact CD1-CD2 3.96Å; I537-F594 HydrophobicContact CD1-CE1 4.41Å; I537-F594 HydrophobicContact CD1-CG 3.36Å; D590-F594 WeakPolarHBondContact O-CB 3.43Å; D590-F594 PolarHBondContact O-N 3.47Å; Y592-F594 VanDerWaalsContact C-N 3.25Å; Y592-F594 PolarHBondContact O-N 2.93Å; F594-L596 VanDerWaalsContact C-N 3.29Å; F594-L596 PolarHBondContact O-N 3.03Å; F594-K597 PolarHBondContact O-N 3.42Å; F594-E598 HydrophobicContact CD2-CG 4.02Å; F594-E598 HydrophobicContact CE1-CG 4.16Å; F594-E598 HydrophobicContact CE2-CG 3.41Å; F594-E598 VanDerWaalsContact CE2-CG 3.41Å; F594-E598 HydrophobicContact CZ-CG 3.48Å; F594-E598 VanDerWaalsContact CZ-CG 3.48Å; F594-E598 WeakPolarHBondContact O-CG 3.32Å; F594-E598 PolarHBondContact O-N 3.43Å
595	L	88	Confident	80.7	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-60.9	-40.4	179.5	-73.8	176.3	0	0	0	111.7	W534 A591 Y592 E598 S599 L625 L628 A629	W534-L595 HydrophobicContact CB-CD2 4.2Å; W534-L595 HydrophobicContact CB-CG 4.43Å; W534-L595 VanDerWaalsContact CD1-CD1 3.41Å; W534-L595 HydrophobicContact CG-CD1 4.12Å; W534-L595 HydrophobicContact CG-CG 4.47Å; A591-L595 WeakPolarHBondContact O-CG 3.44Å; A591-L595 PolarHBondContact O-N 3.08Å; A591-L595 VanDerWaalsContact O-N 3.14Å; Y592-L595 PolarHBondContact O-N 3.13Å; Y592-L595 VanDerWaalsContact O-N 3.13Å; L595-E598 PolarHBondContact O-N 2.89Å; L595-S599 VanDerWaalsContact O-CB 3.29Å; L595-S599 WeakPolarHBondContact O-CB 3.44Å; L595-S599 PolarHBondContact O-N 3.3Å; L595-S599 PolarHBondContact O-OG 2.93Å; L595-L625 HydrophobicContact CD2-CD2 4.18Å; L595-L628 HydrophobicContact CD1-CB 4.35Å; L595-L628 HydrophobicContact CD1-CD2 3.84Å; L595-L628 HydrophobicContact CD1-CG 3.75Å; L595-L628 HydrophobicContact CD2-CD2 4.27Å; L595-A629 HydrophobicContact CB-CB 3.98Å; L595-A629 HydrophobicContact CD1-CB 4.32Å
596	L	87.9	Confident	78.8	Confident	80 Å²	80	61.6 Å²	61.6	42%	0.419	32%	0.321	S	S	.	.	H	α-helix	trans	-63.7	-46.5	177.3	-173.6	66.3	0	0	0	111.1	Y592 F594 E598 S599 A600	Y592-L596 HydrophobicContact CE1-CD2 4.4Å; Y592-L596 PolarHBondContact O-N 3.36Å; F594-L596 VanDerWaalsContact C-N 3.29Å; F594-L596 PolarHBondContact O-N 3.03Å; L596-E598 PolarHBondContact O-N 2.91Å; L596-S599 PolarHBondContact O-N 3.02Å; L596-S599 PolarHBondContact O-OG 3.18Å; L596-A600 WeakPolarHBondContact O-CB 3.33Å; L596-A600 PolarHBondContact O-N 2.97Å
597	K	86.9	Confident	77.1	Confident	151 Å²	151	60.2 Å²	60.2	66%	0.657	31%	0.312	S	S	*	.	H	α-helix	trans	-60.9	-44.8	178.4	-176.2	179.2	178.7	-179.3	0	112.2	D593 F594 A600 S601	D593-K597 WeakPolarHBondContact O-CB 3.48Å; D593-K597 PolarHBondContact O-N 3.36Å; F594-K597 PolarHBondContact O-N 3.42Å; K597-A600 PolarHBondContact O-N 3.42Å; K597-S601 WeakPolarHBondContact O-CB 3.48Å; K597-S601 PolarHBondContact O-N 3.33Å; K597-S601 PolarHBondContact O-OG 2.74Å
598	E	81.8	Confident	75.5	Confident	41 Å²	41	62.3 Å²	62.3	19%	0.192	33%	0.325	C	S	.	.	H	α-helix	trans	-68.5	-42.1	178.3	-67.7	-60.9	145.7	0	0	111.4	Y530 F594 L595 L596 A600 S601 L602	Y530-E598 HydrophobicContact CD1-CB 4.02Å; Y530-E598 HydrophobicContact CD1-CG 4.1Å; Y530-E598 HydrophobicContact CE1-CB 4.05Å; Y530-E598 HydrophobicContact CE1-CG 4.18Å; Y530-E598 WeakPolarHBondContact CE1-OE2 3.46Å; F594-E598 HydrophobicContact CD2-CG 4.02Å; F594-E598 HydrophobicContact CE1-CG 4.16Å; F594-E598 HydrophobicContact CE2-CG 3.41Å; F594-E598 VanDerWaalsContact CE2-CG 3.41Å; F594-E598 HydrophobicContact CZ-CG 3.48Å; F594-E598 VanDerWaalsContact CZ-CG 3.48Å; F594-E598 WeakPolarHBondContact O-CG 3.32Å; F594-E598 PolarHBondContact O-N 3.43Å; L595-E598 PolarHBondContact O-N 2.89Å; L596-E598 PolarHBondContact O-N 2.91Å; E598-A600 PolarHBondContact O-N 2.96Å; E598-S601 PolarHBondContact O-N 2.83Å; E598-S601 PolarHBondContact O-OG 3.04Å; E598-L602 WeakPolarHBondContact O-CD1 3.44Å; E598-L602 WeakPolarHBondContact O-CG 3.36Å; E598-L602 PolarHBondContact O-N 3Å
599	S	77.7	Confident	74	Confident	8 Å²	8	62.5 Å²	62.5	6%	0.056	33%	0.327	C	S	.	.	H	α-helix	trans	-59.7	-34	175.8	74.7	0	0	0	0	112.9	L595 L596 N626	L595-S599 VanDerWaalsContact O-CB 3.29Å; L595-S599 WeakPolarHBondContact O-CB 3.44Å; L595-S599 PolarHBondContact O-N 3.3Å; L595-S599 PolarHBondContact O-OG 2.93Å; L596-S599 PolarHBondContact O-N 3.02Å; L596-S599 PolarHBondContact O-OG 3.18Å; S599-N626 WeakPolarHBondContact CB-OD1 3.18Å; S599-N626 PolarHBondContact OG-OD1 2.94Å
600	A	75.9	Confident	72.4	Confident	48 Å²	48	60 Å²	60	40%	0.397	32%	0.317	S	S	.	.	H	α-helix	trans	-81.1	-41.1	179.6	0	0	0	0	0	113.1	L596 K597 E598 L602 I603	L596-A600 WeakPolarHBondContact O-CB 3.33Å; L596-A600 PolarHBondContact O-N 2.97Å; K597-A600 PolarHBondContact O-N 3.42Å; E598-A600 PolarHBondContact O-N 2.96Å; A600-L602 PolarHBondContact O-N 2.82Å; A600-I603 WeakPolarHBondContact O-CB 3.41Å; A600-I603 WeakPolarHBondContact O-CG1 3.28Å; A600-I603 PolarHBondContact O-N 3.33Å
601	S	70.1	Confident	71.3	Confident	27 Å²	27	62.6 Å²	62.6	19%	0.189	33%	0.33	C	S	.	.	H	α-helix	trans	-60.6	-28.6	179.3	68.1	0	0	0	0	112	K597 E598 I603 Q604	K597-S601 WeakPolarHBondContact O-CB 3.48Å; K597-S601 PolarHBondContact O-N 3.33Å; K597-S601 PolarHBondContact O-OG 2.74Å; E598-S601 PolarHBondContact O-N 2.83Å; E598-S601 PolarHBondContact O-OG 3.04Å; S601-I603 PolarHBondContact O-N 3.22Å; S601-Q604 PolarHBondContact O-N 2.84Å
602	L	61	Low	70.4	Confident	11 Å²	11	64.3 Å²	64.3	6%	0.058	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-11.2	177.1	-68.5	163.8	0	0	0	114.5	Y526 E598 A600 Q604 R622	Y526-L602 WeakPolarHBondContact OH-CD1 3.37Å; Y526-L602 WeakPolarHBondContact OH-CD2 3.38Å; E598-L602 WeakPolarHBondContact O-CD1 3.44Å; E598-L602 WeakPolarHBondContact O-CG 3.36Å; E598-L602 PolarHBondContact O-N 3Å; A600-L602 PolarHBondContact O-N 2.82Å; L602-Q604 VanDerWaalsContact C-N 3.3Å; L602-R622 VanDerWaalsContact C-NH2 3.3Å; L602-R622 PolarHBondContact O-NH2 3.12Å
603	I	58.8	Low	69.7	Low	118 Å²	118	63 Å²	63	61%	0.605	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-30.1	176.4	-61.4	170.2	0	0	0	110.5	A600 S601 S605	A600-I603 WeakPolarHBondContact O-CB 3.41Å; A600-I603 WeakPolarHBondContact O-CG1 3.28Å; A600-I603 PolarHBondContact O-N 3.33Å; S601-I603 PolarHBondContact O-N 3.22Å; I603-S605 PolarHBondContact O-N 2.81Å
604	Q	51.5	Low	69	Low	129 Å²	129	60.1 Å²	60.1	60%	0.603	32%	0.317	S	S	*	.	S	Bend	trans	-82	118.5	-180	-66.5	175.7	4	0	0	108.6	S601 L602 Q606 H607	S601-Q604 PolarHBondContact O-N 2.84Å; L602-Q604 VanDerWaalsContact C-N 3.3Å; Q604-Q606 PolarHBondContact O-N 3.32Å; Q604-H607 PolarHBondContact O-N 3.2Å
605	S	48.1	Very low	68.3	Low	109 Å²	109	63.7 Å²	63.7	76%	0.762	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-3.4	170.5	53.2	0	0	0	0	114.4	I603	I603-S605 PolarHBondContact O-N 2.81Å
606	Q	49.2	Very low	67.8	Low	160 Å²	160	66.7 Å²	66.7	75%	0.748	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-5.4	177	-61.6	-171	-7.6	0	0	113.5	Q604 P608	Q604-Q606 PolarHBondContact O-N 3.32Å; Q606-P608 WeakPolarHBondContact O-CD 3.26Å
607	H	55.2	Low	67.4	Low	57 Å²	57	63 Å²	63	26%	0.264	35%	0.345	S	S	.	.			trans	-67.4	120.7	175.6	-135.7	-79.3	0	0	0	109.1	Q604 T609 S610	Q604-H607 PolarHBondContact O-N 3.2Å; H607-T609 PolarHBondContact ND1-OG1 3.37Å; H607-T609 PolarHBondContact O-N 3.42Å; H607-S610 VanDerWaalsContact O-CB 3.31Å; H607-S610 WeakPolarHBondContact O-CB 2.93Å; H607-S610 PolarHBondContact O-N 3.18Å; H607-S610 PolarHBondContact O-OG 2.85Å
608	P	56.9	Low	67.1	Low	52 Å²	52	57.1 Å²	57.1	34%	0.338	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-62.8	-26.4	-167.7	-22.5	31.6	0	0	0	113.9	R35 Q606	R35-P608 VanDerWaalsContact NH1-CG 3.32Å; Q606-P608 WeakPolarHBondContact O-CD 3.26Å
609	T	59.7	Low	67.1	Low	4 Å²	4	58.2 Å²	58.2	3%	0.025	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-77.2	-20.9	178.9	49.3	0	0	0	0	112.7	H607 L611 W612	H607-T609 PolarHBondContact ND1-OG1 3.37Å; H607-T609 PolarHBondContact O-N 3.42Å; T609-L611 PolarHBondContact O-N 3.29Å; T609-W612 PolarHBondContact O-N 3.23Å
610	S	58.6	Low	67.3	Low	20 Å²	20	61.5 Å²	61.5	14%	0.14	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-62.5	-26	-179.1	67.1	0	0	0	0	112.8	H607 W612 W613	H607-S610 VanDerWaalsContact O-CB 3.31Å; H607-S610 WeakPolarHBondContact O-CB 2.93Å; H607-S610 PolarHBondContact O-N 3.18Å; H607-S610 PolarHBondContact O-OG 2.85Å; S610-W612 PolarHBondContact O-N 2.77Å; S610-W613 PolarHBondContact O-N 3.5Å
611	L	66.7	Low	67.6	Low	147 Å²	147	59.3 Å²	59.3	77%	0.77	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-64.9	-23.1	179.1	-72.3	162.1	0	0	0	113.8	T609	T609-L611 PolarHBondContact O-N 3.29Å
612	W	72.7	Confident	68.2	Low	36 Å²	36	61.3 Å²	61.3	14%	0.136	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-85.8	-24.1	-178.2	-65.2	-21.4	0	0	0	113.3	S31 R35 Q384 F385 P386 T609 S610	S31-W612 PolarHBondContact OG-NE1 3.32Å; R35-W612 HydrophobicContact CB-CH2 3.98Å; R35-W612 HydrophobicContact CB-CZ2 3.66Å; R35-W612 HydrophobicContact CG-CH2 3.68Å; R35-W612 HydrophobicContact CG-CZ2 3.77Å; Q384-W612 HydrophobicContact CB-CZ3 4.4Å; F385-W612 HydrophobicContact CB-CE3 4.21Å; F385-W612 HydrophobicContact CB-CH2 4.29Å; F385-W612 HydrophobicContact CB-CZ3 3.85Å; F385-W612 AromaticContact CD2-CD2 3.66Å; F385-W612 HydrophobicContact CD2-CD2 3.66Å; F385-W612 AromaticContact CD2-CE2 3.67Å; F385-W612 AromaticContact CD2-CE3 3.72Å; F385-W612 HydrophobicContact CD2-CE3 3.72Å; F385-W612 HydrophobicContact CD2-CG 4.3Å; F385-W612 AromaticContact CD2-CH2 3.8Å; F385-W612 HydrophobicContact CD2-CH2 3.8Å; F385-W612 AromaticContact CD2-CZ2 3.75Å; F385-W612 HydrophobicContact CD2-CZ2 3.75Å; F385-W612 AromaticContact CD2-CZ3 3.79Å; F385-W612 HydrophobicContact CD2-CZ3 3.79Å; F385-W612 HydrophobicContact CE2-CD2 4.1Å; F385-W612 AromaticContact CE2-CE2 3.96Å; F385-W612 HydrophobicContact CE2-CG 4.34Å; F385-W612 HydrophobicContact CE2-CZ2 4.31Å; F385-W612 HydrophobicContact CG-CE3 4.41Å; F385-W612 HydrophobicContact CG-CZ3 4.33Å; P386-W612 HydrophobicContact CG-CB 3.67Å; P386-W612 WeakPolarHBondContact CG-O 3.37Å; T609-W612 PolarHBondContact O-N 3.23Å; S610-W612 PolarHBondContact O-N 2.77Å
613	W	76.9	Confident	69.5	Low	19 Å²	19	67.7 Å²	67.7	7%	0.072	36%	0.36	C	S	.	.	S	Bend	trans	-99.4	143.8	-170.5	-60.5	101.1	0	0	0	111.1	Q384 P386 L522 Q525 Y526 S610 T617 L618	Q384-W613 WeakPolarHBondContact O-CZ2 2.98Å; P386-W613 HydrophobicContact CB-CD2 4.41Å; P386-W613 HydrophobicContact CB-CE3 3.96Å; P386-W613 HydrophobicContact CB-CH2 3.77Å; P386-W613 HydrophobicContact CB-CZ2 4.24Å; P386-W613 HydrophobicContact CB-CZ3 3.61Å; P386-W613 HydrophobicContact CG-CD2 4.45Å; P386-W613 HydrophobicContact CG-CE3 4.45Å; P386-W613 HydrophobicContact CG-CZ3 4.47Å; L522-W613 WeakPolarHBondContact O-CZ3 3.34Å; Q525-W613 HydrophobicContact CB-CH2 3.88Å; Q525-W613 HydrophobicContact CB-CZ3 4.42Å; Y526-W613 VanDerWaalsContact CA-CH2 3.49Å; Y526-W613 AromaticContact CD2-CD1 3.98Å; Y526-W613 AromaticContact CD2-CD2 3.66Å; Y526-W613 HydrophobicContact CD2-CD2 3.66Å; Y526-W613 AromaticContact CD2-CE2 3.52Å; Y526-W613 HydrophobicContact CD2-CE3 4.16Å; Y526-W613 AromaticContact CD2-CG 3.98Å; Y526-W613 HydrophobicContact CD2-CG 3.98Å; Y526-W613 HydrophobicContact CD2-CH2 4.36Å; Y526-W613 AromaticContact CD2-CZ2 3.88Å; Y526-W613 HydrophobicContact CD2-CZ2 3.88Å; Y526-W613 HydrophobicContact CD2-CZ3 4.48Å; Y526-W613 AromaticContact CD2-NE1 3.73Å; Y526-W613 HydrophobicContact CE2-CD2 4.44Å; Y526-W613 HydrophobicContact CE2-CG 4.31Å; Y526-W613 HydrophobicContact CG-CD2 4.44Å; Y526-W613 HydrophobicContact CG-CZ2 4.49Å; Y526-W613 VanDerWaalsContact N-CH2 3.31Å; S610-W613 PolarHBondContact O-N 3.5Å; W613-T617 HydrophobicContact CE3-CG2 3.84Å; W613-T617 HydrophobicContact CZ3-CG2 4.28Å; W613-L618 HydrophobicContact CB-CD1 4.15Å; W613-L618 HydrophobicContact CB-CD2 3.67Å; W613-L618 HydrophobicContact CB-CG 3.63Å; W613-L618 HydrophobicContact CG-CD2 4.06Å
614	S	74.5	Confident	70.8	Confident	11 Å²	11	64.1 Å²	64.1	8%	0.077	35%	0.345	C	S	.	.			trans	-65.3	147.7	170.1	79.1	0	0	0	0	110.1	S616 T617 L618	S614-S616 PolarHBondContact O-N 2.69Å; S614-S616 PolarHBondContact OG-OG 3.14Å; S614-T617 PolarHBondContact O-N 2.96Å; S614-T617 WeakPolarHBondContact OG-CB 3.44Å; S614-T617 PolarHBondContact OG-N 2.97Å; S614-T617 VanDerWaalsContact OG-N 3.13Å; S614-T617 PolarHBondContact OG-OG1 3.18Å; S614-L618 PolarHBondContact O-N 3.33Å
615	P	76.5	Confident	72.6	Confident	108 Å²	108	58.1 Å²	58.1	70%	0.701	32%	0.317	S	S	*	.	H	α-helix	trans	-57.1	-30.8	176.7	-26.1	34.8	0	0	0	113.5	S619	P615-S619 PolarHBondContact O-N 2.78Å
616	S	77	Confident	74.5	Confident	64 Å²	64	55.8 Å²	55.8	45%	0.448	30%	0.296	S	S	.	.	H	α-helix	trans	-68.2	-48.5	176.1	52.3	0	0	0	0	111.5	S614 L618 S619 E620	S614-S616 PolarHBondContact O-N 2.69Å; S614-S616 PolarHBondContact OG-OG 3.14Å; S616-L618 VanDerWaalsContact C-N 3.28Å; S616-L618 PolarHBondContact O-N 3.18Å; S616-S619 PolarHBondContact O-N 3.12Å; S616-E620 PolarHBondContact O-N 2.88Å
617	T	79.2	Confident	76.4	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.018	28%	0.28	C	S	.	.	H	α-helix	trans	-59.1	-40.5	176.3	-49	0	0	0	0	111.5	L522 K523 W613 S614 G621	L522-T617 HydrophobicContact CB-CG2 4.44Å; K523-T617 HydrophobicContact CG-CG2 4.27Å; W613-T617 HydrophobicContact CE3-CG2 3.84Å; W613-T617 HydrophobicContact CZ3-CG2 4.28Å; S614-T617 PolarHBondContact O-N 2.96Å; S614-T617 WeakPolarHBondContact OG-CB 3.44Å; S614-T617 PolarHBondContact OG-N 2.97Å; S614-T617 VanDerWaalsContact OG-N 3.13Å; S614-T617 PolarHBondContact OG-OG1 3.18Å; T617-G621 PolarHBondContact O-N 2.82Å
618	L	80.6	Confident	78.1	Confident	28 Å²	28	48.2 Å²	48.2	15%	0.147	27%	0.267	C	S	.	.	H	α-helix	trans	-64.2	-43.4	176.9	-71.4	173.6	0	0	0	112.6	Y526 W613 S614 S616 R622	Y526-L618 HydrophobicContact CD2-CD2 4.43Å; Y526-L618 HydrophobicContact CE2-CD2 3.62Å; W613-L618 HydrophobicContact CB-CD1 4.15Å; W613-L618 HydrophobicContact CB-CD2 3.67Å; W613-L618 HydrophobicContact CB-CG 3.63Å; W613-L618 HydrophobicContact CG-CD2 4.06Å; S614-L618 PolarHBondContact O-N 3.33Å; S616-L618 VanDerWaalsContact C-N 3.28Å; S616-L618 PolarHBondContact O-N 3.18Å; L618-R622 VanDerWaalsContact O-CB 3.27Å; L618-R622 WeakPolarHBondContact O-CB 3.45Å; L618-R622 PolarHBondContact O-N 2.98Å
619	S	81.9	Confident	79.6	Confident	63 Å²	63	45.9 Å²	45.9	44%	0.441	25%	0.252	S	S	.	.	H	α-helix	trans	-62.7	-45.7	179.4	-172.1	0	0	0	0	111.5	P615 S616 K623	P615-S619 PolarHBondContact O-N 2.78Å; S616-S619 PolarHBondContact O-N 3.12Å; S619-K623 WeakPolarHBondContact O-CG 3.15Å; S619-K623 PolarHBondContact O-N 3.4Å; S619-K623 VanDerWaalsContact O-N 3.1Å
620	E	82.4	Confident	81.1	Confident	78 Å²	78	50.6 Å²	50.6	36%	0.364	28%	0.278	S	S	.	.	H	α-helix	trans	-73.1	-44	-178	-166.3	167.4	168.9	0	0	112.4	K523 S616 R622 K623 C624	K523-E620 VanDerWaalsContact CD-CD 3.48Å; K523-E620 HydrophobicContact CD-CG 4.25Å; K523-E620 WeakPolarHBondContact CD-OE1 3.26Å; K523-E620 WeakPolarHBondContact CE-OE1 3.46Å; K523-E620 WeakPolarHBondContact CE-OE2 3.44Å; K523-E620 IonicContact NZ-OE1 2.76Å; K523-E620 PolarHBondContact NZ-OE1 3.1Å; K523-E620 IonicContact NZ-OE2 2.78Å; K523-E620 PolarHBondContact NZ-OE2 3.3Å; S616-E620 PolarHBondContact O-N 2.88Å; E620-R622 VanDerWaalsContact C-N 3.26Å; E620-R622 PolarHBondContact O-N 3.45Å; E620-K623 WeakPolarHBondContact O-CB 3.17Å; E620-K623 PolarHBondContact O-N 3.5Å; E620-K623 VanDerWaalsContact O-N 3.1Å; E620-C624 PolarHBondContact O-N 2.83Å; E620-C624 PolarHBondContact O-SG 3.13Å
621	G	82.2	Confident	82.6	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-56	-41.8	172.9	0	0	0	0	0	112	T617 C624 L625	T617-G621 PolarHBondContact O-N 2.82Å; G621-C624 PolarHBondContact O-N 2.85Å; G621-L625 WeakPolarHBondContact O-CG 3.38Å; G621-L625 PolarHBondContact O-N 3.4Å
622	R	83.6	Confident	83.7	Confident	70 Å²	70	44.2 Å²	44.2	26%	0.264	25%	0.245	S	C	.	.	H	α-helix	trans	-63.9	-42.6	175.3	-170.7	-175.5	-59.6	171.9	1.7	112.5	L602 L618 E620 C624 L625 N626	L602-R622 VanDerWaalsContact C-NH2 3.3Å; L602-R622 PolarHBondContact O-NH2 3.12Å; L618-R622 VanDerWaalsContact O-CB 3.27Å; L618-R622 WeakPolarHBondContact O-CB 3.45Å; L618-R622 PolarHBondContact O-N 2.98Å; E620-R622 VanDerWaalsContact C-N 3.26Å; E620-R622 PolarHBondContact O-N 3.45Å; R622-C624 VanDerWaalsContact C-N 3.3Å; R622-C624 PolarHBondContact O-N 3.48Å; R622-L625 PolarHBondContact O-N 2.83Å; R622-N626 WeakPolarHBondContact O-CB 3.41Å; R622-N626 VanDerWaalsContact O-CG 3.3Å; R622-N626 PolarHBondContact O-N 3.45Å
623	K	87	Confident	84.5	Confident	144 Å²	144	45.5 Å²	45.5	63%	0.626	25%	0.254	S	S	*	.	H	α-helix	trans	-59.1	-43.5	175.8	-72.4	173.6	-175.1	177.8	0	111.1	S619 E620 N626 S627	S619-K623 WeakPolarHBondContact O-CG 3.15Å; S619-K623 PolarHBondContact O-N 3.4Å; S619-K623 VanDerWaalsContact O-N 3.1Å; E620-K623 WeakPolarHBondContact O-CB 3.17Å; E620-K623 PolarHBondContact O-N 3.5Å; E620-K623 VanDerWaalsContact O-N 3.1Å; K623-N626 PolarHBondContact O-N 3.06Å; K623-S627 WeakPolarHBondContact O-CB 3.43Å; K623-S627 PolarHBondContact O-N 2.73Å
624	C	87.3	Confident	85.2	Confident	44 Å²	44	47.2 Å²	47.2	30%	0.297	27%	0.269	S	S	.	.	H	α-helix	trans	-64.1	-44.1	176.4	-68	0	0	0	0	112.3	L527 E620 G621 R622 S627 L628	L527-C624 HydrophobicContact CD1-CB 4.21Å; L527-C624 HydrophobicContact CD2-CB 3.95Å; E620-C624 PolarHBondContact O-N 2.83Å; E620-C624 PolarHBondContact O-SG 3.13Å; G621-C624 PolarHBondContact O-N 2.85Å; R622-C624 VanDerWaalsContact C-N 3.3Å; R622-C624 PolarHBondContact O-N 3.48Å; C624-S627 PolarHBondContact O-N 2.92Å; C624-L628 PolarHBondContact O-N 3.26Å
625	L	87.7	Confident	86	Confident	2 Å²	2	48 Å²	48	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-65.4	-40.2	177.3	-69.1	176.3	0	0	0	112.5	Y526 L527 Y530 L595 G621 R622 L628 A629	Y526-L625 HydrophobicContact CE1-CD1 4.3Å; L527-L625 HydrophobicContact CD2-CD2 3.96Å; L527-L625 HydrophobicContact CD2-CG 3.93Å; Y530-L625 HydrophobicContact CD1-CD1 4.49Å; Y530-L625 HydrophobicContact CD2-CD1 4.02Å; Y530-L625 HydrophobicContact CG-CD1 3.98Å; Y530-L625 HydrophobicContact CG-CD2 4.39Å; L595-L625 HydrophobicContact CD2-CD2 4.18Å; G621-L625 WeakPolarHBondContact O-CG 3.38Å; G621-L625 PolarHBondContact O-N 3.4Å; R622-L625 PolarHBondContact O-N 2.83Å; L625-L628 PolarHBondContact O-N 2.85Å; L625-A629 WeakPolarHBondContact O-CB 3.21Å; L625-A629 PolarHBondContact O-N 2.92Å
626	N	88.4	Confident	86.6	Confident	60 Å²	60	45.6 Å²	45.6	32%	0.321	25%	0.248	S	C	.	.	H	α-helix	trans	-64.3	-44.3	174.6	-73.3	-6.4	0	0	0	111.2	S599 R622 K623 L628 A629 D630	S599-N626 WeakPolarHBondContact CB-OD1 3.18Å; S599-N626 PolarHBondContact OG-OD1 2.94Å; R622-N626 WeakPolarHBondContact O-CB 3.41Å; R622-N626 VanDerWaalsContact O-CG 3.3Å; R622-N626 PolarHBondContact O-N 3.45Å; K623-N626 PolarHBondContact O-N 3.06Å; N626-L628 VanDerWaalsContact C-N 3.28Å; N626-L628 PolarHBondContact O-N 2.94Å; N626-A629 WeakPolarHBondContact O-CB 3.32Å; N626-A629 PolarHBondContact O-N 2.88Å; N626-A629 VanDerWaalsContact O-N 3.1Å; N626-D630 VanDerWaalsContact O-CG 3.25Å; N626-D630 PolarHBondContact O-N 3.22Å
627	S	89.9	Confident	87.2	Confident	58 Å²	58	46 Å²	46	41%	0.406	25%	0.247	S	C	.	.	H	α-helix	trans	-60.2	-38.2	175	180	0	0	0	0	112.2	K623 C624 S631	K623-S627 WeakPolarHBondContact O-CB 3.43Å; K623-S627 PolarHBondContact O-N 2.73Å; C624-S627 PolarHBondContact O-N 2.92Å; S627-S631 WeakPolarHBondContact O-CB 3.32Å; S627-S631 PolarHBondContact O-N 2.9Å; S627-S631 PolarHBondContact O-OG 2.97Å
628	L	89.9	Confident	87.7	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67	-41.4	173.4	-178.9	63.3	0	0	0	111.8	V531 W534 L595 C624 L625 N626 S631 T632 W736 K740 L744	V531-L628 HydrophobicContact CG2-CD2 4.14Å; W534-L628 HydrophobicContact CD2-CD2 4.21Å; W534-L628 HydrophobicContact CG-CD2 4.34Å; W534-L628 HydrophobicContact CH2-CD1 4.45Å; W534-L628 HydrophobicContact CZ2-CD1 4.12Å; L595-L628 HydrophobicContact CD1-CB 4.35Å; L595-L628 HydrophobicContact CD1-CD2 3.84Å; L595-L628 HydrophobicContact CD1-CG 3.75Å; L595-L628 HydrophobicContact CD2-CD2 4.27Å; C624-L628 PolarHBondContact O-N 3.26Å; L625-L628 PolarHBondContact O-N 2.85Å; N626-L628 VanDerWaalsContact C-N 3.28Å; N626-L628 PolarHBondContact O-N 2.94Å; L628-S631 PolarHBondContact O-N 2.99Å; L628-T632 WeakPolarHBondContact O-CB 3.11Å; L628-T632 PolarHBondContact O-N 2.99Å; L628-T632 PolarHBondContact O-OG1 3.29Å; L628-W736 HydrophobicContact CD1-CH2 4.21Å; L628-W736 HydrophobicContact CD1-CZ2 4.37Å; L628-K740 HydrophobicContact CD1-CG 3.86Å; L628-L744 HydrophobicContact CB-CD1 4.44Å; L628-L744 HydrophobicContact CD1-CD1 3.92Å; L628-L744 HydrophobicContact CD2-CD1 3.84Å; L628-L744 HydrophobicContact CG-CD1 4.28Å
629	A	89.4	Confident	88	Confident	3 Å²	3	49.4 Å²	49.4	3%	0.025	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-48.4	176.4	0	0	0	0	0	111.1	Y592 L595 L625 N626 S631 T632 L633	Y592-A629 HydrophobicContact CD2-CB 4.24Å; Y592-A629 WeakPolarHBondContact CD2-O 3.47Å; Y592-A629 HydrophobicContact CE2-CB 4.32Å; L595-A629 HydrophobicContact CB-CB 3.98Å; L595-A629 HydrophobicContact CD1-CB 4.32Å; L625-A629 WeakPolarHBondContact O-CB 3.21Å; L625-A629 PolarHBondContact O-N 2.92Å; N626-A629 WeakPolarHBondContact O-CB 3.32Å; N626-A629 PolarHBondContact O-N 2.88Å; N626-A629 VanDerWaalsContact O-N 3.1Å; A629-S631 VanDerWaalsContact C-N 3.33Å; A629-S631 PolarHBondContact O-N 3.49Å; A629-T632 WeakPolarHBondContact O-CB 3.49Å; A629-T632 PolarHBondContact O-N 3.2Å; A629-T632 VanDerWaalsContact O-N 3.14Å; A629-L633 PolarHBondContact O-N 3.1Å
630	D	90.7	Very high	88.3	Confident	104 Å²	104	47.7 Å²	47.7	56%	0.556	25%	0.249	S	C	*	.	H	α-helix	trans	-60.2	-43	177.3	-66.2	-25.9	0	0	0	111.5	N626 L633 S634	N626-D630 VanDerWaalsContact O-CG 3.25Å; N626-D630 PolarHBondContact O-N 3.22Å; D630-L633 PolarHBondContact O-N 2.88Å; D630-S634 PolarHBondContact O-N 2.8Å
631	S	90.8	Very high	88.5	Confident	33 Å²	33	48.8 Å²	48.8	23%	0.231	26%	0.255	C	S	.	.	H	α-helix	trans	-64.8	-40.9	175.9	-58.8	0	0	0	0	111.7	S627 L628 A629 S634 W635	S627-S631 WeakPolarHBondContact O-CB 3.32Å; S627-S631 PolarHBondContact O-N 2.9Å; S627-S631 PolarHBondContact O-OG 2.97Å; L628-S631 PolarHBondContact O-N 2.99Å; A629-S631 VanDerWaalsContact C-N 3.33Å; A629-S631 PolarHBondContact O-N 3.49Å; S631-S634 WeakPolarHBondContact O-CB 3.4Å; S631-S634 PolarHBondContact O-N 3.47Å; S631-W635 PolarHBondContact O-N 3.09Å
632	T	89.3	Confident	88.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.7	-40.3	177.3	-56.5	0	0	0	0	110.9	W534 V588 L628 A629 W635 Y636	W534-T632 PolarHBondContact NE1-OG1 3.37Å; V588-T632 HydrophobicContact CG1-CG2 3.86Å; L628-T632 WeakPolarHBondContact O-CB 3.11Å; L628-T632 PolarHBondContact O-N 2.99Å; L628-T632 PolarHBondContact O-OG1 3.29Å; A629-T632 WeakPolarHBondContact O-CB 3.49Å; A629-T632 PolarHBondContact O-N 3.2Å; A629-T632 VanDerWaalsContact O-N 3.14Å; T632-W635 PolarHBondContact O-N 3.34Å; T632-Y636 PolarHBondContact O-N 2.77Å
633	L	90.4	Very high	88.6	Confident	63 Å²	63	46.6 Å²	46.6	33%	0.33	25%	0.25	S	S	.	.	H	α-helix	trans	-65.7	-40.8	174.3	-176.9	65.3	0	0	0	112	Y592 A629 D630 W635 Y636 T637	Y592-L633 HydrophobicContact CD1-CD1 4.41Å; Y592-L633 HydrophobicContact CD2-CB 3.83Å; Y592-L633 HydrophobicContact CD2-CD1 4.49Å; Y592-L633 HydrophobicContact CE1-CD1 4.26Å; Y592-L633 HydrophobicContact CE2-CB 3.81Å; Y592-L633 HydrophobicContact CE2-CD1 4.33Å; Y592-L633 HydrophobicContact CE2-CD2 4.05Å; Y592-L633 HydrophobicContact CE2-CG 4.28Å; A629-L633 PolarHBondContact O-N 3.1Å; D630-L633 PolarHBondContact O-N 2.88Å; L633-W635 VanDerWaalsContact C-N 3.29Å; L633-W635 PolarHBondContact O-N 3.35Å; L633-Y636 HydrophobicContact CD1-CD1 4.47Å; L633-Y636 WeakPolarHBondContact O-CB 3.35Å; L633-Y636 PolarHBondContact O-N 2.91Å; L633-T637 WeakPolarHBondContact O-CG2 3.36Å; L633-T637 PolarHBondContact O-N 2.79Å; L633-T637 PolarHBondContact O-OG1 2.87Å
634	S	91.5	Very high	88.2	Confident	54 Å²	54	45.1 Å²	45.1	38%	0.378	25%	0.246	S	C	.	.	H	α-helix	trans	-60.7	-39.6	173.7	-173.6	0	0	0	0	111.7	D630 S631 T637 K638	D630-S634 PolarHBondContact O-N 2.8Å; S631-S634 WeakPolarHBondContact O-CB 3.4Å; S631-S634 PolarHBondContact O-N 3.47Å; S634-T637 PolarHBondContact O-OG1 3.06Å; S634-K638 VanDerWaalsContact O-CG 3.32Å; S634-K638 WeakPolarHBondContact O-CG 3.48Å; S634-K638 PolarHBondContact O-N 3.41Å; S634-K638 VanDerWaalsContact O-N 3.1Å
635	W	90.2	Very high	87.5	Confident	29 Å²	29	47.2 Å²	47.2	11%	0.11	25%	0.251	C	S	.	.	H	α-helix	trans	-70.7	-38.7	174.3	-81.7	111.1	0	0	0	113.2	S631 T632 L633 T637 K638 L639 E732 F733 W736	S631-W635 PolarHBondContact O-N 3.09Å; T632-W635 PolarHBondContact O-N 3.34Å; L633-W635 VanDerWaalsContact C-N 3.29Å; L633-W635 PolarHBondContact O-N 3.35Å; W635-T637 VanDerWaalsContact C-N 3.34Å; W635-T637 PolarHBondContact O-N 2.78Å; W635-K638 HydrophobicContact CE3-CB 4.44Å; W635-K638 HydrophobicContact CE3-CD 4.16Å; W635-K638 HydrophobicContact CZ3-CD 4.31Å; W635-K638 PolarHBondContact O-N 2.8Å; W635-L639 WeakPolarHBondContact O-CB 3.41Å; W635-L639 VanDerWaalsContact O-CG 3.27Å; W635-L639 WeakPolarHBondContact O-CG 3.34Å; W635-L639 PolarHBondContact O-N 2.88Å; W635-E732 HydrophobicContact CH2-CB 3.81Å; W635-E732 HydrophobicContact CZ3-CB 4.19Å; W635-F733 HydrophobicContact CB-CD2 3.69Å; W635-F733 HydrophobicContact CB-CE2 3.83Å; W635-F733 HydrophobicContact CD2-CB 4.37Å; W635-F733 AromaticContact CD2-CD2 3.77Å; W635-F733 HydrophobicContact CD2-CD2 3.77Å; W635-F733 HydrophobicContact CE3-CB 3.79Å; W635-F733 AromaticContact CE3-CD2 3.93Å; W635-F733 HydrophobicContact CE3-CD2 3.93Å; W635-F733 HydrophobicContact CE3-CG 4.34Å; W635-F733 AromaticContact CG-CD2 3.68Å; W635-F733 HydrophobicContact CG-CD2 3.68Å; W635-F733 HydrophobicContact CG-CE2 4.15Å; W635-F733 HydrophobicContact CZ3-CB 3.93Å; W635-W736 AromaticContact CD1-CD2 3.41Å; W635-W736 VanDerWaalsContact CD1-CD2 3.41Å; W635-W736 AromaticContact CD1-CE2 3.53Å; W635-W736 AromaticContact CD1-CE3 3.49Å; W635-W736 VanDerWaalsContact CD1-CE3 3.49Å; W635-W736 AromaticContact CD1-CH2 3.85Å; W635-W736 AromaticContact CD1-CZ2 3.78Å; W635-W736 AromaticContact CD1-CZ3 3.71Å; W635-W736 AromaticContact CE2-CD2 3.86Å; W635-W736 AromaticContact CE2-CG 3.64Å; W635-W736 HydrophobicContact CG-CD2 4.35Å; W635-W736 HydrophobicContact CG-CE3 4.14Å; W635-W736 HydrophobicContact CG-CZ3 4.37Å; W635-W736 HydrophobicContact CZ2-CB 3.66Å; W635-W736 AromaticContact CZ2-CG 3.85Å; W635-W736 HydrophobicContact CZ2-CG 3.85Å; W635-W736 AromaticContact NE1-CD1 3.4Å; W635-W736 AromaticContact NE1-CD2 3.04Å; W635-W736 AromaticContact NE1-CE2 3.28Å; W635-W736 VanDerWaalsContact NE1-CE2 3.28Å; W635-W736 AromaticContact NE1-CE3 3.58Å; W635-W736 AromaticContact NE1-CG 3.15Å; W635-W736 AromaticContact NE1-NE1 3.45Å
636	Y	89.2	Confident	86.3	Confident	57 Å²	57	48.3 Å²	48.3	22%	0.224	26%	0.261	C	S	.	.	H	α-helix	trans	-57	-47.5	173.1	174	-96.8	0	0	0	111.5	L585 V588 Q589 T632 L633 L639 S640	L585-Y636 HydrophobicContact CB-CE2 4.49Å; L585-Y636 HydrophobicContact CD2-CD2 4.28Å; L585-Y636 HydrophobicContact CD2-CE2 4.32Å; V588-Y636 HydrophobicContact CG1-CD2 4.42Å; Q589-Y636 HydrophobicContact CB-CD2 4.1Å; Q589-Y636 HydrophobicContact CB-CE2 3.74Å; Q589-Y636 HydrophobicContact CG-CE2 4.36Å; Q589-Y636 PolarHBondContact OE1-OH 2.87Å; T632-Y636 PolarHBondContact O-N 2.77Å; L633-Y636 HydrophobicContact CD1-CD1 4.47Å; L633-Y636 WeakPolarHBondContact O-CB 3.35Å; L633-Y636 PolarHBondContact O-N 2.91Å; Y636-L639 PolarHBondContact O-N 2.79Å; Y636-S640 VanDerWaalsContact O-CB 3.26Å; Y636-S640 WeakPolarHBondContact O-CB 3.46Å; Y636-S640 PolarHBondContact O-N 2.85Å
637	T	89.9	Confident	85	Confident	71 Å²	71	48.9 Å²	48.9	44%	0.436	27%	0.269	S	S	.	.	H	α-helix	trans	-63.5	-44.4	178.4	54.1	0	0	0	0	111.5	L633 S634 W635 L639 S640 M641	L633-T637 WeakPolarHBondContact O-CG2 3.36Å; L633-T637 PolarHBondContact O-N 2.79Å; L633-T637 PolarHBondContact O-OG1 2.87Å; S634-T637 PolarHBondContact O-OG1 3.06Å; W635-T637 VanDerWaalsContact C-N 3.34Å; W635-T637 PolarHBondContact O-N 2.78Å; T637-L639 PolarHBondContact O-N 2.89Å; T637-S640 PolarHBondContact O-N 2.98Å; T637-M641 VanDerWaalsContact O-CG 3.27Å; T637-M641 WeakPolarHBondContact O-CG 3.38Å; T637-M641 PolarHBondContact O-N 3.16Å
638	K	89.8	Confident	83.4	Confident	104 Å²	104	51.7 Å²	51.7	45%	0.452	28%	0.277	S	S	.	.	H	α-helix	trans	-59.4	-44.4	174.6	-73.7	175.1	-178.3	179.7	0	113.1	S634 W635 A642	S634-K638 VanDerWaalsContact O-CG 3.32Å; S634-K638 WeakPolarHBondContact O-CG 3.48Å; S634-K638 PolarHBondContact O-N 3.41Å; S634-K638 VanDerWaalsContact O-N 3.1Å; W635-K638 HydrophobicContact CE3-CB 4.44Å; W635-K638 HydrophobicContact CE3-CD 4.16Å; W635-K638 HydrophobicContact CZ3-CD 4.31Å; W635-K638 PolarHBondContact O-N 2.8Å; K638-A642 WeakPolarHBondContact O-CB 3.36Å; K638-A642 PolarHBondContact O-N 2.88Å; K638-A642 VanDerWaalsContact O-N 3.09Å
639	L	87.5	Confident	81.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67.9	-38.8	178.2	-72	170.8	0	0	0	111.6	L585 V588 W635 Y636 T637 A642 C643 W726 F733	L585-L639 HydrophobicContact CD2-CB 3.65Å; V588-L639 HydrophobicContact CG2-CD1 4.46Å; W635-L639 WeakPolarHBondContact O-CB 3.41Å; W635-L639 VanDerWaalsContact O-CG 3.27Å; W635-L639 WeakPolarHBondContact O-CG 3.34Å; W635-L639 PolarHBondContact O-N 2.88Å; Y636-L639 PolarHBondContact O-N 2.79Å; T637-L639 PolarHBondContact O-N 2.89Å; L639-A642 PolarHBondContact O-N 3.07Å; L639-C643 WeakPolarHBondContact O-CB 3.03Å; L639-C643 PolarHBondContact O-N 3.23Å; L639-W726 HydrophobicContact CB-CZ3 4.21Å; L639-W726 HydrophobicContact CD2-CH2 4.46Å; L639-W726 HydrophobicContact CD2-CZ3 4.16Å; L639-F733 HydrophobicContact CD1-CB 4.42Å; L639-F733 HydrophobicContact CD1-CD1 4Å; L639-F733 HydrophobicContact CD1-CD2 4.11Å; L639-F733 HydrophobicContact CD1-CE1 4.25Å; L639-F733 HydrophobicContact CD1-CE2 4.35Å; L639-F733 HydrophobicContact CD1-CG 3.91Å; L639-F733 HydrophobicContact CD1-CZ 4.42Å; L639-F733 HydrophobicContact CD2-CB 4.31Å
640	S	87.7	Confident	80.3	Confident	27 Å²	27	63.4 Å²	63.4	19%	0.189	33%	0.333	C	S	.	.	H	α-helix	trans	-64.3	-45.6	177.3	-173.7	0	0	0	0	111.3	Y636 T637 A642 C643 Q644	Y636-S640 VanDerWaalsContact O-CB 3.26Å; Y636-S640 WeakPolarHBondContact O-CB 3.46Å; Y636-S640 PolarHBondContact O-N 2.85Å; T637-S640 PolarHBondContact O-N 2.98Å; S640-A642 PolarHBondContact O-N 2.94Å; S640-C643 WeakPolarHBondContact O-CB 3.5Å; S640-C643 PolarHBondContact O-N 3.36Å; S640-C643 VanDerWaalsContact O-N 3.11Å; S640-Q644 WeakPolarHBondContact O-CG 3.34Å; S640-Q644 PolarHBondContact O-N 3.41Å
641	M	86.8	Confident	78.3	Confident	101 Å²	101	64.8 Å²	64.8	50%	0.498	34%	0.336	S	S	.	.	H	α-helix	trans	-59.3	-47.5	174.6	-68.7	-60	-64.2	0	0	111.8	T637 C643 Q644 E645	T637-M641 VanDerWaalsContact O-CG 3.27Å; T637-M641 WeakPolarHBondContact O-CG 3.38Å; T637-M641 PolarHBondContact O-N 3.16Å; M641-C643 PolarHBondContact O-N 3.5Å; M641-Q644 PolarHBondContact O-N 3.05Å; M641-Q644 VanDerWaalsContact O-N 3.12Å; M641-E645 PolarHBondContact O-N 3.3Å
642	A	83.5	Confident	76.3	Confident	3 Å²	3	67.5 Å²	67.5	3%	0.025	35%	0.347	C	S	.	.	H	α-helix	trans	-64.5	-26.3	176.9	0	0	0	0	0	113.1	K638 L639 S640 A646 Q725 T729	K638-A642 WeakPolarHBondContact O-CB 3.36Å; K638-A642 PolarHBondContact O-N 2.88Å; K638-A642 VanDerWaalsContact O-N 3.09Å; L639-A642 PolarHBondContact O-N 3.07Å; S640-A642 PolarHBondContact O-N 2.94Å; A642-A646 PolarHBondContact O-N 3.15Å; A642-Q725 HydrophobicContact CB-CG 4.29Å; A642-T729 HydrophobicContact CB-CG2 3.98Å; A642-T729 VanDerWaalsContact CB-OG1 3.31Å; A642-T729 WeakPolarHBondContact CB-OG1 3.42Å
643	C	83.1	Confident	74.4	Confident	22 Å²	22	71 Å²	71	15%	0.149	37%	0.372	C	S	.	.	H	α-helix	trans	-73.8	-40.6	173.1	-167.2	0	0	0	0	111.7	L585 L639 S640 M641 A646 S647 W726	L585-C643 HydrophobicContact CD1-CB 3.95Å; L639-C643 WeakPolarHBondContact O-CB 3.03Å; L639-C643 PolarHBondContact O-N 3.23Å; S640-C643 WeakPolarHBondContact O-CB 3.5Å; S640-C643 PolarHBondContact O-N 3.36Å; S640-C643 VanDerWaalsContact O-N 3.11Å; M641-C643 PolarHBondContact O-N 3.5Å; C643-A646 PolarHBondContact O-N 3.11Å; C643-S647 PolarHBondContact O-N 3.27Å; C643-W726 HydrophobicContact CB-CE3 4.13Å; C643-W726 HydrophobicContact CB-CZ3 4.12Å
644	Q	79.5	Confident	72.3	Confident	112 Å²	112	73.8 Å²	73.8	52%	0.523	38%	0.383	S	S	.	.	H	α-helix	trans	-67.6	-42.9	177.6	-70.3	178.7	6.5	0	0	112.4	S640 M641 A646 S647 M648	S640-Q644 WeakPolarHBondContact O-CG 3.34Å; S640-Q644 PolarHBondContact O-N 3.41Å; M641-Q644 PolarHBondContact O-N 3.05Å; M641-Q644 VanDerWaalsContact O-N 3.12Å; Q644-A646 VanDerWaalsContact C-N 3.26Å; Q644-A646 PolarHBondContact O-N 3.5Å; Q644-S647 WeakPolarHBondContact O-CA 3.42Å; Q644-S647 WeakPolarHBondContact O-CB 3.34Å; Q644-S647 PolarHBondContact O-N 3.44Å; Q644-M648 PolarHBondContact O-N 2.9Å
645	E	73.4	Confident	69.8	Low	88 Å²	88	75 Å²	75	41%	0.411	39%	0.39	S	S	.	.	H	α-helix	trans	-59.9	-38	175.8	-73	176.4	-176	0	0	112	M641 S647 M648 N649 Q725	M641-E645 PolarHBondContact O-N 3.3Å; E645-S647 VanDerWaalsContact C-N 3.25Å; E645-S647 PolarHBondContact O-N 3.21Å; E645-M648 PolarHBondContact O-N 2.97Å; E645-N649 WeakPolarHBondContact O-CB 3.32Å; E645-N649 PolarHBondContact O-N 2.67Å; E645-N649 PolarHBondContact O-ND2 3.31Å; E645-Q725 WeakPolarHBondContact OE2-CG 3.49Å
646	A	61.5	Low	67.6	Low	26 Å²	26	79.7 Å²	79.7	22%	0.215	41%	0.413	C	S	.	.	H	α-helix	trans	-66.9	-27	175.2	0	0	0	0	0	113	A642 C643 Q644	A642-A646 PolarHBondContact O-N 3.15Å; C643-A646 PolarHBondContact O-N 3.11Å; Q644-A646 VanDerWaalsContact C-N 3.26Å; Q644-A646 PolarHBondContact O-N 3.5Å
647	S	61.2	Low	65.3	Low	71 Å²	71	84.2 Å²	84.2	50%	0.497	44%	0.437	S	S	.	.	H	α-helix	trans	-80.4	-41.9	174.1	-69.2	0	0	0	0	112	C643 Q644 E645 K650 Q651	C643-S647 PolarHBondContact O-N 3.27Å; Q644-S647 WeakPolarHBondContact O-CA 3.42Å; Q644-S647 WeakPolarHBondContact O-CB 3.34Å; Q644-S647 PolarHBondContact O-N 3.44Å; E645-S647 VanDerWaalsContact C-N 3.25Å; E645-S647 PolarHBondContact O-N 3.21Å; S647-K650 WeakPolarHBondContact O-CB 3.37Å; S647-K650 PolarHBondContact O-N 3.16Å; S647-Q651 PolarHBondContact O-N 3.07Å; S647-Q651 VanDerWaalsContact O-N 3.1Å
648	M	56.4	Low	62.9	Low	117 Å²	117	88.6 Å²	88.6	58%	0.576	45%	0.452	S	S	*	.	H	α-helix	trans	-62.9	-42.6	175.5	-80.5	-164.4	79.7	0	0	112	Q644 E645 K650 Q651 L652	Q644-M648 PolarHBondContact O-N 2.9Å; E645-M648 PolarHBondContact O-N 2.97Å; M648-K650 PolarHBondContact O-N 3.18Å; M648-Q651 PolarHBondContact O-N 3Å; M648-Q651 VanDerWaalsContact O-N 3.11Å; M648-L652 PolarHBondContact O-N 3.31Å
649	N	57.2	Low	60.6	Low	103 Å²	103	91.5 Å²	91.5	55%	0.551	47%	0.467	S	S	*	.	H	α-helix	trans	-64.7	-28.6	176.9	-75.3	-19.6	0	0	0	112.3	E645 S653	E645-N649 WeakPolarHBondContact O-CB 3.32Å; E645-N649 PolarHBondContact O-N 2.67Å; E645-N649 PolarHBondContact O-ND2 3.31Å; N649-S653 VanDerWaalsContact O-CB 3.26Å; N649-S653 WeakPolarHBondContact O-CB 3.28Å; N649-S653 PolarHBondContact O-N 3.36Å; N649-S653 PolarHBondContact O-OG 3.27Å
650	K	55.9	Low	58.1	Low	147 Å²	147	95.7 Å²	95.7	64%	0.639	50%	0.497	S	S	*	.	H	α-helix	trans	-71.9	-36.4	174.1	-134.2	176.8	-175.9	-176.2	0	112	S647 M648 Q654	S647-K650 WeakPolarHBondContact O-CB 3.37Å; S647-K650 PolarHBondContact O-N 3.16Å; M648-K650 PolarHBondContact O-N 3.18Å; K650-Q654 WeakPolarHBondContact O-CB 3.41Å; K650-Q654 WeakPolarHBondContact O-CG 3.14Å; K650-Q654 PolarHBondContact O-N 3.13Å; K650-Q654 VanDerWaalsContact O-N 3.1Å
651	Q	49.7	Very low	55.5	Low	132 Å²	132	99.6 Å²	99.6	62%	0.617	52%	0.52	S	S	*	.	H	α-helix	trans	-71.8	-42.5	175.3	-71.9	-178.3	-24.7	0	0	112.3	S647 M648 S653 Q654 C655	S647-Q651 PolarHBondContact O-N 3.07Å; S647-Q651 VanDerWaalsContact O-N 3.1Å; M648-Q651 PolarHBondContact O-N 3Å; M648-Q651 VanDerWaalsContact O-N 3.11Å; Q651-S653 PolarHBondContact O-N 2.87Å; Q651-Q654 PolarHBondContact O-N 2.72Å; Q651-C655 PolarHBondContact O-N 3.13Å
652	L	47.9	Very low	53	Low	90 Å²	90	102.1 Å²	102.1	47%	0.471	54%	0.535	S	S	.	.	H	α-helix	trans	-64.5	-39.4	173.8	-95.3	104.5	0	0	0	112.2	M648 Q654 C655 H656	M648-L652 PolarHBondContact O-N 3.31Å; L652-Q654 VanDerWaalsContact C-N 3.33Å; L652-Q654 PolarHBondContact O-N 3.21Å; L652-C655 PolarHBondContact O-N 2.91Å; L652-H656 PolarHBondContact O-CD2 3.02Å; L652-H656 PolarHBondContact O-N 3.04Å
653	S	50.6	Low	50.7	Low	74 Å²	74	109.9 Å²	109.9	52%	0.517	58%	0.576	S	S	.	*	H	α-helix	trans	-68.8	-31	178.1	-54.9	0	0	0	0	112.6	N649 Q651 Q657	N649-S653 VanDerWaalsContact O-CB 3.26Å; N649-S653 WeakPolarHBondContact O-CB 3.28Å; N649-S653 PolarHBondContact O-N 3.36Å; N649-S653 PolarHBondContact O-OG 3.27Å; Q651-S653 PolarHBondContact O-N 2.87Å; S653-Q657 PolarHBondContact O-N 2.83Å
654	Q	45.2	Very low	48.2	Very low	121 Å²	121	116.2 Å²	116.2	57%	0.565	61%	0.608	S	S	*	*	H	α-helix	trans	-76	-38.6	174.3	-78.8	178	-28.8	0	0	112.4	K650 Q651 L652 H656 Q657 E658	K650-Q654 WeakPolarHBondContact O-CB 3.41Å; K650-Q654 WeakPolarHBondContact O-CG 3.14Å; K650-Q654 PolarHBondContact O-N 3.13Å; K650-Q654 VanDerWaalsContact O-N 3.1Å; Q651-Q654 PolarHBondContact O-N 2.72Å; L652-Q654 VanDerWaalsContact C-N 3.33Å; L652-Q654 PolarHBondContact O-N 3.21Å; Q654-H656 VanDerWaalsContact C-N 3.32Å; Q654-H656 PolarHBondContact O-N 2.84Å; Q654-Q657 PolarHBondContact O-N 3.02Å; Q654-E658 PolarHBondContact O-N 2.83Å
655	C	39.7	Very low	46.1	Very low	79 Å²	79	117.1 Å²	117.1	53%	0.534	62%	0.622	S	S	.	*	H	α-helix	trans	-66.4	-31	174.1	-82.1	0	0	0	0	113.4	Q651 L652	Q651-C655 PolarHBondContact O-N 3.13Å; L652-C655 PolarHBondContact O-N 2.91Å
656	H	43.1	Very low	44.2	Very low	128 Å²	128	119.8 Å²	119.8	59%	0.593	64%	0.638	S	S	*	*	H	α-helix	trans	-80.7	-15.1	176.3	-75.5	-55.7	0	0	0	114.4	L652 Q654	L652-H656 PolarHBondContact O-CD2 3.02Å; L652-H656 PolarHBondContact O-N 3.04Å; Q654-H656 VanDerWaalsContact C-N 3.32Å; Q654-H656 PolarHBondContact O-N 2.84Å
657	Q	41.5	Very low	42.7	Very low	152 Å²	152	124.1 Å²	124.1	71%	0.71	66%	0.662	S	S	*	*	H	α-helix	trans	-92.1	-13.4	176.7	-116.8	171.9	-1	0	0	114	S653 Q654	S653-Q657 PolarHBondContact O-N 2.83Å; Q654-Q657 PolarHBondContact O-N 3.02Å
658	E	39.1	Very low	41.3	Very low	164 Å²	164	126.4 Å²	126.4	77%	0.766	67%	0.673	S	S	*	*	S	Bend	trans	-103.4	2.3	177.9	-69.8	-178.1	166.9	0	0	113.5	Q654	Q654-E658 PolarHBondContact O-N 2.83Å
659	Q	41.4	Very low	40	Very low	165 Å²	165	126.6 Å²	126.6	77%	0.771	68%	0.681	S	S	*	*	S	Bend	trans	-116.8	12.9	179.3	-74.1	-174.6	-10.9	0	0	114.6
660	S	35.8	Very low	38.9	Very low	88 Å²	88	126.9 Å²	126.9	62%	0.615	70%	0.698	S	S	*	*			trans	-131.8	37.7	-176.5	70.7	0	0	0	0	113.9
661	T	32.9	Very low	37.6	Very low	109 Å²	109	128.1 Å²	128.1	67%	0.669	71%	0.706	S	S	*	*			trans	-129.6	67.5	170.1	57.9	0	0	0	0	109.1
662	D	33.8	Very low	36.9	Very low	153 Å²	153	130.3 Å²	130.3	82%	0.818	72%	0.72	S	S	*	*	S	Bend	trans	-165.2	131.3	158.9	-87	-32.7	0	0	0	107.4
663	N	35.5	Very low	36.1	Very low	166 Å²	166	130.5 Å²	130.5	89%	0.888	73%	0.729	S	S	*	*			trans	98.7	68.2	-180	-52.1	-29.9	0	0	0	116.9
664	D	31.3	Very low	35.3	Very low	155 Å²	155	134.1 Å²	134.1	83%	0.829	75%	0.747	S	S	*	*			trans	-63.6	124.4	142.2	-78.7	-39.8	0	0	0	109.7
665	T	34.5	Very low	34.6	Very low	131 Å²	131	134 Å²	134	80%	0.804	75%	0.75	S	S	*	*				163.1	141.9	129	31.7	0	0	0	0	113.1
666	L	33.6	Very low	34.4	Very low	144 Å²	144	137.6 Å²	137.6	75%	0.754	77%	0.765	S	S	*	*			trans	89.6	88.7	153.8	-69.3	150.4	0	0	0	120.3
667	T	30.8	Very low	33.9	Very low	117 Å²	117	138.6 Å²	138.6	72%	0.718	77%	0.77	S	S	*	*				67.4	132.3	112.6	52.8	0	0	0	0	122.7
668	T	31.7	Very low	33.4	Very low	119 Å²	119	138.1 Å²	138.1	73%	0.73	77%	0.772	S	S	*	*			trans	110.8	87.6	135.5	-19.8	0	0	0	0	118.2
669	T	29.3	Very low	33.2	Very low	122 Å²	122	136.8 Å²	136.8	75%	0.748	78%	0.775	S	S	*	*			trans	19.6	124.8	130.7	55.7	0	0	0	0	120.6
670	A	34.2	Very low	32.6	Very low	108 Å²	108	135.4 Å²	135.4	89%	0.893	78%	0.778	S	S	*	*			trans	-150.4	113.3	136.5	0	0	0	0	0	109.6
671	E	27.8	Very low	32.7	Very low	174 Å²	174	136.9 Å²	136.9	81%	0.813	79%	0.785	S	S	*	*			trans	-80.6	137	177.5	-60.8	174.3	149.5	0	0	111
672	I	35.6	Very low	32.7	Very low	177 Å²	177	136 Å²	136	91%	0.908	79%	0.789	S	S	*	*			trans	-138.3	121.8	141.7	-61.2	-175.9	0	0	0	107.8
673	S	30.4	Very low	32.7	Very low	95 Å²	95	138.3 Å²	138.3	66%	0.664	79%	0.792	S	S	*	*			trans	-99.3	144	-171	26.6	0	0	0	0	111.7
674	V	33.9	Very low	32.7	Very low	149 Å²	149	136.1 Å²	136.1	90%	0.903	79%	0.787	S	S	*	*			trans	-145.4	118.3	143.5	-177.2	0	0	0	0	109.4
675	N	31	Very low	33.1	Very low	118 Å²	118	135.6 Å²	135.6	63%	0.631	79%	0.788	S	S	*	*			trans	-65.2	148.6	177.8	-87.3	-20.6	0	0	0	114.1
676	N	34.4	Very low	33.1	Very low	156 Å²	156	138.2 Å²	138.2	83%	0.834	79%	0.791	S	S	*	*				-169.4	120	103.7	-92	-16.9	0	0	0	113.1
677	Q	32.9	Very low	33.4	Very low	149 Å²	149	137.7 Å²	137.7	70%	0.696	78%	0.783	S	S	*	*			trans	-39.8	153.8	164.6	-77.6	154.3	-17	0	0	114.6
678	D	32.5	Very low	34	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	78%	0.783	S	S	*	*			cis	-161.5	167.6	42.1	-105.6	-39.5	0	0	0	113.4
679	T	33.4	Very low	34.8	Very low	137 Å²	137	139 Å²	139	84%	0.84	79%	0.786	S	S	*	*			trans	101.8	99.7	163.2	-9.1	0	0	0	0	118.4
680	V	29.6	Very low	35.6	Very low	135 Å²	135	142.1 Å²	142.1	82%	0.818	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-62	130.3	180	179.4	0	0	0	0	113.5
681	P	37.6	Very low	36	Very low	120 Å²	120	148 Å²	148	78%	0.779	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-101.1	125.3	158.4	31.9	-21.5	0	0	0	110.9
682	A	33.8	Very low	37.2	Very low	90 Å²	90	150.4 Å²	150.4	74%	0.744	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-56.4	138.2	172.1	0	0	0	0	0	112
683	K	32.4	Very low	39	Very low	202 Å²	202	146 Å²	146	88%	0.878	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-55.3	125	175.3	-75.1	178.9	175	179.8	0	110.7
684	P	36.4	Very low	41.3	Very low	120 Å²	120	144.3 Å²	144.3	78%	0.779	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-73	132.8	168	29.4	-29	0	0	0	109.4	E686	P684-E686 PolarHBondContact O-N 3.11Å
685	V	38.7	Very low	43.2	Very low	143 Å²	143	144.2 Å²	144.2	87%	0.867	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-59.7	122.3	178.5	176.4	0	0	0	0	109.9	F687	V685-F687 PolarHBondContact O-N 3.49Å
686	E	36	Very low	45.3	Very low	186 Å²	186	148.5 Å²	148.5	87%	0.869	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-61.1	123.4	176.1	-80.8	-178.7	149.1	0	0	111.6	P684 N688	P684-E686 PolarHBondContact O-N 3.11Å; E686-N688 PolarHBondContact O-N 2.82Å
687	F	40	Very low	47.1	Very low	133 Å²	133	144.9 Å²	144.9	58%	0.583	74%	0.744	S	S	*	*			trans	-76.8	101.9	175.2	-149.4	-92.2	0	0	0	109.2	V685 T689 H701	V685-F687 PolarHBondContact O-N 3.49Å; F687-T689 PolarHBondContact O-N 3.14Å; F687-H701 AromaticContact CE2-NE2 3.97Å
688	N	42.2	Very low	49.3	Very low	134 Å²	134	141.2 Å²	141.2	72%	0.717	73%	0.728	S	S	*	*			trans	-73	96.8	-179.4	-148.5	-24.5	0	0	0	109.7	E686 K690	E686-N688 PolarHBondContact O-N 2.82Å; N688-K690 PolarHBondContact O-N 3.44Å
689	T	49.1	Very low	51.4	Low	129 Å²	129	143.5 Å²	143.5	79%	0.791	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	4.1	-172	50.4	0	0	0	0	115.4	F687	F687-T689 PolarHBondContact O-N 3.14Å
690	K	44.7	Very low	53.6	Low	188 Å²	188	142 Å²	142	82%	0.817	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-1.6	-174.8	-69.7	-177.5	177.9	177	0	115.6	N688	N688-K690 PolarHBondContact O-N 3.44Å
691	R	44.4	Very low	55.6	Low	233 Å²	233	139.6 Å²	139.6	88%	0.879	69%	0.689	S	S	*	*	S	Bend	trans	-113.9	124.8	176.5	-82.9	-175.1	175.2	176.9	-0.2	112.7	I693	R691-I693 PolarHBondContact O-N 3.16Å; R691-I693 VanDerWaalsContact O-N 3.15Å
692	K	52.6	Low	57.5	Low	223 Å²	223	139 Å²	139	97%	0.97	68%	0.679	S	S	*	*			trans	-59.9	112.2	169.4	-72.8	-179.9	177.4	176.8	0	109.4
693	I	73.1	Confident	59.5	Low	86 Å²	86	140.7 Å²	140.7	44%	0.441	67%	0.671	S	S	.	*			trans	-88.1	141.2	173.1	-135.2	174.2	0	0	0	109.2	R691 N697 L698	R691-I693 PolarHBondContact O-N 3.16Å; R691-I693 VanDerWaalsContact O-N 3.15Å; I693-N697 HydrophobicContact CD1-CB 4.17Å; I693-N697 HydrophobicContact CG1-CB 3.83Å; I693-L698 HydrophobicContact CG2-CB 3.94Å; I693-L698 HydrophobicContact CG2-CD1 4.29Å
694	S	78.2	Confident	61.5	Low	58 Å²	58	135.6 Å²	135.6	41%	0.406	65%	0.651	S	S	.	*			trans	-70.6	150.3	174.2	75.1	0	0	0	0	110.3	R696 N697 L698	S694-R696 PolarHBondContact O-N 3.35Å; S694-R696 VanDerWaalsContact O-N 3.1Å; S694-N697 PolarHBondContact O-N 2.7Å; S694-N697 VanDerWaalsContact OG-CG 3.28Å; S694-N697 PolarHBondContact OG-N 3.08Å; S694-N697 PolarHBondContact OG-OD1 3.17Å; S694-L698 PolarHBondContact O-N 2.84Å
695	L	74.1	Confident	63.2	Low	147 Å²	147	136.5 Å²	136.5	77%	0.77	64%	0.64	S	S	*	*	H	α-helix	trans	-54.4	-31.6	177.6	-119.4	164.2	0	0	0	112.5	R699	L695-R699 WeakPolarHBondContact O-CB 3.28Å; L695-R699 PolarHBondContact O-N 2.91Å
696	R	75.4	Confident	64.5	Low	209 Å²	209	133.2 Å²	133.2	79%	0.789	63%	0.627	S	S	*	*	H	α-helix	trans	-68.5	-44.2	176.9	-161.7	176.3	-172.2	140.6	0.7	111.8	S694 R699 Q700	S694-R696 PolarHBondContact O-N 3.35Å; S694-R696 VanDerWaalsContact O-N 3.1Å; R696-R699 PolarHBondContact O-N 3.37Å; R696-Q700 WeakPolarHBondContact O-CB 3.43Å; R696-Q700 PolarHBondContact O-N 2.79Å
697	N	73.1	Confident	66.1	Low	80 Å²	80	129.2 Å²	129.2	43%	0.428	62%	0.616	S	S	.	*	H	α-helix	trans	-69.4	-36.4	178.1	-69.6	5.4	0	0	0	111.6	I693 S694 Q700 H701	I693-N697 HydrophobicContact CD1-CB 4.17Å; I693-N697 HydrophobicContact CG1-CB 3.83Å; S694-N697 PolarHBondContact O-N 2.7Å; S694-N697 VanDerWaalsContact OG-CG 3.28Å; S694-N697 PolarHBondContact OG-N 3.08Å; S694-N697 PolarHBondContact OG-OD1 3.17Å; N697-Q700 PolarHBondContact O-N 2.9Å; N697-H701 VanDerWaalsContact O-CB 3.3Å; N697-H701 WeakPolarHBondContact O-CB 3.38Å; N697-H701 PolarHBondContact O-N 3.48Å
698	L	77.8	Confident	66.8	Low	71 Å²	71	126.9 Å²	126.9	37%	0.372	62%	0.616	S	S	.	*	H	α-helix	trans	-61.6	-45.6	172.5	-173.9	76.9	0	0	0	111	I693 S694 H701 L702	I693-L698 HydrophobicContact CG2-CB 3.94Å; I693-L698 HydrophobicContact CG2-CD1 4.29Å; S694-L698 PolarHBondContact O-N 2.84Å; L698-H701 PolarHBondContact O-N 3.01Å; L698-L702 HydrophobicContact CD2-CD1 4.47Å; L698-L702 HydrophobicContact CG-CD1 4.11Å; L698-L702 WeakPolarHBondContact O-CB 3.32Å; L698-L702 WeakPolarHBondContact O-CG 3.31Å; L698-L702 PolarHBondContact O-N 3.33Å
699	R	76.8	Confident	67.1	Low	190 Å²	190	124.1 Å²	124.1	72%	0.717	61%	0.607	S	S	*	*	H	α-helix	trans	-64.3	-42.5	-179.9	-153.6	176.8	-169	171.9	2.8	111.4	L695 R696 Q703	L695-R699 WeakPolarHBondContact O-CB 3.28Å; L695-R699 PolarHBondContact O-N 2.91Å; R696-R699 PolarHBondContact O-N 3.37Å; R699-Q703 VanDerWaalsContact O-CB 3.22Å; R699-Q703 WeakPolarHBondContact O-CB 3.45Å; R699-Q703 PolarHBondContact O-N 2.82Å
700	Q	79	Confident	67.1	Low	105 Å²	105	123.6 Å²	123.6	49%	0.491	61%	0.606	S	S	.	*	H	α-helix	trans	-62.5	-44.4	174.3	-175.7	173.9	-10.2	0	0	111.4	R696 N697 Q703 E704	R696-Q700 WeakPolarHBondContact O-CB 3.43Å; R696-Q700 PolarHBondContact O-N 2.79Å; N697-Q700 PolarHBondContact O-N 2.9Å; Q700-Q703 CarbonylContact O-C 3.53Å; Q700-Q703 PolarHBondContact O-N 2.79Å; Q700-Q703 VanDerWaalsContact O-N 3.17Å; Q700-E704 HydrophobicContact CG-CG 4.42Å; Q700-E704 WeakPolarHBondContact CG-OE1 3.43Å; Q700-E704 PolarHBondContact NE2-OE1 2.7Å; Q700-E704 WeakPolarHBondContact O-CB 3.49Å; Q700-E704 WeakPolarHBondContact O-CG 3.47Å; Q700-E704 PolarHBondContact O-N 3Å
701	H	73.2	Confident	67.1	Low	85 Å²	85	122 Å²	122	39%	0.394	61%	0.607	S	S	.	*	H	α-helix	trans	-65.6	-41.4	179.3	-165	66.5	0	0	0	112.7	F687 N697 L698 Q703 E704 Y705	F687-H701 AromaticContact CE2-NE2 3.97Å; N697-H701 VanDerWaalsContact O-CB 3.3Å; N697-H701 WeakPolarHBondContact O-CB 3.38Å; N697-H701 PolarHBondContact O-N 3.48Å; L698-H701 PolarHBondContact O-N 3.01Å; H701-Q703 VanDerWaalsContact C-N 3.27Å; H701-Q703 PolarHBondContact O-N 2.97Å; H701-E704 PolarHBondContact O-N 3.06Å; H701-Y705 VanDerWaalsContact O-CB 3.3Å; H701-Y705 WeakPolarHBondContact O-CB 3.26Å; H701-Y705 PolarHBondContact O-N 2.9Å
702	L	76.5	Confident	66.8	Low	106 Å²	106	118.6 Å²	118.6	56%	0.555	59%	0.593	S	S	*	*	H	α-helix	trans	-65.9	-32.2	173.8	-71.1	173.1	0	0	0	111.9	L698 A706	L698-L702 HydrophobicContact CD2-CD1 4.47Å; L698-L702 HydrophobicContact CG-CD1 4.11Å; L698-L702 WeakPolarHBondContact O-CB 3.32Å; L698-L702 WeakPolarHBondContact O-CG 3.31Å; L698-L702 PolarHBondContact O-N 3.33Å; L702-A706 WeakPolarHBondContact O-CB 3.49Å; L702-A706 PolarHBondContact O-N 2.95Å
703	Q	76.2	Confident	66	Low	126 Å²	126	111.9 Å²	111.9	59%	0.589	57%	0.573	S	S	*	*	H	α-helix	trans	-75.6	-39.4	177.3	-163.6	157.5	2.2	0	0	111.8	R699 Q700 H701 Y705 A706 T707	R699-Q703 VanDerWaalsContact O-CB 3.22Å; R699-Q703 WeakPolarHBondContact O-CB 3.45Å; R699-Q703 PolarHBondContact O-N 2.82Å; Q700-Q703 CarbonylContact O-C 3.53Å; Q700-Q703 PolarHBondContact O-N 2.79Å; Q700-Q703 VanDerWaalsContact O-N 3.17Å; H701-Q703 VanDerWaalsContact C-N 3.27Å; H701-Q703 PolarHBondContact O-N 2.97Å; Q703-Y705 VanDerWaalsContact C-N 3.32Å; Q703-A706 PolarHBondContact O-N 3.38Å; Q703-T707 WeakPolarHBondContact O-CG2 3.41Å; Q703-T707 PolarHBondContact O-N 3.27Å; Q703-T707 PolarHBondContact O-OG1 2.88Å; Q703-T707 VanDerWaalsContact O-OG1 3.07Å
704	E	74.1	Confident	64.1	Low	95 Å²	95	115.5 Å²	115.5	44%	0.444	59%	0.592	S	S	.	*	H	α-helix	trans	-63.7	-36.8	169.9	-74.4	168.9	-173.2	0	0	111.5	Q700 H701 T707 S708	Q700-E704 HydrophobicContact CG-CG 4.42Å; Q700-E704 WeakPolarHBondContact CG-OE1 3.43Å; Q700-E704 PolarHBondContact NE2-OE1 2.7Å; Q700-E704 WeakPolarHBondContact O-CB 3.49Å; Q700-E704 WeakPolarHBondContact O-CG 3.47Å; Q700-E704 PolarHBondContact O-N 3Å; H701-E704 PolarHBondContact O-N 3.06Å; E704-T707 WeakPolarHBondContact CA-OG1 3.45Å; E704-T707 PolarHBondContact O-OG1 3.07Å; E704-S708 VanDerWaalsContact O-CB 3.26Å; E704-S708 WeakPolarHBondContact O-CB 3.43Å; E704-S708 PolarHBondContact O-N 3.32Å; E704-S708 VanDerWaalsContact O-N 3.11Å; E704-S708 PolarHBondContact O-OG 2.94Å
705	Y	71.7	Confident	62.3	Low	140 Å²	140	116.9 Å²	116.9	55%	0.549	60%	0.602	S	S	.	*	H	α-helix	trans	-67.6	-38.8	172.8	-162.9	-90.9	0	0	0	112	H701 Q703 S708 I717	H701-Y705 VanDerWaalsContact O-CB 3.3Å; H701-Y705 WeakPolarHBondContact O-CB 3.26Å; H701-Y705 PolarHBondContact O-N 2.9Å; Q703-Y705 VanDerWaalsContact C-N 3.32Å; Y705-S708 PolarHBondContact O-OG 3.48Å; Y705-I717 HydrophobicContact CE1-CD1 4.21Å
706	A	66.2	Low	60.4	Low	73 Å²	73	111.4 Å²	111.4	60%	0.603	58%	0.578	S	S	*	*	H	α-helix	trans	-71.1	-31.1	176.6	0	0	0	0	0	113.2	L702 Q703	L702-A706 WeakPolarHBondContact O-CB 3.49Å; L702-A706 PolarHBondContact O-N 2.95Å; Q703-A706 PolarHBondContact O-N 3.38Å
707	T	69	Low	58.6	Low	103 Å²	103	105.6 Å²	105.6	63%	0.632	56%	0.561	S	S	*	*	H	α-helix	trans	-87.2	-19.9	-179.7	55.2	0	0	0	0	114.1	Q703 E704	Q703-T707 WeakPolarHBondContact O-CG2 3.41Å; Q703-T707 PolarHBondContact O-N 3.27Å; Q703-T707 PolarHBondContact O-OG1 2.88Å; Q703-T707 VanDerWaalsContact O-OG1 3.07Å; E704-T707 WeakPolarHBondContact CA-OG1 3.45Å; E704-T707 PolarHBondContact O-OG1 3.07Å
708	S	56.2	Low	56.9	Low	83 Å²	83	106 Å²	106	58%	0.58	57%	0.567	S	S	*	*	S	Bend	trans	-86.4	2.9	-176.3	51.9	0	0	0	0	115.3	E704 Y705	E704-S708 VanDerWaalsContact O-CB 3.26Å; E704-S708 WeakPolarHBondContact O-CB 3.43Å; E704-S708 PolarHBondContact O-N 3.32Å; E704-S708 VanDerWaalsContact O-N 3.11Å; E704-S708 PolarHBondContact O-OG 2.94Å; Y705-S708 PolarHBondContact O-OG 3.48Å
709	S	46.8	Very low	55	Low	76 Å²	76	106.9 Å²	106.9	53%	0.531	58%	0.579	S	S	.	*			trans	-155.6	92.8	173.5	-86.4	0	0	0	0	113	N711	S709-N711 VanDerWaalsContact C-N 3.33Å; S709-N711 PolarHBondContact O-N 3.41Å
710	P	49.4	Very low	53.1	Low	118 Å²	118	103.9 Å²	103.9	77%	0.766	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-5.1	-174.8	-12.3	27.8	0	0	0	115.8
711	N	45.5	Very low	51.7	Low	156 Å²	156	104.5 Å²	104.5	83%	0.834	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.1	24.2	-167.7	-79.9	-28.2	0	0	0	115.6	S709	S709-N711 VanDerWaalsContact C-N 3.33Å; S709-N711 PolarHBondContact O-N 3.41Å
712	R	38.6	Very low	50.4	Low	160 Å²	160	109 Å²	109	60%	0.604	61%	0.608	S	S	*	*			trans	-89.4	118.9	173.4	-139.2	-179.5	-157.6	-151.3	4.1	109.5	L714 A716	R712-L714 PolarHBondContact O-N 3.48Å; R712-A716 HydrophobicContact CG-CB 4.07Å
713	P	36.1	Very low	49.7	Very low	82 Å²	82	110 Å²	110	53%	0.532	61%	0.608	S	S	.	*			trans	-59.4	135.6	173.8	26.4	-32.9	0	0	0	108.3	S715 A716	P713-S715 PolarHBondContact O-N 3.21Å; P713-A716 PolarHBondContact O-N 3.03Å
714	L	33.3	Very low	49.8	Very low	162 Å²	162	106.9 Å²	106.9	85%	0.848	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-55	-9.8	179	-82.8	149.9	0	0	0	113.4	R712 A716	R712-L714 PolarHBondContact O-N 3.48Å; L714-A716 VanDerWaalsContact C-N 3.34Å
715	S	38.9	Very low	50.2	Low	88 Å²	88	107 Å²	107	62%	0.615	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-71.2	-18.3	170.4	57.1	0	0	0	0	114.9	P713	P713-S715 PolarHBondContact O-N 3.21Å
716	A	33.9	Very low	50.9	Low	31 Å²	31	100.6 Å²	100.6	26%	0.256	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-93.4	2.3	-174.1	0	0	0	0	0	115.3	R712 P713 L714	R712-A716 HydrophobicContact CG-CB 4.07Å; P713-A716 PolarHBondContact O-N 3.03Å; L714-A716 VanDerWaalsContact C-N 3.34Å
717	I	38.3	Very low	51.8	Low	87 Å²	87	99 Å²	99	45%	0.446	55%	0.554	S	S	.	*	S	Bend	trans	-106.1	-4	175.7	-63.6	174.8	0	0	0	111.7	Y705	Y705-I717 HydrophobicContact CE1-CD1 4.21Å
718	T	38.3	Very low	52.6	Low	89 Å²	89	97 Å²	97	55%	0.546	54%	0.539	S	S	.	.	S	Bend	trans	-109	1.1	179.7	-18.1	0	0	0	0	114.3
719	S	38	Very low	54.1	Low	89 Å²	89	93.7 Å²	93.7	62%	0.622	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-2.7	-171.6	55.3	0	0	0	0	115.7
720	T	37	Very low	56.1	Low	127 Å²	127	91.8 Å²	91.8	78%	0.779	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.9	28.1	177.7	58.9	0	0	0	0	113.9
721	I	47.9	Very low	58	Low	119 Å²	119	92.3 Å²	92.3	61%	0.61	49%	0.487	S	S	*	.	S	Bend	trans	-91.5	113.2	159.5	-58.6	173.9	0	0	0	104.8	K723	I721-K723 VanDerWaalsContact C-N 3.3Å; I721-K723 PolarHBondContact O-N 3.12Å
722	H	45.6	Very low	60.1	Low	179 Å²	179	89.9 Å²	89.9	83%	0.829	47%	0.47	S	S	*	.			trans	-50.6	100.7	168.6	-77.3	-90.3	0	0	0	107.5	T724	H722-T724 PolarHBondContact O-N 2.92Å
723	K	63.3	Low	62.6	Low	128 Å²	128	82.2 Å²	82.2	56%	0.557	44%	0.442	S	S	*	.			trans	-62.3	111.8	177.1	-72.6	179.8	-176.8	169.8	0	105.2	I721 I728	I721-K723 VanDerWaalsContact C-N 3.3Å; I721-K723 PolarHBondContact O-N 3.12Å; K723-I728 HydrophobicContact CB-CD1 4.27Å; K723-I728 HydrophobicContact CB-CG1 4.03Å
724	T	77.9	Confident	65.2	Low	59 Å²	59	79 Å²	79	36%	0.362	42%	0.42	S	S	.	.			trans	-62.8	151.7	177.5	63.9	0	0	0	0	108.4	H722 W726 D727 I728	H722-T724 PolarHBondContact O-N 2.92Å; T724-W726 PolarHBondContact O-N 3.19Å; T724-W726 VanDerWaalsContact O-N 3.09Å; T724-D727 PolarHBondContact N-OD2 3.5Å; T724-D727 WeakPolarHBondContact O-CB 3.42Å; T724-D727 PolarHBondContact O-N 3.48Å; T724-D727 VanDerWaalsContact OG1-CG 3.26Å; T724-D727 PolarHBondContact OG1-N 3.29Å; T724-D727 PolarHBondContact OG1-OD2 3.39Å; T724-I728 PolarHBondContact O-N 3.34Å
725	Q	83.3	Confident	67.9	Low	99 Å²	99	74 Å²	74	46%	0.463	40%	0.398	S	S	.	.	H	α-helix	trans	-52	-36.6	176.6	-174.9	63.7	4.8	0	0	111.3	A642 E645 D727 I728 T729	A642-Q725 HydrophobicContact CB-CG 4.29Å; E645-Q725 WeakPolarHBondContact OE2-CG 3.49Å; Q725-D727 PolarHBondContact O-N 3.38Å; Q725-I728 PolarHBondContact O-N 2.96Å; Q725-T729 HydrophobicContact CG-CG2 4.39Å; Q725-T729 WeakPolarHBondContact O-CG2 3.2Å; Q725-T729 PolarHBondContact O-N 2.95Å; Q725-T729 PolarHBondContact O-OG1 2.91Å; Q725-T729 VanDerWaalsContact O-OG1 3.07Å
726	W	85.4	Confident	70.5	Confident	4 Å²	4	71.6 Å²	71.6	2%	0.015	38%	0.376	C	S	.	.	H	α-helix	trans	-55.2	-44.2	170.4	171	-94.4	0	0	0	114.3	K581 L584 L585 L639 C643 T724 I728 T729 R730	K581-W726 HydrophobicContact CB-CD2 4.5Å; K581-W726 HydrophobicContact CB-CH2 3.83Å; K581-W726 HydrophobicContact CB-CZ2 3.73Å; K581-W726 HydrophobicContact CB-CZ3 4.26Å; K581-W726 HydrophobicContact CD-CD2 3.73Å; K581-W726 HydrophobicContact CD-CE3 4.14Å; K581-W726 HydrophobicContact CD-CG 3.95Å; K581-W726 HydrophobicContact CD-CZ2 4.41Å; K581-W726 HydrophobicContact CG-CD2 3.94Å; K581-W726 HydrophobicContact CG-CE3 4.45Å; K581-W726 HydrophobicContact CG-CG 4.42Å; K581-W726 HydrophobicContact CG-CH2 4.23Å; K581-W726 HydrophobicContact CG-CZ2 3.71Å; L584-W726 HydrophobicContact CD2-CH2 4.08Å; L584-W726 HydrophobicContact CD2-CZ2 3.99Å; L585-W726 HydrophobicContact CG-CH2 4.44Å; L585-W726 HydrophobicContact CG-CZ3 4.48Å; L639-W726 HydrophobicContact CB-CZ3 4.21Å; L639-W726 HydrophobicContact CD2-CH2 4.46Å; L639-W726 HydrophobicContact CD2-CZ3 4.16Å; C643-W726 HydrophobicContact CB-CE3 4.13Å; C643-W726 HydrophobicContact CB-CZ3 4.12Å; T724-W726 PolarHBondContact O-N 3.19Å; T724-W726 VanDerWaalsContact O-N 3.09Å; W726-I728 VanDerWaalsContact C-N 3.29Å; W726-I728 PolarHBondContact O-N 2.79Å; W726-T729 WeakPolarHBondContact CA-OG1 3.02Å; W726-T729 PolarHBondContact O-OG1 2.91Å; W726-R730 WeakPolarHBondContact O-CB 3.49Å; W726-R730 PolarHBondContact O-N 3.35Å
727	D	84.9	Confident	73.1	Confident	40 Å²	40	70.1 Å²	70.1	21%	0.214	36%	0.364	C	S	.	.	H	α-helix	trans	-68.8	-31.7	-178.8	-67	-49.8	0	0	0	112.3	T724 Q725 R730 K731	T724-D727 PolarHBondContact N-OD2 3.5Å; T724-D727 WeakPolarHBondContact O-CB 3.42Å; T724-D727 PolarHBondContact O-N 3.48Å; T724-D727 VanDerWaalsContact OG1-CG 3.26Å; T724-D727 PolarHBondContact OG1-N 3.29Å; T724-D727 PolarHBondContact OG1-OD2 3.39Å; Q725-D727 PolarHBondContact O-N 3.38Å; D727-R730 IonicContact OD1-CZ 3.37Å; D727-R730 IonicContact OD1-NH2 3.92Å; D727-R730 PolarHBondContact OD1-NH2 3.48Å; D727-K731 VanDerWaalsContact O-CG 3.31Å; D727-K731 WeakPolarHBondContact O-CG 3.43Å; D727-K731 PolarHBondContact O-N 3.18Å
728	I	86.9	Confident	75.6	Confident	62 Å²	62	68.4 Å²	68.4	32%	0.318	35%	0.354	S	S	.	.	H	α-helix	trans	-71.5	-56.5	175.9	-59.7	173.5	0	0	0	109.2	K723 T724 Q725 W726 R730 K731 E732	K723-I728 HydrophobicContact CB-CD1 4.27Å; K723-I728 HydrophobicContact CB-CG1 4.03Å; T724-I728 PolarHBondContact O-N 3.34Å; Q725-I728 PolarHBondContact O-N 2.96Å; W726-I728 VanDerWaalsContact C-N 3.29Å; W726-I728 PolarHBondContact O-N 2.79Å; I728-R730 VanDerWaalsContact C-N 3.27Å; I728-R730 PolarHBondContact O-N 3.38Å; I728-K731 PolarHBondContact O-N 3Å; I728-E732 WeakPolarHBondContact O-CG 3.34Å; I728-E732 PolarHBondContact O-N 2.89Å
729	T	87	Confident	78	Confident	13 Å²	13	69.7 Å²	69.7	8%	0.08	36%	0.357	C	S	.	.	H	α-helix	trans	-61.6	-35.3	-178.5	55.5	0	0	0	0	112.4	A642 Q725 W726 E732 F733	A642-T729 HydrophobicContact CB-CG2 3.98Å; A642-T729 VanDerWaalsContact CB-OG1 3.31Å; A642-T729 WeakPolarHBondContact CB-OG1 3.42Å; Q725-T729 HydrophobicContact CG-CG2 4.39Å; Q725-T729 WeakPolarHBondContact O-CG2 3.2Å; Q725-T729 PolarHBondContact O-N 2.95Å; Q725-T729 PolarHBondContact O-OG1 2.91Å; Q725-T729 VanDerWaalsContact O-OG1 3.07Å; W726-T729 WeakPolarHBondContact CA-OG1 3.02Å; W726-T729 PolarHBondContact O-OG1 2.91Å; T729-E732 PolarHBondContact O-N 3.01Å; T729-F733 WeakPolarHBondContact O-CB 3.5Å; T729-F733 PolarHBondContact O-N 3.3Å
730	R	88.5	Confident	80.5	Confident	35 Å²	35	66.4 Å²	66.4	13%	0.132	33%	0.331	C	S	.	.	H	α-helix	trans	-64.4	-43.5	173.3	-179.8	173.5	58.8	165	5.1	112.2	G577 L584 W726 D727 I728 E732 F733 L734	G577-R730 PolarHBondContact O-NH1 2.96Å; G577-R730 PolarHBondContact O-NH2 3.43Å; L584-R730 HydrophobicContact CD2-CG 4.19Å; W726-R730 WeakPolarHBondContact O-CB 3.49Å; W726-R730 PolarHBondContact O-N 3.35Å; D727-R730 IonicContact OD1-CZ 3.37Å; D727-R730 IonicContact OD1-NH2 3.92Å; D727-R730 PolarHBondContact OD1-NH2 3.48Å; I728-R730 VanDerWaalsContact C-N 3.27Å; I728-R730 PolarHBondContact O-N 3.38Å; R730-E732 VanDerWaalsContact C-N 3.33Å; R730-F733 PolarHBondContact O-N 2.99Å; R730-L734 HydrophobicContact CG-CD1 4.33Å; R730-L734 VanDerWaalsContact O-CG 3.25Å; R730-L734 WeakPolarHBondContact O-CG 3.13Å; R730-L734 PolarHBondContact O-N 3.33Å
731	K	89.6	Confident	82.9	Confident	130 Å²	130	60.5 Å²	60.5	57%	0.565	30%	0.295	S	S	*	.	H	α-helix	trans	-64.4	-40.3	177.2	-79.4	-178.2	178.3	-168.7	0	111.8	D727 I728 L734 S735	D727-K731 VanDerWaalsContact O-CG 3.31Å; D727-K731 WeakPolarHBondContact O-CG 3.43Å; D727-K731 PolarHBondContact O-N 3.18Å; I728-K731 PolarHBondContact O-N 3Å; K731-L734 PolarHBondContact O-N 2.99Å; K731-S735 PolarHBondContact O-N 3.17Å
732	E	90.4	Very high	84.8	Confident	104 Å²	104	58.2 Å²	58.2	49%	0.486	28%	0.284	S	S	.	.	H	α-helix	trans	-63.5	-43.3	174.8	-66.5	174.8	175.2	0	0	111.6	W635 I728 T729 R730 L734 S735 W736	W635-E732 HydrophobicContact CH2-CB 3.81Å; W635-E732 HydrophobicContact CZ3-CB 4.19Å; I728-E732 WeakPolarHBondContact O-CG 3.34Å; I728-E732 PolarHBondContact O-N 2.89Å; T729-E732 PolarHBondContact O-N 3.01Å; R730-E732 VanDerWaalsContact C-N 3.33Å; E732-L734 PolarHBondContact O-N 3.21Å; E732-S735 PolarHBondContact O-N 3.08Å; E732-W736 WeakPolarHBondContact O-CB 3.35Å; E732-W736 PolarHBondContact O-N 3.15Å
733	F	91.1	Very high	86.8	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-59.3	-45.6	174.3	172.5	-111.2	0	0	0	112.2	L584 V588 W635 L639 T729 R730 W736 I737	L584-F733 HydrophobicContact CD1-CE1 4.41Å; V588-F733 HydrophobicContact CG2-CE1 4.02Å; V588-F733 HydrophobicContact CG2-CE2 4.46Å; V588-F733 HydrophobicContact CG2-CZ 3.61Å; W635-F733 HydrophobicContact CB-CD2 3.69Å; W635-F733 HydrophobicContact CB-CE2 3.83Å; W635-F733 HydrophobicContact CD2-CB 4.37Å; W635-F733 AromaticContact CD2-CD2 3.77Å; W635-F733 HydrophobicContact CD2-CD2 3.77Å; W635-F733 HydrophobicContact CE3-CB 3.79Å; W635-F733 AromaticContact CE3-CD2 3.93Å; W635-F733 HydrophobicContact CE3-CD2 3.93Å; W635-F733 HydrophobicContact CE3-CG 4.34Å; W635-F733 AromaticContact CG-CD2 3.68Å; W635-F733 HydrophobicContact CG-CD2 3.68Å; W635-F733 HydrophobicContact CG-CE2 4.15Å; W635-F733 HydrophobicContact CZ3-CB 3.93Å; L639-F733 HydrophobicContact CD1-CB 4.42Å; L639-F733 HydrophobicContact CD1-CD1 4Å; L639-F733 HydrophobicContact CD1-CD2 4.11Å; L639-F733 HydrophobicContact CD1-CE1 4.25Å; L639-F733 HydrophobicContact CD1-CE2 4.35Å; L639-F733 HydrophobicContact CD1-CG 3.91Å; L639-F733 HydrophobicContact CD1-CZ 4.42Å; L639-F733 HydrophobicContact CD2-CB 4.31Å; T729-F733 WeakPolarHBondContact O-CB 3.5Å; T729-F733 PolarHBondContact O-N 3.3Å; R730-F733 PolarHBondContact O-N 2.99Å; F733-W736 AromaticContact CD2-CE3 3.88Å; F733-W736 HydrophobicContact CD2-CE3 3.88Å; F733-W736 HydrophobicContact CD2-CZ3 4.24Å; F733-W736 AromaticContact CE2-CE3 3.84Å; F733-W736 HydrophobicContact CE2-CE3 3.84Å; F733-W736 AromaticContact CE2-CZ3 3.74Å; F733-W736 HydrophobicContact CE2-CZ3 3.74Å; F733-W736 WeakPolarHBondContact O-CB 3.43Å; F733-W736 PolarHBondContact O-N 3.23Å; F733-I737 HydrophobicContact CD1-CD1 4.14Å; F733-I737 HydrophobicContact CE1-CD1 3.54Å; F733-I737 HydrophobicContact CE1-CG1 4.4Å; F733-I737 HydrophobicContact CE2-CD1 4.24Å; F733-I737 HydrophobicContact CE2-CG1 4.29Å; F733-I737 HydrophobicContact CZ-CD1 3.61Å; F733-I737 HydrophobicContact CZ-CG1 4.14Å; F733-I737 WeakPolarHBondContact O-CG1 3.33Å; F733-I737 PolarHBondContact O-N 2.9Å
734	L	90	Very high	87.9	Confident	13 Å²	13	50.5 Å²	50.5	7%	0.068	25%	0.251	C	S	.	.	H	α-helix	trans	-62.7	-43.3	177.1	-68.4	176.6	0	0	0	111.6	I573 L576 R730 K731 E732 W736 I737 Q738	I573-L734 HydrophobicContact CD1-CD2 4.36Å; I573-L734 HydrophobicContact CG2-CB 4.07Å; I573-L734 HydrophobicContact CG2-CD1 4.26Å; I573-L734 HydrophobicContact CG2-CD2 4.41Å; I573-L734 HydrophobicContact CG2-CG 4.47Å; L576-L734 HydrophobicContact CB-CD2 3.98Å; L576-L734 HydrophobicContact CD2-CD2 3.5Å; L576-L734 VanDerWaalsContact CD2-CD2 3.5Å; L576-L734 HydrophobicContact CG-CD2 3.84Å; R730-L734 HydrophobicContact CG-CD1 4.33Å; R730-L734 VanDerWaalsContact O-CG 3.25Å; R730-L734 WeakPolarHBondContact O-CG 3.13Å; R730-L734 PolarHBondContact O-N 3.33Å; K731-L734 PolarHBondContact O-N 2.99Å; E732-L734 PolarHBondContact O-N 3.21Å; L734-W736 VanDerWaalsContact C-N 3.3Å; L734-W736 PolarHBondContact O-N 3.2Å; L734-I737 HydrophobicContact CD2-CD1 4.5Å; L734-I737 PolarHBondContact O-N 3.41Å; L734-Q738 WeakPolarHBondContact O-CG 3.34Å; L734-Q738 PolarHBondContact O-N 2.93Å
735	S	90.3	Very high	88.4	Confident	57 Å²	57	48 Å²	48	40%	0.399	24%	0.235	S	C	.	.	H	α-helix	trans	-62.9	-37.4	174.5	-170.7	0	0	0	0	111.9	K731 E732 Q738 L739	K731-S735 PolarHBondContact O-N 3.17Å; E732-S735 PolarHBondContact O-N 3.08Å; S735-Q738 PolarHBondContact O-N 3.08Å; S735-L739 WeakPolarHBondContact O-CG 3.48Å; S735-L739 PolarHBondContact O-N 2.99Å; S735-L739 VanDerWaalsContact O-N 3.11Å
736	W	92.8	Very high	88.5	Confident	38 Å²	38	44.5 Å²	44.5	14%	0.144	22%	0.221	C	C	.	.	H	α-helix	trans	-64.1	-41.1	175.9	169.6	81.1	0	0	0	112	W534 L628 W635 E732 F733 L734 Q738 L739 K740	W534-W736 HydrophobicContact CH2-CH2 4.46Å; W534-W736 HydrophobicContact CH2-CZ3 4.31Å; W534-W736 AromaticContact CZ2-CH2 3.94Å; W534-W736 HydrophobicContact CZ2-CH2 3.94Å; W534-W736 AromaticContact CZ2-CZ3 3.9Å; W534-W736 HydrophobicContact CZ2-CZ3 3.9Å; L628-W736 HydrophobicContact CD1-CH2 4.21Å; L628-W736 HydrophobicContact CD1-CZ2 4.37Å; W635-W736 AromaticContact CD1-CD2 3.41Å; W635-W736 VanDerWaalsContact CD1-CD2 3.41Å; W635-W736 AromaticContact CD1-CE2 3.53Å; W635-W736 AromaticContact CD1-CE3 3.49Å; W635-W736 VanDerWaalsContact CD1-CE3 3.49Å; W635-W736 AromaticContact CD1-CH2 3.85Å; W635-W736 AromaticContact CD1-CZ2 3.78Å; W635-W736 AromaticContact CD1-CZ3 3.71Å; W635-W736 AromaticContact CE2-CD2 3.86Å; W635-W736 AromaticContact CE2-CG 3.64Å; W635-W736 HydrophobicContact CG-CD2 4.35Å; W635-W736 HydrophobicContact CG-CE3 4.14Å; W635-W736 HydrophobicContact CG-CZ3 4.37Å; W635-W736 HydrophobicContact CZ2-CB 3.66Å; W635-W736 AromaticContact CZ2-CG 3.85Å; W635-W736 HydrophobicContact CZ2-CG 3.85Å; W635-W736 AromaticContact NE1-CD1 3.4Å; W635-W736 AromaticContact NE1-CD2 3.04Å; W635-W736 AromaticContact NE1-CE2 3.28Å; W635-W736 VanDerWaalsContact NE1-CE2 3.28Å; W635-W736 AromaticContact NE1-CE3 3.58Å; W635-W736 AromaticContact NE1-CG 3.15Å; W635-W736 AromaticContact NE1-NE1 3.45Å; E732-W736 WeakPolarHBondContact O-CB 3.35Å; E732-W736 PolarHBondContact O-N 3.15Å; F733-W736 AromaticContact CD2-CE3 3.88Å; F733-W736 HydrophobicContact CD2-CE3 3.88Å; F733-W736 HydrophobicContact CD2-CZ3 4.24Å; F733-W736 AromaticContact CE2-CE3 3.84Å; F733-W736 HydrophobicContact CE2-CE3 3.84Å; F733-W736 AromaticContact CE2-CZ3 3.74Å; F733-W736 HydrophobicContact CE2-CZ3 3.74Å; F733-W736 WeakPolarHBondContact O-CB 3.43Å; F733-W736 PolarHBondContact O-N 3.23Å; L734-W736 VanDerWaalsContact C-N 3.3Å; L734-W736 PolarHBondContact O-N 3.2Å; W736-Q738 VanDerWaalsContact C-N 3.28Å; W736-Q738 PolarHBondContact O-N 3.37Å; W736-L739 PolarHBondContact O-N 3.12Å; W736-K740 HydrophobicContact CZ2-CB 4.29Å; W736-K740 HydrophobicContact CZ2-CD 4.32Å; W736-K740 HydrophobicContact CZ2-CG 4.04Å; W736-K740 WeakPolarHBondContact O-CB 3.28Å; W736-K740 PolarHBondContact O-N 3.05Å
737	I	89.6	Confident	88.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-56	-45.6	174.3	-69.5	172.2	0	0	0	110.3	W534 L535 I538 I573 F733 L734 K740 L741	W534-I737 HydrophobicContact CH2-CG1 4.22Å; W534-I737 HydrophobicContact CH2-CG2 4.23Å; L535-I737 HydrophobicContact CD1-CG2 4.3Å; I538-I737 HydrophobicContact CG2-CD1 4.2Å; I573-I737 HydrophobicContact CD1-CG2 4.49Å; F733-I737 HydrophobicContact CD1-CD1 4.14Å; F733-I737 HydrophobicContact CE1-CD1 3.54Å; F733-I737 HydrophobicContact CE1-CG1 4.4Å; F733-I737 HydrophobicContact CE2-CD1 4.24Å; F733-I737 HydrophobicContact CE2-CG1 4.29Å; F733-I737 HydrophobicContact CZ-CD1 3.61Å; F733-I737 HydrophobicContact CZ-CG1 4.14Å; F733-I737 WeakPolarHBondContact O-CG1 3.33Å; F733-I737 PolarHBondContact O-N 2.9Å; L734-I737 HydrophobicContact CD2-CD1 4.5Å; L734-I737 PolarHBondContact O-N 3.41Å; I737-K740 PolarHBondContact O-N 3.14Å; I737-L741 HydrophobicContact CG2-CD1 3.69Å; I737-L741 HydrophobicContact CG2-CG 4.24Å; I737-L741 WeakPolarHBondContact O-CB 3.29Å; I737-L741 VanDerWaalsContact O-CG 3.27Å; I737-L741 WeakPolarHBondContact O-CG 3.37Å; I737-L741 PolarHBondContact O-N 3.22Å
738	Q	89.5	Confident	88.2	Confident	51 Å²	51	43.1 Å²	43.1	24%	0.238	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-45.1	-179.6	-55.2	-171.8	-48.4	0	0	111.8	V564 F569 L734 S735 W736 N742	V564-Q738 HydrophobicContact CG1-CB 4.49Å; F569-Q738 HydrophobicContact CE1-CB 4.42Å; F569-Q738 HydrophobicContact CE1-CG 3.73Å; F569-Q738 HydrophobicContact CZ-CG 4.02Å; L734-Q738 WeakPolarHBondContact O-CG 3.34Å; L734-Q738 PolarHBondContact O-N 2.93Å; S735-Q738 PolarHBondContact O-N 3.08Å; W736-Q738 VanDerWaalsContact C-N 3.28Å; W736-Q738 PolarHBondContact O-N 3.37Å; Q738-N742 PolarHBondContact O-N 3.02Å; Q738-N742 VanDerWaalsContact O-N 3.15Å
739	L	90.2	Very high	87.8	Confident	116 Å²	116	42.2 Å²	42.2	61%	0.607	21%	0.208	S	C	*	.	H	α-helix	trans	-64.2	-45.8	177.8	-69.8	172.2	0	0	0	111.7	S735 W736 L741 N742 E743	S735-L739 WeakPolarHBondContact O-CG 3.48Å; S735-L739 PolarHBondContact O-N 2.99Å; S735-L739 VanDerWaalsContact O-N 3.11Å; W736-L739 PolarHBondContact O-N 3.12Å; L739-L741 PolarHBondContact O-N 3.06Å; L739-N742 PolarHBondContact O-N 2.58Å; L739-E743 PolarHBondContact O-N 3.01Å
740	K	89.2	Confident	87.4	Confident	21 Å²	21	48.2 Å²	48.2	9%	0.091	24%	0.235	C	C	.	.	H	α-helix	trans	-68	-35.2	-178.4	-161.6	72.8	-160.6	164.6	0	112.1	L628 W736 I737 E743 L744	L628-K740 HydrophobicContact CD1-CG 3.86Å; W736-K740 HydrophobicContact CZ2-CB 4.29Å; W736-K740 HydrophobicContact CZ2-CD 4.32Å; W736-K740 HydrophobicContact CZ2-CG 4.04Å; W736-K740 WeakPolarHBondContact O-CB 3.28Å; W736-K740 PolarHBondContact O-N 3.05Å; I737-K740 PolarHBondContact O-N 3.14Å; K740-E743 WeakPolarHBondContact CD-OE2 3.26Å; K740-E743 IonicContact NZ-OE1 3.33Å; K740-E743 PolarHBondContact NZ-OE1 3.31Å; K740-E743 IonicContact NZ-OE2 3.42Å; K740-E743 PolarHBondContact NZ-OE2 2.76Å; K740-E743 PolarHBondContact O-N 2.84Å; K740-L744 HydrophobicContact CG-CD1 3.93Å; K740-L744 HydrophobicContact CG-CG 4.32Å; K740-L744 WeakPolarHBondContact O-CB 3.28Å; K740-L744 WeakPolarHBondContact O-CG 3.23Å; K740-L744 PolarHBondContact O-N 2.65Å
741	L	88.5	Confident	87.1	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	24%	0.238	C	C	.	.	H	α-helix	trans	-65.7	-42.6	173.5	-77.4	171.9	0	0	0	112.1	V531 W534 L535 V564 F569 I737 L739 E743 L744 I745	V531-L741 HydrophobicContact CG1-CD2 3.75Å; W534-L741 HydrophobicContact CE3-CD2 4.48Å; W534-L741 HydrophobicContact CZ3-CD2 3.88Å; W534-L741 HydrophobicContact CZ3-CG 4.17Å; L535-L741 HydrophobicContact CD1-CD1 4.17Å; L535-L741 HydrophobicContact CD2-CD1 3.94Å; L535-L741 HydrophobicContact CD2-CD2 4.36Å; V564-L741 HydrophobicContact CG2-CB 4.15Å; F569-L741 HydrophobicContact CE2-CD1 3.57Å; F569-L741 HydrophobicContact CZ-CD1 3.66Å; I737-L741 HydrophobicContact CG2-CD1 3.69Å; I737-L741 HydrophobicContact CG2-CG 4.24Å; I737-L741 WeakPolarHBondContact O-CB 3.29Å; I737-L741 VanDerWaalsContact O-CG 3.27Å; I737-L741 WeakPolarHBondContact O-CG 3.37Å; I737-L741 PolarHBondContact O-N 3.22Å; L739-L741 PolarHBondContact O-N 3.06Å; L741-E743 VanDerWaalsContact C-N 3.29Å; L741-E743 PolarHBondContact O-N 3.26Å; L741-L744 PolarHBondContact O-N 3.48Å; L741-I745 CarbonylContact O-C 3.31Å; L741-I745 VanDerWaalsContact O-C 3.31Å; L741-I745 WeakPolarHBondContact O-CA 3.1Å; L741-I745 PolarHBondContact O-N 2.93Å
742	N	87.2	Confident	86.8	Confident	72 Å²	72	43.4 Å²	43.4	39%	0.385	22%	0.22	S	C	.	.	H	α-helix	trans	-65.7	-32.3	175.3	-82.7	-18.5	0	0	0	112.7	V564 Q738 L739	V564-N742 VanDerWaalsContact CB-OD1 3.31Å; V564-N742 WeakPolarHBondContact CB-OD1 3.42Å; V564-N742 WeakPolarHBondContact CG2-OD1 3.21Å; Q738-N742 PolarHBondContact O-N 3.02Å; Q738-N742 VanDerWaalsContact O-N 3.15Å; L739-N742 PolarHBondContact O-N 2.58Å
743	E	87.4	Confident	86.4	Confident	126 Å²	126	38.5 Å²	38.5	59%	0.589	20%	0.197	S	C	*	.	H	α-helix	trans	-71	-47.9	175.3	-172.4	-163.5	146.3	0	0	112	L739 K740 L741	L739-E743 PolarHBondContact O-N 3.01Å; K740-E743 WeakPolarHBondContact CD-OE2 3.26Å; K740-E743 IonicContact NZ-OE1 3.33Å; K740-E743 PolarHBondContact NZ-OE1 3.31Å; K740-E743 IonicContact NZ-OE2 3.42Å; K740-E743 PolarHBondContact NZ-OE2 2.76Å; K740-E743 PolarHBondContact O-N 2.84Å; L741-E743 VanDerWaalsContact C-N 3.29Å; L741-E743 PolarHBondContact O-N 3.26Å
744	L	86.8	Confident	86	Confident	18 Å²	18	38.8 Å²	38.8	9%	0.094	20%	0.198	C	C	.	.	H	α-helix	trans	-82.6	-37.2	-173.9	-67.8	178	0	0	0	113.6	L524 V531 L628 K740 L741	L524-L744 WeakPolarHBondContact CD1-O 3.44Å; V531-L744 HydrophobicContact CG2-CB 4.49Å; V531-L744 HydrophobicContact CG2-CD1 4.08Å; L628-L744 HydrophobicContact CB-CD1 4.44Å; L628-L744 HydrophobicContact CD1-CD1 3.92Å; L628-L744 HydrophobicContact CD2-CD1 3.84Å; L628-L744 HydrophobicContact CG-CD1 4.28Å; K740-L744 HydrophobicContact CG-CD1 3.93Å; K740-L744 HydrophobicContact CG-CG 4.32Å; K740-L744 WeakPolarHBondContact O-CB 3.28Å; K740-L744 WeakPolarHBondContact O-CG 3.23Å; K740-L744 PolarHBondContact O-N 2.65Å; L741-L744 PolarHBondContact O-N 3.48Å
745	I	87.8	Confident	85.5	Confident	6 Å²	6	38.8 Å²	38.8	3%	0.031	20%	0.198	C	C	.	.	S	Bend	trans	-131.7	74.6	179.4	-46.8	177.1	0	0	0	109.8	L524 I528 V531 L532 W558 L741	L524-I745 HydrophobicContact CD1-CB 4.21Å; L524-I745 HydrophobicContact CD1-CG1 4.41Å; L524-I745 HydrophobicContact CD1-CG2 3.79Å; I528-I745 HydrophobicContact CD1-CG2 4.5Å; I528-I745 HydrophobicContact CG1-CD1 4.23Å; I528-I745 HydrophobicContact CG1-CG1 4.4Å; I528-I745 HydrophobicContact CG1-CG2 3.9Å; V531-I745 HydrophobicContact CB-CD1 3.67Å; V531-I745 HydrophobicContact CB-CG1 4.19Å; V531-I745 HydrophobicContact CG1-CD1 3.5Å; V531-I745 HydrophobicContact CG1-CG1 3.94Å; L532-I745 HydrophobicContact CD2-CD1 4Å; L532-I745 HydrophobicContact CG-CD1 4.33Å; W558-I745 HydrophobicContact CD2-CG2 4.06Å; W558-I745 HydrophobicContact CG-CG2 4.15Å; W558-I745 HydrophobicContact CZ2-CG2 3.86Å; L741-I745 CarbonylContact O-C 3.31Å; L741-I745 VanDerWaalsContact O-C 3.31Å; L741-I745 WeakPolarHBondContact O-CA 3.1Å; L741-I745 PolarHBondContact O-N 2.93Å
746	P	85.5	Confident	85.1	Confident	26 Å²	26	36.1 Å²	36.1	17%	0.169	18%	0.179	C	C	.	.			trans	-60.9	161.9	172.3	27	-34.8	0	0	0	111.3	W558 F748 L751	W558-P746 PolarHBondContact NE1-O 3.4Å; P746-F748 PolarHBondContact O-N 3.44Å; P746-L751 HydrophobicContact CG-CD1 4.32Å; P746-L751 HydrophobicContact CG-CD2 4.23Å; P746-L751 HydrophobicContact CG-CG 4.43Å
747	S	82.9	Confident	84.7	Confident	7 Å²	7	34.4 Å²	34.4	5%	0.049	17%	0.173	C	C	.	.			trans	-62	126.7	171.2	-60.7	0	0	0	0	109	N561 G562 H749 Q750	N561-S747 PolarHBondContact O-OG 2.7Å; G562-S747 WeakPolarHBondContact CA-OG 3.34Å; S747-H749 PolarHBondContact O-N 3.18Å; S747-Q750 WeakPolarHBondContact O-CB 3.46Å; S747-Q750 PolarHBondContact O-N 3.09Å
748	F	81.2	Confident	84.2	Confident	8 Å²	8	34.5 Å²	34.5	4%	0.035	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-57.7	-28.9	-173.9	67.8	-78.8	0	0	0	113.7	W558 L559 P746 Q750 L751 H754 Y758	W558-F748 HydrophobicContact CH2-CB 3.97Å; W558-F748 HydrophobicContact CZ2-CB 3.94Å; L559-F748 HydrophobicContact CD2-CD1 4.46Å; L559-F748 HydrophobicContact CD2-CE1 4.39Å; L559-F748 WeakPolarHBondContact O-CE1 3.2Å; L559-F748 WeakPolarHBondContact O-CZ 3.36Å; P746-F748 PolarHBondContact O-N 3.44Å; F748-Q750 PolarHBondContact O-N 3.12Å; F748-L751 WeakPolarHBondContact O-CB 3.46Å; F748-L751 PolarHBondContact O-N 3.06Å; F748-H754 HydrophobicContact CD2-CB 4.3Å; F748-H754 VanDerWaalsContact O-CB 3.25Å; F748-H754 WeakPolarHBondContact O-CB 3.44Å; F748-Y758 HydrophobicContact CB-CD2 4Å; F748-Y758 HydrophobicContact CB-CE2 4.04Å; F748-Y758 HydrophobicContact CB-CG 4.5Å; F748-Y758 AromaticContact CD2-CD2 3.95Å; F748-Y758 HydrophobicContact CD2-CD2 3.95Å; F748-Y758 AromaticContact CD2-CG 3.89Å; F748-Y758 HydrophobicContact CD2-CG 3.89Å; F748-Y758 HydrophobicContact CE2-CG 4.4Å; F748-Y758 HydrophobicContact CG-CD2 4.27Å; F748-Y758 HydrophobicContact CG-CG 4.34Å
749	H	77.6	Confident	83.3	Confident	43 Å²	43	32.1 Å²	32.1	20%	0.199	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-60	-23.9	174.4	-58.2	-38.5	0	0	0	114.4	S747 L751 S761	S747-H749 PolarHBondContact O-N 3.18Å; H749-L751 VanDerWaalsContact C-N 3.27Å; H749-S761 WeakPolarHBondContact CE1-CB 3.49Å; H749-S761 WeakPolarHBondContact ND1-CB 3.48Å
750	Q	79.7	Confident	82	Confident	139 Å²	139	29 Å²	29	65%	0.65	15%	0.149	S	C	*	.	G	3₁₀ helix	trans	-80.5	-11.9	178.1	-62.9	174.1	-19.5	0	0	112.2	S747 F748	S747-Q750 WeakPolarHBondContact O-CB 3.46Å; S747-Q750 PolarHBondContact O-N 3.09Å; F748-Q750 PolarHBondContact O-N 3.12Å
751	L	81.9	Confident	80.2	Confident	35 Å²	35	30 Å²	30	18%	0.183	16%	0.159	C	C	.	.	S	Bend	trans	-92.2	131.7	-178	-63.6	171.6	0	0	0	110.8	H521 L524 P746 F748 H749 H754	H521-L751 VanDerWaalsContact CE1-CB 3.44Å; H521-L751 WeakPolarHBondContact CE1-CB 3.24Å; L524-L751 HydrophobicContact CD2-CD1 3.35Å; P746-L751 HydrophobicContact CG-CD1 4.32Å; P746-L751 HydrophobicContact CG-CD2 4.23Å; P746-L751 HydrophobicContact CG-CG 4.43Å; F748-L751 WeakPolarHBondContact O-CB 3.46Å; F748-L751 PolarHBondContact O-N 3.06Å; H749-L751 VanDerWaalsContact C-N 3.27Å; L751-H754 PolarHBondContact O-N 3.3Å; L751-H754 PolarHBondContact O-ND1 2.88Å
752	P	83.4	Confident	78.2	Confident	30 Å²	30	34.2 Å²	34.2	20%	0.195	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	146.1	169.8	-20	31.9	0	0	0	110.7	L463 H521 H754	L463-P752 HydrophobicContact CD2-CB 4.02Å; H521-P752 PolarHBondContact CD2-O 3.1Å; H521-P752 PolarHBondContact NE2-O 3.37Å; P752-H754 VanDerWaalsContact C-N 3.29Å; P752-H754 PolarHBondContact O-N 3.24Å
753	L	82.4	Confident	76	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	18.3	-176.6	-70.3	162.7	0	0	0	116.5	Y460 S462 L463 I514 H517 L518 E755 V756	Y460-L753 HydrophobicContact CD1-CD2 4.42Å; Y460-L753 HydrophobicContact CD2-CD2 3.56Å; Y460-L753 HydrophobicContact CE2-CD2 4.14Å; Y460-L753 HydrophobicContact CG-CD2 3.7Å; S462-L753 WeakPolarHBondContact OG-CA 3.42Å; S462-L753 PolarHBondContact OG-N 3.38Å; L463-L753 HydrophobicContact CD1-CD1 4.09Å; L463-L753 HydrophobicContact CD1-CD2 3.51Å; L463-L753 HydrophobicContact CD1-CG 3.76Å; L463-L753 HydrophobicContact CD2-CD1 3.97Å; L463-L753 HydrophobicContact CD2-CD2 4.43Å; L463-L753 HydrophobicContact CD2-CG 3.75Å; L463-L753 HydrophobicContact CG-CD1 4.31Å; L463-L753 HydrophobicContact CG-CD2 3.87Å; L463-L753 HydrophobicContact CG-CG 3.7Å; I514-L753 HydrophobicContact CB-CD1 4.39Å; I514-L753 HydrophobicContact CG2-CD1 3.79Å; H517-L753 HydrophobicContact CB-CD1 4.03Å; L518-L753 HydrophobicContact CD2-CD1 4.18Å; L518-L753 HydrophobicContact CG-CD1 4.39Å; L753-E755 PolarHBondContact O-N 2.94Å; L753-E755 VanDerWaalsContact O-N 3.11Å; L753-V756 HydrophobicContact CB-CG2 4.41Å; L753-V756 HydrophobicContact CD2-CG2 3.89Å; L753-V756 PolarHBondContact O-N 2.97Å
754	H	82.1	Confident	73.4	Confident	6 Å²	6	38 Å²	38	3%	0.028	20%	0.197	C	C	.	.	H	α-helix	trans	-60.2	-23.4	176.4	67.7	-94.7	0	0	0	112.7	F748 L751 P752 V756 F757 Y758 S761	F748-H754 HydrophobicContact CD2-CB 4.3Å; F748-H754 VanDerWaalsContact O-CB 3.25Å; F748-H754 WeakPolarHBondContact O-CB 3.44Å; L751-H754 PolarHBondContact O-N 3.3Å; L751-H754 PolarHBondContact O-ND1 2.88Å; P752-H754 VanDerWaalsContact C-N 3.29Å; P752-H754 PolarHBondContact O-N 3.24Å; H754-V756 PolarHBondContact O-N 3.02Å; H754-F757 PolarHBondContact O-N 3.38Å; H754-Y758 HydrophobicContact CB-CD2 4.33Å; H754-Y758 PolarHBondContact O-N 2.95Å; H754-S761 VanDerWaalsContact NE2-CB 3.31Å; H754-S761 WeakPolarHBondContact NE2-CB 3.28Å; H754-S761 PolarHBondContact NE2-N 3.38Å; H754-S761 PolarHBondContact NE2-OG 3.27Å
755	E	80.1	Confident	70.7	Confident	14 Å²	14	43.6 Å²	43.6	7%	0.065	23%	0.227	C	C	.	.	H	α-helix	trans	-63.1	-29.6	180	-56.2	99.5	145.3	0	0	113.4	Y460 P461 S462 L753 G759 P760	Y460-E755 HydrophobicContact CD1-CB 3.99Å; P461-E755 WeakPolarHBondContact CD-OE1 3.49Å; S462-E755 WeakPolarHBondContact CB-OE1 3.35Å; S462-E755 VanDerWaalsContact CB-OE2 3.27Å; S462-E755 WeakPolarHBondContact CB-OE2 3.48Å; S462-E755 PolarHBondContact N-OE1 3.28Å; S462-E755 PolarHBondContact OG-OE1 3.41Å; S462-E755 VanDerWaalsContact OG-OE1 3.14Å; S462-E755 PolarHBondContact OG-OE2 3.11Å; L753-E755 PolarHBondContact O-N 2.94Å; L753-E755 VanDerWaalsContact O-N 3.11Å; E755-G759 VanDerWaalsContact CA-C 3.47Å; E755-G759 WeakPolarHBondContact O-CA 2.97Å; E755-G759 PolarHBondContact O-N 2.98Å; E755-G759 VanDerWaalsContact O-N 3.09Å; E755-P760 HydrophobicContact CG-CB 4.06Å
756	V	81.8	Confident	67.8	Low	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-66.4	-48	178.5	-179.4	0	0	0	0	110.4	H424 L433 L434 Y460 L753 H754	H424-V756 PolarHBondContact NE2-O 3.3Å; L433-V756 HydrophobicContact CB-CG1 3.91Å; L433-V756 HydrophobicContact CD1-CG2 4.26Å; L434-V756 HydrophobicContact CD2-CG1 3.8Å; L434-V756 WeakPolarHBondContact CD2-O 3.29Å; L434-V756 HydrophobicContact CG-CG1 3.82Å; Y460-V756 HydrophobicContact CD1-CG2 3.98Å; Y460-V756 HydrophobicContact CE1-CG2 3.46Å; Y460-V756 VanDerWaalsContact CE1-CG2 3.46Å; Y460-V756 HydrophobicContact CE2-CG2 4.1Å; Y460-V756 HydrophobicContact CG-CG2 4.5Å; L753-V756 HydrophobicContact CB-CG2 4.41Å; L753-V756 HydrophobicContact CD2-CG2 3.89Å; L753-V756 PolarHBondContact O-N 2.97Å; H754-V756 PolarHBondContact O-N 3.02Å
757	F	83.2	Confident	65.1	Low	2 Å²	2	53.2 Å²	53.2	1%	0.009	29%	0.291	C	S	.	.	H	α-helix	trans	-90.1	-36.9	-170.2	-65.7	-79.9	0	0	0	114	G387 L388 H389 L434 L518 H521 L522 Q525 H754	G387-F757 WeakPolarHBondContact O-CD1 3.34Å; L388-F757 WeakPolarHBondContact CD1-O 3.35Å; H389-F757 PolarHBondContact N-O 3.36Å; L434-F757 HydrophobicContact CD2-CD1 3.76Å; L434-F757 HydrophobicContact CD2-CE1 4.12Å; L434-F757 HydrophobicContact CD2-CG 4.39Å; L518-F757 HydrophobicContact CB-CZ 4.46Å; L518-F757 HydrophobicContact CD2-CE2 3.56Å; L518-F757 HydrophobicContact CD2-CZ 3.78Å; H521-F757 HydrophobicContact CB-CD2 3.59Å; H521-F757 HydrophobicContact CB-CE1 4.37Å; H521-F757 HydrophobicContact CB-CE2 3.34Å; H521-F757 HydrophobicContact CB-CG 4.2Å; H521-F757 HydrophobicContact CB-CZ 3.77Å; H521-F757 AromaticContact CD2-CD2 3.76Å; H521-F757 AromaticContact CD2-CE2 3.69Å; H521-F757 AromaticContact CG-CD2 3.49Å; H521-F757 VanDerWaalsContact CG-CD2 3.49Å; H521-F757 AromaticContact CG-CE2 3.58Å; H521-F757 AromaticContact ND1-CD2 3.98Å; L522-F757 HydrophobicContact CD2-CE1 4.14Å; Q525-F757 VanDerWaalsContact NE2-CD1 3.26Å; H754-F757 PolarHBondContact O-N 3.38Å
758	Y	79.8	Confident	62.6	Low	2 Å²	2	61.2 Å²	61.2	1%	0.008	33%	0.328	C	S	.	.	H	α-helix	trans	-116.5	-9.3	-173.6	-57.6	-76.7	0	0	0	112.8	H389 T391 H521 Q525 W558 L559 F748 H754	H389-Y758 HydrophobicContact CB-CD1 3.93Å; H389-Y758 HydrophobicContact CB-CE1 3.9Å; T391-Y758 WeakPolarHBondContact CG2-O 3.34Å; H521-Y758 AromaticContact ND1-CE2 3.82Å; Q525-Y758 VanDerWaalsContact CG-OH 3.3Å; Q525-Y758 WeakPolarHBondContact CG-OH 3.31Å; W558-Y758 AromaticContact CH2-CE1 3.95Å; W558-Y758 HydrophobicContact CH2-CE1 3.95Å; W558-Y758 AromaticContact CH2-CZ 3.78Å; W558-Y758 AromaticContact CZ3-CE1 3.95Å; W558-Y758 HydrophobicContact CZ3-CE1 3.95Å; L559-Y758 HydrophobicContact CD2-CD1 3.77Å; L559-Y758 HydrophobicContact CD2-CE1 4.05Å; F748-Y758 HydrophobicContact CB-CD2 4Å; F748-Y758 HydrophobicContact CB-CE2 4.04Å; F748-Y758 HydrophobicContact CB-CG 4.5Å; F748-Y758 AromaticContact CD2-CD2 3.95Å; F748-Y758 HydrophobicContact CD2-CD2 3.95Å; F748-Y758 AromaticContact CD2-CG 3.89Å; F748-Y758 HydrophobicContact CD2-CG 3.89Å; F748-Y758 HydrophobicContact CE2-CG 4.4Å; F748-Y758 HydrophobicContact CG-CD2 4.27Å; F748-Y758 HydrophobicContact CG-CG 4.34Å; H754-Y758 HydrophobicContact CB-CD2 4.33Å; H754-Y758 PolarHBondContact O-N 2.95Å
759	G	70.7	Confident	60.1	Low	1 Å²	1	65.8 Å²	65.8	1%	0.01	36%	0.361	C	S	.	.			trans	83	156.5	-164.2	0	0	0	0	0	111.8	E755	E755-G759 VanDerWaalsContact CA-C 3.47Å; E755-G759 WeakPolarHBondContact O-CA 2.97Å; E755-G759 PolarHBondContact O-N 2.98Å; E755-G759 VanDerWaalsContact O-N 3.09Å
760	P	62.2	Low	57.7	Low	50 Å²	50	68.7 Å²	68.7	33%	0.325	39%	0.386	S	S	.	.			trans	-36.6	157.1	167.7	-1.3	-6.4	0	0	0	117.7	E755 H784	E755-P760 HydrophobicContact CG-CB 4.06Å; P760-H784 VanDerWaalsContact CA-CD2 3.46Å; P760-H784 WeakPolarHBondContact CA-CD2 3.13Å; P760-H784 WeakPolarHBondContact CA-NE2 3.39Å; P760-H784 WeakPolarHBondContact CB-CD2 3.29Å; P760-H784 WeakPolarHBondContact CB-NE2 3.4Å; P760-H784 WeakPolarHBondContact CD-CE1 3.42Å; P760-H784 WeakPolarHBondContact CD-NE2 3.35Å; P760-H784 WeakPolarHBondContact CG-CE1 2.94Å; P760-H784 WeakPolarHBondContact CG-NE2 3.27Å; P760-H784 PolarHBondContact O-CD2 3.45Å; P760-H784 PolarHBondContact O-NE2 3.22Å
761	S	52.3	Low	55.3	Low	43 Å²	43	67.3 Å²	67.3	30%	0.301	39%	0.391	S	S	.	.			trans	-101	133.1	178.9	60.2	0	0	0	0	112.5	H749 H754	H749-S761 WeakPolarHBondContact CE1-CB 3.49Å; H749-S761 WeakPolarHBondContact ND1-CB 3.48Å; H754-S761 VanDerWaalsContact NE2-CB 3.31Å; H754-S761 WeakPolarHBondContact NE2-CB 3.28Å; H754-S761 PolarHBondContact NE2-N 3.38Å; H754-S761 PolarHBondContact NE2-OG 3.27Å
762	M	45.9	Very low	52.7	Low	90 Å²	90	71.2 Å²	71.2	44%	0.443	42%	0.421	S	S	.	.			trans	-98.7	118	159	-81.1	-141.4	79.5	0	0	109.5	E764 S782 H784	M762-E764 PolarHBondContact O-N 3.4Å; M762-S782 WeakPolarHBondContact CG-OG 3.48Å; M762-S782 PolarHBondContact SD-OG 2.98Å; M762-H784 HydrophobicContact CG-CB 4.36Å
763	I	41.3	Very low	50.1	Low	114 Å²	114	74.7 Å²	74.7	59%	0.585	45%	0.447	S	S	*	.			trans	-85.7	98.5	165.1	-59.6	171.8	0	0	0	106.7	N765	I763-N765 VanDerWaalsContact C-N 3.3Å; I763-N765 HydrophobicContact CG2-CB 3.71Å; I763-N765 PolarHBondContact O-N 2.86Å
764	E	33.9	Very low	47.4	Very low	163 Å²	163	80.5 Å²	80.5	76%	0.762	49%	0.487	S	S	*	.			trans	-77.7	83.6	157.8	-79.6	-176.8	167.8	0	0	107.9	M762	M762-E764 PolarHBondContact O-N 3.4Å
765	N	29.2	Very low	44.9	Very low	136 Å²	136	84.7 Å²	84.7	73%	0.727	52%	0.517	S	S	*	.			trans	-130	112.3	165.9	-78.9	-25.7	0	0	0	109.7	I763	I763-N765 VanDerWaalsContact C-N 3.3Å; I763-N765 HydrophobicContact CG2-CB 3.71Å; I763-N765 PolarHBondContact O-N 2.86Å
766	G	27.1	Very low	42.6	Very low	66 Å²	66	93 Å²	93	68%	0.68	55%	0.554	S	S	*	*			trans	91.6	65.7	148.4	0	0	0	0	0	118.2
767	I	29.1	Very low	40.1	Very low	169 Å²	169	98.6 Å²	98.6	87%	0.867	59%	0.588	S	S	*	*			trans	-127.2	82.1	138.2	-54.4	179.6	0	0	0	107.5
768	H	30.7	Very low	37.9	Very low	175 Å²	175	106.8 Å²	106.8	81%	0.81	62%	0.62	S	S	*	*			trans	-72.8	150.4	155.5	-74.9	-69.1	0	0	0	108.9
769	S	28.5	Very low	35.6	Very low	104 Å²	104	113 Å²	113	73%	0.727	65%	0.653	S	S	*	*			trans	94.2	117.5	166	76.7	0	0	0	0	117.6
770	S	26.9	Very low	33.8	Very low	104 Å²	104	118.9 Å²	118.9	73%	0.727	69%	0.685	S	S	*	*			trans	57.3	99.9	151.2	58.5	0	0	0	0	117.9
771	S	29.2	Very low	32.7	Very low	109 Å²	109	121.2 Å²	121.2	76%	0.762	70%	0.702	S	S	*	*				169.6	124.3	95.5	44.6	0	0	0	0	110.3	S773	S771-S773 PolarHBondContact O-N 3.22Å
772	S	27.1	Very low	32.6	Very low	117 Å²	117	120.3 Å²	120.3	82%	0.818	70%	0.696	S	S	*	*			trans	-41.4	112.7	154.7	42.9	0	0	0	0	112.3
773	S	28.3	Very low	32.7	Very low	104 Å²	104	122.1 Å²	122.1	73%	0.727	71%	0.706	S	S	*	*			trans	-175.6	128.9	135.7	19.8	0	0	0	0	111	S771 S775	S771-S773 PolarHBondContact O-N 3.22Å; S773-S775 PolarHBondContact O-N 3.32Å
774	S	25.9	Very low	33	Very low	122 Å²	122	117.5 Å²	117.5	85%	0.853	68%	0.682	S	S	*	*			trans	-45.1	111.3	165.2	48.7	0	0	0	0	113.1
775	S	30	Very low	34	Very low	94 Å²	94	110.8 Å²	110.8	66%	0.657	65%	0.653	S	S	*	*			trans	-161.8	124.4	146.2	57.2	0	0	0	0	109	S773 T777	S773-S775 PolarHBondContact O-N 3.32Å; S775-T777 VanDerWaalsContact C-N 3.33Å; S775-T777 PolarHBondContact O-N 2.93Å
776	F	31.1	Very low	35.3	Very low	188 Å²	188	109.6 Å²	109.6	83%	0.825	64%	0.643	S	S	*	*			trans	-69.9	92.3	169.3	-87.6	-91.7	0	0	0	107.9	R801	F776-R801 VanDerWaalsContact CZ-NH2 3.29Å
777	T	30.6	Very low	36.9	Very low	117 Å²	117	107.8 Å²	107.8	72%	0.718	62%	0.617	S	S	*	*			trans	-87.4	119.3	161.9	45.7	0	0	0	0	108.5	S775 D779	S775-T777 VanDerWaalsContact C-N 3.33Å; S775-T777 PolarHBondContact O-N 2.93Å; T777-D779 PolarHBondContact O-N 3.38Å
778	Y	36	Very low	38.6	Very low	174 Å²	174	100.7 Å²	100.7	68%	0.682	58%	0.584	S	S	*	*			trans	-61.2	94.9	164.1	-101.3	-102.8	0	0	0	108	V812	Y778-V812 HydrophobicContact CE2-CG1 3.78Å
779	D	31	Very low	40.4	Very low	132 Å²	132	95.6 Å²	95.6	71%	0.706	56%	0.562	S	S	*	*			trans	-160	36.1	162.5	-118.3	-7.9	0	0	0	114	T777 S781	T777-D779 PolarHBondContact O-N 3.38Å; D779-S781 PolarHBondContact O-N 2.67Å
780	D	34.4	Very low	42.5	Very low	126 Å²	126	92 Å²	92	67%	0.674	54%	0.537	S	S	*	.			trans	-78.3	75.8	161.7	-90.5	-15.2	0	0	0	108.9	S782 S785	D780-S782 PolarHBondContact O-N 2.92Å; D780-S782 VanDerWaalsContact O-N 3.13Å; D780-S785 PolarHBondContact O-OG 3.33Å
781	S	38.8	Very low	44.9	Very low	99 Å²	99	87.3 Å²	87.3	69%	0.692	50%	0.504	S	S	*	.			trans	-78.1	23.6	-173.5	54	0	0	0	0	114.8	D779	D779-S781 PolarHBondContact O-N 2.67Å
782	S	49.5	Very low	47.4	Very low	24 Å²	24	88.8 Å²	88.8	17%	0.168	49%	0.493	C	S	.	.			trans	-95.4	136.6	173.3	99.7	0	0	0	0	111.2	M762 D780 H784 S785 Q786	M762-S782 WeakPolarHBondContact CG-OG 3.48Å; M762-S782 PolarHBondContact SD-OG 2.98Å; D780-S782 PolarHBondContact O-N 2.92Å; D780-S782 VanDerWaalsContact O-N 3.13Å; S782-H784 PolarHBondContact O-N 3.17Å; S782-H784 PolarHBondContact OG-N 2.96Å; S782-S785 PolarHBondContact O-N 3.24Å; S782-S785 PolarHBondContact O-OG 3.26Å; S782-S785 PolarHBondContact OG-N 2.88Å; S782-S785 VanDerWaalsContact OG-N 3.12Å; S782-S785 PolarHBondContact OG-OG 2.86Å; S782-Q786 WeakPolarHBondContact O-CG 3.26Å; S782-Q786 PolarHBondContact O-N 3.07Å
783	I	48.2	Very low	49.9	Very low	127 Å²	127	89.9 Å²	89.9	65%	0.651	48%	0.479	S	S	*	.	H	α-helix	trans	-55.3	-20.3	178.3	-66.1	164.6	0	0	0	111.6	L787	I783-L787 WeakPolarHBondContact O-CB 3.44Å; I783-L787 PolarHBondContact O-N 3.44Å
784	H	48.6	Very low	52.6	Low	18 Å²	18	90.2 Å²	90.2	8%	0.083	46%	0.464	C	S	.	.	H	α-helix	trans	-97.7	-36	-175.6	-84.9	-41.2	0	0	0	118.5	P760 M762 S782 Q786 L787 A788	P760-H784 VanDerWaalsContact CA-CD2 3.46Å; P760-H784 WeakPolarHBondContact CA-CD2 3.13Å; P760-H784 WeakPolarHBondContact CA-NE2 3.39Å; P760-H784 WeakPolarHBondContact CB-CD2 3.29Å; P760-H784 WeakPolarHBondContact CB-NE2 3.4Å; P760-H784 WeakPolarHBondContact CD-CE1 3.42Å; P760-H784 WeakPolarHBondContact CD-NE2 3.35Å; P760-H784 WeakPolarHBondContact CG-CE1 2.94Å; P760-H784 WeakPolarHBondContact CG-NE2 3.27Å; P760-H784 PolarHBondContact O-CD2 3.45Å; P760-H784 PolarHBondContact O-NE2 3.22Å; M762-H784 HydrophobicContact CG-CB 4.36Å; S782-H784 PolarHBondContact O-N 3.17Å; S782-H784 PolarHBondContact OG-N 2.96Å; H784-Q786 PolarHBondContact O-N 3.29Å; H784-L787 PolarHBondContact O-N 3.16Å; H784-A788 VanDerWaalsContact O-CB 3.25Å; H784-A788 WeakPolarHBondContact O-CB 3.36Å; H784-A788 PolarHBondContact O-N 3.01Å
785	S	54.2	Low	55.4	Low	22 Å²	22	86.3 Å²	86.3	15%	0.154	43%	0.434	C	S	.	.	H	α-helix	trans	-54.4	-42.7	162.1	64.9	0	0	0	0	106.7	D780 S782 L789	D780-S785 PolarHBondContact O-OG 3.33Å; S782-S785 PolarHBondContact O-N 3.24Å; S782-S785 PolarHBondContact O-OG 3.26Å; S782-S785 PolarHBondContact OG-N 2.88Å; S782-S785 VanDerWaalsContact OG-N 3.12Å; S782-S785 PolarHBondContact OG-OG 2.86Å; S785-L789 WeakPolarHBondContact O-CA 3.47Å; S785-L789 WeakPolarHBondContact O-CB 3.3Å; S785-L789 VanDerWaalsContact O-CD1 3.26Å; S785-L789 WeakPolarHBondContact O-CD1 3.33Å; S785-L789 WeakPolarHBondContact O-CG 3.39Å; S785-L789 PolarHBondContact O-N 3.1Å
786	Q	56.8	Low	57.9	Low	111 Å²	111	85.4 Å²	85.4	52%	0.519	42%	0.421	S	S	.	.	H	α-helix	trans	-64.4	-45.7	176.5	-64.2	177.7	18.3	0	0	113.7	S782 H784 S790	S782-Q786 WeakPolarHBondContact O-CG 3.26Å; S782-Q786 PolarHBondContact O-N 3.07Å; H784-Q786 PolarHBondContact O-N 3.29Å; Q786-S790 WeakPolarHBondContact O-CA 3.18Å; Q786-S790 WeakPolarHBondContact O-CB 3.48Å; Q786-S790 PolarHBondContact O-N 3.24Å
787	L	59.8	Low	60.5	Low	27 Å²	27	78.3 Å²	78.3	14%	0.141	39%	0.394	C	S	.	.	H	α-helix	trans	-65	-50.1	178.4	-173.2	71.4	0	0	0	111.7	E423 K427 I783 H784 S790 I791	E423-L787 HydrophobicContact CG-CD1 4.37Å; E423-L787 VanDerWaalsContact OE1-CD1 3.24Å; E423-L787 WeakPolarHBondContact OE1-CD1 3.33Å; K427-L787 HydrophobicContact CD-CD1 3.63Å; I783-L787 WeakPolarHBondContact O-CB 3.44Å; I783-L787 PolarHBondContact O-N 3.44Å; H784-L787 PolarHBondContact O-N 3.16Å; L787-S790 WeakPolarHBondContact O-CB 3.37Å; L787-S790 PolarHBondContact O-N 3Å; L787-I791 HydrophobicContact CG-CD1 4.1Å; L787-I791 WeakPolarHBondContact O-CG1 3.37Å; L787-I791 PolarHBondContact O-N 3.25Å
788	A	64.2	Low	63	Low	20 Å²	20	75.4 Å²	75.4	17%	0.165	38%	0.378	C	S	.	.	H	α-helix	trans	-65	-41.1	179.5	0	0	0	0	0	111.4	S393 H784 S790 I791 R792	S393-A788 WeakPolarHBondContact OG-CB 3.3Å; H784-A788 VanDerWaalsContact O-CB 3.25Å; H784-A788 WeakPolarHBondContact O-CB 3.36Å; H784-A788 PolarHBondContact O-N 3.01Å; A788-S790 VanDerWaalsContact C-N 3.33Å; A788-I791 PolarHBondContact O-N 3.5Å; A788-R792 WeakPolarHBondContact O-CB 3.24Å; A788-R792 PolarHBondContact O-N 3.38Å
789	L	68.7	Low	65.3	Low	68 Å²	68	74.5 Å²	74.5	36%	0.356	38%	0.377	S	S	.	.	H	α-helix	trans	-64.9	-37.7	172.8	-70.6	169.1	0	0	0	111.4	S785 R792 R793	S785-L789 WeakPolarHBondContact O-CA 3.47Å; S785-L789 WeakPolarHBondContact O-CB 3.3Å; S785-L789 VanDerWaalsContact O-CD1 3.26Å; S785-L789 WeakPolarHBondContact O-CD1 3.33Å; S785-L789 WeakPolarHBondContact O-CG 3.39Å; S785-L789 PolarHBondContact O-N 3.1Å; L789-R792 PolarHBondContact O-N 3.15Å; L789-R793 VanDerWaalsContact O-CB 3.26Å; L789-R793 WeakPolarHBondContact O-CB 3.13Å; L789-R793 WeakPolarHBondContact O-CG 3.43Å; L789-R793 PolarHBondContact O-N 3.19Å
790	S	72.5	Confident	67.8	Low	29 Å²	29	73 Å²	73	20%	0.203	37%	0.366	C	S	.	.	H	α-helix	trans	-66	-47.2	177.4	-178.2	0	0	0	0	110.9	Q786 L787 A788 R793 R794	Q786-S790 WeakPolarHBondContact O-CA 3.18Å; Q786-S790 WeakPolarHBondContact O-CB 3.48Å; Q786-S790 PolarHBondContact O-N 3.24Å; L787-S790 WeakPolarHBondContact O-CB 3.37Å; L787-S790 PolarHBondContact O-N 3Å; A788-S790 VanDerWaalsContact C-N 3.33Å; S790-R793 PolarHBondContact O-N 2.89Å; S790-R794 WeakPolarHBondContact O-CB 3.34Å; S790-R794 WeakPolarHBondContact O-CG 3.33Å; S790-R794 PolarHBondContact O-N 2.81Å; S790-R794 PolarHBondContact OG-NH2 3.46Å
791	I	77.8	Confident	70.2	Confident	5 Å²	5	73.7 Å²	73.7	3%	0.026	36%	0.359	C	S	.	.	H	α-helix	trans	-60.4	-48	173.6	-70	169.1	0	0	0	109.8	V394 C420 E423 L787 A788 R793 R794 L795	V394-I791 HydrophobicContact CG2-CD1 3.74Å; C420-I791 HydrophobicContact CB-CD1 4.48Å; C420-I791 VanDerWaalsContact SG-CG2 3.57Å; E423-I791 WeakPolarHBondContact OE2-CG1 3.15Å; L787-I791 HydrophobicContact CG-CD1 4.1Å; L787-I791 WeakPolarHBondContact O-CG1 3.37Å; L787-I791 PolarHBondContact O-N 3.25Å; A788-I791 PolarHBondContact O-N 3.5Å; I791-R793 PolarHBondContact O-N 2.91Å; I791-R794 PolarHBondContact O-N 3.03Å; I791-R794 VanDerWaalsContact O-N 3.13Å; I791-L795 HydrophobicContact CG2-CD1 3.59Å; I791-L795 HydrophobicContact CG2-CG 4.05Å; I791-L795 WeakPolarHBondContact O-CB 3.33Å; I791-L795 WeakPolarHBondContact O-CG 3.45Å; I791-L795 PolarHBondContact O-N 2.92Å
792	R	81.9	Confident	72.5	Confident	140 Å²	140	71.4 Å²	71.4	53%	0.528	34%	0.343	S	S	.	.	H	α-helix	trans	-57.5	-46.5	178	173.4	165.3	-175.1	-175.7	4.5	112.4	Y397 A788 L789 R794 L795 N796	Y397-R792 HydrophobicContact CD1-CB 4.3Å; Y397-R792 HydrophobicContact CD2-CG 4.31Å; Y397-R792 HydrophobicContact CE1-CB 3.92Å; Y397-R792 HydrophobicContact CE1-CG 4.03Å; Y397-R792 HydrophobicContact CE2-CB 4.38Å; Y397-R792 HydrophobicContact CE2-CG 3.7Å; A788-R792 WeakPolarHBondContact O-CB 3.24Å; A788-R792 PolarHBondContact O-N 3.38Å; L789-R792 PolarHBondContact O-N 3.15Å; R792-R794 VanDerWaalsContact C-N 3.31Å; R792-R794 PolarHBondContact O-N 3.29Å; R792-L795 PolarHBondContact O-N 3.49Å; R792-N796 CarbonylContact O-C 3.5Å; R792-N796 PolarHBondContact O-N 2.96Å
793	R	80.4	Confident	74.3	Confident	140 Å²	140	73.3 Å²	73.3	53%	0.528	35%	0.351	S	S	.	.	H	α-helix	trans	-65.4	-32.4	177.6	-75.5	171.9	179	-178.1	1.1	112.3	L789 S790 I791 P797	L789-R793 VanDerWaalsContact O-CB 3.26Å; L789-R793 WeakPolarHBondContact O-CB 3.13Å; L789-R793 WeakPolarHBondContact O-CG 3.43Å; L789-R793 PolarHBondContact O-N 3.19Å; S790-R793 PolarHBondContact O-N 2.89Å; I791-R793 PolarHBondContact O-N 2.91Å; R793-P797 WeakPolarHBondContact O-CA 3.48Å; R793-P797 WeakPolarHBondContact O-CB 3.31Å
794	R	84.1	Confident	76.2	Confident	112 Å²	112	68.6 Å²	68.6	42%	0.423	33%	0.326	S	S	.	.	H	α-helix	trans	-78.7	-37.1	177.3	-76.1	-165.2	-90.5	-110.8	5.3	113.5	F419 E423 S790 I791 R792	F419-R794 HydrophobicContact CE1-CB 4.22Å; F419-R794 HydrophobicContact CZ-CB 4.31Å; E423-R794 IonicContact OE1-CZ 2.83Å; E423-R794 IonicContact OE1-NH2 3.81Å; E423-R794 PolarHBondContact OE1-NH2 3.21Å; E423-R794 IonicContact OE2-CZ 3.78Å; E423-R794 IonicContact OE2-NE 2.84Å; E423-R794 PolarHBondContact OE2-NE 3.33Å; E423-R794 IonicContact OE2-NH2 2.68Å; E423-R794 PolarHBondContact OE2-NH2 3.35Å; S790-R794 WeakPolarHBondContact O-CB 3.34Å; S790-R794 WeakPolarHBondContact O-CG 3.33Å; S790-R794 PolarHBondContact O-N 2.81Å; S790-R794 PolarHBondContact OG-NH2 3.46Å; I791-R794 PolarHBondContact O-N 3.03Å; I791-R794 VanDerWaalsContact O-N 3.13Å; R792-R794 VanDerWaalsContact C-N 3.31Å; R792-R794 PolarHBondContact O-N 3.29Å
795	L	84.6	Confident	78	Confident	40 Å²	40	71 Å²	71	21%	0.209	34%	0.337	C	S	.	.	H	α-helix	trans	-81.4	-38.4	-178.3	-66.2	-176	0	0	0	113.1	Y397 L398 I402 R416 F419 I791 R792	Y397-L795 HydrophobicContact CE1-CB 4.35Å; Y397-L795 HydrophobicContact CE1-CD1 4.42Å; L398-L795 HydrophobicContact CD2-CD1 3.5Å; I402-L795 HydrophobicContact CD1-CB 4.1Å; I402-L795 HydrophobicContact CD1-CD1 4.4Å; R416-L795 HydrophobicContact CB-CD1 4.1Å; R416-L795 HydrophobicContact CB-CD2 4.22Å; R416-L795 HydrophobicContact CG-CD1 4.39Å; R416-L795 HydrophobicContact CG-CD2 4.04Å; F419-L795 HydrophobicContact CD1-CD2 3.84Å; F419-L795 HydrophobicContact CD1-CG 4.46Å; F419-L795 HydrophobicContact CG-CD2 4.34Å; I791-L795 HydrophobicContact CG2-CD1 3.59Å; I791-L795 HydrophobicContact CG2-CG 4.05Å; I791-L795 WeakPolarHBondContact O-CB 3.33Å; I791-L795 WeakPolarHBondContact O-CG 3.45Å; I791-L795 PolarHBondContact O-N 2.92Å; R792-L795 PolarHBondContact O-N 3.49Å
796	N	83.6	Confident	79.6	Confident	74 Å²	74	71.5 Å²	71.5	40%	0.396	34%	0.342	S	S	.	.	S	Bend	trans	-138.1	79.6	174.6	-168.6	3.8	0	0	0	109.9	Y397 R792 P798	Y397-N796 WeakPolarHBondContact OH-CB 3.44Å; R792-N796 CarbonylContact O-C 3.5Å; R792-N796 PolarHBondContact O-N 2.96Å; N796-P798 WeakPolarHBondContact O-CD 3.28Å
797	P	84.3	Confident	81.2	Confident	39 Å²	39	66.6 Å²	66.6	25%	0.253	32%	0.32	S	S	.	.			trans	-61.8	123.3	179.8	22.7	-33.6	0	0	0	111.2	R793 F799	R793-P797 WeakPolarHBondContact O-CA 3.48Å; R793-P797 WeakPolarHBondContact O-CB 3.31Å; P797-F799 HydrophobicContact CB-CD1 4.2Å; P797-F799 HydrophobicContact CB-CD2 4.24Å; P797-F799 HydrophobicContact CB-CE1 3.89Å; P797-F799 HydrophobicContact CB-CE2 3.97Å; P797-F799 HydrophobicContact CB-CG 4.36Å; P797-F799 HydrophobicContact CB-CZ 3.78Å; P797-F799 HydrophobicContact CG-CD2 3.96Å; P797-F799 HydrophobicContact CG-CE1 3.94Å; P797-F799 HydrophobicContact CG-CE2 3.3Å; P797-F799 HydrophobicContact CG-CZ 3.28Å; P797-F799 WeakPolarHBondContact O-CD2 3.5Å; P797-F799 PolarHBondContact O-N 2.99Å
798	P	83.7	Confident	82.5	Confident	57 Å²	57	66 Å²	66	37%	0.37	32%	0.317	S	S	.	.			trans	-79.5	64.4	177.5	34.6	-35.9	0	0	0	110.2	N796 Q800 R801 C802	N796-P798 WeakPolarHBondContact O-CD 3.28Å; P798-Q800 PolarHBondContact O-N 3.5Å; P798-Q800 VanDerWaalsContact O-N 3.12Å; P798-R801 HydrophobicContact CB-CB 4.19Å; P798-R801 PolarHBondContact O-N 3.18Å; P798-C802 PolarHBondContact O-N 3.06Å
799	F	84.5	Confident	83.4	Confident	155 Å²	155	66.3 Å²	66.3	68%	0.68	32%	0.316	S	S	*	.	H	α-helix	trans	-48.6	-45	-171.9	-69.5	-65.6	0	0	0	113	P797 R801 C802 L803	P797-F799 HydrophobicContact CB-CD1 4.2Å; P797-F799 HydrophobicContact CB-CD2 4.24Å; P797-F799 HydrophobicContact CB-CE1 3.89Å; P797-F799 HydrophobicContact CB-CE2 3.97Å; P797-F799 HydrophobicContact CB-CG 4.36Å; P797-F799 HydrophobicContact CB-CZ 3.78Å; P797-F799 HydrophobicContact CG-CD2 3.96Å; P797-F799 HydrophobicContact CG-CE1 3.94Å; P797-F799 HydrophobicContact CG-CE2 3.3Å; P797-F799 HydrophobicContact CG-CZ 3.28Å; P797-F799 WeakPolarHBondContact O-CD2 3.5Å; P797-F799 PolarHBondContact O-N 2.99Å; F799-R801 PolarHBondContact O-N 3.31Å; F799-C802 PolarHBondContact O-N 3.16Å; F799-L803 WeakPolarHBondContact O-CB 3.34Å; F799-L803 PolarHBondContact O-N 2.91Å
800	Q	84.1	Confident	84.3	Confident	100 Å²	100	63.4 Å²	63.4	47%	0.467	30%	0.302	S	S	.	.	H	α-helix	trans	-63.7	-42.8	-179	-64.7	179.7	-15.4	0	0	112.4	P798 H804 L911	P798-Q800 PolarHBondContact O-N 3.5Å; P798-Q800 VanDerWaalsContact O-N 3.12Å; Q800-H804 WeakPolarHBondContact O-CB 3.47Å; Q800-H804 PolarHBondContact O-N 3.21Å; Q800-L911 HydrophobicContact CB-CD1 4.13Å
801	R	84.6	Confident	84.7	Confident	140 Å²	140	62.1 Å²	62.1	53%	0.528	29%	0.293	S	S	.	.	H	α-helix	trans	-68.2	-41.4	177.5	-174.8	177.2	178.9	168.4	-0.4	111.3	F776 P798 F799 H804 Q805 L911	F776-R801 VanDerWaalsContact CZ-NH2 3.29Å; P798-R801 HydrophobicContact CB-CB 4.19Å; P798-R801 PolarHBondContact O-N 3.18Å; F799-R801 PolarHBondContact O-N 3.31Å; R801-H804 PolarHBondContact O-N 3.16Å; R801-Q805 WeakPolarHBondContact O-CB 3.37Å; R801-Q805 PolarHBondContact O-N 3.19Å; R801-L911 HydrophobicContact CB-CD2 4.44Å
802	C	85.8	Confident	84.8	Confident	52 Å²	52	63.9 Å²	63.9	35%	0.351	30%	0.303	S	S	.	.	H	α-helix	trans	-63.1	-45	177.2	-72.5	0	0	0	0	111.6	P798 F799 Q805 A806 Y813	P798-C802 PolarHBondContact O-N 3.06Å; F799-C802 PolarHBondContact O-N 3.16Å; C802-Q805 PolarHBondContact O-N 3.3Å; C802-A806 WeakPolarHBondContact O-CB 3.45Å; C802-A806 PolarHBondContact O-N 3.3Å; C802-Y813 PolarHBondContact O-OH 2.91Å
803	L	88.6	Confident	84.8	Confident	64 Å²	64	62.5 Å²	62.5	34%	0.335	30%	0.299	S	S	.	.	H	α-helix	trans	-62.1	-47.7	176.4	-178.1	64.9	0	0	0	111.4	F799 Q805 A806 L807 L889	F799-L803 WeakPolarHBondContact O-CB 3.34Å; F799-L803 PolarHBondContact O-N 2.91Å; L803-Q805 PolarHBondContact O-N 3.42Å; L803-A806 PolarHBondContact O-N 3.09Å; L803-L807 HydrophobicContact CD1-CD1 4.03Å; L803-L807 HydrophobicContact CD1-CG 4.32Å; L803-L807 HydrophobicContact CG-CD1 4.06Å; L803-L807 WeakPolarHBondContact O-CG 3.22Å; L803-L807 PolarHBondContact O-N 3.13Å; L803-L889 HydrophobicContact CD1-CD1 4.4Å; L803-L889 HydrophobicContact CD1-CD2 4.31Å
804	H	87.6	Confident	85	Confident	27 Å²	27	60 Å²	60	13%	0.125	30%	0.296	C	S	.	.	H	α-helix	trans	-58.2	-48.6	176.5	-179.5	73.5	0	0	0	111.5	Q800 R801 A806 L807 V808 Y838	Q800-H804 WeakPolarHBondContact O-CB 3.47Å; Q800-H804 PolarHBondContact O-N 3.21Å; R801-H804 PolarHBondContact O-N 3.16Å; H804-A806 VanDerWaalsContact C-N 3.29Å; H804-A806 PolarHBondContact O-N 2.99Å; H804-L807 PolarHBondContact O-N 3.04Å; H804-V808 WeakPolarHBondContact O-CB 3.33Å; H804-V808 VanDerWaalsContact O-CG2 3.31Å; H804-V808 WeakPolarHBondContact O-CG2 3.48Å; H804-V808 PolarHBondContact O-N 3.37Å; H804-Y838 AromaticContact ND1-CE1 3.7Å; H804-Y838 AromaticContact ND1-CZ 3.76Å; H804-Y838 PolarHBondContact ND1-OH 2.96Å
805	Q	85.9	Confident	84.8	Confident	69 Å²	69	62 Å²	62	32%	0.322	31%	0.31	S	S	.	.	H	α-helix	trans	-60.9	-38.9	178.1	-172.9	65.4	28.7	0	0	112	R801 C802 L803 N809 Y813	R801-Q805 WeakPolarHBondContact O-CB 3.37Å; R801-Q805 PolarHBondContact O-N 3.19Å; C802-Q805 PolarHBondContact O-N 3.3Å; L803-Q805 PolarHBondContact O-N 3.42Å; Q805-N809 CarbonylContact O-C 3.59Å; Q805-N809 PolarHBondContact O-N 3.44Å; Q805-Y813 HydrophobicContact CB-CE2 4.18Å; Q805-Y813 HydrophobicContact CG-CE2 4Å
806	A	88.4	Confident	84.5	Confident	32 Å²	32	64.1 Å²	64.1	26%	0.264	32%	0.321	S	S	.	.	H	α-helix	trans	-67.3	-38.7	-179.4	0	0	0	0	0	111.9	C802 L803 H804 P810 Y813	C802-A806 WeakPolarHBondContact O-CB 3.45Å; C802-A806 PolarHBondContact O-N 3.3Å; L803-A806 PolarHBondContact O-N 3.09Å; H804-A806 VanDerWaalsContact C-N 3.29Å; H804-A806 PolarHBondContact O-N 2.99Å; A806-P810 WeakPolarHBondContact O-CA 3.4Å; A806-Y813 VanDerWaalsContact CA-CE2 3.49Å; A806-Y813 HydrophobicContact CB-CD2 3.93Å; A806-Y813 HydrophobicContact CB-CE2 3.64Å
807	L	88.9	Confident	84.1	Confident	9 Å²	9	65.7 Å²	65.7	5%	0.047	33%	0.333	C	S	.	.	H	α-helix	trans	-80	-30.1	179.5	-63.8	174.6	0	0	0	113.1	L803 H804 L834 C835 Y838	L803-L807 HydrophobicContact CD1-CD1 4.03Å; L803-L807 HydrophobicContact CD1-CG 4.32Å; L803-L807 HydrophobicContact CG-CD1 4.06Å; L803-L807 WeakPolarHBondContact O-CG 3.22Å; L803-L807 PolarHBondContact O-N 3.13Å; H804-L807 PolarHBondContact O-N 3.04Å; L807-L834 HydrophobicContact CD2-CD2 3.74Å; L807-L834 HydrophobicContact CD2-CG 3.81Å; L807-C835 WeakPolarHBondContact O-CB 3.27Å; L807-Y838 HydrophobicContact CB-CD1 3.29Å; L807-Y838 HydrophobicContact CB-CD2 4.42Å; L807-Y838 HydrophobicContact CB-CE1 3.68Å; L807-Y838 HydrophobicContact CB-CG 3.69Å; L807-Y838 HydrophobicContact CD1-CD1 4.01Å; L807-Y838 HydrophobicContact CD1-CD2 3.59Å; L807-Y838 HydrophobicContact CD1-CE1 4.15Å; L807-Y838 HydrophobicContact CD1-CE2 3.78Å; L807-Y838 HydrophobicContact CD1-CG 3.71Å; L807-Y838 HydrophobicContact CG-CD1 4.28Å; L807-Y838 HydrophobicContact CG-CG 4.27Å
808	V	87.1	Confident	83.6	Confident	13 Å²	13	68.1 Å²	68.1	8%	0.079	34%	0.344	C	S	.	.	H	α-helix	trans	-83.1	-41	178.1	174.2	0	0	0	0	112.3	H804 L821 S824 Y838 K839 I842	H804-V808 WeakPolarHBondContact O-CB 3.33Å; H804-V808 VanDerWaalsContact O-CG2 3.31Å; H804-V808 WeakPolarHBondContact O-CG2 3.48Å; H804-V808 PolarHBondContact O-N 3.37Å; V808-L821 WeakPolarHBondContact O-CD1 3.37Å; V808-S824 WeakPolarHBondContact CG1-O 3.42Å; V808-Y838 HydrophobicContact CG2-CD1 4.27Å; V808-Y838 HydrophobicContact CG2-CE1 3.88Å; V808-K839 WeakPolarHBondContact O-CE 3.46Å; V808-K839 PolarHBondContact O-NZ 3.44Å; V808-I842 HydrophobicContact CG2-CD1 3.99Å
809	N	84.6	Confident	83.2	Confident	27 Å²	27	66 Å²	66	14%	0.144	33%	0.329	C	S	.	.			trans	-140.1	79.1	-178.5	-168.3	-9.4	0	0	0	110.8	Q805 G811 V812	Q805-N809 CarbonylContact O-C 3.59Å; Q805-N809 PolarHBondContact O-N 3.44Å; N809-G811 PolarHBondContact O-N 3.27Å; N809-G811 PolarHBondContact OD1-N 3.21Å; N809-V812 HydrophobicContact CB-CG2 4.18Å; N809-V812 PolarHBondContact O-N 2.79Å
810	P	86.4	Confident	82.5	Confident	8 Å²	8	64.8 Å²	64.8	5%	0.052	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.7	179.4	24.7	-34.1	0	0	0	112.8	A806 V812 Y813 L814 L831 F832	A806-P810 WeakPolarHBondContact O-CA 3.4Å; P810-V812 PolarHBondContact O-N 3.19Å; P810-V812 VanDerWaalsContact O-N 3.15Å; P810-Y813 PolarHBondContact O-N 3.11Å; P810-Y813 VanDerWaalsContact O-N 3.08Å; P810-L814 HydrophobicContact CB-CD1 4.47Å; P810-L814 PolarHBondContact O-N 2.94Å; P810-L814 VanDerWaalsContact O-N 3.08Å; P810-L831 HydrophobicContact CG-CD2 3.85Å; P810-F832 HydrophobicContact CB-CD2 4.44Å; P810-F832 HydrophobicContact CB-CE2 4.47Å
811	G	80.9	Confident	81.9	Confident	2 Å²	2	61.3 Å²	61.3	2%	0.021	31%	0.308	C	S	.	.	H	α-helix	trans	-59.9	-22.8	177.5	0	0	0	0	0	114.3	N809 Y813 Q815 L819	N809-G811 PolarHBondContact O-N 3.27Å; N809-G811 PolarHBondContact OD1-N 3.21Å; G811-Y813 VanDerWaalsContact C-N 3.34Å; G811-Q815 WeakPolarHBondContact O-CA 3.28Å; G811-Q815 PolarHBondContact O-N 3.07Å; G811-Q815 VanDerWaalsContact O-N 3.17Å; G811-L819 PolarHBondContact N-O 2.93Å
812	V	79.8	Confident	81.1	Confident	41 Å²	41	60 Å²	60	25%	0.248	32%	0.321	C	S	.	.	H	α-helix	trans	-67.5	-34.5	175.5	177.8	0	0	0	0	112	Y778 N809 P810	Y778-V812 HydrophobicContact CE2-CG1 3.78Å; N809-V812 HydrophobicContact CB-CG2 4.18Å; N809-V812 PolarHBondContact O-N 2.79Å; P810-V812 PolarHBondContact O-N 3.19Å; P810-V812 VanDerWaalsContact O-N 3.15Å
813	Y	82.6	Confident	80.5	Confident	111 Å²	111	62.5 Å²	62.5	44%	0.435	33%	0.33	S	S	.	.	H	α-helix	trans	-94.2	-41.9	-177.5	-64.9	-78.8	0	0	0	112.5	C802 Q805 A806 P810 G811	C802-Y813 PolarHBondContact O-OH 2.91Å; Q805-Y813 HydrophobicContact CB-CE2 4.18Å; Q805-Y813 HydrophobicContact CG-CE2 4Å; A806-Y813 VanDerWaalsContact CA-CE2 3.49Å; A806-Y813 HydrophobicContact CB-CD2 3.93Å; A806-Y813 HydrophobicContact CB-CE2 3.64Å; P810-Y813 PolarHBondContact O-N 3.11Å; P810-Y813 VanDerWaalsContact O-N 3.08Å; G811-Y813 VanDerWaalsContact C-N 3.34Å
814	L	84.9	Confident	79.7	Confident	87 Å²	87	63.3 Å²	63.3	46%	0.455	34%	0.341	S	S	.	.	H	α-helix	trans	-83.4	-15.8	-175	-65	173	0	0	0	113.3	P810 I816 L819 F832	P810-L814 HydrophobicContact CB-CD1 4.47Å; P810-L814 PolarHBondContact O-N 2.94Å; P810-L814 VanDerWaalsContact O-N 3.08Å; L814-I816 HydrophobicContact CB-CD1 4.13Å; L814-I816 HydrophobicContact CB-CG1 4.19Å; L814-I816 PolarHBondContact O-N 3.47Å; L814-L819 HydrophobicContact CB-CD1 4.46Å; L814-L819 HydrophobicContact CD1-CD1 3.68Å; L814-F832 HydrophobicContact CD1-CE2 3.41Å; L814-F832 VanDerWaalsContact CD1-CE2 3.41Å; L814-F832 HydrophobicContact CD1-CZ 3.77Å
815	Q	79.4	Confident	79	Confident	155 Å²	155	66 Å²	66	72%	0.724	36%	0.363	S	S	*	.			trans	57.2	13.2	-178.9	-55.8	-176.7	-0.2	0	0	115.2	G811	G811-Q815 WeakPolarHBondContact O-CA 3.28Å; G811-Q815 PolarHBondContact O-N 3.07Å; G811-Q815 VanDerWaalsContact O-N 3.17Å
816	I	79.6	Confident	78.6	Confident	85 Å²	85	64.5 Å²	64.5	44%	0.436	36%	0.361	S	S	.	.			trans	-77.9	127.6	175.7	-59.4	170.3	0	0	0	109.3	L814 D818 L819	L814-I816 HydrophobicContact CB-CD1 4.13Å; L814-I816 HydrophobicContact CB-CG1 4.19Å; L814-I816 PolarHBondContact O-N 3.47Å; I816-D818 VanDerWaalsContact C-N 3.28Å; I816-D818 HydrophobicContact CG2-CB 4.21Å; I816-D818 PolarHBondContact O-N 2.88Å; I816-L819 HydrophobicContact CB-CD1 4.21Å; I816-L819 HydrophobicContact CB-CG 4.41Å; I816-L819 HydrophobicContact CD1-CD1 4.13Å; I816-L819 HydrophobicContact CG2-CG 4.45Å; I816-L819 PolarHBondContact O-N 3.39Å
817	T	74.6	Confident	78.2	Confident	107 Å²	107	65.6 Å²	65.6	66%	0.656	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-55.8	-40.8	-178.4	46.7	0	0	0	0	113	L819 K820	T817-L819 PolarHBondContact O-N 3.29Å; T817-K820 PolarHBondContact O-N 3.35Å; T817-K820 VanDerWaalsContact O-N 3.16Å
818	D	74	Confident	77.8	Confident	90 Å²	90	67.1 Å²	67.1	48%	0.481	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-68.4	-19.5	-175.9	-75.9	33	0	0	0	113.9	I816 K830	I816-D818 VanDerWaalsContact C-N 3.28Å; I816-D818 HydrophobicContact CG2-CB 4.21Å; I816-D818 PolarHBondContact O-N 2.88Å; D818-K830 HydrophobicContact CB-CD 4.3Å; D818-K830 IonicContact OD2-NZ 2.65Å; D818-K830 PolarHBondContact OD2-NZ 2.69Å
819	L	75.1	Confident	77.4	Confident	11 Å²	11	70 Å²	70	6%	0.058	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-99.3	-3.5	178.6	-63	176.3	0	0	0	112.8	G811 L814 I816 T817 L821 K830 L831 F832	G811-L819 PolarHBondContact N-O 2.93Å; L814-L819 HydrophobicContact CB-CD1 4.46Å; L814-L819 HydrophobicContact CD1-CD1 3.68Å; I816-L819 HydrophobicContact CB-CD1 4.21Å; I816-L819 HydrophobicContact CB-CG 4.41Å; I816-L819 HydrophobicContact CD1-CD1 4.13Å; I816-L819 HydrophobicContact CG2-CG 4.45Å; I816-L819 PolarHBondContact O-N 3.39Å; T817-L819 PolarHBondContact O-N 3.29Å; L819-L821 PolarHBondContact O-N 3.14Å; L819-K830 WeakPolarHBondContact CD2-O 3.35Å; L819-L831 HydrophobicContact CD2-CD2 3.99Å; L819-F832 HydrophobicContact CD1-CE2 3.64Å; L819-F832 HydrophobicContact CD1-CZ 3.99Å; L819-F832 HydrophobicContact CD2-CE2 4.49Å
820	K	69.9	Low	77.3	Confident	131 Å²	131	74.7 Å²	74.7	57%	0.57	41%	0.413	S	S	*	.			trans	-79.6	103.6	176.7	-73.7	-176.2	-179.3	179.1	0	109.7	T817	T817-K820 PolarHBondContact O-N 3.35Å; T817-K820 VanDerWaalsContact O-N 3.16Å
821	L	71.2	Confident	77.3	Confident	26 Å²	26	74.7 Å²	74.7	14%	0.136	41%	0.412	C	S	.	.			trans	-79.5	135.7	175.9	-63.8	151.9	0	0	0	110	V808 L819 S826 L831	V808-L821 WeakPolarHBondContact O-CD1 3.37Å; L819-L821 PolarHBondContact O-N 3.14Å; L821-S826 VanDerWaalsContact CD2-OG 3.28Å; L821-S826 WeakPolarHBondContact CD2-OG 3.49Å; L821-L831 HydrophobicContact CD1-CD1 4.1Å; L821-L831 HydrophobicContact CD1-CD2 4.05Å; L821-L831 HydrophobicContact CD2-CD1 4.2Å; L821-L831 HydrophobicContact CD2-CD2 4.45Å; L821-L831 HydrophobicContact CG-CD2 4.37Å
822	S	68.1	Low	77.7	Confident	114 Å²	114	79.7 Å²	79.7	80%	0.797	43%	0.433	S	S	*	.	S	Bend	trans	-67.6	-40.1	174.2	51	0	0	0	0	111.9
823	N	73.2	Confident	78.3	Confident	103 Å²	103	79.3 Å²	79.3	55%	0.551	43%	0.43	S	S	*	.	S	Bend	trans	-120.4	136.4	174.8	-72.4	-16.9	0	0	0	110.4	S825 S826	N823-S825 PolarHBondContact O-N 3.17Å; N823-S825 VanDerWaalsContact O-N 3.14Å; N823-S826 WeakPolarHBondContact O-CB 3.48Å; N823-S826 PolarHBondContact O-N 2.75Å; N823-S826 PolarHBondContact O-OG 2.87Å
824	S	70.5	Confident	78.8	Confident	81 Å²	81	75.7 Å²	75.7	57%	0.566	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-25.8	178.5	54.5	0	0	0	0	113.5	V808 K839	V808-S824 WeakPolarHBondContact CG1-O 3.42Å; S824-K839 PolarHBondContact O-NZ 2.96Å
825	S	73.4	Confident	79.1	Confident	84 Å²	84	71.9 Å²	71.9	59%	0.587	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-14.1	175.8	56.2	0	0	0	0	114.2	N823	N823-S825 PolarHBondContact O-N 3.17Å; N823-S825 VanDerWaalsContact O-N 3.14Å
826	S	78.8	Confident	79.8	Confident	38 Å²	38	64.5 Å²	64.5	27%	0.266	36%	0.364	S	S	.	.			trans	-69	139.8	179.8	62	0	0	0	0	111	L821 N823 K839	L821-S826 VanDerWaalsContact CD2-OG 3.28Å; L821-S826 WeakPolarHBondContact CD2-OG 3.49Å; N823-S826 WeakPolarHBondContact O-CB 3.48Å; N823-S826 PolarHBondContact O-N 2.75Å; N823-S826 PolarHBondContact O-OG 2.87Å; S826-K839 PolarHBondContact O-NZ 3.2Å
827	I	79.5	Confident	80.4	Confident	54 Å²	54	60.4 Å²	60.4	28%	0.277	34%	0.343	S	S	.	.			trans	-111.3	125.5	175	-55	176.6	0	0	0	106.7	I836 K839 L840 I860	I827-I836 HydrophobicContact CG2-CG2 4.28Å; I827-K839 HydrophobicContact CD1-CB 4.26Å; I827-K839 HydrophobicContact CG1-CB 4.19Å; I827-K839 HydrophobicContact CG1-CD 4.07Å; I827-L840 HydrophobicContact CD1-CD2 4.19Å; I827-I860 HydrophobicContact CD1-CD1 4.38Å; I827-I860 HydrophobicContact CG2-CD1 3.95Å; I827-I860 HydrophobicContact CG2-CG1 4.38Å; I827-I860 HydrophobicContact CG2-CG2 3.84Å
828	S	80.6	Confident	81.3	Confident	41 Å²	41	55.7 Å²	55.7	29%	0.287	31%	0.313	S	S	.	.			trans	-118.8	142	174.7	177.2	0	0	0	0	109.3	K830 L831	S828-K830 PolarHBondContact O-N 2.65Å; S828-K830 PolarHBondContact OG-N 3.1Å; S828-L831 WeakPolarHBondContact O-CB 2.97Å; S828-L831 WeakPolarHBondContact O-CG 3.42Å; S828-L831 PolarHBondContact O-N 3.15Å; S828-L831 VanDerWaalsContact O-N 3.17Å
829	S	79	Confident	82	Confident	73 Å²	73	51.8 Å²	51.8	51%	0.51	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-16.2	174.9	58.7	0	0	0	0	113.5	L831 I860	S829-L831 VanDerWaalsContact C-N 3.31Å; S829-I860 WeakPolarHBondContact CB-O 3.39Å
830	K	82.3	Confident	82.8	Confident	126 Å²	126	52 Å²	52	55%	0.548	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-10.4	175.9	-67.2	-171.8	172	-169.6	0	114	D818 L819 S828	D818-K830 HydrophobicContact CB-CD 4.3Å; D818-K830 IonicContact OD2-NZ 2.65Å; D818-K830 PolarHBondContact OD2-NZ 2.69Å; L819-K830 WeakPolarHBondContact CD2-O 3.35Å; S828-K830 PolarHBondContact O-N 2.65Å; S828-K830 PolarHBondContact OG-N 3.1Å
831	L	85.5	Confident	83.8	Confident	8 Å²	8	45.7 Å²	45.7	4%	0.042	27%	0.266	C	S	.	.	S	Bend	trans	-71.8	156.4	178.6	-64.8	174.3	0	0	0	110.9	P810 L819 L821 S828 S829 C835 I836 K839	P810-L831 HydrophobicContact CG-CD2 3.85Å; L819-L831 HydrophobicContact CD2-CD2 3.99Å; L821-L831 HydrophobicContact CD1-CD1 4.1Å; L821-L831 HydrophobicContact CD1-CD2 4.05Å; L821-L831 HydrophobicContact CD2-CD1 4.2Å; L821-L831 HydrophobicContact CD2-CD2 4.45Å; L821-L831 HydrophobicContact CG-CD2 4.37Å; S828-L831 WeakPolarHBondContact O-CB 2.97Å; S828-L831 WeakPolarHBondContact O-CG 3.42Å; S828-L831 PolarHBondContact O-N 3.15Å; S828-L831 VanDerWaalsContact O-N 3.17Å; S829-L831 VanDerWaalsContact C-N 3.31Å; L831-C835 HydrophobicContact CB-CB 4.35Å; L831-I836 HydrophobicContact CB-CD1 4.29Å; L831-I836 HydrophobicContact CB-CG1 3.82Å; L831-I836 WeakPolarHBondContact O-CD1 3.41Å; L831-K839 HydrophobicContact CD1-CD 4.07Å
832	F	90.4	Very high	84.7	Confident	107 Å²	107	46.3 Å²	46.3	47%	0.469	27%	0.269	S	S	.	.			trans	-62.4	146.5	171.1	-56.8	-72.8	0	0	0	111.1	P810 L814 L819 L834 C835 I836	P810-F832 HydrophobicContact CB-CD2 4.44Å; P810-F832 HydrophobicContact CB-CE2 4.47Å; L814-F832 HydrophobicContact CD1-CE2 3.41Å; L814-F832 VanDerWaalsContact CD1-CE2 3.41Å; L814-F832 HydrophobicContact CD1-CZ 3.77Å; L819-F832 HydrophobicContact CD1-CE2 3.64Å; L819-F832 HydrophobicContact CD1-CZ 3.99Å; L819-F832 HydrophobicContact CD2-CE2 4.49Å; F832-L834 PolarHBondContact O-N 3.12Å; F832-L834 VanDerWaalsContact O-N 3.15Å; F832-C835 WeakPolarHBondContact O-CA 3.31Å; F832-C835 WeakPolarHBondContact O-CB 3.34Å; F832-C835 PolarHBondContact O-N 2.88Å; F832-I836 PolarHBondContact O-N 3.2Å; F832-I836 VanDerWaalsContact O-N 3.12Å
833	D	92.4	Very high	85.5	Confident	33 Å²	33	46.6 Å²	46.6	18%	0.176	26%	0.257	C	S	.	.	H	α-helix	trans	-50.9	-44.7	-177.8	-61.9	-14.5	0	0	0	112.6	C835 I836 L837 F857 R878	D833-C835 VanDerWaalsContact C-N 3.29Å; D833-C835 PolarHBondContact O-N 2.94Å; D833-I836 PolarHBondContact O-N 2.72Å; D833-L837 WeakPolarHBondContact O-CB 3.47Å; D833-L837 VanDerWaalsContact O-CG 3.27Å; D833-L837 WeakPolarHBondContact O-CG 3.34Å; D833-L837 PolarHBondContact O-N 2.97Å; D833-F857 HydrophobicContact CB-CE2 3.98Å; D833-F857 HydrophobicContact CB-CZ 3.81Å; D833-R878 VanDerWaalsContact CG-NH2 3.26Å; D833-R878 IonicContact OD1-CZ 3.68Å; D833-R878 IonicContact OD1-NE 2.72Å; D833-R878 IonicContact OD1-NH2 2.79Å; D833-R878 PolarHBondContact OD1-NH2 3.21Å; D833-R878 IonicContact OD2-CZ 2.86Å; D833-R878 IonicContact OD2-NE 3.32Å; D833-R878 PolarHBondContact OD2-NE 3.44Å; D833-R878 IonicContact OD2-NH2 3.28Å; D833-R878 PolarHBondContact OD2-NH2 2.87Å; D833-R878 VanDerWaalsContact OD2-NH2 3.1Å
834	L	93.3	Very high	86.2	Confident	35 Å²	35	43.7 Å²	43.7	18%	0.183	24%	0.244	C	C	.	.	H	α-helix	trans	-59	-39	178.3	-172.6	65.8	0	0	0	112.7	L807 F832 Y838 E885 L886 L889	L807-L834 HydrophobicContact CD2-CD2 3.74Å; L807-L834 HydrophobicContact CD2-CG 3.81Å; F832-L834 PolarHBondContact O-N 3.12Å; F832-L834 VanDerWaalsContact O-N 3.15Å; L834-Y838 VanDerWaalsContact O-CB 3.24Å; L834-Y838 WeakPolarHBondContact O-CB 3.24Å; L834-Y838 PolarHBondContact O-N 3.32Å; L834-E885 HydrophobicContact CD1-CB 3.82Å; L834-L886 HydrophobicContact CD1-CD2 3.68Å; L834-L886 HydrophobicContact CD1-CG 3.66Å; L834-L889 HydrophobicContact CD2-CD1 4.19Å
835	C	91.3	Very high	86.9	Confident	7 Å²	7	46.2 Å²	46.2	5%	0.047	25%	0.251	C	S	.	.	H	α-helix	trans	-70.7	-40.2	178.5	-63.2	0	0	0	0	111.3	L807 L831 F832 D833 Y838 K839	L807-C835 WeakPolarHBondContact O-CB 3.27Å; L831-C835 HydrophobicContact CB-CB 4.35Å; F832-C835 WeakPolarHBondContact O-CA 3.31Å; F832-C835 WeakPolarHBondContact O-CB 3.34Å; F832-C835 PolarHBondContact O-N 2.88Å; D833-C835 VanDerWaalsContact C-N 3.29Å; D833-C835 PolarHBondContact O-N 2.94Å; C835-Y838 PolarHBondContact O-N 2.89Å; C835-K839 WeakPolarHBondContact O-CG 3.39Å; C835-K839 PolarHBondContact O-N 2.93Å
836	I	92.3	Very high	87.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63	-50.7	176.4	-61.9	172.3	0	0	0	109.6	I827 L831 F832 D833 Y838 K839 L840 F857 I860 L861	I827-I836 HydrophobicContact CG2-CG2 4.28Å; L831-I836 HydrophobicContact CB-CD1 4.29Å; L831-I836 HydrophobicContact CB-CG1 3.82Å; L831-I836 WeakPolarHBondContact O-CD1 3.41Å; F832-I836 PolarHBondContact O-N 3.2Å; F832-I836 VanDerWaalsContact O-N 3.12Å; D833-I836 PolarHBondContact O-N 2.72Å; I836-Y838 VanDerWaalsContact C-N 3.31Å; I836-Y838 PolarHBondContact O-N 3.04Å; I836-K839 PolarHBondContact O-N 3.12Å; I836-L840 HydrophobicContact CG2-CD1 4.22Å; I836-L840 WeakPolarHBondContact O-CG 3.46Å; I836-L840 PolarHBondContact O-N 3.1Å; I836-F857 HydrophobicContact CB-CD2 4.35Å; I836-F857 HydrophobicContact CB-CE2 4.31Å; I836-F857 HydrophobicContact CG2-CD2 3.88Å; I836-F857 HydrophobicContact CG2-CE2 4.27Å; I836-I860 HydrophobicContact CD1-CG2 4.11Å; I836-I860 HydrophobicContact CG2-CB 4.27Å; I836-I860 HydrophobicContact CG2-CD1 3.96Å; I836-I860 HydrophobicContact CG2-CG2 3.8Å; I836-L861 HydrophobicContact CD1-CD2 4.21Å
837	L	93.9	Very high	88.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59	-43.6	177.8	-68.2	173	0	0	0	111.5	D833 L840 L841 W853 F857 F879 L886	D833-L837 WeakPolarHBondContact O-CB 3.47Å; D833-L837 VanDerWaalsContact O-CG 3.27Å; D833-L837 WeakPolarHBondContact O-CG 3.34Å; D833-L837 PolarHBondContact O-N 2.97Å; L837-L840 PolarHBondContact O-N 3.46Å; L837-L841 WeakPolarHBondContact O-CB 3.35Å; L837-L841 PolarHBondContact O-N 2.88Å; L837-W853 HydrophobicContact CB-CZ2 3.92Å; L837-W853 HydrophobicContact CD2-CZ2 4.23Å; L837-W853 VanDerWaalsContact O-CZ2 3.29Å; L837-W853 WeakPolarHBondContact O-CZ2 3.42Å; L837-F857 HydrophobicContact CD2-CB 3.93Å; L837-F857 HydrophobicContact CD2-CD1 4.47Å; L837-F857 HydrophobicContact CD2-CD2 3.53Å; L837-F857 HydrophobicContact CD2-CE2 4.13Å; L837-F857 HydrophobicContact CD2-CG 3.72Å; L837-F857 HydrophobicContact CG-CD2 3.87Å; L837-F857 HydrophobicContact CG-CE2 4.01Å; L837-F857 HydrophobicContact CG-CG 4.49Å; L837-F879 HydrophobicContact CD2-CD2 3.56Å; L837-F879 HydrophobicContact CD2-CE2 3.72Å; L837-L886 HydrophobicContact CB-CD1 3.77Å
838	Y	92.2	Very high	88.7	Confident	7 Å²	7	49 Å²	49	3%	0.027	25%	0.248	C	C	.	.	H	α-helix	trans	-64.1	-40.7	178	-175.8	-104.8	0	0	0	113.2	H804 L807 V808 L834 C835 I836 L841 I842 L886 I908	H804-Y838 AromaticContact ND1-CE1 3.7Å; H804-Y838 AromaticContact ND1-CZ 3.76Å; H804-Y838 PolarHBondContact ND1-OH 2.96Å; L807-Y838 HydrophobicContact CB-CD1 3.29Å; L807-Y838 HydrophobicContact CB-CD2 4.42Å; L807-Y838 HydrophobicContact CB-CE1 3.68Å; L807-Y838 HydrophobicContact CB-CG 3.69Å; L807-Y838 HydrophobicContact CD1-CD1 4.01Å; L807-Y838 HydrophobicContact CD1-CD2 3.59Å; L807-Y838 HydrophobicContact CD1-CE1 4.15Å; L807-Y838 HydrophobicContact CD1-CE2 3.78Å; L807-Y838 HydrophobicContact CD1-CG 3.71Å; L807-Y838 HydrophobicContact CG-CD1 4.28Å; L807-Y838 HydrophobicContact CG-CG 4.27Å; V808-Y838 HydrophobicContact CG2-CD1 4.27Å; V808-Y838 HydrophobicContact CG2-CE1 3.88Å; L834-Y838 VanDerWaalsContact O-CB 3.24Å; L834-Y838 WeakPolarHBondContact O-CB 3.24Å; L834-Y838 PolarHBondContact O-N 3.32Å; C835-Y838 PolarHBondContact O-N 2.89Å; I836-Y838 VanDerWaalsContact C-N 3.31Å; I836-Y838 PolarHBondContact O-N 3.04Å; Y838-L841 WeakPolarHBondContact O-CB 3.5Å; Y838-L841 PolarHBondContact O-N 3.4Å; Y838-I842 HydrophobicContact CD1-CD1 3.6Å; Y838-I842 HydrophobicContact CD1-CG1 4.39Å; Y838-I842 HydrophobicContact CE1-CD1 3.24Å; Y838-I842 HydrophobicContact CE1-CG1 4.08Å; Y838-I842 HydrophobicContact CG-CD1 4.47Å; Y838-I842 WeakPolarHBondContact O-CG1 3.42Å; Y838-I842 PolarHBondContact O-N 3.37Å; Y838-L886 HydrophobicContact CD2-CD2 4.07Å; Y838-I908 HydrophobicContact CD2-CD1 4.49Å; Y838-I908 HydrophobicContact CE2-CD1 3.65Å; Y838-I908 HydrophobicContact CE2-CG1 4.1Å
839	K	89.9	Confident	89.3	Confident	8 Å²	8	49 Å²	49	4%	0.035	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-47.3	175.6	-76.7	170.6	176.8	-90.4	0	111.4	V808 S824 S826 I827 L831 C835 I836 L841 I842 E843	V808-K839 WeakPolarHBondContact O-CE 3.46Å; V808-K839 PolarHBondContact O-NZ 3.44Å; S824-K839 PolarHBondContact O-NZ 2.96Å; S826-K839 PolarHBondContact O-NZ 3.2Å; I827-K839 HydrophobicContact CD1-CB 4.26Å; I827-K839 HydrophobicContact CG1-CB 4.19Å; I827-K839 HydrophobicContact CG1-CD 4.07Å; L831-K839 HydrophobicContact CD1-CD 4.07Å; C835-K839 WeakPolarHBondContact O-CG 3.39Å; C835-K839 PolarHBondContact O-N 2.93Å; I836-K839 PolarHBondContact O-N 3.12Å; K839-L841 VanDerWaalsContact C-N 3.27Å; K839-L841 PolarHBondContact O-N 2.88Å; K839-I842 WeakPolarHBondContact O-CB 3.46Å; K839-I842 PolarHBondContact O-N 2.9Å; K839-I842 VanDerWaalsContact O-N 3.11Å; K839-E843 PolarHBondContact O-N 3.36Å
840	L	91.5	Very high	90.1	Very high	15 Å²	15	47.6 Å²	47.6	8%	0.079	23%	0.232	C	C	.	.	H	α-helix	trans	-57.7	-41.2	173	-69.5	174.1	0	0	0	111.5	I827 I836 L837 I842 E843 T844 A856 F857 I860	I827-L840 HydrophobicContact CD1-CD2 4.19Å; I836-L840 HydrophobicContact CG2-CD1 4.22Å; I836-L840 WeakPolarHBondContact O-CG 3.46Å; I836-L840 PolarHBondContact O-N 3.1Å; L837-L840 PolarHBondContact O-N 3.46Å; L840-I842 VanDerWaalsContact C-N 3.32Å; L840-I842 PolarHBondContact O-N 2.92Å; L840-E843 PolarHBondContact O-N 3.35Å; L840-T844 VanDerWaalsContact O-CG2 3.22Å; L840-T844 WeakPolarHBondContact O-CG2 3.21Å; L840-T844 PolarHBondContact O-N 3.12Å; L840-T844 PolarHBondContact O-OG1 3.19Å; L840-A856 HydrophobicContact CD1-CB 4.14Å; L840-A856 HydrophobicContact CD2-CB 4.27Å; L840-F857 HydrophobicContact CD1-CB 4.34Å; L840-I860 HydrophobicContact CD1-CD1 3.86Å; L840-I860 HydrophobicContact CD2-CD1 3.71Å; L840-I860 HydrophobicContact CG-CD1 4.02Å
841	L	91.1	Very high	90.5	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.2	-36.3	177.2	-178.3	65.7	0	0	0	112.6	L837 Y838 K839 T844 V848 W853 C891 I892 R904 I908	L837-L841 WeakPolarHBondContact O-CB 3.35Å; L837-L841 PolarHBondContact O-N 2.88Å; Y838-L841 WeakPolarHBondContact O-CB 3.5Å; Y838-L841 PolarHBondContact O-N 3.4Å; K839-L841 VanDerWaalsContact C-N 3.27Å; K839-L841 PolarHBondContact O-N 2.88Å; L841-T844 WeakPolarHBondContact CA-OG1 3.32Å; L841-T844 PolarHBondContact O-OG1 3.44Å; L841-V848 HydrophobicContact CD1-CG2 3.86Å; L841-W853 HydrophobicContact CB-CH2 4.36Å; L841-W853 HydrophobicContact CB-CZ2 3.93Å; L841-W853 HydrophobicContact CD1-CH2 4.13Å; L841-W853 HydrophobicContact CD1-CZ2 4.44Å; L841-C891 HydrophobicContact CD2-CB 3.95Å; L841-I892 HydrophobicContact CD1-CG2 3.75Å; L841-I892 HydrophobicContact CD2-CG2 3.63Å; L841-I892 HydrophobicContact CG-CG2 4.36Å; L841-R904 HydrophobicContact CD1-CB 4.05Å; L841-R904 HydrophobicContact CD1-CG 3.87Å; L841-R904 HydrophobicContact CD2-CG 4.36Å; L841-R904 HydrophobicContact CG-CG 4.01Å; L841-R904 VanDerWaalsContact O-CD 3.25Å; L841-R904 WeakPolarHBondContact O-CD 3.38Å; L841-R904 PolarHBondContact O-NH1 3.31Å; L841-I908 HydrophobicContact CD2-CD1 4Å
842	I	88.8	Confident	90.9	Very high	38 Å²	38	51.3 Å²	51.3	20%	0.195	25%	0.25	C	C	.	.	H	α-helix	trans	-66.5	-38.8	176.2	-69.6	161.3	0	0	0	111.2	V808 Y838 K839 L840 R904 I908 L912	V808-I842 HydrophobicContact CG2-CD1 3.99Å; Y838-I842 HydrophobicContact CD1-CD1 3.6Å; Y838-I842 HydrophobicContact CD1-CG1 4.39Å; Y838-I842 HydrophobicContact CE1-CD1 3.24Å; Y838-I842 HydrophobicContact CE1-CG1 4.08Å; Y838-I842 HydrophobicContact CG-CD1 4.47Å; Y838-I842 WeakPolarHBondContact O-CG1 3.42Å; Y838-I842 PolarHBondContact O-N 3.37Å; K839-I842 WeakPolarHBondContact O-CB 3.46Å; K839-I842 PolarHBondContact O-N 2.9Å; K839-I842 VanDerWaalsContact O-N 3.11Å; L840-I842 VanDerWaalsContact C-N 3.32Å; L840-I842 PolarHBondContact O-N 2.92Å; I842-R904 PolarHBondContact O-NH1 2.88Å; I842-I908 HydrophobicContact CD1-CG2 4.32Å; I842-I908 HydrophobicContact CG1-CG2 3.49Å; I842-I908 VanDerWaalsContact CG1-CG2 3.49Å; I842-L912 HydrophobicContact CG2-CD1 4.38Å
843	E	86.3	Confident	91.1	Very high	120 Å²	120	46.5 Å²	46.5	56%	0.561	23%	0.229	S	C	*	.	H	α-helix	trans	-73.8	-28.2	-179.9	-67	175	-178.9	0	0	112.8	K839 L840	K839-E843 PolarHBondContact O-N 3.36Å; L840-E843 PolarHBondContact O-N 3.35Å
844	T	87	Confident	91.1	Very high	42 Å²	42	45.9 Å²	45.9	26%	0.258	23%	0.226	S	C	.	.	S	Bend	trans	-74.9	160.2	178.6	60.1	0	0	0	0	113.9	L840 L841 V848 R904	L840-T844 VanDerWaalsContact O-CG2 3.22Å; L840-T844 WeakPolarHBondContact O-CG2 3.21Å; L840-T844 PolarHBondContact O-N 3.12Å; L840-T844 PolarHBondContact O-OG1 3.19Å; L841-T844 WeakPolarHBondContact CA-OG1 3.32Å; L841-T844 PolarHBondContact O-OG1 3.44Å; T844-V848 HydrophobicContact CG2-CG1 4.07Å; T844-V848 VanDerWaalsContact OG1-CG2 3.26Å; T844-V848 WeakPolarHBondContact OG1-CG2 3.35Å; T844-R904 PolarHBondContact O-NH1 3.29Å
845	N	85.8	Confident	91.1	Very high	134 Å²	134	45.9 Å²	45.9	72%	0.717	23%	0.225	S	C	*	.			trans	-72.6	176.3	173.9	-75.1	-32.4	0	0	0	112.5	M847	N845-M847 PolarHBondContact O-N 3.18Å; N845-M847 VanDerWaalsContact O-N 3.13Å
846	K	88.3	Confident	91.2	Very high	139 Å²	139	47.3 Å²	47.3	60%	0.604	24%	0.237	S	C	*	.	S	Bend	trans	-54.8	-33.1	-178	-176.2	174.1	-178.9	173	0	114.7	I903 R904	K846-I903 HydrophobicContact CG-CG2 4.45Å; K846-I903 WeakPolarHBondContact O-CA 3.46Å; K846-R904 PolarHBondContact O-N 2.69Å
847	M	89.5	Confident	91.3	Very high	90 Å²	90	47.3 Å²	47.3	44%	0.443	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	126.8	172.2	-70.9	-160.9	-63.4	0	0	108.9	N845 V902 I903	N845-M847 PolarHBondContact O-N 3.18Å; N845-M847 VanDerWaalsContact O-N 3.13Å; M847-V902 WeakPolarHBondContact CA-O 3.29Å; M847-I903 HydrophobicContact CG-CG1 4.19Å
848	V	92.3	Very high	91.3	Very high	6 Å²	6	47.3 Å²	47.3	4%	0.036	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	126.9	-175.3	-171.1	0	0	0	0	108.3	L841 T844 W853 H901 V902	L841-V848 HydrophobicContact CD1-CG2 3.86Å; T844-V848 HydrophobicContact CG2-CG1 4.07Å; T844-V848 VanDerWaalsContact OG1-CG2 3.26Å; T844-V848 WeakPolarHBondContact OG1-CG2 3.35Å; V848-W853 HydrophobicContact CG1-CB 4.02Å; V848-W853 HydrophobicContact CG1-CD2 4.01Å; V848-W853 HydrophobicContact CG1-CE3 3.81Å; V848-W853 HydrophobicContact CG1-CG 4.13Å; V848-H901 VanDerWaalsContact O-CA 3.23Å; V848-H901 WeakPolarHBondContact O-CA 3.39Å; V848-V902 HydrophobicContact CB-CG2 3.96Å; V848-V902 PolarHBondContact N-O 3.04Å; V848-V902 PolarHBondContact O-N 3.19Å
849	N	93.3	Very high	91.3	Very high	40 Å²	40	50.8 Å²	50.8	21%	0.214	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	125.1	170.8	-177.8	-1.1	0	0	0	108.7	Y851 D852 W853	N849-Y851 VanDerWaalsContact C-N 3.33Å; N849-Y851 PolarHBondContact O-N 3.33Å; N849-Y851 PolarHBondContact OD1-N 3.32Å; N849-Y851 VanDerWaalsContact OD1-N 3.17Å; N849-D852 HydrophobicContact CB-CB 4.18Å; N849-D852 WeakPolarHBondContact CB-OD2 3.41Å; N849-D852 PolarHBondContact ND2-OD1 3.24Å; N849-D852 PolarHBondContact ND2-OD2 2.91Å; N849-W853 WeakPolarHBondContact O-CB 3.38Å; N849-W853 PolarHBondContact O-N 3.38Å; N849-W853 VanDerWaalsContact O-N 3.14Å
850	L	93.8	Very high	91.4	Very high	45 Å²	45	52.5 Å²	52.5	24%	0.236	27%	0.272	C	S	.	.	H	α-helix	trans	-65.9	-36.2	-177.7	-71.4	177	0	0	0	112.4	W853 L854 L883 D900 V902	L850-W853 HydrophobicContact CD2-CE3 4.28Å; L850-L854 WeakPolarHBondContact O-CB 3.42Å; L850-L854 PolarHBondContact O-N 3.23Å; L850-L883 HydrophobicContact CD2-CD1 3.93Å; L850-L883 HydrophobicContact CD2-CD2 4.1Å; L850-D900 WeakPolarHBondContact CB-O 3.47Å; L850-D900 WeakPolarHBondContact CG-O 3.48Å; L850-D900 PolarHBondContact N-O 3.47Å; L850-V902 HydrophobicContact CD1-CG1 4.23Å; L850-V902 HydrophobicContact CD2-CB 4.42Å; L850-V902 HydrophobicContact CD2-CG1 3.72Å; L850-V902 HydrophobicContact CD2-CG2 3.86Å; L850-V902 HydrophobicContact CG-CG1 4.17Å
851	Y	92	Very high	91.3	Very high	112 Å²	112	53.7 Å²	53.7	44%	0.439	28%	0.278	S	S	.	.	H	α-helix	trans	-67.7	-50.5	-179.7	-173.6	-98.8	0	0	0	111.3	N849 W853 L854 M855	N849-Y851 VanDerWaalsContact C-N 3.33Å; N849-Y851 PolarHBondContact O-N 3.33Å; N849-Y851 PolarHBondContact OD1-N 3.32Å; N849-Y851 VanDerWaalsContact OD1-N 3.17Å; Y851-W853 PolarHBondContact O-N 3.34Å; Y851-L854 WeakPolarHBondContact O-CB 3.29Å; Y851-L854 PolarHBondContact O-N 2.87Å; Y851-L854 VanDerWaalsContact O-N 3.15Å; Y851-M855 HydrophobicContact CD1-CG 3.99Å; Y851-M855 HydrophobicContact CE1-CG 3.67Å; Y851-M855 HydrophobicContact CE1-SD 4.09Å; Y851-M855 HydrophobicContact CE2-SD 4.43Å; Y851-M855 VanDerWaalsContact O-CG 3.27Å; Y851-M855 WeakPolarHBondContact O-CG 3.34Å; Y851-M855 PolarHBondContact O-N 3.42Å
852	D	93	Very high	91.2	Very high	99 Å²	99	56.9 Å²	56.9	53%	0.529	31%	0.311	S	S	.	.	H	α-helix	trans	-61	-35.8	178.8	-56.5	-20	0	0	0	111.4	N849 M855 A856	N849-D852 HydrophobicContact CB-CB 4.18Å; N849-D852 WeakPolarHBondContact CB-OD2 3.41Å; N849-D852 PolarHBondContact ND2-OD1 3.24Å; N849-D852 PolarHBondContact ND2-OD2 2.91Å; D852-M855 PolarHBondContact O-N 3.02Å; D852-A856 WeakPolarHBondContact O-CB 3.36Å; D852-A856 PolarHBondContact O-N 3.21Å
853	W	94.4	Very high	91.1	Very high	6 Å²	6	57.6 Å²	57.6	2%	0.023	31%	0.313	C	S	.	.	H	α-helix	trans	-70.1	-39.8	177.4	-168	15.9	0	0	0	112.5	L837 L841 V848 N849 L850 Y851 A856 F857 F879 L883 L886 I892 V902	L837-W853 HydrophobicContact CB-CZ2 3.92Å; L837-W853 HydrophobicContact CD2-CZ2 4.23Å; L837-W853 VanDerWaalsContact O-CZ2 3.29Å; L837-W853 WeakPolarHBondContact O-CZ2 3.42Å; L841-W853 HydrophobicContact CB-CH2 4.36Å; L841-W853 HydrophobicContact CB-CZ2 3.93Å; L841-W853 HydrophobicContact CD1-CH2 4.13Å; L841-W853 HydrophobicContact CD1-CZ2 4.44Å; V848-W853 HydrophobicContact CG1-CB 4.02Å; V848-W853 HydrophobicContact CG1-CD2 4.01Å; V848-W853 HydrophobicContact CG1-CE3 3.81Å; V848-W853 HydrophobicContact CG1-CG 4.13Å; N849-W853 WeakPolarHBondContact O-CB 3.38Å; N849-W853 PolarHBondContact O-N 3.38Å; N849-W853 VanDerWaalsContact O-N 3.14Å; L850-W853 HydrophobicContact CD2-CE3 4.28Å; Y851-W853 PolarHBondContact O-N 3.34Å; W853-A856 PolarHBondContact O-N 3.11Å; W853-F857 WeakPolarHBondContact O-CB 3.48Å; W853-F857 PolarHBondContact O-N 3Å; W853-F879 HydrophobicContact CB-CE2 4.3Å; W853-F879 HydrophobicContact CB-CZ 4.27Å; W853-F879 HydrophobicContact CD2-CE2 4.07Å; W853-F879 HydrophobicContact CD2-CZ 4.3Å; W853-F879 HydrophobicContact CE3-CE2 4.42Å; W853-F879 HydrophobicContact CE3-CZ 4.27Å; W853-F879 HydrophobicContact CG-CE2 4.01Å; W853-F879 HydrophobicContact CG-CZ 4.32Å; W853-L883 HydrophobicContact CE3-CD2 3.69Å; W853-L883 HydrophobicContact CH2-CD2 3.62Å; W853-L883 HydrophobicContact CZ3-CD2 3.12Å; W853-L886 HydrophobicContact CH2-CD1 3.59Å; W853-L886 HydrophobicContact CZ2-CD1 3.72Å; W853-I892 HydrophobicContact CH2-CD1 4.39Å; W853-I892 HydrophobicContact CH2-CG2 4.29Å; W853-I892 HydrophobicContact CZ3-CD1 4.25Å; W853-I892 HydrophobicContact CZ3-CG2 4.45Å; W853-V902 HydrophobicContact CE3-CG2 4.4Å; W853-V902 HydrophobicContact CZ3-CG2 4.05Å
854	L	94.3	Very high	91	Very high	21 Å²	21	56.7 Å²	56.7	11%	0.11	33%	0.327	C	S	.	.	H	α-helix	trans	-62.1	-45.3	172.6	171.7	65.5	0	0	0	111.2	L850 Y851 F857 A858 P871 Q876 F879	L850-L854 WeakPolarHBondContact O-CB 3.42Å; L850-L854 PolarHBondContact O-N 3.23Å; Y851-L854 WeakPolarHBondContact O-CB 3.29Å; Y851-L854 PolarHBondContact O-N 2.87Å; Y851-L854 VanDerWaalsContact O-N 3.15Å; L854-F857 PolarHBondContact O-N 3.38Å; L854-A858 WeakPolarHBondContact O-CB 3.49Å; L854-A858 PolarHBondContact O-N 3.42Å; L854-P871 HydrophobicContact CD1-CG 4.04Å; L854-P871 HydrophobicContact CD2-CG 3.83Å; L854-P871 HydrophobicContact CG-CG 3.84Å; L854-Q876 HydrophobicContact CD1-CG 4.46Å; L854-Q876 HydrophobicContact CD2-CG 4.37Å; L854-F879 HydrophobicContact CB-CD1 4.05Å; L854-F879 HydrophobicContact CB-CD2 4.28Å; L854-F879 HydrophobicContact CB-CE1 3.79Å; L854-F879 HydrophobicContact CB-CE2 4.1Å; L854-F879 HydrophobicContact CB-CG 4.27Å; L854-F879 HydrophobicContact CB-CZ 3.84Å; L854-F879 HydrophobicContact CD1-CB 3.56Å; L854-F879 HydrophobicContact CD1-CD1 3.65Å; L854-F879 HydrophobicContact CD1-CD2 4.02Å; L854-F879 HydrophobicContact CD1-CE1 4.29Å; L854-F879 HydrophobicContact CD1-CG 3.47Å; L854-F879 VanDerWaalsContact CD1-CG 3.47Å; L854-F879 HydrophobicContact CG-CD1 4.31Å; L854-F879 HydrophobicContact CG-CG 4.45Å
855	M	92.9	Very high	90.8	Very high	34 Å²	34	56.3 Å²	56.3	17%	0.167	32%	0.324	C	S	.	.	H	α-helix	trans	-61.5	-44.5	177.7	-66.4	-64.6	-65.6	0	0	111.5	Y851 D852 A858 S859 V865	Y851-M855 HydrophobicContact CD1-CG 3.99Å; Y851-M855 HydrophobicContact CE1-CG 3.67Å; Y851-M855 HydrophobicContact CE1-SD 4.09Å; Y851-M855 HydrophobicContact CE2-SD 4.43Å; Y851-M855 VanDerWaalsContact O-CG 3.27Å; Y851-M855 WeakPolarHBondContact O-CG 3.34Å; Y851-M855 PolarHBondContact O-N 3.42Å; D852-M855 PolarHBondContact O-N 3.02Å; M855-A858 PolarHBondContact O-N 2.89Å; M855-S859 WeakPolarHBondContact O-CB 3.45Å; M855-S859 PolarHBondContact O-N 3.15Å; M855-V865 HydrophobicContact CE-CB 3.83Å; M855-V865 HydrophobicContact CE-CG1 3.34Å; M855-V865 HydrophobicContact SD-CB 4.42Å; M855-V865 HydrophobicContact SD-CG1 3.49Å; M855-V865 WeakPolarHBondContact SD-CG1 3.3Å
856	A	93	Very high	90.7	Very high	37 Å²	37	53.3 Å²	53.3	31%	0.306	31%	0.308	S	S	.	.	H	α-helix	trans	-62.8	-41.7	175.9	0	0	0	0	0	112.1	L840 D852 W853 S859 I860	L840-A856 HydrophobicContact CD1-CB 4.14Å; L840-A856 HydrophobicContact CD2-CB 4.27Å; D852-A856 WeakPolarHBondContact O-CB 3.36Å; D852-A856 PolarHBondContact O-N 3.21Å; W853-A856 PolarHBondContact O-N 3.11Å; A856-S859 PolarHBondContact O-N 2.88Å; A856-I860 WeakPolarHBondContact O-CD1 3.34Å; A856-I860 WeakPolarHBondContact O-CG1 3.47Å; A856-I860 PolarHBondContact O-N 2.9Å; A856-I860 VanDerWaalsContact O-N 3.11Å
857	F	94.6	Very high	90.2	Very high	0 Å²	0	52 Å²	52	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-47.8	176.5	176	-111.4	0	0	0	112	D833 I836 L837 L840 W853 L854 S859 I860 L861 T875 R878 F879	D833-F857 HydrophobicContact CB-CE2 3.98Å; D833-F857 HydrophobicContact CB-CZ 3.81Å; I836-F857 HydrophobicContact CB-CD2 4.35Å; I836-F857 HydrophobicContact CB-CE2 4.31Å; I836-F857 HydrophobicContact CG2-CD2 3.88Å; I836-F857 HydrophobicContact CG2-CE2 4.27Å; L837-F857 HydrophobicContact CD2-CB 3.93Å; L837-F857 HydrophobicContact CD2-CD1 4.47Å; L837-F857 HydrophobicContact CD2-CD2 3.53Å; L837-F857 HydrophobicContact CD2-CE2 4.13Å; L837-F857 HydrophobicContact CD2-CG 3.72Å; L837-F857 HydrophobicContact CG-CD2 3.87Å; L837-F857 HydrophobicContact CG-CE2 4.01Å; L837-F857 HydrophobicContact CG-CG 4.49Å; L840-F857 HydrophobicContact CD1-CB 4.34Å; W853-F857 WeakPolarHBondContact O-CB 3.48Å; W853-F857 PolarHBondContact O-N 3Å; L854-F857 PolarHBondContact O-N 3.38Å; F857-S859 PolarHBondContact O-N 3.39Å; F857-I860 PolarHBondContact O-N 3.37Å; F857-L861 HydrophobicContact CD1-CD1 4.19Å; F857-L861 HydrophobicContact CE1-CD1 3.58Å; F857-L861 HydrophobicContact CE1-CG 4.49Å; F857-L861 HydrophobicContact CE2-CD1 4.21Å; F857-L861 HydrophobicContact CE2-CG 4.39Å; F857-L861 HydrophobicContact CZ-CD1 3.59Å; F857-L861 HydrophobicContact CZ-CG 4.26Å; F857-L861 PolarHBondContact O-N 2.89Å; F857-L861 VanDerWaalsContact O-N 3.13Å; F857-T875 HydrophobicContact CD1-CG2 4.07Å; F857-T875 HydrophobicContact CE1-CG2 4.09Å; F857-R878 HydrophobicContact CE1-CB 4.37Å; F857-F879 HydrophobicContact CB-CD2 4.16Å; F857-F879 HydrophobicContact CD1-CB 3.92Å; F857-F879 HydrophobicContact CD1-CD2 4.01Å; F857-F879 HydrophobicContact CD1-CG 4.44Å; F857-F879 HydrophobicContact CE1-CB 4.05Å; F857-F879 HydrophobicContact CG-CD2 4.19Å
858	A	93.3	Very high	89.9	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-65.8	-38.3	179.8	0	0	0	0	0	112.5	L854 M855 I860 L861 G862 E863 V865 P871 T875	L854-A858 WeakPolarHBondContact O-CB 3.49Å; L854-A858 PolarHBondContact O-N 3.42Å; M855-A858 PolarHBondContact O-N 2.89Å; A858-I860 VanDerWaalsContact C-N 3.32Å; A858-I860 PolarHBondContact O-N 3.06Å; A858-L861 PolarHBondContact O-N 3.34Å; A858-G862 PolarHBondContact O-N 2.96Å; A858-E863 PolarHBondContact O-N 3.42Å; A858-E863 VanDerWaalsContact O-N 3.15Å; A858-V865 HydrophobicContact CB-CG2 3.58Å; A858-P871 HydrophobicContact CB-CB 3.69Å; A858-T875 HydrophobicContact CB-CG2 3.72Å
859	S	91.7	Very high	89.5	Confident	81 Å²	81	59.6 Å²	59.6	57%	0.566	35%	0.353	S	S	*	.	H	α-helix	trans	-60.7	-39.4	173.5	178.5	0	0	0	0	112.3	M855 A856 F857 L861 G862	M855-S859 WeakPolarHBondContact O-CB 3.45Å; M855-S859 PolarHBondContact O-N 3.15Å; A856-S859 PolarHBondContact O-N 2.88Å; F857-S859 PolarHBondContact O-N 3.39Å; S859-L861 VanDerWaalsContact C-N 3.34Å; S859-G862 PolarHBondContact O-N 3.27Å; S859-G862 VanDerWaalsContact O-N 3.17Å
860	I	91.7	Very high	89.2	Confident	43 Å²	43	61.9 Å²	61.9	22%	0.221	37%	0.37	C	S	.	.	H	α-helix	trans	-68.6	-32.4	176.2	-71.4	159.2	0	0	0	112	I827 S829 I836 L840 A856 F857 A858 G862	I827-I860 HydrophobicContact CD1-CD1 4.38Å; I827-I860 HydrophobicContact CG2-CD1 3.95Å; I827-I860 HydrophobicContact CG2-CG1 4.38Å; I827-I860 HydrophobicContact CG2-CG2 3.84Å; S829-I860 WeakPolarHBondContact CB-O 3.39Å; I836-I860 HydrophobicContact CD1-CG2 4.11Å; I836-I860 HydrophobicContact CG2-CB 4.27Å; I836-I860 HydrophobicContact CG2-CD1 3.96Å; I836-I860 HydrophobicContact CG2-CG2 3.8Å; L840-I860 HydrophobicContact CD1-CD1 3.86Å; L840-I860 HydrophobicContact CD2-CD1 3.71Å; L840-I860 HydrophobicContact CG-CD1 4.02Å; A856-I860 WeakPolarHBondContact O-CD1 3.34Å; A856-I860 WeakPolarHBondContact O-CG1 3.47Å; A856-I860 PolarHBondContact O-N 2.9Å; A856-I860 VanDerWaalsContact O-N 3.11Å; F857-I860 PolarHBondContact O-N 3.37Å; A858-I860 VanDerWaalsContact C-N 3.32Å; A858-I860 PolarHBondContact O-N 3.06Å; I860-G862 PolarHBondContact O-N 3.31Å
861	L	91.4	Very high	89	Confident	41 Å²	41	60 Å²	60	22%	0.215	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-7.1	174.3	-67.2	-178.8	0	0	0	113.4	I836 F857 A858 S859 T875	I836-L861 HydrophobicContact CD1-CD2 4.21Å; F857-L861 HydrophobicContact CD1-CD1 4.19Å; F857-L861 HydrophobicContact CE1-CD1 3.58Å; F857-L861 HydrophobicContact CE1-CG 4.49Å; F857-L861 HydrophobicContact CE2-CD1 4.21Å; F857-L861 HydrophobicContact CE2-CG 4.39Å; F857-L861 HydrophobicContact CZ-CD1 3.59Å; F857-L861 HydrophobicContact CZ-CG 4.26Å; F857-L861 PolarHBondContact O-N 2.89Å; F857-L861 VanDerWaalsContact O-N 3.13Å; A858-L861 PolarHBondContact O-N 3.34Å; S859-L861 VanDerWaalsContact C-N 3.34Å; L861-T875 HydrophobicContact CD1-CG2 4.07Å
862	G	87.4	Confident	88.9	Confident	67 Å²	67	56.9 Å²	56.9	69%	0.691	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.9	11.9	178.5	0	0	0	0	0	114.5	A858 S859 I860	A858-G862 PolarHBondContact O-N 2.96Å; S859-G862 PolarHBondContact O-N 3.27Å; S859-G862 VanDerWaalsContact O-N 3.17Å; I860-G862 PolarHBondContact O-N 3.31Å
863	E	87.1	Confident	88.9	Confident	53 Å²	53	59.7 Å²	59.7	25%	0.248	37%	0.365	C	S	.	.			trans	-74.1	133.4	169.8	-66.8	-170.3	179.7	0	0	109.9	A858 V865 P871 S872 T875	A858-E863 PolarHBondContact O-N 3.42Å; A858-E863 VanDerWaalsContact O-N 3.15Å; E863-V865 HydrophobicContact CB-CG2 3.55Å; E863-V865 WeakPolarHBondContact O-CG2 3.33Å; E863-V865 PolarHBondContact O-N 3Å; E863-P871 WeakPolarHBondContact OE2-CA 3.44Å; E863-S872 VanDerWaalsContact OE1-CB 3.3Å; E863-S872 WeakPolarHBondContact OE1-CB 3.46Å; E863-S872 PolarHBondContact OE1-OG 3.49Å; E863-S872 PolarHBondContact OE2-N 2.84Å; E863-T875 VanDerWaalsContact CD-OG1 3.28Å; E863-T875 WeakPolarHBondContact OE1-CB 3.39Å; E863-T875 PolarHBondContact OE1-OG1 2.91Å
864	A	84.1	Confident	88.9	Confident	101 Å²	101	65.9 Å²	65.9	84%	0.835	39%	0.394	S	S	*	.			trans	-78.8	88	172.2	0	0	0	0	0	108.8
865	V	83.8	Confident	88.8	Confident	33 Å²	33	65.1 Å²	65.1	20%	0.2	39%	0.39	C	S	.	.			trans	-106.2	131.6	-175.2	-156.8	0	0	0	0	110.1	M855 A858 E863 N869 P871	M855-V865 HydrophobicContact CE-CB 3.83Å; M855-V865 HydrophobicContact CE-CG1 3.34Å; M855-V865 HydrophobicContact SD-CB 4.42Å; M855-V865 HydrophobicContact SD-CG1 3.49Å; M855-V865 WeakPolarHBondContact SD-CG1 3.3Å; A858-V865 HydrophobicContact CB-CG2 3.58Å; E863-V865 HydrophobicContact CB-CG2 3.55Å; E863-V865 WeakPolarHBondContact O-CG2 3.33Å; E863-V865 PolarHBondContact O-N 3Å; V865-N869 WeakPolarHBondContact CG1-O 3.39Å; V865-P871 HydrophobicContact CG1-CB 4.25Å; V865-P871 HydrophobicContact CG1-CG 4.44Å; V865-P871 HydrophobicContact CG2-CB 4.37Å
866	D	82.6	Confident	88.8	Confident	71 Å²	71	67 Å²	67	38%	0.38	40%	0.399	S	S	.	.			trans	-136.9	-174.9	172.6	61.7	31.9	0	0	0	109.5	E868 N869	D866-E868 PolarHBondContact O-N 2.95Å; D866-E868 WeakPolarHBondContact OD1-CA 3.34Å; D866-E868 PolarHBondContact OD1-N 3.37Å; D866-N869 PolarHBondContact N-O 3.31Å; D866-N869 CarbonylContact O-C 3.57Å; D866-N869 VanDerWaalsContact OD1-CB 3.27Å; D866-N869 WeakPolarHBondContact OD1-CB 3.45Å; D866-N869 PolarHBondContact OD1-N 3.15Å; D866-N869 PolarHBondContact OD1-ND2 3.17Å; D866-N869 VanDerWaalsContact OD1-ND2 3.1Å; D866-N869 PolarHBondContact OD2-ND2 3.13Å
867	S	78.8	Confident	88.9	Confident	111 Å²	111	68.7 Å²	68.7	78%	0.776	41%	0.408	S	S	*	.	S	Bend	trans	-66.7	-18.9	179.5	50.6	0	0	0	0	114.1
868	E	82.5	Confident	88.9	Confident	167 Å²	167	72.7 Å²	72.7	78%	0.78	42%	0.423	S	S	*	.	S	Bend	trans	-98.4	-25.2	-179.7	-60.4	-162.3	167.2	0	0	112.4	D866 P870	D866-E868 PolarHBondContact O-N 2.95Å; D866-E868 WeakPolarHBondContact OD1-CA 3.34Å; D866-E868 PolarHBondContact OD1-N 3.37Å; E868-P870 WeakPolarHBondContact O-CD 3.36Å
869	N	84.4	Confident	89.1	Confident	89 Å²	89	73 Å²	73	48%	0.476	42%	0.424	S	S	.	.	S	Bend	trans	-114.8	88.2	-177.6	-62	-57.4	0	0	0	109.3	V865 D866	V865-N869 WeakPolarHBondContact CG1-O 3.39Å; D866-N869 PolarHBondContact N-O 3.31Å; D866-N869 CarbonylContact O-C 3.57Å; D866-N869 VanDerWaalsContact OD1-CB 3.27Å; D866-N869 WeakPolarHBondContact OD1-CB 3.45Å; D866-N869 PolarHBondContact OD1-N 3.15Å; D866-N869 PolarHBondContact OD1-ND2 3.17Å; D866-N869 VanDerWaalsContact OD1-ND2 3.1Å; D866-N869 PolarHBondContact OD2-ND2 3.13Å
870	P	86	Confident	89.2	Confident	88 Å²	88	74.4 Å²	74.4	57%	0.571	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-65	157.6	178.1	28.5	-35.2	0	0	0	111.2	E868	E868-P870 WeakPolarHBondContact O-CD 3.36Å
871	P	89.2	Confident	89.4	Confident	5 Å²	5	78 Å²	78	3%	0.032	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-61.9	153.1	179.2	25.9	-32.8	0	0	0	110.9	L854 A858 E863 V865 T875 Q876	L854-P871 HydrophobicContact CD1-CG 4.04Å; L854-P871 HydrophobicContact CD2-CG 3.83Å; L854-P871 HydrophobicContact CG-CG 3.84Å; A858-P871 HydrophobicContact CB-CB 3.69Å; E863-P871 WeakPolarHBondContact OE2-CA 3.44Å; V865-P871 HydrophobicContact CG1-CB 4.25Å; V865-P871 HydrophobicContact CG1-CG 4.44Å; V865-P871 HydrophobicContact CG2-CB 4.37Å; P871-T875 HydrophobicContact CB-CG2 4.05Å; P871-Q876 HydrophobicContact CB-CG 4.48Å; P871-Q876 HydrophobicContact CG-CG 3.91Å; P871-Q876 PolarHBondContact O-NE2 3.18Å
872	S	91.6	Very high	89.6	Confident	47 Å²	47	76.2 Å²	76.2	33%	0.329	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-56.3	153.5	-178.6	73.9	0	0	0	0	112	E863 E874 T875 Q876	E863-S872 VanDerWaalsContact OE1-CB 3.3Å; E863-S872 WeakPolarHBondContact OE1-CB 3.46Å; E863-S872 PolarHBondContact OE1-OG 3.49Å; E863-S872 PolarHBondContact OE2-N 2.84Å; S872-E874 PolarHBondContact O-N 2.61Å; S872-T875 PolarHBondContact O-N 3.23Å; S872-T875 VanDerWaalsContact O-N 3.11Å; S872-T875 WeakPolarHBondContact OG-CB 3.25Å; S872-T875 PolarHBondContact OG-N 3.43Å; S872-T875 VanDerWaalsContact OG-N 3.15Å; S872-T875 PolarHBondContact OG-OG1 3.49Å; S872-Q876 WeakPolarHBondContact O-CG 3.22Å; S872-Q876 PolarHBondContact O-N 3.11Å
873	Q	92.5	Very high	90	Very high	159 Å²	159	73.9 Å²	73.9	74%	0.743	40%	0.403	S	S	*	.	H	α-helix	trans	-58.3	-34	178	-171.4	176.5	8.1	0	0	111.6	Q876 C877	Q873-Q876 PolarHBondContact O-N 2.96Å; Q873-C877 PolarHBondContact O-N 3.43Å; Q873-C877 PolarHBondContact O-SG 2.95Å
874	E	93.2	Very high	90.3	Very high	136 Å²	136	74 Å²	74	64%	0.636	41%	0.414	S	S	*	.	H	α-helix	trans	-64.9	-47.5	175.5	-171.4	-179.5	161.6	0	0	111.6	S872 Q876 C877 R878	S872-E874 PolarHBondContact O-N 2.61Å; E874-Q876 VanDerWaalsContact C-N 3.31Å; E874-Q876 PolarHBondContact O-N 2.59Å; E874-C877 WeakPolarHBondContact O-CB 3.45Å; E874-C877 PolarHBondContact O-N 3.26Å; E874-C877 VanDerWaalsContact O-N 3.15Å; E874-R878 WeakPolarHBondContact O-CG 3.35Å; E874-R878 PolarHBondContact O-N 2.91Å
875	T	93.1	Very high	90.9	Very high	4 Å²	4	72.8 Å²	72.8	3%	0.025	39%	0.391	C	S	.	.	H	α-helix	trans	-63.2	-37.8	177	-70.8	0	0	0	0	111.9	F857 A858 L861 E863 P871 S872 R878 F879	F857-T875 HydrophobicContact CD1-CG2 4.07Å; F857-T875 HydrophobicContact CE1-CG2 4.09Å; A858-T875 HydrophobicContact CB-CG2 3.72Å; L861-T875 HydrophobicContact CD1-CG2 4.07Å; E863-T875 VanDerWaalsContact CD-OG1 3.28Å; E863-T875 WeakPolarHBondContact OE1-CB 3.39Å; E863-T875 PolarHBondContact OE1-OG1 2.91Å; P871-T875 HydrophobicContact CB-CG2 4.05Å; S872-T875 PolarHBondContact O-N 3.23Å; S872-T875 VanDerWaalsContact O-N 3.11Å; S872-T875 WeakPolarHBondContact OG-CB 3.25Å; S872-T875 PolarHBondContact OG-N 3.43Å; S872-T875 VanDerWaalsContact OG-N 3.15Å; S872-T875 PolarHBondContact OG-OG1 3.49Å; T875-R878 PolarHBondContact O-N 3.48Å; T875-F879 WeakPolarHBondContact O-CB 3.4Å; T875-F879 PolarHBondContact O-N 2.81Å
876	Q	93.7	Very high	91.3	Very high	74 Å²	74	71.2 Å²	71.2	35%	0.346	38%	0.381	S	S	.	.	H	α-helix	trans	-62.6	-44.2	172.1	-67.1	179.8	28.9	0	0	112	L854 P871 S872 Q873 E874 F879 L880	L854-Q876 HydrophobicContact CD1-CG 4.46Å; L854-Q876 HydrophobicContact CD2-CG 4.37Å; P871-Q876 HydrophobicContact CB-CG 4.48Å; P871-Q876 HydrophobicContact CG-CG 3.91Å; P871-Q876 PolarHBondContact O-NE2 3.18Å; S872-Q876 WeakPolarHBondContact O-CG 3.22Å; S872-Q876 PolarHBondContact O-N 3.11Å; Q873-Q876 PolarHBondContact O-N 2.96Å; E874-Q876 VanDerWaalsContact C-N 3.31Å; E874-Q876 PolarHBondContact O-N 2.59Å; Q876-F879 PolarHBondContact O-N 2.92Å; Q876-L880 WeakPolarHBondContact O-CB 3.44Å; Q876-L880 VanDerWaalsContact O-CG 3.28Å; Q876-L880 WeakPolarHBondContact O-CG 3.32Å; Q876-L880 PolarHBondContact O-N 2.91Å
877	C	94.7	Very high	91.8	Very high	73 Å²	73	73 Å²	73	49%	0.493	39%	0.387	S	S	.	.	H	α-helix	trans	-62.2	-44.2	175.9	-74.5	0	0	0	0	112.1	Q873 E874 L880 Q881	Q873-C877 PolarHBondContact O-N 3.43Å; Q873-C877 PolarHBondContact O-SG 2.95Å; E874-C877 WeakPolarHBondContact O-CB 3.45Å; E874-C877 PolarHBondContact O-N 3.26Å; E874-C877 VanDerWaalsContact O-N 3.15Å; C877-L880 PolarHBondContact O-N 2.92Å; C877-Q881 WeakPolarHBondContact O-CB 3.44Å; C877-Q881 PolarHBondContact O-N 3.28Å
878	R	95.1	Very high	92.5	Very high	84 Å²	84	77.6 Å²	77.6	32%	0.317	39%	0.389	S	S	.	.	H	α-helix	trans	-62.3	-43	176.2	-70.7	172.6	68.5	178.6	0.3	111.9	D833 F857 E874 T875 Q881 G882	D833-R878 VanDerWaalsContact CG-NH2 3.26Å; D833-R878 IonicContact OD1-CZ 3.68Å; D833-R878 IonicContact OD1-NE 2.72Å; D833-R878 IonicContact OD1-NH2 2.79Å; D833-R878 PolarHBondContact OD1-NH2 3.21Å; D833-R878 IonicContact OD2-CZ 2.86Å; D833-R878 IonicContact OD2-NE 3.32Å; D833-R878 PolarHBondContact OD2-NE 3.44Å; D833-R878 IonicContact OD2-NH2 3.28Å; D833-R878 PolarHBondContact OD2-NH2 2.87Å; D833-R878 VanDerWaalsContact OD2-NH2 3.1Å; F857-R878 HydrophobicContact CE1-CB 4.37Å; E874-R878 WeakPolarHBondContact O-CG 3.35Å; E874-R878 PolarHBondContact O-N 2.91Å; T875-R878 PolarHBondContact O-N 3.48Å; R878-Q881 PolarHBondContact O-N 3.45Å; R878-G882 PolarHBondContact O-N 3.01Å
879	F	95.9	Very high	92.9	Very high	7 Å²	7	72.9 Å²	72.9	3%	0.031	37%	0.369	C	S	.	.	H	α-helix	trans	-60.9	-48.4	174.3	176.8	-102.8	0	0	0	111.9	L837 W853 L854 F857 T875 Q876 Q881 G882 L883	L837-F879 HydrophobicContact CD2-CD2 3.56Å; L837-F879 HydrophobicContact CD2-CE2 3.72Å; W853-F879 HydrophobicContact CB-CE2 4.3Å; W853-F879 HydrophobicContact CB-CZ 4.27Å; W853-F879 HydrophobicContact CD2-CE2 4.07Å; W853-F879 HydrophobicContact CD2-CZ 4.3Å; W853-F879 HydrophobicContact CE3-CE2 4.42Å; W853-F879 HydrophobicContact CE3-CZ 4.27Å; W853-F879 HydrophobicContact CG-CE2 4.01Å; W853-F879 HydrophobicContact CG-CZ 4.32Å; L854-F879 HydrophobicContact CB-CD1 4.05Å; L854-F879 HydrophobicContact CB-CD2 4.28Å; L854-F879 HydrophobicContact CB-CE1 3.79Å; L854-F879 HydrophobicContact CB-CE2 4.1Å; L854-F879 HydrophobicContact CB-CG 4.27Å; L854-F879 HydrophobicContact CB-CZ 3.84Å; L854-F879 HydrophobicContact CD1-CB 3.56Å; L854-F879 HydrophobicContact CD1-CD1 3.65Å; L854-F879 HydrophobicContact CD1-CD2 4.02Å; L854-F879 HydrophobicContact CD1-CE1 4.29Å; L854-F879 HydrophobicContact CD1-CG 3.47Å; L854-F879 VanDerWaalsContact CD1-CG 3.47Å; L854-F879 HydrophobicContact CG-CD1 4.31Å; L854-F879 HydrophobicContact CG-CG 4.45Å; F857-F879 HydrophobicContact CB-CD2 4.16Å; F857-F879 HydrophobicContact CD1-CB 3.92Å; F857-F879 HydrophobicContact CD1-CD2 4.01Å; F857-F879 HydrophobicContact CD1-CG 4.44Å; F857-F879 HydrophobicContact CE1-CB 4.05Å; F857-F879 HydrophobicContact CG-CD2 4.19Å; T875-F879 WeakPolarHBondContact O-CB 3.4Å; T875-F879 PolarHBondContact O-N 2.81Å; Q876-F879 PolarHBondContact O-N 2.92Å; F879-Q881 VanDerWaalsContact C-N 3.31Å; F879-Q881 PolarHBondContact O-N 2.93Å; F879-G882 PolarHBondContact O-N 3.13Å; F879-L883 HydrophobicContact CD1-CD1 3.71Å; F879-L883 HydrophobicContact CD1-CG 4.21Å; F879-L883 HydrophobicContact CE1-CD1 3.2Å; F879-L883 HydrophobicContact CE1-CD2 4.5Å; F879-L883 HydrophobicContact CE1-CG 3.88Å; F879-L883 HydrophobicContact CE2-CD1 4.46Å; F879-L883 HydrophobicContact CE2-CD2 4.48Å; F879-L883 HydrophobicContact CE2-CG 4.31Å; F879-L883 HydrophobicContact CZ-CD1 3.63Å; F879-L883 HydrophobicContact CZ-CD2 4.1Å; F879-L883 HydrophobicContact CZ-CG 3.91Å; F879-L883 WeakPolarHBondContact O-CB 3.26Å; F879-L883 WeakPolarHBondContact O-CG 3.28Å; F879-L883 PolarHBondContact O-N 2.87Å
880	L	94.8	Very high	93.1	Very high	110 Å²	110	70 Å²	70	58%	0.576	36%	0.361	S	S	*	.	H	α-helix	trans	-62.5	-38.3	177.9	-72.2	173.5	0	0	0	112	Q876 C877 L883 A884	Q876-L880 WeakPolarHBondContact O-CB 3.44Å; Q876-L880 VanDerWaalsContact O-CG 3.28Å; Q876-L880 WeakPolarHBondContact O-CG 3.32Å; Q876-L880 PolarHBondContact O-N 2.91Å; C877-L880 PolarHBondContact O-N 2.92Å; L880-L883 HydrophobicContact CD2-CD1 4.37Å; L880-L883 PolarHBondContact O-N 3.21Å; L880-A884 WeakPolarHBondContact O-CB 3.45Å; L880-A884 PolarHBondContact O-N 3.15Å
881	Q	96.1	Very high	93.3	Very high	118 Å²	118	66.2 Å²	66.2	55%	0.551	34%	0.336	S	S	*	.	H	α-helix	trans	-63.1	-49.9	173.5	-178.5	179.4	-14.5	0	0	111.2	C877 R878 F879 L883 A884 E885	C877-Q881 WeakPolarHBondContact O-CB 3.44Å; C877-Q881 PolarHBondContact O-N 3.28Å; R878-Q881 PolarHBondContact O-N 3.45Å; F879-Q881 VanDerWaalsContact C-N 3.31Å; F879-Q881 PolarHBondContact O-N 2.93Å; Q881-L883 VanDerWaalsContact C-N 3.3Å; Q881-L883 PolarHBondContact O-N 3.11Å; Q881-A884 WeakPolarHBondContact O-CB 3.37Å; Q881-A884 PolarHBondContact O-N 3.47Å; Q881-A884 VanDerWaalsContact O-N 3.1Å; Q881-E885 PolarHBondContact NE2-OE1 3.09Å; Q881-E885 WeakPolarHBondContact O-CG 3.08Å; Q881-E885 PolarHBondContact O-N 3.42Å
882	G	95.3	Very high	93.5	Very high	3 Å²	3	66.2 Å²	66.2	3%	0.031	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-34	178.1	0	0	0	0	0	113.3	R878 F879 E885 L886	R878-G882 PolarHBondContact O-N 3.01Å; F879-G882 PolarHBondContact O-N 3.13Å; G882-E885 PolarHBondContact O-N 2.85Å; G882-L886 WeakPolarHBondContact O-CB 3.49Å; G882-L886 WeakPolarHBondContact O-CG 3.48Å; G882-L886 PolarHBondContact O-N 3.5Å
883	L	94.6	Very high	93.5	Very high	18 Å²	18	70.1 Å²	70.1	9%	0.094	35%	0.347	C	S	.	.	H	α-helix	trans	-62.4	-45.6	169.9	-79.1	-179.5	0	0	0	112.1	L850 W853 F879 L880 Q881 E885 L886 Q887 I892	L850-L883 HydrophobicContact CD2-CD1 3.93Å; L850-L883 HydrophobicContact CD2-CD2 4.1Å; W853-L883 HydrophobicContact CE3-CD2 3.69Å; W853-L883 HydrophobicContact CH2-CD2 3.62Å; W853-L883 HydrophobicContact CZ3-CD2 3.12Å; F879-L883 HydrophobicContact CD1-CD1 3.71Å; F879-L883 HydrophobicContact CD1-CG 4.21Å; F879-L883 HydrophobicContact CE1-CD1 3.2Å; F879-L883 HydrophobicContact CE1-CD2 4.5Å; F879-L883 HydrophobicContact CE1-CG 3.88Å; F879-L883 HydrophobicContact CE2-CD1 4.46Å; F879-L883 HydrophobicContact CE2-CD2 4.48Å; F879-L883 HydrophobicContact CE2-CG 4.31Å; F879-L883 HydrophobicContact CZ-CD1 3.63Å; F879-L883 HydrophobicContact CZ-CD2 4.1Å; F879-L883 HydrophobicContact CZ-CG 3.91Å; F879-L883 WeakPolarHBondContact O-CB 3.26Å; F879-L883 WeakPolarHBondContact O-CG 3.28Å; F879-L883 PolarHBondContact O-N 2.87Å; L880-L883 HydrophobicContact CD2-CD1 4.37Å; L880-L883 PolarHBondContact O-N 3.21Å; Q881-L883 VanDerWaalsContact C-N 3.3Å; Q881-L883 PolarHBondContact O-N 3.11Å; L883-E885 VanDerWaalsContact C-N 3.3Å; L883-E885 PolarHBondContact O-N 2.85Å; L883-L886 PolarHBondContact O-N 3.06Å; L883-Q887 WeakPolarHBondContact O-CB 3.39Å; L883-Q887 PolarHBondContact O-N 2.96Å; L883-I892 HydrophobicContact CD2-CD1 3.76Å
884	A	94.7	Very high	93.5	Very high	57 Å²	57	66.4 Å²	66.4	47%	0.471	34%	0.339	S	S	.	.	H	α-helix	trans	-61.3	-41.3	177.8	0	0	0	0	0	111.2	L880 Q881 Q887 Y888	L880-A884 WeakPolarHBondContact O-CB 3.45Å; L880-A884 PolarHBondContact O-N 3.15Å; Q881-A884 WeakPolarHBondContact O-CB 3.37Å; Q881-A884 PolarHBondContact O-N 3.47Å; Q881-A884 VanDerWaalsContact O-N 3.1Å; A884-Q887 PolarHBondContact O-N 3.5Å; A884-Y888 WeakPolarHBondContact O-CB 3.38Å; A884-Y888 PolarHBondContact O-N 2.91Å
885	E	95.4	Very high	93.3	Very high	74 Å²	74	61.2 Å²	61.2	35%	0.346	32%	0.316	S	S	.	.	H	α-helix	trans	-66	-45.1	175.4	-70.9	175.4	-166.9	0	0	112.3	L834 Q881 G882 L883 Q887 Y888 L889	L834-E885 HydrophobicContact CD1-CB 3.82Å; Q881-E885 PolarHBondContact NE2-OE1 3.09Å; Q881-E885 WeakPolarHBondContact O-CG 3.08Å; Q881-E885 PolarHBondContact O-N 3.42Å; G882-E885 PolarHBondContact O-N 2.85Å; L883-E885 VanDerWaalsContact C-N 3.3Å; L883-E885 PolarHBondContact O-N 2.85Å; E885-Q887 VanDerWaalsContact C-N 3.3Å; E885-Q887 PolarHBondContact O-N 2.82Å; E885-Y888 WeakPolarHBondContact O-CB 3.27Å; E885-Y888 PolarHBondContact O-N 2.9Å; E885-L889 WeakPolarHBondContact O-CG 3.35Å; E885-L889 PolarHBondContact O-N 2.91Å
886	L	93.4	Very high	93.2	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-64.2	-35	175.7	-74.4	176.9	0	0	0	112.7	L834 L837 Y838 W853 G882 L883 G890 C891 I892	L834-L886 HydrophobicContact CD1-CD2 3.68Å; L834-L886 HydrophobicContact CD1-CG 3.66Å; L837-L886 HydrophobicContact CB-CD1 3.77Å; Y838-L886 HydrophobicContact CD2-CD2 4.07Å; W853-L886 HydrophobicContact CH2-CD1 3.59Å; W853-L886 HydrophobicContact CZ2-CD1 3.72Å; G882-L886 WeakPolarHBondContact O-CB 3.49Å; G882-L886 WeakPolarHBondContact O-CG 3.48Å; G882-L886 PolarHBondContact O-N 3.5Å; L883-L886 PolarHBondContact O-N 3.06Å; L886-G890 PolarHBondContact O-N 3.15Å; L886-C891 HydrophobicContact CB-CB 4.32Å; L886-C891 HydrophobicContact CD2-CB 4.09Å; L886-C891 WeakPolarHBondContact O-CB 3.4Å; L886-C891 PolarHBondContact O-N 3.46Å; L886-I892 HydrophobicContact CB-CD1 4.12Å; L886-I892 HydrophobicContact CB-CG1 4.15Å
887	Q	93.2	Very high	93	Very high	109 Å²	109	79.9 Å²	79.9	51%	0.509	38%	0.383	S	S	.	.	H	α-helix	trans	-67.6	-42.3	173.4	-176	176.6	-22.6	0	0	110.8	L883 A884 E885 G890 I892	L883-Q887 WeakPolarHBondContact O-CB 3.39Å; L883-Q887 PolarHBondContact O-N 2.96Å; A884-Q887 PolarHBondContact O-N 3.5Å; E885-Q887 VanDerWaalsContact C-N 3.3Å; E885-Q887 PolarHBondContact O-N 2.82Å; Q887-G890 PolarHBondContact O-N 2.96Å; Q887-G890 VanDerWaalsContact O-N 3.12Å; Q887-I892 HydrophobicContact CB-CD1 4.31Å; Q887-I892 HydrophobicContact CB-CG1 3.92Å
888	Y	92.5	Very high	92.6	Very high	208 Å²	208	81.7 Å²	81.7	82%	0.816	38%	0.382	S	S	*	.	H	α-helix	trans	-62.4	-41.8	176.3	-178.3	-99.2	0	0	0	112.3	A884 E885 G890	A884-Y888 WeakPolarHBondContact O-CB 3.38Å; A884-Y888 PolarHBondContact O-N 2.91Å; E885-Y888 WeakPolarHBondContact O-CB 3.27Å; E885-Y888 PolarHBondContact O-N 2.9Å; Y888-G890 PolarHBondContact O-N 3.26Å
889	L	90.7	Very high	92.3	Very high	67 Å²	67	83.4 Å²	83.4	35%	0.351	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-6.7	175.2	-68.5	173.7	0	0	0	113.9	L803 L834 E885	L803-L889 HydrophobicContact CD1-CD1 4.4Å; L803-L889 HydrophobicContact CD1-CD2 4.31Å; L834-L889 HydrophobicContact CD2-CD1 4.19Å; E885-L889 WeakPolarHBondContact O-CG 3.35Å; E885-L889 PolarHBondContact O-N 2.91Å
890	G	90	Very high	91.9	Very high	30 Å²	30	88.3 Å²	88.3	31%	0.309	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	24.4	-178.6	0	0	0	0	0	114.1	L886 Q887 Y888 L905	L886-G890 PolarHBondContact O-N 3.15Å; Q887-G890 PolarHBondContact O-N 2.96Å; Q887-G890 VanDerWaalsContact O-N 3.12Å; Y888-G890 PolarHBondContact O-N 3.26Å; G890-L905 WeakPolarHBondContact O-CD1 3.44Å
891	C	89.6	Confident	91.8	Very high	7 Å²	7	84 Å²	84	5%	0.047	41%	0.405	C	S	.	.	S	Bend	trans	-81.9	-33.4	175.6	-66.1	0	0	0	0	112.1	L841 L886 L905 I908	L841-C891 HydrophobicContact CD2-CB 3.95Å; L886-C891 HydrophobicContact CB-CB 4.32Å; L886-C891 HydrophobicContact CD2-CB 4.09Å; L886-C891 WeakPolarHBondContact O-CB 3.4Å; L886-C891 PolarHBondContact O-N 3.46Å; C891-L905 PolarHBondContact O-N 2.78Å; C891-I908 HydrophobicContact CB-CD1 4.1Å
892	I	92.6	Very high	91.7	Very high	6 Å²	6	79 Å²	79	3%	0.031	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	155.2	-179.4	62	174.9	0	0	0	112.1	L841 W853 L883 L886 Q887 I903	L841-I892 HydrophobicContact CD1-CG2 3.75Å; L841-I892 HydrophobicContact CD2-CG2 3.63Å; L841-I892 HydrophobicContact CG-CG2 4.36Å; W853-I892 HydrophobicContact CH2-CD1 4.39Å; W853-I892 HydrophobicContact CH2-CG2 4.29Å; W853-I892 HydrophobicContact CZ3-CD1 4.25Å; W853-I892 HydrophobicContact CZ3-CG2 4.45Å; L883-I892 HydrophobicContact CD2-CD1 3.76Å; L886-I892 HydrophobicContact CB-CD1 4.12Å; L886-I892 HydrophobicContact CB-CG1 4.15Å; Q887-I892 HydrophobicContact CB-CD1 4.31Å; Q887-I892 HydrophobicContact CB-CG1 3.92Å; I892-I903 CarbonylContact C-O 3.57Å; I892-I903 WeakPolarHBondContact CA-O 3.23Å
893	K	92.8	Very high	91.5	Very high	128 Å²	128	80.4 Å²	80.4	56%	0.557	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.3	138.7	173.4	-173.5	178.8	178.9	174	0	110.5	I903 L905	K893-I903 PolarHBondContact N-O 3.1Å; K893-I903 PolarHBondContact O-N 2.99Å; K893-L905 HydrophobicContact CB-CD1 4.23Å; K893-L905 HydrophobicContact CB-CD2 4.13Å; K893-L905 HydrophobicContact CB-CG 4.26Å
894	S	91.3	Very high	91.3	Very high	82 Å²	82	81.1 Å²	81.1	57%	0.573	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.3	144.4	172.8	59.3	0	0	0	0	111.5
895	T	90.8	Very high	90.8	Very high	26 Å²	26	80.8 Å²	80.8	16%	0.16	38%	0.38	C	S	.	.			trans	-129.7	144.7	178.7	178.8	0	0	0	0	111.4	R897 H901 I903	T895-R897 WeakPolarHBondContact OG1-CB 3.13Å; T895-R897 PolarHBondContact OG1-N 3.14Å; T895-H901 HydrophobicContact CG2-CB 4.09Å; T895-H901 WeakPolarHBondContact CG2-O 3.27Å; T895-I903 HydrophobicContact CG2-CD1 4.18Å; T895-I903 HydrophobicContact CG2-CG1 3.84Å
896	R	90.2	Very high	89.3	Confident	261 Å²	261	82 Å²	82	99%	0.985	39%	0.393	S	S	*	.	S	Bend	trans	-96.8	0.2	170.4	-61.1	-175.5	-178	-177.3	-0.2	112.6
897	R	88.2	Confident	87.9	Confident	210 Å²	210	89.9 Å²	89.9	79%	0.792	42%	0.423	S	S	*	.	S	Bend	trans	-71.5	-34.3	-175.9	-67.2	-175.9	177.5	-170.6	-2.1	112.8	T895	T895-R897 WeakPolarHBondContact OG1-CB 3.13Å; T895-R897 PolarHBondContact OG1-N 3.14Å
898	K	88.1	Confident	86.2	Confident	111 Å²	111	85.1 Å²	85.1	48%	0.483	40%	0.401	S	S	.	.	S	Bend	trans	-143.5	135.5	176.5	-166.3	171.9	173.2	-156.6	0	107.9	H901	K898-H901 HydrophobicContact CB-CB 4.19Å; K898-H901 VanDerWaalsContact CD-CE1 3.46Å; K898-H901 WeakPolarHBondContact CD-CE1 3.43Å; K898-H901 WeakPolarHBondContact CD-NE2 3.38Å; K898-H901 WeakPolarHBondContact CE-CE1 3.34Å; K898-H901 WeakPolarHBondContact CE-NE2 3.39Å; K898-H901 PolarHBondContact NZ-CE1 2.9Å; K898-H901 VanDerWaalsContact NZ-CE1 3.34Å; K898-H901 PolarHBondContact NZ-NE2 2.96Å
899	V	87.4	Confident	84	Confident	119 Å²	119	78 Å²	78	72%	0.721	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	142.8	179.5	-173	0	0	0	0	108.8	H901	V899-H901 PolarHBondContact O-N 3.48Å; V899-H901 PolarHBondContact O-ND1 3.17Å
900	D	88.3	Confident	81.9	Confident	110 Å²	110	78.1 Å²	78.1	59%	0.588	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	28.1	179.9	-49.3	-33.8	0	0	0	115.2	L850	L850-D900 WeakPolarHBondContact CB-O 3.47Å; L850-D900 WeakPolarHBondContact CG-O 3.48Å; L850-D900 PolarHBondContact N-O 3.47Å
901	H	92.4	Very high	79.7	Confident	21 Å²	21	79.9 Å²	79.9	10%	0.097	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	151.2	175.4	-69.6	55.2	0	0	0	111.7	V848 T895 K898 V899	V848-H901 VanDerWaalsContact O-CA 3.23Å; V848-H901 WeakPolarHBondContact O-CA 3.39Å; T895-H901 HydrophobicContact CG2-CB 4.09Å; T895-H901 WeakPolarHBondContact CG2-O 3.27Å; K898-H901 HydrophobicContact CB-CB 4.19Å; K898-H901 VanDerWaalsContact CD-CE1 3.46Å; K898-H901 WeakPolarHBondContact CD-CE1 3.43Å; K898-H901 WeakPolarHBondContact CD-NE2 3.38Å; K898-H901 WeakPolarHBondContact CE-CE1 3.34Å; K898-H901 WeakPolarHBondContact CE-NE2 3.39Å; K898-H901 PolarHBondContact NZ-CE1 2.9Å; K898-H901 VanDerWaalsContact NZ-CE1 3.34Å; K898-H901 PolarHBondContact NZ-NE2 2.96Å; V899-H901 PolarHBondContact O-N 3.48Å; V899-H901 PolarHBondContact O-ND1 3.17Å
902	V	93.3	Very high	77.2	Confident	13 Å²	13	88.1 Å²	88.1	8%	0.079	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	154.2	167.6	-66.9	0	0	0	0	110.2	M847 V848 L850 W853	M847-V902 WeakPolarHBondContact CA-O 3.29Å; V848-V902 HydrophobicContact CB-CG2 3.96Å; V848-V902 PolarHBondContact N-O 3.04Å; V848-V902 PolarHBondContact O-N 3.19Å; L850-V902 HydrophobicContact CD1-CG1 4.23Å; L850-V902 HydrophobicContact CD2-CB 4.42Å; L850-V902 HydrophobicContact CD2-CG1 3.72Å; L850-V902 HydrophobicContact CD2-CG2 3.86Å; L850-V902 HydrophobicContact CG-CG1 4.17Å; W853-V902 HydrophobicContact CE3-CG2 4.4Å; W853-V902 HydrophobicContact CZ3-CG2 4.05Å
903	I	91.7	Very high	76.4	Confident	32 Å²	32	92.2 Å²	92.2	16%	0.164	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.3	175.8	-67.5	171.3	0	0	0	108.6	K846 M847 I892 K893 T895	K846-I903 HydrophobicContact CG-CG2 4.45Å; K846-I903 WeakPolarHBondContact O-CA 3.46Å; M847-I903 HydrophobicContact CG-CG1 4.19Å; I892-I903 CarbonylContact C-O 3.57Å; I892-I903 WeakPolarHBondContact CA-O 3.23Å; K893-I903 PolarHBondContact N-O 3.1Å; K893-I903 PolarHBondContact O-N 2.99Å; T895-I903 HydrophobicContact CG2-CD1 4.18Å; T895-I903 HydrophobicContact CG2-CG1 3.84Å
904	R	89.8	Confident	75.6	Confident	32 Å²	32	90.3 Å²	90.3	12%	0.121	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	129.4	167.6	-170.6	178	82.5	179.6	6	110.2	L841 I842 T844 K846 I908 S909	L841-R904 HydrophobicContact CD1-CB 4.05Å; L841-R904 HydrophobicContact CD1-CG 3.87Å; L841-R904 HydrophobicContact CD2-CG 4.36Å; L841-R904 HydrophobicContact CG-CG 4.01Å; L841-R904 VanDerWaalsContact O-CD 3.25Å; L841-R904 WeakPolarHBondContact O-CD 3.38Å; L841-R904 PolarHBondContact O-NH1 3.31Å; I842-R904 PolarHBondContact O-NH1 2.88Å; T844-R904 PolarHBondContact O-NH1 3.29Å; K846-R904 PolarHBondContact O-N 2.69Å; R904-I908 HydrophobicContact CG-CD1 4.22Å; R904-S909 PolarHBondContact NH2-OG 3.29Å
905	L	85.8	Confident	74.7	Confident	50 Å²	50	90.8 Å²	90.8	26%	0.262	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-84.5	139	176	-63.9	177.4	0	0	0	110.7	G890 C891 K893 W907	G890-L905 WeakPolarHBondContact O-CD1 3.44Å; C891-L905 PolarHBondContact O-N 2.78Å; K893-L905 HydrophobicContact CB-CD1 4.23Å; K893-L905 HydrophobicContact CB-CD2 4.13Å; K893-L905 HydrophobicContact CB-CG 4.26Å; L905-W907 VanDerWaalsContact C-N 3.29Å; L905-W907 PolarHBondContact O-N 2.98Å; L905-W907 VanDerWaalsContact O-N 3.12Å
906	T	62.9	Low	73.8	Confident	99 Å²	99	94.6 Å²	94.6	61%	0.607	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-69.5	-9	-159.3	15.1	0	0	0	0	117	I908 S909	T906-I908 PolarHBondContact O-N 3.34Å; T906-S909 PolarHBondContact O-N 2.72Å
907	W	64.5	Low	72.7	Confident	166 Å²	166	84.2 Å²	84.2	63%	0.629	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-59.7	-23.2	-177.6	-48.3	94.1	0	0	0	112.9	L905	L905-W907 VanDerWaalsContact C-N 3.29Å; L905-W907 PolarHBondContact O-N 2.98Å; L905-W907 VanDerWaalsContact O-N 3.12Å
908	I	56.2	Low	71.7	Confident	10 Å²	10	75.8 Å²	75.8	5%	0.051	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-77.2	-27.2	-178.4	-56.7	171.1	0	0	0	111.8	Y838 L841 I842 C891 R904 T906	Y838-I908 HydrophobicContact CD2-CD1 4.49Å; Y838-I908 HydrophobicContact CE2-CD1 3.65Å; Y838-I908 HydrophobicContact CE2-CG1 4.1Å; L841-I908 HydrophobicContact CD2-CD1 4Å; I842-I908 HydrophobicContact CD1-CG2 4.32Å; I842-I908 HydrophobicContact CG1-CG2 3.49Å; I842-I908 VanDerWaalsContact CG1-CG2 3.49Å; C891-I908 HydrophobicContact CB-CD1 4.1Å; R904-I908 HydrophobicContact CG-CD1 4.22Å; T906-I908 PolarHBondContact O-N 3.34Å
909	S	48	Very low	70.5	Confident	59 Å²	59	73.3 Å²	73.3	41%	0.413	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-23.8	-176.2	-71	0	0	0	0	114.5	R904 T906	R904-S909 PolarHBondContact NH2-OG 3.29Å; T906-S909 PolarHBondContact O-N 2.72Å
910	G	45.3	Very low	69.2	Low	68 Å²	68	69.8 Å²	69.8	70%	0.701	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	0.7	-175.7	0	0	0	0	0	115.1
911	L	44.9	Very low	67.6	Low	68 Å²	68	66.4 Å²	66.4	36%	0.356	37%	0.368	S	S	.	.			trans	-102.1	-7.3	179.7	-83.6	157.6	0	0	0	113.2	Q800 R801	Q800-L911 HydrophobicContact CB-CD1 4.13Å; R801-L911 HydrophobicContact CB-CD2 4.44Å
912	L	37	Very low	65.4	Low	179 Å²	179	70.5 Å²	70.5	94%	0.937	39%	0.393	S	S	*	.			trans	-82.7	0	161.2	-71.2	166.1	0	0	0	108.5	I842	I842-L912 HydrophobicContact CG2-CD1 4.38Å

Retrieved 912 of 912 residues in 645.3 ms (Link to these results)

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