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Coatomer subunit gamma

The coatomer is a cytosolic protein complex that binds to dilysine motifs and reversibly associates with Golgi non-clathrin-coated vesicles, which further mediate biosynthetic protein transport from the ER, via the Golgi up to the trans Golgi network. Coatomer complex is required for budding from Golgi membranes, and is essential for the retrograde Golgi-to-ER transport of dilysine-tagged proteins.

AlphaFold DB , UniProt , Accession A0A061ACR1, Species CAEEL (Caenorhabditis elegans), Gene copg-1, Length 872 aa.

						>A0A061ACR1_CAEEL|A0A061ACR1|copg-1
MKTNKKDEETGGNVYAHLDKTSVLQEARAFNETPINARKCCFILSKLIYIIQQGESIGRTEATEAFFGVTKLWQSKDVSLRRMVYLAVKELAEVSDDVIIVTSSLTKDMTGREDLYRAAAIRALCKITDTGMLQTIERYMKQAIVDRNSAISSSAIVSSIHLMRKSSEVVRRWANEVQEAVSSDNHMVQYHALALLYQIRANDRLAVNKLVQKFSKNALRSPYAVCYLIRIATRCLVDDDHCRPDSSVFTFIESCLRHKSEMVVYEAARAIVSLPQTTPSEIQPAITALQMCCTSPKAAVRFAAVRTLNKVAMAHPNAVMSCNVDLEKFITDPNRSIATLAITTLLKTGAESSVERLMQQIAGFVNEISDEFKIVVVDAIRSLCSRYPRKHTVMMPFLAKMLRSDGSYDYKKAIVETIIAIIEENPDAKVAGLAHLCEFIEDCEHDNLSTRVLHLLGREAPKTPNPSSYIRFIYNRVILESTKVRAAAVTALAKFGAQCVDLRPSIQVLLKRCLLDSDDEVRDRATFYLKMLTEAAEGLIHNFILDGLQVSPSGLERSILDYLRSGSYSSPFDLRVVPVTQQALSQPEKRVPQLVEEEEKPKAPKVEPYAAQLAAIPQFAALGPVFKSSTRIALTESIAEYTVHMIKHTFANAMVLQFECKNTMNDQLLLDVSVELEDPDGEWETGNTVQIDKLPYGEVHSAFSLLEFPDSGAISGSLGAILKFKVMDVDPTSGEPDSDDTYEQTYVLEEVDVNVSDSVQGVAKSSFGSAWEALGDDATREETFQLSTVENIPDAVKKISEILGLVPCERSDRVPEGKTQHTVFLSGVFRGGYDVLSKATVAVDPNDNSIAMNIIIKSNEPLVADLVISAVV
					

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(Predicted Aligned Error values between residue pairs)

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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	32.4	Very low	36.4	Very low	242 Å²	242	168.7 Å²	168.7	100%	1.192	88%	0.876	S	S	*	*				0	134.9	0	-125.2	170.4	175.5	0	0	107.5	T3	M1-T3 PolarHBondContact O-N 2.82Å
2	K	34.1	Very low	37.9	Very low	203 Å²	203	159 Å²	159	88%	0.883	85%	0.847	S	S	*	*			trans	-54.9	124.4	174.2	-81	173.3	170.8	176.2	0	109.3	N4	K2-N4 PolarHBondContact O-N 2.73Å
3	T	34.5	Very low	39.9	Very low	139 Å²	139	153.2 Å²	153.2	85%	0.853	82%	0.817	S	S	*	*			trans	-71.3	110	172.1	30.7	0	0	0	0	108.9	M1 K5	M1-T3 PolarHBondContact O-N 2.82Å; T3-K5 PolarHBondContact O-N 2.71Å
4	N	34.8	Very low	41.7	Very low	137 Å²	137	150.9 Å²	150.9	73%	0.733	81%	0.81	S	S	*	*			trans	-73.4	123.8	169.9	-90.2	-17.9	0	0	0	108.9	K2 K6	K2-N4 PolarHBondContact O-N 2.73Å; N4-K6 PolarHBondContact O-N 3.36Å
5	K	37.9	Very low	43.7	Very low	214 Å²	214	144.7 Å²	144.7	93%	0.93	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	34.4	-177.1	-112.3	-179.1	176.8	-175.5	0	114	T3	T3-K5 PolarHBondContact O-N 2.71Å
6	K	33.6	Very low	44.9	Very low	186 Å²	186	138.6 Å²	138.6	81%	0.809	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.1	-2.8	-176.3	-105.1	-172.5	175.7	-173.7	0	115.5	N4	N4-K6 PolarHBondContact O-N 3.36Å
7	D	38.3	Very low	46.5	Very low	140 Å²	140	141.3 Å²	141.3	75%	0.749	75%	0.754	S	S	*	*	S	Bend	trans	-101.2	10.7	-172.9	-64.6	-20	0	0	0	114.4
8	E	36.6	Very low	48.4	Very low	193 Å²	193	135.3 Å²	135.3	90%	0.902	72%	0.721	S	S	*	*	S	Bend	trans	-95.5	-4.3	-179	-76.5	-174.1	161.2	0	0	114.8
9	E	38.9	Very low	50.2	Low	191 Å²	191	132.7 Å²	132.7	89%	0.893	71%	0.708	S	S	*	*	S	Bend	trans	-108.4	10.1	-175.9	-83	-173.3	165.2	0	0	116.2
10	T	38.4	Very low	51.8	Low	116 Å²	116	127.9 Å²	127.9	71%	0.712	68%	0.68	S	S	*	*			trans	-127.9	88.6	170.4	29.6	0	0	0	0	110.8	G12	T10-G12 PolarHBondContact O-N 3.17Å
11	G	41.2	Very low	53.3	Low	95 Å²	95	125.6 Å²	125.6	98%	0.979	67%	0.671	S	S	*	*			trans	-68.4	39.2	165	0	0	0	0	0	113.2
12	G	54.2	Low	55.9	Low	52 Å²	52	116 Å²	116	54%	0.536	63%	0.628	S	S	.	*			trans	-87	145.9	174.4	0	0	0	0	0	110.6	T10 V14	T10-G12 PolarHBondContact O-N 3.17Å; G12-V14 PolarHBondContact O-N 3.28Å; G12-V14 VanDerWaalsContact O-N 3.15Å
13	N	64	Low	58.3	Low	84 Å²	84	106.3 Å²	106.3	45%	0.449	59%	0.586	S	S	.	*			trans	-61.5	118	175.4	179.9	-2.4	0	0	0	109.9	Y15 A16 Y49	N13-Y15 PolarHBondContact O-N 3.14Å; N13-Y15 PolarHBondContact OD1-N 3.4Å; N13-A16 HydrophobicContact CB-CB 4.25Å; N13-A16 VanDerWaalsContact O-CB 3.26Å; N13-A16 WeakPolarHBondContact O-CB 3.02Å; N13-A16 PolarHBondContact O-N 3.46Å; N13-Y49 PolarHBondContact ND2-OH 3.36Å
14	V	65.5	Low	60.7	Low	120 Å²	120	101.2 Å²	101.2	73%	0.727	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-16.9	-179	-176.6	0	0	0	0	112.7	G12	G12-V14 PolarHBondContact O-N 3.28Å; G12-V14 VanDerWaalsContact O-N 3.15Å
15	Y	70.9	Confident	63.2	Low	59 Å²	59	100.5 Å²	100.5	23%	0.231	55%	0.545	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	6.6	-179.9	-52.7	-70.1	0	0	0	114.3	N13 H17 L18 F42 K46 Y49	N13-Y15 PolarHBondContact O-N 3.14Å; N13-Y15 PolarHBondContact OD1-N 3.4Å; Y15-H17 VanDerWaalsContact C-N 3.25Å; Y15-H17 PolarHBondContact O-N 3.42Å; Y15-H17 VanDerWaalsContact O-N 3.14Å; Y15-L18 HydrophobicContact CD1-CD1 4.01Å; Y15-L18 HydrophobicContact CG-CD1 4.46Å; Y15-F42 HydrophobicContact CE1-CD2 4.44Å; Y15-F42 AromaticContact CE1-CE2 3.91Å; Y15-F42 HydrophobicContact CE1-CE2 3.91Å; Y15-F42 HydrophobicContact CE1-CZ 4.47Å; Y15-K46 HydrophobicContact CD1-CG 4.08Å; Y15-K46 HydrophobicContact CE1-CG 4.06Å; Y15-Y49 HydrophobicContact CG-CD1 4.47Å; Y15-Y49 HydrophobicContact CG-CG 4.31Å; Y15-Y49 WeakPolarHBondContact O-CE1 3.26Å
16	A	64.1	Low	65.5	Low	46 Å²	46	93.7 Å²	93.7	38%	0.38	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-16	-171.1	0	0	0	0	0	116.1	N13	N13-A16 HydrophobicContact CB-CB 4.25Å; N13-A16 VanDerWaalsContact O-CB 3.26Å; N13-A16 WeakPolarHBondContact O-CB 3.02Å; N13-A16 PolarHBondContact O-N 3.46Å
17	H	71.4	Confident	68	Low	185 Å²	185	85.2 Å²	85.2	86%	0.856	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.4	50.2	-175.8	-58.6	-57.5	0	0	0	111.9	Y15	Y15-H17 VanDerWaalsContact C-N 3.25Å; Y15-H17 PolarHBondContact O-N 3.42Å; Y15-H17 VanDerWaalsContact O-N 3.14Å
18	L	80.6	Confident	70.2	Confident	33 Å²	33	87.3 Å²	87.3	17%	0.173	48%	0.479	C	S	.	.			trans	-86	134.1	174.7	-66	175.2	0	0	0	110.6	Y15 V23 K46 Y49 I50	Y15-L18 HydrophobicContact CD1-CD1 4.01Å; Y15-L18 HydrophobicContact CG-CD1 4.46Å; L18-V23 HydrophobicContact CB-CG2 4.25Å; L18-V23 HydrophobicContact CD2-CG2 4.18Å; L18-K46 HydrophobicContact CD1-CB 3.75Å; L18-K46 HydrophobicContact CD1-CG 3.81Å; L18-K46 HydrophobicContact CD2-CB 4.46Å; L18-K46 HydrophobicContact CD2-CD 3.76Å; L18-K46 HydrophobicContact CD2-CG 3.89Å; L18-Y49 HydrophobicContact CD1-CD1 3.96Å; L18-I50 HydrophobicContact CB-CD1 4.06Å; L18-I50 HydrophobicContact CB-CG1 4.12Å; L18-I50 HydrophobicContact CD1-CD1 4.46Å; L18-I50 HydrophobicContact CD1-CG1 4.3Å
19	D	82.1	Confident	72.6	Confident	86 Å²	86	78.4 Å²	78.4	46%	0.46	44%	0.439	S	S	.	.			trans	-97.1	127.5	170.1	167.2	44.4	0	0	0	110.1	T21 S22 V23	D19-T21 VanDerWaalsContact C-N 3.25Å; D19-T21 PolarHBondContact O-N 3.01Å; D19-T21 PolarHBondContact OD1-N 3.26Å; D19-T21 WeakPolarHBondContact OD2-CB 3.16Å; D19-S22 PolarHBondContact O-N 3.36Å; D19-S22 VanDerWaalsContact O-N 3.13Å; D19-S22 PolarHBondContact O-OG 3.32Å; D19-S22 PolarHBondContact OD2-N 2.83Å; D19-S22 VanDerWaalsContact OD2-N 3.09Å; D19-V23 PolarHBondContact O-N 3.49Å
20	K	83.1	Confident	74.9	Confident	36 Å²	36	69.4 Å²	69.4	16%	0.157	40%	0.396	C	S	.	.	H	α-helix	trans	-50.9	-44.7	178.8	172.8	-174.1	170.9	-169.6	0	112.5	S22 V23 L24 E55 S56 E61	K20-S22 PolarHBondContact O-N 2.86Å; K20-V23 PolarHBondContact O-N 3.37Å; K20-L24 HydrophobicContact CG-CD1 3.9Å; K20-L24 HydrophobicContact CG-CG 4.48Å; K20-L24 WeakPolarHBondContact O-CB 3.27Å; K20-L24 WeakPolarHBondContact O-CG 3.47Å; K20-L24 PolarHBondContact O-N 2.9Å; K20-E55 WeakPolarHBondContact CB-OE1 3.45Å; K20-E55 HydrophobicContact CD-CG 4.33Å; K20-S56 PolarHBondContact NZ-O 3.14Å; K20-E61 WeakPolarHBondContact CE-OE2 3.29Å; K20-E61 IonicContact NZ-OE1 2.7Å; K20-E61 IonicContact NZ-OE2 3.65Å; K20-E61 PolarHBondContact NZ-OE2 2.97Å
21	T	83.7	Confident	77.2	Confident	80 Å²	80	67.7 Å²	67.7	49%	0.491	38%	0.383	S	S	.	.	H	α-helix	trans	-64.7	-44.2	-177.3	-46.7	0	0	0	0	110.8	D19 V23 Q25	D19-T21 VanDerWaalsContact C-N 3.25Å; D19-T21 PolarHBondContact O-N 3.01Å; D19-T21 PolarHBondContact OD1-N 3.26Å; D19-T21 WeakPolarHBondContact OD2-CB 3.16Å; T21-V23 PolarHBondContact O-N 2.85Å; T21-Q25 VanDerWaalsContact O-CG 3.3Å; T21-Q25 WeakPolarHBondContact O-CG 3.35Å; T21-Q25 PolarHBondContact O-N 3.48Å
22	S	85.3	Confident	79.3	Confident	40 Å²	40	67.3 Å²	67.3	28%	0.28	36%	0.356	S	S	.	.	H	α-helix	trans	-61.3	-41.9	175.8	75.8	0	0	0	0	113.2	D19 K20 Q25 E26	D19-S22 PolarHBondContact O-N 3.36Å; D19-S22 VanDerWaalsContact O-N 3.13Å; D19-S22 PolarHBondContact O-OG 3.32Å; D19-S22 PolarHBondContact OD2-N 2.83Å; D19-S22 VanDerWaalsContact OD2-N 3.09Å; K20-S22 PolarHBondContact O-N 2.86Å; S22-Q25 PolarHBondContact O-N 3.3Å; S22-E26 WeakPolarHBondContact O-CG 3.2Å; S22-E26 PolarHBondContact O-N 3Å
23	V	85.9	Confident	80.5	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.006	37%	0.368	C	S	.	.	H	α-helix	trans	-72.6	-38.6	-176.4	176.1	0	0	0	0	111.3	L18 D19 K20 T21 Q25 E26 A27 K46 L47 I50	L18-V23 HydrophobicContact CB-CG2 4.25Å; L18-V23 HydrophobicContact CD2-CG2 4.18Å; D19-V23 PolarHBondContact O-N 3.49Å; K20-V23 PolarHBondContact O-N 3.37Å; T21-V23 PolarHBondContact O-N 2.85Å; V23-Q25 VanDerWaalsContact C-N 3.32Å; V23-Q25 PolarHBondContact O-N 3.01Å; V23-E26 PolarHBondContact O-N 3.34Å; V23-A27 PolarHBondContact O-N 3.17Å; V23-K46 HydrophobicContact CG1-CB 3.76Å; V23-K46 HydrophobicContact CG2-CB 4.02Å; V23-K46 HydrophobicContact CG2-CD 4.06Å; V23-L47 HydrophobicContact CG1-CB 4.21Å; V23-L47 HydrophobicContact CG1-CD1 4.45Å; V23-I50 HydrophobicContact CB-CD1 3.6Å; V23-I50 HydrophobicContact CG1-CD1 3.92Å; V23-I50 HydrophobicContact CG2-CD1 3.48Å; V23-I50 VanDerWaalsContact CG2-CD1 3.48Å
24	L	85.4	Confident	81.4	Confident	32 Å²	32	72.4 Å²	72.4	17%	0.168	38%	0.382	C	S	.	.	H	α-helix	trans	-65.7	-34.4	172.8	-70.1	174.4	0	0	0	112.1	K20 A27 L47 E61 A65	K20-L24 HydrophobicContact CG-CD1 3.9Å; K20-L24 HydrophobicContact CG-CG 4.48Å; K20-L24 WeakPolarHBondContact O-CB 3.27Å; K20-L24 WeakPolarHBondContact O-CG 3.47Å; K20-L24 PolarHBondContact O-N 2.9Å; L24-A27 WeakPolarHBondContact O-CB 3.35Å; L24-A27 PolarHBondContact O-N 3.48Å; L24-L47 HydrophobicContact CD2-CD1 4Å; L24-E61 HydrophobicContact CD1-CB 4.08Å; L24-E61 HydrophobicContact CD1-CG 4.32Å; L24-A65 HydrophobicContact CD2-CB 4.35Å
25	Q	85.9	Confident	82.4	Confident	121 Å²	121	68.4 Å²	68.4	57%	0.565	36%	0.356	S	S	*	.	H	α-helix	trans	-67.2	-43.6	171.6	-74.1	-179.1	13.6	0	0	112.1	T21 S22 V23 A27 R28	T21-Q25 VanDerWaalsContact O-CG 3.3Å; T21-Q25 WeakPolarHBondContact O-CG 3.35Å; T21-Q25 PolarHBondContact O-N 3.48Å; S22-Q25 PolarHBondContact O-N 3.3Å; V23-Q25 VanDerWaalsContact C-N 3.32Å; V23-Q25 PolarHBondContact O-N 3.01Å; Q25-A27 PolarHBondContact O-N 3.42Å; Q25-R28 VanDerWaalsContact O-CB 3.32Å; Q25-R28 WeakPolarHBondContact O-CB 3.31Å; Q25-R28 WeakPolarHBondContact O-CG 3.49Å; Q25-R28 PolarHBondContact O-N 3.44Å; Q25-R28 VanDerWaalsContact O-N 3.15Å
26	E	86.6	Confident	83.2	Confident	71 Å²	71	69.7 Å²	69.7	33%	0.332	37%	0.367	S	S	.	.	H	α-helix	trans	-59.7	-33.6	174.4	-74.7	-177.9	-160.6	0	0	111.8	S22 V23 R28 A29 I43 K46	S22-E26 WeakPolarHBondContact O-CG 3.2Å; S22-E26 PolarHBondContact O-N 3Å; V23-E26 PolarHBondContact O-N 3.34Å; E26-R28 PolarHBondContact O-N 2.88Å; E26-A29 WeakPolarHBondContact O-CB 3.43Å; E26-A29 PolarHBondContact O-N 3Å; E26-I43 HydrophobicContact CB-CD1 4.27Å; E26-I43 HydrophobicContact CB-CG1 4.19Å; E26-I43 HydrophobicContact CB-CG2 4.1Å; E26-K46 IonicContact OE1-NZ 3.62Å; E26-K46 PolarHBondContact OE1-NZ 3.5Å; E26-K46 IonicContact OE2-NZ 2.91Å; E26-K46 PolarHBondContact OE2-NZ 2.68Å
27	A	85.8	Confident	84.3	Confident	9 Å²	9	68.3 Å²	68.3	7%	0.074	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-59.4	-17.5	177.2	0	0	0	0	0	113.8	V23 L24 Q25 A29 F30 I43	V23-A27 PolarHBondContact O-N 3.17Å; L24-A27 WeakPolarHBondContact O-CB 3.35Å; L24-A27 PolarHBondContact O-N 3.48Å; Q25-A27 PolarHBondContact O-N 3.42Å; A27-A29 PolarHBondContact O-N 2.93Å; A27-A29 VanDerWaalsContact O-N 3.14Å; A27-F30 HydrophobicContact CB-CD2 4.04Å; A27-F30 HydrophobicContact CB-CE2 3.69Å; A27-F30 HydrophobicContact CB-CZ 4.25Å; A27-F30 VanDerWaalsContact O-CB 3.31Å; A27-F30 WeakPolarHBondContact O-CB 3.37Å; A27-F30 WeakPolarHBondContact O-CD2 3.42Å; A27-F30 WeakPolarHBondContact O-CG 3.43Å; A27-F30 PolarHBondContact O-N 3.2Å; A27-I43 HydrophobicContact CB-CG2 4.33Å
28	R	84.4	Confident	85	Confident	183 Å²	183	70.2 Å²	70.2	69%	0.691	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-59.8	-23	170.1	-65.6	-178.9	177	-176.9	-0.3	112.9	Q25 E26 F30 N31	Q25-R28 VanDerWaalsContact O-CB 3.32Å; Q25-R28 WeakPolarHBondContact O-CB 3.31Å; Q25-R28 WeakPolarHBondContact O-CG 3.49Å; Q25-R28 PolarHBondContact O-N 3.44Å; Q25-R28 VanDerWaalsContact O-N 3.15Å; E26-R28 PolarHBondContact O-N 2.88Å; R28-F30 PolarHBondContact O-N 3.27Å; R28-F30 VanDerWaalsContact O-N 3.11Å; R28-N31 WeakPolarHBondContact O-CB 3.35Å; R28-N31 PolarHBondContact O-N 3.46Å
29	A	86.6	Confident	85.4	Confident	6 Å²	6	72.8 Å²	72.8	5%	0.05	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-59.7	-18.5	173.1	0	0	0	0	0	113.1	E26 A27 N31 E32 K39 I43	E26-A29 WeakPolarHBondContact O-CB 3.43Å; E26-A29 PolarHBondContact O-N 3Å; A27-A29 PolarHBondContact O-N 2.93Å; A27-A29 VanDerWaalsContact O-N 3.14Å; A29-N31 PolarHBondContact O-N 2.76Å; A29-E32 WeakPolarHBondContact O-CB 3.1Å; A29-E32 PolarHBondContact O-N 3.33Å; A29-K39 HydrophobicContact CB-CD 4.47Å; A29-I43 HydrophobicContact CB-CD1 3.74Å
30	F	88.4	Confident	85.7	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.009	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-66.4	-17.4	174	-55.4	-25.9	0	0	0	113.4	A27 R28 C40 I43 L44 G68 V69 L72	A27-F30 HydrophobicContact CB-CD2 4.04Å; A27-F30 HydrophobicContact CB-CE2 3.69Å; A27-F30 HydrophobicContact CB-CZ 4.25Å; A27-F30 VanDerWaalsContact O-CB 3.31Å; A27-F30 WeakPolarHBondContact O-CB 3.37Å; A27-F30 WeakPolarHBondContact O-CD2 3.42Å; A27-F30 WeakPolarHBondContact O-CG 3.43Å; A27-F30 PolarHBondContact O-N 3.2Å; R28-F30 PolarHBondContact O-N 3.27Å; R28-F30 VanDerWaalsContact O-N 3.11Å; F30-C40 HydrophobicContact CD1-CB 4.08Å; F30-C40 HydrophobicContact CE1-CB 4.06Å; F30-I43 HydrophobicContact CE1-CB 3.93Å; F30-I43 HydrophobicContact CE1-CG2 3.88Å; F30-I43 HydrophobicContact CZ-CB 4.09Å; F30-I43 HydrophobicContact CZ-CG2 3.63Å; F30-L44 HydrophobicContact CE1-CD2 4.24Å; F30-L44 HydrophobicContact CE1-CG 4.05Å; F30-L44 HydrophobicContact CE2-CD2 3.88Å; F30-L44 HydrophobicContact CZ-CD2 3.49Å; F30-L44 VanDerWaalsContact CZ-CD2 3.49Å; F30-L44 HydrophobicContact CZ-CG 3.72Å; F30-G68 WeakPolarHBondContact CB-O 3.36Å; F30-V69 HydrophobicContact CD2-CG2 4.23Å; F30-V69 HydrophobicContact CE2-CG2 3.99Å; F30-L72 HydrophobicContact CB-CD1 4.44Å; F30-L72 HydrophobicContact CB-CD2 3.97Å; F30-L72 HydrophobicContact CB-CG 4.24Å; F30-L72 HydrophobicContact CD1-CD1 3.75Å; F30-L72 HydrophobicContact CD1-CD2 3.97Å; F30-L72 HydrophobicContact CD1-CG 4.31Å; F30-L72 HydrophobicContact CD2-CD1 4.4Å; F30-L72 HydrophobicContact CE1-CD1 4.04Å; F30-L72 HydrophobicContact CG-CD1 3.95Å; F30-L72 HydrophobicContact CG-CD2 4.2Å; F30-L72 HydrophobicContact CG-CG 4.29Å; F30-L72 HydrophobicContact CZ-CD1 4.5Å
31	N	85.3	Confident	86	Confident	81 Å²	81	68.1 Å²	68.1	43%	0.433	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-91.5	-5.7	176.1	-62.4	-53.6	0	0	0	113.3	R28 A29 K71	R28-N31 WeakPolarHBondContact O-CB 3.35Å; R28-N31 PolarHBondContact O-N 3.46Å; A29-N31 PolarHBondContact O-N 2.76Å; N31-K71 VanDerWaalsContact OD1-CD 3.26Å; N31-K71 WeakPolarHBondContact OD1-CD 3.23Å; N31-K71 WeakPolarHBondContact OD1-CE 3.38Å; N31-K71 PolarHBondContact OD1-NZ 3.49Å
32	E	85.2	Confident	86.2	Confident	86 Å²	86	68.5 Å²	68.5	40%	0.402	34%	0.338	S	S	.	.			trans	-67.1	135.7	180	-70.5	171.5	-171.4	0	0	110.9	A29 P34 I35 K39	A29-E32 WeakPolarHBondContact O-CB 3.1Å; A29-E32 PolarHBondContact O-N 3.33Å; E32-P34 CarbonylContact O-C 3.57Å; E32-I35 WeakPolarHBondContact O-CG1 3.47Å; E32-K39 IonicContact OE1-NZ 2.86Å; E32-K39 PolarHBondContact OE1-NZ 2.95Å; E32-K39 IonicContact OE2-NZ 3.67Å; E32-K39 PolarHBondContact OE2-NZ 2.92Å
33	T	80.8	Confident	86.4	Confident	128 Å²	128	66.8 Å²	66.8	79%	0.785	33%	0.326	S	S	*	.	S	Bend	trans	-121	117	173	-45.8	0	0	0	0	108.3
34	P	81.7	Confident	86.6	Confident	115 Å²	115	66.8 Å²	66.8	75%	0.747	33%	0.326	S	S	*	.	S	Bend	cis	-79.2	148.4	5.9	32.9	-35.6	0	0	0	114.2	E32 N36	E32-P34 CarbonylContact O-C 3.57Å; P34-N36 PolarHBondContact O-N 3.3Å
35	I	86.6	Confident	86.8	Confident	37 Å²	37	66.9 Å²	66.9	19%	0.19	33%	0.329	C	S	.	.			trans	-70	124.9	-179.4	-62.1	169.3	0	0	0	110.7	E32 A37 L72 Q74 L80	E32-I35 WeakPolarHBondContact O-CG1 3.47Å; I35-A37 PolarHBondContact O-N 3.45Å; I35-L72 HydrophobicContact CG2-CD2 3.93Å; I35-Q74 HydrophobicContact CD1-CB 3.95Å; I35-L80 HydrophobicContact CG2-CD2 4.17Å
36	N	88.1	Confident	87	Confident	86 Å²	86	62.2 Å²	62.2	46%	0.46	31%	0.307	S	S	.	.			trans	-91.2	98.7	172.3	-174.5	-28.4	0	0	0	111	P34 R38 K39 C40	P34-N36 PolarHBondContact O-N 3.3Å; N36-R38 VanDerWaalsContact C-N 3.3Å; N36-R38 PolarHBondContact O-N 2.71Å; N36-R38 PolarHBondContact OD1-N 3Å; N36-K39 HydrophobicContact CB-CB 4.05Å; N36-K39 PolarHBondContact O-N 2.78Å; N36-K39 PolarHBondContact OD1-N 3.4Å; N36-C40 PolarHBondContact O-N 3.25Å; N36-C40 PolarHBondContact O-SG 2.87Å
37	A	86.8	Confident	87	Confident	17 Å²	17	59 Å²	59	14%	0.14	29%	0.292	C	S	.	.	H	α-helix	trans	-56	-38.5	-174.7	0	0	0	0	0	114.3	I35 C41 D77 L80	I35-A37 PolarHBondContact O-N 3.45Å; A37-C41 WeakPolarHBondContact O-CB 3.18Å; A37-C41 PolarHBondContact O-N 3.05Å; A37-C41 PolarHBondContact O-SG 3.28Å; A37-D77 HydrophobicContact CB-CB 3.73Å; A37-L80 HydrophobicContact CB-CB 4.34Å; A37-L80 HydrophobicContact CB-CD2 4.1Å
38	R	87.1	Confident	87.1	Confident	225 Å²	225	59.8 Å²	59.8	85%	0.849	30%	0.295	S	S	*	.	H	α-helix	trans	-68.3	-44.6	-179.7	-69.3	-175.8	-176.7	174.8	1.3	112	N36 C41 F42	N36-R38 VanDerWaalsContact C-N 3.3Å; N36-R38 PolarHBondContact O-N 2.71Å; N36-R38 PolarHBondContact OD1-N 3Å; R38-C41 PolarHBondContact O-N 3.23Å; R38-F42 PolarHBondContact O-N 3.23Å
39	K	87.6	Confident	87.2	Confident	86 Å²	86	53.9 Å²	53.9	37%	0.374	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-46.6	177.3	-174.7	-176.1	171	-165.4	0	110.3	A29 E32 N36 C41 F42 I43	A29-K39 HydrophobicContact CB-CD 4.47Å; E32-K39 IonicContact OE1-NZ 2.86Å; E32-K39 PolarHBondContact OE1-NZ 2.95Å; E32-K39 IonicContact OE2-NZ 3.67Å; E32-K39 PolarHBondContact OE2-NZ 2.92Å; N36-K39 HydrophobicContact CB-CB 4.05Å; N36-K39 PolarHBondContact O-N 2.78Å; N36-K39 PolarHBondContact OD1-N 3.4Å; K39-C41 PolarHBondContact O-N 3.26Å; K39-F42 PolarHBondContact O-N 3.16Å; K39-I43 HydrophobicContact CG-CD1 3.92Å; K39-I43 VanDerWaalsContact O-CG1 3.32Å; K39-I43 WeakPolarHBondContact O-CG1 3.33Å; K39-I43 PolarHBondContact O-N 3.45Å; K39-I43 VanDerWaalsContact O-N 3.08Å
40	C	89.4	Confident	87.2	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.007	27%	0.271	C	S	.	.	H	α-helix	trans	-64.5	-40.1	179	-60.5	0	0	0	0	112.7	F30 N36 F42 I43 L44 L72 L80	F30-C40 HydrophobicContact CD1-CB 4.08Å; F30-C40 HydrophobicContact CE1-CB 4.06Å; N36-C40 PolarHBondContact O-N 3.25Å; N36-C40 PolarHBondContact O-SG 2.87Å; C40-F42 VanDerWaalsContact C-N 3.32Å; C40-F42 PolarHBondContact O-N 3.46Å; C40-I43 PolarHBondContact O-N 2.95Å; C40-L44 WeakPolarHBondContact O-CB 3.26Å; C40-L44 WeakPolarHBondContact O-CG 3.48Å; C40-L44 PolarHBondContact O-N 3.45Å; C40-L72 HydrophobicContact CB-CD1 4.42Å; C40-L72 HydrophobicContact CB-CD2 4.06Å; C40-L80 HydrophobicContact CB-CD1 3.6Å; C40-L80 HydrophobicContact CB-CD2 4.47Å
41	C	88.9	Confident	87	Confident	23 Å²	23	55.6 Å²	55.6	16%	0.155	28%	0.281	C	S	.	.	H	α-helix	trans	-58.2	-44.2	173.4	-76.7	0	0	0	0	112	A37 R38 K39 L44 S45 L80	A37-C41 WeakPolarHBondContact O-CB 3.18Å; A37-C41 PolarHBondContact O-N 3.05Å; A37-C41 PolarHBondContact O-SG 3.28Å; R38-C41 PolarHBondContact O-N 3.23Å; K39-C41 PolarHBondContact O-N 3.26Å; C41-L44 PolarHBondContact O-N 3.07Å; C41-S45 PolarHBondContact O-N 3.19Å; C41-S45 PolarHBondContact O-OG 3.24Å; C41-S45 VanDerWaalsContact O-OG 3.07Å; C41-L80 WeakPolarHBondContact SG-CA 3.48Å; C41-L80 VanDerWaalsContact SG-CD1 3.59Å
42	F	89.3	Confident	87	Confident	89 Å²	89	59.2 Å²	59.2	39%	0.39	30%	0.295	S	S	.	.	H	α-helix	trans	-63.8	-43.1	179.6	-172.9	-115.2	0	0	0	112	Y15 R38 K39 C40 S45 K46	Y15-F42 HydrophobicContact CE1-CD2 4.44Å; Y15-F42 AromaticContact CE1-CE2 3.91Å; Y15-F42 HydrophobicContact CE1-CE2 3.91Å; Y15-F42 HydrophobicContact CE1-CZ 4.47Å; R38-F42 PolarHBondContact O-N 3.23Å; K39-F42 PolarHBondContact O-N 3.16Å; C40-F42 VanDerWaalsContact C-N 3.32Å; C40-F42 PolarHBondContact O-N 3.46Å; F42-S45 WeakPolarHBondContact O-CB 3.23Å; F42-S45 PolarHBondContact O-N 2.87Å; F42-K46 HydrophobicContact CE1-CD 4.31Å; F42-K46 WeakPolarHBondContact O-CG 3.34Å; F42-K46 PolarHBondContact O-N 3.3Å
43	I	88.9	Confident	86.9	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-67	-40.9	178	-61.1	162.6	0	0	0	111	E26 A27 A29 F30 K39 C40 S45 K46 L47	E26-I43 HydrophobicContact CB-CD1 4.27Å; E26-I43 HydrophobicContact CB-CG1 4.19Å; E26-I43 HydrophobicContact CB-CG2 4.1Å; A27-I43 HydrophobicContact CB-CG2 4.33Å; A29-I43 HydrophobicContact CB-CD1 3.74Å; F30-I43 HydrophobicContact CE1-CB 3.93Å; F30-I43 HydrophobicContact CE1-CG2 3.88Å; F30-I43 HydrophobicContact CZ-CB 4.09Å; F30-I43 HydrophobicContact CZ-CG2 3.63Å; K39-I43 HydrophobicContact CG-CD1 3.92Å; K39-I43 VanDerWaalsContact O-CG1 3.32Å; K39-I43 WeakPolarHBondContact O-CG1 3.33Å; K39-I43 PolarHBondContact O-N 3.45Å; K39-I43 VanDerWaalsContact O-N 3.08Å; C40-I43 PolarHBondContact O-N 2.95Å; I43-S45 VanDerWaalsContact C-N 3.33Å; I43-S45 PolarHBondContact O-N 3.33Å; I43-K46 WeakPolarHBondContact O-CB 3.13Å; I43-K46 PolarHBondContact O-N 3.43Å; I43-L47 PolarHBondContact O-N 3.05Å
44	L	89.6	Confident	86.8	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-39.8	173.9	-73.2	175.2	0	0	0	112.1	F30 C40 C41 L47 I48 V69 L72 L80 M83 V84 A87	F30-L44 HydrophobicContact CE1-CD2 4.24Å; F30-L44 HydrophobicContact CE1-CG 4.05Å; F30-L44 HydrophobicContact CE2-CD2 3.88Å; F30-L44 HydrophobicContact CZ-CD2 3.49Å; F30-L44 VanDerWaalsContact CZ-CD2 3.49Å; F30-L44 HydrophobicContact CZ-CG 3.72Å; C40-L44 WeakPolarHBondContact O-CB 3.26Å; C40-L44 WeakPolarHBondContact O-CG 3.48Å; C40-L44 PolarHBondContact O-N 3.45Å; C41-L44 PolarHBondContact O-N 3.07Å; L44-L47 PolarHBondContact O-N 2.73Å; L44-I48 WeakPolarHBondContact O-CD1 3.44Å; L44-I48 VanDerWaalsContact O-CG1 3.32Å; L44-I48 WeakPolarHBondContact O-CG1 3.31Å; L44-I48 PolarHBondContact O-N 2.94Å; L44-V69 HydrophobicContact CD2-CG2 3.7Å; L44-L72 HydrophobicContact CD1-CD1 3.79Å; L44-L72 HydrophobicContact CD2-CD1 4.36Å; L44-L72 HydrophobicContact CG-CD1 4.29Å; L44-L80 HydrophobicContact CD1-CD1 3.96Å; L44-M83 HydrophobicContact CB-CB 4.27Å; L44-M83 HydrophobicContact CB-CE 3.84Å; L44-M83 HydrophobicContact CD1-CB 3.6Å; L44-V84 HydrophobicContact CD1-CG2 4.25Å; L44-A87 HydrophobicContact CD2-CB 3.88Å
45	S	90.1	Very high	86.8	Confident	35 Å²	35	55.3 Å²	55.3	25%	0.245	28%	0.276	C	S	.	.	H	α-helix	trans	-62.1	-43.1	175	-63.9	0	0	0	0	111.9	C41 F42 I43 Y49 M83	C41-S45 PolarHBondContact O-N 3.19Å; C41-S45 PolarHBondContact O-OG 3.24Å; C41-S45 VanDerWaalsContact O-OG 3.07Å; F42-S45 WeakPolarHBondContact O-CB 3.23Å; F42-S45 PolarHBondContact O-N 2.87Å; I43-S45 VanDerWaalsContact C-N 3.33Å; I43-S45 PolarHBondContact O-N 3.33Å; S45-Y49 VanDerWaalsContact O-CB 3.24Å; S45-Y49 WeakPolarHBondContact O-CB 3.45Å; S45-Y49 PolarHBondContact O-N 3.38Å; S45-M83 WeakPolarHBondContact OG-CE 3.49Å
46	K	88.9	Confident	86.3	Confident	23 Å²	23	58.4 Å²	58.4	10%	0.1	30%	0.301	C	S	.	.	H	α-helix	trans	-59.9	-45.8	174.1	-71.2	-177.8	176	179.2	0	111.8	Y15 L18 V23 E26 F42 I43 Y49 I50	Y15-K46 HydrophobicContact CD1-CG 4.08Å; Y15-K46 HydrophobicContact CE1-CG 4.06Å; L18-K46 HydrophobicContact CD1-CB 3.75Å; L18-K46 HydrophobicContact CD1-CG 3.81Å; L18-K46 HydrophobicContact CD2-CB 4.46Å; L18-K46 HydrophobicContact CD2-CD 3.76Å; L18-K46 HydrophobicContact CD2-CG 3.89Å; V23-K46 HydrophobicContact CG1-CB 3.76Å; V23-K46 HydrophobicContact CG2-CB 4.02Å; V23-K46 HydrophobicContact CG2-CD 4.06Å; E26-K46 IonicContact OE1-NZ 3.62Å; E26-K46 PolarHBondContact OE1-NZ 3.5Å; E26-K46 IonicContact OE2-NZ 2.91Å; E26-K46 PolarHBondContact OE2-NZ 2.68Å; F42-K46 HydrophobicContact CE1-CD 4.31Å; F42-K46 WeakPolarHBondContact O-CG 3.34Å; F42-K46 PolarHBondContact O-N 3.3Å; I43-K46 WeakPolarHBondContact O-CB 3.13Å; I43-K46 PolarHBondContact O-N 3.43Å; K46-Y49 PolarHBondContact O-N 3.47Å; K46-I50 WeakPolarHBondContact O-CG1 3.4Å; K46-I50 PolarHBondContact O-N 3.34Å
47	L	87.2	Confident	86.1	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-62.1	-47.5	-179.4	-175.8	66.9	0	0	0	111.6	V23 L24 I43 L44 Y49 I50 I51 I57 A65 L91	V23-L47 HydrophobicContact CG1-CB 4.21Å; V23-L47 HydrophobicContact CG1-CD1 4.45Å; L24-L47 HydrophobicContact CD2-CD1 4Å; I43-L47 PolarHBondContact O-N 3.05Å; L44-L47 PolarHBondContact O-N 2.73Å; L47-Y49 VanDerWaalsContact C-N 3.31Å; L47-Y49 PolarHBondContact O-N 2.88Å; L47-I50 PolarHBondContact O-N 2.64Å; L47-I51 HydrophobicContact CG-CD1 4.43Å; L47-I51 WeakPolarHBondContact O-CG1 3.49Å; L47-I51 PolarHBondContact O-N 2.68Å; L47-I57 HydrophobicContact CD1-CD1 3.91Å; L47-A65 HydrophobicContact CD2-CB 4.48Å; L47-L91 HydrophobicContact CD2-CD1 4.22Å
48	I	87.5	Confident	86	Confident	27 Å²	27	56 Å²	56	14%	0.138	29%	0.292	C	S	.	.	H	α-helix	trans	-66.2	-36.3	178.3	-66.3	162.7	0	0	0	111	L44 I51 Q52 M83 L86 A87	L44-I48 WeakPolarHBondContact O-CD1 3.44Å; L44-I48 VanDerWaalsContact O-CG1 3.32Å; L44-I48 WeakPolarHBondContact O-CG1 3.31Å; L44-I48 PolarHBondContact O-N 2.94Å; I48-I51 PolarHBondContact O-N 3.04Å; I48-Q52 WeakPolarHBondContact O-CB 3.46Å; I48-Q52 PolarHBondContact O-N 3.22Å; I48-M83 HydrophobicContact CD1-CE 3.73Å; I48-L86 HydrophobicContact CD1-CB 4.24Å; I48-L86 HydrophobicContact CD1-CD2 3.79Å; I48-L86 HydrophobicContact CD1-CG 3.84Å; I48-L86 HydrophobicContact CG2-CD2 4.42Å; I48-A87 HydrophobicContact CD1-CB 4.37Å
49	Y	87.8	Confident	86	Confident	59 Å²	59	52.4 Å²	52.4	23%	0.231	28%	0.279	C	S	.	.	H	α-helix	trans	-63.1	-42.5	177.3	-175.3	-95.7	0	0	0	112.3	N13 Y15 L18 S45 K46 L47 Q52 Q53	N13-Y49 PolarHBondContact ND2-OH 3.36Å; Y15-Y49 HydrophobicContact CG-CD1 4.47Å; Y15-Y49 HydrophobicContact CG-CG 4.31Å; Y15-Y49 WeakPolarHBondContact O-CE1 3.26Å; L18-Y49 HydrophobicContact CD1-CD1 3.96Å; S45-Y49 VanDerWaalsContact O-CB 3.24Å; S45-Y49 WeakPolarHBondContact O-CB 3.45Å; S45-Y49 PolarHBondContact O-N 3.38Å; K46-Y49 PolarHBondContact O-N 3.47Å; L47-Y49 VanDerWaalsContact C-N 3.31Å; L47-Y49 PolarHBondContact O-N 2.88Å; Y49-Q52 PolarHBondContact O-N 2.9Å; Y49-Q53 HydrophobicContact CD1-CG 4.33Å; Y49-Q53 HydrophobicContact CE1-CG 3.94Å; Y49-Q53 WeakPolarHBondContact O-CG 3.39Å; Y49-Q53 PolarHBondContact O-N 3Å; Y49-Q53 PolarHBondContact OH-NE2 3.27Å
50	I	86.5	Confident	85.9	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-60.8	-45.1	174.5	-73.8	166.3	0	0	0	111.2	L18 V23 K46 L47 Q52 Q53 E55	L18-I50 HydrophobicContact CB-CD1 4.06Å; L18-I50 HydrophobicContact CB-CG1 4.12Å; L18-I50 HydrophobicContact CD1-CD1 4.46Å; L18-I50 HydrophobicContact CD1-CG1 4.3Å; V23-I50 HydrophobicContact CB-CD1 3.6Å; V23-I50 HydrophobicContact CG1-CD1 3.92Å; V23-I50 HydrophobicContact CG2-CD1 3.48Å; V23-I50 VanDerWaalsContact CG2-CD1 3.48Å; K46-I50 WeakPolarHBondContact O-CG1 3.4Å; K46-I50 PolarHBondContact O-N 3.34Å; L47-I50 PolarHBondContact O-N 2.64Å; I50-Q52 VanDerWaalsContact C-N 3.31Å; I50-Q52 PolarHBondContact O-N 3.19Å; I50-Q53 PolarHBondContact O-N 3.14Å; I50-E55 HydrophobicContact CG2-CB 3.75Å; I50-E55 HydrophobicContact CG2-CG 4.29Å; I50-E55 WeakPolarHBondContact CG2-OE2 3.36Å; I50-E55 PolarHBondContact O-N 2.68Å
51	I	84.1	Confident	85.8	Confident	42 Å²	42	56.5 Å²	56.5	22%	0.215	31%	0.306	C	S	.	.	H	α-helix	trans	-60	-43.2	176.9	-65	167.5	0	0	0	110.5	L47 I48 Q53 G54 I57 E90 L91	L47-I51 HydrophobicContact CG-CD1 4.43Å; L47-I51 WeakPolarHBondContact O-CG1 3.49Å; L47-I51 PolarHBondContact O-N 2.68Å; I48-I51 PolarHBondContact O-N 3.04Å; I51-Q53 VanDerWaalsContact C-N 3.31Å; I51-Q53 PolarHBondContact O-N 3.22Å; I51-G54 PolarHBondContact O-N 3.32Å; I51-G54 VanDerWaalsContact O-N 3.07Å; I51-I57 HydrophobicContact CD1-CD1 3.89Å; I51-I57 HydrophobicContact CG1-CD1 3.54Å; I51-I57 HydrophobicContact CG1-CG1 4.42Å; I51-E90 HydrophobicContact CD1-CB 4.39Å; I51-L91 HydrophobicContact CD1-CD2 3.97Å
52	Q	84.6	Confident	85.6	Confident	157 Å²	157	55.4 Å²	55.4	73%	0.734	30%	0.299	S	S	*	.	H	α-helix	trans	-68.2	-26.9	-180	-171	63.6	42.3	0	0	113.4	I48 Y49 I50 G54	I48-Q52 WeakPolarHBondContact O-CB 3.46Å; I48-Q52 PolarHBondContact O-N 3.22Å; Y49-Q52 PolarHBondContact O-N 2.9Å; I50-Q52 VanDerWaalsContact C-N 3.31Å; I50-Q52 PolarHBondContact O-N 3.19Å; Q52-G54 PolarHBondContact O-N 2.88Å
53	Q	83.9	Confident	85.6	Confident	104 Å²	104	52 Å²	52	49%	0.486	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-6.5	172.9	-74.5	-169.5	-28.7	0	0	113.1	Y49 I50 I51	Y49-Q53 HydrophobicContact CD1-CG 4.33Å; Y49-Q53 HydrophobicContact CE1-CG 3.94Å; Y49-Q53 WeakPolarHBondContact O-CG 3.39Å; Y49-Q53 PolarHBondContact O-N 3Å; Y49-Q53 PolarHBondContact OH-NE2 3.27Å; I50-Q53 PolarHBondContact O-N 3.14Å; I51-Q53 VanDerWaalsContact C-N 3.31Å; I51-Q53 PolarHBondContact O-N 3.22Å
54	G	78	Confident	85.5	Confident	66 Å²	66	58.7 Å²	58.7	68%	0.68	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	87	14.4	179.1	0	0	0	0	0	113.9	I51 Q52 S56	I51-G54 PolarHBondContact O-N 3.32Å; I51-G54 VanDerWaalsContact O-N 3.07Å; Q52-G54 PolarHBondContact O-N 2.88Å; G54-S56 PolarHBondContact O-N 3.44Å
55	E	81.8	Confident	85.4	Confident	76 Å²	76	59.1 Å²	59.1	36%	0.355	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-76.3	123.3	176.2	-162.2	172.4	179.8	0	0	110.6	K20 I50 I57	K20-E55 WeakPolarHBondContact CB-OE1 3.45Å; K20-E55 HydrophobicContact CD-CG 4.33Å; I50-E55 HydrophobicContact CG2-CB 3.75Å; I50-E55 HydrophobicContact CG2-CG 4.29Å; I50-E55 WeakPolarHBondContact CG2-OE2 3.36Å; I50-E55 PolarHBondContact O-N 2.68Å; E55-I57 PolarHBondContact O-N 2.8Å
56	S	76.4	Confident	85.3	Confident	102 Å²	102	57.4 Å²	57.4	71%	0.713	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-76.5	117.1	-176.7	58.2	0	0	0	0	111.8	K20 G54	K20-S56 PolarHBondContact NZ-O 3.14Å; G54-S56 PolarHBondContact O-N 3.44Å
57	I	83.6	Confident	85.3	Confident	23 Å²	23	59.7 Å²	59.7	12%	0.118	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-85.3	131.5	169.9	-56.1	-180	0	0	0	108.3	L47 I51 E55 E61 A62	L47-I57 HydrophobicContact CD1-CD1 3.91Å; I51-I57 HydrophobicContact CD1-CD1 3.89Å; I51-I57 HydrophobicContact CG1-CD1 3.54Å; I51-I57 HydrophobicContact CG1-CG1 4.42Å; E55-I57 PolarHBondContact O-N 2.8Å; I57-E61 HydrophobicContact CG2-CB 3.79Å; I57-A62 HydrophobicContact CG2-CB 3.9Å
58	G	85.4	Confident	85.4	Confident	29 Å²	29	59.8 Å²	59.8	30%	0.299	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-66.3	151.3	177.8	0	0	0	0	0	111.3	T60 E61 A62	G58-T60 VanDerWaalsContact C-N 3.28Å; G58-T60 PolarHBondContact O-N 3.25Å; G58-E61 PolarHBondContact N-OE2 3.38Å; G58-E61 PolarHBondContact O-N 3.27Å; G58-A62 WeakPolarHBondContact O-CB 3.14Å; G58-A62 PolarHBondContact O-N 3.25Å
59	R	86.2	Confident	85.5	Confident	150 Å²	150	58.5 Å²	58.5	57%	0.566	31%	0.313	S	S	*	.	H	α-helix	trans	-56	-39	-178	174.1	170.6	-89.5	-175.9	-6.3	113.4	T63 V94 D96	R59-T63 WeakPolarHBondContact O-CB 3.2Å; R59-T63 PolarHBondContact O-N 3.14Å; R59-T63 PolarHBondContact O-OG1 3.33Å; R59-V94 WeakPolarHBondContact CG-O 3.28Å; R59-V94 PolarHBondContact NE-O 3.41Å; R59-D96 VanDerWaalsContact CD-OD2 3.29Å; R59-D96 WeakPolarHBondContact CD-OD2 3.49Å; R59-D96 WeakPolarHBondContact CG-OD2 3.38Å; R59-D96 IonicContact CZ-OD1 3.35Å; R59-D96 IonicContact NE-OD1 3.45Å; R59-D96 PolarHBondContact NE-OD1 3.32Å
60	T	86.5	Confident	85.5	Confident	104 Å²	104	57 Å²	57	64%	0.638	31%	0.31	S	S	*	.	H	α-helix	trans	-66.7	-48.7	176.1	47.2	0	0	0	0	112.2	G58 A62 T63 E64	G58-T60 VanDerWaalsContact C-N 3.28Å; G58-T60 PolarHBondContact O-N 3.25Å; T60-A62 VanDerWaalsContact C-N 3.34Å; T60-A62 PolarHBondContact O-N 3.47Å; T60-T63 PolarHBondContact O-N 2.9Å; T60-E64 PolarHBondContact O-N 3.38Å
61	E	86.6	Confident	85.5	Confident	70 Å²	70	61.5 Å²	61.5	33%	0.327	33%	0.329	S	S	.	.	H	α-helix	trans	-61.6	-41.4	177.7	-60	172.9	148.8	0	0	111.8	K20 L24 I57 G58 T63 E64 A65	K20-E61 WeakPolarHBondContact CE-OE2 3.29Å; K20-E61 IonicContact NZ-OE1 2.7Å; K20-E61 IonicContact NZ-OE2 3.65Å; K20-E61 PolarHBondContact NZ-OE2 2.97Å; L24-E61 HydrophobicContact CD1-CB 4.08Å; L24-E61 HydrophobicContact CD1-CG 4.32Å; I57-E61 HydrophobicContact CG2-CB 3.79Å; G58-E61 PolarHBondContact N-OE2 3.38Å; G58-E61 PolarHBondContact O-N 3.27Å; E61-T63 VanDerWaalsContact C-N 3.35Å; E61-E64 PolarHBondContact O-N 3.04Å; E61-A65 WeakPolarHBondContact O-CB 3.49Å; E61-A65 PolarHBondContact O-N 2.84Å
62	A	85.9	Confident	85.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.3	-42.7	176.7	0	0	0	0	0	111	I57 G58 T60 A65 F66 L91 V94 S95	I57-A62 HydrophobicContact CG2-CB 3.9Å; G58-A62 WeakPolarHBondContact O-CB 3.14Å; G58-A62 PolarHBondContact O-N 3.25Å; T60-A62 VanDerWaalsContact C-N 3.34Å; T60-A62 PolarHBondContact O-N 3.47Å; A62-A65 PolarHBondContact O-N 3.45Å; A62-F66 WeakPolarHBondContact O-CB 3.28Å; A62-F66 PolarHBondContact O-N 3.13Å; A62-L91 HydrophobicContact CB-CD2 4.37Å; A62-V94 HydrophobicContact CB-CB 4.17Å; A62-V94 HydrophobicContact CB-CG1 3.82Å; A62-S95 PolarHBondContact O-OG 3.18Å
63	T	88.1	Confident	85.9	Confident	17 Å²	17	53.3 Å²	53.3	10%	0.104	29%	0.289	C	S	.	.	H	α-helix	trans	-65.7	-43.2	178.2	-57.7	0	0	0	0	111.8	R59 T60 E61 F66 F67 S95 D96	R59-T63 WeakPolarHBondContact O-CB 3.2Å; R59-T63 PolarHBondContact O-N 3.14Å; R59-T63 PolarHBondContact O-OG1 3.33Å; T60-T63 PolarHBondContact O-N 2.9Å; E61-T63 VanDerWaalsContact C-N 3.35Å; T63-F66 WeakPolarHBondContact O-CB 3.27Å; T63-F66 PolarHBondContact O-N 3.46Å; T63-F67 HydrophobicContact CG2-CD2 3.81Å; T63-F67 HydrophobicContact CG2-CE2 3.43Å; T63-F67 VanDerWaalsContact CG2-CE2 3.43Å; T63-F67 HydrophobicContact CG2-CZ 4.43Å; T63-F67 WeakPolarHBondContact O-CD2 3.45Å; T63-F67 PolarHBondContact O-N 3.35Å; T63-S95 WeakPolarHBondContact OG1-CA 3.24Å; T63-D96 PolarHBondContact OG1-N 3.23Å
64	E	87.3	Confident	86	Confident	145 Å²	145	55.1 Å²	55.1	68%	0.678	30%	0.298	S	S	*	.	H	α-helix	trans	-62	-46.3	174.3	-73.4	-175.9	-174.8	0	0	112.2	T60 E61 F66 F67 G68	T60-E64 PolarHBondContact O-N 3.38Å; E61-E64 PolarHBondContact O-N 3.04Å; E64-F66 VanDerWaalsContact C-N 3.32Å; E64-F66 PolarHBondContact O-N 3.22Å; E64-F67 PolarHBondContact O-N 2.66Å; E64-G68 PolarHBondContact O-N 2.93Å
65	A	87.3	Confident	86.3	Confident	8 Å²	8	53 Å²	53	7%	0.066	27%	0.272	C	S	.	.	H	α-helix	trans	-60.6	-44.4	175.5	0	0	0	0	0	110.7	L24 L47 E61 A62 F67 G68 V69 L91	L24-A65 HydrophobicContact CD2-CB 4.35Å; L47-A65 HydrophobicContact CD2-CB 4.48Å; E61-A65 WeakPolarHBondContact O-CB 3.49Å; E61-A65 PolarHBondContact O-N 2.84Å; A62-A65 PolarHBondContact O-N 3.45Å; A65-F67 PolarHBondContact O-N 2.9Å; A65-G68 CarbonylContact O-C 3.59Å; A65-G68 WeakPolarHBondContact O-CA 3.45Å; A65-G68 PolarHBondContact O-N 3.06Å; A65-G68 VanDerWaalsContact O-N 3.12Å; A65-V69 WeakPolarHBondContact O-CG2 3.36Å; A65-V69 PolarHBondContact O-N 2.96Å; A65-L91 HydrophobicContact CB-CD1 4.46Å
66	F	88.9	Confident	86.4	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58	-49	178	-178	-94.3	0	0	0	111.7	A62 T63 E64 G68 V69 T70 V88 L91 V98 I100 V101	A62-F66 WeakPolarHBondContact O-CB 3.28Å; A62-F66 PolarHBondContact O-N 3.13Å; T63-F66 WeakPolarHBondContact O-CB 3.27Å; T63-F66 PolarHBondContact O-N 3.46Å; E64-F66 VanDerWaalsContact C-N 3.32Å; E64-F66 PolarHBondContact O-N 3.22Å; F66-G68 VanDerWaalsContact C-N 3.29Å; F66-G68 PolarHBondContact O-N 3.31Å; F66-V69 WeakPolarHBondContact O-CA 2.95Å; F66-V69 WeakPolarHBondContact O-CB 3.06Å; F66-V69 PolarHBondContact O-N 3.5Å; F66-T70 HydrophobicContact CD1-CG2 4.09Å; F66-T70 HydrophobicContact CE1-CG2 3.89Å; F66-T70 HydrophobicContact CZ-CG2 4.43Å; F66-T70 WeakPolarHBondContact O-CG2 3.48Å; F66-T70 PolarHBondContact O-N 2.93Å; F66-V88 HydrophobicContact CE2-CB 4.29Å; F66-V88 HydrophobicContact CE2-CG1 4.05Å; F66-V88 HydrophobicContact CE2-CG2 3.96Å; F66-L91 HydrophobicContact CB-CD1 4.41Å; F66-L91 HydrophobicContact CD2-CB 3.94Å; F66-V98 HydrophobicContact CE2-CG1 4.12Å; F66-V98 HydrophobicContact CZ-CB 4.15Å; F66-V98 HydrophobicContact CZ-CG1 3.74Å; F66-V98 HydrophobicContact CZ-CG2 4.34Å; F66-I100 HydrophobicContact CE1-CG2 3.9Å; F66-V101 HydrophobicContact CE1-CG1 4.07Å; F66-V101 HydrophobicContact CZ-CG1 3.73Å; F66-V101 HydrophobicContact CZ-CG2 4.04Å
67	F	88.6	Confident	86.9	Confident	70 Å²	70	56.5 Å²	56.5	31%	0.307	28%	0.277	S	S	.	.	H	α-helix	trans	-59.8	-39.2	174.6	-77.3	-59	0	0	0	112.4	T63 E64 A65 T70 D97 I100	T63-F67 HydrophobicContact CG2-CD2 3.81Å; T63-F67 HydrophobicContact CG2-CE2 3.43Å; T63-F67 VanDerWaalsContact CG2-CE2 3.43Å; T63-F67 HydrophobicContact CG2-CZ 4.43Å; T63-F67 WeakPolarHBondContact O-CD2 3.45Å; T63-F67 PolarHBondContact O-N 3.35Å; E64-F67 PolarHBondContact O-N 2.66Å; A65-F67 PolarHBondContact O-N 2.9Å; F67-T70 PolarHBondContact O-N 2.94Å; F67-T70 PolarHBondContact O-OG1 2.98Å; F67-D97 HydrophobicContact CZ-CB 4.02Å; F67-I100 HydrophobicContact CD1-CD1 4.29Å; F67-I100 HydrophobicContact CE1-CD1 3.81Å; F67-I100 HydrophobicContact CE1-CG2 4.11Å
68	G	87.9	Confident	87	Confident	4 Å²	4	58 Å²	58	4%	0.041	29%	0.287	C	S	.	.	H	α-helix	trans	-58	-47.6	170.9	0	0	0	0	0	112.3	F30 E64 A65 F66 T70 K71	F30-G68 WeakPolarHBondContact CB-O 3.36Å; E64-G68 PolarHBondContact O-N 2.93Å; A65-G68 CarbonylContact O-C 3.59Å; A65-G68 WeakPolarHBondContact O-CA 3.45Å; A65-G68 PolarHBondContact O-N 3.06Å; A65-G68 VanDerWaalsContact O-N 3.12Å; F66-G68 VanDerWaalsContact C-N 3.29Å; F66-G68 PolarHBondContact O-N 3.31Å; G68-T70 VanDerWaalsContact C-N 3.29Å; G68-T70 PolarHBondContact O-N 3.44Å; G68-K71 PolarHBondContact O-N 3.38Å
69	V	89.8	Confident	87	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.7	-38.3	177	176.1	0	0	0	0	111.7	F30 L44 A65 F66 K71 L72 V84 A87 V88 L91	F30-V69 HydrophobicContact CD2-CG2 4.23Å; F30-V69 HydrophobicContact CE2-CG2 3.99Å; L44-V69 HydrophobicContact CD2-CG2 3.7Å; A65-V69 WeakPolarHBondContact O-CG2 3.36Å; A65-V69 PolarHBondContact O-N 2.96Å; F66-V69 WeakPolarHBondContact O-CA 2.95Å; F66-V69 WeakPolarHBondContact O-CB 3.06Å; F66-V69 PolarHBondContact O-N 3.5Å; V69-K71 PolarHBondContact O-N 3.43Å; V69-L72 VanDerWaalsContact O-CB 3.29Å; V69-L72 WeakPolarHBondContact O-CB 2.97Å; V69-L72 PolarHBondContact O-N 3.02Å; V69-V84 HydrophobicContact CG1-CB 4.39Å; V69-V84 HydrophobicContact CG1-CG1 4.01Å; V69-V84 HydrophobicContact CG1-CG2 4.28Å; V69-A87 HydrophobicContact CG1-CB 4.05Å; V69-A87 HydrophobicContact CG2-CB 4.27Å; V69-V88 HydrophobicContact CG1-CG2 4.1Å; V69-L91 HydrophobicContact CG2-CD1 4.25Å
70	T	88.1	Confident	87.2	Confident	29 Å²	29	53 Å²	53	18%	0.178	27%	0.27	C	S	.	.	H	α-helix	trans	-60.2	-31.4	-179.9	72	0	0	0	0	113.3	F66 F67 G68 L72 W73 I100 V101	F66-T70 HydrophobicContact CD1-CG2 4.09Å; F66-T70 HydrophobicContact CE1-CG2 3.89Å; F66-T70 HydrophobicContact CZ-CG2 4.43Å; F66-T70 WeakPolarHBondContact O-CG2 3.48Å; F66-T70 PolarHBondContact O-N 2.93Å; F67-T70 PolarHBondContact O-N 2.94Å; F67-T70 PolarHBondContact O-OG1 2.98Å; G68-T70 VanDerWaalsContact C-N 3.29Å; G68-T70 PolarHBondContact O-N 3.44Å; T70-L72 VanDerWaalsContact C-N 3.26Å; T70-L72 PolarHBondContact O-N 3.22Å; T70-W73 WeakPolarHBondContact O-CB 3.23Å; T70-W73 PolarHBondContact O-N 3.18Å; T70-I100 HydrophobicContact CG2-CG2 4.13Å; T70-V101 HydrophobicContact CG2-CG1 3.34Å
71	K	87.4	Confident	87.3	Confident	95 Å²	95	49.2 Å²	49.2	41%	0.413	24%	0.244	S	C	.	.	H	α-helix	trans	-70.4	-23.7	178.6	-65.4	179.4	-174.9	175.3	0	112.9	N31 G68 V69 W73 Q74	N31-K71 VanDerWaalsContact OD1-CD 3.26Å; N31-K71 WeakPolarHBondContact OD1-CD 3.23Å; N31-K71 WeakPolarHBondContact OD1-CE 3.38Å; N31-K71 PolarHBondContact OD1-NZ 3.49Å; G68-K71 PolarHBondContact O-N 3.38Å; V69-K71 PolarHBondContact O-N 3.43Å; K71-W73 PolarHBondContact O-N 3.41Å; K71-W73 VanDerWaalsContact O-N 3.13Å; K71-Q74 WeakPolarHBondContact O-CB 3.41Å; K71-Q74 WeakPolarHBondContact O-CG 3.46Å; K71-Q74 PolarHBondContact O-N 2.99Å; K71-Q74 VanDerWaalsContact O-N 3.16Å
72	L	88.8	Confident	87.3	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-65.9	-14.8	178.3	-56.8	177.4	0	0	0	112.8	F30 I35 C40 L44 V69 T70 Q74 S75 L80 V84	F30-L72 HydrophobicContact CB-CD1 4.44Å; F30-L72 HydrophobicContact CB-CD2 3.97Å; F30-L72 HydrophobicContact CB-CG 4.24Å; F30-L72 HydrophobicContact CD1-CD1 3.75Å; F30-L72 HydrophobicContact CD1-CD2 3.97Å; F30-L72 HydrophobicContact CD1-CG 4.31Å; F30-L72 HydrophobicContact CD2-CD1 4.4Å; F30-L72 HydrophobicContact CE1-CD1 4.04Å; F30-L72 HydrophobicContact CG-CD1 3.95Å; F30-L72 HydrophobicContact CG-CD2 4.2Å; F30-L72 HydrophobicContact CG-CG 4.29Å; F30-L72 HydrophobicContact CZ-CD1 4.5Å; I35-L72 HydrophobicContact CG2-CD2 3.93Å; C40-L72 HydrophobicContact CB-CD1 4.42Å; C40-L72 HydrophobicContact CB-CD2 4.06Å; L44-L72 HydrophobicContact CD1-CD1 3.79Å; L44-L72 HydrophobicContact CD2-CD1 4.36Å; L44-L72 HydrophobicContact CG-CD1 4.29Å; V69-L72 VanDerWaalsContact O-CB 3.29Å; V69-L72 WeakPolarHBondContact O-CB 2.97Å; V69-L72 PolarHBondContact O-N 3.02Å; T70-L72 VanDerWaalsContact C-N 3.26Å; T70-L72 PolarHBondContact O-N 3.22Å; L72-Q74 PolarHBondContact O-N 3.35Å; L72-Q74 VanDerWaalsContact O-N 3.12Å; L72-S75 PolarHBondContact O-N 3.05Å; L72-S75 VanDerWaalsContact O-N 3.13Å; L72-L80 HydrophobicContact CB-CD2 4.3Å; L72-L80 HydrophobicContact CD1-CD1 4.33Å; L72-L80 HydrophobicContact CD2-CD2 4.48Å; L72-V84 HydrophobicContact CB-CG2 3.56Å; L72-V84 HydrophobicContact CD1-CG2 4.01Å; L72-V84 HydrophobicContact CG-CG2 4.44Å
73	W	87.8	Confident	87.5	Confident	25 Å²	25	54.3 Å²	54.3	10%	0.095	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-58.9	-19	171.2	-106	-98.4	0	0	0	113.6	T70 K71 S75 R81 V84 Y85 V88 V101 L105 D108	T70-W73 WeakPolarHBondContact O-CB 3.23Å; T70-W73 PolarHBondContact O-N 3.18Å; K71-W73 PolarHBondContact O-N 3.41Å; K71-W73 VanDerWaalsContact O-N 3.13Å; W73-S75 VanDerWaalsContact C-N 3.27Å; W73-S75 PolarHBondContact O-N 3.46Å; W73-R81 VanDerWaalsContact CA-NH1 3.3Å; W73-R81 VanDerWaalsContact O-CZ 3.24Å; W73-R81 PolarHBondContact O-NH1 3.18Å; W73-R81 PolarHBondContact O-NH2 2.9Å; W73-V84 HydrophobicContact CD2-CG1 3.84Å; W73-V84 HydrophobicContact CE3-CG1 3.27Å; W73-V84 HydrophobicContact CH2-CG1 3.45Å; W73-V84 VanDerWaalsContact CH2-CG1 3.45Å; W73-V84 HydrophobicContact CZ2-CG1 3.96Å; W73-V84 HydrophobicContact CZ3-CG1 3.08Å; W73-Y85 HydrophobicContact CH2-CD1 4.45Å; W73-Y85 AromaticContact CZ2-CD1 3.91Å; W73-Y85 HydrophobicContact CZ2-CD1 3.91Å; W73-Y85 AromaticContact CZ2-CE1 3.72Å; W73-Y85 HydrophobicContact CZ2-CE1 3.72Å; W73-V88 HydrophobicContact CH2-CB 4.49Å; W73-V88 HydrophobicContact CH2-CG2 3.72Å; W73-V88 HydrophobicContact CZ3-CG2 3.71Å; W73-V101 HydrophobicContact CH2-CB 4.38Å; W73-V101 HydrophobicContact CH2-CG1 4.36Å; W73-V101 HydrophobicContact CZ3-CB 4.49Å; W73-V101 HydrophobicContact CZ3-CG1 4.02Å; W73-L105 HydrophobicContact CH2-CD2 4.29Å; W73-L105 HydrophobicContact CZ2-CD2 3.73Å; W73-L105 HydrophobicContact CZ2-CG 4.09Å; W73-D108 PolarHBondContact NE1-OD2 3.05Å
74	Q	84.8	Confident	87.6	Confident	142 Å²	142	53.5 Å²	53.5	66%	0.664	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-69.3	-24.8	177.5	-64.2	177.7	10.5	0	0	112.8	I35 K71 L72	I35-Q74 HydrophobicContact CD1-CB 3.95Å; K71-Q74 WeakPolarHBondContact O-CB 3.41Å; K71-Q74 WeakPolarHBondContact O-CG 3.46Å; K71-Q74 PolarHBondContact O-N 2.99Å; K71-Q74 VanDerWaalsContact O-N 3.16Å; L72-Q74 PolarHBondContact O-N 3.35Å; L72-Q74 VanDerWaalsContact O-N 3.12Å
75	S	85.9	Confident	87.7	Confident	21 Å²	21	46.9 Å²	46.9	15%	0.147	23%	0.227	C	C	.	.			trans	-75.8	138.8	178.1	-178.8	0	0	0	0	111.8	L72 W73 D77 R81	L72-S75 PolarHBondContact O-N 3.05Å; L72-S75 VanDerWaalsContact O-N 3.13Å; W73-S75 VanDerWaalsContact C-N 3.27Å; W73-S75 PolarHBondContact O-N 3.46Å; S75-D77 VanDerWaalsContact C-N 3.29Å; S75-D77 WeakPolarHBondContact OG-CB 3.32Å; S75-D77 PolarHBondContact OG-N 3.4Å; S75-R81 PolarHBondContact O-NH2 3.16Å
76	K	82.5	Confident	87.8	Confident	189 Å²	189	49.9 Å²	49.9	82%	0.822	24%	0.241	S	C	*	.			trans	-86.6	3.6	173.5	-62.5	-175.2	-178.7	-180	0	113.3	V78	K76-V78 PolarHBondContact O-N 3.46Å
77	D	87.4	Confident	87.8	Confident	63 Å²	63	50 Å²	50	34%	0.337	24%	0.242	S	C	.	.			trans	-71.2	124.1	-180	-173.9	-90.4	0	0	0	111.7	A37 S75 S79 L80 R81	A37-D77 HydrophobicContact CB-CB 3.73Å; S75-D77 VanDerWaalsContact C-N 3.29Å; S75-D77 WeakPolarHBondContact OG-CB 3.32Å; S75-D77 PolarHBondContact OG-N 3.4Å; D77-S79 PolarHBondContact O-N 2.95Å; D77-S79 WeakPolarHBondContact OD1-CA 3.47Å; D77-S79 WeakPolarHBondContact OD1-CB 3.34Å; D77-S79 PolarHBondContact OD1-N 3.28Å; D77-L80 HydrophobicContact CB-CB 4.04Å; D77-L80 PolarHBondContact OD1-N 3.3Å; D77-R81 WeakPolarHBondContact O-CB 3.4Å; D77-R81 PolarHBondContact O-N 3.28Å
78	V	85.4	Confident	87.8	Confident	54 Å²	54	46.6 Å²	46.6	33%	0.327	23%	0.227	S	C	.	.	H	α-helix	trans	-65.3	-38.8	-176.4	177	0	0	0	0	111.9	K76 R81 R82 Y116	K76-V78 PolarHBondContact O-N 3.46Å; V78-R81 PolarHBondContact O-N 3.34Å; V78-R82 WeakPolarHBondContact O-CG 3.47Å; V78-R82 PolarHBondContact O-N 2.92Å; V78-R82 VanDerWaalsContact O-N 3.1Å; V78-Y116 HydrophobicContact CG1-CE1 4.21Å; V78-Y116 HydrophobicContact CG2-CE1 4.41Å; V78-Y116 WeakPolarHBondContact CG2-OH 3.4Å
79	S	86.8	Confident	87.8	Confident	75 Å²	75	48.6 Å²	48.6	52%	0.524	23%	0.234	S	C	.	.	H	α-helix	trans	-70.2	-43.7	-178.1	-61.5	0	0	0	0	110.7	D77 R81 R82 M83	D77-S79 PolarHBondContact O-N 2.95Å; D77-S79 WeakPolarHBondContact OD1-CA 3.47Å; D77-S79 WeakPolarHBondContact OD1-CB 3.34Å; D77-S79 PolarHBondContact OD1-N 3.28Å; S79-R81 PolarHBondContact O-N 3.18Å; S79-R82 PolarHBondContact O-N 3.24Å; S79-M83 WeakPolarHBondContact O-CG 3.45Å; S79-M83 PolarHBondContact O-N 3.24Å; S79-M83 VanDerWaalsContact O-N 3.11Å
80	L	89.3	Confident	87.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-44.1	173.9	-172.3	66.9	0	0	0	111.3	I35 A37 C40 C41 L44 L72 D77 R82 M83 V84	I35-L80 HydrophobicContact CG2-CD2 4.17Å; A37-L80 HydrophobicContact CB-CB 4.34Å; A37-L80 HydrophobicContact CB-CD2 4.1Å; C40-L80 HydrophobicContact CB-CD1 3.6Å; C40-L80 HydrophobicContact CB-CD2 4.47Å; C41-L80 WeakPolarHBondContact SG-CA 3.48Å; C41-L80 VanDerWaalsContact SG-CD1 3.59Å; L44-L80 HydrophobicContact CD1-CD1 3.96Å; L72-L80 HydrophobicContact CB-CD2 4.3Å; L72-L80 HydrophobicContact CD1-CD1 4.33Å; L72-L80 HydrophobicContact CD2-CD2 4.48Å; D77-L80 HydrophobicContact CB-CB 4.04Å; D77-L80 PolarHBondContact OD1-N 3.3Å; L80-R82 VanDerWaalsContact C-N 3.29Å; L80-R82 PolarHBondContact O-N 3.38Å; L80-M83 PolarHBondContact O-N 3.02Å; L80-M83 VanDerWaalsContact O-N 3.14Å; L80-V84 HydrophobicContact CG-CG2 4.42Å; L80-V84 VanDerWaalsContact O-CG2 3.25Å; L80-V84 WeakPolarHBondContact O-CG2 3.21Å; L80-V84 PolarHBondContact O-N 3.45Å
81	R	88.7	Confident	87.6	Confident	24 Å²	24	50.6 Å²	50.6	9%	0.091	24%	0.242	C	C	.	.	H	α-helix	trans	-56.9	-41.4	176.6	-169.5	78.8	67.6	178.7	-6.8	112.2	W73 S75 D77 V78 S79 V84 Y85 D108 Y116	W73-R81 VanDerWaalsContact CA-NH1 3.3Å; W73-R81 VanDerWaalsContact O-CZ 3.24Å; W73-R81 PolarHBondContact O-NH1 3.18Å; W73-R81 PolarHBondContact O-NH2 2.9Å; S75-R81 PolarHBondContact O-NH2 3.16Å; D77-R81 WeakPolarHBondContact O-CB 3.4Å; D77-R81 PolarHBondContact O-N 3.28Å; V78-R81 PolarHBondContact O-N 3.34Å; S79-R81 PolarHBondContact O-N 3.18Å; R81-V84 WeakPolarHBondContact O-CB 3.33Å; R81-V84 PolarHBondContact O-N 3.27Å; R81-Y85 HydrophobicContact CG-CD2 4.43Å; R81-Y85 HydrophobicContact CG-CE2 3.63Å; R81-Y85 WeakPolarHBondContact O-CD2 3.36Å; R81-Y85 PolarHBondContact O-N 2.91Å; R81-Y85 VanDerWaalsContact O-N 3.12Å; R81-D108 IonicContact NH1-OD2 2.83Å; R81-Y116 HydrophobicContact CB-CE1 3.97Å; R81-Y116 HydrophobicContact CG-CD1 3.94Å; R81-Y116 HydrophobicContact CG-CE1 3.73Å; R81-Y116 HydrophobicContact CG-CG 4.44Å
82	R	87.3	Confident	87.5	Confident	139 Å²	139	46.9 Å²	46.9	53%	0.525	23%	0.229	S	C	.	.	H	α-helix	trans	-64	-43.6	176	-72.4	175.5	-178.8	-171	2.9	112.4	V78 S79 L80 V84 Y85 L86	V78-R82 WeakPolarHBondContact O-CG 3.47Å; V78-R82 PolarHBondContact O-N 2.92Å; V78-R82 VanDerWaalsContact O-N 3.1Å; S79-R82 PolarHBondContact O-N 3.24Å; L80-R82 VanDerWaalsContact C-N 3.29Å; L80-R82 PolarHBondContact O-N 3.38Å; R82-V84 VanDerWaalsContact C-N 3.29Å; R82-V84 PolarHBondContact O-N 3.4Å; R82-Y85 PolarHBondContact O-N 3.18Å; R82-L86 PolarHBondContact O-N 3.05Å
83	M	89	Confident	87.2	Confident	38 Å²	38	53.5 Å²	53.5	19%	0.187	26%	0.26	C	S	.	.	H	α-helix	trans	-63.3	-37.4	176.4	-69.4	-59.5	-65.5	0	0	111.8	L44 S45 I48 S79 L80 L86 A87	L44-M83 HydrophobicContact CB-CB 4.27Å; L44-M83 HydrophobicContact CB-CE 3.84Å; L44-M83 HydrophobicContact CD1-CB 3.6Å; S45-M83 WeakPolarHBondContact OG-CE 3.49Å; I48-M83 HydrophobicContact CD1-CE 3.73Å; S79-M83 WeakPolarHBondContact O-CG 3.45Å; S79-M83 PolarHBondContact O-N 3.24Å; S79-M83 VanDerWaalsContact O-N 3.11Å; L80-M83 PolarHBondContact O-N 3.02Å; L80-M83 VanDerWaalsContact O-N 3.14Å; M83-L86 PolarHBondContact O-N 3.3Å; M83-A87 WeakPolarHBondContact O-CB 3.28Å; M83-A87 PolarHBondContact O-N 2.97Å
84	V	90.7	Very high	87	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-45.9	175.2	167.3	0	0	0	0	111.5	L44 V69 L72 W73 L80 R81 R82 L86 A87 V88	L44-V84 HydrophobicContact CD1-CG2 4.25Å; V69-V84 HydrophobicContact CG1-CB 4.39Å; V69-V84 HydrophobicContact CG1-CG1 4.01Å; V69-V84 HydrophobicContact CG1-CG2 4.28Å; L72-V84 HydrophobicContact CB-CG2 3.56Å; L72-V84 HydrophobicContact CD1-CG2 4.01Å; L72-V84 HydrophobicContact CG-CG2 4.44Å; W73-V84 HydrophobicContact CD2-CG1 3.84Å; W73-V84 HydrophobicContact CE3-CG1 3.27Å; W73-V84 HydrophobicContact CH2-CG1 3.45Å; W73-V84 VanDerWaalsContact CH2-CG1 3.45Å; W73-V84 HydrophobicContact CZ2-CG1 3.96Å; W73-V84 HydrophobicContact CZ3-CG1 3.08Å; L80-V84 HydrophobicContact CG-CG2 4.42Å; L80-V84 VanDerWaalsContact O-CG2 3.25Å; L80-V84 WeakPolarHBondContact O-CG2 3.21Å; L80-V84 PolarHBondContact O-N 3.45Å; R81-V84 WeakPolarHBondContact O-CB 3.33Å; R81-V84 PolarHBondContact O-N 3.27Å; R82-V84 VanDerWaalsContact C-N 3.29Å; R82-V84 PolarHBondContact O-N 3.4Å; V84-L86 VanDerWaalsContact C-N 3.29Å; V84-L86 PolarHBondContact O-N 3.43Å; V84-A87 PolarHBondContact O-N 2.93Å; V84-V88 WeakPolarHBondContact O-CB 3.45Å; V84-V88 WeakPolarHBondContact O-CG2 3.17Å; V84-V88 PolarHBondContact O-N 3.18Å
85	Y	90	Very high	87	Confident	6 Å²	6	48.8 Å²	48.8	2%	0.024	24%	0.244	C	C	.	.	H	α-helix	trans	-61.6	-36.7	175.8	-63	-49.5	0	0	0	113.1	W73 R81 R82 K89 L105 D108 Y116 A119 A120 A123	W73-Y85 HydrophobicContact CH2-CD1 4.45Å; W73-Y85 AromaticContact CZ2-CD1 3.91Å; W73-Y85 HydrophobicContact CZ2-CD1 3.91Å; W73-Y85 AromaticContact CZ2-CE1 3.72Å; W73-Y85 HydrophobicContact CZ2-CE1 3.72Å; R81-Y85 HydrophobicContact CG-CD2 4.43Å; R81-Y85 HydrophobicContact CG-CE2 3.63Å; R81-Y85 WeakPolarHBondContact O-CD2 3.36Å; R81-Y85 PolarHBondContact O-N 2.91Å; R81-Y85 VanDerWaalsContact O-N 3.12Å; R82-Y85 PolarHBondContact O-N 3.18Å; Y85-K89 VanDerWaalsContact O-CG 3.31Å; Y85-K89 WeakPolarHBondContact O-CG 3.43Å; Y85-K89 PolarHBondContact O-N 3.42Å; Y85-L105 HydrophobicContact CD1-CD2 3.87Å; Y85-L105 HydrophobicContact CE1-CD2 3.75Å; Y85-D108 WeakPolarHBondContact OH-CB 3.4Å; Y85-D108 PolarHBondContact OH-OD2 3.1Å; Y85-Y116 HydrophobicContact CE2-CD1 4.43Å; Y85-A119 HydrophobicContact CD2-CB 3.43Å; Y85-A119 VanDerWaalsContact CD2-CB 3.43Å; Y85-A119 HydrophobicContact CE2-CB 3.65Å; Y85-A119 HydrophobicContact CG-CB 4.12Å; Y85-A120 HydrophobicContact CE1-CB 4.16Å; Y85-A123 HydrophobicContact CD1-CB 4.33Å
86	L	88.8	Confident	86.9	Confident	72 Å²	72	51.2 Å²	51.2	38%	0.377	26%	0.255	S	S	.	.	H	α-helix	trans	-69.7	-48.8	177.5	-175.4	59.6	0	0	0	110.8	I48 R82 M83 V84 V88 K89 E90	I48-L86 HydrophobicContact CD1-CB 4.24Å; I48-L86 HydrophobicContact CD1-CD2 3.79Å; I48-L86 HydrophobicContact CD1-CG 3.84Å; I48-L86 HydrophobicContact CG2-CD2 4.42Å; R82-L86 PolarHBondContact O-N 3.05Å; M83-L86 PolarHBondContact O-N 3.3Å; V84-L86 VanDerWaalsContact C-N 3.29Å; V84-L86 PolarHBondContact O-N 3.43Å; L86-V88 VanDerWaalsContact C-N 3.32Å; L86-V88 PolarHBondContact O-N 3.09Å; L86-K89 WeakPolarHBondContact O-CB 3.39Å; L86-K89 PolarHBondContact O-N 3.18Å; L86-K89 VanDerWaalsContact O-N 3.08Å; L86-E90 PolarHBondContact O-N 2.88Å; L86-E90 VanDerWaalsContact O-N 3.09Å
87	A	88.7	Confident	86.8	Confident	1 Å²	1	48 Å²	48	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-59.8	-41	178	0	0	0	0	0	112.3	L44 I48 V69 M83 V84 K89 E90 L91	L44-A87 HydrophobicContact CD2-CB 3.88Å; I48-A87 HydrophobicContact CD1-CB 4.37Å; V69-A87 HydrophobicContact CG1-CB 4.05Å; V69-A87 HydrophobicContact CG2-CB 4.27Å; M83-A87 WeakPolarHBondContact O-CB 3.28Å; M83-A87 PolarHBondContact O-N 2.97Å; V84-A87 PolarHBondContact O-N 2.93Å; A87-K89 VanDerWaalsContact C-N 3.34Å; A87-K89 PolarHBondContact O-N 3.46Å; A87-E90 PolarHBondContact O-N 3.17Å; A87-L91 VanDerWaalsContact O-CB 3.29Å; A87-L91 WeakPolarHBondContact O-CB 3.3Å; A87-L91 VanDerWaalsContact O-CG 3.32Å; A87-L91 WeakPolarHBondContact O-CG 3.33Å; A87-L91 PolarHBondContact O-N 3.4Å
88	V	89.2	Confident	86.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.3	-40.5	174.7	163.2	0	0	0	0	111.7	F66 V69 W73 V84 L86 A92 V101	F66-V88 HydrophobicContact CE2-CB 4.29Å; F66-V88 HydrophobicContact CE2-CG1 4.05Å; F66-V88 HydrophobicContact CE2-CG2 3.96Å; V69-V88 HydrophobicContact CG1-CG2 4.1Å; W73-V88 HydrophobicContact CH2-CB 4.49Å; W73-V88 HydrophobicContact CH2-CG2 3.72Å; W73-V88 HydrophobicContact CZ3-CG2 3.71Å; V84-V88 WeakPolarHBondContact O-CB 3.45Å; V84-V88 WeakPolarHBondContact O-CG2 3.17Å; V84-V88 PolarHBondContact O-N 3.18Å; L86-V88 VanDerWaalsContact C-N 3.32Å; L86-V88 PolarHBondContact O-N 3.09Å; V88-A92 WeakPolarHBondContact O-CB 3.45Å; V88-A92 PolarHBondContact O-N 2.99Å; V88-V101 HydrophobicContact CG1-CG2 4.15Å
89	K	87.4	Confident	86.4	Confident	45 Å²	45	48 Å²	48	20%	0.196	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-41.1	178.2	-76.9	173.5	177.5	-173.4	0	112.7	Y85 L86 A87 R122 A123 K126	Y85-K89 VanDerWaalsContact O-CG 3.31Å; Y85-K89 WeakPolarHBondContact O-CG 3.43Å; Y85-K89 PolarHBondContact O-N 3.42Å; L86-K89 WeakPolarHBondContact O-CB 3.39Å; L86-K89 PolarHBondContact O-N 3.18Å; L86-K89 VanDerWaalsContact O-N 3.08Å; A87-K89 VanDerWaalsContact C-N 3.34Å; A87-K89 PolarHBondContact O-N 3.46Å; K89-R122 VanDerWaalsContact CE-C 3.46Å; K89-R122 WeakPolarHBondContact CE-O 3.36Å; K89-R122 VanDerWaalsContact NZ-CB 3.32Å; K89-A123 VanDerWaalsContact CE-CA 3.45Å; K89-A123 HydrophobicContact CG-CB 4.17Å; K89-K126 HydrophobicContact CB-CD 3.85Å; K89-K126 HydrophobicContact CG-CD 3.99Å; K89-K126 WeakPolarHBondContact O-CD 3.37Å; K89-K126 VanDerWaalsContact O-CE 3.25Å; K89-K126 WeakPolarHBondContact O-CE 3.5Å; K89-K126 PolarHBondContact O-NZ 2.86Å
90	E	87.8	Confident	86.3	Confident	66 Å²	66	49 Å²	49	31%	0.308	24%	0.243	S	C	.	.	H	α-helix	trans	-74.5	-43.6	-179.4	-60.9	-48.1	130.2	0	0	111.6	I51 L86 A87 A92	I51-E90 HydrophobicContact CD1-CB 4.39Å; L86-E90 PolarHBondContact O-N 2.88Å; L86-E90 VanDerWaalsContact O-N 3.09Å; A87-E90 PolarHBondContact O-N 3.17Å; E90-A92 PolarHBondContact O-N 2.89Å
91	L	86.6	Confident	86.2	Confident	5 Å²	5	49 Å²	49	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-75.6	-23.1	-177.5	-67.9	172.4	0	0	0	113.8	L47 I51 A62 A65 F66 V69 A87 E93 V94 S95	L47-L91 HydrophobicContact CD2-CD1 4.22Å; I51-L91 HydrophobicContact CD1-CD2 3.97Å; A62-L91 HydrophobicContact CB-CD2 4.37Å; A65-L91 HydrophobicContact CB-CD1 4.46Å; F66-L91 HydrophobicContact CB-CD1 4.41Å; F66-L91 HydrophobicContact CD2-CB 3.94Å; V69-L91 HydrophobicContact CG2-CD1 4.25Å; A87-L91 VanDerWaalsContact O-CB 3.29Å; A87-L91 WeakPolarHBondContact O-CB 3.3Å; A87-L91 VanDerWaalsContact O-CG 3.32Å; A87-L91 WeakPolarHBondContact O-CG 3.33Å; A87-L91 PolarHBondContact O-N 3.4Å; L91-E93 PolarHBondContact O-N 3.49Å; L91-V94 PolarHBondContact O-N 2.99Å; L91-V94 VanDerWaalsContact O-N 3.17Å; L91-S95 VanDerWaalsContact O-CB 3.31Å; L91-S95 WeakPolarHBondContact O-CB 3.49Å; L91-S95 PolarHBondContact O-N 3.36Å; L91-S95 PolarHBondContact O-OG 3.35Å
92	A	84.9	Confident	86	Confident	18 Å²	18	48.9 Å²	48.9	15%	0.149	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.2	-176.4	0	0	0	0	0	114.9	V88 E90 V94 V98 I127	V88-A92 WeakPolarHBondContact O-CB 3.45Å; V88-A92 PolarHBondContact O-N 2.99Å; E90-A92 PolarHBondContact O-N 2.89Å; A92-V94 VanDerWaalsContact C-N 3.35Å; A92-V98 HydrophobicContact CB-CG1 3.67Å; A92-V98 HydrophobicContact CB-CG2 4.39Å; A92-I127 HydrophobicContact CB-CG2 3.58Å
93	E	82.1	Confident	86	Confident	141 Å²	141	46.8 Å²	46.8	66%	0.659	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-23.4	178.9	-69.4	178.3	-165	0	0	112.4	L91 K126	L91-E93 PolarHBondContact O-N 3.49Å; E93-K126 WeakPolarHBondContact OE1-CE 3.42Å; E93-K126 IonicContact OE1-NZ 3.65Å; E93-K126 PolarHBondContact OE1-NZ 3.01Å
94	V	84.4	Confident	85.9	Confident	59 Å²	59	47 Å²	47	36%	0.358	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-29.4	-172.4	-174.7	0	0	0	0	112	R59 A62 L91 A92	R59-V94 WeakPolarHBondContact CG-O 3.28Å; R59-V94 PolarHBondContact NE-O 3.41Å; A62-V94 HydrophobicContact CB-CB 4.17Å; A62-V94 HydrophobicContact CB-CG1 3.82Å; L91-V94 PolarHBondContact O-N 2.99Å; L91-V94 VanDerWaalsContact O-N 3.17Å; A92-V94 VanDerWaalsContact C-N 3.35Å
95	S	84.8	Confident	85.9	Confident	9 Å²	9	47 Å²	47	6%	0.063	26%	0.257	C	S	.	.			trans	-83.6	151.6	-174.3	-50.1	0	0	0	0	112.8	A62 T63 L91 V98	A62-S95 PolarHBondContact O-OG 3.18Å; T63-S95 WeakPolarHBondContact OG1-CA 3.24Å; L91-S95 VanDerWaalsContact O-CB 3.31Å; L91-S95 WeakPolarHBondContact O-CB 3.49Å; L91-S95 PolarHBondContact O-N 3.36Å; L91-S95 PolarHBondContact O-OG 3.35Å; S95-V98 VanDerWaalsContact O-CG2 3.27Å; S95-V98 WeakPolarHBondContact O-CG2 3.34Å
96	D	82.7	Confident	85.7	Confident	72 Å²	72	48 Å²	48	39%	0.385	26%	0.264	S	S	.	.	S	Bend	trans	-89	164.2	169.7	-61.2	-42.8	0	0	0	110.8	R59 T63 V98	R59-D96 VanDerWaalsContact CD-OD2 3.29Å; R59-D96 WeakPolarHBondContact CD-OD2 3.49Å; R59-D96 WeakPolarHBondContact CG-OD2 3.38Å; R59-D96 IonicContact CZ-OD1 3.35Å; R59-D96 IonicContact NE-OD1 3.45Å; R59-D96 PolarHBondContact NE-OD1 3.32Å; T63-D96 PolarHBondContact OG1-N 3.23Å; D96-V98 PolarHBondContact O-N 2.7Å; D96-V98 VanDerWaalsContact O-N 3.12Å
97	D	81.6	Confident	85.7	Confident	120 Å²	120	51.9 Å²	51.9	64%	0.642	28%	0.278	S	S	*	.			trans	55.5	29.4	176.2	-63.3	-36.8	0	0	0	116.3	F67 I99 I100	F67-D97 HydrophobicContact CZ-CB 4.02Å; D97-I99 PolarHBondContact O-N 3.05Å; D97-I100 WeakPolarHBondContact O-CG2 3.37Å; D97-I100 PolarHBondContact O-N 3.49Å
98	V	82.4	Confident	85.7	Confident	18 Å²	18	52.8 Å²	52.8	11%	0.109	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-57.7	-21	-179.1	-179	0	0	0	0	113	F66 A92 S95 D96 I100 V101 I127	F66-V98 HydrophobicContact CE2-CG1 4.12Å; F66-V98 HydrophobicContact CZ-CB 4.15Å; F66-V98 HydrophobicContact CZ-CG1 3.74Å; F66-V98 HydrophobicContact CZ-CG2 4.34Å; A92-V98 HydrophobicContact CB-CG1 3.67Å; A92-V98 HydrophobicContact CB-CG2 4.39Å; S95-V98 VanDerWaalsContact O-CG2 3.27Å; S95-V98 WeakPolarHBondContact O-CG2 3.34Å; D96-V98 PolarHBondContact O-N 2.7Å; D96-V98 VanDerWaalsContact O-N 3.12Å; V98-I100 PolarHBondContact O-N 3.18Å; V98-I100 VanDerWaalsContact O-N 3.09Å; V98-V101 WeakPolarHBondContact O-CG2 3.41Å; V98-V101 PolarHBondContact O-N 3.02Å; V98-I127 HydrophobicContact CG1-CB 3.86Å; V98-I127 HydrophobicContact CG1-CD1 4.48Å; V98-I127 HydrophobicContact CG1-CG2 3.53Å
99	I	81.4	Confident	85.5	Confident	99 Å²	99	53 Å²	53	51%	0.508	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-60.3	-22.4	-179.4	-59.8	178	0	0	0	112.5	D97 V101 T102 M132	D97-I99 PolarHBondContact O-N 3.05Å; I99-V101 PolarHBondContact O-N 3.09Å; I99-V101 VanDerWaalsContact O-N 3.09Å; I99-T102 WeakPolarHBondContact O-CB 3.38Å; I99-T102 PolarHBondContact O-N 3.48Å; I99-T102 PolarHBondContact O-OG1 2.84Å; I99-M132 HydrophobicContact CB-SD 4.49Å; I99-M132 HydrophobicContact CD1-CE 4.1Å; I99-M132 HydrophobicContact CG1-CE 3.79Å; I99-M132 HydrophobicContact CG1-SD 4.21Å; I99-M132 HydrophobicContact CG2-CE 4.48Å; I99-M132 HydrophobicContact CG2-SD 3.76Å
100	I	84.6	Confident	85.4	Confident	96 Å²	96	54.5 Å²	54.5	49%	0.492	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-57.2	-28.5	-178.2	-163.8	169.7	0	0	0	113.9	F66 F67 T70 D97 V98 T102	F66-I100 HydrophobicContact CE1-CG2 3.9Å; F67-I100 HydrophobicContact CD1-CD1 4.29Å; F67-I100 HydrophobicContact CE1-CD1 3.81Å; F67-I100 HydrophobicContact CE1-CG2 4.11Å; T70-I100 HydrophobicContact CG2-CG2 4.13Å; D97-I100 WeakPolarHBondContact O-CG2 3.37Å; D97-I100 PolarHBondContact O-N 3.49Å; V98-I100 PolarHBondContact O-N 3.18Å; V98-I100 VanDerWaalsContact O-N 3.09Å; I100-T102 VanDerWaalsContact C-N 3.31Å; I100-T102 PolarHBondContact O-N 3.44Å
101	V	86.9	Confident	85.3	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.006	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-81.9	-7.3	179.5	-60.7	0	0	0	0	113.6	F66 T70 W73 V88 V98 I99 S103 S104 L105 I127	F66-V101 HydrophobicContact CE1-CG1 4.07Å; F66-V101 HydrophobicContact CZ-CG1 3.73Å; F66-V101 HydrophobicContact CZ-CG2 4.04Å; T70-V101 HydrophobicContact CG2-CG1 3.34Å; W73-V101 HydrophobicContact CH2-CB 4.38Å; W73-V101 HydrophobicContact CH2-CG1 4.36Å; W73-V101 HydrophobicContact CZ3-CB 4.49Å; W73-V101 HydrophobicContact CZ3-CG1 4.02Å; V88-V101 HydrophobicContact CG1-CG2 4.15Å; V98-V101 WeakPolarHBondContact O-CG2 3.41Å; V98-V101 PolarHBondContact O-N 3.02Å; I99-V101 PolarHBondContact O-N 3.09Å; I99-V101 VanDerWaalsContact O-N 3.09Å; V101-S103 PolarHBondContact O-N 3.38Å; V101-S104 PolarHBondContact O-N 3.44Å; V101-L105 HydrophobicContact CB-CD1 4.23Å; V101-L105 HydrophobicContact CG2-CD1 3.68Å; V101-L105 WeakPolarHBondContact O-CG 3.35Å; V101-L105 PolarHBondContact O-N 2.84Å; V101-I127 HydrophobicContact CG2-CD1 3.46Å; V101-I127 VanDerWaalsContact CG2-CD1 3.46Å
102	T	85.1	Confident	85	Confident	22 Å²	22	64.5 Å²	64.5	14%	0.135	34%	0.34	C	S	.	.	H	α-helix	trans	-56.5	-48.1	-175.2	-57.5	0	0	0	0	111.6	I99 I100 S104 L105 T106 L124 M132	I99-T102 WeakPolarHBondContact O-CB 3.38Å; I99-T102 PolarHBondContact O-N 3.48Å; I99-T102 PolarHBondContact O-OG1 2.84Å; I100-T102 VanDerWaalsContact C-N 3.31Å; I100-T102 PolarHBondContact O-N 3.44Å; T102-S104 PolarHBondContact O-N 3.33Å; T102-L105 PolarHBondContact O-N 3.28Å; T102-T106 WeakPolarHBondContact O-CB 3.45Å; T102-T106 PolarHBondContact O-N 3.29Å; T102-T106 PolarHBondContact O-OG1 3.06Å; T102-L124 HydrophobicContact CG2-CD1 4.08Å; T102-M132 HydrophobicContact CG2-SD 4.11Å
103	S	86.4	Confident	84.9	Confident	95 Å²	95	68.6 Å²	68.6	66%	0.664	36%	0.356	S	S	*	.	H	α-helix	trans	-61.3	-43	179.5	-175.8	0	0	0	0	112.4	V101 T106 K107	V101-S103 PolarHBondContact O-N 3.38Å; S103-T106 PolarHBondContact O-N 3.5Å; S103-K107 WeakPolarHBondContact O-CB 3.49Å; S103-K107 PolarHBondContact O-N 3.26Å
104	S	88.3	Confident	84.7	Confident	42 Å²	42	65 Å²	65	29%	0.294	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-42.9	177.1	-62.7	0	0	0	0	111.8	V101 T102 K107 D108	V101-S104 PolarHBondContact O-N 3.44Å; T102-S104 PolarHBondContact O-N 3.33Å; S104-K107 WeakPolarHBondContact O-CB 3.46Å; S104-K107 PolarHBondContact O-N 3.14Å; S104-D108 PolarHBondContact O-N 3.49Å
105	L	88.9	Confident	84.5	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-68.8	-39.1	177.1	-72.1	168.7	0	0	0	112.5	W73 Y85 V101 T102 K107 D108 M109 A120 A123 L124 I127	W73-L105 HydrophobicContact CH2-CD2 4.29Å; W73-L105 HydrophobicContact CZ2-CD2 3.73Å; W73-L105 HydrophobicContact CZ2-CG 4.09Å; Y85-L105 HydrophobicContact CD1-CD2 3.87Å; Y85-L105 HydrophobicContact CE1-CD2 3.75Å; V101-L105 HydrophobicContact CB-CD1 4.23Å; V101-L105 HydrophobicContact CG2-CD1 3.68Å; V101-L105 WeakPolarHBondContact O-CG 3.35Å; V101-L105 PolarHBondContact O-N 2.84Å; T102-L105 PolarHBondContact O-N 3.28Å; L105-K107 VanDerWaalsContact C-N 3.31Å; L105-K107 PolarHBondContact O-N 3.39Å; L105-D108 PolarHBondContact O-N 3.18Å; L105-M109 VanDerWaalsContact O-CB 3.28Å; L105-M109 WeakPolarHBondContact O-CB 3.47Å; L105-M109 PolarHBondContact O-N 3.29Å; L105-A120 HydrophobicContact CD2-CB 4.18Å; L105-A123 HydrophobicContact CD1-CB 4.42Å; L105-A123 HydrophobicContact CD2-CB 3.84Å; L105-L124 HydrophobicContact CB-CB 4.22Å; L105-L124 HydrophobicContact CB-CD1 4.12Å; L105-L124 HydrophobicContact CD1-CB 4.3Å; L105-L124 HydrophobicContact CD1-CD1 4.29Å; L105-I127 HydrophobicContact CD1-CD1 3.55Å; L105-I127 HydrophobicContact CD1-CG1 4.43Å
106	T	86.8	Confident	84.6	Confident	27 Å²	27	67.7 Å²	67.7	17%	0.166	35%	0.352	C	S	.	.	H	α-helix	trans	-64.6	-37.4	174.7	-55.4	0	0	0	0	111.4	T102 S103 M109 T110 Y139	T102-T106 WeakPolarHBondContact O-CB 3.45Å; T102-T106 PolarHBondContact O-N 3.29Å; T102-T106 PolarHBondContact O-OG1 3.06Å; S103-T106 PolarHBondContact O-N 3.5Å; T106-M109 HydrophobicContact CG2-CE 4.03Å; T106-M109 PolarHBondContact O-N 3.45Å; T106-T110 WeakPolarHBondContact O-CG2 3.5Å; T106-T110 PolarHBondContact O-N 3.4Å; T106-T110 VanDerWaalsContact O-N 3.11Å; T106-T110 PolarHBondContact O-OG1 3.29Å; T106-Y139 HydrophobicContact CG2-CD2 4.31Å; T106-Y139 HydrophobicContact CG2-CE2 4.02Å
107	K	88.4	Confident	84.8	Confident	153 Å²	153	66.5 Å²	66.5	67%	0.665	34%	0.341	S	S	*	.	H	α-helix	trans	-64.4	-44.3	173.9	-173.4	-178.8	-179.3	179.4	0	111.8	S103 S104 L105 M109 T110 G111	S103-K107 WeakPolarHBondContact O-CB 3.49Å; S103-K107 PolarHBondContact O-N 3.26Å; S104-K107 WeakPolarHBondContact O-CB 3.46Å; S104-K107 PolarHBondContact O-N 3.14Å; L105-K107 VanDerWaalsContact C-N 3.31Å; L105-K107 PolarHBondContact O-N 3.39Å; K107-M109 VanDerWaalsContact C-N 3.34Å; K107-T110 PolarHBondContact O-N 3.33Å; K107-T110 PolarHBondContact O-OG1 3.11Å; K107-G111 PolarHBondContact O-N 2.99Å
108	D	88.4	Confident	85.1	Confident	20 Å²	20	61.1 Å²	61.1	11%	0.107	31%	0.314	C	S	.	.	H	α-helix	trans	-71.2	-30.2	178.9	-71.7	-19.3	0	0	0	112.3	W73 R81 Y85 S104 L105 R117 A120	W73-D108 PolarHBondContact NE1-OD2 3.05Å; R81-D108 IonicContact NH1-OD2 2.83Å; Y85-D108 WeakPolarHBondContact OH-CB 3.4Å; Y85-D108 PolarHBondContact OH-OD2 3.1Å; S104-D108 PolarHBondContact O-N 3.49Å; L105-D108 PolarHBondContact O-N 3.18Å; D108-R117 WeakPolarHBondContact O-CG 3.45Å; D108-A120 HydrophobicContact CB-CB 3.78Å
109	M	85.3	Confident	85.3	Confident	6 Å²	6	60.9 Å²	60.9	3%	0.03	31%	0.314	C	S	.	.	H	α-helix	trans	-66.5	-37.6	173.2	176.3	176.5	63.9	0	0	113	L105 T106 K107 R117 A120 I121 L124 Y139	L105-M109 VanDerWaalsContact O-CB 3.28Å; L105-M109 WeakPolarHBondContact O-CB 3.47Å; L105-M109 PolarHBondContact O-N 3.29Å; T106-M109 HydrophobicContact CG2-CE 4.03Å; T106-M109 PolarHBondContact O-N 3.45Å; K107-M109 VanDerWaalsContact C-N 3.34Å; M109-R117 WeakPolarHBondContact O-CG 3.46Å; M109-R117 PolarHBondContact O-NE 2.89Å; M109-A120 HydrophobicContact CB-CB 4.46Å; M109-I121 HydrophobicContact CB-CG1 4.43Å; M109-I121 HydrophobicContact CG-CD1 4.28Å; M109-I121 HydrophobicContact CG-CG1 3.69Å; M109-I121 HydrophobicContact SD-CG1 3.85Å; M109-L124 HydrophobicContact CE-CD2 4Å; M109-L124 HydrophobicContact SD-CD2 4.07Å; M109-Y139 HydrophobicContact CE-CD2 3.74Å; M109-Y139 HydrophobicContact CE-CG 3.62Å
110	T	86.3	Confident	85.7	Confident	76 Å²	76	56.2 Å²	56.2	47%	0.466	29%	0.29	S	S	.	.	H	α-helix	trans	-94.2	-3	-179.9	55.7	0	0	0	0	113.3	T106 K107 Y139	T106-T110 WeakPolarHBondContact O-CG2 3.5Å; T106-T110 PolarHBondContact O-N 3.4Å; T106-T110 VanDerWaalsContact O-N 3.11Å; T106-T110 PolarHBondContact O-OG1 3.29Å; K107-T110 PolarHBondContact O-N 3.33Å; K107-T110 PolarHBondContact O-OG1 3.11Å; T110-Y139 HydrophobicContact CG2-CD1 3.42Å; T110-Y139 VanDerWaalsContact CG2-CD1 3.42Å; T110-Y139 HydrophobicContact CG2-CE1 3.44Å; T110-Y139 VanDerWaalsContact CG2-CE1 3.44Å; T110-Y139 HydrophobicContact CG2-CG 4.15Å
111	G	84.5	Confident	86	Confident	28 Å²	28	51.7 Å²	51.7	29%	0.289	27%	0.267	S	S	.	.	S	Bend	trans	-65.6	168.6	-179.9	0	0	0	0	0	113.5	K107 E113 R117	K107-G111 PolarHBondContact O-N 2.99Å; G111-E113 VanDerWaalsContact C-N 3.32Å; G111-R117 VanDerWaalsContact O-CD 3.24Å; G111-R117 WeakPolarHBondContact O-CD 3.48Å
112	R	80.3	Confident	86.1	Confident	253 Å²	253	57 Å²	57	96%	0.955	29%	0.286	S	S	*	.	S	Bend	trans	-79.4	-13.9	177.6	-64.5	-176.7	-179.2	179.7	-0.2	113.6	D114	R112-D114 PolarHBondContact O-N 3.25Å
113	E	82.9	Confident	86.3	Confident	103 Å²	103	55.9 Å²	55.9	48%	0.481	28%	0.28	S	S	.	.			trans	-92.3	99.8	-175	-67.2	-171.1	-149	0	0	111.5	G111 L115 Y116 R117	G111-E113 VanDerWaalsContact C-N 3.32Å; E113-L115 PolarHBondContact O-N 3.27Å; E113-L115 VanDerWaalsContact O-N 3.09Å; E113-Y116 HydrophobicContact CB-CD2 3.8Å; E113-Y116 HydrophobicContact CB-CE2 4.31Å; E113-Y116 HydrophobicContact CB-CG 4.2Å; E113-Y116 HydrophobicContact CG-CD2 4.4Å; E113-Y116 HydrophobicContact CG-CE2 4.49Å; E113-Y116 PolarHBondContact O-N 3.33Å; E113-Y116 WeakPolarHBondContact OE2-CD2 3.34Å; E113-Y116 WeakPolarHBondContact OE2-CE2 3.27Å; E113-R117 WeakPolarHBondContact O-CG 3.18Å; E113-R117 PolarHBondContact O-N 2.84Å
114	D	79.3	Confident	86.3	Confident	67 Å²	67	51.4 Å²	51.4	36%	0.358	25%	0.249	S	C	.	.	H	α-helix	trans	-55.3	-31.2	-177	-75.3	-12.3	0	0	0	114.7	R112 Y116 R117 A118 N148 I151	R112-D114 PolarHBondContact O-N 3.25Å; D114-Y116 VanDerWaalsContact C-N 3.27Å; D114-Y116 PolarHBondContact O-N 2.88Å; D114-R117 PolarHBondContact O-N 3.21Å; D114-R117 WeakPolarHBondContact OD1-CD 3.47Å; D114-R117 IonicContact OD1-CZ 2.64Å; D114-R117 IonicContact OD1-NH1 3.72Å; D114-R117 PolarHBondContact OD1-NH1 3.3Å; D114-A118 PolarHBondContact O-N 3.19Å; D114-N148 WeakPolarHBondContact CB-ND2 3.38Å; D114-N148 PolarHBondContact OD2-ND2 2.76Å; D114-I151 HydrophobicContact CB-CD1 4.1Å
115	L	79.8	Confident	86.3	Confident	110 Å²	110	49.8 Å²	49.8	58%	0.576	24%	0.237	S	C	*	.	H	α-helix	trans	-62.9	-33.4	176.6	-74	165.8	0	0	0	112.6	E113	E113-L115 PolarHBondContact O-N 3.27Å; E113-L115 VanDerWaalsContact O-N 3.09Å
116	Y	86.1	Confident	86.1	Confident	14 Å²	14	52.9 Å²	52.9	6%	0.055	25%	0.25	C	S	.	.	H	α-helix	trans	-82	-39.8	177.3	-63.4	-15.9	0	0	0	111	V78 R81 Y85 E113 D114 A118 A119 A120	V78-Y116 HydrophobicContact CG1-CE1 4.21Å; V78-Y116 HydrophobicContact CG2-CE1 4.41Å; V78-Y116 WeakPolarHBondContact CG2-OH 3.4Å; R81-Y116 HydrophobicContact CB-CE1 3.97Å; R81-Y116 HydrophobicContact CG-CD1 3.94Å; R81-Y116 HydrophobicContact CG-CE1 3.73Å; R81-Y116 HydrophobicContact CG-CG 4.44Å; Y85-Y116 HydrophobicContact CE2-CD1 4.43Å; E113-Y116 HydrophobicContact CB-CD2 3.8Å; E113-Y116 HydrophobicContact CB-CE2 4.31Å; E113-Y116 HydrophobicContact CB-CG 4.2Å; E113-Y116 HydrophobicContact CG-CD2 4.4Å; E113-Y116 HydrophobicContact CG-CE2 4.49Å; E113-Y116 PolarHBondContact O-N 3.33Å; E113-Y116 WeakPolarHBondContact OE2-CD2 3.34Å; E113-Y116 WeakPolarHBondContact OE2-CE2 3.27Å; D114-Y116 VanDerWaalsContact C-N 3.27Å; D114-Y116 PolarHBondContact O-N 2.88Å; Y116-A118 PolarHBondContact O-N 3.35Å; Y116-A119 PolarHBondContact O-N 3.01Å; Y116-A120 WeakPolarHBondContact O-CB 3.04Å; Y116-A120 PolarHBondContact O-N 3.41Å
117	R	88.1	Confident	86	Confident	46 Å²	46	52.6 Å²	52.6	17%	0.174	25%	0.248	C	C	.	.	H	α-helix	trans	-53.6	-52.3	-177.1	-62.3	174.2	73.7	-155.1	-6	112.5	D108 M109 G111 E113 D114 A119 A120 I121 D146 I151	D108-R117 WeakPolarHBondContact O-CG 3.45Å; M109-R117 WeakPolarHBondContact O-CG 3.46Å; M109-R117 PolarHBondContact O-NE 2.89Å; G111-R117 VanDerWaalsContact O-CD 3.24Å; G111-R117 WeakPolarHBondContact O-CD 3.48Å; E113-R117 WeakPolarHBondContact O-CG 3.18Å; E113-R117 PolarHBondContact O-N 2.84Å; D114-R117 PolarHBondContact O-N 3.21Å; D114-R117 WeakPolarHBondContact OD1-CD 3.47Å; D114-R117 IonicContact OD1-CZ 2.64Å; D114-R117 IonicContact OD1-NH1 3.72Å; D114-R117 PolarHBondContact OD1-NH1 3.3Å; R117-A119 PolarHBondContact O-N 3.21Å; R117-A120 PolarHBondContact O-N 3.39Å; R117-I121 WeakPolarHBondContact O-CD1 3.47Å; R117-I121 VanDerWaalsContact O-CG1 3.23Å; R117-I121 WeakPolarHBondContact O-CG1 3.47Å; R117-I121 PolarHBondContact O-N 3.33Å; R117-D146 IonicContact CZ-OD2 4Å; R117-D146 IonicContact NH1-OD2 3.07Å; R117-D146 PolarHBondContact NH1-OD2 3.27Å; R117-D146 VanDerWaalsContact NH1-OD2 3.14Å; R117-D146 IonicContact NH2-OD2 3.14Å; R117-D146 PolarHBondContact NH2-OD2 3.4Å; R117-I151 HydrophobicContact CB-CD1 3.78Å; R117-I151 HydrophobicContact CB-CG1 4.28Å; R117-I151 HydrophobicContact CG-CD1 4.39Å
118	A	86.8	Confident	85.8	Confident	8 Å²	8	45.4 Å²	45.4	7%	0.066	22%	0.217	C	C	.	.	H	α-helix	trans	-65.1	-37.9	-178.8	0	0	0	0	0	113.2	D114 Y116 R122 I151	D114-A118 PolarHBondContact O-N 3.19Å; Y116-A118 PolarHBondContact O-N 3.35Å; A118-R122 WeakPolarHBondContact O-CG 3.44Å; A118-R122 PolarHBondContact O-N 2.83Å; A118-R122 PolarHBondContact O-NE 3.1Å; A118-I151 HydrophobicContact CB-CG1 4.28Å
119	A	87.8	Confident	85.3	Confident	13 Å²	13	47.9 Å²	47.9	11%	0.107	23%	0.23	C	C	.	.	H	α-helix	trans	-73	-40.5	178.9	0	0	0	0	0	112	Y85 Y116 R117 R122 A123	Y85-A119 HydrophobicContact CD2-CB 3.43Å; Y85-A119 VanDerWaalsContact CD2-CB 3.43Å; Y85-A119 HydrophobicContact CE2-CB 3.65Å; Y85-A119 HydrophobicContact CG-CB 4.12Å; Y116-A119 PolarHBondContact O-N 3.01Å; R117-A119 PolarHBondContact O-N 3.21Å; A119-R122 PolarHBondContact O-N 3.38Å; A119-A123 PolarHBondContact O-N 3.02Å
120	A	89.4	Confident	84.9	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.9	-44.6	176.6	0	0	0	0	0	111.5	Y85 L105 D108 M109 Y116 R117 R122 A123 L124	Y85-A120 HydrophobicContact CE1-CB 4.16Å; L105-A120 HydrophobicContact CD2-CB 4.18Å; D108-A120 HydrophobicContact CB-CB 3.78Å; M109-A120 HydrophobicContact CB-CB 4.46Å; Y116-A120 WeakPolarHBondContact O-CB 3.04Å; Y116-A120 PolarHBondContact O-N 3.41Å; R117-A120 PolarHBondContact O-N 3.39Å; A120-R122 VanDerWaalsContact C-N 3.35Å; A120-R122 PolarHBondContact O-N 2.65Å; A120-A123 PolarHBondContact O-N 2.72Å; A120-L124 WeakPolarHBondContact O-CB 3.5Å; A120-L124 PolarHBondContact O-N 3.49Å
121	I	90.1	Very high	84.6	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-55.4	-49.7	174.8	-70.3	163.1	0	0	0	110.7	M109 R117 A123 L124 C125 M140 A143 I151 A155	M109-I121 HydrophobicContact CB-CG1 4.43Å; M109-I121 HydrophobicContact CG-CD1 4.28Å; M109-I121 HydrophobicContact CG-CG1 3.69Å; M109-I121 HydrophobicContact SD-CG1 3.85Å; R117-I121 WeakPolarHBondContact O-CD1 3.47Å; R117-I121 VanDerWaalsContact O-CG1 3.23Å; R117-I121 WeakPolarHBondContact O-CG1 3.47Å; R117-I121 PolarHBondContact O-N 3.33Å; I121-A123 VanDerWaalsContact C-N 3.33Å; I121-A123 PolarHBondContact O-N 3.13Å; I121-L124 PolarHBondContact O-N 3.3Å; I121-C125 PolarHBondContact O-N 3.49Å; I121-C125 PolarHBondContact O-SG 3.28Å; I121-M140 HydrophobicContact CG2-CE 4.21Å; I121-M140 HydrophobicContact CG2-SD 4.06Å; I121-A143 HydrophobicContact CD1-CB 3.78Å; I121-I151 HydrophobicContact CD1-CG2 3.78Å; I121-A155 HydrophobicContact CG2-CB 4.35Å
122	R	89.5	Confident	84.4	Confident	112 Å²	112	50.2 Å²	50.2	42%	0.423	25%	0.246	S	C	.	.	H	α-helix	trans	-65.8	-33.9	-179.3	-67.1	-178.8	-66.9	-132	9.5	113.2	K89 A118 A119 A120 S154	K89-R122 VanDerWaalsContact CE-C 3.46Å; K89-R122 WeakPolarHBondContact CE-O 3.36Å; K89-R122 VanDerWaalsContact NZ-CB 3.32Å; A118-R122 WeakPolarHBondContact O-CG 3.44Å; A118-R122 PolarHBondContact O-N 2.83Å; A118-R122 PolarHBondContact O-NE 3.1Å; A119-R122 PolarHBondContact O-N 3.38Å; A120-R122 VanDerWaalsContact C-N 3.35Å; A120-R122 PolarHBondContact O-N 2.65Å; R122-S154 PolarHBondContact NH1-OG 3.44Å
123	A	88.3	Confident	84.6	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-73.4	-44	176.8	0	0	0	0	0	110.9	Y85 K89 L105 A119 A120 I121 K126 I127	Y85-A123 HydrophobicContact CD1-CB 4.33Å; K89-A123 VanDerWaalsContact CE-CA 3.45Å; K89-A123 HydrophobicContact CG-CB 4.17Å; L105-A123 HydrophobicContact CD1-CB 4.42Å; L105-A123 HydrophobicContact CD2-CB 3.84Å; A119-A123 PolarHBondContact O-N 3.02Å; A120-A123 PolarHBondContact O-N 2.72Å; I121-A123 VanDerWaalsContact C-N 3.33Å; I121-A123 PolarHBondContact O-N 3.13Å; A123-K126 WeakPolarHBondContact O-CB 3.5Å; A123-K126 PolarHBondContact O-N 3.08Å; A123-I127 PolarHBondContact O-N 3.31Å
124	L	88	Confident	84.6	Confident	1 Å²	1	39 Å²	39	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-59.4	-52.8	178.1	-175.7	58.2	0	0	0	111.1	T102 L105 M109 A120 I121 K126 I127 T128 I136	T102-L124 HydrophobicContact CG2-CD1 4.08Å; L105-L124 HydrophobicContact CB-CB 4.22Å; L105-L124 HydrophobicContact CB-CD1 4.12Å; L105-L124 HydrophobicContact CD1-CB 4.3Å; L105-L124 HydrophobicContact CD1-CD1 4.29Å; M109-L124 HydrophobicContact CE-CD2 4Å; M109-L124 HydrophobicContact SD-CD2 4.07Å; A120-L124 WeakPolarHBondContact O-CB 3.5Å; A120-L124 PolarHBondContact O-N 3.49Å; I121-L124 PolarHBondContact O-N 3.3Å; L124-K126 PolarHBondContact O-N 2.49Å; L124-K126 VanDerWaalsContact O-N 3.07Å; L124-I127 HydrophobicContact CD1-CD1 4.32Å; L124-I127 HydrophobicContact CD1-CG1 4.35Å; L124-I127 WeakPolarHBondContact O-CG1 3.06Å; L124-I127 PolarHBondContact O-N 2.95Å; L124-T128 PolarHBondContact O-N 2.87Å; L124-T128 PolarHBondContact O-OG1 3.11Å; L124-I136 HydrophobicContact CD2-CD1 4Å; L124-I136 HydrophobicContact CD2-CG2 4.18Å; L124-I136 HydrophobicContact CG-CD1 4.08Å
125	C	86.9	Confident	84.9	Confident	8 Å²	8	41 Å²	41	5%	0.054	22%	0.22	C	C	.	.	H	α-helix	trans	-63.8	-19	-178.6	-61.8	0	0	0	0	114.2	I121 S158 L162	I121-C125 PolarHBondContact O-N 3.49Å; I121-C125 PolarHBondContact O-SG 3.28Å; C125-S158 VanDerWaalsContact SG-CB 3.51Å; C125-L162 HydrophobicContact CB-CD1 3.98Å; C125-L162 HydrophobicContact CB-CD2 4.35Å; C125-L162 HydrophobicContact CB-CG 4.15Å
126	K	85.4	Confident	85.2	Confident	64 Å²	64	36 Å²	36	28%	0.278	19%	0.193	S	C	.	.	H	α-helix	trans	-71.8	-42.3	173	-168.1	172.9	-176.2	-174	0	111	K89 E93 A123 L124 K165	K89-K126 HydrophobicContact CB-CD 3.85Å; K89-K126 HydrophobicContact CG-CD 3.99Å; K89-K126 WeakPolarHBondContact O-CD 3.37Å; K89-K126 VanDerWaalsContact O-CE 3.25Å; K89-K126 WeakPolarHBondContact O-CE 3.5Å; K89-K126 PolarHBondContact O-NZ 2.86Å; E93-K126 WeakPolarHBondContact OE1-CE 3.42Å; E93-K126 IonicContact OE1-NZ 3.65Å; E93-K126 PolarHBondContact OE1-NZ 3.01Å; A123-K126 WeakPolarHBondContact O-CB 3.5Å; A123-K126 PolarHBondContact O-N 3.08Å; L124-K126 PolarHBondContact O-N 2.49Å; L124-K126 VanDerWaalsContact O-N 3.07Å; K126-K165 PolarHBondContact O-NZ 3.25Å; K126-K165 VanDerWaalsContact O-NZ 3.14Å
127	I	84.9	Confident	85.3	Confident	21 Å²	21	36.6 Å²	36.6	11%	0.108	20%	0.197	C	C	.	.	H	α-helix	trans	-88.4	-15.2	-176.8	68.7	168.7	0	0	0	113.9	A92 V98 V101 L105 A123 L124	A92-I127 HydrophobicContact CB-CG2 3.58Å; V98-I127 HydrophobicContact CG1-CB 3.86Å; V98-I127 HydrophobicContact CG1-CD1 4.48Å; V98-I127 HydrophobicContact CG1-CG2 3.53Å; V101-I127 HydrophobicContact CG2-CD1 3.46Å; V101-I127 VanDerWaalsContact CG2-CD1 3.46Å; L105-I127 HydrophobicContact CD1-CD1 3.55Å; L105-I127 HydrophobicContact CD1-CG1 4.43Å; A123-I127 PolarHBondContact O-N 3.31Å; L124-I127 HydrophobicContact CD1-CD1 4.32Å; L124-I127 HydrophobicContact CD1-CG1 4.35Å; L124-I127 WeakPolarHBondContact O-CG1 3.06Å; L124-I127 PolarHBondContact O-N 2.95Å
128	T	83.3	Confident	85.4	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.012	22%	0.22	C	C	.	.			trans	-65.3	134.1	-178.5	-58.6	0	0	0	0	111.9	L124 M132 L133 I136	L124-T128 PolarHBondContact O-N 2.87Å; L124-T128 PolarHBondContact O-OG1 3.11Å; T128-M132 HydrophobicContact CG2-CB 4.08Å; T128-L133 HydrophobicContact CG2-CB 3.81Å; T128-L133 HydrophobicContact CG2-CD1 4.13Å; T128-I136 HydrophobicContact CG2-CD1 3.93Å
129	D	78.5	Confident	85.5	Confident	73 Å²	73	46.4 Å²	46.4	39%	0.39	23%	0.233	S	C	.	.			trans	-102	178.8	169.2	67.7	1.9	0	0	0	111.1	G131 M132 L133	D129-G131 VanDerWaalsContact C-N 3.31Å; D129-G131 PolarHBondContact O-N 2.99Å; D129-G131 PolarHBondContact OD1-N 3.43Å; D129-M132 HydrophobicContact CB-CE 4.19Å; D129-M132 WeakPolarHBondContact OD1-CB 3.45Å; D129-M132 VanDerWaalsContact OD1-CE 3.28Å; D129-M132 WeakPolarHBondContact OD1-CE 3.48Å; D129-M132 WeakPolarHBondContact OD1-CG 2.99Å; D129-M132 PolarHBondContact OD1-N 3.33Å; D129-L133 WeakPolarHBondContact O-CB 3.47Å; D129-L133 PolarHBondContact O-N 2.95Å; D129-L133 VanDerWaalsContact O-N 3.08Å
130	T	77.6	Confident	85.6	Confident	91 Å²	91	45.8 Å²	45.8	56%	0.558	23%	0.227	S	C	*	.	H	α-helix	trans	-63.2	-35.9	-174.4	60.3	0	0	0	0	112.9	S166	T130-S166 WeakPolarHBondContact CG2-OG 3.37Å
131	G	78.8	Confident	85.7	Confident	43 Å²	43	48.1 Å²	48.1	44%	0.443	24%	0.237	S	C	.	.	H	α-helix	trans	-72	-48.3	179.1	0	0	0	0	0	112.8	D129 L133 Q134	D129-G131 VanDerWaalsContact C-N 3.31Å; D129-G131 PolarHBondContact O-N 2.99Å; D129-G131 PolarHBondContact OD1-N 3.43Å; G131-L133 PolarHBondContact O-N 3.43Å; G131-Q134 PolarHBondContact O-N 3.5Å
132	M	80.9	Confident	85.7	Confident	25 Å²	25	53 Å²	53	12%	0.123	26%	0.261	C	S	.	.	H	α-helix	trans	-66.5	-27.6	178.7	-70.3	-171.1	-76.9	0	0	112.7	I99 T102 T128 D129 Q134 T135 I136	I99-M132 HydrophobicContact CB-SD 4.49Å; I99-M132 HydrophobicContact CD1-CE 4.1Å; I99-M132 HydrophobicContact CG1-CE 3.79Å; I99-M132 HydrophobicContact CG1-SD 4.21Å; I99-M132 HydrophobicContact CG2-CE 4.48Å; I99-M132 HydrophobicContact CG2-SD 3.76Å; T102-M132 HydrophobicContact CG2-SD 4.11Å; T128-M132 HydrophobicContact CG2-CB 4.08Å; D129-M132 HydrophobicContact CB-CE 4.19Å; D129-M132 WeakPolarHBondContact OD1-CB 3.45Å; D129-M132 VanDerWaalsContact OD1-CE 3.28Å; D129-M132 WeakPolarHBondContact OD1-CE 3.48Å; D129-M132 WeakPolarHBondContact OD1-CG 2.99Å; D129-M132 PolarHBondContact OD1-N 3.33Å; M132-Q134 PolarHBondContact O-N 3.49Å; M132-T135 WeakPolarHBondContact O-CB 3.5Å; M132-T135 PolarHBondContact O-N 2.92Å; M132-T135 VanDerWaalsContact O-N 3.08Å; M132-I136 PolarHBondContact O-N 3.41Å
133	L	83.7	Confident	85.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.2	-37.7	179.2	-174.4	59.6	0	0	0	112.3	T128 D129 G131 T135 I136 E137 L162 S166 V169 V170 W173	T128-L133 HydrophobicContact CG2-CB 3.81Å; T128-L133 HydrophobicContact CG2-CD1 4.13Å; D129-L133 WeakPolarHBondContact O-CB 3.47Å; D129-L133 PolarHBondContact O-N 2.95Å; D129-L133 VanDerWaalsContact O-N 3.08Å; G131-L133 PolarHBondContact O-N 3.43Å; L133-T135 VanDerWaalsContact C-N 3.33Å; L133-T135 PolarHBondContact O-N 3.46Å; L133-I136 HydrophobicContact CD1-CD1 4.25Å; L133-I136 HydrophobicContact CD1-CG1 4.21Å; L133-I136 WeakPolarHBondContact O-CG1 3.34Å; L133-I136 PolarHBondContact O-N 3.4Å; L133-E137 PolarHBondContact O-N 3.4Å; L133-L162 HydrophobicContact CD1-CD1 3.67Å; L133-L162 HydrophobicContact CD1-CD2 4.18Å; L133-L162 HydrophobicContact CD1-CG 4.43Å; L133-S166 VanDerWaalsContact CD2-CB 3.45Å; L133-V169 HydrophobicContact CD2-CB 3.87Å; L133-V169 HydrophobicContact CD2-CG1 4.1Å; L133-V169 HydrophobicContact CD2-CG2 4.24Å; L133-V169 HydrophobicContact CG-CB 4.37Å; L133-V169 HydrophobicContact CG-CG1 4.06Å; L133-V170 HydrophobicContact CD2-CG2 4.5Å; L133-W173 HydrophobicContact CD1-CH2 3.89Å; L133-W173 HydrophobicContact CD1-CZ2 4.26Å
134	Q	83.9	Confident	86	Confident	119 Å²	119	47.9 Å²	47.9	56%	0.556	24%	0.242	S	C	*	.	H	α-helix	trans	-65.3	-37.8	177.5	-61.6	-174.2	3.1	0	0	111.7	G131 M132 I136 E137 V169	G131-Q134 PolarHBondContact O-N 3.5Å; M132-Q134 PolarHBondContact O-N 3.49Å; Q134-I136 VanDerWaalsContact C-N 3.32Å; Q134-I136 PolarHBondContact O-N 3.33Å; Q134-E137 WeakPolarHBondContact O-CB 3.47Å; Q134-E137 PolarHBondContact O-N 3.17Å; Q134-V169 HydrophobicContact CG-CG2 4.43Å
135	T	84.4	Confident	86.2	Confident	111 Å²	111	50.5 Å²	50.5	68%	0.681	26%	0.257	S	S	*	.	H	α-helix	trans	-66.9	-34.6	178.8	-46	0	0	0	0	112	M132 L133	M132-T135 WeakPolarHBondContact O-CB 3.5Å; M132-T135 PolarHBondContact O-N 2.92Å; M132-T135 VanDerWaalsContact O-N 3.08Å; L133-T135 VanDerWaalsContact C-N 3.33Å; L133-T135 PolarHBondContact O-N 3.46Å
136	I	86.8	Confident	86.4	Confident	4 Å²	4	52 Å²	52	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-93.7	-5.1	-177.9	69.4	170.8	0	0	0	113.7	L124 T128 M132 L133 Q134 R138 Y139 M140	L124-I136 HydrophobicContact CD2-CD1 4Å; L124-I136 HydrophobicContact CD2-CG2 4.18Å; L124-I136 HydrophobicContact CG-CD1 4.08Å; T128-I136 HydrophobicContact CG2-CD1 3.93Å; M132-I136 PolarHBondContact O-N 3.41Å; L133-I136 HydrophobicContact CD1-CD1 4.25Å; L133-I136 HydrophobicContact CD1-CG1 4.21Å; L133-I136 WeakPolarHBondContact O-CG1 3.34Å; L133-I136 PolarHBondContact O-N 3.4Å; Q134-I136 VanDerWaalsContact C-N 3.32Å; Q134-I136 PolarHBondContact O-N 3.33Å; I136-R138 VanDerWaalsContact C-N 3.32Å; I136-R138 PolarHBondContact O-N 3.46Å; I136-Y139 PolarHBondContact O-N 3.4Å; I136-M140 HydrophobicContact CD1-CG 4.38Å; I136-M140 HydrophobicContact CG1-CG 4.35Å; I136-M140 PolarHBondContact O-N 3.06Å
137	E	88.2	Confident	86.5	Confident	26 Å²	26	61 Å²	61	12%	0.121	30%	0.297	C	S	.	.	H	α-helix	trans	-50.4	-48	-176	169.8	167.8	-174.3	0	0	112.5	L133 Q134 Y139 M140 K141 R172 W173	L133-E137 PolarHBondContact O-N 3.4Å; Q134-E137 WeakPolarHBondContact O-CB 3.47Å; Q134-E137 PolarHBondContact O-N 3.17Å; E137-Y139 VanDerWaalsContact C-N 3.29Å; E137-Y139 PolarHBondContact O-N 3.03Å; E137-M140 PolarHBondContact O-N 2.89Å; E137-K141 HydrophobicContact CG-CD 4.21Å; E137-K141 PolarHBondContact O-N 3.34Å; E137-K141 WeakPolarHBondContact OE1-CE 3.28Å; E137-K141 IonicContact OE1-NZ 3.35Å; E137-K141 PolarHBondContact OE1-NZ 2.96Å; E137-R172 IonicContact OE2-NH1 3.48Å; E137-R172 PolarHBondContact OE2-NH1 3.34Å; E137-W173 HydrophobicContact CB-CZ2 4.33Å; E137-W173 HydrophobicContact CG-CZ2 4.21Å; E137-W173 PolarHBondContact OE1-NE1 3.42Å
138	R	89.4	Confident	86.8	Confident	177 Å²	177	62.2 Å²	62.2	67%	0.668	30%	0.304	S	S	*	.	H	α-helix	trans	-58.9	-41.6	-179.5	-178.9	-179.8	175.8	-177.4	1.1	112.1	I136 Q142	I136-R138 VanDerWaalsContact C-N 3.32Å; I136-R138 PolarHBondContact O-N 3.46Å; R138-Q142 WeakPolarHBondContact O-CG 3.22Å; R138-Q142 PolarHBondContact O-N 3.12Å
139	Y	89.1	Confident	87.1	Confident	84 Å²	84	64.4 Å²	64.4	33%	0.329	32%	0.319	S	S	.	.	H	α-helix	trans	-72.6	-35.7	-179.5	-57.6	-65.2	0	0	0	111.7	T106 M109 T110 I136 E137 Q142 A143	T106-Y139 HydrophobicContact CG2-CD2 4.31Å; T106-Y139 HydrophobicContact CG2-CE2 4.02Å; M109-Y139 HydrophobicContact CE-CD2 3.74Å; M109-Y139 HydrophobicContact CE-CG 3.62Å; T110-Y139 HydrophobicContact CG2-CD1 3.42Å; T110-Y139 VanDerWaalsContact CG2-CD1 3.42Å; T110-Y139 HydrophobicContact CG2-CE1 3.44Å; T110-Y139 VanDerWaalsContact CG2-CE1 3.44Å; T110-Y139 HydrophobicContact CG2-CG 4.15Å; I136-Y139 PolarHBondContact O-N 3.4Å; E137-Y139 VanDerWaalsContact C-N 3.29Å; E137-Y139 PolarHBondContact O-N 3.03Å; Y139-Q142 PolarHBondContact O-N 2.84Å; Y139-A143 WeakPolarHBondContact O-CB 3.46Å; Y139-A143 PolarHBondContact O-N 3.15Å
140	M	90.8	Very high	87.6	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64.5	-45.4	175.1	-71	-60.1	-65.1	0	0	111.8	I121 I136 E137 Q142 A143 I144 A155 L162 W173	I121-M140 HydrophobicContact CG2-CE 4.21Å; I121-M140 HydrophobicContact CG2-SD 4.06Å; I136-M140 HydrophobicContact CD1-CG 4.38Å; I136-M140 HydrophobicContact CG1-CG 4.35Å; I136-M140 PolarHBondContact O-N 3.06Å; E137-M140 PolarHBondContact O-N 2.89Å; M140-Q142 VanDerWaalsContact C-N 3.32Å; M140-Q142 PolarHBondContact O-N 3.44Å; M140-A143 PolarHBondContact O-N 3.28Å; M140-A143 VanDerWaalsContact O-N 3.13Å; M140-I144 VanDerWaalsContact O-CG1 3.29Å; M140-I144 WeakPolarHBondContact O-CG1 3.42Å; M140-I144 PolarHBondContact O-N 3.2Å; M140-A155 HydrophobicContact CE-CB 4.25Å; M140-L162 HydrophobicContact CE-CD1 4.5Å; M140-W173 HydrophobicContact CB-CH2 3.88Å; M140-W173 HydrophobicContact CB-CZ2 4.31Å; M140-W173 HydrophobicContact CB-CZ3 4.1Å; M140-W173 HydrophobicContact CE-CZ3 4.42Å; M140-W173 HydrophobicContact CG-CH2 4.12Å
141	K	91.3	Very high	88.3	Confident	48 Å²	48	59 Å²	59	21%	0.209	29%	0.294	C	S	.	.	H	α-helix	trans	-55.2	-46.8	174.1	-78.3	175	160.7	163.4	0	112.1	E137 A143 I144 W173 E176	E137-K141 HydrophobicContact CG-CD 4.21Å; E137-K141 PolarHBondContact O-N 3.34Å; E137-K141 WeakPolarHBondContact OE1-CE 3.28Å; E137-K141 IonicContact OE1-NZ 3.35Å; E137-K141 PolarHBondContact OE1-NZ 2.96Å; K141-A143 PolarHBondContact O-N 3.25Å; K141-I144 PolarHBondContact O-N 3.18Å; K141-W173 HydrophobicContact CG-CG 4.24Å; K141-E176 HydrophobicContact CB-CG 4.16Å; K141-E176 VanDerWaalsContact CD-OE1 3.26Å; K141-E176 WeakPolarHBondContact CD-OE1 3.26Å; K141-E176 VanDerWaalsContact CE-OE1 3.25Å; K141-E176 WeakPolarHBondContact CE-OE1 3.41Å; K141-E176 HydrophobicContact CG-CG 4.18Å
142	Q	90.8	Very high	88.9	Confident	105 Å²	105	57.1 Å²	57.1	49%	0.491	27%	0.274	S	S	.	.	H	α-helix	trans	-63.9	-39.5	176.3	-71.3	177.3	-12.5	0	0	112.7	R138 Y139 M140 D146	R138-Q142 WeakPolarHBondContact O-CG 3.22Å; R138-Q142 PolarHBondContact O-N 3.12Å; Y139-Q142 PolarHBondContact O-N 2.84Å; M140-Q142 VanDerWaalsContact C-N 3.32Å; M140-Q142 PolarHBondContact O-N 3.44Å; Q142-D146 PolarHBondContact O-N 3.05Å
143	A	91.3	Very high	89.5	Confident	3 Å²	3	57 Å²	57	3%	0.025	28%	0.276	C	S	.	.	H	α-helix	trans	-68.8	-33.5	179.2	0	0	0	0	0	112.5	I121 Y139 M140 K141 V145 D146 I151 S152 A155	I121-A143 HydrophobicContact CD1-CB 3.78Å; Y139-A143 WeakPolarHBondContact O-CB 3.46Å; Y139-A143 PolarHBondContact O-N 3.15Å; M140-A143 PolarHBondContact O-N 3.28Å; M140-A143 VanDerWaalsContact O-N 3.13Å; K141-A143 PolarHBondContact O-N 3.25Å; A143-V145 PolarHBondContact O-N 3.48Å; A143-D146 WeakPolarHBondContact O-CB 3.26Å; A143-D146 PolarHBondContact O-N 3.24Å; A143-I151 HydrophobicContact CB-CG2 4.09Å; A143-S152 WeakPolarHBondContact O-CA 3.41Å; A143-A155 HydrophobicContact CB-CB 3.7Å
144	I	92.6	Very high	89.8	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-42.1	177.9	-72.5	163.7	0	0	0	111.4	M140 K141 S152 A155 I156 W173 E176 V177 A180	M140-I144 VanDerWaalsContact O-CG1 3.29Å; M140-I144 WeakPolarHBondContact O-CG1 3.42Å; M140-I144 PolarHBondContact O-N 3.2Å; K141-I144 PolarHBondContact O-N 3.18Å; I144-S152 WeakPolarHBondContact O-CB 3.22Å; I144-S152 PolarHBondContact O-OG 3.2Å; I144-A155 HydrophobicContact CG1-CB 4.06Å; I144-I156 HydrophobicContact CG1-CG1 4.27Å; I144-I156 HydrophobicContact CG2-CG1 4.11Å; I144-W173 HydrophobicContact CD1-CB 4.5Å; I144-W173 HydrophobicContact CD1-CE3 3.91Å; I144-E176 HydrophobicContact CG2-CB 4.21Å; I144-V177 HydrophobicContact CD1-CG2 4.3Å; I144-V177 HydrophobicContact CG2-CG2 4.26Å; I144-A180 HydrophobicContact CG2-CB 4.05Å
145	V	91.8	Very high	90.2	Very high	56 Å²	56	51.7 Å²	51.7	34%	0.339	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	14.5	-179.9	-60.8	0	0	0	0	113.4	A143 E176 E179	A143-V145 PolarHBondContact O-N 3.48Å; V145-E176 HydrophobicContact CG1-CB 3.96Å; V145-E176 HydrophobicContact CG1-CG 4.48Å; V145-E176 WeakPolarHBondContact CG1-O 3.2Å; V145-E179 HydrophobicContact CG1-CB 4.28Å; V145-E179 HydrophobicContact CG1-CG 4.36Å
146	D	90.9	Very high	90.7	Very high	40 Å²	40	46.4 Å²	46.4	21%	0.214	22%	0.219	C	C	.	.			trans	-65.3	143.6	-179.3	-163.2	-69.4	0	0	0	111.5	R117 Q142 A143 N148 I151	R117-D146 IonicContact CZ-OD2 4Å; R117-D146 IonicContact NH1-OD2 3.07Å; R117-D146 PolarHBondContact NH1-OD2 3.27Å; R117-D146 VanDerWaalsContact NH1-OD2 3.14Å; R117-D146 IonicContact NH2-OD2 3.14Å; R117-D146 PolarHBondContact NH2-OD2 3.4Å; Q142-D146 PolarHBondContact O-N 3.05Å; A143-D146 WeakPolarHBondContact O-CB 3.26Å; A143-D146 PolarHBondContact O-N 3.24Å; D146-N148 PolarHBondContact O-N 3.15Å; D146-N148 WeakPolarHBondContact OD1-CB 3.33Å; D146-N148 PolarHBondContact OD1-N 3.45Å; D146-I151 HydrophobicContact CB-CB 4.35Å; D146-I151 HydrophobicContact CB-CG2 4.11Å
147	R	87.8	Confident	91	Very high	254 Å²	254	48.3 Å²	48.3	96%	0.958	23%	0.231	S	C	*	.	S	Bend	trans	-63.9	-28.8	178	-65.6	-177	179.9	-179.7	-0.4	112.2	S149	R147-S149 PolarHBondContact O-N 3.14Å
148	N	90.6	Very high	91.1	Very high	46 Å²	46	47.4 Å²	47.4	25%	0.246	23%	0.227	C	C	.	.	S	Bend	trans	-79.2	112.2	176.9	-170	-32.6	0	0	0	110.1	D114 D146 A150 I151 S152	D114-N148 WeakPolarHBondContact CB-ND2 3.38Å; D114-N148 PolarHBondContact OD2-ND2 2.76Å; D146-N148 PolarHBondContact O-N 3.15Å; D146-N148 WeakPolarHBondContact OD1-CB 3.33Å; D146-N148 PolarHBondContact OD1-N 3.45Å; N148-A150 PolarHBondContact O-N 3.4Å; N148-A150 WeakPolarHBondContact OD1-CB 3.12Å; N148-A150 PolarHBondContact OD1-N 3.34Å; N148-I151 HydrophobicContact CB-CB 4.34Å; N148-I151 HydrophobicContact CB-CD1 3.92Å; N148-I151 HydrophobicContact CB-CG1 4.04Å; N148-I151 PolarHBondContact O-N 3.15Å; N148-S152 PolarHBondContact O-N 3.36Å
149	S	90.3	Very high	91.2	Very high	47 Å²	47	39 Å²	39	33%	0.329	20%	0.196	S	C	.	.	H	α-helix	trans	-58.7	-30.9	-177.6	59.3	0	0	0	0	113.8	R147 I151 S153 N185	R147-S149 PolarHBondContact O-N 3.14Å; S149-I151 VanDerWaalsContact C-N 3.34Å; S149-S153 WeakPolarHBondContact O-CB 3.42Å; S149-S153 PolarHBondContact O-N 3.19Å; S149-N185 WeakPolarHBondContact CB-ND2 3.36Å; S149-N185 PolarHBondContact OG-ND2 3.19Å
150	A	89.5	Confident	91.3	Very high	50 Å²	50	36.3 Å²	36.3	41%	0.413	19%	0.187	S	C	.	.	H	α-helix	trans	-69.2	-34.7	178.3	0	0	0	0	0	112	N148 S154	N148-A150 PolarHBondContact O-N 3.4Å; N148-A150 WeakPolarHBondContact OD1-CB 3.12Å; N148-A150 PolarHBondContact OD1-N 3.34Å; A150-S154 VanDerWaalsContact O-CB 3.22Å; A150-S154 WeakPolarHBondContact O-CB 3.35Å; A150-S154 PolarHBondContact O-N 2.84Å; A150-S154 VanDerWaalsContact O-N 3.12Å; A150-S154 PolarHBondContact O-OG 2.98Å
151	I	91.4	Very high	91.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-75.2	-52.2	178.9	-59.9	-179	0	0	0	109.3	D114 R117 A118 I121 A143 D146 N148 S149 S153 S154 A155	D114-I151 HydrophobicContact CB-CD1 4.1Å; R117-I151 HydrophobicContact CB-CD1 3.78Å; R117-I151 HydrophobicContact CB-CG1 4.28Å; R117-I151 HydrophobicContact CG-CD1 4.39Å; A118-I151 HydrophobicContact CB-CG1 4.28Å; I121-I151 HydrophobicContact CD1-CG2 3.78Å; A143-I151 HydrophobicContact CB-CG2 4.09Å; D146-I151 HydrophobicContact CB-CB 4.35Å; D146-I151 HydrophobicContact CB-CG2 4.11Å; N148-I151 HydrophobicContact CB-CB 4.34Å; N148-I151 HydrophobicContact CB-CD1 3.92Å; N148-I151 HydrophobicContact CB-CG1 4.04Å; N148-I151 PolarHBondContact O-N 3.15Å; S149-I151 VanDerWaalsContact C-N 3.34Å; I151-S153 PolarHBondContact O-N 3.01Å; I151-S154 PolarHBondContact O-N 3.46Å; I151-S154 VanDerWaalsContact O-N 3.15Å; I151-A155 WeakPolarHBondContact O-CB 3.17Å; I151-A155 PolarHBondContact O-N 3.47Å
152	S	92.1	Very high	91.1	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.028	20%	0.202	C	C	.	.	H	α-helix	trans	-55.6	-50.5	176.6	173.1	0	0	0	0	111.9	A143 I144 N148 S154 A155 I156 V188	A143-S152 WeakPolarHBondContact O-CA 3.41Å; I144-S152 WeakPolarHBondContact O-CB 3.22Å; I144-S152 PolarHBondContact O-OG 3.2Å; N148-S152 PolarHBondContact O-N 3.36Å; S152-S154 VanDerWaalsContact C-N 3.34Å; S152-S154 PolarHBondContact O-N 3.31Å; S152-A155 PolarHBondContact O-N 2.75Å; S152-I156 WeakPolarHBondContact O-CB 3.46Å; S152-I156 WeakPolarHBondContact O-CD1 3.03Å; S152-I156 WeakPolarHBondContact O-CG1 2.98Å; S152-I156 PolarHBondContact O-N 2.8Å; S152-V188 VanDerWaalsContact OG-CG1 3.27Å; S152-V188 WeakPolarHBondContact OG-CG1 3.32Å
153	S	92.5	Very high	90.9	Very high	23 Å²	23	35.5 Å²	35.5	16%	0.161	18%	0.184	C	C	.	.	H	α-helix	trans	-58.7	-43.4	176.3	-178.1	0	0	0	0	112.5	S149 I151 I156 V157 H191	S149-S153 WeakPolarHBondContact O-CB 3.42Å; S149-S153 PolarHBondContact O-N 3.19Å; I151-S153 PolarHBondContact O-N 3.01Å; S153-I156 PolarHBondContact O-N 2.88Å; S153-V157 VanDerWaalsContact O-CG2 3.3Å; S153-V157 WeakPolarHBondContact O-CG2 3.44Å; S153-V157 PolarHBondContact O-N 3.41Å; S153-H191 PolarHBondContact OG-CE1 3.12Å; S153-H191 PolarHBondContact OG-ND1 2.83Å
154	S	90.5	Very high	90.6	Very high	7 Å²	7	45.5 Å²	45.5	5%	0.049	22%	0.221	C	C	.	.	H	α-helix	trans	-66.9	-39	178.3	-62.7	0	0	0	0	112.4	R122 A150 I151 S152 S158	R122-S154 PolarHBondContact NH1-OG 3.44Å; A150-S154 VanDerWaalsContact O-CB 3.22Å; A150-S154 WeakPolarHBondContact O-CB 3.35Å; A150-S154 PolarHBondContact O-N 2.84Å; A150-S154 VanDerWaalsContact O-N 3.12Å; A150-S154 PolarHBondContact O-OG 2.98Å; I151-S154 PolarHBondContact O-N 3.46Å; I151-S154 VanDerWaalsContact O-N 3.15Å; S152-S154 VanDerWaalsContact C-N 3.34Å; S152-S154 PolarHBondContact O-N 3.31Å; S154-S158 WeakPolarHBondContact O-CB 3.46Å; S154-S158 PolarHBondContact O-N 2.9Å; S154-S158 PolarHBondContact O-OG 3.24Å
155	A	92.9	Very high	90.1	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-66	-44.8	176.8	0	0	0	0	0	111.4	I121 M140 A143 I144 I151 S152 S158 S159	I121-A155 HydrophobicContact CG2-CB 4.35Å; M140-A155 HydrophobicContact CE-CB 4.25Å; A143-A155 HydrophobicContact CB-CB 3.7Å; I144-A155 HydrophobicContact CG1-CB 4.06Å; I151-A155 WeakPolarHBondContact O-CB 3.17Å; I151-A155 PolarHBondContact O-N 3.47Å; S152-A155 PolarHBondContact O-N 2.75Å; A155-S158 PolarHBondContact O-N 2.83Å; A155-S159 WeakPolarHBondContact O-CB 3.31Å; A155-S159 PolarHBondContact O-N 3.44Å; A155-S159 PolarHBondContact O-OG 2.85Å
156	I	94.2	Very high	89.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-48.4	179.1	-64.8	160.9	0	0	0	111.1	I144 S152 S153 S158 S159 I160 A180 V188 H191 A192 L195	I144-I156 HydrophobicContact CG1-CG1 4.27Å; I144-I156 HydrophobicContact CG2-CG1 4.11Å; S152-I156 WeakPolarHBondContact O-CB 3.46Å; S152-I156 WeakPolarHBondContact O-CD1 3.03Å; S152-I156 WeakPolarHBondContact O-CG1 2.98Å; S152-I156 PolarHBondContact O-N 2.8Å; S153-I156 PolarHBondContact O-N 2.88Å; I156-S158 VanDerWaalsContact C-N 3.31Å; I156-S158 PolarHBondContact O-N 2.89Å; I156-S159 WeakPolarHBondContact O-CA 3.44Å; I156-S159 WeakPolarHBondContact O-CB 3.27Å; I156-S159 PolarHBondContact O-N 2.83Å; I156-S159 VanDerWaalsContact O-N 3.11Å; I156-I160 PolarHBondContact O-N 3.47Å; I156-A180 HydrophobicContact CD1-CB 4.05Å; I156-V188 HydrophobicContact CD1-CG1 3.98Å; I156-H191 HydrophobicContact CB-CB 4.24Å; I156-H191 HydrophobicContact CG2-CB 3.66Å; I156-H191 VanDerWaalsContact CG2-O 3.24Å; I156-H191 WeakPolarHBondContact CG2-O 3.38Å; I156-A192 HydrophobicContact CD1-CB 4.03Å; I156-L195 HydrophobicContact CG2-CB 3.9Å; I156-L195 HydrophobicContact CG2-CD2 3.85Å
157	V	92.9	Very high	89.4	Confident	45 Å²	45	49.6 Å²	49.6	27%	0.273	24%	0.239	S	C	.	.	H	α-helix	trans	-62.9	-40.5	177.7	174.2	0	0	0	0	111	S153 S159 I160 H161 H191	S153-V157 VanDerWaalsContact O-CG2 3.3Å; S153-V157 WeakPolarHBondContact O-CG2 3.44Å; S153-V157 PolarHBondContact O-N 3.41Å; V157-S159 VanDerWaalsContact C-N 3.27Å; V157-S159 PolarHBondContact O-N 3.31Å; V157-I160 WeakPolarHBondContact O-CB 3.48Å; V157-I160 PolarHBondContact O-N 2.68Å; V157-H161 PolarHBondContact O-CD2 3.26Å; V157-H161 PolarHBondContact O-N 2.85Å; V157-H191 HydrophobicContact CG2-CB 4.27Å
158	S	90.8	Very high	89.3	Confident	6 Å²	6	44.2 Å²	44.2	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-64	-35.6	175.2	-56.5	0	0	0	0	111.8	C125 S154 A155 I156 I160 H161 L162	C125-S158 VanDerWaalsContact SG-CB 3.51Å; S154-S158 WeakPolarHBondContact O-CB 3.46Å; S154-S158 PolarHBondContact O-N 2.9Å; S154-S158 PolarHBondContact O-OG 3.24Å; A155-S158 PolarHBondContact O-N 2.83Å; I156-S158 VanDerWaalsContact C-N 3.31Å; I156-S158 PolarHBondContact O-N 2.89Å; S158-I160 VanDerWaalsContact C-N 3.35Å; S158-H161 PolarHBondContact O-N 2.98Å; S158-L162 WeakPolarHBondContact O-CG 3.22Å; S158-L162 PolarHBondContact O-N 3.09Å
159	S	92.1	Very high	89.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.2	-34.3	174.7	-54.9	0	0	0	0	112.5	A155 I156 V157 H161 L162 M163 W173	A155-S159 WeakPolarHBondContact O-CB 3.31Å; A155-S159 PolarHBondContact O-N 3.44Å; A155-S159 PolarHBondContact O-OG 2.85Å; I156-S159 WeakPolarHBondContact O-CA 3.44Å; I156-S159 WeakPolarHBondContact O-CB 3.27Å; I156-S159 PolarHBondContact O-N 2.83Å; I156-S159 VanDerWaalsContact O-N 3.11Å; V157-S159 VanDerWaalsContact C-N 3.27Å; V157-S159 PolarHBondContact O-N 3.31Å; S159-H161 VanDerWaalsContact C-N 3.35Å; S159-L162 PolarHBondContact O-N 3.11Å; S159-M163 PolarHBondContact O-N 3.46Å; S159-W173 WeakPolarHBondContact OG-CZ3 3.19Å
160	I	90.8	Very high	89	Confident	28 Å²	28	40.2 Å²	40.2	14%	0.144	20%	0.201	C	C	.	.	H	α-helix	trans	-61.2	-43	171.8	-70.3	170.9	0	0	0	110.8	I156 V157 S158 M163 A194 L195	I156-I160 PolarHBondContact O-N 3.47Å; V157-I160 WeakPolarHBondContact O-CB 3.48Å; V157-I160 PolarHBondContact O-N 2.68Å; S158-I160 VanDerWaalsContact C-N 3.35Å; I160-M163 VanDerWaalsContact O-CB 3.28Å; I160-M163 WeakPolarHBondContact O-CB 3.44Å; I160-M163 PolarHBondContact O-N 3.22Å; I160-A194 HydrophobicContact CD1-CB 4.19Å; I160-L195 HydrophobicContact CD1-CB 4.25Å; I160-L195 HydrophobicContact CG1-CB 3.86Å; I160-L195 HydrophobicContact CG1-CD1 3.82Å; I160-L195 HydrophobicContact CG1-CG 4.34Å
161	H	88.5	Confident	89	Confident	110 Å²	110	42.5 Å²	42.5	51%	0.509	20%	0.198	S	C	.	.	H	α-helix	trans	-66.3	-40.2	175.5	-68.9	-70.3	0	0	0	112.1	V157 S158 S159 M163 R164	V157-H161 PolarHBondContact O-CD2 3.26Å; V157-H161 PolarHBondContact O-N 2.85Å; S158-H161 PolarHBondContact O-N 2.98Å; S159-H161 VanDerWaalsContact C-N 3.35Å; H161-M163 VanDerWaalsContact C-N 3.26Å; H161-M163 PolarHBondContact O-N 2.87Å; H161-R164 PolarHBondContact O-N 3Å
162	L	88.3	Confident	88.9	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-65.2	-28.4	176.5	-70.1	168.1	0	0	0	112.8	C125 L133 M140 S158 S159 R164 K165 S166 V170 W173	C125-L162 HydrophobicContact CB-CD1 3.98Å; C125-L162 HydrophobicContact CB-CD2 4.35Å; C125-L162 HydrophobicContact CB-CG 4.15Å; L133-L162 HydrophobicContact CD1-CD1 3.67Å; L133-L162 HydrophobicContact CD1-CD2 4.18Å; L133-L162 HydrophobicContact CD1-CG 4.43Å; M140-L162 HydrophobicContact CE-CD1 4.5Å; S158-L162 WeakPolarHBondContact O-CG 3.22Å; S158-L162 PolarHBondContact O-N 3.09Å; S159-L162 PolarHBondContact O-N 3.11Å; L162-R164 PolarHBondContact O-N 3.16Å; L162-R164 VanDerWaalsContact O-N 3.16Å; L162-K165 PolarHBondContact O-N 3.26Å; L162-S166 PolarHBondContact O-N 3.17Å; L162-V170 HydrophobicContact CB-CG2 4.06Å; L162-W173 HydrophobicContact CD1-CH2 4.45Å
163	M	86.8	Confident	88.9	Confident	23 Å²	23	48.2 Å²	48.2	11%	0.113	22%	0.219	C	C	.	.	H	α-helix	trans	-55.3	-33	175	-164.3	68	71.9	0	0	112.5	S159 I160 H161 V170 L195 I199	S159-M163 PolarHBondContact O-N 3.46Å; I160-M163 VanDerWaalsContact O-CB 3.28Å; I160-M163 WeakPolarHBondContact O-CB 3.44Å; I160-M163 PolarHBondContact O-N 3.22Å; H161-M163 VanDerWaalsContact C-N 3.26Å; H161-M163 PolarHBondContact O-N 2.87Å; M163-V170 HydrophobicContact CE-CB 3.82Å; M163-V170 HydrophobicContact CE-CG1 3.33Å; M163-V170 HydrophobicContact SD-CB 3.96Å; M163-V170 HydrophobicContact SD-CG1 4.15Å; M163-L195 HydrophobicContact CE-CD1 3.49Å; M163-L195 VanDerWaalsContact CE-CD1 3.49Å; M163-I199 HydrophobicContact CE-CB 4.44Å; M163-I199 HydrophobicContact CE-CD1 4.33Å; M163-I199 HydrophobicContact CE-CG1 3.37Å
164	R	84.6	Confident	88.8	Confident	214 Å²	214	48 Å²	48	81%	0.808	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-27.2	177.6	-62	-177.3	-179.8	176.1	-1.9	113.2	H161 L162	H161-R164 PolarHBondContact O-N 3Å; L162-R164 PolarHBondContact O-N 3.16Å; L162-R164 VanDerWaalsContact O-N 3.16Å
165	K	83.4	Confident	88.8	Confident	124 Å²	124	54 Å²	54	54%	0.539	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-36.7	-178.9	-67.1	-175.3	176.4	-177.2	0	112.9	K126 L162	K126-K165 PolarHBondContact O-NZ 3.25Å; K126-K165 VanDerWaalsContact O-NZ 3.14Å; L162-K165 PolarHBondContact O-N 3.26Å
166	S	83.4	Confident	88.9	Confident	16 Å²	16	56 Å²	56	11%	0.112	26%	0.26	C	S	.	.			trans	-150.5	69.1	-170.5	-57.8	0	0	0	0	111.7	T130 L133 L162 E168 V169	T130-S166 WeakPolarHBondContact CG2-OG 3.37Å; L133-S166 VanDerWaalsContact CD2-CB 3.45Å; L162-S166 PolarHBondContact O-N 3.17Å; S166-E168 VanDerWaalsContact C-N 3.31Å; S166-E168 PolarHBondContact O-N 2.93Å; S166-V169 PolarHBondContact O-N 2.85Å
167	S	84.9	Confident	88.8	Confident	41 Å²	41	56 Å²	56	29%	0.287	26%	0.26	S	S	.	.	H	α-helix	trans	-60.5	-35.2	-174.9	56.8	0	0	0	0	114.1	V169 V170 R171	S167-V169 PolarHBondContact O-N 2.67Å; S167-V170 PolarHBondContact O-N 3.2Å; S167-R171 VanDerWaalsContact O-CG 3.26Å; S167-R171 WeakPolarHBondContact O-CG 3.19Å; S167-R171 PolarHBondContact O-N 3.21Å
168	E	85.6	Confident	88.8	Confident	142 Å²	142	55.2 Å²	55.2	66%	0.664	25%	0.253	S	S	*	.	H	α-helix	trans	-65.1	-39.1	-175.6	-64.7	-173.7	168.8	0	0	113.7	S166	S166-E168 VanDerWaalsContact C-N 3.31Å; S166-E168 PolarHBondContact O-N 2.93Å
169	V	86.7	Confident	88.8	Confident	9 Å²	9	61 Å²	61	6%	0.055	28%	0.28	C	S	.	.	H	α-helix	trans	-69.4	-46.1	179.4	-176.1	0	0	0	0	109.6	L133 Q134 S166 S167 R171 R172 W173	L133-V169 HydrophobicContact CD2-CB 3.87Å; L133-V169 HydrophobicContact CD2-CG1 4.1Å; L133-V169 HydrophobicContact CD2-CG2 4.24Å; L133-V169 HydrophobicContact CG-CB 4.37Å; L133-V169 HydrophobicContact CG-CG1 4.06Å; Q134-V169 HydrophobicContact CG-CG2 4.43Å; S166-V169 PolarHBondContact O-N 2.85Å; S167-V169 PolarHBondContact O-N 2.67Å; V169-R171 VanDerWaalsContact C-N 3.33Å; V169-R171 PolarHBondContact O-N 3.49Å; V169-R172 WeakPolarHBondContact O-CB 3.4Å; V169-R172 PolarHBondContact O-N 3.12Å; V169-W173 HydrophobicContact CG1-CZ2 3.94Å; V169-W173 PolarHBondContact O-NE1 3.26Å
170	V	88.2	Confident	88.7	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-68.1	-31.9	-176.8	-172.2	0	0	0	0	112	L133 L162 M163 S167 R172 W173 L195	L133-V170 HydrophobicContact CD2-CG2 4.5Å; L162-V170 HydrophobicContact CB-CG2 4.06Å; M163-V170 HydrophobicContact CE-CB 3.82Å; M163-V170 HydrophobicContact CE-CG1 3.33Å; M163-V170 HydrophobicContact SD-CB 3.96Å; M163-V170 HydrophobicContact SD-CG1 4.15Å; S167-V170 PolarHBondContact O-N 3.2Å; V170-R172 PolarHBondContact O-N 3.48Å; V170-W173 HydrophobicContact CB-CE3 4.28Å; V170-W173 HydrophobicContact CB-CZ3 4.43Å; V170-W173 HydrophobicContact CG1-CD2 4.31Å; V170-W173 HydrophobicContact CG1-CE3 3.73Å; V170-W173 HydrophobicContact CG1-CZ3 4.07Å; V170-W173 HydrophobicContact CG2-CE3 4.34Å; V170-W173 HydrophobicContact CG2-CH2 4.16Å; V170-W173 HydrophobicContact CG2-CZ3 4Å; V170-W173 WeakPolarHBondContact O-CB 3.33Å; V170-W173 PolarHBondContact O-N 3.26Å; V170-L195 HydrophobicContact CG1-CD1 4.11Å
171	R	88.7	Confident	88.7	Confident	97 Å²	97	60 Å²	60	37%	0.366	28%	0.276	S	S	.	.	H	α-helix	trans	-57.9	-28.6	174.3	-77.9	175.7	-170.3	148.8	3.6	113.1	S167 V169 W173 A174 I199 N202	S167-R171 VanDerWaalsContact O-CG 3.26Å; S167-R171 WeakPolarHBondContact O-CG 3.19Å; S167-R171 PolarHBondContact O-N 3.21Å; V169-R171 VanDerWaalsContact C-N 3.33Å; V169-R171 PolarHBondContact O-N 3.49Å; R171-W173 PolarHBondContact O-N 3.4Å; R171-A174 PolarHBondContact O-N 3.23Å; R171-I199 HydrophobicContact CB-CG2 4.41Å; R171-I199 HydrophobicContact CG-CG2 4.18Å; R171-N202 PolarHBondContact NH2-ND2 3.1Å
172	R	89.6	Confident	88.7	Confident	124 Å²	124	59 Å²	59	47%	0.468	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-10.3	176.6	-59.5	179.8	-127.8	161.4	-9.9	113.5	E137 V169 V170 A174	E137-R172 IonicContact OE2-NH1 3.48Å; E137-R172 PolarHBondContact OE2-NH1 3.34Å; V169-R172 WeakPolarHBondContact O-CB 3.4Å; V169-R172 PolarHBondContact O-N 3.12Å; V170-R172 PolarHBondContact O-N 3.48Å; R172-A174 VanDerWaalsContact C-N 3.31Å
173	W	91.9	Very high	88.7	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	9.4	-176.5	-49	-8.3	0	0	0	111.8	L133 E137 M140 K141 I144 S159 L162 V169 V170 R171 N175 E176 V177	L133-W173 HydrophobicContact CD1-CH2 3.89Å; L133-W173 HydrophobicContact CD1-CZ2 4.26Å; E137-W173 HydrophobicContact CB-CZ2 4.33Å; E137-W173 HydrophobicContact CG-CZ2 4.21Å; E137-W173 PolarHBondContact OE1-NE1 3.42Å; M140-W173 HydrophobicContact CB-CH2 3.88Å; M140-W173 HydrophobicContact CB-CZ2 4.31Å; M140-W173 HydrophobicContact CB-CZ3 4.1Å; M140-W173 HydrophobicContact CE-CZ3 4.42Å; M140-W173 HydrophobicContact CG-CH2 4.12Å; K141-W173 HydrophobicContact CG-CG 4.24Å; I144-W173 HydrophobicContact CD1-CB 4.5Å; I144-W173 HydrophobicContact CD1-CE3 3.91Å; S159-W173 WeakPolarHBondContact OG-CZ3 3.19Å; L162-W173 HydrophobicContact CD1-CH2 4.45Å; V169-W173 HydrophobicContact CG1-CZ2 3.94Å; V169-W173 PolarHBondContact O-NE1 3.26Å; V170-W173 HydrophobicContact CB-CE3 4.28Å; V170-W173 HydrophobicContact CB-CZ3 4.43Å; V170-W173 HydrophobicContact CG1-CD2 4.31Å; V170-W173 HydrophobicContact CG1-CE3 3.73Å; V170-W173 HydrophobicContact CG1-CZ3 4.07Å; V170-W173 HydrophobicContact CG2-CE3 4.34Å; V170-W173 HydrophobicContact CG2-CH2 4.16Å; V170-W173 HydrophobicContact CG2-CZ3 4Å; V170-W173 WeakPolarHBondContact O-CB 3.33Å; V170-W173 PolarHBondContact O-N 3.26Å; R171-W173 PolarHBondContact O-N 3.4Å; W173-N175 PolarHBondContact O-N 3.11Å; W173-E176 WeakPolarHBondContact CA-OE2 3.33Å; W173-E176 PolarHBondContact O-N 2.9Å; W173-V177 HydrophobicContact CB-CG2 4.48Å; W173-V177 VanDerWaalsContact O-CG2 3.25Å; W173-V177 WeakPolarHBondContact O-CG2 3.43Å; W173-V177 PolarHBondContact O-N 3.18Å
174	A	89.7	Confident	88.7	Confident	20 Å²	20	65 Å²	65	17%	0.165	32%	0.317	C	S	.	.	H	α-helix	trans	-57.3	-32.7	-174	0	0	0	0	0	113.6	R171 R172 Q178 I199	R171-A174 PolarHBondContact O-N 3.23Å; R172-A174 VanDerWaalsContact C-N 3.31Å; A174-Q178 WeakPolarHBondContact O-CB 3.11Å; A174-Q178 PolarHBondContact O-N 3.4Å; A174-I199 HydrophobicContact CB-CD1 4.47Å; A174-I199 HydrophobicContact CB-CG2 4.15Å
175	N	91.9	Very high	89.1	Confident	131 Å²	131	57.7 Å²	57.7	70%	0.701	29%	0.293	S	S	*	.	H	α-helix	trans	-71.9	-46.9	-179	-69.4	-25.6	0	0	0	111.5	W173 V177 Q178 E179	W173-N175 PolarHBondContact O-N 3.11Å; N175-V177 VanDerWaalsContact C-N 3.34Å; N175-Q178 WeakPolarHBondContact O-CB 3.42Å; N175-Q178 PolarHBondContact O-N 3.19Å; N175-E179 PolarHBondContact O-N 3.03Å
176	E	93.9	Very high	89.5	Confident	44 Å²	44	56 Å²	56	21%	0.206	29%	0.287	C	S	.	.	H	α-helix	trans	-64.4	-40.6	176.8	-64.2	86.2	166.4	0	0	111.1	K141 I144 V145 W173 Q178 E179 A180	K141-E176 HydrophobicContact CB-CG 4.16Å; K141-E176 VanDerWaalsContact CD-OE1 3.26Å; K141-E176 WeakPolarHBondContact CD-OE1 3.26Å; K141-E176 VanDerWaalsContact CE-OE1 3.25Å; K141-E176 WeakPolarHBondContact CE-OE1 3.41Å; K141-E176 HydrophobicContact CG-CG 4.18Å; I144-E176 HydrophobicContact CG2-CB 4.21Å; V145-E176 HydrophobicContact CG1-CB 3.96Å; V145-E176 HydrophobicContact CG1-CG 4.48Å; V145-E176 WeakPolarHBondContact CG1-O 3.2Å; W173-E176 WeakPolarHBondContact CA-OE2 3.33Å; W173-E176 PolarHBondContact O-N 2.9Å; E176-Q178 VanDerWaalsContact C-N 3.35Å; E176-E179 PolarHBondContact O-N 3.04Å; E176-A180 PolarHBondContact O-N 2.79Å
177	V	93.1	Very high	89.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-65.4	-40.6	175	178.4	0	0	0	0	110.7	I144 W173 N175 E179 A180 V181 A192 L195 L196 I199	I144-V177 HydrophobicContact CD1-CG2 4.3Å; I144-V177 HydrophobicContact CG2-CG2 4.26Å; W173-V177 HydrophobicContact CB-CG2 4.48Å; W173-V177 VanDerWaalsContact O-CG2 3.25Å; W173-V177 WeakPolarHBondContact O-CG2 3.43Å; W173-V177 PolarHBondContact O-N 3.18Å; N175-V177 VanDerWaalsContact C-N 3.34Å; V177-E179 VanDerWaalsContact C-N 3.31Å; V177-E179 PolarHBondContact O-N 3.17Å; V177-A180 WeakPolarHBondContact O-CB 3.38Å; V177-A180 PolarHBondContact O-N 3.18Å; V177-A180 VanDerWaalsContact O-N 3.14Å; V177-V181 WeakPolarHBondContact O-CG2 3.41Å; V177-V181 PolarHBondContact O-N 3.4Å; V177-V181 VanDerWaalsContact O-N 3.11Å; V177-A192 HydrophobicContact CG1-CB 4.43Å; V177-A192 VanDerWaalsContact CG1-O 3.26Å; V177-A192 WeakPolarHBondContact CG1-O 3.43Å; V177-L195 HydrophobicContact CG1-CB 4.09Å; V177-L195 HydrophobicContact CG1-CD2 4.15Å; V177-L195 HydrophobicContact CG1-CG 4.1Å; V177-L195 HydrophobicContact CG2-CD2 3.51Å; V177-L195 HydrophobicContact CG2-CG 4.09Å; V177-L196 HydrophobicContact CG1-CB 3.91Å; V177-L196 HydrophobicContact CG1-CD1 4.45Å; V177-I199 HydrophobicContact CG2-CD1 4.3Å
178	Q	91.1	Very high	90.3	Very high	28 Å²	28	57.4 Å²	57.4	13%	0.131	29%	0.289	C	S	.	.	H	α-helix	trans	-62.5	-36.4	177.1	178.1	71.5	71.3	0	0	112.4	A174 N175 E176	A174-Q178 WeakPolarHBondContact O-CB 3.11Å; A174-Q178 PolarHBondContact O-N 3.4Å; N175-Q178 WeakPolarHBondContact O-CB 3.42Å; N175-Q178 PolarHBondContact O-N 3.19Å; E176-Q178 VanDerWaalsContact C-N 3.35Å
179	E	91	Very high	90.7	Very high	127 Å²	127	51.2 Å²	51.2	59%	0.593	26%	0.26	S	S	*	.	H	α-helix	trans	-65.4	-43.5	171.4	-176	179.6	169.1	0	0	111.1	V145 N175 E176 V177 V181 S182	V145-E179 HydrophobicContact CG1-CB 4.28Å; V145-E179 HydrophobicContact CG1-CG 4.36Å; N175-E179 PolarHBondContact O-N 3.03Å; E176-E179 PolarHBondContact O-N 3.04Å; V177-E179 VanDerWaalsContact C-N 3.31Å; V177-E179 PolarHBondContact O-N 3.17Å; E179-V181 PolarHBondContact O-N 2.81Å; E179-S182 WeakPolarHBondContact O-CB 3.38Å; E179-S182 PolarHBondContact O-N 3.17Å
180	A	91.5	Very high	91.1	Very high	7 Å²	7	54 Å²	54	6%	0.058	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-25.1	178.4	0	0	0	0	0	113.7	I144 I156 E176 V177 S182 S183 V188 A192	I144-A180 HydrophobicContact CG2-CB 4.05Å; I156-A180 HydrophobicContact CD1-CB 4.05Å; E176-A180 PolarHBondContact O-N 2.79Å; V177-A180 WeakPolarHBondContact O-CB 3.38Å; V177-A180 PolarHBondContact O-N 3.18Å; V177-A180 VanDerWaalsContact O-N 3.14Å; A180-S182 PolarHBondContact O-N 3.28Å; A180-S183 WeakPolarHBondContact O-CB 3.49Å; A180-S183 PolarHBondContact O-N 3.34Å; A180-S183 VanDerWaalsContact O-N 3.16Å; A180-V188 HydrophobicContact CB-CG1 4.43Å; A180-A192 HydrophobicContact CB-CB 3.83Å
181	V	90.3	Very high	91.4	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-28.1	172.5	-174.7	0	0	0	0	111.7	V177 E179 S183 Q189 A192 L196 F214 L219	V177-V181 WeakPolarHBondContact O-CG2 3.41Å; V177-V181 PolarHBondContact O-N 3.4Å; V177-V181 VanDerWaalsContact O-N 3.11Å; E179-V181 PolarHBondContact O-N 2.81Å; V181-S183 PolarHBondContact O-N 2.82Å; V181-Q189 HydrophobicContact CG1-CG 4.4Å; V181-Q189 VanDerWaalsContact O-CG 3.29Å; V181-Q189 WeakPolarHBondContact O-CG 3.4Å; V181-Q189 PolarHBondContact O-NE2 3.49Å; V181-A192 HydrophobicContact CB-CB 4.38Å; V181-A192 HydrophobicContact CG2-CB 3.68Å; V181-L196 HydrophobicContact CG2-CD2 4.04Å; V181-F214 HydrophobicContact CB-CE1 4.32Å; V181-F214 HydrophobicContact CB-CZ 3.87Å; V181-F214 HydrophobicContact CG1-CD1 4.37Å; V181-F214 HydrophobicContact CG1-CE1 3.5Å; V181-F214 HydrophobicContact CG1-CE2 4.12Å; V181-F214 HydrophobicContact CG1-CZ 3.33Å; V181-F214 HydrophobicContact CG2-CZ 4.31Å; V181-L219 HydrophobicContact CG1-CD2 4.03Å
182	S	87.8	Confident	91.6	Very high	90 Å²	90	50.9 Å²	50.9	63%	0.629	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	3.7	177.6	-67.9	0	0	0	0	113.8	E179 A180	E179-S182 WeakPolarHBondContact O-CB 3.38Å; E179-S182 PolarHBondContact O-N 3.17Å; A180-S182 PolarHBondContact O-N 3.28Å
183	S	88.7	Confident	91.8	Very high	36 Å²	36	45 Å²	45	25%	0.252	24%	0.237	S	C	.	.			trans	-59.8	145.4	176.3	171.9	0	0	0	0	113.1	A180 V181 N185	A180-S183 WeakPolarHBondContact O-CB 3.49Å; A180-S183 PolarHBondContact O-N 3.34Å; A180-S183 VanDerWaalsContact O-N 3.16Å; V181-S183 PolarHBondContact O-N 2.82Å; S183-N185 VanDerWaalsContact C-N 3.26Å; S183-N185 PolarHBondContact O-N 3.47Å; S183-N185 PolarHBondContact OG-N 3.41Å; S183-N185 VanDerWaalsContact OG-N 3.14Å
184	D	87.3	Confident	91.9	Very high	115 Å²	115	45.4 Å²	45.4	62%	0.615	24%	0.24	S	C	*	.	S	Bend	trans	-70.4	-21.9	174	-65.8	-39.4	0	0	0	112.9	R220	D184-R220 IonicContact OD1-CZ 3.46Å; D184-R220 IonicContact OD1-NH1 2.63Å; D184-R220 PolarHBondContact OD1-NH1 2.89Å; D184-R220 IonicContact OD1-NH2 3.78Å
185	N	92.1	Very high	92.1	Very high	60 Å²	60	44.4 Å²	44.4	32%	0.321	23%	0.233	S	C	.	.	S	Bend	trans	-81.7	124.8	-178.1	-172	-67.9	0	0	0	111.5	S149 S183 M187 V188 Q189	S149-N185 WeakPolarHBondContact CB-ND2 3.36Å; S149-N185 PolarHBondContact OG-ND2 3.19Å; S183-N185 VanDerWaalsContact C-N 3.26Å; S183-N185 PolarHBondContact O-N 3.47Å; S183-N185 PolarHBondContact OG-N 3.41Å; S183-N185 VanDerWaalsContact OG-N 3.14Å; N185-M187 VanDerWaalsContact C-N 3.32Å; N185-M187 PolarHBondContact O-N 3.07Å; N185-M187 PolarHBondContact OD1-N 3.34Å; N185-V188 HydrophobicContact CB-CB 4.14Å; N185-V188 HydrophobicContact CB-CG2 3.95Å; N185-V188 PolarHBondContact O-N 2.83Å; N185-V188 PolarHBondContact OD1-N 3.46Å; N185-Q189 PolarHBondContact O-N 3.47Å
186	H	92.3	Very high	92.1	Very high	89 Å²	89	38.2 Å²	38.2	41%	0.412	20%	0.199	S	C	.	.	H	α-helix	trans	-57.3	-38.9	-175.5	-68.2	177.1	0	0	0	114.5	Y190 S221	H186-Y190 WeakPolarHBondContact O-CB 3.5Å; H186-Y190 PolarHBondContact O-N 3.22Å; H186-Y190 VanDerWaalsContact O-N 3.12Å; H186-S221 VanDerWaalsContact O-CB 3.28Å; H186-S221 WeakPolarHBondContact O-CB 3.37Å; H186-S221 PolarHBondContact O-OG 2.81Å
187	M	92.4	Very high	92	Very high	85 Å²	85	37.4 Å²	37.4	42%	0.419	20%	0.195	S	C	.	.	H	α-helix	trans	-77.9	-38.1	-177.7	-65.9	-61.8	-87.9	0	0	111.6	N185 Y190 H191 Y223	N185-M187 VanDerWaalsContact C-N 3.32Å; N185-M187 PolarHBondContact O-N 3.07Å; N185-M187 PolarHBondContact OD1-N 3.34Å; M187-Y190 PolarHBondContact O-N 2.64Å; M187-H191 WeakPolarHBondContact O-CB 3.42Å; M187-H191 VanDerWaalsContact O-CG 3.22Å; M187-H191 PolarHBondContact O-N 3.01Å; M187-H191 PolarHBondContact O-ND1 2.84Å; M187-Y223 HydrophobicContact SD-CD2 4.22Å; M187-Y223 HydrophobicContact SD-CE2 4.3Å
188	V	93.2	Very high	91.9	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-47.8	174.6	176.1	0	0	0	0	109.9	S152 I156 A180 N185 Y190 H191 A192	S152-V188 VanDerWaalsContact OG-CG1 3.27Å; S152-V188 WeakPolarHBondContact OG-CG1 3.32Å; I156-V188 HydrophobicContact CD1-CG1 3.98Å; A180-V188 HydrophobicContact CB-CG1 4.43Å; N185-V188 HydrophobicContact CB-CB 4.14Å; N185-V188 HydrophobicContact CB-CG2 3.95Å; N185-V188 PolarHBondContact O-N 2.83Å; N185-V188 PolarHBondContact OD1-N 3.46Å; V188-Y190 VanDerWaalsContact C-N 3.32Å; V188-Y190 PolarHBondContact O-N 3.1Å; V188-H191 PolarHBondContact O-N 3.11Å; V188-A192 WeakPolarHBondContact O-CB 3.33Å; V188-A192 PolarHBondContact O-N 3.45Å
189	Q	93.6	Very high	91.9	Very high	11 Å²	11	40.3 Å²	40.3	5%	0.051	21%	0.208	C	C	.	.	H	α-helix	trans	-59	-41.8	176.8	175.6	168.5	81.1	0	0	112.2	V181 N185 L193 L219 S221 A224	V181-Q189 HydrophobicContact CG1-CG 4.4Å; V181-Q189 VanDerWaalsContact O-CG 3.29Å; V181-Q189 WeakPolarHBondContact O-CG 3.4Å; V181-Q189 PolarHBondContact O-NE2 3.49Å; N185-Q189 PolarHBondContact O-N 3.47Å; Q189-L193 WeakPolarHBondContact O-CB 3.4Å; Q189-L193 PolarHBondContact O-N 2.82Å; Q189-L219 HydrophobicContact CG-CD2 4.25Å; Q189-S221 VanDerWaalsContact OE1-CB 3.25Å; Q189-A224 HydrophobicContact CG-CB 3.92Å
190	Y	94.3	Very high	91.8	Very high	69 Å²	69	37.2 Å²	37.2	27%	0.271	19%	0.191	S	C	.	.	H	α-helix	trans	-64.8	-51.5	176.8	168.6	-119	0	0	0	112.6	H186 M187 V188 A192 L193 A194 Y227	H186-Y190 WeakPolarHBondContact O-CB 3.5Å; H186-Y190 PolarHBondContact O-N 3.22Å; H186-Y190 VanDerWaalsContact O-N 3.12Å; M187-Y190 PolarHBondContact O-N 2.64Å; V188-Y190 VanDerWaalsContact C-N 3.32Å; V188-Y190 PolarHBondContact O-N 3.1Å; Y190-A192 VanDerWaalsContact C-N 3.33Å; Y190-A192 PolarHBondContact O-N 3.26Å; Y190-L193 PolarHBondContact O-N 3.36Å; Y190-A194 PolarHBondContact O-N 3.37Å; Y190-Y227 HydrophobicContact CE2-CD2 4.17Å; Y190-Y227 HydrophobicContact CE2-CG 4.04Å
191	H	94.7	Very high	91.5	Very high	30 Å²	30	39 Å²	39	14%	0.139	21%	0.207	C	C	.	.	H	α-helix	trans	-63.6	-39.7	179.1	-61.6	155.8	0	0	0	111.6	S153 I156 V157 M187 V188 A194 L195	S153-H191 PolarHBondContact OG-CE1 3.12Å; S153-H191 PolarHBondContact OG-ND1 2.83Å; I156-H191 HydrophobicContact CB-CB 4.24Å; I156-H191 HydrophobicContact CG2-CB 3.66Å; I156-H191 VanDerWaalsContact CG2-O 3.24Å; I156-H191 WeakPolarHBondContact CG2-O 3.38Å; V157-H191 HydrophobicContact CG2-CB 4.27Å; M187-H191 WeakPolarHBondContact O-CB 3.42Å; M187-H191 VanDerWaalsContact O-CG 3.22Å; M187-H191 PolarHBondContact O-N 3.01Å; M187-H191 PolarHBondContact O-ND1 2.84Å; V188-H191 PolarHBondContact O-N 3.11Å; H191-A194 WeakPolarHBondContact O-CB 3.44Å; H191-A194 PolarHBondContact O-N 2.91Å; H191-L195 PolarHBondContact O-N 3.14Å
192	A	94.1	Very high	91.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.2	-43.7	178.7	0	0	0	0	0	111.1	I156 V177 A180 V181 V188 Y190 A194 L195 L196	I156-A192 HydrophobicContact CD1-CB 4.03Å; V177-A192 HydrophobicContact CG1-CB 4.43Å; V177-A192 VanDerWaalsContact CG1-O 3.26Å; V177-A192 WeakPolarHBondContact CG1-O 3.43Å; A180-A192 HydrophobicContact CB-CB 3.83Å; V181-A192 HydrophobicContact CB-CB 4.38Å; V181-A192 HydrophobicContact CG2-CB 3.68Å; V188-A192 WeakPolarHBondContact O-CB 3.33Å; V188-A192 PolarHBondContact O-N 3.45Å; Y190-A192 VanDerWaalsContact C-N 3.33Å; Y190-A192 PolarHBondContact O-N 3.26Å; A192-A194 VanDerWaalsContact C-N 3.32Å; A192-A194 PolarHBondContact O-N 2.66Å; A192-L195 PolarHBondContact O-N 2.55Å; A192-L196 VanDerWaalsContact O-CB 3.27Å; A192-L196 WeakPolarHBondContact O-CB 3.5Å; A192-L196 PolarHBondContact O-N 2.96Å
193	L	93.8	Very high	91.2	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-41.1	175.6	-177.1	66.6	0	0	0	111.4	Q189 Y190 L196 Y197 L210 F214 L219 A224 Y227 L228	Q189-L193 WeakPolarHBondContact O-CB 3.4Å; Q189-L193 PolarHBondContact O-N 2.82Å; Y190-L193 PolarHBondContact O-N 3.36Å; L193-L196 PolarHBondContact O-N 3.31Å; L193-Y197 WeakPolarHBondContact O-CB 3.34Å; L193-Y197 PolarHBondContact O-N 2.99Å; L193-L210 HydrophobicContact CD1-CD2 4.05Å; L193-F214 HydrophobicContact CD1-CD2 4.19Å; L193-F214 HydrophobicContact CD1-CE2 4.23Å; L193-L219 HydrophobicContact CD2-CD1 3.93Å; L193-A224 HydrophobicContact CD2-CB 4.12Å; L193-A224 VanDerWaalsContact CD2-O 3.3Å; L193-A224 WeakPolarHBondContact CD2-O 3.44Å; L193-Y227 HydrophobicContact CD2-CD1 4.17Å; L193-Y227 HydrophobicContact CG-CD1 4.18Å; L193-L228 HydrophobicContact CD2-CB 4.15Å
194	A	93.4	Very high	90.9	Very high	9 Å²	9	49.2 Å²	49.2	7%	0.074	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-46.4	177.1	0	0	0	0	0	112.6	I160 Y190 H191 A192 Y197 Q198 Y227	I160-A194 HydrophobicContact CD1-CB 4.19Å; Y190-A194 PolarHBondContact O-N 3.37Å; H191-A194 WeakPolarHBondContact O-CB 3.44Å; H191-A194 PolarHBondContact O-N 2.91Å; A192-A194 VanDerWaalsContact C-N 3.32Å; A192-A194 PolarHBondContact O-N 2.66Å; A194-Y197 PolarHBondContact O-N 2.92Å; A194-Q198 WeakPolarHBondContact O-CG 3.34Å; A194-Q198 PolarHBondContact O-N 2.82Å; A194-Q198 VanDerWaalsContact O-N 3.1Å; A194-Y227 HydrophobicContact CB-CD1 4.46Å; A194-Y227 HydrophobicContact CB-CE1 3.93Å
195	L	93.2	Very high	90.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.4	-41.8	176.1	-179.8	58	0	0	0	111.8	I156 I160 M163 V170 V177 H191 A192 Y197 Q198 I199	I156-L195 HydrophobicContact CG2-CB 3.9Å; I156-L195 HydrophobicContact CG2-CD2 3.85Å; I160-L195 HydrophobicContact CD1-CB 4.25Å; I160-L195 HydrophobicContact CG1-CB 3.86Å; I160-L195 HydrophobicContact CG1-CD1 3.82Å; I160-L195 HydrophobicContact CG1-CG 4.34Å; M163-L195 HydrophobicContact CE-CD1 3.49Å; M163-L195 VanDerWaalsContact CE-CD1 3.49Å; V170-L195 HydrophobicContact CG1-CD1 4.11Å; V177-L195 HydrophobicContact CG1-CB 4.09Å; V177-L195 HydrophobicContact CG1-CD2 4.15Å; V177-L195 HydrophobicContact CG1-CG 4.1Å; V177-L195 HydrophobicContact CG2-CD2 3.51Å; V177-L195 HydrophobicContact CG2-CG 4.09Å; H191-L195 PolarHBondContact O-N 3.14Å; A192-L195 PolarHBondContact O-N 2.55Å; L195-Y197 VanDerWaalsContact C-N 3.33Å; L195-Y197 PolarHBondContact O-N 3.21Å; L195-Q198 PolarHBondContact O-N 2.97Å; L195-I199 HydrophobicContact CD1-CD1 4.44Å; L195-I199 HydrophobicContact CD1-CG1 4.44Å; L195-I199 HydrophobicContact CG-CD1 4.15Å; L195-I199 WeakPolarHBondContact O-CG1 3.27Å; L195-I199 PolarHBondContact O-N 2.86Å
196	L	92.8	Very high	90.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.9	-39.9	179.3	-172.1	62.8	0	0	0	112.1	V177 V181 A192 L193 R200 L210 F214	V177-L196 HydrophobicContact CG1-CB 3.91Å; V177-L196 HydrophobicContact CG1-CD1 4.45Å; V181-L196 HydrophobicContact CG2-CD2 4.04Å; A192-L196 VanDerWaalsContact O-CB 3.27Å; A192-L196 WeakPolarHBondContact O-CB 3.5Å; A192-L196 PolarHBondContact O-N 2.96Å; L193-L196 PolarHBondContact O-N 3.31Å; L196-R200 PolarHBondContact O-N 3.04Å; L196-L210 HydrophobicContact CB-CD1 4.35Å; L196-L210 HydrophobicContact CD2-CD1 3.58Å; L196-L210 HydrophobicContact CD2-CG 4.46Å; L196-L210 HydrophobicContact CG-CD1 3.61Å; L196-F214 HydrophobicContact CD2-CE2 4.18Å
197	Y	92.1	Very high	90.3	Very high	28 Å²	28	43.8 Å²	43.8	11%	0.11	22%	0.218	C	C	.	.	H	α-helix	trans	-62.7	-47.2	172.9	172.5	-109.6	0	0	0	111.3	L193 A194 L195 I199 R200 A201 V207 Y227 I231 R234	L193-Y197 WeakPolarHBondContact O-CB 3.34Å; L193-Y197 PolarHBondContact O-N 2.99Å; A194-Y197 PolarHBondContact O-N 2.92Å; L195-Y197 VanDerWaalsContact C-N 3.33Å; L195-Y197 PolarHBondContact O-N 3.21Å; Y197-I199 VanDerWaalsContact C-N 3.32Å; Y197-I199 PolarHBondContact O-N 3.2Å; Y197-R200 CarbonylContact O-C 3.4Å; Y197-R200 PolarHBondContact O-N 3.12Å; Y197-A201 WeakPolarHBondContact O-CA 3.5Å; Y197-A201 WeakPolarHBondContact O-CB 3.38Å; Y197-A201 PolarHBondContact O-N 2.62Å; Y197-V207 HydrophobicContact CD2-CG1 4.26Å; Y197-V207 HydrophobicContact CD2-CG2 4.25Å; Y197-V207 HydrophobicContact CE2-CG1 4Å; Y197-V207 HydrophobicContact CE2-CG2 4.13Å; Y197-Y227 HydrophobicContact CD1-CE1 4.31Å; Y197-Y227 WeakPolarHBondContact CD1-OH 3.3Å; Y197-Y227 HydrophobicContact CG-CE1 4.5Å; Y197-I231 HydrophobicContact CD1-CD1 4.37Å; Y197-I231 HydrophobicContact CD1-CG1 4.35Å; Y197-I231 HydrophobicContact CD2-CB 4.5Å; Y197-I231 HydrophobicContact CD2-CD1 3.77Å; Y197-I231 HydrophobicContact CD2-CG1 3.83Å; Y197-I231 HydrophobicContact CD2-CG2 3.81Å; Y197-I231 HydrophobicContact CE2-CB 4.5Å; Y197-I231 HydrophobicContact CE2-CD1 4.48Å; Y197-I231 HydrophobicContact CE2-CG1 4.04Å; Y197-I231 HydrophobicContact CE2-CG2 3.75Å; Y197-I231 HydrophobicContact CG-CD1 3.7Å; Y197-I231 HydrophobicContact CG-CG1 4Å; Y197-R234 PolarHBondContact OH-NH1 3.01Å; Y197-R234 VanDerWaalsContact OH-NH1 3.14Å
198	Q	90.1	Very high	89.9	Confident	70 Å²	70	41.3 Å²	41.3	33%	0.327	21%	0.207	S	C	.	.	H	α-helix	trans	-61.4	-37.7	178.1	-73.6	-177.9	-0.7	0	0	113.4	A194 L195 R200 A201	A194-Q198 WeakPolarHBondContact O-CG 3.34Å; A194-Q198 PolarHBondContact O-N 2.82Å; A194-Q198 VanDerWaalsContact O-N 3.1Å; L195-Q198 PolarHBondContact O-N 2.97Å; Q198-R200 PolarHBondContact O-N 2.8Å; Q198-A201 PolarHBondContact O-N 2.82Å
199	I	90.8	Very high	89.6	Confident	18 Å²	18	48.1 Å²	48.1	9%	0.092	24%	0.236	C	C	.	.	H	α-helix	trans	-57.9	-39.5	173.8	-73.6	169.8	0	0	0	110.9	M163 R171 A174 V177 L195 Y197	M163-I199 HydrophobicContact CE-CB 4.44Å; M163-I199 HydrophobicContact CE-CD1 4.33Å; M163-I199 HydrophobicContact CE-CG1 3.37Å; R171-I199 HydrophobicContact CB-CG2 4.41Å; R171-I199 HydrophobicContact CG-CG2 4.18Å; A174-I199 HydrophobicContact CB-CD1 4.47Å; A174-I199 HydrophobicContact CB-CG2 4.15Å; V177-I199 HydrophobicContact CG2-CD1 4.3Å; L195-I199 HydrophobicContact CD1-CD1 4.44Å; L195-I199 HydrophobicContact CD1-CG1 4.44Å; L195-I199 HydrophobicContact CG-CD1 4.15Å; L195-I199 WeakPolarHBondContact O-CG1 3.27Å; L195-I199 PolarHBondContact O-N 2.86Å; Y197-I199 VanDerWaalsContact C-N 3.32Å; Y197-I199 PolarHBondContact O-N 3.2Å
200	R	89.8	Confident	89.3	Confident	62 Å²	62	47.7 Å²	47.7	23%	0.234	23%	0.234	C	C	.	.	H	α-helix	trans	-100.3	-0	-173.3	-64.1	179.7	-178.2	-178.6	10.8	114.1	L196 Y197 Q198 N202 D203 A206 V207	L196-R200 PolarHBondContact O-N 3.04Å; Y197-R200 CarbonylContact O-C 3.4Å; Y197-R200 PolarHBondContact O-N 3.12Å; Q198-R200 PolarHBondContact O-N 2.8Å; R200-N202 PolarHBondContact O-N 2.74Å; R200-D203 CarbonylContact O-C 3.58Å; R200-D203 PolarHBondContact O-N 3.44Å; R200-A206 HydrophobicContact CB-CB 4.19Å; R200-A206 HydrophobicContact CG-CB 4.19Å; R200-V207 HydrophobicContact CB-CG2 4.21Å; R200-V207 VanDerWaalsContact O-CG2 3.32Å; R200-V207 WeakPolarHBondContact O-CG2 3.42Å
201	A	86	Confident	89	Confident	46 Å²	46	44.4 Å²	44.4	38%	0.38	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.7	-169.7	0	0	0	0	0	113.7	Y197 Q198	Y197-A201 WeakPolarHBondContact O-CA 3.5Å; Y197-A201 WeakPolarHBondContact O-CB 3.38Å; Y197-A201 PolarHBondContact O-N 2.62Å; Q198-A201 PolarHBondContact O-N 2.82Å
202	N	84.4	Confident	88.6	Confident	138 Å²	138	47.2 Å²	47.2	74%	0.738	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-13.4	177.6	-64.5	4.6	0	0	0	113.4	R171 R200	R171-N202 PolarHBondContact NH2-ND2 3.1Å; R200-N202 PolarHBondContact O-N 2.74Å
203	D	86.6	Confident	88.3	Confident	82 Å²	82	51.6 Å²	51.6	44%	0.439	25%	0.253	S	S	.	.			trans	-114.1	100.5	-179.1	178.7	-11.4	0	0	0	110.1	R200 L205 A206 V207	R200-D203 CarbonylContact O-C 3.58Å; R200-D203 PolarHBondContact O-N 3.44Å; D203-L205 VanDerWaalsContact C-N 3.32Å; D203-L205 PolarHBondContact O-N 2.81Å; D203-L205 PolarHBondContact OD1-N 3.06Å; D203-A206 HydrophobicContact CB-CB 3.87Å; D203-A206 VanDerWaalsContact CG-CB 3.42Å; D203-A206 PolarHBondContact O-N 3.42Å; D203-A206 PolarHBondContact OD1-N 3.41Å; D203-A206 WeakPolarHBondContact OD2-CB 3.42Å; D203-V207 WeakPolarHBondContact O-CG2 3.4Å; D203-V207 PolarHBondContact O-N 3.31Å
204	R	82.6	Confident	88.1	Confident	119 Å²	119	52 Å²	52	45%	0.449	26%	0.255	S	S	.	.	H	α-helix	trans	-58	-40.9	-178.9	-170.8	179.9	-176	133.7	-10.3	112.8	V207 N208 D238 D239	R204-V207 PolarHBondContact O-N 3.22Å; R204-N208 PolarHBondContact O-N 2.97Å; R204-D238 PolarHBondContact NH2-O 2.88Å; R204-D239 IonicContact CZ-OD1 3.21Å; R204-D239 IonicContact NE-OD1 3.46Å; R204-D239 PolarHBondContact NE-OD1 3.34Å; R204-D239 IonicContact NE-OD2 3.55Å; R204-D239 IonicContact NH2-OD1 3.02Å; R204-D239 PolarHBondContact NH2-OD1 3.31Å; R204-D239 IonicContact NH2-OD2 2.65Å
205	L	84.6	Confident	87.6	Confident	125 Å²	125	52.8 Å²	52.8	65%	0.654	26%	0.26	S	S	*	.	H	α-helix	trans	-67.8	-39.1	-179.8	-68.6	174.1	0	0	0	111	D203 V207 N208 K209	D203-L205 VanDerWaalsContact C-N 3.32Å; D203-L205 PolarHBondContact O-N 2.81Å; D203-L205 PolarHBondContact OD1-N 3.06Å; L205-V207 VanDerWaalsContact C-N 3.33Å; L205-N208 PolarHBondContact O-N 3.46Å; L205-K209 WeakPolarHBondContact O-CB 3.33Å; L205-K209 WeakPolarHBondContact O-CG 3.11Å; L205-K209 PolarHBondContact O-N 2.89Å
206	A	86.1	Confident	87.1	Confident	18 Å²	18	60.9 Å²	60.9	15%	0.149	30%	0.296	C	S	.	.	H	α-helix	trans	-67.6	-33.4	176.4	0	0	0	0	0	112.7	R200 D203 L210	R200-A206 HydrophobicContact CB-CB 4.19Å; R200-A206 HydrophobicContact CG-CB 4.19Å; D203-A206 HydrophobicContact CB-CB 3.87Å; D203-A206 VanDerWaalsContact CG-CB 3.42Å; D203-A206 PolarHBondContact O-N 3.42Å; D203-A206 PolarHBondContact OD1-N 3.41Å; D203-A206 WeakPolarHBondContact OD2-CB 3.42Å; A206-L210 WeakPolarHBondContact O-CB 3.4Å; A206-L210 PolarHBondContact O-N 3.43Å; A206-L210 VanDerWaalsContact O-N 3.07Å
207	V	87	Confident	86.5	Confident	8 Å²	8	65.6 Å²	65.6	5%	0.048	32%	0.321	C	S	.	.	H	α-helix	trans	-68.5	-47.1	172.1	176.6	0	0	0	0	110.8	Y197 R200 D203 R204 L205 K209 L210 V211 I231 C235	Y197-V207 HydrophobicContact CD2-CG1 4.26Å; Y197-V207 HydrophobicContact CD2-CG2 4.25Å; Y197-V207 HydrophobicContact CE2-CG1 4Å; Y197-V207 HydrophobicContact CE2-CG2 4.13Å; R200-V207 HydrophobicContact CB-CG2 4.21Å; R200-V207 VanDerWaalsContact O-CG2 3.32Å; R200-V207 WeakPolarHBondContact O-CG2 3.42Å; D203-V207 WeakPolarHBondContact O-CG2 3.4Å; D203-V207 PolarHBondContact O-N 3.31Å; R204-V207 PolarHBondContact O-N 3.22Å; L205-V207 VanDerWaalsContact C-N 3.33Å; V207-K209 VanDerWaalsContact C-N 3.34Å; V207-K209 PolarHBondContact O-N 3.31Å; V207-L210 WeakPolarHBondContact O-CA 3.42Å; V207-L210 WeakPolarHBondContact O-CB 3.31Å; V207-L210 PolarHBondContact O-N 3.36Å; V207-V211 WeakPolarHBondContact O-CG2 3.48Å; V207-V211 PolarHBondContact O-N 3.41Å; V207-I231 HydrophobicContact CG1-CG2 3.69Å; V207-C235 VanDerWaalsContact CG1-SG 3.59Å
208	N	85.4	Confident	85.7	Confident	32 Å²	32	68.7 Å²	68.7	17%	0.171	35%	0.352	C	S	.	.	H	α-helix	trans	-59.9	-43.1	177.6	-80.9	-15.1	0	0	0	111.9	R204 L205 L210 V211 Q212 D239	R204-N208 PolarHBondContact O-N 2.97Å; L205-N208 PolarHBondContact O-N 3.46Å; N208-L210 VanDerWaalsContact C-N 3.32Å; N208-L210 PolarHBondContact O-N 3.09Å; N208-V211 PolarHBondContact O-N 2.78Å; N208-Q212 WeakPolarHBondContact O-CG 3.34Å; N208-Q212 PolarHBondContact O-N 3.03Å; N208-D239 PolarHBondContact ND2-OD2 3.5Å
209	K	86.2	Confident	85.6	Confident	146 Å²	146	66.1 Å²	66.1	64%	0.635	34%	0.34	S	S	*	.	H	α-helix	trans	-62.5	-37	173.3	-74.9	177.6	-179.6	175.1	0	112.9	L205 V207 K213	L205-K209 WeakPolarHBondContact O-CB 3.33Å; L205-K209 WeakPolarHBondContact O-CG 3.11Å; L205-K209 PolarHBondContact O-N 2.89Å; V207-K209 VanDerWaalsContact C-N 3.34Å; V207-K209 PolarHBondContact O-N 3.31Å; K209-K213 WeakPolarHBondContact O-CB 3.33Å; K209-K213 PolarHBondContact O-N 3.07Å
210	L	88	Confident	85.4	Confident	1 Å²	1	73 Å²	73	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-64.1	-47.4	176.3	178.5	153.8	0	0	0	111	L193 L196 A206 V207 N208 K213 F214 L228	L193-L210 HydrophobicContact CD1-CD2 4.05Å; L196-L210 HydrophobicContact CB-CD1 4.35Å; L196-L210 HydrophobicContact CD2-CD1 3.58Å; L196-L210 HydrophobicContact CD2-CG 4.46Å; L196-L210 HydrophobicContact CG-CD1 3.61Å; A206-L210 WeakPolarHBondContact O-CB 3.4Å; A206-L210 PolarHBondContact O-N 3.43Å; A206-L210 VanDerWaalsContact O-N 3.07Å; V207-L210 WeakPolarHBondContact O-CA 3.42Å; V207-L210 WeakPolarHBondContact O-CB 3.31Å; V207-L210 PolarHBondContact O-N 3.36Å; N208-L210 VanDerWaalsContact C-N 3.32Å; N208-L210 PolarHBondContact O-N 3.09Å; L210-K213 PolarHBondContact O-N 3.44Å; L210-F214 HydrophobicContact CD2-CD2 4.13Å; L210-F214 HydrophobicContact CG-CD2 4.01Å; L210-F214 HydrophobicContact CG-CE2 4.13Å; L210-F214 WeakPolarHBondContact O-CD2 3.5Å; L210-F214 PolarHBondContact O-N 3.34Å; L210-F214 VanDerWaalsContact O-N 3.14Å; L210-L228 HydrophobicContact CD2-CD1 4.23Å
211	V	87.8	Confident	85.5	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-61.7	-48	178.2	176.3	0	0	0	0	110.5	V207 N208 K213 F214 S215 L228 I231 A232 V248	V207-V211 WeakPolarHBondContact O-CG2 3.48Å; V207-V211 PolarHBondContact O-N 3.41Å; N208-V211 PolarHBondContact O-N 2.78Å; V211-K213 VanDerWaalsContact C-N 3.32Å; V211-K213 PolarHBondContact O-N 3.09Å; V211-F214 PolarHBondContact O-N 2.96Å; V211-S215 WeakPolarHBondContact O-CB 3.43Å; V211-S215 PolarHBondContact O-N 3.17Å; V211-L228 HydrophobicContact CG2-CD1 4.29Å; V211-I231 HydrophobicContact CG2-CB 4.46Å; V211-I231 HydrophobicContact CG2-CG2 3.67Å; V211-A232 HydrophobicContact CG1-CB 3.92Å; V211-V248 HydrophobicContact CG1-CG1 3.93Å; V211-V248 HydrophobicContact CG1-CG2 4Å
212	Q	86.6	Confident	85.8	Confident	90 Å²	90	69.1 Å²	69.1	42%	0.421	34%	0.344	S	S	.	.	H	α-helix	trans	-59.9	-39.7	177.9	-72.1	177.2	2.6	0	0	112.9	N208 K216	N208-Q212 WeakPolarHBondContact O-CG 3.34Å; N208-Q212 PolarHBondContact O-N 3.03Å; Q212-K216 PolarHBondContact O-N 3.47Å
213	K	88.2	Confident	86.2	Confident	91 Å²	91	68.2 Å²	68.2	40%	0.396	33%	0.331	S	S	.	.	H	α-helix	trans	-63.4	-48.3	178.8	-178.3	-178.7	-179.9	-177.1	0	112.1	K209 L210 V211 N217	K209-K213 WeakPolarHBondContact O-CB 3.33Å; K209-K213 PolarHBondContact O-N 3.07Å; L210-K213 PolarHBondContact O-N 3.44Å; V211-K213 VanDerWaalsContact C-N 3.32Å; V211-K213 PolarHBondContact O-N 3.09Å; K213-N217 WeakPolarHBondContact O-CB 3.48Å; K213-N217 PolarHBondContact O-N 2.86Å; K213-N217 VanDerWaalsContact O-N 3.15Å
214	F	87.8	Confident	86.5	Confident	9 Å²	9	64.3 Å²	64.3	4%	0.039	31%	0.31	C	S	.	.	H	α-helix	trans	-87.4	-12.2	-176.4	-67.4	-64	0	0	0	114	V181 L193 L196 L210 V211 N217 L219 L228	V181-F214 HydrophobicContact CB-CE1 4.32Å; V181-F214 HydrophobicContact CB-CZ 3.87Å; V181-F214 HydrophobicContact CG1-CD1 4.37Å; V181-F214 HydrophobicContact CG1-CE1 3.5Å; V181-F214 HydrophobicContact CG1-CE2 4.12Å; V181-F214 HydrophobicContact CG1-CZ 3.33Å; V181-F214 HydrophobicContact CG2-CZ 4.31Å; L193-F214 HydrophobicContact CD1-CD2 4.19Å; L193-F214 HydrophobicContact CD1-CE2 4.23Å; L196-F214 HydrophobicContact CD2-CE2 4.18Å; L210-F214 HydrophobicContact CD2-CD2 4.13Å; L210-F214 HydrophobicContact CG-CD2 4.01Å; L210-F214 HydrophobicContact CG-CE2 4.13Å; L210-F214 WeakPolarHBondContact O-CD2 3.5Å; L210-F214 PolarHBondContact O-N 3.34Å; L210-F214 VanDerWaalsContact O-N 3.14Å; V211-F214 PolarHBondContact O-N 2.96Å; F214-N217 CarbonylContact O-C 3.53Å; F214-L219 HydrophobicContact CB-CD1 4.34Å; F214-L219 HydrophobicContact CB-CD2 4.5Å; F214-L219 HydrophobicContact CB-CG 4.35Å; F214-L219 HydrophobicContact CD1-CD2 3.61Å; F214-L219 HydrophobicContact CD1-CG 4.32Å; F214-L219 HydrophobicContact CE1-CD2 4.03Å; F214-L219 HydrophobicContact CG-CD2 4.24Å; F214-L228 HydrophobicContact CB-CD1 4.32Å; F214-L228 HydrophobicContact CB-CD2 3.67Å
215	S	84.5	Confident	87	Confident	26 Å²	26	59 Å²	59	18%	0.182	29%	0.291	C	S	.	.	H	α-helix	trans	-66.4	-44.5	165.5	157.3	0	0	0	0	110.8	V211 F251	V211-S215 WeakPolarHBondContact O-CB 3.43Å; V211-S215 PolarHBondContact O-N 3.17Å; S215-F251 VanDerWaalsContact OG-CB 3.3Å; S215-F251 WeakPolarHBondContact OG-CB 2.89Å
216	K	81.9	Confident	87.5	Confident	170 Å²	170	53.4 Å²	53.4	74%	0.739	26%	0.263	S	S	*	.	H	α-helix	trans	-75	-37.8	177.1	-64	-177	-175.9	-176.9	0	112.8	Q212	Q212-K216 PolarHBondContact O-N 3.47Å
217	N	81.2	Confident	87.9	Confident	98 Å²	98	54.6 Å²	54.6	52%	0.524	26%	0.264	S	S	.	.	S	Bend	trans	-97.6	98.6	178.8	-69.4	-28	0	0	0	110.4	K213 F214 L219	K213-N217 WeakPolarHBondContact O-CB 3.48Å; K213-N217 PolarHBondContact O-N 2.86Å; K213-N217 VanDerWaalsContact O-N 3.15Å; F214-N217 CarbonylContact O-C 3.53Å; N217-L219 PolarHBondContact O-N 3.46Å; N217-L219 VanDerWaalsContact O-N 3.12Å
218	A	74.7	Confident	88.2	Confident	93 Å²	93	54.3 Å²	54.3	77%	0.769	26%	0.262	S	S	*	.			trans	-54.6	118	-177.3	0	0	0	0	0	112.3
219	L	87.3	Confident	88.5	Confident	16 Å²	16	52.8 Å²	52.8	8%	0.084	25%	0.253	C	S	.	.			trans	-68.7	144.5	169.2	-62.6	172.3	0	0	0	109.4	V181 Q189 L193 F214 N217 A224 V225 L228	V181-L219 HydrophobicContact CG1-CD2 4.03Å; Q189-L219 HydrophobicContact CG-CD2 4.25Å; L193-L219 HydrophobicContact CD2-CD1 3.93Å; F214-L219 HydrophobicContact CB-CD1 4.34Å; F214-L219 HydrophobicContact CB-CD2 4.5Å; F214-L219 HydrophobicContact CB-CG 4.35Å; F214-L219 HydrophobicContact CD1-CD2 3.61Å; F214-L219 HydrophobicContact CD1-CG 4.32Å; F214-L219 HydrophobicContact CE1-CD2 4.03Å; F214-L219 HydrophobicContact CG-CD2 4.24Å; N217-L219 PolarHBondContact O-N 3.46Å; N217-L219 VanDerWaalsContact O-N 3.12Å; L219-A224 HydrophobicContact CD1-CB 3.99Å; L219-V225 HydrophobicContact CB-CG2 3.84Å; L219-L228 HydrophobicContact CD1-CB 4.28Å; L219-L228 HydrophobicContact CD1-CD2 3.83Å
220	R	86.9	Confident	88.8	Confident	163 Å²	163	51.8 Å²	51.8	62%	0.615	25%	0.246	S	C	*	.	S	Bend	trans	-86.7	-34.5	-177.5	-63.2	-177.3	-175.5	174	9.4	112.2	D184 P222	D184-R220 IonicContact OD1-CZ 3.46Å; D184-R220 IonicContact OD1-NH1 2.63Å; D184-R220 PolarHBondContact OD1-NH1 2.89Å; D184-R220 IonicContact OD1-NH2 3.78Å; R220-P222 WeakPolarHBondContact O-CD 3.42Å
221	S	91.6	Very high	88.9	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.247	C	C	.	.			trans	-75.1	119.9	-177.7	-177.7	0	0	0	0	111.6	H186 Q189 Y223 A224 V225	H186-S221 VanDerWaalsContact O-CB 3.28Å; H186-S221 WeakPolarHBondContact O-CB 3.37Å; H186-S221 PolarHBondContact O-OG 2.81Å; Q189-S221 VanDerWaalsContact OE1-CB 3.25Å; S221-Y223 PolarHBondContact O-N 3.49Å; S221-A224 PolarHBondContact O-N 3.09Å; S221-A224 VanDerWaalsContact O-N 3.09Å; S221-A224 PolarHBondContact OG-N 3.32Å; S221-V225 WeakPolarHBondContact O-CG2 3.44Å; S221-V225 PolarHBondContact O-N 3.44Å
222	P	92.4	Very high	89	Confident	27 Å²	27	52 Å²	52	18%	0.175	25%	0.247	C	C	.	.	H	α-helix	trans	-57.8	-33.4	173.9	-25.7	35.7	0	0	0	113	R220 V225 C226 M262 V263	R220-P222 WeakPolarHBondContact O-CD 3.42Å; P222-V225 PolarHBondContact O-N 3.19Å; P222-C226 PolarHBondContact O-N 2.62Å; P222-C226 PolarHBondContact O-SG 3.4Å; P222-M262 VanDerWaalsContact C-CE 3.47Å; P222-M262 HydrophobicContact CB-CE 3.72Å; P222-M262 WeakPolarHBondContact O-CE 3.29Å; P222-V263 HydrophobicContact CB-CG2 3.97Å
223	Y	93.4	Very high	89.1	Confident	118 Å²	118	48.4 Å²	48.4	46%	0.463	23%	0.231	S	C	.	.	H	α-helix	trans	-66.9	-41.5	176.7	-57.9	-75.9	0	0	0	111.9	M187 S221 C226 Y227 M262	M187-Y223 HydrophobicContact SD-CD2 4.22Å; M187-Y223 HydrophobicContact SD-CE2 4.3Å; S221-Y223 PolarHBondContact O-N 3.49Å; Y223-C226 PolarHBondContact O-N 3.46Å; Y223-Y227 PolarHBondContact O-N 3.41Å; Y223-M262 HydrophobicContact CD1-CE 3.65Å; Y223-M262 HydrophobicContact CD1-SD 4.18Å; Y223-M262 HydrophobicContact CE1-CE 3.97Å; Y223-M262 HydrophobicContact CE1-SD 4.09Å; Y223-M262 HydrophobicContact CG-CE 4.12Å
224	A	93.1	Very high	89	Confident	0 Å²	0	51 Å²	51	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-67.9	-39.9	177.2	0	0	0	0	0	111.4	Q189 L193 L219 S221 Y227 L228	Q189-A224 HydrophobicContact CG-CB 3.92Å; L193-A224 HydrophobicContact CD2-CB 4.12Å; L193-A224 VanDerWaalsContact CD2-O 3.3Å; L193-A224 WeakPolarHBondContact CD2-O 3.44Å; L219-A224 HydrophobicContact CD1-CB 3.99Å; S221-A224 PolarHBondContact O-N 3.09Å; S221-A224 VanDerWaalsContact O-N 3.09Å; S221-A224 PolarHBondContact OG-N 3.32Å; A224-Y227 PolarHBondContact O-N 3.46Å; A224-L228 WeakPolarHBondContact O-CB 3.49Å; A224-L228 PolarHBondContact O-N 2.97Å
225	V	93.3	Very high	88.8	Confident	8 Å²	8	51.2 Å²	51.2	5%	0.048	24%	0.241	C	C	.	.	H	α-helix	trans	-62.2	-45.5	174.6	179.8	0	0	0	0	111	L219 S221 P222 Y227 L228 I229 F251 V263	L219-V225 HydrophobicContact CB-CG2 3.84Å; S221-V225 WeakPolarHBondContact O-CG2 3.44Å; S221-V225 PolarHBondContact O-N 3.44Å; P222-V225 PolarHBondContact O-N 3.19Å; V225-Y227 VanDerWaalsContact C-N 3.29Å; V225-Y227 PolarHBondContact O-N 2.77Å; V225-L228 WeakPolarHBondContact O-CB 3.44Å; V225-L228 PolarHBondContact O-N 2.91Å; V225-I229 HydrophobicContact CG1-CD1 4.08Å; V225-I229 WeakPolarHBondContact O-CG1 3.21Å; V225-I229 PolarHBondContact O-N 2.78Å; V225-F251 HydrophobicContact CG1-CZ 4.49Å; V225-V263 HydrophobicContact CB-CG1 4.44Å; V225-V263 HydrophobicContact CB-CG2 4.15Å; V225-V263 HydrophobicContact CG1-CG1 3.58Å; V225-V263 HydrophobicContact CG1-CG2 4.18Å
226	C	94.6	Very high	88.6	Confident	8 Å²	8	50.3 Å²	50.3	5%	0.054	23%	0.234	C	C	.	.	H	α-helix	trans	-60.3	-40	176.1	-66.8	0	0	0	0	112	P222 Y223 I229 R230 M262 E266	P222-C226 PolarHBondContact O-N 2.62Å; P222-C226 PolarHBondContact O-SG 3.4Å; Y223-C226 PolarHBondContact O-N 3.46Å; C226-I229 PolarHBondContact O-N 2.79Å; C226-R230 WeakPolarHBondContact O-CG 3.23Å; C226-R230 PolarHBondContact O-N 2.83Å; C226-R230 VanDerWaalsContact O-N 3.14Å; C226-M262 VanDerWaalsContact SG-CE 3.59Å; C226-E266 HydrophobicContact CB-CB 4.36Å; C226-E266 HydrophobicContact CB-CG 4.1Å
227	Y	93.8	Very high	88.5	Confident	43 Å²	43	45.3 Å²	45.3	17%	0.169	22%	0.218	C	C	.	.	H	α-helix	trans	-68	-38.8	176.6	-163.4	-108.4	0	0	0	112.2	Y190 L193 A194 Y197 Y223 A224 V225 R230 I231	Y190-Y227 HydrophobicContact CE2-CD2 4.17Å; Y190-Y227 HydrophobicContact CE2-CG 4.04Å; L193-Y227 HydrophobicContact CD2-CD1 4.17Å; L193-Y227 HydrophobicContact CG-CD1 4.18Å; A194-Y227 HydrophobicContact CB-CD1 4.46Å; A194-Y227 HydrophobicContact CB-CE1 3.93Å; Y197-Y227 HydrophobicContact CD1-CE1 4.31Å; Y197-Y227 WeakPolarHBondContact CD1-OH 3.3Å; Y197-Y227 HydrophobicContact CG-CE1 4.5Å; Y223-Y227 PolarHBondContact O-N 3.41Å; A224-Y227 PolarHBondContact O-N 3.46Å; V225-Y227 VanDerWaalsContact C-N 3.29Å; V225-Y227 PolarHBondContact O-N 2.77Å; Y227-R230 PolarHBondContact O-N 2.77Å; Y227-I231 HydrophobicContact CD1-CD1 3.68Å; Y227-I231 HydrophobicContact CD1-CG1 4.37Å; Y227-I231 HydrophobicContact CE1-CD1 3.62Å; Y227-I231 HydrophobicContact CE1-CG1 4.22Å; Y227-I231 WeakPolarHBondContact O-CG1 3.41Å; Y227-I231 PolarHBondContact O-N 2.85Å
228	L	92.8	Very high	88.3	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-62.7	-41.3	174.2	-174.1	62.1	0	0	0	111.7	L193 L210 V211 F214 L219 A224 V225 R230 I231 A232 F251	L193-L228 HydrophobicContact CD2-CB 4.15Å; L210-L228 HydrophobicContact CD2-CD1 4.23Å; V211-L228 HydrophobicContact CG2-CD1 4.29Å; F214-L228 HydrophobicContact CB-CD1 4.32Å; F214-L228 HydrophobicContact CB-CD2 3.67Å; L219-L228 HydrophobicContact CD1-CB 4.28Å; L219-L228 HydrophobicContact CD1-CD2 3.83Å; A224-L228 WeakPolarHBondContact O-CB 3.49Å; A224-L228 PolarHBondContact O-N 2.97Å; V225-L228 WeakPolarHBondContact O-CB 3.44Å; V225-L228 PolarHBondContact O-N 2.91Å; L228-R230 VanDerWaalsContact C-N 3.33Å; L228-R230 PolarHBondContact O-N 2.8Å; L228-I231 PolarHBondContact O-N 2.85Å; L228-A232 VanDerWaalsContact O-CB 3.27Å; L228-A232 WeakPolarHBondContact O-CB 3.25Å; L228-A232 PolarHBondContact O-N 2.93Å; L228-F251 HydrophobicContact CD2-CE1 3.96Å; L228-F251 HydrophobicContact CD2-CE2 4.32Å; L228-F251 HydrophobicContact CD2-CZ 3.59Å; L228-F251 HydrophobicContact CG-CE1 4.01Å; L228-F251 HydrophobicContact CG-CZ 4.11Å
229	I	92.6	Very high	88	Confident	0 Å²	0	42 Å²	42	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-57.7	-46.7	173.5	-69	163.8	0	0	0	110	V225 C226 I231 A232 T233 F251 I252 C255 V263 E266 A267 A270	V225-I229 HydrophobicContact CG1-CD1 4.08Å; V225-I229 WeakPolarHBondContact O-CG1 3.21Å; V225-I229 PolarHBondContact O-N 2.78Å; C226-I229 PolarHBondContact O-N 2.79Å; I229-I231 PolarHBondContact O-N 2.91Å; I229-A232 WeakPolarHBondContact O-CB 3.36Å; I229-A232 PolarHBondContact O-N 3.45Å; I229-T233 PolarHBondContact O-N 2.97Å; I229-T233 PolarHBondContact O-OG1 2.64Å; I229-F251 HydrophobicContact CG1-CE1 4.13Å; I229-I252 HydrophobicContact CG2-CG2 4.43Å; I229-C255 HydrophobicContact CD1-CB 3.95Å; I229-V263 HydrophobicContact CD1-CG1 4.04Å; I229-E266 HydrophobicContact CB-CG 4.33Å; I229-E266 HydrophobicContact CG2-CG 4.09Å; I229-A267 HydrophobicContact CD1-CB 4.02Å; I229-A270 HydrophobicContact CG2-CB 3.61Å
230	R	92.3	Very high	86.6	Confident	125 Å²	125	46.4 Å²	46.4	47%	0.472	21%	0.211	S	C	.	.	H	α-helix	trans	-60.8	-41.6	177.9	-69	176.9	-174.1	171.3	8.2	113.1	C226 Y227 L228 R234 E266	C226-R230 WeakPolarHBondContact O-CG 3.23Å; C226-R230 PolarHBondContact O-N 2.83Å; C226-R230 VanDerWaalsContact O-N 3.14Å; Y227-R230 PolarHBondContact O-N 2.77Å; L228-R230 VanDerWaalsContact C-N 3.33Å; L228-R230 PolarHBondContact O-N 2.8Å; R230-R234 PolarHBondContact O-N 3.18Å; R230-R234 VanDerWaalsContact O-N 3.1Å; R230-E266 WeakPolarHBondContact CG-OE1 3.4Å; R230-E266 IonicContact CZ-OE1 3.25Å; R230-E266 IonicContact CZ-OE2 2.72Å; R230-E266 IonicContact NE-OE1 3.62Å; R230-E266 PolarHBondContact NE-OE1 2.83Å; R230-E266 IonicContact NE-OE2 2.84Å; R230-E266 PolarHBondContact NE-OE2 3.16Å; R230-E266 IonicContact NH2-OE1 3.25Å; R230-E266 IonicContact NH2-OE2 3.73Å; R230-E266 PolarHBondContact NH2-OE2 2.95Å
231	I	90.4	Very high	85	Confident	5 Å²	5	47.4 Å²	47.4	3%	0.026	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-46.4	175.7	-63.2	163.4	0	0	0	109.8	Y197 V207 V211 Y227 L228 I229 T233 R234 C235	Y197-I231 HydrophobicContact CD1-CD1 4.37Å; Y197-I231 HydrophobicContact CD1-CG1 4.35Å; Y197-I231 HydrophobicContact CD2-CB 4.5Å; Y197-I231 HydrophobicContact CD2-CD1 3.77Å; Y197-I231 HydrophobicContact CD2-CG1 3.83Å; Y197-I231 HydrophobicContact CD2-CG2 3.81Å; Y197-I231 HydrophobicContact CE2-CB 4.5Å; Y197-I231 HydrophobicContact CE2-CD1 4.48Å; Y197-I231 HydrophobicContact CE2-CG1 4.04Å; Y197-I231 HydrophobicContact CE2-CG2 3.75Å; Y197-I231 HydrophobicContact CG-CD1 3.7Å; Y197-I231 HydrophobicContact CG-CG1 4Å; V207-I231 HydrophobicContact CG1-CG2 3.69Å; V211-I231 HydrophobicContact CG2-CB 4.46Å; V211-I231 HydrophobicContact CG2-CG2 3.67Å; Y227-I231 HydrophobicContact CD1-CD1 3.68Å; Y227-I231 HydrophobicContact CD1-CG1 4.37Å; Y227-I231 HydrophobicContact CE1-CD1 3.62Å; Y227-I231 HydrophobicContact CE1-CG1 4.22Å; Y227-I231 WeakPolarHBondContact O-CG1 3.41Å; Y227-I231 PolarHBondContact O-N 2.85Å; L228-I231 PolarHBondContact O-N 2.85Å; I229-I231 PolarHBondContact O-N 2.91Å; I231-T233 PolarHBondContact O-N 3.23Å; I231-R234 PolarHBondContact O-N 3.21Å; I231-C235 PolarHBondContact O-N 3.36Å; I231-C235 PolarHBondContact O-SG 2.87Å
232	A	88.9	Confident	83.2	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.9	-46	178.3	0	0	0	0	0	112.2	V211 L228 I229 R234 C235 L236 V248 I252	V211-A232 HydrophobicContact CG1-CB 3.92Å; L228-A232 VanDerWaalsContact O-CB 3.27Å; L228-A232 WeakPolarHBondContact O-CB 3.25Å; L228-A232 PolarHBondContact O-N 2.93Å; I229-A232 WeakPolarHBondContact O-CB 3.36Å; I229-A232 PolarHBondContact O-N 3.45Å; A232-R234 VanDerWaalsContact C-N 3.34Å; A232-R234 PolarHBondContact O-N 2.81Å; A232-C235 PolarHBondContact O-N 2.88Å; A232-L236 WeakPolarHBondContact O-CG 3.39Å; A232-L236 PolarHBondContact O-N 3.24Å; A232-V248 HydrophobicContact CB-CG1 3.47Å; A232-V248 VanDerWaalsContact CB-CG1 3.47Å; A232-I252 HydrophobicContact CB-CD1 4.08Å; A232-I252 HydrophobicContact CB-CG1 4.33Å
233	T	88.6	Confident	81.6	Confident	16 Å²	16	50.5 Å²	50.5	10%	0.098	24%	0.237	C	C	.	.	H	α-helix	trans	-59.7	-44.4	175.4	-53.4	0	0	0	0	111.4	I229 I231 C235 L236 V237 A270 L274	I229-T233 PolarHBondContact O-N 2.97Å; I229-T233 PolarHBondContact O-OG1 2.64Å; I231-T233 PolarHBondContact O-N 3.23Å; T233-C235 VanDerWaalsContact C-N 3.33Å; T233-C235 PolarHBondContact O-N 3.03Å; T233-L236 PolarHBondContact O-N 3.16Å; T233-V237 WeakPolarHBondContact O-CG2 3.4Å; T233-V237 PolarHBondContact O-N 3.48Å; T233-A270 HydrophobicContact CG2-CB 4.39Å; T233-A270 VanDerWaalsContact OG1-CB 3.23Å; T233-A270 WeakPolarHBondContact OG1-CB 3.45Å; T233-L274 HydrophobicContact CG2-CD2 3.86Å
234	R	86.9	Confident	79.5	Confident	145 Å²	145	49.7 Å²	49.7	55%	0.547	25%	0.245	S	C	.	.	H	α-helix	trans	-60.1	-43.4	177	-173.1	176.5	179.6	168.8	7.8	111.9	Y197 R230 I231 A232 L236 V237 D238	Y197-R234 PolarHBondContact OH-NH1 3.01Å; Y197-R234 VanDerWaalsContact OH-NH1 3.14Å; R230-R234 PolarHBondContact O-N 3.18Å; R230-R234 VanDerWaalsContact O-N 3.1Å; I231-R234 PolarHBondContact O-N 3.21Å; A232-R234 VanDerWaalsContact C-N 3.34Å; A232-R234 PolarHBondContact O-N 2.81Å; R234-L236 VanDerWaalsContact C-N 3.3Å; R234-L236 PolarHBondContact O-N 3.29Å; R234-V237 PolarHBondContact O-N 3.29Å; R234-D238 VanDerWaalsContact O-CG 3.31Å; R234-D238 PolarHBondContact O-N 2.74Å
235	C	83.4	Confident	77.7	Confident	14 Å²	14	57.3 Å²	57.3	10%	0.095	29%	0.286	C	S	.	.	H	α-helix	trans	-61.1	-39.9	176.5	-57.7	0	0	0	0	111.8	V207 I231 A232 T233 D238 D239	V207-C235 VanDerWaalsContact CG1-SG 3.59Å; I231-C235 PolarHBondContact O-N 3.36Å; I231-C235 PolarHBondContact O-SG 2.87Å; A232-C235 PolarHBondContact O-N 2.88Å; T233-C235 VanDerWaalsContact C-N 3.33Å; T233-C235 PolarHBondContact O-N 3.03Å; C235-D238 PolarHBondContact O-N 2.95Å; C235-D239 WeakPolarHBondContact O-CB 3.44Å; C235-D239 PolarHBondContact O-N 3.07Å
236	L	80.3	Confident	76.6	Confident	7 Å²	7	57.8 Å²	57.8	4%	0.037	29%	0.29	C	S	.	.	H	α-helix	trans	-71.2	-25.8	178.1	-70.5	174	0	0	0	114.3	A232 T233 R234 C242 R243 V248 F249 I252 L274	A232-L236 WeakPolarHBondContact O-CG 3.39Å; A232-L236 PolarHBondContact O-N 3.24Å; T233-L236 PolarHBondContact O-N 3.16Å; R234-L236 VanDerWaalsContact C-N 3.3Å; R234-L236 PolarHBondContact O-N 3.29Å; L236-C242 HydrophobicContact CD2-CB 4.34Å; L236-R243 PolarHBondContact O-NH2 3.25Å; L236-V248 HydrophobicContact CD1-CG1 4.04Å; L236-V248 HydrophobicContact CD2-CB 4.23Å; L236-V248 HydrophobicContact CD2-CG1 4.33Å; L236-V248 HydrophobicContact CG-CB 4.44Å; L236-V248 HydrophobicContact CG-CG1 4Å; L236-F249 HydrophobicContact CD1-CB 4.49Å; L236-I252 HydrophobicContact CD1-CD1 3.8Å; L236-L274 HydrophobicContact CB-CD2 3.89Å; L236-L274 HydrophobicContact CD1-CD1 4.28Å; L236-L274 HydrophobicContact CD1-CD2 4.46Å
237	V	80.9	Confident	75.7	Confident	64 Å²	64	59.9 Å²	59.9	39%	0.388	31%	0.305	S	S	.	.	H	α-helix	trans	-76.4	-41.4	173.8	174.1	0	0	0	0	110.1	T233 R234 L274 P275	T233-V237 WeakPolarHBondContact O-CG2 3.4Å; T233-V237 PolarHBondContact O-N 3.48Å; R234-V237 PolarHBondContact O-N 3.29Å; V237-L274 HydrophobicContact CG2-CD2 4Å; V237-P275 HydrophobicContact CG1-CG 4.46Å; V237-P275 HydrophobicContact CG2-CG 4.5Å
238	D	75.9	Confident	75.2	Confident	87 Å²	87	58.2 Å²	58.2	47%	0.465	30%	0.299	S	S	.	.	H	α-helix	trans	-73.4	-27.7	-178.4	-63	-20.8	0	0	0	112.2	R204 R234 C235	R204-D238 PolarHBondContact NH2-O 2.88Å; R234-D238 VanDerWaalsContact O-CG 3.31Å; R234-D238 PolarHBondContact O-N 2.74Å; C235-D238 PolarHBondContact O-N 2.95Å
239	D	69.1	Low	74.8	Confident	36 Å²	36	59.2 Å²	59.2	19%	0.193	30%	0.303	C	S	.	.			trans	-100.3	93.9	179.8	-81	-48.7	0	0	0	112	R204 N208 C235 H241 C242	R204-D239 IonicContact CZ-OD1 3.21Å; R204-D239 IonicContact NE-OD1 3.46Å; R204-D239 PolarHBondContact NE-OD1 3.34Å; R204-D239 IonicContact NE-OD2 3.55Å; R204-D239 IonicContact NH2-OD1 3.02Å; R204-D239 PolarHBondContact NH2-OD1 3.31Å; R204-D239 IonicContact NH2-OD2 2.65Å; N208-D239 PolarHBondContact ND2-OD2 3.5Å; C235-D239 WeakPolarHBondContact O-CB 3.44Å; C235-D239 PolarHBondContact O-N 3.07Å; D239-H241 PolarHBondContact O-N 2.8Å; D239-H241 VanDerWaalsContact O-N 3.16Å; D239-C242 HydrophobicContact CB-CB 4.12Å; D239-C242 PolarHBondContact O-N 2.81Å
240	D	57.1	Low	74.5	Confident	107 Å²	107	63 Å²	63	57%	0.572	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-15.7	176.4	-99.9	-17.1	0	0	0	114	C242 R243	D240-C242 PolarHBondContact O-N 3.25Å; D240-R243 IonicContact OD1-CZ 2.75Å; D240-R243 IonicContact OD1-NH1 2.77Å; D240-R243 PolarHBondContact OD1-NH1 2.98Å; D240-R243 IonicContact OD1-NH2 3.26Å; D240-R243 PolarHBondContact OD1-NH2 2.79Å
241	H	53.7	Low	74.3	Confident	185 Å²	185	58 Å²	58	86%	0.856	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	2.3	-177.1	-71.1	72.5	0	0	0	114.8	D239	D239-H241 PolarHBondContact O-N 2.8Å; D239-H241 VanDerWaalsContact O-N 3.16Å
242	C	53.6	Low	74.3	Confident	45 Å²	45	57.7 Å²	57.7	30%	0.304	31%	0.307	S	S	.	.			trans	-119.4	36.9	-164	-85.4	0	0	0	0	115.4	L236 D239 D240 S246	L236-C242 HydrophobicContact CD2-CB 4.34Å; D239-C242 HydrophobicContact CB-CB 4.12Å; D239-C242 PolarHBondContact O-N 2.81Å; D240-C242 PolarHBondContact O-N 3.25Å; C242-S246 WeakPolarHBondContact O-CB 3.33Å
243	R	58.4	Low	74.2	Confident	47 Å²	47	61.6 Å²	61.6	18%	0.177	33%	0.325	C	S	.	.	S	Bend	trans	-101	-2	-164.7	-76.3	-166	175.9	128.8	17.1	120.2	L236 D240 P275	L236-R243 PolarHBondContact O-NH2 3.25Å; D240-R243 IonicContact OD1-CZ 2.75Å; D240-R243 IonicContact OD1-NH1 2.77Å; D240-R243 PolarHBondContact OD1-NH1 2.98Å; D240-R243 IonicContact OD1-NH2 3.26Å; D240-R243 PolarHBondContact OD1-NH2 2.79Å; R243-P275 PolarHBondContact NE-O 3.35Å
244	P	50.5	Low	74.3	Confident	100 Å²	100	64.2 Å²	64.2	65%	0.649	34%	0.344	S	S	*	.	S	Bend	trans	-127.8	-37.5	160.6	6	16.4	0	0	0	116.6
245	D	53.7	Low	74.5	Confident	161 Å²	161	57.7 Å²	57.7	86%	0.861	32%	0.32	S	S	*	.	S	Bend	trans	-100.7	12.1	-174.1	-70.2	-35.7	0	0	0	113.9	S247	D245-S247 PolarHBondContact O-N 3.34Å; D245-S247 VanDerWaalsContact O-N 3.15Å
246	S	70.4	Confident	74.9	Confident	18 Å²	18	57.9 Å²	57.9	13%	0.126	32%	0.321	C	S	.	.			trans	-69.2	117.3	178.6	-178	0	0	0	0	109.8	C242 V248 F249 T250	C242-S246 WeakPolarHBondContact O-CB 3.33Å; S246-V248 PolarHBondContact O-N 3.4Å; S246-V248 WeakPolarHBondContact OG-CB 3.26Å; S246-V248 PolarHBondContact OG-N 2.92Å; S246-F249 PolarHBondContact O-N 3.01Å; S246-T250 PolarHBondContact O-N 3.24Å
247	S	76.8	Confident	75.3	Confident	51 Å²	51	68.6 Å²	68.6	36%	0.357	36%	0.361	S	S	.	.	H	α-helix	trans	-48	-19.6	169.2	61.2	0	0	0	0	114.2	D245 F251	D245-S247 PolarHBondContact O-N 3.34Å; D245-S247 VanDerWaalsContact O-N 3.15Å; S247-F251 PolarHBondContact O-N 2.82Å
248	V	81.9	Confident	75.8	Confident	9 Å²	9	68.8 Å²	68.8	6%	0.055	36%	0.357	C	S	.	.	H	α-helix	trans	-74.6	-41.4	175	-175.3	0	0	0	0	111.7	V211 A232 L236 S246 F251 I252	V211-V248 HydrophobicContact CG1-CG1 3.93Å; V211-V248 HydrophobicContact CG1-CG2 4Å; A232-V248 HydrophobicContact CB-CG1 3.47Å; A232-V248 VanDerWaalsContact CB-CG1 3.47Å; L236-V248 HydrophobicContact CD1-CG1 4.04Å; L236-V248 HydrophobicContact CD2-CB 4.23Å; L236-V248 HydrophobicContact CD2-CG1 4.33Å; L236-V248 HydrophobicContact CG-CB 4.44Å; L236-V248 HydrophobicContact CG-CG1 4Å; S246-V248 PolarHBondContact O-N 3.4Å; S246-V248 WeakPolarHBondContact OG-CB 3.26Å; S246-V248 PolarHBondContact OG-N 2.92Å; V248-F251 WeakPolarHBondContact O-CB 3.41Å; V248-F251 PolarHBondContact O-N 2.72Å; V248-I252 WeakPolarHBondContact O-CG1 3.22Å; V248-I252 PolarHBondContact O-N 3.13Å
249	F	84.6	Confident	76.5	Confident	21 Å²	21	74.7 Å²	74.7	9%	0.092	38%	0.379	C	S	.	.	H	α-helix	trans	-67.5	-46.5	177.3	-174.9	-92.2	0	0	0	111.1	L236 S246 F251 I252 E253 I271 L274 E281	L236-F249 HydrophobicContact CD1-CB 4.49Å; S246-F249 PolarHBondContact O-N 3.01Å; F249-F251 PolarHBondContact O-N 2.74Å; F249-F251 VanDerWaalsContact O-N 3.17Å; F249-I252 PolarHBondContact O-N 3.13Å; F249-E253 PolarHBondContact O-N 2.89Å; F249-I271 HydrophobicContact CE2-CG1 4.48Å; F249-L274 HydrophobicContact CD2-CD1 4.19Å; F249-L274 HydrophobicContact CE2-CD1 4.13Å; F249-E281 HydrophobicContact CE1-CG 4.34Å; F249-E281 HydrophobicContact CZ-CB 3.99Å; F249-E281 HydrophobicContact CZ-CG 3.88Å
250	T	86.4	Confident	77.5	Confident	81 Å²	81	74.4 Å²	74.4	50%	0.497	38%	0.379	S	S	.	.	H	α-helix	trans	-56.2	-34.7	175.3	-44.3	0	0	0	0	112.1	S246 S254	S246-T250 PolarHBondContact O-N 3.24Å; T250-S254 WeakPolarHBondContact O-CB 3.46Å; T250-S254 PolarHBondContact O-N 3.38Å
251	F	89	Confident	79	Confident	18 Å²	18	72.7 Å²	72.7	8%	0.079	37%	0.368	C	S	.	.	H	α-helix	trans	-65.4	-48.1	173.9	166.3	-103.4	0	0	0	112.5	S215 V225 L228 I229 S247 V248 F249 E253 S254 C255	S215-F251 VanDerWaalsContact OG-CB 3.3Å; S215-F251 WeakPolarHBondContact OG-CB 2.89Å; V225-F251 HydrophobicContact CG1-CZ 4.49Å; L228-F251 HydrophobicContact CD2-CE1 3.96Å; L228-F251 HydrophobicContact CD2-CE2 4.32Å; L228-F251 HydrophobicContact CD2-CZ 3.59Å; L228-F251 HydrophobicContact CG-CE1 4.01Å; L228-F251 HydrophobicContact CG-CZ 4.11Å; I229-F251 HydrophobicContact CG1-CE1 4.13Å; S247-F251 PolarHBondContact O-N 2.82Å; V248-F251 WeakPolarHBondContact O-CB 3.41Å; V248-F251 PolarHBondContact O-N 2.72Å; F249-F251 PolarHBondContact O-N 2.74Å; F249-F251 VanDerWaalsContact O-N 3.17Å; F251-E253 VanDerWaalsContact C-N 3.29Å; F251-E253 PolarHBondContact O-N 2.93Å; F251-S254 PolarHBondContact O-N 3.25Å; F251-S254 PolarHBondContact O-OG 3.48Å; F251-C255 PolarHBondContact O-N 2.84Å; F251-C255 VanDerWaalsContact O-N 3.12Å; F251-C255 PolarHBondContact O-SG 3.28Å
252	I	89.3	Confident	80.8	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.5	-41.7	177.8	-60.3	171.5	0	0	0	110	I229 A232 L236 V248 F249 S254 C255 A267 A270 I271	I229-I252 HydrophobicContact CG2-CG2 4.43Å; A232-I252 HydrophobicContact CB-CD1 4.08Å; A232-I252 HydrophobicContact CB-CG1 4.33Å; L236-I252 HydrophobicContact CD1-CD1 3.8Å; V248-I252 WeakPolarHBondContact O-CG1 3.22Å; V248-I252 PolarHBondContact O-N 3.13Å; F249-I252 PolarHBondContact O-N 3.13Å; I252-S254 PolarHBondContact O-N 2.95Å; I252-C255 VanDerWaalsContact O-CB 3.32Å; I252-C255 WeakPolarHBondContact O-CB 3.46Å; I252-C255 PolarHBondContact O-N 3.33Å; I252-C255 VanDerWaalsContact O-N 3.12Å; I252-A267 HydrophobicContact CG2-CB 4.16Å; I252-A270 HydrophobicContact CG2-CB 4.2Å; I252-I271 HydrophobicContact CG2-CD1 4.05Å; I252-I271 HydrophobicContact CG2-CG1 3.69Å
253	E	88.5	Confident	82.7	Confident	82 Å²	82	65.3 Å²	65.3	38%	0.383	33%	0.33	S	S	.	.	H	α-helix	trans	-61.6	-43.2	176	-167.4	-174	179.7	0	0	111.9	F249 F251 C255 L256	F249-E253 PolarHBondContact O-N 2.89Å; F251-E253 VanDerWaalsContact C-N 3.29Å; F251-E253 PolarHBondContact O-N 2.93Å; E253-C255 PolarHBondContact O-N 3.48Å; E253-L256 HydrophobicContact CG-CD1 4.29Å; E253-L256 VanDerWaalsContact O-CB 3.26Å; E253-L256 WeakPolarHBondContact O-CB 3.36Å; E253-L256 WeakPolarHBondContact O-CG 3.49Å; E253-L256 PolarHBondContact O-N 3.22Å
254	S	89.9	Confident	84.4	Confident	71 Å²	71	64 Å²	64	50%	0.497	33%	0.327	S	S	.	.	H	α-helix	trans	-60.8	-30.2	175.9	79.7	0	0	0	0	112.7	T250 F251 I252 L256 R257	T250-S254 WeakPolarHBondContact O-CB 3.46Å; T250-S254 PolarHBondContact O-N 3.38Å; F251-S254 PolarHBondContact O-N 3.25Å; F251-S254 PolarHBondContact O-OG 3.48Å; I252-S254 PolarHBondContact O-N 2.95Å; S254-L256 PolarHBondContact O-N 2.93Å; S254-R257 PolarHBondContact O-N 3.4Å
255	C	91.3	Very high	86.5	Confident	7 Å²	7	61.2 Å²	61.2	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-69.6	-17.2	178.2	-67.7	0	0	0	0	113.2	I229 F251 I252 E253 R257 H258 V263 A267	I229-C255 HydrophobicContact CD1-CB 3.95Å; F251-C255 PolarHBondContact O-N 2.84Å; F251-C255 VanDerWaalsContact O-N 3.12Å; F251-C255 PolarHBondContact O-SG 3.28Å; I252-C255 VanDerWaalsContact O-CB 3.32Å; I252-C255 WeakPolarHBondContact O-CB 3.46Å; I252-C255 PolarHBondContact O-N 3.33Å; I252-C255 VanDerWaalsContact O-N 3.12Å; E253-C255 PolarHBondContact O-N 3.48Å; C255-R257 PolarHBondContact O-N 3.49Å; C255-H258 WeakPolarHBondContact O-CB 3.22Å; C255-H258 PolarHBondContact O-N 2.67Å; C255-H258 VanDerWaalsContact O-N 3.16Å; C255-V263 HydrophobicContact CB-CG1 3.99Å; C255-A267 HydrophobicContact CB-CB 3.73Å
256	L	91.3	Very high	88.4	Confident	19 Å²	19	54.3 Å²	54.3	10%	0.099	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-22.7	174.3	-64.3	174.3	0	0	0	113	E253 S254 V264 A267 A268 I271 P284 A288	E253-L256 HydrophobicContact CG-CD1 4.29Å; E253-L256 VanDerWaalsContact O-CB 3.26Å; E253-L256 WeakPolarHBondContact O-CB 3.36Å; E253-L256 WeakPolarHBondContact O-CG 3.49Å; E253-L256 PolarHBondContact O-N 3.22Å; S254-L256 PolarHBondContact O-N 2.93Å; L256-V264 WeakPolarHBondContact O-CG1 3.15Å; L256-V264 WeakPolarHBondContact O-CG2 3.15Å; L256-A267 HydrophobicContact CD2-CB 3.9Å; L256-A267 HydrophobicContact CG-CB 4.4Å; L256-A268 HydrophobicContact CD2-CB 3.83Å; L256-I271 HydrophobicContact CD1-CD1 3.77Å; L256-I271 HydrophobicContact CD2-CD1 4.19Å; L256-I271 HydrophobicContact CG-CD1 4.13Å; L256-P284 HydrophobicContact CD1-CB 3.77Å; L256-A288 HydrophobicContact CD2-CB 3.94Å
257	R	89.7	Confident	89.5	Confident	232 Å²	232	53.5 Å²	53.5	88%	0.875	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	13.2	178.5	-59.8	-177	-175.5	174.7	3.8	113	S254 C255	S254-R257 PolarHBondContact O-N 3.4Å; C255-R257 PolarHBondContact O-N 3.49Å
258	H	91.6	Very high	90.3	Very high	68 Å²	68	51 Å²	51	32%	0.315	24%	0.244	S	C	.	.			trans	-69.8	151.7	-177.2	-168.5	-95.7	0	0	0	112.2	C255 S260 V263 V264	C255-H258 WeakPolarHBondContact O-CB 3.22Å; C255-H258 PolarHBondContact O-N 2.67Å; C255-H258 VanDerWaalsContact O-N 3.16Å; H258-S260 PolarHBondContact ND1-N 3.17Å; H258-S260 VanDerWaalsContact ND1-N 3.16Å; H258-S260 PolarHBondContact O-N 3.27Å; H258-V263 HydrophobicContact CB-CB 4.07Å; H258-V263 HydrophobicContact CB-CG1 3.68Å; H258-V264 HydrophobicContact CB-CG2 4.3Å; H258-V264 WeakPolarHBondContact O-CG2 3.37Å
259	K	89.6	Confident	90.8	Very high	211 Å²	211	56.4 Å²	56.4	92%	0.917	26%	0.263	S	S	*	.	S	Bend	trans	-66.7	-22.2	-177.6	-63.6	-176.7	-179.2	-180	0	114.4
260	S	90.5	Very high	91.1	Very high	30 Å²	30	55.6 Å²	55.6	21%	0.21	26%	0.26	C	S	.	.	S	Bend	trans	-98.7	119.7	-176.9	174.1	0	0	0	0	110.8	H258 M262 V263 V264	H258-S260 PolarHBondContact ND1-N 3.17Å; H258-S260 VanDerWaalsContact ND1-N 3.16Å; H258-S260 PolarHBondContact O-N 3.27Å; S260-M262 PolarHBondContact O-N 3.35Å; S260-M262 VanDerWaalsContact O-N 3.11Å; S260-V263 PolarHBondContact O-N 2.96Å; S260-V264 PolarHBondContact O-N 3Å
261	E	89	Confident	91.2	Very high	71 Å²	71	51.8 Å²	51.8	33%	0.332	24%	0.237	S	C	.	.	H	α-helix	trans	-50.7	-36.6	176.4	-64.6	177	132.9	0	0	112.5	V263 V264 Y265 S295 K297	E261-V263 VanDerWaalsContact C-N 3.34Å; E261-V263 PolarHBondContact O-N 2.82Å; E261-V264 PolarHBondContact O-N 3.5Å; E261-Y265 WeakPolarHBondContact O-CB 3.44Å; E261-Y265 PolarHBondContact O-N 2.87Å; E261-S295 PolarHBondContact OE1-OG 3.18Å; E261-K297 IonicContact OE2-NZ 3.95Å; E261-K297 PolarHBondContact OE2-NZ 2.77Å
262	M	91.3	Very high	91.2	Very high	75 Å²	75	52.2 Å²	52.2	37%	0.369	24%	0.241	S	C	.	.	H	α-helix	trans	-61.6	-39.7	178.3	-173.8	-179.9	75.9	0	0	112.7	P222 Y223 C226 S260 E266	P222-M262 VanDerWaalsContact C-CE 3.47Å; P222-M262 HydrophobicContact CB-CE 3.72Å; P222-M262 WeakPolarHBondContact O-CE 3.29Å; Y223-M262 HydrophobicContact CD1-CE 3.65Å; Y223-M262 HydrophobicContact CD1-SD 4.18Å; Y223-M262 HydrophobicContact CE1-CE 3.97Å; Y223-M262 HydrophobicContact CE1-SD 4.09Å; Y223-M262 HydrophobicContact CG-CE 4.12Å; C226-M262 VanDerWaalsContact SG-CE 3.59Å; S260-M262 PolarHBondContact O-N 3.35Å; S260-M262 VanDerWaalsContact O-N 3.11Å; M262-E266 WeakPolarHBondContact O-CB 3.39Å; M262-E266 PolarHBondContact O-N 3.36Å
263	V	93.7	Very high	91.1	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-73.8	-42.4	-179.6	173.9	0	0	0	0	110	P222 V225 I229 C255 H258 S260 E261 Y265 E266 A267	P222-V263 HydrophobicContact CB-CG2 3.97Å; V225-V263 HydrophobicContact CB-CG1 4.44Å; V225-V263 HydrophobicContact CB-CG2 4.15Å; V225-V263 HydrophobicContact CG1-CG1 3.58Å; V225-V263 HydrophobicContact CG1-CG2 4.18Å; I229-V263 HydrophobicContact CD1-CG1 4.04Å; C255-V263 HydrophobicContact CB-CG1 3.99Å; H258-V263 HydrophobicContact CB-CB 4.07Å; H258-V263 HydrophobicContact CB-CG1 3.68Å; S260-V263 PolarHBondContact O-N 2.96Å; E261-V263 VanDerWaalsContact C-N 3.34Å; E261-V263 PolarHBondContact O-N 2.82Å; V263-Y265 VanDerWaalsContact C-N 3.33Å; V263-Y265 PolarHBondContact O-N 3.16Å; V263-E266 PolarHBondContact O-N 3.32Å; V263-A267 VanDerWaalsContact O-CB 3.31Å; V263-A267 WeakPolarHBondContact O-CB 3.19Å; V263-A267 PolarHBondContact O-N 2.84Å
264	V	93.8	Very high	90.9	Very high	19 Å²	19	51.8 Å²	51.8	12%	0.115	25%	0.246	C	C	.	.	H	α-helix	trans	-59	-46.8	176.4	176.5	0	0	0	0	110.6	L256 H258 S260 E261 A267 A268 A288	L256-V264 WeakPolarHBondContact O-CG1 3.15Å; L256-V264 WeakPolarHBondContact O-CG2 3.15Å; H258-V264 HydrophobicContact CB-CG2 4.3Å; H258-V264 WeakPolarHBondContact O-CG2 3.37Å; S260-V264 PolarHBondContact O-N 3Å; E261-V264 PolarHBondContact O-N 3.5Å; V264-A267 PolarHBondContact O-N 3.27Å; V264-A268 WeakPolarHBondContact O-CB 3.38Å; V264-A268 PolarHBondContact O-N 2.65Å; V264-A288 HydrophobicContact CG1-CB 3.87Å
265	Y	94	Very high	90.1	Very high	42 Å²	42	51.1 Å²	51.1	17%	0.165	24%	0.24	C	C	.	.	H	α-helix	trans	-64.3	-45.5	177.7	176.5	-100.1	0	0	0	112.6	E261 V263 A267 A268 R269 L289 A303 T307	E261-Y265 WeakPolarHBondContact O-CB 3.44Å; E261-Y265 PolarHBondContact O-N 2.87Å; V263-Y265 VanDerWaalsContact C-N 3.33Å; V263-Y265 PolarHBondContact O-N 3.16Å; Y265-A267 VanDerWaalsContact C-N 3.34Å; Y265-A267 PolarHBondContact O-N 2.94Å; Y265-A268 PolarHBondContact O-N 3.46Å; Y265-R269 VanDerWaalsContact O-CB 3.32Å; Y265-R269 WeakPolarHBondContact O-CB 3.47Å; Y265-R269 PolarHBondContact O-N 3.27Å; Y265-L289 HydrophobicContact CD2-CD2 3.93Å; Y265-L289 HydrophobicContact CE2-CD2 4.03Å; Y265-A303 HydrophobicContact CD2-CB 4.3Å; Y265-A303 HydrophobicContact CE1-CB 4.05Å; Y265-A303 VanDerWaalsContact CE2-C 3.42Å; Y265-A303 HydrophobicContact CE2-CB 3.67Å; Y265-A303 VanDerWaalsContact CE2-O 3.28Å; Y265-A303 WeakPolarHBondContact CE2-O 3.49Å; Y265-A303 PolarHBondContact OH-O 3.13Å; Y265-A303 VanDerWaalsContact OH-O 3.08Å; Y265-T307 WeakPolarHBondContact CE2-OG1 3.29Å; Y265-T307 PolarHBondContact OH-OG1 3.23Å
266	E	94.5	Very high	89.1	Confident	16 Å²	16	58.3 Å²	58.3	8%	0.075	27%	0.272	C	S	.	.	H	α-helix	trans	-63.7	-40.5	179.2	-170.8	73.3	-151.9	0	0	111.3	C226 I229 R230 M262 V263 R269 A270	C226-E266 HydrophobicContact CB-CB 4.36Å; C226-E266 HydrophobicContact CB-CG 4.1Å; I229-E266 HydrophobicContact CB-CG 4.33Å; I229-E266 HydrophobicContact CG2-CG 4.09Å; R230-E266 WeakPolarHBondContact CG-OE1 3.4Å; R230-E266 IonicContact CZ-OE1 3.25Å; R230-E266 IonicContact CZ-OE2 2.72Å; R230-E266 IonicContact NE-OE1 3.62Å; R230-E266 PolarHBondContact NE-OE1 2.83Å; R230-E266 IonicContact NE-OE2 2.84Å; R230-E266 PolarHBondContact NE-OE2 3.16Å; R230-E266 IonicContact NH2-OE1 3.25Å; R230-E266 IonicContact NH2-OE2 3.73Å; R230-E266 PolarHBondContact NH2-OE2 2.95Å; M262-E266 WeakPolarHBondContact O-CB 3.39Å; M262-E266 PolarHBondContact O-N 3.36Å; V263-E266 PolarHBondContact O-N 3.32Å; E266-R269 PolarHBondContact O-N 3.03Å; E266-A270 VanDerWaalsContact O-CB 3.25Å; E266-A270 WeakPolarHBondContact O-CB 3.42Å; E266-A270 PolarHBondContact O-N 2.84Å
267	A	93.3	Very high	88.1	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.8	-46.4	174.5	0	0	0	0	0	112.1	I229 I252 C255 L256 V263 V264 Y265 A270 I271	I229-A267 HydrophobicContact CD1-CB 4.02Å; I252-A267 HydrophobicContact CG2-CB 4.16Å; C255-A267 HydrophobicContact CB-CB 3.73Å; L256-A267 HydrophobicContact CD2-CB 3.9Å; L256-A267 HydrophobicContact CG-CB 4.4Å; V263-A267 VanDerWaalsContact O-CB 3.31Å; V263-A267 WeakPolarHBondContact O-CB 3.19Å; V263-A267 PolarHBondContact O-N 2.84Å; V264-A267 PolarHBondContact O-N 3.27Å; Y265-A267 VanDerWaalsContact C-N 3.34Å; Y265-A267 PolarHBondContact O-N 2.94Å; A267-A270 WeakPolarHBondContact O-CB 3.29Å; A267-A270 PolarHBondContact O-N 3Å; A267-I271 WeakPolarHBondContact O-CG1 3.36Å; A267-I271 PolarHBondContact O-N 3.46Å
268	A	92.9	Very high	87.6	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.8	-43.5	177.8	0	0	0	0	0	111.7	L256 V264 Y265 A270 I271 V272 A285 A288 L289	L256-A268 HydrophobicContact CD2-CB 3.83Å; V264-A268 WeakPolarHBondContact O-CB 3.38Å; V264-A268 PolarHBondContact O-N 2.65Å; Y265-A268 PolarHBondContact O-N 3.46Å; A268-A270 VanDerWaalsContact C-N 3.33Å; A268-A270 PolarHBondContact O-N 2.92Å; A268-I271 PolarHBondContact O-N 2.87Å; A268-V272 WeakPolarHBondContact O-CG2 3.45Å; A268-V272 PolarHBondContact O-N 3.44Å; A268-A285 HydrophobicContact CB-CB 4.18Å; A268-A288 HydrophobicContact CB-CB 4.34Å; A268-L289 HydrophobicContact CB-CD1 4.5Å; A268-L289 HydrophobicContact CB-CD2 3.97Å; A268-L289 HydrophobicContact CB-CG 3.89Å
269	R	92.6	Very high	87	Confident	122 Å²	122	50.5 Å²	50.5	46%	0.46	26%	0.258	S	S	.	.	H	α-helix	trans	-61.1	-42.6	175.2	-179.3	-176.2	172.8	-151.8	-0.7	111.7	Y265 E266 S273	Y265-R269 VanDerWaalsContact O-CB 3.32Å; Y265-R269 WeakPolarHBondContact O-CB 3.47Å; Y265-R269 PolarHBondContact O-N 3.27Å; E266-R269 PolarHBondContact O-N 3.03Å; R269-S273 WeakPolarHBondContact O-CB 3.48Å; R269-S273 PolarHBondContact O-N 3.3Å; R269-S273 VanDerWaalsContact O-N 3.07Å; R269-S273 PolarHBondContact O-OG 2.87Å
270	A	90.8	Very high	86.5	Confident	4 Å²	4	44.7 Å²	44.7	3%	0.033	24%	0.244	C	C	.	.	H	α-helix	trans	-58.9	-51.6	178.3	0	0	0	0	0	111.4	I229 T233 I252 E266 A267 A268 V272 S273 L274	I229-A270 HydrophobicContact CG2-CB 3.61Å; T233-A270 HydrophobicContact CG2-CB 4.39Å; T233-A270 VanDerWaalsContact OG1-CB 3.23Å; T233-A270 WeakPolarHBondContact OG1-CB 3.45Å; I252-A270 HydrophobicContact CG2-CB 4.2Å; E266-A270 VanDerWaalsContact O-CB 3.25Å; E266-A270 WeakPolarHBondContact O-CB 3.42Å; E266-A270 PolarHBondContact O-N 2.84Å; A267-A270 WeakPolarHBondContact O-CB 3.29Å; A267-A270 PolarHBondContact O-N 3Å; A268-A270 VanDerWaalsContact C-N 3.33Å; A268-A270 PolarHBondContact O-N 2.92Å; A270-V272 PolarHBondContact O-N 3.25Å; A270-S273 WeakPolarHBondContact CA-OG 3.48Å; A270-S273 PolarHBondContact O-N 3.33Å; A270-S273 VanDerWaalsContact O-N 3.11Å; A270-S273 PolarHBondContact O-OG 3.31Å; A270-L274 PolarHBondContact O-N 2.82Å
271	I	89.4	Confident	86.1	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-57.1	-49.1	-180	-67.8	167.9	0	0	0	110.6	F249 I252 L256 A267 A268 S273 L274 T277 A285	F249-I271 HydrophobicContact CE2-CG1 4.48Å; I252-I271 HydrophobicContact CG2-CD1 4.05Å; I252-I271 HydrophobicContact CG2-CG1 3.69Å; L256-I271 HydrophobicContact CD1-CD1 3.77Å; L256-I271 HydrophobicContact CD2-CD1 4.19Å; L256-I271 HydrophobicContact CG-CD1 4.13Å; A267-I271 WeakPolarHBondContact O-CG1 3.36Å; A267-I271 PolarHBondContact O-N 3.46Å; A268-I271 PolarHBondContact O-N 2.87Å; I271-S273 PolarHBondContact O-N 2.81Å; I271-L274 PolarHBondContact O-N 3.47Å; I271-T277 WeakPolarHBondContact O-CG2 3.46Å; I271-A285 HydrophobicContact CB-CB 4.03Å; I271-A285 HydrophobicContact CD1-CB 4.23Å; I271-A285 HydrophobicContact CG2-CB 3.96Å
272	V	88.4	Confident	86	Confident	26 Å²	26	42 Å²	42	16%	0.158	23%	0.228	C	C	.	.	H	α-helix	trans	-74.2	-13.1	-177.3	-167.7	0	0	0	0	113.6	A268 A270 I282 A285 V311	A268-V272 WeakPolarHBondContact O-CG2 3.45Å; A268-V272 PolarHBondContact O-N 3.44Å; A270-V272 PolarHBondContact O-N 3.25Å; V272-I282 HydrophobicContact CG2-CG2 4.27Å; V272-A285 HydrophobicContact CG2-CB 4.01Å; V272-V311 HydrophobicContact CB-CG2 4.1Å; V272-V311 HydrophobicContact CG1-CB 3.92Å; V272-V311 HydrophobicContact CG1-CG1 3.76Å; V272-V311 HydrophobicContact CG1-CG2 3.22Å; V272-V311 HydrophobicContact CG2-CG2 4.12Å
273	S	87.2	Confident	85.9	Confident	59 Å²	59	42 Å²	42	41%	0.413	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-7.3	176	65.7	0	0	0	0	114.2	R269 A270 I271	R269-S273 WeakPolarHBondContact O-CB 3.48Å; R269-S273 PolarHBondContact O-N 3.3Å; R269-S273 VanDerWaalsContact O-N 3.07Å; R269-S273 PolarHBondContact O-OG 2.87Å; A270-S273 WeakPolarHBondContact CA-OG 3.48Å; A270-S273 PolarHBondContact O-N 3.33Å; A270-S273 VanDerWaalsContact O-N 3.11Å; A270-S273 PolarHBondContact O-OG 3.31Å; I271-S273 PolarHBondContact O-N 2.81Å
274	L	84.3	Confident	85.7	Confident	15 Å²	15	44.1 Å²	44.1	8%	0.079	24%	0.241	C	C	.	.	S	Bend	trans	-71.4	141.8	-179.8	-70	170.1	0	0	0	111.1	T233 L236 V237 F249 A270 I271 T277	T233-L274 HydrophobicContact CG2-CD2 3.86Å; L236-L274 HydrophobicContact CB-CD2 3.89Å; L236-L274 HydrophobicContact CD1-CD1 4.28Å; L236-L274 HydrophobicContact CD1-CD2 4.46Å; V237-L274 HydrophobicContact CG2-CD2 4Å; F249-L274 HydrophobicContact CD2-CD1 4.19Å; F249-L274 HydrophobicContact CE2-CD1 4.13Å; A270-L274 PolarHBondContact O-N 2.82Å; I271-L274 PolarHBondContact O-N 3.47Å; L274-T277 HydrophobicContact CB-CG2 3.62Å; L274-T277 WeakPolarHBondContact O-CG2 3.29Å
275	P	73.1	Confident	85.6	Confident	56 Å²	56	43.2 Å²	43.2	36%	0.364	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	145.7	171.8	1.5	9.9	0	0	0	110.6	V237 R243 T277	V237-P275 HydrophobicContact CG1-CG 4.46Å; V237-P275 HydrophobicContact CG2-CG 4.5Å; R243-P275 PolarHBondContact NE-O 3.35Å; P275-T277 PolarHBondContact O-N 3.16Å
276	Q	69.2	Low	85.5	Confident	158 Å²	158	41.2 Å²	41.2	74%	0.738	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	34	173.8	-55.7	175.1	-16.1	0	0	115.8
277	T	72.2	Confident	85.4	Confident	17 Å²	17	43.7 Å²	43.7	10%	0.104	24%	0.244	C	C	.	.			trans	-70.5	137.4	177.4	46.5	0	0	0	0	113.1	I271 L274 P275 I282	I271-T277 WeakPolarHBondContact O-CG2 3.46Å; L274-T277 HydrophobicContact CB-CG2 3.62Å; L274-T277 WeakPolarHBondContact O-CG2 3.29Å; P275-T277 PolarHBondContact O-N 3.16Å; T277-I282 VanDerWaalsContact OG1-CD1 3.25Å; T277-I282 WeakPolarHBondContact OG1-CD1 3.31Å
278	T	79	Confident	85.3	Confident	53 Å²	53	44.2 Å²	44.2	33%	0.325	25%	0.248	S	C	.	.			trans	-79.6	151.4	174.3	66.2	0	0	0	0	111.8	S280 E281 I282	T278-S280 PolarHBondContact O-N 2.84Å; T278-S280 VanDerWaalsContact O-N 3.14Å; T278-S280 PolarHBondContact OG1-OG 2.88Å; T278-E281 PolarHBondContact N-OE2 3.02Å; T278-E281 VanDerWaalsContact N-OE2 3.1Å; T278-E281 PolarHBondContact O-N 2.93Å; T278-E281 VanDerWaalsContact O-N 3.08Å; T278-E281 VanDerWaalsContact OG1-CG 3.28Å; T278-E281 WeakPolarHBondContact OG1-CG 3.43Å; T278-E281 PolarHBondContact OG1-OE1 2.81Å; T278-I282 WeakPolarHBondContact O-CG1 3.28Å; T278-I282 PolarHBondContact O-N 3.36Å
279	P	77.5	Confident	85.3	Confident	85 Å²	85	44.2 Å²	44.2	55%	0.552	25%	0.248	S	C	*	.	H	α-helix	trans	-56.1	-30.8	176.8	-27.2	35.5	0	0	0	114.1	Q283	P279-Q283 PolarHBondContact O-N 3.02Å
280	S	80.1	Confident	85.3	Confident	90 Å²	90	40.7 Å²	40.7	63%	0.629	24%	0.237	S	C	*	.	H	α-helix	trans	-67.4	-37.7	175.9	36.9	0	0	0	0	113.4	T278 P284	T278-S280 PolarHBondContact O-N 2.84Å; T278-S280 VanDerWaalsContact O-N 3.14Å; T278-S280 PolarHBondContact OG1-OG 2.88Å; S280-P284 VanDerWaalsContact O-CD 3.31Å; S280-P284 WeakPolarHBondContact O-CD 3.13Å
281	E	81.3	Confident	85.2	Confident	45 Å²	45	46.6 Å²	46.6	21%	0.21	27%	0.266	C	S	.	.	H	α-helix	trans	-71.9	-32.3	178.6	-74.2	153.9	-146.1	0	0	112.3	F249 T278 P284	F249-E281 HydrophobicContact CE1-CG 4.34Å; F249-E281 HydrophobicContact CZ-CB 3.99Å; F249-E281 HydrophobicContact CZ-CG 3.88Å; T278-E281 PolarHBondContact N-OE2 3.02Å; T278-E281 VanDerWaalsContact N-OE2 3.1Å; T278-E281 PolarHBondContact O-N 2.93Å; T278-E281 VanDerWaalsContact O-N 3.08Å; T278-E281 VanDerWaalsContact OG1-CG 3.28Å; T278-E281 WeakPolarHBondContact OG1-CG 3.43Å; T278-E281 PolarHBondContact OG1-OE1 2.81Å; E281-P284 WeakPolarHBondContact O-CD 3.41Å
282	I	86.8	Confident	85.3	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-77.3	-29.6	-177.3	-62.5	172.3	0	0	0	111.3	V272 T277 T278 A285 I286 V311 H315	V272-I282 HydrophobicContact CG2-CG2 4.27Å; T277-I282 VanDerWaalsContact OG1-CD1 3.25Å; T277-I282 WeakPolarHBondContact OG1-CD1 3.31Å; T278-I282 WeakPolarHBondContact O-CG1 3.28Å; T278-I282 PolarHBondContact O-N 3.36Å; I282-A285 WeakPolarHBondContact O-CB 3.49Å; I282-A285 PolarHBondContact O-N 3.36Å; I282-I286 HydrophobicContact CG2-CD1 3.55Å; I282-I286 HydrophobicContact CG2-CG1 3.76Å; I282-I286 PolarHBondContact O-N 2.98Å; I282-V311 HydrophobicContact CG2-CG1 4.27Å; I282-H315 WeakPolarHBondContact CD1-CD2 3.46Å
283	Q	89.3	Confident	85.3	Confident	74 Å²	74	45.9 Å²	45.9	35%	0.346	26%	0.262	S	S	.	.	H	α-helix	trans	-59	-44.6	-172.2	-168.7	62.7	47.2	0	0	114	P279 A285 I286 T287	P279-Q283 PolarHBondContact O-N 3.02Å; Q283-A285 VanDerWaalsContact C-N 3.3Å; Q283-A285 PolarHBondContact O-N 2.91Å; Q283-I286 PolarHBondContact O-N 3.22Å; Q283-T287 PolarHBondContact O-N 2.85Å; Q283-T287 PolarHBondContact O-OG1 2.84Å; Q283-T287 VanDerWaalsContact O-OG1 3.12Å
284	P	90.6	Very high	85.4	Confident	45 Å²	45	47.4 Å²	47.4	29%	0.292	27%	0.268	S	S	.	.	H	α-helix	trans	-59.8	-38.2	173.7	-24.5	34.9	0	0	0	113.3	L256 S280 E281 T287 A288	L256-P284 HydrophobicContact CD1-CB 3.77Å; S280-P284 VanDerWaalsContact O-CD 3.31Å; S280-P284 WeakPolarHBondContact O-CD 3.13Å; E281-P284 WeakPolarHBondContact O-CD 3.41Å; P284-T287 PolarHBondContact O-N 2.78Å; P284-A288 PolarHBondContact O-N 3.09Å
285	A	91.9	Very high	85.7	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.8	-39.6	177.4	0	0	0	0	0	111.7	A268 I271 V272 I282 Q283 A288 L289	A268-A285 HydrophobicContact CB-CB 4.18Å; I271-A285 HydrophobicContact CB-CB 4.03Å; I271-A285 HydrophobicContact CD1-CB 4.23Å; I271-A285 HydrophobicContact CG2-CB 3.96Å; V272-A285 HydrophobicContact CG2-CB 4.01Å; I282-A285 WeakPolarHBondContact O-CB 3.49Å; I282-A285 PolarHBondContact O-N 3.36Å; Q283-A285 VanDerWaalsContact C-N 3.3Å; Q283-A285 PolarHBondContact O-N 2.91Å; A285-A288 PolarHBondContact O-N 2.74Å; A285-L289 WeakPolarHBondContact O-CG 3.26Å; A285-L289 PolarHBondContact O-N 2.6Å
286	I	91.4	Very high	86.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-45.1	174.6	-69.4	177.2	0	0	0	110.9	I282 Q283 A288 L289 Q290 L308 V311 A318 V319	I282-I286 HydrophobicContact CG2-CD1 3.55Å; I282-I286 HydrophobicContact CG2-CG1 3.76Å; I282-I286 PolarHBondContact O-N 2.98Å; Q283-I286 PolarHBondContact O-N 3.22Å; I286-A288 VanDerWaalsContact C-N 3.27Å; I286-A288 PolarHBondContact O-N 3.33Å; I286-L289 CarbonylContact O-C 3.59Å; I286-L289 PolarHBondContact O-N 2.88Å; I286-L289 VanDerWaalsContact O-N 3.11Å; I286-Q290 PolarHBondContact O-N 2.91Å; I286-L308 HydrophobicContact CG2-CD2 4.4Å; I286-V311 HydrophobicContact CD1-CG1 4.36Å; I286-A318 HydrophobicContact CD1-CB 3.35Å; I286-A318 WeakPolarHBondContact CD1-O 3.46Å; I286-V319 HydrophobicContact CD1-CG2 4.05Å
287	T	91.9	Very high	87.4	Confident	67 Å²	67	48.2 Å²	48.2	41%	0.411	28%	0.277	S	S	.	.	H	α-helix	trans	-59.2	-40	176.2	-55.9	0	0	0	0	111.4	Q283 P284 Q290 M291	Q283-T287 PolarHBondContact O-N 2.85Å; Q283-T287 PolarHBondContact O-OG1 2.84Å; Q283-T287 VanDerWaalsContact O-OG1 3.12Å; P284-T287 PolarHBondContact O-N 2.78Å; T287-Q290 WeakPolarHBondContact O-CB 3.43Å; T287-Q290 PolarHBondContact O-N 3.42Å; T287-M291 WeakPolarHBondContact O-CG 3.4Å; T287-M291 PolarHBondContact O-N 3.34Å
288	A	92.1	Very high	88.3	Confident	11 Å²	11	49.4 Å²	49.4	9%	0.091	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-40.6	174.9	0	0	0	0	0	112.6	L256 V264 A268 P284 A285 I286 M291 C292	L256-A288 HydrophobicContact CD2-CB 3.94Å; V264-A288 HydrophobicContact CG1-CB 3.87Å; A268-A288 HydrophobicContact CB-CB 4.34Å; P284-A288 PolarHBondContact O-N 3.09Å; A285-A288 PolarHBondContact O-N 2.74Å; I286-A288 VanDerWaalsContact C-N 3.27Å; I286-A288 PolarHBondContact O-N 3.33Å; A288-M291 PolarHBondContact O-N 3.02Å; A288-C292 PolarHBondContact O-N 3.47Å; A288-C292 PolarHBondContact O-SG 2.86Å
289	L	92.4	Very high	88.9	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.6	-38.4	174.1	-69	170	0	0	0	111.8	Y265 A268 A285 I286 M291 C292 C293 A304 T307 L308	Y265-L289 HydrophobicContact CD2-CD2 3.93Å; Y265-L289 HydrophobicContact CE2-CD2 4.03Å; A268-L289 HydrophobicContact CB-CD1 4.5Å; A268-L289 HydrophobicContact CB-CD2 3.97Å; A268-L289 HydrophobicContact CB-CG 3.89Å; A285-L289 WeakPolarHBondContact O-CG 3.26Å; A285-L289 PolarHBondContact O-N 2.6Å; I286-L289 CarbonylContact O-C 3.59Å; I286-L289 PolarHBondContact O-N 2.88Å; I286-L289 VanDerWaalsContact O-N 3.11Å; L289-M291 VanDerWaalsContact C-N 3.33Å; L289-M291 PolarHBondContact O-N 3.43Å; L289-C292 WeakPolarHBondContact O-CA 3.39Å; L289-C292 WeakPolarHBondContact O-CB 3.32Å; L289-C292 PolarHBondContact O-N 3.19Å; L289-C292 VanDerWaalsContact O-N 3.1Å; L289-C293 PolarHBondContact O-N 3.05Å; L289-C293 PolarHBondContact O-SG 3.44Å; L289-C293 VanDerWaalsContact O-SG 3.39Å; L289-A304 HydrophobicContact CD2-CB 4.41Å; L289-T307 HydrophobicContact CD1-CG2 3.74Å; L289-T307 HydrophobicContact CD2-CG2 4.29Å; L289-L308 HydrophobicContact CB-CD1 4.5Å; L289-L308 HydrophobicContact CB-CD2 3.96Å; L289-L308 HydrophobicContact CB-CG 4.15Å; L289-L308 HydrophobicContact CD1-CD2 3.89Å; L289-L308 HydrophobicContact CD1-CG 4.27Å
290	Q	91.6	Very high	89.5	Confident	49 Å²	49	47.9 Å²	47.9	23%	0.229	29%	0.285	C	S	.	.	H	α-helix	trans	-60	-43.9	174.5	-170.5	177.2	10.3	0	0	111.2	I286 T287 C292 C293 D325	I286-Q290 PolarHBondContact O-N 2.91Å; T287-Q290 WeakPolarHBondContact O-CB 3.43Å; T287-Q290 PolarHBondContact O-N 3.42Å; Q290-C292 VanDerWaalsContact C-N 3.31Å; Q290-C292 PolarHBondContact O-N 2.73Å; Q290-C293 VanDerWaalsContact O-CB 3.29Å; Q290-C293 WeakPolarHBondContact O-CB 3.08Å; Q290-C293 PolarHBondContact O-N 2.71Å; Q290-C293 VanDerWaalsContact O-N 3.16Å; Q290-D325 PolarHBondContact NE2-OD2 2.76Å
291	M	90.3	Very high	90.1	Very high	128 Å²	128	45.8 Å²	45.8	63%	0.631	26%	0.263	S	S	*	.	H	α-helix	trans	-60.7	-41.6	173.1	-68.7	-58.3	-60	0	0	111.5	T287 A288 L289 C293 T294	T287-M291 WeakPolarHBondContact O-CG 3.4Å; T287-M291 PolarHBondContact O-N 3.34Å; A288-M291 PolarHBondContact O-N 3.02Å; L289-M291 VanDerWaalsContact C-N 3.33Å; L289-M291 PolarHBondContact O-N 3.43Å; M291-C293 VanDerWaalsContact C-N 3.26Å; M291-C293 PolarHBondContact O-N 2.84Å; M291-T294 PolarHBondContact O-N 2.96Å; M291-T294 PolarHBondContact O-OG1 2.69Å
292	C	90.4	Very high	90.6	Very high	8 Å²	8	46.7 Å²	46.7	5%	0.054	27%	0.267	C	S	.	.	H	α-helix	trans	-61.9	-30.8	176	-65.6	0	0	0	0	113.2	A288 L289 Q290 T294 S295 V300 A304	A288-C292 PolarHBondContact O-N 3.47Å; A288-C292 PolarHBondContact O-SG 2.86Å; L289-C292 WeakPolarHBondContact O-CA 3.39Å; L289-C292 WeakPolarHBondContact O-CB 3.32Å; L289-C292 PolarHBondContact O-N 3.19Å; L289-C292 VanDerWaalsContact O-N 3.1Å; Q290-C292 VanDerWaalsContact C-N 3.31Å; Q290-C292 PolarHBondContact O-N 2.73Å; C292-T294 PolarHBondContact O-N 3.22Å; C292-S295 VanDerWaalsContact O-CB 3.27Å; C292-S295 WeakPolarHBondContact O-CB 3.38Å; C292-S295 PolarHBondContact O-N 3.16Å; C292-S295 VanDerWaalsContact O-N 3.16Å; C292-V300 HydrophobicContact CB-CG1 3.89Å; C292-A304 HydrophobicContact CB-CB 3.76Å
293	C	88.9	Confident	90.8	Very high	4 Å²	4	47.7 Å²	47.7	3%	0.027	28%	0.275	C	S	.	.	H	α-helix	trans	-61.5	-30.2	173.6	-69.7	0	0	0	0	112.3	L289 Q290 M291 S295 R301 F329	L289-C293 PolarHBondContact O-N 3.05Å; L289-C293 PolarHBondContact O-SG 3.44Å; L289-C293 VanDerWaalsContact O-SG 3.39Å; Q290-C293 VanDerWaalsContact O-CB 3.29Å; Q290-C293 WeakPolarHBondContact O-CB 3.08Å; Q290-C293 PolarHBondContact O-N 2.71Å; Q290-C293 VanDerWaalsContact O-N 3.16Å; M291-C293 VanDerWaalsContact C-N 3.26Å; M291-C293 PolarHBondContact O-N 2.84Å; C293-S295 VanDerWaalsContact C-N 3.29Å; C293-S295 PolarHBondContact O-N 2.8Å; C293-R301 VanDerWaalsContact O-CD 3.27Å; C293-R301 WeakPolarHBondContact O-CD 3.41Å; C293-R301 VanDerWaalsContact O-CG 3.32Å; C293-R301 WeakPolarHBondContact O-CG 3.31Å; C293-F329 HydrophobicContact CB-CE2 3.82Å; C293-F329 HydrophobicContact CB-CZ 3.87Å; C293-F329 VanDerWaalsContact O-CZ 3.25Å; C293-F329 WeakPolarHBondContact O-CZ 3.05Å
294	T	89.3	Confident	91	Very high	90 Å²	90	44.2 Å²	44.2	55%	0.552	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-3.2	178.2	66.4	0	0	0	0	114.4	M291 C292	M291-T294 PolarHBondContact O-N 2.96Å; M291-T294 PolarHBondContact O-OG1 2.69Å; C292-T294 PolarHBondContact O-N 3.22Å
295	S	89.5	Confident	91.1	Very high	7 Å²	7	42 Å²	42	5%	0.049	25%	0.245	C	C	.	.			trans	-64.8	140.3	-179.1	-174	0	0	0	0	111.6	E261 C292 C293 K297 R301	E261-S295 PolarHBondContact OE1-OG 3.18Å; C292-S295 VanDerWaalsContact O-CB 3.27Å; C292-S295 WeakPolarHBondContact O-CB 3.38Å; C292-S295 PolarHBondContact O-N 3.16Å; C292-S295 VanDerWaalsContact O-N 3.16Å; C293-S295 VanDerWaalsContact C-N 3.29Å; C293-S295 PolarHBondContact O-N 2.8Å; S295-K297 PolarHBondContact O-N 3.25Å; S295-K297 VanDerWaalsContact O-N 3.17Å; S295-R301 WeakPolarHBondContact O-CD 3.46Å; S295-R301 VanDerWaalsContact O-CG 3.22Å; S295-R301 WeakPolarHBondContact O-CG 3.39Å; S295-R301 PolarHBondContact O-NE 3.35Å
296	P	89.1	Confident	91.1	Very high	123 Å²	123	49.6 Å²	49.6	80%	0.799	27%	0.273	S	S	*	.	S	Bend	trans	-66.6	-16.1	176.6	27.4	-35.4	0	0	0	113.1	A298	P296-A298 PolarHBondContact O-N 2.93Å
297	K	90.9	Very high	91.2	Very high	117 Å²	117	50.3 Å²	50.3	51%	0.509	28%	0.277	S	S	.	.			trans	-83.2	115.6	-177.7	-63.6	172.1	-170.6	158.9	0	110.8	E261 S295 A299 V300 R301	E261-K297 IonicContact OE2-NZ 3.95Å; E261-K297 PolarHBondContact OE2-NZ 2.77Å; S295-K297 PolarHBondContact O-N 3.25Å; S295-K297 VanDerWaalsContact O-N 3.17Å; K297-A299 PolarHBondContact O-N 3.09Å; K297-V300 HydrophobicContact CB-CB 4.21Å; K297-V300 HydrophobicContact CB-CG2 3.86Å; K297-V300 HydrophobicContact CD-CG2 4.04Å; K297-V300 PolarHBondContact O-N 3.41Å; K297-R301 PolarHBondContact O-N 2.76Å; K297-R301 VanDerWaalsContact O-N 3.14Å
298	A	89.7	Confident	91.2	Very high	42 Å²	42	47.1 Å²	47.1	35%	0.347	26%	0.258	S	S	.	.	H	α-helix	trans	-54.9	-36.6	177.8	0	0	0	0	0	113.5	P296 V300 R301 F302	P296-A298 PolarHBondContact O-N 2.93Å; A298-V300 PolarHBondContact O-N 3.24Å; A298-R301 PolarHBondContact O-N 2.92Å; A298-F302 WeakPolarHBondContact O-CB 3.34Å; A298-F302 PolarHBondContact O-N 3.07Å
299	A	91.5	Very high	91	Very high	78 Å²	78	47.7 Å²	47.7	65%	0.645	26%	0.259	S	S	*	.	H	α-helix	trans	-63	-38.8	177.4	0	0	0	0	0	113	K297 A303	K297-A299 PolarHBondContact O-N 3.09Å; A299-A303 VanDerWaalsContact O-CB 3.31Å; A299-A303 WeakPolarHBondContact O-CB 3.38Å; A299-A303 PolarHBondContact O-N 3.48Å
300	V	90.4	Very high	90.8	Very high	27 Å²	27	54.9 Å²	54.9	16%	0.164	29%	0.291	C	S	.	.	H	α-helix	trans	-71	-44	178.4	178.5	0	0	0	0	110.1	C292 K297 A298 F302 A303 A304	C292-V300 HydrophobicContact CB-CG1 3.89Å; K297-V300 HydrophobicContact CB-CB 4.21Å; K297-V300 HydrophobicContact CB-CG2 3.86Å; K297-V300 HydrophobicContact CD-CG2 4.04Å; K297-V300 PolarHBondContact O-N 3.41Å; A298-V300 PolarHBondContact O-N 3.24Å; V300-F302 PolarHBondContact O-N 3.41Å; V300-A303 PolarHBondContact O-N 3.27Å; V300-A304 WeakPolarHBondContact O-CB 3.42Å; V300-A304 PolarHBondContact O-N 2.94Å
301	R	92.2	Very high	90.6	Very high	47 Å²	47	52.7 Å²	52.7	18%	0.177	28%	0.281	C	S	.	.	H	α-helix	trans	-59.1	-47.9	175.2	-63.9	-168.8	-73.1	145.2	8.1	111.6	C293 S295 K297 A298 A303 A304 V305 D332 I337	C293-R301 VanDerWaalsContact O-CD 3.27Å; C293-R301 WeakPolarHBondContact O-CD 3.41Å; C293-R301 VanDerWaalsContact O-CG 3.32Å; C293-R301 WeakPolarHBondContact O-CG 3.31Å; S295-R301 WeakPolarHBondContact O-CD 3.46Å; S295-R301 VanDerWaalsContact O-CG 3.22Å; S295-R301 WeakPolarHBondContact O-CG 3.39Å; S295-R301 PolarHBondContact O-NE 3.35Å; K297-R301 PolarHBondContact O-N 2.76Å; K297-R301 VanDerWaalsContact O-N 3.14Å; A298-R301 PolarHBondContact O-N 2.92Å; R301-A303 PolarHBondContact O-N 3.13Å; R301-A304 PolarHBondContact O-N 3.25Å; R301-V305 VanDerWaalsContact O-CG2 3.29Å; R301-V305 WeakPolarHBondContact O-CG2 3.38Å; R301-V305 PolarHBondContact O-N 3.08Å; R301-D332 IonicContact CZ-OD2 3.48Å; R301-D332 IonicContact NH1-OD2 3.64Å; R301-D332 PolarHBondContact NH1-OD2 2.85Å; R301-D332 IonicContact NH2-OD2 2.81Å; R301-D332 PolarHBondContact NH2-OD2 2.72Å; R301-I337 HydrophobicContact CB-CD1 4.18Å
302	F	92.3	Very high	90.5	Very high	64 Å²	64	46.7 Å²	46.7	28%	0.281	25%	0.252	S	S	.	.	H	α-helix	trans	-58.1	-47.6	176	176.4	-101.2	0	0	0	112.1	A298 V300 A304 V305 R306 I337 L340	A298-F302 WeakPolarHBondContact O-CB 3.34Å; A298-F302 PolarHBondContact O-N 3.07Å; V300-F302 PolarHBondContact O-N 3.41Å; F302-A304 VanDerWaalsContact C-N 3.34Å; F302-A304 PolarHBondContact O-N 3.31Å; F302-V305 PolarHBondContact O-N 3.44Å; F302-R306 VanDerWaalsContact O-CB 3.24Å; F302-R306 WeakPolarHBondContact O-CB 3.28Å; F302-R306 PolarHBondContact O-N 3.16Å; F302-I337 HydrophobicContact CB-CD1 4.07Å; F302-I337 HydrophobicContact CB-CG1 3.84Å; F302-I337 HydrophobicContact CD2-CG1 3.96Å; F302-I337 HydrophobicContact CG-CG1 4.41Å; F302-L340 HydrophobicContact CD2-CD1 3.94Å; F302-L340 HydrophobicContact CE2-CD1 3.44Å; F302-L340 VanDerWaalsContact CE2-CD1 3.44Å; F302-L340 HydrophobicContact CZ-CD1 4.11Å
303	A	92.3	Very high	90	Very high	21 Å²	21	51.5 Å²	51.5	17%	0.174	28%	0.275	C	S	.	.	H	α-helix	trans	-62.1	-41.4	179.6	0	0	0	0	0	111.9	Y265 A299 V300 R301 T307	Y265-A303 HydrophobicContact CD2-CB 4.3Å; Y265-A303 HydrophobicContact CE1-CB 4.05Å; Y265-A303 VanDerWaalsContact CE2-C 3.42Å; Y265-A303 HydrophobicContact CE2-CB 3.67Å; Y265-A303 VanDerWaalsContact CE2-O 3.28Å; Y265-A303 WeakPolarHBondContact CE2-O 3.49Å; Y265-A303 PolarHBondContact OH-O 3.13Å; Y265-A303 VanDerWaalsContact OH-O 3.08Å; A299-A303 VanDerWaalsContact O-CB 3.31Å; A299-A303 WeakPolarHBondContact O-CB 3.38Å; A299-A303 PolarHBondContact O-N 3.48Å; V300-A303 PolarHBondContact O-N 3.27Å; R301-A303 PolarHBondContact O-N 3.13Å; A303-T307 PolarHBondContact O-N 3.39Å; A303-T307 VanDerWaalsContact O-N 3.08Å; A303-T307 PolarHBondContact O-OG1 3.45Å; A303-T307 VanDerWaalsContact O-OG1 3.06Å
304	A	93.4	Very high	89.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.6	-51.5	177.1	0	0	0	0	0	112.1	L289 C292 V300 R301 F302 R306 T307 L308	L289-A304 HydrophobicContact CD2-CB 4.41Å; C292-A304 HydrophobicContact CB-CB 3.76Å; V300-A304 WeakPolarHBondContact O-CB 3.42Å; V300-A304 PolarHBondContact O-N 2.94Å; R301-A304 PolarHBondContact O-N 3.25Å; F302-A304 VanDerWaalsContact C-N 3.34Å; F302-A304 PolarHBondContact O-N 3.31Å; A304-R306 VanDerWaalsContact C-N 3.31Å; A304-R306 PolarHBondContact O-N 2.94Å; A304-T307 PolarHBondContact O-N 3.26Å; A304-L308 WeakPolarHBondContact O-CG 3.43Å; A304-L308 PolarHBondContact O-N 2.95Å
305	V	92.7	Very high	89.4	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63.2	-37.4	179.3	179.9	0	0	0	0	111.2	R301 F302 L308 N309 L326 F329 I337 L340 A341	R301-V305 VanDerWaalsContact O-CG2 3.29Å; R301-V305 WeakPolarHBondContact O-CG2 3.38Å; R301-V305 PolarHBondContact O-N 3.08Å; F302-V305 PolarHBondContact O-N 3.44Å; V305-L308 PolarHBondContact O-N 3.4Å; V305-N309 WeakPolarHBondContact O-CB 3.34Å; V305-N309 PolarHBondContact O-N 3.27Å; V305-L326 HydrophobicContact CG1-CD2 4.05Å; V305-L326 HydrophobicContact CG2-CD2 3.9Å; V305-F329 HydrophobicContact CG2-CD2 3.76Å; V305-F329 HydrophobicContact CG2-CE2 3.82Å; V305-I337 HydrophobicContact CG2-CG2 4.25Å; V305-L340 HydrophobicContact CG1-CB 3.65Å; V305-A341 HydrophobicContact CG1-CB 4.23Å
306	R	92.1	Very high	89.1	Confident	158 Å²	158	54.4 Å²	54.4	60%	0.596	30%	0.296	S	S	*	.	H	α-helix	trans	-61.6	-45.1	174.1	-176.9	179.2	174.7	176.2	0.4	112	F302 A304 N309 K310 L340	F302-R306 VanDerWaalsContact O-CB 3.24Å; F302-R306 WeakPolarHBondContact O-CB 3.28Å; F302-R306 PolarHBondContact O-N 3.16Å; A304-R306 VanDerWaalsContact C-N 3.31Å; A304-R306 PolarHBondContact O-N 2.94Å; R306-N309 PolarHBondContact O-N 2.98Å; R306-K310 PolarHBondContact O-N 3.24Å; R306-L340 HydrophobicContact CB-CD1 3.91Å; R306-L340 HydrophobicContact CG-CD1 4.42Å
307	T	91.9	Very high	88.9	Confident	15 Å²	15	55 Å²	55	9%	0.092	29%	0.292	C	S	.	.	H	α-helix	trans	-64.8	-47.1	176.6	-56.3	0	0	0	0	110.4	Y265 L289 A303 A304 N309 K310 V311	Y265-T307 WeakPolarHBondContact CE2-OG1 3.29Å; Y265-T307 PolarHBondContact OH-OG1 3.23Å; L289-T307 HydrophobicContact CD1-CG2 3.74Å; L289-T307 HydrophobicContact CD2-CG2 4.29Å; A303-T307 PolarHBondContact O-N 3.39Å; A303-T307 VanDerWaalsContact O-N 3.08Å; A303-T307 PolarHBondContact O-OG1 3.45Å; A303-T307 VanDerWaalsContact O-OG1 3.06Å; A304-T307 PolarHBondContact O-N 3.26Å; T307-N309 VanDerWaalsContact C-N 3.29Å; T307-N309 PolarHBondContact O-N 3.11Å; T307-K310 WeakPolarHBondContact O-CA 3.16Å; T307-K310 WeakPolarHBondContact O-CB 3.39Å; T307-K310 PolarHBondContact O-N 3.13Å; T307-V311 HydrophobicContact CG2-CG2 4.38Å; T307-V311 WeakPolarHBondContact O-CG2 3.46Å; T307-V311 PolarHBondContact O-N 3.43Å
308	L	92.1	Very high	88.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-56.2	-40.4	176.5	-71.8	174.8	0	0	0	112.6	I286 L289 A304 V305 K310 V311 A312 V319 C322 L326	I286-L308 HydrophobicContact CG2-CD2 4.4Å; L289-L308 HydrophobicContact CB-CD1 4.5Å; L289-L308 HydrophobicContact CB-CD2 3.96Å; L289-L308 HydrophobicContact CB-CG 4.15Å; L289-L308 HydrophobicContact CD1-CD2 3.89Å; L289-L308 HydrophobicContact CD1-CG 4.27Å; A304-L308 WeakPolarHBondContact O-CG 3.43Å; A304-L308 PolarHBondContact O-N 2.95Å; V305-L308 PolarHBondContact O-N 3.4Å; L308-K310 VanDerWaalsContact C-N 3.31Å; L308-K310 PolarHBondContact O-N 2.93Å; L308-V311 PolarHBondContact O-N 3.19Å; L308-A312 WeakPolarHBondContact O-CB 3.43Å; L308-A312 PolarHBondContact O-N 3.1Å; L308-V319 HydrophobicContact CB-CG1 4.44Å; L308-V319 HydrophobicContact CD2-CG1 4.27Å; L308-V319 HydrophobicContact CD2-CG2 4.45Å; L308-C322 HydrophobicContact CD1-CB 4.34Å; L308-L326 HydrophobicContact CD1-CD2 4.31Å
309	N	89.1	Confident	88.5	Confident	23 Å²	23	48.1 Å²	48.1	12%	0.123	26%	0.256	C	S	.	.	H	α-helix	trans	-61.7	-39	175.7	-170.3	-98.2	0	0	0	112.7	V305 R306 T307 L340 T343 T344 K347	V305-N309 WeakPolarHBondContact O-CB 3.34Å; V305-N309 PolarHBondContact O-N 3.27Å; R306-N309 PolarHBondContact O-N 2.98Å; T307-N309 VanDerWaalsContact C-N 3.29Å; T307-N309 PolarHBondContact O-N 3.11Å; N309-L340 HydrophobicContact CB-CD2 4.44Å; N309-L340 PolarHBondContact ND2-O 2.74Å; N309-T343 WeakPolarHBondContact ND2-CB 3.25Å; N309-T343 WeakPolarHBondContact ND2-CG2 3.17Å; N309-T344 WeakPolarHBondContact CA-OG1 3.13Å; N309-T344 VanDerWaalsContact CB-OG1 3.26Å; N309-T344 WeakPolarHBondContact CB-OG1 3.47Å; N309-T344 PolarHBondContact ND2-N 3.18Å; N309-T344 PolarHBondContact ND2-OG1 3.29Å; N309-K347 PolarHBondContact OD1-NZ 3.48Å
310	K	87.5	Confident	88.2	Confident	152 Å²	152	48 Å²	48	66%	0.661	24%	0.244	S	C	*	.	H	α-helix	trans	-66.4	-43.8	174.8	-171.1	178	179.6	179.3	0	110.8	R306 T307 L308 A312 M313	R306-K310 PolarHBondContact O-N 3.24Å; T307-K310 WeakPolarHBondContact O-CA 3.16Å; T307-K310 WeakPolarHBondContact O-CB 3.39Å; T307-K310 PolarHBondContact O-N 3.13Å; L308-K310 VanDerWaalsContact C-N 3.31Å; L308-K310 PolarHBondContact O-N 2.93Å; K310-A312 VanDerWaalsContact C-N 3.31Å; K310-A312 PolarHBondContact O-N 3.32Å; K310-M313 WeakPolarHBondContact O-CB 3.32Å; K310-M313 PolarHBondContact O-N 2.93Å
311	V	88	Confident	88	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-41.9	176.8	-167.1	0	0	0	0	111.2	V272 I282 I286 T307 L308 M313 A314 H315 V319	V272-V311 HydrophobicContact CB-CG2 4.1Å; V272-V311 HydrophobicContact CG1-CB 3.92Å; V272-V311 HydrophobicContact CG1-CG1 3.76Å; V272-V311 HydrophobicContact CG1-CG2 3.22Å; V272-V311 HydrophobicContact CG2-CG2 4.12Å; I282-V311 HydrophobicContact CG2-CG1 4.27Å; I286-V311 HydrophobicContact CD1-CG1 4.36Å; T307-V311 HydrophobicContact CG2-CG2 4.38Å; T307-V311 WeakPolarHBondContact O-CG2 3.46Å; T307-V311 PolarHBondContact O-N 3.43Å; L308-V311 PolarHBondContact O-N 3.19Å; V311-M313 PolarHBondContact O-N 3.42Å; V311-M313 VanDerWaalsContact O-N 3.08Å; V311-A314 PolarHBondContact O-N 2.94Å; V311-H315 HydrophobicContact CG1-CB 4.43Å; V311-H315 PolarHBondContact O-N 3.4Å; V311-V319 HydrophobicContact CB-CG2 3.81Å; V311-V319 HydrophobicContact CG1-CG2 3.77Å
312	A	86.4	Confident	87.9	Confident	2 Å²	2	47.3 Å²	47.3	2%	0.017	25%	0.247	C	C	.	.	H	α-helix	trans	-63.4	-15	-178.4	0	0	0	0	0	113.8	L308 K310 P316 V319 T344 K347 T348	L308-A312 WeakPolarHBondContact O-CB 3.43Å; L308-A312 PolarHBondContact O-N 3.1Å; K310-A312 VanDerWaalsContact C-N 3.31Å; K310-A312 PolarHBondContact O-N 3.32Å; A312-P316 WeakPolarHBondContact O-CG 3.28Å; A312-V319 HydrophobicContact CB-CG1 4.49Å; A312-V319 HydrophobicContact CB-CG2 4.43Å; A312-T344 HydrophobicContact CB-CG2 3.93Å; A312-K347 HydrophobicContact CB-CB 4.22Å; A312-K347 HydrophobicContact CB-CD 4.31Å; A312-T348 HydrophobicContact CB-CG2 3.79Å
313	M	80.5	Confident	87.6	Confident	109 Å²	109	45.3 Å²	45.3	54%	0.537	24%	0.239	S	C	.	.	H	α-helix	trans	-75.3	-37.6	170.3	-68.2	-61.1	-143.6	0	0	112.5	K310 V311 K347	K310-M313 WeakPolarHBondContact O-CB 3.32Å; K310-M313 PolarHBondContact O-N 2.93Å; V311-M313 PolarHBondContact O-N 3.42Å; V311-M313 VanDerWaalsContact O-N 3.08Å; M313-K347 HydrophobicContact CE-CD 4.45Å; M313-K347 VanDerWaalsContact CE-CE 3.48Å; M313-K347 HydrophobicContact CG-CD 4.43Å; M313-K347 HydrophobicContact SD-CD 3.59Å; M313-K347 VanDerWaalsContact SD-CD 3.59Å; M313-K347 WeakPolarHBondContact SD-CE 3.47Å; M313-K347 PolarHBondContact SD-NZ 3.3Å
314	A	81.9	Confident	87.4	Confident	70 Å²	70	49 Å²	49	58%	0.579	26%	0.26	S	S	*	.	H	α-helix	trans	-94.6	-41.7	-176.3	0	0	0	0	0	112.6	V311	V311-A314 PolarHBondContact O-N 2.94Å
315	H	83.4	Confident	87.1	Confident	58 Å²	58	50.2 Å²	50.2	27%	0.269	27%	0.266	S	S	.	.			trans	-133.7	72.7	-175.9	-57.2	-72.9	0	0	0	111.8	I282 V311 N317 A318	I282-H315 WeakPolarHBondContact CD1-CD2 3.46Å; V311-H315 HydrophobicContact CG1-CB 4.43Å; V311-H315 PolarHBondContact O-N 3.4Å; H315-N317 VanDerWaalsContact C-N 3.31Å; H315-N317 PolarHBondContact O-N 3.16Å; H315-A318 HydrophobicContact CB-CB 4.35Å; H315-A318 PolarHBondContact O-N 3.41Å
316	P	83.6	Confident	86.9	Confident	34 Å²	34	50.2 Å²	50.2	22%	0.221	27%	0.266	C	S	.	.	H	α-helix	trans	-56.5	-40.9	-179.1	-20.5	27.4	0	0	0	113.7	A312 A318 V319 M320	A312-P316 WeakPolarHBondContact O-CG 3.28Å; P316-A318 VanDerWaalsContact C-N 3.31Å; P316-A318 PolarHBondContact O-N 2.54Å; P316-V319 PolarHBondContact O-N 3.24Å; P316-M320 PolarHBondContact O-N 3.39Å
317	N	84.4	Confident	86.6	Confident	136 Å²	136	44.3 Å²	44.3	73%	0.727	25%	0.245	S	C	*	.	H	α-helix	trans	-63.7	-34.5	-174.2	-66.1	-14.3	0	0	0	113	H315 V319 M320	H315-N317 VanDerWaalsContact C-N 3.31Å; H315-N317 PolarHBondContact O-N 3.16Å; N317-V319 VanDerWaalsContact C-N 3.31Å; N317-V319 PolarHBondContact O-N 2.83Å; N317-M320 PolarHBondContact O-N 3.08Å
318	A	85.1	Confident	86.4	Confident	13 Å²	13	49.7 Å²	49.7	11%	0.107	27%	0.267	C	S	.	.	H	α-helix	trans	-69.8	-31.8	-178.9	0	0	0	0	0	111.8	I286 H315 P316 S321	I286-A318 HydrophobicContact CD1-CB 3.35Å; I286-A318 WeakPolarHBondContact CD1-O 3.46Å; H315-A318 HydrophobicContact CB-CB 4.35Å; H315-A318 PolarHBondContact O-N 3.41Å; P316-A318 VanDerWaalsContact C-N 3.31Å; P316-A318 PolarHBondContact O-N 2.54Å; A318-S321 PolarHBondContact O-OG 2.8Å
319	V	88.4	Confident	86.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-82.6	-14.1	-178	179.8	0	0	0	0	112.7	I286 L308 V311 A312 P316 N317 S321 C322 T344 T348	I286-V319 HydrophobicContact CD1-CG2 4.05Å; L308-V319 HydrophobicContact CB-CG1 4.44Å; L308-V319 HydrophobicContact CD2-CG1 4.27Å; L308-V319 HydrophobicContact CD2-CG2 4.45Å; V311-V319 HydrophobicContact CB-CG2 3.81Å; V311-V319 HydrophobicContact CG1-CG2 3.77Å; A312-V319 HydrophobicContact CB-CG1 4.49Å; A312-V319 HydrophobicContact CB-CG2 4.43Å; P316-V319 PolarHBondContact O-N 3.24Å; N317-V319 VanDerWaalsContact C-N 3.31Å; N317-V319 PolarHBondContact O-N 2.83Å; V319-S321 PolarHBondContact O-N 2.81Å; V319-S321 VanDerWaalsContact O-N 3.07Å; V319-C322 WeakPolarHBondContact O-CB 3.47Å; V319-C322 PolarHBondContact O-N 3.29Å; V319-T344 HydrophobicContact CG1-CG2 3.96Å; V319-T348 HydrophobicContact CB-CG2 3.77Å; V319-T348 HydrophobicContact CG1-CG2 3.79Å
320	M	85.1	Confident	85.9	Confident	77 Å²	77	49.7 Å²	49.7	38%	0.379	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-54.7	-32.3	-179.1	-70	178.8	67	0	0	113.7	P316 N317 C322 N323 A350	P316-M320 PolarHBondContact O-N 3.39Å; N317-M320 PolarHBondContact O-N 3.08Å; M320-C322 PolarHBondContact O-N 2.87Å; M320-N323 WeakPolarHBondContact O-CB 3.5Å; M320-N323 VanDerWaalsContact O-CG 3.28Å; M320-N323 PolarHBondContact O-N 2.81Å; M320-N323 VanDerWaalsContact O-N 3.12Å; M320-A350 HydrophobicContact CE-CB 4.35Å
321	S	86	Confident	85.7	Confident	58 Å²	58	48.4 Å²	48.4	41%	0.406	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-57.3	-26.9	175.7	57.5	0	0	0	0	113.7	A318 V319	A318-S321 PolarHBondContact O-OG 2.8Å; V319-S321 PolarHBondContact O-N 2.81Å; V319-S321 VanDerWaalsContact O-N 3.07Å
322	C	88.9	Confident	85.6	Confident	1 Å²	1	49 Å²	49	1%	0.007	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-89.2	-6	-178.8	-62.2	0	0	0	0	113.6	L308 V319 M320 V324 D325 L326	L308-C322 HydrophobicContact CD1-CB 4.34Å; V319-C322 WeakPolarHBondContact O-CB 3.47Å; V319-C322 PolarHBondContact O-N 3.29Å; M320-C322 PolarHBondContact O-N 2.87Å; C322-V324 VanDerWaalsContact C-N 3.29Å; C322-V324 PolarHBondContact O-N 3.5Å; C322-D325 PolarHBondContact O-N 2.88Å; C322-D325 VanDerWaalsContact O-N 3.09Å; C322-L326 HydrophobicContact CB-CD1 4.28Å; C322-L326 HydrophobicContact CB-CG 4.43Å; C322-L326 WeakPolarHBondContact O-CG 3.25Å; C322-L326 PolarHBondContact O-N 2.89Å
323	N	87.7	Confident	85.5	Confident	21 Å²	21	54.5 Å²	54.5	11%	0.112	31%	0.311	C	S	.	.	H	α-helix	trans	-57.3	-40	-171.4	-75.2	-4.5	0	0	0	112.8	M320 D325 L326 E327 L345 T348	M320-N323 WeakPolarHBondContact O-CB 3.5Å; M320-N323 VanDerWaalsContact O-CG 3.28Å; M320-N323 PolarHBondContact O-N 2.81Å; M320-N323 VanDerWaalsContact O-N 3.12Å; N323-D325 VanDerWaalsContact C-N 3.29Å; N323-D325 PolarHBondContact O-N 3.27Å; N323-L326 PolarHBondContact O-N 2.78Å; N323-E327 WeakPolarHBondContact O-CG 3.48Å; N323-E327 PolarHBondContact O-N 3.13Å; N323-L345 HydrophobicContact CB-CD2 3.86Å; N323-T348 PolarHBondContact ND2-O 2.89Å; N323-T348 WeakPolarHBondContact OD1-CB 3.15Å; N323-T348 PolarHBondContact OD1-OG1 3.13Å
324	V	86.4	Confident	85.8	Confident	100 Å²	100	52.1 Å²	52.1	61%	0.606	30%	0.3	S	S	*	.	H	α-helix	trans	-62.6	-36.4	-179.9	179.8	0	0	0	0	112.1	C322	C322-V324 VanDerWaalsContact C-N 3.29Å; C322-V324 PolarHBondContact O-N 3.5Å
325	D	87.6	Confident	85.9	Confident	24 Å²	24	54.1 Å²	54.1	13%	0.128	29%	0.292	C	S	.	.	H	α-helix	trans	-78.9	-35.1	177.5	-65.7	-51	0	0	0	111.7	Q290 C322 N323 E327 K328	Q290-D325 PolarHBondContact NE2-OD2 2.76Å; C322-D325 PolarHBondContact O-N 2.88Å; C322-D325 VanDerWaalsContact O-N 3.09Å; N323-D325 VanDerWaalsContact C-N 3.29Å; N323-D325 PolarHBondContact O-N 3.27Å; D325-E327 VanDerWaalsContact C-N 3.34Å; D325-E327 PolarHBondContact O-N 2.88Å; D325-K328 WeakPolarHBondContact O-CB 3.32Å; D325-K328 PolarHBondContact O-N 2.96Å; D325-K328 IonicContact OD1-NZ 2.7Å; D325-K328 PolarHBondContact OD1-NZ 2.83Å
326	L	88.7	Confident	85.9	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.6	-35	175.7	-67.8	174.6	0	0	0	112.4	V305 L308 C322 N323 K328 F329 A341 T344 L345	V305-L326 HydrophobicContact CG1-CD2 4.05Å; V305-L326 HydrophobicContact CG2-CD2 3.9Å; L308-L326 HydrophobicContact CD1-CD2 4.31Å; C322-L326 HydrophobicContact CB-CD1 4.28Å; C322-L326 HydrophobicContact CB-CG 4.43Å; C322-L326 WeakPolarHBondContact O-CG 3.25Å; C322-L326 PolarHBondContact O-N 2.89Å; N323-L326 PolarHBondContact O-N 2.78Å; L326-K328 PolarHBondContact O-N 2.94Å; L326-F329 HydrophobicContact CD2-CD2 4.14Å; L326-F329 HydrophobicContact CD2-CE2 4.42Å; L326-F329 WeakPolarHBondContact O-CB 3.4Å; L326-F329 PolarHBondContact O-N 2.73Å; L326-A341 HydrophobicContact CD2-CB 4.5Å; L326-T344 HydrophobicContact CD1-CG2 3.6Å; L326-L345 HydrophobicContact CB-CD1 4.16Å; L326-L345 HydrophobicContact CB-CD2 3.89Å; L326-L345 HydrophobicContact CB-CG 3.92Å
327	E	86.3	Confident	86.2	Confident	34 Å²	34	52.4 Å²	52.4	16%	0.159	29%	0.288	C	S	.	.	H	α-helix	trans	-60.3	-33	176.3	-78.9	-178.4	-174.5	0	0	112.4	N323 D325 F329 I330 L345 R356 L357	N323-E327 WeakPolarHBondContact O-CG 3.48Å; N323-E327 PolarHBondContact O-N 3.13Å; D325-E327 VanDerWaalsContact C-N 3.34Å; D325-E327 PolarHBondContact O-N 2.88Å; E327-F329 PolarHBondContact O-N 3.44Å; E327-I330 HydrophobicContact CB-CD1 4.47Å; E327-I330 HydrophobicContact CG-CD1 4.42Å; E327-I330 WeakPolarHBondContact O-CB 3.42Å; E327-I330 WeakPolarHBondContact O-CG1 3.44Å; E327-I330 PolarHBondContact O-N 2.69Å; E327-L345 HydrophobicContact CG-CD1 3.88Å; E327-L345 HydrophobicContact CG-CD2 4.07Å; E327-R356 IonicContact OE1-CZ 3.4Å; E327-R356 IonicContact OE1-NE 3.92Å; E327-R356 IonicContact OE1-NH2 3.77Å; E327-R356 PolarHBondContact OE1-NH2 3.11Å; E327-R356 IonicContact OE2-CZ 2.78Å; E327-R356 IonicContact OE2-NE 3.75Å; E327-R356 IonicContact OE2-NH2 2.84Å; E327-R356 PolarHBondContact OE2-NH2 3.23Å; E327-L357 HydrophobicContact CG-CD2 4.39Å
328	K	86.7	Confident	86.3	Confident	128 Å²	128	46 Å²	46	56%	0.557	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-24	175.9	-59.6	169.4	-170.9	160.1	0	112.3	D325 L326 T331	D325-K328 WeakPolarHBondContact O-CB 3.32Å; D325-K328 PolarHBondContact O-N 2.96Å; D325-K328 IonicContact OD1-NZ 2.7Å; D325-K328 PolarHBondContact OD1-NZ 2.83Å; L326-K328 PolarHBondContact O-N 2.94Å; K328-T331 PolarHBondContact O-OG1 2.74Å
329	F	87.9	Confident	86.2	Confident	14 Å²	14	45.7 Å²	45.7	6%	0.061	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-9.2	-179.6	-59.9	-44.1	0	0	0	114.2	C293 V305 L326 E327 T331 D332 I337 A338 A341	C293-F329 HydrophobicContact CB-CE2 3.82Å; C293-F329 HydrophobicContact CB-CZ 3.87Å; C293-F329 VanDerWaalsContact O-CZ 3.25Å; C293-F329 WeakPolarHBondContact O-CZ 3.05Å; V305-F329 HydrophobicContact CG2-CD2 3.76Å; V305-F329 HydrophobicContact CG2-CE2 3.82Å; L326-F329 HydrophobicContact CD2-CD2 4.14Å; L326-F329 HydrophobicContact CD2-CE2 4.42Å; L326-F329 WeakPolarHBondContact O-CB 3.4Å; L326-F329 PolarHBondContact O-N 2.73Å; E327-F329 PolarHBondContact O-N 3.44Å; F329-T331 PolarHBondContact O-N 2.74Å; F329-D332 HydrophobicContact CB-CB 4.36Å; F329-D332 VanDerWaalsContact O-CB 3.22Å; F329-D332 WeakPolarHBondContact O-CB 3.12Å; F329-D332 PolarHBondContact O-N 3.31Å; F329-I337 HydrophobicContact CB-CG2 3.96Å; F329-I337 HydrophobicContact CD1-CG2 4.27Å; F329-I337 HydrophobicContact CD2-CG2 4.37Å; F329-I337 HydrophobicContact CG-CG2 3.94Å; F329-A338 VanDerWaalsContact O-CA 3.23Å; F329-A338 WeakPolarHBondContact O-CA 3.5Å; F329-A338 VanDerWaalsContact O-CB 3.28Å; F329-A338 WeakPolarHBondContact O-CB 3.39Å; F329-A341 HydrophobicContact CB-CB 3.71Å
330	I	83.3	Confident	86.1	Confident	9 Å²	9	47.4 Å²	47.4	5%	0.046	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-34.2	175.5	-62.1	171.6	0	0	0	110.5	E327 I342 L345 L357 Q360	E327-I330 HydrophobicContact CB-CD1 4.47Å; E327-I330 HydrophobicContact CG-CD1 4.42Å; E327-I330 WeakPolarHBondContact O-CB 3.42Å; E327-I330 WeakPolarHBondContact O-CG1 3.44Å; E327-I330 PolarHBondContact O-N 2.69Å; I330-I342 HydrophobicContact CG1-CG1 4.04Å; I330-I342 HydrophobicContact CG2-CD1 4.27Å; I330-I342 HydrophobicContact CG2-CG1 4.29Å; I330-L345 HydrophobicContact CD1-CD1 3.73Å; I330-L345 HydrophobicContact CG1-CD1 4.02Å; I330-L357 HydrophobicContact CD1-CD2 4.26Å; I330-Q360 HydrophobicContact CD1-CB 4.42Å; I330-Q360 HydrophobicContact CG2-CB 4.26Å
331	T	84.5	Confident	86.3	Confident	126 Å²	126	43.7 Å²	43.7	77%	0.773	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	13.6	177.4	56.7	0	0	0	0	113.4	K328 F329	K328-T331 PolarHBondContact O-OG1 2.74Å; F329-T331 PolarHBondContact O-N 2.74Å
332	D	85.6	Confident	86.2	Confident	14 Å²	14	41 Å²	41	8%	0.075	22%	0.222	C	C	.	.			trans	-66	139.1	179.8	-164.9	-84.7	0	0	0	111.1	R301 F329 N334	R301-D332 IonicContact CZ-OD2 3.48Å; R301-D332 IonicContact NH1-OD2 3.64Å; R301-D332 PolarHBondContact NH1-OD2 2.85Å; R301-D332 IonicContact NH2-OD2 2.81Å; R301-D332 PolarHBondContact NH2-OD2 2.72Å; F329-D332 HydrophobicContact CB-CB 4.36Å; F329-D332 VanDerWaalsContact O-CB 3.22Å; F329-D332 WeakPolarHBondContact O-CB 3.12Å; F329-D332 PolarHBondContact O-N 3.31Å; D332-N334 PolarHBondContact O-N 2.83Å; D332-N334 WeakPolarHBondContact OD1-CA 3.49Å; D332-N334 VanDerWaalsContact OD1-CB 3.26Å; D332-N334 WeakPolarHBondContact OD1-CB 3.43Å; D332-N334 PolarHBondContact OD1-N 3.35Å
333	P	84.6	Confident	85.9	Confident	119 Å²	119	41.3 Å²	41.3	77%	0.773	22%	0.224	S	C	*	.	S	Bend	trans	-60.3	-26.5	177	24.7	-36.2	0	0	0	113	R335	P333-R335 PolarHBondContact O-N 2.83Å
334	N	85.8	Confident	85.9	Confident	58 Å²	58	40.3 Å²	40.3	31%	0.31	22%	0.218	S	C	.	.			trans	-84	104.3	174.7	-171.3	-26	0	0	0	110.6	D332 S336 I337 A338	D332-N334 PolarHBondContact O-N 2.83Å; D332-N334 WeakPolarHBondContact OD1-CA 3.49Å; D332-N334 VanDerWaalsContact OD1-CB 3.26Å; D332-N334 WeakPolarHBondContact OD1-CB 3.43Å; D332-N334 PolarHBondContact OD1-N 3.35Å; N334-S336 PolarHBondContact O-N 3.25Å; N334-S336 VanDerWaalsContact O-N 3.13Å; N334-S336 WeakPolarHBondContact OD1-CB 3.4Å; N334-S336 PolarHBondContact OD1-N 2.92Å; N334-I337 HydrophobicContact CB-CB 4.33Å; N334-I337 HydrophobicContact CB-CD1 3.87Å; N334-I337 HydrophobicContact CB-CG1 3.91Å; N334-I337 WeakPolarHBondContact O-CB 3.26Å; N334-I337 PolarHBondContact O-N 3.05Å; N334-A338 PolarHBondContact O-N 3.41Å; N334-A338 VanDerWaalsContact O-N 3.09Å
335	R	82.9	Confident	85.9	Confident	112 Å²	112	35.6 Å²	35.6	42%	0.423	19%	0.19	S	C	.	.	H	α-helix	trans	-56	-31.2	179.7	-57	-55.4	-177.9	160.6	4.6	113.8	P333 T339 F364 E367	P333-R335 PolarHBondContact O-N 2.83Å; R335-T339 VanDerWaalsContact O-CB 3.31Å; R335-T339 WeakPolarHBondContact O-CB 3.35Å; R335-T339 PolarHBondContact O-N 3.36Å; R335-T339 PolarHBondContact O-OG1 3.47Å; R335-F364 VanDerWaalsContact NH1-CD2 3.35Å; R335-F364 VanDerWaalsContact NH1-CE2 3.31Å; R335-E367 IonicContact CZ-OE2 3.41Å; R335-E367 IonicContact NH1-OE2 2.62Å; R335-E367 PolarHBondContact NH1-OE2 3.14Å; R335-E367 IonicContact NH2-OE2 3.62Å; R335-E367 PolarHBondContact NH2-OE2 2.98Å
336	S	85.4	Confident	85.7	Confident	57 Å²	57	34.5 Å²	34.5	40%	0.399	18%	0.184	S	C	.	.	H	α-helix	trans	-68.5	-37.1	176.8	-49.6	0	0	0	0	112	N334 L340	N334-S336 PolarHBondContact O-N 3.25Å; N334-S336 VanDerWaalsContact O-N 3.13Å; N334-S336 WeakPolarHBondContact OD1-CB 3.4Å; N334-S336 PolarHBondContact OD1-N 2.92Å; S336-L340 VanDerWaalsContact O-CG 3.31Å; S336-L340 WeakPolarHBondContact O-CG 3.31Å; S336-L340 PolarHBondContact O-N 2.81Å
337	I	88.9	Confident	85.3	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.3	-48.2	175.4	-57.6	-179.4	0	0	0	109.6	R301 F302 V305 F329 N334 T339 L340 A341	R301-I337 HydrophobicContact CB-CD1 4.18Å; F302-I337 HydrophobicContact CB-CD1 4.07Å; F302-I337 HydrophobicContact CB-CG1 3.84Å; F302-I337 HydrophobicContact CD2-CG1 3.96Å; F302-I337 HydrophobicContact CG-CG1 4.41Å; V305-I337 HydrophobicContact CG2-CG2 4.25Å; F329-I337 HydrophobicContact CB-CG2 3.96Å; F329-I337 HydrophobicContact CD1-CG2 4.27Å; F329-I337 HydrophobicContact CD2-CG2 4.37Å; F329-I337 HydrophobicContact CG-CG2 3.94Å; N334-I337 HydrophobicContact CB-CB 4.33Å; N334-I337 HydrophobicContact CB-CD1 3.87Å; N334-I337 HydrophobicContact CB-CG1 3.91Å; N334-I337 WeakPolarHBondContact O-CB 3.26Å; N334-I337 PolarHBondContact O-N 3.05Å; I337-T339 VanDerWaalsContact C-N 3.32Å; I337-T339 PolarHBondContact O-N 3.09Å; I337-L340 PolarHBondContact O-N 2.81Å; I337-A341 WeakPolarHBondContact O-CB 3.38Å; I337-A341 PolarHBondContact O-N 3.27Å
338	A	86	Confident	85.3	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.6	-44.6	179	0	0	0	0	0	112.2	F329 N334 A341 I342 F364	F329-A338 VanDerWaalsContact O-CA 3.23Å; F329-A338 WeakPolarHBondContact O-CA 3.5Å; F329-A338 VanDerWaalsContact O-CB 3.28Å; F329-A338 WeakPolarHBondContact O-CB 3.39Å; N334-A338 PolarHBondContact O-N 3.41Å; N334-A338 VanDerWaalsContact O-N 3.09Å; A338-A341 PolarHBondContact O-N 3Å; A338-I342 VanDerWaalsContact O-CG1 3.29Å; A338-I342 WeakPolarHBondContact O-CG1 3.32Å; A338-I342 PolarHBondContact O-N 3.42Å; A338-F364 HydrophobicContact CB-CD2 4.49Å; A338-F364 HydrophobicContact CB-CE2 3.58Å; A338-F364 HydrophobicContact CB-CZ 3.65Å
339	T	83.6	Confident	84.8	Confident	7 Å²	7	28.4 Å²	28.4	4%	0.043	16%	0.159	C	C	.	.	H	α-helix	trans	-63.3	-45.6	178.9	-56.8	0	0	0	0	112.1	R335 I337 A341 I342 T343 F372	R335-T339 VanDerWaalsContact O-CB 3.31Å; R335-T339 WeakPolarHBondContact O-CB 3.35Å; R335-T339 PolarHBondContact O-N 3.36Å; R335-T339 PolarHBondContact O-OG1 3.47Å; I337-T339 VanDerWaalsContact C-N 3.32Å; I337-T339 PolarHBondContact O-N 3.09Å; T339-A341 VanDerWaalsContact C-N 3.33Å; T339-A341 PolarHBondContact O-N 3.17Å; T339-I342 PolarHBondContact O-N 2.8Å; T339-T343 WeakPolarHBondContact O-CB 3.47Å; T339-T343 PolarHBondContact O-N 2.95Å; T339-T343 PolarHBondContact O-OG1 2.76Å; T339-F372 HydrophobicContact CG2-CB 4.01Å; T339-F372 HydrophobicContact CG2-CD1 3.5Å; T339-F372 VanDerWaalsContact CG2-CD1 3.5Å; T339-F372 HydrophobicContact CG2-CE1 4.09Å; T339-F372 HydrophobicContact CG2-CG 3.8Å
340	L	86.4	Confident	84.3	Confident	36 Å²	36	29 Å²	29	19%	0.188	17%	0.166	C	C	.	.	H	α-helix	trans	-66.7	-35.9	176.8	-69.7	170.5	0	0	0	111.8	F302 V305 R306 N309 S336 I337 T344	F302-L340 HydrophobicContact CD2-CD1 3.94Å; F302-L340 HydrophobicContact CE2-CD1 3.44Å; F302-L340 VanDerWaalsContact CE2-CD1 3.44Å; F302-L340 HydrophobicContact CZ-CD1 4.11Å; V305-L340 HydrophobicContact CG1-CB 3.65Å; R306-L340 HydrophobicContact CB-CD1 3.91Å; R306-L340 HydrophobicContact CG-CD1 4.42Å; N309-L340 HydrophobicContact CB-CD2 4.44Å; N309-L340 PolarHBondContact ND2-O 2.74Å; S336-L340 VanDerWaalsContact O-CG 3.31Å; S336-L340 WeakPolarHBondContact O-CG 3.31Å; S336-L340 PolarHBondContact O-N 2.81Å; I337-L340 PolarHBondContact O-N 2.81Å; L340-T344 WeakPolarHBondContact O-CB 3.48Å; L340-T344 PolarHBondContact O-N 2.84Å; L340-T344 PolarHBondContact O-OG1 3.3Å
341	A	88.6	Confident	84.2	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.6	-49.3	176.1	0	0	0	0	0	111.3	V305 L326 F329 I337 A338 T339 T343 T344 L345	V305-A341 HydrophobicContact CG1-CB 4.23Å; L326-A341 HydrophobicContact CD2-CB 4.5Å; F329-A341 HydrophobicContact CB-CB 3.71Å; I337-A341 WeakPolarHBondContact O-CB 3.38Å; I337-A341 PolarHBondContact O-N 3.27Å; A338-A341 PolarHBondContact O-N 3Å; T339-A341 VanDerWaalsContact C-N 3.33Å; T339-A341 PolarHBondContact O-N 3.17Å; A341-T343 PolarHBondContact O-N 3.02Å; A341-T344 PolarHBondContact O-N 3.36Å; A341-T344 VanDerWaalsContact O-N 3.15Å; A341-L345 WeakPolarHBondContact O-CB 3.25Å; A341-L345 VanDerWaalsContact O-CG 3.31Å; A341-L345 WeakPolarHBondContact O-CG 3.42Å; A341-L345 PolarHBondContact O-N 3.25Å
342	I	84	Confident	84	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-56.4	-50	175	-70.3	165.3	0	0	0	110.6	I330 A338 T339 T344 L345 L346 I361 F364 V376	I330-I342 HydrophobicContact CG1-CG1 4.04Å; I330-I342 HydrophobicContact CG2-CD1 4.27Å; I330-I342 HydrophobicContact CG2-CG1 4.29Å; A338-I342 VanDerWaalsContact O-CG1 3.29Å; A338-I342 WeakPolarHBondContact O-CG1 3.32Å; A338-I342 PolarHBondContact O-N 3.42Å; T339-I342 PolarHBondContact O-N 2.8Å; I342-T344 PolarHBondContact O-N 3.47Å; I342-L345 PolarHBondContact O-N 3.34Å; I342-L346 HydrophobicContact CG2-CD1 3.97Å; I342-L346 HydrophobicContact CG2-CG 4.39Å; I342-L346 WeakPolarHBondContact O-CG 3.27Å; I342-L346 PolarHBondContact O-N 3.03Å; I342-I361 HydrophobicContact CD1-CG1 4.37Å; I342-I361 HydrophobicContact CG1-CG1 4.21Å; I342-I361 HydrophobicContact CG2-CD1 3.64Å; I342-I361 HydrophobicContact CG2-CG1 3.76Å; I342-F364 HydrophobicContact CD1-CB 4.42Å; I342-F364 HydrophobicContact CD1-CD1 3.3Å; I342-F364 HydrophobicContact CD1-CE1 3.55Å; I342-F364 HydrophobicContact CD1-CG 3.9Å; I342-F364 HydrophobicContact CD1-CZ 4.33Å; I342-V376 HydrophobicContact CG2-CG2 4.34Å
343	T	83.6	Confident	83.8	Confident	6 Å²	6	31.9 Å²	31.9	4%	0.037	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-34.9	-179.4	-54.5	0	0	0	0	111.6	N309 T339 A341 K347 V375	N309-T343 WeakPolarHBondContact ND2-CB 3.25Å; N309-T343 WeakPolarHBondContact ND2-CG2 3.17Å; T339-T343 WeakPolarHBondContact O-CB 3.47Å; T339-T343 PolarHBondContact O-N 2.95Å; T339-T343 PolarHBondContact O-OG1 2.76Å; A341-T343 PolarHBondContact O-N 3.02Å; T343-K347 WeakPolarHBondContact O-CD 3.49Å; T343-K347 WeakPolarHBondContact O-CG 3.3Å; T343-V375 HydrophobicContact CG2-CG1 3.73Å
344	T	87.5	Confident	83.6	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-71	-46.6	176.3	-52.2	0	0	0	0	110.7	N309 A312 V319 L326 L340 A341 I342 L346 K347 T348	N309-T344 WeakPolarHBondContact CA-OG1 3.13Å; N309-T344 VanDerWaalsContact CB-OG1 3.26Å; N309-T344 WeakPolarHBondContact CB-OG1 3.47Å; N309-T344 PolarHBondContact ND2-N 3.18Å; N309-T344 PolarHBondContact ND2-OG1 3.29Å; A312-T344 HydrophobicContact CB-CG2 3.93Å; V319-T344 HydrophobicContact CG1-CG2 3.96Å; L326-T344 HydrophobicContact CD1-CG2 3.6Å; L340-T344 WeakPolarHBondContact O-CB 3.48Å; L340-T344 PolarHBondContact O-N 2.84Å; L340-T344 PolarHBondContact O-OG1 3.3Å; A341-T344 PolarHBondContact O-N 3.36Å; A341-T344 VanDerWaalsContact O-N 3.15Å; I342-T344 PolarHBondContact O-N 3.47Å; T344-L346 VanDerWaalsContact C-N 3.33Å; T344-L346 PolarHBondContact O-N 2.94Å; T344-K347 WeakPolarHBondContact O-CA 3.49Å; T344-K347 WeakPolarHBondContact O-CB 3.15Å; T344-K347 PolarHBondContact O-N 3.5Å; T344-T348 HydrophobicContact CG2-CG2 4.39Å; T344-T348 PolarHBondContact O-N 3.4Å; T344-T348 PolarHBondContact O-OG1 2.65Å
345	L	86.9	Confident	83.5	Confident	2 Å²	2	28.4 Å²	28.4	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-62.1	-35.7	178.9	-73.5	168.1	0	0	0	113.2	N323 L326 E327 I330 A341 I342 K347 T348 G349 L357	N323-L345 HydrophobicContact CB-CD2 3.86Å; L326-L345 HydrophobicContact CB-CD1 4.16Å; L326-L345 HydrophobicContact CB-CD2 3.89Å; L326-L345 HydrophobicContact CB-CG 3.92Å; E327-L345 HydrophobicContact CG-CD1 3.88Å; E327-L345 HydrophobicContact CG-CD2 4.07Å; I330-L345 HydrophobicContact CD1-CD1 3.73Å; I330-L345 HydrophobicContact CG1-CD1 4.02Å; A341-L345 WeakPolarHBondContact O-CB 3.25Å; A341-L345 VanDerWaalsContact O-CG 3.31Å; A341-L345 WeakPolarHBondContact O-CG 3.42Å; A341-L345 PolarHBondContact O-N 3.25Å; I342-L345 PolarHBondContact O-N 3.34Å; L345-K347 PolarHBondContact O-N 3Å; L345-T348 PolarHBondContact O-N 3.05Å; L345-G349 WeakPolarHBondContact O-CA 3.11Å; L345-G349 PolarHBondContact O-N 3.4Å; L345-L357 HydrophobicContact CB-CD1 4.32Å; L345-L357 HydrophobicContact CB-CD2 4.02Å; L345-L357 HydrophobicContact CD1-CD2 3.91Å; L345-L357 HydrophobicContact CG-CD2 4.41Å
346	L	81.6	Confident	83.4	Confident	1 Å²	1	29 Å²	29	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-66.9	-28.4	174.3	-68.8	172.8	0	0	0	112.2	I342 T344 M358 I361 V376 A379 L383 R386	I342-L346 HydrophobicContact CG2-CD1 3.97Å; I342-L346 HydrophobicContact CG2-CG 4.39Å; I342-L346 WeakPolarHBondContact O-CG 3.27Å; I342-L346 PolarHBondContact O-N 3.03Å; T344-L346 VanDerWaalsContact C-N 3.33Å; T344-L346 PolarHBondContact O-N 2.94Å; L346-M358 HydrophobicContact CD2-CE 3.36Å; L346-I361 HydrophobicContact CD1-CD1 4.22Å; L346-I361 HydrophobicContact CD2-CD1 3.8Å; L346-I361 HydrophobicContact CG-CD1 4.13Å; L346-V376 HydrophobicContact CD1-CG1 4.05Å; L346-A379 HydrophobicContact CB-CB 3.68Å; L346-A379 HydrophobicContact CD1-CB 3.72Å; L346-A379 HydrophobicContact CG-CB 4.34Å; L346-L383 HydrophobicContact CD2-CD2 4.33Å; L346-R386 PolarHBondContact O-NH2 3.39Å
347	K	81.2	Confident	83.3	Confident	24 Å²	24	26.4 Å²	26.4	10%	0.104	14%	0.139	C	C	.	.	H	α-helix	trans	-81.1	-37	177.2	-67.5	169.9	-169	173	0	112.3	N309 A312 M313 T343 T344 L345 R386	N309-K347 PolarHBondContact OD1-NZ 3.48Å; A312-K347 HydrophobicContact CB-CB 4.22Å; A312-K347 HydrophobicContact CB-CD 4.31Å; M313-K347 HydrophobicContact CE-CD 4.45Å; M313-K347 VanDerWaalsContact CE-CE 3.48Å; M313-K347 HydrophobicContact CG-CD 4.43Å; M313-K347 HydrophobicContact SD-CD 3.59Å; M313-K347 VanDerWaalsContact SD-CD 3.59Å; M313-K347 WeakPolarHBondContact SD-CE 3.47Å; M313-K347 PolarHBondContact SD-NZ 3.3Å; T343-K347 WeakPolarHBondContact O-CD 3.49Å; T343-K347 WeakPolarHBondContact O-CG 3.3Å; T344-K347 WeakPolarHBondContact O-CA 3.49Å; T344-K347 WeakPolarHBondContact O-CB 3.15Å; T344-K347 PolarHBondContact O-N 3.5Å; L345-K347 PolarHBondContact O-N 3Å; K347-R386 PolarHBondContact O-NH1 3.29Å; K347-R386 PolarHBondContact O-NH2 2.93Å
348	T	85.6	Confident	83	Confident	5 Å²	5	26.6 Å²	26.6	3%	0.031	14%	0.14	C	C	.	.	H	α-helix	trans	-101.3	-0.1	-175.6	59.8	0	0	0	0	113.7	A312 V319 N323 T344 L345 A350	A312-T348 HydrophobicContact CB-CG2 3.79Å; V319-T348 HydrophobicContact CB-CG2 3.77Å; V319-T348 HydrophobicContact CG1-CG2 3.79Å; N323-T348 PolarHBondContact ND2-O 2.89Å; N323-T348 WeakPolarHBondContact OD1-CB 3.15Å; N323-T348 PolarHBondContact OD1-OG1 3.13Å; T344-T348 HydrophobicContact CG2-CG2 4.39Å; T344-T348 PolarHBondContact O-N 3.4Å; T344-T348 PolarHBondContact O-OG1 2.65Å; L345-T348 PolarHBondContact O-N 3.05Å; T348-A350 PolarHBondContact O-N 3.48Å
349	G	77.3	Confident	82.9	Confident	4 Å²	4	33.1 Å²	33.1	4%	0.041	17%	0.171	C	C	.	.			trans	-65.8	130.3	-174.9	0	0	0	0	0	111.6	L345	L345-G349 WeakPolarHBondContact O-CA 3.11Å; L345-G349 PolarHBondContact O-N 3.4Å
350	A	77.6	Confident	82.8	Confident	26 Å²	26	36.5 Å²	36.5	22%	0.215	19%	0.186	C	C	.	.			trans	-81	157.7	170.5	0	0	0	0	0	110.4	M320 T348 S352 S353 V354	M320-A350 HydrophobicContact CE-CB 4.35Å; T348-A350 PolarHBondContact O-N 3.48Å; A350-S352 PolarHBondContact O-N 3.07Å; A350-S353 PolarHBondContact N-OG 3.05Å; A350-S353 VanDerWaalsContact N-OG 3.14Å; A350-S353 PolarHBondContact O-N 3.4Å; A350-S353 PolarHBondContact O-OG 3.39Å; A350-V354 PolarHBondContact O-N 3.21Å
351	E	79.9	Confident	82.6	Confident	87 Å²	87	34.9 Å²	34.9	41%	0.407	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-35.5	-178.7	-173	177.4	177.6	0	0	113.7	S353 Y387 K390	E351-S353 VanDerWaalsContact C-N 3.32Å; E351-S353 PolarHBondContact O-N 3.33Å; E351-Y387 HydrophobicContact CB-CD1 3.9Å; E351-Y387 HydrophobicContact CB-CE1 3.86Å; E351-Y387 HydrophobicContact CB-CG 4.36Å; E351-Y387 HydrophobicContact CG-CD1 4.17Å; E351-Y387 HydrophobicContact CG-CG 4.46Å; E351-K390 HydrophobicContact CG-CD 4.34Å; E351-K390 HydrophobicContact CG-CG 3.98Å; E351-K390 WeakPolarHBondContact OE1-CE 3.41Å
352	S	81.1	Confident	82.2	Confident	110 Å²	110	36.3 Å²	36.3	77%	0.769	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-24.4	178.9	56.2	0	0	0	0	114.2	A350	A350-S352 PolarHBondContact O-N 3.07Å
353	S	80.6	Confident	81.9	Confident	13 Å²	13	38.8 Å²	38.8	9%	0.091	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-17.6	-176	64	0	0	0	0	113.8	A350 E351 E355 R356 L357	A350-S353 PolarHBondContact N-OG 3.05Å; A350-S353 VanDerWaalsContact N-OG 3.14Å; A350-S353 PolarHBondContact O-N 3.4Å; A350-S353 PolarHBondContact O-OG 3.39Å; E351-S353 VanDerWaalsContact C-N 3.32Å; E351-S353 PolarHBondContact O-N 3.33Å; S353-E355 VanDerWaalsContact C-N 3.33Å; S353-E355 PolarHBondContact O-N 3.39Å; S353-R356 PolarHBondContact O-N 3.41Å; S353-L357 WeakPolarHBondContact O-CG 3.47Å; S353-L357 PolarHBondContact O-N 3.5Å
354	V	81.6	Confident	81.6	Confident	2 Å²	2	39 Å²	39	1%	0.012	22%	0.216	C	C	.	.	H	α-helix	trans	-54.1	-47.5	-172	177.6	0	0	0	0	112.1	A350 L357 M358 L383 M394	A350-V354 PolarHBondContact O-N 3.21Å; V354-L357 PolarHBondContact O-N 3.29Å; V354-M358 HydrophobicContact CG1-CG 4.36Å; V354-M358 VanDerWaalsContact O-CG 3.29Å; V354-M358 WeakPolarHBondContact O-CG 3.36Å; V354-M358 PolarHBondContact O-N 3.1Å; V354-L383 HydrophobicContact CG1-CD2 3.9Å; V354-L383 HydrophobicContact CG2-CD1 4.3Å; V354-L383 HydrophobicContact CG2-CD2 4.02Å; V354-L383 HydrophobicContact CG2-CG 4.4Å; V354-M394 HydrophobicContact CG1-CG 4.15Å; V354-M394 HydrophobicContact CG1-SD 4.14Å
355	E	82.9	Confident	81.2	Confident	103 Å²	103	39.1 Å²	39.1	48%	0.481	22%	0.217	S	C	.	.	H	α-helix	trans	-64.8	-44.5	-176.4	-172.1	171.6	-175.5	0	0	112.4	S353 M358 Q359 V393	S353-E355 VanDerWaalsContact C-N 3.33Å; S353-E355 PolarHBondContact O-N 3.39Å; E355-M358 PolarHBondContact O-N 3.21Å; E355-Q359 WeakPolarHBondContact O-CG 3.44Å; E355-Q359 PolarHBondContact O-N 3.08Å; E355-Q359 VanDerWaalsContact O-N 3.16Å; E355-V393 HydrophobicContact CG-CG1 4.36Å
356	R	82.3	Confident	80.9	Confident	125 Å²	125	44.5 Å²	44.5	47%	0.472	25%	0.245	S	C	.	.	H	α-helix	trans	-62.6	-43.6	175.8	-177.4	174.5	68.8	-165.5	0.8	111.5	E327 S353 Q359 Q360	E327-R356 IonicContact OE1-CZ 3.4Å; E327-R356 IonicContact OE1-NE 3.92Å; E327-R356 IonicContact OE1-NH2 3.77Å; E327-R356 PolarHBondContact OE1-NH2 3.11Å; E327-R356 IonicContact OE2-CZ 2.78Å; E327-R356 IonicContact OE2-NE 3.75Å; E327-R356 IonicContact OE2-NH2 2.84Å; E327-R356 PolarHBondContact OE2-NH2 3.23Å; S353-R356 PolarHBondContact O-N 3.41Å; R356-Q359 PolarHBondContact O-N 3.49Å; R356-Q360 WeakPolarHBondContact O-CG 3.32Å; R356-Q360 PolarHBondContact O-N 2.96Å; R356-Q360 VanDerWaalsContact O-N 3.14Å
357	L	82	Confident	80.9	Confident	2 Å²	2	50 Å²	50	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-62	-46.5	178.4	-70.7	172.5	0	0	0	111.2	E327 I330 L345 S353 V354 Q359 Q360 I361	E327-L357 HydrophobicContact CG-CD2 4.39Å; I330-L357 HydrophobicContact CD1-CD2 4.26Å; L345-L357 HydrophobicContact CB-CD1 4.32Å; L345-L357 HydrophobicContact CB-CD2 4.02Å; L345-L357 HydrophobicContact CD1-CD2 3.91Å; L345-L357 HydrophobicContact CG-CD2 4.41Å; S353-L357 WeakPolarHBondContact O-CG 3.47Å; S353-L357 PolarHBondContact O-N 3.5Å; V354-L357 PolarHBondContact O-N 3.29Å; L357-Q359 VanDerWaalsContact C-N 3.31Å; L357-Q359 PolarHBondContact O-N 3.25Å; L357-Q360 PolarHBondContact O-N 3.04Å; L357-I361 HydrophobicContact CB-CD1 4.34Å; L357-I361 WeakPolarHBondContact O-CB 3.34Å; L357-I361 WeakPolarHBondContact O-CD1 3.16Å; L357-I361 WeakPolarHBondContact O-CG1 3.41Å; L357-I361 PolarHBondContact O-N 3.3Å
358	M	83.6	Confident	80.8	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.02	27%	0.27	C	S	.	.	H	α-helix	trans	-59.2	-41.1	178.1	-69.7	-62.5	104.4	0	0	112.1	L346 V354 E355 I361 A362 I380 V393 M394 F397	L346-M358 HydrophobicContact CD2-CE 3.36Å; V354-M358 HydrophobicContact CG1-CG 4.36Å; V354-M358 VanDerWaalsContact O-CG 3.29Å; V354-M358 WeakPolarHBondContact O-CG 3.36Å; V354-M358 PolarHBondContact O-N 3.1Å; E355-M358 PolarHBondContact O-N 3.21Å; M358-I361 HydrophobicContact CE-CD1 3.95Å; M358-A362 PolarHBondContact O-N 3.29Å; M358-I380 HydrophobicContact CE-CD1 4.44Å; M358-I380 HydrophobicContact CE-CG1 4.13Å; M358-I380 HydrophobicContact SD-CD1 4.3Å; M358-I380 HydrophobicContact SD-CG1 4.4Å; M358-V393 HydrophobicContact CB-CG1 4.37Å; M358-V393 HydrophobicContact CG-CG1 4.33Å; M358-M394 HydrophobicContact SD-CG 4.45Å; M358-F397 HydrophobicContact SD-CD1 3.64Å; M358-F397 HydrophobicContact SD-CE1 3.96Å; M358-F397 HydrophobicContact SD-CG 4Å
359	Q	83.9	Confident	80.8	Confident	137 Å²	137	52.1 Å²	52.1	64%	0.64	29%	0.288	S	S	*	.	H	α-helix	trans	-64	-42.3	177.2	-72.5	179.4	1.6	0	0	112.7	E355 R356 L357 A362	E355-Q359 WeakPolarHBondContact O-CG 3.44Å; E355-Q359 PolarHBondContact O-N 3.08Å; E355-Q359 VanDerWaalsContact O-N 3.16Å; R356-Q359 PolarHBondContact O-N 3.49Å; L357-Q359 VanDerWaalsContact C-N 3.31Å; L357-Q359 PolarHBondContact O-N 3.25Å; Q359-A362 WeakPolarHBondContact O-CB 3.34Å
360	Q	80.4	Confident	81.1	Confident	78 Å²	78	53.8 Å²	53.8	36%	0.364	30%	0.295	S	S	.	.	H	α-helix	trans	-69.3	-40.6	179.1	-70.3	175.6	-25.4	0	0	112	I330 R356 L357 A362 G363	I330-Q360 HydrophobicContact CD1-CB 4.42Å; I330-Q360 HydrophobicContact CG2-CB 4.26Å; R356-Q360 WeakPolarHBondContact O-CG 3.32Å; R356-Q360 PolarHBondContact O-N 2.96Å; R356-Q360 VanDerWaalsContact O-N 3.14Å; L357-Q360 PolarHBondContact O-N 3.04Å; Q360-A362 VanDerWaalsContact C-N 3.3Å; Q360-A362 PolarHBondContact O-N 3.04Å; Q360-G363 PolarHBondContact O-N 3.23Å
361	I	81.9	Confident	81.4	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-66.4	-33.4	179.6	-67.4	166.1	0	0	0	110.9	I342 L346 L357 M358 G363 F364 V365 V376 F397	I342-I361 HydrophobicContact CD1-CG1 4.37Å; I342-I361 HydrophobicContact CG1-CG1 4.21Å; I342-I361 HydrophobicContact CG2-CD1 3.64Å; I342-I361 HydrophobicContact CG2-CG1 3.76Å; L346-I361 HydrophobicContact CD1-CD1 4.22Å; L346-I361 HydrophobicContact CD2-CD1 3.8Å; L346-I361 HydrophobicContact CG-CD1 4.13Å; L357-I361 HydrophobicContact CB-CD1 4.34Å; L357-I361 WeakPolarHBondContact O-CB 3.34Å; L357-I361 WeakPolarHBondContact O-CD1 3.16Å; L357-I361 WeakPolarHBondContact O-CG1 3.41Å; L357-I361 PolarHBondContact O-N 3.3Å; M358-I361 HydrophobicContact CE-CD1 3.95Å; I361-G363 PolarHBondContact O-N 3.17Å; I361-F364 PolarHBondContact O-N 3.01Å; I361-V365 HydrophobicContact CG2-CG2 3.29Å; I361-V365 VanDerWaalsContact O-CG2 3.32Å; I361-V365 WeakPolarHBondContact O-CG2 3.34Å; I361-V365 PolarHBondContact O-N 2.84Å; I361-V376 HydrophobicContact CG2-CG1 4.25Å; I361-F397 HydrophobicContact CB-CZ 4.45Å; I361-F397 HydrophobicContact CG2-CZ 3.91Å
362	A	81.3	Confident	81.3	Confident	30 Å²	30	59.7 Å²	59.7	25%	0.248	32%	0.317	C	S	.	.	H	α-helix	trans	-55	-35.3	179.6	0	0	0	0	0	114.4	M358 Q359 Q360 F397	M358-A362 PolarHBondContact O-N 3.29Å; Q359-A362 WeakPolarHBondContact O-CB 3.34Å; Q360-A362 VanDerWaalsContact C-N 3.3Å; Q360-A362 PolarHBondContact O-N 3.04Å; A362-F397 HydrophobicContact CB-CD2 4.45Å; A362-F397 HydrophobicContact CB-CE2 3.73Å
363	G	76.9	Confident	81.6	Confident	54 Å²	54	55.2 Å²	55.2	56%	0.557	28%	0.284	S	S	*	.	H	α-helix	trans	-77.3	-30.2	177.1	0	0	0	0	0	113.3	Q360 I361	Q360-G363 PolarHBondContact O-N 3.23Å; I361-G363 PolarHBondContact O-N 3.17Å
364	F	78.4	Confident	81.9	Confident	11 Å²	11	56.6 Å²	56.6	5%	0.048	29%	0.29	C	S	.	.	H	α-helix	trans	-88.6	-32.4	-174.3	180	-95.1	0	0	0	113.6	R335 A338 I342 I361 N366 E367 I368	R335-F364 VanDerWaalsContact NH1-CD2 3.35Å; R335-F364 VanDerWaalsContact NH1-CE2 3.31Å; A338-F364 HydrophobicContact CB-CD2 4.49Å; A338-F364 HydrophobicContact CB-CE2 3.58Å; A338-F364 HydrophobicContact CB-CZ 3.65Å; I342-F364 HydrophobicContact CD1-CB 4.42Å; I342-F364 HydrophobicContact CD1-CD1 3.3Å; I342-F364 HydrophobicContact CD1-CE1 3.55Å; I342-F364 HydrophobicContact CD1-CG 3.9Å; I342-F364 HydrophobicContact CD1-CZ 4.33Å; I361-F364 PolarHBondContact O-N 3.01Å; F364-N366 PolarHBondContact O-N 2.86Å; F364-N366 VanDerWaalsContact O-N 3.16Å; F364-E367 WeakPolarHBondContact O-CB 3.33Å; F364-E367 PolarHBondContact O-N 3.12Å; F364-I368 HydrophobicContact CD1-CD1 4.39Å; F364-I368 HydrophobicContact CD1-CG2 3.93Å; F364-I368 HydrophobicContact CE1-CB 4.49Å; F364-I368 HydrophobicContact CE1-CD1 4.22Å; F364-I368 HydrophobicContact CE1-CG2 3.25Å; F364-I368 HydrophobicContact CE2-CG2 4.32Å; F364-I368 HydrophobicContact CZ-CG2 3.47Å; F364-I368 VanDerWaalsContact CZ-CG2 3.47Å
365	V	79.3	Confident	81.9	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.012	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-59.9	-29.6	-173.9	162.2	0	0	0	0	113.3	I361 E367 I368 K373 V376 F397 M401	I361-V365 HydrophobicContact CG2-CG2 3.29Å; I361-V365 VanDerWaalsContact O-CG2 3.32Å; I361-V365 WeakPolarHBondContact O-CG2 3.34Å; I361-V365 PolarHBondContact O-N 2.84Å; V365-E367 PolarHBondContact O-N 3.06Å; V365-I368 WeakPolarHBondContact O-CG1 3.35Å; V365-K373 HydrophobicContact CG1-CD 4.3Å; V365-K373 HydrophobicContact CG1-CG 4.21Å; V365-K373 WeakPolarHBondContact O-CE 3.44Å; V365-V376 HydrophobicContact CG2-CG1 4.5Å; V365-F397 HydrophobicContact CG2-CZ 4.5Å; V365-M401 HydrophobicContact CG1-CE 3.8Å; V365-M401 HydrophobicContact CG1-CG 4.32Å; V365-M401 HydrophobicContact CG1-SD 4.26Å
366	N	79.9	Confident	81.9	Confident	114 Å²	114	53.4 Å²	53.4	61%	0.61	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-75.3	-14	178.1	-66.3	-20.6	0	0	0	113.2	F364	F364-N366 PolarHBondContact O-N 2.86Å; F364-N366 VanDerWaalsContact O-N 3.16Å
367	E	80.6	Confident	82.2	Confident	116 Å²	116	47.5 Å²	47.5	54%	0.542	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-99.2	-0.5	-176	-55.9	-174.9	151.8	0	0	113.1	R335 F364 V365	R335-E367 IonicContact CZ-OE2 3.41Å; R335-E367 IonicContact NH1-OE2 2.62Å; R335-E367 PolarHBondContact NH1-OE2 3.14Å; R335-E367 IonicContact NH2-OE2 3.62Å; R335-E367 PolarHBondContact NH2-OE2 2.98Å; F364-E367 WeakPolarHBondContact O-CB 3.33Å; F364-E367 PolarHBondContact O-N 3.12Å; V365-E367 PolarHBondContact O-N 3.06Å
368	I	80.1	Confident	82.3	Confident	18 Å²	18	50.5 Å²	50.5	9%	0.092	27%	0.271	C	S	.	.	S	Bend	trans	-111.2	159.5	-177.6	56.5	169.6	0	0	0	112.5	F364 V365 F372 K373	F364-I368 HydrophobicContact CD1-CD1 4.39Å; F364-I368 HydrophobicContact CD1-CG2 3.93Å; F364-I368 HydrophobicContact CE1-CB 4.49Å; F364-I368 HydrophobicContact CE1-CD1 4.22Å; F364-I368 HydrophobicContact CE1-CG2 3.25Å; F364-I368 HydrophobicContact CE2-CG2 4.32Å; F364-I368 HydrophobicContact CZ-CG2 3.47Å; F364-I368 VanDerWaalsContact CZ-CG2 3.47Å; V365-I368 WeakPolarHBondContact O-CG1 3.35Å; I368-F372 HydrophobicContact CB-CB 4.37Å; I368-F372 HydrophobicContact CD1-CB 3.92Å; I368-K373 HydrophobicContact CD1-CG 3.93Å; I368-K373 HydrophobicContact CG1-CG 3.84Å; I368-K373 VanDerWaalsContact O-CE 3.27Å; I368-K373 WeakPolarHBondContact O-CE 3.11Å
369	S	84.3	Confident	82.1	Confident	57 Å²	57	50.7 Å²	50.7	40%	0.399	27%	0.273	S	S	.	.			trans	-68.7	155.9	175.7	64.5	0	0	0	0	112	E371 F372 K373	S369-E371 VanDerWaalsContact C-N 3.26Å; S369-E371 PolarHBondContact O-N 3.18Å; S369-F372 PolarHBondContact O-N 3.06Å; S369-F372 VanDerWaalsContact O-N 3.07Å; S369-F372 WeakPolarHBondContact OG-CD2 3.43Å; S369-K373 PolarHBondContact O-N 2.91Å; S369-K373 VanDerWaalsContact O-N 3.13Å
370	D	84	Confident	82.2	Confident	38 Å²	38	44.1 Å²	44.1	20%	0.203	24%	0.243	C	C	.	.	H	α-helix	trans	-60.1	-33.1	-178.3	-76.1	2.4	0	0	0	113.3	F372 K373 I374 S407	D370-F372 VanDerWaalsContact C-N 3.3Å; D370-F372 PolarHBondContact O-N 2.95Å; D370-K373 PolarHBondContact O-N 3.29Å; D370-K373 VanDerWaalsContact O-N 3.13Å; D370-K373 IonicContact OD1-NZ 3.38Å; D370-K373 PolarHBondContact OD1-NZ 2.92Å; D370-I374 WeakPolarHBondContact O-CG1 3.27Å; D370-I374 PolarHBondContact O-N 3.05Å; D370-S407 WeakPolarHBondContact OD2-CB 3.1Å; D370-S407 PolarHBondContact OD2-N 2.95Å; D370-S407 PolarHBondContact OD2-OG 3.33Å
371	E	83.7	Confident	82.5	Confident	149 Å²	149	43.5 Å²	43.5	70%	0.696	24%	0.237	S	C	*	.	H	α-helix	trans	-55.3	-44.4	173.4	-66.8	176.4	-177.6	0	0	111.9	S369 I374 V375	S369-E371 VanDerWaalsContact C-N 3.26Å; S369-E371 PolarHBondContact O-N 3.18Å; E371-I374 PolarHBondContact O-N 3Å; E371-V375 PolarHBondContact O-N 2.94Å
372	F	79.3	Confident	82.5	Confident	88 Å²	88	46 Å²	46	39%	0.386	26%	0.255	S	S	.	.	H	α-helix	trans	-74.4	-33.4	177.7	-67.4	-58.3	0	0	0	112.3	T339 I368 S369 D370 I374 V375 V376	T339-F372 HydrophobicContact CG2-CB 4.01Å; T339-F372 HydrophobicContact CG2-CD1 3.5Å; T339-F372 VanDerWaalsContact CG2-CD1 3.5Å; T339-F372 HydrophobicContact CG2-CE1 4.09Å; T339-F372 HydrophobicContact CG2-CG 3.8Å; I368-F372 HydrophobicContact CB-CB 4.37Å; I368-F372 HydrophobicContact CD1-CB 3.92Å; S369-F372 PolarHBondContact O-N 3.06Å; S369-F372 VanDerWaalsContact O-N 3.07Å; S369-F372 WeakPolarHBondContact OG-CD2 3.43Å; D370-F372 VanDerWaalsContact C-N 3.3Å; D370-F372 PolarHBondContact O-N 2.95Å; F372-I374 VanDerWaalsContact C-N 3.28Å; F372-I374 PolarHBondContact O-N 3.41Å; F372-V375 PolarHBondContact O-N 3.49Å; F372-V376 WeakPolarHBondContact O-CG2 3.21Å; F372-V376 PolarHBondContact O-N 3.43Å; F372-V376 VanDerWaalsContact O-N 3.1Å
373	K	86.1	Confident	82.6	Confident	16 Å²	16	44.7 Å²	44.7	7%	0.07	24%	0.244	C	C	.	.	H	α-helix	trans	-62.8	-37.4	174.5	-59	-179.7	-170.7	155.4	0	111.3	V365 I368 S369 D370 V376 V377 Y410	V365-K373 HydrophobicContact CG1-CD 4.3Å; V365-K373 HydrophobicContact CG1-CG 4.21Å; V365-K373 WeakPolarHBondContact O-CE 3.44Å; I368-K373 HydrophobicContact CD1-CG 3.93Å; I368-K373 HydrophobicContact CG1-CG 3.84Å; I368-K373 VanDerWaalsContact O-CE 3.27Å; I368-K373 WeakPolarHBondContact O-CE 3.11Å; S369-K373 PolarHBondContact O-N 2.91Å; S369-K373 VanDerWaalsContact O-N 3.13Å; D370-K373 PolarHBondContact O-N 3.29Å; D370-K373 VanDerWaalsContact O-N 3.13Å; D370-K373 IonicContact OD1-NZ 3.38Å; D370-K373 PolarHBondContact OD1-NZ 2.92Å; K373-V376 WeakPolarHBondContact O-CB 3.5Å; K373-V376 PolarHBondContact O-N 3.37Å; K373-V377 VanDerWaalsContact O-CG2 3.32Å; K373-V377 WeakPolarHBondContact O-CG2 3.44Å; K373-V377 PolarHBondContact O-N 3.45Å; K373-Y410 HydrophobicContact CB-CD2 3.62Å; K373-Y410 HydrophobicContact CB-CE2 3.3Å; K373-Y410 HydrophobicContact CB-CG 4.47Å; K373-Y410 HydrophobicContact CD-CD1 4.37Å; K373-Y410 HydrophobicContact CD-CD2 4.34Å; K373-Y410 HydrophobicContact CD-CE1 3.88Å; K373-Y410 HydrophobicContact CD-CE2 3.88Å; K373-Y410 HydrophobicContact CG-CE2 4.22Å
374	I	87.1	Confident	82.9	Confident	43 Å²	43	42.4 Å²	42.4	22%	0.221	22%	0.219	C	C	.	.	H	α-helix	trans	-59.5	-46	174.5	-68.2	164.4	0	0	0	110.5	D370 E371 F372 V376 V377 D378 D409 Y410 A413	D370-I374 WeakPolarHBondContact O-CG1 3.27Å; D370-I374 PolarHBondContact O-N 3.05Å; E371-I374 PolarHBondContact O-N 3Å; F372-I374 VanDerWaalsContact C-N 3.28Å; F372-I374 PolarHBondContact O-N 3.41Å; I374-V376 VanDerWaalsContact C-N 3.28Å; I374-V376 PolarHBondContact O-N 2.83Å; I374-V377 WeakPolarHBondContact O-CB 3.46Å; I374-V377 PolarHBondContact O-N 2.71Å; I374-V377 VanDerWaalsContact O-N 3.08Å; I374-D378 PolarHBondContact O-N 2.64Å; I374-D409 HydrophobicContact CD1-CB 4.27Å; I374-Y410 HydrophobicContact CG1-CD2 4.21Å; I374-A413 HydrophobicContact CG1-CB 4.25Å; I374-A413 HydrophobicContact CG2-CB 4.15Å
375	V	81.8	Confident	83.1	Confident	35 Å²	35	45 Å²	45	21%	0.212	24%	0.239	C	C	.	.	H	α-helix	trans	-60.4	-37.5	176.8	178	0	0	0	0	112.2	T343 E371 F372 A379 L594	T343-V375 HydrophobicContact CG2-CG1 3.73Å; E371-V375 PolarHBondContact O-N 2.94Å; F372-V375 PolarHBondContact O-N 3.49Å; V375-A379 WeakPolarHBondContact O-CB 3.27Å; V375-A379 PolarHBondContact O-N 2.87Å; V375-A379 VanDerWaalsContact O-N 3.08Å; V375-L594 HydrophobicContact CG2-CD1 3.94Å
376	V	83.6	Confident	83.3	Confident	3 Å²	3	50 Å²	50	2%	0.018	26%	0.257	C	S	.	.	H	α-helix	trans	-65	-42.6	174.7	171.6	0	0	0	0	111	I342 L346 I361 V365 F372 K373 I374 A379 I380	I342-V376 HydrophobicContact CG2-CG2 4.34Å; L346-V376 HydrophobicContact CD1-CG1 4.05Å; I361-V376 HydrophobicContact CG2-CG1 4.25Å; V365-V376 HydrophobicContact CG2-CG1 4.5Å; F372-V376 WeakPolarHBondContact O-CG2 3.21Å; F372-V376 PolarHBondContact O-N 3.43Å; F372-V376 VanDerWaalsContact O-N 3.1Å; K373-V376 WeakPolarHBondContact O-CB 3.5Å; K373-V376 PolarHBondContact O-N 3.37Å; I374-V376 VanDerWaalsContact C-N 3.28Å; I374-V376 PolarHBondContact O-N 2.83Å; V376-A379 PolarHBondContact O-N 2.89Å; V376-I380 HydrophobicContact CG1-CD1 3.91Å; V376-I380 VanDerWaalsContact O-CG1 3.3Å; V376-I380 WeakPolarHBondContact O-CG1 3.32Å; V376-I380 PolarHBondContact O-N 3.16Å
377	V	87.9	Confident	83.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-62.3	-45.2	177.8	171.1	0	0	0	0	111.2	K373 I374 A379 I380 R381 L398 M401 Y410 A413 I414 T417	K373-V377 VanDerWaalsContact O-CG2 3.32Å; K373-V377 WeakPolarHBondContact O-CG2 3.44Å; K373-V377 PolarHBondContact O-N 3.45Å; I374-V377 WeakPolarHBondContact O-CB 3.46Å; I374-V377 PolarHBondContact O-N 2.71Å; I374-V377 VanDerWaalsContact O-N 3.08Å; V377-A379 VanDerWaalsContact C-N 3.31Å; V377-A379 PolarHBondContact O-N 3.48Å; V377-I380 WeakPolarHBondContact O-CB 3.42Å; V377-I380 PolarHBondContact O-N 2.94Å; V377-I380 VanDerWaalsContact O-N 3.16Å; V377-R381 PolarHBondContact O-N 3.22Å; V377-L398 HydrophobicContact CG1-CD2 4.38Å; V377-L398 HydrophobicContact CG2-CD2 4.34Å; V377-M401 HydrophobicContact CG2-CE 3.71Å; V377-Y410 HydrophobicContact CG2-CE2 4.06Å; V377-A413 HydrophobicContact CG1-CB 4.35Å; V377-I414 HydrophobicContact CG1-CG1 4.14Å; V377-I414 HydrophobicContact CG2-CD1 4.42Å; V377-I414 HydrophobicContact CG2-CG1 3.59Å; V377-T417 HydrophobicContact CG1-CG2 4.28Å; V377-T417 VanDerWaalsContact CG1-OG1 3.27Å; V377-T417 WeakPolarHBondContact CG1-OG1 3.4Å
378	D	83.7	Confident	83.8	Confident	65 Å²	65	45.1 Å²	45.1	35%	0.348	23%	0.234	S	C	.	.	H	α-helix	trans	-61.2	-40.3	176	-73.5	-26.4	0	0	0	111.9	I374 I380 R381 S382	I374-D378 PolarHBondContact O-N 2.64Å; D378-I380 PolarHBondContact O-N 2.85Å; D378-R381 WeakPolarHBondContact O-CB 3.09Å; D378-R381 PolarHBondContact O-N 2.82Å; D378-S382 PolarHBondContact O-N 2.9Å; D378-S382 VanDerWaalsContact O-N 3.11Å; D378-S382 PolarHBondContact O-OG 3.39Å
379	A	80.9	Confident	84.1	Confident	8 Å²	8	54.2 Å²	54.2	7%	0.066	27%	0.267	C	S	.	.	H	α-helix	trans	-66.5	-36.8	176.5	0	0	0	0	0	112.2	L346 V375 V376 V377 R381 S382 L383	L346-A379 HydrophobicContact CB-CB 3.68Å; L346-A379 HydrophobicContact CD1-CB 3.72Å; L346-A379 HydrophobicContact CG-CB 4.34Å; V375-A379 WeakPolarHBondContact O-CB 3.27Å; V375-A379 PolarHBondContact O-N 2.87Å; V375-A379 VanDerWaalsContact O-N 3.08Å; V376-A379 PolarHBondContact O-N 2.89Å; V377-A379 VanDerWaalsContact C-N 3.31Å; V377-A379 PolarHBondContact O-N 3.48Å; A379-R381 VanDerWaalsContact C-N 3.34Å; A379-S382 PolarHBondContact O-N 2.82Å; A379-L383 WeakPolarHBondContact O-CB 3.26Å; A379-L383 PolarHBondContact O-N 3.36Å
380	I	85.7	Confident	84.2	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-65	-38.7	173.2	-67.6	163.8	0	0	0	110.8	M358 V376 V377 D378 L383 C384 M394 F397 L398	M358-I380 HydrophobicContact CE-CD1 4.44Å; M358-I380 HydrophobicContact CE-CG1 4.13Å; M358-I380 HydrophobicContact SD-CD1 4.3Å; M358-I380 HydrophobicContact SD-CG1 4.4Å; V376-I380 HydrophobicContact CG1-CD1 3.91Å; V376-I380 VanDerWaalsContact O-CG1 3.3Å; V376-I380 WeakPolarHBondContact O-CG1 3.32Å; V376-I380 PolarHBondContact O-N 3.16Å; V377-I380 WeakPolarHBondContact O-CB 3.42Å; V377-I380 PolarHBondContact O-N 2.94Å; V377-I380 VanDerWaalsContact O-N 3.16Å; D378-I380 PolarHBondContact O-N 2.85Å; I380-L383 WeakPolarHBondContact O-CB 2.9Å; I380-L383 PolarHBondContact O-N 2.95Å; I380-C384 PolarHBondContact O-N 3.32Å; I380-C384 PolarHBondContact O-SG 2.83Å; I380-M394 HydrophobicContact CG2-CB 4.17Å; I380-M394 HydrophobicContact CG2-CG 4.43Å; I380-M394 HydrophobicContact CG2-SD 4.36Å; I380-F397 HydrophobicContact CD1-CD1 3.82Å; I380-F397 HydrophobicContact CD1-CE1 3.63Å; I380-L398 HydrophobicContact CB-CD2 4.46Å; I380-L398 HydrophobicContact CD1-CD2 4.06Å; I380-L398 HydrophobicContact CG2-CD1 3.96Å; I380-L398 HydrophobicContact CG2-CD2 4.09Å; I380-L398 HydrophobicContact CG2-CG 4.07Å
381	R	85.5	Confident	84.3	Confident	64 Å²	64	53.4 Å²	53.4	24%	0.242	26%	0.255	C	S	.	.	H	α-helix	trans	-57.2	-51.4	174.2	-172.6	-179.5	173.4	175.3	0.7	111.2	V377 D378 A379 L383 C384 S385 T417	V377-R381 PolarHBondContact O-N 3.22Å; D378-R381 WeakPolarHBondContact O-CB 3.09Å; D378-R381 PolarHBondContact O-N 2.82Å; A379-R381 VanDerWaalsContact C-N 3.34Å; R381-L383 PolarHBondContact O-N 2.91Å; R381-C384 PolarHBondContact O-N 2.81Å; R381-S385 PolarHBondContact O-N 3.31Å; R381-T417 HydrophobicContact CB-CG2 3.63Å; R381-T417 HydrophobicContact CG-CG2 4.04Å
382	S	82.9	Confident	84.6	Confident	56 Å²	56	50.6 Å²	50.6	39%	0.392	25%	0.248	S	C	.	.	H	α-helix	trans	-62.1	-31.5	177.2	-57.4	0	0	0	0	112.8	D378 A379 R386	D378-S382 PolarHBondContact O-N 2.9Å; D378-S382 VanDerWaalsContact O-N 3.11Å; D378-S382 PolarHBondContact O-OG 3.39Å; A379-S382 PolarHBondContact O-N 2.82Å; S382-R386 WeakPolarHBondContact O-CG 3.18Å; S382-R386 PolarHBondContact O-N 3.46Å; S382-R386 PolarHBondContact O-NE 3.25Å
383	L	82.7	Confident	85	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-73	-40.2	176.3	-168.6	65.8	0	0	0	112.2	L346 V354 A379 I380 R381 S385 R386 Y387 M394	L346-L383 HydrophobicContact CD2-CD2 4.33Å; V354-L383 HydrophobicContact CG1-CD2 3.9Å; V354-L383 HydrophobicContact CG2-CD1 4.3Å; V354-L383 HydrophobicContact CG2-CD2 4.02Å; V354-L383 HydrophobicContact CG2-CG 4.4Å; A379-L383 WeakPolarHBondContact O-CB 3.26Å; A379-L383 PolarHBondContact O-N 3.36Å; I380-L383 WeakPolarHBondContact O-CB 2.9Å; I380-L383 PolarHBondContact O-N 2.95Å; R381-L383 PolarHBondContact O-N 2.91Å; L383-S385 VanDerWaalsContact C-N 3.34Å; L383-R386 PolarHBondContact O-N 3.48Å; L383-Y387 HydrophobicContact CD1-CD2 3.58Å; L383-Y387 HydrophobicContact CD1-CE2 3.75Å; L383-Y387 HydrophobicContact CG-CD2 4.29Å; L383-Y387 PolarHBondContact O-N 2.81Å; L383-M394 HydrophobicContact CB-SD 4.12Å; L383-M394 HydrophobicContact CD2-SD 3.8Å; L383-M394 HydrophobicContact CG-SD 3.87Å
384	C	83.5	Confident	85.1	Confident	7 Å²	7	47.5 Å²	47.5	5%	0.047	24%	0.238	C	C	.	.	H	α-helix	trans	-62.8	-40.6	174.7	-69.3	0	0	0	0	111.9	I380 R381 R386 Y387 P388 M394 I421	I380-C384 PolarHBondContact O-N 3.32Å; I380-C384 PolarHBondContact O-SG 2.83Å; R381-C384 PolarHBondContact O-N 2.81Å; C384-R386 VanDerWaalsContact C-N 3.33Å; C384-R386 PolarHBondContact O-N 3.04Å; C384-Y387 CarbonylContact O-C 3.53Å; C384-P388 WeakPolarHBondContact O-CA 3.37Å; C384-M394 HydrophobicContact CB-CE 4.15Å; C384-M394 WeakPolarHBondContact SG-CE 3.42Å; C384-M394 PolarHBondContact SG-SD 2.91Å; C384-I421 HydrophobicContact CB-CD1 3.96Å; C384-I421 HydrophobicContact CB-CG1 3.81Å; C384-I421 VanDerWaalsContact SG-CD1 3.52Å
385	S	83.1	Confident	85.2	Confident	65 Å²	65	45.6 Å²	45.6	46%	0.455	23%	0.228	S	C	.	.	H	α-helix	trans	-65.3	-37.1	177.1	-154.9	0	0	0	0	111.7	R381 L383 E424	R381-S385 PolarHBondContact O-N 3.31Å; L383-S385 VanDerWaalsContact C-N 3.34Å; S385-E424 WeakPolarHBondContact CB-OE2 3.48Å; S385-E424 PolarHBondContact OG-OE2 2.89Å
386	R	83.1	Confident	85.6	Confident	107 Å²	107	46.8 Å²	46.8	40%	0.404	24%	0.236	S	C	.	.	H	α-helix	trans	-76	-36.5	176.6	-75.1	-176.2	-71	-179.1	8.4	114.3	L346 K347 S382 L383 C384	L346-R386 PolarHBondContact O-NH2 3.39Å; K347-R386 PolarHBondContact O-NH1 3.29Å; K347-R386 PolarHBondContact O-NH2 2.93Å; S382-R386 WeakPolarHBondContact O-CG 3.18Å; S382-R386 PolarHBondContact O-N 3.46Å; S382-R386 PolarHBondContact O-NE 3.25Å; L383-R386 PolarHBondContact O-N 3.48Å; C384-R386 VanDerWaalsContact C-N 3.33Å; C384-R386 PolarHBondContact O-N 3.04Å
387	Y	85.5	Confident	85.9	Confident	68 Å²	68	47.6 Å²	47.6	27%	0.267	24%	0.239	S	C	.	.			trans	-125.8	73.3	-180	-56.1	-65.6	0	0	0	111.8	E351 L383 C384 R389 K390	E351-Y387 HydrophobicContact CB-CD1 3.9Å; E351-Y387 HydrophobicContact CB-CE1 3.86Å; E351-Y387 HydrophobicContact CB-CG 4.36Å; E351-Y387 HydrophobicContact CG-CD1 4.17Å; E351-Y387 HydrophobicContact CG-CG 4.46Å; L383-Y387 HydrophobicContact CD1-CD2 3.58Å; L383-Y387 HydrophobicContact CD1-CE2 3.75Å; L383-Y387 HydrophobicContact CG-CD2 4.29Å; L383-Y387 PolarHBondContact O-N 2.81Å; C384-Y387 CarbonylContact O-C 3.53Å; Y387-R389 VanDerWaalsContact C-N 3.25Å; Y387-R389 PolarHBondContact O-N 3.02Å; Y387-R389 VanDerWaalsContact O-N 3.12Å; Y387-K390 PolarHBondContact O-N 3.48Å
388	P	85	Confident	86.1	Confident	60 Å²	60	47.6 Å²	47.6	39%	0.39	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-57.9	-32.7	-173.1	-27.4	35.5	0	0	0	114.3	C384 K390 H391 N425	C384-P388 WeakPolarHBondContact O-CA 3.37Å; P388-K390 PolarHBondContact O-N 3.24Å; P388-H391 WeakPolarHBondContact O-CB 3.46Å; P388-H391 PolarHBondContact O-N 2.74Å; P388-H391 PolarHBondContact O-ND1 2.79Å; P388-N425 PolarHBondContact O-ND2 2.91Å; P388-N425 VanDerWaalsContact O-ND2 3.11Å
389	R	86.9	Confident	86.4	Confident	208 Å²	208	44.7 Å²	44.7	79%	0.785	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-66.3	-22.3	-180	-69	-175.7	176.9	172.1	0.5	113.9	Y387 H391	Y387-R389 VanDerWaalsContact C-N 3.25Å; Y387-R389 PolarHBondContact O-N 3.02Å; Y387-R389 VanDerWaalsContact O-N 3.12Å; R389-H391 VanDerWaalsContact C-N 3.27Å; R389-H391 PolarHBondContact O-N 3.49Å
390	K	86.8	Confident	86.8	Confident	56 Å²	56	50.9 Å²	50.9	24%	0.243	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-84.9	5.1	180	-65.6	-64.3	-172.7	178.2	0	113.6	E351 Y387 P388 T392 V393 M394	E351-K390 HydrophobicContact CG-CD 4.34Å; E351-K390 HydrophobicContact CG-CG 3.98Å; E351-K390 WeakPolarHBondContact OE1-CE 3.41Å; Y387-K390 PolarHBondContact O-N 3.48Å; P388-K390 PolarHBondContact O-N 3.24Å; K390-T392 PolarHBondContact O-N 3.03Å; K390-T392 VanDerWaalsContact O-N 3.1Å; K390-V393 PolarHBondContact O-N 2.96Å; K390-M394 VanDerWaalsContact C-CE 3.46Å; K390-M394 HydrophobicContact CB-CE 3.58Å; K390-M394 WeakPolarHBondContact O-CE 3.46Å; K390-M394 PolarHBondContact O-N 3.19Å
391	H	86.8	Confident	86.9	Confident	22 Å²	22	51.3 Å²	51.3	10%	0.102	25%	0.252	C	S	.	.	H	α-helix	trans	-53.5	-28.6	173.5	70.1	-80.1	0	0	0	112.8	P388 R389 V393 M394 M395 N425 A428	P388-H391 WeakPolarHBondContact O-CB 3.46Å; P388-H391 PolarHBondContact O-N 2.74Å; P388-H391 PolarHBondContact O-ND1 2.79Å; R389-H391 VanDerWaalsContact C-N 3.27Å; R389-H391 PolarHBondContact O-N 3.49Å; H391-V393 PolarHBondContact O-N 2.99Å; H391-M394 PolarHBondContact O-N 2.7Å; H391-M395 WeakPolarHBondContact O-CB 3.41Å; H391-M395 PolarHBondContact O-N 3.41Å; H391-N425 PolarHBondContact ND1-ND2 3.18Å; H391-A428 HydrophobicContact CB-CB 4.14Å
392	T	88.6	Confident	87.1	Confident	90 Å²	90	48.4 Å²	48.4	55%	0.552	24%	0.241	S	C	*	.	H	α-helix	trans	-58.6	-25.8	176.6	53	0	0	0	0	114.1	K390 P396	K390-T392 PolarHBondContact O-N 3.03Å; K390-T392 VanDerWaalsContact O-N 3.1Å; T392-P396 VanDerWaalsContact O-CD 3.26Å; T392-P396 WeakPolarHBondContact O-CD 3.44Å; T392-P396 VanDerWaalsContact O-CG 3.26Å; T392-P396 WeakPolarHBondContact O-CG 3.48Å
393	V	88.6	Confident	87.3	Confident	40 Å²	40	53.1 Å²	53.1	24%	0.242	25%	0.25	C	S	.	.	H	α-helix	trans	-100.4	-42.8	176.7	-179	0	0	0	0	111.2	E355 M358 K390 H391 F397	E355-V393 HydrophobicContact CG-CG1 4.36Å; M358-V393 HydrophobicContact CB-CG1 4.37Å; M358-V393 HydrophobicContact CG-CG1 4.33Å; K390-V393 PolarHBondContact O-N 2.96Å; H391-V393 PolarHBondContact O-N 2.99Å; V393-F397 PolarHBondContact O-N 3.47Å
394	M	87.8	Confident	87.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-71.5	-36	-174.5	-68.2	-179	-75.8	0	0	112.8	V354 M358 I380 L383 C384 K390 H391 F397 L398	V354-M394 HydrophobicContact CG1-CG 4.15Å; V354-M394 HydrophobicContact CG1-SD 4.14Å; M358-M394 HydrophobicContact SD-CG 4.45Å; I380-M394 HydrophobicContact CG2-CB 4.17Å; I380-M394 HydrophobicContact CG2-CG 4.43Å; I380-M394 HydrophobicContact CG2-SD 4.36Å; L383-M394 HydrophobicContact CB-SD 4.12Å; L383-M394 HydrophobicContact CD2-SD 3.8Å; L383-M394 HydrophobicContact CG-SD 3.87Å; C384-M394 HydrophobicContact CB-CE 4.15Å; C384-M394 WeakPolarHBondContact SG-CE 3.42Å; C384-M394 PolarHBondContact SG-SD 2.91Å; K390-M394 VanDerWaalsContact C-CE 3.46Å; K390-M394 HydrophobicContact CB-CE 3.58Å; K390-M394 WeakPolarHBondContact O-CE 3.46Å; K390-M394 PolarHBondContact O-N 3.19Å; H391-M394 PolarHBondContact O-N 2.7Å; M394-F397 WeakPolarHBondContact O-CB 3.47Å; M394-F397 PolarHBondContact O-N 2.96Å; M394-L398 WeakPolarHBondContact O-CG 3.5Å; M394-L398 PolarHBondContact O-N 3.43Å
395	M	88.7	Confident	87.4	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.015	30%	0.295	C	S	.	.	H	α-helix	trans	-73.3	-42.9	-175.9	-168.2	164.4	53.7	0	0	112.9	H391 F397 L398 A399 A428 A431 G432	H391-M395 WeakPolarHBondContact O-CB 3.41Å; H391-M395 PolarHBondContact O-N 3.41Å; M395-F397 PolarHBondContact O-N 2.96Å; M395-L398 PolarHBondContact O-N 2.97Å; M395-A399 WeakPolarHBondContact O-CB 3.4Å; M395-A399 PolarHBondContact O-N 3.24Å; M395-A428 HydrophobicContact CE-CB 4.05Å; M395-A428 HydrophobicContact SD-CB 4.23Å; M395-A431 HydrophobicContact CE-CB 3.4Å; M395-G432 WeakPolarHBondContact SD-CA 3.5Å; M395-G432 PolarHBondContact SD-N 3.14Å
396	P	90.6	Very high	87.4	Confident	59 Å²	59	59.4 Å²	59.4	38%	0.383	29%	0.287	S	S	.	.	H	α-helix	trans	-60.5	-32.9	169	-26.1	36.5	0	0	0	113.2	T392 A399 K400	T392-P396 VanDerWaalsContact O-CD 3.26Å; T392-P396 WeakPolarHBondContact O-CD 3.44Å; T392-P396 VanDerWaalsContact O-CG 3.26Å; T392-P396 WeakPolarHBondContact O-CG 3.48Å; P396-A399 PolarHBondContact O-N 2.73Å; P396-K400 WeakPolarHBondContact O-CB 3.46Å; P396-K400 PolarHBondContact O-N 3.17Å
397	F	89.9	Confident	87.7	Confident	21 Å²	21	56.5 Å²	56.5	9%	0.092	28%	0.283	C	S	.	.	H	α-helix	trans	-65.6	-48.7	175.2	-179.5	-99.8	0	0	0	111.9	M358 I361 A362 V365 I380 V393 M394 M395 A399 K400 M401	M358-F397 HydrophobicContact SD-CD1 3.64Å; M358-F397 HydrophobicContact SD-CE1 3.96Å; M358-F397 HydrophobicContact SD-CG 4Å; I361-F397 HydrophobicContact CB-CZ 4.45Å; I361-F397 HydrophobicContact CG2-CZ 3.91Å; A362-F397 HydrophobicContact CB-CD2 4.45Å; A362-F397 HydrophobicContact CB-CE2 3.73Å; V365-F397 HydrophobicContact CG2-CZ 4.5Å; I380-F397 HydrophobicContact CD1-CD1 3.82Å; I380-F397 HydrophobicContact CD1-CE1 3.63Å; V393-F397 PolarHBondContact O-N 3.47Å; M394-F397 WeakPolarHBondContact O-CB 3.47Å; M394-F397 PolarHBondContact O-N 2.96Å; M395-F397 PolarHBondContact O-N 2.96Å; F397-A399 VanDerWaalsContact C-N 3.32Å; F397-A399 PolarHBondContact O-N 2.79Å; F397-K400 PolarHBondContact O-N 3.05Å; F397-M401 HydrophobicContact CD1-SD 3.83Å; F397-M401 HydrophobicContact CE1-CG 4.3Å; F397-M401 HydrophobicContact CE1-SD 3.21Å; F397-M401 WeakPolarHBondContact CE1-SD 3.42Å; F397-M401 HydrophobicContact CZ-CG 4.38Å; F397-M401 HydrophobicContact CZ-SD 3.66Å; F397-M401 PolarHBondContact O-N 3.15Å
398	L	91.1	Very high	87.8	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60	-40.5	173.1	-71.4	173	0	0	0	111.9	V377 I380 M394 M395 M401 L402 I414 T417 I418 I421	V377-L398 HydrophobicContact CG1-CD2 4.38Å; V377-L398 HydrophobicContact CG2-CD2 4.34Å; I380-L398 HydrophobicContact CB-CD2 4.46Å; I380-L398 HydrophobicContact CD1-CD2 4.06Å; I380-L398 HydrophobicContact CG2-CD1 3.96Å; I380-L398 HydrophobicContact CG2-CD2 4.09Å; I380-L398 HydrophobicContact CG2-CG 4.07Å; M394-L398 WeakPolarHBondContact O-CG 3.5Å; M394-L398 PolarHBondContact O-N 3.43Å; M395-L398 PolarHBondContact O-N 2.97Å; L398-M401 WeakPolarHBondContact O-CB 3.47Å; L398-M401 PolarHBondContact O-N 3.23Å; L398-L402 WeakPolarHBondContact O-CB 3.19Å; L398-L402 PolarHBondContact O-N 3.45Å; L398-I414 HydrophobicContact CB-CG2 4.25Å; L398-I414 HydrophobicContact CD2-CG2 4.45Å; L398-T417 HydrophobicContact CD1-CG2 3.85Å; L398-I418 HydrophobicContact CB-CD1 4.28Å; L398-I418 HydrophobicContact CB-CG1 4.22Å; L398-I418 HydrophobicContact CD1-CG1 4.2Å; L398-I421 HydrophobicContact CD1-CD1 3.7Å
399	A	90.1	Very high	88.1	Confident	3 Å²	3	58.7 Å²	58.7	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-63.9	-41	176.9	0	0	0	0	0	112	M395 P396 F397 M401 L402 R403 H435	M395-A399 WeakPolarHBondContact O-CB 3.4Å; M395-A399 PolarHBondContact O-N 3.24Å; P396-A399 PolarHBondContact O-N 2.73Å; F397-A399 VanDerWaalsContact C-N 3.32Å; F397-A399 PolarHBondContact O-N 2.79Å; A399-M401 VanDerWaalsContact C-N 3.35Å; A399-L402 PolarHBondContact O-N 2.93Å; A399-R403 WeakPolarHBondContact O-CG 3.46Å; A399-R403 PolarHBondContact O-N 3.33Å; A399-H435 HydrophobicContact CB-CB 3.83Å; A399-H435 VanDerWaalsContact CB-CG 3.49Å
400	K	89.9	Confident	88.2	Confident	139 Å²	139	48.8 Å²	48.8	60%	0.604	25%	0.253	S	S	*	.	H	α-helix	trans	-62.7	-41.9	174	-174.7	-179.5	177.8	-176.6	0	111.6	P396 F397 L402 R403	P396-K400 WeakPolarHBondContact O-CB 3.46Å; P396-K400 PolarHBondContact O-N 3.17Å; F397-K400 PolarHBondContact O-N 3.05Å; K400-L402 VanDerWaalsContact C-N 3.35Å; K400-R403 PolarHBondContact O-N 3.39Å
401	M	88.8	Confident	88.5	Confident	9 Å²	9	47.2 Å²	47.2	4%	0.044	25%	0.247	C	C	.	.	H	α-helix	trans	-62.5	-41.2	173.9	-78	176.8	69.4	0	0	111.8	V365 V377 F397 L398 A399 R403 S404 Y410 I414	V365-M401 HydrophobicContact CG1-CE 3.8Å; V365-M401 HydrophobicContact CG1-CG 4.32Å; V365-M401 HydrophobicContact CG1-SD 4.26Å; V377-M401 HydrophobicContact CG2-CE 3.71Å; F397-M401 HydrophobicContact CD1-SD 3.83Å; F397-M401 HydrophobicContact CE1-CG 4.3Å; F397-M401 HydrophobicContact CE1-SD 3.21Å; F397-M401 WeakPolarHBondContact CE1-SD 3.42Å; F397-M401 HydrophobicContact CZ-CG 4.38Å; F397-M401 HydrophobicContact CZ-SD 3.66Å; F397-M401 PolarHBondContact O-N 3.15Å; L398-M401 WeakPolarHBondContact O-CB 3.47Å; L398-M401 PolarHBondContact O-N 3.23Å; A399-M401 VanDerWaalsContact C-N 3.35Å; M401-R403 VanDerWaalsContact C-N 3.27Å; M401-R403 PolarHBondContact O-N 2.95Å; M401-S404 WeakPolarHBondContact O-CB 3.43Å; M401-S404 PolarHBondContact O-N 3.3Å; M401-S404 VanDerWaalsContact O-N 3.09Å; M401-S404 PolarHBondContact O-OG 3.32Å; M401-Y410 WeakPolarHBondContact CB-OH 3.48Å; M401-Y410 HydrophobicContact CE-CE2 3.84Å; M401-Y410 WeakPolarHBondContact CE-OH 3.35Å; M401-I414 HydrophobicContact CB-CD1 3.99Å
402	L	89.4	Confident	88.8	Confident	3 Å²	3	49 Å²	49	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-32.5	-179.8	-173.8	59.1	0	0	0	113.2	L398 A399 K400 S404 K411 I414 V415 I418 L436 F439	L398-L402 WeakPolarHBondContact O-CB 3.19Å; L398-L402 PolarHBondContact O-N 3.45Å; A399-L402 PolarHBondContact O-N 2.93Å; K400-L402 VanDerWaalsContact C-N 3.35Å; L402-S404 VanDerWaalsContact C-N 3.32Å; L402-K411 HydrophobicContact CD1-CB 4.22Å; L402-K411 HydrophobicContact CD1-CG 4.4Å; L402-I414 HydrophobicContact CB-CG2 3.92Å; L402-I414 HydrophobicContact CD1-CB 4.15Å; L402-I414 HydrophobicContact CD1-CG2 4.09Å; L402-I414 HydrophobicContact CD2-CG2 4.47Å; L402-I414 HydrophobicContact CG-CG2 4.38Å; L402-V415 HydrophobicContact CD1-CG2 3.85Å; L402-V415 HydrophobicContact CD2-CG2 4.19Å; L402-I418 HydrophobicContact CD2-CD1 4.12Å; L402-L436 HydrophobicContact CD2-CD2 4.32Å; L402-F439 HydrophobicContact CD1-CD2 3.95Å; L402-F439 HydrophobicContact CD1-CE1 4.37Å; L402-F439 HydrophobicContact CD1-CE2 3.65Å; L402-F439 HydrophobicContact CD1-CG 4.4Å; L402-F439 HydrophobicContact CD1-CZ 3.87Å; L402-F439 HydrophobicContact CD2-CB 3.78Å; L402-F439 HydrophobicContact CD2-CD1 4Å; L402-F439 HydrophobicContact CD2-CD2 3.76Å; L402-F439 HydrophobicContact CD2-CE2 4.3Å; L402-F439 HydrophobicContact CD2-CG 3.56Å; L402-F439 HydrophobicContact CG-CB 4.39Å; L402-F439 HydrophobicContact CG-CD1 4.47Å; L402-F439 HydrophobicContact CG-CD2 3.48Å; L402-F439 VanDerWaalsContact CG-CD2 3.48Å; L402-F439 HydrophobicContact CG-CE2 3.73Å; L402-F439 HydrophobicContact CG-CG 3.87Å; L402-F439 HydrophobicContact CG-CZ 4.32Å
403	R	87.1	Confident	88.9	Confident	155 Å²	155	45.2 Å²	45.2	59%	0.585	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-14.5	176.3	-66.1	-177.5	-160.1	153.7	1.8	113.9	A399 K400 M401 E438	A399-R403 WeakPolarHBondContact O-CG 3.46Å; A399-R403 PolarHBondContact O-N 3.33Å; K400-R403 PolarHBondContact O-N 3.39Å; M401-R403 VanDerWaalsContact C-N 3.27Å; M401-R403 PolarHBondContact O-N 2.95Å; R403-E438 IonicContact CZ-OE2 2.88Å; R403-E438 IonicContact NH2-OE2 2.66Å; R403-E438 PolarHBondContact NH2-OE2 3Å
404	S	85.6	Confident	89.1	Confident	28 Å²	28	43.3 Å²	43.3	20%	0.196	22%	0.221	C	C	.	.	S	Bend	trans	-77.9	159	178	70.2	0	0	0	0	111.9	M401 L402 K411	M401-S404 WeakPolarHBondContact O-CB 3.43Å; M401-S404 PolarHBondContact O-N 3.3Å; M401-S404 VanDerWaalsContact O-N 3.09Å; M401-S404 PolarHBondContact O-OG 3.32Å; L402-S404 VanDerWaalsContact C-N 3.32Å; S404-K411 WeakPolarHBondContact O-CE 3.25Å
405	D	81.3	Confident	89.4	Confident	149 Å²	149	43.4 Å²	43.4	80%	0.797	22%	0.221	S	C	*	.			trans	-64.3	137.5	174.3	-66.7	-32.4	0	0	0	110.9
406	G	84.1	Confident	89.5	Confident	27 Å²	27	46.3 Å²	46.3	28%	0.278	24%	0.235	S	C	.	.			trans	177.7	164	179.1	0	0	0	0	0	112.9
407	S	88.3	Confident	89.6	Confident	47 Å²	47	43.5 Å²	43.5	33%	0.329	22%	0.217	S	C	.	.			trans	-61.1	160.8	179.9	58.1	0	0	0	0	113.2	D370 D409 Y410 K411	D370-S407 WeakPolarHBondContact OD2-CB 3.1Å; D370-S407 PolarHBondContact OD2-N 2.95Å; D370-S407 PolarHBondContact OD2-OG 3.33Å; S407-D409 VanDerWaalsContact C-N 3.35Å; S407-D409 PolarHBondContact O-N 3.38Å; S407-Y410 PolarHBondContact O-N 3.46Å; S407-Y410 WeakPolarHBondContact OG-CB 3.4Å; S407-K411 PolarHBondContact O-N 2.95Å
408	Y	89.5	Confident	89.7	Confident	75 Å²	75	42.5 Å²	42.5	29%	0.294	21%	0.212	S	C	.	.	H	α-helix	trans	-55.4	-47.1	175.1	173.7	-99.2	0	0	0	112.4	Y410 K411 K412 H445 N447 L448	Y408-Y410 VanDerWaalsContact C-N 3.32Å; Y408-Y410 PolarHBondContact O-N 3.18Å; Y408-K411 PolarHBondContact O-N 2.96Å; Y408-K412 HydrophobicContact CE1-CD 4.03Å; Y408-K412 VanDerWaalsContact O-CB 3.22Å; Y408-K412 WeakPolarHBondContact O-CB 3.41Å; Y408-K412 PolarHBondContact O-N 3.29Å; Y408-H445 HydrophobicContact CD2-CB 4.25Å; Y408-H445 AromaticContact CD2-CD2 3.88Å; Y408-H445 AromaticContact CD2-CG 3.99Å; Y408-H445 HydrophobicContact CE2-CB 4.47Å; Y408-N447 HydrophobicContact CE2-CB 4.12Å; Y408-N447 WeakPolarHBondContact OH-CB 3.4Å; Y408-L448 HydrophobicContact CD2-CD1 4.29Å; Y408-L448 HydrophobicContact CD2-CG 4.32Å; Y408-L448 HydrophobicContact CE2-CD1 4.31Å; Y408-L448 HydrophobicContact CE2-CD2 4.16Å; Y408-L448 HydrophobicContact CE2-CG 3.85Å
409	D	89.6	Confident	89.7	Confident	98 Å²	98	42.8 Å²	42.8	52%	0.524	21%	0.214	S	C	.	.	H	α-helix	trans	-65	-36.8	-177.1	-66.7	-46	0	0	0	112.3	I374 S407 A413	I374-D409 HydrophobicContact CD1-CB 4.27Å; S407-D409 VanDerWaalsContact C-N 3.35Å; S407-D409 PolarHBondContact O-N 3.38Å; D409-A413 WeakPolarHBondContact O-CB 3.37Å; D409-A413 PolarHBondContact O-N 3.06Å
410	Y	90.5	Very high	89.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65.5	-49.2	174	169.5	-121.9	0	0	0	112.4	K373 I374 V377 M401 S407 Y408 K412 A413 I414	K373-Y410 HydrophobicContact CB-CD2 3.62Å; K373-Y410 HydrophobicContact CB-CE2 3.3Å; K373-Y410 HydrophobicContact CB-CG 4.47Å; K373-Y410 HydrophobicContact CD-CD1 4.37Å; K373-Y410 HydrophobicContact CD-CD2 4.34Å; K373-Y410 HydrophobicContact CD-CE1 3.88Å; K373-Y410 HydrophobicContact CD-CE2 3.88Å; K373-Y410 HydrophobicContact CG-CE2 4.22Å; I374-Y410 HydrophobicContact CG1-CD2 4.21Å; V377-Y410 HydrophobicContact CG2-CE2 4.06Å; M401-Y410 WeakPolarHBondContact CB-OH 3.48Å; M401-Y410 HydrophobicContact CE-CE2 3.84Å; M401-Y410 WeakPolarHBondContact CE-OH 3.35Å; S407-Y410 PolarHBondContact O-N 3.46Å; S407-Y410 WeakPolarHBondContact OG-CB 3.4Å; Y408-Y410 VanDerWaalsContact C-N 3.32Å; Y408-Y410 PolarHBondContact O-N 3.18Å; Y410-K412 VanDerWaalsContact C-N 3.3Å; Y410-K412 PolarHBondContact O-N 3.07Å; Y410-A413 PolarHBondContact O-N 3.31Å; Y410-I414 HydrophobicContact CD1-CD1 4.39Å; Y410-I414 HydrophobicContact CD2-CD1 4.08Å; Y410-I414 HydrophobicContact CD2-CG1 4.44Å; Y410-I414 HydrophobicContact CE1-CD1 3.89Å; Y410-I414 HydrophobicContact CE2-CD1 3.49Å; Y410-I414 VanDerWaalsContact CE2-CD1 3.49Å; Y410-I414 HydrophobicContact CE2-CG1 4.04Å; Y410-I414 HydrophobicContact CG-CD1 4.5Å; Y410-I414 VanDerWaalsContact CZ-CD1 3.42Å; Y410-I414 WeakPolarHBondContact O-CG1 3.44Å; Y410-I414 PolarHBondContact O-N 2.95Å
411	K	92	Very high	89.6	Confident	24 Å²	24	36.5 Å²	36.5	10%	0.104	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-38.7	176.7	-69.4	-170.4	-178.7	-178.1	0	111.5	L402 S404 S407 Y408 I414 V415 F439 L448	L402-K411 HydrophobicContact CD1-CB 4.22Å; L402-K411 HydrophobicContact CD1-CG 4.4Å; S404-K411 WeakPolarHBondContact O-CE 3.25Å; S407-K411 PolarHBondContact O-N 2.95Å; Y408-K411 PolarHBondContact O-N 2.96Å; K411-I414 PolarHBondContact O-N 3.26Å; K411-V415 WeakPolarHBondContact O-CG2 3.5Å; K411-V415 PolarHBondContact O-N 3.23Å; K411-F439 HydrophobicContact CD-CE2 4.36Å; K411-L448 HydrophobicContact CB-CD1 3.75Å
412	K	92.7	Very high	89.6	Confident	59 Å²	59	36.2 Å²	36.2	26%	0.257	19%	0.185	S	C	.	.	H	α-helix	trans	-58.1	-49.2	174	-178.7	-179	169.8	-176.2	0	111.7	Y408 Y410 I414 V415 E416 L448	Y408-K412 HydrophobicContact CE1-CD 4.03Å; Y408-K412 VanDerWaalsContact O-CB 3.22Å; Y408-K412 WeakPolarHBondContact O-CB 3.41Å; Y408-K412 PolarHBondContact O-N 3.29Å; Y410-K412 VanDerWaalsContact C-N 3.3Å; Y410-K412 PolarHBondContact O-N 3.07Å; K412-I414 VanDerWaalsContact C-N 3.28Å; K412-I414 PolarHBondContact O-N 2.83Å; K412-V415 PolarHBondContact O-N 3.15Å; K412-E416 WeakPolarHBondContact CE-OE1 3.45Å; K412-E416 HydrophobicContact CG-CG 4.4Å; K412-E416 IonicContact NZ-OE1 2.66Å; K412-E416 WeakPolarHBondContact O-CB 3.38Å; K412-E416 WeakPolarHBondContact O-CG 3.3Å; K412-E416 PolarHBondContact O-N 2.72Å; K412-L448 HydrophobicContact CB-CD2 3.91Å; K412-L448 HydrophobicContact CG-CD2 4.2Å
413	A	92.3	Very high	89.4	Confident	11 Å²	11	37.7 Å²	37.7	9%	0.091	19%	0.192	C	C	.	.	H	α-helix	trans	-59.3	-38.9	178.8	0	0	0	0	0	112.4	I374 V377 D409 Y410 T417	I374-A413 HydrophobicContact CG1-CB 4.25Å; I374-A413 HydrophobicContact CG2-CB 4.15Å; V377-A413 HydrophobicContact CG1-CB 4.35Å; D409-A413 WeakPolarHBondContact O-CB 3.37Å; D409-A413 PolarHBondContact O-N 3.06Å; Y410-A413 PolarHBondContact O-N 3.31Å; A413-T417 WeakPolarHBondContact O-CB 3.06Å; A413-T417 PolarHBondContact O-N 2.88Å; A413-T417 PolarHBondContact O-OG1 3.05Å
414	I	92.9	Very high	89.2	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66.6	-48.5	175.8	-62.6	164.2	0	0	0	111.1	V377 L398 M401 L402 Y410 K411 K412 E416 T417 I418	V377-I414 HydrophobicContact CG1-CG1 4.14Å; V377-I414 HydrophobicContact CG2-CD1 4.42Å; V377-I414 HydrophobicContact CG2-CG1 3.59Å; L398-I414 HydrophobicContact CB-CG2 4.25Å; L398-I414 HydrophobicContact CD2-CG2 4.45Å; M401-I414 HydrophobicContact CB-CD1 3.99Å; L402-I414 HydrophobicContact CB-CG2 3.92Å; L402-I414 HydrophobicContact CD1-CB 4.15Å; L402-I414 HydrophobicContact CD1-CG2 4.09Å; L402-I414 HydrophobicContact CD2-CG2 4.47Å; L402-I414 HydrophobicContact CG-CG2 4.38Å; Y410-I414 HydrophobicContact CD1-CD1 4.39Å; Y410-I414 HydrophobicContact CD2-CD1 4.08Å; Y410-I414 HydrophobicContact CD2-CG1 4.44Å; Y410-I414 HydrophobicContact CE1-CD1 3.89Å; Y410-I414 HydrophobicContact CE2-CD1 3.49Å; Y410-I414 VanDerWaalsContact CE2-CD1 3.49Å; Y410-I414 HydrophobicContact CE2-CG1 4.04Å; Y410-I414 HydrophobicContact CG-CD1 4.5Å; Y410-I414 VanDerWaalsContact CZ-CD1 3.42Å; Y410-I414 WeakPolarHBondContact O-CG1 3.44Å; Y410-I414 PolarHBondContact O-N 2.95Å; K411-I414 PolarHBondContact O-N 3.26Å; K412-I414 VanDerWaalsContact C-N 3.28Å; K412-I414 PolarHBondContact O-N 2.83Å; I414-E416 VanDerWaalsContact C-N 3.35Å; I414-E416 PolarHBondContact O-N 2.9Å; I414-T417 WeakPolarHBondContact O-CB 3.42Å; I414-T417 PolarHBondContact O-N 3.4Å; I414-T417 VanDerWaalsContact O-N 3.16Å; I414-I418 HydrophobicContact CG2-CD1 3.81Å; I414-I418 HydrophobicContact CG2-CG1 4.3Å; I414-I418 WeakPolarHBondContact O-CG1 3.36Å; I414-I418 PolarHBondContact O-N 3.24Å
415	V	92.9	Very high	89.1	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.012	18%	0.175	C	C	.	.	H	α-helix	trans	-60.3	-45.1	179.4	171.2	0	0	0	0	110.8	L402 K411 K412 T417 I418 I419 L436 F439 V452	L402-V415 HydrophobicContact CD1-CG2 3.85Å; L402-V415 HydrophobicContact CD2-CG2 4.19Å; K411-V415 WeakPolarHBondContact O-CG2 3.5Å; K411-V415 PolarHBondContact O-N 3.23Å; K412-V415 PolarHBondContact O-N 3.15Å; V415-T417 VanDerWaalsContact C-N 3.3Å; V415-T417 PolarHBondContact O-N 2.94Å; V415-I418 PolarHBondContact O-N 3.27Å; V415-I419 HydrophobicContact CG1-CD1 3.75Å; V415-I419 HydrophobicContact CG1-CG1 4.42Å; V415-I419 WeakPolarHBondContact O-CB 3.41Å; V415-I419 VanDerWaalsContact O-CG1 3.22Å; V415-I419 WeakPolarHBondContact O-CG1 3.06Å; V415-I419 PolarHBondContact O-N 2.77Å; V415-L436 HydrophobicContact CG1-CD2 4.46Å; V415-L436 HydrophobicContact CG2-CD2 4.46Å; V415-F439 HydrophobicContact CG2-CD1 4.4Å; V415-F439 HydrophobicContact CG2-CE1 3.95Å; V415-F439 HydrophobicContact CG2-CZ 4.46Å; V415-V452 HydrophobicContact CG1-CG2 3.85Å
416	E	91.4	Very high	89.3	Confident	63 Å²	63	30.5 Å²	30.5	29%	0.294	17%	0.165	S	C	.	.	H	α-helix	trans	-61.3	-38.2	175.6	-74.1	179.8	176	0	0	112.2	K412 I414 I419 A420	K412-E416 WeakPolarHBondContact CE-OE1 3.45Å; K412-E416 HydrophobicContact CG-CG 4.4Å; K412-E416 IonicContact NZ-OE1 2.66Å; K412-E416 WeakPolarHBondContact O-CB 3.38Å; K412-E416 WeakPolarHBondContact O-CG 3.3Å; K412-E416 PolarHBondContact O-N 2.72Å; I414-E416 VanDerWaalsContact C-N 3.35Å; I414-E416 PolarHBondContact O-N 2.9Å; E416-I419 PolarHBondContact O-N 3.47Å; E416-A420 WeakPolarHBondContact O-CB 3.46Å; E416-A420 PolarHBondContact O-N 3.01Å
417	T	91.6	Very high	89.4	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.006	18%	0.184	C	C	.	.	H	α-helix	trans	-67.4	-44.3	176	-64.3	0	0	0	0	112	V377 R381 L398 A413 I414 V415 I419 A420 I421	V377-T417 HydrophobicContact CG1-CG2 4.28Å; V377-T417 VanDerWaalsContact CG1-OG1 3.27Å; V377-T417 WeakPolarHBondContact CG1-OG1 3.4Å; R381-T417 HydrophobicContact CB-CG2 3.63Å; R381-T417 HydrophobicContact CG-CG2 4.04Å; L398-T417 HydrophobicContact CD1-CG2 3.85Å; A413-T417 WeakPolarHBondContact O-CB 3.06Å; A413-T417 PolarHBondContact O-N 2.88Å; A413-T417 PolarHBondContact O-OG1 3.05Å; I414-T417 WeakPolarHBondContact O-CB 3.42Å; I414-T417 PolarHBondContact O-N 3.4Å; I414-T417 VanDerWaalsContact O-N 3.16Å; V415-T417 VanDerWaalsContact C-N 3.3Å; V415-T417 PolarHBondContact O-N 2.94Å; T417-I419 VanDerWaalsContact C-N 3.34Å; T417-I419 PolarHBondContact O-N 3.04Å; T417-A420 PolarHBondContact O-N 2.99Å; T417-I421 HydrophobicContact CG2-CD1 3.9Å; T417-I421 VanDerWaalsContact O-CG1 3.25Å; T417-I421 WeakPolarHBondContact O-CG1 3.46Å; T417-I421 PolarHBondContact O-N 2.7Å
418	I	92.4	Very high	89.4	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.2	-42.4	176	-65.9	170.6	0	0	0	110.3	L398 L402 I414 V415 A420 I421 I422 L436	L398-I418 HydrophobicContact CB-CD1 4.28Å; L398-I418 HydrophobicContact CB-CG1 4.22Å; L398-I418 HydrophobicContact CD1-CG1 4.2Å; L402-I418 HydrophobicContact CD2-CD1 4.12Å; I414-I418 HydrophobicContact CG2-CD1 3.81Å; I414-I418 HydrophobicContact CG2-CG1 4.3Å; I414-I418 WeakPolarHBondContact O-CG1 3.36Å; I414-I418 PolarHBondContact O-N 3.24Å; V415-I418 PolarHBondContact O-N 3.27Å; I418-A420 PolarHBondContact O-N 3.13Å; I418-I421 PolarHBondContact O-N 2.93Å; I418-I422 HydrophobicContact CG2-CD1 3.77Å; I418-I422 HydrophobicContact CG2-CG1 4.35Å; I418-I422 VanDerWaalsContact O-CG1 3.29Å; I418-I422 WeakPolarHBondContact O-CG1 3.44Å; I418-I422 PolarHBondContact O-N 2.96Å; I418-L436 HydrophobicContact CB-CD2 4.38Å; I418-L436 HydrophobicContact CD1-CD2 4.25Å; I418-L436 HydrophobicContact CG2-CD1 3.89Å; I418-L436 HydrophobicContact CG2-CD2 4.06Å; I418-L436 HydrophobicContact CG2-CG 3.85Å
419	I	90.5	Very high	89.4	Confident	6 Å²	6	31.1 Å²	31.1	3%	0.031	16%	0.162	C	C	.	.	H	α-helix	trans	-57.2	-49.4	174.4	-72	166.4	0	0	0	110.4	V415 E416 T417 I421 I422 E423 L436 R451 L455	V415-I419 HydrophobicContact CG1-CD1 3.75Å; V415-I419 HydrophobicContact CG1-CG1 4.42Å; V415-I419 WeakPolarHBondContact O-CB 3.41Å; V415-I419 VanDerWaalsContact O-CG1 3.22Å; V415-I419 WeakPolarHBondContact O-CG1 3.06Å; V415-I419 PolarHBondContact O-N 2.77Å; E416-I419 PolarHBondContact O-N 3.47Å; T417-I419 VanDerWaalsContact C-N 3.34Å; T417-I419 PolarHBondContact O-N 3.04Å; I419-I421 VanDerWaalsContact C-N 3.32Å; I419-I421 PolarHBondContact O-N 3.38Å; I419-I422 PolarHBondContact O-N 3.05Å; I419-E423 HydrophobicContact CG2-CG 4.38Å; I419-E423 WeakPolarHBondContact CG2-OE1 3.26Å; I419-E423 WeakPolarHBondContact O-CG 3.35Å; I419-E423 PolarHBondContact O-N 2.96Å; I419-L436 HydrophobicContact CG1-CD1 4.5Å; I419-R451 HydrophobicContact CD1-CG 4.17Å; I419-L455 HydrophobicContact CG1-CD1 4.3Å; I419-L455 HydrophobicContact CG1-CD2 3.69Å; I419-L455 HydrophobicContact CG1-CG 4.46Å; I419-L455 HydrophobicContact CG2-CD1 4.02Å
420	A	89	Confident	89.4	Confident	3 Å²	3	30 Å²	30	3%	0.025	16%	0.159	C	C	.	.	H	α-helix	trans	-59.6	-41.9	178.4	0	0	0	0	0	111.9	E416 T417 I418 E423 E424	E416-A420 WeakPolarHBondContact O-CB 3.46Å; E416-A420 PolarHBondContact O-N 3.01Å; T417-A420 PolarHBondContact O-N 2.99Å; I418-A420 PolarHBondContact O-N 3.13Å; A420-E423 PolarHBondContact O-N 3.2Å; A420-E424 VanDerWaalsContact O-CB 3.32Å; A420-E424 WeakPolarHBondContact O-CB 3.3Å; A420-E424 VanDerWaalsContact O-CG 3.28Å; A420-E424 WeakPolarHBondContact O-CG 3.5Å; A420-E424 PolarHBondContact O-N 3.29Å
421	I	88.8	Confident	89.4	Confident	7 Å²	7	32 Å²	32	4%	0.036	18%	0.175	C	C	.	.	H	α-helix	trans	-63.7	-43.2	177.2	-66.4	163.1	0	0	0	111.4	C384 L398 T417 I418 I419 E423 E424 N425 A428	C384-I421 HydrophobicContact CB-CD1 3.96Å; C384-I421 HydrophobicContact CB-CG1 3.81Å; C384-I421 VanDerWaalsContact SG-CD1 3.52Å; L398-I421 HydrophobicContact CD1-CD1 3.7Å; T417-I421 HydrophobicContact CG2-CD1 3.9Å; T417-I421 VanDerWaalsContact O-CG1 3.25Å; T417-I421 WeakPolarHBondContact O-CG1 3.46Å; T417-I421 PolarHBondContact O-N 2.7Å; I418-I421 PolarHBondContact O-N 2.93Å; I419-I421 VanDerWaalsContact C-N 3.32Å; I419-I421 PolarHBondContact O-N 3.38Å; I421-E423 VanDerWaalsContact C-N 3.32Å; I421-E423 PolarHBondContact O-N 3.44Å; I421-E424 PolarHBondContact O-N 3.48Å; I421-N425 PolarHBondContact O-N 3.49Å; I421-A428 HydrophobicContact CG2-CB 3.9Å
422	I	89.2	Confident	89.3	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.01	17%	0.17	C	C	.	.	H	α-helix	trans	-62.8	-40.7	177.1	-70.1	165.3	0	0	0	110.9	I418 I419 K429 L433 L436 L455	I418-I422 HydrophobicContact CG2-CD1 3.77Å; I418-I422 HydrophobicContact CG2-CG1 4.35Å; I418-I422 VanDerWaalsContact O-CG1 3.29Å; I418-I422 WeakPolarHBondContact O-CG1 3.44Å; I418-I422 PolarHBondContact O-N 2.96Å; I419-I422 PolarHBondContact O-N 3.05Å; I422-K429 HydrophobicContact CG2-CB 4.34Å; I422-K429 HydrophobicContact CG2-CG 4.02Å; I422-L433 HydrophobicContact CD1-CD2 4.16Å; I422-L433 HydrophobicContact CD1-CG 4.36Å; I422-L436 HydrophobicContact CD1-CD1 3.81Å; I422-L455 HydrophobicContact CD1-CD2 4.13Å
423	E	85	Confident	89.3	Confident	35 Å²	35	28.1 Å²	28.1	16%	0.164	16%	0.158	C	C	.	.	H	α-helix	trans	-70	-42.4	178.1	-72.1	176.7	179.4	0	0	111.1	I419 A420 I421 R458 R810	I419-E423 HydrophobicContact CG2-CG 4.38Å; I419-E423 WeakPolarHBondContact CG2-OE1 3.26Å; I419-E423 WeakPolarHBondContact O-CG 3.35Å; I419-E423 PolarHBondContact O-N 2.96Å; A420-E423 PolarHBondContact O-N 3.2Å; I421-E423 VanDerWaalsContact C-N 3.32Å; I421-E423 PolarHBondContact O-N 3.44Å; E423-R458 IonicContact OE1-CZ 3.82Å; E423-R458 IonicContact OE1-NH2 3.16Å; E423-R458 PolarHBondContact OE1-NH2 2.88Å; E423-R810 PolarHBondContact O-NH1 2.91Å; E423-R810 PolarHBondContact O-NH2 3.01Å
424	E	84.3	Confident	89.3	Confident	71 Å²	71	29.4 Å²	29.4	33%	0.332	17%	0.169	S	C	.	.	H	α-helix	trans	-74.2	-34.5	-177.2	-73.6	175.6	-152.8	0	0	113	S385 A420 I421	S385-E424 WeakPolarHBondContact CB-OE2 3.48Å; S385-E424 PolarHBondContact OG-OE2 2.89Å; A420-E424 VanDerWaalsContact O-CB 3.32Å; A420-E424 WeakPolarHBondContact O-CB 3.3Å; A420-E424 VanDerWaalsContact O-CG 3.28Å; A420-E424 WeakPolarHBondContact O-CG 3.5Å; A420-E424 PolarHBondContact O-N 3.29Å; I421-E424 PolarHBondContact O-N 3.48Å
425	N	84	Confident	89.3	Confident	17 Å²	17	31.1 Å²	31.1	9%	0.091	18%	0.177	C	C	.	.			trans	-125.4	111.4	-173.7	-174.2	-0.2	0	0	0	113.3	P388 H391 I421 D427 A428	P388-N425 PolarHBondContact O-ND2 2.91Å; P388-N425 VanDerWaalsContact O-ND2 3.11Å; H391-N425 PolarHBondContact ND1-ND2 3.18Å; I421-N425 PolarHBondContact O-N 3.49Å; N425-D427 VanDerWaalsContact C-N 3.31Å; N425-D427 PolarHBondContact O-N 3.27Å; N425-D427 PolarHBondContact OD1-N 3.46Å; N425-A428 HydrophobicContact CB-CB 4.09Å; N425-A428 PolarHBondContact O-N 3.15Å
426	P	84.3	Confident	89.3	Confident	92 Å²	92	31 Å²	31	60%	0.597	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-58.1	-36.7	176.3	-23.9	33.9	0	0	0	114.4	A428 K429	P426-A428 VanDerWaalsContact C-N 3.25Å; P426-A428 PolarHBondContact O-N 3.34Å; P426-K429 WeakPolarHBondContact O-CB 3.43Å; P426-K429 PolarHBondContact O-N 3.23Å; P426-K429 VanDerWaalsContact O-N 3.13Å
427	D	86.4	Confident	89.3	Confident	124 Å²	124	28 Å²	28	66%	0.663	16%	0.163	S	C	*	.	G	3₁₀ helix	trans	-67	-30.6	-177.7	-64.6	-21.6	0	0	0	111.6	N425 K429	N425-D427 VanDerWaalsContact C-N 3.31Å; N425-D427 PolarHBondContact O-N 3.27Å; N425-D427 PolarHBondContact OD1-N 3.46Å; D427-K429 VanDerWaalsContact C-N 3.28Å; D427-K429 PolarHBondContact O-N 3.36Å
428	A	88	Confident	89.3	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-77.5	-13.6	178.1	0	0	0	0	0	113	H391 M395 I421 N425 P426 V430 A431 G432	H391-A428 HydrophobicContact CB-CB 4.14Å; M395-A428 HydrophobicContact CE-CB 4.05Å; M395-A428 HydrophobicContact SD-CB 4.23Å; I421-A428 HydrophobicContact CG2-CB 3.9Å; N425-A428 HydrophobicContact CB-CB 4.09Å; N425-A428 PolarHBondContact O-N 3.15Å; P426-A428 VanDerWaalsContact C-N 3.25Å; P426-A428 PolarHBondContact O-N 3.34Å; A428-V430 PolarHBondContact O-N 3.33Å; A428-A431 PolarHBondContact O-N 2.97Å; A428-G432 PolarHBondContact O-N 2.95Å
429	K	89.1	Confident	89.2	Confident	39 Å²	39	32.5 Å²	32.5	17%	0.17	18%	0.183	C	C	.	.	H	α-helix	trans	-57.8	-51	-170.3	-175.9	174.4	-57.5	-161.9	0	112.8	I422 P426 D427 A431 G432 L433 E459 T463	I422-K429 HydrophobicContact CG2-CB 4.34Å; I422-K429 HydrophobicContact CG2-CG 4.02Å; P426-K429 WeakPolarHBondContact O-CB 3.43Å; P426-K429 PolarHBondContact O-N 3.23Å; P426-K429 VanDerWaalsContact O-N 3.13Å; D427-K429 VanDerWaalsContact C-N 3.28Å; D427-K429 PolarHBondContact O-N 3.36Å; K429-A431 PolarHBondContact O-N 3.23Å; K429-G432 PolarHBondContact O-N 3.49Å; K429-L433 HydrophobicContact CG-CD1 3.76Å; K429-L433 HydrophobicContact CG-CG 4.36Å; K429-L433 WeakPolarHBondContact O-CB 3.37Å; K429-L433 WeakPolarHBondContact O-CG 3.29Å; K429-L433 PolarHBondContact O-N 2.95Å; K429-E459 WeakPolarHBondContact CE-OE2 3.19Å; K429-E459 IonicContact NZ-OE2 2.76Å; K429-E459 PolarHBondContact NZ-OE2 2.9Å; K429-T463 HydrophobicContact CD-CG2 4.28Å; K429-T463 HydrophobicContact CG-CG2 4.33Å
430	V	90.2	Very high	89.2	Confident	75 Å²	75	32.2 Å²	32.2	46%	0.455	18%	0.182	S	C	.	.	H	α-helix	trans	-62.9	-47.9	-175.2	178.4	0	0	0	0	111.1	A428 A434	A428-V430 PolarHBondContact O-N 3.33Å; V430-A434 WeakPolarHBondContact O-CB 3.32Å; V430-A434 PolarHBondContact O-N 2.91Å; V430-A434 VanDerWaalsContact O-N 3.09Å
431	A	90.1	Very high	89.2	Confident	42 Å²	42	34.9 Å²	34.9	35%	0.347	19%	0.194	S	C	.	.	H	α-helix	trans	-71.4	-38	-178.8	0	0	0	0	0	112.4	M395 A428 K429 A434 H435	M395-A431 HydrophobicContact CE-CB 3.4Å; A428-A431 PolarHBondContact O-N 2.97Å; K429-A431 PolarHBondContact O-N 3.23Å; A431-A434 PolarHBondContact O-N 3.48Å; A431-H435 PolarHBondContact O-CD2 3.26Å; A431-H435 PolarHBondContact O-N 2.7Å; A431-H435 VanDerWaalsContact O-N 3.09Å
432	G	90.9	Very high	89.1	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.4	-45.1	176	0	0	0	0	0	112.6	M395 A428 K429 A434 H435 L436	M395-G432 WeakPolarHBondContact SD-CA 3.5Å; M395-G432 PolarHBondContact SD-N 3.14Å; A428-G432 PolarHBondContact O-N 2.95Å; K429-G432 PolarHBondContact O-N 3.49Å; G432-A434 VanDerWaalsContact C-N 3.31Å; G432-A434 PolarHBondContact O-N 3.43Å; G432-H435 PolarHBondContact O-N 2.9Å; G432-L436 WeakPolarHBondContact O-CG 3.48Å; G432-L436 PolarHBondContact O-N 2.84Å
433	L	92.3	Very high	88.9	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-37.1	175.6	-66.2	172.6	0	0	0	111.6	I422 K429 L436 C437 L455 L456 E459 A460 T463 Y469	I422-L433 HydrophobicContact CD1-CD2 4.16Å; I422-L433 HydrophobicContact CD1-CG 4.36Å; K429-L433 HydrophobicContact CG-CD1 3.76Å; K429-L433 HydrophobicContact CG-CG 4.36Å; K429-L433 WeakPolarHBondContact O-CB 3.37Å; K429-L433 WeakPolarHBondContact O-CG 3.29Å; K429-L433 PolarHBondContact O-N 2.95Å; L433-L436 PolarHBondContact O-N 3.48Å; L433-C437 WeakPolarHBondContact O-CB 3.46Å; L433-C437 PolarHBondContact O-N 2.79Å; L433-C437 PolarHBondContact O-SG 3.23Å; L433-L455 HydrophobicContact CD2-CD2 3.98Å; L433-L455 HydrophobicContact CD2-CG 4.35Å; L433-L456 HydrophobicContact CB-CD2 4.45Å; L433-L456 HydrophobicContact CD2-CD2 3.97Å; L433-E459 HydrophobicContact CD1-CB 4.41Å; L433-E459 HydrophobicContact CD2-CB 4.37Å; L433-A460 HydrophobicContact CD1-CB 4.18Å; L433-T463 HydrophobicContact CD1-CG2 3.65Å; L433-Y469 HydrophobicContact CB-CE1 3.82Å
434	A	91.8	Very high	89	Confident	39 Å²	39	48.4 Å²	48.4	32%	0.322	26%	0.262	S	S	.	.	H	α-helix	trans	-61.6	-47.2	175.9	0	0	0	0	0	112	V430 A431 G432 L436 C437 E438	V430-A434 WeakPolarHBondContact O-CB 3.32Å; V430-A434 PolarHBondContact O-N 2.91Å; V430-A434 VanDerWaalsContact O-N 3.09Å; A431-A434 PolarHBondContact O-N 3.48Å; G432-A434 VanDerWaalsContact C-N 3.31Å; G432-A434 PolarHBondContact O-N 3.43Å; A434-L436 VanDerWaalsContact C-N 3.34Å; A434-L436 PolarHBondContact O-N 3.33Å; A434-C437 WeakPolarHBondContact O-CB 3.33Å; A434-C437 PolarHBondContact O-N 2.95Å; A434-E438 WeakPolarHBondContact O-CG 3.33Å; A434-E438 PolarHBondContact O-N 3.29Å
435	H	92.7	Very high	89.2	Confident	35 Å²	35	47.1 Å²	47.1	16%	0.162	26%	0.257	C	S	.	.	H	α-helix	trans	-63.4	-37.8	176.8	-70.3	-46.6	0	0	0	113.3	A399 A431 G432 C437 E438 F439	A399-H435 HydrophobicContact CB-CB 3.83Å; A399-H435 VanDerWaalsContact CB-CG 3.49Å; A431-H435 PolarHBondContact O-CD2 3.26Å; A431-H435 PolarHBondContact O-N 2.7Å; A431-H435 VanDerWaalsContact O-N 3.09Å; G432-H435 PolarHBondContact O-N 2.9Å; H435-C437 VanDerWaalsContact C-N 3.35Å; H435-E438 IonicContact ND1-OE2 3.01Å; H435-E438 PolarHBondContact O-N 2.82Å; H435-F439 PolarHBondContact O-N 2.81Å
436	L	93.1	Very high	89.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-68.9	-33.7	174.8	-69.8	179.2	0	0	0	112.3	L402 V415 I418 I419 I422 G432 L433 A434 F439 I440 V452 L455	L402-L436 HydrophobicContact CD2-CD2 4.32Å; V415-L436 HydrophobicContact CG1-CD2 4.46Å; V415-L436 HydrophobicContact CG2-CD2 4.46Å; I418-L436 HydrophobicContact CB-CD2 4.38Å; I418-L436 HydrophobicContact CD1-CD2 4.25Å; I418-L436 HydrophobicContact CG2-CD1 3.89Å; I418-L436 HydrophobicContact CG2-CD2 4.06Å; I418-L436 HydrophobicContact CG2-CG 3.85Å; I419-L436 HydrophobicContact CG1-CD1 4.5Å; I422-L436 HydrophobicContact CD1-CD1 3.81Å; G432-L436 WeakPolarHBondContact O-CG 3.48Å; G432-L436 PolarHBondContact O-N 2.84Å; L433-L436 PolarHBondContact O-N 3.48Å; A434-L436 VanDerWaalsContact C-N 3.34Å; A434-L436 PolarHBondContact O-N 3.33Å; L436-F439 PolarHBondContact O-N 2.94Å; L436-I440 PolarHBondContact O-N 3.36Å; L436-I440 VanDerWaalsContact O-N 3.1Å; L436-V452 HydrophobicContact CB-CG1 3.83Å; L436-V452 HydrophobicContact CD2-CG2 4.18Å; L436-L455 HydrophobicContact CD1-CD2 3.46Å; L436-L455 VanDerWaalsContact CD1-CD2 3.46Å
437	C	92.3	Very high	89.7	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.007	26%	0.263	C	S	.	.	H	α-helix	trans	-65.6	-42.6	174.4	-72.5	0	0	0	0	112.2	L433 A434 H435 F439 I440 L456 Y469 F472	L433-C437 WeakPolarHBondContact O-CB 3.46Å; L433-C437 PolarHBondContact O-N 2.79Å; L433-C437 PolarHBondContact O-SG 3.23Å; A434-C437 WeakPolarHBondContact O-CB 3.33Å; A434-C437 PolarHBondContact O-N 2.95Å; H435-C437 VanDerWaalsContact C-N 3.35Å; C437-F439 VanDerWaalsContact C-N 3.32Å; C437-I440 WeakPolarHBondContact O-CG1 3.43Å; C437-L456 VanDerWaalsContact SG-CD2 3.53Å; C437-Y469 VanDerWaalsContact SG-CD1 3.56Å; C437-F472 HydrophobicContact CB-CB 4.26Å; C437-F472 HydrophobicContact CB-CD1 3.81Å; C437-F472 HydrophobicContact CB-CD2 4.22Å; C437-F472 HydrophobicContact CB-CE1 4.13Å; C437-F472 HydrophobicContact CB-CG 3.85Å; C437-F472 HydrophobicContact CB-CZ 4.48Å
438	E	90.6	Very high	89.9	Confident	80 Å²	80	43.6 Å²	43.6	37%	0.374	23%	0.233	S	C	.	.	H	α-helix	trans	-62.9	-40.6	173	-68	172.2	167.3	0	0	111.2	R403 A434 H435 I440 E441	R403-E438 IonicContact CZ-OE2 2.88Å; R403-E438 IonicContact NH2-OE2 2.66Å; R403-E438 PolarHBondContact NH2-OE2 3Å; A434-E438 WeakPolarHBondContact O-CG 3.33Å; A434-E438 PolarHBondContact O-N 3.29Å; H435-E438 IonicContact ND1-OE2 3.01Å; H435-E438 PolarHBondContact O-N 2.82Å; E438-I440 PolarHBondContact O-N 3.05Å; E438-E441 WeakPolarHBondContact O-CB 3.29Å; E438-E441 PolarHBondContact O-N 3.42Å
439	F	91.2	Very high	90.1	Very high	15 Å²	15	43.7 Å²	43.7	7%	0.066	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-43.4	179.6	170.8	-111.7	0	0	0	113.2	L402 K411 V415 H435 L436 C437 E441 D442 C443 L448	L402-F439 HydrophobicContact CD1-CD2 3.95Å; L402-F439 HydrophobicContact CD1-CE1 4.37Å; L402-F439 HydrophobicContact CD1-CE2 3.65Å; L402-F439 HydrophobicContact CD1-CG 4.4Å; L402-F439 HydrophobicContact CD1-CZ 3.87Å; L402-F439 HydrophobicContact CD2-CB 3.78Å; L402-F439 HydrophobicContact CD2-CD1 4Å; L402-F439 HydrophobicContact CD2-CD2 3.76Å; L402-F439 HydrophobicContact CD2-CE2 4.3Å; L402-F439 HydrophobicContact CD2-CG 3.56Å; L402-F439 HydrophobicContact CG-CB 4.39Å; L402-F439 HydrophobicContact CG-CD1 4.47Å; L402-F439 HydrophobicContact CG-CD2 3.48Å; L402-F439 VanDerWaalsContact CG-CD2 3.48Å; L402-F439 HydrophobicContact CG-CE2 3.73Å; L402-F439 HydrophobicContact CG-CG 3.87Å; L402-F439 HydrophobicContact CG-CZ 4.32Å; K411-F439 HydrophobicContact CD-CE2 4.36Å; V415-F439 HydrophobicContact CG2-CD1 4.4Å; V415-F439 HydrophobicContact CG2-CE1 3.95Å; V415-F439 HydrophobicContact CG2-CZ 4.46Å; H435-F439 PolarHBondContact O-N 2.81Å; L436-F439 PolarHBondContact O-N 2.94Å; C437-F439 VanDerWaalsContact C-N 3.32Å; F439-E441 PolarHBondContact O-N 3.02Å; F439-D442 PolarHBondContact O-N 3.12Å; F439-C443 HydrophobicContact CE1-CB 4.21Å; F439-C443 VanDerWaalsContact CE1-SG 3.51Å; F439-C443 HydrophobicContact CE2-CB 4.48Å; F439-C443 HydrophobicContact CZ-CB 4.2Å; F439-C443 WeakPolarHBondContact CZ-SG 3.41Å; F439-C443 WeakPolarHBondContact O-CB 3.46Å; F439-C443 PolarHBondContact O-N 2.75Å; F439-L448 HydrophobicContact CE1-CB 4.23Å; F439-L448 HydrophobicContact CZ-CD1 4.19Å
440	I	90.7	Very high	90.2	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-9.7	179.3	62.4	169.7	0	0	0	113.2	L436 C437 E438 D442 V452 L453 L456 R476	L436-I440 PolarHBondContact O-N 3.36Å; L436-I440 VanDerWaalsContact O-N 3.1Å; C437-I440 WeakPolarHBondContact O-CG1 3.43Å; E438-I440 PolarHBondContact O-N 3.05Å; I440-D442 VanDerWaalsContact C-N 3.33Å; I440-V452 HydrophobicContact CG2-CB 3.69Å; I440-V452 HydrophobicContact CG2-CG1 3.53Å; I440-V452 HydrophobicContact CG2-CG2 4.2Å; I440-L453 HydrophobicContact CD1-CD2 4.14Å; I440-L456 HydrophobicContact CD1-CD1 3.81Å; I440-R476 HydrophobicContact CD1-CG 4.49Å; I440-R476 VanDerWaalsContact O-CD 3.27Å; I440-R476 WeakPolarHBondContact O-CD 3.33Å; I440-R476 PolarHBondContact O-NE 3.14Å; I440-R476 PolarHBondContact O-NH1 3.12Å
441	E	88.6	Confident	90.3	Very high	58 Å²	58	44.3 Å²	44.3	27%	0.271	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-35.9	174.6	-72.2	-174.5	165.3	0	0	112.6	E438 F439 R471 F472 R476	E438-E441 WeakPolarHBondContact O-CB 3.29Å; E438-E441 PolarHBondContact O-N 3.42Å; F439-E441 PolarHBondContact O-N 3.02Å; E441-R471 IonicContact OE1-NH2 3.04Å; E441-R471 PolarHBondContact OE1-NH2 2.94Å; E441-F472 HydrophobicContact CG-CD1 4.14Å; E441-F472 WeakPolarHBondContact OE1-CD1 3.46Å; E441-F472 WeakPolarHBondContact OE1-CE1 3.24Å; E441-R476 PolarHBondContact O-NH2 3.06Å; E441-R476 VanDerWaalsContact O-NH2 3.14Å
442	D	85.8	Confident	90.4	Very high	149 Å²	149	42.3 Å²	42.3	80%	0.797	21%	0.213	S	C	*	.	S	Bend	trans	-124.4	26.4	-176.1	-61.2	-41.3	0	0	0	112.2	F439 I440	F439-D442 PolarHBondContact O-N 3.12Å; I440-D442 VanDerWaalsContact C-N 3.33Å
443	C	86.6	Confident	90.5	Very high	11 Å²	11	42.3 Å²	42.3	7%	0.074	21%	0.213	C	C	.	.			trans	-83.8	118.9	-176.5	-169.4	0	0	0	0	112.2	F439 H445 S449	F439-C443 HydrophobicContact CE1-CB 4.21Å; F439-C443 VanDerWaalsContact CE1-SG 3.51Å; F439-C443 HydrophobicContact CE2-CB 4.48Å; F439-C443 HydrophobicContact CZ-CB 4.2Å; F439-C443 WeakPolarHBondContact CZ-SG 3.41Å; F439-C443 WeakPolarHBondContact O-CB 3.46Å; F439-C443 PolarHBondContact O-N 2.75Å; C443-H445 VanDerWaalsContact C-N 3.29Å; C443-H445 PolarHBondContact O-N 3.49Å; C443-S449 WeakPolarHBondContact CB-OG 3.39Å
444	E	85.5	Confident	90.4	Very high	168 Å²	168	46 Å²	46	79%	0.785	23%	0.23	S	C	*	.			trans	-78.2	-8.5	176.5	-58.8	178.9	164.3	0	0	114
445	H	89	Confident	90.3	Very high	45 Å²	45	44.6 Å²	44.6	21%	0.208	22%	0.216	C	C	.	.			trans	-107.8	103.7	-171.4	-59.5	119	0	0	0	112.6	Y408 C443 N447 L448 S449	Y408-H445 HydrophobicContact CD2-CB 4.25Å; Y408-H445 AromaticContact CD2-CD2 3.88Å; Y408-H445 AromaticContact CD2-CG 3.99Å; Y408-H445 HydrophobicContact CE2-CB 4.47Å; C443-H445 VanDerWaalsContact C-N 3.29Å; C443-H445 PolarHBondContact O-N 3.49Å; H445-N447 VanDerWaalsContact C-N 3.3Å; H445-N447 PolarHBondContact O-N 3.22Å; H445-L448 HydrophobicContact CB-CB 4.15Å; H445-L448 HydrophobicContact CB-CD1 3.95Å; H445-L448 HydrophobicContact CB-CG 4.03Å; H445-L448 PolarHBondContact O-N 2.94Å; H445-S449 PolarHBondContact O-N 3.07Å; H445-S449 PolarHBondContact O-OG 2.76Å
446	D	89.4	Confident	90.3	Very high	62 Å²	62	42.9 Å²	42.9	33%	0.332	21%	0.209	S	C	.	.	H	α-helix	trans	-49.7	-44.7	179.3	-72.5	-28.1	0	0	0	113.9	L448 S449 T450 S481 V484	D446-L448 VanDerWaalsContact C-N 3.32Å; D446-L448 PolarHBondContact O-N 3.48Å; D446-S449 PolarHBondContact O-N 3.31Å; D446-T450 WeakPolarHBondContact O-CB 3.36Å; D446-T450 VanDerWaalsContact O-CG2 3.28Å; D446-T450 WeakPolarHBondContact O-CG2 3.39Å; D446-T450 PolarHBondContact O-N 2.75Å; D446-T450 PolarHBondContact O-OG1 3.38Å; D446-S481 WeakPolarHBondContact OD1-CB 3.29Å; D446-S481 PolarHBondContact OD1-OG 2.66Å; D446-S481 PolarHBondContact OD2-OG 3.35Å; D446-V484 HydrophobicContact CB-CG2 4.12Å; D446-V484 WeakPolarHBondContact OD1-CG2 3.47Å
447	N	90.2	Very high	90.1	Very high	91 Å²	91	42.9 Å²	42.9	49%	0.487	21%	0.209	S	C	.	.	H	α-helix	trans	-66.6	-31.8	-177.6	-68.8	-22	0	0	0	112.7	Y408 H445 T450 R451	Y408-N447 HydrophobicContact CE2-CB 4.12Å; Y408-N447 WeakPolarHBondContact OH-CB 3.4Å; H445-N447 VanDerWaalsContact C-N 3.3Å; H445-N447 PolarHBondContact O-N 3.22Å; N447-T450 WeakPolarHBondContact CA-OG1 3.29Å; N447-T450 PolarHBondContact O-OG1 3.09Å; N447-R451 WeakPolarHBondContact O-CB 3.24Å; N447-R451 PolarHBondContact O-N 3.48Å
448	L	90.8	Very high	89.8	Confident	6 Å²	6	45.8 Å²	45.8	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-78	-43.3	176.6	-63.7	179.9	0	0	0	110.4	Y408 K411 K412 F439 H445 D446 T450 R451 V452	Y408-L448 HydrophobicContact CD2-CD1 4.29Å; Y408-L448 HydrophobicContact CD2-CG 4.32Å; Y408-L448 HydrophobicContact CE2-CD1 4.31Å; Y408-L448 HydrophobicContact CE2-CD2 4.16Å; Y408-L448 HydrophobicContact CE2-CG 3.85Å; K411-L448 HydrophobicContact CB-CD1 3.75Å; K412-L448 HydrophobicContact CB-CD2 3.91Å; K412-L448 HydrophobicContact CG-CD2 4.2Å; F439-L448 HydrophobicContact CE1-CB 4.23Å; F439-L448 HydrophobicContact CZ-CD1 4.19Å; H445-L448 HydrophobicContact CB-CB 4.15Å; H445-L448 HydrophobicContact CB-CD1 3.95Å; H445-L448 HydrophobicContact CB-CG 4.03Å; H445-L448 PolarHBondContact O-N 2.94Å; D446-L448 VanDerWaalsContact C-N 3.32Å; D446-L448 PolarHBondContact O-N 3.48Å; L448-T450 PolarHBondContact O-N 3.26Å; L448-R451 PolarHBondContact O-N 3.46Å; L448-V452 WeakPolarHBondContact O-CG2 3.46Å; L448-V452 PolarHBondContact O-N 3Å
449	S	91.7	Very high	89.7	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.007	21%	0.206	C	C	.	.	H	α-helix	trans	-57.3	-48	175.6	-64.9	0	0	0	0	111.7	C443 H445 D446 R451 V452 L453	C443-S449 WeakPolarHBondContact CB-OG 3.39Å; H445-S449 PolarHBondContact O-N 3.07Å; H445-S449 PolarHBondContact O-OG 2.76Å; D446-S449 PolarHBondContact O-N 3.31Å; S449-R451 PolarHBondContact O-N 2.97Å; S449-V452 PolarHBondContact O-N 2.91Å; S449-L453 WeakPolarHBondContact O-CB 3.39Å; S449-L453 WeakPolarHBondContact O-CG 3.39Å; S449-L453 PolarHBondContact O-N 3.11Å
450	T	91.6	Very high	89.6	Confident	25 Å²	25	42.2 Å²	42.2	15%	0.153	20%	0.203	C	C	.	.	H	α-helix	trans	-60.1	-43.7	175.8	49.1	0	0	0	0	112.3	D446 N447 L448 V452 L453 H454 K483 V484 A487	D446-T450 WeakPolarHBondContact O-CB 3.36Å; D446-T450 VanDerWaalsContact O-CG2 3.28Å; D446-T450 WeakPolarHBondContact O-CG2 3.39Å; D446-T450 PolarHBondContact O-N 2.75Å; D446-T450 PolarHBondContact O-OG1 3.38Å; N447-T450 WeakPolarHBondContact CA-OG1 3.29Å; N447-T450 PolarHBondContact O-OG1 3.09Å; L448-T450 PolarHBondContact O-N 3.26Å; T450-V452 PolarHBondContact O-N 3.02Å; T450-L453 PolarHBondContact O-N 2.87Å; T450-H454 PolarHBondContact O-CD2 3.27Å; T450-H454 PolarHBondContact O-N 3.14Å; T450-K483 HydrophobicContact CG2-CB 4.43Å; T450-K483 WeakPolarHBondContact CG2-O 3.39Å; T450-V484 HydrophobicContact CG2-CG2 4.18Å; T450-A487 HydrophobicContact CG2-CB 3.85Å
451	R	91.3	Very high	89.6	Confident	103 Å²	103	42.8 Å²	42.8	39%	0.389	21%	0.207	S	C	.	.	H	α-helix	trans	-62	-44.5	177.3	-172.9	63.9	174.8	-178.9	1.1	112.3	I419 N447 L448 S449 H454 L455	I419-R451 HydrophobicContact CD1-CG 4.17Å; N447-R451 WeakPolarHBondContact O-CB 3.24Å; N447-R451 PolarHBondContact O-N 3.48Å; L448-R451 PolarHBondContact O-N 3.46Å; S449-R451 PolarHBondContact O-N 2.97Å; R451-H454 PolarHBondContact O-N 3.46Å; R451-L455 PolarHBondContact O-N 3.17Å; R451-L455 VanDerWaalsContact O-N 3.11Å
452	V	92.4	Very high	89.4	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.8	-41.2	176.9	173	0	0	0	0	111.1	V415 L436 I440 L448 S449 T450 H454 L455 L456	V415-V452 HydrophobicContact CG1-CG2 3.85Å; L436-V452 HydrophobicContact CB-CG1 3.83Å; L436-V452 HydrophobicContact CD2-CG2 4.18Å; I440-V452 HydrophobicContact CG2-CB 3.69Å; I440-V452 HydrophobicContact CG2-CG1 3.53Å; I440-V452 HydrophobicContact CG2-CG2 4.2Å; L448-V452 WeakPolarHBondContact O-CG2 3.46Å; L448-V452 PolarHBondContact O-N 3Å; S449-V452 PolarHBondContact O-N 2.91Å; T450-V452 PolarHBondContact O-N 3.02Å; V452-H454 VanDerWaalsContact C-N 3.34Å; V452-H454 PolarHBondContact O-N 3.26Å; V452-L455 WeakPolarHBondContact O-CB 3.5Å; V452-L455 PolarHBondContact O-N 3.23Å; V452-L455 VanDerWaalsContact O-N 3.16Å; V452-L456 HydrophobicContact CG1-CD1 4.11Å; V452-L456 HydrophobicContact CG1-CG 4.28Å; V452-L456 WeakPolarHBondContact O-CG 3.35Å; V452-L456 PolarHBondContact O-N 3.43Å
453	L	92.3	Very high	89.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.5	-40.7	176.5	-73.3	167.1	0	0	0	112.2	I440 S449 T450 L456 G457 I473 V484 A487 A488 A491	I440-L453 HydrophobicContact CD1-CD2 4.14Å; S449-L453 WeakPolarHBondContact O-CB 3.39Å; S449-L453 WeakPolarHBondContact O-CG 3.39Å; S449-L453 PolarHBondContact O-N 3.11Å; T450-L453 PolarHBondContact O-N 2.87Å; L453-L456 HydrophobicContact CD2-CD1 4.43Å; L453-L456 PolarHBondContact O-N 2.99Å; L453-G457 PolarHBondContact O-N 3.02Å; L453-I473 HydrophobicContact CD2-CB 4.44Å; L453-I473 HydrophobicContact CD2-CG1 4.18Å; L453-I473 HydrophobicContact CD2-CG2 4.17Å; L453-V484 HydrophobicContact CD1-CG1 3.7Å; L453-A487 HydrophobicContact CB-CB 4.24Å; L453-A487 HydrophobicContact CD1-CB 4.1Å; L453-A488 HydrophobicContact CD1-CB 4.07Å; L453-A488 HydrophobicContact CD2-CB 4.27Å; L453-A491 WeakPolarHBondContact O-CB 3.3Å
454	H	90.5	Very high	89.5	Confident	78 Å²	78	44.1 Å²	44.1	36%	0.361	22%	0.215	S	C	.	.	H	α-helix	trans	-64.2	-38.9	173.9	-74.7	-54.1	0	0	0	112.7	T450 R451 V452 G457 R458	T450-H454 PolarHBondContact O-CD2 3.27Å; T450-H454 PolarHBondContact O-N 3.14Å; R451-H454 PolarHBondContact O-N 3.46Å; V452-H454 VanDerWaalsContact C-N 3.34Å; V452-H454 PolarHBondContact O-N 3.26Å; H454-G457 PolarHBondContact O-N 3.08Å; H454-R458 PolarHBondContact O-N 3.45Å
455	L	90.4	Very high	89.6	Confident	8 Å²	8	41.6 Å²	41.6	4%	0.042	21%	0.207	C	C	.	.	H	α-helix	trans	-62.2	-47.7	172.7	-178.8	78.2	0	0	0	111	I419 I422 L433 L436 R451 V452 G457 R458 E459	I419-L455 HydrophobicContact CG1-CD1 4.3Å; I419-L455 HydrophobicContact CG1-CD2 3.69Å; I419-L455 HydrophobicContact CG1-CG 4.46Å; I419-L455 HydrophobicContact CG2-CD1 4.02Å; I422-L455 HydrophobicContact CD1-CD2 4.13Å; L433-L455 HydrophobicContact CD2-CD2 3.98Å; L433-L455 HydrophobicContact CD2-CG 4.35Å; L436-L455 HydrophobicContact CD1-CD2 3.46Å; L436-L455 VanDerWaalsContact CD1-CD2 3.46Å; R451-L455 PolarHBondContact O-N 3.17Å; R451-L455 VanDerWaalsContact O-N 3.11Å; V452-L455 WeakPolarHBondContact O-CB 3.5Å; V452-L455 PolarHBondContact O-N 3.23Å; V452-L455 VanDerWaalsContact O-N 3.16Å; L455-G457 VanDerWaalsContact C-N 3.32Å; L455-G457 PolarHBondContact O-N 2.87Å; L455-R458 PolarHBondContact O-N 2.98Å; L455-E459 HydrophobicContact CD1-CG 4.03Å; L455-E459 PolarHBondContact O-N 3.24Å
456	L	91.8	Very high	89.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-56.9	-46.9	178.2	-71.6	171.8	0	0	0	110.5	L433 C437 I440 V452 L453 R458 A460 P461 Y469 I473	L433-L456 HydrophobicContact CB-CD2 4.45Å; L433-L456 HydrophobicContact CD2-CD2 3.97Å; C437-L456 VanDerWaalsContact SG-CD2 3.53Å; I440-L456 HydrophobicContact CD1-CD1 3.81Å; V452-L456 HydrophobicContact CG1-CD1 4.11Å; V452-L456 HydrophobicContact CG1-CG 4.28Å; V452-L456 WeakPolarHBondContact O-CG 3.35Å; V452-L456 PolarHBondContact O-N 3.43Å; L453-L456 HydrophobicContact CD2-CD1 4.43Å; L453-L456 PolarHBondContact O-N 2.99Å; L456-R458 PolarHBondContact O-N 3.01Å; L456-R458 VanDerWaalsContact O-N 3.17Å; L456-A460 HydrophobicContact CD2-CB 4.23Å; L456-A460 WeakPolarHBondContact O-CB 3.46Å; L456-A460 PolarHBondContact O-N 3.42Å; L456-P461 VanDerWaalsContact O-CD 3.26Å; L456-P461 WeakPolarHBondContact O-CD 3.35Å; L456-Y469 HydrophobicContact CD2-CD1 4.31Å; L456-I473 HydrophobicContact CB-CD1 4.31Å; L456-I473 HydrophobicContact CD1-CG1 4.24Å
457	G	89.1	Confident	89.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-23.9	176.2	0	0	0	0	0	114.6	L453 H454 L455 K494 Q498	L453-G457 PolarHBondContact O-N 3.02Å; H454-G457 PolarHBondContact O-N 3.08Å; L455-G457 VanDerWaalsContact C-N 3.32Å; L455-G457 PolarHBondContact O-N 2.87Å; G457-K494 WeakPolarHBondContact O-CB 3.34Å; G457-Q498 PolarHBondContact O-NE2 2.87Å
458	R	86.8	Confident	89.6	Confident	62 Å²	62	39.2 Å²	39.2	23%	0.234	21%	0.207	C	C	.	.	H	α-helix	trans	-92.5	-42.5	-179.9	-168.6	179	68.5	-168.7	-8.8	113.3	E423 H454 L455 L456 K462 S585	E423-R458 IonicContact OE1-CZ 3.82Å; E423-R458 IonicContact OE1-NH2 3.16Å; E423-R458 PolarHBondContact OE1-NH2 2.88Å; H454-R458 PolarHBondContact O-N 3.45Å; L455-R458 PolarHBondContact O-N 2.98Å; L456-R458 PolarHBondContact O-N 3.01Å; L456-R458 VanDerWaalsContact O-N 3.17Å; R458-K462 WeakPolarHBondContact O-CE 3.37Å; R458-S585 PolarHBondContact NH1-O 3.47Å; R458-S585 VanDerWaalsContact NH1-O 3.12Å
459	E	88.4	Confident	89.6	Confident	19 Å²	19	39.6 Å²	39.6	9%	0.089	21%	0.209	C	C	.	.	H	α-helix	trans	-105.1	-31	-170	-66.8	-55.7	137.4	0	0	114.1	K429 L433 L455 K462	K429-E459 WeakPolarHBondContact CE-OE2 3.19Å; K429-E459 IonicContact NZ-OE2 2.76Å; K429-E459 PolarHBondContact NZ-OE2 2.9Å; L433-E459 HydrophobicContact CD1-CB 4.41Å; L433-E459 HydrophobicContact CD2-CB 4.37Å; L455-E459 HydrophobicContact CD1-CG 4.03Å; L455-E459 PolarHBondContact O-N 3.24Å; E459-K462 WeakPolarHBondContact O-CB 3.38Å; E459-K462 PolarHBondContact O-N 3.35Å; E459-K462 IonicContact OE1-NZ 2.95Å
460	A	89.6	Confident	89.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-68.8	-32.8	-176.8	0	0	0	0	0	114.3	L433 L456 K462 T463 Y469 F495	L433-A460 HydrophobicContact CD1-CB 4.18Å; L456-A460 HydrophobicContact CD2-CB 4.23Å; L456-A460 WeakPolarHBondContact O-CB 3.46Å; L456-A460 PolarHBondContact O-N 3.42Å; A460-K462 PolarHBondContact O-N 3.43Å; A460-T463 WeakPolarHBondContact O-CB 3.32Å; A460-T463 WeakPolarHBondContact O-CG2 3.19Å; A460-T463 PolarHBondContact O-N 3.48Å; A460-T463 VanDerWaalsContact O-N 3.12Å; A460-T463 PolarHBondContact O-OG1 3.31Å; A460-Y469 HydrophobicContact CB-CD1 4.43Å; A460-Y469 HydrophobicContact CB-CD2 4.02Å; A460-Y469 HydrophobicContact CB-CG 3.97Å; A460-F495 HydrophobicContact CB-CE1 4.45Å; A460-F495 HydrophobicContact CB-CE2 4.04Å; A460-F495 HydrophobicContact CB-CZ 3.49Å; A460-F495 VanDerWaalsContact CB-CZ 3.49Å
461	P	88.9	Confident	89.4	Confident	12 Å²	12	46.2 Å²	46.2	8%	0.078	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-60.6	-23.8	171.8	-24.5	33.6	0	0	0	114.2	L456 T463 P466 F495 Q498	L456-P461 VanDerWaalsContact O-CD 3.26Å; L456-P461 WeakPolarHBondContact O-CD 3.35Å; P461-T463 VanDerWaalsContact C-N 3.29Å; P461-T463 PolarHBondContact O-N 3.08Å; P461-P466 WeakPolarHBondContact O-CG 3.47Å; P461-F495 HydrophobicContact CG-CD1 4.12Å; P461-F495 HydrophobicContact CG-CD2 3.8Å; P461-F495 HydrophobicContact CG-CE1 4.22Å; P461-F495 HydrophobicContact CG-CE2 3.92Å; P461-F495 HydrophobicContact CG-CG 3.93Å; P461-F495 HydrophobicContact CG-CZ 4.16Å; P461-Q498 HydrophobicContact CB-CB 3.8Å; P461-Q498 HydrophobicContact CB-CG 4.43Å; P461-Q498 HydrophobicContact CG-CB 4.44Å
462	K	86.4	Confident	89.4	Confident	125 Å²	125	43 Å²	43	54%	0.543	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-85.5	1	179.7	-54.6	177.6	-176.7	175.2	0	113.2	R458 E459 A460	R458-K462 WeakPolarHBondContact O-CE 3.37Å; E459-K462 WeakPolarHBondContact O-CB 3.38Å; E459-K462 PolarHBondContact O-N 3.35Å; E459-K462 IonicContact OE1-NZ 2.95Å; A460-K462 PolarHBondContact O-N 3.43Å
463	T	87.6	Confident	89.3	Confident	11 Å²	11	43 Å²	43	7%	0.067	22%	0.22	C	C	.	.	S	Bend	trans	-84.2	162.1	179	64.7	0	0	0	0	111.2	K429 L433 A460 P461 N465 P466 Y469	K429-T463 HydrophobicContact CD-CG2 4.28Å; K429-T463 HydrophobicContact CG-CG2 4.33Å; L433-T463 HydrophobicContact CD1-CG2 3.65Å; A460-T463 WeakPolarHBondContact O-CB 3.32Å; A460-T463 WeakPolarHBondContact O-CG2 3.19Å; A460-T463 PolarHBondContact O-N 3.48Å; A460-T463 VanDerWaalsContact O-N 3.12Å; A460-T463 PolarHBondContact O-OG1 3.31Å; P461-T463 VanDerWaalsContact C-N 3.29Å; P461-T463 PolarHBondContact O-N 3.08Å; T463-N465 PolarHBondContact O-N 3.24Å; T463-P466 WeakPolarHBondContact O-CD 3.25Å; T463-P466 WeakPolarHBondContact O-CG 3.5Å; T463-Y469 HydrophobicContact CG2-CE2 4.19Å; T463-Y469 WeakPolarHBondContact OG1-CE2 3.39Å
464	P	85.5	Confident	89.1	Confident	110 Å²	110	45 Å²	45	71%	0.714	23%	0.229	S	C	*	.	S	Bend	trans	-61.6	-29.1	178.7	-23.8	34	0	0	0	114.2
465	N	87.9	Confident	89	Confident	115 Å²	115	44.1 Å²	44.1	62%	0.615	23%	0.227	S	C	*	.			trans	-130.3	71.1	-177	-70.7	-40.3	0	0	0	112.4	T463 S467 S468	T463-N465 PolarHBondContact O-N 3.24Å; N465-S467 VanDerWaalsContact C-N 3.3Å; N465-S467 PolarHBondContact O-N 2.96Å; N465-S468 PolarHBondContact O-N 3.07Å; N465-S468 PolarHBondContact O-OG 2.9Å
466	P	88.9	Confident	88.9	Confident	21 Å²	21	44.4 Å²	44.4	14%	0.136	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-32.2	-175.4	-24.4	36	0	0	0	114.1	P461 T463 S468 Y469 F495 L502	P461-P466 WeakPolarHBondContact O-CG 3.47Å; T463-P466 WeakPolarHBondContact O-CD 3.25Å; T463-P466 WeakPolarHBondContact O-CG 3.5Å; P466-S468 PolarHBondContact O-N 3.39Å; P466-S468 VanDerWaalsContact O-N 3.15Å; P466-Y469 PolarHBondContact O-N 2.64Å; P466-Y469 VanDerWaalsContact O-N 3.12Å; P466-F495 HydrophobicContact CB-CD1 4.25Å; P466-F495 HydrophobicContact CB-CE1 3.8Å; P466-F495 WeakPolarHBondContact O-CE1 3.27Å; P466-L502 HydrophobicContact CB-CD1 3.92Å
467	S	89.1	Confident	88.4	Confident	71 Å²	71	44.9 Å²	44.9	50%	0.497	23%	0.23	S	C	.	.	H	α-helix	trans	-58.2	-31.4	-176.5	57.5	0	0	0	0	113.8	N465 Y469 I470	N465-S467 VanDerWaalsContact C-N 3.3Å; N465-S467 PolarHBondContact O-N 2.96Å; S467-Y469 PolarHBondContact O-N 3.41Å; S467-I470 PolarHBondContact O-N 3.17Å
468	S	90.1	Very high	87.8	Confident	57 Å²	57	49.8 Å²	49.8	40%	0.399	26%	0.255	S	S	.	.	H	α-helix	trans	-61.6	-30.7	179.4	65.7	0	0	0	0	113.3	N465 P466 F472	N465-S468 PolarHBondContact O-N 3.07Å; N465-S468 PolarHBondContact O-OG 2.9Å; P466-S468 PolarHBondContact O-N 3.39Å; P466-S468 VanDerWaalsContact O-N 3.15Å; S468-F472 WeakPolarHBondContact O-CD2 3.48Å; S468-F472 WeakPolarHBondContact O-CE2 3.31Å
469	Y	90.9	Very high	87.2	Confident	14 Å²	14	53 Å²	53	6%	0.055	28%	0.276	C	S	.	.	H	α-helix	trans	-80	-24.1	-176.9	-63	-78.3	0	0	0	113.3	L433 C437 L456 A460 T463 P466 S467 R471 F472 I473	L433-Y469 HydrophobicContact CB-CE1 3.82Å; C437-Y469 VanDerWaalsContact SG-CD1 3.56Å; L456-Y469 HydrophobicContact CD2-CD1 4.31Å; A460-Y469 HydrophobicContact CB-CD1 4.43Å; A460-Y469 HydrophobicContact CB-CD2 4.02Å; A460-Y469 HydrophobicContact CB-CG 3.97Å; T463-Y469 HydrophobicContact CG2-CE2 4.19Å; T463-Y469 WeakPolarHBondContact OG1-CE2 3.39Å; P466-Y469 PolarHBondContact O-N 2.64Å; P466-Y469 VanDerWaalsContact O-N 3.12Å; S467-Y469 PolarHBondContact O-N 3.41Å; Y469-R471 VanDerWaalsContact C-N 3.26Å; Y469-R471 PolarHBondContact O-N 2.88Å; Y469-F472 PolarHBondContact O-N 2.99Å; Y469-I473 PolarHBondContact O-N 3.39Å
470	I	90.2	Very high	87.1	Confident	21 Å²	21	54.2 Å²	54.2	11%	0.108	28%	0.282	C	S	.	.	H	α-helix	trans	-59	-39.1	-176.7	-64	175.7	0	0	0	111.3	S467 F472 I473 Y474 L492 F495 L502 I506 L509	S467-I470 PolarHBondContact O-N 3.17Å; I470-F472 VanDerWaalsContact C-N 3.31Å; I470-F472 PolarHBondContact O-N 2.67Å; I470-I473 PolarHBondContact O-N 2.96Å; I470-Y474 WeakPolarHBondContact O-CB 3.43Å; I470-Y474 PolarHBondContact O-N 3.04Å; I470-L492 HydrophobicContact CG2-CD2 4.02Å; I470-F495 HydrophobicContact CD1-CD1 4.46Å; I470-F495 HydrophobicContact CG1-CD1 4.1Å; I470-F495 HydrophobicContact CG1-CE1 4.23Å; I470-L502 HydrophobicContact CD1-CD1 4.13Å; I470-I506 HydrophobicContact CD1-CD1 3.81Å; I470-I506 HydrophobicContact CG1-CD1 4.22Å; I470-I506 HydrophobicContact CG2-CD1 4.23Å; I470-L509 HydrophobicContact CG2-CD1 3.58Å
471	R	90.3	Very high	87	Confident	144 Å²	144	56.1 Å²	56.1	54%	0.543	30%	0.295	S	S	.	.	H	α-helix	trans	-54	-47.2	175.6	144.6	-174	139.6	123.2	10	111.6	E441 Y469 I473 Y474 N475	E441-R471 IonicContact OE1-NH2 3.04Å; E441-R471 PolarHBondContact OE1-NH2 2.94Å; Y469-R471 VanDerWaalsContact C-N 3.26Å; Y469-R471 PolarHBondContact O-N 2.88Å; R471-I473 VanDerWaalsContact C-N 3.32Å; R471-I473 PolarHBondContact O-N 2.75Å; R471-Y474 PolarHBondContact O-N 3.48Å; R471-N475 VanDerWaalsContact O-CG 3.25Å; R471-N475 PolarHBondContact O-N 2.96Å; R471-N475 VanDerWaalsContact O-N 3.09Å; R471-N475 PolarHBondContact O-OD1 3.4Å
472	F	89.8	Confident	87.1	Confident	34 Å²	34	57.5 Å²	57.5	15%	0.149	30%	0.304	C	S	.	.	H	α-helix	trans	-68.2	-36.8	-175	-63.6	-88	0	0	0	110.9	C437 E441 S468 Y469 I470 R476	C437-F472 HydrophobicContact CB-CB 4.26Å; C437-F472 HydrophobicContact CB-CD1 3.81Å; C437-F472 HydrophobicContact CB-CD2 4.22Å; C437-F472 HydrophobicContact CB-CE1 4.13Å; C437-F472 HydrophobicContact CB-CG 3.85Å; C437-F472 HydrophobicContact CB-CZ 4.48Å; E441-F472 HydrophobicContact CG-CD1 4.14Å; E441-F472 WeakPolarHBondContact OE1-CD1 3.46Å; E441-F472 WeakPolarHBondContact OE1-CE1 3.24Å; S468-F472 WeakPolarHBondContact O-CD2 3.48Å; S468-F472 WeakPolarHBondContact O-CE2 3.31Å; Y469-F472 PolarHBondContact O-N 2.99Å; I470-F472 VanDerWaalsContact C-N 3.31Å; I470-F472 PolarHBondContact O-N 2.67Å; F472-R476 WeakPolarHBondContact O-CG 3.39Å
473	I	91	Very high	87.2	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-70.8	-47	176.4	-59.5	169.2	0	0	0	110.6	L453 L456 Y469 I470 R471 N475 R476 A488 A491 L492 F495	L453-I473 HydrophobicContact CD2-CB 4.44Å; L453-I473 HydrophobicContact CD2-CG1 4.18Å; L453-I473 HydrophobicContact CD2-CG2 4.17Å; L456-I473 HydrophobicContact CB-CD1 4.31Å; L456-I473 HydrophobicContact CD1-CG1 4.24Å; Y469-I473 PolarHBondContact O-N 3.39Å; I470-I473 PolarHBondContact O-N 2.96Å; R471-I473 VanDerWaalsContact C-N 3.32Å; R471-I473 PolarHBondContact O-N 2.75Å; I473-N475 PolarHBondContact O-N 2.86Å; I473-R476 WeakPolarHBondContact O-CB 3.49Å; I473-R476 PolarHBondContact O-N 2.71Å; I473-A488 HydrophobicContact CG2-CB 3.88Å; I473-A488 WeakPolarHBondContact CG2-O 3.29Å; I473-A491 HydrophobicContact CD1-CB 4.18Å; I473-A491 HydrophobicContact CG2-CB 4.07Å; I473-L492 HydrophobicContact CB-CD2 4.27Å; I473-L492 HydrophobicContact CG2-CD1 4.48Å; I473-L492 HydrophobicContact CG2-CD2 3.88Å; I473-L492 HydrophobicContact CG2-CG 3.74Å; I473-F495 HydrophobicContact CD1-CD2 4.12Å; I473-F495 HydrophobicContact CD1-CE2 3.54Å; I473-F495 HydrophobicContact CD1-CZ 4.11Å
474	Y	88.3	Confident	87.4	Confident	43 Å²	43	57.8 Å²	57.8	17%	0.169	30%	0.304	C	S	.	.	H	α-helix	trans	-65.5	-37.3	-175.7	-177.9	-103.7	0	0	0	112.8	I470 R471 R476 V477 I478 L509 R512	I470-Y474 WeakPolarHBondContact O-CB 3.43Å; I470-Y474 PolarHBondContact O-N 3.04Å; R471-Y474 PolarHBondContact O-N 3.48Å; Y474-R476 PolarHBondContact O-N 3.47Å; Y474-V477 WeakPolarHBondContact O-CB 3.41Å; Y474-V477 PolarHBondContact O-N 2.9Å; Y474-I478 HydrophobicContact CD1-CD1 4.39Å; Y474-I478 HydrophobicContact CE1-CD1 3.74Å; Y474-L509 HydrophobicContact CD2-CB 4.1Å; Y474-L509 HydrophobicContact CD2-CD1 4.09Å; Y474-L509 HydrophobicContact CD2-CD2 3.78Å; Y474-L509 HydrophobicContact CD2-CG 4.19Å; Y474-L509 HydrophobicContact CE2-CB 4.13Å; Y474-L509 HydrophobicContact CE2-CD2 3.63Å; Y474-L509 HydrophobicContact CE2-CG 4.33Å; Y474-L509 HydrophobicContact CG-CD1 4.47Å; Y474-L509 HydrophobicContact CG-CD2 4.33Å; Y474-R512 WeakPolarHBondContact OH-CD 3.37Å; Y474-R512 PolarHBondContact OH-NH1 2.86Å; Y474-R512 VanDerWaalsContact OH-NH1 3.07Å
475	N	88.2	Confident	87.7	Confident	60 Å²	60	54 Å²	54	32%	0.321	28%	0.275	S	S	.	.	H	α-helix	trans	-59	-32.3	176.3	-72.6	-8.2	0	0	0	112.4	R471 I473 V477 I478 L479	R471-N475 VanDerWaalsContact O-CG 3.25Å; R471-N475 PolarHBondContact O-N 2.96Å; R471-N475 VanDerWaalsContact O-N 3.09Å; R471-N475 PolarHBondContact O-OD1 3.4Å; I473-N475 PolarHBondContact O-N 2.86Å; N475-V477 VanDerWaalsContact C-N 3.35Å; N475-I478 PolarHBondContact O-N 3.49Å; N475-L479 PolarHBondContact O-N 2.83Å
476	R	88.5	Confident	87.9	Confident	14 Å²	14	48.6 Å²	48.6	5%	0.053	25%	0.247	C	C	.	.	H	α-helix	trans	-74.1	-23.4	177.4	-57.7	-73.8	80.7	81.8	-18.1	113.3	I440 E441 F472 I473 Y474 I478 E480 V484 R485 A488	I440-R476 HydrophobicContact CD1-CG 4.49Å; I440-R476 VanDerWaalsContact O-CD 3.27Å; I440-R476 WeakPolarHBondContact O-CD 3.33Å; I440-R476 PolarHBondContact O-NE 3.14Å; I440-R476 PolarHBondContact O-NH1 3.12Å; E441-R476 PolarHBondContact O-NH2 3.06Å; E441-R476 VanDerWaalsContact O-NH2 3.14Å; F472-R476 WeakPolarHBondContact O-CG 3.39Å; I473-R476 WeakPolarHBondContact O-CB 3.49Å; I473-R476 PolarHBondContact O-N 2.71Å; Y474-R476 PolarHBondContact O-N 3.47Å; R476-I478 PolarHBondContact O-N 3.18Å; R476-E480 HydrophobicContact CB-CG 4Å; R476-E480 WeakPolarHBondContact CD-OE1 3.31Å; R476-E480 HydrophobicContact CG-CG 4.48Å; R476-E480 IonicContact CZ-OE1 2.96Å; R476-E480 IonicContact NE-OE1 3.94Å; R476-E480 PolarHBondContact NE-OE1 3.09Å; R476-E480 IonicContact NH2-OE1 2.69Å; R476-E480 WeakPolarHBondContact O-CB 3.49Å; R476-E480 WeakPolarHBondContact O-CG 3.34Å; R476-V484 HydrophobicContact CB-CG1 4.22Å; R476-R485 WeakPolarHBondContact O-CG 3.23Å; R476-A488 HydrophobicContact CB-CB 4.45Å
477	V	80.9	Confident	88	Confident	10 Å²	10	47.7 Å²	47.7	6%	0.061	24%	0.241	C	C	.	.	H	α-helix	trans	-65.5	-24.7	174.6	179.2	0	0	0	0	111.3	Y474 N475 R485 A488 L492	Y474-V477 WeakPolarHBondContact O-CB 3.41Å; Y474-V477 PolarHBondContact O-N 2.9Å; N475-V477 VanDerWaalsContact C-N 3.35Å; V477-R485 WeakPolarHBondContact O-CD 3.35Å; V477-R485 VanDerWaalsContact O-CG 3.32Å; V477-R485 WeakPolarHBondContact O-CG 3.34Å; V477-A488 HydrophobicContact CG2-CB 3.56Å; V477-L492 HydrophobicContact CG2-CD1 4.2Å
478	I	76.3	Confident	88.2	Confident	102 Å²	102	44.3 Å²	44.3	52%	0.523	22%	0.218	S	C	.	.	H	α-helix	trans	-97	-40.7	-173.5	-58.4	175.1	0	0	0	112.2	Y474 N475 R476	Y474-I478 HydrophobicContact CD1-CD1 4.39Å; Y474-I478 HydrophobicContact CE1-CD1 3.74Å; N475-I478 PolarHBondContact O-N 3.49Å; R476-I478 PolarHBondContact O-N 3.18Å
479	L	75.1	Confident	88.4	Confident	130 Å²	130	41.6 Å²	41.6	68%	0.681	20%	0.199	S	C	*	.	H	α-helix	trans	-104	-5.1	-161.6	-63.5	172.1	0	0	0	114.7	N475	N475-L479 PolarHBondContact O-N 2.83Å
480	E	85.1	Confident	88.4	Confident	45 Å²	45	41.5 Å²	41.5	21%	0.21	20%	0.199	C	C	.	.	S	Bend	trans	-114.7	174.7	-165.2	-58.5	-68.2	168.5	0	0	114.3	R476 V484 R485	R476-E480 HydrophobicContact CB-CG 4Å; R476-E480 WeakPolarHBondContact CD-OE1 3.31Å; R476-E480 HydrophobicContact CG-CG 4.48Å; R476-E480 IonicContact CZ-OE1 2.96Å; R476-E480 IonicContact NE-OE1 3.94Å; R476-E480 PolarHBondContact NE-OE1 3.09Å; R476-E480 IonicContact NH2-OE1 2.69Å; R476-E480 WeakPolarHBondContact O-CB 3.49Å; R476-E480 WeakPolarHBondContact O-CG 3.34Å; E480-V484 HydrophobicContact CB-CB 3.77Å; E480-V484 HydrophobicContact CB-CG1 3.73Å; E480-V484 HydrophobicContact CG-CB 4.43Å; E480-V484 HydrophobicContact CG-CG1 3.87Å; E480-R485 HydrophobicContact CB-CG 4.44Å; E480-R485 WeakPolarHBondContact O-CD 3.44Å; E480-R485 PolarHBondContact O-NE 2.93Å
481	S	89.1	Confident	88.5	Confident	39 Å²	39	40.5 Å²	40.5	27%	0.273	19%	0.194	S	C	.	.			trans	-59.6	155.4	173.6	73.2	0	0	0	0	112.5	D446 K483 V484 R485	D446-S481 WeakPolarHBondContact OD1-CB 3.29Å; D446-S481 PolarHBondContact OD1-OG 2.66Å; D446-S481 PolarHBondContact OD2-OG 3.35Å; S481-K483 VanDerWaalsContact C-N 3.26Å; S481-K483 PolarHBondContact O-N 3Å; S481-V484 PolarHBondContact O-N 2.94Å; S481-V484 WeakPolarHBondContact OG-CG2 3.38Å; S481-R485 WeakPolarHBondContact O-CG 3.13Å; S481-R485 PolarHBondContact O-N 3.5Å
482	T	89.1	Confident	88.7	Confident	42 Å²	42	33.6 Å²	33.6	26%	0.258	17%	0.168	S	C	.	.	H	α-helix	trans	-48.6	-46.2	178.2	-67.4	0	0	0	0	112.3	V484 R485 A486 D518 V521	T482-V484 VanDerWaalsContact C-N 3.31Å; T482-V484 PolarHBondContact O-N 3.25Å; T482-R485 PolarHBondContact O-N 3.23Å; T482-R485 PolarHBondContact OG1-NH2 3.25Å; T482-A486 WeakPolarHBondContact O-CB 3.4Å; T482-A486 PolarHBondContact O-N 3Å; T482-D518 WeakPolarHBondContact CB-OD2 3.49Å; T482-D518 HydrophobicContact CG2-CB 4.04Å; T482-D518 WeakPolarHBondContact CG2-OD1 3.32Å; T482-D518 WeakPolarHBondContact CG2-OD2 3.32Å; T482-D518 PolarHBondContact OG1-OD2 3.07Å; T482-V521 HydrophobicContact CG2-CG2 4.18Å
483	K	89.8	Confident	88.7	Confident	142 Å²	142	32 Å²	32	62%	0.617	16%	0.161	S	C	*	.	H	α-helix	trans	-60.2	-39	-178.8	-67.4	-179.6	179.2	177.4	0	112.8	T450 S481 A486 A487	T450-K483 HydrophobicContact CG2-CB 4.43Å; T450-K483 WeakPolarHBondContact CG2-O 3.39Å; S481-K483 VanDerWaalsContact C-N 3.26Å; S481-K483 PolarHBondContact O-N 3Å; K483-A486 WeakPolarHBondContact O-CB 3.32Å; K483-A487 PolarHBondContact O-N 3.29Å
484	V	91.1	Very high	88.7	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-74.2	-42.5	179.5	178.5	0	0	0	0	110.7	D446 T450 L453 R476 E480 S481 T482 A486 A487 A488	D446-V484 HydrophobicContact CB-CG2 4.12Å; D446-V484 WeakPolarHBondContact OD1-CG2 3.47Å; T450-V484 HydrophobicContact CG2-CG2 4.18Å; L453-V484 HydrophobicContact CD1-CG1 3.7Å; R476-V484 HydrophobicContact CB-CG1 4.22Å; E480-V484 HydrophobicContact CB-CB 3.77Å; E480-V484 HydrophobicContact CB-CG1 3.73Å; E480-V484 HydrophobicContact CG-CB 4.43Å; E480-V484 HydrophobicContact CG-CG1 3.87Å; S481-V484 PolarHBondContact O-N 2.94Å; S481-V484 WeakPolarHBondContact OG-CG2 3.38Å; T482-V484 VanDerWaalsContact C-N 3.31Å; T482-V484 PolarHBondContact O-N 3.25Å; V484-A486 VanDerWaalsContact C-N 3.33Å; V484-A486 PolarHBondContact O-N 3.46Å; V484-A487 PolarHBondContact O-N 3.36Å; V484-A488 WeakPolarHBondContact O-CB 3.44Å; V484-A488 PolarHBondContact O-N 2.94Å
485	R	92.9	Very high	88.8	Confident	29 Å²	29	31.9 Å²	31.9	11%	0.109	16%	0.161	C	C	.	.	H	α-helix	trans	-58.9	-45.3	175.2	-65.1	-171.4	-70.6	159.4	6	111.7	R476 V477 E480 S481 T482 A487 A488 V489 D516 V521	R476-R485 WeakPolarHBondContact O-CG 3.23Å; V477-R485 WeakPolarHBondContact O-CD 3.35Å; V477-R485 VanDerWaalsContact O-CG 3.32Å; V477-R485 WeakPolarHBondContact O-CG 3.34Å; E480-R485 HydrophobicContact CB-CG 4.44Å; E480-R485 WeakPolarHBondContact O-CD 3.44Å; E480-R485 PolarHBondContact O-NE 2.93Å; S481-R485 WeakPolarHBondContact O-CG 3.13Å; S481-R485 PolarHBondContact O-N 3.5Å; T482-R485 PolarHBondContact O-N 3.23Å; T482-R485 PolarHBondContact OG1-NH2 3.25Å; R485-A487 PolarHBondContact O-N 3.31Å; R485-A488 WeakPolarHBondContact O-CB 3.28Å; R485-A488 PolarHBondContact O-N 3.14Å; R485-A488 VanDerWaalsContact O-N 3.16Å; R485-V489 WeakPolarHBondContact O-CG2 3.44Å; R485-V489 PolarHBondContact O-N 2.97Å; R485-D516 IonicContact CZ-OD1 2.74Å; R485-D516 VanDerWaalsContact CZ-OD1 3.23Å; R485-D516 IonicContact CZ-OD2 3.68Å; R485-D516 IonicContact NE-OD2 3.67Å; R485-D516 IonicContact NH1-OD1 3.93Å; R485-D516 PolarHBondContact NH1-OD1 3.44Å; R485-D516 IonicContact NH1-OD2 3.3Å; R485-D516 PolarHBondContact NH1-OD2 2.7Å; R485-D516 IonicContact NH2-OD1 2.62Å; R485-D516 PolarHBondContact NH2-OD1 3.3Å; R485-V521 HydrophobicContact CB-CG2 4.04Å
486	A	91.3	Very high	88.8	Confident	2 Å²	2	29 Å²	29	2%	0.017	15%	0.146	C	C	.	.	H	α-helix	trans	-56.8	-44.2	175.1	0	0	0	0	0	113.4	T482 K483 V484 T490 E520 V521 R524	T482-A486 WeakPolarHBondContact O-CB 3.4Å; T482-A486 PolarHBondContact O-N 3Å; K483-A486 WeakPolarHBondContact O-CB 3.32Å; V484-A486 VanDerWaalsContact C-N 3.33Å; V484-A486 PolarHBondContact O-N 3.46Å; A486-T490 PolarHBondContact O-N 3.32Å; A486-T490 PolarHBondContact O-OG1 2.98Å; A486-E520 WeakPolarHBondContact CB-OE2 3.39Å; A486-V521 HydrophobicContact CB-CG2 4.25Å; A486-R524 VanDerWaalsContact CB-NH1 3.33Å; A486-R524 WeakPolarHBondContact O-CD 3.26Å; A486-R524 PolarHBondContact O-NH1 3.22Å
487	A	91.8	Very high	88.8	Confident	3 Å²	3	28.8 Å²	28.8	3%	0.025	15%	0.147	C	C	.	.	H	α-helix	trans	-69.7	-37.2	174.6	0	0	0	0	0	112.2	T450 L453 K483 V484 R485 T490 A491	T450-A487 HydrophobicContact CG2-CB 3.85Å; L453-A487 HydrophobicContact CB-CB 4.24Å; L453-A487 HydrophobicContact CD1-CB 4.1Å; K483-A487 PolarHBondContact O-N 3.29Å; V484-A487 PolarHBondContact O-N 3.36Å; R485-A487 PolarHBondContact O-N 3.31Å; A487-T490 WeakPolarHBondContact O-CB 3.3Å; A487-T490 PolarHBondContact O-N 2.92Å; A487-A491 PolarHBondContact O-N 3.31Å
488	A	92.8	Very high	89	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.8	-40.9	176.7	0	0	0	0	0	112	L453 I473 R476 V477 V484 R485 T490 A491 L492	L453-A488 HydrophobicContact CD1-CB 4.07Å; L453-A488 HydrophobicContact CD2-CB 4.27Å; I473-A488 HydrophobicContact CG2-CB 3.88Å; I473-A488 WeakPolarHBondContact CG2-O 3.29Å; R476-A488 HydrophobicContact CB-CB 4.45Å; V477-A488 HydrophobicContact CG2-CB 3.56Å; V484-A488 WeakPolarHBondContact O-CB 3.44Å; V484-A488 PolarHBondContact O-N 2.94Å; R485-A488 WeakPolarHBondContact O-CB 3.28Å; R485-A488 PolarHBondContact O-N 3.14Å; R485-A488 VanDerWaalsContact O-N 3.16Å; A488-T490 VanDerWaalsContact C-N 3.31Å; A488-T490 PolarHBondContact O-N 3.26Å; A488-A491 PolarHBondContact O-N 3.43Å; A488-L492 WeakPolarHBondContact O-CG 3.4Å; A488-L492 PolarHBondContact O-N 2.91Å
489	V	93.8	Very high	89.4	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-58.7	-43.1	172.2	169.4	0	0	0	0	111.3	R485 L492 A493 L510 C513 V521 R524 A525 Y528	R485-V489 WeakPolarHBondContact O-CG2 3.44Å; R485-V489 PolarHBondContact O-N 2.97Å; V489-L492 PolarHBondContact O-N 3.01Å; V489-A493 PolarHBondContact O-N 3.16Å; V489-L510 HydrophobicContact CG1-CD2 3.86Å; V489-C513 HydrophobicContact CG2-CB 4.16Å; V489-V521 HydrophobicContact CG2-CG1 3.85Å; V489-R524 HydrophobicContact CG1-CB 4.44Å; V489-R524 HydrophobicContact CG1-CG 4.05Å; V489-A525 HydrophobicContact CG1-CB 4.1Å; V489-Y528 HydrophobicContact CG1-CD2 4.08Å
490	T	92.1	Very high	89.9	Confident	11 Å²	11	25.2 Å²	25.2	7%	0.067	13%	0.132	C	C	.	.	H	α-helix	trans	-60.8	-44.7	174.4	-51.7	0	0	0	0	111.9	A486 A487 A488 A493 K494 R524 Y528	A486-T490 PolarHBondContact O-N 3.32Å; A486-T490 PolarHBondContact O-OG1 2.98Å; A487-T490 WeakPolarHBondContact O-CB 3.3Å; A487-T490 PolarHBondContact O-N 2.92Å; A488-T490 VanDerWaalsContact C-N 3.31Å; A488-T490 PolarHBondContact O-N 3.26Å; T490-A493 PolarHBondContact O-N 3.09Å; T490-K494 WeakPolarHBondContact O-CG 3.15Å; T490-K494 PolarHBondContact O-N 3.23Å; T490-R524 VanDerWaalsContact OG1-CD 3.29Å; T490-R524 WeakPolarHBondContact OG1-CD 3.34Å; T490-Y528 HydrophobicContact CG2-CE2 4.35Å
491	A	92.5	Very high	90	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.5	-46	178.6	0	0	0	0	0	111.1	L453 I473 A487 A488 A493 K494 F495	L453-A491 WeakPolarHBondContact O-CB 3.3Å; I473-A491 HydrophobicContact CD1-CB 4.18Å; I473-A491 HydrophobicContact CG2-CB 4.07Å; A487-A491 PolarHBondContact O-N 3.31Å; A488-A491 PolarHBondContact O-N 3.43Å; A491-A493 VanDerWaalsContact C-N 3.32Å; A491-A493 PolarHBondContact O-N 3.14Å; A491-K494 PolarHBondContact O-N 3.29Å; A491-F495 WeakPolarHBondContact O-CD2 3.4Å; A491-F495 PolarHBondContact O-N 3.21Å; A491-F495 VanDerWaalsContact O-N 3.09Å
492	L	92.9	Very high	90	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.2	-43	174.8	-69.6	173.8	0	0	0	111.8	I470 I473 V477 A488 V489 K494 F495 G496 I506 L509 L510	I470-L492 HydrophobicContact CG2-CD2 4.02Å; I473-L492 HydrophobicContact CB-CD2 4.27Å; I473-L492 HydrophobicContact CG2-CD1 4.48Å; I473-L492 HydrophobicContact CG2-CD2 3.88Å; I473-L492 HydrophobicContact CG2-CG 3.74Å; V477-L492 HydrophobicContact CG2-CD1 4.2Å; A488-L492 WeakPolarHBondContact O-CG 3.4Å; A488-L492 PolarHBondContact O-N 2.91Å; V489-L492 PolarHBondContact O-N 3.01Å; L492-K494 VanDerWaalsContact C-N 3.33Å; L492-K494 PolarHBondContact O-N 3.05Å; L492-F495 WeakPolarHBondContact O-CB 3.45Å; L492-F495 PolarHBondContact O-N 3.22Å; L492-G496 PolarHBondContact O-N 3.45Å; L492-I506 HydrophobicContact CB-CD1 4.43Å; L492-I506 HydrophobicContact CB-CG2 4.32Å; L492-I506 HydrophobicContact CD2-CD1 3.77Å; L492-I506 VanDerWaalsContact O-CG2 3.23Å; L492-I506 WeakPolarHBondContact O-CG2 2.86Å; L492-L509 HydrophobicContact CD1-CB 4.43Å; L492-L509 HydrophobicContact CD2-CD1 4.25Å; L492-L510 HydrophobicContact CB-CD2 4.29Å
493	A	91.2	Very high	90	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.5	-41.5	176.9	0	0	0	0	0	112.4	V489 T490 A491 F495 G496 A497 Y528 I544	V489-A493 PolarHBondContact O-N 3.16Å; T490-A493 PolarHBondContact O-N 3.09Å; A491-A493 VanDerWaalsContact C-N 3.32Å; A491-A493 PolarHBondContact O-N 3.14Å; A493-F495 VanDerWaalsContact C-N 3.34Å; A493-F495 PolarHBondContact O-N 3.35Å; A493-G496 PolarHBondContact O-N 3.14Å; A493-G496 VanDerWaalsContact O-N 3.17Å; A493-A497 WeakPolarHBondContact O-CB 3.22Å; A493-A497 PolarHBondContact O-N 2.7Å; A493-Y528 HydrophobicContact CB-CD1 3.76Å; A493-Y528 HydrophobicContact CB-CD2 3.4Å; A493-Y528 VanDerWaalsContact CB-CD2 3.4Å; A493-Y528 HydrophobicContact CB-CE1 4.26Å; A493-Y528 HydrophobicContact CB-CE2 3.92Å; A493-Y528 HydrophobicContact CB-CG 3.32Å; A493-I544 HydrophobicContact CB-CG2 4.23Å
494	K	90.1	Very high	90	Very high	40 Å²	40	27 Å²	27	17%	0.174	15%	0.147	C	C	.	.	H	α-helix	trans	-63.8	-36.2	175.1	-69.1	-176.3	177.6	-166.3	0	112.9	G457 T490 A491 L492 A497 Q498 I544 L545	G457-K494 WeakPolarHBondContact O-CB 3.34Å; T490-K494 WeakPolarHBondContact O-CG 3.15Å; T490-K494 PolarHBondContact O-N 3.23Å; A491-K494 PolarHBondContact O-N 3.29Å; L492-K494 VanDerWaalsContact C-N 3.33Å; L492-K494 PolarHBondContact O-N 3.05Å; K494-A497 PolarHBondContact O-N 3.08Å; K494-Q498 WeakPolarHBondContact O-CG 3.49Å; K494-Q498 PolarHBondContact O-N 2.91Å; K494-I544 WeakPolarHBondContact CE-O 3.5Å; K494-I544 HydrophobicContact CG-CG2 3.98Å; K494-L545 HydrophobicContact CB-CD2 4.44Å; K494-L545 HydrophobicContact CG-CD2 4.39Å
495	F	90.9	Very high	90	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.1	-45.4	170.5	-90.5	-103.1	0	0	0	111.8	A460 P461 P466 I470 I473 A491 L492 A493 A497 Q498 C499 I506	A460-F495 HydrophobicContact CB-CE1 4.45Å; A460-F495 HydrophobicContact CB-CE2 4.04Å; A460-F495 HydrophobicContact CB-CZ 3.49Å; A460-F495 VanDerWaalsContact CB-CZ 3.49Å; P461-F495 HydrophobicContact CG-CD1 4.12Å; P461-F495 HydrophobicContact CG-CD2 3.8Å; P461-F495 HydrophobicContact CG-CE1 4.22Å; P461-F495 HydrophobicContact CG-CE2 3.92Å; P461-F495 HydrophobicContact CG-CG 3.93Å; P461-F495 HydrophobicContact CG-CZ 4.16Å; P466-F495 HydrophobicContact CB-CD1 4.25Å; P466-F495 HydrophobicContact CB-CE1 3.8Å; P466-F495 WeakPolarHBondContact O-CE1 3.27Å; I470-F495 HydrophobicContact CD1-CD1 4.46Å; I470-F495 HydrophobicContact CG1-CD1 4.1Å; I470-F495 HydrophobicContact CG1-CE1 4.23Å; I473-F495 HydrophobicContact CD1-CD2 4.12Å; I473-F495 HydrophobicContact CD1-CE2 3.54Å; I473-F495 HydrophobicContact CD1-CZ 4.11Å; A491-F495 WeakPolarHBondContact O-CD2 3.4Å; A491-F495 PolarHBondContact O-N 3.21Å; A491-F495 VanDerWaalsContact O-N 3.09Å; L492-F495 WeakPolarHBondContact O-CB 3.45Å; L492-F495 PolarHBondContact O-N 3.22Å; A493-F495 VanDerWaalsContact C-N 3.34Å; A493-F495 PolarHBondContact O-N 3.35Å; F495-A497 VanDerWaalsContact C-N 3.27Å; F495-A497 PolarHBondContact O-N 3.22Å; F495-Q498 PolarHBondContact O-N 3.38Å; F495-C499 WeakPolarHBondContact O-CB 3.31Å; F495-C499 PolarHBondContact O-N 3.36Å; F495-I506 HydrophobicContact CB-CD1 4.14Å; F495-I506 HydrophobicContact CB-CG1 4.33Å
496	G	88.2	Confident	90	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-65	-30.7	176.8	0	0	0	0	0	113.3	L492 A493 R503	L492-G496 PolarHBondContact O-N 3.45Å; A493-G496 PolarHBondContact O-N 3.14Å; A493-G496 VanDerWaalsContact O-N 3.17Å; G496-R503 PolarHBondContact O-NE 2.8Å; G496-R503 PolarHBondContact O-NH2 3.26Å
497	A	87.1	Confident	90	Very high	10 Å²	10	30.9 Å²	30.9	8%	0.083	17%	0.173	C	C	.	.	H	α-helix	trans	-72.6	-48.7	176.1	0	0	0	0	0	112	A493 K494 F495 R503 L532 I540 I544 L545	A493-A497 WeakPolarHBondContact O-CB 3.22Å; A493-A497 PolarHBondContact O-N 2.7Å; K494-A497 PolarHBondContact O-N 3.08Å; F495-A497 VanDerWaalsContact C-N 3.27Å; F495-A497 PolarHBondContact O-N 3.22Å; A497-R503 PolarHBondContact O-NH2 3.37Å; A497-L532 HydrophobicContact CB-CD2 4.27Å; A497-I540 HydrophobicContact CB-CG2 3.49Å; A497-I540 VanDerWaalsContact CB-CG2 3.49Å; A497-I544 HydrophobicContact CB-CB 4.27Å; A497-I544 HydrophobicContact CB-CG2 3.87Å; A497-L545 HydrophobicContact CB-CD1 4.26Å; A497-L545 HydrophobicContact CB-CD2 3.9Å; A497-L545 HydrophobicContact CB-CG 4.08Å
498	Q	85.3	Confident	90	Very high	63 Å²	63	34.4 Å²	34.4	29%	0.294	20%	0.195	S	C	.	.	H	α-helix	trans	-81.7	-30.7	-175.3	-67	175.7	48.3	0	0	114.1	G457 P461 K494 F495 L545	G457-Q498 PolarHBondContact O-NE2 2.87Å; P461-Q498 HydrophobicContact CB-CB 3.8Å; P461-Q498 HydrophobicContact CB-CG 4.43Å; P461-Q498 HydrophobicContact CG-CB 4.44Å; K494-Q498 WeakPolarHBondContact O-CG 3.49Å; K494-Q498 PolarHBondContact O-N 2.91Å; F495-Q498 PolarHBondContact O-N 3.38Å; Q498-L545 HydrophobicContact CG-CD1 4.02Å; Q498-L545 HydrophobicContact CG-CD2 3.63Å
499	C	86	Confident	89.9	Confident	20 Å²	20	35.7 Å²	35.7	14%	0.135	20%	0.201	C	C	.	.			trans	-114.6	97.6	-177.3	-59.5	0	0	0	0	110.8	F495 D501 L502 R503	F495-C499 WeakPolarHBondContact O-CB 3.31Å; F495-C499 PolarHBondContact O-N 3.36Å; C499-D501 VanDerWaalsContact C-N 3.31Å; C499-D501 PolarHBondContact O-N 3.2Å; C499-L502 HydrophobicContact CB-CB 4.08Å; C499-L502 HydrophobicContact CB-CD1 3.97Å; C499-L502 HydrophobicContact CB-CG 4.18Å; C499-L502 PolarHBondContact O-N 3.29Å; C499-R503 PolarHBondContact O-N 3.26Å
500	V	84.4	Confident	89.8	Confident	84 Å²	84	35.7 Å²	35.7	51%	0.509	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-59.4	-40.9	-178.6	-176.7	0	0	0	0	111.8	L502 R503	V500-L502 VanDerWaalsContact C-N 3.25Å; V500-L502 PolarHBondContact O-N 3.11Å; V500-R503 VanDerWaalsContact O-CB 3.23Å; V500-R503 WeakPolarHBondContact O-CB 3.47Å; V500-R503 PolarHBondContact O-N 3.07Å; V500-R503 VanDerWaalsContact O-N 3.14Å
501	D	87.2	Confident	89.9	Confident	155 Å²	155	40.7 Å²	40.7	83%	0.829	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-62.5	-30.4	180	-61.3	-30.9	0	0	0	113.5	C499	C499-D501 VanDerWaalsContact C-N 3.31Å; C499-D501 PolarHBondContact O-N 3.2Å
502	L	89.1	Confident	89.7	Confident	34 Å²	34	47.6 Å²	47.6	18%	0.178	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-91	-12	-179	-62.2	175	0	0	0	112.4	P466 I470 C499 V500 S505 I506	P466-L502 HydrophobicContact CB-CD1 3.92Å; I470-L502 HydrophobicContact CD1-CD1 4.13Å; C499-L502 HydrophobicContact CB-CB 4.08Å; C499-L502 HydrophobicContact CB-CD1 3.97Å; C499-L502 HydrophobicContact CB-CG 4.18Å; C499-L502 PolarHBondContact O-N 3.29Å; V500-L502 VanDerWaalsContact C-N 3.25Å; V500-L502 PolarHBondContact O-N 3.11Å; L502-S505 WeakPolarHBondContact O-CB 3.43Å; L502-S505 PolarHBondContact O-N 2.88Å; L502-S505 VanDerWaalsContact O-N 3.13Å; L502-I506 WeakPolarHBondContact O-CG1 3.29Å; L502-I506 PolarHBondContact O-N 3.08Å
503	R	89.4	Confident	89.6	Confident	37 Å²	37	47.8 Å²	47.8	14%	0.14	25%	0.249	C	C	.	.	H	α-helix	trans	-54.7	-45.1	-176.2	-172.5	179.3	-69.4	173.1	1.6	113.4	G496 A497 C499 V500 S505 I506 Q507	G496-R503 PolarHBondContact O-NE 2.8Å; G496-R503 PolarHBondContact O-NH2 3.26Å; A497-R503 PolarHBondContact O-NH2 3.37Å; C499-R503 PolarHBondContact O-N 3.26Å; V500-R503 VanDerWaalsContact O-CB 3.23Å; V500-R503 WeakPolarHBondContact O-CB 3.47Å; V500-R503 PolarHBondContact O-N 3.07Å; V500-R503 VanDerWaalsContact O-N 3.14Å; R503-S505 VanDerWaalsContact C-N 3.32Å; R503-S505 PolarHBondContact O-N 3.47Å; R503-I506 PolarHBondContact O-N 2.92Å; R503-Q507 HydrophobicContact CG-CG 4.49Å; R503-Q507 WeakPolarHBondContact O-CG 3.25Å; R503-Q507 PolarHBondContact O-N 3.06Å
504	P	90.9	Very high	89.6	Confident	80 Å²	80	50.7 Å²	50.7	52%	0.519	27%	0.265	S	S	.	.	H	α-helix	trans	-61.1	-40.8	178.1	-23.1	34.6	0	0	0	112.7	Q507 V508	P504-Q507 PolarHBondContact O-N 3.36Å; P504-V508 WeakPolarHBondContact O-CG2 3.45Å; P504-V508 PolarHBondContact O-N 3.39Å
505	S	90.8	Very high	89.6	Confident	72 Å²	72	56.2 Å²	56.2	50%	0.503	30%	0.295	S	S	.	.	H	α-helix	trans	-65.4	-45	177.1	-60.8	0	0	0	0	111.3	L502 R503 Q507 V508 L509	L502-S505 WeakPolarHBondContact O-CB 3.43Å; L502-S505 PolarHBondContact O-N 2.88Å; L502-S505 VanDerWaalsContact O-N 3.13Å; R503-S505 VanDerWaalsContact C-N 3.32Å; R503-S505 PolarHBondContact O-N 3.47Å; S505-Q507 PolarHBondContact O-N 3.32Å; S505-V508 WeakPolarHBondContact O-CB 3.43Å; S505-V508 PolarHBondContact O-N 3.3Å; S505-L509 WeakPolarHBondContact O-CG 3.02Å; S505-L509 PolarHBondContact O-N 3.44Å
506	I	92.1	Very high	89.6	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.4	-42.3	176.5	-66.5	-61.1	0	0	0	111.4	I470 L492 F495 L502 R503 V508 L509 L510 L532	I470-I506 HydrophobicContact CD1-CD1 3.81Å; I470-I506 HydrophobicContact CG1-CD1 4.22Å; I470-I506 HydrophobicContact CG2-CD1 4.23Å; L492-I506 HydrophobicContact CB-CD1 4.43Å; L492-I506 HydrophobicContact CB-CG2 4.32Å; L492-I506 HydrophobicContact CD2-CD1 3.77Å; L492-I506 VanDerWaalsContact O-CG2 3.23Å; L492-I506 WeakPolarHBondContact O-CG2 2.86Å; F495-I506 HydrophobicContact CB-CD1 4.14Å; F495-I506 HydrophobicContact CB-CG1 4.33Å; L502-I506 WeakPolarHBondContact O-CG1 3.29Å; L502-I506 PolarHBondContact O-N 3.08Å; R503-I506 PolarHBondContact O-N 2.92Å; I506-V508 VanDerWaalsContact C-N 3.27Å; I506-V508 PolarHBondContact O-N 3.32Å; I506-L509 HydrophobicContact CD1-CD1 4.38Å; I506-L509 WeakPolarHBondContact O-CB 3.43Å; I506-L509 PolarHBondContact O-N 3.47Å; I506-L510 HydrophobicContact CG2-CD1 3.94Å; I506-L510 HydrophobicContact CG2-CG 4.15Å; I506-L510 WeakPolarHBondContact O-CG 3.15Å; I506-L510 PolarHBondContact O-N 3.2Å; I506-L532 HydrophobicContact CG2-CD1 4.4Å
507	Q	91.8	Very high	89.7	Confident	39 Å²	39	61.9 Å²	61.9	18%	0.182	33%	0.333	C	S	.	.	H	α-helix	trans	-59.1	-38	176.8	-74.4	174.3	-4.2	0	0	112	R503 P504 S505 L509 L510 K511 L529 L532	R503-Q507 HydrophobicContact CG-CG 4.49Å; R503-Q507 WeakPolarHBondContact O-CG 3.25Å; R503-Q507 PolarHBondContact O-N 3.06Å; P504-Q507 PolarHBondContact O-N 3.36Å; S505-Q507 PolarHBondContact O-N 3.32Å; Q507-L509 VanDerWaalsContact C-N 3.34Å; Q507-L510 PolarHBondContact O-N 3.2Å; Q507-K511 WeakPolarHBondContact O-CB 3.44Å; Q507-K511 VanDerWaalsContact O-CG 3.31Å; Q507-K511 WeakPolarHBondContact O-CG 3.31Å; Q507-K511 PolarHBondContact O-N 2.94Å; Q507-L529 HydrophobicContact CB-CD1 3.94Å; Q507-L529 HydrophobicContact CG-CD1 4.09Å; Q507-L532 PolarHBondContact NE2-O 3.35Å
508	V	91.6	Very high	89.9	Confident	78 Å²	78	63.2 Å²	63.2	47%	0.473	34%	0.339	S	S	.	.	H	α-helix	trans	-63.8	-40.3	174.4	174.2	0	0	0	0	111.3	P504 S505 I506 R512	P504-V508 WeakPolarHBondContact O-CG2 3.45Å; P504-V508 PolarHBondContact O-N 3.39Å; S505-V508 WeakPolarHBondContact O-CB 3.43Å; S505-V508 PolarHBondContact O-N 3.3Å; I506-V508 VanDerWaalsContact C-N 3.27Å; I506-V508 PolarHBondContact O-N 3.32Å; V508-R512 PolarHBondContact O-N 3.31Å
509	L	90.9	Very high	90.3	Very high	26 Å²	26	64.9 Å²	64.9	14%	0.136	35%	0.35	C	S	.	.	H	α-helix	trans	-67.6	-43.4	177.1	-57.6	179.6	0	0	0	111.6	I470 Y474 L492 S505 I506 Q507 K511 R512 C513	I470-L509 HydrophobicContact CG2-CD1 3.58Å; Y474-L509 HydrophobicContact CD2-CB 4.1Å; Y474-L509 HydrophobicContact CD2-CD1 4.09Å; Y474-L509 HydrophobicContact CD2-CD2 3.78Å; Y474-L509 HydrophobicContact CD2-CG 4.19Å; Y474-L509 HydrophobicContact CE2-CB 4.13Å; Y474-L509 HydrophobicContact CE2-CD2 3.63Å; Y474-L509 HydrophobicContact CE2-CG 4.33Å; Y474-L509 HydrophobicContact CG-CD1 4.47Å; Y474-L509 HydrophobicContact CG-CD2 4.33Å; L492-L509 HydrophobicContact CD1-CB 4.43Å; L492-L509 HydrophobicContact CD2-CD1 4.25Å; S505-L509 WeakPolarHBondContact O-CG 3.02Å; S505-L509 PolarHBondContact O-N 3.44Å; I506-L509 HydrophobicContact CD1-CD1 4.38Å; I506-L509 WeakPolarHBondContact O-CB 3.43Å; I506-L509 PolarHBondContact O-N 3.47Å; Q507-L509 VanDerWaalsContact C-N 3.34Å; L509-K511 VanDerWaalsContact C-N 3.35Å; L509-K511 PolarHBondContact O-N 2.97Å; L509-R512 WeakPolarHBondContact O-CB 3.35Å; L509-R512 PolarHBondContact O-N 3.25Å; L509-R512 VanDerWaalsContact O-N 3.16Å; L509-C513 PolarHBondContact O-N 3.28Å; L509-C513 PolarHBondContact O-SG 3.45Å
510	L	91.8	Very high	90.5	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-63.8	-37.5	176.9	-69	177.8	0	0	0	112.2	V489 L492 I506 Q507 R512 C513 L514 L529 L532	V489-L510 HydrophobicContact CG1-CD2 3.86Å; L492-L510 HydrophobicContact CB-CD2 4.29Å; I506-L510 HydrophobicContact CG2-CD1 3.94Å; I506-L510 HydrophobicContact CG2-CG 4.15Å; I506-L510 WeakPolarHBondContact O-CG 3.15Å; I506-L510 PolarHBondContact O-N 3.2Å; Q507-L510 PolarHBondContact O-N 3.2Å; L510-R512 PolarHBondContact O-N 3.2Å; L510-C513 VanDerWaalsContact O-CB 3.31Å; L510-C513 WeakPolarHBondContact O-CB 3.32Å; L510-C513 PolarHBondContact O-N 3.02Å; L510-L514 PolarHBondContact O-N 3.18Å; L510-L529 HydrophobicContact CB-CD1 4.17Å; L510-L532 HydrophobicContact CD1-CD1 3.83Å
511	K	92.8	Very high	90.8	Very high	116 Å²	116	62.9 Å²	62.9	50%	0.504	33%	0.333	S	S	.	.	H	α-helix	trans	-58.1	-33.6	173.7	-80.2	174.7	-177.1	178.9	0	112.9	Q507 L509 C513 L514 L529	Q507-K511 WeakPolarHBondContact O-CB 3.44Å; Q507-K511 VanDerWaalsContact O-CG 3.31Å; Q507-K511 WeakPolarHBondContact O-CG 3.31Å; Q507-K511 PolarHBondContact O-N 2.94Å; L509-K511 VanDerWaalsContact C-N 3.35Å; L509-K511 PolarHBondContact O-N 2.97Å; K511-C513 VanDerWaalsContact C-N 3.34Å; K511-L514 WeakPolarHBondContact O-CB 3.47Å; K511-L514 WeakPolarHBondContact O-CG 3.4Å; K511-L514 PolarHBondContact O-N 3.49Å; K511-L529 HydrophobicContact CG-CD1 4Å; K511-L529 HydrophobicContact CG-CD2 3.6Å; K511-L529 HydrophobicContact CG-CG 4.47Å
512	R	89.4	Confident	91.1	Very high	146 Å²	146	59.2 Å²	59.2	55%	0.551	31%	0.308	S	S	*	.	H	α-helix	trans	-70.4	-32.4	175.5	-66.1	178	177.1	-177.9	-2.4	112.2	Y474 V508 L509 L510 L514 L515	Y474-R512 WeakPolarHBondContact OH-CD 3.37Å; Y474-R512 PolarHBondContact OH-NH1 2.86Å; Y474-R512 VanDerWaalsContact OH-NH1 3.07Å; V508-R512 PolarHBondContact O-N 3.31Å; L509-R512 WeakPolarHBondContact O-CB 3.35Å; L509-R512 PolarHBondContact O-N 3.25Å; L509-R512 VanDerWaalsContact O-N 3.16Å; L510-R512 PolarHBondContact O-N 3.2Å; R512-L514 PolarHBondContact O-N 3.08Å; R512-L515 PolarHBondContact O-N 3.48Å; R512-L515 VanDerWaalsContact O-N 3.14Å
513	C	90.9	Very high	91.3	Very high	4 Å²	4	62.7 Å²	62.7	3%	0.027	33%	0.326	C	S	.	.	H	α-helix	trans	-68.2	-15.1	177.4	-53	0	0	0	0	112.7	V489 L509 L510 K511 L515 D516 A525	V489-C513 HydrophobicContact CG2-CB 4.16Å; L509-C513 PolarHBondContact O-N 3.28Å; L509-C513 PolarHBondContact O-SG 3.45Å; L510-C513 VanDerWaalsContact O-CB 3.31Å; L510-C513 WeakPolarHBondContact O-CB 3.32Å; L510-C513 PolarHBondContact O-N 3.02Å; K511-C513 VanDerWaalsContact C-N 3.34Å; C513-L515 PolarHBondContact O-N 2.93Å; C513-D516 VanDerWaalsContact O-CB 3.26Å; C513-D516 WeakPolarHBondContact O-CB 3.13Å; C513-D516 PolarHBondContact O-N 2.9Å; C513-A525 HydrophobicContact CB-CB 3.62Å
514	L	90.8	Very high	91.4	Very high	61 Å²	61	64.6 Å²	64.6	32%	0.319	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-19.5	172	-58.3	177.5	0	0	0	112.9	L510 K511 R512 R522 A525 T526 L529	L510-L514 PolarHBondContact O-N 3.18Å; K511-L514 WeakPolarHBondContact O-CB 3.47Å; K511-L514 WeakPolarHBondContact O-CG 3.4Å; K511-L514 PolarHBondContact O-N 3.49Å; R512-L514 PolarHBondContact O-N 3.08Å; L514-R522 WeakPolarHBondContact O-CD 3.49Å; L514-R522 WeakPolarHBondContact O-CG 3.38Å; L514-A525 HydrophobicContact CD2-CB 4.2Å; L514-T526 WeakPolarHBondContact CD2-OG1 3.44Å; L514-L529 HydrophobicContact CD1-CD2 3.98Å
515	L	89.7	Confident	91.5	Very high	156 Å²	156	60.8 Å²	60.8	82%	0.817	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	8.7	177.5	-57.3	177.3	0	0	0	112.5	R512 C513	R512-L515 PolarHBondContact O-N 3.48Å; R512-L515 VanDerWaalsContact O-N 3.14Å; C513-L515 PolarHBondContact O-N 2.93Å
516	D	91.9	Very high	91.6	Very high	19 Å²	19	60.9 Å²	60.9	10%	0.102	31%	0.306	C	S	.	.			trans	-61.4	150.6	177.6	-159.6	-69.8	0	0	0	110.8	R485 C513 D518 V521 R522	R485-D516 IonicContact CZ-OD1 2.74Å; R485-D516 VanDerWaalsContact CZ-OD1 3.23Å; R485-D516 IonicContact CZ-OD2 3.68Å; R485-D516 IonicContact NE-OD2 3.67Å; R485-D516 IonicContact NH1-OD1 3.93Å; R485-D516 PolarHBondContact NH1-OD1 3.44Å; R485-D516 IonicContact NH1-OD2 3.3Å; R485-D516 PolarHBondContact NH1-OD2 2.7Å; R485-D516 IonicContact NH2-OD1 2.62Å; R485-D516 PolarHBondContact NH2-OD1 3.3Å; C513-D516 VanDerWaalsContact O-CB 3.26Å; C513-D516 WeakPolarHBondContact O-CB 3.13Å; C513-D516 PolarHBondContact O-N 2.9Å; D516-D518 VanDerWaalsContact C-N 3.29Å; D516-D518 PolarHBondContact OD1-N 2.9Å; D516-V521 HydrophobicContact CB-CB 4.14Å; D516-V521 HydrophobicContact CB-CG1 3.96Å; D516-R522 HydrophobicContact CB-CG 4.08Å; D516-R522 VanDerWaalsContact O-CD 3.27Å; D516-R522 WeakPolarHBondContact O-CD 3.34Å; D516-R522 PolarHBondContact O-NH1 3.05Å
517	S	89.6	Confident	91.6	Very high	100 Å²	100	65 Å²	65	70%	0.699	33%	0.325	S	S	*	.	S	Bend	trans	-69.7	-27.2	177.5	53.5	0	0	0	0	112.8	R522	S517-R522 PolarHBondContact O-NH1 3.18Å
518	D	92.5	Very high	91.6	Very high	37 Å²	37	64.4 Å²	64.4	20%	0.198	32%	0.321	C	S	.	.	S	Bend	trans	-93.8	138.3	-175.2	-162.2	-82	0	0	0	112.2	T482 D516 E520 V521 R522	T482-D518 WeakPolarHBondContact CB-OD2 3.49Å; T482-D518 HydrophobicContact CG2-CB 4.04Å; T482-D518 WeakPolarHBondContact CG2-OD1 3.32Å; T482-D518 WeakPolarHBondContact CG2-OD2 3.32Å; T482-D518 PolarHBondContact OG1-OD2 3.07Å; D516-D518 VanDerWaalsContact C-N 3.29Å; D516-D518 PolarHBondContact OD1-N 2.9Å; D518-E520 VanDerWaalsContact OD1-CB 3.28Å; D518-E520 WeakPolarHBondContact OD1-CB 3.46Å; D518-E520 PolarHBondContact OD1-N 3.42Å; D518-V521 HydrophobicContact CB-CG2 4.13Å; D518-R522 WeakPolarHBondContact O-CG 3.32Å; D518-R522 PolarHBondContact O-N 2.91Å; D518-R522 PolarHBondContact O-NH1 3.12Å
519	D	91.8	Very high	91.6	Very high	98 Å²	98	61.7 Å²	61.7	52%	0.524	30%	0.304	S	S	.	.	H	α-helix	trans	-69	-38.7	-179.6	53.9	-17	0	0	0	112.9	V521 R522 D523	D519-V521 VanDerWaalsContact C-N 3.32Å; D519-V521 PolarHBondContact O-N 3.46Å; D519-R522 VanDerWaalsContact CA-NH2 3.25Å; D519-R522 PolarHBondContact O-N 3.22Å; D519-D523 WeakPolarHBondContact O-CB 3.46Å; D519-D523 VanDerWaalsContact O-CG 3.29Å; D519-D523 PolarHBondContact O-N 3.45Å
520	E	91.3	Very high	91.5	Very high	63 Å²	63	66 Å²	66	29%	0.294	32%	0.321	S	S	.	.	H	α-helix	trans	-59.8	-45	-179.7	-164.6	-90.9	-159.7	0	0	111.6	A486 D518 D523 R524	A486-E520 WeakPolarHBondContact CB-OE2 3.39Å; D518-E520 VanDerWaalsContact OD1-CB 3.28Å; D518-E520 WeakPolarHBondContact OD1-CB 3.46Å; D518-E520 PolarHBondContact OD1-N 3.42Å; E520-D523 PolarHBondContact O-N 3Å; E520-R524 VanDerWaalsContact O-CB 3.28Å; E520-R524 WeakPolarHBondContact O-CB 3.24Å; E520-R524 PolarHBondContact O-N 3.09Å; E520-R524 IonicContact OE1-CZ 2.81Å; E520-R524 IonicContact OE1-NH1 2.84Å; E520-R524 PolarHBondContact OE1-NH1 3.49Å; E520-R524 IonicContact OE1-NH2 2.62Å; E520-R524 PolarHBondContact OE1-NH2 2.88Å; E520-R524 IonicContact OE2-CZ 2.71Å; E520-R524 IonicContact OE2-NH1 4Å; E520-R524 PolarHBondContact OE2-NH1 3.18Å
521	V	91.4	Very high	91.3	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-67.3	-42.6	-179.1	-176.6	0	0	0	0	110.5	T482 R485 A486 V489 D516 D518 D519 A525	T482-V521 HydrophobicContact CG2-CG2 4.18Å; R485-V521 HydrophobicContact CB-CG2 4.04Å; A486-V521 HydrophobicContact CB-CG2 4.25Å; V489-V521 HydrophobicContact CG2-CG1 3.85Å; D516-V521 HydrophobicContact CB-CB 4.14Å; D516-V521 HydrophobicContact CB-CG1 3.96Å; D518-V521 HydrophobicContact CB-CG2 4.13Å; D519-V521 VanDerWaalsContact C-N 3.32Å; D519-V521 PolarHBondContact O-N 3.46Å; V521-A525 VanDerWaalsContact O-CB 3.23Å; V521-A525 WeakPolarHBondContact O-CB 3.49Å; V521-A525 PolarHBondContact O-N 3.4Å
522	R	93.2	Very high	91	Very high	77 Å²	77	62.6 Å²	62.6	29%	0.291	31%	0.307	S	S	.	.	H	α-helix	trans	-64.7	-45	177.6	-73.7	-168.7	-55.8	-91.8	-3.2	111.9	L514 D516 S517 D518 D519 A525 T526	L514-R522 WeakPolarHBondContact O-CD 3.49Å; L514-R522 WeakPolarHBondContact O-CG 3.38Å; D516-R522 HydrophobicContact CB-CG 4.08Å; D516-R522 VanDerWaalsContact O-CD 3.27Å; D516-R522 WeakPolarHBondContact O-CD 3.34Å; D516-R522 PolarHBondContact O-NH1 3.05Å; S517-R522 PolarHBondContact O-NH1 3.18Å; D518-R522 WeakPolarHBondContact O-CG 3.32Å; D518-R522 PolarHBondContact O-N 2.91Å; D518-R522 PolarHBondContact O-NH1 3.12Å; D519-R522 VanDerWaalsContact CA-NH2 3.25Å; D519-R522 PolarHBondContact O-N 3.22Å; R522-A525 PolarHBondContact O-N 3.14Å; R522-T526 WeakPolarHBondContact O-CB 3.39Å; R522-T526 PolarHBondContact O-N 3.46Å; R522-T526 PolarHBondContact O-OG1 3.48Å
523	D	92.8	Very high	90.8	Very high	107 Å²	107	59.6 Å²	59.6	57%	0.572	31%	0.305	S	S	*	.	H	α-helix	trans	-65.4	-44.4	-178.6	-74.7	-6.8	0	0	0	110.5	D519 E520 T526 F527	D519-D523 WeakPolarHBondContact O-CB 3.46Å; D519-D523 VanDerWaalsContact O-CG 3.29Å; D519-D523 PolarHBondContact O-N 3.45Å; E520-D523 PolarHBondContact O-N 3Å; D523-T526 PolarHBondContact O-N 3.48Å; D523-F527 WeakPolarHBondContact O-CB 3.4Å; D523-F527 PolarHBondContact O-N 3.3Å
524	R	92.3	Very high	90.4	Very high	78 Å²	78	66 Å²	66	29%	0.294	34%	0.335	S	S	.	.	H	α-helix	trans	-64.6	-41.7	176	-172.6	171.6	-77	144.1	12.1	112.3	A486 V489 T490 E520 F527 Y528	A486-R524 VanDerWaalsContact CB-NH1 3.33Å; A486-R524 WeakPolarHBondContact O-CD 3.26Å; A486-R524 PolarHBondContact O-NH1 3.22Å; V489-R524 HydrophobicContact CG1-CB 4.44Å; V489-R524 HydrophobicContact CG1-CG 4.05Å; T490-R524 VanDerWaalsContact OG1-CD 3.29Å; T490-R524 WeakPolarHBondContact OG1-CD 3.34Å; E520-R524 VanDerWaalsContact O-CB 3.28Å; E520-R524 WeakPolarHBondContact O-CB 3.24Å; E520-R524 PolarHBondContact O-N 3.09Å; E520-R524 IonicContact OE1-CZ 2.81Å; E520-R524 IonicContact OE1-NH1 2.84Å; E520-R524 PolarHBondContact OE1-NH1 3.49Å; E520-R524 IonicContact OE1-NH2 2.62Å; E520-R524 PolarHBondContact OE1-NH2 2.88Å; E520-R524 IonicContact OE2-CZ 2.71Å; E520-R524 IonicContact OE2-NH1 4Å; E520-R524 PolarHBondContact OE2-NH1 3.18Å; R524-F527 PolarHBondContact O-N 3.24Å; R524-Y528 HydrophobicContact CG-CD2 3.64Å; R524-Y528 HydrophobicContact CG-CE2 3.23Å; R524-Y528 WeakPolarHBondContact O-CD2 3.49Å; R524-Y528 PolarHBondContact O-N 3.35Å
525	A	93	Very high	89.6	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.7	-41.1	175	0	0	0	0	0	111.9	V489 C513 L514 V521 R522 L529	V489-A525 HydrophobicContact CG1-CB 4.1Å; C513-A525 HydrophobicContact CB-CB 3.62Å; L514-A525 HydrophobicContact CD2-CB 4.2Å; V521-A525 VanDerWaalsContact O-CB 3.23Å; V521-A525 WeakPolarHBondContact O-CB 3.49Å; V521-A525 PolarHBondContact O-N 3.4Å; R522-A525 PolarHBondContact O-N 3.14Å; A525-L529 WeakPolarHBondContact O-CB 3.38Å; A525-L529 PolarHBondContact O-N 3.38Å
526	T	92.8	Very high	88.9	Confident	73 Å²	73	59.9 Å²	59.9	45%	0.448	32%	0.316	S	S	.	.	H	α-helix	trans	-62.7	-47.9	177	-57.4	0	0	0	0	111	L514 R522 D523 L529 K530	L514-T526 WeakPolarHBondContact CD2-OG1 3.44Å; R522-T526 WeakPolarHBondContact O-CB 3.39Å; R522-T526 PolarHBondContact O-N 3.46Å; R522-T526 PolarHBondContact O-OG1 3.48Å; D523-T526 PolarHBondContact O-N 3.48Å; T526-L529 PolarHBondContact O-N 3.34Å; T526-K530 WeakPolarHBondContact O-CB 3.46Å; T526-K530 PolarHBondContact O-N 3.4Å
527	F	91.3	Very high	88	Confident	88 Å²	88	65.5 Å²	65.5	39%	0.386	34%	0.342	S	S	.	.	H	α-helix	trans	-57.6	-53.5	177.7	175.9	-103.1	0	0	0	111.5	D523 R524 L529 K530 M531 F543	D523-F527 WeakPolarHBondContact O-CB 3.4Å; D523-F527 PolarHBondContact O-N 3.3Å; R524-F527 PolarHBondContact O-N 3.24Å; F527-L529 PolarHBondContact O-N 3.47Å; F527-K530 PolarHBondContact O-N 3.05Å; F527-M531 HydrophobicContact CE1-CG 4.21Å; F527-M531 HydrophobicContact CE2-CG 4.14Å; F527-M531 HydrophobicContact CZ-CG 3.98Å; F527-M531 WeakPolarHBondContact O-CG 3.26Å; F527-M531 PolarHBondContact O-N 3.08Å; F527-F543 HydrophobicContact CZ-CB 4.15Å; F527-F543 HydrophobicContact CZ-CD1 4.41Å; F527-F543 HydrophobicContact CZ-CG 4.45Å
528	Y	91.4	Very high	87	Confident	26 Å²	26	62.3 Å²	62.3	10%	0.102	32%	0.324	C	S	.	.	H	α-helix	trans	-67.9	-36.2	-178.9	-68	-44	0	0	0	113.3	V489 T490 A493 R524 K530 M531 L532 I544	V489-Y528 HydrophobicContact CG1-CD2 4.08Å; T490-Y528 HydrophobicContact CG2-CE2 4.35Å; A493-Y528 HydrophobicContact CB-CD1 3.76Å; A493-Y528 HydrophobicContact CB-CD2 3.4Å; A493-Y528 VanDerWaalsContact CB-CD2 3.4Å; A493-Y528 HydrophobicContact CB-CE1 4.26Å; A493-Y528 HydrophobicContact CB-CE2 3.92Å; A493-Y528 HydrophobicContact CB-CG 3.32Å; R524-Y528 HydrophobicContact CG-CD2 3.64Å; R524-Y528 HydrophobicContact CG-CE2 3.23Å; R524-Y528 WeakPolarHBondContact O-CD2 3.49Å; R524-Y528 PolarHBondContact O-N 3.35Å; Y528-K530 VanDerWaalsContact C-N 3.33Å; Y528-K530 PolarHBondContact O-N 2.62Å; Y528-M531 PolarHBondContact O-N 2.83Å; Y528-L532 WeakPolarHBondContact O-CB 3.34Å; Y528-L532 VanDerWaalsContact O-CG 3.27Å; Y528-L532 WeakPolarHBondContact O-CG 3.35Å; Y528-L532 PolarHBondContact O-N 2.83Å; Y528-I544 HydrophobicContact CD1-CD1 3.92Å; Y528-I544 HydrophobicContact CD1-CG1 3.83Å; Y528-I544 HydrophobicContact CE1-CG1 3.97Å; Y528-I544 HydrophobicContact CE1-CG2 4.45Å
529	L	91.5	Very high	86.2	Confident	21 Å²	21	64.4 Å²	64.4	11%	0.11	34%	0.335	C	S	.	.	H	α-helix	trans	-63.4	-42.4	176.5	-175.4	70.2	0	0	0	111	Q507 L510 K511 L514 A525 T526 F527 T533	Q507-L529 HydrophobicContact CB-CD1 3.94Å; Q507-L529 HydrophobicContact CG-CD1 4.09Å; L510-L529 HydrophobicContact CB-CD1 4.17Å; K511-L529 HydrophobicContact CG-CD1 4Å; K511-L529 HydrophobicContact CG-CD2 3.6Å; K511-L529 HydrophobicContact CG-CG 4.47Å; L514-L529 HydrophobicContact CD1-CD2 3.98Å; A525-L529 WeakPolarHBondContact O-CB 3.38Å; A525-L529 PolarHBondContact O-N 3.38Å; T526-L529 PolarHBondContact O-N 3.34Å; F527-L529 PolarHBondContact O-N 3.47Å; L529-T533 WeakPolarHBondContact O-CB 3.31Å; L529-T533 PolarHBondContact O-N 3.36Å; L529-T533 PolarHBondContact O-OG1 3.3Å
530	K	90.1	Very high	85.6	Confident	116 Å²	116	60 Å²	60	50%	0.504	31%	0.311	S	S	.	.	H	α-helix	trans	-64.1	-47.4	176.7	-167.9	174.8	-175.6	179.4	0	111.3	T526 F527 Y528 L532 T533 E534	T526-K530 WeakPolarHBondContact O-CB 3.46Å; T526-K530 PolarHBondContact O-N 3.4Å; F527-K530 PolarHBondContact O-N 3.05Å; Y528-K530 VanDerWaalsContact C-N 3.33Å; Y528-K530 PolarHBondContact O-N 2.62Å; K530-L532 PolarHBondContact O-N 2.71Å; K530-T533 PolarHBondContact O-N 2.92Å; K530-E534 WeakPolarHBondContact CE-OE2 3.14Å; K530-E534 WeakPolarHBondContact CG-OE2 3.49Å; K530-E534 PolarHBondContact O-N 3.48Å
531	M	87.4	Confident	84.8	Confident	38 Å²	38	57.7 Å²	57.7	19%	0.187	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-45.9	177.2	-70.5	-63.9	97.5	0	0	112.5	F527 Y528 T533 A535 I544	F527-M531 HydrophobicContact CE1-CG 4.21Å; F527-M531 HydrophobicContact CE2-CG 4.14Å; F527-M531 HydrophobicContact CZ-CG 3.98Å; F527-M531 WeakPolarHBondContact O-CG 3.26Å; F527-M531 PolarHBondContact O-N 3.08Å; Y528-M531 PolarHBondContact O-N 2.83Å; M531-T533 PolarHBondContact O-N 3.39Å; M531-A535 HydrophobicContact CE-CB 4.26Å; M531-A535 WeakPolarHBondContact O-CB 3.22Å; M531-A535 PolarHBondContact O-N 3.36Å; M531-A535 VanDerWaalsContact O-N 3.14Å; M531-A535 HydrophobicContact SD-CB 3.98Å; M531-I544 HydrophobicContact CB-CD1 4Å
532	L	86.8	Confident	83.9	Confident	6 Å²	6	62 Å²	62	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-72.5	-12.5	-179.6	-68.6	173.5	0	0	0	114.2	A497 I506 Q507 L510 Y528 K530 I540 I544	A497-L532 HydrophobicContact CB-CD2 4.27Å; I506-L532 HydrophobicContact CG2-CD1 4.4Å; Q507-L532 PolarHBondContact NE2-O 3.35Å; L510-L532 HydrophobicContact CD1-CD1 3.83Å; Y528-L532 WeakPolarHBondContact O-CB 3.34Å; Y528-L532 VanDerWaalsContact O-CG 3.27Å; Y528-L532 WeakPolarHBondContact O-CG 3.35Å; Y528-L532 PolarHBondContact O-N 2.83Å; K530-L532 PolarHBondContact O-N 2.71Å; L532-I540 HydrophobicContact CD2-CG2 4.33Å; L532-I544 HydrophobicContact CD2-CD1 3.98Å; L532-I544 HydrophobicContact CG-CD1 4.11Å
533	T	85.3	Confident	83.1	Confident	83 Å²	83	64 Å²	64	51%	0.509	34%	0.335	S	S	.	.	H	α-helix	trans	-102.6	-40.7	-178.6	-51.9	0	0	0	0	112.1	L529 K530 M531	L529-T533 WeakPolarHBondContact O-CB 3.31Å; L529-T533 PolarHBondContact O-N 3.36Å; L529-T533 PolarHBondContact O-OG1 3.3Å; K530-T533 PolarHBondContact O-N 2.92Å; M531-T533 PolarHBondContact O-N 3.39Å
534	E	81.7	Confident	82.5	Confident	140 Å²	140	59.2 Å²	59.2	65%	0.654	31%	0.309	S	S	*	.	H	α-helix	trans	-114.3	-19	-167.4	-63.6	174	-171.7	0	0	113.8	K530	K530-E534 WeakPolarHBondContact CE-OE2 3.14Å; K530-E534 WeakPolarHBondContact CG-OE2 3.49Å; K530-E534 PolarHBondContact O-N 3.48Å
535	A	74.8	Confident	81.8	Confident	22 Å²	22	57.2 Å²	57.2	18%	0.182	30%	0.304	C	S	.	.	S	Bend	trans	-89	146.5	-171.1	0	0	0	0	0	113.2	M531 L539 I540	M531-A535 HydrophobicContact CE-CB 4.26Å; M531-A535 WeakPolarHBondContact O-CB 3.22Å; M531-A535 PolarHBondContact O-N 3.36Å; M531-A535 VanDerWaalsContact O-N 3.14Å; M531-A535 HydrophobicContact SD-CB 3.98Å; A535-L539 HydrophobicContact CB-CB 4Å; A535-L539 HydrophobicContact CB-CD1 4.39Å; A535-I540 HydrophobicContact CB-CG1 4.18Å
536	A	73.9	Confident	80.6	Confident	66 Å²	66	58.2 Å²	58.2	55%	0.545	31%	0.309	S	S	.	.			trans	-64.3	155.2	169.9	0	0	0	0	0	111.3	G538 L539 I540	A536-G538 VanDerWaalsContact C-N 3.26Å; A536-G538 PolarHBondContact O-N 3.04Å; A536-L539 WeakPolarHBondContact O-CB 3.45Å; A536-L539 PolarHBondContact O-N 3.49Å; A536-I540 PolarHBondContact O-N 3.44Å; A536-I540 VanDerWaalsContact O-N 3.14Å
537	E	72.7	Confident	79.2	Confident	137 Å²	137	57.1 Å²	57.1	64%	0.64	31%	0.312	S	S	*	.	H	α-helix	trans	-57.6	-36.2	-174.9	-67.2	-168.2	155.8	0	0	113.5	L539 I540 H541	E537-L539 VanDerWaalsContact C-N 3.34Å; E537-L539 PolarHBondContact O-N 3.47Å; E537-I540 WeakPolarHBondContact O-CB 3.49Å; E537-I540 PolarHBondContact O-N 3.16Å; E537-H541 PolarHBondContact O-N 3.47Å
538	G	69.3	Low	78	Confident	33 Å²	33	57.9 Å²	57.9	34%	0.34	32%	0.32	S	S	.	.	H	α-helix	trans	-62.4	-36.2	175.1	0	0	0	0	0	113.9	A536 H541 N542	A536-G538 VanDerWaalsContact C-N 3.26Å; A536-G538 PolarHBondContact O-N 3.04Å; G538-H541 PolarHBondContact O-N 3.06Å; G538-N542 WeakPolarHBondContact O-CB 3.46Å; G538-N542 PolarHBondContact O-N 3.35Å; G538-N542 PolarHBondContact O-ND2 3.19Å; G538-N542 PolarHBondContact O-OD1 2.91Å
539	L	76.4	Confident	76.5	Confident	80 Å²	80	58.7 Å²	58.7	42%	0.419	33%	0.325	S	S	.	.	H	α-helix	trans	-73.5	-37.7	176.3	-74.2	164.2	0	0	0	111.7	A535 A536 E537 H541 N542 F543	A535-L539 HydrophobicContact CB-CB 4Å; A535-L539 HydrophobicContact CB-CD1 4.39Å; A536-L539 WeakPolarHBondContact O-CB 3.45Å; A536-L539 PolarHBondContact O-N 3.49Å; E537-L539 VanDerWaalsContact C-N 3.34Å; E537-L539 PolarHBondContact O-N 3.47Å; L539-H541 VanDerWaalsContact C-N 3.28Å; L539-H541 PolarHBondContact O-N 3.36Å; L539-N542 PolarHBondContact O-N 2.97Å; L539-F543 HydrophobicContact CD2-CD2 4.08Å; L539-F543 HydrophobicContact CD2-CE2 3.67Å; L539-F543 WeakPolarHBondContact O-CD2 3.18Å; L539-F543 PolarHBondContact O-N 2.92Å
540	I	79.4	Confident	75.2	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.026	32%	0.324	C	S	.	.	H	α-helix	trans	-59.1	-44.8	173.1	-67.9	175.2	0	0	0	109.5	A497 L532 A535 A536 E537 I544	A497-I540 HydrophobicContact CB-CG2 3.49Å; A497-I540 VanDerWaalsContact CB-CG2 3.49Å; L532-I540 HydrophobicContact CD2-CG2 4.33Å; A535-I540 HydrophobicContact CB-CG1 4.18Å; A536-I540 PolarHBondContact O-N 3.44Å; A536-I540 VanDerWaalsContact O-N 3.14Å; E537-I540 WeakPolarHBondContact O-CB 3.49Å; E537-I540 PolarHBondContact O-N 3.16Å; I540-I544 HydrophobicContact CG2-CD1 4.27Å; I540-I544 VanDerWaalsContact O-CB 3.24Å; I540-I544 WeakPolarHBondContact O-CB 3.49Å; I540-I544 PolarHBondContact O-N 2.73Å
541	H	73.8	Confident	73.9	Confident	15 Å²	15	53.9 Å²	53.9	7%	0.069	31%	0.307	C	S	.	.	I	π-helix	trans	-61.9	-51.9	177.7	-162.3	-81	0	0	0	111.5	E537 G538 L539 F543 L545 D546 S766	E537-H541 PolarHBondContact O-N 3.47Å; G538-H541 PolarHBondContact O-N 3.06Å; L539-H541 VanDerWaalsContact C-N 3.28Å; L539-H541 PolarHBondContact O-N 3.36Å; H541-F543 PolarHBondContact O-N 3.09Å; H541-L545 VanDerWaalsContact CD2-CD1 3.47Å; H541-L545 WeakPolarHBondContact CD2-CD1 3.43Å; H541-L545 WeakPolarHBondContact O-CA 3.34Å; H541-L545 WeakPolarHBondContact O-CB 3.1Å; H541-L545 PolarHBondContact O-N 2.75Å; H541-D546 IonicContact CE1-OD1 2.74Å; H541-D546 PolarHBondContact CE1-OD1 3.25Å; H541-D546 VanDerWaalsContact CE1-OD1 3.25Å; H541-D546 IonicContact CE1-OD2 2.69Å; H541-D546 PolarHBondContact CE1-OD2 2.99Å; H541-D546 IonicContact ND1-OD1 2.76Å; H541-D546 IonicContact ND1-OD2 3.1Å; H541-D546 PolarHBondContact ND1-OD2 2.94Å; H541-D546 PolarHBondContact O-N 3.07Å; H541-S766 VanDerWaalsContact CE1-CB 3.48Å; H541-S766 WeakPolarHBondContact CE1-CB 3.43Å; H541-S766 WeakPolarHBondContact NE2-CB 3.33Å
542	N	72.8	Confident	72.9	Confident	91 Å²	91	56.2 Å²	56.2	49%	0.487	33%	0.325	S	S	.	.	I	π-helix	trans	-66	-31.8	-174.7	-70.4	-9.4	0	0	0	114.9	G538 L539	G538-N542 WeakPolarHBondContact O-CB 3.46Å; G538-N542 PolarHBondContact O-N 3.35Å; G538-N542 PolarHBondContact O-ND2 3.19Å; G538-N542 PolarHBondContact O-OD1 2.91Å; L539-N542 PolarHBondContact O-N 2.97Å
543	F	75.9	Confident	71.9	Confident	119 Å²	119	58.7 Å²	58.7	52%	0.522	34%	0.342	S	S	.	.	I	π-helix	trans	-104.8	-19.6	-174.5	-74.2	-73.3	0	0	0	114.5	F527 L539 H541	F527-F543 HydrophobicContact CZ-CB 4.15Å; F527-F543 HydrophobicContact CZ-CD1 4.41Å; F527-F543 HydrophobicContact CZ-CG 4.45Å; L539-F543 HydrophobicContact CD2-CD2 4.08Å; L539-F543 HydrophobicContact CD2-CE2 3.67Å; L539-F543 WeakPolarHBondContact O-CD2 3.18Å; L539-F543 PolarHBondContact O-N 2.92Å; H541-F543 PolarHBondContact O-N 3.09Å
544	I	80.9	Confident	71	Confident	6 Å²	6	55.3 Å²	55.3	3%	0.031	32%	0.324	C	S	.	.	I	π-helix	trans	-109.8	-39.3	-178.4	-55	-177.1	0	0	0	111.5	A493 K494 A497 Y528 M531 L532 I540	A493-I544 HydrophobicContact CB-CG2 4.23Å; K494-I544 WeakPolarHBondContact CE-O 3.5Å; K494-I544 HydrophobicContact CG-CG2 3.98Å; A497-I544 HydrophobicContact CB-CB 4.27Å; A497-I544 HydrophobicContact CB-CG2 3.87Å; Y528-I544 HydrophobicContact CD1-CD1 3.92Å; Y528-I544 HydrophobicContact CD1-CG1 3.83Å; Y528-I544 HydrophobicContact CE1-CG1 3.97Å; Y528-I544 HydrophobicContact CE1-CG2 4.45Å; M531-I544 HydrophobicContact CB-CD1 4Å; L532-I544 HydrophobicContact CD2-CD1 3.98Å; L532-I544 HydrophobicContact CG-CD1 4.11Å; I540-I544 HydrophobicContact CG2-CD1 4.27Å; I540-I544 VanDerWaalsContact O-CB 3.24Å; I540-I544 WeakPolarHBondContact O-CB 3.49Å; I540-I544 PolarHBondContact O-N 2.73Å
545	L	77.2	Confident	70.8	Confident	36 Å²	36	50.5 Å²	50.5	19%	0.188	30%	0.303	C	S	.	.	I	π-helix	trans	-96.8	-49.2	-173.6	-58.3	179.5	0	0	0	111.8	K494 A497 Q498 H541	K494-L545 HydrophobicContact CB-CD2 4.44Å; K494-L545 HydrophobicContact CG-CD2 4.39Å; A497-L545 HydrophobicContact CB-CD1 4.26Å; A497-L545 HydrophobicContact CB-CD2 3.9Å; A497-L545 HydrophobicContact CB-CG 4.08Å; Q498-L545 HydrophobicContact CG-CD1 4.02Å; Q498-L545 HydrophobicContact CG-CD2 3.63Å; H541-L545 VanDerWaalsContact CD2-CD1 3.47Å; H541-L545 WeakPolarHBondContact CD2-CD1 3.43Å; H541-L545 WeakPolarHBondContact O-CA 3.34Å; H541-L545 WeakPolarHBondContact O-CB 3.1Å; H541-L545 PolarHBondContact O-N 2.75Å
546	D	68	Low	70.9	Confident	21 Å²	21	55.4 Å²	55.4	11%	0.112	32%	0.322	C	S	.	.	S	Bend	trans	-82.8	119.6	172.3	-62.9	-32.5	0	0	0	109.2	H541 S765	H541-D546 IonicContact CE1-OD1 2.74Å; H541-D546 PolarHBondContact CE1-OD1 3.25Å; H541-D546 VanDerWaalsContact CE1-OD1 3.25Å; H541-D546 IonicContact CE1-OD2 2.69Å; H541-D546 PolarHBondContact CE1-OD2 2.99Å; H541-D546 IonicContact ND1-OD1 2.76Å; H541-D546 IonicContact ND1-OD2 3.1Å; H541-D546 PolarHBondContact ND1-OD2 2.94Å; H541-D546 PolarHBondContact O-N 3.07Å; D546-S765 WeakPolarHBondContact OD1-CB 3.42Å; D546-S765 PolarHBondContact OD1-OG 3.25Å
547	G	63.4	Low	70.6	Confident	50 Å²	50	57.6 Å²	57.6	52%	0.515	32%	0.316	S	S	.	.			trans	-76.5	166.2	168.9	0	0	0	0	0	110.9	Q549	G547-Q549 WeakPolarHBondContact O-CG 3.26Å; G547-Q549 PolarHBondContact O-N 3.23Å; G547-Q549 VanDerWaalsContact O-N 3.1Å
548	L	64.4	Low	70.7	Confident	104 Å²	104	51.8 Å²	51.8	55%	0.545	29%	0.291	S	S	.	.			trans	-59.9	113.3	170.7	-158.6	75.4	0	0	0	109.4	V550 L555 L574 L584	L548-V550 HydrophobicContact CD2-CG2 3.4Å; L548-V550 VanDerWaalsContact CD2-CG2 3.4Å; L548-V550 HydrophobicContact CG-CG1 4.31Å; L548-V550 HydrophobicContact CG-CG2 3.67Å; L548-V550 PolarHBondContact O-N 3.29Å; L548-L555 HydrophobicContact CD2-CD2 4.42Å; L548-L574 HydrophobicContact CD1-CD2 4.15Å; L548-L574 HydrophobicContact CD2-CD2 4.13Å; L548-L584 WeakPolarHBondContact O-CD1 3.39Å
549	Q	60.6	Low	71.1	Confident	44 Å²	44	53.3 Å²	53.3	21%	0.206	29%	0.29	C	S	.	.			trans	-85.2	26.7	-174.5	-61.1	-65.2	-17.8	0	0	113.4	G547 V579 T580	G547-Q549 WeakPolarHBondContact O-CG 3.26Å; G547-Q549 PolarHBondContact O-N 3.23Å; G547-Q549 VanDerWaalsContact O-N 3.1Å; Q549-V579 HydrophobicContact CB-CG1 4.05Å; Q549-V579 WeakPolarHBondContact O-CG1 3.29Å; Q549-T580 PolarHBondContact O-N 3.14Å
550	V	64.4	Low	71.2	Confident	15 Å²	15	53 Å²	53	9%	0.091	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-94.6	146.5	-178.1	-60.9	0	0	0	0	111.1	L548 L555 L574 V577	L548-V550 HydrophobicContact CD2-CG2 3.4Å; L548-V550 VanDerWaalsContact CD2-CG2 3.4Å; L548-V550 HydrophobicContact CG-CG1 4.31Å; L548-V550 HydrophobicContact CG-CG2 3.67Å; L548-V550 PolarHBondContact O-N 3.29Å; V550-L555 HydrophobicContact CG2-CB 4.14Å; V550-L555 HydrophobicContact CG2-CD2 4.01Å; V550-L555 HydrophobicContact CG2-CG 4.45Å; V550-L574 HydrophobicContact CG1-CD2 4.22Å; V550-V577 HydrophobicContact CB-CB 4.35Å; V550-V577 HydrophobicContact CB-CG1 3.75Å; V550-V577 HydrophobicContact CG1-CB 4.03Å; V550-V577 HydrophobicContact CG1-CG1 4Å
551	S	62.9	Low	71	Confident	21 Å²	21	56.2 Å²	56.2	15%	0.147	31%	0.306	C	S	.	.			trans	-67.2	130.8	170.9	66.2	0	0	0	0	109.4	S553 G554 L555 P578 T580	S551-S553 PolarHBondContact O-N 3.24Å; S551-G554 PolarHBondContact O-N 2.99Å; S551-G554 WeakPolarHBondContact OG-CA 3.43Å; S551-G554 PolarHBondContact OG-N 3.19Å; S551-L555 WeakPolarHBondContact O-CB 3.5Å; S551-L555 PolarHBondContact O-N 3.03Å; S551-P578 PolarHBondContact N-O 2.76Å; S551-T580 WeakPolarHBondContact CA-OG1 3.35Å; S551-T580 WeakPolarHBondContact CB-OG1 3.25Å; S551-T580 PolarHBondContact N-OG1 3.46Å; S551-T580 VanDerWaalsContact N-OG1 3.09Å
552	P	65.6	Low	71.2	Confident	87 Å²	87	58 Å²	58	57%	0.565	31%	0.313	S	S	*	.	H	α-helix	trans	-58.2	-38.2	178.4	-27.2	35	0	0	0	112.8	E556 L584	P552-E556 WeakPolarHBondContact O-CB 3.29Å; P552-E556 PolarHBondContact O-N 3.24Å; P552-L584 HydrophobicContact CG-CD2 4.31Å
553	S	66.4	Low	71.6	Confident	57 Å²	57	58.1 Å²	58.1	40%	0.399	31%	0.313	S	S	.	.	H	α-helix	trans	-71.1	-38.7	176.5	46.5	0	0	0	0	113.1	S551 R557	S551-S553 PolarHBondContact O-N 3.24Å; S553-R557 PolarHBondContact O-N 3.43Å; S553-R557 VanDerWaalsContact O-N 3.11Å
554	G	67.4	Low	71.7	Confident	12 Å²	12	61.6 Å²	61.6	12%	0.124	32%	0.322	C	S	.	.	H	α-helix	trans	-67.4	-40.4	173.9	0	0	0	0	0	111.6	S551 R557 S558	S551-G554 PolarHBondContact O-N 2.99Å; S551-G554 WeakPolarHBondContact OG-CA 3.43Å; S551-G554 PolarHBondContact OG-N 3.19Å; G554-R557 PolarHBondContact O-N 3.39Å; G554-S558 WeakPolarHBondContact O-CB 3.47Å; G554-S558 PolarHBondContact O-N 3.23Å; G554-S558 PolarHBondContact O-OG 3.46Å; G554-S558 VanDerWaalsContact O-OG 3.1Å
555	L	75.8	Confident	71.3	Confident	39 Å²	39	64.9 Å²	64.9	20%	0.204	35%	0.346	C	S	.	.	H	α-helix	trans	-61	-46.9	175	-179.3	64.2	0	0	0	111	L548 V550 S551 R557 S558 I559 F572 L574 V577	L548-L555 HydrophobicContact CD2-CD2 4.42Å; V550-L555 HydrophobicContact CG2-CB 4.14Å; V550-L555 HydrophobicContact CG2-CD2 4.01Å; V550-L555 HydrophobicContact CG2-CG 4.45Å; S551-L555 WeakPolarHBondContact O-CB 3.5Å; S551-L555 PolarHBondContact O-N 3.03Å; L555-R557 VanDerWaalsContact C-N 3.32Å; L555-R557 PolarHBondContact O-N 3.23Å; L555-S558 PolarHBondContact O-N 3.1Å; L555-I559 HydrophobicContact CD1-CD1 3.83Å; L555-I559 HydrophobicContact CD1-CG1 4.22Å; L555-I559 HydrophobicContact CG-CD1 3.76Å; L555-I559 HydrophobicContact CG-CG1 4.5Å; L555-I559 WeakPolarHBondContact O-CB 3.31Å; L555-I559 WeakPolarHBondContact O-CD1 3.44Å; L555-I559 WeakPolarHBondContact O-CG1 3.34Å; L555-I559 PolarHBondContact O-N 3.01Å; L555-F572 HydrophobicContact CD1-CE1 3.93Å; L555-F572 HydrophobicContact CD1-CZ 4.29Å; L555-L574 HydrophobicContact CD1-CD2 3.98Å; L555-V577 HydrophobicContact CB-CG1 4.07Å; L555-V577 HydrophobicContact CD1-CG2 3.84Å
556	E	77	Confident	70.5	Confident	126 Å²	126	65.4 Å²	65.4	59%	0.589	36%	0.36	S	S	*	.	H	α-helix	trans	-56.4	-46.1	176	-176.8	178.2	-171.4	0	0	111.5	P552 I559 L560	P552-E556 WeakPolarHBondContact O-CB 3.29Å; P552-E556 PolarHBondContact O-N 3.24Å; E556-I559 PolarHBondContact O-N 3.39Å; E556-L560 HydrophobicContact CG-CD1 4.18Å; E556-L560 VanDerWaalsContact O-CG 3.28Å; E556-L560 WeakPolarHBondContact O-CG 3.45Å; E556-L560 PolarHBondContact O-N 3.41Å
557	R	69.1	Low	70.3	Confident	111 Å²	111	67.1 Å²	67.1	42%	0.419	37%	0.373	S	S	.	.	H	α-helix	trans	-66.8	-48.6	179.8	-173	173.3	179.2	168.7	-2.7	112.7	S553 G554 L555 I559 L560 D561	S553-R557 PolarHBondContact O-N 3.43Å; S553-R557 VanDerWaalsContact O-N 3.11Å; G554-R557 PolarHBondContact O-N 3.39Å; L555-R557 VanDerWaalsContact C-N 3.32Å; L555-R557 PolarHBondContact O-N 3.23Å; R557-I559 PolarHBondContact O-N 3.18Å; R557-L560 WeakPolarHBondContact O-CB 3.36Å; R557-L560 PolarHBondContact O-N 3.42Å; R557-D561 PolarHBondContact O-N 3.36Å
558	S	73.1	Confident	71	Confident	15 Å²	15	71.6 Å²	71.6	11%	0.105	38%	0.376	C	S	.	.	H	α-helix	trans	-60.1	-36.5	177.8	-61.7	0	0	0	0	111.6	G554 L555 D561 Y562 F572	G554-S558 WeakPolarHBondContact O-CB 3.47Å; G554-S558 PolarHBondContact O-N 3.23Å; G554-S558 PolarHBondContact O-OG 3.46Å; G554-S558 VanDerWaalsContact O-OG 3.1Å; L555-S558 PolarHBondContact O-N 3.1Å; S558-D561 PolarHBondContact O-N 3.38Å; S558-Y562 WeakPolarHBondContact O-CB 3.25Å; S558-Y562 PolarHBondContact O-N 2.8Å; S558-F572 WeakPolarHBondContact O-CE2 3.47Å
559	I	78.5	Confident	71.3	Confident	65 Å²	65	72 Å²	72	33%	0.333	39%	0.388	S	S	.	.	H	α-helix	trans	-66.4	-44.4	173.3	-69.4	169.2	0	0	0	110.7	L555 E556 R557 D561 Y562 L563 F572	L555-I559 HydrophobicContact CD1-CD1 3.83Å; L555-I559 HydrophobicContact CD1-CG1 4.22Å; L555-I559 HydrophobicContact CG-CD1 3.76Å; L555-I559 HydrophobicContact CG-CG1 4.5Å; L555-I559 WeakPolarHBondContact O-CB 3.31Å; L555-I559 WeakPolarHBondContact O-CD1 3.44Å; L555-I559 WeakPolarHBondContact O-CG1 3.34Å; L555-I559 PolarHBondContact O-N 3.01Å; E556-I559 PolarHBondContact O-N 3.39Å; R557-I559 PolarHBondContact O-N 3.18Å; I559-D561 VanDerWaalsContact C-N 3.32Å; I559-D561 PolarHBondContact O-N 3.35Å; I559-Y562 PolarHBondContact O-N 3.39Å; I559-L563 HydrophobicContact CG2-CD1 4.01Å; I559-L563 HydrophobicContact CG2-CG 4.39Å; I559-L563 WeakPolarHBondContact O-CB 3.46Å; I559-L563 VanDerWaalsContact O-CG 3.26Å; I559-L563 WeakPolarHBondContact O-CG 3.12Å; I559-L563 PolarHBondContact O-N 3.02Å; I559-F572 HydrophobicContact CG1-CD1 4.42Å; I559-F572 HydrophobicContact CG1-CE1 3.94Å; I559-F572 HydrophobicContact CG1-CE2 4.21Å; I559-F572 HydrophobicContact CG1-CZ 3.81Å
560	L	79.6	Confident	71.8	Confident	74 Å²	74	73 Å²	73	39%	0.387	40%	0.4	S	S	.	.	H	α-helix	trans	-61.6	-39.9	176.5	-74.3	169.3	0	0	0	112.2	E556 R557 L563 R564	E556-L560 HydrophobicContact CG-CD1 4.18Å; E556-L560 VanDerWaalsContact O-CG 3.28Å; E556-L560 WeakPolarHBondContact O-CG 3.45Å; E556-L560 PolarHBondContact O-N 3.41Å; R557-L560 WeakPolarHBondContact O-CB 3.36Å; R557-L560 PolarHBondContact O-N 3.42Å; L560-L563 PolarHBondContact O-N 3.21Å; L560-R564 WeakPolarHBondContact O-CB 3.39Å; L560-R564 WeakPolarHBondContact O-CG 3.47Å; L560-R564 PolarHBondContact O-N 3.35Å
561	D	73.6	Confident	72.5	Confident	72 Å²	72	77.8 Å²	77.8	39%	0.385	43%	0.43	S	S	.	.	H	α-helix	trans	-69.9	-40.2	178	-68.6	-22.5	0	0	0	111.2	R557 S558 I559 L563 R564 S565	R557-D561 PolarHBondContact O-N 3.36Å; S558-D561 PolarHBondContact O-N 3.38Å; I559-D561 VanDerWaalsContact C-N 3.32Å; I559-D561 PolarHBondContact O-N 3.35Å; D561-L563 VanDerWaalsContact C-N 3.35Å; D561-L563 PolarHBondContact O-N 3.41Å; D561-R564 PolarHBondContact O-N 3.4Å; D561-R564 IonicContact OD1-NH1 2.68Å; D561-S565 WeakPolarHBondContact O-CB 3.31Å; D561-S565 PolarHBondContact O-N 3.39Å
562	Y	78.2	Confident	73.1	Confident	54 Å²	54	79.5 Å²	79.5	21%	0.212	44%	0.436	C	S	.	.	H	α-helix	trans	-59.1	-45.3	170.4	176.6	-102.8	0	0	0	111.7	S558 I559 R564 S565 Y568 S570 F572	S558-Y562 WeakPolarHBondContact O-CB 3.25Å; S558-Y562 PolarHBondContact O-N 2.8Å; I559-Y562 PolarHBondContact O-N 3.39Å; Y562-R564 VanDerWaalsContact C-N 3.3Å; Y562-R564 PolarHBondContact O-N 2.64Å; Y562-S565 PolarHBondContact O-N 2.98Å; Y562-S565 PolarHBondContact O-OG 3.42Å; Y562-Y568 HydrophobicContact CE1-CD1 4.14Å; Y562-S570 WeakPolarHBondContact CE2-O 3.39Å; Y562-S570 PolarHBondContact OH-O 3.13Å; Y562-F572 HydrophobicContact CD1-CB 4.14Å; Y562-F572 HydrophobicContact CD1-CD2 4.21Å; Y562-F572 HydrophobicContact CD2-CB 4.41Å; Y562-F572 HydrophobicContact CD2-CD2 4.13Å; Y562-F572 HydrophobicContact CE1-CB 4.15Å; Y562-F572 HydrophobicContact CE2-CB 4.41Å; Y562-F572 HydrophobicContact CG-CB 4.27Å; Y562-F572 AromaticContact CG-CD2 3.73Å; Y562-F572 HydrophobicContact CG-CD2 3.73Å; Y562-F572 HydrophobicContact CG-CG 4.46Å
563	L	81.5	Confident	73.4	Confident	93 Å²	93	78 Å²	78	49%	0.487	42%	0.423	S	S	.	.	H	α-helix	trans	-62.8	-35.7	176.9	-72.3	172.4	0	0	0	112.4	I559 L560 D561 Y568	I559-L563 HydrophobicContact CG2-CD1 4.01Å; I559-L563 HydrophobicContact CG2-CG 4.39Å; I559-L563 WeakPolarHBondContact O-CB 3.46Å; I559-L563 VanDerWaalsContact O-CG 3.26Å; I559-L563 WeakPolarHBondContact O-CG 3.12Å; I559-L563 PolarHBondContact O-N 3.02Å; L560-L563 PolarHBondContact O-N 3.21Å; D561-L563 VanDerWaalsContact C-N 3.35Å; D561-L563 PolarHBondContact O-N 3.41Å; L563-Y568 HydrophobicContact CD2-CE1 4.42Å; L563-Y568 PolarHBondContact O-OH 3.43Å
564	R	77.8	Confident	73.5	Confident	191 Å²	191	79.2 Å²	79.2	72%	0.721	42%	0.424	S	S	*	.	H	α-helix	trans	-76	-30.5	177.4	-74.2	169.2	-178.8	175.4	-0.6	113.6	L560 D561 Y562 G566	L560-R564 WeakPolarHBondContact O-CB 3.39Å; L560-R564 WeakPolarHBondContact O-CG 3.47Å; L560-R564 PolarHBondContact O-N 3.35Å; D561-R564 PolarHBondContact O-N 3.4Å; D561-R564 IonicContact OD1-NH1 2.68Å; Y562-R564 VanDerWaalsContact C-N 3.3Å; Y562-R564 PolarHBondContact O-N 2.64Å; R564-G566 PolarHBondContact O-N 3.16Å
565	S	71.8	Confident	73.5	Confident	75 Å²	75	87.2 Å²	87.2	52%	0.524	45%	0.451	S	S	.	.	H	α-helix	trans	-62.9	-21.4	-178.3	75.7	0	0	0	0	113.7	D561 Y562 S567	D561-S565 WeakPolarHBondContact O-CB 3.31Å; D561-S565 PolarHBondContact O-N 3.39Å; Y562-S565 PolarHBondContact O-N 2.98Å; Y562-S565 PolarHBondContact O-OG 3.42Å; S565-S567 PolarHBondContact O-N 2.93Å
566	G	62.2	Low	72.9	Confident	47 Å²	47	88.8 Å²	88.8	49%	0.485	46%	0.462	S	S	.	.			trans	68.1	0.2	177.2	0	0	0	0	0	115.2	R564 Y568	R564-G566 PolarHBondContact O-N 3.16Å; G566-Y568 PolarHBondContact O-N 3.29Å
567	S	64	Low	72.3	Confident	57 Å²	57	83 Å²	83	40%	0.399	44%	0.435	S	S	.	.			trans	-97.7	79.1	-179.9	178.4	0	0	0	0	111.1	S565 S569	S565-S567 PolarHBondContact O-N 2.93Å; S567-S569 PolarHBondContact O-N 3.1Å; S567-S569 PolarHBondContact OG-OG 3.16Å
568	Y	77.2	Confident	71.7	Confident	144 Å²	144	79.9 Å²	79.9	57%	0.565	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	11	179.2	-47.7	-62.7	0	0	0	114.1	Y562 L563 G566	Y562-Y568 HydrophobicContact CE1-CD1 4.14Å; L563-Y568 HydrophobicContact CD2-CE1 4.42Å; L563-Y568 PolarHBondContact O-OH 3.43Å; G566-Y568 PolarHBondContact O-N 3.29Å
569	S	71.6	Confident	70.9	Confident	114 Å²	114	80.8 Å²	80.8	80%	0.797	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-25.9	179.3	53.1	0	0	0	0	113.2	S567	S567-S569 PolarHBondContact O-N 3.1Å; S567-S569 PolarHBondContact OG-OG 3.16Å
570	S	70.1	Confident	69.6	Low	65 Å²	65	79.6 Å²	79.6	46%	0.455	43%	0.43	S	S	.	.	S	Bend	trans	-108.5	139.9	172.2	48.8	0	0	0	0	110.3	Y562	Y562-S570 WeakPolarHBondContact CE2-O 3.39Å; Y562-S570 PolarHBondContact OH-O 3.13Å
571	P	78.8	Confident	67.8	Low	114 Å²	114	82.4 Å²	82.4	74%	0.74	44%	0.441	S	S	*	.			trans	-65.2	153.2	176.1	27.6	-33.5	0	0	0	111.2	D573	P571-D573 PolarHBondContact O-N 3.12Å
572	F	76.9	Confident	66.2	Low	58 Å²	58	84.5 Å²	84.5	25%	0.254	45%	0.449	S	S	.	.			trans	-60.7	126.4	174.9	177.1	-105.1	0	0	0	110.9	L555 S558 I559 Y562 L574 V577	L555-F572 HydrophobicContact CD1-CE1 3.93Å; L555-F572 HydrophobicContact CD1-CZ 4.29Å; S558-F572 WeakPolarHBondContact O-CE2 3.47Å; I559-F572 HydrophobicContact CG1-CD1 4.42Å; I559-F572 HydrophobicContact CG1-CE1 3.94Å; I559-F572 HydrophobicContact CG1-CE2 4.21Å; I559-F572 HydrophobicContact CG1-CZ 3.81Å; Y562-F572 HydrophobicContact CD1-CB 4.14Å; Y562-F572 HydrophobicContact CD1-CD2 4.21Å; Y562-F572 HydrophobicContact CD2-CB 4.41Å; Y562-F572 HydrophobicContact CD2-CD2 4.13Å; Y562-F572 HydrophobicContact CE1-CB 4.15Å; Y562-F572 HydrophobicContact CE2-CB 4.41Å; Y562-F572 HydrophobicContact CG-CB 4.27Å; Y562-F572 AromaticContact CG-CD2 3.73Å; Y562-F572 HydrophobicContact CG-CD2 3.73Å; Y562-F572 HydrophobicContact CG-CG 4.46Å; F572-L574 HydrophobicContact CE1-CG 4.28Å; F572-V577 HydrophobicContact CE1-CG2 4.15Å; F572-V577 HydrophobicContact CZ-CG2 3.74Å
573	D	71.1	Confident	64.2	Low	56 Å²	56	83 Å²	83	30%	0.299	45%	0.448	S	S	.	.			trans	-98.3	113.1	-178.4	-169.1	-9.3	0	0	0	111.3	P571 R575 V576	P571-D573 PolarHBondContact O-N 3.12Å; D573-R575 VanDerWaalsContact CG-NE 3.32Å; D573-R575 PolarHBondContact O-N 2.74Å; D573-R575 VanDerWaalsContact OD1-CB 3.3Å; D573-R575 WeakPolarHBondContact OD1-CB 3.28Å; D573-R575 WeakPolarHBondContact OD1-CG 3.39Å; D573-R575 IonicContact OD1-CZ 3.23Å; D573-R575 PolarHBondContact OD1-N 2.86Å; D573-R575 IonicContact OD1-NE 3.54Å; D573-R575 PolarHBondContact OD1-NE 3.48Å; D573-R575 IonicContact OD1-NH2 2.78Å; D573-R575 IonicContact OD2-CZ 3.89Å; D573-R575 IonicContact OD2-NE 2.74Å; D573-R575 PolarHBondContact OD2-NE 3.12Å; D573-R575 IonicContact OD2-NH2 3.7Å; D573-R575 PolarHBondContact OD2-NH2 3.36Å; D573-V576 HydrophobicContact CB-CG2 4.11Å; D573-V576 PolarHBondContact O-N 3.33Å
574	L	68.9	Low	62	Low	82 Å²	82	83.7 Å²	83.7	43%	0.429	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-62.6	-18.5	177.9	-90.5	144.6	0	0	0	113.5	L548 V550 L555 F572 V576 V577	L548-L574 HydrophobicContact CD1-CD2 4.15Å; L548-L574 HydrophobicContact CD2-CD2 4.13Å; V550-L574 HydrophobicContact CG1-CD2 4.22Å; L555-L574 HydrophobicContact CD1-CD2 3.98Å; F572-L574 HydrophobicContact CE1-CG 4.28Å; L574-V576 PolarHBondContact O-N 2.81Å; L574-V577 PolarHBondContact O-N 3.47Å
575	R	66.3	Low	59.9	Low	180 Å²	180	77.1 Å²	77.1	68%	0.679	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-68.4	-18.9	177.2	-63.4	174.7	-70.1	-178.5	1.9	113.4	D573 V577	D573-R575 VanDerWaalsContact CG-NE 3.32Å; D573-R575 PolarHBondContact O-N 2.74Å; D573-R575 VanDerWaalsContact OD1-CB 3.3Å; D573-R575 WeakPolarHBondContact OD1-CB 3.28Å; D573-R575 WeakPolarHBondContact OD1-CG 3.39Å; D573-R575 IonicContact OD1-CZ 3.23Å; D573-R575 PolarHBondContact OD1-N 2.86Å; D573-R575 IonicContact OD1-NE 3.54Å; D573-R575 PolarHBondContact OD1-NE 3.48Å; D573-R575 IonicContact OD1-NH2 2.78Å; D573-R575 IonicContact OD2-CZ 3.89Å; D573-R575 IonicContact OD2-NE 2.74Å; D573-R575 PolarHBondContact OD2-NE 3.12Å; D573-R575 IonicContact OD2-NH2 3.7Å; D573-R575 PolarHBondContact OD2-NH2 3.36Å; R575-V577 VanDerWaalsContact C-N 3.27Å
576	V	63.6	Low	58	Low	72 Å²	72	79.9 Å²	79.9	44%	0.436	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-80.2	-12.8	179	-174.3	0	0	0	0	111.6	D573 L574 P624	D573-V576 HydrophobicContact CB-CG2 4.11Å; D573-V576 PolarHBondContact O-N 3.33Å; L574-V576 PolarHBondContact O-N 2.81Å; V576-P624 HydrophobicContact CG1-CG 3.89Å
577	V	63.8	Low	56.4	Low	3 Å²	3	80.1 Å²	80.1	2%	0.018	43%	0.432	C	S	.	.	S	Bend	trans	-82.9	127	-178.1	-173.2	0	0	0	0	110.2	V550 L555 F572 L574 R575 V579	V550-V577 HydrophobicContact CB-CB 4.35Å; V550-V577 HydrophobicContact CB-CG1 3.75Å; V550-V577 HydrophobicContact CG1-CB 4.03Å; V550-V577 HydrophobicContact CG1-CG1 4Å; L555-V577 HydrophobicContact CB-CG1 4.07Å; L555-V577 HydrophobicContact CD1-CG2 3.84Å; F572-V577 HydrophobicContact CE1-CG2 4.15Å; F572-V577 HydrophobicContact CZ-CG2 3.74Å; L574-V577 PolarHBondContact O-N 3.47Å; R575-V577 VanDerWaalsContact C-N 3.27Å; V577-V579 PolarHBondContact O-N 2.88Å
578	P	57.4	Low	54.7	Low	47 Å²	47	84.2 Å²	84.2	31%	0.305	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-56.7	125.7	176.1	-24	33	0	0	0	111.8	S551	S551-P578 PolarHBondContact N-O 2.76Å
579	V	56.3	Low	52.3	Low	33 Å²	33	86.9 Å²	86.9	20%	0.2	46%	0.459	C	S	.	.	B	Isolated β-bridge	trans	-76.5	137.2	179.8	-167.3	0	0	0	0	108.7	Q549 V577 Q760 V762	Q549-V579 HydrophobicContact CB-CG1 4.05Å; Q549-V579 WeakPolarHBondContact O-CG1 3.29Å; V577-V579 PolarHBondContact O-N 2.88Å; V579-Q760 PolarHBondContact O-NE2 3.03Å; V579-V762 HydrophobicContact CB-CG2 3.99Å; V579-V762 HydrophobicContact CG1-CB 4.3Å; V579-V762 HydrophobicContact CG1-CG1 3.74Å; V579-V762 HydrophobicContact CG1-CG2 3.51Å
580	T	50.4	Low	50.4	Low	41 Å²	41	89.6 Å²	89.6	25%	0.252	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-80.3	132.9	-178.9	-49.9	0	0	0	0	110	Q549 S551 Q582	Q549-T580 PolarHBondContact O-N 3.14Å; S551-T580 WeakPolarHBondContact CA-OG1 3.35Å; S551-T580 WeakPolarHBondContact CB-OG1 3.25Å; S551-T580 PolarHBondContact N-OG1 3.46Å; S551-T580 VanDerWaalsContact N-OG1 3.09Å; T580-Q582 HydrophobicContact CG2-CB 4.48Å; T580-Q582 WeakPolarHBondContact CG2-O 3.39Å; T580-Q582 PolarHBondContact O-N 3.05Å; T580-Q582 VanDerWaalsContact O-N 3.14Å
581	Q	41.9	Very low	48.5	Very low	133 Å²	133	91.8 Å²	91.8	62%	0.621	46%	0.462	S	S	*	.	S	Bend	trans	-60.7	-19.9	175.7	-72.1	-178.7	-16.3	0	0	113.8
582	Q	39.8	Very low	46.1	Very low	116 Å²	116	90.4 Å²	90.4	54%	0.542	45%	0.453	S	S	.	.	S	Bend	trans	-110.2	123.1	174	-72.2	177	-5.9	0	0	108.9	T580 L584	T580-Q582 HydrophobicContact CG2-CB 4.48Å; T580-Q582 WeakPolarHBondContact CG2-O 3.39Å; T580-Q582 PolarHBondContact O-N 3.05Å; T580-Q582 VanDerWaalsContact O-N 3.14Å; Q582-L584 PolarHBondContact O-N 3.41Å
583	A	36.8	Very low	43.8	Very low	23 Å²	23	95.7 Å²	95.7	19%	0.19	48%	0.479	C	S	.	.			trans	-53.7	127.9	162.6	0	0	0	0	0	107.7	S585 Q586	A583-S585 PolarHBondContact O-N 3.3Å; A583-Q586 PolarHBondContact O-N 3.2Å
584	L	35.8	Very low	41.7	Very low	107 Å²	107	99.8 Å²	99.8	56%	0.56	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-4.8	177.6	-73.1	155.8	0	0	0	114.4	L548 P552 Q582	L548-L584 WeakPolarHBondContact O-CD1 3.39Å; P552-L584 HydrophobicContact CG-CD2 4.31Å; Q582-L584 PolarHBondContact O-N 3.41Å
585	S	34	Very low	40	Very low	53 Å²	53	102.3 Å²	102.3	37%	0.371	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-5.3	-178.3	69	0	0	0	0	115.4	R458 A583	R458-S585 PolarHBondContact NH1-O 3.47Å; R458-S585 VanDerWaalsContact NH1-O 3.12Å; A583-S585 PolarHBondContact O-N 3.3Å
586	Q	30.9	Very low	38.2	Very low	132 Å²	132	102.8 Å²	102.8	62%	0.617	53%	0.529	S	S	*	.	S	Bend	trans	-92.6	124.4	171.8	-70.2	-168.3	8.4	0	0	110.8	A583	A583-Q586 PolarHBondContact O-N 3.2Å
587	P	28.5	Very low	36.4	Very low	52 Å²	52	108.3 Å²	108.3	34%	0.338	55%	0.55	S	S	.	.	P	Polyproline II helix	trans	-65.5	135.8	170.5	26.1	-29.8	0	0	0	110	K589	P587-K589 PolarHBondContact O-N 3.08Å
588	E	28	Very low	34.5	Very low	144 Å²	144	117.9 Å²	117.9	67%	0.673	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-46.8	131.8	172.7	-73.4	179.5	148.8	0	0	110.6	R590	E588-R590 VanDerWaalsContact C-N 3.27Å; E588-R590 PolarHBondContact O-N 3.28Å
589	K	28.4	Very low	33	Very low	200 Å²	200	122.4 Å²	122.4	87%	0.87	61%	0.611	S	S	*	*			trans	-65.4	89.5	168	-77.9	-178.7	178.8	175.4	0	108.6	P587 V591	P587-K589 PolarHBondContact O-N 3.08Å; K589-V591 PolarHBondContact O-N 3.14Å
590	R	30.3	Very low	31.5	Very low	170 Å²	170	129.5 Å²	129.5	64%	0.642	64%	0.639	S	S	*	*			trans	-67.2	109.9	167	-77.5	-177.8	172.5	-168.6	-7.1	108.9	E588	E588-R590 VanDerWaalsContact C-N 3.27Å; E588-R590 PolarHBondContact O-N 3.28Å
591	V	30.3	Very low	30.2	Very low	111 Å²	111	133.6 Å²	133.6	67%	0.673	67%	0.667	S	S	*	*			trans	-71.6	130.4	161.9	-173.8	0	0	0	0	106.6	K589 Q593	K589-V591 PolarHBondContact O-N 3.14Å; V591-Q593 PolarHBondContact O-N 3.33Å
592	P	28.3	Very low	29.3	Very low	85 Å²	85	135 Å²	135	55%	0.552	67%	0.671	S	S	*	*			trans	-67.2	101.5	178.2	24.3	-31.2	0	0	0	110.1
593	Q	28.4	Very low	28.6	Very low	170 Å²	170	133.1 Å²	133.1	79%	0.794	68%	0.676	S	S	*	*			trans	-106.9	128.2	168.3	-75.9	-179.2	-27.2	0	0	108.9	V591	V591-Q593 PolarHBondContact O-N 3.33Å
594	L	28.1	Very low	28.1	Very low	141 Å²	141	137 Å²	137	74%	0.738	70%	0.699	S	S	*	*			trans	-128.2	118.6	167	-88.3	168.1	0	0	0	110	V375	V375-L594 HydrophobicContact CG2-CD1 3.94Å
595	V	33.4	Very low	27.9	Very low	136 Å²	136	142.1 Å²	142.1	82%	0.824	72%	0.716	S	S	*	*			trans	69.3	78.9	166.2	-156.5	0	0	0	0	116.5
596	E	28.3	Very low	28.1	Very low	189 Å²	189	144.1 Å²	144.1	88%	0.883	73%	0.726	S	S	*	*			trans	-118.5	152.9	141.5	-78.7	-177.5	166.4	0	0	108.1
597	E	26.2	Very low	29.1	Very low	189 Å²	189	141.8 Å²	141.8	88%	0.883	72%	0.715	S	S	*	*			trans	-50.6	155.8	-171.1	-67.9	172	150.8	0	0	113.6	E599	E597-E599 VanDerWaalsContact C-N 3.32Å; E597-E599 PolarHBondContact O-N 3.23Å
598	E	24.2	Very low	30.6	Very low	203 Å²	203	143.1 Å²	143.1	95%	0.949	72%	0.724	S	S	*	*			trans	-50.4	86.2	177.5	-70.8	-178.8	152.2	0	0	112.5
599	E	24.1	Very low	32.5	Very low	142 Å²	142	139.1 Å²	139.1	66%	0.664	70%	0.703	S	S	*	*			trans	-74.9	121.1	151.4	-82.9	-161.2	140.2	0	0	107.1	E597 K602	E597-E599 VanDerWaalsContact C-N 3.32Å; E597-E599 PolarHBondContact O-N 3.23Å; E599-K602 IonicContact OE1-NZ 3.85Å; E599-K602 PolarHBondContact OE1-NZ 2.99Å; E599-K602 IonicContact OE2-NZ 2.94Å; E599-K602 PolarHBondContact OE2-NZ 3.49Å
600	K	25	Very low	34.4	Very low	182 Å²	182	130.7 Å²	130.7	79%	0.791	67%	0.671	S	S	*	*			trans	-40.3	142	169.3	-70	175.6	178.2	176	0	110.1	K602	K600-K602 PolarHBondContact O-N 3.13Å
601	P	23.7	Very low	36.2	Very low	128 Å²	128	125.5 Å²	125.5	83%	0.831	66%	0.664	S	S	*	*			trans	-54.5	107.1	-179.9	22.3	-31.7	0	0	0	108.8	A603	P601-A603 PolarHBondContact O-N 3.46Å
602	K	24	Very low	38.3	Very low	161 Å²	161	125 Å²	125	70%	0.7	66%	0.655	S	S	*	*			trans	-63.3	113	170.2	-79.6	172.4	178.2	152.3	0	105.1	E599 K600	E599-K602 IonicContact OE1-NZ 3.85Å; E599-K602 PolarHBondContact OE1-NZ 2.99Å; E599-K602 IonicContact OE2-NZ 2.94Å; E599-K602 PolarHBondContact OE2-NZ 3.49Å; K600-K602 PolarHBondContact O-N 3.13Å
603	A	24.4	Very low	40.8	Very low	78 Å²	78	121.2 Å²	121.2	65%	0.645	63%	0.63	S	S	*	*			trans	-46.7	149.7	170.5	0	0	0	0	0	109.6	P601 K605	P601-A603 PolarHBondContact O-N 3.46Å; A603-K605 PolarHBondContact O-N 3.32Å
604	P	25.7	Very low	42.9	Very low	104 Å²	104	116 Å²	116	68%	0.675	62%	0.615	S	S	*	*			trans	-47.6	133.8	172.1	21.8	-33.1	0	0	0	108.4	V606	P604-V606 PolarHBondContact O-N 3.14Å
605	K	32.8	Very low	45.3	Very low	215 Å²	215	113 Å²	113	94%	0.935	61%	0.611	S	S	*	*			trans	-57.5	83.1	-176.9	-72.6	179.4	177.6	-179.8	0	110.2	A603	A603-K605 PolarHBondContact O-N 3.32Å
606	V	36.8	Very low	47.5	Very low	94 Å²	94	107.7 Å²	107.7	57%	0.57	58%	0.578	S	S	*	*			trans	-81	126	162.7	175.8	0	0	0	0	105.6	P604 P608	P604-V606 PolarHBondContact O-N 3.14Å; V606-P608 WeakPolarHBondContact O-CD 3.27Å; V606-P608 VanDerWaalsContact O-N 3.15Å
607	E	51.8	Low	49.9	Very low	84 Å²	84	103.9 Å²	103.9	39%	0.393	57%	0.57	S	S	.	*			trans	-51.5	112.4	-177.4	-66.2	174.5	176.4	0	0	110.9	Y609 S628	E607-Y609 HydrophobicContact CB-CD2 4.45Å; E607-Y609 PolarHBondContact O-N 3.11Å; E607-Y609 VanDerWaalsContact O-N 3.1Å; E607-S628 PolarHBondContact OE2-OG 3.27Å
608	P	59.8	Low	52.4	Low	80 Å²	80	99.3 Å²	99.3	52%	0.519	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-14.7	-177.4	25.5	-33.6	0	0	0	113.3	V606	V606-P608 WeakPolarHBondContact O-CD 3.27Å; V606-P608 VanDerWaalsContact O-N 3.15Å
609	Y	68.8	Low	55.2	Low	59 Å²	59	89.9 Å²	89.9	23%	0.231	50%	0.504	C	S	.	.	H	α-helix	trans	-74	-33	-172.7	-50.7	-63.6	0	0	0	113.6	E607 A611 Q612 L613 I646 H648	E607-Y609 HydrophobicContact CB-CD2 4.45Å; E607-Y609 PolarHBondContact O-N 3.11Å; E607-Y609 VanDerWaalsContact O-N 3.1Å; Y609-A611 PolarHBondContact O-N 3.1Å; Y609-Q612 PolarHBondContact O-N 3.35Å; Y609-L613 WeakPolarHBondContact O-CG 3.12Å; Y609-L613 PolarHBondContact O-N 3.06Å; Y609-I646 HydrophobicContact CE1-CD1 3.74Å; Y609-I646 HydrophobicContact CE2-CD1 4.45Å; Y609-H648 VanDerWaalsContact CB-CE1 3.41Å; Y609-H648 WeakPolarHBondContact CB-CE1 3.41Å; Y609-H648 AromaticContact CD2-CE1 3.82Å; Y609-H648 AromaticContact CG-CE1 3.51Å
610	A	67.6	Low	57.5	Low	24 Å²	24	86.4 Å²	86.4	20%	0.198	50%	0.5	C	S	.	.	H	α-helix	trans	-64.2	-27.6	-176.6	0	0	0	0	0	113.5	A614 V625	A610-A614 VanDerWaalsContact O-CB 3.31Å; A610-A614 WeakPolarHBondContact O-CB 3.32Å; A610-A614 PolarHBondContact O-N 3.34Å; A610-V625 HydrophobicContact CB-CG2 4.35Å
611	A	69.4	Low	59.9	Low	61 Å²	61	82.6 Å²	82.6	50%	0.504	50%	0.502	S	S	.	.	H	α-helix	trans	-79	-36.3	174	0	0	0	0	0	112.2	Y609 A615	Y609-A611 PolarHBondContact O-N 3.1Å; A611-A615 PolarHBondContact O-N 3.27Å
612	Q	74.6	Confident	62.3	Low	100 Å²	100	78.8 Å²	78.8	47%	0.467	47%	0.474	S	S	.	.	H	α-helix	trans	-67.4	-46.9	177.8	-66.9	175	-18.4	0	0	111.1	Y609 A614 A615	Y609-Q612 PolarHBondContact O-N 3.35Å; Q612-A614 PolarHBondContact O-N 3.48Å; Q612-A615 WeakPolarHBondContact O-CB 3.22Å; Q612-A615 PolarHBondContact O-N 2.94Å; Q612-A615 VanDerWaalsContact O-N 3.17Å
613	L	78.9	Confident	64.7	Low	5 Å²	5	73.2 Å²	73.2	3%	0.026	46%	0.463	C	S	.	.	H	α-helix	trans	-64.7	-38.7	178.5	-67	169.3	0	0	0	112.3	Y609 A615 I616 F619 V625 H648 F650 V655 F703	Y609-L613 WeakPolarHBondContact O-CG 3.12Å; Y609-L613 PolarHBondContact O-N 3.06Å; L613-A615 PolarHBondContact O-N 2.85Å; L613-I616 PolarHBondContact O-N 3.29Å; L613-F619 HydrophobicContact CD2-CD2 4.35Å; L613-V625 HydrophobicContact CD1-CG2 3.89Å; L613-H648 HydrophobicContact CD1-CB 3.84Å; L613-F650 HydrophobicContact CD1-CZ 4.25Å; L613-V655 HydrophobicContact CD2-CG1 3.97Å; L613-F703 HydrophobicContact CD2-CD1 3.99Å; L613-F703 HydrophobicContact CD2-CE1 3.74Å
614	A	73.5	Confident	67.2	Low	60 Å²	60	73 Å²	73	50%	0.496	46%	0.455	S	S	.	.	H	α-helix	trans	-68.3	-21.7	176.6	0	0	0	0	0	113.5	A610 Q612 I616	A610-A614 VanDerWaalsContact O-CB 3.31Å; A610-A614 WeakPolarHBondContact O-CB 3.32Å; A610-A614 PolarHBondContact O-N 3.34Å; Q612-A614 PolarHBondContact O-N 3.48Å; A614-I616 VanDerWaalsContact C-N 3.29Å
615	A	78.2	Confident	69.8	Low	79 Å²	79	68.9 Å²	68.9	65%	0.653	43%	0.428	S	S	*	.	H	α-helix	trans	-76.8	-17.2	175.3	0	0	0	0	0	112.6	A611 Q612 L613 P617	A611-A615 PolarHBondContact O-N 3.27Å; Q612-A615 WeakPolarHBondContact O-CB 3.22Å; Q612-A615 PolarHBondContact O-N 2.94Å; Q612-A615 VanDerWaalsContact O-N 3.17Å; L613-A615 PolarHBondContact O-N 2.85Å; A615-P617 WeakPolarHBondContact O-CD 3.42Å
616	I	80.5	Confident	72.1	Confident	24 Å²	24	60.3 Å²	60.3	12%	0.123	39%	0.391	C	S	.	.	S	Bend	trans	-84.6	113.3	179.4	-60.2	173.6	0	0	0	108.6	L613 A614 Q618 F619 A620 V689 F703	L613-I616 PolarHBondContact O-N 3.29Å; A614-I616 VanDerWaalsContact C-N 3.29Å; I616-Q618 HydrophobicContact CG2-CB 4.26Å; I616-Q618 PolarHBondContact O-N 3.04Å; I616-F619 HydrophobicContact CB-CD2 3.82Å; I616-F619 HydrophobicContact CB-CE2 4.41Å; I616-F619 HydrophobicContact CD1-CD2 3.93Å; I616-F619 HydrophobicContact CD1-CE2 3.97Å; I616-F619 HydrophobicContact CG1-CD2 4.48Å; I616-F619 HydrophobicContact CG2-CD2 3.56Å; I616-F619 HydrophobicContact CG2-CE2 3.82Å; I616-F619 HydrophobicContact CG2-CG 4.17Å; I616-F619 PolarHBondContact O-N 2.81Å; I616-A620 PolarHBondContact O-N 2.94Å; I616-V689 HydrophobicContact CG2-CG2 4.23Å; I616-F703 HydrophobicContact CD1-CD1 4.4Å; I616-F703 HydrophobicContact CD1-CD2 3.89Å; I616-F703 HydrophobicContact CD1-CE1 4.18Å; I616-F703 HydrophobicContact CD1-CE2 3.66Å; I616-F703 HydrophobicContact CD1-CG 4.26Å; I616-F703 HydrophobicContact CD1-CZ 3.82Å
617	P	78.7	Confident	74.3	Confident	110 Å²	110	57.6 Å²	57.6	71%	0.714	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-58.8	-33	-175.3	-25.2	35.1	0	0	0	113.7	A615 F619 A620	A615-P617 WeakPolarHBondContact O-CD 3.42Å; P617-F619 PolarHBondContact O-N 3.06Å; P617-A620 PolarHBondContact O-N 2.84Å
618	Q	78.6	Confident	75.9	Confident	93 Å²	93	54.4 Å²	54.4	44%	0.435	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-63.4	-22.7	178.9	-63.2	92.5	-19.7	0	0	113.3	I616 N687	I616-Q618 HydrophobicContact CG2-CB 4.26Å; I616-Q618 PolarHBondContact O-N 3.04Å; Q618-N687 HydrophobicContact CB-CB 4.39Å
619	F	81.9	Confident	77.1	Confident	5 Å²	5	51.7 Å²	51.7	2%	0.022	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-111.1	-2.2	-174.7	-55.6	-34.6	0	0	0	113.7	L613 I616 P617 A621 L622 V655 N687 V689 F703 L705	L613-F619 HydrophobicContact CD2-CD2 4.35Å; I616-F619 HydrophobicContact CB-CD2 3.82Å; I616-F619 HydrophobicContact CB-CE2 4.41Å; I616-F619 HydrophobicContact CD1-CD2 3.93Å; I616-F619 HydrophobicContact CD1-CE2 3.97Å; I616-F619 HydrophobicContact CG1-CD2 4.48Å; I616-F619 HydrophobicContact CG2-CD2 3.56Å; I616-F619 HydrophobicContact CG2-CE2 3.82Å; I616-F619 HydrophobicContact CG2-CG 4.17Å; I616-F619 PolarHBondContact O-N 2.81Å; P617-F619 PolarHBondContact O-N 3.06Å; F619-A621 PolarHBondContact O-N 3.47Å; F619-A621 VanDerWaalsContact O-N 3.14Å; F619-L622 HydrophobicContact CB-CD1 3.94Å; F619-L622 HydrophobicContact CD1-CD1 4.04Å; F619-L622 HydrophobicContact CG-CD1 4.29Å; F619-L622 WeakPolarHBondContact O-CB 3.28Å; F619-L622 PolarHBondContact O-N 3.36Å; F619-L622 VanDerWaalsContact O-N 3.15Å; F619-V655 HydrophobicContact CD1-CG2 4.3Å; F619-V655 HydrophobicContact CD2-CG1 4.36Å; F619-V655 HydrophobicContact CE1-CG2 4.49Å; F619-V655 HydrophobicContact CE2-CG1 3.99Å; F619-V655 HydrophobicContact CG-CG2 4.36Å; F619-V655 HydrophobicContact CZ-CG1 4.22Å; F619-N687 HydrophobicContact CE1-CB 4.41Å; F619-V689 HydrophobicContact CE2-CG2 4.15Å; F619-V689 HydrophobicContact CZ-CG2 3.91Å; F619-F703 HydrophobicContact CE2-CB 3.64Å; F619-F703 HydrophobicContact CE2-CD1 4.27Å; F619-F703 AromaticContact CE2-CG 3.96Å; F619-F703 HydrophobicContact CE2-CG 3.96Å; F619-F703 HydrophobicContact CZ-CB 3.76Å; F619-L705 HydrophobicContact CE1-CB 4.04Å
620	A	72.6	Confident	77.9	Confident	68 Å²	68	54.6 Å²	54.6	56%	0.562	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-61.8	-24.7	-176.4	0	0	0	0	0	114	I616 P617	I616-A620 PolarHBondContact O-N 2.94Å; P617-A620 PolarHBondContact O-N 2.84Å
621	A	76.3	Confident	78.6	Confident	102 Å²	102	59.3 Å²	59.3	84%	0.843	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-81.8	-10.1	-179.6	0	0	0	0	0	114.4	F619 G623	F619-A621 PolarHBondContact O-N 3.47Å; F619-A621 VanDerWaalsContact O-N 3.14Å; A621-G623 VanDerWaalsContact C-N 3.3Å; A621-G623 PolarHBondContact O-N 3.39Å
622	L	73.1	Confident	79.5	Confident	48 Å²	48	59.1 Å²	59.1	25%	0.251	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-78.1	-11	-172.8	-63.3	173.4	0	0	0	114.2	F619 F650 A653 V655 L705	F619-L622 HydrophobicContact CB-CD1 3.94Å; F619-L622 HydrophobicContact CD1-CD1 4.04Å; F619-L622 HydrophobicContact CG-CD1 4.29Å; F619-L622 WeakPolarHBondContact O-CB 3.28Å; F619-L622 PolarHBondContact O-N 3.36Å; F619-L622 VanDerWaalsContact O-N 3.15Å; L622-F650 HydrophobicContact CB-CD1 3.77Å; L622-F650 HydrophobicContact CB-CE1 3.97Å; L622-F650 HydrophobicContact CB-CG 4.09Å; L622-F650 HydrophobicContact CB-CZ 4.46Å; L622-F650 HydrophobicContact CD1-CD2 4.45Å; L622-F650 HydrophobicContact CD1-CE2 4.35Å; L622-A653 HydrophobicContact CD2-CB 4.02Å; L622-V655 HydrophobicContact CD1-CG2 3.78Å; L622-L705 HydrophobicContact CD1-CD1 3.64Å; L622-L705 HydrophobicContact CD2-CD1 4.26Å
623	G	74.1	Confident	80.2	Confident	45 Å²	45	56.7 Å²	56.7	46%	0.464	37%	0.365	S	S	.	.			trans	81.5	-163.3	-177.6	0	0	0	0	0	113.3	A621 F650	A621-G623 VanDerWaalsContact C-N 3.3Å; A621-G623 PolarHBondContact O-N 3.39Å; G623-F650 VanDerWaalsContact O-CE1 3.27Å; G623-F650 WeakPolarHBondContact O-CE1 3.32Å
624	P	76.8	Confident	80.8	Confident	72 Å²	72	56.6 Å²	56.6	47%	0.468	36%	0.364	S	S	.	.	S	Bend	trans	-73.4	144.1	-179.9	29.8	-33.4	0	0	0	111.9	V576 F626 F650	V576-P624 HydrophobicContact CG1-CG 3.89Å; P624-F626 PolarHBondContact O-N 2.98Å; P624-F650 WeakPolarHBondContact O-CD1 3.46Å
625	V	81.4	Confident	81.5	Confident	18 Å²	18	54.3 Å²	54.3	11%	0.109	34%	0.344	C	S	.	.			trans	-62.9	128.5	171.7	-178.7	0	0	0	0	108.9	A610 L613 H648 F650	A610-V625 HydrophobicContact CB-CG2 4.35Å; L613-V625 HydrophobicContact CD1-CG2 3.89Å; V625-H648 HydrophobicContact CG1-CB 4.36Å; V625-F650 HydrophobicContact CB-CE1 4.34Å; V625-F650 HydrophobicContact CB-CZ 4.49Å; V625-F650 HydrophobicContact CG2-CD1 4.47Å; V625-F650 HydrophobicContact CG2-CE1 3.62Å; V625-F650 HydrophobicContact CG2-CE2 4.28Å; V625-F650 HydrophobicContact CG2-CZ 3.52Å
626	F	81.6	Confident	81.7	Confident	36 Å²	36	57.5 Å²	57.5	16%	0.158	35%	0.345	C	S	.	.			trans	-81.3	-47.9	176.7	174.3	-107.9	0	0	0	111.4	P624 T649 S758 Q760 V828 R830	P624-F626 PolarHBondContact O-N 2.98Å; F626-T649 WeakPolarHBondContact CA-O 3.39Å; F626-T649 VanDerWaalsContact CB-O 3.31Å; F626-T649 WeakPolarHBondContact CB-O 3.23Å; F626-T649 HydrophobicContact CD1-CG2 4.37Å; F626-T649 PolarHBondContact N-O 3.02Å; F626-S758 WeakPolarHBondContact CE1-O 3.17Å; F626-Q760 HydrophobicContact CE1-CB 3.98Å; F626-Q760 HydrophobicContact CE2-CB 4.37Å; F626-Q760 HydrophobicContact CZ-CB 3.63Å; F626-V828 WeakPolarHBondContact CZ-O 3.15Å; F626-R830 HydrophobicContact CD1-CB 4.01Å; F626-R830 HydrophobicContact CE1-CB 4.12Å; F626-R830 HydrophobicContact CG-CB 4.36Å
627	K	83.3	Confident	81.2	Confident	36 Å²	36	61.9 Å²	61.9	16%	0.157	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	142	-178.3	-177.4	179.9	177.8	-177.4	0	110.5	T649 S756 V759	K627-T649 PolarHBondContact N-O 3.44Å; K627-T649 PolarHBondContact O-N 3.49Å; K627-S756 PolarHBondContact NZ-O 3.4Å; K627-V759 WeakPolarHBondContact CD-O 3.41Å; K627-V759 PolarHBondContact NZ-O 3.1Å
628	S	85.2	Confident	81	Confident	17 Å²	17	64.2 Å²	64.2	12%	0.119	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	140.1	168.3	-53.6	0	0	0	0	110.8	E607 K647 H648	E607-S628 PolarHBondContact OE2-OG 3.27Å; S628-K647 CarbonylContact C-O 3.6Å; S628-K647 VanDerWaalsContact CA-O 3.28Å; S628-K647 WeakPolarHBondContact CA-O 3.46Å; S628-H648 WeakPolarHBondContact CB-ND1 3.48Å; S628-H648 PolarHBondContact OG-ND1 3.45Å
629	S	84.4	Confident	81.1	Confident	24 Å²	24	60.4 Å²	60.4	17%	0.168	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-76.5	168.4	175.4	76.6	0	0	0	0	112	K647	S629-K647 PolarHBondContact N-O 3.17Å; S629-K647 PolarHBondContact OG-N 3.29Å
630	T	84.4	Confident	81.2	Confident	120 Å²	120	64.8 Å²	64.8	74%	0.736	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-69.7	162.9	161.4	50.6	0	0	0	0	110.4	I632	T630-I632 PolarHBondContact O-N 3.11Å
631	R	83.4	Confident	82	Confident	123 Å²	123	61.7 Å²	61.7	46%	0.464	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-65.5	120.4	175.1	-167.2	-177	-159.4	-145.3	5.8	110.1	H644 I646 E659	R631-H644 HydrophobicContact CG-CB 3.62Å; R631-H644 VanDerWaalsContact NE-CG 3.33Å; R631-H644 PolarHBondContact NH1-CE1 3.43Å; R631-H644 PolarHBondContact NH1-NE2 2.78Å; R631-H644 PolarHBondContact NH2-ND1 3.34Å; R631-I646 HydrophobicContact CB-CG1 4.48Å; R631-I646 HydrophobicContact CG-CG1 4.49Å; R631-E659 IonicContact CZ-OE2 3.62Å; R631-E659 IonicContact NE-OE2 3.54Å; R631-E659 PolarHBondContact NE-OE2 2.93Å; R631-E659 IonicContact NH2-OE2 3.66Å; R631-E659 PolarHBondContact NH2-OE2 3.28Å
632	I	88.8	Confident	82.6	Confident	57 Å²	57	57.9 Å²	57.9	29%	0.292	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131	178.5	-61.6	162.5	0	0	0	107.3	T630 L634 H644 M645	T630-I632 PolarHBondContact O-N 3.11Å; I632-L634 HydrophobicContact CG2-CD2 4.41Å; I632-H644 CarbonylContact O-C 3.59Å; I632-H644 WeakPolarHBondContact O-CA 3.41Å; I632-M645 HydrophobicContact CB-CE 4.38Å; I632-M645 HydrophobicContact CD1-CE 3.79Å; I632-M645 PolarHBondContact N-O 3.08Å; I632-M645 PolarHBondContact O-N 3.49Å
633	A	89.6	Confident	83.5	Confident	48 Å²	48	55.6 Å²	55.6	40%	0.397	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	132	174.1	0	0	0	0	0	108.8
634	L	89.5	Confident	84.3	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	30%	0.302	C	S	.	.	S	Bend	trans	-104.7	3.4	174.2	-62.5	-177.8	0	0	0	112.5	I632 V643 M645 F658 L748 E749 V751	I632-L634 HydrophobicContact CG2-CD2 4.41Å; L634-V643 HydrophobicContact CD1-CG1 4.4Å; L634-V643 PolarHBondContact N-O 3.17Å; L634-M645 HydrophobicContact CD1-CB 3.8Å; L634-M645 HydrophobicContact CD1-SD 4.4Å; L634-M645 HydrophobicContact CD2-CB 4.47Å; L634-M645 HydrophobicContact CG-CB 3.99Å; L634-F658 HydrophobicContact CD1-CD1 3.89Å; L634-F658 HydrophobicContact CD1-CE1 3.75Å; L634-L748 HydrophobicContact CB-CB 4.24Å; L634-L748 HydrophobicContact CD1-CD1 4.21Å; L634-E749 HydrophobicContact CD2-CB 4.48Å; L634-E749 PolarHBondContact O-N 2.85Å; L634-V751 HydrophobicContact CD1-CG2 3.99Å; L634-V751 HydrophobicContact CD2-CG2 4.2Å
635	T	89.3	Confident	85.1	Confident	11 Å²	11	51.9 Å²	51.9	7%	0.067	28%	0.28	C	S	.	.	S	Bend	trans	-144.6	146.5	-178.3	57.8	0	0	0	0	109.4	Y641 T642 V643 Y746 L748	T635-Y641 WeakPolarHBondContact CG2-O 3.28Å; T635-Y641 PolarHBondContact OG1-O 3.32Å; T635-T642 WeakPolarHBondContact OG1-CA 3.18Å; T635-V643 HydrophobicContact CG2-CB 4.02Å; T635-V643 HydrophobicContact CG2-CG2 4.18Å; T635-V643 PolarHBondContact OG1-N 2.86Å; T635-V643 PolarHBondContact OG1-O 3.16Å; T635-Y746 HydrophobicContact CG2-CE1 4.08Å; T635-L748 HydrophobicContact CG2-CD2 3.5Å; T635-L748 VanDerWaalsContact CG2-CD2 3.5Å
636	E	82.3	Confident	85.5	Confident	146 Å²	146	51.1 Å²	51.1	68%	0.682	28%	0.275	S	S	*	.			trans	-61.8	155.8	174.3	-61.7	-174.2	175.7	0	0	112.8	I638 A639	E636-I638 PolarHBondContact O-N 3.16Å; E636-A639 WeakPolarHBondContact O-CB 3.48Å; E636-A639 PolarHBondContact O-N 3.33Å; E636-A639 VanDerWaalsContact O-N 3.14Å
637	S	70.8	Confident	86	Confident	116 Å²	116	49.8 Å²	49.8	81%	0.811	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-10	-175.1	54.9	0	0	0	0	115.7
638	I	73.2	Confident	86.2	Confident	159 Å²	159	48 Å²	48	82%	0.815	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.8	16.7	-178.3	-40.7	178.7	0	0	0	110.9	E636	E636-I638 PolarHBondContact O-N 3.16Å
639	A	81.2	Confident	86.3	Confident	13 Å²	13	47.4 Å²	47.4	11%	0.107	26%	0.257	C	S	.	.	S	Bend	trans	-73	156.3	178.7	0	0	0	0	0	113.1	E636 Y641 T663	E636-A639 WeakPolarHBondContact O-CB 3.48Å; E636-A639 PolarHBondContact O-N 3.33Å; E636-A639 VanDerWaalsContact O-N 3.14Å; A639-Y641 WeakPolarHBondContact CB-O 3.44Å; A639-Y641 PolarHBondContact O-N 3.43Å; A639-T663 PolarHBondContact O-OG1 3.32Å
640	E	83.8	Confident	86.4	Confident	97 Å²	97	46.5 Å²	46.5	45%	0.453	25%	0.25	S	S	.	.	S	Bend	trans	-58.6	-31.3	175.6	-62.6	175.6	172.3	0	0	112.3	T663 M664	E640-T663 VanDerWaalsContact C-OG1 3.24Å; E640-T663 PolarHBondContact O-N 2.92Å; E640-T663 PolarHBondContact O-OG1 3.41Å; E640-M664 HydrophobicContact CB-CG 4.24Å; E640-M664 HydrophobicContact CB-SD 4.35Å; E640-M664 HydrophobicContact CG-SD 4.32Å
641	Y	89.1	Confident	86.2	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.016	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	129.8	173	-48	-66.9	0	0	0	108.3	T635 A639 M664 Q667 L669 F724 Y746	T635-Y641 WeakPolarHBondContact CG2-O 3.28Å; T635-Y641 PolarHBondContact OG1-O 3.32Å; A639-Y641 WeakPolarHBondContact CB-O 3.44Å; A639-Y641 PolarHBondContact O-N 3.43Å; Y641-M664 HydrophobicContact CE1-CG 4.49Å; Y641-Q667 PolarHBondContact OH-OE1 3.41Å; Y641-L669 HydrophobicContact CD1-CD1 3.69Å; Y641-L669 HydrophobicContact CE1-CD1 3.58Å; Y641-L669 HydrophobicContact CE1-CD2 3.99Å; Y641-L669 HydrophobicContact CE1-CG 4.34Å; Y641-F724 HydrophobicContact CD2-CE1 4.39Å; Y641-F724 HydrophobicContact CD2-CZ 4.07Å; Y641-F724 HydrophobicContact CE1-CE2 4.44Å; Y641-F724 HydrophobicContact CE1-CZ 4.27Å; Y641-F724 HydrophobicContact CE2-CE1 4.16Å; Y641-F724 HydrophobicContact CE2-CE2 4.21Å; Y641-F724 AromaticContact CE2-CZ 3.42Å; Y641-F724 HydrophobicContact CE2-CZ 3.42Å; Y641-F724 VanDerWaalsContact CE2-CZ 3.42Å; Y641-F724 AromaticContact CZ-CE2 3.84Å; Y641-F724 AromaticContact CZ-CZ 3.52Å; Y641-Y746 AromaticContact CD2-CD2 3.81Å; Y641-Y746 HydrophobicContact CD2-CD2 3.81Å; Y641-Y746 HydrophobicContact CD2-CE2 4.27Å; Y641-Y746 AromaticContact CD2-CG 3.98Å; Y641-Y746 HydrophobicContact CD2-CG 3.98Å; Y641-Y746 HydrophobicContact CE2-CD2 4.12Å
642	T	88.8	Confident	86	Confident	22 Å²	22	43.2 Å²	43.2	14%	0.135	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	116.4	175.3	-43.1	0	0	0	0	109.2	T635 H644 K661 T663	T635-T642 WeakPolarHBondContact OG1-CA 3.18Å; T642-H644 WeakPolarHBondContact CG2-CE1 3.2Å; T642-K661 PolarHBondContact N-O 2.81Å; T642-K661 PolarHBondContact O-N 3.37Å; T642-T663 WeakPolarHBondContact OG1-CG2 3.46Å
643	V	92.1	Very high	85.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.5	177.4	-174.4	0	0	0	0	109.8	L634 T635 F658 E659 L722 L748	L634-V643 HydrophobicContact CD1-CG1 4.4Å; L634-V643 PolarHBondContact N-O 3.17Å; T635-V643 HydrophobicContact CG2-CB 4.02Å; T635-V643 HydrophobicContact CG2-CG2 4.18Å; T635-V643 PolarHBondContact OG1-N 2.86Å; T635-V643 PolarHBondContact OG1-O 3.16Å; V643-F658 HydrophobicContact CG1-CB 4.26Å; V643-F658 HydrophobicContact CG1-CD1 4.3Å; V643-E659 WeakPolarHBondContact CA-O 3.49Å; V643-L722 HydrophobicContact CG2-CD2 4.06Å; V643-L748 HydrophobicContact CB-CD1 4.44Å; V643-L748 HydrophobicContact CB-CD2 4.05Å; V643-L748 HydrophobicContact CG1-CD1 4.1Å; V643-L748 HydrophobicContact CG2-CD1 4.47Å; V643-L748 HydrophobicContact CG2-CD2 3.82Å
644	H	91.9	Very high	85.8	Confident	37 Å²	37	38.4 Å²	38.4	17%	0.171	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	142.3	170	-60.5	78.2	0	0	0	110.3	R631 I632 T642 F658 E659	R631-H644 HydrophobicContact CG-CB 3.62Å; R631-H644 VanDerWaalsContact NE-CG 3.33Å; R631-H644 PolarHBondContact NH1-CE1 3.43Å; R631-H644 PolarHBondContact NH1-NE2 2.78Å; R631-H644 PolarHBondContact NH2-ND1 3.34Å; I632-H644 CarbonylContact O-C 3.59Å; I632-H644 WeakPolarHBondContact O-CA 3.41Å; T642-H644 WeakPolarHBondContact CG2-CE1 3.2Å; H644-F658 CarbonylContact O-C 3.57Å; H644-F658 WeakPolarHBondContact O-CA 3.25Å; H644-E659 HydrophobicContact CB-CB 4.37Å; H644-E659 PolarHBondContact N-O 2.98Å; H644-E659 PolarHBondContact O-N 3.04Å
645	M	92.9	Very high	85.9	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	143.1	179.2	-174.8	-172.1	63.2	0	0	111.6	I632 L634 K647 L656 Q657 F658 V751	I632-M645 HydrophobicContact CB-CE 4.38Å; I632-M645 HydrophobicContact CD1-CE 3.79Å; I632-M645 PolarHBondContact N-O 3.08Å; I632-M645 PolarHBondContact O-N 3.49Å; L634-M645 HydrophobicContact CD1-CB 3.8Å; L634-M645 HydrophobicContact CD1-SD 4.4Å; L634-M645 HydrophobicContact CD2-CB 4.47Å; L634-M645 HydrophobicContact CG-CB 3.99Å; M645-K647 HydrophobicContact CE-CD 4.34Å; M645-K647 VanDerWaalsContact CE-CE 3.49Å; M645-K647 HydrophobicContact CE-CG 3.96Å; M645-K647 HydrophobicContact SD-CG 4.44Å; M645-L656 HydrophobicContact SD-CD2 4.09Å; M645-Q657 CarbonylContact C-O 3.56Å; M645-Q657 VanDerWaalsContact CA-O 3.25Å; M645-Q657 WeakPolarHBondContact CA-O 3.17Å; M645-F658 HydrophobicContact CB-CD1 4.23Å; M645-F658 HydrophobicContact CB-CE1 4.31Å; M645-F658 HydrophobicContact CG-CD1 4.17Å; M645-F658 HydrophobicContact CG-CE1 3.92Å; M645-F658 HydrophobicContact SD-CE1 3.98Å; M645-F658 HydrophobicContact SD-CZ 4.42Å; M645-V751 HydrophobicContact CE-CG1 3.9Å; M645-V751 HydrophobicContact CE-CG2 4.42Å; M645-V751 HydrophobicContact SD-CB 4.23Å; M645-V751 HydrophobicContact SD-CG1 3.47Å; M645-V751 WeakPolarHBondContact SD-CG1 3.33Å; M645-V751 HydrophobicContact SD-CG2 3.72Å
646	I	90.6	Very high	86.1	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	130.8	167.4	-53.4	173.7	0	0	0	107.7	Y609 R631 H648 Q657	Y609-I646 HydrophobicContact CE1-CD1 3.74Å; Y609-I646 HydrophobicContact CE2-CD1 4.45Å; R631-I646 HydrophobicContact CB-CG1 4.48Å; R631-I646 HydrophobicContact CG-CG1 4.49Å; I646-H648 VanDerWaalsContact CG2-CE1 3.43Å; I646-H648 WeakPolarHBondContact CG2-CE1 3.22Å; I646-Q657 HydrophobicContact CB-CB 4.33Å; I646-Q657 PolarHBondContact N-O 3.4Å; I646-Q657 PolarHBondContact O-N 2.88Å
647	K	90.7	Very high	86.6	Confident	8 Å²	8	30.9 Å²	30.9	4%	0.035	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	130.7	177.4	-50.3	174.4	-174.6	163.7	0	109.5	S628 S629 M645 M654 L656 D752 D757	S628-K647 CarbonylContact C-O 3.6Å; S628-K647 VanDerWaalsContact CA-O 3.28Å; S628-K647 WeakPolarHBondContact CA-O 3.46Å; S629-K647 PolarHBondContact N-O 3.17Å; S629-K647 PolarHBondContact OG-N 3.29Å; M645-K647 HydrophobicContact CE-CD 4.34Å; M645-K647 VanDerWaalsContact CE-CE 3.49Å; M645-K647 HydrophobicContact CE-CG 3.96Å; M645-K647 HydrophobicContact SD-CG 4.44Å; K647-M654 HydrophobicContact CB-SD 4.04Å; K647-M654 HydrophobicContact CD-SD 4.25Å; K647-M654 HydrophobicContact CG-SD 4.4Å; K647-L656 HydrophobicContact CB-CD2 4.12Å; K647-L656 HydrophobicContact CG-CD2 3.74Å; K647-D752 WeakPolarHBondContact CE-O 3.39Å; K647-D752 PolarHBondContact NZ-O 3.41Å; K647-D757 WeakPolarHBondContact CD-OD2 3.46Å; K647-D757 IonicContact NZ-OD1 2.9Å; K647-D757 IonicContact NZ-OD2 3.82Å; K647-D757 PolarHBondContact NZ-OD2 3.17Å
648	H	89.1	Confident	87.6	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	105.5	174.6	-56.5	-72.8	0	0	0	109.6	Y609 L613 V625 S628 I646 F650 M654 V655 Q657	Y609-H648 VanDerWaalsContact CB-CE1 3.41Å; Y609-H648 WeakPolarHBondContact CB-CE1 3.41Å; Y609-H648 AromaticContact CD2-CE1 3.82Å; Y609-H648 AromaticContact CG-CE1 3.51Å; L613-H648 HydrophobicContact CD1-CB 3.84Å; V625-H648 HydrophobicContact CG1-CB 4.36Å; S628-H648 WeakPolarHBondContact CB-ND1 3.48Å; S628-H648 PolarHBondContact OG-ND1 3.45Å; I646-H648 VanDerWaalsContact CG2-CE1 3.43Å; I646-H648 WeakPolarHBondContact CG2-CE1 3.22Å; H648-F650 HydrophobicContact CB-CE2 4.13Å; H648-F650 WeakPolarHBondContact O-CD2 3.25Å; H648-M654 CarbonylContact O-C 3.54Å; H648-M654 WeakPolarHBondContact O-CA 3.46Å; H648-V655 HydrophobicContact CB-CB 4.31Å; H648-V655 PolarHBondContact N-O 3.36Å; H648-V655 PolarHBondContact O-N 3.04Å; H648-Q657 PolarHBondContact NE2-OE1 3.36Å; H648-Q657 VanDerWaalsContact NE2-OE1 3.16Å
649	T	87.5	Confident	88.6	Confident	3 Å²	3	19.3 Å²	19.3	2%	0.018	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	130.6	-179.7	-50.4	0	0	0	0	109.9	F626 K627 M654 F708 D757	F626-T649 WeakPolarHBondContact CA-O 3.39Å; F626-T649 VanDerWaalsContact CB-O 3.31Å; F626-T649 WeakPolarHBondContact CB-O 3.23Å; F626-T649 HydrophobicContact CD1-CG2 4.37Å; F626-T649 PolarHBondContact N-O 3.02Å; K627-T649 PolarHBondContact N-O 3.44Å; K627-T649 PolarHBondContact O-N 3.49Å; T649-M654 HydrophobicContact CG2-CE 4.48Å; T649-F708 HydrophobicContact CG2-CE2 4.42Å; T649-F708 HydrophobicContact CG2-CZ 4.09Å; T649-D757 PolarHBondContact OG1-O 3.01Å
650	F	85.9	Confident	89.1	Confident	5 Å²	5	18.8 Å²	18.8	2%	0.022	10%	0.102	C	C	.	.			trans	-111.2	-178.2	169.3	-63.8	-100.8	0	0	0	109.8	L613 L622 G623 P624 V625 H648 N652 A653 V655	L613-F650 HydrophobicContact CD1-CZ 4.25Å; L622-F650 HydrophobicContact CB-CD1 3.77Å; L622-F650 HydrophobicContact CB-CE1 3.97Å; L622-F650 HydrophobicContact CB-CG 4.09Å; L622-F650 HydrophobicContact CB-CZ 4.46Å; L622-F650 HydrophobicContact CD1-CD2 4.45Å; L622-F650 HydrophobicContact CD1-CE2 4.35Å; G623-F650 VanDerWaalsContact O-CE1 3.27Å; G623-F650 WeakPolarHBondContact O-CE1 3.32Å; P624-F650 WeakPolarHBondContact O-CD1 3.46Å; V625-F650 HydrophobicContact CB-CE1 4.34Å; V625-F650 HydrophobicContact CB-CZ 4.49Å; V625-F650 HydrophobicContact CG2-CD1 4.47Å; V625-F650 HydrophobicContact CG2-CE1 3.62Å; V625-F650 HydrophobicContact CG2-CE2 4.28Å; V625-F650 HydrophobicContact CG2-CZ 3.52Å; H648-F650 HydrophobicContact CB-CE2 4.13Å; H648-F650 WeakPolarHBondContact O-CD2 3.25Å; F650-N652 VanDerWaalsContact C-N 3.34Å; F650-N652 PolarHBondContact O-N 3.02Å; F650-A653 WeakPolarHBondContact CA-O 3.18Å; F650-A653 WeakPolarHBondContact CB-O 3.46Å; F650-A653 PolarHBondContact N-O 3.21Å; F650-V655 HydrophobicContact CD2-CG2 4.21Å; F650-V655 HydrophobicContact CE2-CB 4.06Å; F650-V655 HydrophobicContact CE2-CG2 3.6Å; F650-V655 HydrophobicContact CZ-CG2 4.43Å
651	A	79.9	Confident	89.5	Confident	43 Å²	43	18 Å²	18	36%	0.355	10%	0.097	S	C	.	.	S	Bend	trans	-59.7	-43.9	178.3	0	0	0	0	0	112.4	R830	A651-R830 PolarHBondContact O-NH1 3.12Å
652	N	79.5	Confident	89.5	Confident	131 Å²	131	17.8 Å²	17.8	70%	0.701	10%	0.096	S	C	*	.	S	Bend	trans	-122.9	-2.3	-171	-61.7	-15.4	0	0	0	114.7	F650 F708	F650-N652 VanDerWaalsContact C-N 3.34Å; F650-N652 PolarHBondContact O-N 3.02Å; N652-F708 VanDerWaalsContact C-CD2 3.42Å; N652-F708 WeakPolarHBondContact O-CD2 3.47Å
653	A	86.5	Confident	89.4	Confident	4 Å²	4	19.1 Å²	19.1	3%	0.033	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	169.7	178.7	0	0	0	0	0	111.3	L622 F650 L705 L706	L622-A653 HydrophobicContact CD2-CB 4.02Å; F650-A653 WeakPolarHBondContact CA-O 3.18Å; F650-A653 WeakPolarHBondContact CB-O 3.46Å; F650-A653 PolarHBondContact N-O 3.21Å; A653-L705 HydrophobicContact CB-CD1 3.74Å; A653-L706 WeakPolarHBondContact CA-O 3.47Å
654	M	88.1	Confident	89.1	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	131.7	173.3	-173	176.5	-60.9	0	0	109.7	K647 H648 T649 L656 L706 F708 V753 D757	K647-M654 HydrophobicContact CB-SD 4.04Å; K647-M654 HydrophobicContact CD-SD 4.25Å; K647-M654 HydrophobicContact CG-SD 4.4Å; H648-M654 CarbonylContact O-C 3.54Å; H648-M654 WeakPolarHBondContact O-CA 3.46Å; T649-M654 HydrophobicContact CG2-CE 4.48Å; M654-L656 HydrophobicContact CG-CD2 4.19Å; M654-L656 HydrophobicContact SD-CD2 3.97Å; M654-L706 HydrophobicContact CB-CB 4.42Å; M654-L706 PolarHBondContact N-O 3.24Å; M654-L706 PolarHBondContact O-N 3.18Å; M654-F708 HydrophobicContact CB-CZ 4.25Å; M654-F708 HydrophobicContact CE-CE1 4.11Å; M654-F708 HydrophobicContact CE-CZ 3.93Å; M654-V753 HydrophobicContact CE-CG1 3.81Å; M654-V753 HydrophobicContact SD-CG1 4.31Å; M654-V753 HydrophobicContact SD-CG2 4.43Å; M654-D757 HydrophobicContact CE-CB 4.03Å
655	V	91.5	Very high	88.8	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	123.4	172.5	177.4	0	0	0	0	108.7	L613 F619 L622 H648 F650 F703 L705	L613-V655 HydrophobicContact CD2-CG1 3.97Å; F619-V655 HydrophobicContact CD1-CG2 4.3Å; F619-V655 HydrophobicContact CD2-CG1 4.36Å; F619-V655 HydrophobicContact CE1-CG2 4.49Å; F619-V655 HydrophobicContact CE2-CG1 3.99Å; F619-V655 HydrophobicContact CG-CG2 4.36Å; F619-V655 HydrophobicContact CZ-CG1 4.22Å; L622-V655 HydrophobicContact CD1-CG2 3.78Å; H648-V655 HydrophobicContact CB-CB 4.31Å; H648-V655 PolarHBondContact N-O 3.36Å; H648-V655 PolarHBondContact O-N 3.04Å; F650-V655 HydrophobicContact CD2-CG2 4.21Å; F650-V655 HydrophobicContact CE2-CB 4.06Å; F650-V655 HydrophobicContact CE2-CG2 3.6Å; F650-V655 HydrophobicContact CZ-CG2 4.43Å; V655-F703 HydrophobicContact CG1-CB 4.38Å; V655-F703 HydrophobicContact CG1-CD1 4.01Å; V655-L705 HydrophobicContact CG2-CD1 3.71Å
656	L	92	Very high	88.4	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	115.2	175.8	-58.4	175.5	0	0	0	108.7	M645 K647 M654 F658 L676 F703 S704 V751	M645-L656 HydrophobicContact SD-CD2 4.09Å; K647-L656 HydrophobicContact CB-CD2 4.12Å; K647-L656 HydrophobicContact CG-CD2 3.74Å; M654-L656 HydrophobicContact CG-CD2 4.19Å; M654-L656 HydrophobicContact SD-CD2 3.97Å; L656-F658 HydrophobicContact CB-CE2 3.68Å; L656-F658 HydrophobicContact CB-CZ 3.77Å; L656-F658 HydrophobicContact CD1-CZ 4.23Å; L656-L676 HydrophobicContact CD1-CD1 3.52Å; L656-F703 CarbonylContact O-C 3.57Å; L656-F703 VanDerWaalsContact O-CA 3.29Å; L656-F703 WeakPolarHBondContact O-CA 3.38Å; L656-S704 PolarHBondContact N-O 3.4Å; L656-S704 PolarHBondContact O-N 3.05Å; L656-V751 HydrophobicContact CD1-CG1 4.18Å
657	Q	92.7	Very high	88.2	Confident	4 Å²	4	27.2 Å²	27.2	2%	0.019	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	121.7	175.1	176.8	179.3	-3.3	0	0	109.2	M645 I646 H648 S701 F703	M645-Q657 CarbonylContact C-O 3.56Å; M645-Q657 VanDerWaalsContact CA-O 3.25Å; M645-Q657 WeakPolarHBondContact CA-O 3.17Å; I646-Q657 HydrophobicContact CB-CB 4.33Å; I646-Q657 PolarHBondContact N-O 3.4Å; I646-Q657 PolarHBondContact O-N 2.88Å; H648-Q657 PolarHBondContact NE2-OE1 3.36Å; H648-Q657 VanDerWaalsContact NE2-OE1 3.16Å; Q657-S701 PolarHBondContact NE2-OG 3.26Å; Q657-F703 HydrophobicContact CB-CD1 3.82Å; Q657-F703 HydrophobicContact CB-CE1 3.7Å; Q657-F703 HydrophobicContact CG-CD1 4.01Å; Q657-F703 HydrophobicContact CG-CE1 3.48Å; Q657-F703 VanDerWaalsContact CG-CE1 3.48Å; Q657-F703 HydrophobicContact CG-CZ 4.02Å
658	F	93.4	Very high	88.1	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	106.5	176.9	-57.9	-83.8	0	0	0	109.9	L634 V643 H644 M645 L656 C660 V674 L676 S701 A702 V751	L634-F658 HydrophobicContact CD1-CD1 3.89Å; L634-F658 HydrophobicContact CD1-CE1 3.75Å; V643-F658 HydrophobicContact CG1-CB 4.26Å; V643-F658 HydrophobicContact CG1-CD1 4.3Å; H644-F658 CarbonylContact O-C 3.57Å; H644-F658 WeakPolarHBondContact O-CA 3.25Å; M645-F658 HydrophobicContact CB-CD1 4.23Å; M645-F658 HydrophobicContact CB-CE1 4.31Å; M645-F658 HydrophobicContact CG-CD1 4.17Å; M645-F658 HydrophobicContact CG-CE1 3.92Å; M645-F658 HydrophobicContact SD-CE1 3.98Å; M645-F658 HydrophobicContact SD-CZ 4.42Å; L656-F658 HydrophobicContact CB-CE2 3.68Å; L656-F658 HydrophobicContact CB-CZ 3.77Å; L656-F658 HydrophobicContact CD1-CZ 4.23Å; F658-C660 PolarHBondContact O-N 3.2Å; F658-V674 HydrophobicContact CB-CG2 3.95Å; F658-V674 HydrophobicContact CD1-CB 4.4Å; F658-V674 HydrophobicContact CD1-CG1 4.21Å; F658-V674 HydrophobicContact CD1-CG2 4.05Å; F658-V674 HydrophobicContact CD2-CB 3.89Å; F658-V674 HydrophobicContact CD2-CG1 4.35Å; F658-V674 HydrophobicContact CD2-CG2 3.94Å; F658-V674 HydrophobicContact CE1-CB 4.46Å; F658-V674 HydrophobicContact CE1-CG1 3.92Å; F658-V674 HydrophobicContact CE2-CB 3.97Å; F658-V674 HydrophobicContact CE2-CG1 4.06Å; F658-V674 HydrophobicContact CE2-CG2 4.46Å; F658-V674 HydrophobicContact CG-CB 4.12Å; F658-V674 HydrophobicContact CG-CG1 4.42Å; F658-V674 HydrophobicContact CG-CG2 3.71Å; F658-V674 HydrophobicContact CZ-CB 4.26Å; F658-V674 HydrophobicContact CZ-CG1 3.84Å; F658-L676 HydrophobicContact CZ-CD2 4.13Å; F658-S701 CarbonylContact O-C 3.57Å; F658-S701 VanDerWaalsContact O-CA 3.25Å; F658-S701 WeakPolarHBondContact O-CA 3.34Å; F658-A702 HydrophobicContact CB-CB 4.42Å; F658-A702 PolarHBondContact N-O 3.44Å; F658-A702 PolarHBondContact O-N 3.35Å; F658-V751 HydrophobicContact CE1-CG2 4.41Å
659	E	92.5	Very high	88.1	Confident	32 Å²	32	28.3 Å²	28.3	15%	0.15	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	101.3	171.8	-65.5	-176.3	159.6	0	0	110.1	R631 V643 H644 V699 H700	R631-E659 IonicContact CZ-OE2 3.62Å; R631-E659 IonicContact NE-OE2 3.54Å; R631-E659 PolarHBondContact NE-OE2 2.93Å; R631-E659 IonicContact NH2-OE2 3.66Å; R631-E659 PolarHBondContact NH2-OE2 3.28Å; V643-E659 WeakPolarHBondContact CA-O 3.49Å; H644-E659 HydrophobicContact CB-CB 4.37Å; H644-E659 PolarHBondContact N-O 2.98Å; H644-E659 PolarHBondContact O-N 3.04Å; E659-V699 HydrophobicContact CB-CG1 4.04Å; E659-H700 WeakPolarHBondContact CA-O 3.33Å
660	C	92.4	Very high	88.3	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.014	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	134.8	-178.4	-58.2	0	0	0	0	110.3	F658 I691 L694 V699 H700	F658-C660 PolarHBondContact O-N 3.2Å; C660-I691 HydrophobicContact CB-CD1 4.01Å; C660-L694 HydrophobicContact CB-CD2 3.7Å; C660-V699 WeakPolarHBondContact O-CA 3.46Å; C660-H700 PolarHBondContact N-O 3.48Å; C660-H700 PolarHBondContact O-N 2.91Å; C660-H700 VanDerWaalsContact O-N 3.13Å
661	K	91.6	Very high	88.5	Confident	80 Å²	80	31.8 Å²	31.8	35%	0.348	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	125.3	173.5	-175.8	-178.1	-179.1	-178.6	0	110.1	T642 G697 E698 V699	T642-K661 PolarHBondContact N-O 2.81Å; T642-K661 PolarHBondContact O-N 3.37Å; K661-G697 WeakPolarHBondContact CE-O 3.42Å; K661-E698 WeakPolarHBondContact CG-O 3.44Å; K661-V699 HydrophobicContact CB-CG2 4.08Å; K661-V699 HydrophobicContact CD-CG2 4.06Å; K661-V699 HydrophobicContact CG-CG2 4.09Å
662	N	90.5	Very high	89.1	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	122.3	170.7	-178.8	12.3	0	0	0	110.3	M664 Q667 L669 L694 G697	N662-M664 PolarHBondContact ND2-O 3.04Å; N662-M664 WeakPolarHBondContact OD1-CB 3.43Å; N662-M664 PolarHBondContact OD1-N 3.41Å; N662-M664 PolarHBondContact OD1-O 2.96Å; N662-Q667 PolarHBondContact ND2-O 3.28Å; N662-L669 HydrophobicContact CB-CD1 4.07Å; N662-L669 HydrophobicContact CB-CG 4.34Å; N662-L694 HydrophobicContact CB-CD2 4.44Å; N662-L694 HydrophobicContact CB-CG 4.18Å; N662-G697 PolarHBondContact O-N 2.83Å
663	T	86.8	Confident	89.7	Confident	50 Å²	50	25 Å²	25	31%	0.307	13%	0.131	S	C	.	.			trans	-103.4	1.5	177.2	72.8	0	0	0	0	113.2	A639 E640 T642 Y696	A639-T663 PolarHBondContact O-OG1 3.32Å; E640-T663 VanDerWaalsContact C-OG1 3.24Å; E640-T663 PolarHBondContact O-N 2.92Å; E640-T663 PolarHBondContact O-OG1 3.41Å; T642-T663 WeakPolarHBondContact OG1-CG2 3.46Å; T663-Y696 VanDerWaalsContact O-CE2 3.3Å; T663-Y696 WeakPolarHBondContact O-CE2 3.26Å
664	M	85.2	Confident	89.9	Confident	53 Å²	53	25 Å²	25	26%	0.261	13%	0.131	S	C	.	.			trans	-94.3	123.1	175.8	-60.4	-61.1	-70.9	0	0	110.2	E640 Y641 N662 Q667 Y696	E640-M664 HydrophobicContact CB-CG 4.24Å; E640-M664 HydrophobicContact CB-SD 4.35Å; E640-M664 HydrophobicContact CG-SD 4.32Å; Y641-M664 HydrophobicContact CE1-CG 4.49Å; N662-M664 PolarHBondContact ND2-O 3.04Å; N662-M664 WeakPolarHBondContact OD1-CB 3.43Å; N662-M664 PolarHBondContact OD1-N 3.41Å; N662-M664 PolarHBondContact OD1-O 2.96Å; M664-Q667 HydrophobicContact CB-CB 4.32Å; M664-Q667 HydrophobicContact CB-CG 4.42Å; M664-Y696 VanDerWaalsContact C-CD2 3.45Å; M664-Y696 VanDerWaalsContact O-CD2 3.29Å; M664-Y696 WeakPolarHBondContact O-CD2 3.49Å
665	N	85	Confident	90	Very high	75 Å²	75	28.9 Å²	28.9	40%	0.401	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.3	-174.2	67.1	-32.8	0	0	0	114.2	Y696	N665-Y696 HydrophobicContact CB-CD1 3.97Å; N665-Y696 HydrophobicContact CB-CD2 3.8Å; N665-Y696 HydrophobicContact CB-CE1 3.95Å; N665-Y696 HydrophobicContact CB-CE2 3.77Å; N665-Y696 HydrophobicContact CB-CG 3.88Å
666	D	85	Confident	89.9	Confident	59 Å²	59	29.6 Å²	29.6	32%	0.316	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	2.4	176.9	58.5	-23.6	0	0	0	113	V729 P731	D666-V729 VanDerWaalsContact C-CG2 3.45Å; D666-V729 WeakPolarHBondContact CA-O 3.24Å; D666-V729 PolarHBondContact O-N 3.15Å; D666-P731 HydrophobicContact CB-CG 4.13Å
667	Q	86.3	Confident	89.7	Confident	22 Å²	22	34.7 Å²	34.7	10%	0.103	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	140.8	-175.4	-64	177.6	4.7	0	0	112.4	Y641 N662 M664 L669 V726	Y641-Q667 PolarHBondContact OH-OE1 3.41Å; N662-Q667 PolarHBondContact ND2-O 3.28Å; M664-Q667 HydrophobicContact CB-CB 4.32Å; M664-Q667 HydrophobicContact CB-CG 4.42Å; Q667-L669 HydrophobicContact CB-CD2 4.34Å; Q667-V726 HydrophobicContact CB-CG1 4.03Å; Q667-V726 HydrophobicContact CG-CG1 3.75Å
668	L	87.9	Confident	89.2	Confident	31 Å²	31	36 Å²	36	16%	0.162	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125.1	163.3	174.4	65.6	0	0	0	108.7	L670 P695 M727 V729	L668-L670 HydrophobicContact CD2-CD2 4.21Å; L668-L670 HydrophobicContact CG-CD2 4.25Å; L668-P695 HydrophobicContact CD1-CB 4.29Å; L668-P695 HydrophobicContact CD1-CG 4.15Å; L668-M727 HydrophobicContact CB-CB 4.39Å; L668-M727 HydrophobicContact CD2-SD 4.3Å; L668-M727 PolarHBondContact N-O 2.67Å; L668-M727 PolarHBondContact O-N 2.9Å; L668-V729 HydrophobicContact CB-CG1 3.77Å
669	L	90.1	Very high	88.3	Confident	1 Å²	1	41 Å²	41	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	134.1	179.3	-43.2	-178.1	0	0	0	110.3	Y641 N662 Q667 V672 K693 L694 F724 K725 V726	Y641-L669 HydrophobicContact CD1-CD1 3.69Å; Y641-L669 HydrophobicContact CE1-CD1 3.58Å; Y641-L669 HydrophobicContact CE1-CD2 3.99Å; Y641-L669 HydrophobicContact CE1-CG 4.34Å; N662-L669 HydrophobicContact CB-CD1 4.07Å; N662-L669 HydrophobicContact CB-CG 4.34Å; Q667-L669 HydrophobicContact CB-CD2 4.34Å; L669-V672 HydrophobicContact CB-CG2 3.64Å; L669-K693 CarbonylContact O-C 3.53Å; L669-K693 WeakPolarHBondContact O-CA 3.47Å; L669-L694 HydrophobicContact CB-CB 4.24Å; L669-L694 HydrophobicContact CD1-CD2 4.25Å; L669-L694 PolarHBondContact N-O 3.25Å; L669-L694 PolarHBondContact O-N 2.92Å; L669-F724 HydrophobicContact CB-CB 4.46Å; L669-F724 HydrophobicContact CB-CD2 4.34Å; L669-F724 HydrophobicContact CD1-CD2 4.24Å; L669-F724 HydrophobicContact CD1-CE2 4.39Å; L669-F724 HydrophobicContact CD1-CG 4.44Å; L669-F724 HydrophobicContact CD2-CD2 3.67Å; L669-F724 HydrophobicContact CD2-CE2 3.76Å; L669-F724 HydrophobicContact CG-CD2 4.29Å; L669-K725 CarbonylContact C-O 3.59Å; L669-K725 WeakPolarHBondContact CA-O 3.42Å; L669-V726 HydrophobicContact CD2-CG2 4.11Å
670	L	90.8	Very high	87.3	Confident	25 Å²	25	46 Å²	46	13%	0.131	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	151.2	178.9	-57.7	175.8	0	0	0	110.3	L668 V672 D692 K693 K725 M727 T741	L668-L670 HydrophobicContact CD2-CD2 4.21Å; L668-L670 HydrophobicContact CG-CD2 4.25Å; L670-V672 VanDerWaalsContact C-N 3.3Å; L670-V672 PolarHBondContact O-N 3.11Å; L670-D692 WeakPolarHBondContact CA-O 3.27Å; L670-K693 HydrophobicContact CD2-CB 4.18Å; L670-K693 HydrophobicContact CD2-CD 4.08Å; L670-K693 HydrophobicContact CD2-CG 3.62Å; L670-K725 HydrophobicContact CB-CB 4.26Å; L670-K725 PolarHBondContact N-O 2.82Å; L670-K725 PolarHBondContact O-N 3.43Å; L670-M727 HydrophobicContact CD1-CB 4.44Å; L670-M727 HydrophobicContact CD1-CE 3.81Å; L670-M727 HydrophobicContact CD1-SD 4.44Å; L670-T741 HydrophobicContact CD1-CG2 4.06Å
671	D	90.4	Very high	86.4	Confident	55 Å²	55	49 Å²	49	29%	0.294	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	49.8	46.2	178.6	-58.6	-29.5	0	0	0	113.1	S673 I691 D692 K725	D671-S673 PolarHBondContact O-N 2.67Å; D671-I691 CarbonylContact C-O 3.5Å; D671-I691 WeakPolarHBondContact CA-O 3.34Å; D671-I691 PolarHBondContact N-O 3.02Å; D671-D692 PolarHBondContact N-O 3.39Å; D671-K725 IonicContact OD2-NZ 3.35Å; D671-K725 PolarHBondContact OD2-NZ 2.86Å
672	V	92.3	Very high	85.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	122	-176.6	-170.1	0	0	0	0	109.9	L669 L670 Q690 I691 L694 L722 K723 F724	L669-V672 HydrophobicContact CB-CG2 3.64Å; L670-V672 VanDerWaalsContact C-N 3.3Å; L670-V672 PolarHBondContact O-N 3.11Å; V672-Q690 CarbonylContact O-C 3.41Å; V672-Q690 WeakPolarHBondContact O-CA 3.42Å; V672-Q690 WeakPolarHBondContact O-CB 3.4Å; V672-I691 HydrophobicContact CB-CB 4.1Å; V672-I691 HydrophobicContact CB-CD1 4.3Å; V672-I691 PolarHBondContact N-O 3.31Å; V672-I691 PolarHBondContact O-N 3.05Å; V672-L694 HydrophobicContact CG2-CB 4.13Å; V672-L694 HydrophobicContact CG2-CD2 4.43Å; V672-L722 HydrophobicContact CG1-CD1 3.59Å; V672-L722 HydrophobicContact CG1-CG 4.23Å; V672-K723 WeakPolarHBondContact CA-O 3.4Å; V672-F724 HydrophobicContact CB-CB 4.22Å; V672-F724 HydrophobicContact CG1-CB 4.23Å; V672-F724 HydrophobicContact CG2-CB 3.84Å
673	S	92.3	Very high	85.2	Confident	31 Å²	31	50.7 Å²	50.7	22%	0.217	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	158.4	177.8	58.1	0	0	0	0	110.9	D671 K723	D671-S673 PolarHBondContact O-N 2.67Å; S673-K723 PolarHBondContact N-O 2.8Å; S673-K723 PolarHBondContact O-N 3.46Å
674	V	92.1	Very high	84.8	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.024	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	117.6	174.4	-179	0	0	0	0	108	F658 L676 S704 A720 I721 L722 L748	F658-V674 HydrophobicContact CB-CG2 3.95Å; F658-V674 HydrophobicContact CD1-CB 4.4Å; F658-V674 HydrophobicContact CD1-CG1 4.21Å; F658-V674 HydrophobicContact CD1-CG2 4.05Å; F658-V674 HydrophobicContact CD2-CB 3.89Å; F658-V674 HydrophobicContact CD2-CG1 4.35Å; F658-V674 HydrophobicContact CD2-CG2 3.94Å; F658-V674 HydrophobicContact CE1-CB 4.46Å; F658-V674 HydrophobicContact CE1-CG1 3.92Å; F658-V674 HydrophobicContact CE2-CB 3.97Å; F658-V674 HydrophobicContact CE2-CG1 4.06Å; F658-V674 HydrophobicContact CE2-CG2 4.46Å; F658-V674 HydrophobicContact CG-CB 4.12Å; F658-V674 HydrophobicContact CG-CG1 4.42Å; F658-V674 HydrophobicContact CG-CG2 3.71Å; F658-V674 HydrophobicContact CZ-CB 4.26Å; F658-V674 HydrophobicContact CZ-CG1 3.84Å; V674-L676 HydrophobicContact CG1-CD2 4.35Å; V674-S704 PolarHBondContact O-OG 3.28Å; V674-A720 HydrophobicContact CG1-CB 4.22Å; V674-I721 WeakPolarHBondContact CA-O 3.5Å; V674-L722 HydrophobicContact CG2-CD1 3.62Å; V674-L748 HydrophobicContact CG1-CD1 4.18Å; V674-L748 HydrophobicContact CG2-CD1 4.38Å
675	E	90.1	Very high	84.6	Confident	82 Å²	82	55.4 Å²	55.4	38%	0.383	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	137.7	171.8	-169.7	173.1	-150.2	0	0	109.5	I721 K723	E675-I721 PolarHBondContact N-O 2.73Å; E675-I721 PolarHBondContact O-N 3.4Å; E675-K723 HydrophobicContact CB-CD 4.48Å; E675-K723 IonicContact OE1-NZ 2.93Å; E675-K723 WeakPolarHBondContact OE2-CE 3.28Å; E675-K723 IonicContact OE2-NZ 3.38Å; E675-K723 PolarHBondContact OE2-NZ 3.43Å
676	L	89.6	Confident	84.4	Confident	16 Å²	16	53.4 Å²	53.4	8%	0.084	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.6	178.9	-62	169.5	0	0	0	108.1	L656 F658 V674 G719 A720 V751	L656-L676 HydrophobicContact CD1-CD1 3.52Å; F658-L676 HydrophobicContact CZ-CD2 4.13Å; V674-L676 HydrophobicContact CG1-CD2 4.35Å; L676-G719 CarbonylContact C-O 3.57Å; L676-G719 WeakPolarHBondContact CA-O 3.32Å; L676-A720 HydrophobicContact CD2-CB 3.96Å; L676-V751 HydrophobicContact CD2-CG2 4.31Å
677	E	86.8	Confident	84.3	Confident	106 Å²	106	54.9 Å²	54.9	50%	0.495	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	117.2	175.7	-66.3	-174.4	170	0	0	108.4	P679 G719 I721	E677-P679 WeakPolarHBondContact O-CD 3.37Å; E677-G719 PolarHBondContact N-O 2.88Å; E677-G719 PolarHBondContact O-N 3.38Å; E677-I721 HydrophobicContact CG-CD1 4.35Å; E677-I721 WeakPolarHBondContact OE1-CD1 3.39Å
678	D	82.8	Confident	84.3	Confident	33 Å²	33	57.5 Å²	57.5	18%	0.176	33%	0.328	C	S	.	.			trans	-93.3	114.9	170.9	-176.3	5.6	0	0	0	109.5	D680 G681 E682 W683 L718	D678-D680 PolarHBondContact O-N 3.21Å; D678-D680 PolarHBondContact OD1-N 3.39Å; D678-G681 VanDerWaalsContact CG-N 3.29Å; D678-G681 PolarHBondContact O-N 3.44Å; D678-G681 WeakPolarHBondContact OD2-CA 3.35Å; D678-G681 PolarHBondContact OD2-N 2.97Å; D678-G681 VanDerWaalsContact OD2-N 3.16Å; D678-E682 PolarHBondContact OD2-N 3.1Å; D678-W683 HydrophobicContact CB-CB 4.32Å; D678-W683 WeakPolarHBondContact OD2-CB 3.4Å; D678-W683 PolarHBondContact OD2-N 2.95Å; D678-L718 HydrophobicContact CB-CD2 3.58Å
679	P	73.7	Confident	84.3	Confident	105 Å²	105	57.7 Å²	57.7	68%	0.682	33%	0.33	S	S	*	.	S	Bend	trans	-62	-30.3	176.6	-20	32.4	0	0	0	113.4	E677	E677-P679 WeakPolarHBondContact O-CD 3.37Å
680	D	72	Confident	84.4	Confident	137 Å²	137	62.1 Å²	62.1	73%	0.733	35%	0.351	S	S	*	.	S	Bend	trans	-93.8	-17.1	-174.5	-66	-39.8	0	0	0	112.4	D678 E682	D678-D680 PolarHBondContact O-N 3.21Å; D678-D680 PolarHBondContact OD1-N 3.39Å; D680-E682 VanDerWaalsContact C-N 3.31Å; D680-E682 PolarHBondContact O-N 3.48Å
681	G	73.4	Confident	84.4	Confident	63 Å²	63	61.4 Å²	61.4	65%	0.649	35%	0.347	S	S	*	.	S	Bend	trans	69.7	22.2	175.6	0	0	0	0	0	114.8	D678	D678-G681 VanDerWaalsContact CG-N 3.29Å; D678-G681 PolarHBondContact O-N 3.44Å; D678-G681 WeakPolarHBondContact OD2-CA 3.35Å; D678-G681 PolarHBondContact OD2-N 2.97Å; D678-G681 VanDerWaalsContact OD2-N 3.16Å
682	E	76.3	Confident	84.4	Confident	98 Å²	98	64 Å²	64	46%	0.458	36%	0.361	S	S	.	.			trans	-87.2	-28.8	177	-63.3	-161.8	166.1	0	0	112.5	D678 D680 P709 A713	D678-E682 PolarHBondContact OD2-N 3.1Å; D680-E682 VanDerWaalsContact C-N 3.31Å; D680-E682 PolarHBondContact O-N 3.48Å; E682-P709 HydrophobicContact CB-CG 4.41Å; E682-P709 WeakPolarHBondContact O-CB 3.35Å; E682-P709 VanDerWaalsContact O-CG 3.27Å; E682-P709 WeakPolarHBondContact O-CG 3.33Å; E682-A713 VanDerWaalsContact OE2-CB 3.31Å; E682-A713 WeakPolarHBondContact OE2-CB 3.5Å
683	W	80.5	Confident	84.4	Confident	18 Å²	18	70.3 Å²	70.3	7%	0.068	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-96	120.5	-175.6	-66.3	88.8	0	0	0	112.1	D678 L706 F708 P709 L718 V753	D678-W683 HydrophobicContact CB-CB 4.32Å; D678-W683 WeakPolarHBondContact OD2-CB 3.4Å; D678-W683 PolarHBondContact OD2-N 2.95Å; W683-L706 HydrophobicContact CB-CD1 4.06Å; W683-L706 HydrophobicContact CD2-CD2 4.18Å; W683-L706 HydrophobicContact CD2-CG 4.49Å; W683-L706 HydrophobicContact CE3-CD1 4.09Å; W683-L706 HydrophobicContact CE3-CD2 3.38Å; W683-L706 HydrophobicContact CE3-CG 3.56Å; W683-L706 HydrophobicContact CZ3-CD2 3.58Å; W683-L706 HydrophobicContact CZ3-CG 4.03Å; W683-F708 AromaticContact CH2-CD1 3.9Å; W683-F708 HydrophobicContact CH2-CD1 3.9Å; W683-F708 HydrophobicContact CH2-CE1 4.14Å; W683-F708 AromaticContact CZ3-CD1 3.75Å; W683-F708 HydrophobicContact CZ3-CD1 3.75Å; W683-F708 HydrophobicContact CZ3-CE1 4.15Å; W683-P709 HydrophobicContact CD2-CG 3.92Å; W683-P709 HydrophobicContact CE3-CG 4.05Å; W683-P709 HydrophobicContact CG-CG 4.27Å; W683-L718 HydrophobicContact CB-CD2 4.01Å; W683-L718 HydrophobicContact CG-CD2 4.11Å; W683-V753 HydrophobicContact CH2-CB 4.32Å; W683-V753 HydrophobicContact CH2-CG1 3.82Å; W683-V753 HydrophobicContact CZ2-CB 4.36Å; W683-V753 HydrophobicContact CZ2-CG1 4.26Å
684	E	78.5	Confident	84.2	Confident	145 Å²	145	68.9 Å²	68.9	68%	0.678	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	126	176.2	-66.3	-168.6	171.6	0	0	111.4	E707	E684-E707 PolarHBondContact O-N 2.83Å
685	T	81.6	Confident	84.1	Confident	58 Å²	58	70.7 Å²	70.7	36%	0.356	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	116.7	172.3	-57.1	0	0	0	0	109.3	T688 L705	T685-T688 HydrophobicContact CG2-CG2 3.91Å; T685-L705 CarbonylContact C-O 3.5Å; T685-L705 WeakPolarHBondContact CA-O 3.36Å
686	G	80.7	Confident	83.9	Confident	33 Å²	33	73.3 Å²	73.3	34%	0.34	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-132.6	176.8	0	0	0	0	0	112.6	T688 L705	G686-T688 PolarHBondContact O-N 3.49Å; G686-L705 PolarHBondContact N-O 3.13Å
687	N	82.6	Confident	83.6	Confident	89 Å²	89	74.2 Å²	74.2	48%	0.476	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	129.4	-178.4	-69.1	-39.4	0	0	0	112.5	Q618 F619 L705	Q618-N687 HydrophobicContact CB-CB 4.39Å; F619-N687 HydrophobicContact CE1-CB 4.41Å; N687-L705 VanDerWaalsContact O-CB 3.3Å; N687-L705 WeakPolarHBondContact O-CB 3.42Å; N687-L705 PolarHBondContact O-N 2.85Å
688	T	85.6	Confident	83.6	Confident	78 Å²	78	73.9 Å²	73.9	48%	0.479	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	145.6	171	57.4	0	0	0	0	111.2	T685 G686 F703	T685-T688 HydrophobicContact CG2-CG2 3.91Å; G686-T688 PolarHBondContact O-N 3.49Å; T688-F703 CarbonylContact C-O 3.59Å; T688-F703 VanDerWaalsContact CA-O 3.29Å; T688-F703 WeakPolarHBondContact CA-O 3.48Å
689	V	88.9	Confident	83.9	Confident	34 Å²	34	75.6 Å²	75.6	21%	0.206	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	112.9	175.5	-177.8	0	0	0	0	107.6	I616 F619 A702 F703	I616-V689 HydrophobicContact CG2-CG2 4.23Å; F619-V689 HydrophobicContact CE2-CG2 4.15Å; F619-V689 HydrophobicContact CZ-CG2 3.91Å; V689-A702 CarbonylContact O-C 3.56Å; V689-A702 VanDerWaalsContact O-CA 3.31Å; V689-A702 WeakPolarHBondContact O-CA 3.32Å; V689-F703 HydrophobicContact CB-CB 4.08Å; V689-F703 HydrophobicContact CB-CD2 4.14Å; V689-F703 HydrophobicContact CG1-CD2 4.32Å; V689-F703 HydrophobicContact CG2-CB 4.37Å; V689-F703 PolarHBondContact N-O 3.46Å; V689-F703 PolarHBondContact O-N 3.05Å
690	Q	91.3	Very high	84.7	Confident	94 Å²	94	74 Å²	74	44%	0.439	40%	0.404	S	S	.	.			trans	-87.1	161.9	179.4	66.7	-175.1	9	0	0	112.1	V672	V672-Q690 CarbonylContact O-C 3.41Å; V672-Q690 WeakPolarHBondContact O-CA 3.42Å; V672-Q690 WeakPolarHBondContact O-CB 3.4Å
691	I	91.4	Very high	85.6	Confident	10 Å²	10	69.2 Å²	69.2	5%	0.051	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	119.6	172.3	-57	159	0	0	0	108.4	C660 D671 V672 K693 L694 H700 A702	C660-I691 HydrophobicContact CB-CD1 4.01Å; D671-I691 CarbonylContact C-O 3.5Å; D671-I691 WeakPolarHBondContact CA-O 3.34Å; D671-I691 PolarHBondContact N-O 3.02Å; V672-I691 HydrophobicContact CB-CB 4.1Å; V672-I691 HydrophobicContact CB-CD1 4.3Å; V672-I691 PolarHBondContact N-O 3.31Å; V672-I691 PolarHBondContact O-N 3.05Å; I691-K693 WeakPolarHBondContact CG2-O 3.47Å; I691-L694 HydrophobicContact CG2-CB 4.24Å; I691-H700 HydrophobicContact CD1-CB 3.88Å; I691-H700 HydrophobicContact CG1-CB 4.03Å; I691-H700 HydrophobicContact CG2-CB 3.64Å; I691-A702 HydrophobicContact CD1-CB 4.02Å; I691-A702 HydrophobicContact CG1-CB 4.03Å
692	D	91	Very high	86.5	Confident	110 Å²	110	66.2 Å²	66.2	59%	0.588	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.3	-43.8	-178.7	-63	-27.8	0	0	0	112.6	L670 D671	L670-D692 WeakPolarHBondContact CA-O 3.27Å; D671-D692 PolarHBondContact N-O 3.39Å
693	K	90.3	Very high	87.3	Confident	132 Å²	132	62.5 Å²	62.5	57%	0.574	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.7	133.7	180	-54.6	-164.2	173.1	-173.5	0	111	L669 L670 I691 H700	L669-K693 CarbonylContact O-C 3.53Å; L669-K693 WeakPolarHBondContact O-CA 3.47Å; L670-K693 HydrophobicContact CD2-CB 4.18Å; L670-K693 HydrophobicContact CD2-CD 4.08Å; L670-K693 HydrophobicContact CD2-CG 3.62Å; I691-K693 WeakPolarHBondContact CG2-O 3.47Å; K693-H700 PolarHBondContact O-CE1 2.86Å; K693-H700 VanDerWaalsContact O-CE1 3.27Å; K693-H700 PolarHBondContact O-ND1 3.48Å
694	L	89.7	Confident	87.8	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	94.2	175.8	-179.3	59.6	0	0	0	110.7	C660 N662 L669 V672 I691 E698 H700	C660-L694 HydrophobicContact CB-CD2 3.7Å; N662-L694 HydrophobicContact CB-CD2 4.44Å; N662-L694 HydrophobicContact CB-CG 4.18Å; L669-L694 HydrophobicContact CB-CB 4.24Å; L669-L694 HydrophobicContact CD1-CD2 4.25Å; L669-L694 PolarHBondContact N-O 3.25Å; L669-L694 PolarHBondContact O-N 2.92Å; V672-L694 HydrophobicContact CG2-CB 4.13Å; V672-L694 HydrophobicContact CG2-CD2 4.43Å; I691-L694 HydrophobicContact CG2-CB 4.24Å; L694-E698 WeakPolarHBondContact CD1-O 3.29Å; L694-H700 HydrophobicContact CD1-CB 4.02Å
695	P	89.2	Confident	88.3	Confident	41 Å²	41	55.1 Å²	55.1	27%	0.266	30%	0.299	S	S	.	.			trans	-69.5	163.8	177.1	-20.3	34.3	0	0	0	114	L668 G697 E698	L668-P695 HydrophobicContact CD1-CB 4.29Å; L668-P695 HydrophobicContact CD1-CG 4.15Å; P695-G697 PolarHBondContact O-N 3.22Å; P695-E698 HydrophobicContact CB-CG 4.37Å; P695-E698 WeakPolarHBondContact CG-OE2 3.37Å; P695-E698 PolarHBondContact O-N 3.01Å
696	Y	86.9	Confident	88.6	Confident	137 Å²	137	52.4 Å²	52.4	54%	0.537	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-56.4	128	174.8	170.7	-112.5	0	0	0	112.2	T663 M664 N665 E698	T663-Y696 VanDerWaalsContact O-CE2 3.3Å; T663-Y696 WeakPolarHBondContact O-CE2 3.26Å; M664-Y696 VanDerWaalsContact C-CD2 3.45Å; M664-Y696 VanDerWaalsContact O-CD2 3.29Å; M664-Y696 WeakPolarHBondContact O-CD2 3.49Å; N665-Y696 HydrophobicContact CB-CD1 3.97Å; N665-Y696 HydrophobicContact CB-CD2 3.8Å; N665-Y696 HydrophobicContact CB-CE1 3.95Å; N665-Y696 HydrophobicContact CB-CE2 3.77Å; N665-Y696 HydrophobicContact CB-CG 3.88Å; Y696-E698 PolarHBondContact O-N 2.99Å
697	G	82.6	Confident	88.9	Confident	36 Å²	36	55.5 Å²	55.5	37%	0.371	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	-9.9	173.5	0	0	0	0	0	115.6	K661 N662 P695	K661-G697 WeakPolarHBondContact CE-O 3.42Å; N662-G697 PolarHBondContact O-N 2.83Å; P695-G697 PolarHBondContact O-N 3.22Å
698	E	86.8	Confident	88.9	Confident	99 Å²	99	52.4 Å²	52.4	46%	0.463	27%	0.271	S	S	.	.			trans	-87	155.4	176	-63.6	-169.3	168.5	0	0	111.9	K661 L694 P695 Y696 H700	K661-E698 WeakPolarHBondContact CG-O 3.44Å; L694-E698 WeakPolarHBondContact CD1-O 3.29Å; P695-E698 HydrophobicContact CB-CG 4.37Å; P695-E698 WeakPolarHBondContact CG-OE2 3.37Å; P695-E698 PolarHBondContact O-N 3.01Å; Y696-E698 PolarHBondContact O-N 2.99Å; E698-H700 IonicContact OE2-NE2 3.35Å
699	V	88.9	Confident	88.6	Confident	68 Å²	68	49.5 Å²	49.5	41%	0.412	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	114.7	179.9	-174.6	0	0	0	0	108.7	E659 C660 K661	E659-V699 HydrophobicContact CB-CG1 4.04Å; C660-V699 WeakPolarHBondContact O-CA 3.46Å; K661-V699 HydrophobicContact CB-CG2 4.08Å; K661-V699 HydrophobicContact CD-CG2 4.06Å; K661-V699 HydrophobicContact CG-CG2 4.09Å
700	H	90.7	Very high	87.7	Confident	73 Å²	73	56.4 Å²	56.4	34%	0.338	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	161.3	172.3	-66.2	170.7	0	0	0	110.5	E659 C660 I691 K693 L694 E698	E659-H700 WeakPolarHBondContact CA-O 3.33Å; C660-H700 PolarHBondContact N-O 3.48Å; C660-H700 PolarHBondContact O-N 2.91Å; C660-H700 VanDerWaalsContact O-N 3.13Å; I691-H700 HydrophobicContact CD1-CB 3.88Å; I691-H700 HydrophobicContact CG1-CB 4.03Å; I691-H700 HydrophobicContact CG2-CB 3.64Å; K693-H700 PolarHBondContact O-CE1 2.86Å; K693-H700 VanDerWaalsContact O-CE1 3.27Å; K693-H700 PolarHBondContact O-ND1 3.48Å; L694-H700 HydrophobicContact CD1-CB 4.02Å; E698-H700 IonicContact OE2-NE2 3.35Å
701	S	91.6	Very high	86.6	Confident	35 Å²	35	55.8 Å²	55.8	25%	0.245	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126.1	-178	-60.4	0	0	0	0	111.9	Q657 F658	Q657-S701 PolarHBondContact NE2-OG 3.26Å; F658-S701 CarbonylContact O-C 3.57Å; F658-S701 VanDerWaalsContact O-CA 3.25Å; F658-S701 WeakPolarHBondContact O-CA 3.34Å
702	A	91.8	Very high	85.5	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.008	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	156.3	162.6	0	0	0	0	0	109.3	F658 V689 I691	F658-A702 HydrophobicContact CB-CB 4.42Å; F658-A702 PolarHBondContact N-O 3.44Å; F658-A702 PolarHBondContact O-N 3.35Å; V689-A702 CarbonylContact O-C 3.56Å; V689-A702 VanDerWaalsContact O-CA 3.31Å; V689-A702 WeakPolarHBondContact O-CA 3.32Å; I691-A702 HydrophobicContact CD1-CB 4.02Å; I691-A702 HydrophobicContact CG1-CB 4.03Å
703	F	92.3	Very high	84.4	Confident	19 Å²	19	52.4 Å²	52.4	8%	0.083	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	141.5	179.2	-57.6	-95.1	0	0	0	111.4	L613 I616 F619 V655 L656 Q657 T688 V689	L613-F703 HydrophobicContact CD2-CD1 3.99Å; L613-F703 HydrophobicContact CD2-CE1 3.74Å; I616-F703 HydrophobicContact CD1-CD1 4.4Å; I616-F703 HydrophobicContact CD1-CD2 3.89Å; I616-F703 HydrophobicContact CD1-CE1 4.18Å; I616-F703 HydrophobicContact CD1-CE2 3.66Å; I616-F703 HydrophobicContact CD1-CG 4.26Å; I616-F703 HydrophobicContact CD1-CZ 3.82Å; F619-F703 HydrophobicContact CE2-CB 3.64Å; F619-F703 HydrophobicContact CE2-CD1 4.27Å; F619-F703 AromaticContact CE2-CG 3.96Å; F619-F703 HydrophobicContact CE2-CG 3.96Å; F619-F703 HydrophobicContact CZ-CB 3.76Å; V655-F703 HydrophobicContact CG1-CB 4.38Å; V655-F703 HydrophobicContact CG1-CD1 4.01Å; L656-F703 CarbonylContact O-C 3.57Å; L656-F703 VanDerWaalsContact O-CA 3.29Å; L656-F703 WeakPolarHBondContact O-CA 3.38Å; Q657-F703 HydrophobicContact CB-CD1 3.82Å; Q657-F703 HydrophobicContact CB-CE1 3.7Å; Q657-F703 HydrophobicContact CG-CD1 4.01Å; Q657-F703 HydrophobicContact CG-CE1 3.48Å; Q657-F703 VanDerWaalsContact CG-CE1 3.48Å; Q657-F703 HydrophobicContact CG-CZ 4.02Å; T688-F703 CarbonylContact C-O 3.59Å; T688-F703 VanDerWaalsContact CA-O 3.29Å; T688-F703 WeakPolarHBondContact CA-O 3.48Å; V689-F703 HydrophobicContact CB-CB 4.08Å; V689-F703 HydrophobicContact CB-CD2 4.14Å; V689-F703 HydrophobicContact CG1-CD2 4.32Å; V689-F703 HydrophobicContact CG2-CB 4.37Å; V689-F703 PolarHBondContact N-O 3.46Å; V689-F703 PolarHBondContact O-N 3.05Å
704	S	90.8	Very high	83.7	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.014	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128.1	171	-57.1	0	0	0	0	109.9	L656 V674	L656-S704 PolarHBondContact N-O 3.4Å; L656-S704 PolarHBondContact O-N 3.05Å; V674-S704 PolarHBondContact O-OG 3.28Å
705	L	90.1	Very high	83.3	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	128.6	173	-178.7	66.7	0	0	0	109.7	F619 L622 A653 V655 T685 G686 N687	F619-L705 HydrophobicContact CE1-CB 4.04Å; L622-L705 HydrophobicContact CD1-CD1 3.64Å; L622-L705 HydrophobicContact CD2-CD1 4.26Å; A653-L705 HydrophobicContact CB-CD1 3.74Å; V655-L705 HydrophobicContact CG2-CD1 3.71Å; T685-L705 CarbonylContact C-O 3.5Å; T685-L705 WeakPolarHBondContact CA-O 3.36Å; G686-L705 PolarHBondContact N-O 3.13Å; N687-L705 VanDerWaalsContact O-CB 3.3Å; N687-L705 WeakPolarHBondContact O-CB 3.42Å; N687-L705 PolarHBondContact O-N 2.85Å
706	L	88.5	Confident	83	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	117.9	175.5	-166.7	71.5	0	0	0	108.2	A653 M654 W683 L718 V753	A653-L706 WeakPolarHBondContact CA-O 3.47Å; M654-L706 HydrophobicContact CB-CB 4.42Å; M654-L706 PolarHBondContact N-O 3.24Å; M654-L706 PolarHBondContact O-N 3.18Å; W683-L706 HydrophobicContact CB-CD1 4.06Å; W683-L706 HydrophobicContact CD2-CD2 4.18Å; W683-L706 HydrophobicContact CD2-CG 4.49Å; W683-L706 HydrophobicContact CE3-CD1 4.09Å; W683-L706 HydrophobicContact CE3-CD2 3.38Å; W683-L706 HydrophobicContact CE3-CG 3.56Å; W683-L706 HydrophobicContact CZ3-CD2 3.58Å; W683-L706 HydrophobicContact CZ3-CG 4.03Å; L706-L718 HydrophobicContact CD1-CD1 4.06Å; L706-L718 HydrophobicContact CD2-CD1 3.84Å; L706-V753 HydrophobicContact CD2-CG2 4.12Å
707	E	85.4	Confident	83	Confident	99 Å²	99	43.5 Å²	43.5	46%	0.463	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	141	176.1	-64	-168.5	174.6	0	0	109.7	E684	E684-E707 PolarHBondContact O-N 2.83Å
708	F	83.8	Confident	83.4	Confident	23 Å²	23	41.9 Å²	41.9	10%	0.101	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-71.5	131.9	177.1	-73.2	-66.7	0	0	0	109.7	T649 N652 M654 W683 R830	T649-F708 HydrophobicContact CG2-CE2 4.42Å; T649-F708 HydrophobicContact CG2-CZ 4.09Å; N652-F708 VanDerWaalsContact C-CD2 3.42Å; N652-F708 WeakPolarHBondContact O-CD2 3.47Å; M654-F708 HydrophobicContact CB-CZ 4.25Å; M654-F708 HydrophobicContact CE-CE1 4.11Å; M654-F708 HydrophobicContact CE-CZ 3.93Å; W683-F708 AromaticContact CH2-CD1 3.9Å; W683-F708 HydrophobicContact CH2-CD1 3.9Å; W683-F708 HydrophobicContact CH2-CE1 4.14Å; W683-F708 AromaticContact CZ3-CD1 3.75Å; W683-F708 HydrophobicContact CZ3-CD1 3.75Å; W683-F708 HydrophobicContact CZ3-CE1 4.15Å; F708-R830 VanDerWaalsContact CG-NH2 3.34Å
709	P	79.1	Confident	83.5	Confident	18 Å²	18	38.2 Å²	38.2	12%	0.117	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-60.4	143.8	-177.2	-24.7	33.8	0	0	0	113.4	E682 W683 S711 G712 A713	E682-P709 HydrophobicContact CB-CG 4.41Å; E682-P709 WeakPolarHBondContact O-CB 3.35Å; E682-P709 VanDerWaalsContact O-CG 3.27Å; E682-P709 WeakPolarHBondContact O-CG 3.33Å; W683-P709 HydrophobicContact CD2-CG 3.92Å; W683-P709 HydrophobicContact CE3-CG 4.05Å; W683-P709 HydrophobicContact CG-CG 4.27Å; P709-S711 WeakPolarHBondContact CB-OG 3.39Å; P709-S711 PolarHBondContact O-N 3.47Å; P709-G712 PolarHBondContact O-N 3.19Å; P709-A713 HydrophobicContact CB-CB 4.47Å; P709-A713 HydrophobicContact CG-CB 4.24Å
710	D	70.3	Confident	83.6	Confident	178 Å²	178	35 Å²	35	95%	0.952	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-19.7	171.9	-78.1	-24	0	0	0	112.6	G712	D710-G712 PolarHBondContact O-N 2.85Å
711	S	67.1	Low	83.7	Confident	82 Å²	82	33 Å²	33	57%	0.573	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-17.6	172.9	65.3	0	0	0	0	112.9	P709 A713	P709-S711 WeakPolarHBondContact CB-OG 3.39Å; P709-S711 PolarHBondContact O-N 3.47Å; S711-A713 PolarHBondContact OG-N 3.14Å
712	G	67.8	Low	83.8	Confident	28 Å²	28	31.4 Å²	31.4	29%	0.289	20%	0.198	S	C	.	.			trans	85.2	5.3	-175.1	0	0	0	0	0	114.1	P709 D710 I714 L866	P709-G712 PolarHBondContact O-N 3.19Å; D710-G712 PolarHBondContact O-N 2.85Å; G712-I714 PolarHBondContact O-N 3.43Å; G712-L866 WeakPolarHBondContact O-CD2 3.5Å
713	A	69.7	Low	83.8	Confident	21 Å²	21	35.2 Å²	35.2	17%	0.174	22%	0.215	C	C	.	.			trans	-60.4	135.1	175.2	0	0	0	0	0	111.3	E682 P709 S711	E682-A713 VanDerWaalsContact OE2-CB 3.31Å; E682-A713 WeakPolarHBondContact OE2-CB 3.5Å; P709-A713 HydrophobicContact CB-CB 4.47Å; P709-A713 HydrophobicContact CG-CB 4.24Å; S711-A713 PolarHBondContact OG-N 3.14Å
714	I	74.3	Confident	83.9	Confident	3 Å²	3	34.6 Å²	34.6	2%	0.015	21%	0.212	C	C	.	.			trans	-131	8.4	-179.2	57.3	159.5	0	0	0	113	G712 V755 F829 L866	G712-I714 PolarHBondContact O-N 3.43Å; I714-V755 HydrophobicContact CD1-CB 3.95Å; I714-V755 HydrophobicContact CD1-CG1 3.65Å; I714-V755 HydrophobicContact CD1-CG2 3.5Å; I714-V755 HydrophobicContact CG1-CG2 3.83Å; I714-F829 HydrophobicContact CD1-CE2 4.06Å; I714-F829 HydrophobicContact CD1-CZ 4.41Å; I714-F829 HydrophobicContact CG2-CZ 4.44Å; I714-L866 HydrophobicContact CD1-CB 3.66Å; I714-L866 HydrophobicContact CD1-CD1 4.41Å; I714-L866 HydrophobicContact CD1-CG 4.45Å; I714-L866 HydrophobicContact CG1-CB 4.2Å; I714-L866 HydrophobicContact CG1-CD2 4.24Å; I714-L866 HydrophobicContact CG2-CD1 4.22Å
715	S	81.4	Confident	83.9	Confident	63 Å²	63	37.4 Å²	37.4	44%	0.441	22%	0.224	S	C	.	.			trans	-138.3	144.2	174.4	53	0	0	0	0	110	V753	S715-V753 CarbonylContact C-O 3.36Å; S715-V753 WeakPolarHBondContact CA-O 3.48Å
716	G	83.2	Confident	83.9	Confident	23 Å²	23	37.1 Å²	37.1	24%	0.237	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.7	154.9	178.8	0	0	0	0	0	111.4	D752 V753	G716-D752 CarbonylContact O-C 3.57Å; G716-V753 PolarHBondContact N-O 2.89Å; G716-V753 VanDerWaalsContact N-O 3.09Å; G716-V753 PolarHBondContact O-N 3.47Å
717	S	87.1	Confident	83.9	Confident	36 Å²	36	38.2 Å²	38.2	25%	0.252	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.4	171	177.7	0	0	0	0	109	E750 D752	S717-E750 WeakPolarHBondContact OG-CB 3.43Å; S717-E750 PolarHBondContact OG-OE2 2.73Å; S717-D752 WeakPolarHBondContact CB-OD1 3.3Å; S717-D752 PolarHBondContact OG-OD1 3.48Å
718	L	89.8	Confident	83.9	Confident	2 Å²	2	36.5 Å²	36.5	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	128.9	-179.3	-58	170.2	0	0	0	109.4	D678 W683 L706 E750 V751 V753	D678-L718 HydrophobicContact CB-CD2 3.58Å; W683-L718 HydrophobicContact CB-CD2 4.01Å; W683-L718 HydrophobicContact CG-CD2 4.11Å; L706-L718 HydrophobicContact CD1-CD1 4.06Å; L706-L718 HydrophobicContact CD2-CD1 3.84Å; L718-E750 WeakPolarHBondContact O-CA 3.21Å; L718-V751 HydrophobicContact CB-CB 4.28Å; L718-V751 PolarHBondContact N-O 2.98Å; L718-V751 PolarHBondContact O-N 2.89Å; L718-V753 HydrophobicContact CD1-CG2 4.49Å
719	G	89.7	Confident	83.9	Confident	22 Å²	22	36 Å²	36	23%	0.227	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	136	168.3	0	0	0	0	0	110	L676 E677	L676-G719 CarbonylContact C-O 3.57Å; L676-G719 WeakPolarHBondContact CA-O 3.32Å; E677-G719 PolarHBondContact N-O 2.88Å; E677-G719 PolarHBondContact O-N 3.38Å
720	A	92.1	Very high	83.8	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.008	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	126.9	179.5	0	0	0	0	0	111.2	V674 L676 L748 V751	V674-A720 HydrophobicContact CG1-CB 4.22Å; L676-A720 HydrophobicContact CD2-CB 3.96Å; A720-L748 HydrophobicContact CB-CB 3.97Å; A720-L748 HydrophobicContact CB-CD1 4.19Å; A720-L748 WeakPolarHBondContact O-CB 3.22Å; A720-L748 PolarHBondContact O-N 2.91Å; A720-V751 HydrophobicContact CB-CG2 3.85Å
721	I	92.3	Very high	83.8	Confident	29 Å²	29	32.8 Å²	32.8	15%	0.149	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	118.2	-179.6	-56.6	174.4	0	0	0	109	V674 E675 E677 K723 T745	V674-I721 WeakPolarHBondContact CA-O 3.5Å; E675-I721 PolarHBondContact N-O 2.73Å; E675-I721 PolarHBondContact O-N 3.4Å; E677-I721 HydrophobicContact CG-CD1 4.35Å; E677-I721 WeakPolarHBondContact OE1-CD1 3.39Å; I721-K723 HydrophobicContact CG2-CG 4.33Å; I721-K723 PolarHBondContact O-N 2.94Å; I721-T745 HydrophobicContact CG2-CG2 4.49Å
722	L	92.5	Very high	84	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	117.8	173.4	-173.2	72.6	0	0	0	109.2	V643 V672 V674 F724 T745 Y746 L748	V643-L722 HydrophobicContact CG2-CD2 4.06Å; V672-L722 HydrophobicContact CG1-CD1 3.59Å; V672-L722 HydrophobicContact CG1-CG 4.23Å; V674-L722 HydrophobicContact CG2-CD1 3.62Å; L722-F724 HydrophobicContact CD2-CD1 4Å; L722-F724 HydrophobicContact CD2-CE1 3.81Å; L722-F724 HydrophobicContact CG-CD1 3.84Å; L722-F724 HydrophobicContact CG-CE1 4.02Å; L722-T745 CarbonylContact O-C 3.59Å; L722-T745 VanDerWaalsContact O-CA 3.29Å; L722-T745 WeakPolarHBondContact O-CA 3.4Å; L722-Y746 WeakPolarHBondContact CB-O 3.2Å; L722-Y746 PolarHBondContact N-O 3.14Å; L722-Y746 PolarHBondContact O-N 2.8Å; L722-L748 HydrophobicContact CB-CD1 4.18Å; L722-L748 HydrophobicContact CB-CD2 4.33Å; L722-L748 HydrophobicContact CB-CG 4.21Å
723	K	93.4	Very high	84.1	Confident	82 Å²	82	37.1 Å²	37.1	36%	0.357	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	131.7	177.4	-66.7	-169.9	161.8	176.9	0	110.3	V672 S673 E675 I721 T745	V672-K723 WeakPolarHBondContact CA-O 3.4Å; S673-K723 PolarHBondContact N-O 2.8Å; S673-K723 PolarHBondContact O-N 3.46Å; E675-K723 HydrophobicContact CB-CD 4.48Å; E675-K723 IonicContact OE1-NZ 2.93Å; E675-K723 WeakPolarHBondContact OE2-CE 3.28Å; E675-K723 IonicContact OE2-NZ 3.38Å; E675-K723 PolarHBondContact OE2-NZ 3.43Å; I721-K723 HydrophobicContact CG2-CG 4.33Å; I721-K723 PolarHBondContact O-N 2.94Å; K723-T745 HydrophobicContact CG-CG2 4.01Å
724	F	93.1	Very high	83.8	Confident	6 Å²	6	38.6 Å²	38.6	3%	0.026	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	164.6	178.5	52.2	-86.6	0	0	0	111.6	Y641 L669 V672 L722 V726 Q744	Y641-F724 HydrophobicContact CD2-CE1 4.39Å; Y641-F724 HydrophobicContact CD2-CZ 4.07Å; Y641-F724 HydrophobicContact CE1-CE2 4.44Å; Y641-F724 HydrophobicContact CE1-CZ 4.27Å; Y641-F724 HydrophobicContact CE2-CE1 4.16Å; Y641-F724 HydrophobicContact CE2-CE2 4.21Å; Y641-F724 AromaticContact CE2-CZ 3.42Å; Y641-F724 HydrophobicContact CE2-CZ 3.42Å; Y641-F724 VanDerWaalsContact CE2-CZ 3.42Å; Y641-F724 AromaticContact CZ-CE2 3.84Å; Y641-F724 AromaticContact CZ-CZ 3.52Å; L669-F724 HydrophobicContact CB-CB 4.46Å; L669-F724 HydrophobicContact CB-CD2 4.34Å; L669-F724 HydrophobicContact CD1-CD2 4.24Å; L669-F724 HydrophobicContact CD1-CE2 4.39Å; L669-F724 HydrophobicContact CD1-CG 4.44Å; L669-F724 HydrophobicContact CD2-CD2 3.67Å; L669-F724 HydrophobicContact CD2-CE2 3.76Å; L669-F724 HydrophobicContact CG-CD2 4.29Å; V672-F724 HydrophobicContact CB-CB 4.22Å; V672-F724 HydrophobicContact CG1-CB 4.23Å; V672-F724 HydrophobicContact CG2-CB 3.84Å; L722-F724 HydrophobicContact CD2-CD1 4Å; L722-F724 HydrophobicContact CD2-CE1 3.81Å; L722-F724 HydrophobicContact CG-CD1 3.84Å; L722-F724 HydrophobicContact CG-CE1 4.02Å; F724-V726 HydrophobicContact CD2-CG2 3.66Å; F724-V726 HydrophobicContact CE2-CG2 3.45Å; F724-V726 VanDerWaalsContact CE2-CG2 3.45Å; F724-Q744 HydrophobicContact CD2-CB 4.38Å; F724-Q744 HydrophobicContact CE2-CB 3.89Å; F724-Q744 HydrophobicContact CE2-CG 4.21Å; F724-Q744 HydrophobicContact CZ-CB 4.2Å; F724-Q744 HydrophobicContact CZ-CG 4.12Å; F724-Q744 PolarHBondContact N-O 3.18Å; F724-Q744 VanDerWaalsContact N-O 3.08Å; F724-Q744 PolarHBondContact O-N 3.35Å; F724-Q744 VanDerWaalsContact O-O 3.05Å
725	K	91.5	Very high	83.8	Confident	61 Å²	61	45 Å²	45	27%	0.265	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	133.8	168.4	-68.4	170.3	-169.1	156.6	0	109.5	L669 L670 D671 Y742 E743	L669-K725 CarbonylContact C-O 3.59Å; L669-K725 WeakPolarHBondContact CA-O 3.42Å; L670-K725 HydrophobicContact CB-CB 4.26Å; L670-K725 PolarHBondContact N-O 2.82Å; L670-K725 PolarHBondContact O-N 3.43Å; D671-K725 IonicContact OD2-NZ 3.35Å; D671-K725 PolarHBondContact OD2-NZ 2.86Å; K725-Y742 CarbonylContact C-O 3.55Å; K725-Y742 WeakPolarHBondContact CA-O 3.28Å; K725-E743 HydrophobicContact CG-CG 3.85Å
726	V	89.8	Confident	83.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	135.3	177	-175.7	0	0	0	0	109.4	Q667 L669 F724 T741 Y742 Q744	Q667-V726 HydrophobicContact CB-CG1 4.03Å; Q667-V726 HydrophobicContact CG-CG1 3.75Å; L669-V726 HydrophobicContact CD2-CG2 4.11Å; F724-V726 HydrophobicContact CD2-CG2 3.66Å; F724-V726 HydrophobicContact CE2-CG2 3.45Å; F724-V726 VanDerWaalsContact CE2-CG2 3.45Å; V726-T741 WeakPolarHBondContact O-CA 3.46Å; V726-Y742 HydrophobicContact CB-CD2 4.25Å; V726-Y742 HydrophobicContact CB-CE1 4.2Å; V726-Y742 HydrophobicContact CB-CE2 3.72Å; V726-Y742 HydrophobicContact CG1-CE1 4.29Å; V726-Y742 HydrophobicContact CG1-CE2 4.26Å; V726-Y742 HydrophobicContact CG2-CE2 4.01Å; V726-Y742 PolarHBondContact N-O 3.22Å; V726-Y742 PolarHBondContact O-N 3.43Å; V726-Q744 HydrophobicContact CG2-CB 4.1Å
727	M	87.7	Confident	83	Confident	24 Å²	24	49.6 Å²	49.6	12%	0.118	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	122.7	168.4	179.9	176.5	-78.1	0	0	108.1	L668 L670 P736 T741	L668-M727 HydrophobicContact CB-CB 4.39Å; L668-M727 HydrophobicContact CD2-SD 4.3Å; L668-M727 PolarHBondContact N-O 2.67Å; L668-M727 PolarHBondContact O-N 2.9Å; L670-M727 HydrophobicContact CD1-CB 4.44Å; L670-M727 HydrophobicContact CD1-CE 3.81Å; L670-M727 HydrophobicContact CD1-SD 4.44Å; M727-P736 HydrophobicContact CG-CB 3.99Å; M727-P736 HydrophobicContact SD-CB 3.67Å; M727-P736 HydrophobicContact SD-CG 4.35Å; M727-T741 HydrophobicContact CB-CG2 4.27Å; M727-T741 HydrophobicContact CE-CG2 3.55Å
728	D	85.8	Confident	82.4	Confident	63 Å²	63	50.3 Å²	50.3	34%	0.337	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	133.6	180	-64.1	-36.5	0	0	0	110.6	P736 D737	D728-P736 WeakPolarHBondContact O-CA 3.23Å; D728-D737 PolarHBondContact O-N 3Å
729	V	84.3	Confident	81.6	Confident	11 Å²	11	57.4 Å²	57.4	7%	0.067	34%	0.335	C	S	.	.	B	Isolated β-bridge	trans	-127.7	146.9	-179.6	-63	0	0	0	0	111.3	D666 L668 P731 E735 P736	D666-V729 VanDerWaalsContact C-CG2 3.45Å; D666-V729 WeakPolarHBondContact CA-O 3.24Å; D666-V729 PolarHBondContact O-N 3.15Å; L668-V729 HydrophobicContact CB-CG1 3.77Å; V729-P731 WeakPolarHBondContact O-CD 3.5Å; V729-E735 CarbonylContact C-O 3.59Å; V729-E735 VanDerWaalsContact CA-O 3.32Å; V729-E735 WeakPolarHBondContact CA-O 3.27Å; V729-P736 HydrophobicContact CG1-CB 4.38Å
730	D	76.4	Confident	81.1	Confident	53 Å²	53	62.6 Å²	62.6	28%	0.283	36%	0.357	S	S	.	.			trans	-63.6	121.6	174	167.1	9.6	0	0	0	110.1	T732 S733 G734 E735	D730-T732 PolarHBondContact O-N 2.84Å; D730-T732 PolarHBondContact OD1-N 3.12Å; D730-T732 PolarHBondContact OD1-OG1 3.17Å; D730-S733 VanDerWaalsContact CB-OG 3.3Å; D730-S733 WeakPolarHBondContact CB-OG 3.38Å; D730-S733 VanDerWaalsContact CG-OG 3.25Å; D730-S733 PolarHBondContact O-N 3.32Å; D730-S733 WeakPolarHBondContact OD2-CB 3.5Å; D730-S733 PolarHBondContact OD2-OG 3.38Å; D730-G734 WeakPolarHBondContact O-CA 3.41Å; D730-G734 PolarHBondContact O-N 2.9Å; D730-E735 PolarHBondContact N-O 3.36Å
731	P	71.4	Confident	80.8	Confident	76 Å²	76	65.7 Å²	65.7	49%	0.494	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-17.1	-177.8	-26.1	34	0	0	0	115.8	D666 V729	D666-P731 HydrophobicContact CB-CG 4.13Å; V729-P731 WeakPolarHBondContact O-CD 3.5Å
732	T	70.3	Confident	80.6	Confident	135 Å²	135	69.3 Å²	69.3	83%	0.828	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-36.1	-175.5	-35.2	0	0	0	0	112.8	D730	D730-T732 PolarHBondContact O-N 2.84Å; D730-T732 PolarHBondContact OD1-N 3.12Å; D730-T732 PolarHBondContact OD1-OG1 3.17Å
733	S	69.6	Low	80.4	Confident	67 Å²	67	76.9 Å²	76.9	47%	0.469	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-24.1	-176.3	64	0	0	0	0	113.4	D730 E735	D730-S733 VanDerWaalsContact CB-OG 3.3Å; D730-S733 WeakPolarHBondContact CB-OG 3.38Å; D730-S733 VanDerWaalsContact CG-OG 3.25Å; D730-S733 PolarHBondContact O-N 3.32Å; D730-S733 WeakPolarHBondContact OD2-CB 3.5Å; D730-S733 PolarHBondContact OD2-OG 3.38Å; S733-E735 PolarHBondContact O-N 3.02Å; S733-E735 PolarHBondContact OG-N 3.44Å
734	G	64.6	Low	80.3	Confident	52 Å²	52	75.9 Å²	75.9	54%	0.536	42%	0.421	S	S	.	.			trans	71.3	11.3	-174.9	0	0	0	0	0	113.9	D730	D730-G734 WeakPolarHBondContact O-CA 3.41Å; D730-G734 PolarHBondContact O-N 2.9Å
735	E	74.3	Confident	80.2	Confident	136 Å²	136	79.7 Å²	79.7	64%	0.636	45%	0.445	S	S	*	.			trans	-85.3	142.9	175	-66.7	-170.6	166.4	0	0	110.7	V729 D730 S733	V729-E735 CarbonylContact C-O 3.59Å; V729-E735 VanDerWaalsContact CA-O 3.32Å; V729-E735 WeakPolarHBondContact CA-O 3.27Å; D730-E735 PolarHBondContact N-O 3.36Å; S733-E735 PolarHBondContact O-N 3.02Å; S733-E735 PolarHBondContact OG-N 3.44Å
736	P	74.1	Confident	80.2	Confident	68 Å²	68	79.7 Å²	79.7	44%	0.442	44%	0.444	S	S	.	.	B	Isolated β-bridge	trans	-67.9	132.7	179.1	26.5	-32.2	0	0	0	112	M727 D728 V729 S738	M727-P736 HydrophobicContact CG-CB 3.99Å; M727-P736 HydrophobicContact SD-CB 3.67Å; M727-P736 HydrophobicContact SD-CG 4.35Å; D728-P736 WeakPolarHBondContact O-CA 3.23Å; V729-P736 HydrophobicContact CG1-CB 4.38Å; P736-S738 VanDerWaalsContact C-N 3.29Å; P736-S738 PolarHBondContact O-N 3.28Å
737	D	73.2	Confident	80.2	Confident	116 Å²	116	85 Å²	85	62%	0.62	48%	0.475	S	S	*	.	S	Bend	trans	-71.5	-26	180	-79.2	-21.9	0	0	0	112	D728	D728-D737 PolarHBondContact O-N 3Å
738	S	74.6	Confident	80.4	Confident	50 Å²	50	84.4 Å²	84.4	35%	0.35	47%	0.473	S	S	.	.			trans	-158	166.9	174.3	70.6	0	0	0	0	111.7	P736 D740	P736-S738 VanDerWaalsContact C-N 3.29Å; P736-S738 PolarHBondContact O-N 3.28Å; S738-D740 PolarHBondContact O-N 3.43Å; S738-D740 PolarHBondContact OG-N 3.48Å
739	D	73.9	Confident	80.7	Confident	152 Å²	152	86.6 Å²	86.6	81%	0.813	48%	0.481	S	S	*	.	S	Bend	trans	-81.5	0.5	173.3	-74.7	-30.1	0	0	0	113
740	D	77.8	Confident	80.9	Confident	131 Å²	131	92.1 Å²	92.1	70%	0.701	51%	0.506	S	S	*	.			trans	-77.7	131.2	-178.6	-70.7	-27.2	0	0	0	110.4	S738	S738-D740 PolarHBondContact O-N 3.43Å; S738-D740 PolarHBondContact OG-N 3.48Å
741	T	85.9	Confident	81.5	Confident	66 Å²	66	89.6 Å²	89.6	41%	0.405	49%	0.492	S	S	.	.			trans	-122.8	141.6	176.1	62.9	0	0	0	0	110.5	L670 V726 M727	L670-T741 HydrophobicContact CD1-CG2 4.06Å; V726-T741 WeakPolarHBondContact O-CA 3.46Å; M727-T741 HydrophobicContact CB-CG2 4.27Å; M727-T741 HydrophobicContact CE-CG2 3.55Å
742	Y	87.6	Confident	82.2	Confident	104 Å²	104	89.9 Å²	89.9	41%	0.408	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	148.1	172.5	58.6	-91.8	0	0	0	111.7	K725 V726	K725-Y742 CarbonylContact C-O 3.55Å; K725-Y742 WeakPolarHBondContact CA-O 3.28Å; V726-Y742 HydrophobicContact CB-CD2 4.25Å; V726-Y742 HydrophobicContact CB-CE1 4.2Å; V726-Y742 HydrophobicContact CB-CE2 3.72Å; V726-Y742 HydrophobicContact CG1-CE1 4.29Å; V726-Y742 HydrophobicContact CG1-CE2 4.26Å; V726-Y742 HydrophobicContact CG2-CE2 4.01Å; V726-Y742 PolarHBondContact N-O 3.22Å; V726-Y742 PolarHBondContact O-N 3.43Å
743	E	89.1	Confident	83.1	Confident	161 Å²	161	83.5 Å²	83.5	75%	0.752	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	135.7	-179.5	-70.2	179.4	175	0	0	110.8	K725	K725-E743 HydrophobicContact CG-CG 3.85Å
744	Q	90.9	Very high	83.9	Confident	62 Å²	62	83.9 Å²	83.9	29%	0.29	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	149.3	176.5	-172.1	167.8	-12.2	0	0	110.3	F724 V726	F724-Q744 HydrophobicContact CD2-CB 4.38Å; F724-Q744 HydrophobicContact CE2-CB 3.89Å; F724-Q744 HydrophobicContact CE2-CG 4.21Å; F724-Q744 HydrophobicContact CZ-CB 4.2Å; F724-Q744 HydrophobicContact CZ-CG 4.12Å; F724-Q744 PolarHBondContact N-O 3.18Å; F724-Q744 VanDerWaalsContact N-O 3.08Å; F724-Q744 PolarHBondContact O-N 3.35Å; F724-Q744 VanDerWaalsContact O-O 3.05Å; V726-Q744 HydrophobicContact CG2-CB 4.1Å
745	T	91.1	Very high	84.9	Confident	86 Å²	86	81.7 Å²	81.7	53%	0.528	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	139.8	177.2	60.4	0	0	0	0	109.9	I721 L722 K723	I721-T745 HydrophobicContact CG2-CG2 4.49Å; L722-T745 CarbonylContact O-C 3.59Å; L722-T745 VanDerWaalsContact O-CA 3.29Å; L722-T745 WeakPolarHBondContact O-CA 3.4Å; K723-T745 HydrophobicContact CG-CG2 4.01Å
746	Y	91	Very high	85.4	Confident	61 Å²	61	76.2 Å²	76.2	24%	0.239	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	123.6	177.6	-173.7	-85.1	0	0	0	109.6	T635 Y641 L722 L748	T635-Y746 HydrophobicContact CG2-CE1 4.08Å; Y641-Y746 AromaticContact CD2-CD2 3.81Å; Y641-Y746 HydrophobicContact CD2-CD2 3.81Å; Y641-Y746 HydrophobicContact CD2-CE2 4.27Å; Y641-Y746 AromaticContact CD2-CG 3.98Å; Y641-Y746 HydrophobicContact CD2-CG 3.98Å; Y641-Y746 HydrophobicContact CE2-CD2 4.12Å; L722-Y746 WeakPolarHBondContact CB-O 3.2Å; L722-Y746 PolarHBondContact N-O 3.14Å; L722-Y746 PolarHBondContact O-N 2.8Å; Y746-L748 HydrophobicContact CD1-CD2 3.81Å; Y746-L748 HydrophobicContact CE1-CD2 4.08Å
747	V	91.6	Very high	85.9	Confident	110 Å²	110	73.7 Å²	73.7	67%	0.667	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	127.8	-178.3	-176	0	0	0	0	109.2
748	L	91.4	Very high	86.5	Confident	12 Å²	12	68.1 Å²	68.1	6%	0.063	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-97.8	168.2	177.7	-57.7	177	0	0	0	110.5	L634 T635 V643 V674 A720 L722 Y746	L634-L748 HydrophobicContact CB-CB 4.24Å; L634-L748 HydrophobicContact CD1-CD1 4.21Å; T635-L748 HydrophobicContact CG2-CD2 3.5Å; T635-L748 VanDerWaalsContact CG2-CD2 3.5Å; V643-L748 HydrophobicContact CB-CD1 4.44Å; V643-L748 HydrophobicContact CB-CD2 4.05Å; V643-L748 HydrophobicContact CG1-CD1 4.1Å; V643-L748 HydrophobicContact CG2-CD1 4.47Å; V643-L748 HydrophobicContact CG2-CD2 3.82Å; V674-L748 HydrophobicContact CG1-CD1 4.18Å; V674-L748 HydrophobicContact CG2-CD1 4.38Å; A720-L748 HydrophobicContact CB-CB 3.97Å; A720-L748 HydrophobicContact CB-CD1 4.19Å; A720-L748 WeakPolarHBondContact O-CB 3.22Å; A720-L748 PolarHBondContact O-N 2.91Å; L722-L748 HydrophobicContact CB-CD1 4.18Å; L722-L748 HydrophobicContact CB-CD2 4.33Å; L722-L748 HydrophobicContact CB-CG 4.21Å; Y746-L748 HydrophobicContact CD1-CD2 3.81Å; Y746-L748 HydrophobicContact CE1-CD2 4.08Å
749	E	90.8	Very high	87.1	Confident	109 Å²	109	65.8 Å²	65.8	51%	0.509	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-61.2	150.8	165.9	-68.3	-178	-178.8	0	0	111.1	L634	L634-E749 HydrophobicContact CD2-CB 4.48Å; L634-E749 PolarHBondContact O-N 2.85Å
750	E	88.5	Confident	87.5	Confident	127 Å²	127	59.2 Å²	59.2	59%	0.593	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-60.7	143.5	-179.9	-67.5	179.5	-173	0	0	111.7	S717 L718	S717-E750 WeakPolarHBondContact OG-CB 3.43Å; S717-E750 PolarHBondContact OG-OE2 2.73Å; L718-E750 WeakPolarHBondContact O-CA 3.21Å
751	V	88.8	Confident	87.7	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	98.3	178.4	172.8	0	0	0	0	108.5	L634 M645 L656 F658 L676 L718 A720	L634-V751 HydrophobicContact CD1-CG2 3.99Å; L634-V751 HydrophobicContact CD2-CG2 4.2Å; M645-V751 HydrophobicContact CE-CG1 3.9Å; M645-V751 HydrophobicContact CE-CG2 4.42Å; M645-V751 HydrophobicContact SD-CB 4.23Å; M645-V751 HydrophobicContact SD-CG1 3.47Å; M645-V751 WeakPolarHBondContact SD-CG1 3.33Å; M645-V751 HydrophobicContact SD-CG2 3.72Å; L656-V751 HydrophobicContact CD1-CG1 4.18Å; F658-V751 HydrophobicContact CE1-CG2 4.41Å; L676-V751 HydrophobicContact CD2-CG2 4.31Å; L718-V751 HydrophobicContact CB-CB 4.28Å; L718-V751 PolarHBondContact N-O 2.98Å; L718-V751 PolarHBondContact O-N 2.89Å; A720-V751 HydrophobicContact CB-CG2 3.85Å
752	D	87.9	Confident	87.3	Confident	82 Å²	82	50.4 Å²	50.4	44%	0.439	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	125.3	174.3	-64.3	-44.3	0	0	0	110.7	K647 G716 S717	K647-D752 WeakPolarHBondContact CE-O 3.39Å; K647-D752 PolarHBondContact NZ-O 3.41Å; G716-D752 CarbonylContact O-C 3.57Å; S717-D752 WeakPolarHBondContact CB-OD1 3.3Å; S717-D752 PolarHBondContact OG-OD1 3.48Å
753	V	87.4	Confident	86.6	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	125.7	165.2	-178	0	0	0	0	108	M654 W683 L706 S715 G716 L718	M654-V753 HydrophobicContact CE-CG1 3.81Å; M654-V753 HydrophobicContact SD-CG1 4.31Å; M654-V753 HydrophobicContact SD-CG2 4.43Å; W683-V753 HydrophobicContact CH2-CB 4.32Å; W683-V753 HydrophobicContact CH2-CG1 3.82Å; W683-V753 HydrophobicContact CZ2-CB 4.36Å; W683-V753 HydrophobicContact CZ2-CG1 4.26Å; L706-V753 HydrophobicContact CD2-CG2 4.12Å; S715-V753 CarbonylContact C-O 3.36Å; S715-V753 WeakPolarHBondContact CA-O 3.48Å; G716-V753 PolarHBondContact N-O 2.89Å; G716-V753 VanDerWaalsContact N-O 3.09Å; G716-V753 PolarHBondContact O-N 3.47Å; L718-V753 HydrophobicContact CD1-CG2 4.49Å
754	N	86.6	Confident	85.8	Confident	76 Å²	76	41.8 Å²	41.8	41%	0.406	22%	0.222	S	C	.	.			trans	-114.8	156.8	-177.3	-70.1	-43.7	0	0	0	111.7	S756 D757	N754-S756 PolarHBondContact O-N 2.92Å; N754-D757 PolarHBondContact N-OD2 3.42Å; N754-D757 VanDerWaalsContact O-CB 3.26Å; N754-D757 WeakPolarHBondContact O-CB 3.34Å; N754-D757 PolarHBondContact O-N 3.2Å
755	V	85.5	Confident	84.5	Confident	5 Å²	5	41.9 Å²	41.9	3%	0.03	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-58	-35.8	174.1	175.6	0	0	0	0	112.1	I714 D757 S758 V759 V867 A870	I714-V755 HydrophobicContact CD1-CB 3.95Å; I714-V755 HydrophobicContact CD1-CG1 3.65Å; I714-V755 HydrophobicContact CD1-CG2 3.5Å; I714-V755 HydrophobicContact CG1-CG2 3.83Å; V755-D757 PolarHBondContact O-N 2.96Å; V755-D757 VanDerWaalsContact O-N 3.16Å; V755-S758 PolarHBondContact O-N 2.94Å; V755-V759 HydrophobicContact CG1-CG2 4.37Å; V755-V759 PolarHBondContact O-N 3.07Å; V755-V867 HydrophobicContact CG1-CG2 4.33Å; V755-A870 HydrophobicContact CB-CB 3.59Å; V755-A870 HydrophobicContact CG1-CB 3.91Å; V755-A870 HydrophobicContact CG2-CB 3.45Å; V755-A870 VanDerWaalsContact CG2-CB 3.45Å
756	S	85.1	Confident	83.5	Confident	21 Å²	21	39.3 Å²	39.3	15%	0.147	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-59.9	-23.2	174.7	61.1	0	0	0	0	113.2	K627 N754 S758 V759 E801 I802	K627-S756 PolarHBondContact NZ-O 3.4Å; N754-S756 PolarHBondContact O-N 2.92Å; S756-S758 VanDerWaalsContact C-N 3.27Å; S756-S758 PolarHBondContact O-N 3.39Å; S756-V759 PolarHBondContact O-N 3.46Å; S756-E801 WeakPolarHBondContact CB-O 3.49Å; S756-I802 WeakPolarHBondContact CB-O 3.42Å
757	D	86	Confident	83	Confident	15 Å²	15	36.7 Å²	36.7	8%	0.08	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-70.8	-24.9	175	-63.4	-43.9	0	0	0	112	K647 T649 M654 N754 V755	K647-D757 WeakPolarHBondContact CD-OD2 3.46Å; K647-D757 IonicContact NZ-OD1 2.9Å; K647-D757 IonicContact NZ-OD2 3.82Å; K647-D757 PolarHBondContact NZ-OD2 3.17Å; T649-D757 PolarHBondContact OG1-O 3.01Å; M654-D757 HydrophobicContact CE-CB 4.03Å; N754-D757 PolarHBondContact N-OD2 3.42Å; N754-D757 VanDerWaalsContact O-CB 3.26Å; N754-D757 WeakPolarHBondContact O-CB 3.34Å; N754-D757 PolarHBondContact O-N 3.2Å; V755-D757 PolarHBondContact O-N 2.96Å; V755-D757 VanDerWaalsContact O-N 3.16Å
758	S	86	Confident	82.3	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-92.8	-4.2	176.4	-67.2	0	0	0	0	114	F626 V755 S756 R830	F626-S758 WeakPolarHBondContact CE1-O 3.17Å; V755-S758 PolarHBondContact O-N 2.94Å; S756-S758 VanDerWaalsContact C-N 3.27Å; S756-S758 PolarHBondContact O-N 3.39Å; S758-R830 PolarHBondContact O-N 3.12Å
759	V	85.9	Confident	81.4	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.5	-178.3	-179.8	0	0	0	0	111.2	K627 V755 S756 L803 L805 F829 V867	K627-V759 WeakPolarHBondContact CD-O 3.41Å; K627-V759 PolarHBondContact NZ-O 3.1Å; V755-V759 HydrophobicContact CG1-CG2 4.37Å; V755-V759 PolarHBondContact O-N 3.07Å; S756-V759 PolarHBondContact O-N 3.46Å; V759-L803 WeakPolarHBondContact CB-O 3.41Å; V759-L803 WeakPolarHBondContact CG1-O 3.47Å; V759-L805 HydrophobicContact CG1-CD2 3.61Å; V759-L805 HydrophobicContact CG1-CG 4.33Å; V759-F829 HydrophobicContact CG2-CD2 3.81Å; V759-F829 HydrophobicContact CG2-CE2 4.49Å; V759-V867 HydrophobicContact CG2-CG2 4.39Å
760	Q	83	Confident	80.7	Confident	15 Å²	15	30.3 Å²	30.3	7%	0.07	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	116.8	170.9	-167.9	178.8	13.6	0	0	110.2	V579 F626 V762 G827 V828	V579-Q760 PolarHBondContact O-NE2 3.03Å; F626-Q760 HydrophobicContact CE1-CB 3.98Å; F626-Q760 HydrophobicContact CE2-CB 4.37Å; F626-Q760 HydrophobicContact CZ-CB 3.63Å; Q760-V762 PolarHBondContact O-N 3.12Å; Q760-G827 CarbonylContact O-C 3.51Å; Q760-G827 VanDerWaalsContact O-CA 3.23Å; Q760-G827 WeakPolarHBondContact O-CA 3.31Å; Q760-V828 PolarHBondContact N-O 3.5Å; Q760-V828 PolarHBondContact O-N 3Å
761	G	80.9	Confident	80.4	Confident	7 Å²	7	26.4 Å²	26.4	7%	0.072	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	127.3	178.7	0	0	0	0	0	112.8	G804	G761-G804 VanDerWaalsContact CA-O 3.31Å; G761-G804 WeakPolarHBondContact CA-O 3.32Å; G761-G804 PolarHBondContact N-O 3.11Å; G761-G804 VanDerWaalsContact N-O 3.12Å
762	V	77.8	Confident	80	Confident	5 Å²	5	33.6 Å²	33.6	3%	0.03	20%	0.199	C	C	.	.			trans	-142.2	110	-177.3	178.3	0	0	0	0	107.8	V579 Q760 S826 V828	V579-V762 HydrophobicContact CB-CG2 3.99Å; V579-V762 HydrophobicContact CG1-CB 4.3Å; V579-V762 HydrophobicContact CG1-CG1 3.74Å; V579-V762 HydrophobicContact CG1-CG2 3.51Å; Q760-V762 PolarHBondContact O-N 3.12Å; V762-S826 PolarHBondContact N-O 3.2Å; V762-S826 CarbonylContact O-C 3.53Å; V762-S826 WeakPolarHBondContact O-CB 3.43Å; V762-S826 PolarHBondContact O-OG 3.06Å; V762-V828 HydrophobicContact CB-CG2 4.4Å; V762-V828 HydrophobicContact CG2-CG2 4.05Å
763	A	73.5	Confident	79.5	Confident	36 Å²	36	33.3 Å²	33.3	30%	0.298	21%	0.208	S	C	.	.			trans	-71.6	127.1	179.5	0	0	0	0	0	111.7	V806 S826	A763-V806 HydrophobicContact CB-CG1 3.96Å; A763-S826 WeakPolarHBondContact CA-OG 3.49Å
764	K	72.1	Confident	78.9	Confident	47 Å²	47	34.6 Å²	34.6	20%	0.204	21%	0.214	C	C	.	.			trans	-87.5	148.5	172	-57.6	-74.4	-177.3	169.9	0	110.4	C808 S826 D834 L836	K764-C808 PolarHBondContact N-SG 3.38Å; K764-S826 PolarHBondContact N-OG 3.45Å; K764-D834 VanDerWaalsContact NZ-CG 3.34Å; K764-D834 IonicContact NZ-OD1 3.7Å; K764-D834 PolarHBondContact NZ-OD1 2.94Å; K764-D834 IonicContact NZ-OD2 2.54Å; K764-D834 PolarHBondContact NZ-OD2 3.43Å; K764-L836 HydrophobicContact CG-CD2 4.32Å
765	S	62.8	Low	78.1	Confident	64 Å²	64	32.5 Å²	32.5	45%	0.448	21%	0.211	S	C	.	.	S	Bend	trans	-71.8	-36.4	-177.2	-35	0	0	0	0	113.3	D546	D546-S765 WeakPolarHBondContact OD1-CB 3.42Å; D546-S765 PolarHBondContact OD1-OG 3.25Å
766	S	71.1	Confident	77.5	Confident	32 Å²	32	38.1 Å²	38.1	22%	0.224	24%	0.241	C	C	.	.			trans	-130.3	115.3	169.8	-170.6	0	0	0	0	108.8	H541 E809	H541-S766 VanDerWaalsContact CE1-CB 3.48Å; H541-S766 WeakPolarHBondContact CE1-CB 3.43Å; H541-S766 WeakPolarHBondContact NE2-CB 3.33Å; S766-E809 WeakPolarHBondContact CA-OE1 2.87Å
767	F	80.6	Confident	76.4	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-71.1	-39.5	179.2	-178.9	-92.3	0	0	0	111.1	S769 A770 W771 C808 E809 F824 L825 L836 S837 K838	F767-S769 PolarHBondContact O-N 3.06Å; F767-A770 PolarHBondContact O-N 3.46Å; F767-W771 HydrophobicContact CD1-CB 4.36Å; F767-W771 HydrophobicContact CE1-CB 4.14Å; F767-W771 AromaticContact CE1-CD2 3.97Å; F767-W771 HydrophobicContact CE1-CD2 3.97Å; F767-W771 AromaticContact CE1-CE3 3.58Å; F767-W771 HydrophobicContact CE1-CE3 3.58Å; F767-W771 HydrophobicContact CE1-CG 4.24Å; F767-W771 HydrophobicContact CE1-CZ3 4.27Å; F767-W771 HydrophobicContact CE2-CE3 4.3Å; F767-W771 HydrophobicContact CZ-CD2 4.18Å; F767-W771 AromaticContact CZ-CE3 3.33Å; F767-W771 HydrophobicContact CZ-CE3 3.33Å; F767-W771 AromaticContact CZ-CZ3 3.75Å; F767-W771 HydrophobicContact CZ-CZ3 3.75Å; F767-W771 VanDerWaalsContact O-CB 3.26Å; F767-W771 WeakPolarHBondContact O-CB 3.44Å; F767-W771 PolarHBondContact O-N 3.2Å; F767-C808 HydrophobicContact CB-CB 4.14Å; F767-C808 HydrophobicContact CD2-CB 4.33Å; F767-E809 PolarHBondContact N-OE1 3.37Å; F767-F824 HydrophobicContact CB-CB 4.25Å; F767-F824 HydrophobicContact CD1-CB 3.89Å; F767-F824 AromaticContact CD1-CD1 3.48Å; F767-F824 HydrophobicContact CD1-CD1 3.48Å; F767-F824 VanDerWaalsContact CD1-CD1 3.48Å; F767-F824 HydrophobicContact CD1-CE1 4.16Å; F767-F824 AromaticContact CD1-CG 3.77Å; F767-F824 HydrophobicContact CD1-CG 3.77Å; F767-F824 HydrophobicContact CD2-CB 3.75Å; F767-F824 HydrophobicContact CE1-CB 4.13Å; F767-F824 AromaticContact CE1-CD1 3.39Å; F767-F824 HydrophobicContact CE1-CD1 3.39Å; F767-F824 HydrophobicContact CE1-CE1 4.12Å; F767-F824 HydrophobicContact CE1-CG 4.05Å; F767-F824 HydrophobicContact CE2-CB 3.98Å; F767-F824 HydrophobicContact CG-CB 3.68Å; F767-F824 HydrophobicContact CG-CD1 4.19Å; F767-F824 HydrophobicContact CG-CG 4.03Å; F767-F824 HydrophobicContact CZ-CB 4.15Å; F767-F824 HydrophobicContact CZ-CD1 4.01Å; F767-L825 WeakPolarHBondContact CE2-O 3.38Å; F767-L836 HydrophobicContact CD2-CD2 4.37Å; F767-L836 HydrophobicContact CE2-CB 3.91Å; F767-L836 HydrophobicContact CE2-CD1 4.38Å; F767-L836 HydrophobicContact CE2-CD2 4.13Å; F767-L836 HydrophobicContact CE2-CG 4.37Å; F767-L836 HydrophobicContact CZ-CB 4.19Å; F767-S837 WeakPolarHBondContact CZ-O 3.45Å; F767-K838 HydrophobicContact CZ-CB 4.41Å
768	G	77.2	Confident	75.7	Confident	36 Å²	36	44.4 Å²	44.4	37%	0.371	27%	0.274	S	S	.	.	H	α-helix	trans	-58.6	-49.2	-176.6	0	0	0	0	0	113.6	A770 W771 E772	G768-A770 PolarHBondContact O-N 3.45Å; G768-W771 WeakPolarHBondContact O-CB 3.4Å; G768-W771 PolarHBondContact O-N 2.75Å; G768-E772 PolarHBondContact O-N 2.7Å; G768-E772 VanDerWaalsContact O-N 3.08Å
769	S	72.9	Confident	75.6	Confident	44 Å²	44	46.3 Å²	46.3	31%	0.308	29%	0.286	S	S	.	.	H	α-helix	trans	-66.6	-38.1	178.9	-58.1	0	0	0	0	112.7	F767 W771 E772 A773	F767-S769 PolarHBondContact O-N 3.06Å; S769-W771 VanDerWaalsContact C-N 3.33Å; S769-E772 PolarHBondContact O-N 3.05Å; S769-A773 WeakPolarHBondContact O-CB 3.31Å; S769-A773 PolarHBondContact O-N 2.77Å; S769-A773 VanDerWaalsContact O-N 3.13Å
770	A	75.6	Confident	75.6	Confident	16 Å²	16	50.2 Å²	50.2	13%	0.132	30%	0.3	C	S	.	.	H	α-helix	trans	-65.8	-38.8	175.5	0	0	0	0	0	111.3	F767 G768 A773 L774 L836	F767-A770 PolarHBondContact O-N 3.46Å; G768-A770 PolarHBondContact O-N 3.45Å; A770-A773 PolarHBondContact O-N 3.26Å; A770-L774 WeakPolarHBondContact O-CD1 3.46Å; A770-L774 PolarHBondContact O-N 3.45Å; A770-L836 HydrophobicContact CB-CD1 3.78Å
771	W	81.8	Confident	75.8	Confident	45 Å²	45	55.2 Å²	55.2	17%	0.17	32%	0.324	C	S	.	.	H	α-helix	trans	-63.5	-39.4	177.3	-176.3	-91.2	0	0	0	113.4	F767 G768 S769 L836 K838 I855 K857	F767-W771 HydrophobicContact CD1-CB 4.36Å; F767-W771 HydrophobicContact CE1-CB 4.14Å; F767-W771 AromaticContact CE1-CD2 3.97Å; F767-W771 HydrophobicContact CE1-CD2 3.97Å; F767-W771 AromaticContact CE1-CE3 3.58Å; F767-W771 HydrophobicContact CE1-CE3 3.58Å; F767-W771 HydrophobicContact CE1-CG 4.24Å; F767-W771 HydrophobicContact CE1-CZ3 4.27Å; F767-W771 HydrophobicContact CE2-CE3 4.3Å; F767-W771 HydrophobicContact CZ-CD2 4.18Å; F767-W771 AromaticContact CZ-CE3 3.33Å; F767-W771 HydrophobicContact CZ-CE3 3.33Å; F767-W771 AromaticContact CZ-CZ3 3.75Å; F767-W771 HydrophobicContact CZ-CZ3 3.75Å; F767-W771 VanDerWaalsContact O-CB 3.26Å; F767-W771 WeakPolarHBondContact O-CB 3.44Å; F767-W771 PolarHBondContact O-N 3.2Å; G768-W771 WeakPolarHBondContact O-CB 3.4Å; G768-W771 PolarHBondContact O-N 2.75Å; S769-W771 VanDerWaalsContact C-N 3.33Å; W771-L836 HydrophobicContact CB-CD1 4.33Å; W771-L836 HydrophobicContact CE3-CB 3.82Å; W771-L836 HydrophobicContact CE3-CD1 4.32Å; W771-L836 HydrophobicContact CZ3-CB 4.01Å; W771-K838 HydrophobicContact CH2-CB 3.94Å; W771-K838 HydrophobicContact CZ2-CB 4.47Å; W771-K838 HydrophobicContact CZ3-CB 4.16Å; W771-I855 HydrophobicContact CH2-CB 3.98Å; W771-I855 HydrophobicContact CH2-CG2 3.65Å; W771-I855 HydrophobicContact CZ2-CB 4.35Å; W771-I855 HydrophobicContact CZ2-CG2 3.79Å; W771-K857 HydrophobicContact CD2-CD 3.88Å; W771-K857 HydrophobicContact CE3-CD 4.1Å; W771-K857 HydrophobicContact CE3-CG 4.4Å; W771-K857 HydrophobicContact CH2-CB 4.37Å; W771-K857 HydrophobicContact CH2-CD 3.96Å; W771-K857 HydrophobicContact CH2-CG 3.73Å; W771-K857 HydrophobicContact CZ2-CD 3.69Å; W771-K857 HydrophobicContact CZ2-CG 3.92Å; W771-K857 HydrophobicContact CZ3-CB 4.15Å; W771-K857 HydrophobicContact CZ3-CD 4.14Å; W771-K857 HydrophobicContact CZ3-CG 3.98Å
772	E	80.9	Confident	76.1	Confident	151 Å²	151	59 Å²	59	71%	0.706	34%	0.34	S	S	*	.	H	α-helix	trans	-72.4	-34.1	176.2	-70.9	177.9	178.1	0	0	112.2	G768 S769 L774 G775	G768-E772 PolarHBondContact O-N 2.7Å; G768-E772 VanDerWaalsContact O-N 3.08Å; S769-E772 PolarHBondContact O-N 3.05Å; E772-L774 VanDerWaalsContact C-N 3.31Å; E772-L774 PolarHBondContact O-N 3.22Å; E772-G775 PolarHBondContact O-N 3.24Å
773	A	77.4	Confident	76.5	Confident	76 Å²	76	63.4 Å²	63.4	63%	0.628	37%	0.367	S	S	*	.	H	α-helix	trans	-67.8	-27.6	-178.4	0	0	0	0	0	114.1	S769 A770 G775	S769-A773 WeakPolarHBondContact O-CB 3.31Å; S769-A773 PolarHBondContact O-N 2.77Å; S769-A773 VanDerWaalsContact O-N 3.13Å; A770-A773 PolarHBondContact O-N 3.26Å; A773-G775 PolarHBondContact O-N 3.17Å
774	L	74.7	Confident	77	Confident	28 Å²	28	63.1 Å²	63.1	15%	0.147	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-11.3	179.5	-90.6	142.2	0	0	0	113.9	A770 E772 L836 N859	A770-L774 WeakPolarHBondContact O-CD1 3.46Å; A770-L774 PolarHBondContact O-N 3.45Å; E772-L774 VanDerWaalsContact C-N 3.31Å; E772-L774 PolarHBondContact O-N 3.22Å; L774-L836 HydrophobicContact CD1-CB 4.26Å; L774-L836 HydrophobicContact CD1-CD1 3.27Å; L774-L836 HydrophobicContact CD1-CG 3.55Å; L774-N859 WeakPolarHBondContact CD2-OD1 3.39Å
775	G	68.6	Low	77.5	Confident	33 Å²	33	67.5 Å²	67.5	34%	0.34	38%	0.38	S	S	.	.			trans	66.7	-171.9	-174.4	0	0	0	0	0	113	E772 A773 K857	E772-G775 PolarHBondContact O-N 3.24Å; A773-G775 PolarHBondContact O-N 3.17Å; G775-K857 PolarHBondContact O-NZ 3.21Å
776	D	73.6	Confident	78.2	Confident	122 Å²	122	65.8 Å²	65.8	65%	0.652	37%	0.366	S	S	*	.	S	Bend	trans	-108.7	-8.7	-178.1	-72	-27.5	0	0	0	113.9	A778 T779 K857	D776-A778 VanDerWaalsContact C-N 3.28Å; D776-A778 PolarHBondContact O-N 3.03Å; D776-T779 WeakPolarHBondContact CA-OG1 3.41Å; D776-T779 PolarHBondContact O-N 3.33Å; D776-T779 PolarHBondContact O-OG1 2.97Å; D776-K857 IonicContact OD1-NZ 3.79Å; D776-K857 PolarHBondContact OD1-NZ 3.03Å
777	D	62.8	Low	78.1	Confident	161 Å²	161	69.7 Å²	69.7	86%	0.861	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-28.2	-169.1	-65.1	-30	0	0	0	114.2
778	A	71.1	Confident	77.6	Confident	8 Å²	8	74.3 Å²	74.3	7%	0.066	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	48.6	-179.2	0	0	0	0	0	111.7	D776 S858 P861	D776-A778 VanDerWaalsContact C-N 3.28Å; D776-A778 PolarHBondContact O-N 3.03Å; A778-S858 WeakPolarHBondContact CB-O 3.45Å; A778-S858 PolarHBondContact O-N 3.37Å; A778-P861 HydrophobicContact CB-CB 4.3Å; A778-P861 HydrophobicContact CB-CG 4.06Å
779	T	84.2	Confident	77.4	Confident	39 Å²	39	73.2 Å²	73.2	24%	0.239	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	136.5	176	-47.1	0	0	0	0	111	D776 I855 I856 K857	D776-T779 WeakPolarHBondContact CA-OG1 3.41Å; D776-T779 PolarHBondContact O-N 3.33Å; D776-T779 PolarHBondContact O-OG1 2.97Å; T779-I855 HydrophobicContact CG2-CG2 3.54Å; T779-I856 WeakPolarHBondContact CA-O 3.45Å; T779-K857 HydrophobicContact CG2-CG 3.9Å; T779-K857 WeakPolarHBondContact OG1-CE 3.48Å
780	R	84.1	Confident	77.5	Confident	82 Å²	82	79.9 Å²	79.9	31%	0.309	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	137.3	170.3	-66.9	-61.4	-176.6	-92.8	-11.2	110.4	I855 I856 A864 D865 I868	R780-I855 CarbonylContact O-C 3.5Å; R780-I855 VanDerWaalsContact O-CA 3.25Å; R780-I855 WeakPolarHBondContact O-CA 3.11Å; R780-I856 PolarHBondContact N-O 3Å; R780-I856 PolarHBondContact O-N 3.23Å; R780-A864 HydrophobicContact CG-CB 3.97Å; R780-D865 WeakPolarHBondContact CD-OD1 3.12Å; R780-D865 WeakPolarHBondContact CG-OD1 3.34Å; R780-D865 IonicContact CZ-OD1 2.72Å; R780-D865 IonicContact CZ-OD2 2.64Å; R780-D865 IonicContact NE-OD1 2.88Å; R780-D865 PolarHBondContact NE-OD1 3.17Å; R780-D865 IonicContact NE-OD2 3.48Å; R780-D865 IonicContact NH2-OD1 2.68Å; R780-D865 PolarHBondContact NH2-OD1 3.29Å; R780-D865 IonicContact NH2-OD2 2.71Å; R780-D865 PolarHBondContact NH2-OD2 2.8Å; R780-I868 HydrophobicContact CB-CD1 3.79Å; R780-I868 HydrophobicContact CB-CG2 4.38Å
781	E	88.1	Confident	77.8	Confident	121 Å²	121	82 Å²	82	57%	0.565	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.7	125.1	-179.8	176.6	174.6	-174.7	0	0	109.2	N853 I854 I855	E781-N853 PolarHBondContact OE1-ND2 3.18Å; E781-I854 WeakPolarHBondContact CA-O 3.42Å; E781-I855 HydrophobicContact CB-CG1 4.14Å; E781-I855 HydrophobicContact CG-CG1 3.87Å
782	E	86.9	Confident	77.9	Confident	87 Å²	87	80.3 Å²	80.3	41%	0.407	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	157.4	174.1	-74	-167	165.4	0	0	111.3	F784 N853 I854 I868	E782-F784 HydrophobicContact CB-CD2 4.41Å; E782-F784 HydrophobicContact CB-CE2 3.61Å; E782-F784 HydrophobicContact CB-CZ 3.87Å; E782-F784 WeakPolarHBondContact OE2-CZ 3.33Å; E782-N853 WeakPolarHBondContact O-CA 3.46Å; E782-I854 PolarHBondContact N-O 3.36Å; E782-I854 PolarHBondContact O-N 3.04Å; E782-I868 HydrophobicContact CB-CD1 3.79Å; E782-I868 HydrophobicContact CB-CG1 4.27Å; E782-I868 HydrophobicContact CG-CD1 3.79Å; E782-I868 HydrophobicContact CG-CG1 4.36Å
783	T	86.5	Confident	78.1	Confident	97 Å²	97	76.2 Å²	76.2	60%	0.595	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.9	125.3	178.3	-57.5	0	0	0	0	110.1	M852 N853	T783-M852 CarbonylContact C-O 3.51Å; T783-M852 VanDerWaalsContact CA-O 3.3Å; T783-M852 WeakPolarHBondContact CA-O 3.19Å; T783-N853 PolarHBondContact OG1-ND2 3.05Å
784	F	84.8	Confident	78.4	Confident	29 Å²	29	76 Å²	76	13%	0.127	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	150.2	-176.1	-62.2	-83	0	0	0	110.9	E782 M852 I854 I868 V871 V872	E782-F784 HydrophobicContact CB-CD2 4.41Å; E782-F784 HydrophobicContact CB-CE2 3.61Å; E782-F784 HydrophobicContact CB-CZ 3.87Å; E782-F784 WeakPolarHBondContact OE2-CZ 3.33Å; F784-M852 HydrophobicContact CB-CE 4.2Å; F784-M852 HydrophobicContact CD2-CE 3.77Å; F784-M852 HydrophobicContact CG-CE 4.28Å; F784-M852 PolarHBondContact N-O 3.25Å; F784-M852 PolarHBondContact O-N 3.07Å; F784-I854 HydrophobicContact CD2-CG2 3.82Å; F784-I854 HydrophobicContact CE2-CG2 3.52Å; F784-I868 HydrophobicContact CE2-CG1 4.48Å; F784-V871 HydrophobicContact CB-CG1 4.43Å; F784-V871 HydrophobicContact CD1-CG1 3.98Å; F784-V871 HydrophobicContact CD2-CB 4.33Å; F784-V871 HydrophobicContact CD2-CG1 3.53Å; F784-V871 HydrophobicContact CE1-CB 4.23Å; F784-V871 HydrophobicContact CE1-CG1 4.05Å; F784-V871 HydrophobicContact CE2-CB 3.88Å; F784-V871 HydrophobicContact CE2-CG1 3.6Å; F784-V871 HydrophobicContact CG-CG1 3.7Å; F784-V871 HydrophobicContact CZ-CB 3.81Å; F784-V871 HydrophobicContact CZ-CG1 3.86Å; F784-V872 HydrophobicContact CE1-CG2 3.69Å; F784-V872 HydrophobicContact CZ-CG2 4.21Å
785	Q	81.3	Confident	78.9	Confident	139 Å²	139	74.6 Å²	74.6	65%	0.65	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.1	116	165.1	-71.6	-158.5	-10.8	0	0	109.6	S787	Q785-S787 PolarHBondContact O-N 3.42Å
786	L	78.2	Confident	79.6	Confident	29 Å²	29	73.2 Å²	73.2	15%	0.152	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	97.1	-179.3	-62.2	174.2	0	0	0	109.1	V789 A795 I799 I850 M852	L786-V789 HydrophobicContact CB-CG2 4.12Å; L786-A795 HydrophobicContact CD1-CB 4.08Å; L786-I799 HydrophobicContact CD1-CD1 4.4Å; L786-I850 HydrophobicContact CB-CB 4.36Å; L786-I850 HydrophobicContact CD1-CG2 4.28Å; L786-I850 PolarHBondContact N-O 2.93Å; L786-M852 HydrophobicContact CD1-CB 4.06Å; L786-M852 HydrophobicContact CD1-SD 4.36Å; L786-M852 HydrophobicContact CG-CB 4.41Å
787	S	69.4	Low	80.2	Confident	114 Å²	114	73.3 Å²	73.3	80%	0.797	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-18.6	178.8	55.5	0	0	0	0	113.7	Q785	Q785-S787 PolarHBondContact O-N 3.42Å
788	T	68.7	Low	81.2	Confident	103 Å²	103	69.6 Å²	69.6	63%	0.632	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	10.6	-173.3	62.6	0	0	0	0	114.1	K798	T788-K798 PolarHBondContact O-NZ 2.85Å
789	V	74.8	Confident	82	Confident	14 Å²	14	69.5 Å²	69.5	9%	0.085	36%	0.359	C	S	.	.			trans	-129.9	128.3	-172.1	-164.8	0	0	0	0	111	L786 N791 D794 A795 K798 I850	L786-V789 HydrophobicContact CB-CG2 4.12Å; V789-N791 WeakPolarHBondContact CG1-O 3.25Å; V789-D794 HydrophobicContact CG1-CB 3.73Å; V789-A795 HydrophobicContact CG1-CB 3.84Å; V789-A795 VanDerWaalsContact CG1-N 3.3Å; V789-K798 HydrophobicContact CG2-CD 3.72Å; V789-I850 HydrophobicContact CB-CD1 4.26Å; V789-I850 HydrophobicContact CG1-CD1 4.16Å
790	E	73.9	Confident	82.1	Confident	183 Å²	183	68.5 Å²	68.5	86%	0.855	35%	0.353	S	S	*	.	S	Bend	trans	-89.8	-24.4	-172.9	-60.3	-176.4	175.6	0	0	113.4
791	N	82.6	Confident	82.1	Confident	60 Å²	60	69.9 Å²	69.9	32%	0.321	36%	0.364	S	S	.	.	S	Bend	trans	-146.4	158.6	-177	64.8	60.5	0	0	0	113.1	V789 P793 D794 A795 I850	V789-N791 WeakPolarHBondContact CG1-O 3.25Å; N791-P793 VanDerWaalsContact OD1-CD 3.25Å; N791-P793 WeakPolarHBondContact OD1-CD 3.38Å; N791-D794 VanDerWaalsContact CG-OD2 3.31Å; N791-D794 PolarHBondContact ND2-OD2 2.97Å; N791-D794 PolarHBondContact O-N 3.38Å; N791-D794 VanDerWaalsContact OD1-CB 3.24Å; N791-D794 WeakPolarHBondContact OD1-CB 3.33Å; N791-D794 PolarHBondContact OD1-N 2.96Å; N791-D794 PolarHBondContact OD1-OD2 3.34Å; N791-A795 PolarHBondContact O-N 3.41Å; N791-A795 VanDerWaalsContact O-N 3.09Å; N791-I850 WeakPolarHBondContact O-CD1 3.37Å
792	I	83.2	Confident	82	Confident	10 Å²	10	67.9 Å²	67.9	5%	0.051	36%	0.356	C	S	.	.	H	α-helix	trans	-58.9	-44.3	-179.4	-62.6	170.3	0	0	0	112.5	D794 A795 V796 V814 K818 H821 V841 V843	I792-D794 PolarHBondContact O-N 3.41Å; I792-A795 WeakPolarHBondContact O-CB 3.48Å; I792-A795 PolarHBondContact O-N 2.92Å; I792-V796 HydrophobicContact CG2-CG2 4.43Å; I792-V796 WeakPolarHBondContact O-CG2 3.48Å; I792-V796 PolarHBondContact O-N 3.13Å; I792-V814 HydrophobicContact CB-CG1 4.34Å; I792-V814 HydrophobicContact CG2-CG1 3.93Å; I792-V814 HydrophobicContact CG2-CG2 3.94Å; I792-K818 WeakPolarHBondContact CD1-O 3.25Å; I792-H821 HydrophobicContact CG2-CB 3.78Å; I792-V841 HydrophobicContact CG1-CG1 4.33Å; I792-V841 HydrophobicContact CG2-CB 4.37Å; I792-V841 HydrophobicContact CG2-CG1 4.27Å; I792-V843 HydrophobicContact CD1-CG2 4.01Å; I792-V843 HydrophobicContact CG1-CG2 4.05Å
793	P	84.8	Confident	81.9	Confident	65 Å²	65	63.7 Å²	63.7	42%	0.422	34%	0.336	S	S	.	.	H	α-helix	trans	-56.2	-44.1	176.2	-26.5	33.1	0	0	0	114.3	N791 A795 V796 K797 V814	N791-P793 VanDerWaalsContact OD1-CD 3.25Å; N791-P793 WeakPolarHBondContact OD1-CD 3.38Å; P793-A795 VanDerWaalsContact C-N 3.29Å; P793-A795 PolarHBondContact O-N 3.39Å; P793-V796 PolarHBondContact O-N 2.93Å; P793-K797 PolarHBondContact O-N 3.14Å; P793-V814 HydrophobicContact CB-CG2 4.4Å; P793-V814 HydrophobicContact CG-CB 4.09Å; P793-V814 HydrophobicContact CG-CG2 4.07Å
794	D	84.2	Confident	81.7	Confident	71 Å²	71	59.8 Å²	59.8	38%	0.38	32%	0.315	S	S	.	.	H	α-helix	trans	-67.7	-33.2	178.2	-70.9	-21.2	0	0	0	111.2	V789 N791 I792 K797 K798	V789-D794 HydrophobicContact CG1-CB 3.73Å; N791-D794 VanDerWaalsContact CG-OD2 3.31Å; N791-D794 PolarHBondContact ND2-OD2 2.97Å; N791-D794 PolarHBondContact O-N 3.38Å; N791-D794 VanDerWaalsContact OD1-CB 3.24Å; N791-D794 WeakPolarHBondContact OD1-CB 3.33Å; N791-D794 PolarHBondContact OD1-N 2.96Å; N791-D794 PolarHBondContact OD1-OD2 3.34Å; I792-D794 PolarHBondContact O-N 3.41Å; D794-K797 PolarHBondContact O-N 3.33Å; D794-K798 WeakPolarHBondContact O-CB 3.34Å; D794-K798 WeakPolarHBondContact O-CG 3.47Å; D794-K798 PolarHBondContact O-N 2.81Å
795	A	84.3	Confident	81.9	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-63.3	-51	174.5	0	0	0	0	0	110	L786 V789 N791 I792 P793 K797 K798 I799 V841 I850	L786-A795 HydrophobicContact CD1-CB 4.08Å; V789-A795 HydrophobicContact CG1-CB 3.84Å; V789-A795 VanDerWaalsContact CG1-N 3.3Å; N791-A795 PolarHBondContact O-N 3.41Å; N791-A795 VanDerWaalsContact O-N 3.09Å; I792-A795 WeakPolarHBondContact O-CB 3.48Å; I792-A795 PolarHBondContact O-N 2.92Å; P793-A795 VanDerWaalsContact C-N 3.29Å; P793-A795 PolarHBondContact O-N 3.39Å; A795-K797 PolarHBondContact O-N 3.35Å; A795-K798 PolarHBondContact O-N 3.36Å; A795-I799 HydrophobicContact CB-CD1 4.39Å; A795-I799 WeakPolarHBondContact O-CB 3.38Å; A795-I799 WeakPolarHBondContact O-CD1 3.48Å; A795-I799 WeakPolarHBondContact O-CG1 3.33Å; A795-I799 PolarHBondContact O-N 3.15Å; A795-V841 HydrophobicContact CB-CG1 4.04Å; A795-I850 HydrophobicContact CB-CD1 4.46Å; A795-I850 HydrophobicContact CB-CG2 4.35Å
796	V	85.2	Confident	82	Confident	4 Å²	4	54.5 Å²	54.5	2%	0.024	30%	0.295	C	S	.	.	H	α-helix	trans	-56.3	-41.5	178	171.9	0	0	0	0	111.4	I792 P793 S800 V814 V823	I792-V796 HydrophobicContact CG2-CG2 4.43Å; I792-V796 WeakPolarHBondContact O-CG2 3.48Å; I792-V796 PolarHBondContact O-N 3.13Å; P793-V796 PolarHBondContact O-N 2.93Å; V796-S800 WeakPolarHBondContact O-CB 3.36Å; V796-S800 PolarHBondContact O-N 2.82Å; V796-S800 VanDerWaalsContact O-N 3.16Å; V796-S800 PolarHBondContact O-OG 2.86Å; V796-V814 HydrophobicContact CG2-CG2 4.4Å; V796-V823 HydrophobicContact CG1-CB 4.2Å; V796-V823 HydrophobicContact CG1-CG2 3.79Å; V796-V823 HydrophobicContact CG2-CB 4.29Å; V796-V823 HydrophobicContact CG2-CG1 4.39Å
797	K	85.3	Confident	82.2	Confident	124 Å²	124	54.8 Å²	54.8	54%	0.539	30%	0.298	S	S	.	.	H	α-helix	trans	-65.9	-51.2	177.8	-171.9	-179	172.4	-167.4	0	112	P793 D794 A795 I799 S800 E801	P793-K797 PolarHBondContact O-N 3.14Å; D794-K797 PolarHBondContact O-N 3.33Å; A795-K797 PolarHBondContact O-N 3.35Å; K797-I799 PolarHBondContact O-N 3.38Å; K797-S800 WeakPolarHBondContact O-CB 3.29Å; K797-S800 PolarHBondContact O-N 3.31Å; K797-E801 WeakPolarHBondContact CE-OE1 3.27Å; K797-E801 WeakPolarHBondContact O-CG 3.26Å; K797-E801 PolarHBondContact O-N 2.95Å
798	K	84.5	Confident	82.8	Confident	82 Å²	82	49.4 Å²	49.4	36%	0.357	26%	0.26	S	S	.	.	H	α-helix	trans	-60.2	-43.4	179.3	-78.9	-179.6	171.7	-169	0	112.3	T788 V789 D794 A795 S800 E801 I802	T788-K798 PolarHBondContact O-NZ 2.85Å; V789-K798 HydrophobicContact CG2-CD 3.72Å; D794-K798 WeakPolarHBondContact O-CB 3.34Å; D794-K798 WeakPolarHBondContact O-CG 3.47Å; D794-K798 PolarHBondContact O-N 2.81Å; A795-K798 PolarHBondContact O-N 3.36Å; K798-S800 VanDerWaalsContact C-N 3.31Å; K798-S800 PolarHBondContact O-N 3.38Å; K798-E801 PolarHBondContact O-N 3.4Å; K798-I802 WeakPolarHBondContact O-CB 3.34Å; K798-I802 VanDerWaalsContact O-CG1 3.27Å; K798-I802 WeakPolarHBondContact O-CG1 3.11Å; K798-I802 PolarHBondContact O-N 3.29Å
799	I	86.8	Confident	83.2	Confident	7 Å²	7	49.6 Å²	49.6	4%	0.036	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-42.9	177.8	-62.7	153.7	0	0	0	110.6	L786 A795 K797 E801 I802 L803 L825 V841 M852 I854	L786-I799 HydrophobicContact CD1-CD1 4.4Å; A795-I799 HydrophobicContact CB-CD1 4.39Å; A795-I799 WeakPolarHBondContact O-CB 3.38Å; A795-I799 WeakPolarHBondContact O-CD1 3.48Å; A795-I799 WeakPolarHBondContact O-CG1 3.33Å; A795-I799 PolarHBondContact O-N 3.15Å; K797-I799 PolarHBondContact O-N 3.38Å; I799-E801 VanDerWaalsContact C-N 3.3Å; I799-E801 PolarHBondContact O-N 3.11Å; I799-I802 PolarHBondContact O-N 3.46Å; I799-L803 HydrophobicContact CG2-CD1 3.67Å; I799-L803 HydrophobicContact CG2-CG 4.3Å; I799-L803 WeakPolarHBondContact O-CB 3.42Å; I799-L803 WeakPolarHBondContact O-CG 3.44Å; I799-L803 PolarHBondContact O-N 3.32Å; I799-L825 HydrophobicContact CG2-CD1 3.81Å; I799-V841 HydrophobicContact CD1-CG2 4.05Å; I799-M852 HydrophobicContact CD1-CG 4.42Å; I799-M852 HydrophobicContact CD1-SD 3.15Å; I799-M852 WeakPolarHBondContact CD1-SD 3.26Å; I799-M852 HydrophobicContact CG1-CE 4.43Å; I799-M852 HydrophobicContact CG1-SD 3.61Å; I799-M852 HydrophobicContact CG2-SD 4.39Å; I799-I854 HydrophobicContact CG2-CD1 4.48Å
800	S	86.3	Confident	83	Confident	17 Å²	17	54.7 Å²	54.7	12%	0.119	27%	0.272	C	S	.	.	H	α-helix	trans	-62.9	-38.5	178	-55.2	0	0	0	0	111.6	V796 K797 K798 G804 L805 L825	V796-S800 WeakPolarHBondContact O-CB 3.36Å; V796-S800 PolarHBondContact O-N 2.82Å; V796-S800 VanDerWaalsContact O-N 3.16Å; V796-S800 PolarHBondContact O-OG 2.86Å; K797-S800 WeakPolarHBondContact O-CB 3.29Å; K797-S800 PolarHBondContact O-N 3.31Å; K798-S800 VanDerWaalsContact C-N 3.31Å; K798-S800 PolarHBondContact O-N 3.38Å; S800-G804 WeakPolarHBondContact O-CA 3.41Å; S800-G804 PolarHBondContact O-N 3.5Å; S800-L805 PolarHBondContact O-N 3.36Å; S800-L825 WeakPolarHBondContact OG-CD2 3.41Å
801	E	85.1	Confident	83.3	Confident	112 Å²	112	46.4 Å²	46.4	52%	0.523	23%	0.234	S	C	.	.	H	α-helix	trans	-70.1	-45.7	177.5	-72.1	171.9	179.8	0	0	112.4	S756 K797 K798 I799 G804	S756-E801 WeakPolarHBondContact CB-O 3.49Å; K797-E801 WeakPolarHBondContact CE-OE1 3.27Å; K797-E801 WeakPolarHBondContact O-CG 3.26Å; K797-E801 PolarHBondContact O-N 2.95Å; K798-E801 PolarHBondContact O-N 3.4Å; I799-E801 VanDerWaalsContact C-N 3.3Å; I799-E801 PolarHBondContact O-N 3.11Å; E801-G804 PolarHBondContact O-N 2.65Å
802	I	85.1	Confident	83.1	Confident	78 Å²	78	47.4 Å²	47.4	40%	0.4	24%	0.239	S	C	.	.	H	α-helix	trans	-61.9	-46.2	179.2	-70.1	166	0	0	0	111.1	S756 K798 I799 A870	S756-I802 WeakPolarHBondContact CB-O 3.42Å; K798-I802 WeakPolarHBondContact O-CB 3.34Å; K798-I802 VanDerWaalsContact O-CG1 3.27Å; K798-I802 WeakPolarHBondContact O-CG1 3.11Å; K798-I802 PolarHBondContact O-N 3.29Å; I799-I802 PolarHBondContact O-N 3.46Å; I802-A870 HydrophobicContact CG2-CB 4.26Å; I802-A870 WeakPolarHBondContact CG2-O 3.39Å
803	L	85.3	Confident	82.8	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-81.5	-17.1	-178.2	-60.4	177.8	0	0	0	112.9	V759 I799 L805 L825 I854 V867 A870 V871	V759-L803 WeakPolarHBondContact CB-O 3.41Å; V759-L803 WeakPolarHBondContact CG1-O 3.47Å; I799-L803 HydrophobicContact CG2-CD1 3.67Å; I799-L803 HydrophobicContact CG2-CG 4.3Å; I799-L803 WeakPolarHBondContact O-CB 3.42Å; I799-L803 WeakPolarHBondContact O-CG 3.44Å; I799-L803 PolarHBondContact O-N 3.32Å; L803-L805 HydrophobicContact CB-CB 4.34Å; L803-L805 HydrophobicContact CB-CD1 3.94Å; L803-L805 HydrophobicContact CB-CG 3.86Å; L803-L805 HydrophobicContact CD1-CD1 4.03Å; L803-L805 PolarHBondContact O-N 3.06Å; L803-L825 HydrophobicContact CD1-CD1 4.12Å; L803-I854 HydrophobicContact CD1-CD1 3.67Å; L803-V867 HydrophobicContact CD2-CG1 3.88Å; L803-V867 VanDerWaalsContact CD2-O 3.32Å; L803-V867 WeakPolarHBondContact CD2-O 3.29Å; L803-A870 HydrophobicContact CD2-CB 4.22Å; L803-V871 HydrophobicContact CD2-CG2 3.8Å
804	G	82.4	Confident	82.4	Confident	14 Å²	14	52.7 Å²	52.7	14%	0.144	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	16.3	-172.2	0	0	0	0	0	114.3	G761 S800 E801	G761-G804 VanDerWaalsContact CA-O 3.31Å; G761-G804 WeakPolarHBondContact CA-O 3.32Å; G761-G804 PolarHBondContact N-O 3.11Å; G761-G804 VanDerWaalsContact N-O 3.12Å; S800-G804 WeakPolarHBondContact O-CA 3.41Å; S800-G804 PolarHBondContact O-N 3.5Å; E801-G804 PolarHBondContact O-N 2.65Å
805	L	87.9	Confident	82	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.026	26%	0.255	C	S	.	.			trans	-93.6	154.6	-179.5	-59.7	174.2	0	0	0	111.3	V759 S800 L803 L825 V835	V759-L805 HydrophobicContact CG1-CD2 3.61Å; V759-L805 HydrophobicContact CG1-CG 4.33Å; S800-L805 PolarHBondContact O-N 3.36Å; L803-L805 HydrophobicContact CB-CB 4.34Å; L803-L805 HydrophobicContact CB-CD1 3.94Å; L803-L805 HydrophobicContact CB-CG 3.86Å; L803-L805 HydrophobicContact CD1-CD1 4.03Å; L803-L805 PolarHBondContact O-N 3.06Å; L805-L825 HydrophobicContact CB-CB 3.76Å; L805-L825 HydrophobicContact CD1-CB 3.88Å; L805-L825 HydrophobicContact CG-CB 4.48Å; L805-V835 HydrophobicContact CD1-CG1 4.5Å; L805-V835 HydrophobicContact CD2-CB 4.34Å; L805-V835 HydrophobicContact CD2-CG1 4.28Å
806	V	83.4	Confident	81.4	Confident	53 Å²	53	62 Å²	62	32%	0.321	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	137.8	-179.3	169.6	0	0	0	0	110.9	A763 C808 L825 S826	A763-V806 HydrophobicContact CB-CG1 3.96Å; V806-C808 PolarHBondContact O-N 2.84Å; V806-L825 WeakPolarHBondContact O-CA 3.3Å; V806-S826 PolarHBondContact N-O 3.43Å; V806-S826 PolarHBondContact O-N 3.26Å
807	P	84.1	Confident	80.6	Confident	35 Å²	35	65.8 Å²	65.8	23%	0.227	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	131.3	176.3	24.3	-33.2	0	0	0	112.9	D812 V823 F824 L825	P807-D812 HydrophobicContact CB-CB 3.94Å; P807-D812 HydrophobicContact CG-CB 3.79Å; P807-V823 HydrophobicContact CB-CG2 4.29Å; P807-F824 CarbonylContact C-O 3.44Å; P807-F824 VanDerWaalsContact CA-O 3.28Å; P807-F824 WeakPolarHBondContact CA-O 3.16Å; P807-L825 HydrophobicContact CB-CD2 4.16Å
808	C	80.4	Confident	80.1	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.007	34%	0.339	C	S	.	.	S	Bend	trans	-91.8	157.9	174.1	-75.6	0	0	0	0	111.6	K764 F767 V806 R810 S811 F824 S826	K764-C808 PolarHBondContact N-SG 3.38Å; F767-C808 HydrophobicContact CB-CB 4.14Å; F767-C808 HydrophobicContact CD2-CB 4.33Å; V806-C808 PolarHBondContact O-N 2.84Å; C808-R810 PolarHBondContact O-N 3.35Å; C808-S811 WeakPolarHBondContact O-CB 3.21Å; C808-S811 PolarHBondContact O-N 3.2Å; C808-S811 PolarHBondContact O-OG 2.94Å; C808-F824 HydrophobicContact CB-CB 4.2Å; C808-F824 PolarHBondContact N-O 3.33Å; C808-S826 PolarHBondContact SG-OG 3.09Å
809	E	77.8	Confident	79.9	Confident	106 Å²	106	66.6 Å²	66.6	50%	0.495	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	23.7	167.9	-58.7	-178.2	-178.9	0	0	115.6	S766 F767 S811	S766-E809 WeakPolarHBondContact CA-OE1 2.87Å; F767-E809 PolarHBondContact N-OE1 3.37Å; E809-S811 PolarHBondContact O-N 3.36Å
810	R	71.1	Confident	79.9	Confident	121 Å²	121	71.8 Å²	71.8	46%	0.457	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	28.9	-174.6	-53.2	178.8	176.6	179.7	-2.2	114.1	E423 C808 D812 R813	E423-R810 PolarHBondContact O-NH1 2.91Å; E423-R810 PolarHBondContact O-NH2 3.01Å; C808-R810 PolarHBondContact O-N 3.35Å; R810-D812 WeakPolarHBondContact CA-OD1 3.39Å; R810-D812 PolarHBondContact O-N 3.17Å; R810-D812 VanDerWaalsContact O-N 3.13Å; R810-R813 PolarHBondContact O-N 3.2Å; R810-R813 VanDerWaalsContact O-N 3.13Å
811	S	79.1	Confident	80	Confident	10 Å²	10	71.9 Å²	71.9	7%	0.07	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-2.9	175.5	68.5	0	0	0	0	113.2	C808 E809 R813 H821 V823 F824	C808-S811 WeakPolarHBondContact O-CB 3.21Å; C808-S811 PolarHBondContact O-N 3.2Å; C808-S811 PolarHBondContact O-OG 2.94Å; E809-S811 PolarHBondContact O-N 3.36Å; S811-R813 VanDerWaalsContact C-N 3.31Å; S811-H821 PolarHBondContact O-NE2 3.44Å; S811-V823 VanDerWaalsContact OG-CG2 3.29Å; S811-V823 WeakPolarHBondContact OG-CG2 3.27Å; S811-F824 PolarHBondContact OG-N 3.38Å; S811-F824 PolarHBondContact OG-O 3.12Å
812	D	78.9	Confident	80.2	Confident	80 Å²	80	68.5 Å²	68.5	43%	0.428	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-24.2	168.4	63.1	-44.9	0	0	0	113	P807 R810 V814	P807-D812 HydrophobicContact CB-CB 3.94Å; P807-D812 HydrophobicContact CG-CB 3.79Å; R810-D812 WeakPolarHBondContact CA-OD1 3.39Å; R810-D812 PolarHBondContact O-N 3.17Å; R810-D812 VanDerWaalsContact O-N 3.13Å; D812-V814 PolarHBondContact O-N 3.09Å
813	R	77.4	Confident	80.4	Confident	154 Å²	154	64.8 Å²	64.8	58%	0.581	34%	0.344	S	S	*	.			trans	-84.5	99.6	179.5	-66.6	-170.7	179.8	-170	-0.8	111.1	R810 S811 P815	R810-R813 PolarHBondContact O-N 3.2Å; R810-R813 VanDerWaalsContact O-N 3.13Å; S811-R813 VanDerWaalsContact C-N 3.31Å; R813-P815 WeakPolarHBondContact O-CD 3.2Å
814	V	76.8	Confident	80.6	Confident	33 Å²	33	67.2 Å²	67.2	20%	0.2	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-77.6	119.5	172.7	-171.2	0	0	0	0	109.5	I792 P793 V796 D812 H821	I792-V814 HydrophobicContact CB-CG1 4.34Å; I792-V814 HydrophobicContact CG2-CG1 3.93Å; I792-V814 HydrophobicContact CG2-CG2 3.94Å; P793-V814 HydrophobicContact CB-CG2 4.4Å; P793-V814 HydrophobicContact CG-CB 4.09Å; P793-V814 HydrophobicContact CG-CG2 4.07Å; V796-V814 HydrophobicContact CG2-CG2 4.4Å; D812-V814 PolarHBondContact O-N 3.09Å; V814-H821 HydrophobicContact CG1-CB 4.36Å
815	P	74.6	Confident	80.9	Confident	61 Å²	61	66.5 Å²	66.5	40%	0.396	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-64.8	140	173.9	-20.1	33.2	0	0	0	111.7	R813 G817 K818	R813-P815 WeakPolarHBondContact O-CD 3.2Å; P815-G817 PolarHBondContact O-N 3.06Å; P815-K818 HydrophobicContact CB-CD 4.24Å; P815-K818 HydrophobicContact CB-CG 4.34Å; P815-K818 HydrophobicContact CG-CD 4.06Å
816	E	71.1	Confident	80.9	Confident	204 Å²	204	66.3 Å²	66.3	95%	0.953	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	131.3	178.9	-70.9	-178.1	172	0	0	111.8
817	G	68.6	Low	81	Confident	85 Å²	85	63.8 Å²	63.8	88%	0.876	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	6.8	173.5	0	0	0	0	0	116.6	P815	P815-G817 PolarHBondContact O-N 3.06Å
818	K	76.4	Confident	81	Confident	117 Å²	117	62.6 Å²	62.6	51%	0.509	32%	0.323	S	S	.	.			trans	-81.8	136	173	-73.7	-164.2	177.1	-176.9	0	112.3	I792 P815	I792-K818 WeakPolarHBondContact CD1-O 3.25Å; P815-K818 HydrophobicContact CB-CD 4.24Å; P815-K818 HydrophobicContact CB-CG 4.34Å; P815-K818 HydrophobicContact CG-CD 4.06Å
819	T	79.8	Confident	81.3	Confident	106 Å²	106	63 Å²	63	65%	0.65	33%	0.325	S	S	*	.	S	Bend	trans	-89.6	-9.4	174.1	52.5	0	0	0	0	113.6	A842 V843	T819-A842 WeakPolarHBondContact O-CA 3.42Å; T819-V843 PolarHBondContact O-N 3.16Å
820	Q	85.8	Confident	81.5	Confident	115 Å²	115	59.8 Å²	59.8	54%	0.537	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	140.1	177.1	-176.7	-178.6	15.3	0	0	110.3	T840 V841 A842	Q820-T840 HydrophobicContact CG-CG2 4.01Å; Q820-V841 CarbonylContact C-O 3.52Å; Q820-V841 VanDerWaalsContact CA-O 3.32Å; Q820-V841 WeakPolarHBondContact CA-O 3Å; Q820-A842 HydrophobicContact CB-CB 4.28Å; Q820-A842 HydrophobicContact CG-CB 4.16Å
821	H	89.8	Confident	81.6	Confident	19 Å²	19	56.3 Å²	56.3	9%	0.088	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	143.3	178.1	-173.7	70.7	0	0	0	111.3	I792 S811 V814 V841	I792-H821 HydrophobicContact CG2-CB 3.78Å; S811-H821 PolarHBondContact O-NE2 3.44Å; V814-H821 HydrophobicContact CG1-CB 4.36Å; H821-V841 PolarHBondContact N-O 2.74Å; H821-V841 PolarHBondContact O-N 3.44Å
822	T	88.5	Confident	81.4	Confident	41 Å²	41	57.1 Å²	57.1	25%	0.252	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.3	175.3	-58	0	0	0	0	109.3	F824 K838 A839 T840	T822-F824 HydrophobicContact CG2-CD1 4.4Å; T822-F824 HydrophobicContact CG2-CE1 3.86Å; T822-F824 HydrophobicContact CG2-CZ 4.1Å; T822-K838 HydrophobicContact CG2-CD 4.44Å; T822-K838 HydrophobicContact CG2-CG 3.77Å; T822-A839 CarbonylContact C-O 3.52Å; T822-A839 WeakPolarHBondContact CA-O 3.43Å; T822-T840 PolarHBondContact OG1-OG1 3.05Å
823	V	89.1	Confident	81.6	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	137.2	172.8	65.8	0	0	0	0	110.1	V796 P807 S811 L825 A839	V796-V823 HydrophobicContact CG1-CB 4.2Å; V796-V823 HydrophobicContact CG1-CG2 3.79Å; V796-V823 HydrophobicContact CG2-CB 4.29Å; V796-V823 HydrophobicContact CG2-CG1 4.39Å; P807-V823 HydrophobicContact CB-CG2 4.29Å; S811-V823 VanDerWaalsContact OG-CG2 3.29Å; S811-V823 WeakPolarHBondContact OG-CG2 3.27Å; V823-L825 HydrophobicContact CG1-CD1 4.38Å; V823-L825 HydrophobicContact CG1-CG 4.3Å; V823-L825 HydrophobicContact CG2-CD2 3.76Å; V823-L825 HydrophobicContact CG2-CG 4.06Å; V823-A839 HydrophobicContact CG1-CB 3.7Å; V823-A839 PolarHBondContact N-O 2.91Å; V823-A839 PolarHBondContact O-N 3Å
824	F	89.4	Confident	81.9	Confident	51 Å²	51	52.9 Å²	52.9	22%	0.224	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	122.3	173.6	-56.2	-61.3	0	0	0	108.4	F767 P807 C808 S811 T822 K838	F767-F824 HydrophobicContact CB-CB 4.25Å; F767-F824 HydrophobicContact CD1-CB 3.89Å; F767-F824 AromaticContact CD1-CD1 3.48Å; F767-F824 HydrophobicContact CD1-CD1 3.48Å; F767-F824 VanDerWaalsContact CD1-CD1 3.48Å; F767-F824 HydrophobicContact CD1-CE1 4.16Å; F767-F824 AromaticContact CD1-CG 3.77Å; F767-F824 HydrophobicContact CD1-CG 3.77Å; F767-F824 HydrophobicContact CD2-CB 3.75Å; F767-F824 HydrophobicContact CE1-CB 4.13Å; F767-F824 AromaticContact CE1-CD1 3.39Å; F767-F824 HydrophobicContact CE1-CD1 3.39Å; F767-F824 HydrophobicContact CE1-CE1 4.12Å; F767-F824 HydrophobicContact CE1-CG 4.05Å; F767-F824 HydrophobicContact CE2-CB 3.98Å; F767-F824 HydrophobicContact CG-CB 3.68Å; F767-F824 HydrophobicContact CG-CD1 4.19Å; F767-F824 HydrophobicContact CG-CG 4.03Å; F767-F824 HydrophobicContact CZ-CB 4.15Å; F767-F824 HydrophobicContact CZ-CD1 4.01Å; P807-F824 CarbonylContact C-O 3.44Å; P807-F824 VanDerWaalsContact CA-O 3.28Å; P807-F824 WeakPolarHBondContact CA-O 3.16Å; C808-F824 HydrophobicContact CB-CB 4.2Å; C808-F824 PolarHBondContact N-O 3.33Å; S811-F824 PolarHBondContact OG-N 3.38Å; S811-F824 PolarHBondContact OG-O 3.12Å; T822-F824 HydrophobicContact CG2-CD1 4.4Å; T822-F824 HydrophobicContact CG2-CE1 3.86Å; T822-F824 HydrophobicContact CG2-CZ 4.1Å; F824-K838 HydrophobicContact CD1-CB 4.44Å; F824-K838 HydrophobicContact CD1-CG 4.05Å; F824-K838 HydrophobicContact CE1-CD 4.06Å; F824-K838 HydrophobicContact CE1-CG 3.92Å
825	L	88.5	Confident	82.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	138.7	-173.4	-64.3	175.2	0	0	0	109.5	F767 I799 S800 L803 L805 V806 P807 V823 S837	F767-L825 WeakPolarHBondContact CE2-O 3.38Å; I799-L825 HydrophobicContact CG2-CD1 3.81Å; S800-L825 WeakPolarHBondContact OG-CD2 3.41Å; L803-L825 HydrophobicContact CD1-CD1 4.12Å; L805-L825 HydrophobicContact CB-CB 3.76Å; L805-L825 HydrophobicContact CD1-CB 3.88Å; L805-L825 HydrophobicContact CG-CB 4.48Å; V806-L825 WeakPolarHBondContact O-CA 3.3Å; P807-L825 HydrophobicContact CB-CD2 4.16Å; V823-L825 HydrophobicContact CG1-CD1 4.38Å; V823-L825 HydrophobicContact CG1-CG 4.3Å; V823-L825 HydrophobicContact CG2-CD2 3.76Å; V823-L825 HydrophobicContact CG2-CG 4.06Å; L825-S837 PolarHBondContact N-O 3.05Å; L825-S837 PolarHBondContact O-N 3Å
826	S	87.6	Confident	83.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	149.8	178	65.8	0	0	0	0	113.3	V762 A763 K764 V806 C808	V762-S826 PolarHBondContact N-O 3.2Å; V762-S826 CarbonylContact O-C 3.53Å; V762-S826 WeakPolarHBondContact O-CB 3.43Å; V762-S826 PolarHBondContact O-OG 3.06Å; A763-S826 WeakPolarHBondContact CA-OG 3.49Å; K764-S826 PolarHBondContact N-OG 3.45Å; V806-S826 PolarHBondContact N-O 3.43Å; V806-S826 PolarHBondContact O-N 3.26Å; C808-S826 PolarHBondContact SG-OG 3.09Å
827	G	86.6	Confident	84	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.2	-174.7	177.2	0	0	0	0	0	111.9	Q760 V835	Q760-G827 CarbonylContact O-C 3.51Å; Q760-G827 VanDerWaalsContact O-CA 3.23Å; Q760-G827 WeakPolarHBondContact O-CA 3.31Å; G827-V835 PolarHBondContact N-O 3.38Å; G827-V835 PolarHBondContact O-N 2.69Å; G827-V835 VanDerWaalsContact O-O 3.11Å
828	V	84.6	Confident	85.1	Confident	11 Å²	11	38.1 Å²	38.1	7%	0.067	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	130.5	-179.7	-177.5	0	0	0	0	107.4	F626 Q760 V762 Y833	F626-V828 WeakPolarHBondContact CZ-O 3.15Å; Q760-V828 PolarHBondContact N-O 3.5Å; Q760-V828 PolarHBondContact O-N 3Å; V762-V828 HydrophobicContact CB-CG2 4.4Å; V762-V828 HydrophobicContact CG2-CG2 4.05Å; V828-Y833 CarbonylContact C-O 3.55Å; V828-Y833 WeakPolarHBondContact CA-O 3.42Å
829	F	86.4	Confident	85.7	Confident	10 Å²	10	32.6 Å²	32.6	4%	0.044	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	152.6	172.1	-171.5	-98	0	0	0	110.2	I714 V759 G831 G832 Y833 V835 V863 V867	I714-F829 HydrophobicContact CD1-CE2 4.06Å; I714-F829 HydrophobicContact CD1-CZ 4.41Å; I714-F829 HydrophobicContact CG2-CZ 4.44Å; V759-F829 HydrophobicContact CG2-CD2 3.81Å; V759-F829 HydrophobicContact CG2-CE2 4.49Å; F829-G831 PolarHBondContact O-N 3.22Å; F829-G832 PolarHBondContact O-N 3.47Å; F829-Y833 HydrophobicContact CD1-CD2 4.49Å; F829-Y833 PolarHBondContact N-O 3.23Å; F829-Y833 PolarHBondContact O-N 3.22Å; F829-V835 HydrophobicContact CB-CG2 3.84Å; F829-V863 HydrophobicContact CB-CG1 3.71Å; F829-V863 HydrophobicContact CD1-CG1 3.99Å; F829-V863 HydrophobicContact CD1-CG2 3.83Å; F829-V863 HydrophobicContact CD2-CG1 4Å; F829-V863 HydrophobicContact CE1-CG2 4.14Å; F829-V863 HydrophobicContact CG-CG1 3.64Å; F829-V863 HydrophobicContact CG-CG2 4.35Å; F829-V867 HydrophobicContact CD2-CG2 4.35Å
830	R	80.9	Confident	86.2	Confident	37 Å²	37	28.7 Å²	28.7	14%	0.14	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.1	138.4	176.5	63	177	176.6	102.5	-3.8	111.3	F626 A651 F708 S758	F626-R830 HydrophobicContact CD1-CB 4.01Å; F626-R830 HydrophobicContact CE1-CB 4.12Å; F626-R830 HydrophobicContact CG-CB 4.36Å; A651-R830 PolarHBondContact O-NH1 3.12Å; F708-R830 VanDerWaalsContact CG-NH2 3.34Å; S758-R830 PolarHBondContact O-N 3.12Å
831	G	73.6	Confident	86.3	Confident	48 Å²	48	23.2 Å²	23.2	50%	0.495	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	-2.7	-170.3	0	0	0	0	0	114.8	F829	F829-G831 PolarHBondContact O-N 3.22Å
832	G	74.7	Confident	86.2	Confident	27 Å²	27	23.7 Å²	23.7	28%	0.278	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.3	21	170.6	0	0	0	0	0	114.6	F829	F829-G832 PolarHBondContact O-N 3.47Å
833	Y	83.9	Confident	86	Confident	97 Å²	97	23.8 Å²	23.8	38%	0.38	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	122.9	178	-57.5	-76	0	0	0	110.4	V828 F829 E860 V863	V828-Y833 CarbonylContact C-O 3.55Å; V828-Y833 WeakPolarHBondContact CA-O 3.42Å; F829-Y833 HydrophobicContact CD1-CD2 4.49Å; F829-Y833 PolarHBondContact N-O 3.23Å; F829-Y833 PolarHBondContact O-N 3.22Å; Y833-E860 HydrophobicContact CD1-CB 4.17Å; Y833-E860 HydrophobicContact CE1-CB 4.38Å; Y833-V863 HydrophobicContact CD2-CG2 4.37Å
834	D	83	Confident	85.4	Confident	48 Å²	48	25.6 Å²	25.6	26%	0.257	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	137.4	174.8	-84	-38.4	0	0	0	110.2	K764 S858	K764-D834 VanDerWaalsContact NZ-CG 3.34Å; K764-D834 IonicContact NZ-OD1 3.7Å; K764-D834 PolarHBondContact NZ-OD1 2.94Å; K764-D834 IonicContact NZ-OD2 2.54Å; K764-D834 PolarHBondContact NZ-OD2 3.43Å; D834-S858 WeakPolarHBondContact O-CA 3.3Å; D834-S858 WeakPolarHBondContact O-CB 3.32Å; D834-S858 PolarHBondContact O-OG 2.7Å
835	V	87.7	Confident	84.6	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	120.6	175.1	-177.8	0	0	0	0	108.8	L805 G827 F829 I856 V863 V867	L805-V835 HydrophobicContact CD1-CG1 4.5Å; L805-V835 HydrophobicContact CD2-CB 4.34Å; L805-V835 HydrophobicContact CD2-CG1 4.28Å; G827-V835 PolarHBondContact N-O 3.38Å; G827-V835 PolarHBondContact O-N 2.69Å; G827-V835 VanDerWaalsContact O-O 3.11Å; F829-V835 HydrophobicContact CB-CG2 3.84Å; V835-I856 HydrophobicContact CG1-CG2 3.99Å; V835-V863 HydrophobicContact CG2-CG1 3.57Å; V835-V867 HydrophobicContact CG1-CG1 4.19Å; V835-V867 HydrophobicContact CG1-CG2 4.34Å
836	L	89.8	Confident	83.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	140.6	174.7	-60.2	-174.3	0	0	0	109.7	K764 F767 A770 W771 L774 I856 K857	K764-L836 HydrophobicContact CG-CD2 4.32Å; F767-L836 HydrophobicContact CD2-CD2 4.37Å; F767-L836 HydrophobicContact CE2-CB 3.91Å; F767-L836 HydrophobicContact CE2-CD1 4.38Å; F767-L836 HydrophobicContact CE2-CD2 4.13Å; F767-L836 HydrophobicContact CE2-CG 4.37Å; F767-L836 HydrophobicContact CZ-CB 4.19Å; A770-L836 HydrophobicContact CB-CD1 3.78Å; W771-L836 HydrophobicContact CB-CD1 4.33Å; W771-L836 HydrophobicContact CE3-CB 3.82Å; W771-L836 HydrophobicContact CE3-CD1 4.32Å; W771-L836 HydrophobicContact CZ3-CB 4.01Å; L774-L836 HydrophobicContact CD1-CB 4.26Å; L774-L836 HydrophobicContact CD1-CD1 3.27Å; L774-L836 HydrophobicContact CD1-CG 3.55Å; L836-I856 CarbonylContact O-C 3.56Å; L836-I856 WeakPolarHBondContact O-CA 3.24Å; L836-K857 PolarHBondContact N-O 3.14Å; L836-K857 PolarHBondContact O-N 3.11Å
837	S	90.2	Very high	83.1	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	139.2	176.8	172.5	0	0	0	0	111.5	F767 L825 I854 I855	F767-S837 WeakPolarHBondContact CZ-O 3.45Å; L825-S837 PolarHBondContact N-O 3.05Å; L825-S837 PolarHBondContact O-N 3Å; S837-I854 WeakPolarHBondContact OG-CD1 3.26Å; S837-I854 WeakPolarHBondContact OG-CG1 3.46Å; S837-I855 CarbonylContact C-O 3.58Å; S837-I855 VanDerWaalsContact CA-O 3.26Å; S837-I855 WeakPolarHBondContact CA-O 3.42Å
838	K	91	Very high	82.3	Confident	74 Å²	74	48 Å²	48	32%	0.322	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	107.7	171.4	-179.3	-179.1	177.6	-175.2	0	107.5	F767 W771 T822 F824 I855	F767-K838 HydrophobicContact CZ-CB 4.41Å; W771-K838 HydrophobicContact CH2-CB 3.94Å; W771-K838 HydrophobicContact CZ2-CB 4.47Å; W771-K838 HydrophobicContact CZ3-CB 4.16Å; T822-K838 HydrophobicContact CG2-CD 4.44Å; T822-K838 HydrophobicContact CG2-CG 3.77Å; F824-K838 HydrophobicContact CD1-CB 4.44Å; F824-K838 HydrophobicContact CD1-CG 4.05Å; F824-K838 HydrophobicContact CE1-CD 4.06Å; F824-K838 HydrophobicContact CE1-CG 3.92Å; K838-I855 PolarHBondContact N-O 3.02Å; K838-I855 PolarHBondContact O-N 3.43Å
839	A	89.3	Confident	82	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	123.2	178	0	0	0	0	0	110.5	T822 V823 M852 N853 I854	T822-A839 CarbonylContact C-O 3.52Å; T822-A839 WeakPolarHBondContact CA-O 3.43Å; V823-A839 HydrophobicContact CG1-CB 3.7Å; V823-A839 PolarHBondContact N-O 2.91Å; V823-A839 PolarHBondContact O-N 3Å; A839-M852 HydrophobicContact CB-CG 4.36Å; A839-M852 HydrophobicContact CB-SD 4.15Å; A839-N853 CarbonylContact C-O 3.49Å; A839-N853 WeakPolarHBondContact CA-O 3.21Å; A839-I854 HydrophobicContact CB-CB 4.27Å; A839-I854 HydrophobicContact CB-CD1 4.26Å; A839-I854 HydrophobicContact CB-CG1 4Å
840	T	90.3	Very high	81.8	Confident	25 Å²	25	48.4 Å²	48.4	15%	0.153	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	115.1	175.4	-57.6	0	0	0	0	108.9	Q820 T822 M852 N853	Q820-T840 HydrophobicContact CG-CG2 4.01Å; T822-T840 PolarHBondContact OG1-OG1 3.05Å; T840-M852 CarbonylContact O-C 3.56Å; T840-M852 WeakPolarHBondContact O-CA 3.37Å; T840-N853 PolarHBondContact N-O 3.39Å; T840-N853 PolarHBondContact O-N 3.49Å
841	V	88.4	Confident	82	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.5	-176.4	-172.9	0	0	0	0	108.6	I792 A795 I799 Q820 H821 I850 A851 M852	I792-V841 HydrophobicContact CG1-CG1 4.33Å; I792-V841 HydrophobicContact CG2-CB 4.37Å; I792-V841 HydrophobicContact CG2-CG1 4.27Å; A795-V841 HydrophobicContact CB-CG1 4.04Å; I799-V841 HydrophobicContact CD1-CG2 4.05Å; Q820-V841 CarbonylContact C-O 3.52Å; Q820-V841 VanDerWaalsContact CA-O 3.32Å; Q820-V841 WeakPolarHBondContact CA-O 3Å; H821-V841 PolarHBondContact N-O 2.74Å; H821-V841 PolarHBondContact O-N 3.44Å; V841-I850 HydrophobicContact CG1-CG2 3.14Å; V841-A851 CarbonylContact C-O 3.54Å; V841-A851 WeakPolarHBondContact CA-O 3.28Å; V841-M852 HydrophobicContact CG2-CG 4.16Å
842	A	86.6	Confident	82.7	Confident	28 Å²	28	45.7 Å²	45.7	23%	0.231	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	144.8	179.9	0	0	0	0	0	111.1	T819 Q820 I850 A851	T819-A842 WeakPolarHBondContact O-CA 3.42Å; Q820-A842 HydrophobicContact CB-CB 4.28Å; Q820-A842 HydrophobicContact CG-CB 4.16Å; A842-I850 CarbonylContact O-C 3.51Å; A842-I850 WeakPolarHBondContact O-CA 3.45Å; A842-A851 PolarHBondContact N-O 3.01Å; A842-A851 PolarHBondContact O-N 2.92Å
843	V	83.7	Confident	83.5	Confident	43 Å²	43	46.3 Å²	46.3	26%	0.261	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	125.4	171.8	-178.1	0	0	0	0	108.6	I792 T819 P845	I792-V843 HydrophobicContact CD1-CG2 4.01Å; I792-V843 HydrophobicContact CG1-CG2 4.05Å; T819-V843 PolarHBondContact O-N 3.16Å; V843-P845 WeakPolarHBondContact O-CD 3.32Å
844	D	78	Confident	83.8	Confident	38 Å²	38	41.7 Å²	41.7	20%	0.203	24%	0.238	C	C	.	.			trans	-68.8	121.3	172.7	-166.2	-41.8	0	0	0	109.2	N846 N848 S849	D844-N846 PolarHBondContact O-N 3.25Å; D844-N846 WeakPolarHBondContact OD1-CB 3.42Å; D844-N846 PolarHBondContact OD1-N 3.3Å; D844-N846 PolarHBondContact OD1-ND2 3.16Å; D844-N848 WeakPolarHBondContact O-CA 3.49Å; D844-N848 PolarHBondContact O-N 3.31Å; D844-S849 PolarHBondContact N-O 3.25Å
845	P	71.1	Confident	84.2	Confident	118 Å²	118	40.9 Å²	40.9	77%	0.766	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-14.1	-177.7	26.5	-35	0	0	0	114.4	V843	V843-P845 WeakPolarHBondContact O-CD 3.32Å
846	N	72.3	Confident	84.2	Confident	136 Å²	136	40.9 Å²	40.9	73%	0.727	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-48	-177.6	-61.9	-43.4	0	0	0	112.7	D844	D844-N846 PolarHBondContact O-N 3.25Å; D844-N846 WeakPolarHBondContact OD1-CB 3.42Å; D844-N846 PolarHBondContact OD1-N 3.3Å; D844-N846 PolarHBondContact OD1-ND2 3.16Å
847	D	72.7	Confident	84.2	Confident	134 Å²	134	41.3 Å²	41.3	72%	0.717	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.7	2.5	-171.5	-68.8	-25.3	0	0	0	113.4	S849	D847-S849 PolarHBondContact O-N 3.07Å
848	N	71.2	Confident	84.1	Confident	133 Å²	133	41.4 Å²	41.4	71%	0.711	24%	0.236	S	C	*	.			trans	58.1	14.8	-177.2	-126.9	32.3	0	0	0	113.7	D844	D844-N848 WeakPolarHBondContact O-CA 3.49Å; D844-N848 PolarHBondContact O-N 3.31Å
849	S	77.7	Confident	83.6	Confident	30 Å²	30	42.2 Å²	42.2	21%	0.21	24%	0.244	C	C	.	.			trans	-77.3	158.6	174.1	60.3	0	0	0	0	110.4	D844 D847	D844-S849 PolarHBondContact N-O 3.25Å; D847-S849 PolarHBondContact O-N 3.07Å
850	I	82.7	Confident	83.2	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	114.7	-177.4	-62.5	179.7	0	0	0	109.2	L786 V789 N791 A795 V841 A842	L786-I850 HydrophobicContact CB-CB 4.36Å; L786-I850 HydrophobicContact CD1-CG2 4.28Å; L786-I850 PolarHBondContact N-O 2.93Å; V789-I850 HydrophobicContact CB-CD1 4.26Å; V789-I850 HydrophobicContact CG1-CD1 4.16Å; N791-I850 WeakPolarHBondContact O-CD1 3.37Å; A795-I850 HydrophobicContact CB-CD1 4.46Å; A795-I850 HydrophobicContact CB-CG2 4.35Å; V841-I850 HydrophobicContact CG1-CG2 3.14Å; A842-I850 CarbonylContact O-C 3.51Å; A842-I850 WeakPolarHBondContact O-CA 3.45Å
851	A	85	Confident	82.7	Confident	27 Å²	27	47.3 Å²	47.3	22%	0.223	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	136.6	170.2	0	0	0	0	0	110	V841 A842	V841-A851 CarbonylContact C-O 3.54Å; V841-A851 WeakPolarHBondContact CA-O 3.28Å; A842-A851 PolarHBondContact N-O 3.01Å; A842-A851 PolarHBondContact O-N 2.92Å
852	M	88.3	Confident	82.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	123.8	177.2	178.8	-176.5	69.8	0	0	110.3	T783 F784 L786 I799 A839 T840 V841 I854 V871	T783-M852 CarbonylContact C-O 3.51Å; T783-M852 VanDerWaalsContact CA-O 3.3Å; T783-M852 WeakPolarHBondContact CA-O 3.19Å; F784-M852 HydrophobicContact CB-CE 4.2Å; F784-M852 HydrophobicContact CD2-CE 3.77Å; F784-M852 HydrophobicContact CG-CE 4.28Å; F784-M852 PolarHBondContact N-O 3.25Å; F784-M852 PolarHBondContact O-N 3.07Å; L786-M852 HydrophobicContact CD1-CB 4.06Å; L786-M852 HydrophobicContact CD1-SD 4.36Å; L786-M852 HydrophobicContact CG-CB 4.41Å; I799-M852 HydrophobicContact CD1-CG 4.42Å; I799-M852 HydrophobicContact CD1-SD 3.15Å; I799-M852 WeakPolarHBondContact CD1-SD 3.26Å; I799-M852 HydrophobicContact CG1-CE 4.43Å; I799-M852 HydrophobicContact CG1-SD 3.61Å; I799-M852 HydrophobicContact CG2-SD 4.39Å; A839-M852 HydrophobicContact CB-CG 4.36Å; A839-M852 HydrophobicContact CB-SD 4.15Å; T840-M852 CarbonylContact O-C 3.56Å; T840-M852 WeakPolarHBondContact O-CA 3.37Å; V841-M852 HydrophobicContact CG2-CG 4.16Å; M852-I854 HydrophobicContact CE-CB 4.24Å; M852-I854 HydrophobicContact CE-CG2 4.21Å; M852-I854 HydrophobicContact SD-CB 4.48Å; M852-V871 HydrophobicContact CE-CG1 3.36Å
853	N	90.8	Very high	82.1	Confident	40 Å²	40	51.8 Å²	51.8	21%	0.214	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	123.6	163.9	172.6	-75.3	0	0	0	108.2	E781 E782 T783 A839 T840	E781-N853 PolarHBondContact OE1-ND2 3.18Å; E782-N853 WeakPolarHBondContact O-CA 3.46Å; T783-N853 PolarHBondContact OG1-ND2 3.05Å; A839-N853 CarbonylContact C-O 3.49Å; A839-N853 WeakPolarHBondContact CA-O 3.21Å; T840-N853 PolarHBondContact N-O 3.39Å; T840-N853 PolarHBondContact O-N 3.49Å
854	I	90.2	Very high	82.1	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	131.6	-179	-171	168.1	0	0	0	110.4	E781 E782 F784 I799 L803 S837 A839 M852 I856 I868 V871	E781-I854 WeakPolarHBondContact CA-O 3.42Å; E782-I854 PolarHBondContact N-O 3.36Å; E782-I854 PolarHBondContact O-N 3.04Å; F784-I854 HydrophobicContact CD2-CG2 3.82Å; F784-I854 HydrophobicContact CE2-CG2 3.52Å; I799-I854 HydrophobicContact CG2-CD1 4.48Å; L803-I854 HydrophobicContact CD1-CD1 3.67Å; S837-I854 WeakPolarHBondContact OG-CD1 3.26Å; S837-I854 WeakPolarHBondContact OG-CG1 3.46Å; A839-I854 HydrophobicContact CB-CB 4.27Å; A839-I854 HydrophobicContact CB-CD1 4.26Å; A839-I854 HydrophobicContact CB-CG1 4Å; M852-I854 HydrophobicContact CE-CB 4.24Å; M852-I854 HydrophobicContact CE-CG2 4.21Å; M852-I854 HydrophobicContact SD-CB 4.48Å; I854-I856 HydrophobicContact CD1-CD1 4.16Å; I854-I856 HydrophobicContact CD1-CG1 4.37Å; I854-I856 HydrophobicContact CG1-CD1 4.37Å; I854-I856 HydrophobicContact CG1-CG1 4.22Å; I854-I868 HydrophobicContact CG2-CD1 4.35Å; I854-I868 HydrophobicContact CG2-CG1 4.31Å; I854-V871 HydrophobicContact CD1-CG2 4.32Å
855	I	90.6	Very high	82.4	Confident	31 Å²	31	50.9 Å²	50.9	16%	0.159	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122	175.4	-51.6	170.4	0	0	0	108	W771 T779 R780 E781 S837 K838	W771-I855 HydrophobicContact CH2-CB 3.98Å; W771-I855 HydrophobicContact CH2-CG2 3.65Å; W771-I855 HydrophobicContact CZ2-CB 4.35Å; W771-I855 HydrophobicContact CZ2-CG2 3.79Å; T779-I855 HydrophobicContact CG2-CG2 3.54Å; R780-I855 CarbonylContact O-C 3.5Å; R780-I855 VanDerWaalsContact O-CA 3.25Å; R780-I855 WeakPolarHBondContact O-CA 3.11Å; E781-I855 HydrophobicContact CB-CG1 4.14Å; E781-I855 HydrophobicContact CG-CG1 3.87Å; S837-I855 CarbonylContact C-O 3.58Å; S837-I855 VanDerWaalsContact CA-O 3.26Å; S837-I855 WeakPolarHBondContact CA-O 3.42Å; K838-I855 PolarHBondContact N-O 3.02Å; K838-I855 PolarHBondContact O-N 3.43Å
856	I	89.3	Confident	82.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	136	177.3	-68.2	157.5	0	0	0	109.5	T779 R780 V835 L836 I854 A864 V867 I868	T779-I856 WeakPolarHBondContact CA-O 3.45Å; R780-I856 PolarHBondContact N-O 3Å; R780-I856 PolarHBondContact O-N 3.23Å; V835-I856 HydrophobicContact CG1-CG2 3.99Å; L836-I856 CarbonylContact O-C 3.56Å; L836-I856 WeakPolarHBondContact O-CA 3.24Å; I854-I856 HydrophobicContact CD1-CD1 4.16Å; I854-I856 HydrophobicContact CD1-CG1 4.37Å; I854-I856 HydrophobicContact CG1-CD1 4.37Å; I854-I856 HydrophobicContact CG1-CG1 4.22Å; I856-A864 HydrophobicContact CG2-CB 4.15Å; I856-V867 HydrophobicContact CD1-CB 4.35Å; I856-V867 HydrophobicContact CD1-CG1 3.88Å; I856-V867 HydrophobicContact CG2-CB 4.45Å; I856-V867 HydrophobicContact CG2-CG1 4.44Å; I856-I868 HydrophobicContact CD1-CB 3.61Å; I856-I868 HydrophobicContact CD1-CD1 4.34Å; I856-I868 HydrophobicContact CD1-CG1 3.89Å
857	K	89.3	Confident	83.5	Confident	9 Å²	9	40.7 Å²	40.7	4%	0.039	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	137.5	172.9	-72.4	-168.3	173.1	-159.6	0	110.4	W771 G775 D776 T779 L836	W771-K857 HydrophobicContact CD2-CD 3.88Å; W771-K857 HydrophobicContact CE3-CD 4.1Å; W771-K857 HydrophobicContact CE3-CG 4.4Å; W771-K857 HydrophobicContact CH2-CB 4.37Å; W771-K857 HydrophobicContact CH2-CD 3.96Å; W771-K857 HydrophobicContact CH2-CG 3.73Å; W771-K857 HydrophobicContact CZ2-CD 3.69Å; W771-K857 HydrophobicContact CZ2-CG 3.92Å; W771-K857 HydrophobicContact CZ3-CB 4.15Å; W771-K857 HydrophobicContact CZ3-CD 4.14Å; W771-K857 HydrophobicContact CZ3-CG 3.98Å; G775-K857 PolarHBondContact O-NZ 3.21Å; D776-K857 IonicContact OD1-NZ 3.79Å; D776-K857 PolarHBondContact OD1-NZ 3.03Å; T779-K857 HydrophobicContact CG2-CG 3.9Å; T779-K857 WeakPolarHBondContact OG1-CE 3.48Å; L836-K857 PolarHBondContact N-O 3.14Å; L836-K857 PolarHBondContact O-N 3.11Å
858	S	86.8	Confident	84.1	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.014	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	168.8	170.8	-168	0	0	0	0	111.1	A778 D834 E860	A778-S858 WeakPolarHBondContact CB-O 3.45Å; A778-S858 PolarHBondContact O-N 3.37Å; D834-S858 WeakPolarHBondContact O-CA 3.3Å; D834-S858 WeakPolarHBondContact O-CB 3.32Å; D834-S858 PolarHBondContact O-OG 2.7Å; S858-E860 PolarHBondContact O-N 3.14Å
859	N	80.6	Confident	84.6	Confident	92 Å²	92	30.9 Å²	30.9	49%	0.492	18%	0.175	S	C	.	.	S	Bend	trans	-71.3	-20.5	172	-71.6	-24	0	0	0	112.2	L774	L774-N859 WeakPolarHBondContact CD2-OD1 3.39Å
860	E	81.8	Confident	84.6	Confident	77 Å²	77	30.5 Å²	30.5	36%	0.36	17%	0.173	S	C	.	.	S	Bend	trans	-121.9	125.6	-177.3	-168.9	65.2	-157.1	0	0	110	Y833 S858 L862 V863 A864	Y833-E860 HydrophobicContact CD1-CB 4.17Å; Y833-E860 HydrophobicContact CE1-CB 4.38Å; S858-E860 PolarHBondContact O-N 3.14Å; E860-L862 VanDerWaalsContact C-N 3.32Å; E860-L862 PolarHBondContact O-N 2.96Å; E860-V863 HydrophobicContact CB-CB 4.37Å; E860-V863 HydrophobicContact CB-CG2 3.9Å; E860-V863 HydrophobicContact CG-CG2 4.3Å; E860-V863 PolarHBondContact O-N 2.85Å; E860-V863 VanDerWaalsContact O-N 3.15Å; E860-A864 PolarHBondContact O-N 3.12Å
861	P	79.4	Confident	84.2	Confident	54 Å²	54	31.6 Å²	31.6	35%	0.351	18%	0.18	S	C	.	.	H	α-helix	trans	-58.4	-40.4	-176.3	-23.9	31.7	0	0	0	113.8	A778 V863 A864 D865	A778-P861 HydrophobicContact CB-CB 4.3Å; A778-P861 HydrophobicContact CB-CG 4.06Å; P861-V863 VanDerWaalsContact C-N 3.27Å; P861-V863 PolarHBondContact O-N 3.39Å; P861-A864 PolarHBondContact O-N 3.29Å; P861-D865 PolarHBondContact O-N 3.34Å
862	L	80.2	Confident	83	Confident	116 Å²	116	37.7 Å²	37.7	61%	0.607	21%	0.214	S	C	*	.	H	α-helix	trans	-61.2	-35.9	179.5	-70.3	168.2	0	0	0	111.9	E860 D865 L866	E860-L862 VanDerWaalsContact C-N 3.32Å; E860-L862 PolarHBondContact O-N 2.96Å; L862-D865 PolarHBondContact O-N 3.22Å; L862-L866 VanDerWaalsContact O-CG 3.22Å; L862-L866 WeakPolarHBondContact O-CG 3.5Å; L862-L866 PolarHBondContact O-N 3.16Å
863	V	83.3	Confident	82.8	Confident	7 Å²	7	39.6 Å²	39.6	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-68.2	-37.8	179.3	177.3	0	0	0	0	110.9	F829 Y833 V835 E860 P861 L866 V867	F829-V863 HydrophobicContact CB-CG1 3.71Å; F829-V863 HydrophobicContact CD1-CG1 3.99Å; F829-V863 HydrophobicContact CD1-CG2 3.83Å; F829-V863 HydrophobicContact CD2-CG1 4Å; F829-V863 HydrophobicContact CE1-CG2 4.14Å; F829-V863 HydrophobicContact CG-CG1 3.64Å; F829-V863 HydrophobicContact CG-CG2 4.35Å; Y833-V863 HydrophobicContact CD2-CG2 4.37Å; V835-V863 HydrophobicContact CG2-CG1 3.57Å; E860-V863 HydrophobicContact CB-CB 4.37Å; E860-V863 HydrophobicContact CB-CG2 3.9Å; E860-V863 HydrophobicContact CG-CG2 4.3Å; E860-V863 PolarHBondContact O-N 2.85Å; E860-V863 VanDerWaalsContact O-N 3.15Å; P861-V863 VanDerWaalsContact C-N 3.27Å; P861-V863 PolarHBondContact O-N 3.39Å; V863-L866 PolarHBondContact O-N 3.32Å; V863-V867 HydrophobicContact CG1-CG2 4.21Å; V863-V867 WeakPolarHBondContact O-CB 3.41Å; V863-V867 WeakPolarHBondContact O-CG2 3.48Å; V863-V867 PolarHBondContact O-N 3.37Å
864	A	83.8	Confident	82.4	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.4	-39.8	176.3	0	0	0	0	0	111.9	R780 I856 E860 P861 I868	R780-A864 HydrophobicContact CG-CB 3.97Å; I856-A864 HydrophobicContact CG2-CB 4.15Å; E860-A864 PolarHBondContact O-N 3.12Å; P861-A864 PolarHBondContact O-N 3.29Å; A864-I868 WeakPolarHBondContact O-CB 3.43Å; A864-I868 WeakPolarHBondContact O-CG2 3.43Å; A864-I868 PolarHBondContact O-N 3.15Å; A864-I868 VanDerWaalsContact O-N 3.11Å
865	D	83.1	Confident	81.9	Confident	61 Å²	61	41.7 Å²	41.7	33%	0.326	24%	0.238	S	C	.	.	H	α-helix	trans	-64.3	-42.5	175.9	-75.8	-40.4	0	0	0	112.3	R780 P861 L862 I868 S869	R780-D865 WeakPolarHBondContact CD-OD1 3.12Å; R780-D865 WeakPolarHBondContact CG-OD1 3.34Å; R780-D865 IonicContact CZ-OD1 2.72Å; R780-D865 IonicContact CZ-OD2 2.64Å; R780-D865 IonicContact NE-OD1 2.88Å; R780-D865 PolarHBondContact NE-OD1 3.17Å; R780-D865 IonicContact NE-OD2 3.48Å; R780-D865 IonicContact NH2-OD1 2.68Å; R780-D865 PolarHBondContact NH2-OD1 3.29Å; R780-D865 IonicContact NH2-OD2 2.71Å; R780-D865 PolarHBondContact NH2-OD2 2.8Å; P861-D865 PolarHBondContact O-N 3.34Å; L862-D865 PolarHBondContact O-N 3.22Å; D865-I868 WeakPolarHBondContact O-CG2 3.48Å; D865-S869 PolarHBondContact O-N 3.48Å; D865-S869 PolarHBondContact O-OG 3.07Å
866	L	82.2	Confident	81.4	Confident	41 Å²	41	42.4 Å²	42.4	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-72.5	-33.7	179.6	-67.9	175	0	0	0	113.4	G712 I714 L862 V863 S869	G712-L866 WeakPolarHBondContact O-CD2 3.5Å; I714-L866 HydrophobicContact CD1-CB 3.66Å; I714-L866 HydrophobicContact CD1-CD1 4.41Å; I714-L866 HydrophobicContact CD1-CG 4.45Å; I714-L866 HydrophobicContact CG1-CB 4.2Å; I714-L866 HydrophobicContact CG1-CD2 4.24Å; I714-L866 HydrophobicContact CG2-CD1 4.22Å; L862-L866 VanDerWaalsContact O-CG 3.22Å; L862-L866 WeakPolarHBondContact O-CG 3.5Å; L862-L866 PolarHBondContact O-N 3.16Å; V863-L866 PolarHBondContact O-N 3.32Å; L866-S869 PolarHBondContact O-OG 2.87Å
867	V	84.1	Confident	80.9	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-76.6	-33.5	179	176.7	0	0	0	0	111.2	V755 V759 L803 F829 V835 I856 V863 A870	V755-V867 HydrophobicContact CG1-CG2 4.33Å; V759-V867 HydrophobicContact CG2-CG2 4.39Å; L803-V867 HydrophobicContact CD2-CG1 3.88Å; L803-V867 VanDerWaalsContact CD2-O 3.32Å; L803-V867 WeakPolarHBondContact CD2-O 3.29Å; F829-V867 HydrophobicContact CD2-CG2 4.35Å; V835-V867 HydrophobicContact CG1-CG1 4.19Å; V835-V867 HydrophobicContact CG1-CG2 4.34Å; I856-V867 HydrophobicContact CD1-CB 4.35Å; I856-V867 HydrophobicContact CD1-CG1 3.88Å; I856-V867 HydrophobicContact CG2-CB 4.45Å; I856-V867 HydrophobicContact CG2-CG1 4.44Å; V863-V867 HydrophobicContact CG1-CG2 4.21Å; V863-V867 WeakPolarHBondContact O-CB 3.41Å; V863-V867 WeakPolarHBondContact O-CG2 3.48Å; V863-V867 PolarHBondContact O-N 3.37Å; V867-A870 WeakPolarHBondContact O-CB 3.37Å
868	I	85.1	Confident	80.4	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.036	27%	0.272	C	S	.	.	H	α-helix	trans	-73.3	-34.3	177.9	-157.9	160.5	0	0	0	112.1	R780 E782 F784 I854 I856 A864 D865 A870 V871	R780-I868 HydrophobicContact CB-CD1 3.79Å; R780-I868 HydrophobicContact CB-CG2 4.38Å; E782-I868 HydrophobicContact CB-CD1 3.79Å; E782-I868 HydrophobicContact CB-CG1 4.27Å; E782-I868 HydrophobicContact CG-CD1 3.79Å; E782-I868 HydrophobicContact CG-CG1 4.36Å; F784-I868 HydrophobicContact CE2-CG1 4.48Å; I854-I868 HydrophobicContact CG2-CD1 4.35Å; I854-I868 HydrophobicContact CG2-CG1 4.31Å; I856-I868 HydrophobicContact CD1-CB 3.61Å; I856-I868 HydrophobicContact CD1-CD1 4.34Å; I856-I868 HydrophobicContact CD1-CG1 3.89Å; A864-I868 WeakPolarHBondContact O-CB 3.43Å; A864-I868 WeakPolarHBondContact O-CG2 3.43Å; A864-I868 PolarHBondContact O-N 3.15Å; A864-I868 VanDerWaalsContact O-N 3.11Å; D865-I868 WeakPolarHBondContact O-CG2 3.48Å; I868-A870 PolarHBondContact O-N 2.63Å; I868-V871 PolarHBondContact O-N 3.23Å
869	S	81.6	Confident	79.9	Confident	54 Å²	54	50.6 Å²	50.6	38%	0.378	29%	0.29	S	S	.	.	H	α-helix	trans	-63.8	-21	177.3	66.6	0	0	0	0	113.4	D865 L866 V871 V872	D865-S869 PolarHBondContact O-N 3.48Å; D865-S869 PolarHBondContact O-OG 3.07Å; L866-S869 PolarHBondContact O-OG 2.87Å; S869-V871 PolarHBondContact O-N 3.14Å; S869-V872 PolarHBondContact O-N 3.44Å
870	A	79	Confident	79.8	Confident	21 Å²	21	47.5 Å²	47.5	17%	0.174	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.8	177.3	0	0	0	0	0	114.4	V755 I802 L803 V867 I868	V755-A870 HydrophobicContact CB-CB 3.59Å; V755-A870 HydrophobicContact CG1-CB 3.91Å; V755-A870 HydrophobicContact CG2-CB 3.45Å; V755-A870 VanDerWaalsContact CG2-CB 3.45Å; I802-A870 HydrophobicContact CG2-CB 4.26Å; I802-A870 WeakPolarHBondContact CG2-O 3.39Å; L803-A870 HydrophobicContact CD2-CB 4.22Å; V867-A870 WeakPolarHBondContact O-CB 3.37Å; I868-A870 PolarHBondContact O-N 2.63Å
871	V	73.8	Confident	79.7	Confident	25 Å²	25	45 Å²	45	15%	0.152	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-20.2	-177.2	-178.2	0	0	0	0	111.9	F784 L803 M852 I854 I868 S869	F784-V871 HydrophobicContact CB-CG1 4.43Å; F784-V871 HydrophobicContact CD1-CG1 3.98Å; F784-V871 HydrophobicContact CD2-CB 4.33Å; F784-V871 HydrophobicContact CD2-CG1 3.53Å; F784-V871 HydrophobicContact CE1-CB 4.23Å; F784-V871 HydrophobicContact CE1-CG1 4.05Å; F784-V871 HydrophobicContact CE2-CB 3.88Å; F784-V871 HydrophobicContact CE2-CG1 3.6Å; F784-V871 HydrophobicContact CG-CG1 3.7Å; F784-V871 HydrophobicContact CZ-CB 3.81Å; F784-V871 HydrophobicContact CZ-CG1 3.86Å; L803-V871 HydrophobicContact CD2-CG2 3.8Å; M852-V871 HydrophobicContact CE-CG1 3.36Å; I854-V871 HydrophobicContact CD1-CG2 4.32Å; I868-V871 PolarHBondContact O-N 3.23Å; S869-V871 PolarHBondContact O-N 3.14Å
872	V	60.6	Low	79.7	Confident	154 Å²	154	44.2 Å²	44.2	93%	0.933	26%	0.26	S	S	*	.			trans	-74.5	0	174.7	-175.8	0	0	0	0	109.2	F784 S869	F784-V872 HydrophobicContact CE1-CG2 3.69Å; F784-V872 HydrophobicContact CZ-CG2 4.21Å; S869-V872 PolarHBondContact O-N 3.44Å

Retrieved 872 of 872 residues in 402.8 ms (Link to these results)

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