A0A096NEA3_PAPAN Loading...

Coatomer subunit beta

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 (A0A2K6UZ38), UniProt , Accession A0A096NEA3, Species PAPAN (Papio anubis, Olive baboon), Gene COPB1, Length 953 aa.

						>A0A096NEA3_PAPAN|A0A096NEA3|COPB1
MTAAENVCYTLINVPMDSEPPSEISLKNDLEKGDVKSKTEALKKVIIMILNGEKLPGLLMTIIRFVLPLQDHTIKKLLLVFWEIVPKTTPDGRLLHEMILVCDAYRKDLQHPNEFIRGSTLRFLCKLKEAELLEPLMPAIRACLEHRHSYVRRNAVLAIYTIYRNFEHLIPDAPELIHDFLVNEKDASCKRNAFMMLIHADQDRALDYLSTCIDQVQTFGDILQLVIVELIYKVCHANPSERARFIRCIYNLLQSSSPAVKYEAAGTLVTLSSAPTAIKAAAQCYIDLIIKESDNNVKLIVLDRLIELKEHPAHERVLQDLVMDILRVLSTPDLEVRKKTLQLALDLVSSRNVEELVIVLKKEVIKTNNVSEHEDTDKYRQLLVRTLHSCSVRFPDMAANVIPVLMEFLSDNNEAAAADVLEFVREAIQRFDNLRMLIVEKMLEVFHAIKSVKIYRGALWILGEYCSTKEDIQSVMTEIRRSLGEIPIVESEIKKEAGELKPEEEITVGPVQKLVTEMGTYATQSALSSSRPTKKEEDRPPLRGFLLDGDFFVAASLATTLTKIALRYVALVQEKKKQNSFVAEAMLLMATILHLGKSSLPKKPITDDDVDRISLCLKVLSECSPLMNDIFNKECRQSLSHMLSAKLEEEKLSQKKESEKRNVTVQPDDPISFMQLTAKNEMNCKEDQFQLSLLAAMGNTQRKEAADPLASKLNKVTQLTGFSDPVYAEAYVHVNQYDIVLDVLVVNQTSDTLQNCTLELATLGDLKLVEKPSPLTLAPHDFANIKANVKVASTENGIIFGNIVYDVSGAASDRNCVVLSDIHIDIMDYIQPATCTDAEFRQMWAEFEWENKVTVNTNMIDLNDYLQHILKSTNMKCLTPEKALSGYCGFMAANLYARSIFGEDALANVSIEKPIHQGPDAAVTGHIRIRAKSQGMALSLGDKINLSQKKTSI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	45	Very low	158 Å²	158	109.8 Å²	109.8	78%	0.778	64%	0.639	S	S	*	*				0	115.5	0	-64.4	-177.5	-136.5	0	0	107.3	E5 G92	M1-E5 WeakPolarHBondContact CB-OE2 3.48Å; M1-E5 WeakPolarHBondContact CG-OE2 3.43Å; M1-G92 VanDerWaalsContact CE-CA 3.48Å
2	T	25	Very low	47	Very low	106 Å²	106	106.1 Å²	106.1	65%	0.65	61%	0.613	S	S	*	*			trans	-68.2	149.3	172	41.1	0	0	0	0	109.3	A4 E5	T2-A4 PolarHBondContact O-N 2.76Å; T2-E5 PolarHBondContact O-N 3.09Å; T2-E5 VanDerWaalsContact O-N 3.11Å
3	A	31.1	Very low	47.9	Very low	90 Å²	90	109.8 Å²	109.8	74%	0.744	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-52	-16	-178.5	0	0	0	0	0	115.2	E5	A3-E5 VanDerWaalsContact C-N 3.28Å; A3-E5 PolarHBondContact O-N 3.31Å
4	A	33.3	Very low	49	Very low	94 Å²	94	106.5 Å²	106.5	78%	0.777	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-69.4	-9	175.8	0	0	0	0	0	115.9	T2	T2-A4 PolarHBondContact O-N 2.76Å
5	E	39.1	Very low	49.9	Very low	132 Å²	132	105.7 Å²	105.7	62%	0.617	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-97.5	1	179.2	-70.4	-177.9	144.8	0	0	114.4	M1 T2 A3	M1-E5 WeakPolarHBondContact CB-OE2 3.48Å; M1-E5 WeakPolarHBondContact CG-OE2 3.43Å; T2-E5 PolarHBondContact O-N 3.09Å; T2-E5 VanDerWaalsContact O-N 3.11Å; A3-E5 VanDerWaalsContact C-N 3.28Å; A3-E5 PolarHBondContact O-N 3.31Å
6	N	48.8	Very low	50.1	Low	128 Å²	128	111.3 Å²	111.3	68%	0.684	63%	0.634	S	S	*	*	S	Bend	trans	-71.8	144.1	179.7	-80.2	-24.3	0	0	0	112.5	C8	N6-C8 PolarHBondContact O-N 3.39Å
7	V	53.7	Low	50.2	Low	64 Å²	64	114.7 Å²	114.7	39%	0.388	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-58.1	116.5	178.6	-172.8	0	0	0	0	109.4	Y9	V7-Y9 HydrophobicContact CB-CE1 4.29Å; V7-Y9 HydrophobicContact CG1-CE1 4.34Å; V7-Y9 WeakPolarHBondContact O-CE2 3.32Å; V7-Y9 PolarHBondContact O-N 3.26Å
8	C	48.4	Very low	50.7	Low	121 Å²	121	111.7 Å²	111.7	82%	0.818	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-66.3	120.2	169.8	-66.7	0	0	0	0	109.2	N6	N6-C8 PolarHBondContact O-N 3.39Å
9	Y	62.7	Low	51.3	Low	118 Å²	118	115.5 Å²	115.5	46%	0.463	65%	0.649	S	S	.	*	P	Polyproline II helix	trans	-82.3	136.6	177.4	-59.1	-64	0	0	0	110.1	V7 L50	V7-Y9 HydrophobicContact CB-CE1 4.29Å; V7-Y9 HydrophobicContact CG1-CE1 4.34Å; V7-Y9 WeakPolarHBondContact O-CE2 3.32Å; V7-Y9 PolarHBondContact O-N 3.26Å; Y9-L50 CarbonylContact C-O 3.46Å; Y9-L50 VanDerWaalsContact CA-O 3.31Å; Y9-L50 WeakPolarHBondContact CA-O 3.21Å; Y9-L50 VanDerWaalsContact CB-O 3.26Å; Y9-L50 WeakPolarHBondContact CB-O 3.36Å
10	T	59.6	Low	52	Low	82 Å²	82	115.2 Å²	115.2	50%	0.503	65%	0.652	S	S	.	*			trans	-100.6	112.8	175.4	-56.5	0	0	0	0	107.4	I12 L50 N51	T10-I12 HydrophobicContact CG2-CG1 4.19Å; T10-I12 PolarHBondContact O-N 3.03Å; T10-L50 PolarHBondContact N-O 2.82Å; T10-L50 CarbonylContact O-C 3.5Å; T10-N51 PolarHBondContact O-OD1 3.36Å
11	L	60.8	Low	53.1	Low	115 Å²	115	111.2 Å²	111.2	60%	0.602	63%	0.631	S	S	*	*			trans	-70.6	98.8	175.6	-68.2	171.6	0	0	0	109.2
12	I	68.5	Low	55.3	Low	65 Å²	65	106.9 Å²	106.9	33%	0.333	62%	0.616	S	S	.	*			trans	-89.1	114.2	174.6	-61.6	174.9	0	0	0	107.4	T10 V14 I47 L50 N51	T10-I12 HydrophobicContact CG2-CG1 4.19Å; T10-I12 PolarHBondContact O-N 3.03Å; I12-V14 PolarHBondContact O-N 3.35Å; I12-V14 VanDerWaalsContact O-N 3.12Å; I12-I47 HydrophobicContact CB-CG2 4.33Å; I12-I47 HydrophobicContact CD1-CG1 4.4Å; I12-I47 HydrophobicContact CG2-CG2 4.37Å; I12-L50 HydrophobicContact CD1-CB 4.17Å; I12-L50 HydrophobicContact CD1-CD1 3.65Å; I12-N51 PolarHBondContact N-OD1 3.17Å
13	N	59.7	Low	58	Low	155 Å²	155	105.8 Å²	105.8	83%	0.829	60%	0.604	S	S	*	*			trans	-62.7	112.9	177.6	-169.1	13.2	0	0	0	110.1
14	V	62.5	Low	60.5	Low	63 Å²	63	107.6 Å²	107.6	38%	0.382	60%	0.599	S	S	.	*			trans	-90.7	131.1	173.7	-178.4	0	0	0	0	107.3	I12 M16 S18 I47	I12-V14 PolarHBondContact O-N 3.35Å; I12-V14 VanDerWaalsContact O-N 3.12Å; V14-M16 PolarHBondContact O-N 2.95Å; V14-S18 WeakPolarHBondContact CG1-OG 3.41Å; V14-I47 HydrophobicContact CG2-CG2 4.17Å
15	P	62.3	Low	63	Low	94 Å²	94	105 Å²	105	61%	0.61	58%	0.576	S	S	*	*			trans	-53.1	135.7	177.9	-17.9	25.6	0	0	0	110.9	D17 S18	P15-D17 PolarHBondContact O-N 3.29Å; P15-S18 PolarHBondContact O-N 2.65Å; P15-S18 VanDerWaalsContact O-N 3.11Å; P15-S18 PolarHBondContact O-OG 2.95Å
16	M	54.1	Low	65.2	Low	196 Å²	196	98.8 Å²	98.8	97%	0.966	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-16.7	-178.1	-74.3	-168.1	164.1	0	0	114.2	V14	V14-M16 PolarHBondContact O-N 2.95Å
17	D	51.8	Low	67	Low	169 Å²	169	96.8 Å²	96.8	90%	0.904	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-1.7	-179.8	-69	-26.1	0	0	0	114.8	P15	P15-D17 PolarHBondContact O-N 3.29Å
18	S	58.9	Low	68.7	Low	61 Å²	61	97.2 Å²	97.2	43%	0.427	53%	0.532	S	S	.	.	S	Bend	trans	-109.4	117.6	178.6	66.3	0	0	0	0	112.8	V14 P15	V14-S18 WeakPolarHBondContact CG1-OG 3.41Å; P15-S18 PolarHBondContact O-N 2.65Å; P15-S18 VanDerWaalsContact O-N 3.11Å; P15-S18 PolarHBondContact O-OG 2.95Å
19	E	62.6	Low	70.6	Confident	183 Å²	183	94.7 Å²	94.7	86%	0.855	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-60.3	136.2	170.7	-70.3	-176.6	161.7	0	0	111.1
20	P	65	Low	71.8	Confident	109 Å²	109	89 Å²	89	71%	0.708	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-64.3	124.8	175.7	24.9	-31.3	0	0	0	109.6
21	P	73.6	Confident	73.3	Confident	33 Å²	33	87.8 Å²	87.8	21%	0.214	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-66.9	136	-178.2	29.2	-36.3	0	0	0	110.7	L26 K44 M48	P21-L26 HydrophobicContact CB-CD1 4.31Å; P21-L26 HydrophobicContact CB-CD2 4.04Å; P21-L26 HydrophobicContact CB-CG 4.06Å; P21-L26 HydrophobicContact CG-CD1 4.11Å; P21-L26 HydrophobicContact CG-CD2 4.16Å; P21-L26 HydrophobicContact CG-CG 4.32Å; P21-K44 HydrophobicContact CB-CD 4.46Å; P21-K44 HydrophobicContact CG-CB 4.29Å; P21-K44 HydrophobicContact CG-CD 4.08Å; P21-K44 HydrophobicContact CG-CG 4.48Å; P21-M48 HydrophobicContact CG-SD 3.86Å
22	S	80.5	Confident	74.5	Confident	66 Å²	66	90.5 Å²	90.5	46%	0.462	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-68.1	149.2	176.4	74.6	0	0	0	0	112.3	I24 S25 L26	S22-I24 PolarHBondContact O-N 3.06Å; S22-S25 PolarHBondContact N-OG 3.33Å; S22-S25 VanDerWaalsContact N-OG 3.16Å; S22-S25 PolarHBondContact O-N 3.13Å; S22-S25 VanDerWaalsContact O-N 3.16Å; S22-S25 PolarHBondContact O-OG 3.08Å; S22-S25 WeakPolarHBondContact OG-CB 3.46Å; S22-S25 PolarHBondContact OG-N 2.95Å; S22-S25 VanDerWaalsContact OG-N 3.1Å; S22-S25 PolarHBondContact OG-OG 3.16Å; S22-L26 WeakPolarHBondContact O-CG 3.33Å; S22-L26 PolarHBondContact O-N 3.44Å
23	E	81.9	Confident	75.3	Confident	84 Å²	84	88.3 Å²	88.3	39%	0.393	48%	0.477	S	S	.	.	H	α-helix	trans	-57.2	-35.8	175.8	-172.9	179.4	-178.2	0	0	111.8	L26 K27 L55 L58	E23-L26 PolarHBondContact O-N 2.74Å; E23-K27 WeakPolarHBondContact O-CB 3.39Å; E23-K27 PolarHBondContact O-N 3.16Å; E23-L55 HydrophobicContact CB-CD2 4.4Å; E23-L55 HydrophobicContact CG-CD2 4.18Å; E23-L58 HydrophobicContact CG-CD1 4.28Å; E23-L58 HydrophobicContact CG-CD2 4.11Å; E23-L58 HydrophobicContact CG-CG 4.05Å
24	I	83.7	Confident	76.7	Confident	128 Å²	128	85.2 Å²	85.2	66%	0.656	46%	0.46	S	S	*	.	H	α-helix	trans	-68.3	-42.1	179.2	-59	172.5	0	0	0	111.2	S22 K27 N28	S22-I24 PolarHBondContact O-N 3.06Å; I24-K27 PolarHBondContact O-N 3.06Å; I24-N28 PolarHBondContact O-N 3.16Å; I24-N28 PolarHBondContact O-ND2 3.05Å
25	S	84.9	Confident	78	Confident	40 Å²	40	85.3 Å²	85.3	28%	0.28	46%	0.461	S	S	.	.	H	α-helix	trans	-64.5	-44.2	175.3	50.7	0	0	0	0	111.2	S22 K27 N28 D29	S22-S25 PolarHBondContact N-OG 3.33Å; S22-S25 VanDerWaalsContact N-OG 3.16Å; S22-S25 PolarHBondContact O-N 3.13Å; S22-S25 VanDerWaalsContact O-N 3.16Å; S22-S25 PolarHBondContact O-OG 3.08Å; S22-S25 WeakPolarHBondContact OG-CB 3.46Å; S22-S25 PolarHBondContact OG-N 2.95Å; S22-S25 VanDerWaalsContact OG-N 3.1Å; S22-S25 PolarHBondContact OG-OG 3.16Å; S25-K27 VanDerWaalsContact C-N 3.33Å; S25-K27 PolarHBondContact O-N 3.06Å; S25-N28 PolarHBondContact O-N 3.45Å; S25-D29 PolarHBondContact O-N 3.39Å
26	L	85.9	Confident	79.2	Confident	0 Å²	0	88.6 Å²	88.6	0%	0	47%	0.466	C	S	.	.	H	α-helix	trans	-61.7	-41.6	177.2	-68.5	171.5	0	0	0	111.7	P21 S22 E23 N28 D29 L30 A41 K44 V45 M48 L58	P21-L26 HydrophobicContact CB-CD1 4.31Å; P21-L26 HydrophobicContact CB-CD2 4.04Å; P21-L26 HydrophobicContact CB-CG 4.06Å; P21-L26 HydrophobicContact CG-CD1 4.11Å; P21-L26 HydrophobicContact CG-CD2 4.16Å; P21-L26 HydrophobicContact CG-CG 4.32Å; S22-L26 WeakPolarHBondContact O-CG 3.33Å; S22-L26 PolarHBondContact O-N 3.44Å; E23-L26 PolarHBondContact O-N 2.74Å; L26-N28 PolarHBondContact O-N 3.49Å; L26-D29 PolarHBondContact O-N 2.87Å; L26-L30 WeakPolarHBondContact O-CB 3.29Å; L26-L30 WeakPolarHBondContact O-CG 3.43Å; L26-L30 PolarHBondContact O-N 3.28Å; L26-A41 HydrophobicContact CD2-CB 4.24Å; L26-K44 HydrophobicContact CD2-CB 4Å; L26-K44 HydrophobicContact CD2-CD 4.24Å; L26-V45 HydrophobicContact CD1-CG2 4.02Å; L26-V45 HydrophobicContact CD2-CG2 4.49Å; L26-M48 HydrophobicContact CD1-CE 4.21Å; L26-M48 HydrophobicContact CD1-SD 3.61Å; L26-L58 HydrophobicContact CB-CD1 4.22Å; L26-L58 HydrophobicContact CD1-CD1 4.43Å
27	K	86.9	Confident	80.9	Confident	87 Å²	87	81.7 Å²	81.7	38%	0.378	44%	0.437	S	S	.	.	H	α-helix	trans	-59.7	-46.4	175.3	-170.3	175.4	-179.7	174.5	0	111.7	E23 I24 S25 L30 E31 L58 T61	E23-K27 WeakPolarHBondContact O-CB 3.39Å; E23-K27 PolarHBondContact O-N 3.16Å; I24-K27 PolarHBondContact O-N 3.06Å; S25-K27 VanDerWaalsContact C-N 3.33Å; S25-K27 PolarHBondContact O-N 3.06Å; K27-L30 PolarHBondContact O-N 3.22Å; K27-E31 WeakPolarHBondContact CE-OE1 2.83Å; K27-E31 HydrophobicContact CG-CG 4.5Å; K27-E31 WeakPolarHBondContact O-CB 3.33Å; K27-E31 VanDerWaalsContact O-CG 3.28Å; K27-E31 WeakPolarHBondContact O-CG 3.36Å; K27-E31 PolarHBondContact O-N 3.46Å; K27-L58 HydrophobicContact CB-CD2 3.72Å; K27-L58 HydrophobicContact CG-CD2 4.23Å; K27-T61 HydrophobicContact CG-CG2 4.21Å
28	N	87.8	Confident	82.8	Confident	73 Å²	73	74.7 Å²	74.7	39%	0.39	40%	0.398	S	S	.	.	H	α-helix	trans	-63.2	-42.2	178	-75.8	-36.9	0	0	0	112.2	I24 S25 L26 L30 E31 K32	I24-N28 PolarHBondContact O-N 3.16Å; I24-N28 PolarHBondContact O-ND2 3.05Å; S25-N28 PolarHBondContact O-N 3.45Å; L26-N28 PolarHBondContact O-N 3.49Å; N28-L30 VanDerWaalsContact C-N 3.34Å; N28-L30 PolarHBondContact O-N 3.5Å; N28-E31 PolarHBondContact O-N 3.08Å; N28-K32 PolarHBondContact O-N 3.09Å
29	D	88.6	Confident	84.3	Confident	67 Å²	67	72.3 Å²	72.3	36%	0.358	38%	0.381	S	S	.	.	H	α-helix	trans	-64.9	-38.2	178.6	-67.2	-17.3	0	0	0	111.6	S25 L26 G33 A41	S25-D29 PolarHBondContact O-N 3.39Å; L26-D29 PolarHBondContact O-N 2.87Å; D29-G33 WeakPolarHBondContact O-CA 3.46Å; D29-G33 PolarHBondContact O-N 3.05Å; D29-A41 HydrophobicContact CB-CB 3.89Å
30	L	89.1	Confident	85.6	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-73.6	-33.2	177.3	-66.4	169.6	0	0	0	113	L26 K27 N28 K38 A41 L42 V45 T61 I62 V66	L26-L30 WeakPolarHBondContact O-CB 3.29Å; L26-L30 WeakPolarHBondContact O-CG 3.43Å; L26-L30 PolarHBondContact O-N 3.28Å; K27-L30 PolarHBondContact O-N 3.22Å; N28-L30 VanDerWaalsContact C-N 3.34Å; N28-L30 PolarHBondContact O-N 3.5Å; L30-K38 WeakPolarHBondContact O-CE 3.28Å; L30-K38 PolarHBondContact O-NZ 3.43Å; L30-K38 VanDerWaalsContact O-NZ 3.13Å; L30-A41 HydrophobicContact CD2-CB 3.65Å; L30-A41 HydrophobicContact CG-CB 3.92Å; L30-L42 HydrophobicContact CD2-CB 4.47Å; L30-V45 HydrophobicContact CD1-CG2 4.34Å; L30-T61 HydrophobicContact CB-CG2 3.89Å; L30-I62 HydrophobicContact CD1-CD1 4.35Å; L30-I62 HydrophobicContact CD1-CG1 3.9Å; L30-V66 HydrophobicContact CB-CG2 4.32Å; L30-V66 HydrophobicContact CD2-CG2 3.86Å
31	E	89.4	Confident	86.8	Confident	55 Å²	55	63 Å²	63	26%	0.257	33%	0.328	S	S	.	.	H	α-helix	trans	-78.7	-50.6	179.3	-71.3	-176.7	-177.3	0	0	112.3	K27 N28 T61 F65	K27-E31 WeakPolarHBondContact CE-OE1 2.83Å; K27-E31 HydrophobicContact CG-CG 4.5Å; K27-E31 WeakPolarHBondContact O-CB 3.33Å; K27-E31 VanDerWaalsContact O-CG 3.28Å; K27-E31 WeakPolarHBondContact O-CG 3.36Å; K27-E31 PolarHBondContact O-N 3.46Å; N28-E31 PolarHBondContact O-N 3.08Å; E31-T61 HydrophobicContact CG-CG2 3.56Å; E31-T61 PolarHBondContact OE1-OG1 3.04Å; E31-F65 HydrophobicContact CB-CD2 4.44Å; E31-F65 HydrophobicContact CG-CD2 3.7Å; E31-F65 HydrophobicContact CG-CE2 3.71Å; E31-F65 HydrophobicContact CG-CG 4.35Å; E31-F65 HydrophobicContact CG-CZ 4.39Å
32	K	86.8	Confident	87.6	Confident	172 Å²	172	61.4 Å²	61.4	75%	0.748	32%	0.318	S	S	*	.	H	α-helix	trans	-112.5	-11.6	-167.4	-61.8	178.2	-175.1	170.3	0	114.5	N28	N28-K32 PolarHBondContact O-N 3.09Å
33	G	84.7	Confident	88	Confident	20 Å²	20	61.9 Å²	61.9	21%	0.206	31%	0.312	C	S	.	.	S	Bend	trans	-68.4	161.4	-179	0	0	0	0	0	113.8	D29 K38	D29-G33 WeakPolarHBondContact O-CA 3.46Å; D29-G33 PolarHBondContact O-N 3.05Å; G33-K38 WeakPolarHBondContact O-CE 3.5Å
34	D	89.3	Confident	88.3	Confident	89 Å²	89	62.4 Å²	62.4	48%	0.476	31%	0.313	S	S	.	.			trans	-73.4	171.7	170	75.1	-30.8	0	0	0	111.2	K36 S37 K38	D34-K36 PolarHBondContact O-N 3.26Å; D34-K36 VanDerWaalsContact O-N 3.13Å; D34-S37 PolarHBondContact O-N 3.15Å; D34-S37 VanDerWaalsContact O-N 3.09Å; D34-S37 WeakPolarHBondContact OD1-CB 3.45Å; D34-S37 PolarHBondContact OD1-N 2.93Å; D34-S37 PolarHBondContact OD1-OG 3.14Å; D34-K38 WeakPolarHBondContact O-CG 3.2Å; D34-K38 PolarHBondContact O-N 2.86Å
35	V	89.3	Confident	88.6	Confident	65 Å²	65	56.4 Å²	56.4	39%	0.394	28%	0.282	S	S	.	.	H	α-helix	trans	-54.6	-36.8	-177.5	177.5	0	0	0	0	111.8	T39 D71 I74	V35-T39 WeakPolarHBondContact O-CB 3.32Å; V35-T39 PolarHBondContact O-N 3.25Å; V35-T39 PolarHBondContact O-OG1 3.09Å; V35-D71 HydrophobicContact CG1-CB 3.93Å; V35-I74 HydrophobicContact CG1-CD1 3.8Å
36	K	89.3	Confident	88.7	Confident	164 Å²	164	55 Å²	55	71%	0.713	27%	0.272	S	S	*	.	H	α-helix	trans	-69.2	-47.8	177.4	-66.9	-177.4	178.2	-179.7	0	111.7	D34 K38 T39 E40	D34-K36 PolarHBondContact O-N 3.26Å; D34-K36 VanDerWaalsContact O-N 3.13Å; K36-K38 VanDerWaalsContact C-N 3.32Å; K36-K38 PolarHBondContact O-N 2.72Å; K36-T39 WeakPolarHBondContact O-CB 2.99Å; K36-T39 PolarHBondContact O-N 3.32Å; K36-T39 VanDerWaalsContact O-N 3.13Å; K36-E40 PolarHBondContact O-N 3.05Å
37	S	89.6	Confident	88.7	Confident	51 Å²	51	57.8 Å²	57.8	36%	0.357	29%	0.286	S	S	.	.	H	α-helix	trans	-61.1	-41.6	176.8	-57.2	0	0	0	0	111.7	D34 T39 E40 A41	D34-S37 PolarHBondContact O-N 3.15Å; D34-S37 VanDerWaalsContact O-N 3.09Å; D34-S37 WeakPolarHBondContact OD1-CB 3.45Å; D34-S37 PolarHBondContact OD1-N 2.93Å; D34-S37 PolarHBondContact OD1-OG 3.14Å; S37-T39 VanDerWaalsContact C-N 3.32Å; S37-T39 PolarHBondContact O-N 2.87Å; S37-E40 PolarHBondContact O-N 3.35Å; S37-A41 VanDerWaalsContact O-CB 3.26Å; S37-A41 WeakPolarHBondContact O-CB 3.34Å; S37-A41 PolarHBondContact O-N 2.95Å
38	K	91.1	Very high	88.6	Confident	21 Å²	21	54.5 Å²	54.5	9%	0.091	27%	0.272	C	S	.	.	H	α-helix	trans	-63	-37.1	174.4	-68.2	-173	-179.5	-157.1	0	112.7	L30 G33 D34 K36 L42 F65 L69 I74	L30-K38 WeakPolarHBondContact O-CE 3.28Å; L30-K38 PolarHBondContact O-NZ 3.43Å; L30-K38 VanDerWaalsContact O-NZ 3.13Å; G33-K38 WeakPolarHBondContact O-CE 3.5Å; D34-K38 WeakPolarHBondContact O-CG 3.2Å; D34-K38 PolarHBondContact O-N 2.86Å; K36-K38 VanDerWaalsContact C-N 3.32Å; K36-K38 PolarHBondContact O-N 2.72Å; K38-L42 VanDerWaalsContact O-CB 3.28Å; K38-L42 WeakPolarHBondContact O-CB 3.15Å; K38-L42 PolarHBondContact O-N 3.22Å; K38-F65 PolarHBondContact NZ-O 3.06Å; K38-L69 HydrophobicContact CD-CD1 3.71Å; K38-I74 HydrophobicContact CB-CD1 4.34Å
39	T	90.4	Very high	88.4	Confident	12 Å²	12	52 Å²	52	7%	0.074	26%	0.258	C	S	.	.	H	α-helix	trans	-65.3	-47.6	176.9	-60.8	0	0	0	0	111	V35 K36 S37 L42 K43 T73 I74 L77	V35-T39 WeakPolarHBondContact O-CB 3.32Å; V35-T39 PolarHBondContact O-N 3.25Å; V35-T39 PolarHBondContact O-OG1 3.09Å; K36-T39 WeakPolarHBondContact O-CB 2.99Å; K36-T39 PolarHBondContact O-N 3.32Å; K36-T39 VanDerWaalsContact O-N 3.13Å; S37-T39 VanDerWaalsContact C-N 3.32Å; S37-T39 PolarHBondContact O-N 2.87Å; T39-L42 PolarHBondContact O-N 2.87Å; T39-K43 WeakPolarHBondContact O-CG 3.47Å; T39-K43 PolarHBondContact O-N 3.37Å; T39-T73 HydrophobicContact CG2-CG2 3.8Å; T39-I74 WeakPolarHBondContact OG1-CG1 3.25Å; T39-L77 HydrophobicContact CG2-CD1 3.68Å
40	E	89.6	Confident	88.1	Confident	93 Å²	93	50.4 Å²	50.4	44%	0.435	25%	0.25	S	C	.	.	H	α-helix	trans	-67.6	-40.1	177.9	-69.3	-55	132.2	0	0	112.2	K36 S37 L42 K43 K44	K36-E40 PolarHBondContact O-N 3.05Å; S37-E40 PolarHBondContact O-N 3.35Å; E40-L42 PolarHBondContact O-N 2.88Å; E40-K43 PolarHBondContact O-N 2.95Å; E40-K43 IonicContact OE1-NZ 3.57Å; E40-K43 PolarHBondContact OE1-NZ 3.13Å; E40-K43 IonicContact OE2-NZ 3.18Å; E40-K44 WeakPolarHBondContact O-CG 3.29Å; E40-K44 PolarHBondContact O-N 3.47Å
41	A	89.8	Confident	87.6	Confident	2 Å²	2	52.6 Å²	52.6	2%	0.017	26%	0.262	C	S	.	.	H	α-helix	trans	-61.6	-43.4	174.2	0	0	0	0	0	111.6	L26 D29 L30 S37 K43 K44 V45	L26-A41 HydrophobicContact CD2-CB 4.24Å; D29-A41 HydrophobicContact CB-CB 3.89Å; L30-A41 HydrophobicContact CD2-CB 3.65Å; L30-A41 HydrophobicContact CG-CB 3.92Å; S37-A41 VanDerWaalsContact O-CB 3.26Å; S37-A41 WeakPolarHBondContact O-CB 3.34Å; S37-A41 PolarHBondContact O-N 2.95Å; A41-K43 PolarHBondContact O-N 3.47Å; A41-K44 PolarHBondContact O-N 3.1Å; A41-V45 VanDerWaalsContact O-CG2 3.32Å; A41-V45 WeakPolarHBondContact O-CG2 3.45Å; A41-V45 PolarHBondContact O-N 2.66Å
42	L	90.6	Very high	86.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.2	-38.5	177.2	-176	61.4	0	0	0	112.3	L30 K38 T39 E40 V45 I46 I62 V66 I74 L77 L78 F81	L30-L42 HydrophobicContact CD2-CB 4.47Å; K38-L42 VanDerWaalsContact O-CB 3.28Å; K38-L42 WeakPolarHBondContact O-CB 3.15Å; K38-L42 PolarHBondContact O-N 3.22Å; T39-L42 PolarHBondContact O-N 2.87Å; E40-L42 PolarHBondContact O-N 2.88Å; L42-V45 PolarHBondContact O-N 2.84Å; L42-I46 HydrophobicContact CG-CD1 4.19Å; L42-I46 VanDerWaalsContact O-CG1 3.29Å; L42-I46 WeakPolarHBondContact O-CG1 3.36Å; L42-I46 PolarHBondContact O-N 3.21Å; L42-I62 HydrophobicContact CD1-CD1 4.22Å; L42-V66 HydrophobicContact CD2-CG1 4.15Å; L42-I74 HydrophobicContact CD2-CG2 4.48Å; L42-L77 HydrophobicContact CD2-CB 3.52Å; L42-L77 HydrophobicContact CD2-CD1 4.41Å; L42-L77 HydrophobicContact CG-CB 4.12Å; L42-L78 HydrophobicContact CD2-CD2 4.1Å; L42-L78 HydrophobicContact CD2-CG 4.04Å; L42-F81 HydrophobicContact CD1-CB 4.4Å; L42-F81 HydrophobicContact CD1-CD2 4.26Å; L42-F81 HydrophobicContact CD1-CG 4.3Å
43	K	89.9	Confident	86.6	Confident	76 Å²	76	47.2 Å²	47.2	33%	0.33	25%	0.246	S	C	.	.	H	α-helix	trans	-60.5	-46.6	172.9	-73.1	175	-174.4	169.2	0	111.7	T39 E40 A41 V45 I46 I47 L77	T39-K43 WeakPolarHBondContact O-CG 3.47Å; T39-K43 PolarHBondContact O-N 3.37Å; E40-K43 PolarHBondContact O-N 2.95Å; E40-K43 IonicContact OE1-NZ 3.57Å; E40-K43 PolarHBondContact OE1-NZ 3.13Å; E40-K43 IonicContact OE2-NZ 3.18Å; A41-K43 PolarHBondContact O-N 3.47Å; K43-V45 VanDerWaalsContact C-N 3.34Å; K43-V45 PolarHBondContact O-N 3.18Å; K43-I46 PolarHBondContact O-N 2.73Å; K43-I47 WeakPolarHBondContact O-CG1 3.3Å; K43-I47 PolarHBondContact O-N 3.5Å; K43-L77 HydrophobicContact CG-CD1 3.81Å; K43-L77 HydrophobicContact CG-CD2 3.88Å
44	K	88.3	Confident	86.2	Confident	96 Å²	96	54.7 Å²	54.7	42%	0.417	27%	0.273	S	S	.	.	H	α-helix	trans	-59.3	-44.9	177.4	-73.8	170.9	171.6	-168.6	0	111.3	P21 L26 E40 A41 I46 I47 M48	P21-K44 HydrophobicContact CB-CD 4.46Å; P21-K44 HydrophobicContact CG-CB 4.29Å; P21-K44 HydrophobicContact CG-CD 4.08Å; P21-K44 HydrophobicContact CG-CG 4.48Å; L26-K44 HydrophobicContact CD2-CB 4Å; L26-K44 HydrophobicContact CD2-CD 4.24Å; E40-K44 WeakPolarHBondContact O-CG 3.29Å; E40-K44 PolarHBondContact O-N 3.47Å; A41-K44 PolarHBondContact O-N 3.1Å; K44-I46 PolarHBondContact O-N 3Å; K44-I47 PolarHBondContact O-N 3.06Å; K44-M48 VanDerWaalsContact O-CG 3.3Å; K44-M48 WeakPolarHBondContact O-CG 3.49Å; K44-M48 PolarHBondContact O-N 3.38Å
45	V	88.7	Confident	85.7	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-59.7	-45.4	175.3	171.9	0	0	0	0	111.7	L26 L30 A41 L42 K43 I47 M48 I49 L55 L58 I62 F81	L26-V45 HydrophobicContact CD1-CG2 4.02Å; L26-V45 HydrophobicContact CD2-CG2 4.49Å; L30-V45 HydrophobicContact CD1-CG2 4.34Å; A41-V45 VanDerWaalsContact O-CG2 3.32Å; A41-V45 WeakPolarHBondContact O-CG2 3.45Å; A41-V45 PolarHBondContact O-N 2.66Å; L42-V45 PolarHBondContact O-N 2.84Å; K43-V45 VanDerWaalsContact C-N 3.34Å; K43-V45 PolarHBondContact O-N 3.18Å; V45-I47 VanDerWaalsContact C-N 3.33Å; V45-I47 PolarHBondContact O-N 3.23Å; V45-M48 PolarHBondContact O-N 3.24Å; V45-I49 HydrophobicContact CG1-CD1 3.72Å; V45-I49 HydrophobicContact CG1-CG1 4.35Å; V45-I49 VanDerWaalsContact O-CG1 3.3Å; V45-I49 WeakPolarHBondContact O-CG1 3.46Å; V45-I49 PolarHBondContact O-N 2.9Å; V45-L55 HydrophobicContact CG1-CD1 4.38Å; V45-L58 HydrophobicContact CG1-CD1 4.46Å; V45-L58 HydrophobicContact CG2-CD1 3.69Å; V45-I62 HydrophobicContact CG1-CD1 4.2Å; V45-F81 HydrophobicContact CG1-CD2 4.25Å; V45-F81 HydrophobicContact CG1-CE2 3.76Å
46	I	88.4	Confident	84.9	Confident	12 Å²	12	53.5 Å²	53.5	6%	0.062	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-44.3	177.8	-70.9	164.7	0	0	0	111	L42 K43 K44 I49 L50 L77 V80 F81 I84	L42-I46 HydrophobicContact CG-CD1 4.19Å; L42-I46 VanDerWaalsContact O-CG1 3.29Å; L42-I46 WeakPolarHBondContact O-CG1 3.36Å; L42-I46 PolarHBondContact O-N 3.21Å; K43-I46 PolarHBondContact O-N 2.73Å; K44-I46 PolarHBondContact O-N 3Å; I46-I49 PolarHBondContact O-N 3.29Å; I46-L50 HydrophobicContact CG2-CD1 3.85Å; I46-L50 HydrophobicContact CG2-CG 4.45Å; I46-L50 WeakPolarHBondContact O-CB 3.38Å; I46-L50 VanDerWaalsContact O-CG 3.29Å; I46-L50 WeakPolarHBondContact O-CG 3.36Å; I46-L50 PolarHBondContact O-N 3.37Å; I46-L77 HydrophobicContact CD1-CB 4.16Å; I46-L77 HydrophobicContact CD1-CD2 4.09Å; I46-L77 WeakPolarHBondContact CD1-O 3.3Å; I46-V80 HydrophobicContact CD1-CB 4.43Å; I46-V80 HydrophobicContact CD1-CG1 4.4Å; I46-V80 HydrophobicContact CG2-CG1 4.04Å; I46-F81 HydrophobicContact CD1-CB 4.11Å; I46-F81 HydrophobicContact CG1-CB 3.96Å; I46-F81 HydrophobicContact CG1-CD2 4.15Å; I46-I84 HydrophobicContact CG2-CD1 3.77Å
47	I	85.6	Confident	84.5	Confident	57 Å²	57	47.5 Å²	47.5	29%	0.292	26%	0.255	S	S	.	.	H	α-helix	trans	-63.1	-45.2	178.7	-66.7	164.2	0	0	0	110.9	I12 V14 K43 K44 V45 I49 L50 N51	I12-I47 HydrophobicContact CB-CG2 4.33Å; I12-I47 HydrophobicContact CD1-CG1 4.4Å; I12-I47 HydrophobicContact CG2-CG2 4.37Å; V14-I47 HydrophobicContact CG2-CG2 4.17Å; K43-I47 WeakPolarHBondContact O-CG1 3.3Å; K43-I47 PolarHBondContact O-N 3.5Å; K44-I47 PolarHBondContact O-N 3.06Å; V45-I47 VanDerWaalsContact C-N 3.33Å; V45-I47 PolarHBondContact O-N 3.23Å; I47-I49 PolarHBondContact O-N 2.75Å; I47-L50 PolarHBondContact O-N 3.2Å; I47-N51 WeakPolarHBondContact O-CB 3.38Å; I47-N51 PolarHBondContact O-N 3.25Å
48	M	84.1	Confident	84.2	Confident	19 Å²	19	45.1 Å²	45.1	9%	0.094	24%	0.238	C	C	.	.	H	α-helix	trans	-62.7	-42.8	179	-69.2	167.4	80.3	0	0	111.9	P21 L26 K44 V45 N51 G52 E53 L55	P21-M48 HydrophobicContact CG-SD 3.86Å; L26-M48 HydrophobicContact CD1-CE 4.21Å; L26-M48 HydrophobicContact CD1-SD 3.61Å; K44-M48 VanDerWaalsContact O-CG 3.3Å; K44-M48 WeakPolarHBondContact O-CG 3.49Å; K44-M48 PolarHBondContact O-N 3.38Å; V45-M48 PolarHBondContact O-N 3.24Å; M48-N51 PolarHBondContact O-N 3.01Å; M48-G52 PolarHBondContact O-N 2.74Å; M48-E53 HydrophobicContact CB-CB 4.32Å; M48-E53 WeakPolarHBondContact CE-OE2 3.46Å; M48-E53 WeakPolarHBondContact O-CB 3.35Å; M48-E53 PolarHBondContact O-N 2.84Å; M48-L55 HydrophobicContact CB-CD1 3.92Å; M48-L55 HydrophobicContact CE-CD1 4.21Å; M48-L55 HydrophobicContact SD-CD1 4.31Å
49	I	83.8	Confident	84	Confident	19 Å²	19	45.1 Å²	45.1	10%	0.097	24%	0.239	C	C	.	.	H	α-helix	trans	-66.4	-39.6	176.6	-63.3	172.2	0	0	0	111	V45 I46 I47 N51 G52 L55 F81 I84 V85	V45-I49 HydrophobicContact CG1-CD1 3.72Å; V45-I49 HydrophobicContact CG1-CG1 4.35Å; V45-I49 VanDerWaalsContact O-CG1 3.3Å; V45-I49 WeakPolarHBondContact O-CG1 3.46Å; V45-I49 PolarHBondContact O-N 2.9Å; I46-I49 PolarHBondContact O-N 3.29Å; I47-I49 PolarHBondContact O-N 2.75Å; I49-N51 VanDerWaalsContact C-N 3.27Å; I49-N51 PolarHBondContact O-N 3.06Å; I49-G52 PolarHBondContact O-N 2.92Å; I49-G52 VanDerWaalsContact O-N 3.08Å; I49-L55 HydrophobicContact CG1-CD1 4.33Å; I49-F81 HydrophobicContact CD1-CD2 4.1Å; I49-F81 HydrophobicContact CD1-CE2 3.54Å; I49-I84 HydrophobicContact CB-CG2 4.44Å; I49-I84 HydrophobicContact CG2-CB 4.46Å; I49-I84 HydrophobicContact CG2-CG2 3.53Å; I49-V85 HydrophobicContact CD1-CG2 4.11Å
50	L	81.7	Confident	83.8	Confident	34 Å²	34	49.5 Å²	49.5	18%	0.178	26%	0.26	C	S	.	.	H	α-helix	trans	-64	-32.2	175.4	-75.4	170.7	0	0	0	112.6	Y9 T10 I12 I46 I47 G52 I84	Y9-L50 CarbonylContact C-O 3.46Å; Y9-L50 VanDerWaalsContact CA-O 3.31Å; Y9-L50 WeakPolarHBondContact CA-O 3.21Å; Y9-L50 VanDerWaalsContact CB-O 3.26Å; Y9-L50 WeakPolarHBondContact CB-O 3.36Å; T10-L50 PolarHBondContact N-O 2.82Å; T10-L50 CarbonylContact O-C 3.5Å; I12-L50 HydrophobicContact CD1-CB 4.17Å; I12-L50 HydrophobicContact CD1-CD1 3.65Å; I46-L50 HydrophobicContact CG2-CD1 3.85Å; I46-L50 HydrophobicContact CG2-CG 4.45Å; I46-L50 WeakPolarHBondContact O-CB 3.38Å; I46-L50 VanDerWaalsContact O-CG 3.29Å; I46-L50 WeakPolarHBondContact O-CG 3.36Å; I46-L50 PolarHBondContact O-N 3.37Å; I47-L50 PolarHBondContact O-N 3.2Å; L50-G52 PolarHBondContact O-N 3.26Å; L50-I84 HydrophobicContact CD1-CD1 3.95Å; L50-I84 HydrophobicContact CD2-CD1 3.61Å; L50-I84 HydrophobicContact CD2-CG1 3.81Å; L50-I84 HydrophobicContact CD2-CG2 3.84Å; L50-I84 HydrophobicContact CG-CD1 3.7Å; L50-I84 HydrophobicContact CG-CG1 4.41Å; L50-I84 HydrophobicContact CG-CG2 4.32Å
51	N	80.6	Confident	83.6	Confident	47 Å²	47	45.5 Å²	45.5	25%	0.251	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-0.5	174	-74.8	-14.2	0	0	0	113.7	T10 I12 I47 M48 I49	T10-N51 PolarHBondContact O-OD1 3.36Å; I12-N51 PolarHBondContact N-OD1 3.17Å; I47-N51 WeakPolarHBondContact O-CB 3.38Å; I47-N51 PolarHBondContact O-N 3.25Å; M48-N51 PolarHBondContact O-N 3.01Å; I49-N51 VanDerWaalsContact C-N 3.27Å; I49-N51 PolarHBondContact O-N 3.06Å
52	G	74.2	Confident	83.7	Confident	27 Å²	27	45.4 Å²	45.4	28%	0.278	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.2	3.2	175.6	0	0	0	0	0	115.9	M48 I49 L50	M48-G52 PolarHBondContact O-N 2.74Å; I49-G52 PolarHBondContact O-N 2.92Å; I49-G52 VanDerWaalsContact O-N 3.08Å; L50-G52 PolarHBondContact O-N 3.26Å
53	E	80.3	Confident	83.5	Confident	86 Å²	86	46 Å²	46	40%	0.402	24%	0.244	S	C	.	.			trans	-76.5	126.4	177.3	-61.4	-175.8	-166.2	0	0	111.7	M48 L55	M48-E53 HydrophobicContact CB-CB 4.32Å; M48-E53 WeakPolarHBondContact CE-OE2 3.46Å; M48-E53 WeakPolarHBondContact O-CB 3.35Å; M48-E53 PolarHBondContact O-N 2.84Å; E53-L55 PolarHBondContact O-N 3.39Å
54	K	75.7	Confident	83.4	Confident	178 Å²	178	50.5 Å²	50.5	77%	0.774	26%	0.259	S	S	*	.			trans	-87.2	111.1	176.8	-64.9	-177.3	-177.5	178.2	0	109.8	P56	K54-P56 WeakPolarHBondContact O-CD 3.38Å
55	L	80.1	Confident	83.4	Confident	22 Å²	22	48.9 Å²	48.9	12%	0.115	25%	0.252	C	S	.	.			trans	-114.3	61.5	179.3	-61.7	169.4	0	0	0	112.5	E23 V45 M48 I49 E53 G57 L58	E23-L55 HydrophobicContact CB-CD2 4.4Å; E23-L55 HydrophobicContact CG-CD2 4.18Å; V45-L55 HydrophobicContact CG1-CD1 4.38Å; M48-L55 HydrophobicContact CB-CD1 3.92Å; M48-L55 HydrophobicContact CE-CD1 4.21Å; M48-L55 HydrophobicContact SD-CD1 4.31Å; I49-L55 HydrophobicContact CG1-CD1 4.33Å; E53-L55 PolarHBondContact O-N 3.39Å; L55-G57 PolarHBondContact O-N 2.99Å; L55-L58 HydrophobicContact CB-CD1 4.13Å; L55-L58 HydrophobicContact CB-CG 4.45Å; L55-L58 HydrophobicContact CD1-CD1 4.1Å; L55-L58 PolarHBondContact O-N 3.41Å
56	P	71.8	Confident	83.4	Confident	106 Å²	106	48.8 Å²	48.8	69%	0.688	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-65.2	-27.5	-176.2	28	-34.6	0	0	0	112.9	K54 L58 L59	K54-P56 WeakPolarHBondContact O-CD 3.38Å; P56-L58 PolarHBondContact O-N 3.34Å; P56-L59 PolarHBondContact O-N 3.04Å
57	G	79.9	Confident	83.3	Confident	38 Å²	38	49 Å²	49	39%	0.392	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-66.6	-18.5	-179	0	0	0	0	0	114.6	L55	L55-G57 PolarHBondContact O-N 2.99Å
58	L	84.4	Confident	83.4	Confident	1 Å²	1	50 Å²	50	1%	0.005	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-91.4	-16.1	-179.4	-62.5	-178.4	0	0	0	113.6	E23 L26 K27 V45 L55 P56 M60 T61 I62	E23-L58 HydrophobicContact CG-CD1 4.28Å; E23-L58 HydrophobicContact CG-CD2 4.11Å; E23-L58 HydrophobicContact CG-CG 4.05Å; L26-L58 HydrophobicContact CB-CD1 4.22Å; L26-L58 HydrophobicContact CD1-CD1 4.43Å; K27-L58 HydrophobicContact CB-CD2 3.72Å; K27-L58 HydrophobicContact CG-CD2 4.23Å; V45-L58 HydrophobicContact CG1-CD1 4.46Å; V45-L58 HydrophobicContact CG2-CD1 3.69Å; L55-L58 HydrophobicContact CB-CD1 4.13Å; L55-L58 HydrophobicContact CB-CG 4.45Å; L55-L58 HydrophobicContact CD1-CD1 4.1Å; L55-L58 PolarHBondContact O-N 3.41Å; P56-L58 PolarHBondContact O-N 3.34Å; L58-M60 PolarHBondContact O-N 3.43Å; L58-T61 PolarHBondContact O-N 3.48Å; L58-I62 HydrophobicContact CB-CD1 4.29Å; L58-I62 VanDerWaalsContact O-CG1 3.3Å; L58-I62 WeakPolarHBondContact O-CG1 3.35Å; L58-I62 PolarHBondContact O-N 3.2Å
59	L	85.6	Confident	83.5	Confident	22 Å²	22	51.3 Å²	51.3	12%	0.115	27%	0.27	C	S	.	.	H	α-helix	trans	-57.8	-51.6	-174.9	-179.4	61	0	0	0	112	P56 T61 I62 I63 F81 W82 V85 L95 E97 M98	P56-L59 PolarHBondContact O-N 3.04Å; L59-T61 VanDerWaalsContact C-N 3.35Å; L59-T61 PolarHBondContact O-N 2.87Å; L59-I62 PolarHBondContact O-N 3.46Å; L59-I63 HydrophobicContact CD1-CD1 4.23Å; L59-I63 HydrophobicContact CG-CD1 4.16Å; L59-I63 WeakPolarHBondContact O-CG1 3.16Å; L59-I63 PolarHBondContact O-N 2.73Å; L59-F81 HydrophobicContact CD1-CE1 4.22Å; L59-F81 HydrophobicContact CD1-CZ 4.37Å; L59-W82 HydrophobicContact CD1-CH2 4.15Å; L59-W82 HydrophobicContact CD1-CZ3 3.72Å; L59-V85 HydrophobicContact CD1-CG1 4.2Å; L59-L95 HydrophobicContact CD2-CD1 4.36Å; L59-E97 HydrophobicContact CD2-CB 4.42Å; L59-M98 HydrophobicContact CD1-CE 4.28Å; L59-M98 HydrophobicContact CD2-CE 4.21Å
60	M	86.2	Confident	83.4	Confident	104 Å²	104	55.7 Å²	55.7	51%	0.512	29%	0.29	S	S	.	.	H	α-helix	trans	-69	-34.2	-179.8	-171.7	56.8	168.2	0	0	112.3	L58 I63 R64	L58-M60 PolarHBondContact O-N 3.43Å; M60-I63 PolarHBondContact O-N 3.42Å; M60-R64 WeakPolarHBondContact O-CB 3.48Å; M60-R64 PolarHBondContact O-N 3.38Å
61	T	87.1	Confident	83.7	Confident	8 Å²	8	56.9 Å²	56.9	5%	0.049	30%	0.297	C	S	.	.	H	α-helix	trans	-62.3	-43.4	173.9	-68.7	0	0	0	0	110.8	K27 L30 E31 L58 L59 R64 F65	K27-T61 HydrophobicContact CG-CG2 4.21Å; L30-T61 HydrophobicContact CB-CG2 3.89Å; E31-T61 HydrophobicContact CG-CG2 3.56Å; E31-T61 PolarHBondContact OE1-OG1 3.04Å; L58-T61 PolarHBondContact O-N 3.48Å; L59-T61 VanDerWaalsContact C-N 3.35Å; L59-T61 PolarHBondContact O-N 2.87Å; T61-R64 PolarHBondContact O-N 3.02Å; T61-F65 HydrophobicContact CG2-CD2 4.11Å; T61-F65 WeakPolarHBondContact O-CB 3.18Å; T61-F65 WeakPolarHBondContact O-CD2 3.4Å; T61-F65 PolarHBondContact O-N 3.28Å
62	I	90.1	Very high	83.8	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.4	-45.6	176.9	-68.2	167	0	0	0	110.8	L30 L42 V45 L58 L59 R64 V66 L67 L78 F81	L30-I62 HydrophobicContact CD1-CD1 4.35Å; L30-I62 HydrophobicContact CD1-CG1 3.9Å; L42-I62 HydrophobicContact CD1-CD1 4.22Å; V45-I62 HydrophobicContact CG1-CD1 4.2Å; L58-I62 HydrophobicContact CB-CD1 4.29Å; L58-I62 VanDerWaalsContact O-CG1 3.3Å; L58-I62 WeakPolarHBondContact O-CG1 3.35Å; L58-I62 PolarHBondContact O-N 3.2Å; L59-I62 PolarHBondContact O-N 3.46Å; I62-R64 VanDerWaalsContact C-N 3.32Å; I62-R64 PolarHBondContact O-N 2.98Å; I62-V66 HydrophobicContact CG2-CB 4.16Å; I62-V66 WeakPolarHBondContact O-CA 3.25Å; I62-V66 VanDerWaalsContact O-CB 3.31Å; I62-V66 WeakPolarHBondContact O-CB 3.46Å; I62-V66 PolarHBondContact O-N 3.05Å; I62-L67 PolarHBondContact O-N 3.42Å; I62-L78 HydrophobicContact CG2-CD2 3.7Å; I62-F81 HydrophobicContact CD1-CD2 4.42Å; I62-F81 HydrophobicContact CD1-CE1 3.98Å; I62-F81 HydrophobicContact CD1-CE2 3.62Å; I62-F81 HydrophobicContact CD1-CZ 3.36Å; I62-F81 HydrophobicContact CG2-CD1 4.34Å; I62-F81 HydrophobicContact CG2-CE1 3.97Å; I62-F81 HydrophobicContact CG2-CZ 4.45Å
63	I	87.6	Confident	84.4	Confident	12 Å²	12	62.5 Å²	62.5	6%	0.062	32%	0.319	C	S	.	.	H	α-helix	trans	-59.5	-42.1	177.2	-68	170.4	0	0	0	111.3	L59 M60 L67 W82 E97 L100 V101	L59-I63 HydrophobicContact CD1-CD1 4.23Å; L59-I63 HydrophobicContact CG-CD1 4.16Å; L59-I63 WeakPolarHBondContact O-CG1 3.16Å; L59-I63 PolarHBondContact O-N 2.73Å; M60-I63 PolarHBondContact O-N 3.42Å; I63-L67 HydrophobicContact CG2-CD2 4.11Å; I63-L67 VanDerWaalsContact O-CB 3.31Å; I63-L67 WeakPolarHBondContact O-CB 3.46Å; I63-W82 HydrophobicContact CD1-CH2 4.32Å; I63-W82 HydrophobicContact CG1-CH2 3.72Å; I63-W82 HydrophobicContact CG1-CZ2 4.44Å; I63-E97 HydrophobicContact CD1-CB 3.81Å; I63-E97 HydrophobicContact CD1-CG 4.49Å; I63-L100 HydrophobicContact CG2-CB 4.08Å; I63-L100 HydrophobicContact CG2-CD1 3.89Å; I63-V101 HydrophobicContact CD1-CG2 3.95Å; I63-V101 HydrophobicContact CG1-CG2 4.15Å
64	R	87.8	Confident	84.9	Confident	171 Å²	171	58.4 Å²	58.4	65%	0.645	30%	0.3	S	S	*	.	H	α-helix	trans	-79.3	-40.1	-175.1	-173	173.9	179.8	-176.2	1.3	113.6	M60 T61 I62 P68	M60-R64 WeakPolarHBondContact O-CB 3.48Å; M60-R64 PolarHBondContact O-N 3.38Å; T61-R64 PolarHBondContact O-N 3.02Å; I62-R64 VanDerWaalsContact C-N 3.32Å; I62-R64 PolarHBondContact O-N 2.98Å; R64-P68 WeakPolarHBondContact O-CG 3.37Å
65	F	87.6	Confident	85.4	Confident	62 Å²	62	50.7 Å²	50.7	27%	0.272	27%	0.267	S	S	.	.	H	α-helix	trans	-114.2	-11.6	-166.3	-61	-75	0	0	0	115	E31 K38 T61	E31-F65 HydrophobicContact CB-CD2 4.44Å; E31-F65 HydrophobicContact CG-CD2 3.7Å; E31-F65 HydrophobicContact CG-CE2 3.71Å; E31-F65 HydrophobicContact CG-CG 4.35Å; E31-F65 HydrophobicContact CG-CZ 4.39Å; K38-F65 PolarHBondContact NZ-O 3.06Å; T61-F65 HydrophobicContact CG2-CD2 4.11Å; T61-F65 WeakPolarHBondContact O-CB 3.18Å; T61-F65 WeakPolarHBondContact O-CD2 3.4Å; T61-F65 PolarHBondContact O-N 3.28Å
66	V	88.1	Confident	85.8	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	-45.5	-176.9	-171.9	0	0	0	0	111.4	L30 L42 I62 P68 L69 I74 L78	L30-V66 HydrophobicContact CB-CG2 4.32Å; L30-V66 HydrophobicContact CD2-CG2 3.86Å; L42-V66 HydrophobicContact CD2-CG1 4.15Å; I62-V66 HydrophobicContact CG2-CB 4.16Å; I62-V66 WeakPolarHBondContact O-CA 3.25Å; I62-V66 VanDerWaalsContact O-CB 3.31Å; I62-V66 WeakPolarHBondContact O-CB 3.46Å; I62-V66 PolarHBondContact O-N 3.05Å; V66-P68 VanDerWaalsContact C-N 3.34Å; V66-L69 VanDerWaalsContact O-CB 3.3Å; V66-L69 WeakPolarHBondContact O-CB 3.31Å; V66-L69 WeakPolarHBondContact O-CG 3.28Å; V66-L69 PolarHBondContact O-N 2.89Å; V66-L69 VanDerWaalsContact O-N 3.08Å; V66-I74 HydrophobicContact CG1-CG2 3.51Å; V66-L78 HydrophobicContact CG1-CD1 4.39Å; V66-L78 HydrophobicContact CG1-CD2 4.09Å; V66-L78 HydrophobicContact CG1-CG 4.4Å
67	L	87.3	Confident	86.6	Confident	15 Å²	15	53.3 Å²	53.3	8%	0.079	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-37.2	178.8	-172.7	64.4	0	0	0	115	I62 I63 L69 L78 W82 A104	I62-L67 PolarHBondContact O-N 3.42Å; I63-L67 HydrophobicContact CG2-CD2 4.11Å; I63-L67 VanDerWaalsContact O-CB 3.31Å; I63-L67 WeakPolarHBondContact O-CB 3.46Å; L67-L69 PolarHBondContact O-N 3.39Å; L67-L78 HydrophobicContact CD1-CD1 4.18Å; L67-W82 HydrophobicContact CD1-CZ2 4.13Å; L67-A104 HydrophobicContact CD1-CB 3.82Å; L67-A104 HydrophobicContact CD2-CB 3.73Å; L67-A104 HydrophobicContact CG-CB 3.89Å
68	P	86.4	Confident	87.2	Confident	80 Å²	80	51.7 Å²	51.7	52%	0.519	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-14.1	179.4	-19.4	34.4	0	0	0	114.4	R64 V66 Q70	R64-P68 WeakPolarHBondContact O-CG 3.37Å; V66-P68 VanDerWaalsContact C-N 3.34Å; P68-Q70 PolarHBondContact O-NE2 3.37Å
69	L	86.8	Confident	87.4	Confident	45 Å²	45	52.5 Å²	52.5	24%	0.236	25%	0.254	C	S	.	.			trans	-69.5	139.8	-176.1	-60.2	175	0	0	0	110.9	K38 V66 L67 I74 K75	K38-L69 HydrophobicContact CD-CD1 3.71Å; V66-L69 VanDerWaalsContact O-CB 3.3Å; V66-L69 WeakPolarHBondContact O-CB 3.31Å; V66-L69 WeakPolarHBondContact O-CG 3.28Å; V66-L69 PolarHBondContact O-N 2.89Å; V66-L69 VanDerWaalsContact O-N 3.08Å; L67-L69 PolarHBondContact O-N 3.39Å; L69-I74 HydrophobicContact CB-CD1 4.41Å; L69-I74 HydrophobicContact CB-CG2 4.43Å; L69-I74 HydrophobicContact CD1-CD1 3.58Å; L69-K75 WeakPolarHBondContact O-CE 3.26Å
70	Q	82.5	Confident	87.5	Confident	112 Å²	112	54.3 Å²	54.3	52%	0.523	27%	0.266	S	S	.	.			trans	-94.8	3	-176.6	-58.8	-60.4	-42.1	0	0	113.3	P68 H72 H111	P68-Q70 PolarHBondContact O-NE2 3.37Å; Q70-H72 PolarHBondContact O-N 3.41Å; Q70-H111 PolarHBondContact OE1-NE2 3.06Å
71	D	87.1	Confident	87.7	Confident	59 Å²	59	49.6 Å²	49.6	32%	0.316	24%	0.242	S	C	.	.			trans	-65.5	131.4	179.7	-176.3	79.4	0	0	0	111.3	V35 T73 I74 K75	V35-D71 HydrophobicContact CG1-CB 3.93Å; D71-T73 VanDerWaalsContact C-N 3.29Å; D71-T73 PolarHBondContact O-N 3.03Å; D71-T73 WeakPolarHBondContact OD2-CA 3.46Å; D71-T73 WeakPolarHBondContact OD2-CB 3.42Å; D71-T73 PolarHBondContact OD2-N 3.25Å; D71-T73 PolarHBondContact OD2-OG1 3.01Å; D71-I74 HydrophobicContact CB-CB 4.22Å; D71-I74 HydrophobicContact CB-CD1 4.25Å; D71-I74 HydrophobicContact CB-CG1 4.18Å; D71-I74 PolarHBondContact O-N 3.21Å; D71-I74 PolarHBondContact OD2-N 2.9Å; D71-K75 WeakPolarHBondContact O-CB 3.42Å; D71-K75 WeakPolarHBondContact O-CG 3.47Å; D71-K75 PolarHBondContact O-N 2.82Å
72	H	83.7	Confident	87.8	Confident	118 Å²	118	49.4 Å²	49.4	55%	0.546	24%	0.241	S	C	.	.	H	α-helix	trans	-62	-35.4	-175.9	-68.1	177.3	0	0	0	112.8	Q70 K76 N113	Q70-H72 PolarHBondContact O-N 3.41Å; H72-K76 PolarHBondContact O-N 3.49Å; H72-K76 VanDerWaalsContact O-N 3.12Å; H72-N113 PolarHBondContact CE1-ND2 3.07Å; H72-N113 VanDerWaalsContact CE1-ND2 3.33Å; H72-N113 PolarHBondContact NE2-ND2 3.06Å
73	T	86.6	Confident	87.6	Confident	74 Å²	74	53.3 Å²	53.3	45%	0.454	26%	0.259	S	S	.	.	H	α-helix	trans	-70.8	-46.1	-179	-47.2	0	0	0	0	109.9	T39 D71 K75 K76 L77	T39-T73 HydrophobicContact CG2-CG2 3.8Å; D71-T73 VanDerWaalsContact C-N 3.29Å; D71-T73 PolarHBondContact O-N 3.03Å; D71-T73 WeakPolarHBondContact OD2-CA 3.46Å; D71-T73 WeakPolarHBondContact OD2-CB 3.42Å; D71-T73 PolarHBondContact OD2-N 3.25Å; D71-T73 PolarHBondContact OD2-OG1 3.01Å; T73-K75 PolarHBondContact O-N 3.23Å; T73-K76 PolarHBondContact O-N 2.72Å; T73-L77 HydrophobicContact CG2-CD1 4.29Å; T73-L77 WeakPolarHBondContact O-CG 3.41Å; T73-L77 PolarHBondContact O-N 3.15Å
74	I	89.5	Confident	87.4	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.2	-45.5	176.3	-66.1	-175.8	0	0	0	110.6	V35 K38 T39 L42 V66 L69 D71 K76 L77 L78	V35-I74 HydrophobicContact CG1-CD1 3.8Å; K38-I74 HydrophobicContact CB-CD1 4.34Å; T39-I74 WeakPolarHBondContact OG1-CG1 3.25Å; L42-I74 HydrophobicContact CD2-CG2 4.48Å; V66-I74 HydrophobicContact CG1-CG2 3.51Å; L69-I74 HydrophobicContact CB-CD1 4.41Å; L69-I74 HydrophobicContact CB-CG2 4.43Å; L69-I74 HydrophobicContact CD1-CD1 3.58Å; D71-I74 HydrophobicContact CB-CB 4.22Å; D71-I74 HydrophobicContact CB-CD1 4.25Å; D71-I74 HydrophobicContact CB-CG1 4.18Å; D71-I74 PolarHBondContact O-N 3.21Å; D71-I74 PolarHBondContact OD2-N 2.9Å; I74-K76 VanDerWaalsContact C-N 3.32Å; I74-K76 PolarHBondContact O-N 2.95Å; I74-L77 PolarHBondContact O-N 3.32Å; I74-L78 HydrophobicContact CG2-CD1 3.82Å; I74-L78 HydrophobicContact CG2-CG 4.16Å; I74-L78 WeakPolarHBondContact O-CB 3.43Å; I74-L78 VanDerWaalsContact O-CG 3.28Å; I74-L78 WeakPolarHBondContact O-CG 3.49Å; I74-L78 PolarHBondContact O-N 3.48Å
75	K	87.6	Confident	87.3	Confident	16 Å²	16	46.3 Å²	46.3	7%	0.07	24%	0.235	C	C	.	.	H	α-helix	trans	-57.5	-43.8	177	-77.5	-77.1	177.9	173.2	0	112.4	L69 D71 T73 L78 L79 D108	L69-K75 WeakPolarHBondContact O-CE 3.26Å; D71-K75 WeakPolarHBondContact O-CB 3.42Å; D71-K75 WeakPolarHBondContact O-CG 3.47Å; D71-K75 PolarHBondContact O-N 2.82Å; T73-K75 PolarHBondContact O-N 3.23Å; K75-L78 PolarHBondContact O-N 3.09Å; K75-L79 WeakPolarHBondContact O-CG 3.38Å; K75-L79 PolarHBondContact O-N 3.41Å; K75-L79 VanDerWaalsContact O-N 3.16Å; K75-D108 IonicContact NZ-OD1 2.74Å; K75-D108 PolarHBondContact NZ-OD1 3.21Å; K75-D108 IonicContact NZ-OD2 3.98Å; K75-D108 PolarHBondContact NZ-OD2 3.29Å
76	K	87.6	Confident	87	Confident	153 Å²	153	47.1 Å²	47.1	67%	0.665	25%	0.246	S	C	*	.	H	α-helix	trans	-65.8	-42.9	177.2	-172.3	176.2	176.4	-176.3	0	112.2	H72 T73 I74 L78 L79 V80	H72-K76 PolarHBondContact O-N 3.49Å; H72-K76 VanDerWaalsContact O-N 3.12Å; T73-K76 PolarHBondContact O-N 2.72Å; I74-K76 VanDerWaalsContact C-N 3.32Å; I74-K76 PolarHBondContact O-N 2.95Å; K76-L78 VanDerWaalsContact C-N 3.33Å; K76-L79 PolarHBondContact O-N 3.44Å; K76-V80 PolarHBondContact O-N 3.18Å
77	L	90	Very high	86.8	Confident	29 Å²	29	48.3 Å²	48.3	15%	0.152	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-37.6	176.2	-71.6	171.7	0	0	0	111.9	T39 L42 K43 I46 T73 I74 L79 V80 F81	T39-L77 HydrophobicContact CG2-CD1 3.68Å; L42-L77 HydrophobicContact CD2-CB 3.52Å; L42-L77 HydrophobicContact CD2-CD1 4.41Å; L42-L77 HydrophobicContact CG-CB 4.12Å; K43-L77 HydrophobicContact CG-CD1 3.81Å; K43-L77 HydrophobicContact CG-CD2 3.88Å; I46-L77 HydrophobicContact CD1-CB 4.16Å; I46-L77 HydrophobicContact CD1-CD2 4.09Å; I46-L77 WeakPolarHBondContact CD1-O 3.3Å; T73-L77 HydrophobicContact CG2-CD1 4.29Å; T73-L77 WeakPolarHBondContact O-CG 3.41Å; T73-L77 PolarHBondContact O-N 3.15Å; I74-L77 PolarHBondContact O-N 3.32Å; L77-L79 PolarHBondContact O-N 3.32Å; L77-V80 PolarHBondContact O-N 3.14Å; L77-F81 WeakPolarHBondContact O-CB 3.47Å; L77-F81 PolarHBondContact O-N 3.21Å
78	L	90.9	Very high	86.6	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-60.5	-44.2	174.8	-76.8	169	0	0	0	111.2	L42 I62 V66 L67 I74 K75 K76 V80 F81 W82	L42-L78 HydrophobicContact CD2-CD2 4.1Å; L42-L78 HydrophobicContact CD2-CG 4.04Å; I62-L78 HydrophobicContact CG2-CD2 3.7Å; V66-L78 HydrophobicContact CG1-CD1 4.39Å; V66-L78 HydrophobicContact CG1-CD2 4.09Å; V66-L78 HydrophobicContact CG1-CG 4.4Å; L67-L78 HydrophobicContact CD1-CD1 4.18Å; I74-L78 HydrophobicContact CG2-CD1 3.82Å; I74-L78 HydrophobicContact CG2-CG 4.16Å; I74-L78 WeakPolarHBondContact O-CB 3.43Å; I74-L78 VanDerWaalsContact O-CG 3.28Å; I74-L78 WeakPolarHBondContact O-CG 3.49Å; I74-L78 PolarHBondContact O-N 3.48Å; K75-L78 PolarHBondContact O-N 3.09Å; K76-L78 VanDerWaalsContact C-N 3.33Å; L78-V80 VanDerWaalsContact C-N 3.27Å; L78-V80 PolarHBondContact O-N 3.47Å; L78-F81 WeakPolarHBondContact O-CB 3.41Å; L78-F81 PolarHBondContact O-N 3.06Å; L78-F81 VanDerWaalsContact O-N 3.17Å; L78-W82 VanDerWaalsContact C-CD1 3.45Å; L78-W82 HydrophobicContact CD2-CZ2 4.32Å; L78-W82 PolarHBondContact O-N 3.23Å; L78-W82 PolarHBondContact O-NE1 2.96Å
79	L	89	Confident	86.2	Confident	19 Å²	19	48.1 Å²	48.1	10%	0.099	25%	0.249	C	C	.	.	H	α-helix	trans	-59.2	-38.1	175.7	-65.4	176.5	0	0	0	112.3	K75 K76 L77 E83 F123	K75-L79 WeakPolarHBondContact O-CG 3.38Å; K75-L79 PolarHBondContact O-N 3.41Å; K75-L79 VanDerWaalsContact O-N 3.16Å; K76-L79 PolarHBondContact O-N 3.44Å; L77-L79 PolarHBondContact O-N 3.32Å; L79-E83 PolarHBondContact O-N 2.91Å; L79-F123 HydrophobicContact CB-CB 4.44Å; L79-F123 HydrophobicContact CB-CD2 4.38Å; L79-F123 HydrophobicContact CB-CG 4.39Å; L79-F123 HydrophobicContact CD2-CB 4.02Å; L79-F123 HydrophobicContact CD2-CD1 3.9Å; L79-F123 HydrophobicContact CD2-CG 3.89Å; L79-F123 VanDerWaalsContact O-CD2 3.28Å; L79-F123 WeakPolarHBondContact O-CD2 3.24Å; L79-F123 VanDerWaalsContact O-CE2 3.23Å; L79-F123 WeakPolarHBondContact O-CE2 3.21Å
80	V	88.4	Confident	85.7	Confident	59 Å²	59	52.1 Å²	52.1	36%	0.358	28%	0.278	S	S	.	.	H	α-helix	trans	-67.9	-45.6	174.5	176.5	0	0	0	0	110.9	I46 K76 L77 L78 W82 E83 I84	I46-V80 HydrophobicContact CD1-CB 4.43Å; I46-V80 HydrophobicContact CD1-CG1 4.4Å; I46-V80 HydrophobicContact CG2-CG1 4.04Å; K76-V80 PolarHBondContact O-N 3.18Å; L77-V80 PolarHBondContact O-N 3.14Å; L78-V80 VanDerWaalsContact C-N 3.27Å; L78-V80 PolarHBondContact O-N 3.47Å; V80-W82 VanDerWaalsContact C-N 3.3Å; V80-W82 PolarHBondContact O-N 3.34Å; V80-E83 VanDerWaalsContact O-CB 3.31Å; V80-E83 WeakPolarHBondContact O-CB 3.47Å; V80-E83 PolarHBondContact O-N 3.44Å; V80-I84 HydrophobicContact CG1-CD1 3.87Å; V80-I84 WeakPolarHBondContact O-CD1 3.4Å; V80-I84 WeakPolarHBondContact O-CG1 3.39Å; V80-I84 PolarHBondContact O-N 2.75Å
81	F	90.2	Very high	85.3	Confident	5 Å²	5	53.5 Å²	53.5	2%	0.022	29%	0.289	C	S	.	.	H	α-helix	trans	-55.7	-45.9	176.7	174.7	-102.2	0	0	0	111.5	L42 V45 I46 I49 L59 I62 L77 L78 E83 I84 V85	L42-F81 HydrophobicContact CD1-CB 4.4Å; L42-F81 HydrophobicContact CD1-CD2 4.26Å; L42-F81 HydrophobicContact CD1-CG 4.3Å; V45-F81 HydrophobicContact CG1-CD2 4.25Å; V45-F81 HydrophobicContact CG1-CE2 3.76Å; I46-F81 HydrophobicContact CD1-CB 4.11Å; I46-F81 HydrophobicContact CG1-CB 3.96Å; I46-F81 HydrophobicContact CG1-CD2 4.15Å; I49-F81 HydrophobicContact CD1-CD2 4.1Å; I49-F81 HydrophobicContact CD1-CE2 3.54Å; L59-F81 HydrophobicContact CD1-CE1 4.22Å; L59-F81 HydrophobicContact CD1-CZ 4.37Å; I62-F81 HydrophobicContact CD1-CD2 4.42Å; I62-F81 HydrophobicContact CD1-CE1 3.98Å; I62-F81 HydrophobicContact CD1-CE2 3.62Å; I62-F81 HydrophobicContact CD1-CZ 3.36Å; I62-F81 HydrophobicContact CG2-CD1 4.34Å; I62-F81 HydrophobicContact CG2-CE1 3.97Å; I62-F81 HydrophobicContact CG2-CZ 4.45Å; L77-F81 WeakPolarHBondContact O-CB 3.47Å; L77-F81 PolarHBondContact O-N 3.21Å; L78-F81 WeakPolarHBondContact O-CB 3.41Å; L78-F81 PolarHBondContact O-N 3.06Å; L78-F81 VanDerWaalsContact O-N 3.17Å; F81-E83 PolarHBondContact O-N 3.25Å; F81-I84 PolarHBondContact O-N 2.72Å; F81-I84 VanDerWaalsContact O-N 3.15Å; F81-V85 HydrophobicContact CD1-CG2 4.02Å; F81-V85 HydrophobicContact CD2-CG2 3.83Å; F81-V85 HydrophobicContact CE1-CG2 3.68Å; F81-V85 HydrophobicContact CE2-CG2 3.48Å; F81-V85 VanDerWaalsContact CE2-CG2 3.48Å; F81-V85 HydrophobicContact CG-CG2 4.09Å; F81-V85 HydrophobicContact CZ-CG2 3.4Å; F81-V85 VanDerWaalsContact O-CG2 3.27Å; F81-V85 WeakPolarHBondContact O-CG2 3.49Å; F81-V85 PolarHBondContact O-N 2.79Å
82	W	88.1	Confident	84.7	Confident	5 Å²	5	52.5 Å²	52.5	2%	0.019	29%	0.292	C	S	.	.	H	α-helix	trans	-66.7	-24	178.3	-61.2	129.6	0	0	0	113.8	L59 I63 L67 L78 V80 I84 K87 M98 V101 Y105 F123	L59-W82 HydrophobicContact CD1-CH2 4.15Å; L59-W82 HydrophobicContact CD1-CZ3 3.72Å; I63-W82 HydrophobicContact CD1-CH2 4.32Å; I63-W82 HydrophobicContact CG1-CH2 3.72Å; I63-W82 HydrophobicContact CG1-CZ2 4.44Å; L67-W82 HydrophobicContact CD1-CZ2 4.13Å; L78-W82 VanDerWaalsContact C-CD1 3.45Å; L78-W82 HydrophobicContact CD2-CZ2 4.32Å; L78-W82 PolarHBondContact O-N 3.23Å; L78-W82 PolarHBondContact O-NE1 2.96Å; V80-W82 VanDerWaalsContact C-N 3.3Å; V80-W82 PolarHBondContact O-N 3.34Å; W82-I84 VanDerWaalsContact C-N 3.29Å; W82-K87 WeakPolarHBondContact O-CE 3.31Å; W82-K87 PolarHBondContact O-NZ 3.44Å; W82-M98 HydrophobicContact CZ3-CE 4.28Å; W82-V101 HydrophobicContact CD2-CG1 3.97Å; W82-V101 HydrophobicContact CE3-CG1 4.18Å; W82-V101 HydrophobicContact CE3-CG2 4.41Å; W82-V101 HydrophobicContact CG-CG1 4.48Å; W82-V101 HydrophobicContact CH2-CG1 4.46Å; W82-V101 HydrophobicContact CH2-CG2 3.65Å; W82-V101 HydrophobicContact CZ2-CG1 4.23Å; W82-V101 HydrophobicContact CZ2-CG2 4.02Å; W82-V101 HydrophobicContact CZ3-CG1 4.41Å; W82-V101 HydrophobicContact CZ3-CG2 3.85Å; W82-Y105 WeakPolarHBondContact CB-OH 3.42Å; W82-Y105 AromaticContact CD1-CE1 3.69Å; W82-Y105 AromaticContact CD1-CZ 3.97Å; W82-Y105 HydrophobicContact CG-CE1 4.24Å; W82-F123 HydrophobicContact CB-CE1 4.34Å; W82-F123 HydrophobicContact CB-CE2 3.82Å; W82-F123 HydrophobicContact CB-CZ 3.46Å; W82-F123 VanDerWaalsContact CB-CZ 3.46Å
83	E	85.9	Confident	84.6	Confident	81 Å²	81	56.1 Å²	56.1	38%	0.379	30%	0.301	S	S	.	.	H	α-helix	trans	-67.1	-36.2	174.9	-170.2	173.2	160.1	0	0	110.8	L79 V80 F81 K87 F123 K126	L79-E83 PolarHBondContact O-N 2.91Å; V80-E83 VanDerWaalsContact O-CB 3.31Å; V80-E83 WeakPolarHBondContact O-CB 3.47Å; V80-E83 PolarHBondContact O-N 3.44Å; F81-E83 PolarHBondContact O-N 3.25Å; E83-K87 PolarHBondContact O-NZ 3.35Å; E83-F123 HydrophobicContact CB-CE2 4.05Å; E83-K126 HydrophobicContact CG-CD 4.1Å; E83-K126 WeakPolarHBondContact OE1-CD 3.48Å; E83-K126 IonicContact OE1-NZ 3.33Å; E83-K126 PolarHBondContact OE1-NZ 3.38Å; E83-K126 VanDerWaalsContact OE2-CD 3.27Å; E83-K126 WeakPolarHBondContact OE2-CD 3.36Å; E83-K126 IonicContact OE2-NZ 2.85Å; E83-K126 PolarHBondContact OE2-NZ 3.36Å
84	I	84.3	Confident	84.4	Confident	23 Å²	23	54.3 Å²	54.3	12%	0.118	29%	0.289	C	S	.	.	H	α-helix	trans	-94.2	-34.8	-168.5	-53.2	154.5	0	0	0	112.1	I46 I49 L50 V80 F81 W82	I46-I84 HydrophobicContact CG2-CD1 3.77Å; I49-I84 HydrophobicContact CB-CG2 4.44Å; I49-I84 HydrophobicContact CG2-CB 4.46Å; I49-I84 HydrophobicContact CG2-CG2 3.53Å; L50-I84 HydrophobicContact CD1-CD1 3.95Å; L50-I84 HydrophobicContact CD2-CD1 3.61Å; L50-I84 HydrophobicContact CD2-CG1 3.81Å; L50-I84 HydrophobicContact CD2-CG2 3.84Å; L50-I84 HydrophobicContact CG-CD1 3.7Å; L50-I84 HydrophobicContact CG-CG1 4.41Å; L50-I84 HydrophobicContact CG-CG2 4.32Å; V80-I84 HydrophobicContact CG1-CD1 3.87Å; V80-I84 WeakPolarHBondContact O-CD1 3.4Å; V80-I84 WeakPolarHBondContact O-CG1 3.39Å; V80-I84 PolarHBondContact O-N 2.75Å; F81-I84 PolarHBondContact O-N 2.72Å; F81-I84 VanDerWaalsContact O-N 3.15Å; W82-I84 VanDerWaalsContact C-N 3.29Å
85	V	85.6	Confident	84.2	Confident	13 Å²	13	56 Å²	56	8%	0.079	30%	0.298	C	S	.	.	S	Bend	trans	-65.4	134.6	-175.4	170.1	0	0	0	0	111.5	I49 L59 F81 K87	I49-V85 HydrophobicContact CD1-CG2 4.11Å; L59-V85 HydrophobicContact CD1-CG1 4.2Å; F81-V85 HydrophobicContact CD1-CG2 4.02Å; F81-V85 HydrophobicContact CD2-CG2 3.83Å; F81-V85 HydrophobicContact CE1-CG2 3.68Å; F81-V85 HydrophobicContact CE2-CG2 3.48Å; F81-V85 VanDerWaalsContact CE2-CG2 3.48Å; F81-V85 HydrophobicContact CG-CG2 4.09Å; F81-V85 HydrophobicContact CZ-CG2 3.4Å; F81-V85 VanDerWaalsContact O-CG2 3.27Å; F81-V85 WeakPolarHBondContact O-CG2 3.49Å; F81-V85 PolarHBondContact O-N 2.79Å; V85-K87 WeakPolarHBondContact O-CD 3.41Å; V85-K87 WeakPolarHBondContact O-CE 3.3Å; V85-K87 PolarHBondContact O-N 2.97Å; V85-K87 PolarHBondContact O-NZ 2.93Å
86	P	81.3	Confident	83.9	Confident	80 Å²	80	63 Å²	63	52%	0.519	33%	0.33	S	S	.	.			trans	-60.1	130.2	171.8	-23.2	33.6	0	0	0	111.8	L95	P86-L95 WeakPolarHBondContact O-CD1 3.24Å
87	K	84.5	Confident	83.7	Confident	24 Å²	24	59 Å²	59	10%	0.104	31%	0.314	C	S	.	.			trans	-97.8	-17.5	-178	-62.4	90.6	-174.1	158.7	0	112.8	W82 E83 V85 L94 L95 M98 E129 L132	W82-K87 WeakPolarHBondContact O-CE 3.31Å; W82-K87 PolarHBondContact O-NZ 3.44Å; E83-K87 PolarHBondContact O-NZ 3.35Å; V85-K87 WeakPolarHBondContact O-CD 3.41Å; V85-K87 WeakPolarHBondContact O-CE 3.3Å; V85-K87 PolarHBondContact O-N 2.97Å; V85-K87 PolarHBondContact O-NZ 2.93Å; K87-L94 HydrophobicContact CB-CD1 4.23Å; K87-L95 WeakPolarHBondContact O-CB 3.19Å; K87-L95 WeakPolarHBondContact O-CG 3.47Å; K87-L95 PolarHBondContact O-N 3.41Å; K87-M98 HydrophobicContact CB-CG 4.42Å; K87-M98 HydrophobicContact CB-SD 4.22Å; K87-M98 HydrophobicContact CG-SD 3.99Å; K87-E129 HydrophobicContact CB-CG 4.33Å; K87-L132 HydrophobicContact CG-CD1 4.41Å
88	T	81.8	Confident	83.4	Confident	54 Å²	54	57.8 Å²	57.8	33%	0.331	31%	0.307	S	S	.	.	B	Isolated β-bridge	trans	-109.6	150.5	-177.5	51.7	0	0	0	0	111.3	R93	T88-R93 CarbonylContact C-O 3.46Å; T88-R93 WeakPolarHBondContact CA-O 3.36Å
89	T	79.3	Confident	83	Confident	37 Å²	37	63 Å²	63	23%	0.227	34%	0.335	C	S	.	.			trans	-67.5	164.4	165	60.6	0	0	0	0	109.9	D91 G92 R93 L95	T89-D91 PolarHBondContact O-N 3.23Å; T89-G92 PolarHBondContact O-N 3.16Å; T89-R93 PolarHBondContact N-O 2.98Å; T89-R93 PolarHBondContact OG1-N 3.46Å; T89-R93 PolarHBondContact OG1-O 2.86Å; T89-L95 HydrophobicContact CG2-CD2 3.71Å; T89-L95 HydrophobicContact CG2-CG 4.47Å
90	P	75.1	Confident	82.8	Confident	129 Å²	129	66.4 Å²	66.4	84%	0.838	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-24.8	172.5	-27.2	36.1	0	0	0	114	G92	P90-G92 VanDerWaalsContact C-N 3.28Å; P90-G92 PolarHBondContact O-N 3.41Å
91	D	75.5	Confident	82.7	Confident	142 Å²	142	63.7 Å²	63.7	76%	0.759	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	0.8	177.1	-51.7	-47.5	0	0	0	113.7	T89	T89-D91 PolarHBondContact O-N 3.23Å
92	G	73	Confident	82.6	Confident	37 Å²	37	64.1 Å²	64.1	38%	0.381	34%	0.339	S	S	.	.	S	Bend	trans	81.7	7.6	179.3	0	0	0	0	0	115.5	M1 T89 P90	M1-G92 VanDerWaalsContact CE-CA 3.48Å; T89-G92 PolarHBondContact O-N 3.16Å; P90-G92 VanDerWaalsContact C-N 3.28Å; P90-G92 PolarHBondContact O-N 3.41Å
93	R	81.9	Confident	82.6	Confident	194 Å²	194	67.3 Å²	67.3	73%	0.732	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-88.6	146.3	176.3	-64.5	-174.1	-179.2	-174	0.3	111.1	T88 T89	T88-R93 CarbonylContact C-O 3.46Å; T88-R93 WeakPolarHBondContact CA-O 3.36Å; T89-R93 PolarHBondContact N-O 2.98Å; T89-R93 PolarHBondContact OG1-N 3.46Å; T89-R93 PolarHBondContact OG1-O 2.86Å
94	L	83.5	Confident	82.7	Confident	36 Å²	36	64 Å²	64	19%	0.188	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-63.2	137.7	177.3	-168.5	72.9	0	0	0	111.5	K87 M98 E131 L132	K87-L94 HydrophobicContact CB-CD1 4.23Å; L94-M98 HydrophobicContact CD1-CB 4.14Å; L94-M98 HydrophobicContact CD1-CG 4.09Å; L94-M98 HydrophobicContact CD2-CB 4.23Å; L94-M98 HydrophobicContact CG-CB 4.04Å; L94-M98 HydrophobicContact CG-CG 4.29Å; L94-E131 HydrophobicContact CD2-CB 4.33Å; L94-L132 HydrophobicContact CD1-CD1 3.91Å; L94-L132 HydrophobicContact CD1-CD2 4.15Å; L94-L132 HydrophobicContact CD1-CG 3.82Å; L94-L132 HydrophobicContact CD2-CD2 3.7Å; L94-L132 HydrophobicContact CD2-CG 4.03Å; L94-L132 HydrophobicContact CG-CD2 4.48Å
95	L	84.1	Confident	83	Confident	37 Å²	37	63.2 Å²	63.2	19%	0.194	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-64.2	136.3	173.9	-74.4	170.9	0	0	0	110.8	L59 P86 K87 T89 E97 M98	L59-L95 HydrophobicContact CD2-CD1 4.36Å; P86-L95 WeakPolarHBondContact O-CD1 3.24Å; K87-L95 WeakPolarHBondContact O-CB 3.19Å; K87-L95 WeakPolarHBondContact O-CG 3.47Å; K87-L95 PolarHBondContact O-N 3.41Å; T89-L95 HydrophobicContact CG2-CD2 3.71Å; T89-L95 HydrophobicContact CG2-CG 4.47Å; L95-E97 PolarHBondContact O-N 3.19Å; L95-M98 HydrophobicContact CB-CG 3.86Å; L95-M98 VanDerWaalsContact O-CB 3.29Å; L95-M98 WeakPolarHBondContact O-CB 3.33Å; L95-M98 WeakPolarHBondContact O-CG 3.48Å; L95-M98 PolarHBondContact O-N 2.81Å
96	H	81.3	Confident	83.3	Confident	161 Å²	161	68.6 Å²	68.6	75%	0.745	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-31	-178.5	-68.3	82.8	0	0	0	111.8	M98 I99	H96-M98 PolarHBondContact O-N 2.86Å; H96-I99 WeakPolarHBondContact O-CB 3.4Å; H96-I99 WeakPolarHBondContact O-CG1 3.46Å; H96-I99 PolarHBondContact O-N 3.47Å
97	E	83	Confident	83.7	Confident	71 Å²	71	70.6 Å²	70.6	33%	0.332	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-26.8	175.6	-63.3	84.7	171.7	0	0	112.6	L59 I63 L95 I99 L100	L59-E97 HydrophobicContact CD2-CB 4.42Å; I63-E97 HydrophobicContact CD1-CB 3.81Å; I63-E97 HydrophobicContact CD1-CG 4.49Å; L95-E97 PolarHBondContact O-N 3.19Å; E97-I99 PolarHBondContact O-N 3.42Å; E97-L100 PolarHBondContact O-N 3.34Å
98	M	85.1	Confident	84	Confident	2 Å²	2	70 Å²	70	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-68.7	-17.8	-178.5	-60.2	-68.2	111	0	0	112.9	L59 W82 K87 L94 L95 H96 L100 V101 C102 L132	L59-M98 HydrophobicContact CD1-CE 4.28Å; L59-M98 HydrophobicContact CD2-CE 4.21Å; W82-M98 HydrophobicContact CZ3-CE 4.28Å; K87-M98 HydrophobicContact CB-CG 4.42Å; K87-M98 HydrophobicContact CB-SD 4.22Å; K87-M98 HydrophobicContact CG-SD 3.99Å; L94-M98 HydrophobicContact CD1-CB 4.14Å; L94-M98 HydrophobicContact CD1-CG 4.09Å; L94-M98 HydrophobicContact CD2-CB 4.23Å; L94-M98 HydrophobicContact CG-CB 4.04Å; L94-M98 HydrophobicContact CG-CG 4.29Å; L95-M98 HydrophobicContact CB-CG 3.86Å; L95-M98 VanDerWaalsContact O-CB 3.29Å; L95-M98 WeakPolarHBondContact O-CB 3.33Å; L95-M98 WeakPolarHBondContact O-CG 3.48Å; L95-M98 PolarHBondContact O-N 2.81Å; H96-M98 PolarHBondContact O-N 2.86Å; M98-L100 VanDerWaalsContact C-N 3.32Å; M98-L100 PolarHBondContact O-N 2.63Å; M98-V101 HydrophobicContact CE-CG2 4.21Å; M98-V101 PolarHBondContact O-N 3.13Å; M98-V101 HydrophobicContact SD-CG2 4.48Å; M98-C102 WeakPolarHBondContact O-CB 3.49Å; M98-C102 PolarHBondContact O-N 3.42Å; M98-L132 HydrophobicContact CB-CD2 3.88Å
99	I	82.9	Confident	84.5	Confident	115 Å²	115	67.4 Å²	67.4	59%	0.59	34%	0.34	S	S	*	.	H	α-helix	trans	-61.8	-42.7	172.8	-61.3	173.8	0	0	0	110.4	H96 E97 V101 C102 D103	H96-I99 WeakPolarHBondContact O-CB 3.4Å; H96-I99 WeakPolarHBondContact O-CG1 3.46Å; H96-I99 PolarHBondContact O-N 3.47Å; E97-I99 PolarHBondContact O-N 3.42Å; I99-V101 VanDerWaalsContact C-N 3.29Å; I99-V101 PolarHBondContact O-N 3.47Å; I99-C102 WeakPolarHBondContact O-CB 3.47Å; I99-C102 PolarHBondContact O-N 3.03Å; I99-D103 PolarHBondContact O-N 3.42Å; I99-D103 VanDerWaalsContact O-N 3.12Å
100	L	84.4	Confident	85.1	Confident	90 Å²	90	70.6 Å²	70.6	47%	0.471	35%	0.353	S	S	.	.	H	α-helix	trans	-66.8	-35.7	177.6	-64.2	173.6	0	0	0	111.5	I63 E97 M98 A104	I63-L100 HydrophobicContact CG2-CB 4.08Å; I63-L100 HydrophobicContact CG2-CD1 3.89Å; E97-L100 PolarHBondContact O-N 3.34Å; M98-L100 VanDerWaalsContact C-N 3.32Å; M98-L100 PolarHBondContact O-N 2.63Å; L100-A104 PolarHBondContact O-N 3.33Å; L100-A104 VanDerWaalsContact O-N 3.13Å
101	V	86.3	Confident	85.9	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-68.9	-40	177.1	-177.2	0	0	0	0	110.6	I63 W82 M98 I99 D103 A104 Y105	I63-V101 HydrophobicContact CD1-CG2 3.95Å; I63-V101 HydrophobicContact CG1-CG2 4.15Å; W82-V101 HydrophobicContact CD2-CG1 3.97Å; W82-V101 HydrophobicContact CE3-CG1 4.18Å; W82-V101 HydrophobicContact CE3-CG2 4.41Å; W82-V101 HydrophobicContact CG-CG1 4.48Å; W82-V101 HydrophobicContact CH2-CG1 4.46Å; W82-V101 HydrophobicContact CH2-CG2 3.65Å; W82-V101 HydrophobicContact CZ2-CG1 4.23Å; W82-V101 HydrophobicContact CZ2-CG2 4.02Å; W82-V101 HydrophobicContact CZ3-CG1 4.41Å; W82-V101 HydrophobicContact CZ3-CG2 3.85Å; M98-V101 HydrophobicContact CE-CG2 4.21Å; M98-V101 PolarHBondContact O-N 3.13Å; M98-V101 HydrophobicContact SD-CG2 4.48Å; I99-V101 VanDerWaalsContact C-N 3.29Å; I99-V101 PolarHBondContact O-N 3.47Å; V101-D103 PolarHBondContact O-N 2.83Å; V101-A104 WeakPolarHBondContact O-CB 3.47Å; V101-A104 PolarHBondContact O-N 3.33Å; V101-A104 VanDerWaalsContact O-N 3.15Å; V101-Y105 HydrophobicContact CG1-CD1 4.45Å; V101-Y105 HydrophobicContact CG1-CD2 4.32Å; V101-Y105 HydrophobicContact CG1-CE1 3.72Å; V101-Y105 HydrophobicContact CG1-CE2 3.58Å; V101-Y105 WeakPolarHBondContact CG1-OH 3.42Å; V101-Y105 PolarHBondContact O-N 3.03Å
102	C	87.5	Confident	86.5	Confident	14 Å²	14	64.3 Å²	64.3	10%	0.095	32%	0.316	C	S	.	.	H	α-helix	trans	-60.6	-44.5	174.6	-172	0	0	0	0	111.8	M98 I99 A104 Y105 R106 L132 L136	M98-C102 WeakPolarHBondContact O-CB 3.49Å; M98-C102 PolarHBondContact O-N 3.42Å; I99-C102 WeakPolarHBondContact O-CB 3.47Å; I99-C102 PolarHBondContact O-N 3.03Å; C102-A104 VanDerWaalsContact C-N 3.29Å; C102-A104 PolarHBondContact O-N 2.87Å; C102-Y105 PolarHBondContact O-N 3.31Å; C102-R106 PolarHBondContact O-N 3.42Å; C102-L132 HydrophobicContact CB-CD2 4.27Å; C102-L136 WeakPolarHBondContact O-CD2 3.4Å
103	D	88.1	Confident	87.2	Confident	72 Å²	72	63.8 Å²	63.8	39%	0.385	30%	0.304	S	S	.	.	H	α-helix	trans	-61	-38.2	173.8	-179.3	63.1	0	0	0	112.1	I99 V101 R106 K107	I99-D103 PolarHBondContact O-N 3.42Å; I99-D103 VanDerWaalsContact O-N 3.12Å; V101-D103 PolarHBondContact O-N 2.83Å; D103-R106 PolarHBondContact O-N 2.86Å; D103-K107 WeakPolarHBondContact O-CG 3.29Å; D103-K107 PolarHBondContact O-N 3.08Å; D103-K107 WeakPolarHBondContact OD2-CE 3.36Å; D103-K107 IonicContact OD2-NZ 2.69Å; D103-K107 PolarHBondContact OD2-NZ 2.75Å
104	A	88.2	Confident	87.6	Confident	12 Å²	12	56.7 Å²	56.7	10%	0.099	28%	0.28	C	S	.	.	H	α-helix	trans	-65.4	-42	174.8	0	0	0	0	0	112.6	L67 L100 V101 C102 R106 K107 D108	L67-A104 HydrophobicContact CD1-CB 3.82Å; L67-A104 HydrophobicContact CD2-CB 3.73Å; L67-A104 HydrophobicContact CG-CB 3.89Å; L100-A104 PolarHBondContact O-N 3.33Å; L100-A104 VanDerWaalsContact O-N 3.13Å; V101-A104 WeakPolarHBondContact O-CB 3.47Å; V101-A104 PolarHBondContact O-N 3.33Å; V101-A104 VanDerWaalsContact O-N 3.15Å; C102-A104 VanDerWaalsContact C-N 3.29Å; C102-A104 PolarHBondContact O-N 2.87Å; A104-R106 VanDerWaalsContact C-N 3.33Å; A104-R106 PolarHBondContact O-N 3.1Å; A104-K107 PolarHBondContact O-N 3.42Å; A104-D108 WeakPolarHBondContact O-CB 3.5Å; A104-D108 PolarHBondContact O-N 3.22Å
105	Y	90.3	Very high	87.9	Confident	6 Å²	6	60.8 Å²	60.8	2%	0.024	30%	0.296	C	S	.	.	H	α-helix	trans	-61.3	-42.5	173.9	-61.9	-27.2	0	0	0	111.8	W82 V101 C102 K107 D108 L109 F123 L127 L136	W82-Y105 WeakPolarHBondContact CB-OH 3.42Å; W82-Y105 AromaticContact CD1-CE1 3.69Å; W82-Y105 AromaticContact CD1-CZ 3.97Å; W82-Y105 HydrophobicContact CG-CE1 4.24Å; V101-Y105 HydrophobicContact CG1-CD1 4.45Å; V101-Y105 HydrophobicContact CG1-CD2 4.32Å; V101-Y105 HydrophobicContact CG1-CE1 3.72Å; V101-Y105 HydrophobicContact CG1-CE2 3.58Å; V101-Y105 WeakPolarHBondContact CG1-OH 3.42Å; V101-Y105 PolarHBondContact O-N 3.03Å; C102-Y105 PolarHBondContact O-N 3.31Å; Y105-K107 VanDerWaalsContact C-N 3.33Å; Y105-K107 PolarHBondContact O-N 3.28Å; Y105-D108 PolarHBondContact O-N 3.38Å; Y105-L109 VanDerWaalsContact O-CG 3.31Å; Y105-L109 WeakPolarHBondContact O-CG 3.36Å; Y105-L109 PolarHBondContact O-N 3.02Å; Y105-F123 HydrophobicContact CE1-CD1 4.44Å; Y105-F123 AromaticContact CE1-CE1 3.84Å; Y105-F123 HydrophobicContact CE1-CE1 3.84Å; Y105-F123 AromaticContact CE2-CE1 3.87Å; Y105-F123 HydrophobicContact CE2-CE1 3.87Å; Y105-F123 AromaticContact CZ-CE1 3.44Å; Y105-F123 VanDerWaalsContact CZ-CE1 3.44Å; Y105-F123 AromaticContact CZ-CZ 4Å; Y105-F123 WeakPolarHBondContact OH-CE1 3.49Å; Y105-F123 WeakPolarHBondContact OH-CZ 3.45Å; Y105-L127 HydrophobicContact CE2-CD1 4.48Å; Y105-L136 HydrophobicContact CD2-CD1 4.08Å; Y105-L136 HydrophobicContact CG-CD1 4.5Å
106	R	91.7	Very high	88.1	Confident	126 Å²	126	59.7 Å²	59.7	48%	0.475	29%	0.29	S	S	.	.	H	α-helix	trans	-58.9	-44.8	175.7	-174.7	-180	172.1	172.6	0.1	111.5	C102 D103 A104 L109 Q110 L136 A139	C102-R106 PolarHBondContact O-N 3.42Å; D103-R106 PolarHBondContact O-N 2.86Å; A104-R106 VanDerWaalsContact C-N 3.33Å; A104-R106 PolarHBondContact O-N 3.1Å; R106-L109 PolarHBondContact O-N 3.21Å; R106-Q110 WeakPolarHBondContact O-CG 3.47Å; R106-Q110 PolarHBondContact O-N 3.4Å; R106-L136 HydrophobicContact CB-CD2 3.79Å; R106-A139 HydrophobicContact CG-CB 4.43Å
107	K	90.3	Very high	88.6	Confident	122 Å²	122	53.8 Å²	53.8	53%	0.53	26%	0.262	S	S	.	.	H	α-helix	trans	-63.5	-41.4	175.1	-74.7	169.1	178.4	160.5	0	112	D103 A104 Y105 Q110 H111	D103-K107 WeakPolarHBondContact O-CG 3.29Å; D103-K107 PolarHBondContact O-N 3.08Å; D103-K107 WeakPolarHBondContact OD2-CE 3.36Å; D103-K107 IonicContact OD2-NZ 2.69Å; D103-K107 PolarHBondContact OD2-NZ 2.75Å; A104-K107 PolarHBondContact O-N 3.42Å; Y105-K107 VanDerWaalsContact C-N 3.33Å; Y105-K107 PolarHBondContact O-N 3.28Å; K107-Q110 CarbonylContact O-C 3.34Å; K107-Q110 WeakPolarHBondContact O-CA 3.31Å; K107-Q110 PolarHBondContact O-N 2.99Å; K107-Q110 VanDerWaalsContact O-N 3.08Å; K107-H111 PolarHBondContact O-N 2.96Å
108	D	90.7	Very high	89	Confident	11 Å²	11	50.4 Å²	50.4	6%	0.059	25%	0.246	C	C	.	.	H	α-helix	trans	-67.7	-35.2	179	-74.6	-11.1	0	0	0	112.2	K75 A104 Y105 Q110 H111 I116 R117 T120	K75-D108 IonicContact NZ-OD1 2.74Å; K75-D108 PolarHBondContact NZ-OD1 3.21Å; K75-D108 IonicContact NZ-OD2 3.98Å; K75-D108 PolarHBondContact NZ-OD2 3.29Å; A104-D108 WeakPolarHBondContact O-CB 3.5Å; A104-D108 PolarHBondContact O-N 3.22Å; Y105-D108 PolarHBondContact O-N 3.38Å; D108-Q110 PolarHBondContact O-N 3.42Å; D108-H111 WeakPolarHBondContact O-CB 3.47Å; D108-H111 PolarHBondContact O-N 3.16Å; D108-I116 HydrophobicContact CB-CG2 4.02Å; D108-R117 WeakPolarHBondContact O-CG 3.35Å; D108-T120 HydrophobicContact CB-CG2 4.35Å
109	L	92.5	Very high	89.3	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.4	-25.3	170.6	-70.7	174.3	0	0	0	112.9	Y105 R106 R117 T120 L121 L124 L136 A139 I140	Y105-L109 VanDerWaalsContact O-CG 3.31Å; Y105-L109 WeakPolarHBondContact O-CG 3.36Å; Y105-L109 PolarHBondContact O-N 3.02Å; R106-L109 PolarHBondContact O-N 3.21Å; L109-R117 VanDerWaalsContact O-CD 3.24Å; L109-R117 WeakPolarHBondContact O-CD 3.31Å; L109-R117 WeakPolarHBondContact O-CG 3.48Å; L109-R117 PolarHBondContact O-NE 3.3Å; L109-R117 PolarHBondContact O-NH1 3.38Å; L109-T120 HydrophobicContact CD2-CG2 3.91Å; L109-T120 HydrophobicContact CG-CG2 4.05Å; L109-L121 HydrophobicContact CD2-CD2 3.62Å; L109-L121 HydrophobicContact CD2-CG 3.72Å; L109-L124 HydrophobicContact CD1-CD1 3.98Å; L109-L124 HydrophobicContact CD2-CD1 4.05Å; L109-L124 HydrophobicContact CG-CD1 4.46Å; L109-L136 HydrophobicContact CD1-CB 4.3Å; L109-L136 HydrophobicContact CD1-CD2 4.49Å; L109-A139 HydrophobicContact CB-CB 4.03Å; L109-A139 HydrophobicContact CD1-CB 3.8Å; L109-I140 HydrophobicContact CD1-CG1 3.91Å
110	Q	92.4	Very high	89.7	Confident	105 Å²	105	46.4 Å²	46.4	49%	0.491	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	3.8	177	-65.2	180	-5.8	0	0	113	R106 K107 D108 R117	R106-Q110 WeakPolarHBondContact O-CG 3.47Å; R106-Q110 PolarHBondContact O-N 3.4Å; K107-Q110 CarbonylContact O-C 3.34Å; K107-Q110 WeakPolarHBondContact O-CA 3.31Å; K107-Q110 PolarHBondContact O-N 2.99Å; K107-Q110 VanDerWaalsContact O-N 3.08Å; D108-Q110 PolarHBondContact O-N 3.42Å; Q110-R117 PolarHBondContact O-NH2 3.49Å
111	H	90.4	Very high	90.2	Very high	37 Å²	37	42.1 Å²	42.1	17%	0.171	21%	0.205	C	C	.	.			trans	-67.6	142.9	-174.7	-169.6	-85.7	0	0	0	111.9	Q70 K107 D108 N113 I116 R117	Q70-H111 PolarHBondContact OE1-NE2 3.06Å; K107-H111 PolarHBondContact O-N 2.96Å; D108-H111 WeakPolarHBondContact O-CB 3.47Å; D108-H111 PolarHBondContact O-N 3.16Å; H111-N113 VanDerWaalsContact ND1-CB 3.25Å; H111-N113 WeakPolarHBondContact ND1-CB 3.3Å; H111-N113 PolarHBondContact ND1-N 3.44Å; H111-N113 PolarHBondContact O-N 3.39Å; H111-I116 HydrophobicContact CB-CG2 4.26Å; H111-R117 PolarHBondContact O-NE 3.03Å; H111-R117 PolarHBondContact O-NH2 2.97Å
112	P	88	Confident	90.4	Very high	101 Å²	101	47.4 Å²	47.4	66%	0.656	23%	0.225	S	C	*	.	S	Bend	trans	-61.3	-27.9	-179.5	22.1	-34.4	0	0	0	114.3
113	N	89.6	Confident	90.6	Very high	26 Å²	26	47.1 Å²	47.1	14%	0.139	22%	0.223	C	C	.	.			trans	-78.8	118.9	177.4	-173.8	-21.7	0	0	0	112.2	H72 H111 F115 I116 R117	H72-N113 PolarHBondContact CE1-ND2 3.07Å; H72-N113 VanDerWaalsContact CE1-ND2 3.33Å; H72-N113 PolarHBondContact NE2-ND2 3.06Å; H111-N113 VanDerWaalsContact ND1-CB 3.25Å; H111-N113 WeakPolarHBondContact ND1-CB 3.3Å; H111-N113 PolarHBondContact ND1-N 3.44Å; H111-N113 PolarHBondContact O-N 3.39Å; N113-F115 VanDerWaalsContact C-N 3.33Å; N113-F115 PolarHBondContact O-N 2.92Å; N113-F115 WeakPolarHBondContact OD1-CB 3.4Å; N113-F115 WeakPolarHBondContact OD1-CD2 3.39Å; N113-F115 PolarHBondContact OD1-N 3.04Å; N113-I116 HydrophobicContact CB-CB 4.46Å; N113-I116 HydrophobicContact CB-CD1 4.14Å; N113-I116 HydrophobicContact CB-CG1 4.21Å; N113-I116 PolarHBondContact O-N 3.17Å; N113-R117 PolarHBondContact O-N 3.26Å
114	E	90.3	Very high	90.8	Very high	45 Å²	45	43.8 Å²	43.8	21%	0.21	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-30.7	178.9	63.3	-83.3	-167.1	0	0	114.5	G118 H148 V151	E114-G118 PolarHBondContact O-N 3.23Å; E114-H148 HydrophobicContact CB-CB 4.37Å; E114-H148 IonicContact OE2-CD2 2.68Å; E114-V151 HydrophobicContact CB-CG2 3.68Å
115	F	88.6	Confident	90.9	Very high	122 Å²	122	44.3 Å²	44.3	54%	0.535	21%	0.208	S	C	.	.	H	α-helix	trans	-71.1	-36.2	-179.9	-66	-76.4	0	0	0	111.7	N113 S119 Y150	N113-F115 VanDerWaalsContact C-N 3.33Å; N113-F115 PolarHBondContact O-N 2.92Å; N113-F115 WeakPolarHBondContact OD1-CB 3.4Å; N113-F115 WeakPolarHBondContact OD1-CD2 3.39Å; N113-F115 PolarHBondContact OD1-N 3.04Å; F115-S119 VanDerWaalsContact O-CB 3.27Å; F115-S119 WeakPolarHBondContact O-CB 3.25Å; F115-S119 PolarHBondContact O-N 2.75Å; F115-S119 PolarHBondContact O-OG 3.36Å; F115-Y150 HydrophobicContact CD1-CE1 4.34Å
116	I	88.9	Confident	90.8	Very high	15 Å²	15	49.5 Å²	49.5	8%	0.077	23%	0.23	C	C	.	.	H	α-helix	trans	-66.6	-52.3	174.8	-64.2	-179.8	0	0	0	108.6	D108 H111 N113 G118 S119 T120	D108-I116 HydrophobicContact CB-CG2 4.02Å; H111-I116 HydrophobicContact CB-CG2 4.26Å; N113-I116 HydrophobicContact CB-CB 4.46Å; N113-I116 HydrophobicContact CB-CD1 4.14Å; N113-I116 HydrophobicContact CB-CG1 4.21Å; N113-I116 PolarHBondContact O-N 3.17Å; I116-G118 PolarHBondContact O-N 2.9Å; I116-S119 PolarHBondContact O-N 2.7Å; I116-S119 VanDerWaalsContact O-N 3.16Å; I116-T120 PolarHBondContact O-N 3.26Å; I116-T120 PolarHBondContact O-OG1 3.49Å; I116-T120 VanDerWaalsContact O-OG1 3.04Å
117	R	91.8	Very high	90.6	Very high	37 Å²	37	43.8 Å²	43.8	14%	0.14	21%	0.209	C	C	.	.	H	α-helix	trans	-52.2	-52.3	175.8	-67	-169.3	-176.4	-135.4	4	112.6	D108 L109 Q110 H111 N113 S119 T120 L121 V151	D108-R117 WeakPolarHBondContact O-CG 3.35Å; L109-R117 VanDerWaalsContact O-CD 3.24Å; L109-R117 WeakPolarHBondContact O-CD 3.31Å; L109-R117 WeakPolarHBondContact O-CG 3.48Å; L109-R117 PolarHBondContact O-NE 3.3Å; L109-R117 PolarHBondContact O-NH1 3.38Å; Q110-R117 PolarHBondContact O-NH2 3.49Å; H111-R117 PolarHBondContact O-NE 3.03Å; H111-R117 PolarHBondContact O-NH2 2.97Å; N113-R117 PolarHBondContact O-N 3.26Å; R117-S119 VanDerWaalsContact C-N 3.34Å; R117-S119 PolarHBondContact O-N 3.12Å; R117-T120 PolarHBondContact O-N 3.42Å; R117-L121 WeakPolarHBondContact O-CB 3.48Å; R117-L121 VanDerWaalsContact O-CG 3.3Å; R117-L121 WeakPolarHBondContact O-CG 3.39Å; R117-L121 PolarHBondContact O-N 2.96Å; R117-V151 HydrophobicContact CB-CG1 4.13Å; R117-V151 HydrophobicContact CB-CG2 4.11Å
118	G	91.3	Very high	90.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-68.2	-29.8	-177.8	0	0	0	0	0	113.9	E114 I116 R122	E114-G118 PolarHBondContact O-N 3.23Å; I116-G118 PolarHBondContact O-N 2.9Å; G118-R122 WeakPolarHBondContact O-CG 3.39Å; G118-R122 PolarHBondContact O-N 3.07Å; G118-R122 PolarHBondContact O-NE 3.32Å
119	S	90.7	Very high	90.1	Very high	31 Å²	31	47.6 Å²	47.6	22%	0.217	23%	0.226	C	C	.	.	H	α-helix	trans	-73	-40.9	173.7	-58.4	0	0	0	0	111.5	F115 I116 R117 R122 F123	F115-S119 VanDerWaalsContact O-CB 3.27Å; F115-S119 WeakPolarHBondContact O-CB 3.25Å; F115-S119 PolarHBondContact O-N 2.75Å; F115-S119 PolarHBondContact O-OG 3.36Å; I116-S119 PolarHBondContact O-N 2.7Å; I116-S119 VanDerWaalsContact O-N 3.16Å; R117-S119 VanDerWaalsContact C-N 3.34Å; R117-S119 PolarHBondContact O-N 3.12Å; S119-R122 PolarHBondContact O-N 3.01Å; S119-R122 PolarHBondContact OG-NH2 2.94Å; S119-F123 PolarHBondContact O-N 3.14Å
120	T	92.3	Very high	89.7	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-61.2	-47.3	172.6	-55.2	0	0	0	0	110.8	D108 L109 I116 R117 R122 F123 L124	D108-T120 HydrophobicContact CB-CG2 4.35Å; L109-T120 HydrophobicContact CD2-CG2 3.91Å; L109-T120 HydrophobicContact CG-CG2 4.05Å; I116-T120 PolarHBondContact O-N 3.26Å; I116-T120 PolarHBondContact O-OG1 3.49Å; I116-T120 VanDerWaalsContact O-OG1 3.04Å; R117-T120 PolarHBondContact O-N 3.42Å; T120-R122 VanDerWaalsContact C-N 3.32Å; T120-R122 PolarHBondContact O-N 3.36Å; T120-F123 WeakPolarHBondContact O-CA 3.19Å; T120-F123 WeakPolarHBondContact O-CB 3.22Å; T120-F123 PolarHBondContact O-N 3.49Å; T120-L124 WeakPolarHBondContact O-CG 3.3Å; T120-L124 PolarHBondContact O-N 3.38Å
121	L	93.9	Very high	89.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.8	-41.7	176.5	-73.9	165.6	0	0	0	112.9	L109 R117 F123 L124 C125 I140 C143 V151 N154 A155 A158	L109-L121 HydrophobicContact CD2-CD2 3.62Å; L109-L121 HydrophobicContact CD2-CG 3.72Å; R117-L121 WeakPolarHBondContact O-CB 3.48Å; R117-L121 VanDerWaalsContact O-CG 3.3Å; R117-L121 WeakPolarHBondContact O-CG 3.39Å; R117-L121 PolarHBondContact O-N 2.96Å; L121-F123 VanDerWaalsContact C-N 3.34Å; L121-L124 PolarHBondContact O-N 2.7Å; L121-C125 PolarHBondContact O-N 3.26Å; L121-C125 PolarHBondContact O-SG 2.82Å; L121-C125 VanDerWaalsContact O-SG 3.39Å; L121-I140 HydrophobicContact CD2-CG1 4.34Å; L121-I140 HydrophobicContact CD2-CG2 4.13Å; L121-C143 HydrophobicContact CD1-CB 4.06Å; L121-V151 HydrophobicContact CD1-CG1 3.88Å; L121-N154 HydrophobicContact CB-CB 3.91Å; L121-N154 HydrophobicContact CD1-CB 4.14Å; L121-A155 HydrophobicContact CD1-CB 3.96Å; L121-A155 HydrophobicContact CD2-CB 4.36Å; L121-A158 HydrophobicContact CD2-CB 4.15Å
122	R	91.9	Very high	89.2	Confident	112 Å²	112	48.6 Å²	48.6	42%	0.423	24%	0.235	S	C	.	.	H	α-helix	trans	-65.9	-37	174.5	-74	-177.2	-65.1	179	2.1	112.8	G118 S119 T120 C125 Y150 N154	G118-R122 WeakPolarHBondContact O-CG 3.39Å; G118-R122 PolarHBondContact O-N 3.07Å; G118-R122 PolarHBondContact O-NE 3.32Å; S119-R122 PolarHBondContact O-N 3.01Å; S119-R122 PolarHBondContact OG-NH2 2.94Å; T120-R122 VanDerWaalsContact C-N 3.32Å; T120-R122 PolarHBondContact O-N 3.36Å; R122-C125 WeakPolarHBondContact O-CB 3.36Å; R122-C125 PolarHBondContact O-N 3.49Å; R122-Y150 PolarHBondContact NH2-OH 2.97Å; R122-N154 HydrophobicContact CG-CB 4.5Å; R122-N154 WeakPolarHBondContact CG-OD1 3.39Å
123	F	91.5	Very high	89.3	Confident	9 Å²	9	43.8 Å²	43.8	4%	0.039	20%	0.204	C	C	.	.	H	α-helix	trans	-64.9	-40.6	175.2	166.2	-100	0	0	0	111.4	L79 W82 E83 Y105 S119 T120 L121 C125 K126 L127	L79-F123 HydrophobicContact CB-CB 4.44Å; L79-F123 HydrophobicContact CB-CD2 4.38Å; L79-F123 HydrophobicContact CB-CG 4.39Å; L79-F123 HydrophobicContact CD2-CB 4.02Å; L79-F123 HydrophobicContact CD2-CD1 3.9Å; L79-F123 HydrophobicContact CD2-CG 3.89Å; L79-F123 VanDerWaalsContact O-CD2 3.28Å; L79-F123 WeakPolarHBondContact O-CD2 3.24Å; L79-F123 VanDerWaalsContact O-CE2 3.23Å; L79-F123 WeakPolarHBondContact O-CE2 3.21Å; W82-F123 HydrophobicContact CB-CE1 4.34Å; W82-F123 HydrophobicContact CB-CE2 3.82Å; W82-F123 HydrophobicContact CB-CZ 3.46Å; W82-F123 VanDerWaalsContact CB-CZ 3.46Å; E83-F123 HydrophobicContact CB-CE2 4.05Å; Y105-F123 HydrophobicContact CE1-CD1 4.44Å; Y105-F123 AromaticContact CE1-CE1 3.84Å; Y105-F123 HydrophobicContact CE1-CE1 3.84Å; Y105-F123 AromaticContact CE2-CE1 3.87Å; Y105-F123 HydrophobicContact CE2-CE1 3.87Å; Y105-F123 AromaticContact CZ-CE1 3.44Å; Y105-F123 VanDerWaalsContact CZ-CE1 3.44Å; Y105-F123 AromaticContact CZ-CZ 4Å; Y105-F123 WeakPolarHBondContact OH-CE1 3.49Å; Y105-F123 WeakPolarHBondContact OH-CZ 3.45Å; S119-F123 PolarHBondContact O-N 3.14Å; T120-F123 WeakPolarHBondContact O-CA 3.19Å; T120-F123 WeakPolarHBondContact O-CB 3.22Å; T120-F123 PolarHBondContact O-N 3.49Å; L121-F123 VanDerWaalsContact C-N 3.34Å; F123-C125 PolarHBondContact O-N 2.98Å; F123-K126 WeakPolarHBondContact O-CB 3.48Å; F123-K126 PolarHBondContact O-N 3Å; F123-L127 HydrophobicContact CE1-CD1 4.02Å; F123-L127 HydrophobicContact CE1-CD2 3.96Å; F123-L127 HydrophobicContact CE1-CG 4.08Å; F123-L127 HydrophobicContact CE2-CD2 4.43Å; F123-L127 HydrophobicContact CZ-CD2 3.65Å; F123-L127 HydrophobicContact CZ-CG 4.21Å
124	L	91.2	Very high	89.3	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-60.1	-30.1	177.8	-62.9	178.3	0	0	0	113	L109 T120 L121 K126 L127 L133 L136 I140	L109-L124 HydrophobicContact CD1-CD1 3.98Å; L109-L124 HydrophobicContact CD2-CD1 4.05Å; L109-L124 HydrophobicContact CG-CD1 4.46Å; T120-L124 WeakPolarHBondContact O-CG 3.3Å; T120-L124 PolarHBondContact O-N 3.38Å; L121-L124 PolarHBondContact O-N 2.7Å; L124-K126 PolarHBondContact O-N 3.25Å; L124-K126 VanDerWaalsContact O-N 3.08Å; L124-L127 HydrophobicContact CD2-CD1 3.55Å; L124-L127 PolarHBondContact O-N 3.01Å; L124-L133 HydrophobicContact CB-CD2 4.31Å; L124-L133 HydrophobicContact CD2-CD2 4.25Å; L124-L136 HydrophobicContact CD1-CD1 4.43Å; L124-L136 HydrophobicContact CD2-CD1 3.7Å; L124-I140 HydrophobicContact CD1-CD1 3.73Å; L124-I140 HydrophobicContact CD1-CG1 3.89Å
125	C	90.1	Very high	89.3	Confident	24 Å²	24	49.6 Å²	49.6	16%	0.162	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-18	173.4	-56.1	0	0	0	0	113.7	L121 R122 F123 A158 T161	L121-C125 PolarHBondContact O-N 3.26Å; L121-C125 PolarHBondContact O-SG 2.82Å; L121-C125 VanDerWaalsContact O-SG 3.39Å; R122-C125 WeakPolarHBondContact O-CB 3.36Å; R122-C125 PolarHBondContact O-N 3.49Å; F123-C125 PolarHBondContact O-N 2.98Å; C125-A158 VanDerWaalsContact SG-CA 3.53Å; C125-T161 HydrophobicContact CB-CG2 4.05Å; C125-T161 VanDerWaalsContact O-CG2 3.31Å; C125-T161 WeakPolarHBondContact O-CG2 3.37Å
126	K	88.6	Confident	89.5	Confident	115 Å²	115	43.8 Å²	43.8	50%	0.5	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-9.4	-177.7	-55.7	-172.2	176.8	-172.2	0	113.6	E83 F123 L124	E83-K126 HydrophobicContact CG-CD 4.1Å; E83-K126 WeakPolarHBondContact OE1-CD 3.48Å; E83-K126 IonicContact OE1-NZ 3.33Å; E83-K126 PolarHBondContact OE1-NZ 3.38Å; E83-K126 VanDerWaalsContact OE2-CD 3.27Å; E83-K126 WeakPolarHBondContact OE2-CD 3.36Å; E83-K126 IonicContact OE2-NZ 2.85Å; E83-K126 PolarHBondContact OE2-NZ 3.36Å; F123-K126 WeakPolarHBondContact O-CB 3.48Å; F123-K126 PolarHBondContact O-N 3Å; L124-K126 PolarHBondContact O-N 3.25Å; L124-K126 VanDerWaalsContact O-N 3.08Å
127	L	86.6	Confident	89.6	Confident	6 Å²	6	43.6 Å²	43.6	3%	0.031	21%	0.21	C	C	.	.			trans	-73.7	139.4	178.4	-68.7	-179.7	0	0	0	110.6	Y105 F123 L124 L133	Y105-L127 HydrophobicContact CE2-CD1 4.48Å; F123-L127 HydrophobicContact CE1-CD1 4.02Å; F123-L127 HydrophobicContact CE1-CD2 3.96Å; F123-L127 HydrophobicContact CE1-CG 4.08Å; F123-L127 HydrophobicContact CE2-CD2 4.43Å; F123-L127 HydrophobicContact CZ-CD2 3.65Å; F123-L127 HydrophobicContact CZ-CG 4.21Å; L124-L127 HydrophobicContact CD2-CD1 3.55Å; L124-L127 PolarHBondContact O-N 3.01Å; L127-L133 HydrophobicContact CB-CD1 4.43Å; L127-L133 HydrophobicContact CB-CD2 4.2Å; L127-L133 HydrophobicContact CB-CG 4.38Å; L127-L133 HydrophobicContact CD1-CD2 3.99Å
128	K	83.1	Confident	89.7	Confident	171 Å²	171	46.1 Å²	46.1	74%	0.743	23%	0.231	S	C	*	.			trans	-111.2	-6.9	-179.4	-63.5	-174.8	-179.1	-179	0	112.4	F166	K128-F166 WeakPolarHBondContact O-CZ 3.47Å
129	E	87.3	Confident	89.8	Confident	42 Å²	42	46.4 Å²	46.4	20%	0.196	23%	0.233	C	C	.	.			trans	-95.6	107.9	-175.4	-59.4	77	-171.4	0	0	110.4	K87 E131 L132 L133	K87-E129 HydrophobicContact CB-CG 4.33Å; E129-E131 VanDerWaalsContact C-N 3.31Å; E129-E131 PolarHBondContact O-N 2.89Å; E129-L132 HydrophobicContact CB-CB 4.38Å; E129-L132 HydrophobicContact CB-CD1 4.13Å; E129-L132 HydrophobicContact CB-CG 4.24Å; E129-L132 PolarHBondContact O-N 3.43Å; E129-L133 PolarHBondContact O-N 2.92Å
130	A	85.8	Confident	90	Very high	27 Å²	27	44.9 Å²	44.9	22%	0.223	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-38.8	-179.4	0	0	0	0	0	112.8	L132 L133 E134 F166 L169	A130-L132 PolarHBondContact O-N 3.49Å; A130-L133 PolarHBondContact O-N 3.15Å; A130-E134 PolarHBondContact O-N 2.99Å; A130-F166 HydrophobicContact CB-CD1 4.04Å; A130-F166 HydrophobicContact CB-CE1 4.2Å; A130-F166 HydrophobicContact CB-CG 4.39Å; A130-L169 HydrophobicContact CB-CD1 4.23Å
131	E	85.9	Confident	90	Very high	130 Å²	130	48.8 Å²	48.8	61%	0.607	24%	0.237	S	C	*	.	H	α-helix	trans	-59.6	-27	178.7	-65.1	-178.2	-167.1	0	0	113.3	L94 E129 P135	L94-E131 HydrophobicContact CD2-CB 4.33Å; E129-E131 VanDerWaalsContact C-N 3.31Å; E129-E131 PolarHBondContact O-N 2.89Å; E131-P135 VanDerWaalsContact O-CD 3.29Å; E131-P135 WeakPolarHBondContact O-CD 3.34Å
132	L	86.7	Confident	90	Very high	5 Å²	5	51.5 Å²	51.5	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-83.8	-28.9	176.4	-73.6	-179.5	0	0	0	113.2	K87 L94 M98 C102 E129 A130 L136	K87-L132 HydrophobicContact CG-CD1 4.41Å; L94-L132 HydrophobicContact CD1-CD1 3.91Å; L94-L132 HydrophobicContact CD1-CD2 4.15Å; L94-L132 HydrophobicContact CD1-CG 3.82Å; L94-L132 HydrophobicContact CD2-CD2 3.7Å; L94-L132 HydrophobicContact CD2-CG 4.03Å; L94-L132 HydrophobicContact CG-CD2 4.48Å; M98-L132 HydrophobicContact CB-CD2 3.88Å; C102-L132 HydrophobicContact CB-CD2 4.27Å; E129-L132 HydrophobicContact CB-CB 4.38Å; E129-L132 HydrophobicContact CB-CD1 4.13Å; E129-L132 HydrophobicContact CB-CG 4.24Å; E129-L132 PolarHBondContact O-N 3.43Å; A130-L132 PolarHBondContact O-N 3.49Å; L132-L136 WeakPolarHBondContact O-CD1 3.5Å; L132-L136 WeakPolarHBondContact O-CG 3.43Å
133	L	89.1	Confident	90.1	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-82.3	-37.3	-177.2	-70.7	171.1	0	0	0	111.7	L124 L127 E129 A130 L136 M137 I162 F166 L169	L124-L133 HydrophobicContact CB-CD2 4.31Å; L124-L133 HydrophobicContact CD2-CD2 4.25Å; L127-L133 HydrophobicContact CB-CD1 4.43Å; L127-L133 HydrophobicContact CB-CD2 4.2Å; L127-L133 HydrophobicContact CB-CG 4.38Å; L127-L133 HydrophobicContact CD1-CD2 3.99Å; E129-L133 PolarHBondContact O-N 2.92Å; A130-L133 PolarHBondContact O-N 3.15Å; L133-L136 WeakPolarHBondContact O-CA 3.35Å; L133-L136 WeakPolarHBondContact O-CB 3.44Å; L133-L136 PolarHBondContact O-N 3.2Å; L133-M137 WeakPolarHBondContact O-CG 3.36Å; L133-M137 PolarHBondContact O-N 3.13Å; L133-I162 HydrophobicContact CD1-CG1 4.25Å; L133-I162 HydrophobicContact CD2-CD1 4.17Å; L133-I162 HydrophobicContact CD2-CG1 4.46Å; L133-F166 HydrophobicContact CD1-CD2 3.85Å; L133-F166 HydrophobicContact CD1-CE2 3.79Å; L133-L169 HydrophobicContact CB-CD1 4.02Å
134	E	89.5	Confident	90.1	Very high	125 Å²	125	46.2 Å²	46.2	58%	0.584	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-51.4	-48.2	-177.2	-173.2	-179.4	-178.3	0	0	113.3	A130 L136 M137 L169	A130-E134 PolarHBondContact O-N 2.99Å; E134-L136 PolarHBondContact O-N 3.37Å; E134-M137 WeakPolarHBondContact O-CG 3.31Å; E134-M137 PolarHBondContact O-N 3.42Å; E134-L169 HydrophobicContact CB-CD2 3.86Å; E134-L169 HydrophobicContact CG-CD2 4.09Å
135	P	90.9	Very high	90.2	Very high	68 Å²	68	54.7 Å²	54.7	44%	0.442	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-69.7	-18.8	179.5	-17.8	33.1	0	0	0	113.9	E131	E131-P135 VanDerWaalsContact O-CD 3.29Å; E131-P135 WeakPolarHBondContact O-CD 3.34Å
136	L	92.7	Very high	90.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-88	-17.2	-177.7	-58.1	178.8	0	0	0	112.5	C102 Y105 R106 L109 L124 L132 L133 E134 P138 A139 I140	C102-L136 WeakPolarHBondContact O-CD2 3.4Å; Y105-L136 HydrophobicContact CD2-CD1 4.08Å; Y105-L136 HydrophobicContact CG-CD1 4.5Å; R106-L136 HydrophobicContact CB-CD2 3.79Å; L109-L136 HydrophobicContact CD1-CB 4.3Å; L109-L136 HydrophobicContact CD1-CD2 4.49Å; L124-L136 HydrophobicContact CD1-CD1 4.43Å; L124-L136 HydrophobicContact CD2-CD1 3.7Å; L132-L136 WeakPolarHBondContact O-CD1 3.5Å; L132-L136 WeakPolarHBondContact O-CG 3.43Å; L133-L136 WeakPolarHBondContact O-CA 3.35Å; L133-L136 WeakPolarHBondContact O-CB 3.44Å; L133-L136 PolarHBondContact O-N 3.2Å; E134-L136 PolarHBondContact O-N 3.37Å; L136-P138 VanDerWaalsContact C-CD 3.48Å; L136-A139 WeakPolarHBondContact O-CB 3.33Å; L136-A139 PolarHBondContact O-N 2.89Å; L136-I140 HydrophobicContact CB-CD1 4.16Å; L136-I140 HydrophobicContact CB-CG1 4.48Å; L136-I140 WeakPolarHBondContact O-CG1 3.29Å; L136-I140 PolarHBondContact O-N 3.4Å
137	M	91.5	Very high	90.5	Very high	11 Å²	11	58.2 Å²	58.2	5%	0.054	29%	0.288	C	S	.	.	H	α-helix	trans	-50.7	-44.7	-175.4	-65.6	-54.3	-58.8	0	0	114.2	L133 E134 A139 I140 R141 I162 I170	L133-M137 WeakPolarHBondContact O-CG 3.36Å; L133-M137 PolarHBondContact O-N 3.13Å; E134-M137 WeakPolarHBondContact O-CG 3.31Å; E134-M137 PolarHBondContact O-N 3.42Å; M137-A139 VanDerWaalsContact C-N 3.31Å; M137-A139 PolarHBondContact O-N 3.17Å; M137-I140 PolarHBondContact O-N 3.49Å; M137-I140 HydrophobicContact SD-CD1 4.11Å; M137-R141 WeakPolarHBondContact O-CG 3.44Å; M137-R141 PolarHBondContact O-N 2.77Å; M137-I162 HydrophobicContact CE-CG2 4.45Å; M137-I162 HydrophobicContact SD-CD1 4.23Å; M137-I162 HydrophobicContact SD-CG2 4.12Å; M137-I170 HydrophobicContact CE-CB 3.69Å; M137-I170 HydrophobicContact CE-CD1 3.63Å; M137-I170 HydrophobicContact CE-CG1 4.17Å; M137-I170 HydrophobicContact CE-CG2 4Å
138	P	92.7	Very high	90.8	Very high	90 Å²	90	61 Å²	61	58%	0.584	30%	0.3	S	S	*	.	H	α-helix	trans	-62.1	-36.9	177.4	-23.2	35.1	0	0	0	113.3	L136 A142	L136-P138 VanDerWaalsContact C-CD 3.48Å; P138-A142 WeakPolarHBondContact O-CB 3.4Å; P138-A142 PolarHBondContact O-N 3.37Å; P138-A142 VanDerWaalsContact O-N 3.08Å
139	A	93.9	Very high	91.2	Very high	5 Å²	5	54.8 Å²	54.8	4%	0.041	28%	0.278	C	S	.	.	H	α-helix	trans	-73.2	-35	178.8	0	0	0	0	0	111.9	R106 L109 L136 M137 C143	R106-A139 HydrophobicContact CG-CB 4.43Å; L109-A139 HydrophobicContact CB-CB 4.03Å; L109-A139 HydrophobicContact CD1-CB 3.8Å; L136-A139 WeakPolarHBondContact O-CB 3.33Å; L136-A139 PolarHBondContact O-N 2.89Å; M137-A139 VanDerWaalsContact C-N 3.31Å; M137-A139 PolarHBondContact O-N 3.17Å; A139-C143 PolarHBondContact O-N 2.86Å; A139-C143 PolarHBondContact O-SG 3.41Å
140	I	94	Very high	91.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-65.6	-46.1	174.3	-61.1	168.8	0	0	0	110	L109 L121 L124 L136 M137 A142 C143 A158 I159 I162	L109-I140 HydrophobicContact CD1-CG1 3.91Å; L121-I140 HydrophobicContact CD2-CG1 4.34Å; L121-I140 HydrophobicContact CD2-CG2 4.13Å; L124-I140 HydrophobicContact CD1-CD1 3.73Å; L124-I140 HydrophobicContact CD1-CG1 3.89Å; L136-I140 HydrophobicContact CB-CD1 4.16Å; L136-I140 HydrophobicContact CB-CG1 4.48Å; L136-I140 WeakPolarHBondContact O-CG1 3.29Å; L136-I140 PolarHBondContact O-N 3.4Å; M137-I140 PolarHBondContact O-N 3.49Å; M137-I140 HydrophobicContact SD-CD1 4.11Å; I140-A142 PolarHBondContact O-N 2.96Å; I140-C143 VanDerWaalsContact O-CB 3.28Å; I140-C143 WeakPolarHBondContact O-CB 3.45Å; I140-C143 PolarHBondContact O-N 3.38Å; I140-A158 HydrophobicContact CG2-CB 4.49Å; I140-I159 HydrophobicContact CG2-CD1 4.34Å; I140-I159 HydrophobicContact CG2-CG1 3.81Å; I140-I162 HydrophobicContact CD1-CD1 3.69Å
141	R	93.8	Very high	91.8	Very high	82 Å²	82	54 Å²	54	31%	0.309	27%	0.268	S	S	.	.	H	α-helix	trans	-59.2	-45.2	176.4	-70	-179.8	-173.1	-141.6	2.6	111.7	M137 C143 L144 I170 D172 L176	M137-R141 WeakPolarHBondContact O-CG 3.44Å; M137-R141 PolarHBondContact O-N 2.77Å; R141-C143 PolarHBondContact O-N 2.87Å; R141-C143 VanDerWaalsContact O-N 3.13Å; R141-L144 VanDerWaalsContact O-CB 3.31Å; R141-L144 WeakPolarHBondContact O-CB 3.47Å; R141-L144 PolarHBondContact O-N 3Å; R141-I170 HydrophobicContact CG-CD1 4.4Å; R141-D172 IonicContact CZ-OD1 3.35Å; R141-D172 IonicContact CZ-OD2 2.67Å; R141-D172 IonicContact NH1-OD1 3.21Å; R141-D172 IonicContact NH1-OD2 3.75Å; R141-D172 PolarHBondContact NH1-OD2 2.81Å; R141-D172 IonicContact NH2-OD1 3.37Å; R141-D172 PolarHBondContact NH2-OD1 2.93Å; R141-D172 IonicContact NH2-OD2 2.85Å; R141-D172 PolarHBondContact NH2-OD2 3.33Å; R141-L176 HydrophobicContact CG-CD2 4.23Å
142	A	93.3	Very high	92.3	Very high	57 Å²	57	49.5 Å²	49.5	47%	0.471	25%	0.245	S	C	.	.	H	α-helix	trans	-60.5	-23.8	176.3	0	0	0	0	0	113.6	P138 I140 L144 E145	P138-A142 WeakPolarHBondContact O-CB 3.4Å; P138-A142 PolarHBondContact O-N 3.37Å; P138-A142 VanDerWaalsContact O-N 3.08Å; I140-A142 PolarHBondContact O-N 2.96Å; A142-L144 PolarHBondContact O-N 2.93Å; A142-E145 PolarHBondContact O-N 3.48Å
143	C	93.9	Very high	92.6	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-71.5	-16.4	175.8	-68.4	0	0	0	0	113.6	L121 A139 I140 R141 E145 H146 V151 A155	L121-C143 HydrophobicContact CD1-CB 4.06Å; A139-C143 PolarHBondContact O-N 2.86Å; A139-C143 PolarHBondContact O-SG 3.41Å; I140-C143 VanDerWaalsContact O-CB 3.28Å; I140-C143 WeakPolarHBondContact O-CB 3.45Å; I140-C143 PolarHBondContact O-N 3.38Å; R141-C143 PolarHBondContact O-N 2.87Å; R141-C143 VanDerWaalsContact O-N 3.13Å; C143-E145 VanDerWaalsContact C-N 3.29Å; C143-H146 WeakPolarHBondContact O-CB 3.26Å; C143-H146 PolarHBondContact O-N 3.47Å; C143-V151 HydrophobicContact CB-CG1 3.86Å; C143-A155 HydrophobicContact CB-CB 3.81Å
144	L	92.5	Very high	92.8	Very high	10 Å²	10	53.3 Å²	53.3	5%	0.052	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-68.1	-28	173.1	-69.7	175.4	0	0	0	112.5	R141 A142 H146 R152 A155 V156 I159 L176 I177 F180	R141-L144 VanDerWaalsContact O-CB 3.31Å; R141-L144 WeakPolarHBondContact O-CB 3.47Å; R141-L144 PolarHBondContact O-N 3Å; A142-L144 PolarHBondContact O-N 2.93Å; L144-H146 VanDerWaalsContact C-N 3.32Å; L144-R152 WeakPolarHBondContact O-CD 3.47Å; L144-R152 VanDerWaalsContact O-CG 3.3Å; L144-R152 WeakPolarHBondContact O-CG 3.41Å; L144-A155 HydrophobicContact CD2-CB 3.96Å; L144-A155 HydrophobicContact CG-CB 4.41Å; L144-V156 HydrophobicContact CD2-CG2 3.65Å; L144-I159 HydrophobicContact CD1-CD1 3.58Å; L144-I159 HydrophobicContact CD2-CD1 4Å; L144-I159 HydrophobicContact CG-CD1 3.86Å; L144-L176 HydrophobicContact CD1-CD1 4.33Å; L144-L176 HydrophobicContact CD1-CD2 3.74Å; L144-L176 HydrophobicContact CD1-CG 3.9Å; L144-I177 HydrophobicContact CD1-CD1 4.3Å; L144-I177 HydrophobicContact CD2-CD1 4.24Å; L144-F180 HydrophobicContact CB-CD2 4.25Å; L144-F180 HydrophobicContact CB-CE2 4.44Å; L144-F180 HydrophobicContact CD2-CD2 4.26Å; L144-F180 HydrophobicContact CD2-CE2 4.33Å; L144-F180 WeakPolarHBondContact O-CE2 3.37Å
145	E	91.6	Very high	93.1	Very high	179 Å²	179	47.4 Å²	47.4	84%	0.836	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-93.5	6.5	-179.6	-62.5	-179.5	176.5	0	0	112.6	A142 C143	A142-E145 PolarHBondContact O-N 3.48Å; C143-E145 VanDerWaalsContact C-N 3.29Å
146	H	93.7	Very high	93.2	Very high	26 Å²	26	44.1 Å²	44.1	12%	0.12	21%	0.211	C	C	.	.			trans	-67.5	142.9	-174.3	-167.2	-99	0	0	0	112.3	C143 L144 H148 V151 R152	C143-H146 WeakPolarHBondContact O-CB 3.26Å; C143-H146 PolarHBondContact O-N 3.47Å; L144-H146 VanDerWaalsContact C-N 3.32Å; H146-H148 VanDerWaalsContact C-N 3.26Å; H146-H148 AromaticContact CE1-CD2 3.74Å; H146-H148 PolarHBondContact ND1-N 3.14Å; H146-H148 PolarHBondContact O-N 2.89Å; H146-H148 VanDerWaalsContact O-N 3.13Å; H146-V151 HydrophobicContact CB-CB 4.08Å; H146-V151 HydrophobicContact CB-CG1 3.91Å; H146-R152 HydrophobicContact CB-CG 4.35Å; H146-R152 WeakPolarHBondContact O-CD 3.48Å; H146-R152 WeakPolarHBondContact O-CG 3.26Å; H146-R152 PolarHBondContact O-NH1 2.88Å
147	R	91.1	Very high	93.2	Very high	188 Å²	188	47 Å²	47	71%	0.709	23%	0.226	S	C	*	.	S	Bend	trans	-56.1	-34.4	-176.9	70.5	-176.9	-173.4	-171	-1.8	114.7	R152	R147-R152 VanDerWaalsContact C-NH1 3.26Å; R147-R152 PolarHBondContact O-NH1 2.87Å
148	H	92.8	Very high	93.3	Very high	65 Å²	65	46.5 Å²	46.5	30%	0.301	22%	0.224	S	C	.	.	S	Bend	trans	-94.1	126.7	-176.9	-66.1	-62.3	0	0	0	112.2	E114 H146 Y150 V151 R152	E114-H148 HydrophobicContact CB-CB 4.37Å; E114-H148 IonicContact OE2-CD2 2.68Å; H146-H148 VanDerWaalsContact C-N 3.26Å; H146-H148 AromaticContact CE1-CD2 3.74Å; H146-H148 PolarHBondContact ND1-N 3.14Å; H146-H148 PolarHBondContact O-N 2.89Å; H146-H148 VanDerWaalsContact O-N 3.13Å; H148-Y150 VanDerWaalsContact C-N 3.26Å; H148-Y150 PolarHBondContact O-N 3.08Å; H148-V151 PolarHBondContact O-N 3.33Å; H148-V151 VanDerWaalsContact O-N 3.1Å; H148-R152 PolarHBondContact O-N 3.48Å
149	S	91.8	Very high	93.3	Very high	40 Å²	40	42.2 Å²	42.2	28%	0.28	20%	0.196	S	C	.	.	H	α-helix	trans	-60.7	-31.6	179.9	57.4	0	0	0	0	113.4	V151 R152 R153 D186 C189	S149-V151 VanDerWaalsContact C-N 3.26Å; S149-V151 PolarHBondContact O-N 3.47Å; S149-R152 PolarHBondContact O-N 2.72Å; S149-R153 VanDerWaalsContact O-CB 3.3Å; S149-R153 WeakPolarHBondContact O-CB 3.34Å; S149-R153 PolarHBondContact O-N 3.28Å; S149-D186 VanDerWaalsContact CB-CG 3.43Å; S149-D186 VanDerWaalsContact CB-OD1 3.29Å; S149-D186 WeakPolarHBondContact CB-OD1 3.49Å; S149-D186 PolarHBondContact OG-OD1 3.05Å; S149-D186 VanDerWaalsContact OG-OD1 3.12Å; S149-C189 PolarHBondContact O-SG 3.23Å
150	Y	92.8	Very high	93.3	Very high	51 Å²	51	43.5 Å²	43.5	20%	0.2	20%	0.2	C	C	.	.	H	α-helix	trans	-53.9	-41.2	173.8	174.5	-104.1	0	0	0	112.9	F115 R122 H148 N154	F115-Y150 HydrophobicContact CD1-CE1 4.34Å; R122-Y150 PolarHBondContact NH2-OH 2.97Å; H148-Y150 VanDerWaalsContact C-N 3.26Å; H148-Y150 PolarHBondContact O-N 3.08Å; Y150-N154 WeakPolarHBondContact CE2-ND2 3.48Å; Y150-N154 PolarHBondContact O-N 3.38Å; Y150-N154 PolarHBondContact O-ND2 3.38Å
151	V	94	Very high	93.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-72.6	-48.2	178.9	179	0	0	0	0	110.1	E114 R117 L121 C143 H146 H148 S149 R153 N154 A155	E114-V151 HydrophobicContact CB-CG2 3.68Å; R117-V151 HydrophobicContact CB-CG1 4.13Å; R117-V151 HydrophobicContact CB-CG2 4.11Å; L121-V151 HydrophobicContact CD1-CG1 3.88Å; C143-V151 HydrophobicContact CB-CG1 3.86Å; H146-V151 HydrophobicContact CB-CB 4.08Å; H146-V151 HydrophobicContact CB-CG1 3.91Å; H148-V151 PolarHBondContact O-N 3.33Å; H148-V151 VanDerWaalsContact O-N 3.1Å; S149-V151 VanDerWaalsContact C-N 3.26Å; S149-V151 PolarHBondContact O-N 3.47Å; V151-R153 VanDerWaalsContact C-N 3.34Å; V151-R153 PolarHBondContact O-N 3.16Å; V151-N154 PolarHBondContact O-N 3.17Å; V151-A155 WeakPolarHBondContact O-CB 3.4Å; V151-A155 PolarHBondContact O-N 3.14Å
152	R	95	Very high	93	Very high	36 Å²	36	40.6 Å²	40.6	14%	0.136	19%	0.191	C	C	.	.	H	α-helix	trans	-58.2	-44.9	180	-57.1	-166.5	-59.9	-96.1	11.6	112	L144 H146 R147 H148 S149 N154 A155 V156 F180 E184	L144-R152 WeakPolarHBondContact O-CD 3.47Å; L144-R152 VanDerWaalsContact O-CG 3.3Å; L144-R152 WeakPolarHBondContact O-CG 3.41Å; H146-R152 HydrophobicContact CB-CG 4.35Å; H146-R152 WeakPolarHBondContact O-CD 3.48Å; H146-R152 WeakPolarHBondContact O-CG 3.26Å; H146-R152 PolarHBondContact O-NH1 2.88Å; R147-R152 VanDerWaalsContact C-NH1 3.26Å; R147-R152 PolarHBondContact O-NH1 2.87Å; H148-R152 PolarHBondContact O-N 3.48Å; S149-R152 PolarHBondContact O-N 2.72Å; R152-N154 PolarHBondContact O-N 3.48Å; R152-A155 WeakPolarHBondContact O-CB 3.37Å; R152-A155 PolarHBondContact O-N 3.21Å; R152-A155 VanDerWaalsContact O-N 3.1Å; R152-V156 WeakPolarHBondContact O-CG2 3.37Å; R152-V156 PolarHBondContact O-N 3.06Å; R152-F180 HydrophobicContact CB-CE2 4.27Å; R152-F180 HydrophobicContact CB-CZ 4Å; R152-E184 IonicContact CZ-OE1 3.95Å; R152-E184 IonicContact CZ-OE2 3.83Å; R152-E184 IonicContact NE-OE1 2.94Å; R152-E184 IonicContact NE-OE2 2.7Å; R152-E184 PolarHBondContact NE-OE2 2.9Å; R152-E184 IonicContact NH2-OE1 2.65Å; R152-E184 PolarHBondContact NH2-OE1 3.38Å; R152-E184 IonicContact NH2-OE2 2.68Å; R152-E184 PolarHBondContact NH2-OE2 3.35Å
153	R	93.6	Very high	93	Very high	81 Å²	81	39.5 Å²	39.5	31%	0.306	18%	0.175	S	C	.	.	H	α-helix	trans	-56.6	-45.4	175.9	-176.2	-176.5	71.4	175	1.3	113	S149 V151 L157 S188 N192	S149-R153 VanDerWaalsContact O-CB 3.3Å; S149-R153 WeakPolarHBondContact O-CB 3.34Å; S149-R153 PolarHBondContact O-N 3.28Å; V151-R153 VanDerWaalsContact C-N 3.34Å; V151-R153 PolarHBondContact O-N 3.16Å; R153-L157 PolarHBondContact O-N 3.34Å; R153-S188 WeakPolarHBondContact CD-OG 3.23Å; R153-S188 PolarHBondContact NH1-OG 3.08Å; R153-N192 VanDerWaalsContact CG-ND2 3.27Å; R153-N192 WeakPolarHBondContact CG-ND2 3.25Å; R153-N192 PolarHBondContact O-ND2 3.49Å
154	N	94.1	Very high	92.8	Very high	6 Å²	6	47 Å²	47	3%	0.032	20%	0.204	C	C	.	.	H	α-helix	trans	-73.3	-30.2	178.4	-70.8	-54.3	0	0	0	111.4	L121 R122 Y150 V151 R152 L157 A158	L121-N154 HydrophobicContact CB-CB 3.91Å; L121-N154 HydrophobicContact CD1-CB 4.14Å; R122-N154 HydrophobicContact CG-CB 4.5Å; R122-N154 WeakPolarHBondContact CG-OD1 3.39Å; Y150-N154 WeakPolarHBondContact CE2-ND2 3.48Å; Y150-N154 PolarHBondContact O-N 3.38Å; Y150-N154 PolarHBondContact O-ND2 3.38Å; V151-N154 PolarHBondContact O-N 3.17Å; R152-N154 PolarHBondContact O-N 3.48Å; N154-L157 PolarHBondContact O-N 2.86Å; N154-A158 WeakPolarHBondContact O-CB 3.23Å; N154-A158 PolarHBondContact O-N 2.74Å
155	A	94.8	Very high	92.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.5	-44.2	175.6	0	0	0	0	0	111.2	L121 C143 L144 V151 R152 L157 A158 I159	L121-A155 HydrophobicContact CD1-CB 3.96Å; L121-A155 HydrophobicContact CD2-CB 4.36Å; C143-A155 HydrophobicContact CB-CB 3.81Å; L144-A155 HydrophobicContact CD2-CB 3.96Å; L144-A155 HydrophobicContact CG-CB 4.41Å; V151-A155 WeakPolarHBondContact O-CB 3.4Å; V151-A155 PolarHBondContact O-N 3.14Å; R152-A155 WeakPolarHBondContact O-CB 3.37Å; R152-A155 PolarHBondContact O-N 3.21Å; R152-A155 VanDerWaalsContact O-N 3.1Å; A155-L157 VanDerWaalsContact C-N 3.32Å; A155-L157 PolarHBondContact O-N 3.41Å; A155-A158 PolarHBondContact O-N 3.18Å; A155-I159 WeakPolarHBondContact O-CG1 3.46Å; A155-I159 PolarHBondContact O-N 2.86Å
156	V	94.4	Very high	92.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.8	-44.2	172.6	175.6	0	0	0	0	111.2	L144 R152 A158 I159 Y160 I177 F180 N192 A193	L144-V156 HydrophobicContact CD2-CG2 3.65Å; R152-V156 WeakPolarHBondContact O-CG2 3.37Å; R152-V156 PolarHBondContact O-N 3.06Å; V156-A158 PolarHBondContact O-N 2.91Å; V156-I159 PolarHBondContact O-N 3.41Å; V156-Y160 WeakPolarHBondContact O-CB 3.46Å; V156-Y160 PolarHBondContact O-N 2.96Å; V156-I177 HydrophobicContact CG1-CD1 4.26Å; V156-I177 HydrophobicContact CG2-CD1 4.1Å; V156-F180 HydrophobicContact CG2-CD1 3.91Å; V156-F180 HydrophobicContact CG2-CE1 3.53Å; V156-F180 HydrophobicContact CG2-CZ 4.09Å; V156-N192 HydrophobicContact CB-CB 4.35Å; V156-N192 HydrophobicContact CG1-CB 3.87Å; V156-A193 HydrophobicContact CG1-CB 4.07Å
157	L	92.1	Very high	92.1	Very high	61 Å²	61	48 Å²	48	32%	0.319	21%	0.209	S	C	.	.	H	α-helix	trans	-63.8	-40.2	177.6	-178.1	64.5	0	0	0	112.4	R153 N154 A155 Y160 T161	R153-L157 PolarHBondContact O-N 3.34Å; N154-L157 PolarHBondContact O-N 2.86Å; A155-L157 VanDerWaalsContact C-N 3.32Å; A155-L157 PolarHBondContact O-N 3.41Å; L157-Y160 PolarHBondContact O-N 3.47Å; L157-T161 WeakPolarHBondContact O-CB 3.48Å; L157-T161 PolarHBondContact O-N 3.24Å; L157-T161 PolarHBondContact O-OG1 3.28Å
158	A	93.1	Very high	92	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.2	-48.4	175.9	0	0	0	0	0	111	L121 C125 I140 N154 A155 V156 Y160 T161 I162	L121-A158 HydrophobicContact CD2-CB 4.15Å; C125-A158 VanDerWaalsContact SG-CA 3.53Å; I140-A158 HydrophobicContact CG2-CB 4.49Å; N154-A158 WeakPolarHBondContact O-CB 3.23Å; N154-A158 PolarHBondContact O-N 2.74Å; A155-A158 PolarHBondContact O-N 3.18Å; V156-A158 PolarHBondContact O-N 2.91Å; A158-Y160 VanDerWaalsContact C-N 3.33Å; A158-Y160 PolarHBondContact O-N 3.4Å; A158-T161 PolarHBondContact O-N 2.96Å; A158-I162 WeakPolarHBondContact O-CB 3.32Å; A158-I162 WeakPolarHBondContact O-CG1 3.35Å; A158-I162 PolarHBondContact O-N 3.01Å
159	I	94.1	Very high	91.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.5	-45.7	176.1	-70.6	169.4	0	0	0	110.9	I140 L144 A155 V156 T161 I162 Y163 I170 A173 L176 I177 M196	I140-I159 HydrophobicContact CG2-CD1 4.34Å; I140-I159 HydrophobicContact CG2-CG1 3.81Å; L144-I159 HydrophobicContact CD1-CD1 3.58Å; L144-I159 HydrophobicContact CD2-CD1 4Å; L144-I159 HydrophobicContact CG-CD1 3.86Å; A155-I159 WeakPolarHBondContact O-CG1 3.46Å; A155-I159 PolarHBondContact O-N 2.86Å; V156-I159 PolarHBondContact O-N 3.41Å; I159-T161 PolarHBondContact O-N 3.36Å; I159-I162 PolarHBondContact O-N 3.04Å; I159-Y163 VanDerWaalsContact O-CB 3.25Å; I159-Y163 WeakPolarHBondContact O-CB 3.39Å; I159-Y163 PolarHBondContact O-N 3.13Å; I159-I170 HydrophobicContact CG2-CD1 4.13Å; I159-A173 HydrophobicContact CG2-CB 3.93Å; I159-L176 HydrophobicContact CD1-CD2 4.46Å; I159-I177 HydrophobicContact CD1-CD1 4.29Å; I159-I177 HydrophobicContact CG2-CD1 4.29Å; I159-I177 HydrophobicContact CG2-CG1 4.21Å; I159-M196 HydrophobicContact CG2-CE 3.99Å; I159-M196 HydrophobicContact CG2-SD 4.12Å
160	Y	92.7	Very high	91.7	Very high	32 Å²	32	41.4 Å²	41.4	13%	0.125	18%	0.183	C	C	.	.	H	α-helix	trans	-57.9	-47.4	176.8	174.7	-137.3	0	0	0	112.2	V156 L157 A158 Y163 R164 M196 H199	V156-Y160 WeakPolarHBondContact O-CB 3.46Å; V156-Y160 PolarHBondContact O-N 2.96Å; L157-Y160 PolarHBondContact O-N 3.47Å; A158-Y160 VanDerWaalsContact C-N 3.33Å; A158-Y160 PolarHBondContact O-N 3.4Å; Y160-Y163 PolarHBondContact O-N 2.98Å; Y160-R164 WeakPolarHBondContact O-CB 3.25Å; Y160-R164 PolarHBondContact O-N 3.41Å; Y160-M196 VanDerWaalsContact CA-SD 3.58Å; Y160-M196 HydrophobicContact CD2-CB 3.88Å; Y160-M196 HydrophobicContact CD2-CG 3.62Å; Y160-M196 HydrophobicContact CD2-SD 4.33Å; Y160-M196 HydrophobicContact CG-CB 3.93Å; Y160-M196 HydrophobicContact CG-CG 4.01Å; Y160-M196 HydrophobicContact CG-SD 4.4Å; Y160-H199 HydrophobicContact CE2-CB 3.97Å; Y160-H199 PolarHBondContact OH-CD2 3.5Å; Y160-H199 VanDerWaalsContact OH-CD2 3.25Å
161	T	91.1	Very high	91.5	Very high	19 Å²	19	43.4 Å²	43.4	12%	0.117	20%	0.202	C	C	.	.	H	α-helix	trans	-67.7	-41.8	-178.2	-50.5	0	0	0	0	111.6	C125 L157 A158 I159 R164 N165	C125-T161 HydrophobicContact CB-CG2 4.05Å; C125-T161 VanDerWaalsContact O-CG2 3.31Å; C125-T161 WeakPolarHBondContact O-CG2 3.37Å; L157-T161 WeakPolarHBondContact O-CB 3.48Å; L157-T161 PolarHBondContact O-N 3.24Å; L157-T161 PolarHBondContact O-OG1 3.28Å; A158-T161 PolarHBondContact O-N 2.96Å; I159-T161 PolarHBondContact O-N 3.36Å; T161-R164 PolarHBondContact O-N 3.35Å; T161-N165 PolarHBondContact O-N 2.9Å; T161-N165 VanDerWaalsContact O-N 3.14Å
162	I	91.3	Very high	91.3	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.01	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-46.8	177.3	-67	166.9	0	0	0	110.2	L133 M137 I140 A158 I159 R164 N165 F166 L169 I170	L133-I162 HydrophobicContact CD1-CG1 4.25Å; L133-I162 HydrophobicContact CD2-CD1 4.17Å; L133-I162 HydrophobicContact CD2-CG1 4.46Å; M137-I162 HydrophobicContact CE-CG2 4.45Å; M137-I162 HydrophobicContact SD-CD1 4.23Å; M137-I162 HydrophobicContact SD-CG2 4.12Å; I140-I162 HydrophobicContact CD1-CD1 3.69Å; A158-I162 WeakPolarHBondContact O-CB 3.32Å; A158-I162 WeakPolarHBondContact O-CG1 3.35Å; A158-I162 PolarHBondContact O-N 3.01Å; I159-I162 PolarHBondContact O-N 3.04Å; I162-R164 VanDerWaalsContact C-N 3.35Å; I162-R164 PolarHBondContact O-N 3.09Å; I162-N165 PolarHBondContact O-N 3.14Å; I162-F166 CarbonylContact O-C 3.51Å; I162-F166 WeakPolarHBondContact O-CA 3.44Å; I162-F166 PolarHBondContact O-N 3.07Å; I162-L169 HydrophobicContact CG2-CB 4.4Å; I162-L169 HydrophobicContact CG2-CD1 4.24Å; I162-I170 HydrophobicContact CG2-CG2 4.38Å
163	Y	91.9	Very high	91.1	Very high	33 Å²	33	44.6 Å²	44.6	13%	0.129	21%	0.211	C	C	.	.	H	α-helix	trans	-59.2	-44.9	178	179.9	-99.9	0	0	0	111.9	I159 Y160 N165 F166 E167 I170 A173 P174 A200	I159-Y163 VanDerWaalsContact O-CB 3.25Å; I159-Y163 WeakPolarHBondContact O-CB 3.39Å; I159-Y163 PolarHBondContact O-N 3.13Å; Y160-Y163 PolarHBondContact O-N 2.98Å; Y163-N165 VanDerWaalsContact C-N 3.33Å; Y163-N165 PolarHBondContact O-N 3.32Å; Y163-F166 CarbonylContact O-C 3.43Å; Y163-E167 HydrophobicContact CD2-CG 4.31Å; Y163-E167 HydrophobicContact CE2-CG 3.74Å; Y163-E167 WeakPolarHBondContact O-CA 3.49Å; Y163-E167 PolarHBondContact O-N 3.05Å; Y163-E167 VanDerWaalsContact O-N 3.14Å; Y163-I170 HydrophobicContact CD2-CG2 4.24Å; Y163-I170 WeakPolarHBondContact CD2-O 3.14Å; Y163-A173 HydrophobicContact CD2-CB 3.58Å; Y163-A173 HydrophobicContact CE2-CB 4.16Å; Y163-A173 HydrophobicContact CG-CB 4.02Å; Y163-P174 HydrophobicContact CE1-CG 4.39Å; Y163-P174 HydrophobicContact CE2-CG 4.13Å; Y163-A200 HydrophobicContact CD1-CB 4.05Å; Y163-A200 HydrophobicContact CE1-CB 3.62Å
164	R	89.8	Confident	91	Very high	159 Å²	159	41.1 Å²	41.1	60%	0.6	20%	0.199	S	C	*	.	H	α-helix	trans	-63.8	-36.5	179.8	-168.7	-178.6	71.4	-179.1	2.7	113	Y160 T161 I162	Y160-R164 WeakPolarHBondContact O-CB 3.25Å; Y160-R164 PolarHBondContact O-N 3.41Å; T161-R164 PolarHBondContact O-N 3.35Å; I162-R164 VanDerWaalsContact C-N 3.35Å; I162-R164 PolarHBondContact O-N 3.09Å
165	N	88.2	Confident	90.9	Very high	75 Å²	75	45.7 Å²	45.7	40%	0.401	22%	0.22	S	C	.	.	H	α-helix	trans	-88.2	-33.3	-178.9	-64.8	-9.3	0	0	0	112.3	T161 I162 Y163	T161-N165 PolarHBondContact O-N 2.9Å; T161-N165 VanDerWaalsContact O-N 3.14Å; I162-N165 PolarHBondContact O-N 3.14Å; Y163-N165 VanDerWaalsContact C-N 3.33Å; Y163-N165 PolarHBondContact O-N 3.32Å
166	F	88.5	Confident	90.8	Very high	36 Å²	36	48.1 Å²	48.1	16%	0.158	23%	0.233	C	C	.	.			trans	-142.9	70.1	-170.4	-51	-64.8	0	0	0	111.3	K128 A130 L133 I162 Y163 H168 L169	K128-F166 WeakPolarHBondContact O-CZ 3.47Å; A130-F166 HydrophobicContact CB-CD1 4.04Å; A130-F166 HydrophobicContact CB-CE1 4.2Å; A130-F166 HydrophobicContact CB-CG 4.39Å; L133-F166 HydrophobicContact CD1-CD2 3.85Å; L133-F166 HydrophobicContact CD1-CE2 3.79Å; I162-F166 CarbonylContact O-C 3.51Å; I162-F166 WeakPolarHBondContact O-CA 3.44Å; I162-F166 PolarHBondContact O-N 3.07Å; Y163-F166 CarbonylContact O-C 3.43Å; F166-H168 PolarHBondContact O-N 3.07Å; F166-H168 VanDerWaalsContact O-N 3.17Å; F166-L169 HydrophobicContact CB-CB 4.4Å; F166-L169 HydrophobicContact CB-CD1 3.61Å; F166-L169 HydrophobicContact CB-CG 3.87Å; F166-L169 HydrophobicContact CD2-CD1 4.22Å; F166-L169 HydrophobicContact CG-CD1 4.05Å; F166-L169 PolarHBondContact O-N 2.87Å; F166-L169 VanDerWaalsContact O-N 3.09Å
167	E	87.1	Confident	90.8	Very high	123 Å²	123	48.1 Å²	48.1	58%	0.575	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-53.3	-39.5	-176.9	-171	178.7	171.5	0	0	113.3	Y163 L169 I170	Y163-E167 HydrophobicContact CD2-CG 4.31Å; Y163-E167 HydrophobicContact CE2-CG 3.74Å; Y163-E167 WeakPolarHBondContact O-CA 3.49Å; Y163-E167 PolarHBondContact O-N 3.05Å; Y163-E167 VanDerWaalsContact O-N 3.14Å; E167-L169 PolarHBondContact O-N 3.11Å; E167-I170 CarbonylContact O-C 3.6Å; E167-I170 PolarHBondContact O-N 3.24Å
168	H	88.9	Confident	90.8	Very high	136 Å²	136	47.1 Å²	47.1	63%	0.63	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-63.9	-20.9	-178.9	66.3	-84.4	0	0	0	114.8	F166 I170	F166-H168 PolarHBondContact O-N 3.07Å; F166-H168 VanDerWaalsContact O-N 3.17Å; H168-I170 VanDerWaalsContact C-N 3.34Å
169	L	89.4	Confident	90.7	Very high	20 Å²	20	51.1 Å²	51.1	11%	0.105	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-75.4	-24.5	179	-68.1	-178.9	0	0	0	112.6	A130 L133 E134 I162 F166 E167	A130-L169 HydrophobicContact CB-CD1 4.23Å; L133-L169 HydrophobicContact CB-CD1 4.02Å; E134-L169 HydrophobicContact CB-CD2 3.86Å; E134-L169 HydrophobicContact CG-CD2 4.09Å; I162-L169 HydrophobicContact CG2-CB 4.4Å; I162-L169 HydrophobicContact CG2-CD1 4.24Å; F166-L169 HydrophobicContact CB-CB 4.4Å; F166-L169 HydrophobicContact CB-CD1 3.61Å; F166-L169 HydrophobicContact CB-CG 3.87Å; F166-L169 HydrophobicContact CD2-CD1 4.22Å; F166-L169 HydrophobicContact CG-CD1 4.05Å; F166-L169 PolarHBondContact O-N 2.87Å; F166-L169 VanDerWaalsContact O-N 3.09Å; E167-L169 PolarHBondContact O-N 3.11Å
170	I	88.6	Confident	90.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.253	C	S	.	.			trans	-150.1	68	-179.6	-170	160.1	0	0	0	111.1	M137 R141 I159 I162 Y163 E167 H168 D172 A173 L176	M137-I170 HydrophobicContact CE-CB 3.69Å; M137-I170 HydrophobicContact CE-CD1 3.63Å; M137-I170 HydrophobicContact CE-CG1 4.17Å; M137-I170 HydrophobicContact CE-CG2 4Å; R141-I170 HydrophobicContact CG-CD1 4.4Å; I159-I170 HydrophobicContact CG2-CD1 4.13Å; I162-I170 HydrophobicContact CG2-CG2 4.38Å; Y163-I170 HydrophobicContact CD2-CG2 4.24Å; Y163-I170 WeakPolarHBondContact CD2-O 3.14Å; E167-I170 CarbonylContact O-C 3.6Å; E167-I170 PolarHBondContact O-N 3.24Å; H168-I170 VanDerWaalsContact C-N 3.34Å; I170-D172 PolarHBondContact O-N 3.36Å; I170-A173 HydrophobicContact CB-CB 4.35Å; I170-A173 HydrophobicContact CD1-CB 4.21Å; I170-A173 HydrophobicContact CG1-CB 3.75Å; I170-A173 HydrophobicContact CG2-CB 3.98Å; I170-A173 WeakPolarHBondContact O-CB 3.45Å; I170-A173 PolarHBondContact O-N 3.14Å; I170-A173 VanDerWaalsContact O-N 3.07Å; I170-L176 HydrophobicContact CD1-CD2 4.32Å
171	P	88.3	Confident	90.5	Very high	92 Å²	92	50.7 Å²	50.7	60%	0.597	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-25.6	-177.3	26.7	-35	0	0	0	112.8	A173	P171-A173 VanDerWaalsContact C-N 3.29Å; P171-A173 PolarHBondContact O-N 3.4Å
172	D	91.2	Very high	90.4	Very high	61 Å²	61	53.6 Å²	53.6	33%	0.326	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	8	177.4	60.6	-36.7	0	0	0	113.8	R141 I170 E175 L176	R141-D172 IonicContact CZ-OD1 3.35Å; R141-D172 IonicContact CZ-OD2 2.67Å; R141-D172 IonicContact NH1-OD1 3.21Å; R141-D172 IonicContact NH1-OD2 3.75Å; R141-D172 PolarHBondContact NH1-OD2 2.81Å; R141-D172 IonicContact NH2-OD1 3.37Å; R141-D172 PolarHBondContact NH2-OD1 2.93Å; R141-D172 IonicContact NH2-OD2 2.85Å; R141-D172 PolarHBondContact NH2-OD2 3.33Å; I170-D172 PolarHBondContact O-N 3.36Å; D172-E175 PolarHBondContact O-N 3.45Å; D172-L176 WeakPolarHBondContact O-CB 3.24Å; D172-L176 PolarHBondContact O-N 2.86Å
173	A	90.6	Very high	90.3	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-57.6	-44.7	-176.6	0	0	0	0	0	114.2	I159 Y163 I170 P171 E175 L176 I177 M196	I159-A173 HydrophobicContact CG2-CB 3.93Å; Y163-A173 HydrophobicContact CD2-CB 3.58Å; Y163-A173 HydrophobicContact CE2-CB 4.16Å; Y163-A173 HydrophobicContact CG-CB 4.02Å; I170-A173 HydrophobicContact CB-CB 4.35Å; I170-A173 HydrophobicContact CD1-CB 4.21Å; I170-A173 HydrophobicContact CG1-CB 3.75Å; I170-A173 HydrophobicContact CG2-CB 3.98Å; I170-A173 WeakPolarHBondContact O-CB 3.45Å; I170-A173 PolarHBondContact O-N 3.14Å; I170-A173 VanDerWaalsContact O-N 3.07Å; P171-A173 VanDerWaalsContact C-N 3.29Å; P171-A173 PolarHBondContact O-N 3.4Å; A173-E175 VanDerWaalsContact C-N 3.33Å; A173-E175 PolarHBondContact O-N 3.03Å; A173-L176 PolarHBondContact O-N 3.25Å; A173-I177 WeakPolarHBondContact O-CB 3.45Å; A173-I177 VanDerWaalsContact O-CG1 3.26Å; A173-I177 WeakPolarHBondContact O-CG1 3.4Å; A173-I177 PolarHBondContact O-N 2.84Å; A173-M196 HydrophobicContact CB-CE 3.57Å
174	P	91.6	Very high	90.2	Very high	9 Å²	9	59 Å²	59	6%	0.058	30%	0.295	C	S	.	.	H	α-helix	trans	-62.5	-39	-179.4	-24.2	35.7	0	0	0	112.8	Y163 H178 L197 A200 D201	Y163-P174 HydrophobicContact CE1-CG 4.39Å; Y163-P174 HydrophobicContact CE2-CG 4.13Å; P174-H178 WeakPolarHBondContact O-CB 3.45Å; P174-H178 PolarHBondContact O-N 3.37Å; P174-L197 HydrophobicContact CB-CD2 4.45Å; P174-L197 WeakPolarHBondContact O-CD2 3.45Å; P174-A200 HydrophobicContact CG-CB 4.37Å; P174-D201 HydrophobicContact CB-CB 3.94Å
175	E	91.5	Very high	90.1	Very high	102 Å²	102	60.6 Å²	60.6	48%	0.477	31%	0.306	S	S	.	.	H	α-helix	trans	-67.8	-48	177.2	-174.7	170.2	-176.4	0	0	111.5	D172 A173 I177 H178 D179	D172-E175 PolarHBondContact O-N 3.45Å; A173-E175 VanDerWaalsContact C-N 3.33Å; A173-E175 PolarHBondContact O-N 3.03Å; E175-I177 VanDerWaalsContact C-N 3.29Å; E175-I177 PolarHBondContact O-N 3.01Å; E175-H178 WeakPolarHBondContact O-CB 3.49Å; E175-H178 PolarHBondContact O-N 3.34Å; E175-D179 PolarHBondContact O-N 3.28Å
176	L	92.4	Very high	90.2	Very high	50 Å²	50	59.3 Å²	59.3	26%	0.262	30%	0.299	S	S	.	.	H	α-helix	trans	-56.7	-42.2	177.2	179.8	65.9	0	0	0	112.5	R141 L144 I159 I170 D172 A173 F180	R141-L176 HydrophobicContact CG-CD2 4.23Å; L144-L176 HydrophobicContact CD1-CD1 4.33Å; L144-L176 HydrophobicContact CD1-CD2 3.74Å; L144-L176 HydrophobicContact CD1-CG 3.9Å; I159-L176 HydrophobicContact CD1-CD2 4.46Å; I170-L176 HydrophobicContact CD1-CD2 4.32Å; D172-L176 WeakPolarHBondContact O-CB 3.24Å; D172-L176 PolarHBondContact O-N 2.86Å; A173-L176 PolarHBondContact O-N 3.25Å; L176-F180 WeakPolarHBondContact O-CB 3.4Å; L176-F180 PolarHBondContact O-N 3.18Å
177	I	93.8	Very high	90.1	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-77.5	-30.7	-177.6	-65.8	-65.9	0	0	0	112	L144 V156 I159 A173 E175 F180 L181 A193 M196 L197	L144-I177 HydrophobicContact CD1-CD1 4.3Å; L144-I177 HydrophobicContact CD2-CD1 4.24Å; V156-I177 HydrophobicContact CG1-CD1 4.26Å; V156-I177 HydrophobicContact CG2-CD1 4.1Å; I159-I177 HydrophobicContact CD1-CD1 4.29Å; I159-I177 HydrophobicContact CG2-CD1 4.29Å; I159-I177 HydrophobicContact CG2-CG1 4.21Å; A173-I177 WeakPolarHBondContact O-CB 3.45Å; A173-I177 VanDerWaalsContact O-CG1 3.26Å; A173-I177 WeakPolarHBondContact O-CG1 3.4Å; A173-I177 PolarHBondContact O-N 2.84Å; E175-I177 VanDerWaalsContact C-N 3.29Å; E175-I177 PolarHBondContact O-N 3.01Å; I177-F180 PolarHBondContact O-N 3.03Å; I177-L181 VanDerWaalsContact O-CB 3.26Å; I177-L181 WeakPolarHBondContact O-CB 3.3Å; I177-L181 PolarHBondContact O-N 2.98Å; I177-A193 HydrophobicContact CG2-CB 3.69Å; I177-M196 HydrophobicContact CB-CE 4.28Å; I177-M196 HydrophobicContact CB-SD 4.26Å; I177-M196 HydrophobicContact CD1-SD 4.39Å; I177-M196 HydrophobicContact CG1-CE 3.75Å; I177-M196 HydrophobicContact CG1-SD 3.67Å; I177-M196 HydrophobicContact CG2-SD 4.18Å; I177-L197 HydrophobicContact CG2-CD2 4.37Å; I177-L197 HydrophobicContact CG2-CG 4.24Å
178	H	91.9	Very high	90.1	Very high	40 Å²	40	55.5 Å²	55.5	19%	0.185	29%	0.294	C	S	.	.	H	α-helix	trans	-61.2	-49.1	169.8	175.6	-88.7	0	0	0	111.2	P174 E175 F180 L181 V182 L197	P174-H178 WeakPolarHBondContact O-CB 3.45Å; P174-H178 PolarHBondContact O-N 3.37Å; E175-H178 WeakPolarHBondContact O-CB 3.49Å; E175-H178 PolarHBondContact O-N 3.34Å; H178-F180 VanDerWaalsContact C-N 3.3Å; H178-F180 PolarHBondContact O-N 3.33Å; H178-L181 WeakPolarHBondContact O-CB 3.48Å; H178-L181 PolarHBondContact O-N 2.95Å; H178-L181 VanDerWaalsContact O-N 3.12Å; H178-V182 WeakPolarHBondContact O-CG2 3.35Å; H178-V182 PolarHBondContact O-N 3.46Å; H178-V182 VanDerWaalsContact O-N 3.13Å; H178-L197 HydrophobicContact CB-CD1 4.31Å; H178-L197 HydrophobicContact CB-CD2 4.45Å
179	D	91.4	Very high	90.2	Very high	84 Å²	84	49 Å²	49	45%	0.449	26%	0.264	S	S	.	.	H	α-helix	trans	-64.7	-36.2	178.5	-69.4	-9.4	0	0	0	112.3	E175 N183	E175-D179 PolarHBondContact O-N 3.28Å; D179-N183 PolarHBondContact O-N 3.02Å; D179-N183 PolarHBondContact O-ND2 2.91Å
180	F	92.3	Very high	90.3	Very high	24 Å²	24	49.7 Å²	49.7	11%	0.105	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-45.9	171.6	175.3	-96.9	0	0	0	111.9	L144 R152 V156 L176 I177 H178 V182 N183 E184 C189 A193	L144-F180 HydrophobicContact CB-CD2 4.25Å; L144-F180 HydrophobicContact CB-CE2 4.44Å; L144-F180 HydrophobicContact CD2-CD2 4.26Å; L144-F180 HydrophobicContact CD2-CE2 4.33Å; L144-F180 WeakPolarHBondContact O-CE2 3.37Å; R152-F180 HydrophobicContact CB-CE2 4.27Å; R152-F180 HydrophobicContact CB-CZ 4Å; V156-F180 HydrophobicContact CG2-CD1 3.91Å; V156-F180 HydrophobicContact CG2-CE1 3.53Å; V156-F180 HydrophobicContact CG2-CZ 4.09Å; L176-F180 WeakPolarHBondContact O-CB 3.4Å; L176-F180 PolarHBondContact O-N 3.18Å; I177-F180 PolarHBondContact O-N 3.03Å; H178-F180 VanDerWaalsContact C-N 3.3Å; H178-F180 PolarHBondContact O-N 3.33Å; F180-V182 VanDerWaalsContact C-N 3.33Å; F180-V182 PolarHBondContact O-N 3.22Å; F180-N183 PolarHBondContact O-N 2.97Å; F180-E184 HydrophobicContact CE1-CB 4.17Å; F180-E184 HydrophobicContact CE1-CG 4.13Å; F180-E184 WeakPolarHBondContact CE2-OE2 2.96Å; F180-E184 HydrophobicContact CZ-CB 4.18Å; F180-E184 HydrophobicContact CZ-CG 3.96Å; F180-E184 WeakPolarHBondContact CZ-OE2 3.21Å; F180-E184 VanDerWaalsContact O-CB 3.29Å; F180-E184 WeakPolarHBondContact O-CB 3.37Å; F180-E184 PolarHBondContact O-N 3.4Å; F180-C189 HydrophobicContact CE1-CB 4.18Å; F180-C189 HydrophobicContact CZ-CB 4.14Å; F180-A193 HydrophobicContact CD1-CB 4Å; F180-A193 HydrophobicContact CE1-CB 4.28Å
181	L	90.9	Very high	90.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.6	-39.7	-177.5	177.3	63.1	0	0	0	112.4	I177 H178 K190 A193 F194 L197 Y208	I177-L181 VanDerWaalsContact O-CB 3.26Å; I177-L181 WeakPolarHBondContact O-CB 3.3Å; I177-L181 PolarHBondContact O-N 2.98Å; H178-L181 WeakPolarHBondContact O-CB 3.48Å; H178-L181 PolarHBondContact O-N 2.95Å; H178-L181 VanDerWaalsContact O-N 3.12Å; L181-K190 HydrophobicContact CD1-CB 3.89Å; L181-K190 HydrophobicContact CD1-CG 3.97Å; L181-A193 HydrophobicContact CB-CB 4.16Å; L181-A193 HydrophobicContact CD1-CB 4.05Å; L181-F194 HydrophobicContact CD1-CB 4.42Å; L181-F194 HydrophobicContact CD2-CB 4.29Å; L181-F194 HydrophobicContact CD2-CD2 3.91Å; L181-L197 HydrophobicContact CD2-CD1 3.71Å; L181-Y208 HydrophobicContact CD1-CE1 4.21Å; L181-Y208 HydrophobicContact CD1-CE2 4.47Å; L181-Y208 HydrophobicContact CD2-CD1 3.54Å; L181-Y208 HydrophobicContact CD2-CD2 3.82Å; L181-Y208 HydrophobicContact CD2-CE1 3.77Å; L181-Y208 HydrophobicContact CD2-CE2 4.04Å; L181-Y208 HydrophobicContact CD2-CG 3.56Å; L181-Y208 HydrophobicContact CG-CD1 4.17Å; L181-Y208 HydrophobicContact CG-CD2 3.9Å; L181-Y208 HydrophobicContact CG-CE1 3.95Å; L181-Y208 HydrophobicContact CG-CE2 3.67Å; L181-Y208 HydrophobicContact CG-CG 4.14Å
182	V	88.8	Confident	90.5	Very high	80 Å²	80	49.8 Å²	49.8	49%	0.485	26%	0.256	S	S	.	.	H	α-helix	trans	-64	-40	178.3	174.6	0	0	0	0	111.7	H178 F180 Y208	H178-V182 WeakPolarHBondContact O-CG2 3.35Å; H178-V182 PolarHBondContact O-N 3.46Å; H178-V182 VanDerWaalsContact O-N 3.13Å; F180-V182 VanDerWaalsContact C-N 3.33Å; F180-V182 PolarHBondContact O-N 3.22Å; V182-Y208 HydrophobicContact CG2-CD2 3.98Å; V182-Y208 HydrophobicContact CG2-CE2 4.26Å
183	N	89.3	Confident	90.5	Very high	131 Å²	131	46.9 Å²	46.9	70%	0.701	24%	0.24	S	C	*	.	H	α-helix	trans	-88.4	-22.8	-174.5	-69.3	-52	0	0	0	114.2	D179 F180	D179-N183 PolarHBondContact O-N 3.02Å; D179-N183 PolarHBondContact O-ND2 2.91Å; F180-N183 PolarHBondContact O-N 2.97Å
184	E	90.2	Very high	90.5	Very high	17 Å²	17	46.9 Å²	46.9	8%	0.079	24%	0.24	C	C	.	.			trans	-68.7	152.2	-176.3	-176.4	55.3	-103.7	0	0	112.3	R152 F180 D186 C189 K190	R152-E184 IonicContact CZ-OE1 3.95Å; R152-E184 IonicContact CZ-OE2 3.83Å; R152-E184 IonicContact NE-OE1 2.94Å; R152-E184 IonicContact NE-OE2 2.7Å; R152-E184 PolarHBondContact NE-OE2 2.9Å; R152-E184 IonicContact NH2-OE1 2.65Å; R152-E184 PolarHBondContact NH2-OE1 3.38Å; R152-E184 IonicContact NH2-OE2 2.68Å; R152-E184 PolarHBondContact NH2-OE2 3.35Å; F180-E184 HydrophobicContact CE1-CB 4.17Å; F180-E184 HydrophobicContact CE1-CG 4.13Å; F180-E184 WeakPolarHBondContact CE2-OE2 2.96Å; F180-E184 HydrophobicContact CZ-CB 4.18Å; F180-E184 HydrophobicContact CZ-CG 3.96Å; F180-E184 WeakPolarHBondContact CZ-OE2 3.21Å; F180-E184 VanDerWaalsContact O-CB 3.29Å; F180-E184 WeakPolarHBondContact O-CB 3.37Å; F180-E184 PolarHBondContact O-N 3.4Å; E184-D186 HydrophobicContact CG-CB 4.49Å; E184-D186 WeakPolarHBondContact OE1-CB 3.43Å; E184-D186 PolarHBondContact OE1-N 2.82Å; E184-C189 HydrophobicContact CG-CB 3.61Å; E184-K190 HydrophobicContact CB-CG 4.3Å; E184-K190 HydrophobicContact CG-CG 4.17Å; E184-K190 WeakPolarHBondContact O-CE 3.47Å; E184-K190 PolarHBondContact O-NZ 3.46Å; E184-K190 VanDerWaalsContact O-NZ 3.13Å
185	K	87	Confident	90.3	Very high	192 Å²	192	48 Å²	48	84%	0.835	25%	0.245	S	C	*	.			trans	-116.4	-27.1	176.9	-63.5	-177	-177.8	179	0	112.9
186	D	89.8	Confident	90.3	Very high	49 Å²	49	43.1 Å²	43.1	26%	0.262	22%	0.222	S	C	.	.			trans	-72.5	125.8	-178.4	-177.6	96.2	0	0	0	112.2	S149 E184 S188 C189 K190	S149-D186 VanDerWaalsContact CB-CG 3.43Å; S149-D186 VanDerWaalsContact CB-OD1 3.29Å; S149-D186 WeakPolarHBondContact CB-OD1 3.49Å; S149-D186 PolarHBondContact OG-OD1 3.05Å; S149-D186 VanDerWaalsContact OG-OD1 3.12Å; E184-D186 HydrophobicContact CG-CB 4.49Å; E184-D186 WeakPolarHBondContact OE1-CB 3.43Å; E184-D186 PolarHBondContact OE1-N 2.82Å; D186-S188 VanDerWaalsContact C-N 3.31Å; D186-S188 PolarHBondContact O-N 3.45Å; D186-S188 WeakPolarHBondContact OD2-CA 3.41Å; D186-S188 WeakPolarHBondContact OD2-CB 3.39Å; D186-S188 PolarHBondContact OD2-N 3.19Å; D186-C189 HydrophobicContact CB-CB 4.15Å; D186-C189 PolarHBondContact O-N 2.64Å; D186-C189 PolarHBondContact OD2-N 3.39Å; D186-C189 PolarHBondContact OD2-SG 3.04Å; D186-K190 WeakPolarHBondContact O-CG 3.37Å; D186-K190 PolarHBondContact O-N 2.69Å
187	A	86.2	Confident	90.2	Very high	47 Å²	47	40.8 Å²	40.8	39%	0.388	21%	0.21	S	C	.	.	H	α-helix	trans	-62.8	-34.3	-175.6	0	0	0	0	0	113.5	R191	A187-R191 WeakPolarHBondContact O-CB 3.43Å; A187-R191 PolarHBondContact O-N 2.84Å
188	S	87.9	Confident	89.8	Confident	32 Å²	32	40.9 Å²	40.9	22%	0.224	21%	0.21	C	C	.	.	H	α-helix	trans	-73.4	-38.8	-178.6	-161	0	0	0	0	111.3	R153 D186 N192	R153-S188 WeakPolarHBondContact CD-OG 3.23Å; R153-S188 PolarHBondContact NH1-OG 3.08Å; D186-S188 VanDerWaalsContact C-N 3.31Å; D186-S188 PolarHBondContact O-N 3.45Å; D186-S188 WeakPolarHBondContact OD2-CA 3.41Å; D186-S188 WeakPolarHBondContact OD2-CB 3.39Å; D186-S188 PolarHBondContact OD2-N 3.19Å; S188-N192 PolarHBondContact O-N 3.29Å
189	C	90.9	Very high	89.5	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.2	-47.2	172.6	-60.6	0	0	0	0	111.2	S149 F180 E184 D186 R191 N192 A193	S149-C189 PolarHBondContact O-SG 3.23Å; F180-C189 HydrophobicContact CE1-CB 4.18Å; F180-C189 HydrophobicContact CZ-CB 4.14Å; E184-C189 HydrophobicContact CG-CB 3.61Å; D186-C189 HydrophobicContact CB-CB 4.15Å; D186-C189 PolarHBondContact O-N 2.64Å; D186-C189 PolarHBondContact OD2-N 3.39Å; D186-C189 PolarHBondContact OD2-SG 3.04Å; C189-R191 VanDerWaalsContact C-N 3.32Å; C189-R191 PolarHBondContact O-N 2.78Å; C189-N192 PolarHBondContact O-N 3.29Å; C189-A193 WeakPolarHBondContact O-CB 3.43Å; C189-A193 PolarHBondContact O-N 3.47Å
190	K	90.8	Very high	89.3	Confident	33 Å²	33	41 Å²	41	14%	0.143	21%	0.214	C	C	.	.	H	α-helix	trans	-57	-44.8	175.7	-73.1	-164.5	177.8	-160.3	0	112.3	L181 E184 D186 N192 A193 F194 L223	L181-K190 HydrophobicContact CD1-CB 3.89Å; L181-K190 HydrophobicContact CD1-CG 3.97Å; E184-K190 HydrophobicContact CB-CG 4.3Å; E184-K190 HydrophobicContact CG-CG 4.17Å; E184-K190 WeakPolarHBondContact O-CE 3.47Å; E184-K190 PolarHBondContact O-NZ 3.46Å; E184-K190 VanDerWaalsContact O-NZ 3.13Å; D186-K190 WeakPolarHBondContact O-CG 3.37Å; D186-K190 PolarHBondContact O-N 2.69Å; K190-N192 PolarHBondContact O-N 3.13Å; K190-A193 PolarHBondContact O-N 2.88Å; K190-F194 VanDerWaalsContact O-CB 3.22Å; K190-F194 WeakPolarHBondContact O-CB 3.33Å; K190-F194 PolarHBondContact O-N 3.48Å; K190-L223 HydrophobicContact CB-CD2 4.07Å; K190-L223 HydrophobicContact CD-CD2 4.33Å
191	R	90.2	Very high	89	Confident	73 Å²	73	41.9 Å²	41.9	28%	0.275	22%	0.219	S	C	.	.	H	α-helix	trans	-58	-47	177.6	179.7	-95.1	174.6	-157.7	-2.6	112.1	A187 C189 M195 I222 V226	A187-R191 WeakPolarHBondContact O-CB 3.43Å; A187-R191 PolarHBondContact O-N 2.84Å; C189-R191 VanDerWaalsContact C-N 3.32Å; C189-R191 PolarHBondContact O-N 2.78Å; R191-M195 WeakPolarHBondContact O-CB 3.49Å; R191-M195 PolarHBondContact O-N 2.71Å; R191-I222 HydrophobicContact CB-CG2 4.48Å; R191-I222 HydrophobicContact CG-CG2 3.81Å; R191-V226 HydrophobicContact CG-CG2 3.9Å
192	N	90.8	Very high	88.7	Confident	21 Å²	21	46.2 Å²	46.2	11%	0.112	24%	0.239	C	C	.	.	H	α-helix	trans	-67.9	-38.9	-179.9	-79.3	2.8	0	0	0	112.3	R153 V156 S188 C189 K190 M195 M196	R153-N192 VanDerWaalsContact CG-ND2 3.27Å; R153-N192 WeakPolarHBondContact CG-ND2 3.25Å; R153-N192 PolarHBondContact O-ND2 3.49Å; V156-N192 HydrophobicContact CB-CB 4.35Å; V156-N192 HydrophobicContact CG1-CB 3.87Å; S188-N192 PolarHBondContact O-N 3.29Å; C189-N192 PolarHBondContact O-N 3.29Å; K190-N192 PolarHBondContact O-N 3.13Å; N192-M195 PolarHBondContact O-N 2.92Å; N192-M196 PolarHBondContact O-N 3.44Å
193	A	91.7	Very high	88.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.1	-46.4	178.6	0	0	0	0	0	110.8	V156 I177 F180 L181 C189 K190 M196 L197	V156-A193 HydrophobicContact CG1-CB 4.07Å; I177-A193 HydrophobicContact CG2-CB 3.69Å; F180-A193 HydrophobicContact CD1-CB 4Å; F180-A193 HydrophobicContact CE1-CB 4.28Å; L181-A193 HydrophobicContact CB-CB 4.16Å; L181-A193 HydrophobicContact CD1-CB 4.05Å; C189-A193 WeakPolarHBondContact O-CB 3.43Å; C189-A193 PolarHBondContact O-N 3.47Å; K190-A193 PolarHBondContact O-N 2.88Å; A193-M196 WeakPolarHBondContact O-CB 3.39Å; A193-M196 PolarHBondContact O-N 3.03Å; A193-L197 WeakPolarHBondContact O-CG 3.21Å; A193-L197 PolarHBondContact O-N 2.84Å; A193-L197 VanDerWaalsContact O-N 3.07Å
194	F	90.9	Very high	88.6	Confident	1 Å²	1	45.3 Å²	45.3	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-62.8	-44.9	175.6	-166.9	-113.7	0	0	0	111.8	L181 K190 M196 L197 I198 A205 Y208 L209 L223 V226 I227 L230	L181-F194 HydrophobicContact CD1-CB 4.42Å; L181-F194 HydrophobicContact CD2-CB 4.29Å; L181-F194 HydrophobicContact CD2-CD2 3.91Å; K190-F194 VanDerWaalsContact O-CB 3.22Å; K190-F194 WeakPolarHBondContact O-CB 3.33Å; K190-F194 PolarHBondContact O-N 3.48Å; F194-M196 VanDerWaalsContact C-N 3.29Å; F194-M196 PolarHBondContact O-N 3.28Å; F194-L197 PolarHBondContact O-N 2.89Å; F194-L197 VanDerWaalsContact O-N 3.11Å; F194-I198 HydrophobicContact CD1-CD1 3.72Å; F194-I198 HydrophobicContact CD1-CG1 4.32Å; F194-I198 HydrophobicContact CE1-CD1 3.69Å; F194-I198 HydrophobicContact CE1-CG1 4.25Å; F194-I198 HydrophobicContact CZ-CD1 4.5Å; F194-I198 VanDerWaalsContact O-CG1 3.3Å; F194-I198 WeakPolarHBondContact O-CG1 3.42Å; F194-I198 PolarHBondContact O-N 3.1Å; F194-A205 HydrophobicContact CE2-CB 4.14Å; F194-Y208 AromaticContact CD2-CD1 3.97Å; F194-Y208 HydrophobicContact CD2-CD1 3.97Å; F194-Y208 HydrophobicContact CD2-CE1 4.45Å; F194-Y208 AromaticContact CE2-CD1 3.95Å; F194-Y208 HydrophobicContact CE2-CD1 3.95Å; F194-L209 HydrophobicContact CE2-CB 4.5Å; F194-L209 HydrophobicContact CZ-CB 4.42Å; F194-L223 HydrophobicContact CB-CD1 4.06Å; F194-L223 HydrophobicContact CD1-CD1 4.03Å; F194-L223 HydrophobicContact CG-CD1 4.22Å; F194-V226 HydrophobicContact CD1-CG1 3.84Å; F194-V226 HydrophobicContact CE1-CG1 4.34Å; F194-I227 HydrophobicContact CD1-CG1 4.24Å; F194-I227 HydrophobicContact CE1-CB 4.42Å; F194-I227 HydrophobicContact CE1-CG1 3.56Å; F194-I227 HydrophobicContact CZ-CG1 4.01Å; F194-L230 HydrophobicContact CE1-CB 4.43Å; F194-L230 HydrophobicContact CE1-CD2 3.94Å; F194-L230 HydrophobicContact CE2-CD2 4.21Å; F194-L230 HydrophobicContact CZ-CD2 3.38Å
195	M	88.1	Confident	88.4	Confident	32 Å²	32	44.5 Å²	44.5	16%	0.158	22%	0.222	C	C	.	.	H	α-helix	trans	-57.7	-40.4	175.4	-172.8	67.6	178.8	0	0	112.4	R191 N192 H199 V226	R191-M195 WeakPolarHBondContact O-CB 3.49Å; R191-M195 PolarHBondContact O-N 2.71Å; N192-M195 PolarHBondContact O-N 2.92Å; M195-H199 WeakPolarHBondContact CE-NE2 3.37Å; M195-H199 PolarHBondContact O-CD2 2.93Å; M195-H199 VanDerWaalsContact O-CD2 3.29Å; M195-H199 PolarHBondContact O-N 3.37Å; M195-V226 HydrophobicContact SD-CG1 3.98Å
196	M	90.4	Very high	88.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.2	-47.7	174.5	169.9	172.2	163.6	0	0	111.4	I159 Y160 A173 I177 N192 A193 F194 I198 H199 A200	I159-M196 HydrophobicContact CG2-CE 3.99Å; I159-M196 HydrophobicContact CG2-SD 4.12Å; Y160-M196 VanDerWaalsContact CA-SD 3.58Å; Y160-M196 HydrophobicContact CD2-CB 3.88Å; Y160-M196 HydrophobicContact CD2-CG 3.62Å; Y160-M196 HydrophobicContact CD2-SD 4.33Å; Y160-M196 HydrophobicContact CG-CB 3.93Å; Y160-M196 HydrophobicContact CG-CG 4.01Å; Y160-M196 HydrophobicContact CG-SD 4.4Å; A173-M196 HydrophobicContact CB-CE 3.57Å; I177-M196 HydrophobicContact CB-CE 4.28Å; I177-M196 HydrophobicContact CB-SD 4.26Å; I177-M196 HydrophobicContact CD1-SD 4.39Å; I177-M196 HydrophobicContact CG1-CE 3.75Å; I177-M196 HydrophobicContact CG1-SD 3.67Å; I177-M196 HydrophobicContact CG2-SD 4.18Å; N192-M196 PolarHBondContact O-N 3.44Å; A193-M196 WeakPolarHBondContact O-CB 3.39Å; A193-M196 PolarHBondContact O-N 3.03Å; F194-M196 VanDerWaalsContact C-N 3.29Å; F194-M196 PolarHBondContact O-N 3.28Å; M196-I198 VanDerWaalsContact C-N 3.33Å; M196-I198 PolarHBondContact O-N 3.01Å; M196-H199 PolarHBondContact O-N 3.38Å; M196-H199 VanDerWaalsContact O-N 3.14Å; M196-A200 HydrophobicContact CG-CB 4.48Å; M196-A200 VanDerWaalsContact O-CB 3.3Å; M196-A200 WeakPolarHBondContact O-CB 3.36Å; M196-A200 PolarHBondContact O-N 3.11Å
197	L	90.2	Very high	88.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61	-40.9	179.5	-65.8	175.2	0	0	0	111.7	P174 I177 H178 L181 A193 F194 H199 A200 D201 A205	P174-L197 HydrophobicContact CB-CD2 4.45Å; P174-L197 WeakPolarHBondContact O-CD2 3.45Å; I177-L197 HydrophobicContact CG2-CD2 4.37Å; I177-L197 HydrophobicContact CG2-CG 4.24Å; H178-L197 HydrophobicContact CB-CD1 4.31Å; H178-L197 HydrophobicContact CB-CD2 4.45Å; L181-L197 HydrophobicContact CD2-CD1 3.71Å; A193-L197 WeakPolarHBondContact O-CG 3.21Å; A193-L197 PolarHBondContact O-N 2.84Å; A193-L197 VanDerWaalsContact O-N 3.07Å; F194-L197 PolarHBondContact O-N 2.89Å; F194-L197 VanDerWaalsContact O-N 3.11Å; L197-H199 PolarHBondContact O-N 3.47Å; L197-H199 VanDerWaalsContact O-N 3.11Å; L197-A200 PolarHBondContact O-N 3.38Å; L197-D201 CarbonylContact O-C 3.59Å; L197-D201 WeakPolarHBondContact O-CA 3.35Å; L197-D201 PolarHBondContact O-N 2.92Å; L197-A205 HydrophobicContact CB-CB 3.89Å
198	I	87	Confident	88.3	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-54.1	-35.6	176.1	-66.4	171.6	0	0	0	112.6	F194 M196 Q202 A205 V226 L230	F194-I198 HydrophobicContact CD1-CD1 3.72Å; F194-I198 HydrophobicContact CD1-CG1 4.32Å; F194-I198 HydrophobicContact CE1-CD1 3.69Å; F194-I198 HydrophobicContact CE1-CG1 4.25Å; F194-I198 HydrophobicContact CZ-CD1 4.5Å; F194-I198 VanDerWaalsContact O-CG1 3.3Å; F194-I198 WeakPolarHBondContact O-CG1 3.42Å; F194-I198 PolarHBondContact O-N 3.1Å; M196-I198 VanDerWaalsContact C-N 3.33Å; M196-I198 PolarHBondContact O-N 3.01Å; I198-Q202 WeakPolarHBondContact O-CG 3.47Å; I198-Q202 PolarHBondContact O-NE2 3.44Å; I198-A205 HydrophobicContact CG1-CB 4.35Å; I198-V226 HydrophobicContact CD1-CG1 3.42Å; I198-V226 VanDerWaalsContact CD1-CG1 3.42Å; I198-L230 HydrophobicContact CB-CD1 4.48Å; I198-L230 HydrophobicContact CD1-CB 3.88Å; I198-L230 HydrophobicContact CD1-CD1 4.43Å; I198-L230 HydrophobicContact CD1-CD2 4.43Å; I198-L230 HydrophobicContact CD1-CG 4.46Å; I198-L230 HydrophobicContact CG1-CB 4.28Å; I198-L230 HydrophobicContact CG1-CD1 3.93Å; I198-L230 HydrophobicContact CG1-CD2 4.13Å; I198-L230 HydrophobicContact CG1-CG 4.32Å; I198-L230 HydrophobicContact CG2-CD1 4.07Å
199	H	84.6	Confident	88.2	Confident	97 Å²	97	36.2 Å²	36.2	45%	0.449	18%	0.177	S	C	.	.	H	α-helix	trans	-93.2	-30.5	-178.6	-74.4	-68	0	0	0	114	Y160 M195 M196 L197	Y160-H199 HydrophobicContact CE2-CB 3.97Å; Y160-H199 PolarHBondContact OH-CD2 3.5Å; Y160-H199 VanDerWaalsContact OH-CD2 3.25Å; M195-H199 WeakPolarHBondContact CE-NE2 3.37Å; M195-H199 PolarHBondContact O-CD2 2.93Å; M195-H199 VanDerWaalsContact O-CD2 3.29Å; M195-H199 PolarHBondContact O-N 3.37Å; M196-H199 PolarHBondContact O-N 3.38Å; M196-H199 VanDerWaalsContact O-N 3.14Å; L197-H199 PolarHBondContact O-N 3.47Å; L197-H199 VanDerWaalsContact O-N 3.11Å
200	A	87.1	Confident	87.9	Confident	31 Å²	31	37.5 Å²	37.5	26%	0.256	19%	0.186	S	C	.	.	H	α-helix	trans	-93.2	-43.2	-175.6	0	0	0	0	0	113.2	Y163 P174 M196 L197	Y163-A200 HydrophobicContact CD1-CB 4.05Å; Y163-A200 HydrophobicContact CE1-CB 3.62Å; P174-A200 HydrophobicContact CG-CB 4.37Å; M196-A200 HydrophobicContact CG-CB 4.48Å; M196-A200 VanDerWaalsContact O-CB 3.3Å; M196-A200 WeakPolarHBondContact O-CB 3.36Å; M196-A200 PolarHBondContact O-N 3.11Å; L197-A200 PolarHBondContact O-N 3.38Å
201	D	87.1	Confident	87.7	Confident	42 Å²	42	41.5 Å²	41.5	23%	0.225	21%	0.213	C	C	.	.			trans	-154	92.3	-174.9	-171.3	-18.5	0	0	0	110	P174 L197 D203 R204 A205	P174-D201 HydrophobicContact CB-CB 3.94Å; L197-D201 CarbonylContact O-C 3.59Å; L197-D201 WeakPolarHBondContact O-CA 3.35Å; L197-D201 PolarHBondContact O-N 2.92Å; D201-D203 VanDerWaalsContact C-N 3.31Å; D201-D203 PolarHBondContact O-N 3.43Å; D201-D203 PolarHBondContact OD1-N 3.26Å; D201-R204 PolarHBondContact OD1-N 2.97Å; D201-R204 WeakPolarHBondContact OD2-CD 3.39Å; D201-R204 WeakPolarHBondContact OD2-CG 3.41Å; D201-R204 IonicContact OD2-NE 2.71Å; D201-R204 PolarHBondContact OD2-NE 3.22Å; D201-A205 PolarHBondContact O-N 3.4Å
202	Q	84.8	Confident	87.5	Confident	90 Å²	90	38.6 Å²	38.6	42%	0.421	20%	0.204	S	C	.	.	H	α-helix	trans	-65.6	-32.8	-175.9	-73.3	-178.2	-1	0	0	112.8	I198 A205 L206	I198-Q202 WeakPolarHBondContact O-CG 3.47Å; I198-Q202 PolarHBondContact O-NE2 3.44Å; Q202-A205 WeakPolarHBondContact O-CB 3.41Å; Q202-A205 PolarHBondContact O-N 2.89Å; Q202-L206 WeakPolarHBondContact O-CG 3.09Å; Q202-L206 PolarHBondContact O-N 2.96Å
203	D	86.5	Confident	87.1	Confident	114 Å²	114	38.8 Å²	38.8	61%	0.61	21%	0.205	S	C	*	.	H	α-helix	trans	-65.1	-43.8	-177.5	-66.9	-31.8	0	0	0	110.3	D201 A205 L206 D207	D201-D203 VanDerWaalsContact C-N 3.31Å; D201-D203 PolarHBondContact O-N 3.43Å; D201-D203 PolarHBondContact OD1-N 3.26Å; D203-A205 VanDerWaalsContact C-N 3.33Å; D203-A205 PolarHBondContact O-N 3.28Å; D203-L206 WeakPolarHBondContact O-CB 3.1Å; D203-L206 PolarHBondContact O-N 2.8Å; D203-L206 VanDerWaalsContact O-N 3.15Å; D203-D207 PolarHBondContact O-N 2.77Å
204	R	87.7	Confident	86.7	Confident	78 Å²	78	43.8 Å²	43.8	29%	0.294	23%	0.231	S	C	.	.	H	α-helix	trans	-65.1	-34.6	174.3	-68.1	-177.2	-168.3	-114.6	6.3	113.3	D201 L206 D207 Y208	D201-R204 PolarHBondContact OD1-N 2.97Å; D201-R204 WeakPolarHBondContact OD2-CD 3.39Å; D201-R204 WeakPolarHBondContact OD2-CG 3.41Å; D201-R204 IonicContact OD2-NE 2.71Å; D201-R204 PolarHBondContact OD2-NE 3.22Å; R204-L206 VanDerWaalsContact C-N 3.31Å; R204-D207 PolarHBondContact O-N 2.84Å; R204-Y208 PolarHBondContact O-N 3.43Å
205	A	87.3	Confident	86.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-39.5	174.2	0	0	0	0	0	111.1	F194 L197 I198 D201 Q202 D203 L209 L230	F194-A205 HydrophobicContact CE2-CB 4.14Å; L197-A205 HydrophobicContact CB-CB 3.89Å; I198-A205 HydrophobicContact CG1-CB 4.35Å; D201-A205 PolarHBondContact O-N 3.4Å; Q202-A205 WeakPolarHBondContact O-CB 3.41Å; Q202-A205 PolarHBondContact O-N 2.89Å; D203-A205 VanDerWaalsContact C-N 3.33Å; D203-A205 PolarHBondContact O-N 3.28Å; A205-L209 WeakPolarHBondContact O-CB 3.49Å; A205-L209 PolarHBondContact O-N 3.05Å; A205-L230 HydrophobicContact CB-CD2 4.18Å
206	L	85.4	Confident	86.2	Confident	25 Å²	25	48 Å²	48	13%	0.131	25%	0.251	C	S	.	.	H	α-helix	trans	-68.1	-39	176.3	-70.7	170.8	0	0	0	112.3	Q202 D203 R204 L209 S210 V234 F245	Q202-L206 WeakPolarHBondContact O-CG 3.09Å; Q202-L206 PolarHBondContact O-N 2.96Å; D203-L206 WeakPolarHBondContact O-CB 3.1Å; D203-L206 PolarHBondContact O-N 2.8Å; D203-L206 VanDerWaalsContact O-N 3.15Å; R204-L206 VanDerWaalsContact C-N 3.31Å; L206-L209 PolarHBondContact O-N 3.22Å; L206-S210 WeakPolarHBondContact O-CB 3.39Å; L206-S210 PolarHBondContact O-N 3.36Å; L206-S210 PolarHBondContact O-OG 2.87Å; L206-V234 HydrophobicContact CD1-CG1 4.13Å; L206-V234 HydrophobicContact CD1-CG2 4.32Å; L206-V234 HydrophobicContact CD2-CB 4.36Å; L206-V234 HydrophobicContact CD2-CG1 3.88Å; L206-V234 HydrophobicContact CD2-CG2 3.91Å; L206-V234 HydrophobicContact CG-CG2 4.42Å; L206-F245 HydrophobicContact CD2-CE2 4.04Å; L206-F245 HydrophobicContact CD2-CZ 3.55Å
207	D	86.5	Confident	85.8	Confident	104 Å²	104	52.1 Å²	52.1	56%	0.556	27%	0.27	S	S	*	.	H	α-helix	trans	-62.1	-46.6	174.6	-75.7	-19.3	0	0	0	111.3	D203 R204 S210 T211	D203-D207 PolarHBondContact O-N 2.77Å; R204-D207 PolarHBondContact O-N 2.84Å; D207-S210 VanDerWaalsContact O-CB 3.28Å; D207-S210 WeakPolarHBondContact O-CB 3.45Å; D207-S210 PolarHBondContact O-N 3.2Å; D207-T211 PolarHBondContact O-N 3.09Å; D207-T211 VanDerWaalsContact O-N 3.14Å; D207-T211 PolarHBondContact O-OG1 3.25Å
208	Y	87.6	Confident	85.6	Confident	17 Å²	17	57.6 Å²	57.6	7%	0.067	30%	0.304	C	S	.	.	H	α-helix	trans	-60.7	-48.8	175.2	176.4	-96.3	0	0	0	111.8	L181 V182 F194 R204 S210 T211 C212	L181-Y208 HydrophobicContact CD1-CE1 4.21Å; L181-Y208 HydrophobicContact CD1-CE2 4.47Å; L181-Y208 HydrophobicContact CD2-CD1 3.54Å; L181-Y208 HydrophobicContact CD2-CD2 3.82Å; L181-Y208 HydrophobicContact CD2-CE1 3.77Å; L181-Y208 HydrophobicContact CD2-CE2 4.04Å; L181-Y208 HydrophobicContact CD2-CG 3.56Å; L181-Y208 HydrophobicContact CG-CD1 4.17Å; L181-Y208 HydrophobicContact CG-CD2 3.9Å; L181-Y208 HydrophobicContact CG-CE1 3.95Å; L181-Y208 HydrophobicContact CG-CE2 3.67Å; L181-Y208 HydrophobicContact CG-CG 4.14Å; V182-Y208 HydrophobicContact CG2-CD2 3.98Å; V182-Y208 HydrophobicContact CG2-CE2 4.26Å; F194-Y208 AromaticContact CD2-CD1 3.97Å; F194-Y208 HydrophobicContact CD2-CD1 3.97Å; F194-Y208 HydrophobicContact CD2-CE1 4.45Å; F194-Y208 AromaticContact CE2-CD1 3.95Å; F194-Y208 HydrophobicContact CE2-CD1 3.95Å; R204-Y208 PolarHBondContact O-N 3.43Å; Y208-S210 VanDerWaalsContact C-N 3.26Å; Y208-S210 PolarHBondContact O-N 3.34Å; Y208-T211 WeakPolarHBondContact CA-OG1 3.34Å; Y208-T211 PolarHBondContact O-N 2.8Å; Y208-T211 PolarHBondContact O-OG1 3.5Å; Y208-C212 PolarHBondContact O-N 3.17Å; Y208-C212 PolarHBondContact O-SG 3.38Å
209	L	86.4	Confident	85.5	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61	-38.4	178.7	-178.2	59.9	0	0	0	111.4	F194 A205 L206 T211 C212 I213 V216 I227 L230 I231 F245	F194-L209 HydrophobicContact CE2-CB 4.5Å; F194-L209 HydrophobicContact CZ-CB 4.42Å; A205-L209 WeakPolarHBondContact O-CB 3.49Å; A205-L209 PolarHBondContact O-N 3.05Å; L206-L209 PolarHBondContact O-N 3.22Å; L209-T211 VanDerWaalsContact C-N 3.33Å; L209-T211 PolarHBondContact O-N 3.07Å; L209-C212 CarbonylContact O-C 3.57Å; L209-C212 PolarHBondContact O-N 3Å; L209-C212 VanDerWaalsContact O-N 3.16Å; L209-I213 WeakPolarHBondContact O-CA 3.36Å; L209-I213 WeakPolarHBondContact O-CB 3.44Å; L209-I213 PolarHBondContact O-N 2.96Å; L209-V216 HydrophobicContact CD1-CG2 3.98Å; L209-I227 HydrophobicContact CD1-CD1 4.26Å; L209-I227 HydrophobicContact CD1-CG1 4.34Å; L209-I227 HydrophobicContact CD1-CG2 3.81Å; L209-I227 HydrophobicContact CD2-CG2 4.19Å; L209-L230 HydrophobicContact CD2-CD2 4.22Å; L209-I231 HydrophobicContact CD2-CG1 4.24Å; L209-F245 HydrophobicContact CD2-CD1 4.19Å; L209-F245 HydrophobicContact CD2-CE1 3.52Å; L209-F245 HydrophobicContact CD2-CZ 4.31Å; L209-F245 HydrophobicContact CG-CE1 4.17Å
210	S	84.6	Confident	85.5	Confident	28 Å²	28	55.7 Å²	55.7	20%	0.196	30%	0.303	C	S	.	.	H	α-helix	trans	-57.5	-42.5	176.1	-73.3	0	0	0	0	112.7	L206 D207 Y208 C212 R244	L206-S210 WeakPolarHBondContact O-CB 3.39Å; L206-S210 PolarHBondContact O-N 3.36Å; L206-S210 PolarHBondContact O-OG 2.87Å; D207-S210 VanDerWaalsContact O-CB 3.28Å; D207-S210 WeakPolarHBondContact O-CB 3.45Å; D207-S210 PolarHBondContact O-N 3.2Å; Y208-S210 VanDerWaalsContact C-N 3.26Å; Y208-S210 PolarHBondContact O-N 3.34Å; S210-C212 VanDerWaalsContact C-N 3.35Å; S210-R244 PolarHBondContact OG-NH1 2.88Å; S210-R244 PolarHBondContact OG-NH2 3.2Å
211	T	86.5	Confident	85.5	Confident	117 Å²	117	57.9 Å²	57.9	72%	0.718	31%	0.31	S	S	*	.	H	α-helix	trans	-70	-27	176.9	24.1	0	0	0	0	114.1	D207 Y208 L209	D207-T211 PolarHBondContact O-N 3.09Å; D207-T211 VanDerWaalsContact O-N 3.14Å; D207-T211 PolarHBondContact O-OG1 3.25Å; Y208-T211 WeakPolarHBondContact CA-OG1 3.34Å; Y208-T211 PolarHBondContact O-N 2.8Å; Y208-T211 PolarHBondContact O-OG1 3.5Å; L209-T211 VanDerWaalsContact C-N 3.33Å; L209-T211 PolarHBondContact O-N 3.07Å
212	C	85.6	Confident	85.5	Confident	12 Å²	12	60.2 Å²	60.2	8%	0.081	32%	0.322	C	S	.	.	H	α-helix	trans	-115.5	11.4	-173.9	65.7	0	0	0	0	115	Y208 L209 S210 D214 Q215 V216 F219	Y208-C212 PolarHBondContact O-N 3.17Å; Y208-C212 PolarHBondContact O-SG 3.38Å; L209-C212 CarbonylContact O-C 3.57Å; L209-C212 PolarHBondContact O-N 3Å; L209-C212 VanDerWaalsContact O-N 3.16Å; S210-C212 VanDerWaalsContact C-N 3.35Å; C212-D214 VanDerWaalsContact C-N 3.29Å; C212-D214 PolarHBondContact O-N 2.84Å; C212-D214 VanDerWaalsContact O-N 3.17Å; C212-Q215 PolarHBondContact O-N 2.78Å; C212-V216 PolarHBondContact O-N 2.82Å; C212-F219 HydrophobicContact CB-CE2 4.39Å; C212-F219 HydrophobicContact CB-CZ 3.9Å
213	I	83	Confident	85.6	Confident	25 Å²	25	56 Å²	56	13%	0.128	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-55.7	-37.4	-171.8	-159.9	166.2	0	0	0	114	L209 Q215 V216 R244 F245 C248	L209-I213 WeakPolarHBondContact O-CA 3.36Å; L209-I213 WeakPolarHBondContact O-CB 3.44Å; L209-I213 PolarHBondContact O-N 2.96Å; I213-Q215 VanDerWaalsContact C-N 3.3Å; I213-Q215 PolarHBondContact O-N 3.27Å; I213-V216 WeakPolarHBondContact O-CG2 3.49Å; I213-R244 HydrophobicContact CD1-CG 4.14Å; I213-F245 HydrophobicContact CD1-CD1 4.33Å; I213-F245 HydrophobicContact CD1-CE1 4.43Å; I213-C248 HydrophobicContact CD1-CB 4.11Å; I213-C248 HydrophobicContact CG1-CB 3.83Å
214	D	82.6	Confident	85.8	Confident	104 Å²	104	50.7 Å²	50.7	56%	0.556	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-76.9	-16.7	179.2	-68.5	-53.2	0	0	0	112.8	C212 R247	C212-D214 VanDerWaalsContact C-N 3.29Å; C212-D214 PolarHBondContact O-N 2.84Å; C212-D214 VanDerWaalsContact O-N 3.17Å; D214-R247 IonicContact OD1-CZ 3.64Å; D214-R247 IonicContact OD1-NE 2.74Å; D214-R247 IonicContact OD1-NH2 3.31Å; D214-R247 PolarHBondContact OD1-NH2 3.02Å
215	Q	85.4	Confident	85.8	Confident	119 Å²	119	49.8 Å²	49.8	56%	0.556	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-96.7	-4.2	-178.3	-62.3	178.6	15.5	0	0	113.4	C212 I213 Q217 T218 F219	C212-Q215 PolarHBondContact O-N 2.78Å; I213-Q215 VanDerWaalsContact C-N 3.3Å; I213-Q215 PolarHBondContact O-N 3.27Å; Q215-Q217 PolarHBondContact O-N 3Å; Q215-Q217 VanDerWaalsContact O-N 3.08Å; Q215-T218 WeakPolarHBondContact O-CB 3.44Å; Q215-T218 PolarHBondContact O-N 3Å; Q215-T218 PolarHBondContact O-OG1 3.36Å; Q215-F219 HydrophobicContact CB-CE1 4.43Å
216	V	83.9	Confident	85.8	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.012	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-56.2	-32.8	-171.7	175.5	0	0	0	0	112.9	L209 C212 I213 T218 F219 Q224 I227 L252	L209-V216 HydrophobicContact CD1-CG2 3.98Å; C212-V216 PolarHBondContact O-N 2.82Å; I213-V216 WeakPolarHBondContact O-CG2 3.49Å; V216-T218 PolarHBondContact O-N 3.17Å; V216-F219 HydrophobicContact CB-CD2 4.47Å; V216-F219 HydrophobicContact CG1-CD2 4.5Å; V216-F219 HydrophobicContact CG2-CD2 4.48Å; V216-F219 HydrophobicContact CG2-CE2 4.25Å; V216-F219 WeakPolarHBondContact O-CB 3.37Å; V216-F219 PolarHBondContact O-N 2.8Å; V216-F219 VanDerWaalsContact O-N 3.14Å; V216-Q224 PolarHBondContact O-NE2 3.45Å; V216-I227 HydrophobicContact CG1-CD1 3.97Å; V216-I227 HydrophobicContact CG1-CG2 4.3Å; V216-I227 HydrophobicContact CG2-CD1 4.4Å; V216-L252 HydrophobicContact CG1-CD1 4.25Å; V216-L252 HydrophobicContact CG1-CD2 3.66Å; V216-L252 HydrophobicContact CG1-CG 4.12Å
217	Q	82.2	Confident	85.9	Confident	88 Å²	88	49 Å²	49	41%	0.411	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-62.4	-26.5	177.2	-168	-178.2	12.9	0	0	113.1	Q215 F219 Q224 Q254	Q215-Q217 PolarHBondContact O-N 3Å; Q215-Q217 VanDerWaalsContact O-N 3.08Å; Q217-F219 VanDerWaalsContact C-N 3.34Å; Q217-Q224 PolarHBondContact O-NE2 3.09Å; Q217-Q254 PolarHBondContact NE2-O 3.32Å
218	T	84.9	Confident	86	Confident	115 Å²	115	44.3 Å²	44.3	71%	0.706	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-82.5	-12.9	179.5	68.6	0	0	0	0	113.4	Q215 V216	Q215-T218 WeakPolarHBondContact O-CB 3.44Å; Q215-T218 PolarHBondContact O-N 3Å; Q215-T218 PolarHBondContact O-OG1 3.36Å; V216-T218 PolarHBondContact O-N 3.17Å
219	F	85.8	Confident	85.8	Confident	29 Å²	29	45.5 Å²	45.5	13%	0.127	25%	0.252	C	S	.	.	S	Bend	trans	-72.1	156.4	-180	-64.5	-15.6	0	0	0	112	C212 Q215 V216 Q217 L223 Q224 I227	C212-F219 HydrophobicContact CB-CE2 4.39Å; C212-F219 HydrophobicContact CB-CZ 3.9Å; Q215-F219 HydrophobicContact CB-CE1 4.43Å; V216-F219 HydrophobicContact CB-CD2 4.47Å; V216-F219 HydrophobicContact CG1-CD2 4.5Å; V216-F219 HydrophobicContact CG2-CD2 4.48Å; V216-F219 HydrophobicContact CG2-CE2 4.25Å; V216-F219 WeakPolarHBondContact O-CB 3.37Å; V216-F219 PolarHBondContact O-N 2.8Å; V216-F219 VanDerWaalsContact O-N 3.14Å; Q217-F219 VanDerWaalsContact C-N 3.34Å; F219-L223 HydrophobicContact CB-CB 4.49Å; F219-L223 HydrophobicContact CB-CD2 4.06Å; F219-L223 HydrophobicContact CB-CG 4.46Å; F219-L223 HydrophobicContact CD2-CD2 3.65Å; F219-L223 HydrophobicContact CD2-CG 4.21Å; F219-L223 HydrophobicContact CE2-CD2 4.22Å; F219-L223 HydrophobicContact CG-CD2 3.88Å; F219-Q224 HydrophobicContact CB-CG 4.21Å; F219-Q224 PolarHBondContact O-NE2 3.48Å; F219-Q224 VanDerWaalsContact O-NE2 3.08Å; F219-I227 HydrophobicContact CD2-CD1 3.82Å; F219-I227 HydrophobicContact CE2-CD1 4.2Å
220	G	85.1	Confident	85.8	Confident	30 Å²	30	45.5 Å²	45.5	31%	0.309	25%	0.252	S	S	.	.			trans	-60.4	148	171.6	0	0	0	0	0	111.5	I222 L223 Q224	G220-I222 VanDerWaalsContact C-N 3.29Å; G220-I222 PolarHBondContact O-N 3.44Å; G220-L223 PolarHBondContact O-N 3.35Å; G220-Q224 PolarHBondContact O-N 3.18Å
221	D	86.8	Confident	85.8	Confident	77 Å²	77	44.2 Å²	44.2	41%	0.412	24%	0.243	S	C	.	.	H	α-helix	trans	-50.6	-42.6	179.6	58.5	-15.6	0	0	0	113.7	L223 Q224 L225 V260	D221-L223 VanDerWaalsContact C-N 3.27Å; D221-L223 PolarHBondContact O-N 3.05Å; D221-Q224 PolarHBondContact O-N 3.27Å; D221-L225 WeakPolarHBondContact O-CG 3.36Å; D221-L225 PolarHBondContact O-N 2.97Å; D221-V260 HydrophobicContact CB-CG2 4.18Å
222	I	87.5	Confident	85.7	Confident	90 Å²	90	39.7 Å²	39.7	46%	0.462	21%	0.212	S	C	.	.	H	α-helix	trans	-61	-37.2	179.2	-42.6	179.6	0	0	0	111.4	R191 G220 V226	R191-I222 HydrophobicContact CB-CG2 4.48Å; R191-I222 HydrophobicContact CG-CG2 3.81Å; G220-I222 VanDerWaalsContact C-N 3.29Å; G220-I222 PolarHBondContact O-N 3.44Å; I222-V226 WeakPolarHBondContact O-CG2 3.27Å
223	L	87.4	Confident	85.5	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-76.6	-39.1	177.2	179.9	60	0	0	0	110.9	K190 F194 F219 G220 D221 L225 V226 I227	K190-L223 HydrophobicContact CB-CD2 4.07Å; K190-L223 HydrophobicContact CD-CD2 4.33Å; F194-L223 HydrophobicContact CB-CD1 4.06Å; F194-L223 HydrophobicContact CD1-CD1 4.03Å; F194-L223 HydrophobicContact CG-CD1 4.22Å; F219-L223 HydrophobicContact CB-CB 4.49Å; F219-L223 HydrophobicContact CB-CD2 4.06Å; F219-L223 HydrophobicContact CB-CG 4.46Å; F219-L223 HydrophobicContact CD2-CD2 3.65Å; F219-L223 HydrophobicContact CD2-CG 4.21Å; F219-L223 HydrophobicContact CE2-CD2 4.22Å; F219-L223 HydrophobicContact CG-CD2 3.88Å; G220-L223 PolarHBondContact O-N 3.35Å; D221-L223 VanDerWaalsContact C-N 3.27Å; D221-L223 PolarHBondContact O-N 3.05Å; L223-L225 VanDerWaalsContact C-N 3.33Å; L223-L225 PolarHBondContact O-N 3.19Å; L223-V226 PolarHBondContact O-N 2.97Å; L223-I227 HydrophobicContact CD1-CD1 4.33Å; L223-I227 HydrophobicContact CD1-CG1 4.44Å; L223-I227 HydrophobicContact CG-CD1 3.94Å; L223-I227 HydrophobicContact CG-CG1 4.5Å; L223-I227 WeakPolarHBondContact O-CG1 3.5Å; L223-I227 PolarHBondContact O-N 3.45Å
224	Q	89.6	Confident	85.4	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.009	22%	0.217	C	C	.	.	H	α-helix	trans	-58.4	-43.4	176.3	-69.7	179	-13.3	0	0	111.9	V216 Q217 F219 G220 D221 V226 I227 V228 L252 S255 V260	V216-Q224 PolarHBondContact O-NE2 3.45Å; Q217-Q224 PolarHBondContact O-NE2 3.09Å; F219-Q224 HydrophobicContact CB-CG 4.21Å; F219-Q224 PolarHBondContact O-NE2 3.48Å; F219-Q224 VanDerWaalsContact O-NE2 3.08Å; G220-Q224 PolarHBondContact O-N 3.18Å; D221-Q224 PolarHBondContact O-N 3.27Å; Q224-V226 PolarHBondContact O-N 3.34Å; Q224-I227 WeakPolarHBondContact O-CB 3.17Å; Q224-I227 PolarHBondContact O-N 2.79Å; Q224-V228 WeakPolarHBondContact O-CG2 3.42Å; Q224-V228 PolarHBondContact O-N 3.08Å; Q224-L252 HydrophobicContact CB-CD2 3.98Å; Q224-L252 HydrophobicContact CG-CD2 3.86Å; Q224-S255 PolarHBondContact OE1-OG 2.96Å; Q224-V260 HydrophobicContact CB-CG1 3.95Å; Q224-V260 HydrophobicContact CB-CG2 3.88Å
225	L	87.8	Confident	85.3	Confident	59 Å²	59	36.3 Å²	36.3	31%	0.309	19%	0.191	S	C	.	.	H	α-helix	trans	-60.5	-44.4	177.4	-72.1	171.9	0	0	0	112.4	D221 L223 I227 V228 E229 V260 E263	D221-L225 WeakPolarHBondContact O-CG 3.36Å; D221-L225 PolarHBondContact O-N 2.97Å; L223-L225 VanDerWaalsContact C-N 3.33Å; L223-L225 PolarHBondContact O-N 3.19Å; L225-I227 VanDerWaalsContact C-N 3.29Å; L225-I227 PolarHBondContact O-N 2.95Å; L225-V228 PolarHBondContact O-N 3.47Å; L225-E229 PolarHBondContact O-N 2.98Å; L225-V260 HydrophobicContact CD2-CB 4.5Å; L225-V260 HydrophobicContact CD2-CG2 3.95Å; L225-V260 HydrophobicContact CG-CG2 3.91Å; L225-E263 HydrophobicContact CD2-CB 4.28Å; L225-E263 HydrophobicContact CD2-CG 4.07Å
226	V	86.8	Confident	84.9	Confident	8 Å²	8	35.3 Å²	35.3	5%	0.048	19%	0.186	C	C	.	.	H	α-helix	trans	-66.9	-33.4	177.4	179.1	0	0	0	0	111.3	R191 F194 M195 I198 I222 L223 Q224 E229 L230	R191-V226 HydrophobicContact CG-CG2 3.9Å; F194-V226 HydrophobicContact CD1-CG1 3.84Å; F194-V226 HydrophobicContact CE1-CG1 4.34Å; M195-V226 HydrophobicContact SD-CG1 3.98Å; I198-V226 HydrophobicContact CD1-CG1 3.42Å; I198-V226 VanDerWaalsContact CD1-CG1 3.42Å; I222-V226 WeakPolarHBondContact O-CG2 3.27Å; L223-V226 PolarHBondContact O-N 2.97Å; Q224-V226 PolarHBondContact O-N 3.34Å; V226-E229 PolarHBondContact O-N 3.05Å; V226-L230 PolarHBondContact O-N 3.17Å
227	I	88.5	Confident	84.7	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-65.5	-41.9	172.9	-69.6	166.8	0	0	0	111.1	F194 L209 V216 F219 L223 Q224 L225 E229 L230 I231	F194-I227 HydrophobicContact CD1-CG1 4.24Å; F194-I227 HydrophobicContact CE1-CB 4.42Å; F194-I227 HydrophobicContact CE1-CG1 3.56Å; F194-I227 HydrophobicContact CZ-CG1 4.01Å; L209-I227 HydrophobicContact CD1-CD1 4.26Å; L209-I227 HydrophobicContact CD1-CG1 4.34Å; L209-I227 HydrophobicContact CD1-CG2 3.81Å; L209-I227 HydrophobicContact CD2-CG2 4.19Å; V216-I227 HydrophobicContact CG1-CD1 3.97Å; V216-I227 HydrophobicContact CG1-CG2 4.3Å; V216-I227 HydrophobicContact CG2-CD1 4.4Å; F219-I227 HydrophobicContact CD2-CD1 3.82Å; F219-I227 HydrophobicContact CE2-CD1 4.2Å; L223-I227 HydrophobicContact CD1-CD1 4.33Å; L223-I227 HydrophobicContact CD1-CG1 4.44Å; L223-I227 HydrophobicContact CG-CD1 3.94Å; L223-I227 HydrophobicContact CG-CG1 4.5Å; L223-I227 WeakPolarHBondContact O-CG1 3.5Å; L223-I227 PolarHBondContact O-N 3.45Å; Q224-I227 WeakPolarHBondContact O-CB 3.17Å; Q224-I227 PolarHBondContact O-N 2.79Å; L225-I227 VanDerWaalsContact C-N 3.29Å; L225-I227 PolarHBondContact O-N 2.95Å; I227-E229 VanDerWaalsContact C-N 3.32Å; I227-E229 PolarHBondContact O-N 3.48Å; I227-L230 PolarHBondContact O-N 3.27Å; I227-I231 HydrophobicContact CG2-CD1 3.74Å; I227-I231 HydrophobicContact CG2-CG1 4.32Å; I227-I231 WeakPolarHBondContact O-CB 3.28Å; I227-I231 VanDerWaalsContact O-CG1 3.28Å; I227-I231 WeakPolarHBondContact O-CG1 3.35Å; I227-I231 PolarHBondContact O-N 3.42Å
228	V	88	Confident	84.6	Confident	4 Å²	4	38 Å²	38	2%	0.024	21%	0.212	C	C	.	.	H	α-helix	trans	-60.3	-44.2	174.8	176.2	0	0	0	0	110.6	Q224 L225 L230 I231 Y232 I249 L252 E263 A264 T267	Q224-V228 WeakPolarHBondContact O-CG2 3.42Å; Q224-V228 PolarHBondContact O-N 3.08Å; L225-V228 PolarHBondContact O-N 3.47Å; V228-L230 PolarHBondContact O-N 3.48Å; V228-I231 PolarHBondContact O-N 3.34Å; V228-Y232 WeakPolarHBondContact O-CB 3.41Å; V228-Y232 PolarHBondContact O-N 2.99Å; V228-I249 HydrophobicContact CG1-CD1 4.46Å; V228-I249 HydrophobicContact CG2-CD1 4.31Å; V228-L252 HydrophobicContact CG2-CD1 3.66Å; V228-E263 HydrophobicContact CG1-CB 4.23Å; V228-A264 HydrophobicContact CG2-CB 4.45Å; V228-T267 HydrophobicContact CG1-CG2 4.32Å; V228-T267 WeakPolarHBondContact CG1-OG1 3.49Å
229	E	84.1	Confident	84.3	Confident	42 Å²	42	36.1 Å²	36.1	20%	0.196	20%	0.202	C	C	.	.	H	α-helix	trans	-60.3	-43.1	176.3	-170	-172	160.6	0	0	112.2	L225 V226 I227 Y232 K233	L225-E229 PolarHBondContact O-N 2.98Å; V226-E229 PolarHBondContact O-N 3.05Å; I227-E229 VanDerWaalsContact C-N 3.32Å; I227-E229 PolarHBondContact O-N 3.48Å; E229-Y232 WeakPolarHBondContact O-CB 3.48Å; E229-Y232 PolarHBondContact O-N 2.87Å; E229-K233 WeakPolarHBondContact O-CG 3.35Å; E229-K233 PolarHBondContact O-N 3.3Å; E229-K233 VanDerWaalsContact O-N 3.09Å; E229-K233 WeakPolarHBondContact OE1-CE 3.39Å; E229-K233 IonicContact OE1-NZ 2.73Å; E229-K233 PolarHBondContact OE1-NZ 3.37Å
230	L	85.3	Confident	84	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-62.9	-48.7	175.2	178.4	60.9	0	0	0	111.5	F194 I198 A205 L209 V226 I227 V228 Y232 K233 V234	F194-L230 HydrophobicContact CE1-CB 4.43Å; F194-L230 HydrophobicContact CE1-CD2 3.94Å; F194-L230 HydrophobicContact CE2-CD2 4.21Å; F194-L230 HydrophobicContact CZ-CD2 3.38Å; I198-L230 HydrophobicContact CB-CD1 4.48Å; I198-L230 HydrophobicContact CD1-CB 3.88Å; I198-L230 HydrophobicContact CD1-CD1 4.43Å; I198-L230 HydrophobicContact CD1-CD2 4.43Å; I198-L230 HydrophobicContact CD1-CG 4.46Å; I198-L230 HydrophobicContact CG1-CB 4.28Å; I198-L230 HydrophobicContact CG1-CD1 3.93Å; I198-L230 HydrophobicContact CG1-CD2 4.13Å; I198-L230 HydrophobicContact CG1-CG 4.32Å; I198-L230 HydrophobicContact CG2-CD1 4.07Å; A205-L230 HydrophobicContact CB-CD2 4.18Å; L209-L230 HydrophobicContact CD2-CD2 4.22Å; V226-L230 PolarHBondContact O-N 3.17Å; I227-L230 PolarHBondContact O-N 3.27Å; V228-L230 PolarHBondContact O-N 3.48Å; L230-Y232 PolarHBondContact O-N 3.11Å; L230-K233 PolarHBondContact O-N 3.15Å; L230-V234 HydrophobicContact CD1-CG2 3.48Å; L230-V234 VanDerWaalsContact CD1-CG2 3.48Å; L230-V234 HydrophobicContact CG-CG2 4Å; L230-V234 WeakPolarHBondContact O-CB 3.44Å; L230-V234 VanDerWaalsContact O-CG2 3.32Å; L230-V234 WeakPolarHBondContact O-CG2 3.48Å; L230-V234 PolarHBondContact O-N 3.48Å
231	I	85.3	Confident	83.6	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-56.7	-43.6	-179.7	-74.3	170.3	0	0	0	110	L209 I227 V228 C235 F245 C248 I249 T267 L271	L209-I231 HydrophobicContact CD2-CG1 4.24Å; I227-I231 HydrophobicContact CG2-CD1 3.74Å; I227-I231 HydrophobicContact CG2-CG1 4.32Å; I227-I231 WeakPolarHBondContact O-CB 3.28Å; I227-I231 VanDerWaalsContact O-CG1 3.28Å; I227-I231 WeakPolarHBondContact O-CG1 3.35Å; I227-I231 PolarHBondContact O-N 3.42Å; V228-I231 PolarHBondContact O-N 3.34Å; I231-C235 WeakPolarHBondContact O-CB 3.13Å; I231-C235 PolarHBondContact O-N 3Å; I231-C235 PolarHBondContact O-SG 2.84Å; I231-F245 HydrophobicContact CD1-CB 4.44Å; I231-F245 HydrophobicContact CD1-CD1 4.1Å; I231-F245 HydrophobicContact CG1-CB 4.19Å; I231-F245 HydrophobicContact CG1-CD1 3.75Å; I231-F245 HydrophobicContact CG1-CE1 4.4Å; I231-F245 HydrophobicContact CG1-CG 4.04Å; I231-F245 HydrophobicContact CG2-CB 3.68Å; I231-F245 HydrophobicContact CG2-CG 4.25Å; I231-C248 HydrophobicContact CD1-CB 4.18Å; I231-I249 HydrophobicContact CB-CD1 4.4Å; I231-I249 HydrophobicContact CD1-CD1 3.96Å; I231-I249 HydrophobicContact CD1-CG1 4.29Å; I231-I249 HydrophobicContact CG2-CD1 3.91Å; I231-I249 HydrophobicContact CG2-CG1 3.92Å; I231-T267 HydrophobicContact CG2-CG2 4.49Å; I231-L271 HydrophobicContact CG2-CD1 3.82Å
232	Y	83.4	Confident	83.3	Confident	21 Å²	21	42 Å²	42	8%	0.082	23%	0.226	C	C	.	.	H	α-helix	trans	-56.8	-55.5	175.4	-177.4	-86.5	0	0	0	111.7	V228 E229 L230 V234 C235 H236 T267 T270 D687 Q688	V228-Y232 WeakPolarHBondContact O-CB 3.41Å; V228-Y232 PolarHBondContact O-N 2.99Å; E229-Y232 WeakPolarHBondContact O-CB 3.48Å; E229-Y232 PolarHBondContact O-N 2.87Å; L230-Y232 PolarHBondContact O-N 3.11Å; Y232-V234 PolarHBondContact O-N 3Å; Y232-C235 PolarHBondContact O-N 3.49Å; Y232-H236 WeakPolarHBondContact O-CB 3.48Å; Y232-H236 PolarHBondContact O-N 3.07Å; Y232-H236 VanDerWaalsContact O-N 3.14Å; Y232-T267 HydrophobicContact CD2-CG2 4.21Å; Y232-T270 HydrophobicContact CD2-CG2 4.48Å; Y232-T270 HydrophobicContact CE2-CG2 3.65Å; Y232-D687 WeakPolarHBondContact CE1-OD1 3.39Å; Y232-D687 WeakPolarHBondContact OH-CA 3.34Å; Y232-D687 PolarHBondContact OH-OD1 3.42Å; Y232-Q688 PolarHBondContact OH-N 2.89Å
233	K	82.1	Confident	83	Confident	68 Å²	68	41.5 Å²	41.5	30%	0.296	24%	0.236	S	C	.	.	H	α-helix	trans	-60.8	-45.5	-178.4	-73.2	178.3	-176.2	166.4	0	112.4	E229 L230 H236 A237	E229-K233 WeakPolarHBondContact O-CG 3.35Å; E229-K233 PolarHBondContact O-N 3.3Å; E229-K233 VanDerWaalsContact O-N 3.09Å; E229-K233 WeakPolarHBondContact OE1-CE 3.39Å; E229-K233 IonicContact OE1-NZ 2.73Å; E229-K233 PolarHBondContact OE1-NZ 3.37Å; L230-K233 PolarHBondContact O-N 3.15Å; K233-H236 PolarHBondContact O-N 3.33Å; K233-A237 PolarHBondContact O-N 2.9Å
234	V	81.3	Confident	82.5	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.018	26%	0.255	C	S	.	.	H	α-helix	trans	-69.3	-42.4	-176.7	171.2	0	0	0	0	111.2	L206 L230 Y232 H236 A237 N238 F245	L206-V234 HydrophobicContact CD1-CG1 4.13Å; L206-V234 HydrophobicContact CD1-CG2 4.32Å; L206-V234 HydrophobicContact CD2-CB 4.36Å; L206-V234 HydrophobicContact CD2-CG1 3.88Å; L206-V234 HydrophobicContact CD2-CG2 3.91Å; L206-V234 HydrophobicContact CG-CG2 4.42Å; L230-V234 HydrophobicContact CD1-CG2 3.48Å; L230-V234 VanDerWaalsContact CD1-CG2 3.48Å; L230-V234 HydrophobicContact CG-CG2 4Å; L230-V234 WeakPolarHBondContact O-CB 3.44Å; L230-V234 VanDerWaalsContact O-CG2 3.32Å; L230-V234 WeakPolarHBondContact O-CG2 3.48Å; L230-V234 PolarHBondContact O-N 3.48Å; Y232-V234 PolarHBondContact O-N 3Å; V234-H236 PolarHBondContact O-N 3.32Å; V234-A237 PolarHBondContact O-N 3.09Å; V234-N238 PolarHBondContact O-N 3.22Å; V234-F245 HydrophobicContact CG1-CE2 4.02Å
235	C	79.9	Confident	82.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-70	-21	179	-70.6	0	0	0	0	113.1	I231 Y232 R242 L271	I231-C235 WeakPolarHBondContact O-CB 3.13Å; I231-C235 PolarHBondContact O-N 3Å; I231-C235 PolarHBondContact O-SG 2.84Å; Y232-C235 PolarHBondContact O-N 3.49Å; C235-R242 HydrophobicContact CB-CG 3.89Å; C235-R242 PolarHBondContact O-NE 3.47Å; C235-R242 PolarHBondContact O-NH2 3.46Å; C235-L271 HydrophobicContact CB-CD1 4.11Å; C235-L271 HydrophobicContact CB-CD2 3.36Å; C235-L271 HydrophobicContact CB-CG 4.35Å
236	H	77.6	Confident	82.2	Confident	97 Å²	97	45.3 Å²	45.3	45%	0.449	25%	0.248	S	C	.	.	H	α-helix	trans	-77	-46.6	170.9	-161.1	92	0	0	0	111.1	Y232 K233 V234	Y232-H236 WeakPolarHBondContact O-CB 3.48Å; Y232-H236 PolarHBondContact O-N 3.07Å; Y232-H236 VanDerWaalsContact O-N 3.14Å; K233-H236 PolarHBondContact O-N 3.33Å; V234-H236 PolarHBondContact O-N 3.32Å
237	A	80.1	Confident	82.1	Confident	64 Å²	64	52.5 Å²	52.5	53%	0.529	27%	0.274	S	S	.	.	H	α-helix	trans	-67.2	-44.6	177.8	0	0	0	0	0	113	K233 V234	K233-A237 PolarHBondContact O-N 2.9Å; V234-A237 PolarHBondContact O-N 3.09Å
238	N	79.6	Confident	81.9	Confident	84 Å²	84	52.5 Å²	52.5	45%	0.449	27%	0.274	S	S	.	.			trans	-126.4	93	-173.8	-68.5	-27.6	0	0	0	111.2	V234 S240 E241	V234-N238 PolarHBondContact O-N 3.22Å; N238-S240 PolarHBondContact O-N 3.18Å; N238-S240 VanDerWaalsContact O-N 3.14Å; N238-E241 PolarHBondContact O-N 3.44Å
239	P	78.9	Confident	82	Confident	75 Å²	75	52.3 Å²	52.3	49%	0.487	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-62.6	-19.1	-179	-27.1	36.3	0	0	0	115.9	E241 R242	P239-E241 VanDerWaalsContact C-N 3.33Å; P239-E241 PolarHBondContact O-N 3.37Å; P239-R242 WeakPolarHBondContact O-CB 3.39Å; P239-R242 WeakPolarHBondContact O-CD 3.42Å; P239-R242 VanDerWaalsContact O-CG 3.27Å; P239-R242 WeakPolarHBondContact O-CG 3.36Å; P239-R242 PolarHBondContact O-N 2.77Å
240	S	79.4	Confident	82.2	Confident	99 Å²	99	53.8 Å²	53.8	69%	0.692	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-65.4	-33	-179.7	51.3	0	0	0	0	113.3	N238 R242	N238-S240 PolarHBondContact O-N 3.18Å; N238-S240 VanDerWaalsContact O-N 3.14Å; S240-R242 VanDerWaalsContact C-N 3.29Å; S240-R242 PolarHBondContact O-N 3.04Å
241	E	76.2	Confident	82.3	Confident	67 Å²	67	56 Å²	56	31%	0.313	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-82.6	-4.7	-177.4	-66.3	-59.8	132.2	0	0	113.3	N238 P239 A243 R244 F245	N238-E241 PolarHBondContact O-N 3.44Å; P239-E241 VanDerWaalsContact C-N 3.33Å; P239-E241 PolarHBondContact O-N 3.37Å; E241-A243 VanDerWaalsContact C-N 3.33Å; E241-A243 PolarHBondContact O-N 3.23Å; E241-R244 WeakPolarHBondContact O-CB 3.19Å; E241-R244 PolarHBondContact O-N 2.96Å; E241-R244 VanDerWaalsContact O-N 3.12Å; E241-R244 IonicContact OE2-NH1 2.89Å; E241-F245 HydrophobicContact CB-CD2 3.93Å; E241-F245 HydrophobicContact CB-CE2 3.73Å; E241-F245 HydrophobicContact CG-CE2 4.45Å; E241-F245 WeakPolarHBondContact O-CD2 3.36Å; E241-F245 PolarHBondContact O-N 3.42Å
242	R	81.4	Confident	82.4	Confident	93 Å²	93	56 Å²	56	35%	0.351	29%	0.289	S	S	.	.	H	α-helix	trans	-54.2	-46	-176.4	-75.1	177.2	-177.8	176.7	2.6	112.9	C235 P239 S240 R244 F245 I246	C235-R242 HydrophobicContact CB-CG 3.89Å; C235-R242 PolarHBondContact O-NE 3.47Å; C235-R242 PolarHBondContact O-NH2 3.46Å; P239-R242 WeakPolarHBondContact O-CB 3.39Å; P239-R242 WeakPolarHBondContact O-CD 3.42Å; P239-R242 VanDerWaalsContact O-CG 3.27Å; P239-R242 WeakPolarHBondContact O-CG 3.36Å; P239-R242 PolarHBondContact O-N 2.77Å; S240-R242 VanDerWaalsContact C-N 3.29Å; S240-R242 PolarHBondContact O-N 3.04Å; R242-R244 PolarHBondContact O-N 3.24Å; R242-F245 PolarHBondContact O-N 3.27Å; R242-I246 HydrophobicContact CB-CD1 4.48Å; R242-I246 WeakPolarHBondContact O-CB 3.42Å; R242-I246 WeakPolarHBondContact O-CD1 3.45Å; R242-I246 WeakPolarHBondContact O-CG1 3.3Å; R242-I246 PolarHBondContact O-N 2.97Å
243	A	79.4	Confident	82.7	Confident	80 Å²	80	55.9 Å²	55.9	66%	0.661	29%	0.29	S	S	*	.	H	α-helix	trans	-60.2	-36.2	-176.9	0	0	0	0	0	112.2	E241	E241-A243 VanDerWaalsContact C-N 3.33Å; E241-A243 PolarHBondContact O-N 3.23Å
244	R	78.4	Confident	82.9	Confident	110 Å²	110	59.1 Å²	59.1	42%	0.415	31%	0.306	S	S	.	.	H	α-helix	trans	-69.8	-46.4	179.6	-171.9	-179	-174.1	-176.2	1.2	111.6	S210 I213 E241 R242	S210-R244 PolarHBondContact OG-NH1 2.88Å; S210-R244 PolarHBondContact OG-NH2 3.2Å; I213-R244 HydrophobicContact CD1-CG 4.14Å; E241-R244 WeakPolarHBondContact O-CB 3.19Å; E241-R244 PolarHBondContact O-N 2.96Å; E241-R244 VanDerWaalsContact O-N 3.12Å; E241-R244 IonicContact OE2-NH1 2.89Å; R242-R244 PolarHBondContact O-N 3.24Å
245	F	84.8	Confident	83.2	Confident	1 Å²	1	59.1 Å²	59.1	0%	0.004	31%	0.306	C	S	.	.	H	α-helix	trans	-78.8	-24.9	-177	-67.3	-58.8	0	0	0	114.2	L206 L209 I213 I231 V234 E241 R242 R247 C248 I249	L206-F245 HydrophobicContact CD2-CE2 4.04Å; L206-F245 HydrophobicContact CD2-CZ 3.55Å; L209-F245 HydrophobicContact CD2-CD1 4.19Å; L209-F245 HydrophobicContact CD2-CE1 3.52Å; L209-F245 HydrophobicContact CD2-CZ 4.31Å; L209-F245 HydrophobicContact CG-CE1 4.17Å; I213-F245 HydrophobicContact CD1-CD1 4.33Å; I213-F245 HydrophobicContact CD1-CE1 4.43Å; I231-F245 HydrophobicContact CD1-CB 4.44Å; I231-F245 HydrophobicContact CD1-CD1 4.1Å; I231-F245 HydrophobicContact CG1-CB 4.19Å; I231-F245 HydrophobicContact CG1-CD1 3.75Å; I231-F245 HydrophobicContact CG1-CE1 4.4Å; I231-F245 HydrophobicContact CG1-CG 4.04Å; I231-F245 HydrophobicContact CG2-CB 3.68Å; I231-F245 HydrophobicContact CG2-CG 4.25Å; V234-F245 HydrophobicContact CG1-CE2 4.02Å; E241-F245 HydrophobicContact CB-CD2 3.93Å; E241-F245 HydrophobicContact CB-CE2 3.73Å; E241-F245 HydrophobicContact CG-CE2 4.45Å; E241-F245 WeakPolarHBondContact O-CD2 3.36Å; E241-F245 PolarHBondContact O-N 3.42Å; R242-F245 PolarHBondContact O-N 3.27Å; F245-R247 PolarHBondContact O-N 3.38Å; F245-C248 WeakPolarHBondContact O-CA 3.39Å; F245-C248 VanDerWaalsContact O-CB 3.31Å; F245-C248 WeakPolarHBondContact O-CB 3.31Å; F245-C248 PolarHBondContact O-N 3.3Å; F245-I249 WeakPolarHBondContact O-CG1 3.27Å; F245-I249 PolarHBondContact O-N 3.08Å
246	I	85	Confident	83.5	Confident	33 Å²	33	64.8 Å²	64.8	17%	0.169	35%	0.346	C	S	.	.	H	α-helix	trans	-55.8	-41.4	172.7	-76.5	165.7	0	0	0	110.8	R242 C248 I249 Y250 L268	R242-I246 HydrophobicContact CB-CD1 4.48Å; R242-I246 WeakPolarHBondContact O-CB 3.42Å; R242-I246 WeakPolarHBondContact O-CD1 3.45Å; R242-I246 WeakPolarHBondContact O-CG1 3.3Å; R242-I246 PolarHBondContact O-N 2.97Å; I246-C248 VanDerWaalsContact C-N 3.33Å; I246-C248 PolarHBondContact O-N 2.89Å; I246-I249 PolarHBondContact O-N 3.28Å; I246-Y250 HydrophobicContact CG2-CD2 3.71Å; I246-Y250 HydrophobicContact CG2-CE2 3.46Å; I246-Y250 VanDerWaalsContact CG2-CE2 3.46Å; I246-Y250 WeakPolarHBondContact O-CD2 3.43Å; I246-Y250 PolarHBondContact O-N 2.91Å; I246-L268 HydrophobicContact CG2-CD1 4.3Å
247	R	84.3	Confident	84	Confident	159 Å²	159	61 Å²	61	60%	0.6	33%	0.33	S	S	*	.	H	α-helix	trans	-60.8	-40.9	175	-179.5	177.2	160.9	178	-12.6	112.1	D214 F245 Y250 N251	D214-R247 IonicContact OD1-CZ 3.64Å; D214-R247 IonicContact OD1-NE 2.74Å; D214-R247 IonicContact OD1-NH2 3.31Å; D214-R247 PolarHBondContact OD1-NH2 3.02Å; F245-R247 PolarHBondContact O-N 3.38Å; R247-Y250 PolarHBondContact O-N 2.85Å; R247-N251 PolarHBondContact O-N 3.48Å
248	C	85.9	Confident	84.4	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.007	32%	0.321	C	S	.	.	H	α-helix	trans	-63.3	-41.9	175.7	-172.7	0	0	0	0	111.7	I213 I231 F245 I246 N251 L252	I213-C248 HydrophobicContact CD1-CB 4.11Å; I213-C248 HydrophobicContact CG1-CB 3.83Å; I231-C248 HydrophobicContact CD1-CB 4.18Å; F245-C248 WeakPolarHBondContact O-CA 3.39Å; F245-C248 VanDerWaalsContact O-CB 3.31Å; F245-C248 WeakPolarHBondContact O-CB 3.31Å; F245-C248 PolarHBondContact O-N 3.3Å; I246-C248 VanDerWaalsContact C-N 3.33Å; I246-C248 PolarHBondContact O-N 2.89Å; C248-N251 WeakPolarHBondContact O-CB 3.33Å; C248-N251 PolarHBondContact O-N 3.04Å; C248-L252 WeakPolarHBondContact O-CG 3.03Å; C248-L252 PolarHBondContact O-N 2.99Å; C248-L252 VanDerWaalsContact O-N 3.09Å
249	I	88.8	Confident	84.8	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65	-39.5	178.3	-64.6	-71.1	0	0	0	111.3	V228 I231 F245 I246 N251 L252 L253 A264 T267 L268	V228-I249 HydrophobicContact CG1-CD1 4.46Å; V228-I249 HydrophobicContact CG2-CD1 4.31Å; I231-I249 HydrophobicContact CB-CD1 4.4Å; I231-I249 HydrophobicContact CD1-CD1 3.96Å; I231-I249 HydrophobicContact CD1-CG1 4.29Å; I231-I249 HydrophobicContact CG2-CD1 3.91Å; I231-I249 HydrophobicContact CG2-CG1 3.92Å; F245-I249 WeakPolarHBondContact O-CG1 3.27Å; F245-I249 PolarHBondContact O-N 3.08Å; I246-I249 PolarHBondContact O-N 3.28Å; I249-N251 VanDerWaalsContact C-N 3.29Å; I249-N251 PolarHBondContact O-N 3.04Å; I249-L252 HydrophobicContact CD1-CD1 4.19Å; I249-L252 WeakPolarHBondContact O-CB 3.45Å; I249-L252 PolarHBondContact O-N 3.23Å; I249-L253 PolarHBondContact O-N 2.9Å; I249-A264 HydrophobicContact CG2-CB 4.31Å; I249-A264 VanDerWaalsContact CG2-O 3.29Å; I249-A264 WeakPolarHBondContact CG2-O 3.47Å; I249-T267 HydrophobicContact CD1-CG2 4.05Å; I249-L268 HydrophobicContact CG2-CB 3.77Å; I249-L268 HydrophobicContact CG2-CD1 4.16Å; I249-L268 HydrophobicContact CG2-CG 4.38Å
250	Y	88.5	Confident	85.3	Confident	72 Å²	72	55.3 Å²	55.3	28%	0.282	30%	0.297	S	S	.	.	H	α-helix	trans	-57.6	-39.8	172.7	-84.9	-68.3	0	0	0	113	I246 R247 L252 L253 L268 T276 A277 A280	I246-Y250 HydrophobicContact CG2-CD2 3.71Å; I246-Y250 HydrophobicContact CG2-CE2 3.46Å; I246-Y250 VanDerWaalsContact CG2-CE2 3.46Å; I246-Y250 WeakPolarHBondContact O-CD2 3.43Å; I246-Y250 PolarHBondContact O-N 2.91Å; R247-Y250 PolarHBondContact O-N 2.85Å; Y250-L252 VanDerWaalsContact C-N 3.32Å; Y250-L253 HydrophobicContact CD1-CD1 4.14Å; Y250-L253 PolarHBondContact O-N 2.84Å; Y250-L268 HydrophobicContact CD1-CD2 4.47Å; Y250-L268 HydrophobicContact CE1-CD2 4.13Å; Y250-T276 PolarHBondContact OH-O 3.12Å; Y250-A277 WeakPolarHBondContact OH-CA 3.24Å; Y250-A277 PolarHBondContact OH-N 3.24Å; Y250-A280 HydrophobicContact CD1-CB 4.3Å; Y250-A280 HydrophobicContact CE1-CB 3.6Å
251	N	86.9	Confident	85.9	Confident	48 Å²	48	52.7 Å²	52.7	26%	0.257	27%	0.273	S	S	.	.	H	α-helix	trans	-66.4	-35.9	175	-67.5	-13.7	0	0	0	111.7	R247 C248 I249 Q254	R247-N251 PolarHBondContact O-N 3.48Å; C248-N251 WeakPolarHBondContact O-CB 3.33Å; C248-N251 PolarHBondContact O-N 3.04Å; I249-N251 VanDerWaalsContact C-N 3.29Å; I249-N251 PolarHBondContact O-N 3.04Å; N251-Q254 PolarHBondContact O-N 3.49Å
252	L	89.1	Confident	86.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-71	-26.6	179	-74	170.6	0	0	0	113.6	V216 Q224 V228 C248 I249 Y250 Q254 S255 V260 A264	V216-L252 HydrophobicContact CG1-CD1 4.25Å; V216-L252 HydrophobicContact CG1-CD2 3.66Å; V216-L252 HydrophobicContact CG1-CG 4.12Å; Q224-L252 HydrophobicContact CB-CD2 3.98Å; Q224-L252 HydrophobicContact CG-CD2 3.86Å; V228-L252 HydrophobicContact CG2-CD1 3.66Å; C248-L252 WeakPolarHBondContact O-CG 3.03Å; C248-L252 PolarHBondContact O-N 2.99Å; C248-L252 VanDerWaalsContact O-N 3.09Å; I249-L252 HydrophobicContact CD1-CD1 4.19Å; I249-L252 WeakPolarHBondContact O-CB 3.45Å; I249-L252 PolarHBondContact O-N 3.23Å; Y250-L252 VanDerWaalsContact C-N 3.32Å; L252-Q254 PolarHBondContact O-N 2.94Å; L252-Q254 VanDerWaalsContact O-N 3.15Å; L252-S255 VanDerWaalsContact O-CB 3.23Å; L252-S255 WeakPolarHBondContact O-CB 3.34Å; L252-S255 PolarHBondContact O-N 3.11Å; L252-V260 HydrophobicContact CB-CG1 4.41Å; L252-V260 HydrophobicContact CD2-CG1 3.99Å; L252-A264 HydrophobicContact CB-CB 3.95Å
253	L	88.6	Confident	86.9	Confident	19 Å²	19	51.5 Å²	51.5	10%	0.099	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-23.3	171	-64.7	-179.9	0	0	0	112.6	I249 Y250 K261 A264 A265 L268 A280 C284	I249-L253 PolarHBondContact O-N 2.9Å; Y250-L253 HydrophobicContact CD1-CD1 4.14Å; Y250-L253 PolarHBondContact O-N 2.84Å; L253-K261 WeakPolarHBondContact O-CG 3.41Å; L253-A264 HydrophobicContact CD2-CB 3.98Å; L253-A265 HydrophobicContact CD2-CB 3.88Å; L253-L268 HydrophobicContact CD1-CD2 3.79Å; L253-A280 HydrophobicContact CD1-CB 4.15Å; L253-C284 HydrophobicContact CD2-CB 4.14Å
254	Q	86.6	Confident	87.5	Confident	137 Å²	137	47.7 Å²	47.7	64%	0.64	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.5	13.2	177.3	-58	-176.5	2.1	0	0	113.3	Q217 N251 L252	Q217-Q254 PolarHBondContact NE2-O 3.32Å; N251-Q254 PolarHBondContact O-N 3.49Å; L252-Q254 PolarHBondContact O-N 2.94Å; L252-Q254 VanDerWaalsContact O-N 3.15Å
255	S	87.3	Confident	88	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.021	22%	0.218	C	C	.	.			trans	-60.3	162.1	176.4	-176.3	0	0	0	0	111.7	Q224 L252 S257 K261	Q224-S255 PolarHBondContact OE1-OG 2.96Å; L252-S255 VanDerWaalsContact O-CB 3.23Å; L252-S255 WeakPolarHBondContact O-CB 3.34Å; L252-S255 PolarHBondContact O-N 3.11Å; S255-S257 PolarHBondContact OG-N 2.94Å; S255-K261 WeakPolarHBondContact O-CE 3.34Å; S255-K261 PolarHBondContact O-NZ 3.25Å
256	S	85.8	Confident	88.2	Confident	119 Å²	119	43 Å²	43	83%	0.832	22%	0.223	S	C	*	.	S	Bend	trans	-77.7	-26	171.4	53.8	0	0	0	0	112.2
257	S	89.1	Confident	88.3	Confident	17 Å²	17	41.7 Å²	41.7	12%	0.119	22%	0.217	C	C	.	.			trans	-83.6	125.8	-174.9	178.9	0	0	0	0	112.3	S255 A259 V260 K261	S255-S257 PolarHBondContact OG-N 2.94Å; S257-A259 VanDerWaalsContact C-N 3.34Å; S257-A259 PolarHBondContact O-N 2.91Å; S257-V260 PolarHBondContact O-N 2.75Å; S257-K261 WeakPolarHBondContact O-CG 3.45Å; S257-K261 PolarHBondContact O-N 3.3Å
258	P	88.1	Confident	88.5	Confident	53 Å²	53	34.1 Å²	34.1	34%	0.344	19%	0.189	S	C	.	.	H	α-helix	trans	-60.1	-39.1	175.2	-24.3	34.3	0	0	0	113.5	V260 K261 Y262 L288 E292	P258-V260 PolarHBondContact O-N 3.12Å; P258-K261 WeakPolarHBondContact O-CB 3.42Å; P258-K261 PolarHBondContact O-N 3.38Å; P258-Y262 WeakPolarHBondContact O-CB 3.38Å; P258-Y262 PolarHBondContact O-N 3.11Å; P258-L288 HydrophobicContact CB-CD1 3.91Å; P258-L288 WeakPolarHBondContact O-CD1 3.31Å; P258-E292 WeakPolarHBondContact CB-OE1 3.41Å; P258-E292 WeakPolarHBondContact CG-OE1 3.42Å
259	A	88.6	Confident	88.5	Confident	51 Å²	51	34.7 Å²	34.7	42%	0.421	19%	0.192	S	C	.	.	H	α-helix	trans	-62.5	-42.7	179.3	0	0	0	0	0	111.8	S257 Y262 E263	S257-A259 VanDerWaalsContact C-N 3.34Å; S257-A259 PolarHBondContact O-N 2.91Å; A259-Y262 PolarHBondContact O-N 3.27Å; A259-E263 PolarHBondContact O-N 2.91Å; A259-E263 VanDerWaalsContact O-N 3.08Å
260	V	90.2	Very high	88.3	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-64.1	-42.1	176.8	177.3	0	0	0	0	110.8	D221 Q224 L225 L252 S257 P258 A264	D221-V260 HydrophobicContact CB-CG2 4.18Å; Q224-V260 HydrophobicContact CB-CG1 3.95Å; Q224-V260 HydrophobicContact CB-CG2 3.88Å; L225-V260 HydrophobicContact CD2-CB 4.5Å; L225-V260 HydrophobicContact CD2-CG2 3.95Å; L225-V260 HydrophobicContact CG-CG2 3.91Å; L252-V260 HydrophobicContact CB-CG1 4.41Å; L252-V260 HydrophobicContact CD2-CG1 3.99Å; S257-V260 PolarHBondContact O-N 2.75Å; P258-V260 PolarHBondContact O-N 3.12Å; V260-A264 WeakPolarHBondContact O-CB 3.41Å; V260-A264 PolarHBondContact O-N 2.89Å
261	K	91	Very high	88	Confident	43 Å²	43	32.8 Å²	32.8	19%	0.187	19%	0.187	C	C	.	.	H	α-helix	trans	-60.6	-46.7	176.8	-73.5	-174.4	-171	176.1	0	112.5	L253 S255 S257 P258 A264 A265 L288	L253-K261 WeakPolarHBondContact O-CG 3.41Å; S255-K261 WeakPolarHBondContact O-CE 3.34Å; S255-K261 PolarHBondContact O-NZ 3.25Å; S257-K261 WeakPolarHBondContact O-CG 3.45Å; S257-K261 PolarHBondContact O-N 3.3Å; P258-K261 WeakPolarHBondContact O-CB 3.42Å; P258-K261 PolarHBondContact O-N 3.38Å; K261-A264 PolarHBondContact O-N 3.47Å; K261-A265 VanDerWaalsContact O-CB 3.29Å; K261-A265 WeakPolarHBondContact O-CB 3.47Å; K261-A265 PolarHBondContact O-N 3.34Å; K261-L288 HydrophobicContact CB-CD1 4.09Å
262	Y	90.5	Very high	87.9	Confident	47 Å²	47	31.5 Å²	31.5	18%	0.184	18%	0.182	C	C	.	.	H	α-helix	trans	-60.8	-49.4	-179.4	178.1	-97	0	0	0	111.4	P258 A259 A265 G266 Y285 V301 R304	P258-Y262 WeakPolarHBondContact O-CB 3.38Å; P258-Y262 PolarHBondContact O-N 3.11Å; A259-Y262 PolarHBondContact O-N 3.27Å; Y262-A265 PolarHBondContact O-N 2.86Å; Y262-G266 PolarHBondContact O-N 3.16Å; Y262-Y285 HydrophobicContact CD2-CD1 4.18Å; Y262-Y285 AromaticContact CD2-CE1 3.7Å; Y262-Y285 HydrophobicContact CD2-CE1 3.7Å; Y262-Y285 HydrophobicContact CE2-CE1 4.01Å; Y262-Y285 HydrophobicContact CG-CE1 4.48Å; Y262-V301 HydrophobicContact CD2-CG2 3.82Å; Y262-V301 HydrophobicContact CE2-CG2 3.84Å; Y262-R304 HydrophobicContact CE2-CG 4.19Å; Y262-R304 WeakPolarHBondContact OH-CG 3.41Å; Y262-R304 PolarHBondContact OH-NE 2.85Å
263	E	88.8	Confident	87.5	Confident	89 Å²	89	35.8 Å²	35.8	42%	0.416	21%	0.212	S	C	.	.	H	α-helix	trans	-69.1	-38.6	179.3	-70.1	-60.9	162.9	0	0	112.9	L225 V228 A259 G266 T267	L225-E263 HydrophobicContact CD2-CB 4.28Å; L225-E263 HydrophobicContact CD2-CG 4.07Å; V228-E263 HydrophobicContact CG1-CB 4.23Å; A259-E263 PolarHBondContact O-N 2.91Å; A259-E263 VanDerWaalsContact O-N 3.08Å; E263-G266 PolarHBondContact O-N 3.35Å; E263-T267 VanDerWaalsContact O-CB 3.31Å; E263-T267 WeakPolarHBondContact O-CB 3.38Å; E263-T267 PolarHBondContact O-N 2.67Å; E263-T267 PolarHBondContact O-OG1 3.46Å
264	A	90.6	Very high	87.4	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.1	-40.7	175.7	0	0	0	0	0	111.6	V228 I249 L252 L253 V260 K261 L268	V228-A264 HydrophobicContact CG2-CB 4.45Å; I249-A264 HydrophobicContact CG2-CB 4.31Å; I249-A264 VanDerWaalsContact CG2-O 3.29Å; I249-A264 WeakPolarHBondContact CG2-O 3.47Å; L252-A264 HydrophobicContact CB-CB 3.95Å; L253-A264 HydrophobicContact CD2-CB 3.98Å; V260-A264 WeakPolarHBondContact O-CB 3.41Å; V260-A264 PolarHBondContact O-N 2.89Å; K261-A264 PolarHBondContact O-N 3.47Å; A264-L268 WeakPolarHBondContact O-CB 3.23Å; A264-L268 PolarHBondContact O-N 3.09Å
265	A	89.9	Confident	87.4	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.2	-43.2	175.6	0	0	0	0	0	111.9	L253 K261 Y262 L268 V269 A281 C284 Y285	L253-A265 HydrophobicContact CD2-CB 3.88Å; K261-A265 VanDerWaalsContact O-CB 3.29Å; K261-A265 WeakPolarHBondContact O-CB 3.47Å; K261-A265 PolarHBondContact O-N 3.34Å; Y262-A265 PolarHBondContact O-N 2.86Å; A265-L268 PolarHBondContact O-N 3.34Å; A265-V269 WeakPolarHBondContact O-CG2 3.41Å; A265-V269 PolarHBondContact O-N 3.1Å; A265-V269 VanDerWaalsContact O-N 3.1Å; A265-A281 HydrophobicContact CB-CB 4.19Å; A265-C284 HydrophobicContact CB-CB 4.36Å; A265-Y285 HydrophobicContact CB-CD1 4.14Å; A265-Y285 HydrophobicContact CB-CE1 3.6Å; A265-Y285 HydrophobicContact CB-CE2 4.04Å
266	G	88.8	Confident	87.5	Confident	11 Å²	11	38.8 Å²	38.8	11%	0.113	25%	0.246	C	C	.	.	H	α-helix	trans	-64.9	-42.3	177.7	0	0	0	0	0	112.2	Y262 E263 L268 V269 T270 Y285	Y262-G266 PolarHBondContact O-N 3.16Å; E263-G266 PolarHBondContact O-N 3.35Å; G266-L268 PolarHBondContact O-N 3.42Å; G266-V269 PolarHBondContact O-N 2.72Å; G266-T270 PolarHBondContact O-N 3.27Å; G266-T270 VanDerWaalsContact O-N 3.13Å; G266-T270 PolarHBondContact O-OG1 2.77Å; G266-T270 VanDerWaalsContact O-OG1 3.09Å; G266-Y285 WeakPolarHBondContact CA-OH 3.2Å; G266-Y285 PolarHBondContact N-OH 2.65Å
267	T	87.4	Confident	87.6	Confident	6 Å²	6	33.1 Å²	33.1	4%	0.037	21%	0.206	C	C	.	.	H	α-helix	trans	-61.4	-44.2	172.9	-59.7	0	0	0	0	110.7	V228 I231 Y232 I249 E263 V269 T270 L271	V228-T267 HydrophobicContact CG1-CG2 4.32Å; V228-T267 WeakPolarHBondContact CG1-OG1 3.49Å; I231-T267 HydrophobicContact CG2-CG2 4.49Å; Y232-T267 HydrophobicContact CD2-CG2 4.21Å; I249-T267 HydrophobicContact CD1-CG2 4.05Å; E263-T267 VanDerWaalsContact O-CB 3.31Å; E263-T267 WeakPolarHBondContact O-CB 3.38Å; E263-T267 PolarHBondContact O-N 2.67Å; E263-T267 PolarHBondContact O-OG1 3.46Å; T267-V269 PolarHBondContact O-N 3.44Å; T267-T270 CarbonylContact O-C 3.53Å; T267-T270 WeakPolarHBondContact O-CB 3.26Å; T267-T270 PolarHBondContact O-N 2.98Å; T267-T270 VanDerWaalsContact O-N 3.08Å; T267-L271 HydrophobicContact CG2-CD1 3.67Å; T267-L271 HydrophobicContact CG2-CG 3.97Å; T267-L271 VanDerWaalsContact O-CG 3.26Å; T267-L271 WeakPolarHBondContact O-CG 3.46Å; T267-L271 PolarHBondContact O-N 3.06Å
268	L	88.3	Confident	87.6	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60	-45.1	-179.6	-174.5	57.2	0	0	0	112.9	I246 I249 Y250 L253 A264 A265 G266 T270 L271 S272 A277 A280 A281	I246-L268 HydrophobicContact CG2-CD1 4.3Å; I249-L268 HydrophobicContact CG2-CB 3.77Å; I249-L268 HydrophobicContact CG2-CD1 4.16Å; I249-L268 HydrophobicContact CG2-CG 4.38Å; Y250-L268 HydrophobicContact CD1-CD2 4.47Å; Y250-L268 HydrophobicContact CE1-CD2 4.13Å; L253-L268 HydrophobicContact CD1-CD2 3.79Å; A264-L268 WeakPolarHBondContact O-CB 3.23Å; A264-L268 PolarHBondContact O-N 3.09Å; A265-L268 PolarHBondContact O-N 3.34Å; G266-L268 PolarHBondContact O-N 3.42Å; L268-T270 PolarHBondContact O-N 3.33Å; L268-L271 PolarHBondContact O-N 3.48Å; L268-S272 PolarHBondContact O-N 3.14Å; L268-A277 HydrophobicContact CD1-CB 3.99Å; L268-A277 HydrophobicContact CD2-CB 4.31Å; L268-A277 WeakPolarHBondContact CD2-O 3.26Å; L268-A277 HydrophobicContact CG-CB 4.03Å; L268-A280 HydrophobicContact CD2-CB 4.5Å; L268-A281 HydrophobicContact CD2-CB 4.34Å
269	V	86.8	Confident	87.8	Confident	13 Å²	13	33.5 Å²	33.5	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-61.8	-36.5	175.7	172.6	0	0	0	0	111.1	A265 G266 T267 I278 A281 L308 K685	A265-V269 WeakPolarHBondContact O-CG2 3.41Å; A265-V269 PolarHBondContact O-N 3.1Å; A265-V269 VanDerWaalsContact O-N 3.1Å; G266-V269 PolarHBondContact O-N 2.72Å; T267-V269 PolarHBondContact O-N 3.44Å; V269-I278 HydrophobicContact CB-CD1 4.23Å; V269-I278 HydrophobicContact CG1-CD1 4.01Å; V269-I278 HydrophobicContact CG2-CD1 4.04Å; V269-A281 HydrophobicContact CG2-CB 3.59Å; V269-L308 HydrophobicContact CB-CD2 4.27Å; V269-L308 HydrophobicContact CG1-CD2 3.43Å; V269-L308 VanDerWaalsContact CG1-CD2 3.43Å; V269-L308 HydrophobicContact CG2-CD1 4.46Å; V269-L308 HydrophobicContact CG2-CD2 3.9Å; V269-K685 PolarHBondContact O-NZ 2.87Å
270	T	83.8	Confident	87.9	Confident	15 Å²	15	32.1 Å²	32.1	9%	0.092	19%	0.189	C	C	.	.	H	α-helix	trans	-71.4	-38.3	177.7	-61.3	0	0	0	0	111.8	Y232 G266 T267 L268 K685 Q688	Y232-T270 HydrophobicContact CD2-CG2 4.48Å; Y232-T270 HydrophobicContact CE2-CG2 3.65Å; G266-T270 PolarHBondContact O-N 3.27Å; G266-T270 VanDerWaalsContact O-N 3.13Å; G266-T270 PolarHBondContact O-OG1 2.77Å; G266-T270 VanDerWaalsContact O-OG1 3.09Å; T267-T270 CarbonylContact O-C 3.53Å; T267-T270 WeakPolarHBondContact O-CB 3.26Å; T267-T270 PolarHBondContact O-N 2.98Å; T267-T270 VanDerWaalsContact O-N 3.08Å; L268-T270 PolarHBondContact O-N 3.33Å; T270-K685 VanDerWaalsContact C-NZ 3.33Å; T270-K685 HydrophobicContact CG2-CD 3.88Å; T270-K685 WeakPolarHBondContact O-CD 3.33Å; T270-K685 PolarHBondContact O-NZ 3.23Å; T270-Q688 PolarHBondContact OG1-OE1 2.85Å
271	L	83.1	Confident	87.9	Confident	17 Å²	17	32.1 Å²	32.1	9%	0.089	19%	0.189	C	C	.	.	H	α-helix	trans	-81.6	-30.1	-176.7	-64.3	-174.4	0	0	0	114.3	I231 C235 T267 L268	I231-L271 HydrophobicContact CG2-CD1 3.82Å; C235-L271 HydrophobicContact CB-CD1 4.11Å; C235-L271 HydrophobicContact CB-CD2 3.36Å; C235-L271 HydrophobicContact CB-CG 4.35Å; T267-L271 HydrophobicContact CG2-CD1 3.67Å; T267-L271 HydrophobicContact CG2-CG 3.97Å; T267-L271 VanDerWaalsContact O-CG 3.26Å; T267-L271 WeakPolarHBondContact O-CG 3.46Å; T267-L271 PolarHBondContact O-N 3.06Å; L268-L271 PolarHBondContact O-N 3.48Å
272	S	83.2	Confident	88	Confident	22 Å²	22	30 Å²	30	15%	0.154	18%	0.18	C	C	.	.			trans	-137.9	130.3	-174.7	-174.9	0	0	0	0	112.2	L268 A274	L268-S272 PolarHBondContact O-N 3.14Å; S272-A274 WeakPolarHBondContact OG-CB 3.04Å; S272-A274 PolarHBondContact OG-N 2.92Å
273	S	82.3	Confident	88.1	Confident	89 Å²	89	31.3 Å²	31.3	62%	0.622	19%	0.188	S	C	*	.			trans	-94.6	7.7	169.1	55.1	0	0	0	0	112.7
274	A	85.8	Confident	88.2	Confident	36 Å²	36	27.7 Å²	27.7	30%	0.298	17%	0.172	S	C	.	.			trans	-64.6	135.6	178.8	0	0	0	0	0	110.4	S272 T276 A277 I278	S272-A274 WeakPolarHBondContact OG-CB 3.04Å; S272-A274 PolarHBondContact OG-N 2.92Å; A274-T276 PolarHBondContact O-N 3.41Å; A274-T276 VanDerWaalsContact O-N 3.09Å; A274-A277 HydrophobicContact CB-CB 4.38Å; A274-A277 WeakPolarHBondContact O-CB 3.45Å; A274-A277 PolarHBondContact O-N 3.25Å; A274-I278 PolarHBondContact O-N 2.77Å; A274-I278 VanDerWaalsContact O-N 3.1Å
275	P	86.8	Confident	88.3	Confident	87 Å²	87	28.1 Å²	28.1	57%	0.565	17%	0.173	S	C	*	.	H	α-helix	trans	-54	-34.8	-178.9	-30.6	36.4	0	0	0	114.2	K279 V317	P275-K279 VanDerWaalsContact O-CB 3.24Å; P275-K279 WeakPolarHBondContact O-CB 3.38Å; P275-K279 PolarHBondContact O-N 3.3Å; P275-V317 HydrophobicContact CB-CG2 3.79Å
276	T	88.8	Confident	88.4	Confident	99 Å²	99	28.2 Å²	28.2	61%	0.607	17%	0.174	S	C	*	.	H	α-helix	trans	-67.6	-34.8	177.2	51.9	0	0	0	0	113.2	Y250 A274 A280	Y250-T276 PolarHBondContact OH-O 3.12Å; A274-T276 PolarHBondContact O-N 3.41Å; A274-T276 VanDerWaalsContact O-N 3.09Å; T276-A280 WeakPolarHBondContact O-CB 3.18Å; T276-A280 PolarHBondContact O-N 2.88Å
277	A	87.9	Confident	88.5	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-72.8	-45.9	177.1	0	0	0	0	0	111.1	Y250 L268 A274 K279 A280 A281	Y250-A277 WeakPolarHBondContact OH-CA 3.24Å; Y250-A277 PolarHBondContact OH-N 3.24Å; L268-A277 HydrophobicContact CD1-CB 3.99Å; L268-A277 HydrophobicContact CD2-CB 4.31Å; L268-A277 WeakPolarHBondContact CD2-O 3.26Å; L268-A277 HydrophobicContact CG-CB 4.03Å; A274-A277 HydrophobicContact CB-CB 4.38Å; A274-A277 WeakPolarHBondContact O-CB 3.45Å; A274-A277 PolarHBondContact O-N 3.25Å; A277-K279 VanDerWaalsContact C-N 3.34Å; A277-K279 PolarHBondContact O-N 3.22Å; A277-A280 PolarHBondContact O-N 2.79Å; A277-A281 WeakPolarHBondContact O-CB 3.5Å; A277-A281 PolarHBondContact O-N 2.75Å
278	I	89.6	Confident	88.7	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.2	-42.4	176.2	-57.9	-57.9	0	0	0	110.9	V269 A274 A280 A281 A282 H314 V317	V269-I278 HydrophobicContact CB-CD1 4.23Å; V269-I278 HydrophobicContact CG1-CD1 4.01Å; V269-I278 HydrophobicContact CG2-CD1 4.04Å; A274-I278 PolarHBondContact O-N 2.77Å; A274-I278 VanDerWaalsContact O-N 3.1Å; I278-A280 PolarHBondContact O-N 2.66Å; I278-A281 PolarHBondContact O-N 3.21Å; I278-A282 VanDerWaalsContact O-CB 3.31Å; I278-A282 WeakPolarHBondContact O-CB 3.38Å; I278-A282 PolarHBondContact O-N 3.5Å; I278-H314 HydrophobicContact CG2-CB 4.08Å; I278-V317 HydrophobicContact CB-CG1 4.5Å; I278-V317 HydrophobicContact CG2-CB 4.38Å; I278-V317 HydrophobicContact CG2-CG1 4.32Å
279	K	91.4	Very high	88.8	Confident	78 Å²	78	30.9 Å²	30.9	34%	0.339	19%	0.185	S	C	.	.	H	α-helix	trans	-59.7	-46.2	176.8	-169.8	170.6	-176.3	164.7	0	111.8	P275 A277 A282 Q283 V317 L321	P275-K279 VanDerWaalsContact O-CB 3.24Å; P275-K279 WeakPolarHBondContact O-CB 3.38Å; P275-K279 PolarHBondContact O-N 3.3Å; A277-K279 VanDerWaalsContact C-N 3.34Å; A277-K279 PolarHBondContact O-N 3.22Å; K279-A282 PolarHBondContact O-N 3Å; K279-Q283 WeakPolarHBondContact O-CB 3.5Å; K279-Q283 VanDerWaalsContact O-CG 3.28Å; K279-Q283 WeakPolarHBondContact O-CG 3.16Å; K279-Q283 PolarHBondContact O-N 3.28Å; K279-V317 HydrophobicContact CB-CG1 3.59Å; K279-V317 HydrophobicContact CG-CG1 4.2Å; K279-L321 HydrophobicContact CG-CD1 4.14Å; K279-L321 HydrophobicContact CG-CD2 4.14Å; K279-L321 HydrophobicContact CG-CG 4.38Å
280	A	90.7	Very high	88.9	Confident	21 Å²	21	33.5 Å²	33.5	17%	0.174	20%	0.198	C	C	.	.	H	α-helix	trans	-66.2	-40.7	179.2	0	0	0	0	0	112.5	Y250 L253 L268 T276 A277 I278 C284	Y250-A280 HydrophobicContact CD1-CB 4.3Å; Y250-A280 HydrophobicContact CE1-CB 3.6Å; L253-A280 HydrophobicContact CD1-CB 4.15Å; L268-A280 HydrophobicContact CD2-CB 4.5Å; T276-A280 WeakPolarHBondContact O-CB 3.18Å; T276-A280 PolarHBondContact O-N 2.88Å; A277-A280 PolarHBondContact O-N 2.79Å; I278-A280 PolarHBondContact O-N 2.66Å; A280-C284 WeakPolarHBondContact O-CB 3.36Å; A280-C284 PolarHBondContact O-N 3.18Å
281	A	91.5	Very high	89.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.8	-46.6	175.4	0	0	0	0	0	111.7	A265 L268 V269 A277 I278 Q283 C284 Y285	A265-A281 HydrophobicContact CB-CB 4.19Å; L268-A281 HydrophobicContact CD2-CB 4.34Å; V269-A281 HydrophobicContact CG2-CB 3.59Å; A277-A281 WeakPolarHBondContact O-CB 3.5Å; A277-A281 PolarHBondContact O-N 2.75Å; I278-A281 PolarHBondContact O-N 3.21Å; A281-Q283 PolarHBondContact O-N 3.04Å; A281-C284 WeakPolarHBondContact O-CB 3.28Å; A281-C284 PolarHBondContact O-N 3.01Å; A281-C284 VanDerWaalsContact O-N 3.17Å; A281-Y285 WeakPolarHBondContact O-CD2 3.27Å; A281-Y285 PolarHBondContact O-N 3.38Å
282	A	91.8	Very high	89.4	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-62.5	-42.6	177.4	0	0	0	0	0	112.2	I278 K279 C284 Y285 I286 L305 L318 L321	I278-A282 VanDerWaalsContact O-CB 3.31Å; I278-A282 WeakPolarHBondContact O-CB 3.38Å; I278-A282 PolarHBondContact O-N 3.5Å; K279-A282 PolarHBondContact O-N 3Å; A282-C284 VanDerWaalsContact C-N 3.32Å; A282-C284 PolarHBondContact O-N 2.94Å; A282-Y285 PolarHBondContact O-N 3.3Å; A282-I286 VanDerWaalsContact O-CG1 3.26Å; A282-I286 WeakPolarHBondContact O-CG1 3.31Å; A282-I286 PolarHBondContact O-N 2.9Å; A282-L305 HydrophobicContact CB-CD2 4.15Å; A282-L318 HydrophobicContact CB-CD2 3.68Å; A282-L321 HydrophobicContact CB-CD1 3.52Å
283	Q	92.4	Very high	89.6	Confident	74 Å²	74	45.1 Å²	45.1	35%	0.346	26%	0.258	S	S	.	.	H	α-helix	trans	-60.3	-41.1	173	-76.6	178.1	-27.6	0	0	112	K279 A281 Y285 I286 D287 L321	K279-Q283 WeakPolarHBondContact O-CB 3.5Å; K279-Q283 VanDerWaalsContact O-CG 3.28Å; K279-Q283 WeakPolarHBondContact O-CG 3.16Å; K279-Q283 PolarHBondContact O-N 3.28Å; A281-Q283 PolarHBondContact O-N 3.04Å; Q283-Y285 PolarHBondContact O-N 3.13Å; Q283-I286 PolarHBondContact O-N 3.4Å; Q283-D287 WeakPolarHBondContact O-CB 3.08Å; Q283-D287 PolarHBondContact O-N 3.49Å; Q283-L321 HydrophobicContact CG-CD1 4.03Å; Q283-L321 HydrophobicContact CG-CD2 3.64Å
284	C	91.9	Very high	89.8	Confident	12 Å²	12	44.3 Å²	44.3	8%	0.081	25%	0.247	C	C	.	.	H	α-helix	trans	-62.3	-42.1	175.8	-172.2	0	0	0	0	112.1	L253 A265 A280 A281 A282 L288	L253-C284 HydrophobicContact CD2-CB 4.14Å; A265-C284 HydrophobicContact CB-CB 4.36Å; A280-C284 WeakPolarHBondContact O-CB 3.36Å; A280-C284 PolarHBondContact O-N 3.18Å; A281-C284 WeakPolarHBondContact O-CB 3.28Å; A281-C284 PolarHBondContact O-N 3.01Å; A281-C284 VanDerWaalsContact O-N 3.17Å; A282-C284 VanDerWaalsContact C-N 3.32Å; A282-C284 PolarHBondContact O-N 2.94Å; C284-L288 WeakPolarHBondContact O-CB 3.37Å; C284-L288 PolarHBondContact O-N 3.43Å
285	Y	92.9	Very high	89.8	Confident	10 Å²	10	45.2 Å²	45.2	4%	0.039	25%	0.247	C	C	.	.	H	α-helix	trans	-64.5	-44.1	175	-70.4	-43.9	0	0	0	112.5	Y262 A265 G266 A281 A282 Q283 D287 L288 I289 V301 L305 L308	Y262-Y285 HydrophobicContact CD2-CD1 4.18Å; Y262-Y285 AromaticContact CD2-CE1 3.7Å; Y262-Y285 HydrophobicContact CD2-CE1 3.7Å; Y262-Y285 HydrophobicContact CE2-CE1 4.01Å; Y262-Y285 HydrophobicContact CG-CE1 4.48Å; A265-Y285 HydrophobicContact CB-CD1 4.14Å; A265-Y285 HydrophobicContact CB-CE1 3.6Å; A265-Y285 HydrophobicContact CB-CE2 4.04Å; G266-Y285 WeakPolarHBondContact CA-OH 3.2Å; G266-Y285 PolarHBondContact N-OH 2.65Å; A281-Y285 WeakPolarHBondContact O-CD2 3.27Å; A281-Y285 PolarHBondContact O-N 3.38Å; A282-Y285 PolarHBondContact O-N 3.3Å; Q283-Y285 PolarHBondContact O-N 3.13Å; Y285-D287 PolarHBondContact O-N 3.3Å; Y285-L288 WeakPolarHBondContact O-CB 3.08Å; Y285-L288 PolarHBondContact O-N 3.4Å; Y285-I289 WeakPolarHBondContact O-CG1 3.21Å; Y285-I289 PolarHBondContact O-N 2.96Å; Y285-V301 HydrophobicContact CD1-CG1 3.7Å; Y285-V301 HydrophobicContact CG-CG1 4.05Å; Y285-L305 HydrophobicContact CD2-CD2 3.95Å; Y285-L305 HydrophobicContact CD2-CG 4.45Å; Y285-L305 HydrophobicContact CG-CD2 4.33Å; Y285-L308 HydrophobicContact CD2-CD1 4.21Å; Y285-L308 HydrophobicContact CE2-CD1 4.17Å
286	I	91.8	Very high	89.8	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-60.2	-46.7	176.7	-66.2	162.1	0	0	0	110.7	A282 Q283 L288 I289 I290 L305 L321 D324 I325	A282-I286 VanDerWaalsContact O-CG1 3.26Å; A282-I286 WeakPolarHBondContact O-CG1 3.31Å; A282-I286 PolarHBondContact O-N 2.9Å; Q283-I286 PolarHBondContact O-N 3.4Å; I286-L288 VanDerWaalsContact C-N 3.26Å; I286-L288 PolarHBondContact O-N 2.7Å; I286-I289 PolarHBondContact O-N 3.09Å; I286-I290 HydrophobicContact CG2-CD1 3.82Å; I286-I290 WeakPolarHBondContact O-CG1 3.31Å; I286-I290 PolarHBondContact O-N 3.06Å; I286-L305 HydrophobicContact CG1-CD1 3.99Å; I286-L321 HydrophobicContact CD1-CB 4.23Å; I286-L321 HydrophobicContact CD1-CD1 4.42Å; I286-D324 HydrophobicContact CD1-CB 4.03Å; I286-D324 HydrophobicContact CG2-CB 4.29Å; I286-D324 WeakPolarHBondContact CG2-O 3.49Å; I286-I325 HydrophobicContact CD1-CD1 4.49Å; I286-I325 HydrophobicContact CD1-CG1 3.55Å; I286-I325 HydrophobicContact CG1-CG1 3.99Å
287	D	90.9	Very high	89.7	Confident	65 Å²	65	43.9 Å²	43.9	35%	0.348	23%	0.233	S	C	.	.	H	α-helix	trans	-61.4	-35.7	177.7	-86.3	8.1	0	0	0	112.5	Q283 Y285 K291 R327	Q283-D287 WeakPolarHBondContact O-CB 3.08Å; Q283-D287 PolarHBondContact O-N 3.49Å; Y285-D287 PolarHBondContact O-N 3.3Å; D287-K291 WeakPolarHBondContact O-CB 3.5Å; D287-K291 VanDerWaalsContact O-CG 3.31Å; D287-K291 WeakPolarHBondContact O-CG 3.47Å; D287-K291 PolarHBondContact O-N 2.93Å; D287-K291 VanDerWaalsContact O-N 3.1Å; D287-K291 IonicContact OD2-NZ 3.59Å; D287-R327 IonicContact OD1-NH2 2.75Å
288	L	90.6	Very high	89.7	Confident	9 Å²	9	44.5 Å²	44.5	5%	0.047	24%	0.235	C	C	.	.	H	α-helix	trans	-68.6	-44.1	177	-166.6	127.2	0	0	0	111	P258 K261 C284 Y285 I286 I290 K291 E292 V297 V301	P258-L288 HydrophobicContact CB-CD1 3.91Å; P258-L288 WeakPolarHBondContact O-CD1 3.31Å; K261-L288 HydrophobicContact CB-CD1 4.09Å; C284-L288 WeakPolarHBondContact O-CB 3.37Å; C284-L288 PolarHBondContact O-N 3.43Å; Y285-L288 WeakPolarHBondContact O-CB 3.08Å; Y285-L288 PolarHBondContact O-N 3.4Å; I286-L288 VanDerWaalsContact C-N 3.26Å; I286-L288 PolarHBondContact O-N 2.7Å; L288-I290 VanDerWaalsContact C-N 3.28Å; L288-I290 PolarHBondContact O-N 3.12Å; L288-K291 PolarHBondContact O-N 3.03Å; L288-E292 HydrophobicContact CD2-CG 4.17Å; L288-E292 HydrophobicContact CG-CG 4.03Å; L288-E292 WeakPolarHBondContact O-CB 3.44Å; L288-E292 VanDerWaalsContact O-CG 3.29Å; L288-E292 WeakPolarHBondContact O-CG 3.19Å; L288-E292 PolarHBondContact O-N 2.74Å; L288-V297 HydrophobicContact CD2-CG1 4.21Å; L288-V301 HydrophobicContact CD2-CB 4.21Å; L288-V301 HydrophobicContact CD2-CG1 4.06Å; L288-V301 HydrophobicContact CD2-CG2 3.32Å
289	I	90.1	Very high	89.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-39	175.9	-65.1	164.3	0	0	0	111.6	Y285 I286 K298 V301 L302 L305 V328	Y285-I289 WeakPolarHBondContact O-CG1 3.21Å; Y285-I289 PolarHBondContact O-N 2.96Å; I286-I289 PolarHBondContact O-N 3.09Å; I289-K298 HydrophobicContact CG2-CB 4.18Å; I289-K298 HydrophobicContact CG2-CD 4.34Å; I289-K298 HydrophobicContact CG2-CG 4.08Å; I289-K298 WeakPolarHBondContact O-CD 3.42Å; I289-K298 WeakPolarHBondContact O-CE 3.45Å; I289-V301 HydrophobicContact CD1-CB 4.29Å; I289-V301 HydrophobicContact CD1-CG1 3.9Å; I289-V301 HydrophobicContact CG1-CB 3.84Å; I289-V301 HydrophobicContact CG1-CG1 3.64Å; I289-L302 HydrophobicContact CD1-CB 4.2Å; I289-L302 HydrophobicContact CD1-CD1 4.33Å; I289-L305 HydrophobicContact CD1-CD1 3.61Å; I289-V328 HydrophobicContact CB-CG2 4.23Å; I289-V328 HydrophobicContact CG2-CB 4.23Å; I289-V328 HydrophobicContact CG2-CG1 3.48Å; I289-V328 VanDerWaalsContact CG2-CG1 3.48Å; I289-V328 HydrophobicContact CG2-CG2 3.7Å
290	I	89.8	Confident	89.2	Confident	68 Å²	68	46.4 Å²	46.4	35%	0.349	25%	0.248	S	C	.	.	H	α-helix	trans	-72.2	-39.1	-178.9	-65.8	166.7	0	0	0	111.6	I286 L288 R327 V328	I286-I290 HydrophobicContact CG2-CD1 3.82Å; I286-I290 WeakPolarHBondContact O-CG1 3.31Å; I286-I290 PolarHBondContact O-N 3.06Å; L288-I290 VanDerWaalsContact C-N 3.28Å; L288-I290 PolarHBondContact O-N 3.12Å; I290-R327 HydrophobicContact CD1-CB 3.78Å; I290-V328 HydrophobicContact CG1-CG2 4.14Å
291	K	89.3	Confident	89.2	Confident	141 Å²	141	45.5 Å²	45.5	61%	0.613	24%	0.24	S	C	*	.	H	α-helix	trans	-85.2	-32.9	-173	-72.2	173	-176.9	165.6	0	113.8	D287 L288	D287-K291 WeakPolarHBondContact O-CB 3.5Å; D287-K291 VanDerWaalsContact O-CG 3.31Å; D287-K291 WeakPolarHBondContact O-CG 3.47Å; D287-K291 PolarHBondContact O-N 2.93Å; D287-K291 VanDerWaalsContact O-N 3.1Å; D287-K291 IonicContact OD2-NZ 3.59Å; L288-K291 PolarHBondContact O-N 3.03Å
292	E	88.3	Confident	89	Confident	48 Å²	48	45.5 Å²	45.5	22%	0.224	24%	0.241	C	C	.	.			trans	-68.3	147.2	-179.9	-72.1	-57.2	139.4	0	0	111.7	P258 L288 V297 K298	P258-E292 WeakPolarHBondContact CB-OE1 3.41Å; P258-E292 WeakPolarHBondContact CG-OE1 3.42Å; L288-E292 HydrophobicContact CD2-CG 4.17Å; L288-E292 HydrophobicContact CG-CG 4.03Å; L288-E292 WeakPolarHBondContact O-CB 3.44Å; L288-E292 VanDerWaalsContact O-CG 3.29Å; L288-E292 WeakPolarHBondContact O-CG 3.19Å; L288-E292 PolarHBondContact O-N 2.74Å; E292-V297 HydrophobicContact CG-CG1 4.21Å; E292-K298 WeakPolarHBondContact O-CE 3.36Å; E292-K298 PolarHBondContact O-NZ 3.32Å
293	S	86.6	Confident	88.8	Confident	109 Å²	109	48.3 Å²	48.3	76%	0.762	26%	0.256	S	S	*	.			trans	-93.9	-28.9	177.2	54.9	0	0	0	0	112.9	N295	S293-N295 PolarHBondContact O-N 3.37Å
294	D	87.6	Confident	88.5	Confident	72 Å²	72	48.3 Å²	48.3	39%	0.385	25%	0.253	S	S	.	.			trans	-76.1	120.1	-177.5	-171.2	-13.4	0	0	0	111.6	N296 V297 K298	D294-N296 VanDerWaalsContact C-N 3.28Å; D294-N296 PolarHBondContact O-N 3.44Å; D294-N296 WeakPolarHBondContact OD1-CB 3.15Å; D294-N296 PolarHBondContact OD1-N 3.08Å; D294-N296 PolarHBondContact OD1-ND2 3.24Å; D294-V297 HydrophobicContact CB-CB 4.27Å; D294-V297 HydrophobicContact CB-CG2 3.93Å; D294-V297 PolarHBondContact O-N 3.4Å; D294-K298 WeakPolarHBondContact O-CG 3.39Å; D294-K298 PolarHBondContact O-N 3.19Å
295	N	86	Confident	88.3	Confident	55 Å²	55	47.9 Å²	47.9	29%	0.294	25%	0.249	S	C	.	.	H	α-helix	trans	-63.5	-32.5	178.9	-67.5	-18.4	0	0	0	112.3	S293 K298 L299 D333	S293-N295 PolarHBondContact O-N 3.37Å; N295-K298 WeakPolarHBondContact O-CB 3.47Å; N295-K298 PolarHBondContact O-N 3.13Å; N295-L299 WeakPolarHBondContact O-CG 3.47Å; N295-L299 PolarHBondContact O-N 3.09Å; N295-D333 PolarHBondContact ND2-OD1 3.23Å
296	N	86.1	Confident	88	Confident	107 Å²	107	49.9 Å²	49.9	57%	0.572	26%	0.26	S	S	*	.	H	α-helix	trans	-65.9	-43	179	-63.8	-50	0	0	0	111.1	D294 K298 L299 I300	D294-N296 VanDerWaalsContact C-N 3.28Å; D294-N296 PolarHBondContact O-N 3.44Å; D294-N296 WeakPolarHBondContact OD1-CB 3.15Å; D294-N296 PolarHBondContact OD1-N 3.08Å; D294-N296 PolarHBondContact OD1-ND2 3.24Å; N296-K298 VanDerWaalsContact C-N 3.31Å; N296-K298 PolarHBondContact O-N 3.14Å; N296-L299 PolarHBondContact O-N 3.33Å; N296-I300 VanDerWaalsContact O-CG1 3.3Å; N296-I300 WeakPolarHBondContact O-CG1 3.48Å; N296-I300 PolarHBondContact O-N 3.33Å
297	V	85.6	Confident	87.7	Confident	50 Å²	50	53.8 Å²	53.8	30%	0.303	28%	0.278	S	S	.	.	H	α-helix	trans	-62.2	-41.9	175.7	178.8	0	0	0	0	110.2	L288 E292 D294 L299 I300 V301	L288-V297 HydrophobicContact CD2-CG1 4.21Å; E292-V297 HydrophobicContact CG-CG1 4.21Å; D294-V297 HydrophobicContact CB-CB 4.27Å; D294-V297 HydrophobicContact CB-CG2 3.93Å; D294-V297 PolarHBondContact O-N 3.4Å; V297-L299 PolarHBondContact O-N 3.15Å; V297-I300 PolarHBondContact O-N 3.4Å; V297-V301 HydrophobicContact CG1-CG2 4.23Å; V297-V301 WeakPolarHBondContact O-CG2 3.45Å; V297-V301 PolarHBondContact O-N 3.19Å
298	K	88.1	Confident	87.4	Confident	14 Å²	14	51.4 Å²	51.4	6%	0.061	27%	0.266	C	S	.	.	H	α-helix	trans	-59.6	-44.7	175.4	-66.9	-179.1	-173.1	-169.8	0	112.4	I289 E292 D294 N295 N296 V301 L302 T331 V336	I289-K298 HydrophobicContact CG2-CB 4.18Å; I289-K298 HydrophobicContact CG2-CD 4.34Å; I289-K298 HydrophobicContact CG2-CG 4.08Å; I289-K298 WeakPolarHBondContact O-CD 3.42Å; I289-K298 WeakPolarHBondContact O-CE 3.45Å; E292-K298 WeakPolarHBondContact O-CE 3.36Å; E292-K298 PolarHBondContact O-NZ 3.32Å; D294-K298 WeakPolarHBondContact O-CG 3.39Å; D294-K298 PolarHBondContact O-N 3.19Å; N295-K298 WeakPolarHBondContact O-CB 3.47Å; N295-K298 PolarHBondContact O-N 3.13Å; N296-K298 VanDerWaalsContact C-N 3.31Å; N296-K298 PolarHBondContact O-N 3.14Å; K298-V301 PolarHBondContact O-N 3.16Å; K298-L302 WeakPolarHBondContact O-CB 3.4Å; K298-L302 PolarHBondContact O-N 2.99Å; K298-T331 HydrophobicContact CD-CG2 3.91Å; K298-T331 PolarHBondContact NZ-OG1 2.96Å; K298-V336 HydrophobicContact CB-CG2 4.11Å
299	L	85.7	Confident	87	Confident	24 Å²	24	52.2 Å²	52.2	13%	0.126	27%	0.269	C	S	.	.	H	α-helix	trans	-63.3	-45.2	178.8	-70.7	172.2	0	0	0	111.4	N295 N296 V297 V301 L302 D303 E335 V336 K339	N295-L299 WeakPolarHBondContact O-CG 3.47Å; N295-L299 PolarHBondContact O-N 3.09Å; N296-L299 PolarHBondContact O-N 3.33Å; V297-L299 PolarHBondContact O-N 3.15Å; L299-V301 VanDerWaalsContact C-N 3.33Å; L299-V301 PolarHBondContact O-N 2.88Å; L299-L302 PolarHBondContact O-N 3.08Å; L299-D303 WeakPolarHBondContact O-CB 3.28Å; L299-D303 VanDerWaalsContact O-CG 3.28Å; L299-D303 PolarHBondContact O-N 2.63Å; L299-E335 HydrophobicContact CD2-CB 4.45Å; L299-E335 HydrophobicContact CD2-CG 4Å; L299-V336 HydrophobicContact CD2-CG2 3.76Å; L299-V336 HydrophobicContact CG-CG2 4Å; L299-K339 HydrophobicContact CD2-CD 4.03Å
300	I	85.9	Confident	86.5	Confident	95 Å²	95	59.6 Å²	59.6	49%	0.487	30%	0.303	S	S	.	.	H	α-helix	trans	-58.9	-45.6	177.3	-67.1	164.4	0	0	0	111	N296 V297 D303 R304	N296-I300 VanDerWaalsContact O-CG1 3.3Å; N296-I300 WeakPolarHBondContact O-CG1 3.48Å; N296-I300 PolarHBondContact O-N 3.33Å; V297-I300 PolarHBondContact O-N 3.4Å; I300-D303 PolarHBondContact O-N 3.1Å; I300-R304 PolarHBondContact O-N 2.99Å; I300-R304 VanDerWaalsContact O-N 3.14Å
301	V	89.7	Confident	86	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.006	31%	0.312	C	S	.	.	H	α-helix	trans	-72	-35	-177.3	-178.8	0	0	0	0	111.1	Y262 Y285 L288 I289 V297 K298 L299 R304 L305	Y262-V301 HydrophobicContact CD2-CG2 3.82Å; Y262-V301 HydrophobicContact CE2-CG2 3.84Å; Y285-V301 HydrophobicContact CD1-CG1 3.7Å; Y285-V301 HydrophobicContact CG-CG1 4.05Å; L288-V301 HydrophobicContact CD2-CB 4.21Å; L288-V301 HydrophobicContact CD2-CG1 4.06Å; L288-V301 HydrophobicContact CD2-CG2 3.32Å; I289-V301 HydrophobicContact CD1-CB 4.29Å; I289-V301 HydrophobicContact CD1-CG1 3.9Å; I289-V301 HydrophobicContact CG1-CB 3.84Å; I289-V301 HydrophobicContact CG1-CG1 3.64Å; V297-V301 HydrophobicContact CG1-CG2 4.23Å; V297-V301 WeakPolarHBondContact O-CG2 3.45Å; V297-V301 PolarHBondContact O-N 3.19Å; K298-V301 PolarHBondContact O-N 3.16Å; L299-V301 VanDerWaalsContact C-N 3.33Å; L299-V301 PolarHBondContact O-N 2.88Å; V301-R304 PolarHBondContact O-N 3.22Å; V301-L305 PolarHBondContact O-N 3.21Å; V301-L305 VanDerWaalsContact O-N 3.07Å
302	L	88.9	Confident	85.3	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-67	-39.1	174.4	-174.2	61.1	0	0	0	111.6	I289 K298 L299 R304 L305 I306 K339 L343	I289-L302 HydrophobicContact CD1-CB 4.2Å; I289-L302 HydrophobicContact CD1-CD1 4.33Å; K298-L302 WeakPolarHBondContact O-CB 3.4Å; K298-L302 PolarHBondContact O-N 2.99Å; L299-L302 PolarHBondContact O-N 3.08Å; L302-R304 VanDerWaalsContact C-N 3.3Å; L302-R304 PolarHBondContact O-N 3.27Å; L302-L305 WeakPolarHBondContact O-CB 3.4Å; L302-L305 PolarHBondContact O-N 2.9Å; L302-L305 VanDerWaalsContact O-N 3.12Å; L302-I306 HydrophobicContact CG-CD1 4.33Å; L302-I306 WeakPolarHBondContact O-CG1 3.34Å; L302-I306 PolarHBondContact O-N 3.49Å; L302-K339 HydrophobicContact CD2-CB 3.35Å; L302-K339 HydrophobicContact CD2-CD 4.28Å; L302-K339 HydrophobicContact CD2-CG 4.45Å; L302-K339 HydrophobicContact CG-CB 4.22Å; L302-L343 HydrophobicContact CD1-CD2 3.99Å
303	D	86.5	Confident	84.8	Confident	59 Å²	59	60 Å²	60	32%	0.316	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-39.3	173.9	-71.7	-25.4	0	0	0	110.9	L299 I300 L305 I306 E307 K339	L299-D303 WeakPolarHBondContact O-CB 3.28Å; L299-D303 VanDerWaalsContact O-CG 3.28Å; L299-D303 PolarHBondContact O-N 2.63Å; I300-D303 PolarHBondContact O-N 3.1Å; D303-L305 PolarHBondContact O-N 2.96Å; D303-I306 WeakPolarHBondContact O-CB 3.34Å; D303-I306 PolarHBondContact O-N 3.48Å; D303-I306 VanDerWaalsContact O-N 3.17Å; D303-E307 WeakPolarHBondContact O-CG 3.32Å; D303-E307 PolarHBondContact O-N 3.34Å; D303-K339 IonicContact OD1-NZ 2.66Å; D303-K339 PolarHBondContact OD1-NZ 3.39Å; D303-K339 IonicContact OD2-NZ 3.85Å; D303-K339 PolarHBondContact OD2-NZ 2.89Å
304	R	85.7	Confident	84.7	Confident	74 Å²	74	55.5 Å²	55.5	28%	0.279	29%	0.291	S	S	.	.	H	α-helix	trans	-62.1	-39.5	170.9	-67.9	-53.9	-171.7	176.9	-3.1	113.4	Y262 I300 V301 L302 I306 E307 L308	Y262-R304 HydrophobicContact CE2-CG 4.19Å; Y262-R304 WeakPolarHBondContact OH-CG 3.41Å; Y262-R304 PolarHBondContact OH-NE 2.85Å; I300-R304 PolarHBondContact O-N 2.99Å; I300-R304 VanDerWaalsContact O-N 3.14Å; V301-R304 PolarHBondContact O-N 3.22Å; L302-R304 VanDerWaalsContact C-N 3.3Å; L302-R304 PolarHBondContact O-N 3.27Å; R304-I306 VanDerWaalsContact C-N 3.32Å; R304-I306 PolarHBondContact O-N 3.35Å; R304-E307 WeakPolarHBondContact CD-OE2 3.37Å; R304-E307 IonicContact CZ-OE2 2.87Å; R304-E307 IonicContact NE-OE2 3.98Å; R304-E307 IonicContact NH1-OE1 2.78Å; R304-E307 IonicContact NH1-OE2 3.95Å; R304-E307 PolarHBondContact NH1-OE2 3.11Å; R304-E307 PolarHBondContact O-N 3.48Å; R304-L308 WeakPolarHBondContact O-CG 3.48Å; R304-L308 PolarHBondContact O-N 3.24Å
305	L	88.1	Confident	84.5	Confident	2 Å²	2	54.5 Å²	54.5	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-64.1	-37.2	173.7	-77.5	175.6	0	0	0	112.2	A282 Y285 I286 I289 V301 L302 D303 L308 K309 L318 L343	A282-L305 HydrophobicContact CB-CD2 4.15Å; Y285-L305 HydrophobicContact CD2-CD2 3.95Å; Y285-L305 HydrophobicContact CD2-CG 4.45Å; Y285-L305 HydrophobicContact CG-CD2 4.33Å; I286-L305 HydrophobicContact CG1-CD1 3.99Å; I289-L305 HydrophobicContact CD1-CD1 3.61Å; V301-L305 PolarHBondContact O-N 3.21Å; V301-L305 VanDerWaalsContact O-N 3.07Å; L302-L305 WeakPolarHBondContact O-CB 3.4Å; L302-L305 PolarHBondContact O-N 2.9Å; L302-L305 VanDerWaalsContact O-N 3.12Å; D303-L305 PolarHBondContact O-N 2.96Å; L305-L308 HydrophobicContact CD2-CD1 4.18Å; L305-L308 WeakPolarHBondContact O-CB 3.45Å; L305-L308 PolarHBondContact O-N 3.07Å; L305-K309 PolarHBondContact O-N 2.9Å; L305-L318 HydrophobicContact CD2-CD2 4.49Å; L305-L343 HydrophobicContact CB-CD2 4.15Å
306	I	87.6	Confident	84.5	Confident	52 Å²	52	60.9 Å²	60.9	27%	0.267	30%	0.304	S	S	.	.	H	α-helix	trans	-67.2	-40.3	175.5	-66.8	165.3	0	0	0	110.5	L302 D303 R304 L308 K309 K339 L343	L302-I306 HydrophobicContact CG-CD1 4.33Å; L302-I306 WeakPolarHBondContact O-CG1 3.34Å; L302-I306 PolarHBondContact O-N 3.49Å; D303-I306 WeakPolarHBondContact O-CB 3.34Å; D303-I306 PolarHBondContact O-N 3.48Å; D303-I306 VanDerWaalsContact O-N 3.17Å; R304-I306 VanDerWaalsContact C-N 3.32Å; R304-I306 PolarHBondContact O-N 3.35Å; I306-L308 VanDerWaalsContact C-N 3.32Å; I306-L308 PolarHBondContact O-N 3.38Å; I306-K309 VanDerWaalsContact O-CB 3.31Å; I306-K309 WeakPolarHBondContact O-CB 3.45Å; I306-K309 PolarHBondContact O-N 3.05Å; I306-K339 HydrophobicContact CD1-CB 4.48Å; I306-L343 HydrophobicContact CG1-CB 4.37Å; I306-L343 HydrophobicContact CG1-CD1 4.16Å; I306-L343 HydrophobicContact CG1-CD2 4.23Å; I306-L343 HydrophobicContact CG1-CG 4.48Å
307	E	84.8	Confident	84.6	Confident	84 Å²	84	56.4 Å²	56.4	39%	0.393	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-39	173.4	-71.8	172.9	-172.7	0	0	111.9	D303 R304 K309 E310	D303-E307 WeakPolarHBondContact O-CG 3.32Å; D303-E307 PolarHBondContact O-N 3.34Å; R304-E307 WeakPolarHBondContact CD-OE2 3.37Å; R304-E307 IonicContact CZ-OE2 2.87Å; R304-E307 IonicContact NE-OE2 3.98Å; R304-E307 IonicContact NH1-OE1 2.78Å; R304-E307 IonicContact NH1-OE2 3.95Å; R304-E307 PolarHBondContact NH1-OE2 3.11Å; R304-E307 PolarHBondContact O-N 3.48Å; E307-K309 PolarHBondContact O-N 3.4Å; E307-E310 WeakPolarHBondContact O-CB 3.29Å; E307-E310 PolarHBondContact O-N 3.29Å; E307-E310 VanDerWaalsContact O-N 3.08Å
308	L	84.1	Confident	84.6	Confident	15 Å²	15	54 Å²	54	8%	0.079	27%	0.266	C	S	.	.	H	α-helix	trans	-59.2	-34.5	176.7	-69.4	-178	0	0	0	112.6	V269 Y285 R304 L305 I306 E310 H311 H314 L318	V269-L308 HydrophobicContact CB-CD2 4.27Å; V269-L308 HydrophobicContact CG1-CD2 3.43Å; V269-L308 VanDerWaalsContact CG1-CD2 3.43Å; V269-L308 HydrophobicContact CG2-CD1 4.46Å; V269-L308 HydrophobicContact CG2-CD2 3.9Å; Y285-L308 HydrophobicContact CD2-CD1 4.21Å; Y285-L308 HydrophobicContact CE2-CD1 4.17Å; R304-L308 WeakPolarHBondContact O-CG 3.48Å; R304-L308 PolarHBondContact O-N 3.24Å; L305-L308 HydrophobicContact CD2-CD1 4.18Å; L305-L308 WeakPolarHBondContact O-CB 3.45Å; L305-L308 PolarHBondContact O-N 3.07Å; I306-L308 VanDerWaalsContact C-N 3.32Å; I306-L308 PolarHBondContact O-N 3.38Å; L308-E310 PolarHBondContact O-N 2.98Å; L308-H311 PolarHBondContact O-N 2.82Å; L308-H314 WeakPolarHBondContact O-CB 3.27Å; L308-L318 HydrophobicContact CB-CD1 4.05Å
309	K	83.2	Confident	84.6	Confident	26 Å²	26	55.9 Å²	55.9	11%	0.113	28%	0.275	C	S	.	.	H	α-helix	trans	-64.1	-27.8	178.5	175.9	-156.2	154.5	-159.3	0	112.2	L305 I306 E307 H311 E315 L318 L343 D346 L347	L305-K309 PolarHBondContact O-N 2.9Å; I306-K309 VanDerWaalsContact O-CB 3.31Å; I306-K309 WeakPolarHBondContact O-CB 3.45Å; I306-K309 PolarHBondContact O-N 3.05Å; E307-K309 PolarHBondContact O-N 3.4Å; K309-H311 PolarHBondContact O-N 3.04Å; K309-E315 HydrophobicContact CG-CG 4.43Å; K309-L318 HydrophobicContact CB-CD1 4.04Å; K309-L343 HydrophobicContact CB-CD1 4.43Å; K309-L343 HydrophobicContact CD-CD1 4.05Å; K309-D346 HydrophobicContact CD-CB 4.13Å; K309-D346 VanDerWaalsContact NZ-CB 3.26Å; K309-D346 IonicContact NZ-OD2 3.71Å; K309-D346 PolarHBondContact NZ-OD2 3.07Å; K309-L347 HydrophobicContact CG-CD2 4.17Å
310	E	79.3	Confident	84.7	Confident	155 Å²	155	59.9 Å²	59.9	72%	0.724	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-22.5	-178	-61.9	-167	154.9	0	0	112.9	E307 L308	E307-E310 WeakPolarHBondContact O-CB 3.29Å; E307-E310 PolarHBondContact O-N 3.29Å; E307-E310 VanDerWaalsContact O-N 3.08Å; L308-E310 PolarHBondContact O-N 2.98Å
311	H	79.3	Confident	84.9	Confident	113 Å²	113	55.4 Å²	55.4	52%	0.523	27%	0.273	S	S	.	.	S	Bend	trans	-90.7	121.2	174.4	-68.7	-58	0	0	0	112.4	L308 K309 A313 H314 E315	L308-H311 PolarHBondContact O-N 2.82Å; K309-H311 PolarHBondContact O-N 3.04Å; H311-A313 PolarHBondContact O-N 3.46Å; H311-A313 VanDerWaalsContact O-N 3.09Å; H311-H314 HydrophobicContact CB-CB 4.23Å; H311-H314 AromaticContact CD2-CE1 3.91Å; H311-H314 AromaticContact CD2-ND1 3.84Å; H311-H314 PolarHBondContact O-N 3.29Å; H311-E315 PolarHBondContact O-N 3.49Å
312	P	75.2	Confident	85	Confident	85 Å²	85	55.4 Å²	55.4	55%	0.552	27%	0.273	S	S	*	.	H	α-helix	trans	-58.8	-31.1	-175.4	-24.2	31.2	0	0	0	114.8
313	A	77.2	Confident	85	Confident	66 Å²	66	58 Å²	58	55%	0.545	29%	0.286	S	S	.	.	H	α-helix	trans	-70.7	-35.4	177.9	0	0	0	0	0	112.2	H311	H311-A313 PolarHBondContact O-N 3.46Å; H311-A313 VanDerWaalsContact O-N 3.09Å
314	H	83.8	Confident	85.1	Confident	16 Å²	16	57.2 Å²	57.2	7%	0.074	28%	0.282	C	S	.	.	H	α-helix	trans	-78.7	-34.5	178.8	-59.2	170.8	0	0	0	110.9	I278 L308 H311 R316 V317 L318	I278-H314 HydrophobicContact CG2-CB 4.08Å; L308-H314 WeakPolarHBondContact O-CB 3.27Å; H311-H314 HydrophobicContact CB-CB 4.23Å; H311-H314 AromaticContact CD2-CE1 3.91Å; H311-H314 AromaticContact CD2-ND1 3.84Å; H311-H314 PolarHBondContact O-N 3.29Å; H314-R316 VanDerWaalsContact C-N 3.31Å; H314-R316 PolarHBondContact O-N 3.19Å; H314-V317 WeakPolarHBondContact O-CB 3.46Å; H314-V317 PolarHBondContact O-N 3.42Å; H314-L318 WeakPolarHBondContact O-CG 3.4Å; H314-L318 PolarHBondContact O-N 3.14Å
315	E	84.8	Confident	85.4	Confident	50 Å²	50	53.8 Å²	53.8	23%	0.234	27%	0.269	C	S	.	.	H	α-helix	trans	-52.5	-47.7	176.5	-171.2	-174.9	167.4	0	0	111.8	K309 H311 V317 L318 Q319 L347	K309-E315 HydrophobicContact CG-CG 4.43Å; H311-E315 PolarHBondContact O-N 3.49Å; E315-V317 PolarHBondContact O-N 3.36Å; E315-L318 PolarHBondContact O-N 2.94Å; E315-L318 VanDerWaalsContact O-N 3.09Å; E315-Q319 WeakPolarHBondContact O-CG 3.31Å; E315-Q319 PolarHBondContact O-N 2.93Å; E315-L347 HydrophobicContact CG-CD2 3.96Å
316	R	85.5	Confident	85.5	Confident	190 Å²	190	54.1 Å²	54.1	72%	0.717	27%	0.271	S	S	*	.	H	α-helix	trans	-58.2	-35.1	177.6	-67	-177.6	-176.9	177.2	1.8	113.2	H314	H314-R316 VanDerWaalsContact C-N 3.31Å; H314-R316 PolarHBondContact O-N 3.19Å
317	V	87.3	Confident	85.6	Confident	12 Å²	12	56.7 Å²	56.7	7%	0.073	28%	0.277	C	S	.	.	H	α-helix	trans	-75	-38.5	178.1	-178.2	0	0	0	0	110.8	P275 I278 K279 H314 E315 Q319 D320	P275-V317 HydrophobicContact CB-CG2 3.79Å; I278-V317 HydrophobicContact CB-CG1 4.5Å; I278-V317 HydrophobicContact CG2-CB 4.38Å; I278-V317 HydrophobicContact CG2-CG1 4.32Å; K279-V317 HydrophobicContact CB-CG1 3.59Å; K279-V317 HydrophobicContact CG-CG1 4.2Å; H314-V317 WeakPolarHBondContact O-CB 3.46Å; H314-V317 PolarHBondContact O-N 3.42Å; E315-V317 PolarHBondContact O-N 3.36Å; V317-Q319 VanDerWaalsContact C-N 3.31Å; V317-Q319 PolarHBondContact O-N 3.48Å; V317-D320 PolarHBondContact O-N 2.74Å
318	L	86.8	Confident	85.8	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-67.3	-31.4	176.2	-68.2	172.1	0	0	0	112.1	A282 L305 L308 K309 H314 E315 D320 L321 V322 L347	A282-L318 HydrophobicContact CB-CD2 3.68Å; L305-L318 HydrophobicContact CD2-CD2 4.49Å; L308-L318 HydrophobicContact CB-CD1 4.05Å; K309-L318 HydrophobicContact CB-CD1 4.04Å; H314-L318 WeakPolarHBondContact O-CG 3.4Å; H314-L318 PolarHBondContact O-N 3.14Å; E315-L318 PolarHBondContact O-N 2.94Å; E315-L318 VanDerWaalsContact O-N 3.09Å; L318-D320 PolarHBondContact O-N 3.48Å; L318-L321 CarbonylContact O-C 3.49Å; L318-L321 WeakPolarHBondContact O-CA 3.49Å; L318-L321 PolarHBondContact O-N 3.36Å; L318-V322 PolarHBondContact O-N 3.36Å; L318-L347 HydrophobicContact CB-CD1 3.86Å; L318-L347 HydrophobicContact CB-CD2 3.74Å; L318-L347 HydrophobicContact CB-CG 4.47Å
319	Q	88.4	Confident	85.9	Confident	52 Å²	52	52.1 Å²	52.1	24%	0.243	26%	0.256	C	S	.	.	H	α-helix	trans	-57.9	-33.3	173.9	-72.8	177.8	-3.1	0	0	112.7	E315 V317 L321 V322 L347 N352	E315-Q319 WeakPolarHBondContact O-CG 3.31Å; E315-Q319 PolarHBondContact O-N 2.93Å; V317-Q319 VanDerWaalsContact C-N 3.31Å; V317-Q319 PolarHBondContact O-N 3.48Å; Q319-L321 VanDerWaalsContact C-N 3.29Å; Q319-V322 WeakPolarHBondContact O-CG2 3.24Å; Q319-L347 HydrophobicContact CG-CB 4.46Å; Q319-L347 HydrophobicContact CG-CD2 4.34Å; Q319-L347 WeakPolarHBondContact CG-O 3.49Å; Q319-N352 PolarHBondContact O-ND2 2.93Å
320	D	87.8	Confident	86	Confident	108 Å²	108	55.5 Å²	55.5	58%	0.578	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-18.3	175.4	-67.8	-18.2	0	0	0	112.8	V317 L318	V317-D320 PolarHBondContact O-N 2.74Å; L318-D320 PolarHBondContact O-N 3.48Å
321	L	90	Very high	86.2	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	5.4	-177.7	-64.4	178.4	0	0	0	113.2	K279 A282 Q283 I286 L318 Q319 M323 D324 I325	K279-L321 HydrophobicContact CG-CD1 4.14Å; K279-L321 HydrophobicContact CG-CD2 4.14Å; K279-L321 HydrophobicContact CG-CG 4.38Å; A282-L321 HydrophobicContact CB-CD1 3.52Å; Q283-L321 HydrophobicContact CG-CD1 4.03Å; Q283-L321 HydrophobicContact CG-CD2 3.64Å; I286-L321 HydrophobicContact CD1-CB 4.23Å; I286-L321 HydrophobicContact CD1-CD1 4.42Å; L318-L321 CarbonylContact O-C 3.49Å; L318-L321 WeakPolarHBondContact O-CA 3.49Å; L318-L321 PolarHBondContact O-N 3.36Å; Q319-L321 VanDerWaalsContact C-N 3.29Å; L321-M323 VanDerWaalsContact C-N 3.25Å; L321-M323 PolarHBondContact O-N 3.43Å; L321-D324 WeakPolarHBondContact O-CA 3.49Å; L321-D324 WeakPolarHBondContact O-CB 3.47Å; L321-D324 PolarHBondContact O-N 3.19Å; L321-I325 WeakPolarHBondContact O-CG1 3.49Å; L321-I325 PolarHBondContact O-N 3.32Å
322	V	90.4	Very high	86.3	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-55.7	-40	-176.5	170.9	0	0	0	0	112.4	L318 Q319 D324 I325 L326 L347 L356	L318-V322 PolarHBondContact O-N 3.36Å; Q319-V322 WeakPolarHBondContact O-CG2 3.24Å; V322-D324 VanDerWaalsContact C-N 3.3Å; V322-D324 PolarHBondContact O-N 3.35Å; V322-I325 WeakPolarHBondContact O-CB 3.41Å; V322-I325 PolarHBondContact O-N 3.44Å; V322-L326 HydrophobicContact CG1-CD1 4.36Å; V322-L326 WeakPolarHBondContact O-CG 3.49Å; V322-L326 PolarHBondContact O-N 2.88Å; V322-L347 HydrophobicContact CG2-CB 3.47Å; V322-L347 VanDerWaalsContact CG2-CB 3.47Å; V322-L347 HydrophobicContact CG2-CD1 4.19Å; V322-L347 HydrophobicContact CG2-CG 4.48Å; V322-L356 HydrophobicContact CG1-CD1 3.77Å
323	M	88.4	Confident	86.8	Confident	57 Å²	57	46.1 Å²	46.1	28%	0.281	24%	0.243	S	C	.	.	H	α-helix	trans	-66.1	-35	177.9	-60.4	-54.7	-72.1	0	0	112.3	L321 L326 E355 V359	L321-M323 VanDerWaalsContact C-N 3.25Å; L321-M323 PolarHBondContact O-N 3.43Å; M323-L326 HydrophobicContact SD-CD1 4.14Å; M323-E355 HydrophobicContact CE-CB 3.58Å; M323-E355 WeakPolarHBondContact CG-OE2 3.33Å; M323-E355 HydrophobicContact SD-CB 3.68Å; M323-V359 HydrophobicContact CE-CG2 3.49Å; M323-V359 VanDerWaalsContact CE-CG2 3.49Å
324	D	89.7	Confident	87.2	Confident	42 Å²	42	45.1 Å²	45.1	23%	0.225	23%	0.228	C	C	.	.	H	α-helix	trans	-69.8	-39.2	175.1	-72.5	-36.1	0	0	0	111.3	I286 L321 V322 R327	I286-D324 HydrophobicContact CD1-CB 4.03Å; I286-D324 HydrophobicContact CG2-CB 4.29Å; I286-D324 WeakPolarHBondContact CG2-O 3.49Å; L321-D324 WeakPolarHBondContact O-CA 3.49Å; L321-D324 WeakPolarHBondContact O-CB 3.47Å; L321-D324 PolarHBondContact O-N 3.19Å; V322-D324 VanDerWaalsContact C-N 3.3Å; V322-D324 PolarHBondContact O-N 3.35Å; D324-R327 VanDerWaalsContact O-CB 3.32Å; D324-R327 WeakPolarHBondContact O-CB 3.5Å; D324-R327 PolarHBondContact O-N 2.92Å; D324-R327 PolarHBondContact O-NE 3.21Å; D324-R327 VanDerWaalsContact O-NE 3.17Å; D324-R327 IonicContact OD1-CZ 3.66Å; D324-R327 IonicContact OD1-NE 3.53Å; D324-R327 PolarHBondContact OD1-NE 3.39Å; D324-R327 IonicContact OD1-NH1 2.73Å; D324-R327 PolarHBondContact OD1-NH1 2.86Å; D324-R327 IonicContact OD1-NH2 3.11Å; D324-R327 PolarHBondContact OD1-NH2 3.3Å
325	I	91.6	Very high	87.3	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-42.9	175.4	-65.5	169	0	0	0	110.6	I286 L321 V322 R327 V328 T340 L343 L347	I286-I325 HydrophobicContact CD1-CD1 4.49Å; I286-I325 HydrophobicContact CD1-CG1 3.55Å; I286-I325 HydrophobicContact CG1-CG1 3.99Å; L321-I325 WeakPolarHBondContact O-CG1 3.49Å; L321-I325 PolarHBondContact O-N 3.32Å; V322-I325 WeakPolarHBondContact O-CB 3.41Å; V322-I325 PolarHBondContact O-N 3.44Å; I325-R327 PolarHBondContact O-N 3.43Å; I325-R327 VanDerWaalsContact O-N 3.09Å; I325-V328 WeakPolarHBondContact O-CB 3.39Å; I325-V328 VanDerWaalsContact O-CG2 3.27Å; I325-V328 WeakPolarHBondContact O-CG2 3.4Å; I325-V328 PolarHBondContact O-N 2.8Å; I325-T340 HydrophobicContact CG2-CG2 3.96Å; I325-L343 HydrophobicContact CD1-CD2 4.33Å; I325-L343 HydrophobicContact CG2-CD2 4.27Å; I325-L347 HydrophobicContact CD1-CD1 3.67Å
326	L	89.8	Confident	87.5	Confident	8 Å²	8	47 Å²	47	4%	0.042	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-19.3	179.4	-72.3	172.4	0	0	0	113.6	V322 M323 V328 L329 A344 L356 V359	V322-L326 HydrophobicContact CG1-CD1 4.36Å; V322-L326 WeakPolarHBondContact O-CG 3.49Å; V322-L326 PolarHBondContact O-N 2.88Å; M323-L326 HydrophobicContact SD-CD1 4.14Å; L326-V328 PolarHBondContact O-N 3.31Å; L326-L329 HydrophobicContact CD2-CD1 3.8Å; L326-L329 WeakPolarHBondContact O-CB 3.42Å; L326-L329 VanDerWaalsContact O-CG 3.29Å; L326-L329 WeakPolarHBondContact O-CG 3.42Å; L326-L329 PolarHBondContact O-N 2.73Å; L326-A344 HydrophobicContact CD2-CB 3.84Å; L326-L356 HydrophobicContact CD1-CB 4.25Å; L326-L356 HydrophobicContact CD1-CD1 4.14Å; L326-L356 HydrophobicContact CD1-CG 3.95Å; L326-V359 HydrophobicContact CB-CG1 4.28Å; L326-V359 HydrophobicContact CD1-CB 4.25Å; L326-V359 HydrophobicContact CD1-CG1 4.16Å
327	R	90.1	Very high	87.7	Confident	106 Å²	106	39.9 Å²	39.9	40%	0.4	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-62.6	-24.2	173.4	-59.8	-179.1	-62.9	-176.9	4.2	112.5	D287 I290 D324 I325 L329 S330	D287-R327 IonicContact OD1-NH2 2.75Å; I290-R327 HydrophobicContact CD1-CB 3.78Å; D324-R327 VanDerWaalsContact O-CB 3.32Å; D324-R327 WeakPolarHBondContact O-CB 3.5Å; D324-R327 PolarHBondContact O-N 2.92Å; D324-R327 PolarHBondContact O-NE 3.21Å; D324-R327 VanDerWaalsContact O-NE 3.17Å; D324-R327 IonicContact OD1-CZ 3.66Å; D324-R327 IonicContact OD1-NE 3.53Å; D324-R327 PolarHBondContact OD1-NE 3.39Å; D324-R327 IonicContact OD1-NH1 2.73Å; D324-R327 PolarHBondContact OD1-NH1 2.86Å; D324-R327 IonicContact OD1-NH2 3.11Å; D324-R327 PolarHBondContact OD1-NH2 3.3Å; I325-R327 PolarHBondContact O-N 3.43Å; I325-R327 VanDerWaalsContact O-N 3.09Å; R327-L329 PolarHBondContact O-N 3.39Å; R327-S330 WeakPolarHBondContact O-CB 3.39Å; R327-S330 PolarHBondContact O-N 3.26Å; R327-S330 PolarHBondContact O-OG 3.25Å
328	V	89.6	Confident	87.8	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.012	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-61.7	-25.5	177.1	174.8	0	0	0	0	112.2	I289 I290 I325 L326 S330 T331 V336 T340	I289-V328 HydrophobicContact CB-CG2 4.23Å; I289-V328 HydrophobicContact CG2-CB 4.23Å; I289-V328 HydrophobicContact CG2-CG1 3.48Å; I289-V328 VanDerWaalsContact CG2-CG1 3.48Å; I289-V328 HydrophobicContact CG2-CG2 3.7Å; I290-V328 HydrophobicContact CG1-CG2 4.14Å; I325-V328 WeakPolarHBondContact O-CB 3.39Å; I325-V328 VanDerWaalsContact O-CG2 3.27Å; I325-V328 WeakPolarHBondContact O-CG2 3.4Å; I325-V328 PolarHBondContact O-N 2.8Å; L326-V328 PolarHBondContact O-N 3.31Å; V328-S330 PolarHBondContact O-N 3.12Å; V328-T331 VanDerWaalsContact O-CB 3.29Å; V328-T331 WeakPolarHBondContact O-CB 3.48Å; V328-T331 PolarHBondContact O-N 3.26Å; V328-T331 PolarHBondContact O-OG1 3.01Å; V328-V336 HydrophobicContact CG1-CG1 3.72Å; V328-T340 HydrophobicContact CB-CG2 3.97Å; V328-T340 HydrophobicContact CG1-CG2 4.23Å; V328-T340 WeakPolarHBondContact CG1-OG1 3.49Å
329	L	86.4	Confident	87.9	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-59.4	-18.9	178	-61.8	179.5	0	0	0	113.8	L326 R327 T331 R337 T340 L341 L360	L326-L329 HydrophobicContact CD2-CD1 3.8Å; L326-L329 WeakPolarHBondContact O-CB 3.42Å; L326-L329 VanDerWaalsContact O-CG 3.29Å; L326-L329 WeakPolarHBondContact O-CG 3.42Å; L326-L329 PolarHBondContact O-N 2.73Å; R327-L329 PolarHBondContact O-N 3.39Å; L329-T331 PolarHBondContact O-N 3.36Å; L329-R337 HydrophobicContact CD2-CB 4.39Å; L329-R337 HydrophobicContact CD2-CG 4.31Å; L329-R337 PolarHBondContact O-NE 2.75Å; L329-R337 VanDerWaalsContact O-NE 3.12Å; L329-R337 PolarHBondContact O-NH2 3.5Å; L329-T340 HydrophobicContact CD2-CG2 3.85Å; L329-T340 HydrophobicContact CG-CG2 4.28Å; L329-L341 HydrophobicContact CD1-CD2 3.8Å; L329-L341 HydrophobicContact CD2-CD1 4.48Å; L329-L341 HydrophobicContact CD2-CD2 3.83Å; L329-L341 HydrophobicContact CD2-CG 3.77Å; L329-L341 HydrophobicContact CG-CD2 4.47Å; L329-L360 HydrophobicContact CD1-CD2 4.48Å
330	S	85.1	Confident	88.1	Confident	97 Å²	97	44.1 Å²	44.1	68%	0.678	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-60.5	-21.4	171.8	-45.8	0	0	0	0	113	R327 V328	R327-S330 WeakPolarHBondContact O-CB 3.39Å; R327-S330 PolarHBondContact O-N 3.26Å; R327-S330 PolarHBondContact O-OG 3.25Å; V328-S330 PolarHBondContact O-N 3.12Å
331	T	83.8	Confident	88.3	Confident	9 Å²	9	39.1 Å²	39.1	6%	0.055	20%	0.2	C	C	.	.	S	Bend	trans	-67.1	134	175.1	-56.1	0	0	0	0	109.8	K298 V328 L329 D333 V336 R337	K298-T331 HydrophobicContact CD-CG2 3.91Å; K298-T331 PolarHBondContact NZ-OG1 2.96Å; V328-T331 VanDerWaalsContact O-CB 3.29Å; V328-T331 WeakPolarHBondContact O-CB 3.48Å; V328-T331 PolarHBondContact O-N 3.26Å; V328-T331 PolarHBondContact O-OG1 3.01Å; L329-T331 PolarHBondContact O-N 3.36Å; T331-D333 VanDerWaalsContact C-N 3.32Å; T331-D333 HydrophobicContact CG2-CB 4.14Å; T331-D333 PolarHBondContact O-N 3.41Å; T331-V336 HydrophobicContact CG2-CB 4.48Å; T331-V336 HydrophobicContact CG2-CG1 4.31Å; T331-R337 PolarHBondContact O-NE 3.21Å; T331-R337 PolarHBondContact O-NH2 3.47Å; T331-R337 VanDerWaalsContact O-NH2 3.15Å
332	P	81	Confident	88.2	Confident	103 Å²	103	44.5 Å²	44.5	67%	0.669	23%	0.225	S	C	*	.			trans	-70.5	-24.3	-176.2	27.1	-35	0	0	0	114.3	L334 R337	P332-L334 PolarHBondContact O-N 2.84Å; P332-R337 PolarHBondContact O-NH1 3.03Å
333	D	86.1	Confident	88.2	Confident	44 Å²	44	44.7 Å²	44.7	24%	0.235	23%	0.226	C	C	.	.			trans	-64.3	128.6	-175	-173.4	86	0	0	0	113.3	N295 T331 E335 V336 R337	N295-D333 PolarHBondContact ND2-OD1 3.23Å; T331-D333 VanDerWaalsContact C-N 3.32Å; T331-D333 HydrophobicContact CG2-CB 4.14Å; T331-D333 PolarHBondContact O-N 3.41Å; D333-E335 WeakPolarHBondContact OD2-CA 3.4Å; D333-E335 WeakPolarHBondContact OD2-CB 3.49Å; D333-E335 PolarHBondContact OD2-N 2.79Å; D333-V336 HydrophobicContact CB-CB 4.22Å; D333-V336 HydrophobicContact CB-CG2 4.09Å; D333-V336 WeakPolarHBondContact OD2-CG2 3.44Å; D333-V336 PolarHBondContact OD2-N 3.48Å; D333-R337 WeakPolarHBondContact O-CB 3.38Å; D333-R337 WeakPolarHBondContact O-CD 3.27Å; D333-R337 VanDerWaalsContact O-CG 3.26Å; D333-R337 WeakPolarHBondContact O-CG 3.25Å; D333-R337 PolarHBondContact O-N 3.26Å; D333-R337 VanDerWaalsContact O-N 3.15Å
334	L	85	Confident	88.3	Confident	44 Å²	44	42 Å²	42	23%	0.23	21%	0.213	C	C	.	.	H	α-helix	trans	-69.6	-34.9	-176.1	-176.9	65.1	0	0	0	112.5	P332 R337 K338 K378	P332-L334 PolarHBondContact O-N 2.84Å; L334-R337 PolarHBondContact O-N 2.95Å; L334-K338 VanDerWaalsContact O-CB 3.32Å; L334-K338 WeakPolarHBondContact O-CB 3.37Å; L334-K338 PolarHBondContact O-N 3.21Å; L334-K378 HydrophobicContact CD1-CB 4.48Å; L334-K378 HydrophobicContact CD2-CB 3.98Å; L334-K378 HydrophobicContact CD2-CD 3.99Å
335	E	85.8	Confident	88.2	Confident	107 Å²	107	41.3 Å²	41.3	50%	0.5	21%	0.209	S	C	.	.	H	α-helix	trans	-72.4	-44	-177.8	-170.8	170.3	179	0	0	111.2	L299 D333 R337 K338 K339	L299-E335 HydrophobicContact CD2-CB 4.45Å; L299-E335 HydrophobicContact CD2-CG 4Å; D333-E335 WeakPolarHBondContact OD2-CA 3.4Å; D333-E335 WeakPolarHBondContact OD2-CB 3.49Å; D333-E335 PolarHBondContact OD2-N 2.79Å; E335-R337 VanDerWaalsContact C-N 3.31Å; E335-R337 PolarHBondContact O-N 3.02Å; E335-K338 PolarHBondContact O-N 3.4Å; E335-K339 PolarHBondContact O-N 3.25Å
336	V	88.8	Confident	87.9	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-57.5	-45.6	172	176.2	0	0	0	0	110.4	K298 L299 V328 T331 D333 T340	K298-V336 HydrophobicContact CB-CG2 4.11Å; L299-V336 HydrophobicContact CD2-CG2 3.76Å; L299-V336 HydrophobicContact CG-CG2 4Å; V328-V336 HydrophobicContact CG1-CG1 3.72Å; T331-V336 HydrophobicContact CG2-CB 4.48Å; T331-V336 HydrophobicContact CG2-CG1 4.31Å; D333-V336 HydrophobicContact CB-CB 4.22Å; D333-V336 HydrophobicContact CB-CG2 4.09Å; D333-V336 WeakPolarHBondContact OD2-CG2 3.44Å; D333-V336 PolarHBondContact OD2-N 3.48Å; V336-T340 VanDerWaalsContact O-CB 3.26Å; V336-T340 WeakPolarHBondContact O-CB 3.27Å; V336-T340 PolarHBondContact O-N 3.45Å; V336-T340 PolarHBondContact O-OG1 2.68Å
337	R	90.1	Very high	87.8	Confident	40 Å²	40	43.2 Å²	43.2	15%	0.151	22%	0.219	C	C	.	.	H	α-helix	trans	-61.1	-44.1	176.1	-76.9	167.5	167.6	175.7	7.9	112.4	L329 T331 P332 D333 L334 E335 T340 L341 Y379	L329-R337 HydrophobicContact CD2-CB 4.39Å; L329-R337 HydrophobicContact CD2-CG 4.31Å; L329-R337 PolarHBondContact O-NE 2.75Å; L329-R337 VanDerWaalsContact O-NE 3.12Å; L329-R337 PolarHBondContact O-NH2 3.5Å; T331-R337 PolarHBondContact O-NE 3.21Å; T331-R337 PolarHBondContact O-NH2 3.47Å; T331-R337 VanDerWaalsContact O-NH2 3.15Å; P332-R337 PolarHBondContact O-NH1 3.03Å; D333-R337 WeakPolarHBondContact O-CB 3.38Å; D333-R337 WeakPolarHBondContact O-CD 3.27Å; D333-R337 VanDerWaalsContact O-CG 3.26Å; D333-R337 WeakPolarHBondContact O-CG 3.25Å; D333-R337 PolarHBondContact O-N 3.26Å; D333-R337 VanDerWaalsContact O-N 3.15Å; L334-R337 PolarHBondContact O-N 2.95Å; E335-R337 VanDerWaalsContact C-N 3.31Å; E335-R337 PolarHBondContact O-N 3.02Å; R337-T340 PolarHBondContact O-N 3.3Å; R337-L341 WeakPolarHBondContact O-CB 3.28Å; R337-L341 WeakPolarHBondContact O-CG 3.14Å; R337-L341 PolarHBondContact O-N 3.36Å; R337-Y379 HydrophobicContact CB-CD2 4.2Å; R337-Y379 HydrophobicContact CB-CE2 3.92Å; R337-Y379 HydrophobicContact CG-CD2 4.4Å; R337-Y379 HydrophobicContact CG-CE2 3.92Å
338	K	89.1	Confident	87.7	Confident	107 Å²	107	39 Å²	39	47%	0.465	21%	0.205	S	C	.	.	H	α-helix	trans	-61.6	-51.2	178.9	-175.4	-178.7	176	-176.7	0	112.6	L334 E335 T340 L341 Q342 L382	L334-K338 VanDerWaalsContact O-CB 3.32Å; L334-K338 WeakPolarHBondContact O-CB 3.37Å; L334-K338 PolarHBondContact O-N 3.21Å; E335-K338 PolarHBondContact O-N 3.4Å; K338-T340 VanDerWaalsContact C-N 3.3Å; K338-T340 PolarHBondContact O-N 3.39Å; K338-L341 PolarHBondContact O-N 2.63Å; K338-Q342 WeakPolarHBondContact O-CB 3.13Å; K338-Q342 PolarHBondContact O-N 3.05Å; K338-L382 HydrophobicContact CB-CD2 3.88Å; K338-L382 HydrophobicContact CG-CD1 4.35Å; K338-L382 HydrophobicContact CG-CD2 4.2Å
339	K	89.8	Confident	87.6	Confident	47 Å²	47	40 Å²	40	20%	0.204	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-38.8	176.2	-74.9	-170.4	178.3	-172.2	0	111.6	L299 L302 D303 I306 E335 Q342 L343	L299-K339 HydrophobicContact CD2-CD 4.03Å; L302-K339 HydrophobicContact CD2-CB 3.35Å; L302-K339 HydrophobicContact CD2-CD 4.28Å; L302-K339 HydrophobicContact CD2-CG 4.45Å; L302-K339 HydrophobicContact CG-CB 4.22Å; D303-K339 IonicContact OD1-NZ 2.66Å; D303-K339 PolarHBondContact OD1-NZ 3.39Å; D303-K339 IonicContact OD2-NZ 3.85Å; D303-K339 PolarHBondContact OD2-NZ 2.89Å; I306-K339 HydrophobicContact CD1-CB 4.48Å; E335-K339 PolarHBondContact O-N 3.25Å; K339-Q342 PolarHBondContact O-N 2.91Å; K339-L343 WeakPolarHBondContact O-CB 3.39Å; K339-L343 PolarHBondContact O-N 2.71Å
340	T	92.2	Very high	87.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-46.8	177.6	-59.4	0	0	0	0	112	I325 V328 L329 V336 R337 K338 Q342 L343 A344	I325-T340 HydrophobicContact CG2-CG2 3.96Å; V328-T340 HydrophobicContact CB-CG2 3.97Å; V328-T340 HydrophobicContact CG1-CG2 4.23Å; V328-T340 WeakPolarHBondContact CG1-OG1 3.49Å; L329-T340 HydrophobicContact CD2-CG2 3.85Å; L329-T340 HydrophobicContact CG-CG2 4.28Å; V336-T340 VanDerWaalsContact O-CB 3.26Å; V336-T340 WeakPolarHBondContact O-CB 3.27Å; V336-T340 PolarHBondContact O-N 3.45Å; V336-T340 PolarHBondContact O-OG1 2.68Å; R337-T340 PolarHBondContact O-N 3.3Å; K338-T340 VanDerWaalsContact C-N 3.3Å; K338-T340 PolarHBondContact O-N 3.39Å; T340-Q342 VanDerWaalsContact C-N 3.33Å; T340-Q342 PolarHBondContact O-N 2.87Å; T340-L343 PolarHBondContact O-N 2.82Å; T340-A344 WeakPolarHBondContact O-CB 3.5Å; T340-A344 PolarHBondContact O-N 2.85Å
341	L	90.6	Very high	87.5	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-64.8	-38.2	178	-71.9	173.3	0	0	0	111.7	L329 R337 K338 A344 L345 L360 Y379 L382 L383 T386	L329-L341 HydrophobicContact CD1-CD2 3.8Å; L329-L341 HydrophobicContact CD2-CD1 4.48Å; L329-L341 HydrophobicContact CD2-CD2 3.83Å; L329-L341 HydrophobicContact CD2-CG 3.77Å; L329-L341 HydrophobicContact CG-CD2 4.47Å; R337-L341 WeakPolarHBondContact O-CB 3.28Å; R337-L341 WeakPolarHBondContact O-CG 3.14Å; R337-L341 PolarHBondContact O-N 3.36Å; K338-L341 PolarHBondContact O-N 2.63Å; L341-A344 PolarHBondContact O-N 2.96Å; L341-L345 WeakPolarHBondContact O-CB 3.35Å; L341-L345 WeakPolarHBondContact O-CG 3.47Å; L341-L345 PolarHBondContact O-N 3.49Å; L341-L360 HydrophobicContact CD2-CD2 3.68Å; L341-Y379 HydrophobicContact CD1-CE2 4.21Å; L341-L382 HydrophobicContact CD1-CD2 3.71Å; L341-L382 HydrophobicContact CD1-CG 3.69Å; L341-L383 HydrophobicContact CD1-CD2 3.91Å; L341-L383 HydrophobicContact CD2-CD2 4.16Å; L341-T386 HydrophobicContact CD2-CG2 4.23Å
342	Q	89.4	Confident	87.6	Confident	115 Å²	115	50.7 Å²	50.7	54%	0.537	25%	0.253	S	S	.	.	H	α-helix	trans	-64.1	-46.1	174.7	-173	170.6	2.5	0	0	111.8	K338 K339 T340 A344 L345 D346	K338-Q342 WeakPolarHBondContact O-CB 3.13Å; K338-Q342 PolarHBondContact O-N 3.05Å; K339-Q342 PolarHBondContact O-N 2.91Å; T340-Q342 VanDerWaalsContact C-N 3.33Å; T340-Q342 PolarHBondContact O-N 2.87Å; Q342-A344 VanDerWaalsContact C-N 3.33Å; Q342-A344 PolarHBondContact O-N 3.32Å; Q342-L345 PolarHBondContact O-N 2.98Å; Q342-D346 VanDerWaalsContact O-CG 3.3Å; Q342-D346 PolarHBondContact O-N 3.43Å; Q342-D346 VanDerWaalsContact O-N 3.09Å
343	L	90.3	Very high	87.9	Confident	4 Å²	4	46.2 Å²	46.2	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-60.3	-43.4	174.3	178.3	60	0	0	0	111.5	L302 L305 I306 K309 I325 K339 T340 D346 L347	L302-L343 HydrophobicContact CD1-CD2 3.99Å; L305-L343 HydrophobicContact CB-CD2 4.15Å; I306-L343 HydrophobicContact CG1-CB 4.37Å; I306-L343 HydrophobicContact CG1-CD1 4.16Å; I306-L343 HydrophobicContact CG1-CD2 4.23Å; I306-L343 HydrophobicContact CG1-CG 4.48Å; K309-L343 HydrophobicContact CB-CD1 4.43Å; K309-L343 HydrophobicContact CD-CD1 4.05Å; I325-L343 HydrophobicContact CD1-CD2 4.33Å; I325-L343 HydrophobicContact CG2-CD2 4.27Å; K339-L343 WeakPolarHBondContact O-CB 3.39Å; K339-L343 PolarHBondContact O-N 2.71Å; T340-L343 PolarHBondContact O-N 2.82Å; L343-D346 PolarHBondContact O-N 2.86Å; L343-L347 HydrophobicContact CD1-CD1 3.82Å; L343-L347 HydrophobicContact CD1-CG 4.21Å; L343-L347 HydrophobicContact CG-CD1 3.96Å; L343-L347 WeakPolarHBondContact O-CG 3.48Å; L343-L347 PolarHBondContact O-N 2.68Å; L343-L347 VanDerWaalsContact O-N 3.13Å
344	A	90.5	Very high	88	Confident	2 Å²	2	49.6 Å²	49.6	2%	0.017	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-45.7	177.3	0	0	0	0	0	111.7	L326 T340 L341 Q342 D346 L347 V348 L356	L326-A344 HydrophobicContact CD2-CB 3.84Å; T340-A344 WeakPolarHBondContact O-CB 3.5Å; T340-A344 PolarHBondContact O-N 2.85Å; L341-A344 PolarHBondContact O-N 2.96Å; Q342-A344 VanDerWaalsContact C-N 3.33Å; Q342-A344 PolarHBondContact O-N 3.32Å; A344-D346 PolarHBondContact O-N 2.82Å; A344-L347 CarbonylContact O-C 3.56Å; A344-L347 PolarHBondContact O-N 3.18Å; A344-L347 VanDerWaalsContact O-N 3.14Å; A344-V348 WeakPolarHBondContact O-CG2 3.4Å; A344-V348 PolarHBondContact O-N 2.91Å; A344-V348 VanDerWaalsContact O-N 3.15Å; A344-L356 HydrophobicContact CB-CD1 4.36Å
345	L	86.8	Confident	88.1	Confident	26 Å²	26	52.9 Å²	52.9	14%	0.136	25%	0.252	C	S	.	.	H	α-helix	trans	-57.5	-37.2	176.6	-82.6	171.6	0	0	0	113	L341 Q342 T386 C390 R393	L341-L345 WeakPolarHBondContact O-CB 3.35Å; L341-L345 WeakPolarHBondContact O-CG 3.47Å; L341-L345 PolarHBondContact O-N 3.49Å; Q342-L345 PolarHBondContact O-N 2.98Å; L345-T386 HydrophobicContact CD1-CG2 3.83Å; L345-T386 HydrophobicContact CD2-CG2 3.69Å; L345-T386 HydrophobicContact CG-CG2 3.67Å; L345-C390 WeakPolarHBondContact CD2-SG 3.45Å; L345-R393 PolarHBondContact O-NH1 3.36Å
346	D	86.4	Confident	88.2	Confident	50 Å²	50	47.9 Å²	47.9	27%	0.267	23%	0.229	S	C	.	.	H	α-helix	trans	-76.1	-27.6	179.5	-69.8	-24.2	0	0	0	113.1	K309 Q342 L343 A344	K309-D346 HydrophobicContact CD-CB 4.13Å; K309-D346 VanDerWaalsContact NZ-CB 3.26Å; K309-D346 IonicContact NZ-OD2 3.71Å; K309-D346 PolarHBondContact NZ-OD2 3.07Å; Q342-D346 VanDerWaalsContact O-CG 3.3Å; Q342-D346 PolarHBondContact O-N 3.43Å; Q342-D346 VanDerWaalsContact O-N 3.09Å; L343-D346 PolarHBondContact O-N 2.86Å; A344-D346 PolarHBondContact O-N 2.82Å
347	L	87.6	Confident	88.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	4	177.6	-63.9	172.5	0	0	0	113.2	K309 E315 L318 Q319 V322 I325 L343 A344 S349 N352	K309-L347 HydrophobicContact CG-CD2 4.17Å; E315-L347 HydrophobicContact CG-CD2 3.96Å; L318-L347 HydrophobicContact CB-CD1 3.86Å; L318-L347 HydrophobicContact CB-CD2 3.74Å; L318-L347 HydrophobicContact CB-CG 4.47Å; Q319-L347 HydrophobicContact CG-CB 4.46Å; Q319-L347 HydrophobicContact CG-CD2 4.34Å; Q319-L347 WeakPolarHBondContact CG-O 3.49Å; V322-L347 HydrophobicContact CG2-CB 3.47Å; V322-L347 VanDerWaalsContact CG2-CB 3.47Å; V322-L347 HydrophobicContact CG2-CD1 4.19Å; V322-L347 HydrophobicContact CG2-CG 4.48Å; I325-L347 HydrophobicContact CD1-CD1 3.67Å; L343-L347 HydrophobicContact CD1-CD1 3.82Å; L343-L347 HydrophobicContact CD1-CG 4.21Å; L343-L347 HydrophobicContact CG-CD1 3.96Å; L343-L347 WeakPolarHBondContact O-CG 3.48Å; L343-L347 PolarHBondContact O-N 2.68Å; L343-L347 VanDerWaalsContact O-N 3.13Å; A344-L347 CarbonylContact O-C 3.56Å; A344-L347 PolarHBondContact O-N 3.18Å; A344-L347 VanDerWaalsContact O-N 3.14Å; L347-S349 PolarHBondContact O-N 3.46Å; L347-N352 PolarHBondContact O-ND2 3.43Å
348	V	88.1	Confident	88.1	Confident	18 Å²	18	49.9 Å²	49.9	11%	0.109	24%	0.242	C	C	.	.			trans	-70.4	131	178.5	-171.1	0	0	0	0	110.6	A344 N352 V353 L356 F394	A344-V348 WeakPolarHBondContact O-CG2 3.4Å; A344-V348 PolarHBondContact O-N 2.91Å; A344-V348 VanDerWaalsContact O-N 3.15Å; V348-N352 WeakPolarHBondContact CA-OD1 3.34Å; V348-V353 HydrophobicContact CG1-CB 3.73Å; V348-V353 HydrophobicContact CG1-CG2 3.86Å; V348-L356 HydrophobicContact CG2-CD1 3.59Å; V348-L356 HydrophobicContact CG2-CD2 4.5Å; V348-F394 HydrophobicContact CB-CE2 4.03Å; V348-F394 HydrophobicContact CG1-CD2 4.06Å; V348-F394 HydrophobicContact CG1-CE2 3.35Å; V348-F394 HydrophobicContact CG1-CZ 3.89Å
349	S	86.3	Confident	88.1	Confident	23 Å²	23	46.7 Å²	46.7	16%	0.161	23%	0.231	C	C	.	.			trans	-127.9	169.3	172.8	70	0	0	0	0	109.9	L347 R351 N352 V353	L347-S349 PolarHBondContact O-N 3.46Å; S349-R351 PolarHBondContact O-N 3.2Å; S349-R351 PolarHBondContact OG-N 3.45Å; S349-N352 PolarHBondContact N-OD1 3.4Å; S349-N352 PolarHBondContact O-N 3.09Å; S349-N352 PolarHBondContact O-OD1 3.42Å; S349-V353 WeakPolarHBondContact O-CB 3.42Å; S349-V353 PolarHBondContact O-N 3.26Å; S349-V353 VanDerWaalsContact O-N 3.17Å
350	S	84.7	Confident	88	Confident	99 Å²	99	44.5 Å²	44.5	69%	0.692	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-14.2	174.6	60	0	0	0	0	113.8
351	R	85.2	Confident	87.7	Confident	220 Å²	220	48.6 Å²	48.6	83%	0.83	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-33.9	-179.9	-64.2	-178.6	176.6	177.9	-1.3	113.6	S349	S349-R351 PolarHBondContact O-N 3.2Å; S349-R351 PolarHBondContact OG-N 3.45Å
352	N	86.9	Confident	87.5	Confident	13 Å²	13	54.7 Å²	54.7	7%	0.07	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-10	-172.2	63.1	16.5	0	0	0	113.4	Q319 L347 V348 S349 E354 E355 L356	Q319-N352 PolarHBondContact O-ND2 2.93Å; L347-N352 PolarHBondContact O-ND2 3.43Å; V348-N352 WeakPolarHBondContact CA-OD1 3.34Å; S349-N352 PolarHBondContact N-OD1 3.4Å; S349-N352 PolarHBondContact O-N 3.09Å; S349-N352 PolarHBondContact O-OD1 3.42Å; N352-E354 VanDerWaalsContact C-N 3.32Å; N352-E354 PolarHBondContact O-N 3.41Å; N352-E355 PolarHBondContact O-N 2.94Å; N352-L356 WeakPolarHBondContact O-CB 3.18Å; N352-L356 PolarHBondContact O-N 3.14Å
353	V	87	Confident	87.4	Confident	9 Å²	9	50.2 Å²	50.2	6%	0.055	25%	0.245	C	C	.	.	H	α-helix	trans	-59.7	-38.3	-174.9	67.1	0	0	0	0	113.2	V348 S349 L356 V357 F394 M397	V348-V353 HydrophobicContact CG1-CB 3.73Å; V348-V353 HydrophobicContact CG1-CG2 3.86Å; S349-V353 WeakPolarHBondContact O-CB 3.42Å; S349-V353 PolarHBondContact O-N 3.26Å; S349-V353 VanDerWaalsContact O-N 3.17Å; V353-L356 PolarHBondContact O-N 3.35Å; V353-V357 HydrophobicContact CG2-CG2 4.22Å; V353-V357 WeakPolarHBondContact O-CB 3.38Å; V353-V357 VanDerWaalsContact O-CG2 3.27Å; V353-V357 WeakPolarHBondContact O-CG2 3.41Å; V353-V357 PolarHBondContact O-N 2.96Å; V353-F394 HydrophobicContact CB-CD2 4.23Å; V353-F394 HydrophobicContact CB-CG 4.3Å; V353-F394 HydrophobicContact CG1-CD1 4.42Å; V353-F394 HydrophobicContact CG1-CG 4.31Å; V353-F394 HydrophobicContact CG2-CB 4.03Å; V353-F394 HydrophobicContact CG2-CD2 3.6Å; V353-F394 HydrophobicContact CG2-CE2 4.24Å; V353-F394 HydrophobicContact CG2-CG 3.85Å; V353-M397 HydrophobicContact CG1-CG 3.93Å; V353-M397 HydrophobicContact CG1-SD 4.41Å; V353-M397 HydrophobicContact CG2-CG 3.94Å
354	E	87.8	Confident	87	Confident	116 Å²	116	50 Å²	50	54%	0.542	24%	0.244	S	C	.	.	H	α-helix	trans	-62.6	-50.2	-178.7	-179.3	171.3	-168	0	0	111.5	N352 L356 V357 I358 M397	N352-E354 VanDerWaalsContact C-N 3.32Å; N352-E354 PolarHBondContact O-N 3.41Å; E354-L356 PolarHBondContact O-N 2.99Å; E354-V357 PolarHBondContact O-N 2.94Å; E354-I358 HydrophobicContact CG-CD1 4.23Å; E354-I358 VanDerWaalsContact O-CG1 3.3Å; E354-I358 WeakPolarHBondContact O-CG1 3.45Å; E354-I358 PolarHBondContact O-N 3.1Å; E354-I358 VanDerWaalsContact O-N 3.13Å; E354-M397 HydrophobicContact CB-CE 4.05Å; E354-M397 HydrophobicContact CB-SD 4.06Å; E354-M397 HydrophobicContact CG-CE 4.01Å; E354-M397 HydrophobicContact CG-SD 4.4Å
355	E	87.1	Confident	86.6	Confident	112 Å²	112	53.4 Å²	53.4	52%	0.523	26%	0.261	S	S	.	.	H	α-helix	trans	-65.5	-40.2	178.6	-60.9	-171.7	174.3	0	0	112.1	M323 N352 I358 V359	M323-E355 HydrophobicContact CE-CB 3.58Å; M323-E355 WeakPolarHBondContact CG-OE2 3.33Å; M323-E355 HydrophobicContact SD-CB 3.68Å; N352-E355 PolarHBondContact O-N 2.94Å; E355-I358 PolarHBondContact O-N 3.46Å; E355-V359 WeakPolarHBondContact O-CG2 3.49Å; E355-V359 PolarHBondContact O-N 2.91Å
356	L	88.3	Confident	86.4	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-60.9	-45.8	176.8	177.8	147.6	0	0	0	111.6	V322 L326 A344 V348 N352 V353 E354 I358 V359 L360	V322-L356 HydrophobicContact CG1-CD1 3.77Å; L326-L356 HydrophobicContact CD1-CB 4.25Å; L326-L356 HydrophobicContact CD1-CD1 4.14Å; L326-L356 HydrophobicContact CD1-CG 3.95Å; A344-L356 HydrophobicContact CB-CD1 4.36Å; V348-L356 HydrophobicContact CG2-CD1 3.59Å; V348-L356 HydrophobicContact CG2-CD2 4.5Å; N352-L356 WeakPolarHBondContact O-CB 3.18Å; N352-L356 PolarHBondContact O-N 3.14Å; V353-L356 PolarHBondContact O-N 3.35Å; E354-L356 PolarHBondContact O-N 2.99Å; L356-I358 VanDerWaalsContact C-N 3.29Å; L356-I358 PolarHBondContact O-N 3.3Å; L356-V359 PolarHBondContact O-N 3.45Å; L356-L360 HydrophobicContact CD2-CD1 3.48Å; L356-L360 VanDerWaalsContact CD2-CD1 3.48Å; L356-L360 HydrophobicContact CD2-CG 4.11Å; L356-L360 HydrophobicContact CG-CD1 4.34Å; L356-L360 WeakPolarHBondContact O-CG 3.1Å; L356-L360 PolarHBondContact O-N 2.87Å
357	V	87.1	Confident	85.9	Confident	5 Å²	5	55.6 Å²	55.6	3%	0.03	27%	0.268	C	S	.	.	H	α-helix	trans	-61.9	-38.8	177.4	166.6	0	0	0	0	111	V353 E354 L360 K361 L387 M397 V401	V353-V357 HydrophobicContact CG2-CG2 4.22Å; V353-V357 WeakPolarHBondContact O-CB 3.38Å; V353-V357 VanDerWaalsContact O-CG2 3.27Å; V353-V357 WeakPolarHBondContact O-CG2 3.41Å; V353-V357 PolarHBondContact O-N 2.96Å; E354-V357 PolarHBondContact O-N 2.94Å; V357-L360 PolarHBondContact O-N 3.01Å; V357-K361 VanDerWaalsContact O-CB 3.27Å; V357-K361 WeakPolarHBondContact O-CB 3.11Å; V357-K361 PolarHBondContact O-N 3.29Å; V357-L387 HydrophobicContact CG1-CD2 4.4Å; V357-M397 HydrophobicContact CB-CE 4.14Å; V357-M397 HydrophobicContact CG1-CE 4.2Å; V357-M397 HydrophobicContact CG2-CB 4.43Å; V357-M397 HydrophobicContact CG2-CE 4.41Å; V357-V401 HydrophobicContact CG1-CG2 3.44Å; V357-V401 VanDerWaalsContact CG1-CG2 3.44Å; V357-V401 HydrophobicContact CG2-CG2 4.38Å
358	I	88.2	Confident	85	Confident	77 Å²	77	60.6 Å²	60.6	40%	0.395	29%	0.294	S	S	.	.	H	α-helix	trans	-63.7	-42.1	176.2	-67.5	164.3	0	0	0	111.1	E354 E355 L356 K362	E354-I358 HydrophobicContact CG-CD1 4.23Å; E354-I358 VanDerWaalsContact O-CG1 3.3Å; E354-I358 WeakPolarHBondContact O-CG1 3.45Å; E354-I358 PolarHBondContact O-N 3.1Å; E354-I358 VanDerWaalsContact O-N 3.13Å; E355-I358 PolarHBondContact O-N 3.46Å; L356-I358 VanDerWaalsContact C-N 3.29Å; L356-I358 PolarHBondContact O-N 3.3Å; I358-K362 WeakPolarHBondContact O-CG 3.44Å; I358-K362 PolarHBondContact O-N 3.4Å
359	V	89.5	Confident	83.9	Confident	40 Å²	40	66.1 Å²	66.1	24%	0.242	32%	0.323	C	S	.	.	H	α-helix	trans	-65.8	-47.5	176.8	172.6	0	0	0	0	111.1	M323 L326 E355 L356 K361 K362 E363	M323-V359 HydrophobicContact CE-CG2 3.49Å; M323-V359 VanDerWaalsContact CE-CG2 3.49Å; L326-V359 HydrophobicContact CB-CG1 4.28Å; L326-V359 HydrophobicContact CD1-CB 4.25Å; L326-V359 HydrophobicContact CD1-CG1 4.16Å; E355-V359 WeakPolarHBondContact O-CG2 3.49Å; E355-V359 PolarHBondContact O-N 2.91Å; L356-V359 PolarHBondContact O-N 3.45Å; V359-K361 VanDerWaalsContact C-N 3.32Å; V359-K361 PolarHBondContact O-N 2.71Å; V359-K362 WeakPolarHBondContact O-CB 3.49Å; V359-K362 PolarHBondContact O-N 3.08Å; V359-K362 VanDerWaalsContact O-N 3.15Å; V359-E363 WeakPolarHBondContact O-CB 3.35Å; V359-E363 PolarHBondContact O-N 2.94Å
360	L	88.3	Confident	82.9	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-60.4	-41.2	177.1	-69.3	-177.7	0	0	0	111.6	L329 L341 L356 V357 K362 E363 V364 L383 T386 L387	L329-L360 HydrophobicContact CD1-CD2 4.48Å; L341-L360 HydrophobicContact CD2-CD2 3.68Å; L356-L360 HydrophobicContact CD2-CD1 3.48Å; L356-L360 VanDerWaalsContact CD2-CD1 3.48Å; L356-L360 HydrophobicContact CD2-CG 4.11Å; L356-L360 HydrophobicContact CG-CD1 4.34Å; L356-L360 WeakPolarHBondContact O-CG 3.1Å; L356-L360 PolarHBondContact O-N 2.87Å; V357-L360 PolarHBondContact O-N 3.01Å; L360-K362 PolarHBondContact O-N 3.13Å; L360-E363 PolarHBondContact O-N 3.24Å; L360-V364 WeakPolarHBondContact O-CB 3.27Å; L360-V364 VanDerWaalsContact O-CG2 3.25Å; L360-V364 WeakPolarHBondContact O-CG2 3.46Å; L360-V364 PolarHBondContact O-N 2.76Å; L360-L383 HydrophobicContact CD2-CD2 3.9Å; L360-T386 HydrophobicContact CD1-CG2 3.67Å; L360-T386 HydrophobicContact CD2-CG2 4.48Å; L360-L387 HydrophobicContact CB-CD1 4.45Å; L360-L387 HydrophobicContact CB-CD2 3.66Å; L360-L387 HydrophobicContact CB-CG 4.04Å; L360-L387 HydrophobicContact CD1-CD2 3.82Å; L360-L387 HydrophobicContact CD1-CG 4.11Å; L360-L387 HydrophobicContact CG-CD2 4.42Å
361	K	85.9	Confident	81.3	Confident	86 Å²	86	68.3 Å²	68.3	37%	0.374	34%	0.335	S	S	.	.	H	α-helix	trans	-57.6	-47.8	173.2	173.2	175.9	-176.6	159.2	0	111.6	V357 V359 E363 V364 I365 V404	V357-K361 VanDerWaalsContact O-CB 3.27Å; V357-K361 WeakPolarHBondContact O-CB 3.11Å; V357-K361 PolarHBondContact O-N 3.29Å; V359-K361 VanDerWaalsContact C-N 3.32Å; V359-K361 PolarHBondContact O-N 2.71Å; K361-E363 VanDerWaalsContact C-N 3.29Å; K361-E363 PolarHBondContact O-N 2.9Å; K361-V364 PolarHBondContact O-N 3.27Å; K361-I365 HydrophobicContact CG-CD1 3.9Å; K361-I365 WeakPolarHBondContact O-CD1 3.44Å; K361-I365 VanDerWaalsContact O-CG1 3.27Å; K361-I365 WeakPolarHBondContact O-CG1 3.42Å; K361-I365 PolarHBondContact O-N 2.86Å; K361-V404 HydrophobicContact CD-CG2 3.57Å; K361-V404 HydrophobicContact CG-CG1 4.09Å; K361-V404 HydrophobicContact CG-CG2 3.93Å
362	K	87.1	Confident	79.9	Confident	129 Å²	129	65.2 Å²	65.2	56%	0.561	33%	0.33	S	S	*	.	H	α-helix	trans	-61.1	-41.5	177.4	-74.7	175.9	-178.7	177	0	111.3	I358 V359 L360 I365 K366	I358-K362 WeakPolarHBondContact O-CG 3.44Å; I358-K362 PolarHBondContact O-N 3.4Å; V359-K362 WeakPolarHBondContact O-CB 3.49Å; V359-K362 PolarHBondContact O-N 3.08Å; V359-K362 VanDerWaalsContact O-N 3.15Å; L360-K362 PolarHBondContact O-N 3.13Å; K362-I365 PolarHBondContact O-N 2.96Å; K362-K366 WeakPolarHBondContact O-CG 3.43Å; K362-K366 PolarHBondContact O-N 3.21Å
363	E	85.6	Confident	78.5	Confident	21 Å²	21	70.6 Å²	70.6	10%	0.098	36%	0.355	C	S	.	.	H	α-helix	trans	-67.1	-43.3	-179.6	-162.9	62.9	-170.8	0	0	111.9	V359 L360 K361 I365 K366 T367 Y379 L383	V359-E363 WeakPolarHBondContact O-CB 3.35Å; V359-E363 PolarHBondContact O-N 2.94Å; L360-E363 PolarHBondContact O-N 3.24Å; K361-E363 VanDerWaalsContact C-N 3.29Å; K361-E363 PolarHBondContact O-N 2.9Å; E363-I365 PolarHBondContact O-N 2.96Å; E363-K366 WeakPolarHBondContact O-CB 3.23Å; E363-K366 PolarHBondContact O-N 3.24Å; E363-K366 VanDerWaalsContact O-N 3.17Å; E363-K366 WeakPolarHBondContact OE2-CD 3.36Å; E363-K366 IonicContact OE2-NZ 2.94Å; E363-K366 PolarHBondContact OE2-NZ 3.46Å; E363-T367 WeakPolarHBondContact O-CG2 3.33Å; E363-T367 PolarHBondContact O-N 2.89Å; E363-T367 VanDerWaalsContact O-N 3.17Å; E363-Y379 HydrophobicContact CG-CE1 4.18Å; E363-Y379 WeakPolarHBondContact CG-OH 3.3Å; E363-Y379 PolarHBondContact OE1-OH 3.23Å; E363-Y379 VanDerWaalsContact OE1-OH 3.06Å; E363-L383 HydrophobicContact CB-CD1 4.44Å; E363-L383 HydrophobicContact CG-CD1 4.07Å; E363-L383 HydrophobicContact CG-CD2 4.32Å
364	V	82.8	Confident	77.2	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-57.5	-46.6	172.7	165.4	0	0	0	0	111.2	L360 K361 K366 T367 L383 L387 F408	L360-V364 WeakPolarHBondContact O-CB 3.27Å; L360-V364 VanDerWaalsContact O-CG2 3.25Å; L360-V364 WeakPolarHBondContact O-CG2 3.46Å; L360-V364 PolarHBondContact O-N 2.76Å; K361-V364 PolarHBondContact O-N 3.27Å; V364-K366 VanDerWaalsContact C-N 3.33Å; V364-K366 PolarHBondContact O-N 3.41Å; V364-T367 PolarHBondContact O-N 3.2Å; V364-T367 VanDerWaalsContact O-N 3.15Å; V364-T367 PolarHBondContact O-OG1 3.15Å; V364-L383 HydrophobicContact CG2-CB 3.59Å; V364-L383 HydrophobicContact CG2-CD1 3.85Å; V364-L383 HydrophobicContact CG2-CG 4.27Å; V364-L387 HydrophobicContact CG2-CD1 3.89Å; V364-F408 HydrophobicContact CB-CZ 4.47Å; V364-F408 HydrophobicContact CG1-CD2 4.21Å; V364-F408 HydrophobicContact CG1-CE1 3.97Å; V364-F408 HydrophobicContact CG1-CE2 3.19Å; V364-F408 HydrophobicContact CG1-CZ 3.06Å
365	I	81.9	Confident	76.4	Confident	74 Å²	74	76.9 Å²	76.9	38%	0.379	39%	0.386	S	S	.	.	H	α-helix	trans	-62.9	-37.9	177.1	-66.9	164.1	0	0	0	111.6	K361 K362 E363 T367 N368	K361-I365 HydrophobicContact CG-CD1 3.9Å; K361-I365 WeakPolarHBondContact O-CD1 3.44Å; K361-I365 VanDerWaalsContact O-CG1 3.27Å; K361-I365 WeakPolarHBondContact O-CG1 3.42Å; K361-I365 PolarHBondContact O-N 2.86Å; K362-I365 PolarHBondContact O-N 2.96Å; E363-I365 PolarHBondContact O-N 2.96Å; I365-T367 VanDerWaalsContact C-N 3.28Å; I365-T367 PolarHBondContact O-N 3.05Å; I365-N368 VanDerWaalsContact O-CB 3.31Å; I365-N368 WeakPolarHBondContact O-CB 3.37Å; I365-N368 PolarHBondContact O-N 3.48Å; I365-N368 VanDerWaalsContact O-N 3.14Å
366	K	82.3	Confident	75.9	Confident	114 Å²	114	72.4 Å²	72.4	50%	0.496	37%	0.366	S	S	.	.	H	α-helix	trans	-61.2	-37	175.7	-71.1	174.7	-161.2	163	0	112	K362 E363 V364 N368 N369 V370	K362-K366 WeakPolarHBondContact O-CG 3.43Å; K362-K366 PolarHBondContact O-N 3.21Å; E363-K366 WeakPolarHBondContact O-CB 3.23Å; E363-K366 PolarHBondContact O-N 3.24Å; E363-K366 VanDerWaalsContact O-N 3.17Å; E363-K366 WeakPolarHBondContact OE2-CD 3.36Å; E363-K366 IonicContact OE2-NZ 2.94Å; E363-K366 PolarHBondContact OE2-NZ 3.46Å; V364-K366 VanDerWaalsContact C-N 3.33Å; V364-K366 PolarHBondContact O-N 3.41Å; K366-N368 PolarHBondContact O-N 2.85Å; K366-N368 VanDerWaalsContact O-N 3.1Å; K366-N369 PolarHBondContact O-N 3.38Å; K366-V370 WeakPolarHBondContact O-CG2 3.24Å
367	T	77.1	Confident	75.4	Confident	8 Å²	8	74.8 Å²	74.8	5%	0.049	38%	0.379	C	S	.	.	H	α-helix	trans	-64.4	-12.2	178.3	70	0	0	0	0	114.1	E363 V364 I365 Y379 R380 L383	E363-T367 WeakPolarHBondContact O-CG2 3.33Å; E363-T367 PolarHBondContact O-N 2.89Å; E363-T367 VanDerWaalsContact O-N 3.17Å; V364-T367 PolarHBondContact O-N 3.2Å; V364-T367 VanDerWaalsContact O-N 3.15Å; V364-T367 PolarHBondContact O-OG1 3.15Å; I365-T367 VanDerWaalsContact C-N 3.28Å; I365-T367 PolarHBondContact O-N 3.05Å; T367-Y379 HydrophobicContact CG2-CD1 3.88Å; T367-Y379 HydrophobicContact CG2-CE1 4.05Å; T367-R380 PolarHBondContact O-NH2 2.92Å; T367-R380 PolarHBondContact OG1-NE 3.43Å; T367-L383 HydrophobicContact CG2-CD1 4.05Å
368	N	68.9	Low	75.2	Confident	104 Å²	104	80 Å²	80	56%	0.556	40%	0.402	S	S	*	.	H	α-helix	trans	-82.6	-25.2	174.8	-160.7	20.4	0	0	0	112.6	I365 K366	I365-N368 VanDerWaalsContact O-CB 3.31Å; I365-N368 WeakPolarHBondContact O-CB 3.37Å; I365-N368 PolarHBondContact O-N 3.48Å; I365-N368 VanDerWaalsContact O-N 3.14Å; K366-N368 PolarHBondContact O-N 2.85Å; K366-N368 VanDerWaalsContact O-N 3.1Å
369	N	64.7	Low	75	Confident	134 Å²	134	76.5 Å²	76.5	72%	0.717	38%	0.384	S	S	*	.	H	α-helix	trans	-99.4	-6.9	-173.8	-67	-23.6	0	0	0	113.7	K366	K366-N369 PolarHBondContact O-N 3.38Å
370	V	64.3	Low	74.6	Confident	75 Å²	75	75.2 Å²	75.2	46%	0.455	37%	0.374	S	S	.	.	S	Bend	trans	-98.5	128	-177.5	-178.5	0	0	0	0	108.8	K366 E372	K366-V370 WeakPolarHBondContact O-CG2 3.24Å; V370-E372 PolarHBondContact O-N 3.42Å
371	S	51.5	Low	74.4	Confident	93 Å²	93	77.1 Å²	77.1	65%	0.65	38%	0.383	S	S	*	.			trans	-51.8	131	176.2	48	0	0	0	0	111.5	H373	S371-H373 PolarHBondContact O-N 3.03Å
372	E	55.2	Low	74.3	Confident	155 Å²	155	74.7 Å²	74.7	72%	0.724	37%	0.374	S	S	*	.			trans	-47.2	96.1	-175	-63.2	174.9	171.2	0	0	113	V370	V370-E372 PolarHBondContact O-N 3.42Å
373	H	57.8	Low	74.3	Confident	126 Å²	126	68.6 Å²	68.6	58%	0.583	35%	0.347	S	S	*	.			trans	-86.6	142.2	155.6	-65.8	-69.7	0	0	0	108.4	S371 D375 T376	S371-H373 PolarHBondContact O-N 3.03Å; H373-D375 PolarHBondContact O-N 3.44Å; H373-T376 WeakPolarHBondContact CB-OG1 3.27Å; H373-T376 PolarHBondContact N-OG1 3.34Å; H373-T376 VanDerWaalsContact O-CB 3.23Å; H373-T376 WeakPolarHBondContact O-CB 3.19Å; H373-T376 PolarHBondContact O-N 3.35Å; H373-T376 PolarHBondContact O-OG1 3.5Å
374	E	59.9	Low	74.3	Confident	177 Å²	177	67.6 Å²	67.6	83%	0.827	34%	0.343	S	S	*	.	H	α-helix	trans	-51	-29.6	-176.6	-69.1	-175.6	157.4	0	0	114.4
375	D	70.8	Confident	74.5	Confident	81 Å²	81	71.7 Å²	71.7	43%	0.433	36%	0.358	S	S	.	.	H	α-helix	trans	-88.9	-8.4	179	-67.8	-38.2	0	0	0	114.4	H373 D377 K378 Y379	H373-D375 PolarHBondContact O-N 3.44Å; D375-D377 VanDerWaalsContact C-N 3.32Å; D375-D377 PolarHBondContact O-N 3.46Å; D375-K378 PolarHBondContact O-N 3.38Å; D375-K378 IonicContact OD1-NZ 3.43Å; D375-K378 PolarHBondContact OD1-NZ 2.86Å; D375-Y379 WeakPolarHBondContact O-CB 3.03Å; D375-Y379 PolarHBondContact O-N 3.49Å
376	T	77.6	Confident	74.7	Confident	17 Å²	17	68.5 Å²	68.5	10%	0.104	34%	0.342	C	S	.	.	H	α-helix	trans	-66.4	-38.1	178.5	-48.5	0	0	0	0	110.9	H373 Y379 R380	H373-T376 WeakPolarHBondContact CB-OG1 3.27Å; H373-T376 PolarHBondContact N-OG1 3.34Å; H373-T376 VanDerWaalsContact O-CB 3.23Å; H373-T376 WeakPolarHBondContact O-CB 3.19Å; H373-T376 PolarHBondContact O-N 3.35Å; H373-T376 PolarHBondContact O-OG1 3.5Å; T376-Y379 PolarHBondContact O-N 3.35Å; T376-R380 WeakPolarHBondContact O-CB 3.14Å; T376-R380 PolarHBondContact O-N 2.99Å
377	D	78	Confident	74.9	Confident	53 Å²	53	63.3 Å²	63.3	28%	0.283	32%	0.32	S	S	.	.	H	α-helix	trans	-67.2	-42	178.4	-77.5	-25.8	0	0	0	112.1	D375 Y379 R380 Q381 N413	D375-D377 VanDerWaalsContact C-N 3.32Å; D375-D377 PolarHBondContact O-N 3.46Å; D377-Y379 VanDerWaalsContact C-N 3.34Å; D377-R380 PolarHBondContact O-N 3.42Å; D377-R380 IonicContact OD1-CZ 2.7Å; D377-R380 IonicContact OD1-NH1 3.65Å; D377-R380 PolarHBondContact OD1-NH1 3.44Å; D377-R380 IonicContact OD1-NH2 2.63Å; D377-Q381 PolarHBondContact O-N 2.68Å; D377-N413 WeakPolarHBondContact CB-ND2 3.32Å
378	K	81.4	Confident	75.3	Confident	115 Å²	115	64.4 Å²	64.4	50%	0.5	32%	0.324	S	S	.	.	H	α-helix	trans	-64.5	-40.3	173.4	-64.6	176.1	-169.4	156.2	0	111.3	L334 D375 Q381 L382	L334-K378 HydrophobicContact CD1-CB 4.48Å; L334-K378 HydrophobicContact CD2-CB 3.98Å; L334-K378 HydrophobicContact CD2-CD 3.99Å; D375-K378 PolarHBondContact O-N 3.38Å; D375-K378 IonicContact OD1-NZ 3.43Å; D375-K378 PolarHBondContact OD1-NZ 2.86Å; K378-Q381 PolarHBondContact O-N 2.87Å; K378-L382 WeakPolarHBondContact O-CB 3.12Å; K378-L382 PolarHBondContact O-N 3.17Å
379	Y	84.9	Confident	76	Confident	4 Å²	4	61.2 Å²	61.2	2%	0.016	31%	0.31	C	S	.	.	H	α-helix	trans	-65.4	-41.8	175.5	-179.3	-129.7	0	0	0	112	R337 L341 E363 T367 D375 T376 D377 L382 L383	R337-Y379 HydrophobicContact CB-CD2 4.2Å; R337-Y379 HydrophobicContact CB-CE2 3.92Å; R337-Y379 HydrophobicContact CG-CD2 4.4Å; R337-Y379 HydrophobicContact CG-CE2 3.92Å; L341-Y379 HydrophobicContact CD1-CE2 4.21Å; E363-Y379 HydrophobicContact CG-CE1 4.18Å; E363-Y379 WeakPolarHBondContact CG-OH 3.3Å; E363-Y379 PolarHBondContact OE1-OH 3.23Å; E363-Y379 VanDerWaalsContact OE1-OH 3.06Å; T367-Y379 HydrophobicContact CG2-CD1 3.88Å; T367-Y379 HydrophobicContact CG2-CE1 4.05Å; D375-Y379 WeakPolarHBondContact O-CB 3.03Å; D375-Y379 PolarHBondContact O-N 3.49Å; T376-Y379 PolarHBondContact O-N 3.35Å; D377-Y379 VanDerWaalsContact C-N 3.34Å; Y379-L382 WeakPolarHBondContact O-CB 3.36Å; Y379-L382 PolarHBondContact O-N 2.85Å; Y379-L383 HydrophobicContact CD1-CD1 4.07Å; Y379-L383 HydrophobicContact CD2-CD1 4.48Å; Y379-L383 HydrophobicContact CD2-CG 4.27Å; Y379-L383 HydrophobicContact CE1-CD1 3.73Å; Y379-L383 HydrophobicContact CE1-CG 4.42Å; Y379-L383 HydrophobicContact CE2-CD1 4.14Å; Y379-L383 HydrophobicContact CE2-CD2 4.01Å; Y379-L383 HydrophobicContact CE2-CG 3.94Å; Y379-L383 HydrophobicContact CG-CD1 4.45Å; Y379-L383 WeakPolarHBondContact O-CG 3.38Å; Y379-L383 PolarHBondContact O-N 2.93Å
380	R	80.4	Confident	77	Confident	13 Å²	13	54.9 Å²	54.9	5%	0.049	28%	0.276	C	S	.	.	H	α-helix	trans	-60.1	-47.5	175.4	-169.4	-177.4	-59.5	127.2	9.6	110.9	T367 T376 D377 L382 L383 V384 D411	T367-R380 PolarHBondContact O-NH2 2.92Å; T367-R380 PolarHBondContact OG1-NE 3.43Å; T376-R380 WeakPolarHBondContact O-CB 3.14Å; T376-R380 PolarHBondContact O-N 2.99Å; D377-R380 PolarHBondContact O-N 3.42Å; D377-R380 IonicContact OD1-CZ 2.7Å; D377-R380 IonicContact OD1-NH1 3.65Å; D377-R380 PolarHBondContact OD1-NH1 3.44Å; D377-R380 IonicContact OD1-NH2 2.63Å; R380-L382 VanDerWaalsContact C-N 3.29Å; R380-L382 PolarHBondContact O-N 3.44Å; R380-L383 PolarHBondContact O-N 2.92Å; R380-V384 WeakPolarHBondContact O-CG2 3.45Å; R380-V384 PolarHBondContact O-N 3.03Å; R380-D411 WeakPolarHBondContact CD-OD2 3.24Å; R380-D411 IonicContact CZ-OD2 2.74Å; R380-D411 IonicContact NE-OD2 2.77Å; R380-D411 IonicContact NH1-OD2 2.82Å; R380-D411 PolarHBondContact NH1-OD2 2.75Å
381	Q	83.8	Confident	77.9	Confident	41 Å²	41	51.3 Å²	51.3	19%	0.192	25%	0.254	C	S	.	.	H	α-helix	trans	-56.8	-44.8	175.1	-172.2	-178.7	15.4	0	0	111.6	D377 K378 L383 V384 R385 A416 D419	D377-Q381 PolarHBondContact O-N 2.68Å; K378-Q381 PolarHBondContact O-N 2.87Å; Q381-L383 PolarHBondContact O-N 3.4Å; Q381-V384 PolarHBondContact O-N 3.4Å; Q381-R385 WeakPolarHBondContact O-CG 3.49Å; Q381-R385 PolarHBondContact O-N 2.88Å; Q381-A416 HydrophobicContact CB-CB 4.37Å; Q381-D419 VanDerWaalsContact CG-OD2 3.23Å; Q381-D419 WeakPolarHBondContact CG-OD2 3.5Å; Q381-D419 PolarHBondContact NE2-OD2 3.45Å
382	L	85.1	Confident	79.3	Confident	35 Å²	35	47.8 Å²	47.8	18%	0.183	23%	0.229	C	C	.	.	H	α-helix	trans	-63.1	-40.6	178.6	-179.8	66.1	0	0	0	112.8	K338 L341 K378 Y379 R380 R385 T386	K338-L382 HydrophobicContact CB-CD2 3.88Å; K338-L382 HydrophobicContact CG-CD1 4.35Å; K338-L382 HydrophobicContact CG-CD2 4.2Å; L341-L382 HydrophobicContact CD1-CD2 3.71Å; L341-L382 HydrophobicContact CD1-CG 3.69Å; K378-L382 WeakPolarHBondContact O-CB 3.12Å; K378-L382 PolarHBondContact O-N 3.17Å; Y379-L382 WeakPolarHBondContact O-CB 3.36Å; Y379-L382 PolarHBondContact O-N 2.85Å; R380-L382 VanDerWaalsContact C-N 3.29Å; R380-L382 PolarHBondContact O-N 3.44Å; L382-R385 PolarHBondContact O-N 3.43Å; L382-T386 WeakPolarHBondContact O-CB 3.38Å; L382-T386 PolarHBondContact O-N 3Å; L382-T386 PolarHBondContact O-OG1 3.47Å
383	L	87.1	Confident	80.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.2	-41.9	174.8	-70.4	170.3	0	0	0	111.8	L341 L360 E363 V364 T367 Y379 R380 Q381 T386 L387	L341-L383 HydrophobicContact CD1-CD2 3.91Å; L341-L383 HydrophobicContact CD2-CD2 4.16Å; L360-L383 HydrophobicContact CD2-CD2 3.9Å; E363-L383 HydrophobicContact CB-CD1 4.44Å; E363-L383 HydrophobicContact CG-CD1 4.07Å; E363-L383 HydrophobicContact CG-CD2 4.32Å; V364-L383 HydrophobicContact CG2-CB 3.59Å; V364-L383 HydrophobicContact CG2-CD1 3.85Å; V364-L383 HydrophobicContact CG2-CG 4.27Å; T367-L383 HydrophobicContact CG2-CD1 4.05Å; Y379-L383 HydrophobicContact CD1-CD1 4.07Å; Y379-L383 HydrophobicContact CD2-CD1 4.48Å; Y379-L383 HydrophobicContact CD2-CG 4.27Å; Y379-L383 HydrophobicContact CE1-CD1 3.73Å; Y379-L383 HydrophobicContact CE1-CG 4.42Å; Y379-L383 HydrophobicContact CE2-CD1 4.14Å; Y379-L383 HydrophobicContact CE2-CD2 4.01Å; Y379-L383 HydrophobicContact CE2-CG 3.94Å; Y379-L383 HydrophobicContact CG-CD1 4.45Å; Y379-L383 WeakPolarHBondContact O-CG 3.38Å; Y379-L383 PolarHBondContact O-N 2.93Å; R380-L383 PolarHBondContact O-N 2.92Å; Q381-L383 PolarHBondContact O-N 3.4Å; L383-T386 WeakPolarHBondContact O-CB 3.14Å; L383-T386 PolarHBondContact O-N 3.28Å; L383-L387 PolarHBondContact O-N 3.37Å
384	V	85.5	Confident	81.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.5	-47	176.7	170.2	0	0	0	0	110.9	R380 Q381 T386 L387 H388 L405 D419 V420	R380-V384 WeakPolarHBondContact O-CG2 3.45Å; R380-V384 PolarHBondContact O-N 3.03Å; Q381-V384 PolarHBondContact O-N 3.4Å; V384-T386 VanDerWaalsContact C-N 3.27Å; V384-T386 PolarHBondContact O-N 3.23Å; V384-L387 PolarHBondContact O-N 3.33Å; V384-H388 WeakPolarHBondContact O-CB 3.32Å; V384-H388 PolarHBondContact O-N 3.31Å; V384-L405 HydrophobicContact CG1-CD2 4.28Å; V384-L405 HydrophobicContact CG2-CD2 4.03Å; V384-D419 HydrophobicContact CG1-CB 4.25Å; V384-V420 HydrophobicContact CG1-CG2 3.68Å; V384-V420 HydrophobicContact CG2-CG2 4.35Å
385	R	85.3	Confident	82.8	Confident	87 Å²	87	35.5 Å²	35.5	33%	0.328	17%	0.171	S	C	.	.	H	α-helix	trans	-59.3	-38.7	175.3	-72.5	178.3	175.6	-164.9	-6.2	112.2	Q381 L382 H388 S389 D419 E839	Q381-R385 WeakPolarHBondContact O-CG 3.49Å; Q381-R385 PolarHBondContact O-N 2.88Å; L382-R385 PolarHBondContact O-N 3.43Å; R385-H388 PolarHBondContact O-N 2.73Å; R385-S389 WeakPolarHBondContact O-CB 3.18Å; R385-S389 PolarHBondContact O-N 2.74Å; R385-D419 WeakPolarHBondContact CG-OD2 3.43Å; R385-D419 IonicContact CZ-OD2 3.82Å; R385-D419 IonicContact NE-OD2 3.46Å; R385-D419 PolarHBondContact NE-OD2 3.18Å; R385-D419 IonicContact NH2-OD2 3.67Å; R385-E839 IonicContact CZ-OE1 2.92Å; R385-E839 VanDerWaalsContact CZ-OE1 3.31Å; R385-E839 IonicContact NH1-OE1 2.84Å; R385-E839 PolarHBondContact NH1-OE1 2.98Å; R385-E839 IonicContact NH2-OE1 3.72Å; R385-E839 PolarHBondContact NH2-OE1 3.33Å
386	T	87.2	Confident	83.3	Confident	7 Å²	7	38.8 Å²	38.8	4%	0.043	19%	0.189	C	C	.	.	H	α-helix	trans	-64.5	-47.6	176.1	-57.2	0	0	0	0	111	L341 L345 L360 L382 L383 V384 H388 S389 C390	L341-T386 HydrophobicContact CD2-CG2 4.23Å; L345-T386 HydrophobicContact CD1-CG2 3.83Å; L345-T386 HydrophobicContact CD2-CG2 3.69Å; L345-T386 HydrophobicContact CG-CG2 3.67Å; L360-T386 HydrophobicContact CD1-CG2 3.67Å; L360-T386 HydrophobicContact CD2-CG2 4.48Å; L382-T386 WeakPolarHBondContact O-CB 3.38Å; L382-T386 PolarHBondContact O-N 3Å; L382-T386 PolarHBondContact O-OG1 3.47Å; L383-T386 WeakPolarHBondContact O-CB 3.14Å; L383-T386 PolarHBondContact O-N 3.28Å; V384-T386 VanDerWaalsContact C-N 3.27Å; V384-T386 PolarHBondContact O-N 3.23Å; T386-H388 PolarHBondContact O-N 2.93Å; T386-S389 PolarHBondContact O-N 3Å; T386-C390 PolarHBondContact O-N 3.48Å; T386-C390 PolarHBondContact O-SG 3.25Å; T386-C390 VanDerWaalsContact O-SG 3.4Å
387	L	86.9	Confident	83.5	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-38.7	176.6	-79.4	172.1	0	0	0	112.8	V357 L360 V364 L383 V384 C390 S391 V401 L405	V357-L387 HydrophobicContact CG1-CD2 4.4Å; L360-L387 HydrophobicContact CB-CD1 4.45Å; L360-L387 HydrophobicContact CB-CD2 3.66Å; L360-L387 HydrophobicContact CB-CG 4.04Å; L360-L387 HydrophobicContact CD1-CD2 3.82Å; L360-L387 HydrophobicContact CD1-CG 4.11Å; L360-L387 HydrophobicContact CG-CD2 4.42Å; V364-L387 HydrophobicContact CG2-CD1 3.89Å; L383-L387 PolarHBondContact O-N 3.37Å; V384-L387 PolarHBondContact O-N 3.33Å; L387-C390 PolarHBondContact O-N 2.97Å; L387-S391 WeakPolarHBondContact O-CB 3.45Å; L387-S391 PolarHBondContact O-N 3.41Å; L387-S391 PolarHBondContact O-OG 3.36Å; L387-V401 HydrophobicContact CB-CG1 4.21Å; L387-V401 HydrophobicContact CD2-CG1 4.4Å; L387-V401 HydrophobicContact CD2-CG2 4.38Å; L387-L405 HydrophobicContact CB-CD1 4.45Å; L387-L405 HydrophobicContact CD1-CD2 3.96Å
388	H	85.3	Confident	83.7	Confident	32 Å²	32	36.3 Å²	36.3	15%	0.148	17%	0.174	C	C	.	.	H	α-helix	trans	-59	-53.8	173.3	175.5	-169.9	0	0	0	110.2	V384 R385 T386 C390 S391 V392 F423 E426	V384-H388 WeakPolarHBondContact O-CB 3.32Å; V384-H388 PolarHBondContact O-N 3.31Å; R385-H388 PolarHBondContact O-N 2.73Å; T386-H388 PolarHBondContact O-N 2.93Å; H388-C390 VanDerWaalsContact C-N 3.33Å; H388-C390 PolarHBondContact O-N 3.46Å; H388-S391 PolarHBondContact O-N 3.19Å; H388-S391 VanDerWaalsContact O-N 3.08Å; H388-V392 WeakPolarHBondContact CD2-CG2 3.2Å; H388-V392 WeakPolarHBondContact O-CG2 3.37Å; H388-V392 PolarHBondContact O-N 3.29Å; H388-F423 HydrophobicContact CB-CB 4.27Å; H388-F423 HydrophobicContact CB-CD2 4.24Å; H388-F423 HydrophobicContact CB-CG 4.35Å; H388-F423 AromaticContact CD2-CD2 3.25Å; H388-F423 WeakPolarHBondContact CD2-CD2 3.43Å; H388-F423 AromaticContact CD2-CG 3.95Å; H388-F423 AromaticContact CG-CD2 3.85Å; H388-F423 AromaticContact NE2-CD2 3.9Å; H388-E426 IonicContact CE1-OE2 2.69Å; H388-E426 IonicContact NE2-OE2 2.66Å; H388-E426 PolarHBondContact NE2-OE2 2.92Å
389	S	84	Confident	83.8	Confident	36 Å²	36	32.5 Å²	32.5	25%	0.252	17%	0.165	S	C	.	.	H	α-helix	trans	-57.1	-43.4	178	-174.3	0	0	0	0	112.4	R385 T386 S391 V392 R393	R385-S389 WeakPolarHBondContact O-CB 3.18Å; R385-S389 PolarHBondContact O-N 2.74Å; T386-S389 PolarHBondContact O-N 3Å; S389-S391 PolarHBondContact O-N 3.29Å; S389-V392 PolarHBondContact O-N 3.35Å; S389-R393 WeakPolarHBondContact O-CG 3.18Å; S389-R393 PolarHBondContact O-N 3.18Å
390	C	85.5	Confident	83.6	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.007	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-45	174.2	-73.9	0	0	0	0	112.4	L345 T386 L387 H388 V392 R393 F394	L345-C390 WeakPolarHBondContact CD2-SG 3.45Å; T386-C390 PolarHBondContact O-N 3.48Å; T386-C390 PolarHBondContact O-SG 3.25Å; T386-C390 VanDerWaalsContact O-SG 3.4Å; L387-C390 PolarHBondContact O-N 2.97Å; H388-C390 VanDerWaalsContact C-N 3.33Å; H388-C390 PolarHBondContact O-N 3.46Å; C390-V392 VanDerWaalsContact C-N 3.34Å; C390-V392 PolarHBondContact O-N 3.09Å; C390-R393 PolarHBondContact O-N 3.49Å; C390-F394 WeakPolarHBondContact O-CD2 3.19Å; C390-F394 PolarHBondContact O-N 2.97Å
391	S	82.9	Confident	83.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-69.5	-31.5	-177.9	-56.6	0	0	0	0	112.7	L387 H388 S389 F394 F423	L387-S391 WeakPolarHBondContact O-CB 3.45Å; L387-S391 PolarHBondContact O-N 3.41Å; L387-S391 PolarHBondContact O-OG 3.36Å; H388-S391 PolarHBondContact O-N 3.19Å; H388-S391 VanDerWaalsContact O-N 3.08Å; S389-S391 PolarHBondContact O-N 3.29Å; S391-F394 CarbonylContact O-C 3.59Å; S391-F423 VanDerWaalsContact CB-CE2 3.5Å
392	V	80.5	Confident	83.9	Confident	20 Å²	20	34.4 Å²	34.4	12%	0.121	18%	0.177	C	C	.	.	H	α-helix	trans	-72.7	-37.9	175.7	168.1	0	0	0	0	111.2	H388 S389 C390 E426 R430	H388-V392 WeakPolarHBondContact CD2-CG2 3.2Å; H388-V392 WeakPolarHBondContact O-CG2 3.37Å; H388-V392 PolarHBondContact O-N 3.29Å; S389-V392 PolarHBondContact O-N 3.35Å; C390-V392 VanDerWaalsContact C-N 3.34Å; C390-V392 PolarHBondContact O-N 3.09Å; V392-E426 WeakPolarHBondContact CG2-OE1 3.18Å; V392-R430 VanDerWaalsContact CG1-NH1 3.28Å; V392-R430 VanDerWaalsContact O-CZ 3.29Å; V392-R430 PolarHBondContact O-NH1 3.31Å; V392-R430 VanDerWaalsContact O-NH1 3.13Å; V392-R430 PolarHBondContact O-NH2 2.94Å
393	R	81.4	Confident	83.9	Confident	106 Å²	106	34.6 Å²	34.6	40%	0.4	18%	0.181	S	C	.	.	H	α-helix	trans	-74.3	-36.9	175.9	-70.1	179.3	-175.7	-169.3	1	112.3	L345 S389 C390 P395	L345-R393 PolarHBondContact O-NH1 3.36Å; S389-R393 WeakPolarHBondContact O-CG 3.18Å; S389-R393 PolarHBondContact O-N 3.18Å; C390-R393 PolarHBondContact O-N 3.49Å; R393-P395 WeakPolarHBondContact O-CD 3.4Å
394	F	83.9	Confident	83.7	Confident	45 Å²	45	35 Å²	35	20%	0.197	18%	0.183	C	C	.	.			trans	-125.8	87	-176	-57.3	-80.6	0	0	0	111.6	V348 V353 C390 S391 D396 M397	V348-F394 HydrophobicContact CB-CE2 4.03Å; V348-F394 HydrophobicContact CG1-CD2 4.06Å; V348-F394 HydrophobicContact CG1-CE2 3.35Å; V348-F394 HydrophobicContact CG1-CZ 3.89Å; V353-F394 HydrophobicContact CB-CD2 4.23Å; V353-F394 HydrophobicContact CB-CG 4.3Å; V353-F394 HydrophobicContact CG1-CD1 4.42Å; V353-F394 HydrophobicContact CG1-CG 4.31Å; V353-F394 HydrophobicContact CG2-CB 4.03Å; V353-F394 HydrophobicContact CG2-CD2 3.6Å; V353-F394 HydrophobicContact CG2-CE2 4.24Å; V353-F394 HydrophobicContact CG2-CG 3.85Å; C390-F394 WeakPolarHBondContact O-CD2 3.19Å; C390-F394 PolarHBondContact O-N 2.97Å; S391-F394 CarbonylContact O-C 3.59Å; F394-D396 VanDerWaalsContact C-N 3.27Å; F394-D396 PolarHBondContact O-N 2.81Å; F394-M397 HydrophobicContact CB-CG 4.44Å; F394-M397 PolarHBondContact O-N 3.39Å
395	P	80.9	Confident	83.5	Confident	49 Å²	49	35 Å²	35	32%	0.318	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-50	-38.5	-179.8	-36.1	41.3	0	0	0	116.1	R393 M397 A398 F431	R393-P395 WeakPolarHBondContact O-CD 3.4Å; P395-M397 PolarHBondContact O-N 3.13Å; P395-M397 VanDerWaalsContact O-N 3.14Å; P395-A398 VanDerWaalsContact O-CB 3.3Å; P395-A398 WeakPolarHBondContact O-CB 3.35Å; P395-A398 PolarHBondContact O-N 3.09Å; P395-F431 HydrophobicContact CB-CD1 4.31Å; P395-F431 HydrophobicContact CB-CE1 3.47Å; P395-F431 VanDerWaalsContact CB-CE1 3.47Å; P395-F431 HydrophobicContact CB-CZ 4Å; P395-F431 HydrophobicContact CG-CE1 3.84Å; P395-F431 HydrophobicContact CG-CZ 4.25Å
396	D	81.9	Confident	83.4	Confident	150 Å²	150	30.9 Å²	30.9	80%	0.802	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-62.2	-26.1	-174.1	-59.1	-33.8	0	0	0	112.4	F394	F394-D396 VanDerWaalsContact C-N 3.27Å; F394-D396 PolarHBondContact O-N 2.81Å
397	M	82.1	Confident	83.1	Confident	17 Å²	17	36.4 Å²	36.4	8%	0.084	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-84.6	-16.1	-179.9	-62.6	-53.1	-52.5	0	0	113.6	V353 E354 V357 F394 P395 A399 N400 V401	V353-M397 HydrophobicContact CG1-CG 3.93Å; V353-M397 HydrophobicContact CG1-SD 4.41Å; V353-M397 HydrophobicContact CG2-CG 3.94Å; E354-M397 HydrophobicContact CB-CE 4.05Å; E354-M397 HydrophobicContact CB-SD 4.06Å; E354-M397 HydrophobicContact CG-CE 4.01Å; E354-M397 HydrophobicContact CG-SD 4.4Å; V357-M397 HydrophobicContact CB-CE 4.14Å; V357-M397 HydrophobicContact CG1-CE 4.2Å; V357-M397 HydrophobicContact CG2-CB 4.43Å; V357-M397 HydrophobicContact CG2-CE 4.41Å; F394-M397 HydrophobicContact CB-CG 4.44Å; F394-M397 PolarHBondContact O-N 3.39Å; P395-M397 PolarHBondContact O-N 3.13Å; P395-M397 VanDerWaalsContact O-N 3.14Å; M397-A399 PolarHBondContact O-N 3.37Å; M397-N400 PolarHBondContact O-N 2.95Å; M397-V401 PolarHBondContact O-N 2.53Å
398	A	81.1	Confident	82.6	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59.3	-34.8	-173.8	0	0	0	0	0	112.4	P395 N400 V401 I402 F431 L434	P395-A398 VanDerWaalsContact O-CB 3.3Å; P395-A398 WeakPolarHBondContact O-CB 3.35Å; P395-A398 PolarHBondContact O-N 3.09Å; A398-N400 PolarHBondContact O-N 3Å; A398-V401 PolarHBondContact O-N 3.15Å; A398-I402 HydrophobicContact CB-CD1 4.33Å; A398-I402 WeakPolarHBondContact O-CD1 3.46Å; A398-I402 VanDerWaalsContact O-CG1 3.23Å; A398-I402 WeakPolarHBondContact O-CG1 3.39Å; A398-I402 PolarHBondContact O-N 2.66Å; A398-F431 HydrophobicContact CB-CD2 4.09Å; A398-F431 HydrophobicContact CB-CE2 3.73Å; A398-F431 HydrophobicContact CB-CZ 4.28Å; A398-L434 HydrophobicContact CB-CD1 3.89Å
399	A	83.7	Confident	82.3	Confident	36 Å²	36	35.2 Å²	35.2	30%	0.298	19%	0.187	S	C	.	.	H	α-helix	trans	-58.1	-35.4	177.6	0	0	0	0	0	113.1	M397 P403 L434	M397-A399 PolarHBondContact O-N 3.37Å; A399-P403 WeakPolarHBondContact O-CD 3.28Å; A399-L434 HydrophobicContact CB-CD1 4.39Å; A399-L434 HydrophobicContact CB-CD2 3.76Å
400	N	82	Confident	82	Confident	91 Å²	91	35.7 Å²	35.7	49%	0.487	19%	0.19	S	C	.	.	H	α-helix	trans	-83	-26.1	-179.3	-68.5	-23.7	0	0	0	112.7	M397 A398	M397-N400 PolarHBondContact O-N 2.95Å; A398-N400 PolarHBondContact O-N 3Å
401	V	83.9	Confident	81.4	Confident	5 Å²	5	37.3 Å²	37.3	3%	0.03	20%	0.199	C	C	.	.	H	α-helix	trans	-85.5	-42.1	-176	176.7	0	0	0	0	111.7	V357 L387 M397 A398 V404 L405 F423	V357-V401 HydrophobicContact CG1-CG2 3.44Å; V357-V401 VanDerWaalsContact CG1-CG2 3.44Å; V357-V401 HydrophobicContact CG2-CG2 4.38Å; L387-V401 HydrophobicContact CB-CG1 4.21Å; L387-V401 HydrophobicContact CD2-CG1 4.4Å; L387-V401 HydrophobicContact CD2-CG2 4.38Å; M397-V401 PolarHBondContact O-N 2.53Å; A398-V401 PolarHBondContact O-N 3.15Å; V401-V404 WeakPolarHBondContact O-CB 3.26Å; V401-V404 PolarHBondContact O-N 3.2Å; V401-V404 VanDerWaalsContact O-N 3.16Å; V401-L405 HydrophobicContact CG1-CD1 3.48Å; V401-L405 VanDerWaalsContact CG1-CD1 3.48Å; V401-L405 HydrophobicContact CG1-CG 3.8Å; V401-L405 PolarHBondContact O-N 3.41Å; V401-L405 VanDerWaalsContact O-N 3.1Å; V401-F423 HydrophobicContact CG1-CE1 4.48Å
402	I	85.8	Confident	80.7	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-53.5	-50.9	-173.8	-73.7	161.2	0	0	0	112.9	A398 V404 L405 M406 F423 A427 L434 I438	A398-I402 HydrophobicContact CB-CD1 4.33Å; A398-I402 WeakPolarHBondContact O-CD1 3.46Å; A398-I402 VanDerWaalsContact O-CG1 3.23Å; A398-I402 WeakPolarHBondContact O-CG1 3.39Å; A398-I402 PolarHBondContact O-N 2.66Å; I402-V404 PolarHBondContact O-N 2.99Å; I402-L405 PolarHBondContact O-N 3.31Å; I402-M406 HydrophobicContact CG2-CE 4.05Å; I402-M406 HydrophobicContact CG2-CG 4.15Å; I402-M406 VanDerWaalsContact O-CG 3.24Å; I402-M406 WeakPolarHBondContact O-CG 3.39Å; I402-M406 PolarHBondContact O-N 2.66Å; I402-F423 HydrophobicContact CG1-CE1 3.77Å; I402-F423 HydrophobicContact CG1-CZ 4Å; I402-A427 HydrophobicContact CD1-CB 4.33Å; I402-L434 HydrophobicContact CD1-CB 4.4Å; I402-L434 HydrophobicContact CD1-CD1 3.87Å; I402-I438 HydrophobicContact CD1-CD1 4.03Å; I402-I438 HydrophobicContact CD1-CG1 4.09Å; I402-I438 HydrophobicContact CG2-CG1 3.91Å
403	P	84.9	Confident	80.5	Confident	39 Å²	39	43.1 Å²	43.1	25%	0.253	23%	0.229	S	C	.	.	H	α-helix	trans	-59.6	-35.9	-177.5	-25.3	35.4	0	0	0	113.1	A399 L437	A399-P403 WeakPolarHBondContact O-CD 3.28Å; P403-L437 HydrophobicContact CG-CD2 4.47Å
404	V	82.3	Confident	80.3	Confident	8 Å²	8	41.6 Å²	41.6	5%	0.048	23%	0.227	C	C	.	.	H	α-helix	trans	-69.2	-46	179.3	-176.9	0	0	0	0	110.6	K361 V401 I402 M406 E407 F408	K361-V404 HydrophobicContact CD-CG2 3.57Å; K361-V404 HydrophobicContact CG-CG1 4.09Å; K361-V404 HydrophobicContact CG-CG2 3.93Å; V401-V404 WeakPolarHBondContact O-CB 3.26Å; V401-V404 PolarHBondContact O-N 3.2Å; V401-V404 VanDerWaalsContact O-N 3.16Å; I402-V404 PolarHBondContact O-N 2.99Å; V404-M406 VanDerWaalsContact C-N 3.29Å; V404-M406 PolarHBondContact O-N 3.37Å; V404-E407 PolarHBondContact O-N 3.39Å; V404-F408 HydrophobicContact CG1-CE2 4.16Å; V404-F408 WeakPolarHBondContact O-CD2 3.31Å; V404-F408 VanDerWaalsContact O-CE2 3.28Å; V404-F408 WeakPolarHBondContact O-CE2 3.35Å
405	L	82.9	Confident	80	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.7	-33.3	-179.3	-68	-175.6	0	0	0	111.9	V384 L387 V401 I402 E407 F408 V420 F423	V384-L405 HydrophobicContact CG1-CD2 4.28Å; V384-L405 HydrophobicContact CG2-CD2 4.03Å; L387-L405 HydrophobicContact CB-CD1 4.45Å; L387-L405 HydrophobicContact CD1-CD2 3.96Å; V401-L405 HydrophobicContact CG1-CD1 3.48Å; V401-L405 VanDerWaalsContact CG1-CD1 3.48Å; V401-L405 HydrophobicContact CG1-CG 3.8Å; V401-L405 PolarHBondContact O-N 3.41Å; V401-L405 VanDerWaalsContact O-N 3.1Å; I402-L405 PolarHBondContact O-N 3.31Å; L405-E407 VanDerWaalsContact C-N 3.29Å; L405-E407 PolarHBondContact O-N 2.86Å; L405-F408 WeakPolarHBondContact O-CB 3.37Å; L405-F408 PolarHBondContact O-N 2.96Å; L405-V420 HydrophobicContact CB-CG1 4.02Å; L405-V420 HydrophobicContact CB-CG2 4.35Å; L405-V420 WeakPolarHBondContact O-CG1 3.17Å; L405-F423 HydrophobicContact CD1-CD1 3.51Å; L405-F423 HydrophobicContact CD1-CE1 3.59Å; L405-F423 HydrophobicContact CD1-CG 4.39Å
406	M	82.8	Confident	79.9	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-60.6	-34.6	178.5	-73.3	-70.1	-167	0	0	113.5	I402 V404 F408 L409 V424 I438 K441 M442	I402-M406 HydrophobicContact CG2-CE 4.05Å; I402-M406 HydrophobicContact CG2-CG 4.15Å; I402-M406 VanDerWaalsContact O-CG 3.24Å; I402-M406 WeakPolarHBondContact O-CG 3.39Å; I402-M406 PolarHBondContact O-N 2.66Å; V404-M406 VanDerWaalsContact C-N 3.29Å; V404-M406 PolarHBondContact O-N 3.37Å; M406-F408 PolarHBondContact O-N 3.39Å; M406-L409 WeakPolarHBondContact O-CB 3.26Å; M406-L409 PolarHBondContact O-N 2.84Å; M406-L409 VanDerWaalsContact O-N 3.11Å; M406-L409 HydrophobicContact SD-CD1 3.56Å; M406-L409 VanDerWaalsContact SD-CD1 3.56Å; M406-V424 HydrophobicContact CE-CB 4.19Å; M406-V424 HydrophobicContact CE-CG1 3.46Å; M406-V424 VanDerWaalsContact CE-CG1 3.46Å; M406-V424 HydrophobicContact CE-CG2 3.54Å; M406-V424 HydrophobicContact SD-CG1 4.47Å; M406-V424 HydrophobicContact SD-CG2 3.83Å; M406-I438 HydrophobicContact CE-CB 4.3Å; M406-I438 HydrophobicContact CE-CG1 4.41Å; M406-I438 HydrophobicContact CE-CG2 3.69Å; M406-K441 HydrophobicContact CG-CB 4.26Å; M406-M442 HydrophobicContact CE-CE 3.95Å; M406-M442 HydrophobicContact SD-CE 3.88Å
407	E	79.8	Confident	80	Confident	123 Å²	123	32.1 Å²	32.1	58%	0.575	18%	0.182	S	C	*	.	H	α-helix	trans	-59.8	-31.2	176.1	-67.4	177.6	179.8	0	0	111.7	V404 L405 L409 S410	V404-E407 PolarHBondContact O-N 3.39Å; L405-E407 VanDerWaalsContact C-N 3.29Å; L405-E407 PolarHBondContact O-N 2.86Å; E407-L409 VanDerWaalsContact C-N 3.27Å; E407-L409 PolarHBondContact O-N 3.08Å; E407-S410 PolarHBondContact O-N 2.92Å; E407-S410 PolarHBondContact O-OG 2.8Å
408	F	77.2	Confident	80	Confident	11 Å²	11	33.5 Å²	33.5	5%	0.048	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-75.4	-9.4	179.4	-65	-80.6	0	0	0	114.3	V364 V404 L405 M406 S410 D411 A417 V420	V364-F408 HydrophobicContact CB-CZ 4.47Å; V364-F408 HydrophobicContact CG1-CD2 4.21Å; V364-F408 HydrophobicContact CG1-CE1 3.97Å; V364-F408 HydrophobicContact CG1-CE2 3.19Å; V364-F408 HydrophobicContact CG1-CZ 3.06Å; V404-F408 HydrophobicContact CG1-CE2 4.16Å; V404-F408 WeakPolarHBondContact O-CD2 3.31Å; V404-F408 VanDerWaalsContact O-CE2 3.28Å; V404-F408 WeakPolarHBondContact O-CE2 3.35Å; L405-F408 WeakPolarHBondContact O-CB 3.37Å; L405-F408 PolarHBondContact O-N 2.96Å; M406-F408 PolarHBondContact O-N 3.39Å; F408-S410 PolarHBondContact O-N 2.92Å; F408-D411 WeakPolarHBondContact O-CB 3.34Å; F408-D411 PolarHBondContact O-N 3.35Å; F408-A417 WeakPolarHBondContact O-CB 3.29Å; F408-V420 HydrophobicContact CB-CG2 4.21Å
409	L	79.3	Confident	80.1	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-66.2	-20.6	171.1	-66.5	175.3	0	0	0	112.4	M406 E407 V420 L421 M442 V445 I454	M406-L409 WeakPolarHBondContact O-CB 3.26Å; M406-L409 PolarHBondContact O-N 2.84Å; M406-L409 VanDerWaalsContact O-N 3.11Å; M406-L409 HydrophobicContact SD-CD1 3.56Å; M406-L409 VanDerWaalsContact SD-CD1 3.56Å; E407-L409 VanDerWaalsContact C-N 3.27Å; E407-L409 PolarHBondContact O-N 3.08Å; L409-V420 HydrophobicContact CD2-CB 3.94Å; L409-V420 HydrophobicContact CD2-CG1 3.64Å; L409-V420 HydrophobicContact CG-CG1 3.87Å; L409-L421 HydrophobicContact CD2-CB 4.2Å; L409-M442 HydrophobicContact CD1-CE 3.84Å; L409-M442 HydrophobicContact CD1-SD 3.94Å; L409-V445 HydrophobicContact CB-CG1 4.12Å; L409-I454 HydrophobicContact CB-CG2 4.48Å; L409-I454 HydrophobicContact CD2-CG2 3.88Å
410	S	76.8	Confident	80.2	Confident	45 Å²	45	33 Å²	33	32%	0.315	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-89.4	-5.1	176.4	70.1	0	0	0	0	114.1	E407 F408	E407-S410 PolarHBondContact O-N 2.92Å; E407-S410 PolarHBondContact O-OG 2.8Å; F408-S410 PolarHBondContact O-N 2.92Å
411	D	73.1	Confident	80.4	Confident	35 Å²	35	29.8 Å²	29.8	19%	0.187	17%	0.171	C	C	.	.	S	Bend	trans	-71.6	155.3	-177.3	-162.7	2.5	0	0	0	111.4	R380 F408 N413	R380-D411 WeakPolarHBondContact CD-OD2 3.24Å; R380-D411 IonicContact CZ-OD2 2.74Å; R380-D411 IonicContact NE-OD2 2.77Å; R380-D411 IonicContact NH1-OD2 2.82Å; R380-D411 PolarHBondContact NH1-OD2 2.75Å; F408-D411 WeakPolarHBondContact O-CB 3.34Å; F408-D411 PolarHBondContact O-N 3.35Å; D411-N413 PolarHBondContact O-N 3.38Å
412	N	68.6	Low	80.4	Confident	114 Å²	114	32.9 Å²	32.9	61%	0.61	19%	0.185	S	C	*	.	S	Bend	trans	-71.9	-21.1	-180	-66.2	-31.6	0	0	0	112.1	E414	N412-E414 PolarHBondContact O-N 2.69Å
413	N	75.2	Confident	80.4	Confident	28 Å²	28	32.9 Å²	32.9	15%	0.15	19%	0.185	C	C	.	.			trans	-77.6	101.3	179.9	-175.6	-11.8	0	0	0	111.7	D377 D411 A415 A416 A417	D377-N413 WeakPolarHBondContact CB-ND2 3.32Å; D411-N413 PolarHBondContact O-N 3.38Å; N413-A415 VanDerWaalsContact C-N 3.29Å; N413-A415 PolarHBondContact O-N 2.91Å; N413-A415 PolarHBondContact OD1-N 2.86Å; N413-A415 VanDerWaalsContact OD1-N 3.09Å; N413-A416 HydrophobicContact CB-CB 4.35Å; N413-A416 PolarHBondContact OD1-N 3.08Å; N413-A417 WeakPolarHBondContact O-CB 3.34Å; N413-A417 PolarHBondContact O-N 3.45Å
414	E	78.4	Confident	80.5	Confident	74 Å²	74	31 Å²	31	35%	0.346	17%	0.173	S	C	.	.	H	α-helix	trans	-59.7	-35.9	-179.2	-168.6	-176.8	-176.1	0	0	113.1	N412 A418 K453	N412-E414 PolarHBondContact O-N 2.69Å; E414-A418 VanDerWaalsContact O-CB 3.26Å; E414-A418 WeakPolarHBondContact O-CB 3.36Å; E414-A418 PolarHBondContact O-N 3.12Å; E414-K453 WeakPolarHBondContact OE1-CD 3.47Å; E414-K453 VanDerWaalsContact OE1-CE 3.28Å; E414-K453 WeakPolarHBondContact OE1-CE 3.14Å; E414-K453 WeakPolarHBondContact OE1-CG 3.13Å; E414-K453 IonicContact OE1-NZ 2.64Å; E414-K453 PolarHBondContact OE1-NZ 3.28Å; E414-K453 IonicContact OE2-NZ 2.69Å; E414-K453 PolarHBondContact OE2-NZ 3.09Å
415	A	77.4	Confident	80.7	Confident	44 Å²	44	34.3 Å²	34.3	36%	0.364	19%	0.185	S	C	.	.	H	α-helix	trans	-72.2	-46.3	-175.1	0	0	0	0	0	112.1	N413 A417 A418 D419	N413-A415 VanDerWaalsContact C-N 3.29Å; N413-A415 PolarHBondContact O-N 2.91Å; N413-A415 PolarHBondContact OD1-N 2.86Å; N413-A415 VanDerWaalsContact OD1-N 3.09Å; A415-A417 VanDerWaalsContact C-N 3.32Å; A415-A417 PolarHBondContact O-N 2.78Å; A415-A418 PolarHBondContact O-N 3.4Å; A415-D419 PolarHBondContact O-N 2.91Å; A415-D419 VanDerWaalsContact O-N 3.14Å
416	A	79.1	Confident	80.7	Confident	1 Å²	1	35 Å²	35	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-62.8	-41.9	177.2	0	0	0	0	0	111.3	Q381 N413 D419 V420	Q381-A416 HydrophobicContact CB-CB 4.37Å; N413-A416 HydrophobicContact CB-CB 4.35Å; N413-A416 PolarHBondContact OD1-N 3.08Å; A416-D419 PolarHBondContact O-N 2.86Å; A416-V420 WeakPolarHBondContact O-CG2 3.11Å; A416-V420 PolarHBondContact O-N 3.27Å
417	A	82.8	Confident	80.8	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-74.1	-27.5	-179.6	0	0	0	0	0	113.2	F408 N413 A415 V420 L421 I454	F408-A417 WeakPolarHBondContact O-CB 3.29Å; N413-A417 WeakPolarHBondContact O-CB 3.34Å; N413-A417 PolarHBondContact O-N 3.45Å; A415-A417 VanDerWaalsContact C-N 3.32Å; A415-A417 PolarHBondContact O-N 2.78Å; A417-V420 PolarHBondContact O-N 3.45Å; A417-L421 WeakPolarHBondContact O-CB 3.44Å; A417-L421 PolarHBondContact O-N 3.32Å; A417-I454 HydrophobicContact CB-CD1 3.29Å; A417-I454 HydrophobicContact CB-CG1 4.23Å
418	A	83.6	Confident	81	Confident	46 Å²	46	29.1 Å²	29.1	38%	0.38	16%	0.16	S	C	.	.	H	α-helix	trans	-63.8	-42.4	168	0	0	0	0	0	112	E414 A415 L421 E422	E414-A418 VanDerWaalsContact O-CB 3.26Å; E414-A418 WeakPolarHBondContact O-CB 3.36Å; E414-A418 PolarHBondContact O-N 3.12Å; A415-A418 PolarHBondContact O-N 3.4Å; A418-L421 PolarHBondContact O-N 3.2Å; A418-E422 PolarHBondContact O-N 3.37Å
419	D	82.3	Confident	81.3	Confident	26 Å²	26	30.1 Å²	30.1	14%	0.139	17%	0.165	C	C	.	.	H	α-helix	trans	-64	-40.8	175.5	-71.8	-16.1	0	0	0	111.1	Q381 V384 R385 A415 A416 L421 E422 F423	Q381-D419 VanDerWaalsContact CG-OD2 3.23Å; Q381-D419 WeakPolarHBondContact CG-OD2 3.5Å; Q381-D419 PolarHBondContact NE2-OD2 3.45Å; V384-D419 HydrophobicContact CG1-CB 4.25Å; R385-D419 WeakPolarHBondContact CG-OD2 3.43Å; R385-D419 IonicContact CZ-OD2 3.82Å; R385-D419 IonicContact NE-OD2 3.46Å; R385-D419 PolarHBondContact NE-OD2 3.18Å; R385-D419 IonicContact NH2-OD2 3.67Å; A415-D419 PolarHBondContact O-N 2.91Å; A415-D419 VanDerWaalsContact O-N 3.14Å; A416-D419 PolarHBondContact O-N 2.86Å; D419-L421 VanDerWaalsContact C-N 3.35Å; D419-L421 PolarHBondContact O-N 3.16Å; D419-E422 PolarHBondContact O-N 2.87Å; D419-F423 PolarHBondContact O-N 3.23Å
420	V	86.3	Confident	81.3	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-58.5	-46.9	171.7	174.2	0	0	0	0	111	V384 L405 F408 L409 A416 A417 E422 F423 V424	V384-V420 HydrophobicContact CG1-CG2 3.68Å; V384-V420 HydrophobicContact CG2-CG2 4.35Å; L405-V420 HydrophobicContact CB-CG1 4.02Å; L405-V420 HydrophobicContact CB-CG2 4.35Å; L405-V420 WeakPolarHBondContact O-CG1 3.17Å; F408-V420 HydrophobicContact CB-CG2 4.21Å; L409-V420 HydrophobicContact CD2-CB 3.94Å; L409-V420 HydrophobicContact CD2-CG1 3.64Å; L409-V420 HydrophobicContact CG-CG1 3.87Å; A416-V420 WeakPolarHBondContact O-CG2 3.11Å; A416-V420 PolarHBondContact O-N 3.27Å; A417-V420 PolarHBondContact O-N 3.45Å; V420-E422 VanDerWaalsContact C-N 3.33Å; V420-E422 PolarHBondContact O-N 3.24Å; V420-F423 WeakPolarHBondContact O-CB 3.27Å; V420-F423 PolarHBondContact O-N 3.4Å; V420-V424 HydrophobicContact CG1-CG2 4.14Å; V420-V424 WeakPolarHBondContact O-CG2 3.21Å; V420-V424 PolarHBondContact O-N 3.34Å
421	L	86.1	Confident	81.5	Confident	24 Å²	24	33 Å²	33	13%	0.126	17%	0.17	C	C	.	.	H	α-helix	trans	-63.6	-39.2	-178.2	179.6	67.8	0	0	0	111.8	L409 A417 A418 D419 F423 V424 R425 I461	L409-L421 HydrophobicContact CD2-CB 4.2Å; A417-L421 WeakPolarHBondContact O-CB 3.44Å; A417-L421 PolarHBondContact O-N 3.32Å; A418-L421 PolarHBondContact O-N 3.2Å; D419-L421 VanDerWaalsContact C-N 3.35Å; D419-L421 PolarHBondContact O-N 3.16Å; L421-F423 VanDerWaalsContact C-N 3.35Å; L421-V424 PolarHBondContact O-N 3.05Å; L421-R425 WeakPolarHBondContact O-CB 3.26Å; L421-R425 PolarHBondContact O-N 3.47Å; L421-I461 HydrophobicContact CD1-CD1 3.58Å
422	E	84.1	Confident	81.9	Confident	70 Å²	70	36.2 Å²	36.2	33%	0.327	19%	0.187	S	C	.	.	H	α-helix	trans	-61.3	-44.6	173.1	-174.1	172.7	175.7	0	0	111.2	A418 D419 V420 R425 E426 K646	A418-E422 PolarHBondContact O-N 3.37Å; D419-E422 PolarHBondContact O-N 2.87Å; V420-E422 VanDerWaalsContact C-N 3.33Å; V420-E422 PolarHBondContact O-N 3.24Å; E422-R425 PolarHBondContact O-N 2.66Å; E422-E426 PolarHBondContact O-N 3.05Å; E422-K646 IonicContact OE1-NZ 3.74Å; E422-K646 PolarHBondContact OE1-NZ 3.4Å
423	F	85.4	Confident	82.6	Confident	1 Å²	1	36.9 Å²	36.9	0%	0.004	19%	0.19	C	C	.	.	H	α-helix	trans	-59.2	-48.7	174.8	167.8	-115.3	0	0	0	112.3	H388 S391 V401 I402 L405 D419 V420 L421 R425 E426 A427	H388-F423 HydrophobicContact CB-CB 4.27Å; H388-F423 HydrophobicContact CB-CD2 4.24Å; H388-F423 HydrophobicContact CB-CG 4.35Å; H388-F423 AromaticContact CD2-CD2 3.25Å; H388-F423 WeakPolarHBondContact CD2-CD2 3.43Å; H388-F423 AromaticContact CD2-CG 3.95Å; H388-F423 AromaticContact CG-CD2 3.85Å; H388-F423 AromaticContact NE2-CD2 3.9Å; S391-F423 VanDerWaalsContact CB-CE2 3.5Å; V401-F423 HydrophobicContact CG1-CE1 4.48Å; I402-F423 HydrophobicContact CG1-CE1 3.77Å; I402-F423 HydrophobicContact CG1-CZ 4Å; L405-F423 HydrophobicContact CD1-CD1 3.51Å; L405-F423 HydrophobicContact CD1-CE1 3.59Å; L405-F423 HydrophobicContact CD1-CG 4.39Å; D419-F423 PolarHBondContact O-N 3.23Å; V420-F423 WeakPolarHBondContact O-CB 3.27Å; V420-F423 PolarHBondContact O-N 3.4Å; L421-F423 VanDerWaalsContact C-N 3.35Å; F423-R425 VanDerWaalsContact C-N 3.28Å; F423-R425 PolarHBondContact O-N 3.41Å; F423-E426 PolarHBondContact O-N 3.33Å; F423-E426 VanDerWaalsContact O-N 3.14Å; F423-A427 HydrophobicContact CE2-CB 4.22Å; F423-A427 HydrophobicContact CZ-CB 4.29Å; F423-A427 VanDerWaalsContact O-CB 3.31Å; F423-A427 WeakPolarHBondContact O-CB 3.42Å; F423-A427 PolarHBondContact O-N 3.11Å
424	V	87.2	Confident	83.1	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-61.1	-40.7	179.7	174.7	0	0	0	0	110.8	M406 V420 L421 E426 A427 I428 I438 M442 I461	M406-V424 HydrophobicContact CE-CB 4.19Å; M406-V424 HydrophobicContact CE-CG1 3.46Å; M406-V424 VanDerWaalsContact CE-CG1 3.46Å; M406-V424 HydrophobicContact CE-CG2 3.54Å; M406-V424 HydrophobicContact SD-CG1 4.47Å; M406-V424 HydrophobicContact SD-CG2 3.83Å; V420-V424 HydrophobicContact CG1-CG2 4.14Å; V420-V424 WeakPolarHBondContact O-CG2 3.21Å; V420-V424 PolarHBondContact O-N 3.34Å; L421-V424 PolarHBondContact O-N 3.05Å; V424-E426 VanDerWaalsContact C-N 3.31Å; V424-E426 PolarHBondContact O-N 3.18Å; V424-A427 PolarHBondContact O-N 3.28Å; V424-I428 WeakPolarHBondContact O-CB 3.47Å; V424-I428 WeakPolarHBondContact O-CG2 3.31Å; V424-I428 PolarHBondContact O-N 3.4Å; V424-I438 HydrophobicContact CG1-CG2 3.65Å; V424-M442 HydrophobicContact CG1-CE 3.89Å; V424-I461 HydrophobicContact CB-CD1 4.43Å; V424-I461 HydrophobicContact CG1-CD1 3.91Å
425	R	85.6	Confident	83.4	Confident	76 Å²	76	35.7 Å²	35.7	29%	0.287	18%	0.182	S	C	.	.	H	α-helix	trans	-62.7	-37.2	176.7	-176.7	179.8	66.6	140.5	-0.1	112.3	L421 E422 F423 I428 W460 I461 L639	L421-R425 WeakPolarHBondContact O-CB 3.26Å; L421-R425 PolarHBondContact O-N 3.47Å; E422-R425 PolarHBondContact O-N 2.66Å; F423-R425 VanDerWaalsContact C-N 3.28Å; F423-R425 PolarHBondContact O-N 3.41Å; R425-I428 WeakPolarHBondContact O-CG2 3.42Å; R425-W460 HydrophobicContact CG-CZ3 3.86Å; R425-I461 HydrophobicContact CB-CD1 4.47Å; R425-L639 HydrophobicContact CG-CD1 4.13Å; R425-L639 HydrophobicContact CG-CD2 4.12Å
426	E	83.6	Confident	83.8	Confident	14 Å²	14	40.7 Å²	40.7	7%	0.065	20%	0.2	C	C	.	.	H	α-helix	trans	-71.8	-46.7	173.9	-171.6	-176.2	166	0	0	111.4	H388 V392 E422 F423 V424 I428 Q429 R430 L643	H388-E426 IonicContact CE1-OE2 2.69Å; H388-E426 IonicContact NE2-OE2 2.66Å; H388-E426 PolarHBondContact NE2-OE2 2.92Å; V392-E426 WeakPolarHBondContact CG2-OE1 3.18Å; E422-E426 PolarHBondContact O-N 3.05Å; F423-E426 PolarHBondContact O-N 3.33Å; F423-E426 VanDerWaalsContact O-N 3.14Å; V424-E426 VanDerWaalsContact C-N 3.31Å; V424-E426 PolarHBondContact O-N 3.18Å; E426-I428 PolarHBondContact O-N 3.45Å; E426-Q429 PolarHBondContact O-N 3.48Å; E426-R430 WeakPolarHBondContact O-CB 3.41Å; E426-R430 PolarHBondContact O-N 3.26Å; E426-R430 IonicContact OE1-NH1 2.87Å; E426-L643 HydrophobicContact CB-CD2 4.49Å; E426-L643 HydrophobicContact CG-CD2 4.16Å
427	A	84.6	Confident	84.2	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-42.4	-177.2	0	0	0	0	0	112.5	I402 F423 V424 Q429 R430 F431 I438	I402-A427 HydrophobicContact CD1-CB 4.33Å; F423-A427 HydrophobicContact CE2-CB 4.22Å; F423-A427 HydrophobicContact CZ-CB 4.29Å; F423-A427 VanDerWaalsContact O-CB 3.31Å; F423-A427 WeakPolarHBondContact O-CB 3.42Å; F423-A427 PolarHBondContact O-N 3.11Å; V424-A427 PolarHBondContact O-N 3.28Å; A427-Q429 VanDerWaalsContact C-N 3.3Å; A427-Q429 PolarHBondContact O-N 3.29Å; A427-R430 PolarHBondContact O-N 3.12Å; A427-F431 HydrophobicContact CB-CD2 3.95Å; A427-F431 HydrophobicContact CB-CE2 4.21Å; A427-F431 WeakPolarHBondContact O-CB 3.4Å; A427-F431 WeakPolarHBondContact O-CD2 3.24Å; A427-F431 PolarHBondContact O-N 3.29Å; A427-I438 HydrophobicContact CB-CD1 4.22Å
428	I	84.8	Confident	84.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.5	-30.1	-178.7	-160.6	169.4	0	0	0	112.9	V424 R425 E426 R435 I438 V439 I461 Y465	V424-I428 WeakPolarHBondContact O-CB 3.47Å; V424-I428 WeakPolarHBondContact O-CG2 3.31Å; V424-I428 PolarHBondContact O-N 3.4Å; R425-I428 WeakPolarHBondContact O-CG2 3.42Å; E426-I428 PolarHBondContact O-N 3.45Å; I428-R435 HydrophobicContact CG1-CB 4.38Å; I428-R435 HydrophobicContact CG1-CG 3.85Å; I428-R435 WeakPolarHBondContact O-CG 3.49Å; I428-R435 PolarHBondContact O-NE 3.49Å; I428-I438 HydrophobicContact CB-CD1 3.89Å; I428-I438 HydrophobicContact CB-CG2 4.37Å; I428-I438 HydrophobicContact CD1-CB 4.4Å; I428-I438 HydrophobicContact CD1-CG2 3.77Å; I428-I438 HydrophobicContact CG1-CD1 4.2Å; I428-I438 HydrophobicContact CG1-CG2 4.25Å; I428-V439 HydrophobicContact CD1-CG2 4.3Å; I428-I461 HydrophobicContact CD1-CG2 3.71Å; I428-Y465 HydrophobicContact CD1-CD1 3.98Å; I428-Y465 HydrophobicContact CD1-CD2 3.54Å; I428-Y465 HydrophobicContact CD1-CE2 4.22Å; I428-Y465 HydrophobicContact CD1-CG 3.39Å; I428-Y465 HydrophobicContact CG1-CD1 3.91Å; I428-Y465 HydrophobicContact CG1-CD2 4.11Å; I428-Y465 HydrophobicContact CG1-CE1 4.21Å; I428-Y465 HydrophobicContact CG1-CE2 4.4Å; I428-Y465 HydrophobicContact CG1-CG 3.85Å; I428-Y465 HydrophobicContact CG2-CD2 4Å; I428-Y465 HydrophobicContact CG2-CE1 4.25Å; I428-Y465 HydrophobicContact CG2-CE2 3.54Å
429	Q	82.4	Confident	84.6	Confident	33 Å²	33	41.2 Å²	41.2	15%	0.154	20%	0.196	C	C	.	.	H	α-helix	trans	-80.8	-35.3	176.3	-178.1	57.2	22	0	0	111.4	E426 A427 R435 Y465 L639 S640 L643	E426-Q429 PolarHBondContact O-N 3.48Å; A427-Q429 VanDerWaalsContact C-N 3.3Å; A427-Q429 PolarHBondContact O-N 3.29Å; Q429-R435 PolarHBondContact O-NH2 3.22Å; Q429-Y465 PolarHBondContact OE1-OH 3.26Å; Q429-L639 HydrophobicContact CB-CD2 4.06Å; Q429-L639 HydrophobicContact CG-CD2 4.36Å; Q429-S640 PolarHBondContact NE2-OG 3.07Å; Q429-L643 HydrophobicContact CB-CD1 3.77Å; Q429-L643 HydrophobicContact CG-CD1 3.85Å
430	R	79.6	Confident	84.9	Confident	91 Å²	91	45.2 Å²	45.2	34%	0.343	21%	0.214	S	C	.	.	H	α-helix	trans	-83.1	-33.4	-175.2	-169.5	170.8	176.9	-179.8	-10.5	113.9	V392 E426 A427	V392-R430 VanDerWaalsContact CG1-NH1 3.28Å; V392-R430 VanDerWaalsContact O-CZ 3.29Å; V392-R430 PolarHBondContact O-NH1 3.31Å; V392-R430 VanDerWaalsContact O-NH1 3.13Å; V392-R430 PolarHBondContact O-NH2 2.94Å; E426-R430 WeakPolarHBondContact O-CB 3.41Å; E426-R430 PolarHBondContact O-N 3.26Å; E426-R430 IonicContact OE1-NH1 2.87Å; A427-R430 PolarHBondContact O-N 3.12Å
431	F	82.4	Confident	84.9	Confident	16 Å²	16	47.8 Å²	47.8	7%	0.07	23%	0.225	C	C	.	.			trans	-116.1	86.3	-173.1	-51.2	-53.3	0	0	0	111.4	P395 A398 A427 N433 L434 R435	P395-F431 HydrophobicContact CB-CD1 4.31Å; P395-F431 HydrophobicContact CB-CE1 3.47Å; P395-F431 VanDerWaalsContact CB-CE1 3.47Å; P395-F431 HydrophobicContact CB-CZ 4Å; P395-F431 HydrophobicContact CG-CE1 3.84Å; P395-F431 HydrophobicContact CG-CZ 4.25Å; A398-F431 HydrophobicContact CB-CD2 4.09Å; A398-F431 HydrophobicContact CB-CE2 3.73Å; A398-F431 HydrophobicContact CB-CZ 4.28Å; A427-F431 HydrophobicContact CB-CD2 3.95Å; A427-F431 HydrophobicContact CB-CE2 4.21Å; A427-F431 WeakPolarHBondContact O-CB 3.4Å; A427-F431 WeakPolarHBondContact O-CD2 3.24Å; A427-F431 PolarHBondContact O-N 3.29Å; F431-N433 PolarHBondContact O-N 3.32Å; F431-L434 HydrophobicContact CB-CB 3.98Å; F431-L434 HydrophobicContact CB-CD1 3.82Å; F431-L434 HydrophobicContact CB-CG 3.98Å; F431-L434 HydrophobicContact CD2-CD1 4.07Å; F431-L434 HydrophobicContact CG-CD1 4.06Å; F431-L434 PolarHBondContact O-N 3.16Å; F431-R435 PolarHBondContact O-N 3.44Å
432	D	81.2	Confident	85	Confident	102 Å²	102	46.6 Å²	46.6	55%	0.545	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-56	-36.9	-179.3	-76.5	30.8	0	0	0	113.2	L434 R435	D432-L434 VanDerWaalsContact C-N 3.32Å; D432-L434 PolarHBondContact O-N 2.98Å; D432-R435 WeakPolarHBondContact O-CG 3.19Å; D432-R435 PolarHBondContact O-N 3.17Å; D432-R435 IonicContact OD1-CZ 3.54Å; D432-R435 IonicContact OD1-NE 3.75Å; D432-R435 IonicContact OD1-NH1 3.32Å; D432-R435 PolarHBondContact OD1-NH1 3.43Å; D432-R435 IonicContact OD1-NH2 2.81Å; D432-R435 PolarHBondContact OD1-NH2 3.21Å; D432-R435 IonicContact OD2-CZ 3.37Å; D432-R435 IonicContact OD2-NH1 2.66Å; D432-R435 PolarHBondContact OD2-NH1 2.98Å; D432-R435 IonicContact OD2-NH2 2.95Å
433	N	83.8	Confident	85.1	Confident	127 Å²	127	44 Å²	44	68%	0.679	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-68.2	-25.6	177.8	55.6	-31.2	0	0	0	113.9	F431	F431-N433 PolarHBondContact O-N 3.32Å
434	L	83.9	Confident	85.2	Confident	18 Å²	18	49 Å²	49	9%	0.094	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-95.2	-4.4	-178.7	-59	178.3	0	0	0	113	A398 A399 I402 F431 D432 M436 L437 I438	A398-L434 HydrophobicContact CB-CD1 3.89Å; A399-L434 HydrophobicContact CB-CD1 4.39Å; A399-L434 HydrophobicContact CB-CD2 3.76Å; I402-L434 HydrophobicContact CD1-CB 4.4Å; I402-L434 HydrophobicContact CD1-CD1 3.87Å; F431-L434 HydrophobicContact CB-CB 3.98Å; F431-L434 HydrophobicContact CB-CD1 3.82Å; F431-L434 HydrophobicContact CB-CG 3.98Å; F431-L434 HydrophobicContact CD2-CD1 4.07Å; F431-L434 HydrophobicContact CG-CD1 4.06Å; F431-L434 PolarHBondContact O-N 3.16Å; D432-L434 VanDerWaalsContact C-N 3.32Å; D432-L434 PolarHBondContact O-N 2.98Å; L434-M436 VanDerWaalsContact C-N 3.35Å; L434-M436 PolarHBondContact O-N 3.35Å; L434-L437 HydrophobicContact CD2-CD2 4.49Å; L434-L437 PolarHBondContact O-N 3.47Å; L434-I438 HydrophobicContact CB-CD1 4.37Å; L434-I438 WeakPolarHBondContact O-CG1 3.49Å; L434-I438 PolarHBondContact O-N 2.92Å
435	R	85.7	Confident	85.1	Confident	59 Å²	59	49.9 Å²	49.9	22%	0.223	24%	0.236	C	C	.	.	H	α-helix	trans	-56.3	-44.9	-178.4	-71	-176	174	139.3	8.3	113.2	I428 Q429 F431 D432 I438 V439	I428-R435 HydrophobicContact CG1-CB 4.38Å; I428-R435 HydrophobicContact CG1-CG 3.85Å; I428-R435 WeakPolarHBondContact O-CG 3.49Å; I428-R435 PolarHBondContact O-NE 3.49Å; Q429-R435 PolarHBondContact O-NH2 3.22Å; F431-R435 PolarHBondContact O-N 3.44Å; D432-R435 WeakPolarHBondContact O-CG 3.19Å; D432-R435 PolarHBondContact O-N 3.17Å; D432-R435 IonicContact OD1-CZ 3.54Å; D432-R435 IonicContact OD1-NE 3.75Å; D432-R435 IonicContact OD1-NH1 3.32Å; D432-R435 PolarHBondContact OD1-NH1 3.43Å; D432-R435 IonicContact OD1-NH2 2.81Å; D432-R435 PolarHBondContact OD1-NH2 3.21Å; D432-R435 IonicContact OD2-CZ 3.37Å; D432-R435 IonicContact OD2-NH1 2.66Å; D432-R435 PolarHBondContact OD2-NH1 2.98Å; D432-R435 IonicContact OD2-NH2 2.95Å; R435-I438 PolarHBondContact O-N 3.48Å; R435-V439 WeakPolarHBondContact O-CG2 3.43Å; R435-V439 PolarHBondContact O-N 3.43Å
436	M	85.9	Confident	85.1	Confident	150 Å²	150	46.3 Å²	46.3	74%	0.739	22%	0.222	S	C	*	.	H	α-helix	trans	-62.3	-46.3	-180	-64.1	-171.7	-58.9	0	0	111.2	L434 I438 V439 E440	L434-M436 VanDerWaalsContact C-N 3.35Å; L434-M436 PolarHBondContact O-N 3.35Å; M436-I438 VanDerWaalsContact C-N 3.34Å; M436-I438 PolarHBondContact O-N 3.17Å; M436-V439 PolarHBondContact O-N 2.96Å; M436-E440 WeakPolarHBondContact O-CB 3.26Å; M436-E440 PolarHBondContact O-N 3.27Å
437	L	86.3	Confident	85.1	Confident	53 Å²	53	48 Å²	48	28%	0.277	23%	0.23	S	C	.	.	H	α-helix	trans	-60.2	-42.7	177.6	179.8	68.1	0	0	0	111.9	P403 L434 K441	P403-L437 HydrophobicContact CG-CD2 4.47Å; L434-L437 HydrophobicContact CD2-CD2 4.49Å; L434-L437 PolarHBondContact O-N 3.47Å; L437-K441 HydrophobicContact CD1-CG 4.37Å; L437-K441 WeakPolarHBondContact O-CB 3.43Å; L437-K441 WeakPolarHBondContact O-CG 3.38Å; L437-K441 PolarHBondContact O-N 3.14Å
438	I	86.9	Confident	85	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.5	-45.4	178.4	-70.9	167.3	0	0	0	110.9	I402 M406 V424 A427 I428 L434 R435 M436 M442	I402-I438 HydrophobicContact CD1-CD1 4.03Å; I402-I438 HydrophobicContact CD1-CG1 4.09Å; I402-I438 HydrophobicContact CG2-CG1 3.91Å; M406-I438 HydrophobicContact CE-CB 4.3Å; M406-I438 HydrophobicContact CE-CG1 4.41Å; M406-I438 HydrophobicContact CE-CG2 3.69Å; V424-I438 HydrophobicContact CG1-CG2 3.65Å; A427-I438 HydrophobicContact CB-CD1 4.22Å; I428-I438 HydrophobicContact CB-CD1 3.89Å; I428-I438 HydrophobicContact CB-CG2 4.37Å; I428-I438 HydrophobicContact CD1-CB 4.4Å; I428-I438 HydrophobicContact CD1-CG2 3.77Å; I428-I438 HydrophobicContact CG1-CD1 4.2Å; I428-I438 HydrophobicContact CG1-CG2 4.25Å; L434-I438 HydrophobicContact CB-CD1 4.37Å; L434-I438 WeakPolarHBondContact O-CG1 3.49Å; L434-I438 PolarHBondContact O-N 2.92Å; R435-I438 PolarHBondContact O-N 3.48Å; M436-I438 VanDerWaalsContact C-N 3.34Å; M436-I438 PolarHBondContact O-N 3.17Å; I438-M442 WeakPolarHBondContact O-CB 3.26Å; I438-M442 PolarHBondContact O-N 2.88Å
439	V	88.4	Confident	85	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.024	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-45.7	-179.3	171.7	0	0	0	0	111	I428 R435 M436 K441 M442 L443 L462 D471	I428-V439 HydrophobicContact CD1-CG2 4.3Å; R435-V439 WeakPolarHBondContact O-CG2 3.43Å; R435-V439 PolarHBondContact O-N 3.43Å; M436-V439 PolarHBondContact O-N 2.96Å; V439-K441 PolarHBondContact O-N 3.48Å; V439-M442 PolarHBondContact O-N 3.49Å; V439-L443 HydrophobicContact CG1-CD1 4.12Å; V439-L443 WeakPolarHBondContact O-CG 3.47Å; V439-L443 PolarHBondContact O-N 2.89Å; V439-L462 HydrophobicContact CG1-CD2 4.33Å; V439-D471 HydrophobicContact CG1-CB 4.4Å
440	E	88	Confident	84.8	Confident	111 Å²	111	55.4 Å²	55.4	52%	0.519	27%	0.27	S	S	.	.	H	α-helix	trans	-57.5	-49.8	176.9	-174.9	-179.3	-177.2	0	0	111.3	M436 M442 L443 E444	M436-E440 WeakPolarHBondContact O-CB 3.26Å; M436-E440 PolarHBondContact O-N 3.27Å; E440-M442 PolarHBondContact O-N 3Å; E440-L443 PolarHBondContact O-N 3.32Å; E440-E444 PolarHBondContact O-N 3.33Å; E440-E444 VanDerWaalsContact O-N 3.17Å
441	K	87.2	Confident	85	Confident	53 Å²	53	52.2 Å²	52.2	23%	0.23	26%	0.262	C	S	.	.	H	α-helix	trans	-68.2	-34.6	178.8	-69.1	-69	165.1	-144.4	0	113.5	M406 L437 V439 L443 E444 V445	M406-K441 HydrophobicContact CG-CB 4.26Å; L437-K441 HydrophobicContact CD1-CG 4.37Å; L437-K441 WeakPolarHBondContact O-CB 3.43Å; L437-K441 WeakPolarHBondContact O-CG 3.38Å; L437-K441 PolarHBondContact O-N 3.14Å; V439-K441 PolarHBondContact O-N 3.48Å; K441-L443 VanDerWaalsContact C-N 3.31Å; K441-L443 PolarHBondContact O-N 2.96Å; K441-E444 WeakPolarHBondContact CD-OE2 3.14Å; K441-E444 IonicContact NZ-OE1 2.91Å; K441-E444 PolarHBondContact NZ-OE1 3.17Å; K441-E444 IonicContact NZ-OE2 2.7Å; K441-E444 PolarHBondContact NZ-OE2 3.09Å; K441-E444 PolarHBondContact O-N 2.87Å; K441-V445 WeakPolarHBondContact O-CG2 3.47Å; K441-V445 PolarHBondContact O-N 3.45Å; K441-V445 VanDerWaalsContact O-N 3.15Å
442	M	87.5	Confident	85.2	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-64.7	-37.4	175.1	-172.2	66.3	69.2	0	0	111.3	M406 L409 V424 I438 V439 E440 V445 F446 A458 I461 L462	M406-M442 HydrophobicContact CE-CE 3.95Å; M406-M442 HydrophobicContact SD-CE 3.88Å; L409-M442 HydrophobicContact CD1-CE 3.84Å; L409-M442 HydrophobicContact CD1-SD 3.94Å; V424-M442 HydrophobicContact CG1-CE 3.89Å; I438-M442 WeakPolarHBondContact O-CB 3.26Å; I438-M442 PolarHBondContact O-N 2.88Å; V439-M442 PolarHBondContact O-N 3.49Å; E440-M442 PolarHBondContact O-N 3Å; M442-V445 PolarHBondContact O-N 3.22Å; M442-F446 WeakPolarHBondContact O-CB 3.23Å; M442-F446 PolarHBondContact O-N 3.41Å; M442-A458 HydrophobicContact SD-CB 3.75Å; M442-I461 HydrophobicContact CE-CD1 4.06Å; M442-L462 HydrophobicContact CB-CD2 4.02Å; M442-L462 HydrophobicContact CG-CD1 4.2Å; M442-L462 HydrophobicContact CG-CD2 3.81Å; M442-L462 HydrophobicContact CG-CG 3.9Å
443	L	87.1	Confident	85.3	Confident	15 Å²	15	54.1 Å²	54.1	8%	0.079	27%	0.268	C	S	.	.	H	α-helix	trans	-65.1	-43.4	175.3	-71.6	166.2	0	0	0	111.8	V439 E440 K441 V445 F446 L462 V475	V439-L443 HydrophobicContact CG1-CD1 4.12Å; V439-L443 WeakPolarHBondContact O-CG 3.47Å; V439-L443 PolarHBondContact O-N 2.89Å; E440-L443 PolarHBondContact O-N 3.32Å; K441-L443 VanDerWaalsContact C-N 3.31Å; K441-L443 PolarHBondContact O-N 2.96Å; L443-V445 VanDerWaalsContact C-N 3.34Å; L443-V445 PolarHBondContact O-N 3.48Å; L443-F446 WeakPolarHBondContact O-CB 3.32Å; L443-F446 PolarHBondContact O-N 3.39Å; L443-L462 HydrophobicContact CD2-CD1 4.23Å; L443-L462 HydrophobicContact CD2-CD2 4.04Å; L443-L462 HydrophobicContact CG-CD2 4.06Å; L443-V475 HydrophobicContact CD2-CB 4.43Å; L443-V475 HydrophobicContact CD2-CG2 3.6Å
444	E	86.4	Confident	85.5	Confident	106 Å²	106	48.2 Å²	48.2	50%	0.495	24%	0.237	S	C	.	.	H	α-helix	trans	-57.5	-45.4	176.1	-70.4	175.6	-162.7	0	0	112.3	E440 K441	E440-E444 PolarHBondContact O-N 3.33Å; E440-E444 VanDerWaalsContact O-N 3.17Å; K441-E444 WeakPolarHBondContact CD-OE2 3.14Å; K441-E444 IonicContact NZ-OE1 2.91Å; K441-E444 PolarHBondContact NZ-OE1 3.17Å; K441-E444 IonicContact NZ-OE2 2.7Å; K441-E444 PolarHBondContact NZ-OE2 3.09Å; K441-E444 PolarHBondContact O-N 2.87Å
445	V	86.4	Confident	85.6	Confident	19 Å²	19	47.3 Å²	47.3	12%	0.115	23%	0.232	C	C	.	.	H	α-helix	trans	-82.9	-17.3	-174.8	-178.3	0	0	0	0	112.8	L409 K441 M442 L443 H447 A448 I449	L409-V445 HydrophobicContact CB-CG1 4.12Å; K441-V445 WeakPolarHBondContact O-CG2 3.47Å; K441-V445 PolarHBondContact O-N 3.45Å; K441-V445 VanDerWaalsContact O-N 3.15Å; M442-V445 PolarHBondContact O-N 3.22Å; L443-V445 VanDerWaalsContact C-N 3.34Å; L443-V445 PolarHBondContact O-N 3.48Å; V445-H447 VanDerWaalsContact C-N 3.27Å; V445-H447 PolarHBondContact O-N 3.1Å; V445-A448 PolarHBondContact O-N 3.09Å; V445-I449 HydrophobicContact CG1-CG1 4.36Å
446	F	85.6	Confident	85.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-50.8	-40.2	-169.5	-171.4	-110.2	0	0	0	114.8	M442 L443 A448 Y455 A458 L459 L462 E478 I479	M442-F446 WeakPolarHBondContact O-CB 3.23Å; M442-F446 PolarHBondContact O-N 3.41Å; L443-F446 WeakPolarHBondContact O-CB 3.32Å; L443-F446 PolarHBondContact O-N 3.39Å; F446-A448 VanDerWaalsContact C-N 3.35Å; F446-A448 PolarHBondContact O-N 3.06Å; F446-Y455 HydrophobicContact CE1-CE2 4.14Å; F446-Y455 AromaticContact CE1-CZ 3.71Å; F446-Y455 WeakPolarHBondContact CE1-OH 3.41Å; F446-Y455 HydrophobicContact CE2-CE1 4.23Å; F446-Y455 HydrophobicContact CE2-CE2 4.03Å; F446-Y455 AromaticContact CE2-CZ 3.86Å; F446-Y455 AromaticContact CZ-CE1 3.77Å; F446-Y455 HydrophobicContact CZ-CE1 3.77Å; F446-Y455 AromaticContact CZ-CE2 3.84Å; F446-Y455 HydrophobicContact CZ-CE2 3.84Å; F446-Y455 AromaticContact CZ-CZ 3.29Å; F446-Y455 WeakPolarHBondContact CZ-OH 3.4Å; F446-A458 HydrophobicContact CD2-CB 4.39Å; F446-A458 HydrophobicContact CE2-CB 4.46Å; F446-L459 HydrophobicContact CE2-CD2 3.92Å; F446-L459 HydrophobicContact CE2-CG 4.19Å; F446-L459 HydrophobicContact CZ-CD2 3.61Å; F446-L459 HydrophobicContact CZ-CG 4.23Å; F446-L462 HydrophobicContact CD2-CD1 3.72Å; F446-L462 HydrophobicContact CE2-CD1 3.91Å; F446-L462 HydrophobicContact CG-CD1 4.34Å; F446-E478 HydrophobicContact CB-CG 4.41Å; F446-E478 HydrophobicContact CD1-CB 3.89Å; F446-E478 HydrophobicContact CD1-CG 3.82Å; F446-E478 HydrophobicContact CE1-CB 4.25Å; F446-I479 HydrophobicContact CE1-CG1 4.43Å; F446-I479 HydrophobicContact CZ-CG1 4.48Å
447	H	82.5	Confident	85.8	Confident	49 Å²	49	42.7 Å²	42.7	23%	0.227	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-72.3	-25.5	-179.6	-49.1	96.7	0	0	0	114.5	V445 I449 E478 R481	V445-H447 VanDerWaalsContact C-N 3.27Å; V445-H447 PolarHBondContact O-N 3.1Å; H447-I449 VanDerWaalsContact C-N 3.32Å; H447-E478 WeakPolarHBondContact CE1-CG 3.49Å; H447-E478 IonicContact CE1-OE1 2.71Å; H447-E478 PolarHBondContact CE1-OE1 3.34Å; H447-E478 IonicContact CE1-OE2 3.48Å; H447-E478 PolarHBondContact CE1-OE2 2.77Å; H447-E478 IonicContact ND1-OE2 3.65Å; H447-E478 WeakPolarHBondContact NE2-CG 3.18Å; H447-E478 IonicContact NE2-OE1 2.98Å; H447-E478 PolarHBondContact NE2-OE1 2.94Å; H447-E478 VanDerWaalsContact NE2-OE1 3.07Å; H447-E478 IonicContact NE2-OE2 3.35Å; H447-E478 PolarHBondContact NE2-OE2 3.32Å; H447-R481 PolarHBondContact CE1-NH1 2.91Å; H447-R481 VanDerWaalsContact CE1-NH1 3.29Å; H447-R481 WeakPolarHBondContact NE2-CD 3.37Å; H447-R481 PolarHBondContact NE2-NH1 2.99Å
448	A	83.4	Confident	85.9	Confident	47 Å²	47	40.2 Å²	40.2	39%	0.388	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-85.1	-9.4	-175.3	0	0	0	0	0	112.4	V445 F446 K450	V445-A448 PolarHBondContact O-N 3.09Å; F446-A448 VanDerWaalsContact C-N 3.35Å; F446-A448 PolarHBondContact O-N 3.06Å; A448-K450 PolarHBondContact O-N 2.97Å
449	I	83.8	Confident	86	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.198	C	C	.	.			trans	-72.9	118.7	-178.7	-58.9	172.5	0	0	0	110	V445 H447 I454 Y455 A458	V445-I449 HydrophobicContact CG1-CG1 4.36Å; H447-I449 VanDerWaalsContact C-N 3.32Å; I449-I454 HydrophobicContact CG2-CB 3.98Å; I449-I454 HydrophobicContact CG2-CG2 3.91Å; I449-Y455 HydrophobicContact CB-CD2 4.05Å; I449-Y455 HydrophobicContact CG2-CD2 4.03Å; I449-A458 HydrophobicContact CD1-CB 3.86Å
450	K	79.2	Confident	86	Confident	143 Å²	143	43.3 Å²	43.3	62%	0.622	21%	0.21	S	C	*	.			trans	-100.9	-17.7	-179.6	-63.6	179.7	-175.5	172.7	0	114.8	A448 F545	A448-K450 PolarHBondContact O-N 2.97Å; K450-F545 WeakPolarHBondContact O-CE1 3.43Å; K450-F545 WeakPolarHBondContact O-CZ 3.36Å
451	S	84.1	Confident	86.1	Confident	25 Å²	25	38.1 Å²	38.1	18%	0.175	19%	0.185	C	C	.	.			trans	-95.2	133.5	-178.9	158.1	0	0	0	0	112.7	K453 I454 Y455	S451-K453 PolarHBondContact O-N 2.96Å; S451-K453 PolarHBondContact OG-N 2.94Å; S451-I454 PolarHBondContact O-N 3.19Å; S451-Y455 WeakPolarHBondContact O-CB 3.43Å; S451-Y455 PolarHBondContact O-N 3.23Å
452	V	85.1	Confident	86.1	Confident	37 Å²	37	35.6 Å²	35.6	22%	0.224	18%	0.175	C	C	.	.	H	α-helix	trans	-56.3	-45.6	-180	-179.9	0	0	0	0	112	Y455 R456 F545 D550 V553	V452-Y455 PolarHBondContact O-N 3.02Å; V452-R456 WeakPolarHBondContact O-CB 3.21Å; V452-R456 PolarHBondContact O-N 3.4Å; V452-F545 HydrophobicContact CG2-CB 4.36Å; V452-F545 HydrophobicContact CG2-CD1 3.55Å; V452-F545 HydrophobicContact CG2-CD2 4.41Å; V452-F545 HydrophobicContact CG2-CE1 3.91Å; V452-F545 HydrophobicContact CG2-CG 3.86Å; V452-F545 HydrophobicContact CG2-CZ 4.48Å; V452-D550 HydrophobicContact CG1-CB 4.01Å; V452-V553 HydrophobicContact CB-CG2 4.4Å; V452-V553 HydrophobicContact CG1-CG2 3.25Å
453	K	84.6	Confident	86.1	Confident	120 Å²	120	35.7 Å²	35.7	52%	0.522	18%	0.175	S	C	.	.	H	α-helix	trans	-67.1	-41.4	-176.9	-64.6	-164	-160.9	114	0	111.7	E414 S451 G457	E414-K453 WeakPolarHBondContact OE1-CD 3.47Å; E414-K453 VanDerWaalsContact OE1-CE 3.28Å; E414-K453 WeakPolarHBondContact OE1-CE 3.14Å; E414-K453 WeakPolarHBondContact OE1-CG 3.13Å; E414-K453 IonicContact OE1-NZ 2.64Å; E414-K453 PolarHBondContact OE1-NZ 3.28Å; E414-K453 IonicContact OE2-NZ 2.69Å; E414-K453 PolarHBondContact OE2-NZ 3.09Å; S451-K453 PolarHBondContact O-N 2.96Å; S451-K453 PolarHBondContact OG-N 2.94Å; K453-G457 PolarHBondContact O-N 3.25Å
454	I	86.8	Confident	86	Confident	3 Å²	3	35 Å²	35	2%	0.015	17%	0.171	C	C	.	.	H	α-helix	trans	-68.9	-45.6	178.9	-54.9	167.9	0	0	0	109.6	L409 A417 I449 S451 R456 G457 A458	L409-I454 HydrophobicContact CB-CG2 4.48Å; L409-I454 HydrophobicContact CD2-CG2 3.88Å; A417-I454 HydrophobicContact CB-CD1 3.29Å; A417-I454 HydrophobicContact CB-CG1 4.23Å; I449-I454 HydrophobicContact CG2-CB 3.98Å; I449-I454 HydrophobicContact CG2-CG2 3.91Å; S451-I454 PolarHBondContact O-N 3.19Å; I454-R456 VanDerWaalsContact C-N 3.27Å; I454-R456 PolarHBondContact O-N 3.3Å; I454-G457 PolarHBondContact O-N 3.24Å; I454-A458 PolarHBondContact O-N 3.12Å
455	Y	87.4	Confident	85.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-57.5	-41.7	179	-161	-86.9	0	0	0	111.7	F446 I449 S451 V452 G457 A458 L459 S482 L542 F545 V553	F446-Y455 HydrophobicContact CE1-CE2 4.14Å; F446-Y455 AromaticContact CE1-CZ 3.71Å; F446-Y455 WeakPolarHBondContact CE1-OH 3.41Å; F446-Y455 HydrophobicContact CE2-CE1 4.23Å; F446-Y455 HydrophobicContact CE2-CE2 4.03Å; F446-Y455 AromaticContact CE2-CZ 3.86Å; F446-Y455 AromaticContact CZ-CE1 3.77Å; F446-Y455 HydrophobicContact CZ-CE1 3.77Å; F446-Y455 AromaticContact CZ-CE2 3.84Å; F446-Y455 HydrophobicContact CZ-CE2 3.84Å; F446-Y455 AromaticContact CZ-CZ 3.29Å; F446-Y455 WeakPolarHBondContact CZ-OH 3.4Å; I449-Y455 HydrophobicContact CB-CD2 4.05Å; I449-Y455 HydrophobicContact CG2-CD2 4.03Å; S451-Y455 WeakPolarHBondContact O-CB 3.43Å; S451-Y455 PolarHBondContact O-N 3.23Å; V452-Y455 PolarHBondContact O-N 3.02Å; Y455-G457 PolarHBondContact O-N 3.45Å; Y455-A458 PolarHBondContact O-N 3.07Å; Y455-L459 HydrophobicContact CD1-CD1 3.69Å; Y455-L459 HydrophobicContact CD1-CG 3.96Å; Y455-L459 HydrophobicContact CE1-CD1 3.7Å; Y455-L459 HydrophobicContact CE1-CD2 4.25Å; Y455-L459 HydrophobicContact CE1-CG 3.89Å; Y455-L459 WeakPolarHBondContact O-CB 3.4Å; Y455-L459 WeakPolarHBondContact O-CG 3.14Å; Y455-L459 PolarHBondContact O-N 2.99Å; Y455-S482 WeakPolarHBondContact OH-CB 3.5Å; Y455-S482 PolarHBondContact OH-OG 3.15Å; Y455-L542 HydrophobicContact CD1-CD1 4.41Å; Y455-L542 HydrophobicContact CE1-CB 4.29Å; Y455-L542 HydrophobicContact CE1-CD1 3.84Å; Y455-L542 HydrophobicContact CE1-CD2 4.24Å; Y455-L542 HydrophobicContact CE1-CG 4.35Å; Y455-F545 HydrophobicContact CD2-CE2 4.08Å; Y455-F545 AromaticContact CG-CE2 3.99Å; Y455-F545 HydrophobicContact CG-CE2 3.99Å; Y455-V553 HydrophobicContact CD1-CG1 4Å
456	R	87.9	Confident	85.9	Confident	96 Å²	96	29.5 Å²	29.5	36%	0.362	14%	0.144	S	C	.	.	H	α-helix	trans	-59.4	-44.7	173.7	-179.2	179.6	60.1	133.1	-2.9	112.5	V452 I454 W460	V452-R456 WeakPolarHBondContact O-CB 3.21Å; V452-R456 PolarHBondContact O-N 3.4Å; I454-R456 VanDerWaalsContact C-N 3.27Å; I454-R456 PolarHBondContact O-N 3.3Å; R456-W460 PolarHBondContact O-N 3.06Å; R456-W460 VanDerWaalsContact O-N 3.08Å
457	G	87.1	Confident	85.6	Confident	16 Å²	16	32.7 Å²	32.7	17%	0.165	17%	0.167	C	C	.	.	H	α-helix	trans	-67.8	-40.9	177.7	0	0	0	0	0	112.9	K453 I454 Y455 W460 I461	K453-G457 PolarHBondContact O-N 3.25Å; I454-G457 PolarHBondContact O-N 3.24Å; Y455-G457 PolarHBondContact O-N 3.45Å; G457-W460 WeakPolarHBondContact O-CB 3.46Å; G457-W460 PolarHBondContact O-N 3.17Å; G457-I461 WeakPolarHBondContact O-CG1 3.48Å; G457-I461 PolarHBondContact O-N 3.45Å
458	A	88.3	Confident	85.8	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.1	-46.1	174.6	0	0	0	0	0	111.4	M442 F446 I449 I454 Y455 W460 I461 L462	M442-A458 HydrophobicContact SD-CB 3.75Å; F446-A458 HydrophobicContact CD2-CB 4.39Å; F446-A458 HydrophobicContact CE2-CB 4.46Å; I449-A458 HydrophobicContact CD1-CB 3.86Å; I454-A458 PolarHBondContact O-N 3.12Å; Y455-A458 PolarHBondContact O-N 3.07Å; A458-W460 VanDerWaalsContact C-N 3.3Å; A458-W460 PolarHBondContact O-N 3.34Å; A458-I461 PolarHBondContact O-N 3.39Å; A458-L462 WeakPolarHBondContact O-CG 3.49Å; A458-L462 PolarHBondContact O-N 3.14Å
459	L	89.1	Confident	86	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-56.3	-44	173.3	-79.7	175.2	0	0	0	112	F446 Y455 G463 I479 V553 L557 T560	F446-L459 HydrophobicContact CE2-CD2 3.92Å; F446-L459 HydrophobicContact CE2-CG 4.19Å; F446-L459 HydrophobicContact CZ-CD2 3.61Å; F446-L459 HydrophobicContact CZ-CG 4.23Å; Y455-L459 HydrophobicContact CD1-CD1 3.69Å; Y455-L459 HydrophobicContact CD1-CG 3.96Å; Y455-L459 HydrophobicContact CE1-CD1 3.7Å; Y455-L459 HydrophobicContact CE1-CD2 4.25Å; Y455-L459 HydrophobicContact CE1-CG 3.89Å; Y455-L459 WeakPolarHBondContact O-CB 3.4Å; Y455-L459 WeakPolarHBondContact O-CG 3.14Å; Y455-L459 PolarHBondContact O-N 2.99Å; L459-G463 PolarHBondContact O-N 3.15Å; L459-I479 HydrophobicContact CD2-CD1 4.44Å; L459-I479 HydrophobicContact CD2-CG1 4.4Å; L459-V553 HydrophobicContact CD1-CG1 4.09Å; L459-L557 HydrophobicContact CD1-CB 4.15Å; L459-L557 HydrophobicContact CD1-CD1 4.22Å; L459-L557 HydrophobicContact CD2-CD1 3.78Å; L459-T560 HydrophobicContact CD2-CG2 4.45Å; L459-T560 WeakPolarHBondContact O-CG2 3.49Å; L459-T560 PolarHBondContact O-OG1 3.26Å
460	W	89.5	Confident	86.1	Confident	70 Å²	70	42 Å²	42	27%	0.265	21%	0.205	S	C	.	.	H	α-helix	trans	-63.6	-43.2	178.3	-178.2	90.4	0	0	0	112.1	R425 R456 G457 A458 G463 E464 Y465 L639	R425-W460 HydrophobicContact CG-CZ3 3.86Å; R456-W460 PolarHBondContact O-N 3.06Å; R456-W460 VanDerWaalsContact O-N 3.08Å; G457-W460 WeakPolarHBondContact O-CB 3.46Å; G457-W460 PolarHBondContact O-N 3.17Å; A458-W460 VanDerWaalsContact C-N 3.3Å; A458-W460 PolarHBondContact O-N 3.34Å; W460-G463 PolarHBondContact O-N 3.17Å; W460-E464 HydrophobicContact CH2-CG 4.37Å; W460-E464 HydrophobicContact CZ2-CG 4.34Å; W460-E464 VanDerWaalsContact O-CB 3.29Å; W460-E464 WeakPolarHBondContact O-CB 3.47Å; W460-E464 PolarHBondContact O-N 2.66Å; W460-Y465 HydrophobicContact CH2-CE2 4.28Å; W460-Y465 HydrophobicContact CZ3-CE2 4.1Å; W460-L639 HydrophobicContact CH2-CB 4.28Å; W460-L639 HydrophobicContact CH2-CD1 4.26Å; W460-L639 HydrophobicContact CH2-CD2 3.55Å; W460-L639 HydrophobicContact CH2-CG 4.21Å; W460-L639 HydrophobicContact CZ3-CD2 4.14Å
461	I	88.4	Confident	86.4	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-62.6	-50	177.8	-67.3	170.6	0	0	0	110.4	L421 V424 R425 I428 M442 G457 A458 G463 E464 Y465	L421-I461 HydrophobicContact CD1-CD1 3.58Å; V424-I461 HydrophobicContact CB-CD1 4.43Å; V424-I461 HydrophobicContact CG1-CD1 3.91Å; R425-I461 HydrophobicContact CB-CD1 4.47Å; I428-I461 HydrophobicContact CD1-CG2 3.71Å; M442-I461 HydrophobicContact CE-CD1 4.06Å; G457-I461 WeakPolarHBondContact O-CG1 3.48Å; G457-I461 PolarHBondContact O-N 3.45Å; A458-I461 PolarHBondContact O-N 3.39Å; I461-G463 VanDerWaalsContact C-N 3.34Å; I461-G463 PolarHBondContact O-N 3.37Å; I461-E464 PolarHBondContact O-N 2.8Å; I461-Y465 HydrophobicContact CG2-CD2 4.38Å; I461-Y465 WeakPolarHBondContact O-CD2 3.31Å; I461-Y465 PolarHBondContact O-N 3.09Å
462	L	88.3	Confident	86.6	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.9	-45	177.3	-67.9	175	0	0	0	110.9	V439 M442 L443 F446 A458 E464 C466 V475	V439-L462 HydrophobicContact CG1-CD2 4.33Å; M442-L462 HydrophobicContact CB-CD2 4.02Å; M442-L462 HydrophobicContact CG-CD1 4.2Å; M442-L462 HydrophobicContact CG-CD2 3.81Å; M442-L462 HydrophobicContact CG-CG 3.9Å; L443-L462 HydrophobicContact CD2-CD1 4.23Å; L443-L462 HydrophobicContact CD2-CD2 4.04Å; L443-L462 HydrophobicContact CG-CD2 4.06Å; F446-L462 HydrophobicContact CD2-CD1 3.72Å; F446-L462 HydrophobicContact CE2-CD1 3.91Å; F446-L462 HydrophobicContact CG-CD1 4.34Å; A458-L462 WeakPolarHBondContact O-CG 3.49Å; A458-L462 PolarHBondContact O-N 3.14Å; L462-E464 VanDerWaalsContact C-N 3.29Å; L462-E464 PolarHBondContact O-N 2.9Å; L462-C466 WeakPolarHBondContact O-CB 3.46Å; L462-C466 PolarHBondContact O-N 3.44Å; L462-C466 VanDerWaalsContact O-N 3.08Å; L462-C466 PolarHBondContact O-SG 3.45Å; L462-V475 HydrophobicContact CB-CG2 4.2Å; L462-V475 HydrophobicContact CD1-CG2 4.44Å; L462-V475 HydrophobicContact CD2-CG2 4.36Å
463	G	86.7	Confident	86.8	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-59.9	-35	176.5	0	0	0	0	0	114.2	L459 W460 I461 R567	L459-G463 PolarHBondContact O-N 3.15Å; W460-G463 PolarHBondContact O-N 3.17Å; I461-G463 VanDerWaalsContact C-N 3.34Å; I461-G463 PolarHBondContact O-N 3.37Å; G463-R567 PolarHBondContact O-NH1 2.79Å; G463-R567 PolarHBondContact O-NH2 3.4Å
464	E	85.1	Confident	86.9	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-88.7	-34	-174.9	-167.6	54.1	-123.9	0	0	113.2	W460 I461 L462 K563 R567 R636	W460-E464 HydrophobicContact CH2-CG 4.37Å; W460-E464 HydrophobicContact CZ2-CG 4.34Å; W460-E464 VanDerWaalsContact O-CB 3.29Å; W460-E464 WeakPolarHBondContact O-CB 3.47Å; W460-E464 PolarHBondContact O-N 2.66Å; I461-E464 PolarHBondContact O-N 2.8Å; L462-E464 VanDerWaalsContact C-N 3.29Å; L462-E464 PolarHBondContact O-N 2.9Å; E464-K563 IonicContact OE2-NZ 3.83Å; E464-K563 PolarHBondContact OE2-NZ 2.8Å; E464-R567 VanDerWaalsContact O-CZ 3.29Å; E464-R567 PolarHBondContact O-NH1 2.99Å; E464-R567 PolarHBondContact O-NH2 2.91Å; E464-R567 IonicContact OE1-NH2 3.07Å; E464-R567 PolarHBondContact OE1-NH2 3.01Å; E464-R567 IonicContact OE2-NH2 3.56Å; E464-R636 HydrophobicContact CG-CB 4.49Å; E464-R636 HydrophobicContact CG-CG 4.33Å; E464-R636 PolarHBondContact O-NH2 3.02Å; E464-R636 WeakPolarHBondContact OE1-CB 3.32Å; E464-R636 IonicContact OE1-CZ 3.03Å; E464-R636 IonicContact OE1-NE 3.22Å; E464-R636 PolarHBondContact OE1-NE 3.32Å; E464-R636 IonicContact OE1-NH2 2.66Å
465	Y	85.9	Confident	87	Confident	10 Å²	10	35 Å²	35	4%	0.039	18%	0.178	C	C	.	.	H	α-helix	trans	-113.3	-9.9	-169.6	-64.9	-85.9	0	0	0	115.7	I428 Q429 W460 I461 S467 L639	I428-Y465 HydrophobicContact CD1-CD1 3.98Å; I428-Y465 HydrophobicContact CD1-CD2 3.54Å; I428-Y465 HydrophobicContact CD1-CE2 4.22Å; I428-Y465 HydrophobicContact CD1-CG 3.39Å; I428-Y465 HydrophobicContact CG1-CD1 3.91Å; I428-Y465 HydrophobicContact CG1-CD2 4.11Å; I428-Y465 HydrophobicContact CG1-CE1 4.21Å; I428-Y465 HydrophobicContact CG1-CE2 4.4Å; I428-Y465 HydrophobicContact CG1-CG 3.85Å; I428-Y465 HydrophobicContact CG2-CD2 4Å; I428-Y465 HydrophobicContact CG2-CE1 4.25Å; I428-Y465 HydrophobicContact CG2-CE2 3.54Å; Q429-Y465 PolarHBondContact OE1-OH 3.26Å; W460-Y465 HydrophobicContact CH2-CE2 4.28Å; W460-Y465 HydrophobicContact CZ3-CE2 4.1Å; I461-Y465 HydrophobicContact CG2-CD2 4.38Å; I461-Y465 WeakPolarHBondContact O-CD2 3.31Å; I461-Y465 PolarHBondContact O-N 3.09Å; Y465-S467 PolarHBondContact O-N 2.86Å; Y465-S467 VanDerWaalsContact O-N 3.1Å; Y465-S467 PolarHBondContact O-OG 3.4Å; Y465-L639 WeakPolarHBondContact OH-CD2 3.35Å
466	C	84.8	Confident	87	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.179	C	C	.	.			trans	-63.9	115.8	169.7	-68.4	0	0	0	0	110	L462 D471 I472 V475 R567	L462-C466 WeakPolarHBondContact O-CB 3.46Å; L462-C466 PolarHBondContact O-N 3.44Å; L462-C466 VanDerWaalsContact O-N 3.08Å; L462-C466 PolarHBondContact O-SG 3.45Å; C466-D471 HydrophobicContact CB-CB 4.25Å; C466-I472 HydrophobicContact CB-CG1 4.23Å; C466-V475 VanDerWaalsContact SG-CG2 3.57Å; C466-R567 PolarHBondContact O-NH1 3.14Å
467	S	80.8	Confident	87	Confident	68 Å²	68	34.6 Å²	34.6	48%	0.476	19%	0.186	S	C	.	.			trans	-121.8	-22.4	-171.1	-56.5	0	0	0	0	112.9	Y465 L571	Y465-S467 PolarHBondContact O-N 2.86Å; Y465-S467 VanDerWaalsContact O-N 3.1Å; Y465-S467 PolarHBondContact O-OG 3.4Å; S467-L571 VanDerWaalsContact O-CD1 3.29Å; S467-L571 WeakPolarHBondContact O-CD1 3.45Å
468	T	86.1	Confident	86.9	Confident	62 Å²	62	35.5 Å²	35.5	38%	0.38	19%	0.186	S	C	.	.	S	Bend	trans	-91.6	155.3	178.5	78.7	0	0	0	0	111.3	E470 D471 I472	T468-E470 PolarHBondContact O-N 3.3Å; T468-D471 WeakPolarHBondContact CB-OD2 3.42Å; T468-D471 WeakPolarHBondContact CG2-OD2 3.28Å; T468-D471 WeakPolarHBondContact OG1-CB 3.33Å; T468-D471 PolarHBondContact OG1-N 3.34Å; T468-D471 VanDerWaalsContact OG1-N 3.13Å; T468-D471 PolarHBondContact OG1-OD1 2.88Å; T468-D471 PolarHBondContact OG1-OD2 2.95Å; T468-I472 WeakPolarHBondContact O-CD1 3.29Å; T468-I472 VanDerWaalsContact O-CG1 3.24Å; T468-I472 WeakPolarHBondContact O-CG1 3.47Å; T468-I472 PolarHBondContact O-N 2.96Å
469	K	86.5	Confident	86.9	Confident	114 Å²	114	35.5 Å²	35.5	50%	0.496	19%	0.186	S	C	.	.	H	α-helix	trans	-61.4	-33.9	177.3	82.6	-172.7	-176.3	-163.4	0	111.8	Q473	K469-Q473 WeakPolarHBondContact O-CG 3.45Å; K469-Q473 PolarHBondContact O-N 2.87Å
470	E	86.5	Confident	86.7	Confident	116 Å²	116	40.3 Å²	40.3	54%	0.542	20%	0.204	S	C	.	.	H	α-helix	trans	-74.4	-47.9	-174.5	-77.8	156.2	-152	0	0	109.5	T468 I472 Q473 S474	T468-E470 PolarHBondContact O-N 3.3Å; E470-I472 VanDerWaalsContact C-N 3.29Å; E470-I472 PolarHBondContact O-N 2.89Å; E470-Q473 PolarHBondContact O-N 3.41Å; E470-Q473 VanDerWaalsContact O-N 3.14Å; E470-S474 PolarHBondContact O-N 2.67Å; E470-S474 PolarHBondContact O-OG 2.98Å; E470-S474 VanDerWaalsContact O-OG 3.09Å
471	D	86.3	Confident	86.5	Confident	43 Å²	43	44.6 Å²	44.6	23%	0.23	22%	0.22	C	C	.	.	H	α-helix	trans	-58.6	-42.3	175.6	-55.9	-30.5	0	0	0	111.5	V439 C466 T468 Q473 S474 V475	V439-D471 HydrophobicContact CG1-CB 4.4Å; C466-D471 HydrophobicContact CB-CB 4.25Å; T468-D471 WeakPolarHBondContact CB-OD2 3.42Å; T468-D471 WeakPolarHBondContact CG2-OD2 3.28Å; T468-D471 WeakPolarHBondContact OG1-CB 3.33Å; T468-D471 PolarHBondContact OG1-N 3.34Å; T468-D471 VanDerWaalsContact OG1-N 3.13Å; T468-D471 PolarHBondContact OG1-OD1 2.88Å; T468-D471 PolarHBondContact OG1-OD2 2.95Å; D471-Q473 VanDerWaalsContact C-N 3.33Å; D471-Q473 PolarHBondContact O-N 3.15Å; D471-S474 PolarHBondContact O-N 3.37Å; D471-V475 VanDerWaalsContact O-CG2 3.26Å; D471-V475 WeakPolarHBondContact O-CG2 3.49Å; D471-V475 PolarHBondContact O-N 2.71Å
472	I	87.8	Confident	86.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.1	-43.1	178.3	-73.5	172.3	0	0	0	111.5	C466 T468 E470 M476 I564 R567 Y568 L571 F581	C466-I472 HydrophobicContact CB-CG1 4.23Å; T468-I472 WeakPolarHBondContact O-CD1 3.29Å; T468-I472 VanDerWaalsContact O-CG1 3.24Å; T468-I472 WeakPolarHBondContact O-CG1 3.47Å; T468-I472 PolarHBondContact O-N 2.96Å; E470-I472 VanDerWaalsContact C-N 3.29Å; E470-I472 PolarHBondContact O-N 2.89Å; I472-M476 PolarHBondContact O-N 3.21Å; I472-I564 HydrophobicContact CB-CG2 4.03Å; I472-I564 HydrophobicContact CG1-CG2 3.98Å; I472-I564 HydrophobicContact CG2-CG2 3.28Å; I472-R567 HydrophobicContact CD1-CB 4.28Å; I472-Y568 HydrophobicContact CG2-CD2 3.72Å; I472-Y568 HydrophobicContact CG2-CG 4.3Å; I472-L571 HydrophobicContact CD1-CD1 3.92Å; I472-F581 HydrophobicContact CG2-CE1 4.35Å; I472-F581 HydrophobicContact CG2-CE2 4.06Å; I472-F581 HydrophobicContact CG2-CZ 3.66Å
473	Q	88.3	Confident	85.9	Confident	83 Å²	83	44.7 Å²	44.7	39%	0.388	22%	0.221	S	C	.	.	H	α-helix	trans	-70.7	-37.3	177.9	-72.9	175.8	-13.7	0	0	111.7	K469 E470 D471 M476 T477 Y568	K469-Q473 WeakPolarHBondContact O-CG 3.45Å; K469-Q473 PolarHBondContact O-N 2.87Å; E470-Q473 PolarHBondContact O-N 3.41Å; E470-Q473 VanDerWaalsContact O-N 3.14Å; D471-Q473 VanDerWaalsContact C-N 3.33Å; D471-Q473 PolarHBondContact O-N 3.15Å; Q473-M476 PolarHBondContact O-N 3.42Å; Q473-T477 PolarHBondContact O-N 3.45Å; Q473-T477 PolarHBondContact O-OG1 3.21Å; Q473-Y568 HydrophobicContact CG-CE2 4.25Å; Q473-Y568 PolarHBondContact NE2-OH 3.38Å
474	S	88.1	Confident	85.5	Confident	52 Å²	52	45.8 Å²	45.8	36%	0.364	23%	0.232	S	C	.	.	H	α-helix	trans	-61.7	-47.9	174.2	-62.3	0	0	0	0	111.3	E470 D471 M476 T477 E478	E470-S474 PolarHBondContact O-N 2.67Å; E470-S474 PolarHBondContact O-OG 2.98Å; E470-S474 VanDerWaalsContact O-OG 3.09Å; D471-S474 PolarHBondContact O-N 3.37Å; S474-M476 VanDerWaalsContact C-N 3.29Å; S474-M476 PolarHBondContact O-N 2.84Å; S474-T477 WeakPolarHBondContact O-CB 3.43Å; S474-T477 PolarHBondContact O-N 3.48Å; S474-T477 VanDerWaalsContact O-N 3.09Å; S474-E478 WeakPolarHBondContact O-CB 3.13Å; S474-E478 PolarHBondContact O-N 2.87Å
475	V	88.2	Confident	84.9	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.012	26%	0.26	C	S	.	.	H	α-helix	trans	-56.3	-44	175.5	173.2	0	0	0	0	111.5	L443 L462 C466 D471 T477 E478 I479 I564	L443-V475 HydrophobicContact CD2-CB 4.43Å; L443-V475 HydrophobicContact CD2-CG2 3.6Å; L462-V475 HydrophobicContact CB-CG2 4.2Å; L462-V475 HydrophobicContact CD1-CG2 4.44Å; L462-V475 HydrophobicContact CD2-CG2 4.36Å; C466-V475 VanDerWaalsContact SG-CG2 3.57Å; D471-V475 VanDerWaalsContact O-CG2 3.26Å; D471-V475 WeakPolarHBondContact O-CG2 3.49Å; D471-V475 PolarHBondContact O-N 2.71Å; V475-T477 VanDerWaalsContact C-N 3.31Å; V475-T477 PolarHBondContact O-N 3.36Å; V475-E478 PolarHBondContact O-N 2.82Å; V475-I479 HydrophobicContact CG1-CD1 3.62Å; V475-I479 HydrophobicContact CG1-CG1 4.31Å; V475-I479 WeakPolarHBondContact O-CB 3.32Å; V475-I479 VanDerWaalsContact O-CG1 3.26Å; V475-I479 WeakPolarHBondContact O-CG1 3.43Å; V475-I479 PolarHBondContact O-N 3.32Å; V475-I564 HydrophobicContact CB-CD1 4.3Å; V475-I564 HydrophobicContact CG1-CD1 3.61Å
476	M	87.1	Confident	84.3	Confident	6 Å²	6	53.6 Å²	53.6	3%	0.03	27%	0.27	C	S	.	.	H	α-helix	trans	-64.3	-37.8	178.9	-166.8	65.5	175.7	0	0	112.2	I472 Q473 S474 R480 L561 F581 E584 L588	I472-M476 PolarHBondContact O-N 3.21Å; Q473-M476 PolarHBondContact O-N 3.42Å; S474-M476 VanDerWaalsContact C-N 3.29Å; S474-M476 PolarHBondContact O-N 2.84Å; M476-R480 WeakPolarHBondContact O-CB 3.29Å; M476-R480 PolarHBondContact O-N 3Å; M476-R480 VanDerWaalsContact O-N 3.08Å; M476-L561 HydrophobicContact CE-CD2 4.45Å; M476-L561 HydrophobicContact SD-CD2 3.69Å; M476-F581 HydrophobicContact CB-CE2 3.92Å; M476-F581 HydrophobicContact CB-CZ 4.2Å; M476-F581 HydrophobicContact CG-CE2 3.9Å; M476-F581 HydrophobicContact CG-CZ 4.24Å; M476-F581 HydrophobicContact SD-CE2 4.48Å; M476-F581 HydrophobicContact SD-CZ 4.29Å; M476-E584 HydrophobicContact CE-CB 3.91Å; M476-E584 VanDerWaalsContact CE-CD 3.45Å; M476-E584 HydrophobicContact CE-CG 3.42Å; M476-E584 VanDerWaalsContact CE-CG 3.42Å; M476-E584 VanDerWaalsContact CE-OE1 3.23Å; M476-E584 WeakPolarHBondContact CE-OE1 3.48Å; M476-E584 WeakPolarHBondContact CG-OE1 3.44Å; M476-L588 HydrophobicContact CE-CD1 3.46Å; M476-L588 VanDerWaalsContact CE-CD1 3.46Å; M476-L588 HydrophobicContact CE-CG 4.28Å; M476-L588 HydrophobicContact SD-CD1 4.07Å
477	T	88.5	Confident	83.8	Confident	82 Å²	82	56.5 Å²	56.5	50%	0.503	29%	0.289	S	S	.	.	H	α-helix	trans	-66	-43.8	176.6	-56	0	0	0	0	111	Q473 S474 V475 R480 R481	Q473-T477 PolarHBondContact O-N 3.45Å; Q473-T477 PolarHBondContact O-OG1 3.21Å; S474-T477 WeakPolarHBondContact O-CB 3.43Å; S474-T477 PolarHBondContact O-N 3.48Å; S474-T477 VanDerWaalsContact O-N 3.09Å; V475-T477 VanDerWaalsContact C-N 3.31Å; V475-T477 PolarHBondContact O-N 3.36Å; T477-R480 WeakPolarHBondContact O-CB 3.09Å; T477-R480 PolarHBondContact O-N 3.16Å; T477-R481 PolarHBondContact O-N 2.95Å
478	E	85.8	Confident	83.5	Confident	34 Å²	34	53.3 Å²	53.3	16%	0.159	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-44.5	177.8	-118.7	60.4	-45	0	0	112.5	F446 H447 S474 V475 R480 R481 S482	F446-E478 HydrophobicContact CB-CG 4.41Å; F446-E478 HydrophobicContact CD1-CB 3.89Å; F446-E478 HydrophobicContact CD1-CG 3.82Å; F446-E478 HydrophobicContact CE1-CB 4.25Å; H447-E478 WeakPolarHBondContact CE1-CG 3.49Å; H447-E478 IonicContact CE1-OE1 2.71Å; H447-E478 PolarHBondContact CE1-OE1 3.34Å; H447-E478 IonicContact CE1-OE2 3.48Å; H447-E478 PolarHBondContact CE1-OE2 2.77Å; H447-E478 IonicContact ND1-OE2 3.65Å; H447-E478 WeakPolarHBondContact NE2-CG 3.18Å; H447-E478 IonicContact NE2-OE1 2.98Å; H447-E478 PolarHBondContact NE2-OE1 2.94Å; H447-E478 VanDerWaalsContact NE2-OE1 3.07Å; H447-E478 IonicContact NE2-OE2 3.35Å; H447-E478 PolarHBondContact NE2-OE2 3.32Å; S474-E478 WeakPolarHBondContact O-CB 3.13Å; S474-E478 PolarHBondContact O-N 2.87Å; V475-E478 PolarHBondContact O-N 2.82Å; E478-R480 VanDerWaalsContact C-N 3.3Å; E478-R480 PolarHBondContact O-N 3.45Å; E478-R481 PolarHBondContact O-N 2.92Å; E478-S482 PolarHBondContact O-N 2.84Å; E478-S482 PolarHBondContact O-OG 3.25Å
479	I	86.9	Confident	82.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.9	-43.1	174.4	-71.6	165.1	0	0	0	110.4	F446 L459 V475 S482 L483 L557 L561 L588	F446-I479 HydrophobicContact CE1-CG1 4.43Å; F446-I479 HydrophobicContact CZ-CG1 4.48Å; L459-I479 HydrophobicContact CD2-CD1 4.44Å; L459-I479 HydrophobicContact CD2-CG1 4.4Å; V475-I479 HydrophobicContact CG1-CD1 3.62Å; V475-I479 HydrophobicContact CG1-CG1 4.31Å; V475-I479 WeakPolarHBondContact O-CB 3.32Å; V475-I479 VanDerWaalsContact O-CG1 3.26Å; V475-I479 WeakPolarHBondContact O-CG1 3.43Å; V475-I479 PolarHBondContact O-N 3.32Å; I479-S482 PolarHBondContact O-N 3.41Å; I479-L483 HydrophobicContact CG2-CD1 3.9Å; I479-L483 WeakPolarHBondContact O-CG 3.33Å; I479-L483 PolarHBondContact O-N 3.41Å; I479-L557 HydrophobicContact CD1-CD1 3.75Å; I479-L557 HydrophobicContact CG1-CD1 4.04Å; I479-L557 HydrophobicContact CG2-CD1 3.92Å; I479-L557 HydrophobicContact CG2-CD2 4.37Å; I479-L561 HydrophobicContact CD1-CD2 3.96Å; I479-L588 HydrophobicContact CG2-CD1 4.13Å
480	R	84.8	Confident	82.1	Confident	101 Å²	101	50.5 Å²	50.5	38%	0.381	25%	0.251	S	S	.	.	H	α-helix	trans	-61.9	-45.4	175.6	175	-178.7	-82.7	105.7	-2.2	111.1	M476 T477 E478 S482 L483 G484 E584	M476-R480 WeakPolarHBondContact O-CB 3.29Å; M476-R480 PolarHBondContact O-N 3Å; M476-R480 VanDerWaalsContact O-N 3.08Å; T477-R480 WeakPolarHBondContact O-CB 3.09Å; T477-R480 PolarHBondContact O-N 3.16Å; E478-R480 VanDerWaalsContact C-N 3.3Å; E478-R480 PolarHBondContact O-N 3.45Å; R480-S482 VanDerWaalsContact C-N 3.3Å; R480-S482 PolarHBondContact O-N 3.49Å; R480-L483 PolarHBondContact O-N 3.46Å; R480-G484 PolarHBondContact O-N 2.68Å; R480-E584 IonicContact CZ-OE1 3.79Å; R480-E584 IonicContact NH1-OE1 3.22Å; R480-E584 PolarHBondContact NH1-OE1 3.28Å; R480-E584 IonicContact NH2-OE1 3.93Å; R480-E584 PolarHBondContact NH2-OE1 3.46Å
481	R	85.1	Confident	81.4	Confident	161 Å²	161	45.3 Å²	45.3	61%	0.608	23%	0.228	S	C	*	.	H	α-helix	trans	-61.4	-39.7	178.3	-175	167.4	171	-155.4	7.3	111.8	H447 T477 E478 G484	H447-R481 PolarHBondContact CE1-NH1 2.91Å; H447-R481 VanDerWaalsContact CE1-NH1 3.29Å; H447-R481 WeakPolarHBondContact NE2-CD 3.37Å; H447-R481 PolarHBondContact NE2-NH1 2.99Å; T477-R481 PolarHBondContact O-N 2.95Å; E478-R481 PolarHBondContact O-N 2.92Å; R481-G484 PolarHBondContact O-N 3.29Å
482	S	83.4	Confident	80.6	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.014	22%	0.22	C	C	.	.	H	α-helix	trans	-71.6	-25.2	175.9	-66.1	0	0	0	0	114.2	Y455 E478 I479 R480 P540 L542 R543	Y455-S482 WeakPolarHBondContact OH-CB 3.5Å; Y455-S482 PolarHBondContact OH-OG 3.15Å; E478-S482 PolarHBondContact O-N 2.84Å; E478-S482 PolarHBondContact O-OG 3.25Å; I479-S482 PolarHBondContact O-N 3.41Å; R480-S482 VanDerWaalsContact C-N 3.3Å; R480-S482 PolarHBondContact O-N 3.49Å; S482-P540 WeakPolarHBondContact O-CB 3.38Å; S482-L542 WeakPolarHBondContact O-CB 3.44Å; S482-R543 PolarHBondContact O-N 3.1Å
483	L	80.6	Confident	79.7	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-85	-28.6	173.6	-74.2	168.4	0	0	0	112.9	I479 R480 I488 L542 R543 L546 L588	I479-L483 HydrophobicContact CG2-CD1 3.9Å; I479-L483 WeakPolarHBondContact O-CG 3.33Å; I479-L483 PolarHBondContact O-N 3.41Å; R480-L483 PolarHBondContact O-N 3.46Å; L483-I488 HydrophobicContact CD2-CD1 4.17Å; L483-L542 HydrophobicContact CD1-CD2 4.35Å; L483-L542 HydrophobicContact CD2-CD2 3.57Å; L483-L542 HydrophobicContact CD2-CG 3.72Å; L483-L542 HydrophobicContact CG-CD2 3.61Å; L483-L542 HydrophobicContact CG-CG 4.24Å; L483-R543 WeakPolarHBondContact O-CD 3.33Å; L483-L546 HydrophobicContact CD2-CD1 3.97Å; L483-L588 HydrophobicContact CD1-CD1 4.49Å; L483-L588 HydrophobicContact CD1-CD2 3.82Å
484	G	78.3	Confident	78.8	Confident	24 Å²	24	48.9 Å²	48.9	25%	0.247	24%	0.244	C	C	.	.			trans	76.2	-150.2	-173.4	0	0	0	0	0	112.9	R480 R481	R480-G484 PolarHBondContact O-N 2.68Å; R481-G484 PolarHBondContact O-N 3.29Å
485	E	73.1	Confident	77.9	Confident	124 Å²	124	51.4 Å²	51.4	58%	0.579	25%	0.248	S	C	*	.	S	Bend	trans	-68	135.1	-178.9	-66.3	-175.4	166.5	0	0	112.6	R543	E485-R543 PolarHBondContact O-NH1 3.42Å
486	I	73.3	Confident	76.6	Confident	50 Å²	50	57.7 Å²	57.7	26%	0.256	28%	0.278	S	S	.	.	S	Bend	trans	-117.9	136.3	179.6	-64.6	149.1	0	0	0	107.3	L588 T591	I486-L588 HydrophobicContact CD1-CD2 3.25Å; I486-L588 HydrophobicContact CG1-CD2 4.27Å; I486-T591 HydrophobicContact CG2-CG2 4.19Å
487	P	74.1	Confident	75.6	Confident	61 Å²	61	60.7 Å²	60.7	40%	0.396	30%	0.303	S	S	.	.	S	Bend	cis	-73.9	135.3	6.5	-17.8	32.8	0	0	0	115.3	V489 S491 T591	P487-V489 PolarHBondContact O-N 2.99Å; P487-S491 PolarHBondContact O-N 2.85Å; P487-S491 VanDerWaalsContact O-N 3.12Å; P487-S491 PolarHBondContact O-OG 3.43Å; P487-T591 HydrophobicContact CB-CG2 4.49Å
488	I	74.6	Confident	74	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-64.9	-47.2	-171.1	-57.9	166.5	0	0	0	111.7	L483 E490 S491 E492 T591 L595	L483-I488 HydrophobicContact CD2-CD1 4.17Å; I488-E490 PolarHBondContact O-N 2.94Å; I488-S491 WeakPolarHBondContact CA-OG 3.11Å; I488-S491 PolarHBondContact O-N 3.48Å; I488-S491 PolarHBondContact O-OG 2.9Å; I488-E492 HydrophobicContact CG2-CG 4.33Å; I488-E492 PolarHBondContact O-N 3.01Å; I488-T591 HydrophobicContact CB-CG2 3.97Å; I488-T591 HydrophobicContact CD1-CG2 3.89Å; I488-T591 HydrophobicContact CG1-CG2 3.7Å; I488-L595 HydrophobicContact CD1-CD2 4.37Å; I488-L595 HydrophobicContact CG2-CD1 4.1Å; I488-L595 HydrophobicContact CG2-CD2 3.95Å
489	V	72.3	Confident	72.4	Confident	9 Å²	9	64.9 Å²	64.9	6%	0.055	33%	0.332	C	S	.	.	H	α-helix	trans	-61.6	-45	-176.7	174.5	0	0	0	0	111.9	P487 E492 I493 H594 L595 L600	P487-V489 PolarHBondContact O-N 2.99Å; V489-E492 PolarHBondContact O-N 3.39Å; V489-I493 HydrophobicContact CG1-CD1 3.64Å; V489-I493 HydrophobicContact CG1-CG1 4.43Å; V489-I493 WeakPolarHBondContact O-CB 3.41Å; V489-I493 WeakPolarHBondContact O-CD1 3.44Å; V489-I493 WeakPolarHBondContact O-CG1 3.47Å; V489-I493 PolarHBondContact O-N 3.47Å; V489-H594 VanDerWaalsContact CG2-ND1 3.31Å; V489-H594 WeakPolarHBondContact CG2-ND1 3.08Å; V489-L595 HydrophobicContact CG2-CB 4.04Å; V489-L595 HydrophobicContact CG2-CD1 3.89Å; V489-L600 HydrophobicContact CB-CD1 4.37Å; V489-L600 HydrophobicContact CG1-CD1 3.91Å; V489-L600 HydrophobicContact CG2-CD1 4.39Å
490	E	71.3	Confident	70.4	Confident	108 Å²	108	68.9 Å²	68.9	51%	0.505	35%	0.353	S	S	.	.	H	α-helix	trans	-67	-39.7	177.9	-67.4	178.8	-172.1	0	0	112	I488 I493 K494	I488-E490 PolarHBondContact O-N 2.94Å; E490-I493 PolarHBondContact O-N 3.13Å; E490-K494 WeakPolarHBondContact O-CB 3.29Å; E490-K494 VanDerWaalsContact O-CG 3.24Å; E490-K494 WeakPolarHBondContact O-CG 3.47Å; E490-K494 PolarHBondContact O-N 2.84Å
491	S	70.7	Confident	68	Low	8 Å²	8	73.1 Å²	73.1	6%	0.056	37%	0.374	C	S	.	.	H	α-helix	trans	-66.3	-36.9	176.6	70.2	0	0	0	0	112.4	P487 I488 K495 R543	P487-S491 PolarHBondContact O-N 2.85Å; P487-S491 VanDerWaalsContact O-N 3.12Å; P487-S491 PolarHBondContact O-OG 3.43Å; I488-S491 WeakPolarHBondContact CA-OG 3.11Å; I488-S491 PolarHBondContact O-N 3.48Å; I488-S491 PolarHBondContact O-OG 2.9Å; S491-K495 WeakPolarHBondContact O-CB 3.5Å; S491-K495 VanDerWaalsContact O-CG 3.27Å; S491-K495 WeakPolarHBondContact O-CG 3.36Å; S491-K495 PolarHBondContact O-N 3.06Å; S491-R543 PolarHBondContact OG-NH1 3.5Å; S491-R543 PolarHBondContact OG-NH2 2.82Å
492	E	69.5	Low	65.8	Low	11 Å²	11	70.4 Å²	70.4	5%	0.051	38%	0.378	C	S	.	.	H	α-helix	trans	-69.3	-43.6	173.8	-77.5	-58	150.8	0	0	111.8	I488 V489 K494 K495 E496 R543 L600	I488-E492 HydrophobicContact CG2-CG 4.33Å; I488-E492 PolarHBondContact O-N 3.01Å; V489-E492 PolarHBondContact O-N 3.39Å; E492-K494 VanDerWaalsContact C-N 3.31Å; E492-K494 PolarHBondContact O-N 3.17Å; E492-K495 CarbonylContact O-C 3.54Å; E492-K495 PolarHBondContact O-N 2.92Å; E492-K495 VanDerWaalsContact O-N 3.12Å; E492-E496 PolarHBondContact O-N 2.95Å; E492-R543 IonicContact OE1-CZ 2.65Å; E492-R543 IonicContact OE1-NE 3.66Å; E492-R543 PolarHBondContact OE1-NE 2.93Å; E492-R543 IonicContact OE1-NH2 3.26Å; E492-R543 PolarHBondContact OE1-NH2 3.2Å; E492-L600 HydrophobicContact CB-CD1 4.1Å
493	I	70.4	Confident	63.4	Low	90 Å²	90	80 Å²	80	46%	0.462	42%	0.422	S	S	.	.	H	α-helix	trans	-61.7	-40.6	176.3	-68.3	166.3	0	0	0	110.7	V489 E490 E496 A497 L600	V489-I493 HydrophobicContact CG1-CD1 3.64Å; V489-I493 HydrophobicContact CG1-CG1 4.43Å; V489-I493 WeakPolarHBondContact O-CB 3.41Å; V489-I493 WeakPolarHBondContact O-CD1 3.44Å; V489-I493 WeakPolarHBondContact O-CG1 3.47Å; V489-I493 PolarHBondContact O-N 3.47Å; E490-I493 PolarHBondContact O-N 3.13Å; I493-E496 PolarHBondContact O-N 2.83Å; I493-A497 WeakPolarHBondContact O-CB 3.49Å; I493-A497 PolarHBondContact O-N 2.81Å; I493-L600 HydrophobicContact CG1-CD1 4.35Å
494	K	69.8	Low	61.1	Low	99 Å²	99	88 Å²	88	43%	0.43	46%	0.46	S	S	.	.	H	α-helix	trans	-65.8	-35.1	174.2	-74.7	173.4	-179.5	176	0	112.9	E490 E492 G498 E499 L500	E490-K494 WeakPolarHBondContact O-CB 3.29Å; E490-K494 VanDerWaalsContact O-CG 3.24Å; E490-K494 WeakPolarHBondContact O-CG 3.47Å; E490-K494 PolarHBondContact O-N 2.84Å; E492-K494 VanDerWaalsContact C-N 3.31Å; E492-K494 PolarHBondContact O-N 3.17Å; K494-G498 PolarHBondContact O-N 2.87Å; K494-G498 VanDerWaalsContact O-N 3.15Å; K494-E499 PolarHBondContact O-N 3.09Å; K494-L500 HydrophobicContact CB-CD1 4.4Å
495	K	68.2	Low	58.9	Low	106 Å²	106	95.5 Å²	95.5	46%	0.461	49%	0.488	S	S	.	.	H	α-helix	trans	-71.5	-41.7	174.3	-76.9	-179.2	179.9	-174.5	0	112.1	S491 E492 A497 G498 L500	S491-K495 WeakPolarHBondContact O-CB 3.5Å; S491-K495 VanDerWaalsContact O-CG 3.27Å; S491-K495 WeakPolarHBondContact O-CG 3.36Å; S491-K495 PolarHBondContact O-N 3.06Å; E492-K495 CarbonylContact O-C 3.54Å; E492-K495 PolarHBondContact O-N 2.92Å; E492-K495 VanDerWaalsContact O-N 3.12Å; K495-A497 VanDerWaalsContact C-N 3.28Å; K495-A497 PolarHBondContact O-N 2.88Å; K495-G498 PolarHBondContact O-N 3Å; K495-G498 VanDerWaalsContact O-N 3.1Å; K495-L500 HydrophobicContact CG-CB 4.44Å; K495-L500 HydrophobicContact CG-CD1 3.82Å
496	E	61.6	Low	56.9	Low	134 Å²	134	96.9 Å²	96.9	63%	0.626	50%	0.498	S	S	*	.	H	α-helix	trans	-65.3	-32.2	172.7	-73.1	-164.5	147.7	0	0	112.2	E492 I493 G498	E492-E496 PolarHBondContact O-N 2.95Å; I493-E496 PolarHBondContact O-N 2.83Å; E496-G498 VanDerWaalsContact C-N 3.28Å; E496-G498 PolarHBondContact O-N 2.71Å
497	A	64.6	Low	54.8	Low	68 Å²	68	100.6 Å²	100.6	56%	0.562	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-9.2	172.8	0	0	0	0	0	113.9	I493 K495	I493-A497 WeakPolarHBondContact O-CB 3.49Å; I493-A497 PolarHBondContact O-N 2.81Å; K495-A497 VanDerWaalsContact C-N 3.28Å; K495-A497 PolarHBondContact O-N 2.88Å
498	G	55.4	Low	52.9	Low	57 Å²	57	103.5 Å²	103.5	59%	0.588	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	17.1	176.5	0	0	0	0	0	115.8	K494 K495 E496	K494-G498 PolarHBondContact O-N 2.87Å; K494-G498 VanDerWaalsContact O-N 3.15Å; K495-G498 PolarHBondContact O-N 3Å; K495-G498 VanDerWaalsContact O-N 3.1Å; E496-G498 VanDerWaalsContact C-N 3.28Å; E496-G498 PolarHBondContact O-N 2.71Å
499	E	51.6	Low	51.1	Low	147 Å²	147	106 Å²	106	69%	0.687	57%	0.565	S	S	*	*			trans	-83.9	-5.7	-174.2	-71.9	-172.8	156.8	0	0	114.7	K494	K494-E499 PolarHBondContact O-N 3.09Å
500	L	45.7	Very low	49.3	Very low	85 Å²	85	111.7 Å²	111.7	45%	0.445	60%	0.602	S	S	.	*			trans	-110.9	74.8	178.4	-73	164.9	0	0	0	111.2	K494 K495	K494-L500 HydrophobicContact CB-CD1 4.4Å; K495-L500 HydrophobicContact CG-CB 4.44Å; K495-L500 HydrophobicContact CG-CD1 3.82Å
501	K	34.4	Very low	47.7	Very low	190 Å²	190	111.7 Å²	111.7	83%	0.826	61%	0.609	S	S	*	*			trans	-100.2	111.4	147.5	-76.4	-175.7	178.8	179.6	0	107
502	P	38.5	Very low	46.3	Very low	104 Å²	104	119.9 Å²	119.9	68%	0.675	65%	0.647	S	S	*	*			trans	-60.1	138.6	159.8	-7.8	23.5	0	0	0	107.4	E504	P502-E504 PolarHBondContact O-N 3.21Å
503	E	33.1	Very low	45	Very low	204 Å²	204	126.2 Å²	126.2	95%	0.953	67%	0.674	S	S	*	*			trans	-63.2	81.1	168	-66.2	179.4	156.4	0	0	109.1
504	E	32.3	Very low	44.2	Very low	168 Å²	168	128.2 Å²	128.2	79%	0.785	69%	0.685	S	S	*	*			trans	-90.3	126.5	158.7	-76.3	-172.2	168.6	0	0	108	P502 I506	P502-E504 PolarHBondContact O-N 3.21Å; E504-I506 PolarHBondContact O-N 3.28Å; E504-I506 VanDerWaalsContact O-N 3.1Å
505	E	31.9	Very low	42.9	Very low	182 Å²	182	127 Å²	127	85%	0.85	69%	0.686	S	S	*	*			trans	-44.9	115.6	177.1	-67	-178.8	150.8	0	0	110.9	T507	E505-T507 VanDerWaalsContact C-N 3.27Å; E505-T507 PolarHBondContact O-N 3Å
506	I	31.6	Very low	42.4	Very low	153 Å²	153	126 Å²	126	79%	0.785	69%	0.688	S	S	*	*			trans	-69.7	89.8	171.4	-56.8	169.6	0	0	0	107.1	E504 V508	E504-I506 PolarHBondContact O-N 3.28Å; E504-I506 VanDerWaalsContact O-N 3.1Å; I506-V508 HydrophobicContact CG2-CG2 4.34Å; I506-V508 PolarHBondContact O-N 2.94Å; I506-V508 VanDerWaalsContact O-N 3.08Å
507	T	30.1	Very low	42	Very low	128 Å²	128	129.3 Å²	129.3	79%	0.785	70%	0.704	S	S	*	*			trans	-65.2	105	156.8	45.5	0	0	0	0	107.7	E505 G509	E505-T507 VanDerWaalsContact C-N 3.27Å; E505-T507 PolarHBondContact O-N 3Å; T507-G509 PolarHBondContact O-N 3.41Å; T507-G509 VanDerWaalsContact O-N 3.09Å
508	V	32.4	Very low	41	Very low	122 Å²	122	134.4 Å²	134.4	74%	0.739	72%	0.719	S	S	*	*			trans	-66.6	104	177.5	-163.5	0	0	0	0	108.7	I506	I506-V508 HydrophobicContact CG2-CG2 4.34Å; I506-V508 PolarHBondContact O-N 2.94Å; I506-V508 VanDerWaalsContact O-N 3.08Å
509	G	36.8	Very low	40.9	Very low	52 Å²	52	134.1 Å²	134.1	54%	0.536	72%	0.716	S	S	.	*			trans	-61.7	152.3	164.6	0	0	0	0	0	110.8	T507 V511	T507-G509 PolarHBondContact O-N 3.41Å; T507-G509 VanDerWaalsContact O-N 3.09Å; G509-V511 PolarHBondContact O-N 3.34Å
510	P	34.7	Very low	40.8	Very low	130 Å²	130	132 Å²	132	84%	0.844	71%	0.712	S	S	*	*			trans	-69	128.1	-167.1	28.6	-32.5	0	0	0	111.2	Q512	P510-Q512 PolarHBondContact O-N 3.36Å
511	V	38.9	Very low	41	Very low	107 Å²	107	136 Å²	136	65%	0.648	72%	0.723	S	S	*	*			trans	-67	114.5	171.6	179.7	0	0	0	0	108.6	G509 K513	G509-V511 PolarHBondContact O-N 3.34Å; V511-K513 PolarHBondContact O-N 3.46Å
512	Q	41.4	Very low	41.3	Very low	181 Å²	181	129.9 Å²	129.9	85%	0.846	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-66.9	119.8	172.1	-88	-177.9	-21.9	0	0	110.1	P510	P510-Q512 PolarHBondContact O-N 3.36Å
513	K	42.6	Very low	41.6	Very low	144 Å²	144	129.8 Å²	129.8	63%	0.626	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-91.3	116.5	170.6	-70	178.1	-179.8	176.8	0	108.7	V511	V511-K513 PolarHBondContact O-N 3.46Å
514	L	52.3	Low	42	Very low	131 Å²	131	129 Å²	129	69%	0.686	70%	0.702	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.6	134.4	168.3	-90.3	146.3	0	0	0	109.5
515	V	43.6	Very low	42.5	Very low	73 Å²	73	126.6 Å²	126.6	44%	0.442	70%	0.703	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.5	124.6	175.3	-179.5	0	0	0	0	106.9	Y521	V515-Y521 HydrophobicContact CG2-CD1 3.57Å; V515-Y521 HydrophobicContact CG2-CE1 3.41Å; V515-Y521 VanDerWaalsContact CG2-CE1 3.41Å; V515-Y521 HydrophobicContact CG2-CG 4.44Å
516	T	57.6	Low	42.6	Very low	85 Å²	85	122.1 Å²	122.1	52%	0.521	70%	0.697	S	S	.	*	P	Polyproline II helix	trans	-77.2	160.6	172.5	54.5	0	0	0	0	110.1	M518 G519	T516-M518 PolarHBondContact O-N 3.43Å; T516-G519 PolarHBondContact O-N 3.04Å
517	E	52.9	Low	42.9	Very low	205 Å²	205	123.4 Å²	123.4	96%	0.958	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-5.1	-174.7	-75.5	-176.4	145.8	0	0	115.9
518	M	44	Very low	43	Very low	175 Å²	175	121.9 Å²	121.9	86%	0.862	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	14.3	173.3	-69.9	-67.6	-158.4	0	0	114.4	T516 T520	T516-M518 PolarHBondContact O-N 3.43Å; M518-T520 PolarHBondContact O-N 3.04Å
519	G	53.2	Low	43.2	Very low	51 Å²	51	122.4 Å²	122.4	53%	0.526	71%	0.708	S	S	.	*	S	Bend	trans	79.5	10.8	165.5	0	0	0	0	0	117	T516	T516-G519 PolarHBondContact O-N 3.04Å
520	T	47.9	Very low	42.8	Very low	101 Å²	101	124.7 Å²	124.7	62%	0.62	72%	0.716	S	S	*	*			trans	-100.6	128.4	177.3	-40.6	0	0	0	0	110.9	M518 A522	M518-T520 PolarHBondContact O-N 3.04Å; T520-A522 PolarHBondContact O-N 2.93Å
521	Y	50.9	Low	42.6	Very low	171 Å²	171	130.1 Å²	130.1	67%	0.671	72%	0.72	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.1	119	176.6	-63.2	-86.1	0	0	0	110.9	V515	V515-Y521 HydrophobicContact CG2-CD1 3.57Å; V515-Y521 HydrophobicContact CG2-CE1 3.41Å; V515-Y521 VanDerWaalsContact CG2-CE1 3.41Å; V515-Y521 HydrophobicContact CG2-CG 4.44Å
522	A	40.9	Very low	42.3	Very low	60 Å²	60	130.3 Å²	130.3	50%	0.496	72%	0.723	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.2	123.4	174.6	0	0	0	0	0	110.8	T520	T520-A522 PolarHBondContact O-N 2.93Å
523	T	44.1	Very low	41.7	Very low	102 Å²	102	128.1 Å²	128.1	63%	0.626	72%	0.722	S	S	*	*			trans	-97.6	116.3	168	46.1	0	0	0	0	108.8
524	Q	41.5	Very low	41.4	Very low	189 Å²	189	129.3 Å²	129.3	88%	0.883	73%	0.728	S	S	*	*			trans	-90.3	110.2	179.6	-146.2	178.3	30.3	0	0	110	A526	Q524-A526 PolarHBondContact O-N 3.5Å
525	S	43.2	Very low	40.6	Very low	117 Å²	117	132.1 Å²	132.1	82%	0.818	73%	0.734	S	S	*	*			trans	-83.6	102.6	164.6	-59.1	0	0	0	0	108.2	L527	S525-L527 PolarHBondContact O-N 3.35Å; S525-L527 VanDerWaalsContact O-N 3.15Å
526	A	34.8	Very low	40.4	Very low	87 Å²	87	137.6 Å²	137.6	72%	0.719	76%	0.755	S	S	*	*			trans	-83.8	86.6	-178.1	0	0	0	0	0	111.4	Q524	Q524-A526 PolarHBondContact O-N 3.5Å
527	L	37.3	Very low	39.9	Very low	180 Å²	180	139.9 Å²	139.9	94%	0.942	76%	0.76	S	S	*	*			trans	-97.9	79.7	158.4	-166.3	80.7	0	0	0	108	S525	S525-L527 PolarHBondContact O-N 3.35Å; S525-L527 VanDerWaalsContact O-N 3.15Å
528	S	31.6	Very low	39.9	Very low	97 Å²	97	138.7 Å²	138.7	68%	0.678	76%	0.76	S	S	*	*			trans	-139.5	108.5	168	48.5	0	0	0	0	109.7	S530	S528-S530 PolarHBondContact O-N 3.4Å
529	S	38.1	Very low	41.1	Very low	132 Å²	132	135.1 Å²	135.1	92%	0.923	74%	0.737	S	S	*	*			trans	-64.4	95.9	174.4	51.4	0	0	0	0	110.7
530	S	27.6	Very low	42.3	Very low	100 Å²	100	134.7 Å²	134.7	70%	0.699	73%	0.725	S	S	*	*			trans	-107.1	124.6	150.2	53.2	0	0	0	0	106.5	S528 P532	S528-S530 PolarHBondContact O-N 3.4Å; S530-P532 WeakPolarHBondContact O-CD 3.18Å; S530-P532 VanDerWaalsContact O-N 3.14Å
531	R	31.3	Very low	43.7	Very low	245 Å²	245	131.4 Å²	131.4	93%	0.925	71%	0.705	S	S	*	*			trans	-60.1	115.9	171.9	-82.1	-179.4	175.6	176.8	-1.9	106.8	T533	R531-T533 PolarHBondContact O-N 3.32Å
532	P	30.7	Very low	45.1	Very low	110 Å²	110	123.3 Å²	123.3	71%	0.714	67%	0.673	S	S	*	*			trans	-66	136.1	166.3	29.6	-29.7	0	0	0	106.5	S530 K534	S530-P532 WeakPolarHBondContact O-CD 3.18Å; S530-P532 VanDerWaalsContact O-N 3.14Å; P532-K534 PolarHBondContact O-N 3.46Å; P532-K534 VanDerWaalsContact O-N 3.08Å
533	T	30.3	Very low	47	Very low	136 Å²	136	120.6 Å²	120.6	83%	0.834	65%	0.65	S	S	*	*			trans	-48.5	118.4	158.6	33.9	0	0	0	0	106.9	R531 K535	R531-T533 PolarHBondContact O-N 3.32Å; T533-K535 PolarHBondContact O-N 2.93Å
534	K	35.1	Very low	48.8	Very low	169 Å²	169	116.4 Å²	116.4	74%	0.735	63%	0.628	S	S	*	*			trans	-52.3	104.7	-179.2	-77.9	-179.3	173.1	-177.9	0	107.8	P532 E536	P532-K534 PolarHBondContact O-N 3.46Å; P532-K534 VanDerWaalsContact O-N 3.08Å; K534-E536 PolarHBondContact O-N 3.29Å
535	K	35.3	Very low	50.7	Low	190 Å²	190	108.2 Å²	108.2	83%	0.826	59%	0.589	S	S	*	*			trans	-57.2	128.3	154.1	-76.3	-176.6	174	-177	0	105.1	T533 E537	T533-K535 PolarHBondContact O-N 2.93Å; K535-E537 PolarHBondContact O-N 2.91Å
536	E	40.6	Very low	52.6	Low	187 Å²	187	102.7 Å²	102.7	87%	0.874	55%	0.55	S	S	*	*			trans	-50	108.3	175.8	-74.7	175.7	149.9	0	0	108.6	K534	K534-E536 PolarHBondContact O-N 3.29Å
537	E	47.7	Very low	54.9	Low	134 Å²	134	99.1 Å²	99.1	63%	0.626	52%	0.519	S	S	*	.			trans	-65.4	140.6	175.7	-73.3	172.3	153.7	0	0	108.5	K535 R539	K535-E537 PolarHBondContact O-N 2.91Å; E537-R539 VanDerWaalsContact C-N 3.3Å; E537-R539 WeakPolarHBondContact O-CG 3.48Å; E537-R539 PolarHBondContact O-N 3.46Å; E537-R539 IonicContact OE2-NH2 3.44Å
538	D	52.7	Low	57	Low	179 Å²	179	93.6 Å²	93.6	96%	0.957	49%	0.49	S	S	*	.			trans	-61.6	84.7	-175.4	-147.4	4.8	0	0	0	110.6
539	R	69.3	Low	59.2	Low	100 Å²	100	89.4 Å²	89.4	38%	0.377	46%	0.463	S	S	.	.			trans	-99.2	140.5	-178.1	-72	166.7	-172.5	-161.5	-6.5	109	E537	E537-R539 VanDerWaalsContact C-N 3.3Å; E537-R539 WeakPolarHBondContact O-CG 3.48Å; E537-R539 PolarHBondContact O-N 3.46Å; E537-R539 IonicContact OE2-NH2 3.44Å
540	P	77.3	Confident	61.4	Low	42 Å²	42	86.3 Å²	86.3	27%	0.273	44%	0.436	S	S	.	.			trans	-52.5	141.1	170.4	-28.1	36.2	0	0	0	111.7	S482 L542 R543 G544	S482-P540 WeakPolarHBondContact O-CB 3.38Å; P540-L542 PolarHBondContact O-N 3.48Å; P540-R543 HydrophobicContact CB-CB 4.36Å; P540-R543 WeakPolarHBondContact O-CB 3.45Å; P540-R543 PolarHBondContact O-N 3.29Å; P540-R543 VanDerWaalsContact O-N 3.09Å; P540-G544 PolarHBondContact O-N 2.99Å
541	P	77.3	Confident	64.1	Low	33 Å²	33	81.7 Å²	81.7	21%	0.214	40%	0.403	C	S	.	.	H	α-helix	trans	-59.7	-46	-165.4	19.3	-31.3	0	0	0	113	R543 G544 F545	P541-R543 VanDerWaalsContact C-N 3.32Å; P541-R543 PolarHBondContact O-N 3.03Å; P541-G544 WeakPolarHBondContact O-CA 3.42Å; P541-G544 PolarHBondContact O-N 2.86Å; P541-G544 VanDerWaalsContact O-N 3.15Å; P541-F545 HydrophobicContact CB-CE2 4.09Å; P541-F545 HydrophobicContact CB-CZ 3.97Å; P541-F545 WeakPolarHBondContact O-CD1 3.3Å; P541-F545 VanDerWaalsContact O-CD2 3.27Å; P541-F545 WeakPolarHBondContact O-CD2 3.44Å; P541-F545 WeakPolarHBondContact O-CG 3.2Å; P541-F545 PolarHBondContact O-N 3.4Å
542	L	80.9	Confident	66.7	Low	0 Å²	0	75.6 Å²	75.6	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-66.3	-33.6	-180	-178.1	59.7	0	0	0	112.5	Y455 S482 L483 P540 L546 V553 L557	Y455-L542 HydrophobicContact CD1-CD1 4.41Å; Y455-L542 HydrophobicContact CE1-CB 4.29Å; Y455-L542 HydrophobicContact CE1-CD1 3.84Å; Y455-L542 HydrophobicContact CE1-CD2 4.24Å; Y455-L542 HydrophobicContact CE1-CG 4.35Å; S482-L542 WeakPolarHBondContact O-CB 3.44Å; L483-L542 HydrophobicContact CD1-CD2 4.35Å; L483-L542 HydrophobicContact CD2-CD2 3.57Å; L483-L542 HydrophobicContact CD2-CG 3.72Å; L483-L542 HydrophobicContact CG-CD2 3.61Å; L483-L542 HydrophobicContact CG-CG 4.24Å; P540-L542 PolarHBondContact O-N 3.48Å; L542-L546 VanDerWaalsContact O-CG 3.31Å; L542-L546 WeakPolarHBondContact O-CG 3.49Å; L542-L546 PolarHBondContact O-N 3.4Å; L542-V553 HydrophobicContact CD1-CG1 3.72Å; L542-L557 HydrophobicContact CD2-CD2 3.83Å
543	R	81.4	Confident	69.3	Low	4 Å²	4	70.4 Å²	70.4	2%	0.015	35%	0.35	C	S	.	.	H	α-helix	trans	-69.3	-37.9	173.7	-170.8	176.7	-179.4	132.6	-9.1	111.5	S482 L483 E485 S491 E492 P540 P541 L547	S482-R543 PolarHBondContact O-N 3.1Å; L483-R543 WeakPolarHBondContact O-CD 3.33Å; E485-R543 PolarHBondContact O-NH1 3.42Å; S491-R543 PolarHBondContact OG-NH1 3.5Å; S491-R543 PolarHBondContact OG-NH2 2.82Å; E492-R543 IonicContact OE1-CZ 2.65Å; E492-R543 IonicContact OE1-NE 3.66Å; E492-R543 PolarHBondContact OE1-NE 2.93Å; E492-R543 IonicContact OE1-NH2 3.26Å; E492-R543 PolarHBondContact OE1-NH2 3.2Å; P540-R543 HydrophobicContact CB-CB 4.36Å; P540-R543 WeakPolarHBondContact O-CB 3.45Å; P540-R543 PolarHBondContact O-N 3.29Å; P540-R543 VanDerWaalsContact O-N 3.09Å; P541-R543 VanDerWaalsContact C-N 3.32Å; P541-R543 PolarHBondContact O-N 3.03Å; R543-L547 HydrophobicContact CG-CD1 4.32Å; R543-L547 WeakPolarHBondContact O-CG 3.37Å; R543-L547 PolarHBondContact O-N 2.86Å
544	G	80.5	Confident	72	Confident	14 Å²	14	64 Å²	64	14%	0.144	31%	0.311	C	S	.	.	H	α-helix	trans	-56.6	-55.2	170.9	0	0	0	0	0	111.9	P540 P541 L546 L547 D548	P540-G544 PolarHBondContact O-N 2.99Å; P541-G544 WeakPolarHBondContact O-CA 3.42Å; P541-G544 PolarHBondContact O-N 2.86Å; P541-G544 VanDerWaalsContact O-N 3.15Å; G544-L546 VanDerWaalsContact C-N 3.31Å; G544-L546 PolarHBondContact O-N 3.02Å; G544-L547 PolarHBondContact O-N 3.48Å; G544-L547 VanDerWaalsContact O-N 3.08Å; G544-D548 PolarHBondContact O-N 3.07Å
545	F	82.6	Confident	74.5	Confident	17 Å²	17	56.2 Å²	56.2	8%	0.075	28%	0.278	C	S	.	.	H	α-helix	trans	-57.4	-40.6	-177.9	-53.5	-31.8	0	0	0	113.3	K450 V452 Y455 P541 D548 G549 D550	K450-F545 WeakPolarHBondContact O-CE1 3.43Å; K450-F545 WeakPolarHBondContact O-CZ 3.36Å; V452-F545 HydrophobicContact CG2-CB 4.36Å; V452-F545 HydrophobicContact CG2-CD1 3.55Å; V452-F545 HydrophobicContact CG2-CD2 4.41Å; V452-F545 HydrophobicContact CG2-CE1 3.91Å; V452-F545 HydrophobicContact CG2-CG 3.86Å; V452-F545 HydrophobicContact CG2-CZ 4.48Å; Y455-F545 HydrophobicContact CD2-CE2 4.08Å; Y455-F545 AromaticContact CG-CE2 3.99Å; Y455-F545 HydrophobicContact CG-CE2 3.99Å; P541-F545 HydrophobicContact CB-CE2 4.09Å; P541-F545 HydrophobicContact CB-CZ 3.97Å; P541-F545 WeakPolarHBondContact O-CD1 3.3Å; P541-F545 VanDerWaalsContact O-CD2 3.27Å; P541-F545 WeakPolarHBondContact O-CD2 3.44Å; P541-F545 WeakPolarHBondContact O-CG 3.2Å; P541-F545 PolarHBondContact O-N 3.4Å; F545-D548 PolarHBondContact O-N 2.96Å; F545-G549 PolarHBondContact O-N 3.21Å; F545-D550 PolarHBondContact O-N 3.25Å
546	L	83.4	Confident	77.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-69.4	-35.6	179	-66.6	173.6	0	0	0	112.6	L483 L542 G544 G549 F551 A554 I592 L595	L483-L546 HydrophobicContact CD2-CD1 3.97Å; L542-L546 VanDerWaalsContact O-CG 3.31Å; L542-L546 WeakPolarHBondContact O-CG 3.49Å; L542-L546 PolarHBondContact O-N 3.4Å; G544-L546 VanDerWaalsContact C-N 3.31Å; G544-L546 PolarHBondContact O-N 3.02Å; L546-G549 PolarHBondContact O-N 3.35Å; L546-F551 HydrophobicContact CD2-CD1 4.17Å; L546-F551 HydrophobicContact CD2-CE1 4.3Å; L546-A554 HydrophobicContact CD2-CB 3.6Å; L546-I592 HydrophobicContact CD1-CG1 4.24Å; L546-L595 HydrophobicContact CB-CD2 3.88Å; L546-L595 HydrophobicContact CD1-CD2 4.28Å
547	L	82.1	Confident	79.4	Confident	12 Å²	12	39.2 Å²	39.2	6%	0.063	20%	0.203	C	C	.	.	H	α-helix	trans	-74.1	-30.7	175.5	-70	172.8	0	0	0	112	R543 G544 G549 L595 P601 K602	R543-L547 HydrophobicContact CG-CD1 4.32Å; R543-L547 WeakPolarHBondContact O-CG 3.37Å; R543-L547 PolarHBondContact O-N 2.86Å; G544-L547 PolarHBondContact O-N 3.48Å; G544-L547 VanDerWaalsContact O-N 3.08Å; L547-G549 PolarHBondContact O-N 3.26Å; L547-L595 HydrophobicContact CD2-CD1 4.24Å; L547-P601 WeakPolarHBondContact O-CA 3.23Å; L547-K602 PolarHBondContact O-N 2.97Å
548	D	81.1	Confident	81.4	Confident	64 Å²	64	32.9 Å²	32.9	34%	0.342	17%	0.174	S	C	.	.	H	α-helix	trans	-72.4	-13.5	173.9	-70.5	-33.5	0	0	0	113.3	G544 F545 K602	G544-D548 PolarHBondContact O-N 3.07Å; F545-D548 PolarHBondContact O-N 2.96Å; D548-K602 WeakPolarHBondContact OD1-CE 3.2Å; D548-K602 IonicContact OD1-NZ 3.74Å; D548-K602 PolarHBondContact OD1-NZ 3.26Å
549	G	79	Confident	83.2	Confident	10 Å²	10	25.4 Å²	25.4	10%	0.103	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.7	12.9	171.8	0	0	0	0	0	114.9	F545 L546 L547 F551	F545-G549 PolarHBondContact O-N 3.21Å; L546-G549 PolarHBondContact O-N 3.35Å; L547-G549 PolarHBondContact O-N 3.26Å; G549-F551 VanDerWaalsContact C-N 3.34Å; G549-F551 WeakPolarHBondContact O-CD2 3.39Å; G549-F551 PolarHBondContact O-N 2.81Å; G549-F551 VanDerWaalsContact O-N 3.11Å
550	D	82.8	Confident	84.2	Confident	66 Å²	66	20.8 Å²	20.8	35%	0.353	12%	0.118	S	C	.	.			trans	-86	70.2	179.2	-70.4	-44.5	0	0	0	111.9	V452 F545 F552 V553	V452-D550 HydrophobicContact CG1-CB 4.01Å; F545-D550 PolarHBondContact O-N 3.25Å; D550-F552 PolarHBondContact O-N 2.78Å; D550-V553 PolarHBondContact O-N 2.65Å
551	F	84.4	Confident	84.8	Confident	4 Å²	4	18.9 Å²	18.9	2%	0.018	11%	0.105	C	C	.	.	H	α-helix	trans	-70.7	-12.8	-177.8	-73.2	-78.2	0	0	0	115.3	L546 G549 V553 A554 A555 G596 P601 K603 I605 D609	L546-F551 HydrophobicContact CD2-CD1 4.17Å; L546-F551 HydrophobicContact CD2-CE1 4.3Å; G549-F551 VanDerWaalsContact C-N 3.34Å; G549-F551 WeakPolarHBondContact O-CD2 3.39Å; G549-F551 PolarHBondContact O-N 2.81Å; G549-F551 VanDerWaalsContact O-N 3.11Å; F551-V553 PolarHBondContact O-N 3.08Å; F551-A554 HydrophobicContact CD1-CB 4.47Å; F551-A554 WeakPolarHBondContact O-CA 3.28Å; F551-A554 WeakPolarHBondContact O-CB 2.98Å; F551-A554 PolarHBondContact O-N 3.33Å; F551-A555 PolarHBondContact O-N 3.37Å; F551-A555 VanDerWaalsContact O-N 3.1Å; F551-G596 VanDerWaalsContact CE1-CA 3.46Å; F551-P601 HydrophobicContact CE2-CB 4.02Å; F551-P601 HydrophobicContact CE2-CG 4.3Å; F551-P601 HydrophobicContact CZ-CB 3.9Å; F551-P601 HydrophobicContact CZ-CG 3.72Å; F551-K603 VanDerWaalsContact CE2-O 3.28Å; F551-K603 WeakPolarHBondContact CE2-O 2.76Å; F551-I605 HydrophobicContact CB-CB 4.39Å; F551-I605 HydrophobicContact CB-CD1 4.28Å; F551-I605 HydrophobicContact CB-CG1 3.76Å; F551-I605 HydrophobicContact CD1-CB 3.99Å; F551-I605 HydrophobicContact CD1-CD1 3.75Å; F551-I605 HydrophobicContact CD1-CG1 3.81Å; F551-I605 HydrophobicContact CD2-CB 3.95Å; F551-I605 HydrophobicContact CD2-CG1 4.26Å; F551-I605 HydrophobicContact CE1-CB 4.31Å; F551-I605 HydrophobicContact CE1-CD1 4.42Å; F551-I605 HydrophobicContact CE2-CB 4.28Å; F551-I605 HydrophobicContact CG-CB 3.81Å; F551-I605 HydrophobicContact CG-CD1 4.11Å; F551-I605 HydrophobicContact CG-CG1 3.65Å; F551-I605 HydrophobicContact CZ-CB 4.46Å; F551-D609 HydrophobicContact CB-CB 4.35Å
552	F	85.7	Confident	85.5	Confident	117 Å²	117	17.3 Å²	17.3	51%	0.513	10%	0.095	S	C	.	.	H	α-helix	trans	-63.9	-30.3	174.8	-173.3	-131.2	0	0	0	112.9	D550 A554 A555 S556	D550-F552 PolarHBondContact O-N 2.78Å; F552-A554 VanDerWaalsContact C-N 3.28Å; F552-A554 PolarHBondContact O-N 3.01Å; F552-A555 PolarHBondContact O-N 2.93Å; F552-S556 PolarHBondContact O-N 3.03Å; F552-S556 VanDerWaalsContact O-N 3.13Å
553	V	86.6	Confident	85.9	Confident	1 Å²	1	17.6 Å²	17.6	1%	0.006	10%	0.096	C	C	.	.	H	α-helix	trans	-65.4	-36.1	171.1	178.5	0	0	0	0	110.8	V452 Y455 L459 L542 D550 F551 S556 L557	V452-V553 HydrophobicContact CB-CG2 4.4Å; V452-V553 HydrophobicContact CG1-CG2 3.25Å; Y455-V553 HydrophobicContact CD1-CG1 4Å; L459-V553 HydrophobicContact CD1-CG1 4.09Å; L542-V553 HydrophobicContact CD1-CG1 3.72Å; D550-V553 PolarHBondContact O-N 2.65Å; F551-V553 PolarHBondContact O-N 3.08Å; V553-S556 PolarHBondContact O-N 3.45Å; V553-L557 WeakPolarHBondContact O-CB 3.24Å; V553-L557 PolarHBondContact O-N 3.06Å
554	A	86.3	Confident	86.3	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.008	10%	0.096	C	C	.	.	H	α-helix	trans	-64.6	-40.3	175.5	0	0	0	0	0	112.4	L546 F551 F552 S556 L557 A558 I592 I613	L546-A554 HydrophobicContact CD2-CB 3.6Å; F551-A554 HydrophobicContact CD1-CB 4.47Å; F551-A554 WeakPolarHBondContact O-CA 3.28Å; F551-A554 WeakPolarHBondContact O-CB 2.98Å; F551-A554 PolarHBondContact O-N 3.33Å; F552-A554 VanDerWaalsContact C-N 3.28Å; F552-A554 PolarHBondContact O-N 3.01Å; A554-S556 VanDerWaalsContact C-N 3.35Å; A554-S556 PolarHBondContact O-N 3.12Å; A554-L557 PolarHBondContact O-N 3.1Å; A554-A558 WeakPolarHBondContact O-CB 3.46Å; A554-A558 PolarHBondContact O-N 2.88Å; A554-I592 HydrophobicContact CB-CG2 3.44Å; A554-I592 VanDerWaalsContact CB-CG2 3.44Å; A554-I613 HydrophobicContact CB-CD1 4.28Å
555	A	88.3	Confident	86.6	Confident	5 Å²	5	16.9 Å²	16.9	4%	0.041	9%	0.089	C	C	.	.	H	α-helix	trans	-63.2	-40	173.5	0	0	0	0	0	112.3	F551 F552 A558 T559 D609 R612	F551-A555 PolarHBondContact O-N 3.37Å; F551-A555 VanDerWaalsContact O-N 3.1Å; F552-A555 PolarHBondContact O-N 2.93Å; A555-A558 PolarHBondContact O-N 3.19Å; A555-T559 PolarHBondContact O-N 2.99Å; A555-T559 VanDerWaalsContact O-N 3.13Å; A555-T559 PolarHBondContact O-OG1 3.01Å; A555-D609 HydrophobicContact CB-CB 4.45Å; A555-D609 WeakPolarHBondContact CB-OD1 3.23Å; A555-R612 HydrophobicContact CB-CB 4.27Å; A555-R612 HydrophobicContact CB-CG 4.17Å
556	S	88.8	Confident	86.9	Confident	20 Å²	20	16.3 Å²	16.3	14%	0.14	9%	0.087	C	C	.	.	H	α-helix	trans	-65.6	-40.8	173.8	-170.8	0	0	0	0	112.2	F552 V553 A554 T559 T560	F552-S556 PolarHBondContact O-N 3.03Å; F552-S556 VanDerWaalsContact O-N 3.13Å; V553-S556 PolarHBondContact O-N 3.45Å; A554-S556 VanDerWaalsContact C-N 3.35Å; A554-S556 PolarHBondContact O-N 3.12Å; S556-T559 PolarHBondContact O-N 3.41Å; S556-T560 WeakPolarHBondContact O-CB 3.43Å; S556-T560 PolarHBondContact O-N 3.46Å; S556-T560 PolarHBondContact O-OG1 3.41Å
557	L	89.4	Confident	87	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-63.2	-44.2	175.7	-179.5	63.4	0	0	0	111.5	L459 I479 L542 V553 A554 T559 T560 L561 I592	L459-L557 HydrophobicContact CD1-CB 4.15Å; L459-L557 HydrophobicContact CD1-CD1 4.22Å; L459-L557 HydrophobicContact CD2-CD1 3.78Å; I479-L557 HydrophobicContact CD1-CD1 3.75Å; I479-L557 HydrophobicContact CG1-CD1 4.04Å; I479-L557 HydrophobicContact CG2-CD1 3.92Å; I479-L557 HydrophobicContact CG2-CD2 4.37Å; L542-L557 HydrophobicContact CD2-CD2 3.83Å; V553-L557 WeakPolarHBondContact O-CB 3.24Å; V553-L557 PolarHBondContact O-N 3.06Å; A554-L557 PolarHBondContact O-N 3.1Å; L557-T559 VanDerWaalsContact C-N 3.32Å; L557-T559 PolarHBondContact O-N 3.03Å; L557-T560 WeakPolarHBondContact O-CB 3.27Å; L557-T560 PolarHBondContact O-N 3.26Å; L557-T560 VanDerWaalsContact O-N 3.14Å; L557-L561 HydrophobicContact CD1-CD1 4.39Å; L557-L561 HydrophobicContact CD1-CG 4.23Å; L557-L561 HydrophobicContact CG-CD1 4.08Å; L557-L561 HydrophobicContact CG-CG 4.34Å; L557-L561 WeakPolarHBondContact O-CB 3.15Å; L557-L561 WeakPolarHBondContact O-CG 3.38Å; L557-L561 PolarHBondContact O-N 3.15Å; L557-I592 HydrophobicContact CD2-CD1 3.71Å
558	A	90.4	Very high	87.3	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.008	9%	0.09	C	C	.	.	H	α-helix	trans	-60	-42.5	176.3	0	0	0	0	0	112.1	A554 A555 T560 T562 M589 I613 C616	A554-A558 WeakPolarHBondContact O-CB 3.46Å; A554-A558 PolarHBondContact O-N 2.88Å; A555-A558 PolarHBondContact O-N 3.19Å; A558-T560 VanDerWaalsContact C-N 3.34Å; A558-T560 PolarHBondContact O-N 2.96Å; A558-T562 WeakPolarHBondContact O-CB 3.45Å; A558-T562 PolarHBondContact O-N 2.72Å; A558-T562 PolarHBondContact O-OG1 3.49Å; A558-M589 HydrophobicContact CB-CG 3.92Å; A558-M589 HydrophobicContact CB-SD 3.7Å; A558-I613 HydrophobicContact CB-CB 4.28Å; A558-I613 HydrophobicContact CB-CG1 3.87Å; A558-I613 HydrophobicContact CB-CG2 4.14Å; A558-C616 HydrophobicContact CB-CB 4.13Å
559	T	90.5	Very high	87.5	Confident	22 Å²	22	16.4 Å²	16.4	14%	0.135	9%	0.087	C	C	.	.	H	α-helix	trans	-61.9	-43.8	174.4	-55.6	0	0	0	0	110.8	A555 S556 L557 T562 K563 F631	A555-T559 PolarHBondContact O-N 2.99Å; A555-T559 VanDerWaalsContact O-N 3.13Å; A555-T559 PolarHBondContact O-OG1 3.01Å; S556-T559 PolarHBondContact O-N 3.41Å; L557-T559 VanDerWaalsContact C-N 3.32Å; L557-T559 PolarHBondContact O-N 3.03Å; T559-T562 PolarHBondContact O-N 3.36Å; T559-K563 WeakPolarHBondContact O-CG 3.36Å; T559-K563 PolarHBondContact O-N 3.49Å; T559-K563 VanDerWaalsContact O-N 3.07Å; T559-F631 HydrophobicContact CG2-CD1 4.39Å; T559-F631 HydrophobicContact CG2-CE1 3.92Å
560	T	90.3	Very high	87.8	Confident	4 Å²	4	19.8 Å²	19.8	3%	0.025	11%	0.114	C	C	.	.	H	α-helix	trans	-62.5	-50.6	179.1	-60.8	0	0	0	0	111.6	L459 S556 L557 A558 T562 K563 I564	L459-T560 HydrophobicContact CD2-CG2 4.45Å; L459-T560 WeakPolarHBondContact O-CG2 3.49Å; L459-T560 PolarHBondContact O-OG1 3.26Å; S556-T560 WeakPolarHBondContact O-CB 3.43Å; S556-T560 PolarHBondContact O-N 3.46Å; S556-T560 PolarHBondContact O-OG1 3.41Å; L557-T560 WeakPolarHBondContact O-CB 3.27Å; L557-T560 PolarHBondContact O-N 3.26Å; L557-T560 VanDerWaalsContact O-N 3.14Å; A558-T560 VanDerWaalsContact C-N 3.34Å; A558-T560 PolarHBondContact O-N 2.96Å; T560-T562 VanDerWaalsContact C-N 3.28Å; T560-T562 PolarHBondContact O-N 3.19Å; T560-K563 PolarHBondContact O-N 3.41Å; T560-I564 HydrophobicContact CG2-CD1 3.87Å; T560-I564 WeakPolarHBondContact O-CG1 3.21Å; T560-I564 PolarHBondContact O-N 3.45Å
561	L	90.2	Very high	87.9	Confident	2 Å²	2	21.1 Å²	21.1	1%	0.01	12%	0.121	C	C	.	.	H	α-helix	trans	-59.3	-39.7	176.8	-71.9	174.2	0	0	0	111.6	M476 I479 L557 I564 A565 A585 L588 M589	M476-L561 HydrophobicContact CE-CD2 4.45Å; M476-L561 HydrophobicContact SD-CD2 3.69Å; I479-L561 HydrophobicContact CD1-CD2 3.96Å; L557-L561 HydrophobicContact CD1-CD1 4.39Å; L557-L561 HydrophobicContact CD1-CG 4.23Å; L557-L561 HydrophobicContact CG-CD1 4.08Å; L557-L561 HydrophobicContact CG-CG 4.34Å; L557-L561 WeakPolarHBondContact O-CB 3.15Å; L557-L561 WeakPolarHBondContact O-CG 3.38Å; L557-L561 PolarHBondContact O-N 3.15Å; L561-I564 PolarHBondContact O-N 3.45Å; L561-A565 WeakPolarHBondContact O-CB 3.47Å; L561-A565 PolarHBondContact O-N 2.92Å; L561-A585 HydrophobicContact CB-CB 4.35Å; L561-L588 HydrophobicContact CD1-CB 4.03Å; L561-L588 HydrophobicContact CD1-CD1 4.02Å; L561-L588 HydrophobicContact CD2-CD1 4.23Å; L561-M589 HydrophobicContact CB-CE 4.1Å; L561-M589 HydrophobicContact CD1-CG 4.27Å
562	T	90.4	Very high	88	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.6	-47.1	177.7	-58.1	0	0	0	0	111.7	A558 T559 T560 A565 L566 C616 V619 L620 F631	A558-T562 WeakPolarHBondContact O-CB 3.45Å; A558-T562 PolarHBondContact O-N 2.72Å; A558-T562 PolarHBondContact O-OG1 3.49Å; T559-T562 PolarHBondContact O-N 3.36Å; T560-T562 VanDerWaalsContact C-N 3.28Å; T560-T562 PolarHBondContact O-N 3.19Å; T562-A565 PolarHBondContact O-N 2.95Å; T562-L566 HydrophobicContact CG2-CD1 3.99Å; T562-L566 HydrophobicContact CG2-CG 4.5Å; T562-L566 WeakPolarHBondContact O-CB 3.44Å; T562-L566 VanDerWaalsContact O-CG 3.25Å; T562-L566 WeakPolarHBondContact O-CG 3.45Å; T562-L566 PolarHBondContact O-N 3.49Å; T562-C616 VanDerWaalsContact OG1-CB 3.3Å; T562-C616 WeakPolarHBondContact OG1-CB 3.33Å; T562-V619 HydrophobicContact CG2-CB 4.32Å; T562-V619 HydrophobicContact CG2-CG1 3.82Å; T562-L620 HydrophobicContact CG2-CD2 4.07Å; T562-L620 HydrophobicContact CG2-CG 4.15Å; T562-F631 HydrophobicContact CG2-CD1 4.21Å; T562-F631 HydrophobicContact CG2-CE1 4.17Å
563	K	89.6	Confident	87.8	Confident	5 Å²	5	25.6 Å²	25.6	2%	0.022	15%	0.145	C	C	.	.	H	α-helix	trans	-59.1	-49.5	176.7	-70.1	179.9	177.6	-172.9	0	111.7	E464 T559 T560 L566 R567 F631	E464-K563 IonicContact OE2-NZ 3.83Å; E464-K563 PolarHBondContact OE2-NZ 2.8Å; T559-K563 WeakPolarHBondContact O-CG 3.36Å; T559-K563 PolarHBondContact O-N 3.49Å; T559-K563 VanDerWaalsContact O-N 3.07Å; T560-K563 PolarHBondContact O-N 3.41Å; K563-L566 PolarHBondContact O-N 2.98Å; K563-R567 WeakPolarHBondContact O-CG 3.21Å; K563-R567 PolarHBondContact O-N 2.95Å; K563-F631 WeakPolarHBondContact CE-O 3.23Å; K563-F631 HydrophobicContact CG-CB 4.23Å; K563-F631 HydrophobicContact CG-CD1 3.87Å
564	I	89.4	Confident	88	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.015	17%	0.167	C	C	.	.	H	α-helix	trans	-64.8	-42.8	-177.7	-68.2	175.3	0	0	0	110.9	I472 V475 T560 L561 R567 Y568 F581	I472-I564 HydrophobicContact CB-CG2 4.03Å; I472-I564 HydrophobicContact CG1-CG2 3.98Å; I472-I564 HydrophobicContact CG2-CG2 3.28Å; V475-I564 HydrophobicContact CB-CD1 4.3Å; V475-I564 HydrophobicContact CG1-CD1 3.61Å; T560-I564 HydrophobicContact CG2-CD1 3.87Å; T560-I564 WeakPolarHBondContact O-CG1 3.21Å; T560-I564 PolarHBondContact O-N 3.45Å; L561-I564 PolarHBondContact O-N 3.45Å; I564-R567 PolarHBondContact O-N 3.42Å; I564-Y568 WeakPolarHBondContact O-CB 3.3Å; I564-Y568 PolarHBondContact O-N 3.36Å; I564-F581 HydrophobicContact CG2-CE1 4Å; I564-F581 HydrophobicContact CG2-CZ 3.8Å
565	A	88.4	Confident	88	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-45.1	177.7	0	0	0	0	0	112.2	L561 T562 R567 Y568 V569 F581 V582 A585 L620	L561-A565 WeakPolarHBondContact O-CB 3.47Å; L561-A565 PolarHBondContact O-N 2.92Å; T562-A565 PolarHBondContact O-N 2.95Å; A565-R567 VanDerWaalsContact C-N 3.32Å; A565-R567 PolarHBondContact O-N 2.83Å; A565-Y568 PolarHBondContact O-N 3.26Å; A565-V569 VanDerWaalsContact O-CG2 3.29Å; A565-V569 WeakPolarHBondContact O-CG2 3.46Å; A565-V569 PolarHBondContact O-N 3.28Å; A565-F581 HydrophobicContact CB-CD1 4.1Å; A565-F581 HydrophobicContact CB-CE1 4.03Å; A565-V582 HydrophobicContact CB-CG2 4.41Å; A565-A585 HydrophobicContact CB-CB 4.45Å; A565-L620 HydrophobicContact CB-CD2 3.77Å
566	L	87.3	Confident	88	Confident	6 Å²	6	46.3 Å²	46.3	3%	0.031	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-39.1	176.3	-69.7	172.1	0	0	0	112	T562 K563 A570 V619 L620 F631	T562-L566 HydrophobicContact CG2-CD1 3.99Å; T562-L566 HydrophobicContact CG2-CG 4.5Å; T562-L566 WeakPolarHBondContact O-CB 3.44Å; T562-L566 VanDerWaalsContact O-CG 3.25Å; T562-L566 WeakPolarHBondContact O-CG 3.45Å; T562-L566 PolarHBondContact O-N 3.49Å; K563-L566 PolarHBondContact O-N 2.98Å; L566-A570 PolarHBondContact O-N 2.81Å; L566-A570 VanDerWaalsContact O-N 3.16Å; L566-V619 HydrophobicContact CD1-CG1 4.17Å; L566-L620 HydrophobicContact CD2-CD2 4.38Å; L566-L620 HydrophobicContact CG-CD2 4.26Å; L566-F631 HydrophobicContact CD1-CB 4.3Å
567	R	86.8	Confident	87.9	Confident	21 Å²	21	50 Å²	50	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-68.6	-41.3	174.5	-70.5	178	-162.2	162	3.8	112.7	G463 E464 C466 I472 K563 I564 A565 V569 A570 L571 N632	G463-R567 PolarHBondContact O-NH1 2.79Å; G463-R567 PolarHBondContact O-NH2 3.4Å; E464-R567 VanDerWaalsContact O-CZ 3.29Å; E464-R567 PolarHBondContact O-NH1 2.99Å; E464-R567 PolarHBondContact O-NH2 2.91Å; E464-R567 IonicContact OE1-NH2 3.07Å; E464-R567 PolarHBondContact OE1-NH2 3.01Å; E464-R567 IonicContact OE2-NH2 3.56Å; C466-R567 PolarHBondContact O-NH1 3.14Å; I472-R567 HydrophobicContact CD1-CB 4.28Å; K563-R567 WeakPolarHBondContact O-CG 3.21Å; K563-R567 PolarHBondContact O-N 2.95Å; I564-R567 PolarHBondContact O-N 3.42Å; A565-R567 VanDerWaalsContact C-N 3.32Å; A565-R567 PolarHBondContact O-N 2.83Å; R567-V569 VanDerWaalsContact C-N 3.27Å; R567-V569 PolarHBondContact O-N 2.99Å; R567-A570 WeakPolarHBondContact O-CB 3.31Å; R567-A570 PolarHBondContact O-N 2.92Å; R567-L571 WeakPolarHBondContact O-CG 3.09Å; R567-L571 PolarHBondContact O-N 2.67Å; R567-N632 WeakPolarHBondContact CG-OD1 3.38Å; R567-N632 PolarHBondContact NE-OD1 2.9Å
568	Y	86.9	Confident	87.7	Confident	10 Å²	10	51.5 Å²	51.5	4%	0.039	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-40.2	177.3	-171.1	-101.1	0	0	0	111.3	I472 Q473 I564 A565 A570 L571 V572 F581	I472-Y568 HydrophobicContact CG2-CD2 3.72Å; I472-Y568 HydrophobicContact CG2-CG 4.3Å; Q473-Y568 HydrophobicContact CG-CE2 4.25Å; Q473-Y568 PolarHBondContact NE2-OH 3.38Å; I564-Y568 WeakPolarHBondContact O-CB 3.3Å; I564-Y568 PolarHBondContact O-N 3.36Å; A565-Y568 PolarHBondContact O-N 3.26Å; Y568-A570 VanDerWaalsContact C-N 3.32Å; Y568-A570 PolarHBondContact O-N 2.9Å; Y568-L571 PolarHBondContact O-N 2.89Å; Y568-V572 HydrophobicContact CD1-CG2 4.3Å; Y568-V572 HydrophobicContact CD2-CG2 3.95Å; Y568-V572 HydrophobicContact CE1-CB 4.33Å; Y568-V572 HydrophobicContact CE1-CG2 3.97Å; Y568-V572 HydrophobicContact CE2-CG2 3.58Å; Y568-V572 HydrophobicContact CG-CG2 4.31Å; Y568-V572 WeakPolarHBondContact O-CB 3.28Å; Y568-V572 PolarHBondContact O-N 2.84Å; Y568-F581 HydrophobicContact CD1-CB 3.66Å; Y568-F581 AromaticContact CD1-CD1 3.92Å; Y568-F581 HydrophobicContact CD1-CD1 3.92Å; Y568-F581 HydrophobicContact CD1-CD2 4.25Å; Y568-F581 AromaticContact CD1-CG 3.67Å; Y568-F581 HydrophobicContact CD1-CG 3.67Å; Y568-F581 HydrophobicContact CE1-CB 3.64Å; Y568-F581 HydrophobicContact CE1-CD2 4.24Å; Y568-F581 AromaticContact CE1-CG 3.93Å; Y568-F581 HydrophobicContact CE1-CG 3.93Å; Y568-F581 HydrophobicContact CG-CD1 4.07Å; Y568-F581 HydrophobicContact CG-CD2 4.43Å; Y568-F581 HydrophobicContact CG-CE1 4.42Å; Y568-F581 HydrophobicContact CG-CG 4.08Å
569	V	86.4	Confident	87.6	Confident	46 Å²	46	56.6 Å²	56.6	28%	0.279	28%	0.283	S	S	.	.	H	α-helix	trans	-62.1	-38.7	173.2	173.6	0	0	0	0	111.7	A565 R567 Q578 V582	A565-V569 VanDerWaalsContact O-CG2 3.29Å; A565-V569 WeakPolarHBondContact O-CG2 3.46Å; A565-V569 PolarHBondContact O-N 3.28Å; R567-V569 VanDerWaalsContact C-N 3.27Å; R567-V569 PolarHBondContact O-N 2.99Å; V569-Q578 HydrophobicContact CG2-CB 4.26Å; V569-Q578 HydrophobicContact CG2-CG 4.46Å; V569-Q578 PolarHBondContact O-NE2 2.76Å; V569-V582 HydrophobicContact CG2-CG2 3.76Å
570	A	84.8	Confident	87.6	Confident	82 Å²	82	59 Å²	59	68%	0.678	30%	0.301	S	S	*	.	H	α-helix	trans	-70.5	-31.6	176.8	0	0	0	0	0	113.6	L566 R567 Y568	L566-A570 PolarHBondContact O-N 2.81Å; L566-A570 VanDerWaalsContact O-N 3.16Å; R567-A570 WeakPolarHBondContact O-CB 3.31Å; R567-A570 PolarHBondContact O-N 2.92Å; Y568-A570 VanDerWaalsContact C-N 3.32Å; Y568-A570 PolarHBondContact O-N 2.9Å
571	L	85.4	Confident	87.5	Confident	93 Å²	93	59.4 Å²	59.4	49%	0.487	30%	0.302	S	S	.	.	H	α-helix	trans	-87.9	-38.1	-175.6	-69.5	169.7	0	0	0	113.8	S467 I472 R567 Y568	S467-L571 VanDerWaalsContact O-CD1 3.29Å; S467-L571 WeakPolarHBondContact O-CD1 3.45Å; I472-L571 HydrophobicContact CD1-CD1 3.92Å; R567-L571 WeakPolarHBondContact O-CG 3.09Å; R567-L571 PolarHBondContact O-N 2.67Å; Y568-L571 PolarHBondContact O-N 2.89Å
572	V	87.2	Confident	87.4	Confident	24 Å²	24	60.2 Å²	60.2	15%	0.145	31%	0.307	C	S	.	.			trans	-94.7	128.8	-174.3	176.6	0	0	0	0	110	Y568 E574 K577 Q578	Y568-V572 HydrophobicContact CD1-CG2 4.3Å; Y568-V572 HydrophobicContact CD2-CG2 3.95Å; Y568-V572 HydrophobicContact CE1-CB 4.33Å; Y568-V572 HydrophobicContact CE1-CG2 3.97Å; Y568-V572 HydrophobicContact CE2-CG2 3.58Å; Y568-V572 HydrophobicContact CG-CG2 4.31Å; Y568-V572 WeakPolarHBondContact O-CB 3.28Å; Y568-V572 PolarHBondContact O-N 2.84Å; V572-E574 HydrophobicContact CG1-CB 4.15Å; V572-K577 HydrophobicContact CG1-CB 4.24Å; V572-Q578 HydrophobicContact CB-CG 4.49Å; V572-Q578 PolarHBondContact O-NE2 2.85Å
573	Q	81.4	Confident	87.3	Confident	191 Å²	191	63 Å²	63	89%	0.893	33%	0.33	S	S	*	.			trans	-83.4	-20.1	179.4	-63.5	-175.5	-2.2	0	0	113.7	K575	Q573-K575 PolarHBondContact O-N 2.82Å
574	E	89.9	Confident	87.3	Confident	103 Å²	103	64.8 Å²	64.8	48%	0.481	34%	0.339	S	S	.	.			trans	-78.7	107.8	-178.1	-75.1	-179.2	-142	0	0	113	V572 K576 K577 Q578	V572-E574 HydrophobicContact CG1-CB 4.15Å; E574-K576 VanDerWaalsContact C-N 3.27Å; E574-K576 PolarHBondContact O-N 2.82Å; E574-K576 VanDerWaalsContact O-N 3.16Å; E574-K577 HydrophobicContact CB-CB 4.33Å; E574-K577 HydrophobicContact CB-CD 4.36Å; E574-K577 HydrophobicContact CB-CG 4.42Å; E574-K577 PolarHBondContact O-N 2.75Å; E574-K577 VanDerWaalsContact O-N 3.13Å; E574-K577 IonicContact OE1-NZ 3.87Å; E574-K577 PolarHBondContact OE1-NZ 3.22Å; E574-K577 WeakPolarHBondContact OE2-CD 3.34Å; E574-K577 WeakPolarHBondContact OE2-CE 3.11Å; E574-K577 IonicContact OE2-NZ 3.84Å; E574-K577 PolarHBondContact OE2-NZ 3.03Å; E574-Q578 WeakPolarHBondContact O-CG 3.15Å; E574-Q578 PolarHBondContact O-N 3.07Å; E574-Q578 VanDerWaalsContact O-N 3.08Å
575	K	85.3	Confident	87.3	Confident	160 Å²	160	64.7 Å²	64.7	70%	0.696	34%	0.338	S	S	*	.	H	α-helix	trans	-54	-35.4	178.6	-73.1	-174.6	176.7	-179.6	0	115.1	Q573 Q578 N579	Q573-K575 PolarHBondContact O-N 2.82Å; K575-Q578 PolarHBondContact O-N 2.78Å; K575-N579 WeakPolarHBondContact O-CB 3.44Å; K575-N579 VanDerWaalsContact O-CG 3.25Å; K575-N579 PolarHBondContact O-N 2.78Å
576	K	89.1	Confident	87.4	Confident	180 Å²	180	67.4 Å²	67.4	78%	0.783	35%	0.351	S	S	*	.	H	α-helix	trans	-65	-43.1	-179.9	-171.5	178.4	179.2	-178	0	111.5	E574 S580	E574-K576 VanDerWaalsContact C-N 3.27Å; E574-K576 PolarHBondContact O-N 2.82Å; E574-K576 VanDerWaalsContact O-N 3.16Å; K576-S580 WeakPolarHBondContact O-CB 3.42Å; K576-S580 PolarHBondContact O-N 2.81Å
577	K	86.4	Confident	87.6	Confident	98 Å²	98	71.8 Å²	71.8	43%	0.426	37%	0.374	S	S	.	.	H	α-helix	trans	-70.8	-38.6	177.6	-71.1	-179.8	-177.9	147.4	0	111.5	V572 E574 S580 F581	V572-K577 HydrophobicContact CG1-CB 4.24Å; E574-K577 HydrophobicContact CB-CB 4.33Å; E574-K577 HydrophobicContact CB-CD 4.36Å; E574-K577 HydrophobicContact CB-CG 4.42Å; E574-K577 PolarHBondContact O-N 2.75Å; E574-K577 VanDerWaalsContact O-N 3.13Å; E574-K577 IonicContact OE1-NZ 3.87Å; E574-K577 PolarHBondContact OE1-NZ 3.22Å; E574-K577 WeakPolarHBondContact OE2-CD 3.34Å; E574-K577 WeakPolarHBondContact OE2-CE 3.11Å; E574-K577 IonicContact OE2-NZ 3.84Å; E574-K577 PolarHBondContact OE2-NZ 3.03Å; K577-S580 PolarHBondContact O-N 3.14Å; K577-F581 WeakPolarHBondContact O-CB 3.37Å; K577-F581 PolarHBondContact O-N 2.88Å
578	Q	86	Confident	87.6	Confident	30 Å²	30	71 Å²	71	14%	0.14	37%	0.372	C	S	.	.	H	α-helix	trans	-56.4	-55.3	172.9	-67.6	177	-17.8	0	0	111.1	V569 V572 E574 K575 S580 F581 V582	V569-Q578 HydrophobicContact CG2-CB 4.26Å; V569-Q578 HydrophobicContact CG2-CG 4.46Å; V569-Q578 PolarHBondContact O-NE2 2.76Å; V572-Q578 HydrophobicContact CB-CG 4.49Å; V572-Q578 PolarHBondContact O-NE2 2.85Å; E574-Q578 WeakPolarHBondContact O-CG 3.15Å; E574-Q578 PolarHBondContact O-N 3.07Å; E574-Q578 VanDerWaalsContact O-N 3.08Å; K575-Q578 PolarHBondContact O-N 2.78Å; Q578-S580 VanDerWaalsContact C-N 3.32Å; Q578-S580 PolarHBondContact O-N 3.22Å; Q578-F581 PolarHBondContact O-N 3.26Å; Q578-V582 WeakPolarHBondContact O-CG2 3.44Å; Q578-V582 PolarHBondContact O-N 2.79Å
579	N	88.2	Confident	87.7	Confident	108 Å²	108	70.5 Å²	70.5	58%	0.578	37%	0.37	S	S	*	.	H	α-helix	trans	-63.8	-38.2	-177.6	-69	-5.3	0	0	0	112.1	K575 A583	K575-N579 WeakPolarHBondContact O-CB 3.44Å; K575-N579 VanDerWaalsContact O-CG 3.25Å; K575-N579 PolarHBondContact O-N 2.78Å; N579-A583 WeakPolarHBondContact O-CB 3.41Å; N579-A583 PolarHBondContact O-N 2.95Å
580	S	89.6	Confident	87.8	Confident	74 Å²	74	70.6 Å²	70.6	52%	0.517	38%	0.376	S	S	.	.	H	α-helix	trans	-59.6	-47.4	175.1	-170.3	0	0	0	0	111.4	K576 K577 Q578 A583 E584	K576-S580 WeakPolarHBondContact O-CB 3.42Å; K576-S580 PolarHBondContact O-N 2.81Å; K577-S580 PolarHBondContact O-N 3.14Å; Q578-S580 VanDerWaalsContact C-N 3.32Å; Q578-S580 PolarHBondContact O-N 3.22Å; S580-A583 PolarHBondContact O-N 2.91Å; S580-E584 VanDerWaalsContact O-CB 3.31Å; S580-E584 WeakPolarHBondContact O-CB 2.69Å; S580-E584 PolarHBondContact O-N 3.41Å
581	F	88.5	Confident	87.9	Confident	12 Å²	12	67.3 Å²	67.3	5%	0.053	35%	0.347	C	S	.	.	H	α-helix	trans	-67.1	-42.5	-178.6	-168.6	-88.8	0	0	0	112.2	I472 M476 I564 A565 Y568 K577 Q578 E584 A585	I472-F581 HydrophobicContact CG2-CE1 4.35Å; I472-F581 HydrophobicContact CG2-CE2 4.06Å; I472-F581 HydrophobicContact CG2-CZ 3.66Å; M476-F581 HydrophobicContact CB-CE2 3.92Å; M476-F581 HydrophobicContact CB-CZ 4.2Å; M476-F581 HydrophobicContact CG-CE2 3.9Å; M476-F581 HydrophobicContact CG-CZ 4.24Å; M476-F581 HydrophobicContact SD-CE2 4.48Å; M476-F581 HydrophobicContact SD-CZ 4.29Å; I564-F581 HydrophobicContact CG2-CE1 4Å; I564-F581 HydrophobicContact CG2-CZ 3.8Å; A565-F581 HydrophobicContact CB-CD1 4.1Å; A565-F581 HydrophobicContact CB-CE1 4.03Å; Y568-F581 HydrophobicContact CD1-CB 3.66Å; Y568-F581 AromaticContact CD1-CD1 3.92Å; Y568-F581 HydrophobicContact CD1-CD1 3.92Å; Y568-F581 HydrophobicContact CD1-CD2 4.25Å; Y568-F581 AromaticContact CD1-CG 3.67Å; Y568-F581 HydrophobicContact CD1-CG 3.67Å; Y568-F581 HydrophobicContact CE1-CB 3.64Å; Y568-F581 HydrophobicContact CE1-CD2 4.24Å; Y568-F581 AromaticContact CE1-CG 3.93Å; Y568-F581 HydrophobicContact CE1-CG 3.93Å; Y568-F581 HydrophobicContact CG-CD1 4.07Å; Y568-F581 HydrophobicContact CG-CD2 4.43Å; Y568-F581 HydrophobicContact CG-CE1 4.42Å; Y568-F581 HydrophobicContact CG-CG 4.08Å; K577-F581 WeakPolarHBondContact O-CB 3.37Å; K577-F581 PolarHBondContact O-N 2.88Å; Q578-F581 PolarHBondContact O-N 3.26Å; F581-E584 WeakPolarHBondContact O-CB 3.32Å; F581-E584 PolarHBondContact O-N 3.11Å; F581-A585 PolarHBondContact O-N 2.9Å
582	V	88.7	Confident	88	Confident	18 Å²	18	63 Å²	63	11%	0.109	32%	0.324	C	S	.	.	H	α-helix	trans	-64.9	-45.2	176.8	175	0	0	0	0	110.9	A565 V569 Q578 E584 A585 M586 L620	A565-V582 HydrophobicContact CB-CG2 4.41Å; V569-V582 HydrophobicContact CG2-CG2 3.76Å; Q578-V582 WeakPolarHBondContact O-CG2 3.44Å; Q578-V582 PolarHBondContact O-N 2.79Å; V582-E584 VanDerWaalsContact C-N 3.26Å; V582-E584 PolarHBondContact O-N 3.14Å; V582-A585 PolarHBondContact O-N 2.8Å; V582-M586 HydrophobicContact CG1-CG 4.39Å; V582-M586 HydrophobicContact CG1-SD 4.05Å; V582-M586 VanDerWaalsContact O-CG 3.31Å; V582-M586 WeakPolarHBondContact O-CG 3.46Å; V582-M586 PolarHBondContact O-N 3.07Å; V582-L620 HydrophobicContact CG1-CB 4.27Å
583	A	89.2	Confident	87.9	Confident	58 Å²	58	62.9 Å²	62.9	48%	0.479	32%	0.323	S	S	.	.	H	α-helix	trans	-60.6	-38.9	177.5	0	0	0	0	0	111.7	N579 S580 M586 L587	N579-A583 WeakPolarHBondContact O-CB 3.41Å; N579-A583 PolarHBondContact O-N 2.95Å; S580-A583 PolarHBondContact O-N 2.91Å; A583-M586 PolarHBondContact O-N 2.91Å; A583-L587 WeakPolarHBondContact O-CB 3.23Å; A583-L587 PolarHBondContact O-N 3.2Å
584	E	88.8	Confident	88.1	Confident	44 Å²	44	59 Å²	59	21%	0.206	31%	0.305	C	S	.	.	H	α-helix	trans	-64.7	-46.1	176	-166	-173	151.1	0	0	112.1	M476 R480 S580 F581 V582 M586 L587 L588	M476-E584 HydrophobicContact CE-CB 3.91Å; M476-E584 VanDerWaalsContact CE-CD 3.45Å; M476-E584 HydrophobicContact CE-CG 3.42Å; M476-E584 VanDerWaalsContact CE-CG 3.42Å; M476-E584 VanDerWaalsContact CE-OE1 3.23Å; M476-E584 WeakPolarHBondContact CE-OE1 3.48Å; M476-E584 WeakPolarHBondContact CG-OE1 3.44Å; R480-E584 IonicContact CZ-OE1 3.79Å; R480-E584 IonicContact NH1-OE1 3.22Å; R480-E584 PolarHBondContact NH1-OE1 3.28Å; R480-E584 IonicContact NH2-OE1 3.93Å; R480-E584 PolarHBondContact NH2-OE1 3.46Å; S580-E584 VanDerWaalsContact O-CB 3.31Å; S580-E584 WeakPolarHBondContact O-CB 2.69Å; S580-E584 PolarHBondContact O-N 3.41Å; F581-E584 WeakPolarHBondContact O-CB 3.32Å; F581-E584 PolarHBondContact O-N 3.11Å; V582-E584 VanDerWaalsContact C-N 3.26Å; V582-E584 PolarHBondContact O-N 3.14Å; E584-M586 VanDerWaalsContact C-N 3.34Å; E584-M586 PolarHBondContact O-N 3.17Å; E584-L587 WeakPolarHBondContact O-CB 3.5Å; E584-L587 PolarHBondContact O-N 3.06Å; E584-L588 WeakPolarHBondContact O-CG 3.46Å; E584-L588 PolarHBondContact O-N 3.02Å
585	A	89.8	Confident	87.8	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61	-41.8	174.8	0	0	0	0	0	112.3	L561 A565 F581 V582 L588 M589 L620	L561-A585 HydrophobicContact CB-CB 4.35Å; A565-A585 HydrophobicContact CB-CB 4.45Å; F581-A585 PolarHBondContact O-N 2.9Å; V582-A585 PolarHBondContact O-N 2.8Å; A585-L588 PolarHBondContact O-N 3.35Å; A585-M589 HydrophobicContact CB-CE 4.22Å; A585-M589 VanDerWaalsContact O-CE 3.25Å; A585-M589 WeakPolarHBondContact O-CE 3.31Å; A585-M589 PolarHBondContact O-N 3.16Å; A585-L620 HydrophobicContact CB-CD1 4.34Å
586	M	90.5	Very high	87.6	Confident	57 Å²	57	46.7 Å²	46.7	28%	0.281	25%	0.25	S	C	.	.	H	α-helix	trans	-64.8	-38.8	175.5	-69.1	179.8	81.4	0	0	111.9	V582 A583 E584 M589 A590 L617 L620	V582-M586 HydrophobicContact CG1-CG 4.39Å; V582-M586 HydrophobicContact CG1-SD 4.05Å; V582-M586 VanDerWaalsContact O-CG 3.31Å; V582-M586 WeakPolarHBondContact O-CG 3.46Å; V582-M586 PolarHBondContact O-N 3.07Å; A583-M586 PolarHBondContact O-N 2.91Å; E584-M586 VanDerWaalsContact C-N 3.34Å; E584-M586 PolarHBondContact O-N 3.17Å; M586-M589 PolarHBondContact O-N 2.9Å; M586-A590 WeakPolarHBondContact O-CB 3.3Å; M586-A590 PolarHBondContact O-N 3.42Å; M586-L617 HydrophobicContact CB-CD2 4Å; M586-L617 HydrophobicContact CE-CD2 4.33Å; M586-L617 HydrophobicContact CG-CD2 4.07Å; M586-L620 HydrophobicContact CG-CB 4.22Å; M586-L620 HydrophobicContact CG-CD1 4.01Å; M586-L620 HydrophobicContact SD-CB 4.35Å
587	L	90	Very high	87.3	Confident	98 Å²	98	45.4 Å²	45.4	51%	0.513	24%	0.244	S	C	.	.	H	α-helix	trans	-62.8	-42.6	176.4	-179.3	65.1	0	0	0	111.7	A583 E584 A590 T591	A583-L587 WeakPolarHBondContact O-CB 3.23Å; A583-L587 PolarHBondContact O-N 3.2Å; E584-L587 WeakPolarHBondContact O-CB 3.5Å; E584-L587 PolarHBondContact O-N 3.06Å; L587-A590 PolarHBondContact O-N 2.98Å; L587-T591 WeakPolarHBondContact O-CB 3.41Å; L587-T591 PolarHBondContact O-N 3.22Å; L587-T591 PolarHBondContact O-OG1 3.18Å
588	L	87.5	Confident	87.1	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-59.6	-49	175.3	-67.8	-177.7	0	0	0	111.4	M476 I479 L483 I486 L561 E584 A585 A590 T591 I592	M476-L588 HydrophobicContact CE-CD1 3.46Å; M476-L588 VanDerWaalsContact CE-CD1 3.46Å; M476-L588 HydrophobicContact CE-CG 4.28Å; M476-L588 HydrophobicContact SD-CD1 4.07Å; I479-L588 HydrophobicContact CG2-CD1 4.13Å; L483-L588 HydrophobicContact CD1-CD1 4.49Å; L483-L588 HydrophobicContact CD1-CD2 3.82Å; I486-L588 HydrophobicContact CD1-CD2 3.25Å; I486-L588 HydrophobicContact CG1-CD2 4.27Å; L561-L588 HydrophobicContact CD1-CB 4.03Å; L561-L588 HydrophobicContact CD1-CD1 4.02Å; L561-L588 HydrophobicContact CD2-CD1 4.23Å; E584-L588 WeakPolarHBondContact O-CG 3.46Å; E584-L588 PolarHBondContact O-N 3.02Å; A585-L588 PolarHBondContact O-N 3.35Å; L588-A590 PolarHBondContact O-N 3.39Å; L588-T591 PolarHBondContact O-N 2.89Å; L588-I592 VanDerWaalsContact O-CG1 3.32Å; L588-I592 WeakPolarHBondContact O-CG1 3.49Å; L588-I592 PolarHBondContact O-N 3.15Å
589	M	89.8	Confident	86.5	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-62.3	-42.8	178.7	-76.7	-178.1	-96.5	0	0	112.7	A558 L561 A585 M586 T591 I592 L593 I613 C616 L617 L620	A558-M589 HydrophobicContact CB-CG 3.92Å; A558-M589 HydrophobicContact CB-SD 3.7Å; L561-M589 HydrophobicContact CB-CE 4.1Å; L561-M589 HydrophobicContact CD1-CG 4.27Å; A585-M589 HydrophobicContact CB-CE 4.22Å; A585-M589 VanDerWaalsContact O-CE 3.25Å; A585-M589 WeakPolarHBondContact O-CE 3.31Å; A585-M589 PolarHBondContact O-N 3.16Å; M586-M589 PolarHBondContact O-N 2.9Å; M589-T591 VanDerWaalsContact C-N 3.35Å; M589-T591 PolarHBondContact O-N 2.96Å; M589-I592 PolarHBondContact O-N 3.41Å; M589-L593 PolarHBondContact O-N 3.21Å; M589-I613 HydrophobicContact CB-CG2 3.93Å; M589-I613 HydrophobicContact CG-CG2 4.19Å; M589-C616 HydrophobicContact SD-CB 3.84Å; M589-L617 HydrophobicContact CB-CD1 4.47Å; M589-L617 HydrophobicContact CB-CD2 3.73Å; M589-L617 HydrophobicContact CB-CG 4.09Å; M589-L617 HydrophobicContact SD-CD2 4.25Å; M589-L617 HydrophobicContact SD-CG 4.35Å; M589-L620 HydrophobicContact CE-CD1 3.33Å
590	A	88.9	Confident	85.9	Confident	48 Å²	48	43.6 Å²	43.6	40%	0.397	25%	0.252	S	S	.	.	H	α-helix	trans	-64.5	-39.1	176.7	0	0	0	0	0	112.1	M586 L587 L588 L593 H594	M586-A590 WeakPolarHBondContact O-CB 3.3Å; M586-A590 PolarHBondContact O-N 3.42Å; L587-A590 PolarHBondContact O-N 2.98Å; L588-A590 PolarHBondContact O-N 3.39Å; A590-L593 PolarHBondContact O-N 2.82Å; A590-H594 WeakPolarHBondContact O-CB 3.39Å; A590-H594 PolarHBondContact O-N 3.21Å
591	T	86.7	Confident	85.4	Confident	12 Å²	12	40.9 Å²	40.9	7%	0.074	23%	0.232	C	C	.	.	H	α-helix	trans	-66.1	-39.9	177.9	-54.1	0	0	0	0	111.5	I486 P487 I488 L587 L588 M589 H594 L595	I486-T591 HydrophobicContact CG2-CG2 4.19Å; P487-T591 HydrophobicContact CB-CG2 4.49Å; I488-T591 HydrophobicContact CB-CG2 3.97Å; I488-T591 HydrophobicContact CD1-CG2 3.89Å; I488-T591 HydrophobicContact CG1-CG2 3.7Å; L587-T591 WeakPolarHBondContact O-CB 3.41Å; L587-T591 PolarHBondContact O-N 3.22Å; L587-T591 PolarHBondContact O-OG1 3.18Å; L588-T591 PolarHBondContact O-N 2.89Å; M589-T591 VanDerWaalsContact C-N 3.35Å; M589-T591 PolarHBondContact O-N 2.96Å; T591-H594 PolarHBondContact O-N 3.36Å; T591-L595 WeakPolarHBondContact O-CB 3.2Å; T591-L595 PolarHBondContact O-N 2.96Å
592	I	86.6	Confident	85	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.015	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-42.6	175.9	-70.3	168	0	0	0	111	L546 A554 L557 L588 M589 H594 L595 G596 I613	L546-I592 HydrophobicContact CD1-CG1 4.24Å; A554-I592 HydrophobicContact CB-CG2 3.44Å; A554-I592 VanDerWaalsContact CB-CG2 3.44Å; L557-I592 HydrophobicContact CD2-CD1 3.71Å; L588-I592 VanDerWaalsContact O-CG1 3.32Å; L588-I592 WeakPolarHBondContact O-CG1 3.49Å; L588-I592 PolarHBondContact O-N 3.15Å; M589-I592 PolarHBondContact O-N 3.41Å; I592-H594 VanDerWaalsContact C-N 3.32Å; I592-H594 PolarHBondContact O-N 3Å; I592-L595 PolarHBondContact O-N 3.11Å; I592-G596 PolarHBondContact O-N 3.15Å; I592-I613 HydrophobicContact CG2-CD1 4.24Å
593	L	85.7	Confident	84.6	Confident	21 Å²	21	53 Å²	53	11%	0.11	28%	0.284	C	S	.	.	H	α-helix	trans	-62.5	-39.9	174.4	-78.9	172.7	0	0	0	112.1	M589 A590 G596 K597 I605 V610 I613 L617	M589-L593 PolarHBondContact O-N 3.21Å; A590-L593 PolarHBondContact O-N 2.82Å; L593-G596 PolarHBondContact O-N 3.27Å; L593-K597 WeakPolarHBondContact O-CG 3.36Å; L593-K597 PolarHBondContact O-N 3.21Å; L593-K597 VanDerWaalsContact O-N 3.09Å; L593-I605 HydrophobicContact CD2-CD1 4.27Å; L593-V610 HydrophobicContact CD2-CB 4.38Å; L593-V610 HydrophobicContact CD2-CG1 4.14Å; L593-V610 HydrophobicContact CD2-CG2 4.23Å; L593-I613 HydrophobicContact CD1-CB 4.38Å; L593-I613 HydrophobicContact CD1-CG2 3.74Å; L593-I613 HydrophobicContact CD2-CB 4.1Å; L593-I613 HydrophobicContact CD2-CD1 4.05Å; L593-I613 HydrophobicContact CD2-CG2 4.16Å; L593-I613 HydrophobicContact CG-CB 4.25Å; L593-I613 HydrophobicContact CG-CD1 4.42Å; L593-I613 HydrophobicContact CG-CG2 3.74Å; L593-L617 HydrophobicContact CD1-CD1 3.69Å
594	H	85.8	Confident	84.2	Confident	111 Å²	111	55.3 Å²	55.3	51%	0.514	29%	0.294	S	S	.	.	H	α-helix	trans	-64.9	-41.4	175.9	-173.8	-108.8	0	0	0	111.3	V489 A590 T591 I592 K597 S598	V489-H594 VanDerWaalsContact CG2-ND1 3.31Å; V489-H594 WeakPolarHBondContact CG2-ND1 3.08Å; A590-H594 WeakPolarHBondContact O-CB 3.39Å; A590-H594 PolarHBondContact O-N 3.21Å; T591-H594 PolarHBondContact O-N 3.36Å; I592-H594 VanDerWaalsContact C-N 3.32Å; I592-H594 PolarHBondContact O-N 3Å; H594-K597 PolarHBondContact O-N 2.94Å; H594-S598 PolarHBondContact O-N 3.42Å; H594-S598 VanDerWaalsContact O-N 3.1Å
595	L	83.2	Confident	84	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-62	-46.6	174.1	-179.1	67.4	0	0	0	111.8	I488 V489 L546 L547 T591 I592 K597 S598 L600 P601	I488-L595 HydrophobicContact CD1-CD2 4.37Å; I488-L595 HydrophobicContact CG2-CD1 4.1Å; I488-L595 HydrophobicContact CG2-CD2 3.95Å; V489-L595 HydrophobicContact CG2-CB 4.04Å; V489-L595 HydrophobicContact CG2-CD1 3.89Å; L546-L595 HydrophobicContact CB-CD2 3.88Å; L546-L595 HydrophobicContact CD1-CD2 4.28Å; L547-L595 HydrophobicContact CD2-CD1 4.24Å; T591-L595 WeakPolarHBondContact O-CB 3.2Å; T591-L595 PolarHBondContact O-N 2.96Å; I592-L595 PolarHBondContact O-N 3.11Å; L595-K597 VanDerWaalsContact C-N 3.28Å; L595-K597 PolarHBondContact O-N 3.43Å; L595-S598 WeakPolarHBondContact O-CB 3.13Å; L595-S598 PolarHBondContact O-N 2.98Å; L595-S598 PolarHBondContact O-OG 3.19Å; L595-L600 HydrophobicContact CD1-CB 4.49Å; L595-L600 HydrophobicContact CD1-CD1 4.43Å; L595-P601 HydrophobicContact CD1-CG 4.49Å; L595-P601 HydrophobicContact CG-CG 4.34Å; L595-P601 WeakPolarHBondContact O-CG 3.29Å
596	G	81.3	Confident	83.9	Confident	2 Å²	2	57.5 Å²	57.5	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-64.5	-28.8	-179.5	0	0	0	0	0	114.6	F551 I592 L593 I605	F551-G596 VanDerWaalsContact CE1-CA 3.46Å; I592-G596 PolarHBondContact O-N 3.15Å; L593-G596 PolarHBondContact O-N 3.27Å; G596-I605 WeakPolarHBondContact O-CG2 3.18Å; G596-I605 PolarHBondContact O-N 3.25Å
597	K	82.8	Confident	83.7	Confident	154 Å²	154	61.1 Å²	61.1	67%	0.67	33%	0.33	S	S	*	.	H	α-helix	trans	-86.2	-12	173.6	-69.2	-177.3	178.4	-175.4	0	113.5	L593 H594 L595	L593-K597 WeakPolarHBondContact O-CG 3.36Å; L593-K597 PolarHBondContact O-N 3.21Å; L593-K597 VanDerWaalsContact O-N 3.09Å; H594-K597 PolarHBondContact O-N 2.94Å; L595-K597 VanDerWaalsContact C-N 3.28Å; L595-K597 PolarHBondContact O-N 3.43Å
598	S	81.4	Confident	83.6	Confident	28 Å²	28	62.8 Å²	62.8	20%	0.196	34%	0.339	C	S	.	.	S	Bend	trans	-77.8	163.5	175.6	78.6	0	0	0	0	111.6	H594 L595 L600 P601	H594-S598 PolarHBondContact O-N 3.42Å; H594-S598 VanDerWaalsContact O-N 3.1Å; L595-S598 WeakPolarHBondContact O-CB 3.13Å; L595-S598 PolarHBondContact O-N 2.98Å; L595-S598 PolarHBondContact O-OG 3.19Å; S598-L600 PolarHBondContact O-N 3.28Å; S598-P601 WeakPolarHBondContact O-CD 3.36Å
599	S	73.8	Confident	83.6	Confident	125 Å²	125	63.2 Å²	63.2	87%	0.874	34%	0.342	S	S	*	.	S	Bend	trans	-85.2	12.4	175.6	60.8	0	0	0	0	114
600	L	75.1	Confident	83.6	Confident	44 Å²	44	64.1 Å²	64.1	23%	0.23	35%	0.347	C	S	.	.			trans	-81.5	-37.4	-177.3	-62.6	169.9	0	0	0	114.6	V489 E492 I493 L595 S598	V489-L600 HydrophobicContact CB-CD1 4.37Å; V489-L600 HydrophobicContact CG1-CD1 3.91Å; V489-L600 HydrophobicContact CG2-CD1 4.39Å; E492-L600 HydrophobicContact CB-CD1 4.1Å; I493-L600 HydrophobicContact CG1-CD1 4.35Å; L595-L600 HydrophobicContact CD1-CB 4.49Å; L595-L600 HydrophobicContact CD1-CD1 4.43Å; S598-L600 PolarHBondContact O-N 3.28Å
601	P	80	Confident	83.6	Confident	17 Å²	17	67 Å²	67	11%	0.11	36%	0.356	C	S	.	.	S	Bend	trans	-70.9	151.7	178.6	-18.9	33.3	0	0	0	112.9	L547 F551 L595 S598 K603	L547-P601 WeakPolarHBondContact O-CA 3.23Å; F551-P601 HydrophobicContact CE2-CB 4.02Å; F551-P601 HydrophobicContact CE2-CG 4.3Å; F551-P601 HydrophobicContact CZ-CB 3.9Å; F551-P601 HydrophobicContact CZ-CG 3.72Å; L595-P601 HydrophobicContact CD1-CG 4.49Å; L595-P601 HydrophobicContact CG-CG 4.34Å; L595-P601 WeakPolarHBondContact O-CG 3.29Å; S598-P601 WeakPolarHBondContact O-CD 3.36Å; P601-K603 VanDerWaalsContact C-N 3.31Å; P601-K603 WeakPolarHBondContact CB-O 3.42Å; P601-K603 PolarHBondContact O-N 3.47Å
602	K	78.8	Confident	83.7	Confident	158 Å²	158	72 Å²	72	69%	0.687	37%	0.373	S	S	*	.	S	Bend	trans	-63.1	-34.3	176.4	-69.9	-179.5	-174.8	158.7	0	113.1	L547 D548	L547-K602 PolarHBondContact O-N 2.97Å; D548-K602 WeakPolarHBondContact OD1-CE 3.2Å; D548-K602 IonicContact OD1-NZ 3.74Å; D548-K602 PolarHBondContact OD1-NZ 3.26Å
603	K	81.6	Confident	83.9	Confident	127 Å²	127	71.9 Å²	71.9	55%	0.552	37%	0.373	S	S	*	.	S	Bend	trans	-125.8	140.6	174.1	-61.4	176.1	-178.3	169.6	0	108.8	F551 P601	F551-K603 VanDerWaalsContact CE2-O 3.28Å; F551-K603 WeakPolarHBondContact CE2-O 2.76Å; P601-K603 VanDerWaalsContact C-N 3.31Å; P601-K603 WeakPolarHBondContact CB-O 3.42Å; P601-K603 PolarHBondContact O-N 3.47Å
604	P	80.7	Confident	84	Confident	106 Å²	106	73.3 Å²	73.3	69%	0.688	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-68.6	158.5	175	30	-34.7	0	0	0	111.4
605	I	84.7	Confident	84.2	Confident	20 Å²	20	71.3 Å²	71.3	10%	0.103	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-62.7	142.3	173.2	-168.3	164.8	0	0	0	111.3	F551 L593 G596 D609 V610 I613	F551-I605 HydrophobicContact CB-CB 4.39Å; F551-I605 HydrophobicContact CB-CD1 4.28Å; F551-I605 HydrophobicContact CB-CG1 3.76Å; F551-I605 HydrophobicContact CD1-CB 3.99Å; F551-I605 HydrophobicContact CD1-CD1 3.75Å; F551-I605 HydrophobicContact CD1-CG1 3.81Å; F551-I605 HydrophobicContact CD2-CB 3.95Å; F551-I605 HydrophobicContact CD2-CG1 4.26Å; F551-I605 HydrophobicContact CE1-CB 4.31Å; F551-I605 HydrophobicContact CE1-CD1 4.42Å; F551-I605 HydrophobicContact CE2-CB 4.28Å; F551-I605 HydrophobicContact CG-CB 3.81Å; F551-I605 HydrophobicContact CG-CD1 4.11Å; F551-I605 HydrophobicContact CG-CG1 3.65Å; F551-I605 HydrophobicContact CZ-CB 4.46Å; L593-I605 HydrophobicContact CD2-CD1 4.27Å; G596-I605 WeakPolarHBondContact O-CG2 3.18Å; G596-I605 PolarHBondContact O-N 3.25Å; I605-D609 HydrophobicContact CD1-CB 4.27Å; I605-D609 HydrophobicContact CG1-CB 3.92Å; I605-V610 HydrophobicContact CB-CG2 4.31Å; I605-V610 HydrophobicContact CD1-CG2 3.76Å; I605-V610 HydrophobicContact CG1-CG2 3.81Å; I605-V610 HydrophobicContact CG2-CG2 3.54Å; I605-I613 HydrophobicContact CD1-CD1 4.13Å
606	T	87.6	Confident	84.5	Confident	71 Å²	71	71.3 Å²	71.3	44%	0.436	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-78.3	150.6	175.4	71.1	0	0	0	0	111.2	D608 D609 V610	T606-D608 VanDerWaalsContact C-N 3.28Å; T606-D608 PolarHBondContact O-N 3.18Å; T606-D609 PolarHBondContact O-N 3.37Å; T606-D609 WeakPolarHBondContact OG1-CB 3.16Å; T606-D609 PolarHBondContact OG1-N 3.44Å; T606-D609 PolarHBondContact OG1-OD2 3.31Å; T606-V610 WeakPolarHBondContact O-CG2 3.42Å; T606-V610 PolarHBondContact O-N 3.45Å
607	D	86.7	Confident	84.9	Confident	132 Å²	132	72.9 Å²	72.9	71%	0.706	39%	0.385	S	S	*	.	H	α-helix	trans	-61.1	-38	178.7	-69	-26.8	0	0	0	111.6	D609 V610 D611	D607-D609 PolarHBondContact O-N 3.1Å; D607-V610 WeakPolarHBondContact O-CB 3.13Å; D607-V610 PolarHBondContact O-N 2.86Å; D607-D611 WeakPolarHBondContact O-CB 3.44Å; D607-D611 PolarHBondContact O-N 3.29Å
608	D	87.6	Confident	85.2	Confident	133 Å²	133	71.1 Å²	71.1	71%	0.711	38%	0.377	S	S	*	.	H	α-helix	trans	-60.7	-41.8	175.9	-70.3	-19	0	0	0	112.2	T606 D611 R612	T606-D608 VanDerWaalsContact C-N 3.28Å; T606-D608 PolarHBondContact O-N 3.18Å; D608-D611 PolarHBondContact O-N 3.25Å; D608-R612 WeakPolarHBondContact O-CB 3.47Å; D608-R612 PolarHBondContact O-N 3.14Å
609	D	86.8	Confident	85.5	Confident	14 Å²	14	70.2 Å²	70.2	8%	0.075	37%	0.37	C	S	.	.	H	α-helix	trans	-68	-39.6	176.9	-68.6	-43.1	0	0	0	111.2	F551 A555 I605 T606 D607 R612 I613	F551-D609 HydrophobicContact CB-CB 4.35Å; A555-D609 HydrophobicContact CB-CB 4.45Å; A555-D609 WeakPolarHBondContact CB-OD1 3.23Å; I605-D609 HydrophobicContact CD1-CB 4.27Å; I605-D609 HydrophobicContact CG1-CB 3.92Å; T606-D609 PolarHBondContact O-N 3.37Å; T606-D609 WeakPolarHBondContact OG1-CB 3.16Å; T606-D609 PolarHBondContact OG1-N 3.44Å; T606-D609 PolarHBondContact OG1-OD2 3.31Å; D607-D609 PolarHBondContact O-N 3.1Å; D609-R612 PolarHBondContact O-N 3.47Å; D609-I613 WeakPolarHBondContact O-CD1 3.48Å; D609-I613 VanDerWaalsContact O-CG1 3.24Å; D609-I613 WeakPolarHBondContact O-CG1 2.99Å; D609-I613 PolarHBondContact O-N 3.34Å
610	V	89.3	Confident	86.1	Confident	19 Å²	19	64.5 Å²	64.5	12%	0.115	33%	0.33	C	S	.	.	H	α-helix	trans	-61.3	-46.8	175	173.2	0	0	0	0	110.7	L593 I605 T606 D607 R612 I613 S614	L593-V610 HydrophobicContact CD2-CB 4.38Å; L593-V610 HydrophobicContact CD2-CG1 4.14Å; L593-V610 HydrophobicContact CD2-CG2 4.23Å; I605-V610 HydrophobicContact CB-CG2 4.31Å; I605-V610 HydrophobicContact CD1-CG2 3.76Å; I605-V610 HydrophobicContact CG1-CG2 3.81Å; I605-V610 HydrophobicContact CG2-CG2 3.54Å; T606-V610 WeakPolarHBondContact O-CG2 3.42Å; T606-V610 PolarHBondContact O-N 3.45Å; D607-V610 WeakPolarHBondContact O-CB 3.13Å; D607-V610 PolarHBondContact O-N 2.86Å; V610-R612 VanDerWaalsContact C-N 3.32Å; V610-R612 PolarHBondContact O-N 2.97Å; V610-I613 PolarHBondContact O-N 3.38Å; V610-S614 VanDerWaalsContact O-CB 3.24Å; V610-S614 WeakPolarHBondContact O-CB 3.34Å; V610-S614 PolarHBondContact O-N 3.45Å; V610-S614 PolarHBondContact O-OG 2.93Å
611	D	89.8	Confident	86.7	Confident	109 Å²	109	66.8 Å²	66.8	58%	0.583	35%	0.35	S	S	*	.	H	α-helix	trans	-63.4	-41	179.4	-81	-7.6	0	0	0	111.1	D607 D608 S614 L615	D607-D611 WeakPolarHBondContact O-CB 3.44Å; D607-D611 PolarHBondContact O-N 3.29Å; D608-D611 PolarHBondContact O-N 3.25Å; D611-S614 PolarHBondContact O-N 2.85Å; D611-L615 WeakPolarHBondContact O-CB 3.49Å; D611-L615 PolarHBondContact O-N 3.1Å
612	R	88.8	Confident	86.8	Confident	117 Å²	117	71.7 Å²	71.7	44%	0.442	37%	0.371	S	S	.	.	H	α-helix	trans	-64.6	-44.3	177.7	-168.1	66	177.5	-173.2	0.7	112.6	A555 D608 D609 V610 L615 C616	A555-R612 HydrophobicContact CB-CB 4.27Å; A555-R612 HydrophobicContact CB-CG 4.17Å; D608-R612 WeakPolarHBondContact O-CB 3.47Å; D608-R612 PolarHBondContact O-N 3.14Å; D609-R612 PolarHBondContact O-N 3.47Å; V610-R612 VanDerWaalsContact C-N 3.32Å; V610-R612 PolarHBondContact O-N 2.97Å; R612-L615 PolarHBondContact O-N 3.03Å; R612-C616 PolarHBondContact O-N 3.44Å; R612-C616 VanDerWaalsContact O-N 3.14Å; R612-C616 PolarHBondContact O-SG 2.95Å
613	I	89.8	Confident	86.7	Confident	1 Å²	1	67.2 Å²	67.2	1%	0.005	36%	0.359	C	S	.	.	H	α-helix	trans	-68.3	-39.4	177.5	-60.5	163.6	0	0	0	110.3	A554 A558 M589 I592 L593 I605 D609 V610 L615 C616 L617	A554-I613 HydrophobicContact CB-CD1 4.28Å; A558-I613 HydrophobicContact CB-CB 4.28Å; A558-I613 HydrophobicContact CB-CG1 3.87Å; A558-I613 HydrophobicContact CB-CG2 4.14Å; M589-I613 HydrophobicContact CB-CG2 3.93Å; M589-I613 HydrophobicContact CG-CG2 4.19Å; I592-I613 HydrophobicContact CG2-CD1 4.24Å; L593-I613 HydrophobicContact CD1-CB 4.38Å; L593-I613 HydrophobicContact CD1-CG2 3.74Å; L593-I613 HydrophobicContact CD2-CB 4.1Å; L593-I613 HydrophobicContact CD2-CD1 4.05Å; L593-I613 HydrophobicContact CD2-CG2 4.16Å; L593-I613 HydrophobicContact CG-CB 4.25Å; L593-I613 HydrophobicContact CG-CD1 4.42Å; L593-I613 HydrophobicContact CG-CG2 3.74Å; I605-I613 HydrophobicContact CD1-CD1 4.13Å; D609-I613 WeakPolarHBondContact O-CD1 3.48Å; D609-I613 VanDerWaalsContact O-CG1 3.24Å; D609-I613 WeakPolarHBondContact O-CG1 2.99Å; D609-I613 PolarHBondContact O-N 3.34Å; V610-I613 PolarHBondContact O-N 3.38Å; I613-L615 VanDerWaalsContact C-N 3.35Å; I613-L615 PolarHBondContact O-N 2.84Å; I613-C616 WeakPolarHBondContact O-CB 3.26Å; I613-C616 PolarHBondContact O-N 2.85Å; I613-L617 PolarHBondContact O-N 2.86Å
614	S	89.3	Confident	86.7	Confident	50 Å²	50	63 Å²	63	35%	0.35	35%	0.345	S	S	.	.	H	α-helix	trans	-63.7	-40.1	177.2	-60.2	0	0	0	0	111.9	V610 D611 L617 K618	V610-S614 VanDerWaalsContact O-CB 3.24Å; V610-S614 WeakPolarHBondContact O-CB 3.34Å; V610-S614 PolarHBondContact O-N 3.45Å; V610-S614 PolarHBondContact O-OG 2.93Å; D611-S614 PolarHBondContact O-N 2.85Å; S614-L617 PolarHBondContact O-N 3.36Å; S614-K618 PolarHBondContact O-N 2.89Å
615	L	89.6	Confident	86.7	Confident	70 Å²	70	62.8 Å²	62.8	37%	0.366	34%	0.344	S	S	.	.	H	α-helix	trans	-59.9	-45.3	172.1	179.2	64.8	0	0	0	111.2	D611 R612 I613 L617 K618 V619	D611-L615 WeakPolarHBondContact O-CB 3.49Å; D611-L615 PolarHBondContact O-N 3.1Å; R612-L615 PolarHBondContact O-N 3.03Å; I613-L615 VanDerWaalsContact C-N 3.35Å; I613-L615 PolarHBondContact O-N 2.84Å; L615-L617 PolarHBondContact O-N 2.89Å; L615-K618 PolarHBondContact O-N 3.08Å; L615-V619 HydrophobicContact CD1-CG2 4.45Å; L615-V619 VanDerWaalsContact O-CG2 3.28Å; L615-V619 WeakPolarHBondContact O-CG2 3.23Å; L615-V619 PolarHBondContact O-N 2.8Å
616	C	89.2	Confident	86.6	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-60.4	-43.1	177.2	-68.7	0	0	0	0	112.2	A558 T562 M589 R612 I613 K618 V619 L620	A558-C616 HydrophobicContact CB-CB 4.13Å; T562-C616 VanDerWaalsContact OG1-CB 3.3Å; T562-C616 WeakPolarHBondContact OG1-CB 3.33Å; M589-C616 HydrophobicContact SD-CB 3.84Å; R612-C616 PolarHBondContact O-N 3.44Å; R612-C616 VanDerWaalsContact O-N 3.14Å; R612-C616 PolarHBondContact O-SG 2.95Å; I613-C616 WeakPolarHBondContact O-CB 3.26Å; I613-C616 PolarHBondContact O-N 2.85Å; C616-K618 PolarHBondContact O-N 2.8Å; C616-V619 PolarHBondContact O-N 2.84Å; C616-L620 PolarHBondContact O-N 2.82Å; C616-L620 VanDerWaalsContact O-N 3.09Å
617	L	89.3	Confident	86.4	Confident	35 Å²	35	66.2 Å²	66.2	18%	0.183	36%	0.358	C	S	.	.	H	α-helix	trans	-61.2	-42.3	174.3	-74.9	172.2	0	0	0	112.3	M586 M589 L593 I613 S614 L615 L620 S621	M586-L617 HydrophobicContact CB-CD2 4Å; M586-L617 HydrophobicContact CE-CD2 4.33Å; M586-L617 HydrophobicContact CG-CD2 4.07Å; M589-L617 HydrophobicContact CB-CD1 4.47Å; M589-L617 HydrophobicContact CB-CD2 3.73Å; M589-L617 HydrophobicContact CB-CG 4.09Å; M589-L617 HydrophobicContact SD-CD2 4.25Å; M589-L617 HydrophobicContact SD-CG 4.35Å; L593-L617 HydrophobicContact CD1-CD1 3.69Å; I613-L617 PolarHBondContact O-N 2.86Å; S614-L617 PolarHBondContact O-N 3.36Å; L615-L617 PolarHBondContact O-N 2.89Å; L617-L620 PolarHBondContact O-N 3.23Å; L617-S621 PolarHBondContact O-N 2.92Å
618	K	88.7	Confident	86.2	Confident	118 Å²	118	62.3 Å²	62.3	51%	0.513	34%	0.338	S	S	.	.	H	α-helix	trans	-64.2	-42.3	177	-169.9	175.2	179.1	178.9	0	111.6	S614 L615 C616 L620 S621 E622	S614-K618 PolarHBondContact O-N 2.89Å; L615-K618 PolarHBondContact O-N 3.08Å; C616-K618 PolarHBondContact O-N 2.8Å; K618-L620 VanDerWaalsContact C-N 3.34Å; K618-L620 PolarHBondContact O-N 2.72Å; K618-S621 PolarHBondContact O-N 3.14Å; K618-E622 WeakPolarHBondContact CE-OE1 3.15Å; K618-E622 HydrophobicContact CG-CG 4.38Å; K618-E622 IonicContact NZ-OE1 2.68Å; K618-E622 PolarHBondContact O-N 2.92Å
619	V	88.6	Confident	86	Confident	8 Å²	8	59.4 Å²	59.4	5%	0.048	32%	0.322	C	S	.	.	H	α-helix	trans	-61	-41.5	177.3	170.6	0	0	0	0	111.7	T562 L566 L615 C616 C623 M627 F631	T562-V619 HydrophobicContact CG2-CB 4.32Å; T562-V619 HydrophobicContact CG2-CG1 3.82Å; L566-V619 HydrophobicContact CD1-CG1 4.17Å; L615-V619 HydrophobicContact CD1-CG2 4.45Å; L615-V619 VanDerWaalsContact O-CG2 3.28Å; L615-V619 WeakPolarHBondContact O-CG2 3.23Å; L615-V619 PolarHBondContact O-N 2.8Å; C616-V619 PolarHBondContact O-N 2.84Å; V619-C623 WeakPolarHBondContact O-CA 3.49Å; V619-C623 PolarHBondContact O-N 2.83Å; V619-M627 HydrophobicContact CG1-CB 4.08Å; V619-M627 HydrophobicContact CG2-CB 4.37Å; V619-M627 HydrophobicContact CG2-CE 3.47Å; V619-M627 VanDerWaalsContact CG2-CE 3.47Å; V619-M627 HydrophobicContact CG2-CG 4.31Å; V619-F631 HydrophobicContact CG2-CE2 4.41Å
620	L	86.8	Confident	85.9	Confident	6 Å²	6	61.1 Å²	61.1	3%	0.031	33%	0.33	C	S	.	.	H	α-helix	trans	-71.1	-31.7	176.8	-71	179.8	0	0	0	113.5	T562 A565 L566 V582 A585 M586 M589 C616 L617 K618 C623	T562-L620 HydrophobicContact CG2-CD2 4.07Å; T562-L620 HydrophobicContact CG2-CG 4.15Å; A565-L620 HydrophobicContact CB-CD2 3.77Å; L566-L620 HydrophobicContact CD2-CD2 4.38Å; L566-L620 HydrophobicContact CG-CD2 4.26Å; V582-L620 HydrophobicContact CG1-CB 4.27Å; A585-L620 HydrophobicContact CB-CD1 4.34Å; M586-L620 HydrophobicContact CG-CB 4.22Å; M586-L620 HydrophobicContact CG-CD1 4.01Å; M586-L620 HydrophobicContact SD-CB 4.35Å; M589-L620 HydrophobicContact CE-CD1 3.33Å; C616-L620 PolarHBondContact O-N 2.82Å; C616-L620 VanDerWaalsContact O-N 3.09Å; L617-L620 PolarHBondContact O-N 3.23Å; K618-L620 VanDerWaalsContact C-N 3.34Å; K618-L620 PolarHBondContact O-N 2.72Å; L620-C623 PolarHBondContact O-SG 3.1Å
621	S	86.6	Confident	85.6	Confident	91 Å²	91	60.6 Å²	60.6	64%	0.636	33%	0.327	S	S	*	.	H	α-helix	trans	-71	-45.3	176	-172.7	0	0	0	0	112.2	L617 K618	L617-S621 PolarHBondContact O-N 2.92Å; K618-S621 PolarHBondContact O-N 3.14Å
622	E	83.6	Confident	85.2	Confident	121 Å²	121	56.6 Å²	56.6	57%	0.565	31%	0.305	S	S	*	.	H	α-helix	trans	-85.6	-28.2	-175.6	-67.6	177.8	178.1	0	0	113.2	K618 S624	K618-E622 WeakPolarHBondContact CE-OE1 3.15Å; K618-E622 HydrophobicContact CG-CG 4.38Å; K618-E622 IonicContact NZ-OE1 2.68Å; K618-E622 PolarHBondContact O-N 2.92Å; E622-S624 PolarHBondContact O-N 3.33Å
623	C	76.8	Confident	84.8	Confident	63 Å²	63	56.7 Å²	56.7	43%	0.426	31%	0.309	S	S	.	.			trans	47.2	41.9	-178.6	-76.4	0	0	0	0	113.9	V619 L620	V619-C623 WeakPolarHBondContact O-CA 3.49Å; V619-C623 PolarHBondContact O-N 2.83Å; L620-C623 PolarHBondContact O-SG 3.1Å
624	S	81.3	Confident	84.4	Confident	38 Å²	38	61.7 Å²	61.7	27%	0.266	33%	0.332	S	S	.	.			trans	-60.1	136.3	179.9	171.8	0	0	0	0	112.1	E622 L626 M627 N628	E622-S624 PolarHBondContact O-N 3.33Å; S624-L626 VanDerWaalsContact C-N 3.31Å; S624-L626 PolarHBondContact O-N 2.87Å; S624-M627 PolarHBondContact O-N 2.68Å; S624-N628 PolarHBondContact O-N 3.44Å
625	P	79.2	Confident	83.9	Confident	102 Å²	102	61.4 Å²	61.4	66%	0.662	33%	0.33	S	S	*	.	H	α-helix	trans	-62.7	-35.6	-179.9	23.8	-32.4	0	0	0	112.7	N628 D629	P625-N628 WeakPolarHBondContact O-CB 3.47Å; P625-N628 PolarHBondContact O-N 3.35Å; P625-D629 PolarHBondContact O-N 3.41Å; P625-D629 VanDerWaalsContact O-N 3.09Å
626	L	84.4	Confident	83.4	Confident	116 Å²	116	61.5 Å²	61.5	61%	0.607	33%	0.325	S	S	*	.	H	α-helix	trans	-62.7	-47.3	176.5	-180	67.5	0	0	0	111.2	S624 N628 D629 I630	S624-L626 VanDerWaalsContact C-N 3.31Å; S624-L626 PolarHBondContact O-N 2.87Å; L626-N628 VanDerWaalsContact C-N 3.27Å; L626-N628 PolarHBondContact O-N 2.79Å; L626-D629 PolarHBondContact O-N 3.35Å; L626-I630 HydrophobicContact CD1-CD1 4.44Å; L626-I630 HydrophobicContact CG-CD1 4.06Å; L626-I630 WeakPolarHBondContact O-CG1 3.45Å; L626-I630 PolarHBondContact O-N 3.44Å; L626-I630 VanDerWaalsContact O-N 3.08Å
627	M	83.1	Confident	83.1	Confident	47 Å²	47	66.6 Å²	66.6	23%	0.232	35%	0.349	C	S	.	.	H	α-helix	trans	-66.1	-32.8	178.9	-66.2	-58.2	-73.8	0	0	111.7	V619 S624 I630 F631	V619-M627 HydrophobicContact CG1-CB 4.08Å; V619-M627 HydrophobicContact CG2-CB 4.37Å; V619-M627 HydrophobicContact CG2-CE 3.47Å; V619-M627 VanDerWaalsContact CG2-CE 3.47Å; V619-M627 HydrophobicContact CG2-CG 4.31Å; S624-M627 PolarHBondContact O-N 2.68Å; M627-I630 PolarHBondContact O-N 2.91Å; M627-I630 HydrophobicContact SD-CD1 4.08Å; M627-F631 HydrophobicContact CE-CD2 4.27Å; M627-F631 HydrophobicContact CE-CE2 3.64Å; M627-F631 WeakPolarHBondContact O-CB 3.4Å; M627-F631 WeakPolarHBondContact O-CD2 3.41Å; M627-F631 PolarHBondContact O-N 2.86Å
628	N	82.2	Confident	82.7	Confident	51 Å²	51	68.8 Å²	68.8	27%	0.273	37%	0.367	S	S	.	.	H	α-helix	trans	-62.9	-45	174.4	-166	0.4	0	0	0	111.8	S624 P625 L626 N632	S624-N628 PolarHBondContact O-N 3.44Å; P625-N628 WeakPolarHBondContact O-CB 3.47Å; P625-N628 PolarHBondContact O-N 3.35Å; L626-N628 VanDerWaalsContact C-N 3.27Å; L626-N628 PolarHBondContact O-N 2.79Å; N628-N632 WeakPolarHBondContact O-CB 3.35Å; N628-N632 PolarHBondContact O-N 3.01Å; N628-N632 VanDerWaalsContact O-N 3.09Å; N628-N632 PolarHBondContact OD1-ND2 3.47Å
629	D	83.8	Confident	82.3	Confident	71 Å²	71	63.6 Å²	63.6	38%	0.38	35%	0.345	S	S	.	.	H	α-helix	trans	-64.9	-41.6	176.6	-81.5	-35.8	0	0	0	112.4	P625 L626 K633 E634	P625-D629 PolarHBondContact O-N 3.41Å; P625-D629 VanDerWaalsContact O-N 3.09Å; L626-D629 PolarHBondContact O-N 3.35Å; D629-K633 WeakPolarHBondContact O-CB 3.39Å; D629-K633 PolarHBondContact O-N 3.3Å; D629-K633 WeakPolarHBondContact OD1-CE 3.01Å; D629-K633 IonicContact OD1-NZ 2.76Å; D629-K633 PolarHBondContact OD1-NZ 2.89Å; D629-E634 PolarHBondContact O-N 3.23Å
630	I	84.1	Confident	82	Confident	50 Å²	50	65.5 Å²	65.5	26%	0.256	36%	0.359	S	S	.	.	I	π-helix	trans	-61.5	-49.6	178.2	-65.5	167.3	0	0	0	111.2	L626 M627 N632 E634 C635	L626-I630 HydrophobicContact CD1-CD1 4.44Å; L626-I630 HydrophobicContact CG-CD1 4.06Å; L626-I630 WeakPolarHBondContact O-CG1 3.45Å; L626-I630 PolarHBondContact O-N 3.44Å; L626-I630 VanDerWaalsContact O-N 3.08Å; M627-I630 PolarHBondContact O-N 2.91Å; M627-I630 HydrophobicContact SD-CD1 4.08Å; I630-N632 PolarHBondContact O-N 2.85Å; I630-E634 PolarHBondContact O-N 3.08Å; I630-C635 PolarHBondContact O-N 2.99Å; I630-C635 PolarHBondContact O-SG 2.82Å
631	F	82.9	Confident	81.7	Confident	9 Å²	9	71.2 Å²	71.2	4%	0.039	39%	0.385	C	S	.	.	I	π-helix	trans	-71.3	-30.1	-176.1	-88.1	-100.4	0	0	0	113.2	T559 T562 K563 L566 V619 M627	T559-F631 HydrophobicContact CG2-CD1 4.39Å; T559-F631 HydrophobicContact CG2-CE1 3.92Å; T562-F631 HydrophobicContact CG2-CD1 4.21Å; T562-F631 HydrophobicContact CG2-CE1 4.17Å; K563-F631 WeakPolarHBondContact CE-O 3.23Å; K563-F631 HydrophobicContact CG-CB 4.23Å; K563-F631 HydrophobicContact CG-CD1 3.87Å; L566-F631 HydrophobicContact CD1-CB 4.3Å; V619-F631 HydrophobicContact CG2-CE2 4.41Å; M627-F631 HydrophobicContact CE-CD2 4.27Å; M627-F631 HydrophobicContact CE-CE2 3.64Å; M627-F631 WeakPolarHBondContact O-CB 3.4Å; M627-F631 WeakPolarHBondContact O-CD2 3.41Å; M627-F631 PolarHBondContact O-N 2.86Å
632	N	80.6	Confident	81.5	Confident	25 Å²	25	71 Å²	71	13%	0.134	38%	0.375	C	S	.	.	I	π-helix	trans	-98	-29.6	-176.6	-78.3	-37.7	0	0	0	115.5	R567 N628 I630	R567-N632 WeakPolarHBondContact CG-OD1 3.38Å; R567-N632 PolarHBondContact NE-OD1 2.9Å; N628-N632 WeakPolarHBondContact O-CB 3.35Å; N628-N632 PolarHBondContact O-N 3.01Å; N628-N632 VanDerWaalsContact O-N 3.09Å; N628-N632 PolarHBondContact OD1-ND2 3.47Å; I630-N632 PolarHBondContact O-N 2.85Å
633	K	80.9	Confident	81.3	Confident	119 Å²	119	66 Å²	66	52%	0.517	35%	0.352	S	S	.	.	I	π-helix	trans	-114.7	-54	-174.1	-63.8	175.1	-176.3	153.9	0	112.8	D629 C635 R636 Q637	D629-K633 WeakPolarHBondContact O-CB 3.39Å; D629-K633 PolarHBondContact O-N 3.3Å; D629-K633 WeakPolarHBondContact OD1-CE 3.01Å; D629-K633 IonicContact OD1-NZ 2.76Å; D629-K633 PolarHBondContact OD1-NZ 2.89Å; K633-C635 PolarHBondContact O-N 2.74Å; K633-R636 WeakPolarHBondContact O-CB 3.5Å; K633-R636 PolarHBondContact O-N 3.17Å; K633-R636 VanDerWaalsContact O-N 3.16Å; K633-Q637 WeakPolarHBondContact O-CG 3.45Å; K633-Q637 PolarHBondContact O-N 3.42Å
634	E	80.6	Confident	81.4	Confident	106 Å²	106	65.6 Å²	65.6	50%	0.495	35%	0.35	S	S	.	.	I	π-helix	trans	-66.6	-39.4	-172.8	-63.3	-171.6	171.7	0	0	112.3	D629 I630 R636 Q637 S638	D629-E634 PolarHBondContact O-N 3.23Å; I630-E634 PolarHBondContact O-N 3.08Å; E634-R636 PolarHBondContact O-N 2.67Å; E634-Q637 PolarHBondContact O-N 3.08Å; E634-S638 PolarHBondContact O-N 2.9Å
635	C	80.1	Confident	81.1	Confident	44 Å²	44	65.8 Å²	65.8	30%	0.297	35%	0.354	S	S	.	.	H	α-helix	trans	-55.4	-38.7	174.4	-72.6	0	0	0	0	112.5	I630 K633	I630-C635 PolarHBondContact O-N 2.99Å; I630-C635 PolarHBondContact O-SG 2.82Å; K633-C635 PolarHBondContact O-N 2.74Å
636	R	78.4	Confident	80.9	Confident	71 Å²	71	64.5 Å²	64.5	27%	0.268	34%	0.338	S	S	.	.	H	α-helix	trans	-73.8	-43	178.5	-162.7	-179	-68.4	-172.4	-8.5	112.1	E464 K633 E634 S638 L639 S640	E464-R636 HydrophobicContact CG-CB 4.49Å; E464-R636 HydrophobicContact CG-CG 4.33Å; E464-R636 PolarHBondContact O-NH2 3.02Å; E464-R636 WeakPolarHBondContact OE1-CB 3.32Å; E464-R636 IonicContact OE1-CZ 3.03Å; E464-R636 IonicContact OE1-NE 3.22Å; E464-R636 PolarHBondContact OE1-NE 3.32Å; E464-R636 IonicContact OE1-NH2 2.66Å; K633-R636 WeakPolarHBondContact O-CB 3.5Å; K633-R636 PolarHBondContact O-N 3.17Å; K633-R636 VanDerWaalsContact O-N 3.16Å; E634-R636 PolarHBondContact O-N 2.67Å; R636-S638 VanDerWaalsContact C-N 3.27Å; R636-S638 PolarHBondContact O-N 3.04Å; R636-L639 PolarHBondContact O-N 3.43Å; R636-S640 PolarHBondContact O-N 2.74Å
637	Q	82.7	Confident	80.3	Confident	108 Å²	108	61.2 Å²	61.2	51%	0.505	32%	0.321	S	S	.	.	H	α-helix	trans	-60.9	-38.1	179.5	-73.2	175.7	-7	0	0	111.7	K633 E634 L639 S640 H641	K633-Q637 WeakPolarHBondContact O-CG 3.45Å; K633-Q637 PolarHBondContact O-N 3.42Å; E634-Q637 PolarHBondContact O-N 3.08Å; Q637-L639 VanDerWaalsContact C-N 3.34Å; Q637-L639 PolarHBondContact O-N 3.14Å; Q637-S640 WeakPolarHBondContact O-CA 3.48Å; Q637-S640 WeakPolarHBondContact O-CB 3.4Å; Q637-S640 PolarHBondContact O-N 3.39Å; Q637-H641 PolarHBondContact O-CD2 3.33Å; Q637-H641 PolarHBondContact O-N 3.11Å
638	S	81.6	Confident	79.8	Confident	80 Å²	80	64.1 Å²	64.1	56%	0.559	33%	0.334	S	S	*	.	H	α-helix	trans	-57	-43.6	176.4	-174.5	0	0	0	0	112.8	E634 R636 S640 H641 M642	E634-S638 PolarHBondContact O-N 2.9Å; R636-S638 VanDerWaalsContact C-N 3.27Å; R636-S638 PolarHBondContact O-N 3.04Å; S638-S640 PolarHBondContact O-N 3.45Å; S638-H641 PolarHBondContact O-N 3.28Å; S638-M642 PolarHBondContact O-N 2.83Å
639	L	80.1	Confident	79.1	Confident	10 Å²	10	64.9 Å²	64.9	5%	0.052	34%	0.335	C	S	.	.	H	α-helix	trans	-62.9	-43.9	173.8	-175.9	76.7	0	0	0	111.3	R425 Q429 W460 Y465 R636 Q637 H641 M642 L643	R425-L639 HydrophobicContact CG-CD1 4.13Å; R425-L639 HydrophobicContact CG-CD2 4.12Å; Q429-L639 HydrophobicContact CB-CD2 4.06Å; Q429-L639 HydrophobicContact CG-CD2 4.36Å; W460-L639 HydrophobicContact CH2-CB 4.28Å; W460-L639 HydrophobicContact CH2-CD1 4.26Å; W460-L639 HydrophobicContact CH2-CD2 3.55Å; W460-L639 HydrophobicContact CH2-CG 4.21Å; W460-L639 HydrophobicContact CZ3-CD2 4.14Å; Y465-L639 WeakPolarHBondContact OH-CD2 3.35Å; R636-L639 PolarHBondContact O-N 3.43Å; Q637-L639 VanDerWaalsContact C-N 3.34Å; Q637-L639 PolarHBondContact O-N 3.14Å; L639-H641 VanDerWaalsContact C-N 3.31Å; L639-H641 PolarHBondContact O-N 2.89Å; L639-M642 HydrophobicContact CD1-CE 3.48Å; L639-M642 VanDerWaalsContact CD1-CE 3.48Å; L639-M642 PolarHBondContact O-N 3.42Å; L639-L643 HydrophobicContact CD1-CD1 4.41Å; L639-L643 HydrophobicContact CD1-CG 4.45Å; L639-L643 HydrophobicContact CD2-CD1 4.15Å; L639-L643 HydrophobicContact CG-CD1 3.98Å; L639-L643 HydrophobicContact CG-CG 4.32Å; L639-L643 WeakPolarHBondContact O-CG 3.41Å; L639-L643 PolarHBondContact O-N 2.96Å
640	S	81.3	Confident	78.4	Confident	48 Å²	48	64.8 Å²	64.8	34%	0.336	33%	0.333	S	S	.	.	H	α-helix	trans	-59.1	-42.8	179	-167	0	0	0	0	112	Q429 R636 Q637 S638 S644	Q429-S640 PolarHBondContact NE2-OG 3.07Å; R636-S640 PolarHBondContact O-N 2.74Å; Q637-S640 WeakPolarHBondContact O-CA 3.48Å; Q637-S640 WeakPolarHBondContact O-CB 3.4Å; Q637-S640 PolarHBondContact O-N 3.39Å; S638-S640 PolarHBondContact O-N 3.45Å; S640-S644 WeakPolarHBondContact O-CB 3.47Å; S640-S644 PolarHBondContact O-N 3.31Å; S640-S644 PolarHBondContact O-OG 3.22Å
641	H	82.3	Confident	77.7	Confident	126 Å²	126	68.7 Å²	68.7	58%	0.583	35%	0.348	S	S	*	.	H	α-helix	trans	-63.7	-48	176.5	-72.5	-60.8	0	0	0	111.4	Q637 S638 L639 L643 S644 A645	Q637-H641 PolarHBondContact O-CD2 3.33Å; Q637-H641 PolarHBondContact O-N 3.11Å; S638-H641 PolarHBondContact O-N 3.28Å; L639-H641 VanDerWaalsContact C-N 3.31Å; L639-H641 PolarHBondContact O-N 2.89Å; H641-L643 PolarHBondContact O-N 3.49Å; H641-S644 WeakPolarHBondContact CA-OG 3.49Å; H641-S644 PolarHBondContact O-N 3.02Å; H641-S644 PolarHBondContact O-OG 3.19Å; H641-A645 PolarHBondContact O-N 2.99Å
642	M	81.2	Confident	76.9	Confident	86 Å²	86	72.3 Å²	72.3	42%	0.424	37%	0.367	S	S	.	.	H	α-helix	trans	-57.8	-46.6	177.9	-177.5	-160.3	73.6	0	0	112.4	S638 L639 A645 K646	S638-M642 PolarHBondContact O-N 2.83Å; L639-M642 HydrophobicContact CD1-CE 3.48Å; L639-M642 VanDerWaalsContact CD1-CE 3.48Å; L639-M642 PolarHBondContact O-N 3.42Å; M642-A645 PolarHBondContact O-N 3.14Å; M642-K646 PolarHBondContact O-N 2.73Å; M642-K646 VanDerWaalsContact O-N 3.12Å
643	L	79.8	Confident	76.2	Confident	17 Å²	17	73.9 Å²	73.9	9%	0.089	38%	0.38	C	S	.	.	H	α-helix	trans	-68.2	-38.3	179.6	-69.4	177.1	0	0	0	112.4	E426 Q429 L639 H641 A645 K646 L647	E426-L643 HydrophobicContact CB-CD2 4.49Å; E426-L643 HydrophobicContact CG-CD2 4.16Å; Q429-L643 HydrophobicContact CB-CD1 3.77Å; Q429-L643 HydrophobicContact CG-CD1 3.85Å; L639-L643 HydrophobicContact CD1-CD1 4.41Å; L639-L643 HydrophobicContact CD1-CG 4.45Å; L639-L643 HydrophobicContact CD2-CD1 4.15Å; L639-L643 HydrophobicContact CG-CD1 3.98Å; L639-L643 HydrophobicContact CG-CG 4.32Å; L639-L643 WeakPolarHBondContact O-CG 3.41Å; L639-L643 PolarHBondContact O-N 2.96Å; H641-L643 PolarHBondContact O-N 3.49Å; L643-A645 VanDerWaalsContact C-N 3.34Å; L643-A645 PolarHBondContact O-N 3.18Å; L643-K646 PolarHBondContact O-N 3.05Å; L643-L647 WeakPolarHBondContact O-CG 3.22Å; L643-L647 PolarHBondContact O-N 3.29Å
644	S	78.1	Confident	75.3	Confident	54 Å²	54	72.8 Å²	72.8	38%	0.378	38%	0.377	S	S	.	.	H	α-helix	trans	-62.6	-40.4	175.8	67.7	0	0	0	0	112.3	S640 H641 L647 E648	S640-S644 WeakPolarHBondContact O-CB 3.47Å; S640-S644 PolarHBondContact O-N 3.31Å; S640-S644 PolarHBondContact O-OG 3.22Å; H641-S644 WeakPolarHBondContact CA-OG 3.49Å; H641-S644 PolarHBondContact O-N 3.02Å; H641-S644 PolarHBondContact O-OG 3.19Å; S644-L647 PolarHBondContact O-N 3.25Å; S644-E648 PolarHBondContact O-N 3.17Å; S644-E648 VanDerWaalsContact O-N 3.13Å
645	A	76.5	Confident	74.4	Confident	42 Å²	42	73.7 Å²	73.7	35%	0.347	38%	0.379	S	S	.	.	H	α-helix	trans	-63.1	-47.3	175.5	0	0	0	0	0	111.7	H641 M642 L643 L647 E648 E649	H641-A645 PolarHBondContact O-N 2.99Å; M642-A645 PolarHBondContact O-N 3.14Å; L643-A645 VanDerWaalsContact C-N 3.34Å; L643-A645 PolarHBondContact O-N 3.18Å; A645-L647 VanDerWaalsContact C-N 3.34Å; A645-L647 PolarHBondContact O-N 3.14Å; A645-E648 PolarHBondContact O-N 3.03Å; A645-E649 WeakPolarHBondContact O-CG 3.21Å; A645-E649 PolarHBondContact O-N 3.43Å
646	K	74.1	Confident	73.4	Confident	75 Å²	75	76.1 Å²	76.1	33%	0.326	39%	0.385	S	S	.	.	H	α-helix	trans	-58.7	-43.8	178.2	-167.1	-179.5	179.6	-173.7	0	111.8	E422 M642 L643 E648 E649 E650	E422-K646 IonicContact OE1-NZ 3.74Å; E422-K646 PolarHBondContact OE1-NZ 3.4Å; M642-K646 PolarHBondContact O-N 2.73Å; M642-K646 VanDerWaalsContact O-N 3.12Å; L643-K646 PolarHBondContact O-N 3.05Å; K646-E648 PolarHBondContact O-N 3.48Å; K646-E649 PolarHBondContact O-N 3.5Å; K646-E650 PolarHBondContact O-N 3.09Å
647	L	71.6	Confident	72.4	Confident	47 Å²	47	77.7 Å²	77.7	25%	0.246	40%	0.395	C	S	.	.	H	α-helix	trans	-65.1	-38.1	178.2	-81.3	164.4	0	0	0	113.4	L643 S644 A645 E649 K651	L643-L647 WeakPolarHBondContact O-CG 3.22Å; L643-L647 PolarHBondContact O-N 3.29Å; S644-L647 PolarHBondContact O-N 3.25Å; A645-L647 VanDerWaalsContact C-N 3.34Å; A645-L647 PolarHBondContact O-N 3.14Å; L647-E649 VanDerWaalsContact C-N 3.31Å; L647-K651 VanDerWaalsContact O-CG 3.3Å; L647-K651 WeakPolarHBondContact O-CG 3.45Å; L647-K651 PolarHBondContact O-N 2.82Å
648	E	72.4	Confident	71.1	Confident	107 Å²	107	75 Å²	75	50%	0.5	39%	0.388	S	S	.	.	H	α-helix	trans	-64.7	-38.3	175.2	-76.4	-173.5	176.5	0	0	111.9	S644 A645 K646 K651 L652 K882	S644-E648 PolarHBondContact O-N 3.17Å; S644-E648 VanDerWaalsContact O-N 3.13Å; A645-E648 PolarHBondContact O-N 3.03Å; K646-E648 PolarHBondContact O-N 3.48Å; E648-K651 PolarHBondContact O-N 3.41Å; E648-L652 VanDerWaalsContact O-CG 3.3Å; E648-L652 WeakPolarHBondContact O-CG 3.33Å; E648-L652 PolarHBondContact O-N 2.89Å; E648-K882 IonicContact OE2-NZ 3.62Å; E648-K882 PolarHBondContact OE2-NZ 3.3Å
649	E	68.9	Low	69.8	Low	67 Å²	67	77.6 Å²	77.6	31%	0.313	39%	0.391	S	S	.	.	H	α-helix	trans	-65.9	-45.5	176.7	-70.8	177.8	173.6	0	0	112	A645 K646 L647 K651 L652 S653 K882	A645-E649 WeakPolarHBondContact O-CG 3.21Å; A645-E649 PolarHBondContact O-N 3.43Å; K646-E649 PolarHBondContact O-N 3.5Å; L647-E649 VanDerWaalsContact C-N 3.31Å; E649-K651 VanDerWaalsContact C-N 3.3Å; E649-K651 PolarHBondContact O-N 3.03Å; E649-L652 PolarHBondContact O-N 2.94Å; E649-L652 VanDerWaalsContact O-N 3.16Å; E649-S653 PolarHBondContact O-N 2.86Å; E649-S653 PolarHBondContact O-OG 3.08Å; E649-K882 HydrophobicContact CG-CD 4.49Å
650	E	68.5	Low	68.6	Low	69 Å²	69	86.1 Å²	86.1	32%	0.322	43%	0.428	S	S	.	.	H	α-helix	trans	-61.8	-37.1	175.8	-73.8	179.3	-175.1	0	0	112.5	K646 S653 Q654	K646-E650 PolarHBondContact O-N 3.09Å; E650-S653 WeakPolarHBondContact CA-OG 3.44Å; E650-S653 PolarHBondContact O-OG 3.11Å; E650-Q654 WeakPolarHBondContact O-CB 3.3Å; E650-Q654 VanDerWaalsContact O-CG 3.29Å; E650-Q654 WeakPolarHBondContact O-CG 3.25Å; E650-Q654 PolarHBondContact O-N 3.34Å
651	K	69.4	Low	67.1	Low	132 Å²	132	90.2 Å²	90.2	57%	0.574	44%	0.436	S	S	*	.	H	α-helix	trans	-67.1	-38	174.9	-75.4	175.4	-176.6	179	0	112.1	L647 E648 E649 K655	L647-K651 VanDerWaalsContact O-CG 3.3Å; L647-K651 WeakPolarHBondContact O-CG 3.45Å; L647-K651 PolarHBondContact O-N 2.82Å; E648-K651 PolarHBondContact O-N 3.41Å; E649-K651 VanDerWaalsContact C-N 3.3Å; E649-K651 PolarHBondContact O-N 3.03Å; K651-K655 WeakPolarHBondContact O-CB 2.91Å; K651-K655 VanDerWaalsContact O-CG 3.31Å; K651-K655 WeakPolarHBondContact O-CG 3.35Å; K651-K655 PolarHBondContact O-N 2.92Å
652	L	66.8	Low	65.2	Low	85 Å²	85	89.3 Å²	89.3	45%	0.445	44%	0.436	S	S	.	.	H	α-helix	trans	-69.7	-39.9	178.5	-74.7	164.8	0	0	0	111.7	E648 E649 K655 K656	E648-L652 VanDerWaalsContact O-CG 3.3Å; E648-L652 WeakPolarHBondContact O-CG 3.33Å; E648-L652 PolarHBondContact O-N 2.89Å; E649-L652 PolarHBondContact O-N 2.94Å; E649-L652 VanDerWaalsContact O-N 3.16Å; L652-K655 PolarHBondContact O-N 2.93Å; L652-K656 WeakPolarHBondContact O-CG 3.33Å; L652-K656 PolarHBondContact O-N 2.96Å
653	S	64.2	Low	63.4	Low	58 Å²	58	91.5 Å²	91.5	41%	0.406	45%	0.453	S	S	.	.	H	α-helix	trans	-66.3	-44.6	176.2	60.8	0	0	0	0	111.9	E649 E650 K655 K656 E657	E649-S653 PolarHBondContact O-N 2.86Å; E649-S653 PolarHBondContact O-OG 3.08Å; E650-S653 WeakPolarHBondContact CA-OG 3.44Å; E650-S653 PolarHBondContact O-OG 3.11Å; S653-K655 VanDerWaalsContact C-N 3.32Å; S653-K655 PolarHBondContact O-N 2.8Å; S653-K656 PolarHBondContact O-N 3.02Å; S653-E657 PolarHBondContact O-N 3.13Å
654	Q	62.6	Low	61.5	Low	97 Å²	97	95.9 Å²	95.9	45%	0.453	48%	0.481	S	S	.	.	H	α-helix	trans	-62.1	-38.6	174.6	-73.5	176.7	13.6	0	0	112.3	E650 E657 S658	E650-Q654 WeakPolarHBondContact O-CB 3.3Å; E650-Q654 VanDerWaalsContact O-CG 3.29Å; E650-Q654 WeakPolarHBondContact O-CG 3.25Å; E650-Q654 PolarHBondContact O-N 3.34Å; Q654-E657 PolarHBondContact O-N 2.89Å; Q654-S658 WeakPolarHBondContact O-CB 3.41Å; Q654-S658 PolarHBondContact O-N 3.44Å; Q654-S658 PolarHBondContact O-OG 3.06Å
655	K	61.7	Low	60	Low	125 Å²	125	98.6 Å²	98.6	54%	0.543	50%	0.495	S	S	.	.	H	α-helix	trans	-61.2	-49.7	174	-82.7	-177.9	178.4	-172.1	0	111.8	K651 L652 S653 E657 S658 E659	K651-K655 WeakPolarHBondContact O-CB 2.91Å; K651-K655 VanDerWaalsContact O-CG 3.31Å; K651-K655 WeakPolarHBondContact O-CG 3.35Å; K651-K655 PolarHBondContact O-N 2.92Å; L652-K655 PolarHBondContact O-N 2.93Å; S653-K655 VanDerWaalsContact C-N 3.32Å; S653-K655 PolarHBondContact O-N 2.8Å; K655-E657 VanDerWaalsContact C-N 3.26Å; K655-E657 PolarHBondContact O-N 2.99Å; K655-S658 WeakPolarHBondContact CA-OG 3.46Å; K655-S658 PolarHBondContact O-N 3.13Å; K655-S658 VanDerWaalsContact O-N 3.07Å; K655-S658 PolarHBondContact O-OG 3.22Å; K655-E659 WeakPolarHBondContact O-CB 3.48Å; K655-E659 WeakPolarHBondContact O-CG 3.21Å; K655-E659 PolarHBondContact O-N 3.3Å
656	K	60.3	Low	58.5	Low	95 Å²	95	102.1 Å²	102.1	41%	0.413	51%	0.505	S	S	.	.	H	α-helix	trans	-57.9	-37.8	176.7	-74	-178.4	179.3	-179.9	0	112.2	L652 S653 K660 E881	L652-K656 WeakPolarHBondContact O-CG 3.33Å; L652-K656 PolarHBondContact O-N 2.96Å; S653-K656 PolarHBondContact O-N 3.02Å; K656-K660 WeakPolarHBondContact O-CG 3.46Å; K656-K660 PolarHBondContact O-N 3.04Å; K656-E881 IonicContact NZ-OE1 2.88Å; K656-E881 PolarHBondContact NZ-OE1 3.34Å; K656-E881 IonicContact NZ-OE2 2.84Å; K656-E881 PolarHBondContact NZ-OE2 3.4Å
657	E	56.4	Low	57.5	Low	104 Å²	104	104.4 Å²	104.4	49%	0.486	53%	0.527	S	S	.	.	H	α-helix	trans	-69.9	-40.7	174.1	-74.1	-173.9	-175.8	0	0	112.8	S653 Q654 K655 K660 R661	S653-E657 PolarHBondContact O-N 3.13Å; Q654-E657 PolarHBondContact O-N 2.89Å; K655-E657 VanDerWaalsContact C-N 3.26Å; K655-E657 PolarHBondContact O-N 2.99Å; E657-K660 PolarHBondContact O-N 2.88Å; E657-R661 WeakPolarHBondContact O-CG 3.46Å; E657-R661 PolarHBondContact O-N 3.42Å; E657-R661 IonicContact OE2-NH2 3.06Å; E657-R661 PolarHBondContact OE2-NH2 3.12Å
658	S	55.1	Low	56.7	Low	51 Å²	51	109.1 Å²	109.1	36%	0.357	55%	0.553	S	S	.	*	H	α-helix	trans	-68.2	-35	177.7	70.6	0	0	0	0	112.9	Q654 K655 R661 N662	Q654-S658 WeakPolarHBondContact O-CB 3.41Å; Q654-S658 PolarHBondContact O-N 3.44Å; Q654-S658 PolarHBondContact O-OG 3.06Å; K655-S658 WeakPolarHBondContact CA-OG 3.46Å; K655-S658 PolarHBondContact O-N 3.13Å; K655-S658 VanDerWaalsContact O-N 3.07Å; K655-S658 PolarHBondContact O-OG 3.22Å; S658-R661 PolarHBondContact O-N 3.03Å; S658-R661 VanDerWaalsContact O-N 3.11Å; S658-N662 PolarHBondContact O-N 2.87Å
659	E	54.5	Low	55.7	Low	134 Å²	134	108 Å²	108	63%	0.626	55%	0.55	S	S	*	*	H	α-helix	trans	-67.4	-36.3	175.8	-75.7	172.5	179.9	0	0	111.4	K655 R661	K655-E659 WeakPolarHBondContact O-CB 3.48Å; K655-E659 WeakPolarHBondContact O-CG 3.21Å; K655-E659 PolarHBondContact O-N 3.3Å; E659-R661 VanDerWaalsContact C-N 3.27Å; E659-R661 PolarHBondContact O-N 2.99Å
660	K	54.9	Low	55.1	Low	189 Å²	189	110 Å²	110	82%	0.822	57%	0.569	S	S	*	*	H	α-helix	trans	-65.7	-27.4	170.2	-75.1	-177.4	177.4	-172.6	0	113.4	K656 E657	K656-K660 WeakPolarHBondContact O-CG 3.46Å; K656-K660 PolarHBondContact O-N 3.04Å; E657-K660 PolarHBondContact O-N 2.88Å
661	R	50.3	Low	54.4	Low	134 Å²	134	113.3 Å²	113.3	51%	0.506	59%	0.587	S	S	.	*	H	α-helix	trans	-84.7	-25.5	-179	-70.1	174.9	-165.1	178.9	10.4	113.3	E657 S658 E659 V663	E657-R661 WeakPolarHBondContact O-CG 3.46Å; E657-R661 PolarHBondContact O-N 3.42Å; E657-R661 IonicContact OE2-NH2 3.06Å; E657-R661 PolarHBondContact OE2-NH2 3.12Å; S658-R661 PolarHBondContact O-N 3.03Å; S658-R661 VanDerWaalsContact O-N 3.11Å; E659-R661 VanDerWaalsContact C-N 3.27Å; E659-R661 PolarHBondContact O-N 2.99Å; R661-V663 PolarHBondContact O-N 3.38Å
662	N	41.9	Very low	53.1	Low	108 Å²	108	111.4 Å²	111.4	58%	0.578	59%	0.591	S	S	*	*			trans	-76.8	96.5	176.2	-74.5	-20.9	0	0	0	109.7	S658 T664	S658-N662 PolarHBondContact O-N 2.87Å; N662-T664 VanDerWaalsContact C-N 3.25Å; N662-T664 HydrophobicContact CB-CG2 4.45Å; N662-T664 PolarHBondContact O-N 3.47Å
663	V	44.3	Very low	52.2	Low	131 Å²	131	113.8 Å²	113.8	79%	0.794	60%	0.598	S	S	*	*			trans	-62.6	95	159.5	-177.9	0	0	0	0	106.8	R661 V665	R661-V663 PolarHBondContact O-N 3.38Å; V663-V665 HydrophobicContact CG1-CG2 4.09Å; V663-V665 PolarHBondContact O-N 2.73Å
664	T	39.9	Very low	51	Low	110 Å²	110	119.5 Å²	119.5	68%	0.675	62%	0.62	S	S	*	*			trans	-80.1	93.1	174.9	38.4	0	0	0	0	107.4	N662 Q666	N662-T664 VanDerWaalsContact C-N 3.25Å; N662-T664 HydrophobicContact CB-CG2 4.45Å; N662-T664 PolarHBondContact O-N 3.47Å; T664-Q666 PolarHBondContact O-N 3.07Å
665	V	46.2	Very low	50.1	Low	111 Å²	111	124 Å²	124	67%	0.673	64%	0.641	S	S	*	*			trans	-78.4	111.8	163.5	-176.1	0	0	0	0	106.3	V663 D669	V663-V665 HydrophobicContact CG1-CG2 4.09Å; V663-V665 PolarHBondContact O-N 2.73Å; V665-D669 WeakPolarHBondContact CA-OD2 3.48Å; V665-D669 HydrophobicContact CG1-CB 4.18Å
666	Q	43.9	Very low	49.2	Very low	115 Å²	115	125.2 Å²	125.2	54%	0.537	65%	0.653	S	S	.	*			trans	-71.1	143.8	174.7	-72.6	-85.1	-11.3	0	0	108.5	T664 D668 D669	T664-Q666 PolarHBondContact O-N 3.07Å; Q666-D668 PolarHBondContact O-N 3.37Å; Q666-D668 VanDerWaalsContact O-N 3.1Å; Q666-D669 PolarHBondContact N-OD2 2.71Å; Q666-D669 VanDerWaalsContact O-CB 3.32Å; Q666-D669 WeakPolarHBondContact O-CB 3.25Å; Q666-D669 PolarHBondContact O-N 3.19Å
667	P	53.7	Low	48.1	Very low	123 Å²	123	123.3 Å²	123.3	80%	0.799	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-18.3	177.7	22.5	-30.9	0	0	0	113.7
668	D	54.3	Low	47.2	Very low	147 Å²	147	122.1 Å²	122.1	79%	0.786	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	0.8	175.1	-62.3	-37.4	0	0	0	113.4	Q666	Q666-D668 PolarHBondContact O-N 3.37Å; Q666-D668 VanDerWaalsContact O-N 3.1Å
669	D	53	Low	46.6	Very low	83 Å²	83	129.1 Å²	129.1	44%	0.444	68%	0.681	S	S	.	*	S	Bend	trans	-63.2	130.4	175.2	-77.5	-25.5	0	0	0	109.6	V665 Q666 I671	V665-D669 WeakPolarHBondContact CA-OD2 3.48Å; V665-D669 HydrophobicContact CG1-CB 4.18Å; Q666-D669 PolarHBondContact N-OD2 2.71Å; Q666-D669 VanDerWaalsContact O-CB 3.32Å; Q666-D669 WeakPolarHBondContact O-CB 3.25Å; Q666-D669 PolarHBondContact O-N 3.19Å; D669-I671 PolarHBondContact O-N 3.44Å
670	P	54.8	Low	45.7	Very low	108 Å²	108	130.4 Å²	130.4	70%	0.701	69%	0.692	S	S	*	*			trans	-62.3	134.3	-172	23.8	-32.9	0	0	0	111.3	S672	P670-S672 PolarHBondContact O-N 3.31Å; P670-S672 PolarHBondContact O-OG 2.98Å
671	I	54.3	Low	44.7	Very low	139 Å²	139	129 Å²	129	71%	0.713	69%	0.688	S	S	*	*			trans	-59.3	110.1	172.7	-58.9	174.1	0	0	0	108.2	D669 F673	D669-I671 PolarHBondContact O-N 3.44Å; I671-F673 HydrophobicContact CB-CE2 4.4Å; I671-F673 HydrophobicContact CG2-CE2 4.3Å; I671-F673 HydrophobicContact CG2-CZ 4.33Å; I671-F673 VanDerWaalsContact O-CD2 3.3Å; I671-F673 WeakPolarHBondContact O-CD2 3.15Å; I671-F673 PolarHBondContact O-N 3.23Å; I671-F673 VanDerWaalsContact O-N 3.16Å
672	S	42	Very low	43.7	Very low	93 Å²	93	128.8 Å²	128.8	65%	0.65	70%	0.695	S	S	*	*			trans	-76	103.4	-177.3	-27.3	0	0	0	0	109.6	P670 M674	P670-S672 PolarHBondContact O-N 3.31Å; P670-S672 PolarHBondContact O-OG 2.98Å; S672-M674 PolarHBondContact O-N 3.22Å
673	F	47.9	Very low	43.3	Very low	135 Å²	135	131.9 Å²	131.9	59%	0.592	71%	0.712	S	S	*	*			trans	-76.7	116.6	171.6	-67.6	-86.4	0	0	0	109.2	I671 Q675 L676 T677	I671-F673 HydrophobicContact CB-CE2 4.4Å; I671-F673 HydrophobicContact CG2-CE2 4.3Å; I671-F673 HydrophobicContact CG2-CZ 4.33Å; I671-F673 VanDerWaalsContact O-CD2 3.3Å; I671-F673 WeakPolarHBondContact O-CD2 3.15Å; I671-F673 PolarHBondContact O-N 3.23Å; I671-F673 VanDerWaalsContact O-N 3.16Å; F673-Q675 PolarHBondContact O-N 3.4Å; F673-L676 HydrophobicContact CB-CB 4.47Å; F673-L676 HydrophobicContact CB-CD1 4.29Å; F673-L676 PolarHBondContact O-N 2.96Å; F673-T677 PolarHBondContact O-N 3.09Å; F673-T677 PolarHBondContact O-OG1 3.42Å
674	M	39.1	Very low	42.6	Very low	178 Å²	178	129.8 Å²	129.8	88%	0.877	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.7	-27.4	-176.6	-108.5	-173.5	70.9	0	0	115.2	S672 T677	S672-M674 PolarHBondContact O-N 3.22Å; M674-T677 PolarHBondContact O-OG1 3.5Å
675	Q	44.5	Very low	42.7	Very low	190 Å²	190	129.1 Å²	129.1	89%	0.888	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-12.8	-178.6	-70.8	163.3	-24.3	0	0	113.6	F673	F673-Q675 PolarHBondContact O-N 3.4Å
676	L	42.2	Very low	42.2	Very low	151 Å²	151	129.9 Å²	129.9	79%	0.791	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.4	-7.1	-172.5	-69.2	169.5	0	0	0	113.6	F673	F673-L676 HydrophobicContact CB-CB 4.47Å; F673-L676 HydrophobicContact CB-CD1 4.29Å; F673-L676 PolarHBondContact O-N 2.96Å
677	T	37.4	Very low	42.2	Very low	55 Å²	55	127.4 Å²	127.4	34%	0.337	68%	0.676	S	S	.	*	S	Bend	trans	-76.1	126.6	174.5	25.7	0	0	0	0	111.5	F673 M674	F673-T677 PolarHBondContact O-N 3.09Å; F673-T677 PolarHBondContact O-OG1 3.42Å; M674-T677 PolarHBondContact O-OG1 3.5Å
678	A	37.8	Very low	41.7	Very low	79 Å²	79	125.4 Å²	125.4	65%	0.653	66%	0.656	S	S	*	*			trans	-60.2	141	169.9	0	0	0	0	0	109.9	N680 E681	A678-N680 PolarHBondContact O-N 2.88Å; A678-E681 PolarHBondContact O-N 2.84Å
679	K	42	Very low	41	Very low	199 Å²	199	122.7 Å²	122.7	87%	0.865	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53	-8.5	-174.6	-84.4	-179.1	172.3	-179.9	0	116.3
680	N	34.8	Very low	40.4	Very low	161 Å²	161	124.3 Å²	124.3	86%	0.861	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-7.9	-179.1	-78	0.4	0	0	0	115	A678	A678-N680 PolarHBondContact O-N 2.88Å
681	E	33.7	Very low	39.8	Very low	158 Å²	158	123.3 Å²	123.3	74%	0.738	63%	0.63	S	S	*	*			trans	-112.6	42.2	176.3	-73.1	-171.1	159.6	0	0	112.5	A678 N683	A678-E681 PolarHBondContact O-N 2.84Å; E681-N683 VanDerWaalsContact C-N 3.33Å; E681-N683 PolarHBondContact O-N 3.39Å; E681-N683 VanDerWaalsContact O-N 3.11Å
682	M	31.1	Very low	39.1	Very low	130 Å²	130	119.1 Å²	119.1	64%	0.64	61%	0.614	S	S	*	*			trans	-86.1	77	173.8	-153.6	139.8	77.1	0	0	110.5	C684	M682-C684 HydrophobicContact CG-CB 3.83Å; M682-C684 PolarHBondContact O-N 3.48Å; M682-C684 VanDerWaalsContact O-N 3.12Å
683	N	33.1	Very low	38.9	Very low	174 Å²	174	119 Å²	119	93%	0.93	61%	0.605	S	S	*	*			trans	-72.6	17.7	159.5	-97.1	-7.8	0	0	0	112.3	E681 K685	E681-N683 VanDerWaalsContact C-N 3.33Å; E681-N683 PolarHBondContact O-N 3.39Å; E681-N683 VanDerWaalsContact O-N 3.11Å; N683-K685 PolarHBondContact O-N 3.43Å
684	C	29.9	Very low	38.5	Very low	86 Å²	86	116.1 Å²	116.1	58%	0.581	60%	0.596	S	S	*	*	S	Bend	trans	-89.7	101.8	167.4	-149.5	0	0	0	0	107.3	M682 E686	M682-C684 HydrophobicContact CG-CB 3.83Å; M682-C684 PolarHBondContact O-N 3.48Å; M682-C684 VanDerWaalsContact O-N 3.12Å; C684-E686 PolarHBondContact O-N 3.4Å; C684-E686 VanDerWaalsContact O-N 3.08Å
685	K	40.7	Very low	38.7	Very low	97 Å²	97	110.3 Å²	110.3	42%	0.422	58%	0.576	S	S	.	*			trans	7.5	89.2	173	-62	-169.1	-177.5	-176.5	0	112.5	V269 T270 N683 D687	V269-K685 PolarHBondContact O-NZ 2.87Å; T270-K685 VanDerWaalsContact C-NZ 3.33Å; T270-K685 HydrophobicContact CG2-CD 3.88Å; T270-K685 WeakPolarHBondContact O-CD 3.33Å; T270-K685 PolarHBondContact O-NZ 3.23Å; N683-K685 PolarHBondContact O-N 3.43Å; K685-D687 PolarHBondContact O-N 3.29Å
686	E	36.7	Very low	38.3	Very low	127 Å²	127	105.6 Å²	105.6	59%	0.593	57%	0.57	S	S	*	*			trans	-45.7	137.6	170.9	-69.2	178.5	143.1	0	0	108.8	C684 Q688 L691	C684-E686 PolarHBondContact O-N 3.4Å; C684-E686 VanDerWaalsContact O-N 3.08Å; E686-Q688 VanDerWaalsContact C-N 3.32Å; E686-Q688 PolarHBondContact O-N 3Å; E686-L691 HydrophobicContact CB-CD1 3.63Å; E686-L691 HydrophobicContact CG-CD1 4.36Å; E686-L691 WeakPolarHBondContact OE2-CD1 3.42Å
687	D	44.3	Very low	37.9	Very low	63 Å²	63	105 Å²	105	34%	0.337	57%	0.565	S	S	.	*			trans	-55.8	93.8	-177.4	-161.7	-19.6	0	0	0	108.4	Y232 K685 F689 Q690 L691	Y232-D687 WeakPolarHBondContact CE1-OD1 3.39Å; Y232-D687 WeakPolarHBondContact OH-CA 3.34Å; Y232-D687 PolarHBondContact OH-OD1 3.42Å; K685-D687 PolarHBondContact O-N 3.29Å; D687-F689 PolarHBondContact O-N 2.8Å; D687-Q690 HydrophobicContact CB-CB 3.82Å; D687-Q690 CarbonylContact O-C 3.59Å; D687-Q690 WeakPolarHBondContact O-CA 3.43Å; D687-Q690 WeakPolarHBondContact O-CB 3.27Å; D687-Q690 PolarHBondContact O-N 3.15Å; D687-L691 PolarHBondContact O-N 3.33Å
688	Q	43.1	Very low	37.6	Very low	80 Å²	80	103.6 Å²	103.6	37%	0.374	56%	0.561	S	S	.	*	H	α-helix	trans	-56.4	-25.8	-174	-82.9	-175	-0.3	0	0	111.1	Y232 T270 E686 S692	Y232-Q688 PolarHBondContact OH-N 2.89Å; T270-Q688 PolarHBondContact OG1-OE1 2.85Å; E686-Q688 VanDerWaalsContact C-N 3.32Å; E686-Q688 PolarHBondContact O-N 3Å; Q688-S692 VanDerWaalsContact O-CB 3.24Å; Q688-S692 WeakPolarHBondContact O-CB 3.4Å; Q688-S692 PolarHBondContact O-N 2.86Å; Q688-S692 PolarHBondContact O-OG 3.47Å; Q688-S692 VanDerWaalsContact O-OG 3.09Å
689	F	38.5	Very low	37.5	Very low	91 Å²	91	104 Å²	104	40%	0.399	55%	0.552	S	S	.	*	H	α-helix	trans	-70.8	-40.8	172.9	-172.2	-97.8	0	0	0	112.3	D687 S692 L693	D687-F689 PolarHBondContact O-N 2.8Å; F689-S692 WeakPolarHBondContact CA-OG 3.44Å; F689-S692 PolarHBondContact O-OG 3.22Å; F689-L693 WeakPolarHBondContact O-CB 3.38Å; F689-L693 PolarHBondContact O-N 3.02Å
690	Q	40.4	Very low	37.1	Very low	116 Å²	116	100.8 Å²	100.8	54%	0.542	55%	0.549	S	S	.	.	H	α-helix	trans	-70	-36.2	174.5	-157.5	173.6	10.7	0	0	111.3	D687 L693 L694	D687-Q690 HydrophobicContact CB-CB 3.82Å; D687-Q690 CarbonylContact O-C 3.59Å; D687-Q690 WeakPolarHBondContact O-CA 3.43Å; D687-Q690 WeakPolarHBondContact O-CB 3.27Å; D687-Q690 PolarHBondContact O-N 3.15Å; Q690-L693 PolarHBondContact O-N 3.3Å; Q690-L694 HydrophobicContact CG-CD1 4.31Å; Q690-L694 VanDerWaalsContact O-CB 3.26Å; Q690-L694 WeakPolarHBondContact O-CB 3.45Å; Q690-L694 WeakPolarHBondContact O-CD1 3.32Å; Q690-L694 WeakPolarHBondContact O-CG 3.26Å; Q690-L694 PolarHBondContact O-N 2.78Å
691	L	42.8	Very low	37.4	Very low	87 Å²	87	100.1 Å²	100.1	46%	0.455	54%	0.541	S	S	.	.	H	α-helix	trans	-68.7	-39.8	175.3	-126.3	133.4	0	0	0	112.1	E686 D687 A695	E686-L691 HydrophobicContact CB-CD1 3.63Å; E686-L691 HydrophobicContact CG-CD1 4.36Å; E686-L691 WeakPolarHBondContact OE2-CD1 3.42Å; D687-L691 PolarHBondContact O-N 3.33Å; L691-A695 VanDerWaalsContact O-CB 3.23Å; L691-A695 WeakPolarHBondContact O-CB 3.46Å; L691-A695 PolarHBondContact O-N 2.93Å
692	S	39.7	Very low	37.4	Very low	51 Å²	51	100.4 Å²	100.4	36%	0.357	54%	0.535	S	S	.	.	H	α-helix	trans	-71.5	-35.4	174.1	68.1	0	0	0	0	112.1	Q688 F689 A695 A696	Q688-S692 VanDerWaalsContact O-CB 3.24Å; Q688-S692 WeakPolarHBondContact O-CB 3.4Å; Q688-S692 PolarHBondContact O-N 2.86Å; Q688-S692 PolarHBondContact O-OG 3.47Å; Q688-S692 VanDerWaalsContact O-OG 3.09Å; F689-S692 WeakPolarHBondContact CA-OG 3.44Å; F689-S692 PolarHBondContact O-OG 3.22Å; S692-A695 PolarHBondContact O-N 2.8Å; S692-A696 WeakPolarHBondContact O-CB 3.26Å; S692-A696 PolarHBondContact O-N 3.1Å
693	L	36.4	Very low	37.5	Very low	90 Å²	90	103.6 Å²	103.6	47%	0.471	55%	0.545	S	S	.	.	H	α-helix	trans	-66	-43	172.4	-165.6	83.2	0	0	0	111.2	F689 Q690 A696 M697	F689-L693 WeakPolarHBondContact O-CB 3.38Å; F689-L693 PolarHBondContact O-N 3.02Å; Q690-L693 PolarHBondContact O-N 3.3Å; L693-A696 PolarHBondContact O-N 3.38Å; L693-M697 HydrophobicContact CG-SD 4.47Å; L693-M697 WeakPolarHBondContact O-CB 3.41Å; L693-M697 WeakPolarHBondContact O-CG 3.46Å; L693-M697 PolarHBondContact O-N 2.94Å
694	L	40.5	Very low	37.4	Very low	76 Å²	76	104.3 Å²	104.3	40%	0.398	54%	0.543	S	S	.	.	H	α-helix	trans	-66.4	-37.7	175.4	-75.1	164.9	0	0	0	112	Q690 M697 G698 N699	Q690-L694 HydrophobicContact CG-CD1 4.31Å; Q690-L694 VanDerWaalsContact O-CB 3.26Å; Q690-L694 WeakPolarHBondContact O-CB 3.45Å; Q690-L694 WeakPolarHBondContact O-CD1 3.32Å; Q690-L694 WeakPolarHBondContact O-CG 3.26Å; Q690-L694 PolarHBondContact O-N 2.78Å; L694-M697 CarbonylContact O-C 3.5Å; L694-M697 PolarHBondContact O-N 2.88Å; L694-G698 PolarHBondContact O-N 2.84Å; L694-N699 PolarHBondContact O-N 3.07Å
695	A	42.7	Very low	37.4	Very low	55 Å²	55	103.8 Å²	103.8	46%	0.455	55%	0.545	S	S	.	.	H	α-helix	trans	-68	-40.2	173	0	0	0	0	0	112.1	L691 S692 M697 G698	L691-A695 VanDerWaalsContact O-CB 3.23Å; L691-A695 WeakPolarHBondContact O-CB 3.46Å; L691-A695 PolarHBondContact O-N 2.93Å; S692-A695 PolarHBondContact O-N 2.8Å; A695-M697 PolarHBondContact O-N 3.47Å; A695-G698 PolarHBondContact O-N 3.26Å
696	A	35.8	Very low	37	Very low	92 Å²	92	104 Å²	104	76%	0.76	57%	0.565	S	S	*	*	H	α-helix	trans	-68.2	-23.8	174	0	0	0	0	0	112.7	S692 L693 G698	S692-A696 WeakPolarHBondContact O-CB 3.26Å; S692-A696 PolarHBondContact O-N 3.1Å; L693-A696 PolarHBondContact O-N 3.38Å; A696-G698 VanDerWaalsContact C-N 3.3Å
697	M	34.3	Very low	36.9	Very low	139 Å²	139	102.8 Å²	102.8	69%	0.685	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	5.1	169.5	-68.4	179.1	71.7	0	0	113.3	L693 L694 A695	L693-M697 HydrophobicContact CG-SD 4.47Å; L693-M697 WeakPolarHBondContact O-CB 3.41Å; L693-M697 WeakPolarHBondContact O-CG 3.46Å; L693-M697 PolarHBondContact O-N 2.94Å; L694-M697 CarbonylContact O-C 3.5Å; L694-M697 PolarHBondContact O-N 2.88Å; A695-M697 PolarHBondContact O-N 3.47Å
698	G	32.4	Very low	36.7	Very low	25 Å²	25	103.5 Å²	103.5	26%	0.258	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	84.5	8.9	172.9	0	0	0	0	0	116.1	L694 A695 A696 T700	L694-G698 PolarHBondContact O-N 2.84Å; A695-G698 PolarHBondContact O-N 3.26Å; A696-G698 VanDerWaalsContact C-N 3.3Å; G698-T700 PolarHBondContact O-N 2.96Å
699	N	34.2	Very low	36.4	Very low	86 Å²	86	105.8 Å²	105.8	46%	0.46	58%	0.584	S	S	.	*			trans	-92.8	82.5	177.8	-81.7	-11.8	0	0	0	111.4	L694 Q701	L694-N699 PolarHBondContact O-N 3.07Å; N699-Q701 PolarHBondContact O-N 3.21Å
700	T	33.8	Very low	36.3	Very low	132 Å²	132	103.7 Å²	103.7	81%	0.81	58%	0.584	S	S	*	*			trans	-79	95.5	164.6	34.2	0	0	0	0	109.8	G698	G698-T700 PolarHBondContact O-N 2.96Å
701	Q	41.1	Very low	36.8	Very low	147 Å²	147	100.8 Å²	100.8	69%	0.687	58%	0.576	S	S	*	*			trans	-87.1	118.8	167.7	-73.6	-156.3	-12.2	0	0	111.1	N699	N699-Q701 PolarHBondContact O-N 3.21Å
702	R	33.4	Very low	37	Very low	165 Å²	165	102.1 Å²	102.1	62%	0.623	58%	0.579	S	S	*	*			trans	-60	133.7	153	-73.4	178.4	176.4	169.6	0.8	107.8	E704	R702-E704 VanDerWaalsContact C-N 3.35Å; R702-E704 PolarHBondContact O-N 2.67Å
703	K	34.3	Very low	37.6	Very low	196 Å²	196	105.6 Å²	105.6	85%	0.852	59%	0.592	S	S	*	*	S	Bend	trans	-56.5	99.1	160.6	-79.2	176.8	176.7	175.2	0	107.8
704	E	31.1	Very low	38.5	Very low	190 Å²	190	108.2 Å²	108.2	89%	0.888	61%	0.607	S	S	*	*			trans	162.5	85.8	152	-92.2	172.7	-160.9	0	0	109.9	R702	R702-E704 VanDerWaalsContact C-N 3.35Å; R702-E704 PolarHBondContact O-N 2.67Å
705	A	28.5	Very low	39.7	Very low	75 Å²	75	109 Å²	109	62%	0.62	61%	0.607	S	S	*	*			trans	-171.2	119.4	142	0	0	0	0	0	108.2	D707	A705-D707 PolarHBondContact O-N 2.85Å
706	A	33.3	Very low	41.3	Very low	102 Å²	102	108.9 Å²	108.9	84%	0.843	60%	0.601	S	S	*	*	S	Bend	trans	-59.1	127.8	161.7	0	0	0	0	0	107.9
707	D	34.1	Very low	43.5	Very low	101 Å²	101	106.9 Å²	106.9	54%	0.54	58%	0.579	S	S	.	*			trans	90.4	93.8	172.6	-133.5	-12.6	0	0	0	117.7	A705 L709 A710 S711	A705-D707 PolarHBondContact O-N 2.85Å; D707-L709 PolarHBondContact O-N 2.96Å; D707-A710 HydrophobicContact CB-CB 4.15Å; D707-A710 PolarHBondContact O-N 3.3Å; D707-S711 PolarHBondContact O-N 3.34Å
708	P	41.3	Very low	46.1	Very low	77 Å²	77	104.5 Å²	104.5	50%	0.5	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.9	-18.5	178.3	-20.7	31.8	0	0	0	115.3	K712	P708-K712 WeakPolarHBondContact O-CG 3.43Å
709	L	35.1	Very low	48.7	Very low	128 Å²	128	103.6 Å²	103.6	67%	0.67	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-37.1	177.7	-91.3	116.2	0	0	0	112.4	D707 K712 L713	D707-L709 PolarHBondContact O-N 2.96Å; L709-K712 PolarHBondContact O-N 3.33Å; L709-L713 PolarHBondContact O-N 3Å
710	A	36.6	Very low	51.4	Low	47 Å²	47	99.9 Å²	99.9	39%	0.388	54%	0.536	S	S	.	.	H	α-helix	trans	-68.1	-37.8	179	0	0	0	0	0	112	D707 K712 N714	D707-A710 HydrophobicContact CB-CB 4.15Å; D707-A710 PolarHBondContact O-N 3.3Å; A710-K712 VanDerWaalsContact C-N 3.32Å; A710-K712 PolarHBondContact O-N 2.99Å; A710-N714 PolarHBondContact O-N 3.3Å
711	S	50.5	Low	53.9	Low	55 Å²	55	95 Å²	95	39%	0.385	51%	0.512	S	S	.	.	H	α-helix	trans	-68.2	-27.3	177.5	178.4	0	0	0	0	113.8	D707	D707-S711 PolarHBondContact O-N 3.34Å
712	K	48.7	Very low	55.9	Low	115 Å²	115	94.5 Å²	94.5	50%	0.5	51%	0.508	S	S	.	.	H	α-helix	trans	-77	-41	178.7	-74.5	-178.9	-179.8	-175.6	0	111.4	P708 L709 A710 N714 K715 Y731	P708-K712 WeakPolarHBondContact O-CG 3.43Å; L709-K712 PolarHBondContact O-N 3.33Å; A710-K712 VanDerWaalsContact C-N 3.32Å; A710-K712 PolarHBondContact O-N 2.99Å; K712-N714 VanDerWaalsContact C-N 3.33Å; K712-N714 PolarHBondContact O-N 2.87Å; K712-K715 PolarHBondContact O-N 3.43Å; K712-Y731 HydrophobicContact CB-CE2 4.4Å; K712-Y731 VanDerWaalsContact O-CE2 3.27Å; K712-Y731 WeakPolarHBondContact O-CE2 3.38Å
713	L	51.3	Low	58.3	Low	124 Å²	124	92.4 Å²	92.4	65%	0.649	52%	0.518	S	S	*	.	H	α-helix	trans	-70.3	-27.8	179.9	-68.9	168.1	0	0	0	113	L709 K715 V716	L709-L713 PolarHBondContact O-N 3Å; L713-K715 PolarHBondContact O-N 3.37Å; L713-V716 PolarHBondContact O-N 3.02Å
714	N	56.5	Low	60.8	Low	146 Å²	146	85.8 Å²	85.8	78%	0.781	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-11.1	174.4	-81.9	-9.4	0	0	0	114.5	A710 K712	A710-N714 PolarHBondContact O-N 3.3Å; K712-N714 VanDerWaalsContact C-N 3.33Å; K712-N714 PolarHBondContact O-N 2.87Å
715	K	63.9	Low	63.4	Low	93 Å²	93	79.2 Å²	79.2	40%	0.404	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	6.4	179.3	-70	-168.2	172.9	-161.1	0	113.9	K712 L713 Y731	K712-K715 PolarHBondContact O-N 3.43Å; L713-K715 PolarHBondContact O-N 3.37Å; K715-Y731 HydrophobicContact CB-CE2 4.36Å
716	V	76.2	Confident	66.3	Low	51 Å²	51	75.6 Å²	75.6	31%	0.309	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	119.5	175.2	-178.3	0	0	0	0	108.8	L713 E729 Y731	L713-V716 PolarHBondContact O-N 3.02Å; V716-E729 HydrophobicContact CG1-CB 3.95Å; V716-E729 HydrophobicContact CG1-CG 4.33Å; V716-Y731 HydrophobicContact CG2-CD2 3.88Å
717	T	82.8	Confident	69.1	Low	51 Å²	51	72 Å²	72	31%	0.313	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.4	175.2	-53.8	0	0	0	0	108.7	L719 A730	T717-L719 HydrophobicContact CG2-CD2 4.34Å; T717-L719 PolarHBondContact O-N 3.25Å; T717-A730 PolarHBondContact N-O 3.47Å; T717-A730 PolarHBondContact O-N 3.39Å
718	Q	89.3	Confident	71.8	Confident	88 Å²	88	67.2 Å²	67.2	41%	0.411	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	125.2	172.7	-179.6	174.5	1.8	0	0	109.7	T720 Y727	Q718-T720 WeakPolarHBondContact CG-O 3.27Å; Q718-T720 PolarHBondContact NE2-O 3.1Å; Q718-Y727 HydrophobicContact CG-CE2 4.26Å
719	L	87.7	Confident	74.1	Confident	7 Å²	7	66.5 Å²	66.5	4%	0.037	37%	0.366	C	S	.	.			trans	-99.8	-31	-177.1	-59.2	-177.2	0	0	0	113.3	T717 A728 A730 V743 L819 S820 I822	T717-L719 HydrophobicContact CG2-CD2 4.34Å; T717-L719 PolarHBondContact O-N 3.25Å; L719-A728 HydrophobicContact CB-CB 4.21Å; L719-A728 WeakPolarHBondContact CB-O 3.46Å; L719-A728 PolarHBondContact N-O 2.93Å; L719-A730 HydrophobicContact CD1-CB 3.65Å; L719-A730 HydrophobicContact CD2-CB 4.2Å; L719-A730 HydrophobicContact CG-CB 3.95Å; L719-V743 HydrophobicContact CD1-CG1 4.03Å; L719-L819 HydrophobicContact CB-CB 4.26Å; L719-L819 HydrophobicContact CB-CD2 3.95Å; L719-L819 HydrophobicContact CD1-CD1 4.22Å; L719-L819 HydrophobicContact CD1-CD2 4.43Å; L719-S820 WeakPolarHBondContact CD2-O 3.49Å; L719-S820 WeakPolarHBondContact O-CB 3.4Å; L719-S820 PolarHBondContact O-N 3.24Å; L719-I822 HydrophobicContact CD1-CD1 4.41Å; L719-I822 HydrophobicContact CD2-CD1 3.81Å; L719-I822 HydrophobicContact CD2-CG1 3.51Å
720	T	90.2	Very high	76.7	Confident	7 Å²	7	60.5 Å²	60.5	4%	0.043	33%	0.334	C	S	.	.	S	Bend	trans	-130.1	158.4	177.5	65.6	0	0	0	0	111.8	Q718 D724 V726 Y727 A728 V817 L819	Q718-T720 WeakPolarHBondContact CG-O 3.27Å; Q718-T720 PolarHBondContact NE2-O 3.1Å; T720-D724 WeakPolarHBondContact CB-OD2 3.19Å; T720-V726 PolarHBondContact OG1-O 3.38Å; T720-Y727 WeakPolarHBondContact OG1-CA 3.31Å; T720-A728 HydrophobicContact CG2-CB 4.16Å; T720-A728 PolarHBondContact N-O 2.95Å; T720-A728 PolarHBondContact OG1-N 3.03Å; T720-V817 HydrophobicContact CG2-CG1 3.53Å; T720-L819 HydrophobicContact CG2-CD2 3.44Å; T720-L819 VanDerWaalsContact CG2-CD2 3.44Å
721	G	85.5	Confident	79	Confident	30 Å²	30	60.5 Å²	60.5	31%	0.309	32%	0.324	S	S	.	.			trans	-75.3	159.5	179	0	0	0	0	0	112.2	S723 D724	G721-S723 PolarHBondContact O-N 2.9Å; G721-S723 VanDerWaalsContact O-N 3.13Å; G721-D724 PolarHBondContact N-OD2 2.85Å; G721-D724 PolarHBondContact O-N 3.37Å
722	F	83	Confident	80.5	Confident	137 Å²	137	58.9 Å²	58.9	60%	0.601	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-6.8	173.1	-64	-72.4	0	0	0	114	Y727 Q748	F722-Y727 AromaticContact CD1-CD2 3.99Å; F722-Y727 HydrophobicContact CD1-CD2 3.99Å; F722-Y727 AromaticContact CD1-CE2 3.73Å; F722-Y727 HydrophobicContact CD1-CE2 3.73Å; F722-Y727 HydrophobicContact CE1-CD2 4.17Å; F722-Y727 AromaticContact CE1-CE2 3.48Å; F722-Y727 HydrophobicContact CE1-CE2 3.48Å; F722-Y727 VanDerWaalsContact CE1-CE2 3.48Å; F722-Y727 AromaticContact CE1-CZ 3.75Å; F722-Y727 HydrophobicContact CG-CE2 4.48Å; F722-Y727 HydrophobicContact CZ-CE2 4.05Å; F722-Q748 PolarHBondContact O-OE1 3.4Å
723	S	83.7	Confident	82	Confident	120 Å²	120	56.8 Å²	56.8	84%	0.839	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-7.1	178.1	-54.8	0	0	0	0	112.6	G721	G721-S723 PolarHBondContact O-N 2.9Å; G721-S723 VanDerWaalsContact O-N 3.13Å
724	D	88.4	Confident	82.9	Confident	58 Å²	58	52.7 Å²	52.7	31%	0.31	28%	0.284	S	S	.	.	S	Bend	trans	-81.2	146	-178.8	-65.2	-37.5	0	0	0	110.3	T720 G721 V726 Q748 V817	T720-D724 WeakPolarHBondContact CB-OD2 3.19Å; G721-D724 PolarHBondContact N-OD2 2.85Å; G721-D724 PolarHBondContact O-N 3.37Å; D724-V726 PolarHBondContact O-N 3.17Å; D724-Q748 PolarHBondContact O-OE1 3.33Å; D724-Q748 VanDerWaalsContact O-OE1 3.11Å; D724-V817 HydrophobicContact CB-CG1 4.38Å
725	P	85.6	Confident	83.6	Confident	51 Å²	51	49.3 Å²	49.3	33%	0.331	27%	0.266	S	S	.	.	S	Bend	trans	-56.3	-28.4	179.8	-26.5	34.6	0	0	0	114.1	Q748 T749 Y805	P725-Q748 PolarHBondContact O-N 2.77Å; P725-T749 HydrophobicContact CB-CG2 3.72Å; P725-Y805 VanDerWaalsContact CB-OH 3.32Å; P725-Y805 WeakPolarHBondContact CB-OH 3.11Å
726	V	88.6	Confident	83.9	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	119.4	176.6	-177.9	0	0	0	0	108.7	T720 D724 V745 V746 L753 I803 Y805	T720-V726 PolarHBondContact OG1-O 3.38Å; D724-V726 PolarHBondContact O-N 3.17Å; V726-V745 HydrophobicContact CG1-CG1 3.32Å; V726-V746 WeakPolarHBondContact CA-O 3.41Å; V726-L753 HydrophobicContact CG2-CD1 3.45Å; V726-L753 VanDerWaalsContact CG2-CD1 3.45Å; V726-I803 HydrophobicContact CG1-CD1 4.09Å; V726-I803 HydrophobicContact CG1-CG2 4.36Å; V726-Y805 HydrophobicContact CG2-CD1 3.83Å; V726-Y805 HydrophobicContact CG2-CE1 3.63Å
727	Y	91.7	Very high	83.7	Confident	27 Å²	27	53.8 Å²	53.8	11%	0.106	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	134.1	173.9	176.8	-101.2	0	0	0	110.5	Q718 T720 F722 E729 V745 V746	Q718-Y727 HydrophobicContact CG-CE2 4.26Å; T720-Y727 WeakPolarHBondContact OG1-CA 3.31Å; F722-Y727 AromaticContact CD1-CD2 3.99Å; F722-Y727 HydrophobicContact CD1-CD2 3.99Å; F722-Y727 AromaticContact CD1-CE2 3.73Å; F722-Y727 HydrophobicContact CD1-CE2 3.73Å; F722-Y727 HydrophobicContact CE1-CD2 4.17Å; F722-Y727 AromaticContact CE1-CE2 3.48Å; F722-Y727 HydrophobicContact CE1-CE2 3.48Å; F722-Y727 VanDerWaalsContact CE1-CE2 3.48Å; F722-Y727 AromaticContact CE1-CZ 3.75Å; F722-Y727 HydrophobicContact CG-CE2 4.48Å; F722-Y727 HydrophobicContact CZ-CE2 4.05Å; Y727-E729 HydrophobicContact CE1-CB 4.39Å; Y727-E729 HydrophobicContact CE1-CG 4.25Å; Y727-V745 CarbonylContact O-C 3.58Å; Y727-V745 WeakPolarHBondContact O-CA 3.5Å; Y727-V746 HydrophobicContact CD1-CB 4.28Å; Y727-V746 HydrophobicContact CD1-CG2 4.01Å; Y727-V746 PolarHBondContact N-O 2.68Å; Y727-V746 PolarHBondContact O-N 3.36Å
728	A	90.4	Very high	83.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	134.3	178.4	0	0	0	0	0	112.1	L719 T720 V743 L744 I803 L819	L719-A728 HydrophobicContact CB-CB 4.21Å; L719-A728 WeakPolarHBondContact CB-O 3.46Å; L719-A728 PolarHBondContact N-O 2.93Å; T720-A728 HydrophobicContact CG2-CB 4.16Å; T720-A728 PolarHBondContact N-O 2.95Å; T720-A728 PolarHBondContact OG1-N 3.03Å; A728-V743 HydrophobicContact CB-CG1 4.4Å; A728-L744 WeakPolarHBondContact CA-O 3.33Å; A728-I803 HydrophobicContact CB-CD1 3.78Å; A728-L819 HydrophobicContact CB-CD2 4.22Å
729	E	91	Very high	83.1	Confident	62 Å²	62	50.3 Å²	50.3	29%	0.29	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	139.8	170.8	61.8	178.6	-173.7	0	0	109.6	V716 Y727 V743 L744	V716-E729 HydrophobicContact CG1-CB 3.95Å; V716-E729 HydrophobicContact CG1-CG 4.33Å; Y727-E729 HydrophobicContact CE1-CB 4.39Å; Y727-E729 HydrophobicContact CE1-CG 4.25Å; E729-V743 CarbonylContact O-C 3.58Å; E729-V743 WeakPolarHBondContact O-CA 3.3Å; E729-L744 HydrophobicContact CG-CB 3.81Å; E729-L744 HydrophobicContact CG-CD2 3.95Å; E729-L744 HydrophobicContact CG-CG 4.37Å; E729-L744 PolarHBondContact N-O 3.3Å; E729-L744 PolarHBondContact O-N 3.27Å; E729-L744 WeakPolarHBondContact OE1-CD2 3.45Å
730	A	88.4	Confident	83	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.008	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.2	-178.6	0	0	0	0	0	111.4	T717 L719 D742 V743 I822	T717-A730 PolarHBondContact N-O 3.47Å; T717-A730 PolarHBondContact O-N 3.39Å; L719-A730 HydrophobicContact CD1-CB 3.65Å; L719-A730 HydrophobicContact CD2-CB 4.2Å; L719-A730 HydrophobicContact CG-CB 3.95Å; A730-D742 CarbonylContact C-O 3.52Å; A730-D742 WeakPolarHBondContact CA-O 3.44Å; A730-V743 HydrophobicContact CB-CG2 3.98Å; A730-I822 HydrophobicContact CB-CD1 3.87Å
731	Y	85.3	Confident	82.9	Confident	48 Å²	48	51.2 Å²	51.2	19%	0.188	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.2	169.7	-171.4	-74.2	0	0	0	109.1	K712 K715 V716 H733 D742	K712-Y731 HydrophobicContact CB-CE2 4.4Å; K712-Y731 VanDerWaalsContact O-CE2 3.27Å; K712-Y731 WeakPolarHBondContact O-CE2 3.38Å; K715-Y731 HydrophobicContact CB-CE2 4.36Å; V716-Y731 HydrophobicContact CG2-CD2 3.88Å; Y731-H733 AromaticContact CD1-CD2 3.24Å; Y731-H733 WeakPolarHBondContact CD1-CD2 3.48Å; Y731-H733 AromaticContact CD1-CE1 3.92Å; Y731-H733 AromaticContact CD1-CG 3.9Å; Y731-H733 AromaticContact CD1-NE2 3.28Å; Y731-H733 VanDerWaalsContact CD1-NE2 3.28Å; Y731-H733 WeakPolarHBondContact CD1-NE2 3.29Å; Y731-H733 AromaticContact CE1-CD2 3.23Å; Y731-H733 WeakPolarHBondContact CE1-CD2 2.72Å; Y731-H733 AromaticContact CE1-CE1 3.13Å; Y731-H733 WeakPolarHBondContact CE1-CE1 3.49Å; Y731-H733 AromaticContact CE1-CG 3.52Å; Y731-H733 AromaticContact CE1-ND1 3.47Å; Y731-H733 WeakPolarHBondContact CE1-ND1 3.41Å; Y731-H733 AromaticContact CE1-NE2 2.98Å; Y731-H733 WeakPolarHBondContact CE1-NE2 3.13Å; Y731-H733 AromaticContact CZ-CE1 3.78Å; Y731-H733 AromaticContact CZ-NE2 3.86Å; Y731-D742 PolarHBondContact N-O 3.43Å; Y731-D742 PolarHBondContact O-N 3.21Å
732	V	82.3	Confident	83	Confident	21 Å²	21	51.5 Å²	51.5	13%	0.127	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	116.3	-178.1	-170.8	0	0	0	0	110.5	V734 I739 L741 I822	V732-V734 HydrophobicContact CG1-CG2 4.18Å; V732-I739 HydrophobicContact CG1-CG2 3.74Å; V732-L741 HydrophobicContact CB-CD2 4.23Å; V732-L741 HydrophobicContact CG1-CD2 3.95Å; V732-L741 HydrophobicContact CG2-CD2 3.71Å; V732-I822 HydrophobicContact CG2-CG2 3.81Å
733	H	79.3	Confident	83.3	Confident	71 Å²	71	45.1 Å²	45.1	33%	0.329	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	125	169.6	-76.6	-80.3	0	0	0	110.2	Y731 I739 V740	Y731-H733 AromaticContact CD1-CD2 3.24Å; Y731-H733 WeakPolarHBondContact CD1-CD2 3.48Å; Y731-H733 AromaticContact CD1-CE1 3.92Å; Y731-H733 AromaticContact CD1-CG 3.9Å; Y731-H733 AromaticContact CD1-NE2 3.28Å; Y731-H733 VanDerWaalsContact CD1-NE2 3.28Å; Y731-H733 WeakPolarHBondContact CD1-NE2 3.29Å; Y731-H733 AromaticContact CE1-CD2 3.23Å; Y731-H733 WeakPolarHBondContact CE1-CD2 2.72Å; Y731-H733 AromaticContact CE1-CE1 3.13Å; Y731-H733 WeakPolarHBondContact CE1-CE1 3.49Å; Y731-H733 AromaticContact CE1-CG 3.52Å; Y731-H733 AromaticContact CE1-ND1 3.47Å; Y731-H733 WeakPolarHBondContact CE1-ND1 3.41Å; Y731-H733 AromaticContact CE1-NE2 2.98Å; Y731-H733 WeakPolarHBondContact CE1-NE2 3.13Å; Y731-H733 AromaticContact CZ-CE1 3.78Å; Y731-H733 AromaticContact CZ-NE2 3.86Å; H733-I739 CarbonylContact O-C 3.5Å; H733-I739 VanDerWaalsContact O-CA 3.27Å; H733-I739 WeakPolarHBondContact O-CA 3.39Å; H733-V740 HydrophobicContact CB-CB 4.14Å; H733-V740 PolarHBondContact N-O 3.19Å; H733-V740 PolarHBondContact O-N 3.36Å
734	V	71.7	Confident	83.6	Confident	37 Å²	37	41 Å²	41	22%	0.224	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	112.5	177.8	179.3	0	0	0	0	109.3	V732 I739 Y829	V732-V734 HydrophobicContact CG1-CG2 4.18Å; V734-I739 HydrophobicContact CG2-CG1 4.32Å; V734-Y829 HydrophobicContact CG1-CE1 3.48Å; V734-Y829 VanDerWaalsContact CG1-CE1 3.48Å; V734-Y829 VanDerWaalsContact CG1-CZ 3.49Å; V734-Y829 WeakPolarHBondContact CG1-OH 3.49Å
735	N	71.5	Confident	83.8	Confident	76 Å²	76	38.2 Å²	38.2	41%	0.406	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	85.5	179.8	-75.8	-11.5	0	0	0	110.4	Y737 D738	N735-Y737 VanDerWaalsContact C-N 3.29Å; N735-Y737 PolarHBondContact O-N 3.36Å; N735-D738 WeakPolarHBondContact CA-O 3.31Å; N735-D738 PolarHBondContact N-O 3.18Å; N735-D738 PolarHBondContact O-N 3.05Å
736	Q	69.9	Low	84	Confident	119 Å²	119	37.4 Å²	37.4	56%	0.556	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	-79.5	179.5	-63.1	-178.4	-5.1	0	0	114.4	Y829 I900 F901	Q736-Y829 WeakPolarHBondContact O-CE1 3.28Å; Q736-I900 HydrophobicContact CG-CG2 4.47Å; Q736-F901 WeakPolarHBondContact O-CZ 3.39Å
737	Y	71.2	Confident	84.1	Confident	118 Å²	118	37.4 Å²	37.4	46%	0.463	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-18.7	-178.1	-57.9	-81.6	0	0	0	113.8	N735 V791 F901	N735-Y737 VanDerWaalsContact C-N 3.29Å; N735-Y737 PolarHBondContact O-N 3.36Å; Y737-V791 PolarHBondContact O-N 3.49Å; Y737-F901 HydrophobicContact CD1-CD1 4.09Å; Y737-F901 AromaticContact CD1-CE1 3.5Å; Y737-F901 HydrophobicContact CD1-CE1 3.5Å; Y737-F901 VanDerWaalsContact CD1-CE1 3.5Å; Y737-F901 HydrophobicContact CD1-CZ 4.5Å; Y737-F901 AromaticContact CE1-CD1 3.58Å; Y737-F901 HydrophobicContact CE1-CD1 3.58Å; Y737-F901 AromaticContact CE1-CE1 3.47Å; Y737-F901 HydrophobicContact CE1-CE1 3.47Å; Y737-F901 VanDerWaalsContact CE1-CE1 3.47Å; Y737-F901 HydrophobicContact CG-CE1 4.49Å
738	D	78.1	Confident	83.9	Confident	66 Å²	66	39.3 Å²	39.3	35%	0.353	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	126.8	-175.3	-67.8	-38.9	0	0	0	110.5	N735 K790	N735-D738 WeakPolarHBondContact CA-O 3.31Å; N735-D738 PolarHBondContact N-O 3.18Å; N735-D738 PolarHBondContact O-N 3.05Å; D738-K790 WeakPolarHBondContact OD1-CE 3.33Å; D738-K790 WeakPolarHBondContact OD1-CG 3.39Å
739	I	81.9	Confident	83.7	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	119.8	169.4	-58.6	176.8	0	0	0	107.6	V732 H733 V734 L741 L766 V789 V791 I824	V732-I739 HydrophobicContact CG1-CG2 3.74Å; H733-I739 CarbonylContact O-C 3.5Å; H733-I739 VanDerWaalsContact O-CA 3.27Å; H733-I739 WeakPolarHBondContact O-CA 3.39Å; V734-I739 HydrophobicContact CG2-CG1 4.32Å; I739-L741 HydrophobicContact CG2-CD2 4.2Å; I739-L741 HydrophobicContact CG2-CG 4.38Å; I739-L766 HydrophobicContact CD1-CD2 4.27Å; I739-V789 WeakPolarHBondContact CA-O 3.49Å; I739-V789 HydrophobicContact CB-CB 4.25Å; I739-V789 PolarHBondContact N-O 3.19Å; I739-V789 PolarHBondContact O-N 3.01Å; I739-V791 HydrophobicContact CD1-CG2 3.49Å; I739-V791 VanDerWaalsContact CD1-CG2 3.49Å; I739-V791 HydrophobicContact CG1-CG2 3.62Å; I739-I824 HydrophobicContact CD1-CD1 3.29Å; I739-I824 HydrophobicContact CD1-CG1 4.04Å; I739-I824 HydrophobicContact CD1-CG2 3.88Å; I739-I824 HydrophobicContact CG2-CD1 4.46Å
740	V	85.9	Confident	83.5	Confident	33 Å²	33	42.3 Å²	42.3	20%	0.2	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	116.2	175.4	-173.7	0	0	0	0	107.9	H733 N788	H733-V740 HydrophobicContact CB-CB 4.14Å; H733-V740 PolarHBondContact N-O 3.19Å; H733-V740 PolarHBondContact O-N 3.36Å; V740-N788 WeakPolarHBondContact CG2-OD1 3.46Å
741	L	86.4	Confident	83.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	118.9	173.7	-58.7	165.2	0	0	0	107.8	V732 I739 V743 L760 K786 A787 V789 I799 I822	V732-L741 HydrophobicContact CB-CD2 4.23Å; V732-L741 HydrophobicContact CG1-CD2 3.95Å; V732-L741 HydrophobicContact CG2-CD2 3.71Å; I739-L741 HydrophobicContact CG2-CD2 4.2Å; I739-L741 HydrophobicContact CG2-CG 4.38Å; L741-V743 HydrophobicContact CB-CG2 4.44Å; L741-L760 HydrophobicContact CD1-CD1 3.88Å; L741-K786 CarbonylContact O-C 3.52Å; L741-K786 WeakPolarHBondContact O-CA 3.3Å; L741-A787 HydrophobicContact CB-CB 4.34Å; L741-A787 PolarHBondContact N-O 3.08Å; L741-A787 PolarHBondContact O-N 2.92Å; L741-V789 HydrophobicContact CD1-CG2 3.83Å; L741-I799 HydrophobicContact CD1-CD1 3.66Å; L741-I799 HydrophobicContact CD1-CG2 4.17Å; L741-I799 HydrophobicContact CD2-CD1 3.96Å; L741-I799 HydrophobicContact CG-CD1 4.3Å; L741-I822 HydrophobicContact CD2-CD1 4.21Å
742	D	88.6	Confident	83.4	Confident	37 Å²	37	46.7 Å²	46.7	20%	0.198	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	105.9	170.6	-154	-8.8	0	0	0	107.7	A730 Y731 K786	A730-D742 CarbonylContact C-O 3.52Å; A730-D742 WeakPolarHBondContact CA-O 3.44Å; Y731-D742 PolarHBondContact N-O 3.43Å; Y731-D742 PolarHBondContact O-N 3.21Å; D742-K786 WeakPolarHBondContact OD1-CG 3.32Å; D742-K786 WeakPolarHBondContact OD2-CE 3.34Å; D742-K786 IonicContact OD2-NZ 2.71Å
743	V	89.5	Confident	83.6	Confident	2 Å²	2	45.7 Å²	45.7	1%	0.012	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	111.5	-175.9	-173.1	0	0	0	0	108.9	L719 A728 E729 A730 L741 V745 L758 I785	L719-V743 HydrophobicContact CD1-CG1 4.03Å; A728-V743 HydrophobicContact CB-CG1 4.4Å; E729-V743 CarbonylContact O-C 3.58Å; E729-V743 WeakPolarHBondContact O-CA 3.3Å; A730-V743 HydrophobicContact CB-CG2 3.98Å; L741-V743 HydrophobicContact CB-CG2 4.44Å; V743-V745 HydrophobicContact CG1-CG2 4.04Å; V743-L758 HydrophobicContact CB-CD2 3.99Å; V743-L758 HydrophobicContact CG1-CD2 4.23Å; V743-L758 HydrophobicContact CG2-CD2 3.79Å; V743-I785 HydrophobicContact CB-CB 4.48Å; V743-I785 PolarHBondContact N-O 2.91Å; V743-I785 PolarHBondContact O-N 3.27Å
744	L	90.4	Very high	83.8	Confident	33 Å²	33	46.4 Å²	46.4	17%	0.173	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	126.3	168.5	176	71.4	0	0	0	108.2	A728 E729 V746 F782 N784	A728-L744 WeakPolarHBondContact CA-O 3.33Å; E729-L744 HydrophobicContact CG-CB 3.81Å; E729-L744 HydrophobicContact CG-CD2 3.95Å; E729-L744 HydrophobicContact CG-CG 4.37Å; E729-L744 PolarHBondContact N-O 3.3Å; E729-L744 PolarHBondContact O-N 3.27Å; E729-L744 WeakPolarHBondContact OE1-CD2 3.45Å; L744-V746 HydrophobicContact CD1-CG2 4.4Å; L744-V746 HydrophobicContact CD2-CG2 4.08Å; L744-V746 HydrophobicContact CG-CG2 3.97Å; L744-F782 HydrophobicContact CD1-CB 4.09Å; L744-F782 HydrophobicContact CD1-CD2 3.81Å; L744-F782 HydrophobicContact CD1-CG 4.34Å; L744-N784 WeakPolarHBondContact CA-OD1 3.49Å; L744-N784 WeakPolarHBondContact CB-OD1 2.96Å; L744-N784 WeakPolarHBondContact CD1-OD1 3.18Å
745	V	91	Very high	84.4	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.3	175.9	-175.7	0	0	0	0	108.6	V726 Y727 V743 L777 F782 A783 I785 I803	V726-V745 HydrophobicContact CG1-CG1 3.32Å; Y727-V745 CarbonylContact O-C 3.58Å; Y727-V745 WeakPolarHBondContact O-CA 3.5Å; V743-V745 HydrophobicContact CG1-CG2 4.04Å; V745-L777 HydrophobicContact CG1-CD1 3.84Å; V745-F782 CarbonylContact O-C 3.37Å; V745-F782 VanDerWaalsContact O-CA 3.26Å; V745-F782 WeakPolarHBondContact O-CA 3.31Å; V745-A783 PolarHBondContact N-O 3.1Å; V745-A783 PolarHBondContact O-N 2.84Å; V745-I785 HydrophobicContact CG2-CD1 3.75Å; V745-I785 HydrophobicContact CG2-CG1 4.3Å; V745-I803 HydrophobicContact CG1-CD1 4.11Å; V745-I803 HydrophobicContact CG2-CD1 4.07Å
746	V	91.3	Very high	85.1	Confident	34 Å²	34	45 Å²	45	21%	0.206	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126	-176.9	-173.2	0	0	0	0	109.2	V726 Y727 L744 Q748 F782	V726-V746 WeakPolarHBondContact CA-O 3.41Å; Y727-V746 HydrophobicContact CD1-CB 4.28Å; Y727-V746 HydrophobicContact CD1-CG2 4.01Å; Y727-V746 PolarHBondContact N-O 2.68Å; Y727-V746 PolarHBondContact O-N 3.36Å; L744-V746 HydrophobicContact CD1-CG2 4.4Å; L744-V746 HydrophobicContact CD2-CG2 4.08Å; L744-V746 HydrophobicContact CG-CG2 3.97Å; V746-Q748 PolarHBondContact O-N 2.7Å; V746-F782 HydrophobicContact CB-CB 4.34Å; V746-F782 HydrophobicContact CG1-CB 4.32Å; V746-F782 HydrophobicContact CG2-CB 3.85Å
747	N	90.8	Very high	86	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	113.7	172.3	178.8	12.2	0	0	0	109.5	T749 D751 L753 L777 A778 H780 D781	N747-T749 WeakPolarHBondContact OD1-CB 3.42Å; N747-T749 PolarHBondContact OD1-N 3.43Å; N747-T749 PolarHBondContact OD1-OG1 2.82Å; N747-D751 PolarHBondContact ND2-O 3.26Å; N747-L753 HydrophobicContact CB-CD1 3.96Å; N747-L753 HydrophobicContact CB-CG 4.44Å; N747-L753 WeakPolarHBondContact OD1-CD1 2.99Å; N747-L777 HydrophobicContact CB-CB 3.95Å; N747-L777 HydrophobicContact CB-CD1 4.28Å; N747-A778 PolarHBondContact ND2-O 3.05Å; N747-H780 WeakPolarHBondContact O-CA 3.18Å; N747-H780 PolarHBondContact O-N 3.37Å; N747-D781 PolarHBondContact N-O 3.26Å
748	Q	86.6	Confident	86.8	Confident	68 Å²	68	35.4 Å²	35.4	32%	0.318	20%	0.198	S	C	.	.			trans	-88.2	-9.6	176.7	-62.2	-164.2	-13.9	0	0	113.1	F722 D724 P725 V746 H780	F722-Q748 PolarHBondContact O-OE1 3.4Å; D724-Q748 PolarHBondContact O-OE1 3.33Å; D724-Q748 VanDerWaalsContact O-OE1 3.11Å; P725-Q748 PolarHBondContact O-N 2.77Å; V746-Q748 PolarHBondContact O-N 2.7Å; Q748-H780 PolarHBondContact O-CE1 3.25Å; Q748-H780 VanDerWaalsContact O-CE1 3.22Å
749	T	86.2	Confident	87.3	Confident	35 Å²	35	37.2 Å²	37.2	22%	0.215	20%	0.204	C	C	.	.	S	Bend	trans	-85.5	161.8	-177.6	74	0	0	0	0	112.4	P725 N747 D751 H780	P725-T749 HydrophobicContact CB-CG2 3.72Å; N747-T749 WeakPolarHBondContact OD1-CB 3.42Å; N747-T749 PolarHBondContact OD1-N 3.43Å; N747-T749 PolarHBondContact OD1-OG1 2.82Å; T749-D751 VanDerWaalsContact C-N 3.26Å; T749-D751 PolarHBondContact OG1-N 2.82Å; T749-D751 PolarHBondContact OG1-O 2.74Å; T749-H780 PolarHBondContact O-N 3.45Å
750	S	86.9	Confident	87.6	Confident	90 Å²	90	38.2 Å²	38.2	63%	0.629	21%	0.209	S	C	*	.	S	Bend	trans	-83.4	-1.7	172.9	-55.2	0	0	0	0	113.3	P779	S750-P779 WeakPolarHBondContact O-CB 3Å; S750-P779 WeakPolarHBondContact O-CG 2.84Å
751	D	86.4	Confident	87.7	Confident	93 Å²	93	38.5 Å²	38.5	50%	0.497	22%	0.216	S	C	.	.	S	Bend	trans	-99	155.7	-179.4	-62.9	-40	0	0	0	111.1	N747 T749 V807	N747-D751 PolarHBondContact ND2-O 3.26Å; T749-D751 VanDerWaalsContact C-N 3.26Å; T749-D751 PolarHBondContact OG1-N 2.82Å; T749-D751 PolarHBondContact OG1-O 2.74Å; D751-V807 HydrophobicContact CB-CG1 4Å
752	T	85.4	Confident	87.7	Confident	47 Å²	47	40.4 Å²	40.4	29%	0.288	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-83.2	119.1	174.8	-56.2	0	0	0	0	109.3	T776 S808	T752-T776 HydrophobicContact CG2-CG2 3.87Å; T752-S808 PolarHBondContact O-OG 3.48Å
753	L	86.3	Confident	87.4	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	117.3	176.8	-51.2	-176.9	0	0	0	109.1	V726 N747 T776 L777 Y805 V807	V726-L753 HydrophobicContact CG2-CD1 3.45Å; V726-L753 VanDerWaalsContact CG2-CD1 3.45Å; N747-L753 HydrophobicContact CB-CD1 3.96Å; N747-L753 HydrophobicContact CB-CG 4.44Å; N747-L753 WeakPolarHBondContact OD1-CD1 2.99Å; L753-T776 CarbonylContact O-C 3.5Å; L753-T776 VanDerWaalsContact O-CA 3.3Å; L753-T776 WeakPolarHBondContact O-CA 3.19Å; L753-T776 WeakPolarHBondContact O-CG2 3.2Å; L753-L777 HydrophobicContact CB-CB 4.39Å; L753-L777 PolarHBondContact N-O 3.13Å; L753-L777 PolarHBondContact O-N 3Å; L753-Y805 HydrophobicContact CB-CD2 4.42Å; L753-Y805 HydrophobicContact CD1-CD2 4.29Å; L753-Y805 HydrophobicContact CD1-CG 4.37Å; L753-Y805 HydrophobicContact CD2-CD2 3.61Å; L753-Y805 HydrophobicContact CD2-CE2 3.76Å; L753-Y805 HydrophobicContact CD2-CG 4.44Å; L753-Y805 HydrophobicContact CG-CD2 4.31Å; L753-V807 HydrophobicContact CD2-CG2 4.21Å
754	Q	84.2	Confident	86.7	Confident	86 Å²	86	45.1 Å²	45.1	40%	0.402	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	151.7	177	-63.2	-176.8	-10.7	0	0	109.9	C756 T776 D806	Q754-C756 PolarHBondContact O-N 2.92Å; Q754-C756 VanDerWaalsContact O-N 3.1Å; Q754-T776 HydrophobicContact CG-CG2 4.15Å; Q754-D806 HydrophobicContact CB-CB 4.49Å; Q754-D806 PolarHBondContact N-O 3.03Å; Q754-D806 PolarHBondContact O-N 3.4Å
755	N	84.4	Confident	86	Confident	83 Å²	83	47.5 Å²	47.5	44%	0.444	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	53.4	30.5	178.1	-58	-28.7	0	0	0	114.9	T757 D806	N755-T757 PolarHBondContact O-N 2.91Å; N755-T757 PolarHBondContact O-OG1 3.32Å; N755-D806 PolarHBondContact ND2-OD2 3.08Å
756	C	86.3	Confident	85.5	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.007	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	109.4	176.2	-176.2	0	0	0	0	109.1	Q754 P774 L775 I803 V804	Q754-C756 PolarHBondContact O-N 2.92Å; Q754-C756 VanDerWaalsContact O-N 3.1Å; C756-P774 WeakPolarHBondContact O-CA 3.5Å; C756-L775 WeakPolarHBondContact CA-O 3.41Å; C756-L775 HydrophobicContact CB-CD1 3.76Å; C756-L775 HydrophobicContact CB-CG 4.36Å; C756-L775 VanDerWaalsContact CB-O 3.25Å; C756-L775 WeakPolarHBondContact CB-O 3.43Å; C756-L775 PolarHBondContact N-O 3.4Å; C756-L775 WeakPolarHBondContact O-CG 3.27Å; C756-L775 PolarHBondContact O-N 3.02Å; C756-I803 WeakPolarHBondContact SG-CG2 3.33Å; C756-V804 CarbonylContact C-O 3.47Å; C756-V804 VanDerWaalsContact CA-O 3.27Å; C756-V804 WeakPolarHBondContact CA-O 3.3Å
757	T	87.4	Confident	85.1	Confident	31 Å²	31	53.7 Å²	53.7	19%	0.19	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	127.6	-173.2	-52	0	0	0	0	109	N755 E759 P774 I803 V804	N755-T757 PolarHBondContact O-N 2.91Å; N755-T757 PolarHBondContact O-OG1 3.32Å; T757-E759 HydrophobicContact CG2-CG 4.23Å; T757-P774 WeakPolarHBondContact OG1-CB 3.38Å; T757-I803 WeakPolarHBondContact O-CA 3.41Å; T757-V804 PolarHBondContact N-O 3.43Å; T757-V804 PolarHBondContact O-N 2.87Å
758	L	89.2	Confident	84.7	Confident	3 Å²	3	55.4 Å²	55.4	2%	0.016	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	105.9	171.4	177.5	65.6	0	0	0	108.9	V743 L760 P772 I785 I803 L819	V743-L758 HydrophobicContact CB-CD2 3.99Å; V743-L758 HydrophobicContact CG1-CD2 4.23Å; V743-L758 HydrophobicContact CG2-CD2 3.79Å; L758-L760 HydrophobicContact CD1-CD2 3.88Å; L758-L760 HydrophobicContact CD1-CG 4.36Å; L758-L760 HydrophobicContact CD2-CD1 4.14Å; L758-L760 HydrophobicContact CD2-CD2 4.27Å; L758-L760 HydrophobicContact CD2-CG 4.16Å; L758-L760 HydrophobicContact CG-CD1 4.47Å; L758-L760 HydrophobicContact CG-CD2 4.02Å; L758-L760 HydrophobicContact CG-CG 3.95Å; L758-P772 HydrophobicContact CB-CB 4.24Å; L758-P772 HydrophobicContact CB-CG 4.24Å; L758-P772 HydrophobicContact CD2-CG 4.22Å; L758-P772 HydrophobicContact CG-CG 4.42Å; L758-I785 HydrophobicContact CB-CD1 3.87Å; L758-I785 HydrophobicContact CD2-CB 4.4Å; L758-I785 HydrophobicContact CD2-CD1 4.43Å; L758-I785 HydrophobicContact CD2-CG2 3.97Å; L758-I803 HydrophobicContact CD1-CG1 3.87Å; L758-L819 HydrophobicContact CD1-CD1 3.36Å
759	E	88.5	Confident	84.5	Confident	104 Å²	104	56 Å²	56	49%	0.486	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	110.2	173.6	-57.7	-170.8	159	0	0	109	T757 G801 N802	T757-E759 HydrophobicContact CG2-CG 4.23Å; E759-G801 CarbonylContact O-C 3.58Å; E759-G801 WeakPolarHBondContact O-CA 3.29Å; E759-N802 WeakPolarHBondContact CB-OD1 3.48Å; E759-N802 PolarHBondContact N-O 3.15Å; E759-N802 PolarHBondContact O-N 3.31Å
760	L	88.3	Confident	84.1	Confident	21 Å²	21	59.6 Å²	59.6	11%	0.11	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.3	174.3	-60.9	176.6	0	0	0	110	L741 L758 L768 A787 I799 L819	L741-L760 HydrophobicContact CD1-CD1 3.88Å; L758-L760 HydrophobicContact CD1-CD2 3.88Å; L758-L760 HydrophobicContact CD1-CG 4.36Å; L758-L760 HydrophobicContact CD2-CD1 4.14Å; L758-L760 HydrophobicContact CD2-CD2 4.27Å; L758-L760 HydrophobicContact CD2-CG 4.16Å; L758-L760 HydrophobicContact CG-CD1 4.47Å; L758-L760 HydrophobicContact CG-CD2 4.02Å; L758-L760 HydrophobicContact CG-CG 3.95Å; L760-L768 HydrophobicContact CB-CD2 4.26Å; L760-A787 HydrophobicContact CD1-CB 3.68Å; L760-I799 HydrophobicContact CB-CG2 4.33Å; L760-I799 HydrophobicContact CD1-CG2 4.43Å; L760-I799 HydrophobicContact CD2-CG2 4.11Å; L760-L819 HydrophobicContact CD2-CD1 4.48Å
761	A	87.4	Confident	83.6	Confident	40 Å²	40	63.7 Å²	63.7	33%	0.331	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	148.4	167.1	0	0	0	0	0	108.8	F800	A761-F800 HydrophobicContact CB-CD2 4.11Å; A761-F800 HydrophobicContact CB-CE1 4.08Å; A761-F800 HydrophobicContact CB-CE2 3.58Å; A761-F800 HydrophobicContact CB-CZ 3.57Å; A761-F800 PolarHBondContact N-O 2.94Å; A761-F800 PolarHBondContact O-N 3.18Å
762	T	87.3	Confident	83.3	Confident	40 Å²	40	60 Å²	60	25%	0.245	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	138.8	-179	52.8	0	0	0	0	109.7	L766 V789 I799	T762-L766 WeakPolarHBondContact CB-O 3.37Å; T762-L766 HydrophobicContact CG2-CB 4.03Å; T762-L766 PolarHBondContact OG1-O 2.74Å; T762-V789 HydrophobicContact CG2-CG1 4.2Å; T762-I799 HydrophobicContact CG2-CG1 4.08Å
763	L	82.4	Confident	83	Confident	100 Å²	100	61.3 Å²	61.3	52%	0.524	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	134.1	169.3	-161.6	143.5	0	0	0	108.7	I798 F800	L763-I798 HydrophobicContact CB-CB 4.23Å; L763-I798 PolarHBondContact N-O 3.23Å; L763-I798 PolarHBondContact O-N 2.77Å; L763-I798 VanDerWaalsContact O-N 3.14Å; L763-F800 HydrophobicContact CB-CD1 4.48Å; L763-F800 HydrophobicContact CB-CE1 4Å
764	G	75.1	Confident	82.9	Confident	37 Å²	37	64.5 Å²	64.5	38%	0.381	35%	0.349	S	S	.	.	S	Bend	trans	93.4	-169.2	-172.1	0	0	0	0	0	112.5	L766	G764-L766 PolarHBondContact O-N 2.92Å
765	D	75.1	Confident	83	Confident	83 Å²	83	61.8 Å²	61.8	44%	0.444	34%	0.337	S	S	.	.	S	Bend	trans	-80.7	45.2	-177.1	-85.9	-6.8	0	0	0	113.2	A792 S793	D765-A792 HydrophobicContact CB-CB 4.37Å; D765-A792 WeakPolarHBondContact O-CB 3.48Å; D765-A792 PolarHBondContact O-N 2.96Å; D765-S793 VanDerWaalsContact CB-CB 3.48Å; D765-S793 VanDerWaalsContact OD2-CB 3.3Å; D765-S793 WeakPolarHBondContact OD2-CB 3.43Å
766	L	80.8	Confident	83.1	Confident	13 Å²	13	62 Å²	62	7%	0.068	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	128.5	172	-66.7	-177	0	0	0	109.5	I739 T762 G764 V789 K790 V791 I799 I824	I739-L766 HydrophobicContact CD1-CD2 4.27Å; T762-L766 WeakPolarHBondContact CB-O 3.37Å; T762-L766 HydrophobicContact CG2-CB 4.03Å; T762-L766 PolarHBondContact OG1-O 2.74Å; G764-L766 PolarHBondContact O-N 2.92Å; L766-V789 HydrophobicContact CB-CG1 3.82Å; L766-V789 HydrophobicContact CD1-CG1 4.34Å; L766-V789 HydrophobicContact CD2-CG1 4.32Å; L766-V789 HydrophobicContact CG-CG1 4.41Å; L766-K790 WeakPolarHBondContact CA-O 3.3Å; L766-V791 HydrophobicContact CD2-CB 4.23Å; L766-V791 HydrophobicContact CD2-CG1 4.2Å; L766-V791 HydrophobicContact CD2-CG2 3.87Å; L766-I799 HydrophobicContact CD1-CG1 4.08Å; L766-I824 HydrophobicContact CD1-CD1 3.44Å; L766-I824 VanDerWaalsContact CD1-CD1 3.44Å
767	K	82.7	Confident	83.1	Confident	151 Å²	151	62.1 Å²	62.1	66%	0.657	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	112.6	179.1	-171.1	174.7	-178.8	177	0	110.7	V769 K790	K767-V769 PolarHBondContact O-N 3.08Å; K767-K790 PolarHBondContact N-O 2.95Å; K767-K790 PolarHBondContact O-N 3.35Å
768	L	82.9	Confident	83.1	Confident	36 Å²	36	62.6 Å²	62.6	19%	0.188	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	118.4	168.7	-173.1	69.8	0	0	0	109.1	L760 K771 A787 V789	L760-L768 HydrophobicContact CB-CD2 4.26Å; L768-K771 HydrophobicContact CD2-CG 4.13Å; L768-A787 HydrophobicContact CD1-CB 4.43Å; L768-V789 HydrophobicContact CD1-CG2 3.74Å
769	V	81.3	Confident	83	Confident	82 Å²	82	65 Å²	65	50%	0.497	37%	0.365	S	S	.	.			trans	-87.9	-36.3	-176.7	-177.7	0	0	0	0	111	K767 N788 K790	K767-V769 PolarHBondContact O-N 3.08Å; V769-N788 PolarHBondContact N-O 3.12Å; V769-K790 HydrophobicContact CG2-CB 3.85Å; V769-K790 HydrophobicContact CG2-CD 3.61Å; V769-K790 HydrophobicContact CG2-CG 3.54Å
770	E	78	Confident	82.9	Confident	109 Å²	109	65.9 Å²	65.9	51%	0.509	37%	0.369	S	S	.	.			trans	-131.9	125.8	-172.4	-170.4	170.9	-169.1	0	0	110.1	N788	E770-N788 PolarHBondContact OE2-ND2 3.27Å
771	K	76.8	Confident	83	Confident	177 Å²	177	68.2 Å²	68.2	77%	0.77	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-86.6	126.3	173.2	-72.2	-170.2	175.8	-169.2	0	109.1	L768	L768-K771 HydrophobicContact CD2-CG 4.13Å
772	P	78.9	Confident	83.1	Confident	16 Å²	16	72.6 Å²	72.6	10%	0.104	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-53.7	139	174.2	-30.3	38.1	0	0	0	113.2	L758 I785 A787	L758-P772 HydrophobicContact CB-CB 4.24Å; L758-P772 HydrophobicContact CB-CG 4.24Å; L758-P772 HydrophobicContact CD2-CG 4.22Å; L758-P772 HydrophobicContact CG-CG 4.42Å; P772-I785 HydrophobicContact CB-CG2 3.49Å; P772-I785 VanDerWaalsContact CB-CG2 3.49Å; P772-I785 HydrophobicContact CG-CG2 3.72Å; P772-A787 HydrophobicContact CG-CB 4.16Å
773	S	80.1	Confident	83.2	Confident	74 Å²	74	71.8 Å²	71.8	52%	0.517	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-75.4	145.6	174	56.2	0	0	0	0	111.5
774	P	84.4	Confident	83.5	Confident	68 Å²	68	71.8 Å²	71.8	44%	0.442	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-58.4	140.7	171.6	22.6	-31.7	0	0	0	111.1	C756 T757	C756-P774 WeakPolarHBondContact O-CA 3.5Å; T757-P774 WeakPolarHBondContact OG1-CB 3.38Å
775	L	85.9	Confident	84.1	Confident	28 Å²	28	70.6 Å²	70.6	15%	0.147	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	155.8	178.7	57.5	84.1	0	0	0	111.6	C756 L777 A783 I785	C756-L775 WeakPolarHBondContact CA-O 3.41Å; C756-L775 HydrophobicContact CB-CD1 3.76Å; C756-L775 HydrophobicContact CB-CG 4.36Å; C756-L775 VanDerWaalsContact CB-O 3.25Å; C756-L775 WeakPolarHBondContact CB-O 3.43Å; C756-L775 PolarHBondContact N-O 3.4Å; C756-L775 WeakPolarHBondContact O-CG 3.27Å; C756-L775 PolarHBondContact O-N 3.02Å; L775-L777 HydrophobicContact CD1-CD1 3.78Å; L775-L777 HydrophobicContact CD1-CD2 3.61Å; L775-L777 HydrophobicContact CD1-CG 3.37Å; L775-A783 HydrophobicContact CD1-CB 4.31Å; L775-A783 HydrophobicContact CD2-CB 3.98Å; L775-I785 HydrophobicContact CD2-CD1 3.53Å; L775-I785 HydrophobicContact CD2-CG1 3.48Å; L775-I785 VanDerWaalsContact CD2-CG1 3.48Å; L775-I785 HydrophobicContact CG-CD1 4.47Å
776	T	87.4	Confident	84.6	Confident	88 Å²	88	72.9 Å²	72.9	54%	0.54	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121.2	176.5	-60.6	0	0	0	0	108.4	T752 L753 Q754	T752-T776 HydrophobicContact CG2-CG2 3.87Å; L753-T776 CarbonylContact O-C 3.5Å; L753-T776 VanDerWaalsContact O-CA 3.3Å; L753-T776 WeakPolarHBondContact O-CA 3.19Å; L753-T776 WeakPolarHBondContact O-CG2 3.2Å; Q754-T776 HydrophobicContact CG-CG2 4.15Å
777	L	85.8	Confident	84.9	Confident	3 Å²	3	72.2 Å²	72.2	2%	0.016	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	124.3	179.5	-65.7	171	0	0	0	110.1	V745 N747 L753 L775 A783	V745-L777 HydrophobicContact CG1-CD1 3.84Å; N747-L777 HydrophobicContact CB-CB 3.95Å; N747-L777 HydrophobicContact CB-CD1 4.28Å; L753-L777 HydrophobicContact CB-CB 4.39Å; L753-L777 PolarHBondContact N-O 3.13Å; L753-L777 PolarHBondContact O-N 3Å; L775-L777 HydrophobicContact CD1-CD1 3.78Å; L775-L777 HydrophobicContact CD1-CD2 3.61Å; L775-L777 HydrophobicContact CD1-CG 3.37Å; L777-A783 HydrophobicContact CD2-CB 3.65Å
778	A	87.5	Confident	85.1	Confident	41 Å²	41	67.6 Å²	67.6	34%	0.339	36%	0.361	S	S	.	.			trans	-68	164.4	169.2	0	0	0	0	0	110.9	N747 H780 D781	N747-A778 PolarHBondContact ND2-O 3.05Å; A778-H780 PolarHBondContact O-N 3.42Å; A778-D781 HydrophobicContact CB-CB 3.88Å; A778-D781 VanDerWaalsContact O-CB 3.23Å; A778-D781 WeakPolarHBondContact O-CB 3.26Å; A778-D781 PolarHBondContact O-N 3.43Å; A778-D781 VanDerWaalsContact O-N 3.1Å
779	P	87.3	Confident	85.2	Confident	53 Å²	53	65.9 Å²	65.9	34%	0.344	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	129	175.1	-28	37.6	0	0	0	111.6	S750 D781	S750-P779 WeakPolarHBondContact O-CB 3Å; S750-P779 WeakPolarHBondContact O-CG 2.84Å; P779-D781 PolarHBondContact O-N 3.27Å; P779-D781 VanDerWaalsContact O-N 3.14Å
780	H	86.6	Confident	85.3	Confident	123 Å²	123	67 Å²	67	57%	0.569	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.7	15.9	-178	-54.5	-57.1	0	0	0	116	N747 Q748 T749 A778	N747-H780 WeakPolarHBondContact O-CA 3.18Å; N747-H780 PolarHBondContact O-N 3.37Å; Q748-H780 PolarHBondContact O-CE1 3.25Å; Q748-H780 VanDerWaalsContact O-CE1 3.22Å; T749-H780 PolarHBondContact O-N 3.45Å; A778-H780 PolarHBondContact O-N 3.42Å
781	D	88.9	Confident	85.3	Confident	70 Å²	70	62.5 Å²	62.5	37%	0.374	33%	0.33	S	S	.	.			trans	-89.4	162	178	-158.5	11	0	0	0	111.7	N747 A778 P779	N747-D781 PolarHBondContact N-O 3.26Å; A778-D781 HydrophobicContact CB-CB 3.88Å; A778-D781 VanDerWaalsContact O-CB 3.23Å; A778-D781 WeakPolarHBondContact O-CB 3.26Å; A778-D781 PolarHBondContact O-N 3.43Å; A778-D781 VanDerWaalsContact O-N 3.1Å; P779-D781 PolarHBondContact O-N 3.27Å; P779-D781 VanDerWaalsContact O-N 3.14Å
782	F	89.6	Confident	85.1	Confident	132 Å²	132	57.8 Å²	57.8	58%	0.579	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.3	149.8	-179.1	66.2	-88.8	0	0	0	112.2	L744 V745 V746	L744-F782 HydrophobicContact CD1-CB 4.09Å; L744-F782 HydrophobicContact CD1-CD2 3.81Å; L744-F782 HydrophobicContact CD1-CG 4.34Å; V745-F782 CarbonylContact O-C 3.37Å; V745-F782 VanDerWaalsContact O-CA 3.26Å; V745-F782 WeakPolarHBondContact O-CA 3.31Å; V746-F782 HydrophobicContact CB-CB 4.34Å; V746-F782 HydrophobicContact CG1-CB 4.32Å; V746-F782 HydrophobicContact CG2-CB 3.85Å
783	A	88.6	Confident	84.6	Confident	23 Å²	23	58 Å²	58	19%	0.19	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	147.1	175.3	0	0	0	0	0	111.2	V745 L775 L777	V745-A783 PolarHBondContact N-O 3.1Å; V745-A783 PolarHBondContact O-N 2.84Å; L775-A783 HydrophobicContact CD1-CB 4.31Å; L775-A783 HydrophobicContact CD2-CB 3.98Å; L777-A783 HydrophobicContact CD2-CB 3.65Å
784	N	88.8	Confident	84	Confident	101 Å²	101	54.6 Å²	54.6	54%	0.54	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.2	172.2	-73.5	-26.1	0	0	0	110.1	L744	L744-N784 WeakPolarHBondContact CA-OD1 3.49Å; L744-N784 WeakPolarHBondContact CB-OD1 2.96Å; L744-N784 WeakPolarHBondContact CD1-OD1 3.18Å
785	I	88	Confident	83.5	Confident	11 Å²	11	54.4 Å²	54.4	6%	0.056	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.8	177.8	-57.1	179.5	0	0	0	108.6	V743 V745 L758 P772 L775	V743-I785 HydrophobicContact CB-CB 4.48Å; V743-I785 PolarHBondContact N-O 2.91Å; V743-I785 PolarHBondContact O-N 3.27Å; V745-I785 HydrophobicContact CG2-CD1 3.75Å; V745-I785 HydrophobicContact CG2-CG1 4.3Å; L758-I785 HydrophobicContact CB-CD1 3.87Å; L758-I785 HydrophobicContact CD2-CB 4.4Å; L758-I785 HydrophobicContact CD2-CD1 4.43Å; L758-I785 HydrophobicContact CD2-CG2 3.97Å; P772-I785 HydrophobicContact CB-CG2 3.49Å; P772-I785 VanDerWaalsContact CB-CG2 3.49Å; P772-I785 HydrophobicContact CG-CG2 3.72Å; L775-I785 HydrophobicContact CD2-CD1 3.53Å; L775-I785 HydrophobicContact CD2-CG1 3.48Å; L775-I785 VanDerWaalsContact CD2-CG1 3.48Å; L775-I785 HydrophobicContact CG-CD1 4.47Å
786	K	86.9	Confident	82.9	Confident	131 Å²	131	55.6 Å²	55.6	57%	0.57	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	129.9	174.1	-64.4	-172.6	-179.6	-162.4	0	110.7	L741 D742	L741-K786 CarbonylContact O-C 3.52Å; L741-K786 WeakPolarHBondContact O-CA 3.3Å; D742-K786 WeakPolarHBondContact OD1-CG 3.32Å; D742-K786 WeakPolarHBondContact OD2-CE 3.34Å; D742-K786 IonicContact OD2-NZ 2.71Å
787	A	86.3	Confident	82.5	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	129.4	174	0	0	0	0	0	110.3	L741 L760 L768 P772	L741-A787 HydrophobicContact CB-CB 4.34Å; L741-A787 PolarHBondContact N-O 3.08Å; L741-A787 PolarHBondContact O-N 2.92Å; L760-A787 HydrophobicContact CD1-CB 3.68Å; L768-A787 HydrophobicContact CD1-CB 4.43Å; P772-A787 HydrophobicContact CG-CB 4.16Å
788	N	86.1	Confident	82.5	Confident	53 Å²	53	53.4 Å²	53.4	28%	0.283	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	123.1	178.9	-64.5	-48.6	0	0	0	110.2	V740 V769 E770	V740-N788 WeakPolarHBondContact CG2-OD1 3.46Å; V769-N788 PolarHBondContact N-O 3.12Å; E770-N788 PolarHBondContact OE2-ND2 3.27Å
789	V	85.3	Confident	82.5	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.7	178	-178.6	0	0	0	0	108.6	I739 L741 T762 L766 L768	I739-V789 WeakPolarHBondContact CA-O 3.49Å; I739-V789 HydrophobicContact CB-CB 4.25Å; I739-V789 PolarHBondContact N-O 3.19Å; I739-V789 PolarHBondContact O-N 3.01Å; L741-V789 HydrophobicContact CD1-CG2 3.83Å; T762-V789 HydrophobicContact CG2-CG1 4.2Å; L766-V789 HydrophobicContact CB-CG1 3.82Å; L766-V789 HydrophobicContact CD1-CG1 4.34Å; L766-V789 HydrophobicContact CD2-CG1 4.32Å; L766-V789 HydrophobicContact CG-CG1 4.41Å; L768-V789 HydrophobicContact CD1-CG2 3.74Å
790	K	83.8	Confident	82.6	Confident	106 Å²	106	52.9 Å²	52.9	46%	0.461	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	135.4	175.4	-87	-177.5	-177.6	-161.9	0	111.4	D738 L766 K767 V769	D738-K790 WeakPolarHBondContact OD1-CE 3.33Å; D738-K790 WeakPolarHBondContact OD1-CG 3.39Å; L766-K790 WeakPolarHBondContact CA-O 3.3Å; K767-K790 PolarHBondContact N-O 2.95Å; K767-K790 PolarHBondContact O-N 3.35Å; V769-K790 HydrophobicContact CG2-CB 3.85Å; V769-K790 HydrophobicContact CG2-CD 3.61Å; V769-K790 HydrophobicContact CG2-CG 3.54Å
791	V	79	Confident	82.7	Confident	13 Å²	13	47.6 Å²	47.6	8%	0.079	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	116.3	174.5	-171.7	0	0	0	0	108.5	Y737 I739 L766 S793 F901	Y737-V791 PolarHBondContact O-N 3.49Å; I739-V791 HydrophobicContact CD1-CG2 3.49Å; I739-V791 VanDerWaalsContact CD1-CG2 3.49Å; I739-V791 HydrophobicContact CG1-CG2 3.62Å; L766-V791 HydrophobicContact CD2-CB 4.23Å; L766-V791 HydrophobicContact CD2-CG1 4.2Å; L766-V791 HydrophobicContact CD2-CG2 3.87Å; V791-S793 WeakPolarHBondContact CG1-O 3.29Å; V791-F901 HydrophobicContact CG1-CZ 4.07Å
792	A	71.6	Confident	82.8	Confident	79 Å²	79	46.4 Å²	46.4	65%	0.653	24%	0.244	S	C	*	.			trans	-93.9	-25.6	176.3	0	0	0	0	0	112.6	D765	D765-A792 HydrophobicContact CB-CB 4.37Å; D765-A792 WeakPolarHBondContact O-CB 3.48Å; D765-A792 PolarHBondContact O-N 2.96Å
793	S	69.4	Low	82.9	Confident	21 Å²	21	40.1 Å²	40.1	15%	0.147	22%	0.216	C	C	.	.	S	Bend	trans	-146.6	159.6	-177.1	-175.5	0	0	0	0	111.5	D765 V791 E795	D765-S793 VanDerWaalsContact CB-CB 3.48Å; D765-S793 VanDerWaalsContact OD2-CB 3.3Å; D765-S793 WeakPolarHBondContact OD2-CB 3.43Å; V791-S793 WeakPolarHBondContact CG1-O 3.29Å; S793-E795 VanDerWaalsContact C-N 3.25Å; S793-E795 PolarHBondContact O-N 3.25Å; S793-E795 WeakPolarHBondContact OG-CG 3.28Å; S793-E795 PolarHBondContact OG-OE1 3.35Å
794	T	67.2	Low	82.9	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.012	22%	0.215	C	C	.	.	S	Bend	trans	-83.4	61.9	177.8	47.7	0	0	0	0	111.9	I826 F901 E903 M936	T794-I826 WeakPolarHBondContact O-CD1 3.49Å; T794-F901 HydrophobicContact CG2-CB 4.2Å; T794-F901 HydrophobicContact CG2-CD2 3.05Å; T794-F901 HydrophobicContact CG2-CE2 3.5Å; T794-F901 VanDerWaalsContact CG2-CE2 3.5Å; T794-F901 HydrophobicContact CG2-CG 3.82Å; T794-E903 PolarHBondContact OG1-OE2 2.87Å; T794-M936 VanDerWaalsContact CB-CE 3.43Å; T794-M936 HydrophobicContact CG2-CE 3.93Å; T794-M936 VanDerWaalsContact OG1-CE 3.3Å; T794-M936 WeakPolarHBondContact OG1-CE 3.33Å
795	E	72.9	Confident	82.9	Confident	64 Å²	64	36.2 Å²	36.2	30%	0.299	19%	0.192	S	C	.	.	S	Bend	trans	-116.3	152.5	178	-40.6	-168.3	175.2	0	0	109.3	S793 G797	S793-E795 VanDerWaalsContact C-N 3.25Å; S793-E795 PolarHBondContact O-N 3.25Å; S793-E795 WeakPolarHBondContact OG-CG 3.28Å; S793-E795 PolarHBondContact OG-OE1 3.35Å; E795-G797 PolarHBondContact O-N 3.16Å
796	N	74.8	Confident	82.8	Confident	53 Å²	53	37.7 Å²	37.7	28%	0.283	20%	0.2	S	C	.	.			trans	-60.8	111.6	166.3	-76.4	-13.6	0	0	0	108.4	I826 S939	N796-I826 PolarHBondContact OD1-N 3.25Å; N796-S939 VanDerWaalsContact CG-CB 3.45Å; N796-S939 VanDerWaalsContact CG-OG 3.29Å; N796-S939 PolarHBondContact N-OG 2.95Å; N796-S939 WeakPolarHBondContact ND2-CB 3.39Å; N796-S939 PolarHBondContact ND2-OG 3.42Å; N796-S939 WeakPolarHBondContact OD1-CB 3.44Å
797	G	77.4	Confident	82.7	Confident	1 Å²	1	33 Å²	33	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	137.1	176.6	0	0	0	0	0	110.5	E795 I824	E795-G797 PolarHBondContact O-N 3.16Å; G797-I824 PolarHBondContact O-N 3.33Å
798	I	85.8	Confident	81.7	Confident	44 Å²	44	35.7 Å²	35.7	23%	0.226	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.9	173.3	-55.1	174.9	0	0	0	107.3	L763 D821 I822	L763-I798 HydrophobicContact CB-CB 4.23Å; L763-I798 PolarHBondContact N-O 3.23Å; L763-I798 PolarHBondContact O-N 2.77Å; L763-I798 VanDerWaalsContact O-N 3.14Å; I798-D821 HydrophobicContact CG2-CB 3.8Å; I798-I822 WeakPolarHBondContact CA-O 3.29Å
799	I	87.8	Confident	80.7	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	120.2	170.7	-55.4	151.4	0	0	0	106.9	L741 L760 T762 L766 I822 I824	L741-I799 HydrophobicContact CD1-CD1 3.66Å; L741-I799 HydrophobicContact CD1-CG2 4.17Å; L741-I799 HydrophobicContact CD2-CD1 3.96Å; L741-I799 HydrophobicContact CG-CD1 4.3Å; L760-I799 HydrophobicContact CB-CG2 4.33Å; L760-I799 HydrophobicContact CD1-CG2 4.43Å; L760-I799 HydrophobicContact CD2-CG2 4.11Å; T762-I799 HydrophobicContact CG2-CG1 4.08Å; L766-I799 HydrophobicContact CD1-CG1 4.08Å; I799-I822 HydrophobicContact CB-CB 4.25Å; I799-I822 PolarHBondContact N-O 3.19Å; I799-I822 PolarHBondContact O-N 3.3Å; I799-I824 HydrophobicContact CD1-CD1 3.29Å; I799-I824 HydrophobicContact CD1-CG1 4.11Å; I799-I824 HydrophobicContact CG1-CD1 3.93Å
800	F	89.8	Confident	79.4	Confident	82 Å²	82	39.8 Å²	39.8	36%	0.36	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	159.3	177.5	62.8	-84.9	0	0	0	109	A761 L763 D821	A761-F800 HydrophobicContact CB-CD2 4.11Å; A761-F800 HydrophobicContact CB-CE1 4.08Å; A761-F800 HydrophobicContact CB-CE2 3.58Å; A761-F800 HydrophobicContact CB-CZ 3.57Å; A761-F800 PolarHBondContact N-O 2.94Å; A761-F800 PolarHBondContact O-N 3.18Å; L763-F800 HydrophobicContact CB-CD1 4.48Å; L763-F800 HydrophobicContact CB-CE1 4Å; F800-D821 WeakPolarHBondContact CB-OD1 3.5Å
801	G	89.1	Confident	77.8	Confident	11 Å²	11	40.1 Å²	40.1	11%	0.113	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.6	-178.6	-175.5	0	0	0	0	0	113.8	E759 L819	E759-G801 CarbonylContact O-C 3.58Å; E759-G801 WeakPolarHBondContact O-CA 3.29Å; G801-L819 VanDerWaalsContact O-CB 3.31Å; G801-L819 WeakPolarHBondContact O-CB 3.45Å; G801-L819 PolarHBondContact O-N 2.98Å
802	N	91.5	Very high	76.7	Confident	46 Å²	46	44.5 Å²	44.5	25%	0.246	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	151.8	175.7	53.9	-4.8	0	0	0	110.1	E759 V817	E759-N802 WeakPolarHBondContact CB-OD1 3.48Å; E759-N802 PolarHBondContact N-O 3.15Å; E759-N802 PolarHBondContact O-N 3.31Å; N802-V817 CarbonylContact C-O 3.55Å; N802-V817 VanDerWaalsContact CA-O 3.23Å; N802-V817 WeakPolarHBondContact CA-O 3.37Å; N802-V817 WeakPolarHBondContact CB-O 3.34Å
803	I	90	Very high	76.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	118.1	169.8	-65.2	172.2	0	0	0	107.2	V726 A728 V745 C756 T757 L758 Y805 C816 V817 L819	V726-I803 HydrophobicContact CG1-CD1 4.09Å; V726-I803 HydrophobicContact CG1-CG2 4.36Å; A728-I803 HydrophobicContact CB-CD1 3.78Å; V745-I803 HydrophobicContact CG1-CD1 4.11Å; V745-I803 HydrophobicContact CG2-CD1 4.07Å; C756-I803 WeakPolarHBondContact SG-CG2 3.33Å; T757-I803 WeakPolarHBondContact O-CA 3.41Å; L758-I803 HydrophobicContact CD1-CG1 3.87Å; I803-Y805 HydrophobicContact CG2-CD1 4.41Å; I803-C816 CarbonylContact O-C 3.57Å; I803-C816 WeakPolarHBondContact O-CA 3.44Å; I803-V817 PolarHBondContact N-O 3.18Å; I803-V817 PolarHBondContact O-N 3.34Å; I803-L819 HydrophobicContact CD1-CD2 3.78Å; I803-L819 HydrophobicContact CG1-CD1 4.2Å; I803-L819 HydrophobicContact CG1-CD2 3.93Å; I803-L819 HydrophobicContact CG1-CG 4.38Å
804	V	90.4	Very high	76.4	Confident	28 Å²	28	54.3 Å²	54.3	17%	0.17	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131.5	176.2	-176.5	0	0	0	0	108.3	C756 T757 R814 N815 C816	C756-V804 CarbonylContact C-O 3.47Å; C756-V804 VanDerWaalsContact CA-O 3.27Å; C756-V804 WeakPolarHBondContact CA-O 3.3Å; T757-V804 PolarHBondContact N-O 3.43Å; T757-V804 PolarHBondContact O-N 2.87Å; V804-R814 HydrophobicContact CG1-CB 4.5Å; V804-N815 WeakPolarHBondContact CA-O 3.35Å; V804-C816 HydrophobicContact CG2-CB 4.37Å
805	Y	88.3	Confident	77.2	Confident	14 Å²	14	57.1 Å²	57.1	6%	0.055	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	153.9	178.2	64.1	-92	0	0	0	112.1	P725 V726 L753 I803 V807 N815 V817	P725-Y805 VanDerWaalsContact CB-OH 3.32Å; P725-Y805 WeakPolarHBondContact CB-OH 3.11Å; V726-Y805 HydrophobicContact CG2-CD1 3.83Å; V726-Y805 HydrophobicContact CG2-CE1 3.63Å; L753-Y805 HydrophobicContact CB-CD2 4.42Å; L753-Y805 HydrophobicContact CD1-CD2 4.29Å; L753-Y805 HydrophobicContact CD1-CG 4.37Å; L753-Y805 HydrophobicContact CD2-CD2 3.61Å; L753-Y805 HydrophobicContact CD2-CE2 3.76Å; L753-Y805 HydrophobicContact CD2-CG 4.44Å; L753-Y805 HydrophobicContact CG-CD2 4.31Å; I803-Y805 HydrophobicContact CG2-CD1 4.41Å; Y805-V807 HydrophobicContact CD2-CG2 4.16Å; Y805-V807 HydrophobicContact CE2-CG2 3.91Å; Y805-N815 HydrophobicContact CD1-CB 4.39Å; Y805-N815 HydrophobicContact CD2-CB 3.97Å; Y805-N815 HydrophobicContact CE1-CB 3.91Å; Y805-N815 HydrophobicContact CE2-CB 3.47Å; Y805-N815 VanDerWaalsContact CE2-CB 3.47Å; Y805-N815 HydrophobicContact CG-CB 4.42Å; Y805-N815 VanDerWaalsContact CZ-CB 3.42Å; Y805-N815 PolarHBondContact N-O 3.16Å; Y805-N815 PolarHBondContact O-N 3.02Å; Y805-V817 HydrophobicContact CE1-CG2 3.88Å
806	D	86.5	Confident	77.8	Confident	41 Å²	41	58 Å²	58	22%	0.219	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	134.8	176.6	-61.6	-34.7	0	0	0	109.6	Q754 N755 R814	Q754-D806 HydrophobicContact CB-CB 4.49Å; Q754-D806 PolarHBondContact N-O 3.03Å; Q754-D806 PolarHBondContact O-N 3.4Å; N755-D806 PolarHBondContact ND2-OD2 3.08Å; D806-R814 WeakPolarHBondContact OD1-CG 3.49Å
807	V	82.9	Confident	78.6	Confident	33 Å²	33	56 Å²	56	20%	0.2	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	131.4	173.9	-178	0	0	0	0	109.3	D751 L753 Y805 G809 A810	D751-V807 HydrophobicContact CB-CG1 4Å; L753-V807 HydrophobicContact CD2-CG2 4.21Å; Y805-V807 HydrophobicContact CD2-CG2 4.16Å; Y805-V807 HydrophobicContact CE2-CG2 3.91Å; V807-G809 PolarHBondContact O-N 3.42Å; V807-G809 VanDerWaalsContact O-N 3.07Å; V807-A810 PolarHBondContact O-N 2.98Å
808	S	66.6	Low	79.1	Confident	57 Å²	57	61.3 Å²	61.3	40%	0.399	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	110.7	-179.5	30.8	0	0	0	0	111.5	T752	T752-S808 PolarHBondContact O-OG 3.48Å
809	G	64.4	Low	79.3	Confident	87 Å²	87	59.6 Å²	59.6	90%	0.897	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	117.9	-9.7	175.7	0	0	0	0	0	116.2	V807	V807-G809 PolarHBondContact O-N 3.42Å; V807-G809 VanDerWaalsContact O-N 3.07Å
810	A	57.7	Low	79.4	Confident	52 Å²	52	62.8 Å²	62.8	43%	0.43	39%	0.392	S	S	.	.			trans	-106.4	105.9	175.1	0	0	0	0	0	110.4	V807 S812	V807-A810 PolarHBondContact O-N 2.98Å; A810-S812 PolarHBondContact O-N 3.33Å
811	A	50.2	Low	79.3	Confident	114 Å²	114	62.5 Å²	62.5	94%	0.942	39%	0.394	S	S	*	.	S	Bend	trans	-75	22.5	-171.8	0	0	0	0	0	115.5
812	S	55.9	Low	79.2	Confident	105 Å²	105	62.3 Å²	62.3	73%	0.734	39%	0.39	S	S	*	.	S	Bend	trans	-161.9	-13.4	-174.9	-175.5	0	0	0	0	116.9	A810 R814	A810-S812 PolarHBondContact O-N 3.33Å; S812-R814 PolarHBondContact O-N 3.03Å
813	D	62.2	Low	78.7	Confident	107 Å²	107	66.2 Å²	66.2	57%	0.572	41%	0.407	S	S	*	.			trans	-101.1	95.1	-171.9	-70.8	-18.1	0	0	0	110.8	N815	D813-N815 PolarHBondContact O-N 2.99Å
814	R	73.6	Confident	78.1	Confident	199 Å²	199	66.8 Å²	66.8	75%	0.751	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74	109.2	166.6	-73.4	-175.1	176.7	-179	0.1	108.4	V804 D806 S812	V804-R814 HydrophobicContact CG1-CB 4.5Å; D806-R814 WeakPolarHBondContact OD1-CG 3.49Å; S812-R814 PolarHBondContact O-N 3.03Å
815	N	83.3	Confident	77.3	Confident	61 Å²	61	68.5 Å²	68.5	33%	0.326	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	138.8	175.8	-67.9	-37.9	0	0	0	109.4	V804 Y805 D813	V804-N815 WeakPolarHBondContact CA-O 3.35Å; Y805-N815 HydrophobicContact CD1-CB 4.39Å; Y805-N815 HydrophobicContact CD2-CB 3.97Å; Y805-N815 HydrophobicContact CE1-CB 3.91Å; Y805-N815 HydrophobicContact CE2-CB 3.47Å; Y805-N815 VanDerWaalsContact CE2-CB 3.47Å; Y805-N815 HydrophobicContact CG-CB 4.42Å; Y805-N815 VanDerWaalsContact CZ-CB 3.42Å; Y805-N815 PolarHBondContact N-O 3.16Å; Y805-N815 PolarHBondContact O-N 3.02Å; D813-N815 PolarHBondContact O-N 2.99Å
816	C	86.6	Confident	76.6	Confident	81 Å²	81	67.9 Å²	67.9	55%	0.547	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.8	176.2	64.9	0	0	0	0	110.7	I803 V804	I803-C816 CarbonylContact O-C 3.57Å; I803-C816 WeakPolarHBondContact O-CA 3.44Å; V804-C816 HydrophobicContact CG2-CB 4.37Å
817	V	89.6	Confident	75.8	Confident	13 Å²	13	66.6 Å²	66.6	8%	0.079	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118.3	171	175.2	0	0	0	0	106.9	T720 D724 N802 I803 Y805	T720-V817 HydrophobicContact CG2-CG1 3.53Å; D724-V817 HydrophobicContact CB-CG1 4.38Å; N802-V817 CarbonylContact C-O 3.55Å; N802-V817 VanDerWaalsContact CA-O 3.23Å; N802-V817 WeakPolarHBondContact CA-O 3.37Å; N802-V817 WeakPolarHBondContact CB-O 3.34Å; I803-V817 PolarHBondContact N-O 3.18Å; I803-V817 PolarHBondContact O-N 3.34Å; Y805-V817 HydrophobicContact CE1-CG2 3.88Å
818	V	89.7	Confident	75.2	Confident	111 Å²	111	69.1 Å²	69.1	67%	0.673	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	131.3	177.8	-177.2	0	0	0	0	108.5
819	L	89.9	Confident	75.6	Confident	9 Å²	9	66.7 Å²	66.7	5%	0.047	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-86.8	153.5	-179.1	-57.1	174.1	0	0	0	110.7	L719 T720 A728 L758 L760 G801 I803	L719-L819 HydrophobicContact CB-CB 4.26Å; L719-L819 HydrophobicContact CB-CD2 3.95Å; L719-L819 HydrophobicContact CD1-CD1 4.22Å; L719-L819 HydrophobicContact CD1-CD2 4.43Å; T720-L819 HydrophobicContact CG2-CD2 3.44Å; T720-L819 VanDerWaalsContact CG2-CD2 3.44Å; A728-L819 HydrophobicContact CB-CD2 4.22Å; L758-L819 HydrophobicContact CD1-CD1 3.36Å; L760-L819 HydrophobicContact CD2-CD1 4.48Å; G801-L819 VanDerWaalsContact O-CB 3.31Å; G801-L819 WeakPolarHBondContact O-CB 3.45Å; G801-L819 PolarHBondContact O-N 2.98Å; I803-L819 HydrophobicContact CD1-CD2 3.78Å; I803-L819 HydrophobicContact CG1-CD1 4.2Å; I803-L819 HydrophobicContact CG1-CD2 3.93Å; I803-L819 HydrophobicContact CG1-CG 4.38Å
820	S	89.8	Confident	76.3	Confident	68 Å²	68	62.6 Å²	62.6	48%	0.476	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-67.9	145.1	166.2	-162.2	0	0	0	0	111	L719	L719-S820 WeakPolarHBondContact CD2-O 3.49Å; L719-S820 WeakPolarHBondContact O-CB 3.4Å; L719-S820 PolarHBondContact O-N 3.24Å
821	D	87.7	Confident	77.3	Confident	76 Å²	76	64.6 Å²	64.6	41%	0.406	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-72.1	127.1	-177.5	-62.4	-21	0	0	0	111.7	I798 F800 H823	I798-D821 HydrophobicContact CG2-CB 3.8Å; F800-D821 WeakPolarHBondContact CB-OD1 3.5Å; D821-H823 PolarHBondContact O-ND1 3.21Å; D821-H823 VanDerWaalsContact O-ND1 3.17Å
822	I	86.3	Confident	78.8	Confident	6 Å²	6	63 Å²	63	3%	0.031	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	117	174.2	-53.8	172.9	0	0	0	108.6	L719 A730 V732 L741 I798 I799	L719-I822 HydrophobicContact CD1-CD1 4.41Å; L719-I822 HydrophobicContact CD2-CD1 3.81Å; L719-I822 HydrophobicContact CD2-CG1 3.51Å; A730-I822 HydrophobicContact CB-CD1 3.87Å; V732-I822 HydrophobicContact CG2-CG2 3.81Å; L741-I822 HydrophobicContact CD2-CD1 4.21Å; I798-I822 WeakPolarHBondContact CA-O 3.29Å; I799-I822 HydrophobicContact CB-CB 4.25Å; I799-I822 PolarHBondContact N-O 3.19Å; I799-I822 PolarHBondContact O-N 3.3Å
823	H	80.9	Confident	80.1	Confident	129 Å²	129	59 Å²	59	60%	0.597	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	119.5	176.8	-65.8	69.7	0	0	0	109.8	D821	D821-H823 PolarHBondContact O-ND1 3.21Å; D821-H823 VanDerWaalsContact O-ND1 3.17Å
824	I	78.6	Confident	81	Confident	11 Å²	11	58 Å²	58	6%	0.056	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	114.6	173	-65.7	157.8	0	0	0	108.5	I739 L766 G797 I799 Y829	I739-I824 HydrophobicContact CD1-CD1 3.29Å; I739-I824 HydrophobicContact CD1-CG1 4.04Å; I739-I824 HydrophobicContact CD1-CG2 3.88Å; I739-I824 HydrophobicContact CG2-CD1 4.46Å; L766-I824 HydrophobicContact CD1-CD1 3.44Å; L766-I824 VanDerWaalsContact CD1-CD1 3.44Å; G797-I824 PolarHBondContact O-N 3.33Å; I799-I824 HydrophobicContact CD1-CD1 3.29Å; I799-I824 HydrophobicContact CD1-CG1 4.11Å; I799-I824 HydrophobicContact CG1-CD1 3.93Å; I824-Y829 HydrophobicContact CG2-CE2 4.3Å
825	D	73.6	Confident	81.4	Confident	65 Å²	65	49.6 Å²	49.6	35%	0.348	28%	0.284	S	S	.	.			trans	-76.3	130.8	178.8	-86.8	-40.2	0	0	0	111.5	M827 K943	D825-M827 PolarHBondContact O-N 2.92Å; D825-M827 VanDerWaalsContact O-N 3.16Å; D825-K943 IonicContact OD1-NZ 3.05Å; D825-K943 PolarHBondContact OD1-NZ 3.36Å; D825-K943 IonicContact OD2-NZ 3.07Å; D825-K943 PolarHBondContact OD2-NZ 2.94Å
826	I	72.7	Confident	81.1	Confident	1 Å²	1	50 Å²	50	1%	0.005	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-61.1	-21.7	173.3	-163.3	167.7	0	0	0	114	T794 N796 D828 Y829 I830 M936	T794-I826 WeakPolarHBondContact O-CD1 3.49Å; N796-I826 PolarHBondContact OD1-N 3.25Å; I826-D828 PolarHBondContact O-N 3.15Å; I826-Y829 PolarHBondContact O-N 3.45Å; I826-I830 HydrophobicContact CG1-CD1 4.24Å; I826-I830 HydrophobicContact CG1-CG1 4.48Å; I826-I830 HydrophobicContact CG2-CD1 4.28Å; I826-M936 HydrophobicContact CD1-CB 4.46Å; I826-M936 HydrophobicContact CD1-CE 3.72Å; I826-M936 HydrophobicContact CD1-SD 3.36Å; I826-M936 WeakPolarHBondContact CD1-SD 3.23Å; I826-M936 HydrophobicContact CG1-CE 4.32Å; I826-M936 HydrophobicContact CG1-SD 4.2Å
827	M	70	Confident	80.7	Confident	14 Å²	14	49.7 Å²	49.7	7%	0.069	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-63.3	-25.7	-172.2	-71	-48.6	-48.3	0	0	114.1	D825 Y829 I830 T873 N874 L940 K943	D825-M827 PolarHBondContact O-N 2.92Å; D825-M827 VanDerWaalsContact O-N 3.16Å; M827-Y829 PolarHBondContact O-N 3.31Å; M827-I830 HydrophobicContact CE-CB 4.41Å; M827-I830 PolarHBondContact O-N 3.06Å; M827-I830 HydrophobicContact SD-CD1 4.23Å; M827-T873 VanDerWaalsContact CE-CA 3.5Å; M827-T873 WeakPolarHBondContact CE-O 3.43Å; M827-N874 HydrophobicContact CE-CB 3.87Å; M827-L940 HydrophobicContact SD-CD2 4.13Å; M827-K943 HydrophobicContact CG-CD 4.42Å; M827-K943 HydrophobicContact CG-CG 4Å; M827-K943 HydrophobicContact SD-CG 4.37Å
828	D	70.3	Confident	80.1	Confident	85 Å²	85	52.5 Å²	52.5	46%	0.455	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-66.5	-21.8	175.4	-76.1	-9.2	0	0	0	111.8	I826	I826-D828 PolarHBondContact O-N 3.15Å
829	Y	74.1	Confident	79.7	Confident	6 Å²	6	49.6 Å²	49.6	2%	0.024	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-98.4	-6.8	-179	-50.8	-73.7	0	0	0	114.3	V734 Q736 I824 I826 M827 S899 I900 F901	V734-Y829 HydrophobicContact CG1-CE1 3.48Å; V734-Y829 VanDerWaalsContact CG1-CE1 3.48Å; V734-Y829 VanDerWaalsContact CG1-CZ 3.49Å; V734-Y829 WeakPolarHBondContact CG1-OH 3.49Å; Q736-Y829 WeakPolarHBondContact O-CE1 3.28Å; I824-Y829 HydrophobicContact CG2-CE2 4.3Å; I826-Y829 PolarHBondContact O-N 3.45Å; M827-Y829 PolarHBondContact O-N 3.31Å; Y829-S899 CarbonylContact O-C 3.45Å; Y829-S899 VanDerWaalsContact O-CA 3.23Å; Y829-S899 WeakPolarHBondContact O-CA 3.4Å; Y829-I900 HydrophobicContact CD1-CD1 4.47Å; Y829-I900 WeakPolarHBondContact O-CG1 3.49Å; Y829-I900 PolarHBondContact O-N 3.07Å; Y829-F901 AromaticContact CD1-CE2 3.61Å; Y829-F901 HydrophobicContact CD1-CE2 3.61Å; Y829-F901 HydrophobicContact CD1-CZ 4.09Å; Y829-F901 HydrophobicContact CE1-CE2 4.23Å; Y829-F901 HydrophobicContact CE1-CZ 4.29Å; Y829-F901 AromaticContact CG-CE2 3.86Å; Y829-F901 HydrophobicContact CG-CE2 3.86Å
830	I	79	Confident	79.6	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.005	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	127.4	-175	-61.8	-178.9	0	0	0	110.5	I826 M827 A897 M936 L940	I826-I830 HydrophobicContact CG1-CD1 4.24Å; I826-I830 HydrophobicContact CG1-CG1 4.48Å; I826-I830 HydrophobicContact CG2-CD1 4.28Å; M827-I830 HydrophobicContact CE-CB 4.41Å; M827-I830 PolarHBondContact O-N 3.06Å; M827-I830 HydrophobicContact SD-CD1 4.23Å; I830-A897 HydrophobicContact CG2-CB 3.48Å; I830-A897 VanDerWaalsContact CG2-CB 3.48Å; I830-M936 HydrophobicContact CD1-SD 3.8Å; I830-M936 HydrophobicContact CG1-SD 4.38Å; I830-L940 HydrophobicContact CD1-CD1 4.18Å; I830-L940 HydrophobicContact CD1-CD2 3.48Å; I830-L940 VanDerWaalsContact CD1-CD2 3.48Å; I830-L940 HydrophobicContact CD1-CG 3.95Å
831	Q	78.6	Confident	79.4	Confident	95 Å²	95	54.3 Å²	54.3	44%	0.444	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	141.2	177	-60.7	-172.6	-0.1	0	0	111.2	A833 A897 R898 I900	Q831-A833 PolarHBondContact O-N 2.95Å; Q831-A897 WeakPolarHBondContact O-CB 3.11Å; Q831-R898 PolarHBondContact N-O 3.29Å; Q831-R898 PolarHBondContact O-N 3.36Å; Q831-R898 VanDerWaalsContact O-O 3.12Å; Q831-I900 HydrophobicContact CG-CG1 4.27Å
832	P	83.3	Confident	79.2	Confident	79 Å²	79	57 Å²	57	51%	0.513	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	131.3	174.9	-12.1	21.6	0	0	0	110.7	N874 K876	P832-N874 WeakPolarHBondContact CA-O 3.16Å; P832-N874 WeakPolarHBondContact CB-O 3.47Å; P832-N874 VanDerWaalsContact CG-O 3.26Å; P832-N874 WeakPolarHBondContact CG-O 3.47Å; P832-K876 HydrophobicContact CB-CB 4.23Å
833	A	82.1	Confident	79.2	Confident	21 Å²	21	58 Å²	58	17%	0.174	31%	0.307	C	S	.	.			trans	-133.1	168.2	179.2	0	0	0	0	0	111.1	Q831 K876 Y896 R898	Q831-A833 PolarHBondContact O-N 2.95Å; A833-K876 WeakPolarHBondContact O-CB 3.14Å; A833-Y896 VanDerWaalsContact C-CD1 3.44Å; A833-Y896 HydrophobicContact CB-CD1 3.84Å; A833-Y896 HydrophobicContact CB-CE1 3.41Å; A833-Y896 VanDerWaalsContact CB-CE1 3.41Å; A833-Y896 WeakPolarHBondContact O-CD1 3.5Å; A833-R898 HydrophobicContact CB-CB 3.82Å
834	T	80.8	Confident	79.6	Confident	88 Å²	88	53.9 Å²	53.9	54%	0.54	29%	0.286	S	S	.	.			trans	-126.1	140.4	174.6	49.6	0	0	0	0	111.2	K876	T834-K876 HydrophobicContact CG2-CD 3.42Å; T834-K876 VanDerWaalsContact CG2-CD 3.42Å; T834-K876 HydrophobicContact CG2-CG 4.36Å
835	C	81.6	Confident	80	Confident	22 Å²	22	57.2 Å²	57.2	15%	0.149	32%	0.315	C	S	.	.			trans	-135.9	164.7	169.4	64.9	0	0	0	0	110	E839 M843 L878 Y896	C835-E839 HydrophobicContact CB-CB 4.44Å; C835-M843 HydrophobicContact CB-CE 3.97Å; C835-L878 WeakPolarHBondContact SG-CD1 3.27Å; C835-Y896 HydrophobicContact CB-CD1 3.98Å; C835-Y896 HydrophobicContact CB-CE1 3.78Å
836	T	77.6	Confident	80.6	Confident	68 Å²	68	59.9 Å²	59.9	42%	0.417	33%	0.326	S	S	.	.			trans	-77.3	157.1	175.5	62.5	0	0	0	0	111.4	A838 E839 F840	T836-A838 PolarHBondContact O-N 3.49Å; T836-E839 PolarHBondContact N-OE2 3.45Å; T836-E839 PolarHBondContact O-N 3.01Å; T836-E839 WeakPolarHBondContact OG1-CB 3.31Å; T836-E839 WeakPolarHBondContact OG1-CG 3.3Å; T836-E839 PolarHBondContact OG1-N 3.27Å; T836-E839 PolarHBondContact OG1-OE2 2.96Å; T836-F840 WeakPolarHBondContact O-CB 3.35Å; T836-F840 PolarHBondContact O-N 3.41Å
837	D	78.9	Confident	81.4	Confident	75 Å²	75	60.7 Å²	60.7	40%	0.401	33%	0.329	S	S	.	.	H	α-helix	trans	-57.4	-34.3	177.2	-107.9	41.2	0	0	0	113.3	R841	D837-R841 VanDerWaalsContact O-CG 3.27Å; D837-R841 WeakPolarHBondContact O-CG 3.42Å; D837-R841 PolarHBondContact O-N 3.25Å; D837-R841 VanDerWaalsContact O-N 3.12Å; D837-R841 IonicContact OD2-NH2 3.07Å; D837-R841 PolarHBondContact OD2-NH2 2.95Å
838	A	76.7	Confident	82	Confident	72 Å²	72	68.4 Å²	68.4	60%	0.595	37%	0.365	S	S	*	.	H	α-helix	trans	-71.2	-47	178.1	0	0	0	0	0	111.5	T836 F840 R841 Q842	T836-A838 PolarHBondContact O-N 3.49Å; A838-F840 VanDerWaalsContact C-N 3.32Å; A838-F840 PolarHBondContact O-N 3.12Å; A838-R841 PolarHBondContact O-N 3.34Å; A838-Q842 PolarHBondContact O-N 3.08Å
839	E	81.6	Confident	82.8	Confident	51 Å²	51	69.5 Å²	69.5	24%	0.238	36%	0.363	C	S	.	.	H	α-helix	trans	-61.6	-41.8	174.7	-71.7	162.1	171	0	0	110.8	R385 C835 T836 R841 Q842 M843	R385-E839 IonicContact CZ-OE1 2.92Å; R385-E839 VanDerWaalsContact CZ-OE1 3.31Å; R385-E839 IonicContact NH1-OE1 2.84Å; R385-E839 PolarHBondContact NH1-OE1 2.98Å; R385-E839 IonicContact NH2-OE1 3.72Å; R385-E839 PolarHBondContact NH2-OE1 3.33Å; C835-E839 HydrophobicContact CB-CB 4.44Å; T836-E839 PolarHBondContact N-OE2 3.45Å; T836-E839 PolarHBondContact O-N 3.01Å; T836-E839 WeakPolarHBondContact OG1-CB 3.31Å; T836-E839 WeakPolarHBondContact OG1-CG 3.3Å; T836-E839 PolarHBondContact OG1-N 3.27Å; T836-E839 PolarHBondContact OG1-OE2 2.96Å; E839-R841 VanDerWaalsContact C-N 3.33Å; E839-R841 PolarHBondContact O-N 3.13Å; E839-Q842 PolarHBondContact O-N 3.48Å; E839-M843 HydrophobicContact CB-CE 4.32Å; E839-M843 WeakPolarHBondContact O-CB 3.29Å; E839-M843 VanDerWaalsContact O-CG 3.31Å; E839-M843 WeakPolarHBondContact O-CG 3.44Å; E839-M843 PolarHBondContact O-N 2.68Å
840	F	86.9	Confident	83.5	Confident	7 Å²	7	72.4 Å²	72.4	3%	0.031	38%	0.377	C	S	.	.	H	α-helix	trans	-55.9	-48	174.4	-176.2	-84.8	0	0	0	111.1	T836 A838 W844 L878 N894 L906	T836-F840 WeakPolarHBondContact O-CB 3.35Å; T836-F840 PolarHBondContact O-N 3.41Å; A838-F840 VanDerWaalsContact C-N 3.32Å; A838-F840 PolarHBondContact O-N 3.12Å; F840-W844 HydrophobicContact CE1-CB 4.48Å; F840-W844 HydrophobicContact CE1-CD2 4.19Å; F840-W844 AromaticContact CE1-CE3 3.71Å; F840-W844 HydrophobicContact CE1-CE3 3.71Å; F840-W844 HydrophobicContact CE1-CZ3 4.35Å; F840-W844 HydrophobicContact CE2-CE3 4.49Å; F840-W844 HydrophobicContact CZ-CD2 4.48Å; F840-W844 AromaticContact CZ-CE3 3.58Å; F840-W844 HydrophobicContact CZ-CE3 3.58Å; F840-W844 AromaticContact CZ-CZ3 3.88Å; F840-W844 HydrophobicContact CZ-CZ3 3.88Å; F840-W844 WeakPolarHBondContact O-CB 3.48Å; F840-W844 PolarHBondContact O-N 3.38Å; F840-L878 HydrophobicContact CB-CD1 4.47Å; F840-L878 HydrophobicContact CD2-CD1 3.6Å; F840-L878 HydrophobicContact CE2-CD1 4.24Å; F840-L878 HydrophobicContact CG-CD1 4.31Å; F840-N894 HydrophobicContact CE1-CB 4.19Å; F840-N894 HydrophobicContact CE2-CB 4.06Å; F840-N894 HydrophobicContact CZ-CB 3.87Å; F840-L906 HydrophobicContact CD2-CD2 3.41Å; F840-L906 VanDerWaalsContact CD2-CD2 3.41Å; F840-L906 HydrophobicContact CD2-CG 4.43Å; F840-L906 HydrophobicContact CE2-CB 3.85Å; F840-L906 HydrophobicContact CE2-CD2 3.49Å; F840-L906 VanDerWaalsContact CE2-CD2 3.49Å; F840-L906 HydrophobicContact CE2-CG 4.15Å; F840-L906 HydrophobicContact CG-CD2 4.32Å; F840-L906 HydrophobicContact CZ-CB 4.17Å; F840-L906 HydrophobicContact CZ-CD2 4.45Å
841	R	85.9	Confident	84.1	Confident	169 Å²	169	73.7 Å²	73.7	64%	0.638	38%	0.384	S	S	*	.	H	α-helix	trans	-66.8	-37.4	179.3	-70.9	172.1	-160.4	-173.8	7.2	112.8	D837 A838 E839 A845	D837-R841 VanDerWaalsContact O-CG 3.27Å; D837-R841 WeakPolarHBondContact O-CG 3.42Å; D837-R841 PolarHBondContact O-N 3.25Å; D837-R841 VanDerWaalsContact O-N 3.12Å; D837-R841 IonicContact OD2-NH2 3.07Å; D837-R841 PolarHBondContact OD2-NH2 2.95Å; A838-R841 PolarHBondContact O-N 3.34Å; E839-R841 VanDerWaalsContact C-N 3.33Å; E839-R841 PolarHBondContact O-N 3.13Å; R841-A845 WeakPolarHBondContact O-CB 3.38Å; R841-A845 PolarHBondContact O-N 2.9Å
842	Q	84.3	Confident	84.6	Confident	132 Å²	132	74.7 Å²	74.7	62%	0.617	39%	0.386	S	S	*	.	H	α-helix	trans	-64.5	-53.7	176	-178.6	178.3	-5.2	0	0	110.6	A838 E839 W844 A845 E846	A838-Q842 PolarHBondContact O-N 3.08Å; E839-Q842 PolarHBondContact O-N 3.48Å; Q842-W844 VanDerWaalsContact C-N 3.26Å; Q842-W844 PolarHBondContact O-N 3.4Å; Q842-A845 PolarHBondContact O-N 3.19Å; Q842-A845 VanDerWaalsContact O-N 3.08Å; Q842-E846 WeakPolarHBondContact O-CB 3.4Å; Q842-E846 PolarHBondContact O-N 3.19Å
843	M	86.2	Confident	84.9	Confident	26 Å²	26	71 Å²	71	13%	0.128	36%	0.363	C	S	.	.	H	α-helix	trans	-60.6	-38.8	176.9	-67	-175.1	-69.4	0	0	111.1	C835 E839 A845 E846 F847 Y896 D904 L906	C835-M843 HydrophobicContact CB-CE 3.97Å; E839-M843 HydrophobicContact CB-CE 4.32Å; E839-M843 WeakPolarHBondContact O-CB 3.29Å; E839-M843 VanDerWaalsContact O-CG 3.31Å; E839-M843 WeakPolarHBondContact O-CG 3.44Å; E839-M843 PolarHBondContact O-N 2.68Å; M843-A845 VanDerWaalsContact C-N 3.28Å; M843-A845 PolarHBondContact O-N 2.96Å; M843-E846 PolarHBondContact O-N 3.44Å; M843-F847 HydrophobicContact CB-CE1 4.11Å; M843-F847 HydrophobicContact CB-CE2 4.31Å; M843-F847 HydrophobicContact CB-CZ 3.93Å; M843-F847 HydrophobicContact CG-CZ 4.36Å; M843-F847 WeakPolarHBondContact O-CB 3.4Å; M843-F847 VanDerWaalsContact O-CD1 3.24Å; M843-F847 WeakPolarHBondContact O-CD1 3.31Å; M843-F847 WeakPolarHBondContact O-CG 3.49Å; M843-F847 PolarHBondContact O-N 2.86Å; M843-F847 HydrophobicContact SD-CZ 4.39Å; M843-Y896 HydrophobicContact CE-CE2 4.27Å; M843-D904 HydrophobicContact SD-CB 4.37Å; M843-L906 HydrophobicContact CB-CD1 3.68Å; M843-L906 HydrophobicContact CE-CD2 3.95Å
844	W	89.4	Confident	85.3	Confident	43 Å²	43	73.4 Å²	73.4	16%	0.163	38%	0.375	C	S	.	.	H	α-helix	trans	-60.8	-38.3	175.9	-170.2	-86.5	0	0	0	112	F840 Q842 L906 N908 R928 R930	F840-W844 HydrophobicContact CE1-CB 4.48Å; F840-W844 HydrophobicContact CE1-CD2 4.19Å; F840-W844 AromaticContact CE1-CE3 3.71Å; F840-W844 HydrophobicContact CE1-CE3 3.71Å; F840-W844 HydrophobicContact CE1-CZ3 4.35Å; F840-W844 HydrophobicContact CE2-CE3 4.49Å; F840-W844 HydrophobicContact CZ-CD2 4.48Å; F840-W844 AromaticContact CZ-CE3 3.58Å; F840-W844 HydrophobicContact CZ-CE3 3.58Å; F840-W844 AromaticContact CZ-CZ3 3.88Å; F840-W844 HydrophobicContact CZ-CZ3 3.88Å; F840-W844 WeakPolarHBondContact O-CB 3.48Å; F840-W844 PolarHBondContact O-N 3.38Å; Q842-W844 VanDerWaalsContact C-N 3.26Å; Q842-W844 PolarHBondContact O-N 3.4Å; W844-L906 HydrophobicContact CB-CD1 4.23Å; W844-L906 HydrophobicContact CE3-CB 3.77Å; W844-L906 HydrophobicContact CE3-CD1 4.06Å; W844-L906 HydrophobicContact CZ3-CB 3.87Å; W844-N908 HydrophobicContact CH2-CB 3.52Å; W844-N908 HydrophobicContact CZ2-CB 4.09Å; W844-N908 HydrophobicContact CZ3-CB 4.04Å; W844-R928 HydrophobicContact CH2-CB 3.94Å; W844-R928 WeakPolarHBondContact CH2-O 3.41Å; W844-R928 HydrophobicContact CZ2-CB 4.11Å; W844-R930 HydrophobicContact CD2-CG 4.35Å; W844-R930 HydrophobicContact CE3-CB 4.26Å; W844-R930 HydrophobicContact CE3-CG 4.31Å; W844-R930 HydrophobicContact CH2-CG 4.02Å; W844-R930 HydrophobicContact CZ2-CG 4.06Å; W844-R930 HydrophobicContact CZ3-CB 4.19Å; W844-R930 HydrophobicContact CZ3-CG 4.14Å; W844-R930 WeakPolarHBondContact O-CD 3.24Å; W844-R930 PolarHBondContact O-NH1 3.37Å
845	A	86.2	Confident	85.5	Confident	81 Å²	81	69.2 Å²	69.2	67%	0.669	35%	0.35	S	S	*	.	H	α-helix	trans	-76	-33.2	176.8	0	0	0	0	0	113	R841 Q842 M843	R841-A845 WeakPolarHBondContact O-CB 3.38Å; R841-A845 PolarHBondContact O-N 2.9Å; Q842-A845 PolarHBondContact O-N 3.19Å; Q842-A845 VanDerWaalsContact O-N 3.08Å; M843-A845 VanDerWaalsContact C-N 3.28Å; M843-A845 PolarHBondContact O-N 2.96Å
846	E	87.3	Confident	85.4	Confident	122 Å²	122	73.1 Å²	73.1	57%	0.57	37%	0.369	S	S	*	.	H	α-helix	trans	-74.8	-34.8	179.2	-172.5	179.6	167.2	0	0	112.6	Q842 M843 E848	Q842-E846 WeakPolarHBondContact O-CB 3.4Å; Q842-E846 PolarHBondContact O-N 3.19Å; M843-E846 PolarHBondContact O-N 3.44Å; E846-E848 PolarHBondContact O-N 3.47Å
847	F	88.2	Confident	85.5	Confident	17 Å²	17	70.2 Å²	70.2	8%	0.075	35%	0.351	C	S	.	.			trans	-71.2	117.8	-176.6	-69.2	-0.2	0	0	0	111.4	M843 D904 L906 R930 K932	M843-F847 HydrophobicContact CB-CE1 4.11Å; M843-F847 HydrophobicContact CB-CE2 4.31Å; M843-F847 HydrophobicContact CB-CZ 3.93Å; M843-F847 HydrophobicContact CG-CZ 4.36Å; M843-F847 WeakPolarHBondContact O-CB 3.4Å; M843-F847 VanDerWaalsContact O-CD1 3.24Å; M843-F847 WeakPolarHBondContact O-CD1 3.31Å; M843-F847 WeakPolarHBondContact O-CG 3.49Å; M843-F847 PolarHBondContact O-N 2.86Å; M843-F847 HydrophobicContact SD-CZ 4.39Å; F847-D904 HydrophobicContact CE2-CB 4.28Å; F847-D904 WeakPolarHBondContact CE2-O 3.37Å; F847-D904 HydrophobicContact CZ-CB 3.83Å; F847-L906 HydrophobicContact CD2-CD1 3.6Å; F847-L906 HydrophobicContact CD2-CG 4.15Å; F847-L906 HydrophobicContact CE2-CD1 3.51Å; F847-L906 HydrophobicContact CE2-CG 3.77Å; F847-L906 HydrophobicContact CZ-CD1 4.37Å; F847-R930 HydrophobicContact CB-CB 4.04Å; F847-R930 HydrophobicContact CD2-CB 4.12Å; F847-K932 HydrophobicContact CE1-CB 4.43Å
848	E	84.1	Confident	85.6	Confident	176 Å²	176	72.3 Å²	72.3	82%	0.822	36%	0.362	S	S	*	.			trans	-76.9	-35.1	-177.3	-60.2	-176.8	167.8	0	0	112.4	E846	E846-E848 PolarHBondContact O-N 3.47Å
849	W	86.4	Confident	85.7	Confident	108 Å²	108	69.7 Å²	69.7	41%	0.409	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	124.9	-174.9	-64.8	100.1	0	0	0	111.9	R930 A931 Q934 A937	W849-R930 VanDerWaalsContact O-CA 3.29Å; W849-R930 WeakPolarHBondContact O-CA 3.46Å; W849-A931 PolarHBondContact O-N 2.85Å; W849-Q934 HydrophobicContact CD2-CB 3.59Å; W849-Q934 HydrophobicContact CD2-CG 3.85Å; W849-Q934 HydrophobicContact CE3-CB 3.84Å; W849-Q934 HydrophobicContact CE3-CG 3.52Å; W849-Q934 HydrophobicContact CG-CB 4.02Å; W849-Q934 HydrophobicContact CH2-CB 4.27Å; W849-Q934 VanDerWaalsContact CH2-CD 3.43Å; W849-Q934 HydrophobicContact CH2-CG 4.07Å; W849-Q934 VanDerWaalsContact CH2-OE1 3.23Å; W849-Q934 HydrophobicContact CZ2-CB 4.07Å; W849-Q934 HydrophobicContact CZ2-CG 4.38Å; W849-Q934 HydrophobicContact CZ3-CB 4.17Å; W849-Q934 HydrophobicContact CZ3-CG 3.64Å; W849-A937 HydrophobicContact CB-CB 4.45Å
850	E	89.1	Confident	85.7	Confident	68 Å²	68	71.1 Å²	71.1	32%	0.318	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	132.1	177.5	-175.7	-174	149.3	0	0	111.1	R928 I929 R930	E850-R928 IonicContact OE1-CZ 3.82Å; E850-R928 IonicContact OE1-NE 2.7Å; E850-R928 PolarHBondContact OE1-NE 3.49Å; E850-R928 IonicContact OE1-NH2 3.73Å; E850-R928 PolarHBondContact OE1-NH2 3.33Å; E850-R928 IonicContact OE2-CZ 3.2Å; E850-R928 IonicContact OE2-NE 2.75Å; E850-R928 IonicContact OE2-NH2 2.73Å; E850-R928 PolarHBondContact OE2-NH2 3.04Å; E850-I929 CarbonylContact C-O 3.6Å; E850-I929 VanDerWaalsContact CA-O 3.32Å; E850-I929 WeakPolarHBondContact CA-O 3.3Å; E850-R930 HydrophobicContact CB-CG 4.04Å; E850-R930 HydrophobicContact CG-CG 4.02Å; E850-R930 IonicContact OE2-CZ 3.47Å; E850-R930 IonicContact OE2-NE 3.46Å; E850-R930 PolarHBondContact OE2-NE 2.96Å; E850-R930 IonicContact OE2-NH2 3.42Å; E850-R930 PolarHBondContact OE2-NH2 3.29Å
851	N	90.5	Very high	85.5	Confident	28 Å²	28	74 Å²	74	15%	0.15	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.4	168.2	-170.6	7.6	0	0	0	110.3	R928 I929 A937 L938	N851-R928 WeakPolarHBondContact O-CA 3.49Å; N851-I929 PolarHBondContact N-O 3.49Å; N851-I929 PolarHBondContact O-N 2.92Å; N851-A937 HydrophobicContact CB-CB 4.4Å; N851-A937 WeakPolarHBondContact CB-O 3.37Å; N851-A937 PolarHBondContact ND2-O 3.42Å; N851-A937 VanDerWaalsContact ND2-O 3.11Å; N851-L938 HydrophobicContact CB-CD2 4.46Å
852	K	90.4	Very high	85.4	Confident	115 Å²	115	67 Å²	67	50%	0.5	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	112.5	178.9	-174.5	179.3	178.2	-173.8	0	110	H926 R928	K852-H926 HydrophobicContact CG-CB 4.47Å; K852-R928 HydrophobicContact CG-CG 4.23Å
853	V	89.8	Confident	85.3	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.012	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.4	-179.4	-179.2	0	0	0	0	110	H926 I927 I929 I944 N945	V853-H926 CarbonylContact O-C 3.5Å; V853-H926 VanDerWaalsContact O-CA 3.3Å; V853-H926 WeakPolarHBondContact O-CA 3.38Å; V853-I927 HydrophobicContact CB-CB 4.4Å; V853-I927 PolarHBondContact N-O 3.23Å; V853-I927 PolarHBondContact O-N 2.89Å; V853-I929 HydrophobicContact CG2-CD1 4.17Å; V853-I944 HydrophobicContact CG1-CG2 3.98Å; V853-N945 WeakPolarHBondContact CG1-OD1 3.39Å
854	T	88.6	Confident	85.2	Confident	71 Å²	71	67.6 Å²	67.6	44%	0.436	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	132.5	173.3	44.2	0	0	0	0	110.2	Q948	T854-Q948 PolarHBondContact O-NE2 3.19Å; T854-Q948 PolarHBondContact O-OE1 3.09Å
855	V	85.1	Confident	85.1	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.006	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	113.8	-177.5	175	0	0	0	0	109.7	T857 Y865 I911 G925 I927	V855-T857 HydrophobicContact CG1-CG2 3.45Å; V855-T857 VanDerWaalsContact CG1-CG2 3.45Å; V855-Y865 HydrophobicContact CG1-CD1 4.46Å; V855-Y865 HydrophobicContact CG1-CE1 3.61Å; V855-Y865 HydrophobicContact CG1-CE2 4.36Å; V855-Y865 WeakPolarHBondContact CG1-OH 3.46Å; V855-Y865 HydrophobicContact CG2-CE1 4.26Å; V855-I911 HydrophobicContact CG1-CG2 4.3Å; V855-I911 HydrophobicContact CG2-CG2 4.17Å; V855-G925 PolarHBondContact N-O 3.29Å; V855-I927 HydrophobicContact CG2-CD1 3.73Å; V855-I927 HydrophobicContact CG2-CG1 3.66Å
856	N	80.8	Confident	85.1	Confident	103 Å²	103	61.9 Å²	61.9	55%	0.551	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128	98	175.9	-71.6	-31.7	0	0	0	109.8	Q948	N856-Q948 PolarHBondContact O-OE1 3.13Å
857	T	79.8	Confident	84.9	Confident	8 Å²	8	61.4 Å²	61.4	5%	0.049	31%	0.305	C	S	.	.			trans	-122.4	166.6	-168.5	74.2	0	0	0	0	111.8	V855 M859 Y865 A922 V923 Q948	V855-T857 HydrophobicContact CG1-CG2 3.45Å; V855-T857 VanDerWaalsContact CG1-CG2 3.45Å; T857-M859 PolarHBondContact OG1-N 3.44Å; T857-Y865 HydrophobicContact CG2-CD2 3.61Å; T857-Y865 HydrophobicContact CG2-CE1 4.43Å; T857-Y865 HydrophobicContact CG2-CE2 3.15Å; T857-Y865 HydrophobicContact CG2-CG 4.43Å; T857-A922 WeakPolarHBondContact O-CB 3.21Å; T857-V923 PolarHBondContact OG1-O 2.98Å; T857-Q948 HydrophobicContact CG2-CB 4.32Å; T857-Q948 WeakPolarHBondContact CG2-O 3.46Å
858	N	81.3	Confident	84.8	Confident	118 Å²	118	62.8 Å²	62.8	63%	0.631	31%	0.311	S	S	*	.	S	Bend	trans	-100.2	6.5	168.4	-61.8	-2.5	0	0	0	111.5
859	M	78.5	Confident	84.9	Confident	18 Å²	18	54.4 Å²	54.4	9%	0.089	27%	0.272	C	S	.	.			trans	-87.3	142.7	-176	-63.5	-168.3	179.1	0	0	110.4	T857 Y865 H868 A922 V923 K950	T857-M859 PolarHBondContact OG1-N 3.44Å; M859-Y865 HydrophobicContact SD-CD2 3.81Å; M859-Y865 HydrophobicContact SD-CG 4.41Å; M859-H868 HydrophobicContact CE-CB 3.76Å; M859-H868 VanDerWaalsContact CE-CD2 3.49Å; M859-H868 WeakPolarHBondContact CE-CD2 3.27Å; M859-H868 VanDerWaalsContact CE-CG 3.47Å; M859-H868 HydrophobicContact SD-CB 4.17Å; M859-A922 WeakPolarHBondContact O-CA 3.32Å; M859-V923 WeakPolarHBondContact O-CG2 3.39Å; M859-V923 PolarHBondContact O-N 3.38Å; M859-K950 HydrophobicContact CE-CB 3.75Å; M859-K950 HydrophobicContact CE-CD 4.01Å; M859-K950 HydrophobicContact CE-CG 3.94Å
860	I	80.6	Confident	84.8	Confident	80 Å²	80	51.2 Å²	51.2	41%	0.41	26%	0.262	S	S	.	.			trans	-101.4	-27.6	-174.1	-56.4	170.1	0	0	0	111.4	K913 P919	I860-K913 VanDerWaalsContact CG2-NZ 3.26Å; I860-K913 PolarHBondContact O-NZ 3.34Å; I860-K913 VanDerWaalsContact O-NZ 3.14Å; I860-P919 WeakPolarHBondContact CG2-O 3.39Å
861	D	82.6	Confident	84.6	Confident	69 Å²	69	56.6 Å²	56.6	37%	0.369	29%	0.285	S	S	.	.			trans	-101.2	137.5	179.3	-173.6	40.3	0	0	0	112.2	N863 D864 Y865	D861-N863 PolarHBondContact OD2-N 2.92Å; D861-D864 HydrophobicContact CB-CB 4.07Å; D861-D864 PolarHBondContact OD2-N 3.34Å; D861-Y865 PolarHBondContact O-N 2.89Å
862	L	83.4	Confident	84.2	Confident	21 Å²	21	56.9 Å²	56.9	11%	0.11	29%	0.289	C	S	.	.	H	α-helix	trans	-71.8	-39.7	-177.1	-66.9	170.2	0	0	0	110.9	Y865 L866 M891 I911 V923	L862-Y865 PolarHBondContact O-N 3.35Å; L862-L866 PolarHBondContact O-N 2.87Å; L862-L866 VanDerWaalsContact O-N 3.08Å; L862-M891 HydrophobicContact CB-CE 4.05Å; L862-M891 HydrophobicContact CB-SD 4.5Å; L862-M891 HydrophobicContact CD1-CB 4.32Å; L862-M891 WeakPolarHBondContact O-CE 3.49Å; L862-I911 HydrophobicContact CB-CD1 4.23Å; L862-I911 HydrophobicContact CD2-CB 4.25Å; L862-I911 HydrophobicContact CD2-CD1 3.79Å; L862-I911 HydrophobicContact CD2-CG1 3.86Å; L862-V923 HydrophobicContact CD2-CB 4.32Å; L862-V923 HydrophobicContact CD2-CG1 3.67Å; L862-V923 HydrophobicContact CD2-CG2 3.73Å; L862-V923 HydrophobicContact CG-CG2 4.37Å
863	N	83.8	Confident	83.7	Confident	76 Å²	76	51.4 Å²	51.4	41%	0.406	27%	0.265	S	S	.	.	H	α-helix	trans	-73.1	-42.8	-177.7	-164.3	4.2	0	0	0	111.3	D861 Y865 L866 Q867	D861-N863 PolarHBondContact OD2-N 2.92Å; N863-Y865 VanDerWaalsContact C-N 3.27Å; N863-Y865 PolarHBondContact O-N 2.74Å; N863-L866 PolarHBondContact O-N 3.39Å; N863-L866 VanDerWaalsContact O-N 3.14Å; N863-Q867 WeakPolarHBondContact O-CG 3.48Å; N863-Q867 PolarHBondContact O-N 3.12Å
864	D	84.1	Confident	83.3	Confident	95 Å²	95	53.7 Å²	53.7	51%	0.508	28%	0.278	S	S	.	.	H	α-helix	trans	-56.4	-41.2	172.7	-74.2	-12.3	0	0	0	112.2	D861 Q867 H868	D861-D864 HydrophobicContact CB-CB 4.07Å; D861-D864 PolarHBondContact OD2-N 3.34Å; D864-Q867 PolarHBondContact O-N 3.29Å; D864-H868 WeakPolarHBondContact O-CB 3.44Å; D864-H868 PolarHBondContact O-N 3.04Å
865	Y	86.1	Confident	83.2	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66	-42.4	175.9	-178.6	-109.1	0	0	0	112.4	V855 T857 M859 D861 L862 N863 H868 I869 I911 V923 I927	V855-Y865 HydrophobicContact CG1-CD1 4.46Å; V855-Y865 HydrophobicContact CG1-CE1 3.61Å; V855-Y865 HydrophobicContact CG1-CE2 4.36Å; V855-Y865 WeakPolarHBondContact CG1-OH 3.46Å; V855-Y865 HydrophobicContact CG2-CE1 4.26Å; T857-Y865 HydrophobicContact CG2-CD2 3.61Å; T857-Y865 HydrophobicContact CG2-CE1 4.43Å; T857-Y865 HydrophobicContact CG2-CE2 3.15Å; T857-Y865 HydrophobicContact CG2-CG 4.43Å; M859-Y865 HydrophobicContact SD-CD2 3.81Å; M859-Y865 HydrophobicContact SD-CG 4.41Å; D861-Y865 PolarHBondContact O-N 2.89Å; L862-Y865 PolarHBondContact O-N 3.35Å; N863-Y865 VanDerWaalsContact C-N 3.27Å; N863-Y865 PolarHBondContact O-N 2.74Å; Y865-H868 WeakPolarHBondContact O-CB 3.42Å; Y865-H868 PolarHBondContact O-N 3.33Å; Y865-I869 HydrophobicContact CD1-CG1 4.37Å; Y865-I869 HydrophobicContact CD2-CG1 4.44Å; Y865-I869 HydrophobicContact CE1-CD1 4.5Å; Y865-I869 HydrophobicContact CE1-CG1 3.86Å; Y865-I869 HydrophobicContact CE2-CD1 4Å; Y865-I869 HydrophobicContact CE2-CG1 3.91Å; Y865-I869 WeakPolarHBondContact O-CG1 3.41Å; Y865-I869 PolarHBondContact O-N 3.27Å; Y865-I911 HydrophobicContact CD1-CD1 3.82Å; Y865-I911 HydrophobicContact CD1-CG2 4.19Å; Y865-I911 HydrophobicContact CE1-CG2 4.01Å; Y865-V923 HydrophobicContact CD1-CG1 4.33Å; Y865-I927 HydrophobicContact CE1-CD1 4.43Å
866	L	86.1	Confident	83.3	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	28%	0.278	C	S	.	.	H	α-helix	trans	-62.1	-44.6	175.7	179.6	65.3	0	0	0	111.5	L862 N863 H868 I869 L870 L884 M891 A893 L895	L862-L866 PolarHBondContact O-N 2.87Å; L862-L866 VanDerWaalsContact O-N 3.08Å; N863-L866 PolarHBondContact O-N 3.39Å; N863-L866 VanDerWaalsContact O-N 3.14Å; L866-H868 VanDerWaalsContact C-N 3.3Å; L866-H868 PolarHBondContact O-N 3.22Å; L866-I869 PolarHBondContact O-N 3.26Å; L866-L870 HydrophobicContact CG-CD1 4.14Å; L866-L870 VanDerWaalsContact O-CG 3.25Å; L866-L870 WeakPolarHBondContact O-CG 3.49Å; L866-L870 PolarHBondContact O-N 3.24Å; L866-L884 HydrophobicContact CD2-CD1 4.07Å; L866-L884 HydrophobicContact CD2-CD2 4.35Å; L866-M891 HydrophobicContact CB-CE 3.63Å; L866-M891 HydrophobicContact CD2-CE 3.75Å; L866-M891 HydrophobicContact CD2-SD 4.38Å; L866-M891 HydrophobicContact CG-CE 4.23Å; L866-A893 HydrophobicContact CD1-CB 3.98Å; L866-A893 HydrophobicContact CD2-CB 4.11Å; L866-L895 HydrophobicContact CD1-CD2 4.27Å
867	Q	84.3	Confident	83.6	Confident	112 Å²	112	51.9 Å²	51.9	52%	0.523	26%	0.263	S	S	.	.	H	α-helix	trans	-62.8	-37.6	175.9	-70.6	-170.9	7.5	0	0	112.3	N863 D864 L870 K871	N863-Q867 WeakPolarHBondContact O-CG 3.48Å; N863-Q867 PolarHBondContact O-N 3.12Å; D864-Q867 PolarHBondContact O-N 3.29Å; Q867-L870 PolarHBondContact O-N 3.5Å; Q867-K871 WeakPolarHBondContact O-CB 3.45Å; Q867-K871 PolarHBondContact O-N 3.47Å
868	H	85.2	Confident	83.7	Confident	45 Å²	45	53 Å²	53	21%	0.208	27%	0.268	C	S	.	.	H	α-helix	trans	-60.3	-50.1	173.7	-173.8	-90.7	0	0	0	111.4	M859 D864 Y865 L866 L870 K871 S872 S947	M859-H868 HydrophobicContact CE-CB 3.76Å; M859-H868 VanDerWaalsContact CE-CD2 3.49Å; M859-H868 WeakPolarHBondContact CE-CD2 3.27Å; M859-H868 VanDerWaalsContact CE-CG 3.47Å; M859-H868 HydrophobicContact SD-CB 4.17Å; D864-H868 WeakPolarHBondContact O-CB 3.44Å; D864-H868 PolarHBondContact O-N 3.04Å; Y865-H868 WeakPolarHBondContact O-CB 3.42Å; Y865-H868 PolarHBondContact O-N 3.33Å; L866-H868 VanDerWaalsContact C-N 3.3Å; L866-H868 PolarHBondContact O-N 3.22Å; H868-L870 VanDerWaalsContact C-N 3.35Å; H868-L870 PolarHBondContact O-N 2.91Å; H868-K871 PolarHBondContact O-N 3.38Å; H868-S872 PolarHBondContact O-N 2.84Å; H868-S872 PolarHBondContact O-OG 3.15Å; H868-S872 VanDerWaalsContact O-OG 3.11Å; H868-S947 PolarHBondContact CE1-O 3.03Å; H868-S947 PolarHBondContact ND1-O 3.44Å
869	I	86.1	Confident	83.8	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-61	-43.8	177.2	-67.6	-61	0	0	0	111.1	Y865 L866 K871 S872 T873 L895 I944	Y865-I869 HydrophobicContact CD1-CG1 4.37Å; Y865-I869 HydrophobicContact CD2-CG1 4.44Å; Y865-I869 HydrophobicContact CE1-CD1 4.5Å; Y865-I869 HydrophobicContact CE1-CG1 3.86Å; Y865-I869 HydrophobicContact CE2-CD1 4Å; Y865-I869 HydrophobicContact CE2-CG1 3.91Å; Y865-I869 WeakPolarHBondContact O-CG1 3.41Å; Y865-I869 PolarHBondContact O-N 3.27Å; L866-I869 PolarHBondContact O-N 3.26Å; I869-K871 VanDerWaalsContact C-N 3.29Å; I869-K871 PolarHBondContact O-N 3.48Å; I869-S872 PolarHBondContact O-N 3.17Å; I869-S872 VanDerWaalsContact O-N 3.16Å; I869-T873 HydrophobicContact CG2-CG2 4.06Å; I869-T873 WeakPolarHBondContact O-CB 3.4Å; I869-T873 WeakPolarHBondContact O-CG2 3.29Å; I869-T873 PolarHBondContact O-N 3.23Å; I869-T873 PolarHBondContact O-OG1 3.46Å; I869-L895 HydrophobicContact CG2-CD1 4.16Å; I869-I944 HydrophobicContact CD1-CG2 4.2Å
870	L	85.8	Confident	83.5	Confident	40 Å²	40	50 Å²	50	21%	0.209	26%	0.256	C	S	.	.	H	α-helix	trans	-57.5	-43.7	176.9	-72.4	168.8	0	0	0	111.7	L866 Q867 H868 N874 M875 C877 L895	L866-L870 HydrophobicContact CG-CD1 4.14Å; L866-L870 VanDerWaalsContact O-CG 3.25Å; L866-L870 WeakPolarHBondContact O-CG 3.49Å; L866-L870 PolarHBondContact O-N 3.24Å; Q867-L870 PolarHBondContact O-N 3.5Å; H868-L870 VanDerWaalsContact C-N 3.35Å; H868-L870 PolarHBondContact O-N 2.91Å; L870-N874 PolarHBondContact O-N 2.87Å; L870-N874 VanDerWaalsContact O-N 3.11Å; L870-M875 WeakPolarHBondContact CD2-O 3.42Å; L870-C877 HydrophobicContact CD1-CB 4.16Å; L870-C877 HydrophobicContact CD2-CB 4.03Å; L870-L895 HydrophobicContact CD2-CD1 4.46Å; L870-L895 HydrophobicContact CD2-CD2 3.56Å; L870-L895 HydrophobicContact CG-CD2 4.48Å
871	K	83.3	Confident	83	Confident	181 Å²	181	52.6 Å²	52.6	79%	0.787	27%	0.266	S	S	*	.	H	α-helix	trans	-67.7	-37	177.4	-164	176.5	-175.6	179.1	0	112.6	Q867 H868 I869	Q867-K871 WeakPolarHBondContact O-CB 3.45Å; Q867-K871 PolarHBondContact O-N 3.47Å; H868-K871 PolarHBondContact O-N 3.38Å; I869-K871 VanDerWaalsContact C-N 3.29Å; I869-K871 PolarHBondContact O-N 3.48Å
872	S	82.1	Confident	82.2	Confident	34 Å²	34	53.6 Å²	53.6	24%	0.238	27%	0.267	C	S	.	.	H	α-helix	trans	-76.8	-29.3	179.9	-61.4	0	0	0	0	113.8	H868 I869	H868-S872 PolarHBondContact O-N 2.84Å; H868-S872 PolarHBondContact O-OG 3.15Å; H868-S872 VanDerWaalsContact O-OG 3.11Å; I869-S872 PolarHBondContact O-N 3.17Å; I869-S872 VanDerWaalsContact O-N 3.16Å
873	T	79.7	Confident	81.5	Confident	1 Å²	1	56 Å²	56	1%	0.006	29%	0.291	C	S	.	.	H	α-helix	trans	-107.9	-1	-171.3	60.6	0	0	0	0	114.2	M827 I869 M875 I944	M827-T873 VanDerWaalsContact CE-CA 3.5Å; M827-T873 WeakPolarHBondContact CE-O 3.43Å; I869-T873 HydrophobicContact CG2-CG2 4.06Å; I869-T873 WeakPolarHBondContact O-CB 3.4Å; I869-T873 WeakPolarHBondContact O-CG2 3.29Å; I869-T873 PolarHBondContact O-N 3.23Å; I869-T873 PolarHBondContact O-OG1 3.46Å; T873-M875 WeakPolarHBondContact O-CG 3.34Å; T873-M875 PolarHBondContact O-N 3.17Å; T873-I944 HydrophobicContact CG2-CD1 3.94Å; T873-I944 HydrophobicContact CG2-CG1 3.53Å
874	N	83.1	Confident	80.8	Confident	50 Å²	50	54.2 Å²	54.2	27%	0.267	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	25	-176.1	-67	-29.5	0	0	0	113.7	M827 P832 L870	M827-N874 HydrophobicContact CE-CB 3.87Å; P832-N874 WeakPolarHBondContact CA-O 3.16Å; P832-N874 WeakPolarHBondContact CB-O 3.47Å; P832-N874 VanDerWaalsContact CG-O 3.26Å; P832-N874 WeakPolarHBondContact CG-O 3.47Å; L870-N874 PolarHBondContact O-N 2.87Å; L870-N874 VanDerWaalsContact O-N 3.11Å
875	M	85.3	Confident	79.8	Confident	8 Å²	8	53.7 Å²	53.7	4%	0.039	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-89.5	154.2	177.9	-62.3	-163.8	171.4	0	0	110.3	L870 T873 L895 A897 A905 A907 L940	L870-M875 WeakPolarHBondContact CD2-O 3.42Å; T873-M875 WeakPolarHBondContact O-CG 3.34Å; T873-M875 PolarHBondContact O-N 3.17Å; M875-L895 HydrophobicContact CB-CB 4.06Å; M875-L895 HydrophobicContact CB-CD1 4.48Å; M875-L895 HydrophobicContact SD-CB 3.87Å; M875-L895 HydrophobicContact SD-CD1 4.39Å; M875-A897 HydrophobicContact CB-CB 4.35Å; M875-A897 HydrophobicContact CG-CB 3.83Å; M875-A905 HydrophobicContact CE-CB 4.32Å; M875-A907 HydrophobicContact SD-CB 3.97Å; M875-L940 HydrophobicContact CE-CD1 3.56Å; M875-L940 HydrophobicContact CE-CD2 3.78Å; M875-L940 HydrophobicContact CE-CG 4.26Å
876	K	86.4	Confident	78.7	Confident	96 Å²	96	56.5 Å²	56.5	42%	0.417	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	134.8	172.5	-171.1	161.1	172.5	-178	0	110	P832 A833 T834 L895 Y896	P832-K876 HydrophobicContact CB-CB 4.23Å; A833-K876 WeakPolarHBondContact O-CB 3.14Å; T834-K876 HydrophobicContact CG2-CD 3.42Å; T834-K876 VanDerWaalsContact CG2-CD 3.42Å; T834-K876 HydrophobicContact CG2-CG 4.36Å; K876-L895 WeakPolarHBondContact O-CA 3.19Å; K876-Y896 PolarHBondContact N-O 3.34Å; K876-Y896 PolarHBondContact O-N 3.4Å
877	C	87.1	Confident	77.6	Confident	33 Å²	33	67.7 Å²	67.7	22%	0.223	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	126.7	171.9	-165.9	0	0	0	0	110	L870 L895	L870-C877 HydrophobicContact CD1-CB 4.16Å; L870-C877 HydrophobicContact CD2-CB 4.03Å; C877-L895 HydrophobicContact CB-CD2 3.86Å
878	L	83.3	Confident	76.6	Confident	30 Å²	30	67 Å²	67	16%	0.157	36%	0.364	C	S	.	.			trans	-91.8	-26	176.3	-59.4	179.5	0	0	0	112.1	C835 F840 N894	C835-L878 WeakPolarHBondContact SG-CD1 3.27Å; F840-L878 HydrophobicContact CB-CD1 4.47Å; F840-L878 HydrophobicContact CD2-CD1 3.6Å; F840-L878 HydrophobicContact CE2-CD1 4.24Å; F840-L878 HydrophobicContact CG-CD1 4.31Å; L878-N894 HydrophobicContact CB-CB 4.38Å; L878-N894 PolarHBondContact N-O 3.16Å
879	T	81.9	Confident	76	Confident	26 Å²	26	66.2 Å²	66.2	16%	0.16	37%	0.368	C	S	.	.	S	Bend	trans	-68.5	130.2	-178	-55.4	0	0	0	0	110.7	A883 L884 A893 N894	T879-A883 HydrophobicContact CG2-CB 4.01Å; T879-L884 HydrophobicContact CG2-CD2 3.96Å; T879-L884 HydrophobicContact CG2-CG 4.03Å; T879-A893 WeakPolarHBondContact OG1-CA 3.3Å; T879-N894 PolarHBondContact OG1-N 3.49Å
880	P	73.2	Confident	75.9	Confident	48 Å²	48	71.5 Å²	71.5	31%	0.312	39%	0.391	S	S	.	.			trans	-61.1	143.1	-179.4	-23.5	32.5	0	0	0	112.8	K882 A883 L884	P880-K882 PolarHBondContact O-N 3.37Å; P880-K882 VanDerWaalsContact O-N 3.15Å; P880-A883 WeakPolarHBondContact O-CB 2.92Å; P880-A883 PolarHBondContact O-N 3.12Å; P880-L884 PolarHBondContact O-N 3.4Å; P880-L884 VanDerWaalsContact O-N 3.15Å
881	E	69.4	Low	75.9	Confident	134 Å²	134	70.4 Å²	70.4	63%	0.626	39%	0.386	S	S	*	.	H	α-helix	trans	-57.3	-31	176	-75.3	177	-173.2	0	0	112.6	K656 A883 L884 S885	K656-E881 IonicContact NZ-OE1 2.88Å; K656-E881 PolarHBondContact NZ-OE1 3.34Å; K656-E881 IonicContact NZ-OE2 2.84Å; K656-E881 PolarHBondContact NZ-OE2 3.4Å; E881-A883 VanDerWaalsContact C-N 3.34Å; E881-A883 PolarHBondContact O-N 2.81Å; E881-L884 CarbonylContact O-C 3.47Å; E881-L884 PolarHBondContact O-N 3.22Å; E881-S885 VanDerWaalsContact O-CB 3.31Å; E881-S885 WeakPolarHBondContact O-CB 3.04Å; E881-S885 PolarHBondContact O-N 2.97Å
882	K	66.8	Low	76.1	Confident	90 Å²	90	64 Å²	64	39%	0.391	37%	0.366	S	S	.	.	H	α-helix	trans	-64	-38	174.7	-72.2	-175.8	177.4	-179.7	0	112.2	E648 E649 P880 L884 S885	E648-K882 IonicContact OE2-NZ 3.62Å; E648-K882 PolarHBondContact OE2-NZ 3.3Å; E649-K882 HydrophobicContact CG-CD 4.49Å; P880-K882 PolarHBondContact O-N 3.37Å; P880-K882 VanDerWaalsContact O-N 3.15Å; K882-L884 VanDerWaalsContact C-N 3.31Å; K882-S885 WeakPolarHBondContact CA-OG 3.48Å; K882-S885 PolarHBondContact O-N 3.44Å; K882-S885 PolarHBondContact O-OG 2.84Å
883	A	67.7	Low	76.4	Confident	73 Å²	73	62.3 Å²	62.3	60%	0.603	36%	0.355	S	S	*	.	H	α-helix	trans	-74.3	-25.3	176.4	0	0	0	0	0	112.3	T879 P880 E881	T879-A883 HydrophobicContact CG2-CB 4.01Å; P880-A883 WeakPolarHBondContact O-CB 2.92Å; P880-A883 PolarHBondContact O-N 3.12Å; E881-A883 VanDerWaalsContact C-N 3.34Å; E881-A883 PolarHBondContact O-N 2.81Å
884	L	69.3	Low	76.9	Confident	37 Å²	37	63.8 Å²	63.8	19%	0.194	36%	0.362	C	S	.	.	H	α-helix	trans	-85	-13.5	172.6	-59.1	169.9	0	0	0	112.4	L866 T879 P880 E881 K882 M891 A893	L866-L884 HydrophobicContact CD2-CD1 4.07Å; L866-L884 HydrophobicContact CD2-CD2 4.35Å; T879-L884 HydrophobicContact CG2-CD2 3.96Å; T879-L884 HydrophobicContact CG2-CG 4.03Å; P880-L884 PolarHBondContact O-N 3.4Å; P880-L884 VanDerWaalsContact O-N 3.15Å; E881-L884 CarbonylContact O-C 3.47Å; E881-L884 PolarHBondContact O-N 3.22Å; K882-L884 VanDerWaalsContact C-N 3.31Å; L884-M891 HydrophobicContact CB-SD 4.43Å; L884-M891 HydrophobicContact CD2-CG 3.78Å; L884-M891 HydrophobicContact CD2-SD 3.67Å; L884-A893 HydrophobicContact CD2-CB 4.07Å
885	S	63.5	Low	77.3	Confident	84 Å²	84	61.5 Å²	61.5	59%	0.587	35%	0.35	S	S	*	.			trans	-82.5	125.5	179.9	74.2	0	0	0	0	111.1	E881 K882	E881-S885 VanDerWaalsContact O-CB 3.31Å; E881-S885 WeakPolarHBondContact O-CB 3.04Å; E881-S885 PolarHBondContact O-N 2.97Å; K882-S885 WeakPolarHBondContact CA-OG 3.48Å; K882-S885 PolarHBondContact O-N 3.44Å; K882-S885 PolarHBondContact O-OG 2.84Å
886	G	62.5	Low	77.6	Confident	60 Å²	60	61.3 Å²	61.3	62%	0.619	35%	0.349	S	S	*	.	S	Bend	trans	136.8	156.2	178.1	0	0	0	0	0	112.3	C888	G886-C888 VanDerWaalsContact C-N 3.31Å; G886-C888 PolarHBondContact O-N 3.33Å
887	Y	63.3	Low	77.7	Confident	239 Å²	239	56.7 Å²	56.7	94%	0.937	33%	0.329	S	S	*	.			trans	-95.7	57.9	174.5	-69.4	-80.6	0	0	0	110.4
888	C	63.3	Low	77.6	Confident	96 Å²	96	60 Å²	60	65%	0.649	34%	0.337	S	S	*	.			trans	-84.6	123.5	161	-71.4	0	0	0	0	105.7	G886 F890	G886-C888 VanDerWaalsContact C-N 3.31Å; G886-C888 PolarHBondContact O-N 3.33Å; C888-F890 PolarHBondContact O-N 3.43Å
889	G	73.5	Confident	77.5	Confident	30 Å²	30	58.9 Å²	58.9	31%	0.309	33%	0.331	S	S	.	.	S	Bend	trans	-63.1	19.5	177.7	0	0	0	0	0	114.8	E912 K913	G889-E912 CarbonylContact O-C 3.53Å; G889-E912 VanDerWaalsContact O-CA 3.25Å; G889-E912 WeakPolarHBondContact O-CA 3.22Å; G889-E912 WeakPolarHBondContact O-CB 3.44Å; G889-K913 PolarHBondContact O-N 3.24Å
890	F	83.8	Confident	77.1	Confident	111 Å²	111	60.2 Å²	60.2	49%	0.487	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	133.4	178.5	179.9	-88.1	0	0	0	108.5	C888 A892 I911 E912	C888-F890 PolarHBondContact O-N 3.43Å; F890-A892 HydrophobicContact CE1-CB 3.98Å; F890-A892 HydrophobicContact CZ-CB 4.49Å; F890-I911 CarbonylContact C-O 3.53Å; F890-I911 WeakPolarHBondContact CA-O 3.25Å; F890-E912 HydrophobicContact CB-CB 4.44Å; F890-E912 HydrophobicContact CD2-CB 3.85Å
891	M	85.1	Confident	77	Confident	18 Å²	18	60.6 Å²	60.6	9%	0.089	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.9	178.3	-175.6	167.7	76.1	0	0	110.4	L862 L866 L884 I911	L862-M891 HydrophobicContact CB-CE 4.05Å; L862-M891 HydrophobicContact CB-SD 4.5Å; L862-M891 HydrophobicContact CD1-CB 4.32Å; L862-M891 WeakPolarHBondContact O-CE 3.49Å; L866-M891 HydrophobicContact CB-CE 3.63Å; L866-M891 HydrophobicContact CD2-CE 3.75Å; L866-M891 HydrophobicContact CD2-SD 4.38Å; L866-M891 HydrophobicContact CG-CE 4.23Å; L884-M891 HydrophobicContact CB-SD 4.43Å; L884-M891 HydrophobicContact CD2-CG 3.78Å; L884-M891 HydrophobicContact CD2-SD 3.67Å; M891-I911 HydrophobicContact CB-CG1 4.02Å; M891-I911 HydrophobicContact CE-CD1 3.59Å; M891-I911 HydrophobicContact CE-CG1 4.24Å; M891-I911 PolarHBondContact N-O 3.27Å; M891-I911 PolarHBondContact O-N 2.94Å
892	A	87.8	Confident	77.1	Confident	45 Å²	45	56.3 Å²	56.3	37%	0.372	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.9	172.8	0	0	0	0	0	110.3	F890 V909	F890-A892 HydrophobicContact CE1-CB 3.98Å; F890-A892 HydrophobicContact CZ-CB 4.49Å; A892-V909 CarbonylContact C-O 3.57Å; A892-V909 WeakPolarHBondContact CA-O 3.39Å
893	A	88.3	Confident	77.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	135.1	-179.6	0	0	0	0	0	111.7	L866 T879 L884 V909	L866-A893 HydrophobicContact CD1-CB 3.98Å; L866-A893 HydrophobicContact CD2-CB 4.11Å; T879-A893 WeakPolarHBondContact OG1-CA 3.3Å; L884-A893 HydrophobicContact CD2-CB 4.07Å; A893-V909 HydrophobicContact CB-CB 4.44Å; A893-V909 PolarHBondContact N-O 3.01Å; A893-V909 PolarHBondContact O-N 2.94Å
894	N	91.2	Very high	78.8	Confident	31 Å²	31	52.7 Å²	52.7	17%	0.166	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.4	172.4	-66.4	-28.3	0	0	0	109.5	F840 L878 T879 A907 N908	F840-N894 HydrophobicContact CE1-CB 4.19Å; F840-N894 HydrophobicContact CE2-CB 4.06Å; F840-N894 HydrophobicContact CZ-CB 3.87Å; L878-N894 HydrophobicContact CB-CB 4.38Å; L878-N894 PolarHBondContact N-O 3.16Å; T879-N894 PolarHBondContact OG1-N 3.49Å; N894-A907 CarbonylContact C-O 3.53Å; N894-N908 PolarHBondContact OD1-ND2 2.98Å
895	L	90.2	Very high	79.7	Confident	2 Å²	2	51 Å²	51	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.9	179.8	-54.7	-175.4	0	0	0	109.9	L866 I869 L870 M875 K876 C877 A907 V909	L866-L895 HydrophobicContact CD1-CD2 4.27Å; I869-L895 HydrophobicContact CG2-CD1 4.16Å; L870-L895 HydrophobicContact CD2-CD1 4.46Å; L870-L895 HydrophobicContact CD2-CD2 3.56Å; L870-L895 HydrophobicContact CG-CD2 4.48Å; M875-L895 HydrophobicContact CB-CB 4.06Å; M875-L895 HydrophobicContact CB-CD1 4.48Å; M875-L895 HydrophobicContact SD-CB 3.87Å; M875-L895 HydrophobicContact SD-CD1 4.39Å; K876-L895 WeakPolarHBondContact O-CA 3.19Å; C877-L895 HydrophobicContact CB-CD2 3.86Å; L895-A907 HydrophobicContact CB-CB 4.13Å; L895-A907 PolarHBondContact N-O 3.47Å; L895-A907 PolarHBondContact O-N 3.23Å; L895-V909 HydrophobicContact CD1-CG2 3.58Å; L895-V909 HydrophobicContact CG-CG2 4.02Å
896	Y	91.5	Very high	81	Confident	4 Å²	4	47 Å²	47	2%	0.016	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	142.9	178.9	173.8	-119	0	0	0	112	A833 C835 M843 K876 R898 D904 A905 L906	A833-Y896 VanDerWaalsContact C-CD1 3.44Å; A833-Y896 HydrophobicContact CB-CD1 3.84Å; A833-Y896 HydrophobicContact CB-CE1 3.41Å; A833-Y896 VanDerWaalsContact CB-CE1 3.41Å; A833-Y896 WeakPolarHBondContact O-CD1 3.5Å; C835-Y896 HydrophobicContact CB-CD1 3.98Å; C835-Y896 HydrophobicContact CB-CE1 3.78Å; M843-Y896 HydrophobicContact CE-CE2 4.27Å; K876-Y896 PolarHBondContact N-O 3.34Å; K876-Y896 PolarHBondContact O-N 3.4Å; Y896-R898 PolarHBondContact OH-NE 3.36Å; Y896-R898 PolarHBondContact OH-NH2 3.11Å; Y896-R898 VanDerWaalsContact OH-NH2 3.13Å; Y896-D904 HydrophobicContact CE2-CB 4Å; Y896-D904 PolarHBondContact OH-OD1 3.47Å; Y896-A905 WeakPolarHBondContact CD2-O 3.18Å; Y896-L906 HydrophobicContact CD2-CD2 3.44Å; Y896-L906 VanDerWaalsContact CD2-CD2 3.44Å; Y896-L906 HydrophobicContact CE2-CD2 4.05Å; Y896-L906 HydrophobicContact CG-CD2 4.3Å
897	A	88.9	Confident	82.4	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	164.3	172.7	0	0	0	0	0	111.1	I830 Q831 M875 A905	I830-A897 HydrophobicContact CG2-CB 3.48Å; I830-A897 VanDerWaalsContact CG2-CB 3.48Å; Q831-A897 WeakPolarHBondContact O-CB 3.11Å; M875-A897 HydrophobicContact CB-CB 4.35Å; M875-A897 HydrophobicContact CG-CB 3.83Å; A897-A905 PolarHBondContact N-O 3.33Å; A897-A905 PolarHBondContact O-N 3.05Å
898	R	84.4	Confident	83.8	Confident	102 Å²	102	34.4 Å²	34.4	39%	0.385	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	138.5	177.1	-178	172.9	-72.5	-169.7	-8.9	110	Q831 A833 Y896 E903 D904	Q831-R898 PolarHBondContact N-O 3.29Å; Q831-R898 PolarHBondContact O-N 3.36Å; Q831-R898 VanDerWaalsContact O-O 3.12Å; A833-R898 HydrophobicContact CB-CB 3.82Å; Y896-R898 PolarHBondContact OH-NE 3.36Å; Y896-R898 PolarHBondContact OH-NH2 3.11Å; Y896-R898 VanDerWaalsContact OH-NH2 3.13Å; R898-E903 CarbonylContact C-O 3.56Å; R898-E903 WeakPolarHBondContact CA-O 3.28Å; R898-D904 IonicContact CZ-OD1 3.81Å; R898-D904 VanDerWaalsContact CZ-OD1 3.32Å; R898-D904 IonicContact NE-OD1 2.84Å; R898-D904 PolarHBondContact NE-OD1 3.22Å; R898-D904 IonicContact NH2-OD1 3.33Å; R898-D904 PolarHBondContact NH2-OD1 2.94Å; R898-D904 IonicContact NH2-OD2 3.07Å; R898-D904 PolarHBondContact NH2-OD2 2.88Å
899	S	81.8	Confident	85.1	Confident	6 Å²	6	29.9 Å²	29.9	4%	0.042	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	159.1	174.9	79.6	0	0	0	0	111.5	Y829 F901 G902 E903	Y829-S899 CarbonylContact O-C 3.45Å; Y829-S899 VanDerWaalsContact O-CA 3.23Å; Y829-S899 WeakPolarHBondContact O-CA 3.4Å; S899-F901 PolarHBondContact O-N 3.27Å; S899-F901 VanDerWaalsContact O-N 3.16Å; S899-F901 PolarHBondContact OG-N 3.2Å; S899-G902 PolarHBondContact O-N 3.29Å; S899-G902 PolarHBondContact OG-N 3.01Å; S899-E903 PolarHBondContact N-O 3.26Å; S899-E903 WeakPolarHBondContact OG-CB 3.31Å; S899-E903 PolarHBondContact OG-N 3Å
900	I	74.6	Confident	85.9	Confident	55 Å²	55	30 Å²	30	28%	0.282	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-25.4	171.6	-63.5	169	0	0	0	111.2	Q736 Y829 Q831 G902	Q736-I900 HydrophobicContact CG-CG2 4.47Å; Y829-I900 HydrophobicContact CD1-CD1 4.47Å; Y829-I900 WeakPolarHBondContact O-CG1 3.49Å; Y829-I900 PolarHBondContact O-N 3.07Å; Q831-I900 HydrophobicContact CG-CG1 4.27Å; I900-G902 PolarHBondContact O-N 2.94Å
901	F	69.6	Low	86.1	Confident	55 Å²	55	24.7 Å²	24.7	24%	0.241	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-0.1	176.5	-54	-91	0	0	0	113.2	Q736 Y737 V791 T794 Y829 S899	Q736-F901 WeakPolarHBondContact O-CZ 3.39Å; Y737-F901 HydrophobicContact CD1-CD1 4.09Å; Y737-F901 AromaticContact CD1-CE1 3.5Å; Y737-F901 HydrophobicContact CD1-CE1 3.5Å; Y737-F901 VanDerWaalsContact CD1-CE1 3.5Å; Y737-F901 HydrophobicContact CD1-CZ 4.5Å; Y737-F901 AromaticContact CE1-CD1 3.58Å; Y737-F901 HydrophobicContact CE1-CD1 3.58Å; Y737-F901 AromaticContact CE1-CE1 3.47Å; Y737-F901 HydrophobicContact CE1-CE1 3.47Å; Y737-F901 VanDerWaalsContact CE1-CE1 3.47Å; Y737-F901 HydrophobicContact CG-CE1 4.49Å; V791-F901 HydrophobicContact CG1-CZ 4.07Å; T794-F901 HydrophobicContact CG2-CB 4.2Å; T794-F901 HydrophobicContact CG2-CD2 3.05Å; T794-F901 HydrophobicContact CG2-CE2 3.5Å; T794-F901 VanDerWaalsContact CG2-CE2 3.5Å; T794-F901 HydrophobicContact CG2-CG 3.82Å; Y829-F901 AromaticContact CD1-CE2 3.61Å; Y829-F901 HydrophobicContact CD1-CE2 3.61Å; Y829-F901 HydrophobicContact CD1-CZ 4.09Å; Y829-F901 HydrophobicContact CE1-CE2 4.23Å; Y829-F901 HydrophobicContact CE1-CZ 4.29Å; Y829-F901 AromaticContact CG-CE2 3.86Å; Y829-F901 HydrophobicContact CG-CE2 3.86Å; S899-F901 PolarHBondContact O-N 3.27Å; S899-F901 VanDerWaalsContact O-N 3.16Å; S899-F901 PolarHBondContact OG-N 3.2Å
902	G	72.2	Confident	86.3	Confident	45 Å²	45	28.3 Å²	28.3	46%	0.464	16%	0.156	S	C	.	.	S	Bend	trans	82.8	10.6	179.5	0	0	0	0	0	114.6	S899 I900	S899-G902 PolarHBondContact O-N 3.29Å; S899-G902 PolarHBondContact OG-N 3.01Å; I900-G902 PolarHBondContact O-N 2.94Å
903	E	82.2	Confident	86	Confident	54 Å²	54	28.8 Å²	28.8	25%	0.252	15%	0.149	S	C	.	.			trans	-80.4	137	175.4	-56.7	-162.3	165.5	0	0	111.4	T794 R898 S899 S933	T794-E903 PolarHBondContact OG1-OE2 2.87Å; R898-E903 CarbonylContact C-O 3.56Å; R898-E903 WeakPolarHBondContact CA-O 3.28Å; S899-E903 PolarHBondContact N-O 3.26Å; S899-E903 WeakPolarHBondContact OG-CB 3.31Å; S899-E903 PolarHBondContact OG-N 3Å; E903-S933 PolarHBondContact OE2-OG 3Å
904	D	87.4	Confident	85.5	Confident	32 Å²	32	29.2 Å²	29.2	17%	0.171	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.6	-178.9	-71.7	-47.3	0	0	0	111.1	M843 F847 Y896 R898	M843-D904 HydrophobicContact SD-CB 4.37Å; F847-D904 HydrophobicContact CE2-CB 4.28Å; F847-D904 WeakPolarHBondContact CE2-O 3.37Å; F847-D904 HydrophobicContact CZ-CB 3.83Å; Y896-D904 HydrophobicContact CE2-CB 4Å; Y896-D904 PolarHBondContact OH-OD1 3.47Å; R898-D904 IonicContact CZ-OD1 3.81Å; R898-D904 VanDerWaalsContact CZ-OD1 3.32Å; R898-D904 IonicContact NE-OD1 2.84Å; R898-D904 PolarHBondContact NE-OD1 3.22Å; R898-D904 IonicContact NH2-OD1 3.33Å; R898-D904 PolarHBondContact NH2-OD1 2.94Å; R898-D904 IonicContact NH2-OD2 3.07Å; R898-D904 PolarHBondContact NH2-OD2 2.88Å
905	A	88.6	Confident	84.5	Confident	2 Å²	2	34.8 Å²	34.8	2%	0.017	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	125.8	177.4	0	0	0	0	0	110.6	M875 Y896 A897 M936 L940	M875-A905 HydrophobicContact CE-CB 4.32Å; Y896-A905 WeakPolarHBondContact CD2-O 3.18Å; A897-A905 PolarHBondContact N-O 3.33Å; A897-A905 PolarHBondContact O-N 3.05Å; A905-M936 HydrophobicContact CB-CG 4.19Å; A905-M936 HydrophobicContact CB-SD 4.4Å; A905-L940 HydrophobicContact CB-CD1 3.75Å
906	L	91.8	Very high	83.6	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	140.8	-178.6	-54.7	167.3	0	0	0	109.4	F840 M843 W844 F847 Y896 I929 R930	F840-L906 HydrophobicContact CD2-CD2 3.41Å; F840-L906 VanDerWaalsContact CD2-CD2 3.41Å; F840-L906 HydrophobicContact CD2-CG 4.43Å; F840-L906 HydrophobicContact CE2-CB 3.85Å; F840-L906 HydrophobicContact CE2-CD2 3.49Å; F840-L906 VanDerWaalsContact CE2-CD2 3.49Å; F840-L906 HydrophobicContact CE2-CG 4.15Å; F840-L906 HydrophobicContact CG-CD2 4.32Å; F840-L906 HydrophobicContact CZ-CB 4.17Å; F840-L906 HydrophobicContact CZ-CD2 4.45Å; M843-L906 HydrophobicContact CB-CD1 3.68Å; M843-L906 HydrophobicContact CE-CD2 3.95Å; W844-L906 HydrophobicContact CB-CD1 4.23Å; W844-L906 HydrophobicContact CE3-CB 3.77Å; W844-L906 HydrophobicContact CE3-CD1 4.06Å; W844-L906 HydrophobicContact CZ3-CB 3.87Å; F847-L906 HydrophobicContact CD2-CD1 3.6Å; F847-L906 HydrophobicContact CD2-CG 4.15Å; F847-L906 HydrophobicContact CE2-CD1 3.51Å; F847-L906 HydrophobicContact CE2-CG 3.77Å; F847-L906 HydrophobicContact CZ-CD1 4.37Å; Y896-L906 HydrophobicContact CD2-CD2 3.44Å; Y896-L906 VanDerWaalsContact CD2-CD2 3.44Å; Y896-L906 HydrophobicContact CE2-CD2 4.05Å; Y896-L906 HydrophobicContact CG-CD2 4.3Å; L906-I929 CarbonylContact O-C 3.58Å; L906-I929 WeakPolarHBondContact O-CA 3.41Å; L906-R930 PolarHBondContact N-O 3.41Å; L906-R930 PolarHBondContact O-N 2.65Å
907	A	91.4	Very high	82.4	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.008	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142.4	168	0	0	0	0	0	111.8	M875 N894 L895 I927 R928 I929	M875-A907 HydrophobicContact SD-CB 3.97Å; N894-A907 CarbonylContact C-O 3.53Å; L895-A907 HydrophobicContact CB-CB 4.13Å; L895-A907 PolarHBondContact N-O 3.47Å; L895-A907 PolarHBondContact O-N 3.23Å; A907-I927 HydrophobicContact CB-CG2 4.4Å; A907-R928 CarbonylContact C-O 3.55Å; A907-R928 VanDerWaalsContact CA-O 3.28Å; A907-R928 WeakPolarHBondContact CA-O 3.34Å; A907-I929 HydrophobicContact CB-CG1 4.12Å
908	N	92.2	Very high	81.4	Confident	33 Å²	33	49.2 Å²	49.2	18%	0.176	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	113.4	171.4	179.1	-87	0	0	0	108.1	W844 N894 S910 I927 R928	W844-N908 HydrophobicContact CH2-CB 3.52Å; W844-N908 HydrophobicContact CZ2-CB 4.09Å; W844-N908 HydrophobicContact CZ3-CB 4.04Å; N894-N908 PolarHBondContact OD1-ND2 2.98Å; N908-S910 PolarHBondContact OD1-OG 3.34Å; N908-S910 VanDerWaalsContact OD1-OG 3.09Å; N908-I927 CarbonylContact O-C 3.01Å; N908-I927 WeakPolarHBondContact O-CA 3.47Å; N908-R928 PolarHBondContact N-O 3.13Å; N908-R928 PolarHBondContact O-N 3.43Å
909	V	90.8	Very high	80.6	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	115.4	179.1	178.6	0	0	0	0	107.6	A892 A893 L895 I911 I927	A892-V909 CarbonylContact C-O 3.57Å; A892-V909 WeakPolarHBondContact CA-O 3.39Å; A893-V909 HydrophobicContact CB-CB 4.44Å; A893-V909 PolarHBondContact N-O 3.01Å; A893-V909 PolarHBondContact O-N 2.94Å; L895-V909 HydrophobicContact CD1-CG2 3.58Å; L895-V909 HydrophobicContact CG-CG2 4.02Å; V909-I911 HydrophobicContact CG1-CD1 4.43Å; V909-I911 HydrophobicContact CG1-CG1 4.33Å; V909-I911 HydrophobicContact CG1-CG2 3.82Å; V909-I927 HydrophobicContact CB-CG1 4.32Å; V909-I927 HydrophobicContact CG1-CD1 4.46Å; V909-I927 HydrophobicContact CG1-CG1 4.06Å; V909-I927 HydrophobicContact CG2-CD1 4.38Å; V909-I927 HydrophobicContact CG2-CG1 4.08Å; V909-I927 HydrophobicContact CG2-CG2 4.11Å
910	S	90.3	Very high	79.9	Confident	32 Å²	32	55.2 Å²	55.2	22%	0.224	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	104.8	174	-68	0	0	0	0	108.9	N908 G925 H926	N908-S910 PolarHBondContact OD1-OG 3.34Å; N908-S910 VanDerWaalsContact OD1-OG 3.09Å; S910-G925 CarbonylContact O-C 3.52Å; S910-G925 WeakPolarHBondContact O-CA 3.31Å; S910-H926 CarbonylContact C-O 3.5Å; S910-H926 PolarHBondContact N-O 3.48Å; S910-H926 PolarHBondContact O-N 2.69Å
911	I	89	Confident	79.9	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	147.1	-174.8	56.4	173.4	0	0	0	111.1	V855 L862 Y865 F890 M891 V909 V923 T924	V855-I911 HydrophobicContact CG1-CG2 4.3Å; V855-I911 HydrophobicContact CG2-CG2 4.17Å; L862-I911 HydrophobicContact CB-CD1 4.23Å; L862-I911 HydrophobicContact CD2-CB 4.25Å; L862-I911 HydrophobicContact CD2-CD1 3.79Å; L862-I911 HydrophobicContact CD2-CG1 3.86Å; Y865-I911 HydrophobicContact CD1-CD1 3.82Å; Y865-I911 HydrophobicContact CD1-CG2 4.19Å; Y865-I911 HydrophobicContact CE1-CG2 4.01Å; F890-I911 CarbonylContact C-O 3.53Å; F890-I911 WeakPolarHBondContact CA-O 3.25Å; M891-I911 HydrophobicContact CB-CG1 4.02Å; M891-I911 HydrophobicContact CE-CD1 3.59Å; M891-I911 HydrophobicContact CE-CG1 4.24Å; M891-I911 PolarHBondContact N-O 3.27Å; M891-I911 PolarHBondContact O-N 2.94Å; V909-I911 HydrophobicContact CG1-CD1 4.43Å; V909-I911 HydrophobicContact CG1-CG1 4.33Å; V909-I911 HydrophobicContact CG1-CG2 3.82Å; I911-V923 HydrophobicContact CB-CG1 3.78Å; I911-V923 HydrophobicContact CD1-CG1 4.08Å; I911-V923 HydrophobicContact CG1-CG1 4.43Å; I911-V923 HydrophobicContact CG2-CG1 4.16Å; I911-T924 CarbonylContact C-O 3.6Å
912	E	87.7	Confident	80.4	Confident	95 Å²	95	52 Å²	52	44%	0.444	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	153.5	-178.4	70.6	-178.4	-179.7	0	0	111.3	G889 F890 T924	G889-E912 CarbonylContact O-C 3.53Å; G889-E912 VanDerWaalsContact O-CA 3.25Å; G889-E912 WeakPolarHBondContact O-CA 3.22Å; G889-E912 WeakPolarHBondContact O-CB 3.44Å; F890-E912 HydrophobicContact CB-CB 4.44Å; F890-E912 HydrophobicContact CD2-CB 3.85Å; E912-T924 PolarHBondContact N-O 2.94Å; E912-T924 PolarHBondContact O-N 2.95Å; E912-T924 PolarHBondContact O-OG1 3.5Å
913	K	82.9	Confident	81	Confident	54 Å²	54	49.9 Å²	49.9	24%	0.235	27%	0.271	C	S	.	.			trans	-104	111.9	170.9	-172.5	168.6	-174.3	161.2	0	107.9	I860 G889 I915 P919 A921	I860-K913 VanDerWaalsContact CG2-NZ 3.26Å; I860-K913 PolarHBondContact O-NZ 3.34Å; I860-K913 VanDerWaalsContact O-NZ 3.14Å; G889-K913 PolarHBondContact O-N 3.24Å; K913-I915 PolarHBondContact O-N 3.2Å; K913-P919 WeakPolarHBondContact CE-O 3.28Å; K913-P919 PolarHBondContact NZ-O 3.32Å; K913-A921 WeakPolarHBondContact CE-O 3.43Å
914	P	77.1	Confident	81.1	Confident	9 Å²	9	49.3 Å²	49.3	6%	0.058	27%	0.271	C	S	.	.			trans	-65.5	100.2	-179.8	19.1	-24.4	0	0	0	110.3	H916 Q917 A921 A922 T924	P914-H916 WeakPolarHBondContact CB-CE1 3.33Å; P914-H916 PolarHBondContact O-N 2.87Å; P914-Q917 HydrophobicContact CB-CG 4.37Å; P914-Q917 PolarHBondContact O-N 2.8Å; P914-Q917 VanDerWaalsContact O-N 3.09Å; P914-A921 HydrophobicContact CG-CB 4.21Å; P914-A922 WeakPolarHBondContact CD-O 3.41Å; P914-T924 HydrophobicContact CG-CG2 4.28Å
915	I	70.4	Confident	81.1	Confident	148 Å²	148	48.4 Å²	48.4	76%	0.759	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-57.7	-27.1	-175.8	-57.5	170.9	0	0	0	111.7	K913 Q917	K913-I915 PolarHBondContact O-N 3.2Å; I915-Q917 VanDerWaalsContact C-N 3.28Å; I915-Q917 PolarHBondContact O-N 3.39Å
916	H	69.9	Low	81.3	Confident	154 Å²	154	52.1 Å²	52.1	71%	0.713	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-72	-13.5	-178.6	62.6	-83.1	0	0	0	114.6	P914	P914-H916 WeakPolarHBondContact CB-CE1 3.33Å; P914-H916 PolarHBondContact O-N 2.87Å
917	Q	66.3	Low	81.2	Confident	123 Å²	123	52.1 Å²	52.1	58%	0.575	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-103.9	4.9	-175.5	-61.6	179.7	14.5	0	0	113.9	P914 I915 A921	P914-Q917 HydrophobicContact CB-CG 4.37Å; P914-Q917 PolarHBondContact O-N 2.8Å; P914-Q917 VanDerWaalsContact O-N 3.09Å; I915-Q917 VanDerWaalsContact C-N 3.28Å; I915-Q917 PolarHBondContact O-N 3.39Å; Q917-A921 HydrophobicContact CB-CB 3.73Å
918	G	68.9	Low	81.3	Confident	32 Å²	32	56.3 Å²	56.3	33%	0.33	30%	0.302	S	S	.	.			trans	93.9	175.3	178.2	0	0	0	0	0	114.7	D920 A921	G918-D920 VanDerWaalsContact C-N 3.26Å; G918-D920 PolarHBondContact O-N 2.9Å; G918-A921 VanDerWaalsContact O-CB 3.28Å; G918-A921 WeakPolarHBondContact O-CB 3.3Å; G918-A921 PolarHBondContact O-N 3.42Å
919	P	66.4	Low	81.3	Confident	104 Å²	104	54.7 Å²	54.7	68%	0.675	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.5	-175.2	25.8	-32.4	0	0	0	114.3	I860 K913	I860-P919 WeakPolarHBondContact CG2-O 3.39Å; K913-P919 WeakPolarHBondContact CE-O 3.28Å; K913-P919 PolarHBondContact NZ-O 3.32Å
920	D	68.1	Low	81.3	Confident	131 Å²	131	56.8 Å²	56.8	70%	0.701	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	9.5	177.5	-60.8	-33.7	0	0	0	113	G918 A922	G918-D920 VanDerWaalsContact C-N 3.26Å; G918-D920 PolarHBondContact O-N 2.9Å; D920-A922 PolarHBondContact O-N 3.41Å
921	A	74.5	Confident	81.2	Confident	6 Å²	6	55.3 Å²	55.3	5%	0.05	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-63	133	176.8	0	0	0	0	0	111	K913 P914 Q917 G918	K913-A921 WeakPolarHBondContact CE-O 3.43Å; P914-A921 HydrophobicContact CG-CB 4.21Å; Q917-A921 HydrophobicContact CB-CB 3.73Å; G918-A921 VanDerWaalsContact O-CB 3.28Å; G918-A921 WeakPolarHBondContact O-CB 3.3Å; G918-A921 PolarHBondContact O-N 3.42Å
922	A	80.3	Confident	81	Confident	36 Å²	36	62.7 Å²	62.7	30%	0.298	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-66.1	151.9	176.7	0	0	0	0	0	111.9	T857 M859 P914 D920 T924	T857-A922 WeakPolarHBondContact O-CB 3.21Å; M859-A922 WeakPolarHBondContact O-CA 3.32Å; P914-A922 WeakPolarHBondContact CD-O 3.41Å; D920-A922 PolarHBondContact O-N 3.41Å; A922-T924 PolarHBondContact O-N 3Å
923	V	84	Confident	80.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-68.1	126.8	173.9	175.5	0	0	0	0	110.1	T857 M859 L862 Y865 I911	T857-V923 PolarHBondContact OG1-O 2.98Å; M859-V923 WeakPolarHBondContact O-CG2 3.39Å; M859-V923 PolarHBondContact O-N 3.38Å; L862-V923 HydrophobicContact CD2-CB 4.32Å; L862-V923 HydrophobicContact CD2-CG1 3.67Å; L862-V923 HydrophobicContact CD2-CG2 3.73Å; L862-V923 HydrophobicContact CG-CG2 4.37Å; Y865-V923 HydrophobicContact CD1-CG1 4.33Å; I911-V923 HydrophobicContact CB-CG1 3.78Å; I911-V923 HydrophobicContact CD1-CG1 4.08Å; I911-V923 HydrophobicContact CG1-CG1 4.43Å; I911-V923 HydrophobicContact CG2-CG1 4.16Å
924	T	85.9	Confident	80.8	Confident	42 Å²	42	61 Å²	61	26%	0.258	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	154.3	177.6	55.9	0	0	0	0	110.6	I911 E912 P914 A922	I911-T924 CarbonylContact C-O 3.6Å; E912-T924 PolarHBondContact N-O 2.94Å; E912-T924 PolarHBondContact O-N 2.95Å; E912-T924 PolarHBondContact O-OG1 3.5Å; P914-T924 HydrophobicContact CG-CG2 4.28Å; A922-T924 PolarHBondContact O-N 3Å
925	G	87.6	Confident	80.9	Confident	14 Å²	14	61 Å²	61	14%	0.144	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161	-158.3	175.8	0	0	0	0	0	114.8	V855 S910	V855-G925 PolarHBondContact N-O 3.29Å; S910-G925 CarbonylContact O-C 3.52Å; S910-G925 WeakPolarHBondContact O-CA 3.31Å
926	H	90.9	Very high	81.4	Confident	79 Å²	79	54 Å²	54	37%	0.366	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	137.9	179.9	-55.3	-64.5	0	0	0	111.7	K852 V853 S910	K852-H926 HydrophobicContact CG-CB 4.47Å; V853-H926 CarbonylContact O-C 3.5Å; V853-H926 VanDerWaalsContact O-CA 3.3Å; V853-H926 WeakPolarHBondContact O-CA 3.38Å; S910-H926 CarbonylContact C-O 3.5Å; S910-H926 PolarHBondContact N-O 3.48Å; S910-H926 PolarHBondContact O-N 2.69Å
927	I	91.4	Very high	82.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122.3	169.2	-59.3	169.2	0	0	0	107.4	V853 V855 Y865 A907 N908 V909 I929 I944	V853-I927 HydrophobicContact CB-CB 4.4Å; V853-I927 PolarHBondContact N-O 3.23Å; V853-I927 PolarHBondContact O-N 2.89Å; V855-I927 HydrophobicContact CG2-CD1 3.73Å; V855-I927 HydrophobicContact CG2-CG1 3.66Å; Y865-I927 HydrophobicContact CE1-CD1 4.43Å; A907-I927 HydrophobicContact CB-CG2 4.4Å; N908-I927 CarbonylContact O-C 3.01Å; N908-I927 WeakPolarHBondContact O-CA 3.47Å; V909-I927 HydrophobicContact CB-CG1 4.32Å; V909-I927 HydrophobicContact CG1-CD1 4.46Å; V909-I927 HydrophobicContact CG1-CG1 4.06Å; V909-I927 HydrophobicContact CG2-CD1 4.38Å; V909-I927 HydrophobicContact CG2-CG1 4.08Å; V909-I927 HydrophobicContact CG2-CG2 4.11Å; I927-I929 HydrophobicContact CG2-CG1 4.04Å; I927-I944 HydrophobicContact CD1-CG2 3.72Å; I927-I944 HydrophobicContact CG2-CD1 4.33Å
928	R	92.5	Very high	83	Confident	89 Å²	89	44.5 Å²	44.5	34%	0.336	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	126.3	174.8	-62.1	176.4	75.6	-174.6	3.4	108	W844 E850 N851 K852 A907 N908	W844-R928 HydrophobicContact CH2-CB 3.94Å; W844-R928 WeakPolarHBondContact CH2-O 3.41Å; W844-R928 HydrophobicContact CZ2-CB 4.11Å; E850-R928 IonicContact OE1-CZ 3.82Å; E850-R928 IonicContact OE1-NE 2.7Å; E850-R928 PolarHBondContact OE1-NE 3.49Å; E850-R928 IonicContact OE1-NH2 3.73Å; E850-R928 PolarHBondContact OE1-NH2 3.33Å; E850-R928 IonicContact OE2-CZ 3.2Å; E850-R928 IonicContact OE2-NE 2.75Å; E850-R928 IonicContact OE2-NH2 2.73Å; E850-R928 PolarHBondContact OE2-NH2 3.04Å; N851-R928 WeakPolarHBondContact O-CA 3.49Å; K852-R928 HydrophobicContact CG-CG 4.23Å; A907-R928 CarbonylContact C-O 3.55Å; A907-R928 VanDerWaalsContact CA-O 3.28Å; A907-R928 WeakPolarHBondContact CA-O 3.34Å; N908-R928 PolarHBondContact N-O 3.13Å; N908-R928 PolarHBondContact O-N 3.43Å
929	I	91.8	Very high	83.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.5	-178.9	-52.7	166.1	0	0	0	107.1	E850 N851 V853 L906 A907 I927 L940 G941 I944	E850-I929 CarbonylContact C-O 3.6Å; E850-I929 VanDerWaalsContact CA-O 3.32Å; E850-I929 WeakPolarHBondContact CA-O 3.3Å; N851-I929 PolarHBondContact N-O 3.49Å; N851-I929 PolarHBondContact O-N 2.92Å; V853-I929 HydrophobicContact CG2-CD1 4.17Å; L906-I929 CarbonylContact O-C 3.58Å; L906-I929 WeakPolarHBondContact O-CA 3.41Å; A907-I929 HydrophobicContact CB-CG1 4.12Å; I927-I929 HydrophobicContact CG2-CG1 4.04Å; I929-L940 HydrophobicContact CD1-CB 4.12Å; I929-L940 HydrophobicContact CG2-CB 4.19Å; I929-L940 HydrophobicContact CG2-CD1 4.15Å; I929-G941 VanDerWaalsContact CD1-CA 3.45Å; I929-I944 HydrophobicContact CD1-CD1 3.5Å; I929-I944 HydrophobicContact CG1-CD1 4.29Å
930	R	91.4	Very high	84.4	Confident	45 Å²	45	38.4 Å²	38.4	17%	0.17	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	137.4	174.8	-68.4	-166.2	174.6	-160.5	-8.5	110.4	W844 F847 W849 E850 L906	W844-R930 HydrophobicContact CD2-CG 4.35Å; W844-R930 HydrophobicContact CE3-CB 4.26Å; W844-R930 HydrophobicContact CE3-CG 4.31Å; W844-R930 HydrophobicContact CH2-CG 4.02Å; W844-R930 HydrophobicContact CZ2-CG 4.06Å; W844-R930 HydrophobicContact CZ3-CB 4.19Å; W844-R930 HydrophobicContact CZ3-CG 4.14Å; W844-R930 WeakPolarHBondContact O-CD 3.24Å; W844-R930 PolarHBondContact O-NH1 3.37Å; F847-R930 HydrophobicContact CB-CB 4.04Å; F847-R930 HydrophobicContact CD2-CB 4.12Å; W849-R930 VanDerWaalsContact O-CA 3.29Å; W849-R930 WeakPolarHBondContact O-CA 3.46Å; E850-R930 HydrophobicContact CB-CG 4.04Å; E850-R930 HydrophobicContact CG-CG 4.02Å; E850-R930 IonicContact OE2-CZ 3.47Å; E850-R930 IonicContact OE2-NE 3.46Å; E850-R930 PolarHBondContact OE2-NE 2.96Å; E850-R930 IonicContact OE2-NH2 3.42Å; E850-R930 PolarHBondContact OE2-NH2 3.29Å; L906-R930 PolarHBondContact N-O 3.41Å; L906-R930 PolarHBondContact O-N 2.65Å
931	A	88.3	Confident	85.3	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.008	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	165.8	175.8	0	0	0	0	0	109.6	W849 M936 A937	W849-A931 PolarHBondContact O-N 2.85Å; A931-M936 HydrophobicContact CB-CB 3.89Å; A931-M936 HydrophobicContact CB-CG 3.72Å; A931-A937 HydrophobicContact CB-CB 4.14Å
932	K	85	Confident	85.7	Confident	155 Å²	155	35.7 Å²	35.7	67%	0.674	18%	0.182	S	C	*	.	S	Bend	trans	-70.9	-35.7	174.8	-168.8	174.8	-177.6	175.8	0	112.3	F847	F847-K932 HydrophobicContact CE1-CB 4.43Å
933	S	82.8	Confident	85.7	Confident	19 Å²	19	36.4 Å²	36.4	13%	0.133	18%	0.179	C	C	.	.	S	Bend	trans	-100	138.4	178.3	57.4	0	0	0	0	111.1	E903 G935 M936 A937	E903-S933 PolarHBondContact OE2-OG 3Å; S933-G935 VanDerWaalsContact C-N 3.32Å; S933-G935 PolarHBondContact O-N 2.9Å; S933-M936 PolarHBondContact O-N 3.44Å; S933-M936 WeakPolarHBondContact OG-CB 3.39Å; S933-A937 PolarHBondContact O-N 2.76Å
934	Q	83.7	Confident	85.8	Confident	93 Å²	93	36.5 Å²	36.5	44%	0.435	18%	0.179	S	C	.	.	H	α-helix	trans	-61.3	-42.9	177.2	-174.6	178.6	7.1	0	0	111.4	W849 M936 A937 L938	W849-Q934 HydrophobicContact CD2-CB 3.59Å; W849-Q934 HydrophobicContact CD2-CG 3.85Å; W849-Q934 HydrophobicContact CE3-CB 3.84Å; W849-Q934 HydrophobicContact CE3-CG 3.52Å; W849-Q934 HydrophobicContact CG-CB 4.02Å; W849-Q934 HydrophobicContact CH2-CB 4.27Å; W849-Q934 VanDerWaalsContact CH2-CD 3.43Å; W849-Q934 HydrophobicContact CH2-CG 4.07Å; W849-Q934 VanDerWaalsContact CH2-OE1 3.23Å; W849-Q934 HydrophobicContact CZ2-CB 4.07Å; W849-Q934 HydrophobicContact CZ2-CG 4.38Å; W849-Q934 HydrophobicContact CZ3-CB 4.17Å; W849-Q934 HydrophobicContact CZ3-CG 3.64Å; Q934-M936 VanDerWaalsContact C-N 3.34Å; Q934-M936 PolarHBondContact O-N 3.22Å; Q934-A937 PolarHBondContact O-N 3.16Å; Q934-L938 HydrophobicContact CG-CD1 3.88Å; Q934-L938 HydrophobicContact CG-CG 4.37Å; Q934-L938 PolarHBondContact O-N 2.74Å
935	G	78.4	Confident	85.7	Confident	11 Å²	11	38.1 Å²	38.1	11%	0.113	19%	0.186	C	C	.	.	H	α-helix	trans	-57.6	-43.3	-179.4	0	0	0	0	0	112.7	S933 S939	S933-G935 VanDerWaalsContact C-N 3.32Å; S933-G935 PolarHBondContact O-N 2.9Å; G935-S939 WeakPolarHBondContact O-CB 3.38Å; G935-S939 PolarHBondContact O-N 3.19Å; G935-S939 PolarHBondContact O-OG 2.97Å
936	M	81.4	Confident	85.4	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-63.1	-47.2	177.3	179.9	67.5	68.3	0	0	112.1	T794 I826 I830 A905 A931 S933 Q934 L938 L940	T794-M936 VanDerWaalsContact CB-CE 3.43Å; T794-M936 HydrophobicContact CG2-CE 3.93Å; T794-M936 VanDerWaalsContact OG1-CE 3.3Å; T794-M936 WeakPolarHBondContact OG1-CE 3.33Å; I826-M936 HydrophobicContact CD1-CB 4.46Å; I826-M936 HydrophobicContact CD1-CE 3.72Å; I826-M936 HydrophobicContact CD1-SD 3.36Å; I826-M936 WeakPolarHBondContact CD1-SD 3.23Å; I826-M936 HydrophobicContact CG1-CE 4.32Å; I826-M936 HydrophobicContact CG1-SD 4.2Å; I830-M936 HydrophobicContact CD1-SD 3.8Å; I830-M936 HydrophobicContact CG1-SD 4.38Å; A905-M936 HydrophobicContact CB-CG 4.19Å; A905-M936 HydrophobicContact CB-SD 4.4Å; A931-M936 HydrophobicContact CB-CB 3.89Å; A931-M936 HydrophobicContact CB-CG 3.72Å; S933-M936 PolarHBondContact O-N 3.44Å; S933-M936 WeakPolarHBondContact OG-CB 3.39Å; Q934-M936 VanDerWaalsContact C-N 3.34Å; Q934-M936 PolarHBondContact O-N 3.22Å; M936-L938 PolarHBondContact O-N 3.16Å; M936-L940 HydrophobicContact CG-CD1 3.99Å; M936-L940 WeakPolarHBondContact O-CB 3.09Å; M936-L940 WeakPolarHBondContact O-CG 3.28Å; M936-L940 PolarHBondContact O-N 3.43Å; M936-L940 HydrophobicContact SD-CD1 3.77Å; M936-L940 HydrophobicContact SD-CG 4.2Å
937	A	84.7	Confident	84.8	Confident	2 Å²	2	41.3 Å²	41.3	2%	0.017	20%	0.204	C	C	.	.	H	α-helix	trans	-65.3	-39.1	-178.3	0	0	0	0	0	112.6	W849 N851 A931 S933 Q934 G941	W849-A937 HydrophobicContact CB-CB 4.45Å; N851-A937 HydrophobicContact CB-CB 4.4Å; N851-A937 WeakPolarHBondContact CB-O 3.37Å; N851-A937 PolarHBondContact ND2-O 3.42Å; N851-A937 VanDerWaalsContact ND2-O 3.11Å; A931-A937 HydrophobicContact CB-CB 4.14Å; S933-A937 PolarHBondContact O-N 2.76Å; Q934-A937 PolarHBondContact O-N 3.16Å; A937-G941 PolarHBondContact O-N 2.69Å
938	L	85.5	Confident	84.1	Confident	74 Å²	74	41.7 Å²	41.7	39%	0.387	21%	0.206	S	C	.	.	H	α-helix	trans	-70.6	-50.5	176.3	-69.1	177.3	0	0	0	111.5	N851 Q934 M936 L940 G941 D942	N851-L938 HydrophobicContact CB-CD2 4.46Å; Q934-L938 HydrophobicContact CG-CD1 3.88Å; Q934-L938 HydrophobicContact CG-CG 4.37Å; Q934-L938 PolarHBondContact O-N 2.74Å; M936-L938 PolarHBondContact O-N 3.16Å; L938-L940 VanDerWaalsContact C-N 3.35Å; L938-L940 PolarHBondContact O-N 3.13Å; L938-G941 WeakPolarHBondContact O-CA 3.16Å; L938-G941 PolarHBondContact O-N 3.3Å; L938-D942 PolarHBondContact O-N 3.37Å
939	S	81.6	Confident	83.1	Confident	8 Å²	8	43.5 Å²	43.5	6%	0.056	22%	0.216	C	C	.	.	H	α-helix	trans	-59.6	-42.7	-176.7	-60	0	0	0	0	112.7	N796 G935 G941 D942 K943	N796-S939 VanDerWaalsContact CG-CB 3.45Å; N796-S939 VanDerWaalsContact CG-OG 3.29Å; N796-S939 PolarHBondContact N-OG 2.95Å; N796-S939 WeakPolarHBondContact ND2-CB 3.39Å; N796-S939 PolarHBondContact ND2-OG 3.42Å; N796-S939 WeakPolarHBondContact OD1-CB 3.44Å; G935-S939 WeakPolarHBondContact O-CB 3.38Å; G935-S939 PolarHBondContact O-N 3.19Å; G935-S939 PolarHBondContact O-OG 2.97Å; S939-G941 VanDerWaalsContact C-N 3.33Å; S939-D942 PolarHBondContact O-N 3.44Å; S939-K943 PolarHBondContact O-N 3.08Å
940	L	83.4	Confident	81.7	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.2	-39.7	174	-83.5	169.7	0	0	0	112.2	M827 I830 M875 A905 I929 M936 L938 K943 I944	M827-L940 HydrophobicContact SD-CD2 4.13Å; I830-L940 HydrophobicContact CD1-CD1 4.18Å; I830-L940 HydrophobicContact CD1-CD2 3.48Å; I830-L940 VanDerWaalsContact CD1-CD2 3.48Å; I830-L940 HydrophobicContact CD1-CG 3.95Å; M875-L940 HydrophobicContact CE-CD1 3.56Å; M875-L940 HydrophobicContact CE-CD2 3.78Å; M875-L940 HydrophobicContact CE-CG 4.26Å; A905-L940 HydrophobicContact CB-CD1 3.75Å; I929-L940 HydrophobicContact CD1-CB 4.12Å; I929-L940 HydrophobicContact CG2-CB 4.19Å; I929-L940 HydrophobicContact CG2-CD1 4.15Å; M936-L940 HydrophobicContact CG-CD1 3.99Å; M936-L940 WeakPolarHBondContact O-CB 3.09Å; M936-L940 WeakPolarHBondContact O-CG 3.28Å; M936-L940 PolarHBondContact O-N 3.43Å; M936-L940 HydrophobicContact SD-CD1 3.77Å; M936-L940 HydrophobicContact SD-CG 4.2Å; L938-L940 VanDerWaalsContact C-N 3.35Å; L938-L940 PolarHBondContact O-N 3.13Å; L940-K943 PolarHBondContact O-N 2.99Å; L940-I944 WeakPolarHBondContact O-CG1 3.4Å; L940-I944 PolarHBondContact O-N 3.43Å
941	G	85.3	Confident	79.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.5	-39.6	178.4	0	0	0	0	0	113	I929 A937 L938 S939 I944 N945	I929-G941 VanDerWaalsContact CD1-CA 3.45Å; A937-G941 PolarHBondContact O-N 2.69Å; L938-G941 WeakPolarHBondContact O-CA 3.16Å; L938-G941 PolarHBondContact O-N 3.3Å; S939-G941 VanDerWaalsContact C-N 3.33Å; G941-I944 PolarHBondContact O-N 3.37Å; G941-N945 WeakPolarHBondContact O-CB 3.26Å; G941-N945 PolarHBondContact O-N 3Å; G941-N945 PolarHBondContact O-ND2 2.92Å
942	D	83.3	Confident	77.5	Confident	81 Å²	81	59.7 Å²	59.7	43%	0.433	31%	0.313	S	S	.	.	H	α-helix	trans	-64.5	-41.2	175.1	-69	-21.5	0	0	0	111.3	L938 S939 I944 N945 L946	L938-D942 PolarHBondContact O-N 3.37Å; S939-D942 PolarHBondContact O-N 3.44Å; D942-I944 PolarHBondContact O-N 3Å; D942-N945 WeakPolarHBondContact O-CB 3.21Å; D942-N945 PolarHBondContact O-N 3.34Å; D942-L946 WeakPolarHBondContact O-CG 3.04Å; D942-L946 PolarHBondContact O-N 3.48Å
943	K	81.2	Confident	75	Confident	50 Å²	50	63.5 Å²	63.5	22%	0.217	34%	0.338	C	S	.	.	H	α-helix	trans	-65	-40.7	175.3	-163.2	67.7	169.5	-167.3	0	112.3	D825 M827 S939 L940 N945 L946 S947	D825-K943 IonicContact OD1-NZ 3.05Å; D825-K943 PolarHBondContact OD1-NZ 3.36Å; D825-K943 IonicContact OD2-NZ 3.07Å; D825-K943 PolarHBondContact OD2-NZ 2.94Å; M827-K943 HydrophobicContact CG-CD 4.42Å; M827-K943 HydrophobicContact CG-CG 4Å; M827-K943 HydrophobicContact SD-CG 4.37Å; S939-K943 PolarHBondContact O-N 3.08Å; L940-K943 PolarHBondContact O-N 2.99Å; K943-N945 VanDerWaalsContact C-N 3.34Å; K943-L946 PolarHBondContact O-N 2.97Å; K943-S947 WeakPolarHBondContact O-CB 3.07Å; K943-S947 PolarHBondContact O-N 3.49Å; K943-S947 PolarHBondContact O-OG 3.24Å
944	I	84.8	Confident	74.6	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-61.5	-45.7	174.1	-74	162.8	0	0	0	109.8	V853 I869 T873 I927 I929 L940 G941 D942 L946 S947 Q948	V853-I944 HydrophobicContact CG1-CG2 3.98Å; I869-I944 HydrophobicContact CD1-CG2 4.2Å; T873-I944 HydrophobicContact CG2-CD1 3.94Å; T873-I944 HydrophobicContact CG2-CG1 3.53Å; I927-I944 HydrophobicContact CD1-CG2 3.72Å; I927-I944 HydrophobicContact CG2-CD1 4.33Å; I929-I944 HydrophobicContact CD1-CD1 3.5Å; I929-I944 HydrophobicContact CG1-CD1 4.29Å; L940-I944 WeakPolarHBondContact O-CG1 3.4Å; L940-I944 PolarHBondContact O-N 3.43Å; G941-I944 PolarHBondContact O-N 3.37Å; D942-I944 PolarHBondContact O-N 3Å; I944-L946 VanDerWaalsContact C-N 3.35Å; I944-L946 PolarHBondContact O-N 3.2Å; I944-S947 WeakPolarHBondContact CA-OG 3.44Å; I944-S947 CarbonylContact O-C 3.53Å; I944-S947 PolarHBondContact O-N 3.06Å; I944-S947 VanDerWaalsContact O-N 3.14Å; I944-S947 PolarHBondContact O-OG 2.78Å; I944-Q948 WeakPolarHBondContact O-CG 3.11Å; I944-Q948 PolarHBondContact O-N 3.13Å
945	N	85.4	Confident	74.1	Confident	76 Å²	76	64.3 Å²	64.3	41%	0.406	34%	0.344	S	S	.	.	H	α-helix	trans	-55.9	-44.6	174.7	-86.8	-36.1	0	0	0	113.1	V853 G941 D942 K943 S947 Q948	V853-N945 WeakPolarHBondContact CG1-OD1 3.39Å; G941-N945 WeakPolarHBondContact O-CB 3.26Å; G941-N945 PolarHBondContact O-N 3Å; G941-N945 PolarHBondContact O-ND2 2.92Å; D942-N945 WeakPolarHBondContact O-CB 3.21Å; D942-N945 PolarHBondContact O-N 3.34Å; K943-N945 VanDerWaalsContact C-N 3.34Å; N945-S947 VanDerWaalsContact C-N 3.32Å; N945-S947 PolarHBondContact O-N 3.4Å; N945-Q948 PolarHBondContact OD1-NE2 2.86Å; N945-Q948 VanDerWaalsContact OD1-NE2 3.12Å
946	L	81	Confident	73.9	Confident	140 Å²	140	67.2 Å²	67.2	73%	0.733	36%	0.356	S	S	*	.	H	α-helix	trans	-66.4	-33.8	177.3	-71.3	167.4	0	0	0	112.6	D942 K943 I944	D942-L946 WeakPolarHBondContact O-CG 3.04Å; D942-L946 PolarHBondContact O-N 3.48Å; K943-L946 PolarHBondContact O-N 2.97Å; I944-L946 VanDerWaalsContact C-N 3.35Å; I944-L946 PolarHBondContact O-N 3.2Å
947	S	78.5	Confident	73.4	Confident	20 Å²	20	71.1 Å²	71.1	14%	0.14	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	8.6	-175.9	58.8	0	0	0	0	114.5	H868 K943 I944 N945 K949	H868-S947 PolarHBondContact CE1-O 3.03Å; H868-S947 PolarHBondContact ND1-O 3.44Å; K943-S947 WeakPolarHBondContact O-CB 3.07Å; K943-S947 PolarHBondContact O-N 3.49Å; K943-S947 PolarHBondContact O-OG 3.24Å; I944-S947 WeakPolarHBondContact CA-OG 3.44Å; I944-S947 CarbonylContact O-C 3.53Å; I944-S947 PolarHBondContact O-N 3.06Å; I944-S947 VanDerWaalsContact O-N 3.14Å; I944-S947 PolarHBondContact O-OG 2.78Å; N945-S947 VanDerWaalsContact C-N 3.32Å; N945-S947 PolarHBondContact O-N 3.4Å; S947-K949 VanDerWaalsContact C-N 3.29Å; S947-K949 PolarHBondContact O-N 3.1Å
948	Q	75.9	Confident	72.7	Confident	9 Å²	9	75.4 Å²	75.4	4%	0.042	40%	0.4	C	S	.	.	S	Bend	trans	-68.4	-27.7	-178.9	-59	-167.7	-4.9	0	0	113.7	T854 N856 T857 I944 N945	T854-Q948 PolarHBondContact O-NE2 3.19Å; T854-Q948 PolarHBondContact O-OE1 3.09Å; N856-Q948 PolarHBondContact O-OE1 3.13Å; T857-Q948 HydrophobicContact CG2-CB 4.32Å; T857-Q948 WeakPolarHBondContact CG2-O 3.46Å; I944-Q948 WeakPolarHBondContact O-CG 3.11Å; I944-Q948 PolarHBondContact O-N 3.13Å; N945-Q948 PolarHBondContact OD1-NE2 2.86Å; N945-Q948 VanDerWaalsContact OD1-NE2 3.12Å
949	K	72.6	Confident	71.9	Confident	127 Å²	127	75.5 Å²	75.5	55%	0.552	40%	0.4	S	S	*	.	S	Bend	trans	-101.1	129.1	-178	-67.3	-179.5	-179.4	176.8	0	109.7	S947 T951	S947-K949 VanDerWaalsContact C-N 3.29Å; S947-K949 PolarHBondContact O-N 3.1Å; K949-T951 PolarHBondContact O-N 2.55Å; K949-T951 VanDerWaalsContact O-N 3.07Å
950	K	60.8	Low	71.2	Confident	142 Å²	142	80.4 Å²	80.4	62%	0.617	43%	0.425	S	S	*	.			trans	-64.4	109.6	167.8	-151.1	179	-170.5	170.9	0	107.3	M859 S952	M859-K950 HydrophobicContact CE-CB 3.75Å; M859-K950 HydrophobicContact CE-CD 4.01Å; M859-K950 HydrophobicContact CE-CG 3.94Å; K950-S952 PolarHBondContact O-N 2.9Å; K950-S952 VanDerWaalsContact O-N 3.16Å
951	T	55	Low	70.3	Confident	126 Å²	126	86.5 Å²	86.5	77%	0.773	46%	0.458	S	S	*	.			trans	-66.6	112.3	168.6	-13.8	0	0	0	0	106	K949 I953	K949-T951 PolarHBondContact O-N 2.55Å; K949-T951 VanDerWaalsContact O-N 3.07Å; T951-I953 PolarHBondContact O-N 2.87Å
952	S	37.3	Very low	69	Low	118 Å²	118	93.8 Å²	93.8	83%	0.825	50%	0.496	S	S	*	.			trans	-62.1	105.7	167.4	-9.9	0	0	0	0	106.3	K950	K950-S952 PolarHBondContact O-N 2.9Å; K950-S952 VanDerWaalsContact O-N 3.16Å
953	I	32.2	Very low	67.7	Low	234 Å²	234	94.9 Å²	94.9	100%	1.2	50%	0.502	S	S	*	.			trans	-72.7	0	158.3	-61.5	175.7	0	0	0	107	T951	T951-I953 PolarHBondContact O-N 2.87Å

Retrieved 953 of 953 residues in 756.5 ms (Link to these results)

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