A0A077Z614_TRITR 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 , UniProt , Accession A0A077Z614, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 959 aa.

						>A0A077Z614_TRITR|A0A077Z614
MATGLLEQPCYVFIAKPSDADLQPNEMQIRESLEHGSLSSKIETLKKLIFAVLNGEKLSSTVLMYVIRFCLPSQDHLMKKLLLVFWEIVPKTTADGKLMQEMILVCDAYRKDLQHPNEFVRGSTLRFLCRLKEPELIEPLMPSIRSCLEYRHSYVRRNAVLAAFTIYKNFDFLIPDAPELMHSFLETEQDSSCKRNAFMMLLHADRRLALDYLSTCIEQSPGLAVQVTLFSDILQLIIVQLIYAVCMANPAEVTRFIRCVYNLLQSSSSAVRYEAASVLISLTSSPAAIRASLNTFVELINKEGDNNVKLIVIDRLVELRQNPAVDKVLQDVVMDLLRVLQCQDLEVQKRTLNLVYDLVSPRNVEEVIAYLRKEIAKTVGTSSVDDTEKYRQVLVKTIHSIAVRFPEVAGTVVPALIELLGDAKEIAAIEVLVFIREAVFSIPALRQTAVDNLLQVFPSMQNANSLRFALWILSEYCQTRQEIEKFVSLVRQSFGKLPADKEDDEANVEVQTMATSKQLLNPDGTYTMHTALSALPDKTSKKALIRKLLYDGDFFFFASLASMLTKIAFRYCRLAHNSTERNRLLSEIMFIEACVLQFGQNGLAKCKLSTGDSERIKVCLKLVADQNVDLAEMFLDECRQSLGILLATNKETQKEGTTVGKVEEPLSQPDEVVGFSQLQMKSDLSAKENLFDQSLSQALGQQRKAEKFTIASTKLDNITQLSGFSDPVYAEALITLSNYDITLDCLIVNQTGDTLESLTLELATLGDLKLVDKPSPITLAPHDFATMKTSIKVSSTENGVIFGTLSYDVHGATGDRNCIYLNDIHVNIMDYITPVLCSDEEFRQMWSEFEWENKVAVMTTLSDLREYLSYLVKHTNMRCLTPDEVLSGESGFLAANLYARSVFGEDALANLSIEKATADQQSPVVGHIRIRAKSQGMALSLGDRISRVQKAHVLGYENS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.4	Very low	36.3	Very low	240 Å²	240	141.9 Å²	141.9	100%	1.182	79%	0.792	S	S	*	*				0	121.1	0	-73.6	176.9	178.3	0	0	106.2	T3	M1-T3 PolarHBondContact O-N 2.98Å
2	A	27.2	Very low	37.6	Very low	104 Å²	104	136 Å²	136	86%	0.86	76%	0.761	S	S	*	*			trans	-30.5	96	-160.2	0	0	0	0	0	114.6	G4	A2-G4 PolarHBondContact O-N 3.13Å
3	T	28.3	Very low	39.2	Very low	136 Å²	136	140.3 Å²	140.3	83%	0.834	77%	0.768	S	S	*	*			trans	-61.4	106.2	159.6	42.3	0	0	0	0	105.3	M1 L5	M1-T3 PolarHBondContact O-N 2.98Å; T3-L5 PolarHBondContact O-N 3.02Å; T3-L5 VanDerWaalsContact O-N 3.12Å
4	G	29.3	Very low	40.7	Very low	62 Å²	62	134.9 Å²	134.9	64%	0.639	74%	0.736	S	S	*	*			trans	-43.2	121.2	-176.2	0	0	0	0	0	109.9	A2 L6	A2-G4 PolarHBondContact O-N 3.13Å; G4-L6 PolarHBondContact O-N 3.32Å
5	L	32.7	Very low	42.1	Very low	174 Å²	174	130.8 Å²	130.8	91%	0.911	73%	0.728	S	S	*	*			trans	-59	89.1	158.7	-78.8	152	0	0	0	104.8	T3 E7	T3-L5 PolarHBondContact O-N 3.02Å; T3-L5 VanDerWaalsContact O-N 3.12Å; L5-E7 PolarHBondContact O-N 3.08Å
6	L	33.6	Very low	43.2	Very low	161 Å²	161	129.4 Å²	129.4	84%	0.843	71%	0.712	S	S	*	*			trans	-44.6	112	163.2	-92.6	128.6	0	0	0	105.3	G4 Q8	G4-L6 PolarHBondContact O-N 3.32Å; L6-Q8 PolarHBondContact O-N 3.31Å
7	E	39.4	Very low	44.1	Very low	179 Å²	179	125.6 Å²	125.6	84%	0.836	70%	0.695	S	S	*	*			trans	-52.6	108.5	174.5	-79.6	-172.8	143.9	0	0	106.5	L5	L5-E7 PolarHBondContact O-N 3.08Å
8	Q	39	Very low	44.8	Very low	141 Å²	141	125.1 Å²	125.1	66%	0.659	70%	0.701	S	S	*	*			trans	-61.8	130.6	177.4	-79.6	-176.5	-14.2	0	0	107.2	L6 C10	L6-Q8 PolarHBondContact O-N 3.31Å; Q8-C10 PolarHBondContact O-N 3.04Å
9	P	45.4	Very low	45.4	Very low	81 Å²	81	126.4 Å²	126.4	53%	0.526	71%	0.707	S	S	.	*			trans	-57	138.4	-175.8	19.4	-29.9	0	0	0	110.7	Y11	P9-Y11 HydrophobicContact CG-CE1 3.96Å; P9-Y11 HydrophobicContact CG-CE2 4.41Å; P9-Y11 WeakPolarHBondContact O-CD2 3.45Å; P9-Y11 VanDerWaalsContact O-CE2 3.27Å; P9-Y11 WeakPolarHBondContact O-CE2 3.24Å; P9-Y11 PolarHBondContact O-N 2.56Å
10	C	48	Very low	45.9	Very low	108 Å²	108	122.2 Å²	122.2	73%	0.73	69%	0.688	S	S	*	*			trans	-65	106.8	173.4	-177	0	0	0	0	109.2	Q8 V12	Q8-C10 PolarHBondContact O-N 3.04Å; C10-V12 VanDerWaalsContact C-N 3.32Å; C10-V12 PolarHBondContact O-N 3.12Å
11	Y	50.9	Low	46	Very low	175 Å²	175	122.2 Å²	122.2	69%	0.686	69%	0.687	S	S	*	*			trans	-80.2	-9.4	-175	-64.5	-75	0	0	0	114.3	P9	P9-Y11 HydrophobicContact CG-CE1 3.96Å; P9-Y11 HydrophobicContact CG-CE2 4.41Å; P9-Y11 WeakPolarHBondContact O-CD2 3.45Å; P9-Y11 VanDerWaalsContact O-CE2 3.27Å; P9-Y11 WeakPolarHBondContact O-CE2 3.24Å; P9-Y11 PolarHBondContact O-N 2.56Å
12	V	52.5	Low	47.3	Very low	71 Å²	71	116.9 Å²	116.9	43%	0.43	66%	0.663	S	S	.	*			trans	-133.2	100.9	-174.4	-174.9	0	0	0	0	109.9	C10 I14	C10-V12 VanDerWaalsContact C-N 3.32Å; C10-V12 PolarHBondContact O-N 3.12Å; V12-I14 HydrophobicContact CG1-CD1 4.24Å; V12-I14 HydrophobicContact CG1-CG1 3.78Å
13	F	57.8	Low	48.6	Very low	192 Å²	192	120.1 Å²	120.1	84%	0.842	66%	0.66	S	S	*	*			trans	-99.4	113.8	168.5	-155.6	-89.8	0	0	0	108.5
14	I	60.8	Low	50	Low	64 Å²	64	115.3 Å²	115.3	33%	0.328	63%	0.631	S	S	.	*			trans	-100.8	109.1	176.4	-43.4	-176.3	0	0	0	107.9	V12 K16 I49 F50 L53	V12-I14 HydrophobicContact CG1-CD1 4.24Å; V12-I14 HydrophobicContact CG1-CG1 3.78Å; I14-K16 PolarHBondContact O-N 3.3Å; I14-I49 HydrophobicContact CD1-CG2 4.28Å; I14-F50 HydrophobicContact CB-CE1 3.83Å; I14-F50 HydrophobicContact CB-CZ 4.46Å; I14-F50 HydrophobicContact CG2-CD1 4.3Å; I14-F50 HydrophobicContact CG2-CE1 3.24Å; I14-F50 HydrophobicContact CG2-CZ 3.45Å; I14-F50 VanDerWaalsContact CG2-CZ 3.45Å; I14-L53 HydrophobicContact CB-CD1 4.45Å; I14-L53 HydrophobicContact CD1-CD1 3.71Å; I14-L53 HydrophobicContact CG1-CD1 4.01Å
15	A	61.4	Low	52.2	Low	74 Å²	74	116.5 Å²	116.5	61%	0.612	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-58.3	127.3	177.8	0	0	0	0	0	110.7	P17	A15-P17 WeakPolarHBondContact O-CD 3.38Å
16	K	59.1	Low	54.4	Low	109 Å²	109	111.5 Å²	111.5	47%	0.474	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-63.5	120.8	176.2	-173.6	-177.5	172	-170.1	0	108.5	I14 A20 D21	I14-K16 PolarHBondContact O-N 3.3Å; K16-A20 HydrophobicContact CD-CB 4.49Å; K16-A20 WeakPolarHBondContact CE-O 3.25Å; K16-A20 HydrophobicContact CG-CB 3.86Å; K16-D21 IonicContact NZ-OD1 4Å; K16-D21 PolarHBondContact NZ-OD1 3.35Å
17	P	58.3	Low	56.7	Low	65 Å²	65	109.6 Å²	109.6	42%	0.422	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-59.2	139.2	168.3	-18	29.7	0	0	0	109.4	A15 D19 A20 F50	A15-P17 WeakPolarHBondContact O-CD 3.38Å; P17-D19 PolarHBondContact O-N 2.67Å; P17-A20 HydrophobicContact CB-CB 4.46Å; P17-A20 VanDerWaalsContact O-CB 3.29Å; P17-A20 WeakPolarHBondContact O-CB 3.31Å; P17-A20 PolarHBondContact O-N 3.18Å; P17-F50 HydrophobicContact CG-CZ 4.41Å
18	S	57.9	Low	58.8	Low	116 Å²	116	106.5 Å²	106.5	81%	0.811	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	-31	-179.8	-26.4	0	0	0	0	113
19	D	55.6	Low	61	Low	150 Å²	150	100.5 Å²	100.5	80%	0.802	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	5.6	-178.9	-68.1	-24.9	0	0	0	114.4	P17 D21	P17-D19 PolarHBondContact O-N 2.67Å; D19-D21 PolarHBondContact O-N 3.46Å; D19-D21 VanDerWaalsContact O-N 3.08Å
20	A	55.8	Low	62.9	Low	41 Å²	41	100 Å²	100	34%	0.339	53%	0.528	S	S	.	.			trans	-82.2	28.6	-178.1	0	0	0	0	0	113.8	K16 P17 L22	K16-A20 HydrophobicContact CD-CB 4.49Å; K16-A20 WeakPolarHBondContact CE-O 3.25Å; K16-A20 HydrophobicContact CG-CB 3.86Å; P17-A20 HydrophobicContact CB-CB 4.46Å; P17-A20 VanDerWaalsContact O-CB 3.29Å; P17-A20 WeakPolarHBondContact O-CB 3.31Å; P17-A20 PolarHBondContact O-N 3.18Å; A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 2.93Å
21	D	46.9	Very low	64.8	Low	123 Å²	123	100.2 Å²	100.2	66%	0.658	52%	0.519	S	S	*	.			trans	-84	79.3	168.9	-77.4	-12.5	0	0	0	109.7	K16 D19	K16-D21 IonicContact NZ-OD1 4Å; K16-D21 PolarHBondContact NZ-OD1 3.35Å; D19-D21 PolarHBondContact O-N 3.46Å; D19-D21 VanDerWaalsContact O-N 3.08Å
22	L	53.2	Low	66.6	Low	128 Å²	128	92.9 Å²	92.9	67%	0.67	49%	0.493	S	S	*	.			trans	-148.1	103.2	160	-86.9	122.8	0	0	0	106.8	A20 P24	A20-L22 VanDerWaalsContact C-N 3.34Å; A20-L22 PolarHBondContact O-N 2.93Å; L22-P24 WeakPolarHBondContact O-CD 3.44Å
23	Q	54.9	Low	68.4	Low	172 Å²	172	89.5 Å²	89.5	80%	0.804	47%	0.472	S	S	*	.			trans	-50.4	109.3	155.8	-74.8	178.6	-11	0	0	106.1	N25	Q23-N25 PolarHBondContact O-N 3.44Å
24	P	57.9	Low	69.9	Low	35 Å²	35	83.4 Å²	83.4	23%	0.227	45%	0.447	C	S	.	.			trans	-73.1	114.4	-167.7	30.4	-33.7	0	0	0	107	L22 E26 I29	L22-P24 WeakPolarHBondContact O-CD 3.44Å; P24-E26 PolarHBondContact O-N 2.85Å; P24-E26 VanDerWaalsContact O-N 3.08Å; P24-I29 HydrophobicContact CB-CD1 3.47Å; P24-I29 VanDerWaalsContact CB-CD1 3.47Å; P24-I29 HydrophobicContact CB-CG1 3.79Å; P24-I29 HydrophobicContact CG-CD1 3.69Å
25	N	75.1	Confident	71.2	Confident	88 Å²	88	87.4 Å²	87.4	47%	0.471	46%	0.464	S	S	.	.			trans	-58.7	119.1	178	-178.8	-10.2	0	0	0	108.2	Q23 M27 Q28 I29	Q23-N25 PolarHBondContact O-N 3.44Å; N25-M27 PolarHBondContact O-N 2.69Å; N25-M27 PolarHBondContact OD1-N 3.32Å; N25-Q28 HydrophobicContact CB-CB 4.33Å; N25-Q28 HydrophobicContact CB-CG 4.07Å; N25-Q28 WeakPolarHBondContact O-CB 3.47Å; N25-Q28 PolarHBondContact O-N 2.9Å; N25-I29 PolarHBondContact O-N 2.7Å; N25-I29 VanDerWaalsContact O-N 3.08Å
26	E	79.6	Confident	72.4	Confident	68 Å²	68	84.9 Å²	84.9	32%	0.318	45%	0.445	S	S	.	.	H	α-helix	trans	-54.3	-33.7	-172	-156.9	-173.2	165.8	0	0	112.2	P24 I29 R30 S59 V62	P24-E26 PolarHBondContact O-N 2.85Å; P24-E26 VanDerWaalsContact O-N 3.08Å; E26-I29 PolarHBondContact O-N 2.89Å; E26-R30 VanDerWaalsContact O-CG 3.24Å; E26-R30 WeakPolarHBondContact O-CG 3.23Å; E26-R30 PolarHBondContact O-N 2.94Å; E26-R30 VanDerWaalsContact O-N 3.09Å; E26-R30 IonicContact OE1-CZ 3.49Å; E26-R30 IonicContact OE1-NE 3.55Å; E26-R30 IonicContact OE1-NH2 2.67Å; E26-R30 PolarHBondContact OE1-NH2 3.48Å; E26-R30 IonicContact OE2-NH2 3.3Å; E26-R30 PolarHBondContact OE2-NH2 3.49Å; E26-S59 WeakPolarHBondContact OE1-CB 3.27Å; E26-S59 PolarHBondContact OE1-OG 3.05Å; E26-V62 HydrophobicContact CG-CG2 3.44Å; E26-V62 VanDerWaalsContact CG-CG2 3.44Å
27	M	81.3	Confident	73.9	Confident	121 Å²	121	83.5 Å²	83.5	60%	0.596	45%	0.449	S	S	*	.	H	α-helix	trans	-66	-42.7	176.6	-164	171.7	-163.6	0	0	112.3	N25 R30 E31	N25-M27 PolarHBondContact O-N 2.69Å; N25-M27 PolarHBondContact OD1-N 3.32Å; M27-R30 PolarHBondContact O-N 3.37Å; M27-E31 PolarHBondContact O-N 3.33Å
28	Q	82.8	Confident	75.3	Confident	114 Å²	114	84.2 Å²	84.2	53%	0.533	45%	0.449	S	S	.	.	H	α-helix	trans	-67.9	-37.7	177.9	-67.6	178.7	-13.6	0	0	111.8	N25 R30 S32	N25-Q28 HydrophobicContact CB-CB 4.33Å; N25-Q28 HydrophobicContact CB-CG 4.07Å; N25-Q28 WeakPolarHBondContact O-CB 3.47Å; N25-Q28 PolarHBondContact O-N 2.9Å; Q28-R30 VanDerWaalsContact C-N 3.35Å; Q28-S32 VanDerWaalsContact O-CB 3.23Å; Q28-S32 WeakPolarHBondContact O-CB 3.44Å; Q28-S32 PolarHBondContact O-N 3.29Å
29	I	85.9	Confident	76.9	Confident	15 Å²	15	82.7 Å²	82.7	8%	0.077	44%	0.438	C	S	.	.	H	α-helix	trans	-59.2	-50.2	174	-60.9	172.4	0	0	0	109.3	P24 N25 E26 E31 S32 L33 T44 L48 V62	P24-I29 HydrophobicContact CB-CD1 3.47Å; P24-I29 VanDerWaalsContact CB-CD1 3.47Å; P24-I29 HydrophobicContact CB-CG1 3.79Å; P24-I29 HydrophobicContact CG-CD1 3.69Å; N25-I29 PolarHBondContact O-N 2.7Å; N25-I29 VanDerWaalsContact O-N 3.08Å; E26-I29 PolarHBondContact O-N 2.89Å; I29-E31 PolarHBondContact O-N 2.88Å; I29-S32 PolarHBondContact O-N 3.03Å; I29-L33 HydrophobicContact CG2-CD1 3.85Å; I29-L33 HydrophobicContact CG2-CG 4.2Å; I29-L33 WeakPolarHBondContact O-CB 3.43Å; I29-L33 VanDerWaalsContact O-CG 3.27Å; I29-L33 WeakPolarHBondContact O-CG 3.27Å; I29-L33 PolarHBondContact O-N 3.33Å; I29-T44 HydrophobicContact CB-CG2 4.46Å; I29-T44 HydrophobicContact CG2-CG2 3.85Å; I29-L48 HydrophobicContact CD1-CD2 3.84Å; I29-L48 HydrophobicContact CG2-CD1 3.99Å; I29-L48 HydrophobicContact CG2-CD2 4.21Å; I29-L48 HydrophobicContact CG2-CG 4.34Å; I29-V62 HydrophobicContact CG2-CG1 4.01Å; I29-V62 HydrophobicContact CG2-CG2 4.5Å
30	R	86.5	Confident	78.5	Confident	71 Å²	71	77.3 Å²	77.3	27%	0.268	41%	0.412	S	S	.	.	H	α-helix	trans	-59.7	-48.7	-178.7	-70.9	172.3	-163.5	175.2	2.9	111.7	E26 M27 Q28 S32 L33 E34 Y65	E26-R30 VanDerWaalsContact O-CG 3.24Å; E26-R30 WeakPolarHBondContact O-CG 3.23Å; E26-R30 PolarHBondContact O-N 2.94Å; E26-R30 VanDerWaalsContact O-N 3.09Å; E26-R30 IonicContact OE1-CZ 3.49Å; E26-R30 IonicContact OE1-NE 3.55Å; E26-R30 IonicContact OE1-NH2 2.67Å; E26-R30 PolarHBondContact OE1-NH2 3.48Å; E26-R30 IonicContact OE2-NH2 3.3Å; E26-R30 PolarHBondContact OE2-NH2 3.49Å; M27-R30 PolarHBondContact O-N 3.37Å; Q28-R30 VanDerWaalsContact C-N 3.35Å; R30-S32 PolarHBondContact O-N 3.08Å; R30-L33 PolarHBondContact O-N 3.46Å; R30-E34 WeakPolarHBondContact O-CB 3.34Å; R30-E34 PolarHBondContact O-N 3.09Å; R30-Y65 HydrophobicContact CB-CD1 3.81Å; R30-Y65 HydrophobicContact CB-CE1 3.62Å; R30-Y65 HydrophobicContact CB-CG 4.5Å; R30-Y65 HydrophobicContact CG-CD1 3.98Å; R30-Y65 HydrophobicContact CG-CD2 4.35Å; R30-Y65 HydrophobicContact CG-CE1 3.97Å; R30-Y65 HydrophobicContact CG-CE2 4.32Å; R30-Y65 HydrophobicContact CG-CG 4.18Å
31	E	87.1	Confident	80.2	Confident	112 Å²	112	76.8 Å²	76.8	52%	0.523	40%	0.402	S	S	.	.	H	α-helix	trans	-61.9	-42.5	178.2	-74.5	-177.3	171.2	0	0	112.2	M27 I29 E34 H35	M27-E31 PolarHBondContact O-N 3.33Å; I29-E31 PolarHBondContact O-N 2.88Å; E31-E34 PolarHBondContact O-N 2.9Å; E31-H35 PolarHBondContact O-N 3.41Å
32	S	88	Confident	82.4	Confident	21 Å²	21	71.9 Å²	71.9	15%	0.147	38%	0.376	C	S	.	.	H	α-helix	trans	-65.8	-38.6	177.4	177.3	0	0	0	0	112.3	Q28 I29 R30 G36 S40 T44	Q28-S32 VanDerWaalsContact O-CB 3.23Å; Q28-S32 WeakPolarHBondContact O-CB 3.44Å; Q28-S32 PolarHBondContact O-N 3.29Å; I29-S32 PolarHBondContact O-N 3.03Å; R30-S32 PolarHBondContact O-N 3.08Å; S32-G36 WeakPolarHBondContact O-CA 3.25Å; S32-G36 PolarHBondContact O-N 3.07Å; S32-S40 PolarHBondContact OG-OG 3.05Å; S32-T44 PolarHBondContact OG-OG1 2.87Å
33	L	89.8	Confident	84.1	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-72.2	-38.2	177.2	-69	-176.6	0	0	0	112.6	I29 R30 K41 T44 L48 V66 F69	I29-L33 HydrophobicContact CG2-CD1 3.85Å; I29-L33 HydrophobicContact CG2-CG 4.2Å; I29-L33 WeakPolarHBondContact O-CB 3.43Å; I29-L33 VanDerWaalsContact O-CG 3.27Å; I29-L33 WeakPolarHBondContact O-CG 3.27Å; I29-L33 PolarHBondContact O-N 3.33Å; R30-L33 PolarHBondContact O-N 3.46Å; L33-K41 WeakPolarHBondContact O-CD 3.48Å; L33-K41 WeakPolarHBondContact O-CE 3.48Å; L33-K41 PolarHBondContact O-NZ 3.24Å; L33-T44 HydrophobicContact CD2-CG2 3.73Å; L33-T44 HydrophobicContact CG-CG2 3.91Å; L33-L48 HydrophobicContact CD1-CD1 4.22Å; L33-V66 HydrophobicContact CD1-CG2 3.74Å; L33-F69 VanDerWaalsContact O-CB 3.25Å; L33-F69 WeakPolarHBondContact O-CB 3.36Å
34	E	90.1	Very high	85.7	Confident	64 Å²	64	62.9 Å²	62.9	30%	0.299	33%	0.331	S	S	.	.	H	α-helix	trans	-76.2	-54.9	-178.6	-177.3	163.2	-161.2	0	0	111.9	R30 E31 K41 Y65 F69	R30-E34 WeakPolarHBondContact O-CB 3.34Å; R30-E34 PolarHBondContact O-N 3.09Å; E31-E34 PolarHBondContact O-N 2.9Å; E34-K41 PolarHBondContact O-NZ 3.49Å; E34-Y65 HydrophobicContact CB-CD1 4.4Å; E34-Y65 HydrophobicContact CB-CE1 4.25Å; E34-F69 HydrophobicContact CB-CD2 4.16Å; E34-F69 HydrophobicContact CB-CE1 4.41Å; E34-F69 HydrophobicContact CB-CE2 3.83Å; E34-F69 HydrophobicContact CB-CZ 3.96Å; E34-F69 HydrophobicContact CG-CE1 3.85Å; E34-F69 HydrophobicContact CG-CE2 3.89Å; E34-F69 HydrophobicContact CG-CZ 3.48Å; E34-F69 VanDerWaalsContact CG-CZ 3.48Å
35	H	88.3	Confident	87.3	Confident	149 Å²	149	61.2 Å²	61.2	69%	0.69	32%	0.321	S	S	*	.	H	α-helix	trans	-105.7	-10.1	-170.8	-59.7	-55.1	0	0	0	114.5	E31	E31-H35 PolarHBondContact O-N 3.41Å
36	G	85.5	Confident	88	Confident	21 Å²	21	61.5 Å²	61.5	22%	0.216	32%	0.317	C	S	.	.	S	Bend	trans	-68.1	155.2	-178.1	0	0	0	0	0	114	S32 K41	S32-G36 WeakPolarHBondContact O-CA 3.25Å; S32-G36 PolarHBondContact O-N 3.07Å; G36-K41 WeakPolarHBondContact O-CE 3.29Å
37	S	90.6	Very high	88.4	Confident	79 Å²	79	63.2 Å²	63.2	55%	0.552	32%	0.324	S	S	*	.			trans	-62.5	161.5	169.7	69.7	0	0	0	0	111.1	S39 S40 K41	S37-S39 PolarHBondContact O-N 2.84Å; S37-S40 WeakPolarHBondContact O-CA 3.16Å; S37-S40 WeakPolarHBondContact O-CB 3.44Å; S37-S40 PolarHBondContact O-N 3.37Å; S37-S40 PolarHBondContact OG-N 3.47Å; S37-K41 WeakPolarHBondContact O-CG 3.49Å; S37-K41 PolarHBondContact O-N 3.14Å
38	L	89.5	Confident	88.7	Confident	80 Å²	80	57.7 Å²	57.7	42%	0.419	30%	0.297	S	S	.	.	H	α-helix	trans	-52.2	-41.2	177.3	178.7	63.8	0	0	0	112.3	K41 I42 D75 M78	L38-K41 PolarHBondContact O-N 3.34Å; L38-I42 HydrophobicContact CD1-CD1 4.28Å; L38-I42 HydrophobicContact CG-CD1 4.06Å; L38-I42 VanDerWaalsContact O-CG1 3.28Å; L38-I42 WeakPolarHBondContact O-CG1 3.32Å; L38-I42 PolarHBondContact O-N 3.08Å; L38-D75 HydrophobicContact CD1-CB 3.94Å; L38-D75 HydrophobicContact CD2-CB 3.83Å; L38-D75 HydrophobicContact CG-CB 4.45Å; L38-M78 HydrophobicContact CD1-CE 4.02Å
39	S	89.9	Confident	88.9	Confident	85 Å²	85	52.5 Å²	52.5	59%	0.594	27%	0.273	S	S	*	.	H	α-helix	trans	-62.2	-43.2	175.6	-170.3	0	0	0	0	112.1	S37 I42 E43	S37-S39 PolarHBondContact O-N 2.84Å; S39-I42 PolarHBondContact O-N 3.42Å; S39-E43 PolarHBondContact O-N 3.33Å
40	S	89.3	Confident	88.8	Confident	36 Å²	36	54.1 Å²	54.1	25%	0.252	28%	0.279	S	S	.	.	H	α-helix	trans	-64	-43.1	176.9	-178.4	0	0	0	0	111.3	S32 S37 I42 E43 T44	S32-S40 PolarHBondContact OG-OG 3.05Å; S37-S40 WeakPolarHBondContact O-CA 3.16Å; S37-S40 WeakPolarHBondContact O-CB 3.44Å; S37-S40 PolarHBondContact O-N 3.37Å; S37-S40 PolarHBondContact OG-N 3.47Å; S40-I42 VanDerWaalsContact C-N 3.32Å; S40-I42 PolarHBondContact O-N 3.44Å; S40-E43 PolarHBondContact O-N 3.22Å; S40-T44 WeakPolarHBondContact O-CB 3.33Å; S40-T44 PolarHBondContact O-N 2.94Å; S40-T44 PolarHBondContact O-OG1 2.95Å; S40-T44 VanDerWaalsContact O-OG1 3.05Å
41	K	92.3	Very high	88.6	Confident	31 Å²	31	51.3 Å²	51.3	14%	0.135	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-39.9	175.8	-61.4	-172.4	-168.1	-147.2	0	112.1	L33 E34 G36 S37 L38 T44 L45 M78	L33-K41 WeakPolarHBondContact O-CD 3.48Å; L33-K41 WeakPolarHBondContact O-CE 3.48Å; L33-K41 PolarHBondContact O-NZ 3.24Å; E34-K41 PolarHBondContact O-NZ 3.49Å; G36-K41 WeakPolarHBondContact O-CE 3.29Å; S37-K41 WeakPolarHBondContact O-CG 3.49Å; S37-K41 PolarHBondContact O-N 3.14Å; L38-K41 PolarHBondContact O-N 3.34Å; K41-T44 PolarHBondContact O-N 3.44Å; K41-L45 WeakPolarHBondContact O-CB 3.26Å; K41-L45 PolarHBondContact O-N 3.17Å; K41-M78 HydrophobicContact CB-CE 3.5Å
42	I	92	Very high	88.4	Confident	19 Å²	19	47 Å²	47	10%	0.097	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-44.9	176.8	-74.3	169.3	0	0	0	110.7	L38 S39 S40 L45 K46 L77 M78 L81	L38-I42 HydrophobicContact CD1-CD1 4.28Å; L38-I42 HydrophobicContact CG-CD1 4.06Å; L38-I42 VanDerWaalsContact O-CG1 3.28Å; L38-I42 WeakPolarHBondContact O-CG1 3.32Å; L38-I42 PolarHBondContact O-N 3.08Å; S39-I42 PolarHBondContact O-N 3.42Å; S40-I42 VanDerWaalsContact C-N 3.32Å; S40-I42 PolarHBondContact O-N 3.44Å; I42-L45 PolarHBondContact O-N 2.79Å; I42-K46 HydrophobicContact CG2-CD 4.49Å; I42-K46 WeakPolarHBondContact O-CG 3.48Å; I42-K46 PolarHBondContact O-N 3.4Å; I42-L77 HydrophobicContact CD1-CB 4.41Å; I42-L77 HydrophobicContact CD1-CD2 4.05Å; I42-L77 HydrophobicContact CD1-CG 4.25Å; I42-L77 HydrophobicContact CG2-CD2 4.01Å; I42-L77 HydrophobicContact CG2-CG 4.36Å; I42-M78 HydrophobicContact CG1-CE 3.63Å; I42-M78 HydrophobicContact CG1-SD 4.38Å; I42-L81 HydrophobicContact CB-CD1 4.49Å; I42-L81 HydrophobicContact CG2-CD1 3.72Å
43	E	89.2	Confident	88	Confident	98 Å²	98	49.2 Å²	49.2	46%	0.458	26%	0.262	S	S	.	.	H	α-helix	trans	-64.7	-44.1	177.8	-165.7	-170.7	148.8	0	0	111.7	S39 S40 L45 K46 K47	S39-E43 PolarHBondContact O-N 3.33Å; S40-E43 PolarHBondContact O-N 3.22Å; E43-L45 PolarHBondContact O-N 3.1Å; E43-K46 WeakPolarHBondContact O-CB 3.33Å; E43-K46 PolarHBondContact O-N 3.25Å; E43-K47 WeakPolarHBondContact O-CG 3.48Å; E43-K47 PolarHBondContact O-N 3.44Å; E43-K47 VanDerWaalsContact OE1-CE 3.27Å; E43-K47 WeakPolarHBondContact OE1-CE 3.27Å; E43-K47 IonicContact OE1-NZ 3.77Å; E43-K47 PolarHBondContact OE1-NZ 2.96Å
44	T	89.9	Confident	87.3	Confident	14 Å²	14	54.3 Å²	54.3	9%	0.086	29%	0.289	C	S	.	.	H	α-helix	trans	-64	-40.9	177.4	-61.5	0	0	0	0	111.7	I29 S32 L33 S40 K41 K46 K47 L48	I29-T44 HydrophobicContact CB-CG2 4.46Å; I29-T44 HydrophobicContact CG2-CG2 3.85Å; S32-T44 PolarHBondContact OG-OG1 2.87Å; L33-T44 HydrophobicContact CD2-CG2 3.73Å; L33-T44 HydrophobicContact CG-CG2 3.91Å; S40-T44 WeakPolarHBondContact O-CB 3.33Å; S40-T44 PolarHBondContact O-N 2.94Å; S40-T44 PolarHBondContact O-OG1 2.95Å; S40-T44 VanDerWaalsContact O-OG1 3.05Å; K41-T44 PolarHBondContact O-N 3.44Å; T44-K46 PolarHBondContact O-N 3.37Å; T44-K47 PolarHBondContact O-N 3.03Å; T44-L48 WeakPolarHBondContact O-CG 3.43Å; T44-L48 PolarHBondContact O-N 3.06Å
45	L	91.4	Very high	86.5	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-38.4	174.4	-174.3	61.4	0	0	0	111.9	K41 I42 E43 L48 I49 V66 M78 L81 L82 F85	K41-L45 WeakPolarHBondContact O-CB 3.26Å; K41-L45 PolarHBondContact O-N 3.17Å; I42-L45 PolarHBondContact O-N 2.79Å; E43-L45 PolarHBondContact O-N 3.1Å; L45-L48 PolarHBondContact O-N 2.91Å; L45-I49 HydrophobicContact CG-CD1 4.34Å; L45-I49 WeakPolarHBondContact O-CG1 3.45Å; L45-I49 PolarHBondContact O-N 2.88Å; L45-V66 HydrophobicContact CD1-CG1 4.21Å; L45-M78 HydrophobicContact CD2-SD 3.57Å; L45-M78 VanDerWaalsContact CD2-SD 3.57Å; L45-L81 HydrophobicContact CD2-CB 3.65Å; L45-L81 HydrophobicContact CG-CB 4.32Å; L45-L82 HydrophobicContact CD2-CD2 4Å; L45-L82 HydrophobicContact CD2-CG 3.99Å; L45-F85 HydrophobicContact CD1-CB 4.14Å; L45-F85 HydrophobicContact CD1-CD1 4.36Å; L45-F85 HydrophobicContact CD1-CD2 3.95Å; L45-F85 HydrophobicContact CD1-CE2 4.43Å; L45-F85 HydrophobicContact CD1-CG 3.89Å
46	K	89.4	Confident	86	Confident	93 Å²	93	51.1 Å²	51.1	40%	0.404	29%	0.292	S	S	.	.	H	α-helix	trans	-60.4	-46.8	172.6	-73.7	173.8	179.8	-178.1	0	111.3	I42 E43 T44 L48 I49 F50 L81	I42-K46 HydrophobicContact CG2-CD 4.49Å; I42-K46 WeakPolarHBondContact O-CG 3.48Å; I42-K46 PolarHBondContact O-N 3.4Å; E43-K46 WeakPolarHBondContact O-CB 3.33Å; E43-K46 PolarHBondContact O-N 3.25Å; T44-K46 PolarHBondContact O-N 3.37Å; K46-L48 VanDerWaalsContact C-N 3.31Å; K46-L48 PolarHBondContact O-N 2.81Å; K46-I49 WeakPolarHBondContact O-CB 3.3Å; K46-I49 PolarHBondContact O-N 3.28Å; K46-F50 WeakPolarHBondContact O-CD2 3.48Å; K46-F50 PolarHBondContact O-N 3.06Å; K46-L81 HydrophobicContact CG-CD1 4.01Å; K46-L81 HydrophobicContact CG-CD2 4Å
47	K	86.5	Confident	85.6	Confident	104 Å²	104	60.1 Å²	60.1	45%	0.452	33%	0.325	S	S	.	.	H	α-helix	trans	-58.8	-42	176.6	-71.1	175.8	-175.5	167.8	0	111.6	E43 T44 F50 A51	E43-K47 WeakPolarHBondContact O-CG 3.48Å; E43-K47 PolarHBondContact O-N 3.44Å; E43-K47 VanDerWaalsContact OE1-CE 3.27Å; E43-K47 WeakPolarHBondContact OE1-CE 3.27Å; E43-K47 IonicContact OE1-NZ 3.77Å; E43-K47 PolarHBondContact OE1-NZ 2.96Å; T44-K47 PolarHBondContact O-N 3.03Å; K47-F50 PolarHBondContact O-N 2.89Å; K47-A51 PolarHBondContact O-N 3.06Å
48	L	87.7	Confident	85.2	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.026	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-41.5	174.8	-75.3	173.5	0	0	0	112.9	I29 L33 T44 L45 K46 F50 A51 V52 L58 V62 V66 F85	I29-L48 HydrophobicContact CD1-CD2 3.84Å; I29-L48 HydrophobicContact CG2-CD1 3.99Å; I29-L48 HydrophobicContact CG2-CD2 4.21Å; I29-L48 HydrophobicContact CG2-CG 4.34Å; L33-L48 HydrophobicContact CD1-CD1 4.22Å; T44-L48 WeakPolarHBondContact O-CG 3.43Å; T44-L48 PolarHBondContact O-N 3.06Å; L45-L48 PolarHBondContact O-N 2.91Å; K46-L48 VanDerWaalsContact C-N 3.31Å; K46-L48 PolarHBondContact O-N 2.81Å; L48-F50 VanDerWaalsContact C-N 3.3Å; L48-F50 PolarHBondContact O-N 2.89Å; L48-A51 PolarHBondContact O-N 3.1Å; L48-V52 WeakPolarHBondContact O-CG2 3.33Å; L48-V52 PolarHBondContact O-N 3.13Å; L48-L58 HydrophobicContact CD2-CD1 4.08Å; L48-V62 HydrophobicContact CD1-CG1 3.95Å; L48-V62 HydrophobicContact CD2-CG1 3.9Å; L48-V66 HydrophobicContact CD1-CG2 3.93Å; L48-F85 HydrophobicContact CB-CE2 4.17Å
49	I	88.4	Confident	84.9	Confident	6 Å²	6	56.4 Å²	56.4	3%	0.031	30%	0.302	C	S	.	.	H	α-helix	trans	-59.1	-44.3	175.4	-71.8	165.2	0	0	0	110.6	I14 L45 K46 L53 L81 V84 F85 I88	I14-I49 HydrophobicContact CD1-CG2 4.28Å; L45-I49 HydrophobicContact CG-CD1 4.34Å; L45-I49 WeakPolarHBondContact O-CG1 3.45Å; L45-I49 PolarHBondContact O-N 2.88Å; K46-I49 WeakPolarHBondContact O-CB 3.3Å; K46-I49 PolarHBondContact O-N 3.28Å; I49-L53 HydrophobicContact CG2-CD1 3.94Å; I49-L53 WeakPolarHBondContact O-CB 3.3Å; I49-L53 WeakPolarHBondContact O-CG 2.99Å; I49-L53 PolarHBondContact O-N 3.37Å; I49-L53 VanDerWaalsContact O-N 3.08Å; I49-L81 HydrophobicContact CD1-CB 4.32Å; I49-L81 HydrophobicContact CD1-CD2 4.06Å; I49-V84 HydrophobicContact CD1-CB 4.34Å; I49-V84 HydrophobicContact CD1-CG1 4.26Å; I49-V84 HydrophobicContact CG2-CG1 4.12Å; I49-F85 HydrophobicContact CD1-CB 4.19Å; I49-F85 HydrophobicContact CG1-CB 3.92Å; I49-F85 HydrophobicContact CG1-CD2 3.96Å; I49-F85 HydrophobicContact CG1-CG 4.45Å; I49-I88 HydrophobicContact CB-CD1 4.19Å; I49-I88 HydrophobicContact CG1-CD1 4.27Å; I49-I88 HydrophobicContact CG2-CD1 3.95Å
50	F	83	Confident	84.5	Confident	49 Å²	49	55.6 Å²	55.6	22%	0.215	30%	0.296	C	S	.	.	H	α-helix	trans	-64	-43.8	176.5	-79.2	-69.4	0	0	0	113	I14 P17 K46 K47 L48 L53 N54	I14-F50 HydrophobicContact CB-CE1 3.83Å; I14-F50 HydrophobicContact CB-CZ 4.46Å; I14-F50 HydrophobicContact CG2-CD1 4.3Å; I14-F50 HydrophobicContact CG2-CE1 3.24Å; I14-F50 HydrophobicContact CG2-CZ 3.45Å; I14-F50 VanDerWaalsContact CG2-CZ 3.45Å; P17-F50 HydrophobicContact CG-CZ 4.41Å; K46-F50 WeakPolarHBondContact O-CD2 3.48Å; K46-F50 PolarHBondContact O-N 3.06Å; K47-F50 PolarHBondContact O-N 2.89Å; L48-F50 VanDerWaalsContact C-N 3.3Å; L48-F50 PolarHBondContact O-N 2.89Å; F50-L53 PolarHBondContact O-N 3.12Å; F50-N54 PolarHBondContact O-N 3.11Å; F50-N54 PolarHBondContact O-ND2 3.07Å
51	A	81.7	Confident	84.3	Confident	11 Å²	11	56.9 Å²	56.9	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-58.1	-50.2	177.7	0	0	0	0	0	111.7	K47 L48 L53 N54 G55 E56	K47-A51 PolarHBondContact O-N 3.06Å; L48-A51 PolarHBondContact O-N 3.1Å; A51-L53 PolarHBondContact O-N 3.36Å; A51-N54 PolarHBondContact O-N 2.91Å; A51-G55 PolarHBondContact O-N 2.9Å; A51-E56 HydrophobicContact CB-CB 4.21Å; A51-E56 HydrophobicContact CB-CG 4.44Å; A51-E56 VanDerWaalsContact CB-OE2 3.29Å; A51-E56 WeakPolarHBondContact CB-OE2 3.24Å; A51-E56 WeakPolarHBondContact O-CB 3.14Å; A51-E56 PolarHBondContact O-N 3Å; A51-E56 VanDerWaalsContact O-N 3.09Å
52	V	83.1	Confident	84.1	Confident	21 Å²	21	55.6 Å²	55.6	13%	0.127	30%	0.298	C	S	.	.	H	α-helix	trans	-65.8	-40.1	-178.6	175.1	0	0	0	0	111.8	L48 N54 G55 L58 I88	L48-V52 WeakPolarHBondContact O-CG2 3.33Å; L48-V52 PolarHBondContact O-N 3.13Å; V52-N54 PolarHBondContact O-N 3.32Å; V52-G55 PolarHBondContact O-N 2.91Å; V52-L58 HydrophobicContact CG2-CB 4.23Å; V52-L58 HydrophobicContact CG2-CD1 4.22Å; V52-I88 HydrophobicContact CB-CD1 3.89Å; V52-I88 HydrophobicContact CB-CG1 4.46Å; V52-I88 HydrophobicContact CG1-CB 4.25Å; V52-I88 HydrophobicContact CG1-CD1 3.9Å; V52-I88 HydrophobicContact CG1-CG1 3.95Å
53	L	80.2	Confident	83.9	Confident	69 Å²	69	54.9 Å²	54.9	36%	0.361	29%	0.294	S	S	.	.	H	α-helix	trans	-62	-27.3	175.8	-79.4	171.6	0	0	0	113.2	I14 I49 F50 A51 G55 I88	I14-L53 HydrophobicContact CB-CD1 4.45Å; I14-L53 HydrophobicContact CD1-CD1 3.71Å; I14-L53 HydrophobicContact CG1-CD1 4.01Å; I49-L53 HydrophobicContact CG2-CD1 3.94Å; I49-L53 WeakPolarHBondContact O-CB 3.3Å; I49-L53 WeakPolarHBondContact O-CG 2.99Å; I49-L53 PolarHBondContact O-N 3.37Å; I49-L53 VanDerWaalsContact O-N 3.08Å; F50-L53 PolarHBondContact O-N 3.12Å; A51-L53 PolarHBondContact O-N 3.36Å; L53-G55 VanDerWaalsContact C-N 3.3Å; L53-I88 HydrophobicContact CD2-CB 4.48Å; L53-I88 HydrophobicContact CD2-CG2 3.69Å; L53-I88 HydrophobicContact CG-CD1 4.12Å; L53-I88 HydrophobicContact CG-CG2 4.26Å
54	N	75.8	Confident	84	Confident	107 Å²	107	53.7 Å²	53.7	57%	0.572	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	9.9	176.4	-68.6	-38.4	0	0	0	113.4	F50 A51 V52	F50-N54 PolarHBondContact O-N 3.11Å; F50-N54 PolarHBondContact O-ND2 3.07Å; A51-N54 PolarHBondContact O-N 2.91Å; V52-N54 PolarHBondContact O-N 3.32Å
55	G	73.7	Confident	84	Confident	63 Å²	63	55.7 Å²	55.7	65%	0.649	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.6	7.2	176.5	0	0	0	0	0	115.2	A51 V52 L53 K57	A51-G55 PolarHBondContact O-N 2.9Å; V52-G55 PolarHBondContact O-N 2.91Å; L53-G55 VanDerWaalsContact C-N 3.3Å; G55-K57 PolarHBondContact O-N 3.45Å
56	E	77.4	Confident	84	Confident	83 Å²	83	55.7 Å²	55.7	39%	0.388	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-68	129.2	172.6	-65.1	-168	171.7	0	0	110.6	A51 L58	A51-E56 HydrophobicContact CB-CB 4.21Å; A51-E56 HydrophobicContact CB-CG 4.44Å; A51-E56 VanDerWaalsContact CB-OE2 3.29Å; A51-E56 WeakPolarHBondContact CB-OE2 3.24Å; A51-E56 WeakPolarHBondContact O-CB 3.14Å; A51-E56 PolarHBondContact O-N 3Å; A51-E56 VanDerWaalsContact O-N 3.09Å; E56-L58 PolarHBondContact O-N 2.75Å
57	K	77.2	Confident	84.1	Confident	210 Å²	210	51.9 Å²	51.9	91%	0.913	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-73.9	118.6	179.2	-68.3	-177.1	-179.7	177.8	0	110.1	G55 S59	G55-K57 PolarHBondContact O-N 3.45Å; K57-S59 PolarHBondContact O-N 2.72Å
58	L	81	Confident	84.3	Confident	43 Å²	43	54.8 Å²	54.8	23%	0.225	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-69.5	124.9	174.1	-168.5	78.4	0	0	0	110.5	L48 V52 E56 V62 L63 F85 V89	L48-L58 HydrophobicContact CD2-CD1 4.08Å; V52-L58 HydrophobicContact CG2-CB 4.23Å; V52-L58 HydrophobicContact CG2-CD1 4.22Å; E56-L58 PolarHBondContact O-N 2.75Å; L58-V62 HydrophobicContact CD1-CB 4.3Å; L58-V62 HydrophobicContact CD1-CG1 3.79Å; L58-L63 HydrophobicContact CD2-CB 3.86Å; L58-L63 HydrophobicContact CD2-CD1 3.93Å; L58-L63 HydrophobicContact CD2-CG 4.41Å; L58-F85 HydrophobicContact CD1-CE2 4.38Å; L58-F85 HydrophobicContact CD1-CZ 4.23Å; L58-F85 HydrophobicContact CD2-CE1 4.45Å; L58-F85 HydrophobicContact CD2-CE2 4.31Å; L58-F85 HydrophobicContact CD2-CZ 3.6Å; L58-V89 HydrophobicContact CD2-CG1 4.33Å; L58-V89 HydrophobicContact CD2-CG2 4.01Å
59	S	83.5	Confident	84.4	Confident	38 Å²	38	56.6 Å²	56.6	27%	0.266	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-70.9	145.5	174.3	79.6	0	0	0	0	111.2	E26 K57 T61 V62 L63	E26-S59 WeakPolarHBondContact OE1-CB 3.27Å; E26-S59 PolarHBondContact OE1-OG 3.05Å; K57-S59 PolarHBondContact O-N 2.72Å; S59-T61 PolarHBondContact O-N 3.19Å; S59-V62 PolarHBondContact O-N 3.24Å; S59-V62 VanDerWaalsContact OG-CG2 3.31Å; S59-V62 WeakPolarHBondContact OG-CG2 3.07Å; S59-V62 PolarHBondContact OG-N 2.76Å; S59-V62 VanDerWaalsContact OG-N 3.12Å; S59-L63 PolarHBondContact O-N 2.89Å
60	S	81.6	Confident	84.6	Confident	68 Å²	68	56.3 Å²	56.3	48%	0.476	29%	0.294	S	S	.	.	H	α-helix	trans	-58.5	-29.9	175.9	-53	0	0	0	0	112.4	M64	S60-M64 PolarHBondContact O-N 3.08Å; S60-M64 VanDerWaalsContact O-N 3.08Å
61	T	85.5	Confident	84.9	Confident	63 Å²	63	54.7 Å²	54.7	39%	0.387	29%	0.287	S	S	.	.	H	α-helix	trans	-68.9	-46.4	176.9	-46.3	0	0	0	0	111.7	S59 L63 M64 Y65	S59-T61 PolarHBondContact O-N 3.19Å; T61-L63 VanDerWaalsContact C-N 3.32Å; T61-L63 PolarHBondContact O-N 3.48Å; T61-M64 PolarHBondContact O-N 3Å; T61-Y65 HydrophobicContact CG2-CD2 4.34Å; T61-Y65 HydrophobicContact CG2-CE2 4.07Å; T61-Y65 VanDerWaalsContact O-CD2 3.25Å; T61-Y65 WeakPolarHBondContact O-CD2 3.25Å; T61-Y65 PolarHBondContact O-N 2.77Å; T61-Y65 VanDerWaalsContact O-N 3.14Å
62	V	87.6	Confident	85.3	Confident	4 Å²	4	58.1 Å²	58.1	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-62.8	-42.1	176.4	172.1	0	0	0	0	110.6	E26 I29 L48 L58 S59 M64 Y65 V66	E26-V62 HydrophobicContact CG-CG2 3.44Å; E26-V62 VanDerWaalsContact CG-CG2 3.44Å; I29-V62 HydrophobicContact CG2-CG1 4.01Å; I29-V62 HydrophobicContact CG2-CG2 4.5Å; L48-V62 HydrophobicContact CD1-CG1 3.95Å; L48-V62 HydrophobicContact CD2-CG1 3.9Å; L58-V62 HydrophobicContact CD1-CB 4.3Å; L58-V62 HydrophobicContact CD1-CG1 3.79Å; S59-V62 PolarHBondContact O-N 3.24Å; S59-V62 VanDerWaalsContact OG-CG2 3.31Å; S59-V62 WeakPolarHBondContact OG-CG2 3.07Å; S59-V62 PolarHBondContact OG-N 2.76Å; S59-V62 VanDerWaalsContact OG-N 3.12Å; V62-M64 VanDerWaalsContact C-N 3.29Å; V62-M64 PolarHBondContact O-N 2.94Å; V62-Y65 PolarHBondContact O-N 2.98Å; V62-V66 WeakPolarHBondContact O-CG2 3.46Å; V62-V66 PolarHBondContact O-N 3.44Å
63	L	89.2	Confident	85.5	Confident	3 Å²	3	58.3 Å²	58.3	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-53.6	-46.7	174.6	178.6	62.2	0	0	0	111.7	L58 S59 T61 Y65 V66 I67 F85 W86 V89 M99 E101 M102	L58-L63 HydrophobicContact CD2-CB 3.86Å; L58-L63 HydrophobicContact CD2-CD1 3.93Å; L58-L63 HydrophobicContact CD2-CG 4.41Å; S59-L63 PolarHBondContact O-N 2.89Å; T61-L63 VanDerWaalsContact C-N 3.32Å; T61-L63 PolarHBondContact O-N 3.48Å; L63-Y65 VanDerWaalsContact C-N 3.33Å; L63-Y65 PolarHBondContact O-N 3.19Å; L63-V66 PolarHBondContact O-N 3.09Å; L63-I67 HydrophobicContact CD1-CD1 4.35Å; L63-I67 HydrophobicContact CG-CD1 4.16Å; L63-I67 WeakPolarHBondContact O-CG1 3.42Å; L63-I67 PolarHBondContact O-N 3.48Å; L63-F85 HydrophobicContact CD1-CE1 4.32Å; L63-W86 HydrophobicContact CD1-CH2 3.9Å; L63-W86 HydrophobicContact CD1-CZ3 3.55Å; L63-V89 HydrophobicContact CD1-CG1 4.35Å; L63-M99 HydrophobicContact CD2-CE 3.44Å; L63-M99 VanDerWaalsContact CD2-CE 3.44Å; L63-M99 HydrophobicContact CD2-SD 4.34Å; L63-E101 HydrophobicContact CD2-CB 4.13Å; L63-E101 HydrophobicContact CD2-CG 4.33Å; L63-M102 HydrophobicContact CD1-CE 4.21Å; L63-M102 HydrophobicContact CD2-CE 3.98Å
64	M	89.8	Confident	85.7	Confident	73 Å²	73	61.1 Å²	61.1	36%	0.36	32%	0.322	S	S	.	.	H	α-helix	trans	-63.6	-35.6	177.6	-172.4	58.6	66.9	0	0	112.9	S60 T61 V62 I67 R68 E101	S60-M64 PolarHBondContact O-N 3.08Å; S60-M64 VanDerWaalsContact O-N 3.08Å; T61-M64 PolarHBondContact O-N 3Å; V62-M64 VanDerWaalsContact C-N 3.29Å; V62-M64 PolarHBondContact O-N 2.94Å; M64-I67 PolarHBondContact O-N 3.38Å; M64-R68 VanDerWaalsContact O-CB 3.29Å; M64-R68 WeakPolarHBondContact O-CB 3.25Å; M64-R68 PolarHBondContact O-N 3.07Å; M64-E101 HydrophobicContact CE-CG 3.71Å
65	Y	90.5	Very high	86.4	Confident	56 Å²	56	58.4 Å²	58.4	22%	0.22	31%	0.308	C	S	.	.	H	α-helix	trans	-67.7	-39.3	175.6	-85.6	-119.6	0	0	0	111.5	R30 E34 T61 V62 L63 R68 F69	R30-Y65 HydrophobicContact CB-CD1 3.81Å; R30-Y65 HydrophobicContact CB-CE1 3.62Å; R30-Y65 HydrophobicContact CB-CG 4.5Å; R30-Y65 HydrophobicContact CG-CD1 3.98Å; R30-Y65 HydrophobicContact CG-CD2 4.35Å; R30-Y65 HydrophobicContact CG-CE1 3.97Å; R30-Y65 HydrophobicContact CG-CE2 4.32Å; R30-Y65 HydrophobicContact CG-CG 4.18Å; E34-Y65 HydrophobicContact CB-CD1 4.4Å; E34-Y65 HydrophobicContact CB-CE1 4.25Å; T61-Y65 HydrophobicContact CG2-CD2 4.34Å; T61-Y65 HydrophobicContact CG2-CE2 4.07Å; T61-Y65 VanDerWaalsContact O-CD2 3.25Å; T61-Y65 WeakPolarHBondContact O-CD2 3.25Å; T61-Y65 PolarHBondContact O-N 2.77Å; T61-Y65 VanDerWaalsContact O-N 3.14Å; V62-Y65 PolarHBondContact O-N 2.98Å; L63-Y65 VanDerWaalsContact C-N 3.33Å; L63-Y65 PolarHBondContact O-N 3.19Å; Y65-R68 PolarHBondContact O-N 3.5Å; Y65-F69 AromaticContact CD1-CD2 3.82Å; Y65-F69 HydrophobicContact CD1-CD2 3.82Å; Y65-F69 AromaticContact CD1-CE2 3.58Å; Y65-F69 HydrophobicContact CD1-CE2 3.58Å; Y65-F69 AromaticContact CE1-CE2 3.89Å; Y65-F69 HydrophobicContact CE1-CE2 3.89Å; Y65-F69 HydrophobicContact CG-CD2 4.16Å; Y65-F69 HydrophobicContact CG-CE2 4.06Å; Y65-F69 WeakPolarHBondContact O-CB 3.29Å; Y65-F69 WeakPolarHBondContact O-CD2 3.36Å; Y65-F69 PolarHBondContact O-N 3.38Å
66	V	92	Very high	87	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.6	-45.6	172.8	178.4	0	0	0	0	110.4	L33 L45 L48 V62 L63 R68 C70 L71 L82 F85 W86	L33-V66 HydrophobicContact CD1-CG2 3.74Å; L45-V66 HydrophobicContact CD1-CG1 4.21Å; L48-V66 HydrophobicContact CD1-CG2 3.93Å; V62-V66 WeakPolarHBondContact O-CG2 3.46Å; V62-V66 PolarHBondContact O-N 3.44Å; L63-V66 PolarHBondContact O-N 3.09Å; V66-R68 PolarHBondContact O-N 3.29Å; V66-C70 HydrophobicContact CG1-CB 4.1Å; V66-C70 WeakPolarHBondContact O-CA 3.39Å; V66-C70 VanDerWaalsContact O-CB 3.25Å; V66-C70 WeakPolarHBondContact O-CB 3.44Å; V66-C70 PolarHBondContact O-N 3.16Å; V66-L71 PolarHBondContact O-N 3.17Å; V66-L82 HydrophobicContact CG1-CD2 3.78Å; V66-F85 HydrophobicContact CB-CE1 4.27Å; V66-F85 HydrophobicContact CG1-CD1 4.11Å; V66-F85 HydrophobicContact CG1-CE1 3.77Å; V66-F85 HydrophobicContact CG1-CZ 4.42Å; V66-F85 HydrophobicContact CG2-CE1 4.33Å; V66-F85 HydrophobicContact CG2-CZ 4.19Å; V66-W86 HydrophobicContact CG1-CH2 4.24Å; V66-W86 HydrophobicContact CG1-CZ2 4.25Å
67	I	90.7	Very high	87.5	Confident	13 Å²	13	60.8 Å²	60.8	7%	0.067	30%	0.304	C	S	.	.	H	α-helix	trans	-61.6	-44.3	177	-66.5	171.4	0	0	0	111.2	L63 M64 L71 W86 E101 L104 V105	L63-I67 HydrophobicContact CD1-CD1 4.35Å; L63-I67 HydrophobicContact CG-CD1 4.16Å; L63-I67 WeakPolarHBondContact O-CG1 3.42Å; L63-I67 PolarHBondContact O-N 3.48Å; M64-I67 PolarHBondContact O-N 3.38Å; I67-L71 HydrophobicContact CG2-CD2 3.97Å; I67-L71 WeakPolarHBondContact O-CB 3.17Å; I67-W86 HydrophobicContact CD1-CH2 4.4Å; I67-W86 HydrophobicContact CG1-CH2 3.7Å; I67-W86 HydrophobicContact CG1-CZ2 4.27Å; I67-E101 HydrophobicContact CD1-CB 3.76Å; I67-E101 HydrophobicContact CD1-CG 4.44Å; I67-L104 HydrophobicContact CG2-CB 4.08Å; I67-L104 HydrophobicContact CG2-CD1 4.06Å; I67-V105 HydrophobicContact CD1-CG2 3.82Å; I67-V105 HydrophobicContact CG1-CG2 3.96Å
68	R	90.3	Very high	88.2	Confident	165 Å²	165	50.8 Å²	50.8	62%	0.623	26%	0.26	S	S	*	.	H	α-helix	trans	-75.5	-37.4	-175.1	-172.4	174.7	178.9	-172.2	-2.6	113.3	M64 Y65 V66 P72	M64-R68 VanDerWaalsContact O-CB 3.29Å; M64-R68 WeakPolarHBondContact O-CB 3.25Å; M64-R68 PolarHBondContact O-N 3.07Å; Y65-R68 PolarHBondContact O-N 3.5Å; V66-R68 PolarHBondContact O-N 3.29Å; R68-P72 WeakPolarHBondContact O-CG 3.35Å
69	F	91.1	Very high	88.6	Confident	43 Å²	43	49.6 Å²	49.6	19%	0.189	25%	0.253	C	S	.	.	H	α-helix	trans	-115.2	-17.8	-167.2	-58.7	-65.9	0	0	0	115.3	L33 E34 Y65	L33-F69 VanDerWaalsContact O-CB 3.25Å; L33-F69 WeakPolarHBondContact O-CB 3.36Å; E34-F69 HydrophobicContact CB-CD2 4.16Å; E34-F69 HydrophobicContact CB-CE1 4.41Å; E34-F69 HydrophobicContact CB-CE2 3.83Å; E34-F69 HydrophobicContact CB-CZ 3.96Å; E34-F69 HydrophobicContact CG-CE1 3.85Å; E34-F69 HydrophobicContact CG-CE2 3.89Å; E34-F69 HydrophobicContact CG-CZ 3.48Å; E34-F69 VanDerWaalsContact CG-CZ 3.48Å; Y65-F69 AromaticContact CD1-CD2 3.82Å; Y65-F69 HydrophobicContact CD1-CD2 3.82Å; Y65-F69 AromaticContact CD1-CE2 3.58Å; Y65-F69 HydrophobicContact CD1-CE2 3.58Å; Y65-F69 AromaticContact CE1-CE2 3.89Å; Y65-F69 HydrophobicContact CE1-CE2 3.89Å; Y65-F69 HydrophobicContact CG-CD2 4.16Å; Y65-F69 HydrophobicContact CG-CE2 4.06Å; Y65-F69 WeakPolarHBondContact O-CB 3.29Å; Y65-F69 WeakPolarHBondContact O-CD2 3.36Å; Y65-F69 PolarHBondContact O-N 3.38Å
70	C	91.7	Very high	88.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-45.3	176.2	-62.7	0	0	0	0	112.2	V66 P72 S73 M78 L82	V66-C70 HydrophobicContact CG1-CB 4.1Å; V66-C70 WeakPolarHBondContact O-CA 3.39Å; V66-C70 VanDerWaalsContact O-CB 3.25Å; V66-C70 WeakPolarHBondContact O-CB 3.44Å; V66-C70 PolarHBondContact O-N 3.16Å; C70-P72 VanDerWaalsContact C-CD 3.41Å; C70-P72 VanDerWaalsContact C-N 3.34Å; C70-S73 WeakPolarHBondContact O-CB 3.44Å; C70-S73 PolarHBondContact O-N 3.26Å; C70-M78 HydrophobicContact CB-SD 4.01Å; C70-L82 HydrophobicContact CB-CD1 4.47Å; C70-L82 HydrophobicContact CB-CD2 3.98Å
71	L	89.9	Confident	89.3	Confident	15 Å²	15	52.5 Å²	52.5	8%	0.079	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-37.1	-176.3	-164.2	63.9	0	0	0	114.8	V66 I67 S73 L82 W86 A108	V66-L71 PolarHBondContact O-N 3.17Å; I67-L71 HydrophobicContact CG2-CD2 3.97Å; I67-L71 WeakPolarHBondContact O-CB 3.17Å; L71-S73 PolarHBondContact O-N 2.81Å; L71-L82 HydrophobicContact CD1-CD1 4.37Å; L71-W86 HydrophobicContact CD1-CZ2 4.05Å; L71-A108 HydrophobicContact CD1-CB 3.73Å; L71-A108 HydrophobicContact CD2-CB 3.56Å; L71-A108 HydrophobicContact CG-CB 3.61Å
72	P	89.1	Confident	89.7	Confident	83 Å²	83	49.7 Å²	49.7	54%	0.539	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-8.8	177.3	-17.5	33.4	0	0	0	114.4	R68 C70	R68-P72 WeakPolarHBondContact O-CG 3.35Å; C70-P72 VanDerWaalsContact C-CD 3.41Å; C70-P72 VanDerWaalsContact C-N 3.34Å
73	S	87.5	Confident	89.9	Confident	26 Å²	26	50.3 Å²	50.3	18%	0.182	24%	0.24	C	C	.	.			trans	-62.2	137.4	-178.1	-174.6	0	0	0	0	111.4	C70 L71 D75 K79	C70-S73 WeakPolarHBondContact O-CB 3.44Å; C70-S73 PolarHBondContact O-N 3.26Å; L71-S73 PolarHBondContact O-N 2.81Å; S73-D75 PolarHBondContact OG-N 3.09Å; S73-K79 WeakPolarHBondContact O-CE 3.34Å
74	Q	85.6	Confident	89.9	Confident	127 Å²	127	52.5 Å²	52.5	59%	0.593	25%	0.253	S	S	*	.			trans	-92.4	-2.6	175.4	-60.2	-61.9	-25.8	0	0	112.7	H76 H115	Q74-H76 PolarHBondContact O-N 3.12Å; Q74-H115 PolarHBondContact OE1-NE2 2.97Å
75	D	88.9	Confident	90	Very high	51 Å²	51	49 Å²	49	27%	0.273	24%	0.236	S	C	.	.			trans	-67.7	130.5	179.4	177.5	71.4	0	0	0	111.5	L38 S73 L77 M78 K79	L38-D75 HydrophobicContact CD1-CB 3.94Å; L38-D75 HydrophobicContact CD2-CB 3.83Å; L38-D75 HydrophobicContact CG-CB 4.45Å; S73-D75 PolarHBondContact OG-N 3.09Å; D75-L77 VanDerWaalsContact C-N 3.35Å; D75-L77 PolarHBondContact O-N 3.32Å; D75-L77 WeakPolarHBondContact OD2-CA 3.36Å; D75-L77 WeakPolarHBondContact OD2-CB 3.44Å; D75-L77 PolarHBondContact OD2-N 3.22Å; D75-M78 HydrophobicContact CB-CB 3.99Å; D75-M78 PolarHBondContact O-N 3.06Å; D75-M78 PolarHBondContact OD2-N 2.75Å; D75-K79 WeakPolarHBondContact O-CG 3.22Å; D75-K79 PolarHBondContact O-N 2.82Å
76	H	86.4	Confident	90	Very high	111 Å²	111	46.5 Å²	46.5	51%	0.514	23%	0.226	S	C	.	.	H	α-helix	trans	-64.5	-37.5	-175.8	-69	179.6	0	0	0	112.7	Q74 K80 N117	Q74-H76 PolarHBondContact O-N 3.12Å; H76-K80 WeakPolarHBondContact O-CB 3.41Å; H76-K80 PolarHBondContact O-N 3.08Å; H76-N117 PolarHBondContact CE1-ND2 3.19Å; H76-N117 PolarHBondContact NE2-ND2 2.91Å
77	L	88.6	Confident	89.8	Confident	84 Å²	84	49.5 Å²	49.5	44%	0.44	24%	0.24	S	C	.	.	H	α-helix	trans	-69.7	-43.3	179.7	177.1	58.3	0	0	0	110.2	I42 D75 K80 L81	I42-L77 HydrophobicContact CD1-CB 4.41Å; I42-L77 HydrophobicContact CD1-CD2 4.05Å; I42-L77 HydrophobicContact CD1-CG 4.25Å; I42-L77 HydrophobicContact CG2-CD2 4.01Å; I42-L77 HydrophobicContact CG2-CG 4.36Å; D75-L77 VanDerWaalsContact C-N 3.35Å; D75-L77 PolarHBondContact O-N 3.32Å; D75-L77 WeakPolarHBondContact OD2-CA 3.36Å; D75-L77 WeakPolarHBondContact OD2-CB 3.44Å; D75-L77 PolarHBondContact OD2-N 3.22Å; L77-K80 PolarHBondContact O-N 2.84Å; L77-L81 HydrophobicContact CD1-CD1 4.25Å; L77-L81 HydrophobicContact CD1-CG 4.32Å; L77-L81 HydrophobicContact CG-CD1 4.19Å; L77-L81 WeakPolarHBondContact O-CG 3.38Å; L77-L81 PolarHBondContact O-N 2.83Å
78	M	90.7	Very high	89.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.7	-49.1	173	-174.2	63.9	79.1	0	0	111.5	L38 K41 I42 L45 C70 D75 K80 L81 L82	L38-M78 HydrophobicContact CD1-CE 4.02Å; K41-M78 HydrophobicContact CB-CE 3.5Å; I42-M78 HydrophobicContact CG1-CE 3.63Å; I42-M78 HydrophobicContact CG1-SD 4.38Å; L45-M78 HydrophobicContact CD2-SD 3.57Å; L45-M78 VanDerWaalsContact CD2-SD 3.57Å; C70-M78 HydrophobicContact CB-SD 4.01Å; D75-M78 HydrophobicContact CB-CB 3.99Å; D75-M78 PolarHBondContact O-N 3.06Å; D75-M78 PolarHBondContact OD2-N 2.75Å; M78-K80 VanDerWaalsContact C-N 3.33Å; M78-K80 PolarHBondContact O-N 2.98Å; M78-L81 PolarHBondContact O-N 2.94Å; M78-L82 HydrophobicContact CG-CD1 4.02Å; M78-L82 HydrophobicContact CG-CG 4.44Å; M78-L82 WeakPolarHBondContact O-CB 3.43Å; M78-L82 VanDerWaalsContact O-CG 3.31Å; M78-L82 WeakPolarHBondContact O-CG 3.35Å; M78-L82 PolarHBondContact O-N 2.84Å
79	K	90.5	Very high	89.5	Confident	18 Å²	18	43.2 Å²	43.2	8%	0.078	22%	0.219	C	C	.	.	H	α-helix	trans	-56.9	-45	177	-76.1	-66	-160.2	176.1	0	112.2	S73 D75 L82 L83 D112	S73-K79 WeakPolarHBondContact O-CE 3.34Å; D75-K79 WeakPolarHBondContact O-CG 3.22Å; D75-K79 PolarHBondContact O-N 2.82Å; K79-L82 WeakPolarHBondContact O-CB 3.33Å; K79-L82 PolarHBondContact O-N 2.92Å; K79-L83 WeakPolarHBondContact O-CG 3.45Å; K79-L83 PolarHBondContact O-N 2.94Å; K79-L83 VanDerWaalsContact O-N 3.09Å; K79-D112 WeakPolarHBondContact CE-OD1 3.46Å; K79-D112 IonicContact NZ-OD1 3.78Å; K79-D112 PolarHBondContact NZ-OD1 3.17Å; K79-D112 IonicContact NZ-OD2 3.22Å; K79-D112 PolarHBondContact NZ-OD2 2.8Å
80	K	89.5	Confident	89.2	Confident	142 Å²	142	45 Å²	45	62%	0.617	24%	0.235	S	C	*	.	H	α-helix	trans	-64.4	-41.9	178.3	-169.1	176.7	-179.4	-178.2	0	112.2	H76 L77 M78 L83 V84	H76-K80 WeakPolarHBondContact O-CB 3.41Å; H76-K80 PolarHBondContact O-N 3.08Å; L77-K80 PolarHBondContact O-N 2.84Å; M78-K80 VanDerWaalsContact C-N 3.33Å; M78-K80 PolarHBondContact O-N 2.98Å; K80-L83 PolarHBondContact O-N 3.17Å; K80-V84 PolarHBondContact O-N 2.79Å
81	L	91	Very high	89	Confident	25 Å²	25	46 Å²	46	13%	0.131	24%	0.239	C	C	.	.	H	α-helix	trans	-66.5	-37.7	176	-72.3	170.3	0	0	0	112	I42 L45 K46 I49 L77 M78 L83 V84 F85	I42-L81 HydrophobicContact CB-CD1 4.49Å; I42-L81 HydrophobicContact CG2-CD1 3.72Å; L45-L81 HydrophobicContact CD2-CB 3.65Å; L45-L81 HydrophobicContact CG-CB 4.32Å; K46-L81 HydrophobicContact CG-CD1 4.01Å; K46-L81 HydrophobicContact CG-CD2 4Å; I49-L81 HydrophobicContact CD1-CB 4.32Å; I49-L81 HydrophobicContact CD1-CD2 4.06Å; L77-L81 HydrophobicContact CD1-CD1 4.25Å; L77-L81 HydrophobicContact CD1-CG 4.32Å; L77-L81 HydrophobicContact CG-CD1 4.19Å; L77-L81 WeakPolarHBondContact O-CG 3.38Å; L77-L81 PolarHBondContact O-N 2.83Å; M78-L81 PolarHBondContact O-N 2.94Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L81-L83 PolarHBondContact O-N 2.91Å; L81-V84 PolarHBondContact O-N 2.85Å; L81-F85 WeakPolarHBondContact O-CB 3.4Å; L81-F85 PolarHBondContact O-N 2.91Å
82	L	93.1	Very high	88.8	Confident	4 Å²	4	48 Å²	48	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-59.9	-43.7	174	-76.7	166.4	0	0	0	111.3	L45 V66 C70 L71 M78 K79 V84 F85 W86	L45-L82 HydrophobicContact CD2-CD2 4Å; L45-L82 HydrophobicContact CD2-CG 3.99Å; V66-L82 HydrophobicContact CG1-CD2 3.78Å; C70-L82 HydrophobicContact CB-CD1 4.47Å; C70-L82 HydrophobicContact CB-CD2 3.98Å; L71-L82 HydrophobicContact CD1-CD1 4.37Å; M78-L82 HydrophobicContact CG-CD1 4.02Å; M78-L82 HydrophobicContact CG-CG 4.44Å; M78-L82 WeakPolarHBondContact O-CB 3.43Å; M78-L82 VanDerWaalsContact O-CG 3.31Å; M78-L82 WeakPolarHBondContact O-CG 3.35Å; M78-L82 PolarHBondContact O-N 2.84Å; K79-L82 WeakPolarHBondContact O-CB 3.33Å; K79-L82 PolarHBondContact O-N 2.92Å; L82-V84 VanDerWaalsContact C-N 3.29Å; L82-V84 PolarHBondContact O-N 2.8Å; L82-F85 WeakPolarHBondContact O-CB 3.49Å; L82-F85 PolarHBondContact O-N 3.45Å; L82-W86 VanDerWaalsContact C-CD1 3.46Å; L82-W86 HydrophobicContact CD2-CZ2 4.17Å; L82-W86 WeakPolarHBondContact O-CB 3.27Å; L82-W86 PolarHBondContact O-N 3.32Å
83	L	91.2	Very high	88.5	Confident	18 Å²	18	46.9 Å²	46.9	9%	0.094	24%	0.243	C	C	.	.	H	α-helix	trans	-60.5	-37.8	176.1	-65.1	175.7	0	0	0	112.6	K79 K80 L81 E87 F127	K79-L83 WeakPolarHBondContact O-CG 3.45Å; K79-L83 PolarHBondContact O-N 2.94Å; K79-L83 VanDerWaalsContact O-N 3.09Å; K80-L83 PolarHBondContact O-N 3.17Å; L81-L83 VanDerWaalsContact C-N 3.34Å; L81-L83 PolarHBondContact O-N 2.91Å; L83-E87 PolarHBondContact O-N 2.98Å; L83-E87 VanDerWaalsContact O-N 3.12Å; L83-F127 HydrophobicContact CB-CB 4.35Å; L83-F127 HydrophobicContact CB-CD2 4.37Å; L83-F127 HydrophobicContact CB-CG 4.41Å; L83-F127 HydrophobicContact CD1-CB 4.4Å; L83-F127 HydrophobicContact CD2-CB 3.91Å; L83-F127 HydrophobicContact CD2-CD1 3.91Å; L83-F127 HydrophobicContact CD2-CD2 4.41Å; L83-F127 HydrophobicContact CD2-CG 3.8Å; L83-F127 HydrophobicContact CG-CB 4.44Å; L83-F127 WeakPolarHBondContact O-CD2 3.46Å; L83-F127 WeakPolarHBondContact O-CE2 3.39Å
84	V	89.9	Confident	88	Confident	48 Å²	48	51 Å²	51	29%	0.291	28%	0.28	S	S	.	.	H	α-helix	trans	-67.7	-44.8	174.3	177	0	0	0	0	110.9	I49 K80 L81 L82 W86 E87 I88	I49-V84 HydrophobicContact CD1-CB 4.34Å; I49-V84 HydrophobicContact CD1-CG1 4.26Å; I49-V84 HydrophobicContact CG2-CG1 4.12Å; K80-V84 PolarHBondContact O-N 2.79Å; L81-V84 PolarHBondContact O-N 2.85Å; L82-V84 VanDerWaalsContact C-N 3.29Å; L82-V84 PolarHBondContact O-N 2.8Å; V84-W86 VanDerWaalsContact C-N 3.32Å; V84-W86 PolarHBondContact O-N 3.4Å; V84-E87 WeakPolarHBondContact O-CB 3.41Å; V84-E87 PolarHBondContact O-N 2.89Å; V84-E87 VanDerWaalsContact O-N 3.14Å; V84-I88 PolarHBondContact O-N 3.48Å
85	F	91.8	Very high	87.8	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.7	-43.6	176.7	-180	-104.3	0	0	0	111.6	L45 L48 I49 L58 L63 V66 L81 L82 E87 I88 V89	L45-F85 HydrophobicContact CD1-CB 4.14Å; L45-F85 HydrophobicContact CD1-CD1 4.36Å; L45-F85 HydrophobicContact CD1-CD2 3.95Å; L45-F85 HydrophobicContact CD1-CE2 4.43Å; L45-F85 HydrophobicContact CD1-CG 3.89Å; L48-F85 HydrophobicContact CB-CE2 4.17Å; I49-F85 HydrophobicContact CD1-CB 4.19Å; I49-F85 HydrophobicContact CG1-CB 3.92Å; I49-F85 HydrophobicContact CG1-CD2 3.96Å; I49-F85 HydrophobicContact CG1-CG 4.45Å; L58-F85 HydrophobicContact CD1-CE2 4.38Å; L58-F85 HydrophobicContact CD1-CZ 4.23Å; L58-F85 HydrophobicContact CD2-CE1 4.45Å; L58-F85 HydrophobicContact CD2-CE2 4.31Å; L58-F85 HydrophobicContact CD2-CZ 3.6Å; L63-F85 HydrophobicContact CD1-CE1 4.32Å; V66-F85 HydrophobicContact CB-CE1 4.27Å; V66-F85 HydrophobicContact CG1-CD1 4.11Å; V66-F85 HydrophobicContact CG1-CE1 3.77Å; V66-F85 HydrophobicContact CG1-CZ 4.42Å; V66-F85 HydrophobicContact CG2-CE1 4.33Å; V66-F85 HydrophobicContact CG2-CZ 4.19Å; L81-F85 WeakPolarHBondContact O-CB 3.4Å; L81-F85 PolarHBondContact O-N 2.91Å; L82-F85 WeakPolarHBondContact O-CB 3.49Å; L82-F85 PolarHBondContact O-N 3.45Å; F85-E87 PolarHBondContact O-N 2.9Å; F85-I88 WeakPolarHBondContact O-CG1 3.41Å; F85-I88 PolarHBondContact O-N 3.25Å; F85-V89 HydrophobicContact CD1-CG2 4.04Å; F85-V89 HydrophobicContact CD2-CG2 4.05Å; F85-V89 HydrophobicContact CE1-CG2 3.72Å; F85-V89 HydrophobicContact CE2-CG2 3.73Å; F85-V89 HydrophobicContact CG-CG2 4.21Å; F85-V89 HydrophobicContact CZ-CG2 3.57Å; F85-V89 WeakPolarHBondContact O-CG2 3.27Å; F85-V89 PolarHBondContact O-N 3.02Å; F85-V89 VanDerWaalsContact O-N 3.08Å
86	W	91	Very high	87.3	Confident	3 Å²	3	51.8 Å²	51.8	1%	0.011	30%	0.3	C	S	.	.	H	α-helix	trans	-69.3	-21.7	177.4	-63.1	134	0	0	0	113.5	L63 V66 I67 L71 L82 V84 K91 M102 V105 Y109 F127	L63-W86 HydrophobicContact CD1-CH2 3.9Å; L63-W86 HydrophobicContact CD1-CZ3 3.55Å; V66-W86 HydrophobicContact CG1-CH2 4.24Å; V66-W86 HydrophobicContact CG1-CZ2 4.25Å; I67-W86 HydrophobicContact CD1-CH2 4.4Å; I67-W86 HydrophobicContact CG1-CH2 3.7Å; I67-W86 HydrophobicContact CG1-CZ2 4.27Å; L71-W86 HydrophobicContact CD1-CZ2 4.05Å; L82-W86 VanDerWaalsContact C-CD1 3.46Å; L82-W86 HydrophobicContact CD2-CZ2 4.17Å; L82-W86 WeakPolarHBondContact O-CB 3.27Å; L82-W86 PolarHBondContact O-N 3.32Å; V84-W86 VanDerWaalsContact C-N 3.32Å; V84-W86 PolarHBondContact O-N 3.4Å; W86-K91 WeakPolarHBondContact O-CE 3.23Å; W86-K91 PolarHBondContact O-NZ 3.32Å; W86-M102 HydrophobicContact CZ3-CE 4.25Å; W86-V105 HydrophobicContact CD2-CG1 3.8Å; W86-V105 HydrophobicContact CE3-CG1 4.18Å; W86-V105 HydrophobicContact CE3-CG2 4.4Å; W86-V105 HydrophobicContact CG-CG1 4.19Å; W86-V105 HydrophobicContact CH2-CG2 3.79Å; W86-V105 HydrophobicContact CZ2-CG1 4.15Å; W86-V105 HydrophobicContact CZ2-CG2 3.99Å; W86-V105 HydrophobicContact CZ3-CG2 4Å; W86-Y109 WeakPolarHBondContact CB-OH 3.47Å; W86-Y109 AromaticContact CD1-CE1 3.79Å; W86-Y109 HydrophobicContact CG-CE1 4.24Å; W86-Y109 VanDerWaalsContact CG-OH 3.31Å; W86-F127 HydrophobicContact CB-CE2 3.83Å; W86-F127 HydrophobicContact CB-CZ 3.75Å
87	E	88.1	Confident	87.3	Confident	63 Å²	63	53.8 Å²	53.8	29%	0.294	31%	0.307	S	S	.	.	H	α-helix	trans	-70.3	-41.9	174.7	-171.8	174	157	0	0	111.1	L83 V84 F85 K91 F127 R130	L83-E87 PolarHBondContact O-N 2.98Å; L83-E87 VanDerWaalsContact O-N 3.12Å; V84-E87 WeakPolarHBondContact O-CB 3.41Å; V84-E87 PolarHBondContact O-N 2.89Å; V84-E87 VanDerWaalsContact O-N 3.14Å; F85-E87 PolarHBondContact O-N 2.9Å; E87-K91 PolarHBondContact O-NZ 3.35Å; E87-F127 HydrophobicContact CB-CD2 4.44Å; E87-F127 HydrophobicContact CB-CE2 4.18Å; E87-R130 HydrophobicContact CG-CB 4.48Å; E87-R130 WeakPolarHBondContact OE1-CD 3.28Å; E87-R130 IonicContact OE1-CZ 3.42Å; E87-R130 IonicContact OE1-NE 2.69Å; E87-R130 IonicContact OE1-NH1 3.4Å; E87-R130 VanDerWaalsContact OE2-CD 3.29Å; E87-R130 WeakPolarHBondContact OE2-CD 3.2Å; E87-R130 IonicContact OE2-CZ 2.78Å; E87-R130 IonicContact OE2-NE 3.84Å; E87-R130 IonicContact OE2-NH1 2.68Å; E87-R130 PolarHBondContact OE2-NH1 3.2Å
88	I	86.3	Confident	87.2	Confident	43 Å²	43	51.7 Å²	51.7	22%	0.221	30%	0.296	C	S	.	.	H	α-helix	trans	-87.5	-26.7	-173.6	62.8	176.7	0	0	0	114.3	I49 V52 L53 V84 F85	I49-I88 HydrophobicContact CB-CD1 4.19Å; I49-I88 HydrophobicContact CG1-CD1 4.27Å; I49-I88 HydrophobicContact CG2-CD1 3.95Å; V52-I88 HydrophobicContact CB-CD1 3.89Å; V52-I88 HydrophobicContact CB-CG1 4.46Å; V52-I88 HydrophobicContact CG1-CB 4.25Å; V52-I88 HydrophobicContact CG1-CD1 3.9Å; V52-I88 HydrophobicContact CG1-CG1 3.95Å; L53-I88 HydrophobicContact CD2-CB 4.48Å; L53-I88 HydrophobicContact CD2-CG2 3.69Å; L53-I88 HydrophobicContact CG-CD1 4.12Å; L53-I88 HydrophobicContact CG-CG2 4.26Å; V84-I88 PolarHBondContact O-N 3.48Å; F85-I88 WeakPolarHBondContact O-CG1 3.41Å; F85-I88 PolarHBondContact O-N 3.25Å
89	V	87.8	Confident	87	Confident	4 Å²	4	52.9 Å²	52.9	2%	0.024	30%	0.302	C	S	.	.	S	Bend	trans	-69.7	133.4	-177.9	167.4	0	0	0	0	110.3	L58 L63 F85 K91	L58-V89 HydrophobicContact CD2-CG1 4.33Å; L58-V89 HydrophobicContact CD2-CG2 4.01Å; L63-V89 HydrophobicContact CD1-CG1 4.35Å; F85-V89 HydrophobicContact CD1-CG2 4.04Å; F85-V89 HydrophobicContact CD2-CG2 4.05Å; F85-V89 HydrophobicContact CE1-CG2 3.72Å; F85-V89 HydrophobicContact CE2-CG2 3.73Å; F85-V89 HydrophobicContact CG-CG2 4.21Å; F85-V89 HydrophobicContact CZ-CG2 3.57Å; F85-V89 WeakPolarHBondContact O-CG2 3.27Å; F85-V89 PolarHBondContact O-N 3.02Å; F85-V89 VanDerWaalsContact O-N 3.08Å; V89-K91 VanDerWaalsContact O-CD 3.23Å; V89-K91 WeakPolarHBondContact O-CD 3.47Å; V89-K91 WeakPolarHBondContact O-CE 3.47Å; V89-K91 PolarHBondContact O-NZ 2.97Å
90	P	84.5	Confident	86.7	Confident	81 Å²	81	59.7 Å²	59.7	53%	0.526	33%	0.334	S	S	.	.			trans	-59.5	135.7	171.6	-23.1	33.4	0	0	0	111.6
91	K	88.3	Confident	86.6	Confident	19 Å²	19	55 Å²	55	8%	0.083	31%	0.314	C	S	.	.			trans	-96.5	-17.2	-178.8	-70.4	85	-167.5	172.9	0	112.1	W86 E87 V89 L98 M99 M102 L131 E133 L136	W86-K91 WeakPolarHBondContact O-CE 3.23Å; W86-K91 PolarHBondContact O-NZ 3.32Å; E87-K91 PolarHBondContact O-NZ 3.35Å; V89-K91 VanDerWaalsContact O-CD 3.23Å; V89-K91 WeakPolarHBondContact O-CD 3.47Å; V89-K91 WeakPolarHBondContact O-CE 3.47Å; V89-K91 PolarHBondContact O-NZ 2.97Å; K91-L98 HydrophobicContact CB-CD1 4.24Å; K91-M99 PolarHBondContact O-N 3.49Å; K91-M102 HydrophobicContact CB-CG 4.26Å; K91-M102 HydrophobicContact CB-SD 4.44Å; K91-M102 HydrophobicContact CG-CG 4.4Å; K91-M102 HydrophobicContact CG-SD 3.99Å; K91-L131 HydrophobicContact CD-CD1 4.49Å; K91-E133 HydrophobicContact CB-CG 3.88Å; K91-E133 HydrophobicContact CG-CG 4.45Å; K91-L136 HydrophobicContact CB-CD1 4.46Å; K91-L136 HydrophobicContact CG-CD1 4.09Å
92	T	84.2	Confident	86.5	Confident	59 Å²	59	53.8 Å²	53.8	36%	0.362	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-109.2	148.3	178.9	54	0	0	0	0	110.4	G96 K97	T92-G96 WeakPolarHBondContact CG2-O 3.34Å; T92-K97 CarbonylContact C-O 3.52Å; T92-K97 VanDerWaalsContact CA-O 3.26Å; T92-K97 WeakPolarHBondContact CA-O 3.44Å
93	T	82.8	Confident	86.2	Confident	58 Å²	58	58.9 Å²	58.9	36%	0.356	33%	0.334	S	S	.	.			trans	-67.5	168.2	166.6	54.9	0	0	0	0	110.4	D95 G96 K97 M99	T93-D95 PolarHBondContact O-N 3.02Å; T93-G96 PolarHBondContact O-N 3.34Å; T93-K97 PolarHBondContact N-O 3.22Å; T93-K97 PolarHBondContact OG1-N 2.97Å; T93-K97 PolarHBondContact OG1-O 3.49Å; T93-M99 HydrophobicContact CG2-CG 3.82Å
94	A	78.4	Confident	86.1	Confident	114 Å²	114	62.4 Å²	62.4	94%	0.942	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-24.9	176.6	0	0	0	0	0	113.3	G96	A94-G96 VanDerWaalsContact C-N 3.27Å; A94-G96 PolarHBondContact O-N 2.92Å
95	D	81.3	Confident	86.1	Confident	142 Å²	142	60.1 Å²	60.1	76%	0.759	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	4.4	176.8	-55.1	-32.3	0	0	0	113.5	T93 K97	T93-D95 PolarHBondContact O-N 3.02Å; D95-K97 VanDerWaalsContact C-N 3.3Å; D95-K97 PolarHBondContact O-N 3.27Å
96	G	78.7	Confident	86.1	Confident	52 Å²	52	60.7 Å²	60.7	54%	0.536	34%	0.342	S	S	.	.	S	Bend	trans	80.1	-1.1	-179.1	0	0	0	0	0	115.4	T92 T93 A94	T92-G96 WeakPolarHBondContact CG2-O 3.34Å; T93-G96 PolarHBondContact O-N 3.34Å; A94-G96 VanDerWaalsContact C-N 3.27Å; A94-G96 PolarHBondContact O-N 2.92Å
97	K	85.6	Confident	86.1	Confident	153 Å²	153	62.9 Å²	62.9	67%	0.665	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-81.2	140.8	177.8	-65.7	-178	-180	174.8	0	111.8	T92 T93 D95 M99	T92-K97 CarbonylContact C-O 3.52Å; T92-K97 VanDerWaalsContact CA-O 3.26Å; T92-K97 WeakPolarHBondContact CA-O 3.44Å; T93-K97 PolarHBondContact N-O 3.22Å; T93-K97 PolarHBondContact OG1-N 2.97Å; T93-K97 PolarHBondContact OG1-O 3.49Å; D95-K97 VanDerWaalsContact C-N 3.3Å; D95-K97 PolarHBondContact O-N 3.27Å; K97-M99 PolarHBondContact O-N 3.01Å
98	L	86.5	Confident	86.2	Confident	40 Å²	40	60.3 Å²	60.3	21%	0.209	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-57.3	132.1	175.1	-170.8	75	0	0	0	111.2	K91 M102 E133 E135 L136	K91-L98 HydrophobicContact CB-CD1 4.24Å; L98-M102 HydrophobicContact CD1-CB 4.22Å; L98-M102 HydrophobicContact CD1-CG 4.4Å; L98-M102 HydrophobicContact CG-CB 4.33Å; L98-E133 HydrophobicContact CD1-CG 4.48Å; L98-E135 WeakPolarHBondContact CB-OE2 3.46Å; L98-E135 HydrophobicContact CD2-CB 4.16Å; L98-E135 WeakPolarHBondContact CD2-OE2 3.28Å; L98-L136 HydrophobicContact CD1-CD1 4.07Å; L98-L136 HydrophobicContact CD1-CD2 4.13Å; L98-L136 HydrophobicContact CD1-CG 3.95Å; L98-L136 HydrophobicContact CD2-CD2 3.86Å; L98-L136 HydrophobicContact CD2-CG 4.31Å
99	M	86.8	Confident	86.5	Confident	24 Å²	24	58.4 Å²	58.4	12%	0.118	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-66.9	135	176.5	-66.9	-179.8	71.8	0	0	110.5	L63 K91 T93 K97 E101 M102	L63-M99 HydrophobicContact CD2-CE 3.44Å; L63-M99 VanDerWaalsContact CD2-CE 3.44Å; L63-M99 HydrophobicContact CD2-SD 4.34Å; K91-M99 PolarHBondContact O-N 3.49Å; T93-M99 HydrophobicContact CG2-CG 3.82Å; K97-M99 PolarHBondContact O-N 3.01Å; M99-E101 PolarHBondContact O-N 2.68Å; M99-M102 HydrophobicContact CB-CG 3.97Å; M99-M102 WeakPolarHBondContact O-CB 3.08Å; M99-M102 PolarHBondContact O-N 2.94Å
100	Q	85.4	Confident	86.8	Confident	162 Å²	162	63.5 Å²	63.5	76%	0.757	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-31	-179.7	-67.4	-166.4	-6	0	0	112	M102 I103	Q100-M102 PolarHBondContact O-N 3.48Å; Q100-I103 WeakPolarHBondContact O-CB 3.49Å; Q100-I103 WeakPolarHBondContact O-CG1 3.43Å; Q100-I103 PolarHBondContact O-N 2.95Å; Q100-I103 VanDerWaalsContact O-N 3.1Å
101	E	86.9	Confident	87.2	Confident	42 Å²	42	65.4 Å²	65.4	20%	0.196	35%	0.353	C	S	.	.	H	α-helix	trans	-58	-30.9	174.5	-64.2	86.2	169.1	0	0	112.2	L63 M64 I67 M99 I103 L104 V105	L63-E101 HydrophobicContact CD2-CB 4.13Å; L63-E101 HydrophobicContact CD2-CG 4.33Å; M64-E101 HydrophobicContact CE-CG 3.71Å; I67-E101 HydrophobicContact CD1-CB 3.76Å; I67-E101 HydrophobicContact CD1-CG 4.44Å; M99-E101 PolarHBondContact O-N 2.68Å; E101-I103 PolarHBondContact O-N 3.29Å; E101-L104 WeakPolarHBondContact O-CB 3.31Å; E101-L104 PolarHBondContact O-N 3.42Å; E101-L104 VanDerWaalsContact O-N 3.16Å; E101-V105 PolarHBondContact O-N 2.96Å
102	M	89.4	Confident	87.4	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-68	-20.3	179.4	-63.3	-62.5	110.8	0	0	112.7	L63 W86 K91 L98 M99 Q100 L104 V105 C106 L136	L63-M102 HydrophobicContact CD1-CE 4.21Å; L63-M102 HydrophobicContact CD2-CE 3.98Å; W86-M102 HydrophobicContact CZ3-CE 4.25Å; K91-M102 HydrophobicContact CB-CG 4.26Å; K91-M102 HydrophobicContact CB-SD 4.44Å; K91-M102 HydrophobicContact CG-CG 4.4Å; K91-M102 HydrophobicContact CG-SD 3.99Å; L98-M102 HydrophobicContact CD1-CB 4.22Å; L98-M102 HydrophobicContact CD1-CG 4.4Å; L98-M102 HydrophobicContact CG-CB 4.33Å; M99-M102 HydrophobicContact CB-CG 3.97Å; M99-M102 WeakPolarHBondContact O-CB 3.08Å; M99-M102 PolarHBondContact O-N 2.94Å; Q100-M102 PolarHBondContact O-N 3.48Å; M102-L104 VanDerWaalsContact C-N 3.32Å; M102-V105 HydrophobicContact CE-CG2 4.17Å; M102-V105 PolarHBondContact O-N 3.03Å; M102-V105 HydrophobicContact SD-CG2 4.43Å; M102-C106 WeakPolarHBondContact O-CB 3.45Å; M102-C106 PolarHBondContact O-N 3.31Å; M102-L136 HydrophobicContact CB-CD1 4.32Å; M102-L136 HydrophobicContact CB-CD2 3.87Å
103	I	86.4	Confident	87.9	Confident	110 Å²	110	62.3 Å²	62.3	56%	0.564	34%	0.335	S	S	*	.	H	α-helix	trans	-64.2	-41.2	173.7	-58.5	172.7	0	0	0	110.2	Q100 E101 V105 C106 D107	Q100-I103 WeakPolarHBondContact O-CB 3.49Å; Q100-I103 WeakPolarHBondContact O-CG1 3.43Å; Q100-I103 PolarHBondContact O-N 2.95Å; Q100-I103 VanDerWaalsContact O-N 3.1Å; E101-I103 PolarHBondContact O-N 3.29Å; I103-V105 VanDerWaalsContact C-N 3.32Å; I103-C106 WeakPolarHBondContact O-CB 3.35Å; I103-C106 PolarHBondContact O-N 3.07Å; I103-D107 PolarHBondContact O-N 3.44Å; I103-D107 VanDerWaalsContact O-N 3.09Å
104	L	87.4	Confident	88.5	Confident	92 Å²	92	64.5 Å²	64.5	48%	0.482	34%	0.342	S	S	.	.	H	α-helix	trans	-66.1	-38.6	176.7	-60.6	173.7	0	0	0	111.2	I67 E101 M102 D107 A108	I67-L104 HydrophobicContact CG2-CB 4.08Å; I67-L104 HydrophobicContact CG2-CD1 4.06Å; E101-L104 WeakPolarHBondContact O-CB 3.31Å; E101-L104 PolarHBondContact O-N 3.42Å; E101-L104 VanDerWaalsContact O-N 3.16Å; M102-L104 VanDerWaalsContact C-N 3.32Å; L104-D107 PolarHBondContact O-N 3.33Å; L104-A108 PolarHBondContact O-N 3.18Å
105	V	90.9	Very high	89.1	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-67.6	-39.3	176.7	-172.5	0	0	0	0	110.6	I67 W86 E101 M102 I103 D107 A108 Y109	I67-V105 HydrophobicContact CD1-CG2 3.82Å; I67-V105 HydrophobicContact CG1-CG2 3.96Å; W86-V105 HydrophobicContact CD2-CG1 3.8Å; W86-V105 HydrophobicContact CE3-CG1 4.18Å; W86-V105 HydrophobicContact CE3-CG2 4.4Å; W86-V105 HydrophobicContact CG-CG1 4.19Å; W86-V105 HydrophobicContact CH2-CG2 3.79Å; W86-V105 HydrophobicContact CZ2-CG1 4.15Å; W86-V105 HydrophobicContact CZ2-CG2 3.99Å; W86-V105 HydrophobicContact CZ3-CG2 4Å; E101-V105 PolarHBondContact O-N 2.96Å; M102-V105 HydrophobicContact CE-CG2 4.17Å; M102-V105 PolarHBondContact O-N 3.03Å; M102-V105 HydrophobicContact SD-CG2 4.43Å; I103-V105 VanDerWaalsContact C-N 3.32Å; V105-D107 PolarHBondContact O-N 3.35Å; V105-A108 WeakPolarHBondContact O-CA 3.47Å; V105-A108 WeakPolarHBondContact O-CB 3.33Å; V105-A108 PolarHBondContact O-N 3.22Å; V105-A108 VanDerWaalsContact O-N 3.1Å; V105-Y109 HydrophobicContact CG1-CD1 4.38Å; V105-Y109 HydrophobicContact CG1-CE1 3.59Å; V105-Y109 HydrophobicContact CG1-CE2 3.82Å; V105-Y109 WeakPolarHBondContact CG1-OH 3.42Å; V105-Y109 PolarHBondContact O-N 3.44Å
106	C	91.3	Very high	89.5	Confident	12 Å²	12	58.7 Å²	58.7	8%	0.081	30%	0.299	C	S	.	.	H	α-helix	trans	-59.8	-43.9	174.4	-172.3	0	0	0	0	112.2	M102 I103 A108 Y109 R110 L136	M102-C106 WeakPolarHBondContact O-CB 3.45Å; M102-C106 PolarHBondContact O-N 3.31Å; I103-C106 WeakPolarHBondContact O-CB 3.35Å; I103-C106 PolarHBondContact O-N 3.07Å; C106-A108 VanDerWaalsContact C-N 3.27Å; C106-A108 PolarHBondContact O-N 3.27Å; C106-Y109 WeakPolarHBondContact O-CB 3.25Å; C106-Y109 PolarHBondContact O-N 3.34Å; C106-R110 PolarHBondContact O-N 3.1Å; C106-L136 HydrophobicContact CB-CD2 4.03Å; C106-L136 PolarHBondContact SG-O 3.42Å
107	D	90.7	Very high	90.1	Very high	49 Å²	49	57.5 Å²	57.5	26%	0.262	28%	0.28	S	S	.	.	H	α-helix	trans	-61.9	-35.5	174.2	-177.4	61.6	0	0	0	112.4	I103 L104 V105 R110 K111	I103-D107 PolarHBondContact O-N 3.44Å; I103-D107 VanDerWaalsContact O-N 3.09Å; L104-D107 PolarHBondContact O-N 3.33Å; V105-D107 PolarHBondContact O-N 3.35Å; D107-R110 WeakPolarHBondContact O-CB 3.29Å; D107-R110 PolarHBondContact O-N 2.69Å; D107-R110 IonicContact OD1-CZ 2.71Å; D107-R110 IonicContact OD1-NE 2.79Å; D107-R110 PolarHBondContact OD1-NE 3.39Å; D107-R110 IonicContact OD1-NH2 2.7Å; D107-R110 PolarHBondContact OD1-NH2 3.05Å; D107-K111 WeakPolarHBondContact O-CG 3.12Å; D107-K111 PolarHBondContact O-N 3.06Å; D107-K111 VanDerWaalsContact OD2-CE 3.25Å; D107-K111 WeakPolarHBondContact OD2-CE 3.47Å; D107-K111 IonicContact OD2-NZ 2.77Å; D107-K111 PolarHBondContact OD2-NZ 2.84Å
108	A	91	Very high	90.4	Very high	10 Å²	10	52.4 Å²	52.4	8%	0.083	26%	0.258	C	S	.	.	H	α-helix	trans	-67.5	-40.9	174.2	0	0	0	0	0	112.4	L71 L104 V105 C106 R110 K111 D112	L71-A108 HydrophobicContact CD1-CB 3.73Å; L71-A108 HydrophobicContact CD2-CB 3.56Å; L71-A108 HydrophobicContact CG-CB 3.61Å; L104-A108 PolarHBondContact O-N 3.18Å; V105-A108 WeakPolarHBondContact O-CA 3.47Å; V105-A108 WeakPolarHBondContact O-CB 3.33Å; V105-A108 PolarHBondContact O-N 3.22Å; V105-A108 VanDerWaalsContact O-N 3.1Å; C106-A108 VanDerWaalsContact C-N 3.27Å; C106-A108 PolarHBondContact O-N 3.27Å; A108-R110 VanDerWaalsContact C-N 3.29Å; A108-R110 PolarHBondContact O-N 3.47Å; A108-K111 PolarHBondContact O-N 3.08Å; A108-D112 PolarHBondContact O-N 2.69Å
109	Y	93	Very high	90.6	Very high	3 Å²	3	56.1 Å²	56.1	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-58.8	-43.5	172.6	-58.8	-29.8	0	0	0	111.5	W86 V105 C106 K111 D112 L113 F127 L140	W86-Y109 WeakPolarHBondContact CB-OH 3.47Å; W86-Y109 AromaticContact CD1-CE1 3.79Å; W86-Y109 HydrophobicContact CG-CE1 4.24Å; W86-Y109 VanDerWaalsContact CG-OH 3.31Å; V105-Y109 HydrophobicContact CG1-CD1 4.38Å; V105-Y109 HydrophobicContact CG1-CE1 3.59Å; V105-Y109 HydrophobicContact CG1-CE2 3.82Å; V105-Y109 WeakPolarHBondContact CG1-OH 3.42Å; V105-Y109 PolarHBondContact O-N 3.44Å; C106-Y109 WeakPolarHBondContact O-CB 3.25Å; C106-Y109 PolarHBondContact O-N 3.34Å; Y109-K111 VanDerWaalsContact C-N 3.33Å; Y109-K111 PolarHBondContact O-N 3.31Å; Y109-D112 PolarHBondContact O-N 3.17Å; Y109-D112 VanDerWaalsContact O-N 3.16Å; Y109-L113 WeakPolarHBondContact O-CG 3.38Å; Y109-L113 PolarHBondContact O-N 3.08Å; Y109-F127 HydrophobicContact CD1-CE1 4.27Å; Y109-F127 HydrophobicContact CD2-CE1 4.38Å; Y109-F127 HydrophobicContact CE1-CD1 4.37Å; Y109-F127 AromaticContact CE1-CE1 3.66Å; Y109-F127 HydrophobicContact CE1-CE1 3.66Å; Y109-F127 HydrophobicContact CE1-CZ 4.19Å; Y109-F127 AromaticContact CE2-CE1 3.79Å; Y109-F127 HydrophobicContact CE2-CE1 3.79Å; Y109-F127 HydrophobicContact CE2-CZ 4.3Å; Y109-F127 AromaticContact CZ-CE1 3.37Å; Y109-F127 AromaticContact CZ-CZ 3.68Å; Y109-F127 VanDerWaalsContact OH-CZ 3.32Å; Y109-F127 WeakPolarHBondContact OH-CZ 3.38Å; Y109-L140 HydrophobicContact CD2-CD1 4.12Å; Y109-L140 HydrophobicContact CG-CD1 4.49Å
110	R	94.2	Very high	90.9	Very high	111 Å²	111	55.6 Å²	55.6	42%	0.419	27%	0.271	S	S	.	.	H	α-helix	trans	-58.2	-45.7	176.6	-171.3	177.8	64.3	164.5	0.3	111.6	C106 D107 A108 D112 L113 Q114 L140	C106-R110 PolarHBondContact O-N 3.1Å; D107-R110 WeakPolarHBondContact O-CB 3.29Å; D107-R110 PolarHBondContact O-N 2.69Å; D107-R110 IonicContact OD1-CZ 2.71Å; D107-R110 IonicContact OD1-NE 2.79Å; D107-R110 PolarHBondContact OD1-NE 3.39Å; D107-R110 IonicContact OD1-NH2 2.7Å; D107-R110 PolarHBondContact OD1-NH2 3.05Å; A108-R110 VanDerWaalsContact C-N 3.29Å; A108-R110 PolarHBondContact O-N 3.47Å; R110-D112 VanDerWaalsContact C-N 3.34Å; R110-L113 PolarHBondContact O-N 3.32Å; R110-Q114 WeakPolarHBondContact O-CG 3.5Å; R110-Q114 PolarHBondContact O-N 3.47Å; R110-L140 HydrophobicContact CB-CD2 3.68Å; R110-L140 HydrophobicContact CG-CD2 4.44Å
111	K	92.3	Very high	91.3	Very high	121 Å²	121	49.2 Å²	49.2	53%	0.526	24%	0.24	S	C	.	.	H	α-helix	trans	-62.3	-40.6	175.5	-74.8	167	175.5	156.9	0	112	D107 A108 Y109 Q114 H115	D107-K111 WeakPolarHBondContact O-CG 3.12Å; D107-K111 PolarHBondContact O-N 3.06Å; D107-K111 VanDerWaalsContact OD2-CE 3.25Å; D107-K111 WeakPolarHBondContact OD2-CE 3.47Å; D107-K111 IonicContact OD2-NZ 2.77Å; D107-K111 PolarHBondContact OD2-NZ 2.84Å; A108-K111 PolarHBondContact O-N 3.08Å; Y109-K111 VanDerWaalsContact C-N 3.33Å; Y109-K111 PolarHBondContact O-N 3.31Å; K111-Q114 CarbonylContact O-C 3.48Å; K111-Q114 PolarHBondContact O-N 2.99Å; K111-Q114 VanDerWaalsContact O-N 3.13Å; K111-H115 PolarHBondContact O-N 2.76Å
112	D	92.9	Very high	91.6	Very high	12 Å²	12	47.2 Å²	47.2	6%	0.064	23%	0.231	C	C	.	.	H	α-helix	trans	-69.8	-34.3	179.8	-73	-7.9	0	0	0	112.4	K79 A108 Y109 R110 Q114 H115 V120 T124	K79-D112 WeakPolarHBondContact CE-OD1 3.46Å; K79-D112 IonicContact NZ-OD1 3.78Å; K79-D112 PolarHBondContact NZ-OD1 3.17Å; K79-D112 IonicContact NZ-OD2 3.22Å; K79-D112 PolarHBondContact NZ-OD2 2.8Å; A108-D112 PolarHBondContact O-N 2.69Å; Y109-D112 PolarHBondContact O-N 3.17Å; Y109-D112 VanDerWaalsContact O-N 3.16Å; R110-D112 VanDerWaalsContact C-N 3.34Å; D112-Q114 VanDerWaalsContact C-N 3.25Å; D112-Q114 PolarHBondContact O-N 2.9Å; D112-H115 WeakPolarHBondContact O-CB 3.16Å; D112-H115 PolarHBondContact O-N 2.84Å; D112-V120 HydrophobicContact CB-CG1 3.94Å; D112-T124 HydrophobicContact CB-CG2 4.23Å
113	L	94.8	Very high	91.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-27	169.9	-69.8	175.2	0	0	0	112.9	Y109 R110 R121 T124 L125 L128 L140 I144 C147	Y109-L113 WeakPolarHBondContact O-CG 3.38Å; Y109-L113 PolarHBondContact O-N 3.08Å; R110-L113 PolarHBondContact O-N 3.32Å; L113-R121 VanDerWaalsContact O-CD 3.24Å; L113-R121 WeakPolarHBondContact O-CD 3.43Å; L113-R121 WeakPolarHBondContact O-CG 3.34Å; L113-R121 VanDerWaalsContact O-CZ 3.24Å; L113-R121 PolarHBondContact O-NE 3.31Å; L113-R121 PolarHBondContact O-NH1 2.96Å; L113-T124 HydrophobicContact CD2-CG2 3.95Å; L113-T124 HydrophobicContact CG-CG2 4.07Å; L113-L125 HydrophobicContact CD2-CD2 3.6Å; L113-L125 HydrophobicContact CD2-CG 3.69Å; L113-L128 HydrophobicContact CD1-CD1 3.96Å; L113-L128 HydrophobicContact CD2-CD1 4.05Å; L113-L128 HydrophobicContact CG-CD1 4.44Å; L113-L140 HydrophobicContact CD1-CB 4.08Å; L113-L140 HydrophobicContact CD1-CD2 4.39Å; L113-I144 HydrophobicContact CD1-CG1 3.91Å; L113-C147 PolarHBondContact O-SG 2.89Å
114	Q	94.2	Very high	92.1	Very high	105 Å²	105	44 Å²	44	49%	0.491	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-1	176.9	-65.1	176	2.8	0	0	112.9	R110 K111 D112 R121 S143	R110-Q114 WeakPolarHBondContact O-CG 3.5Å; R110-Q114 PolarHBondContact O-N 3.47Å; K111-Q114 CarbonylContact O-C 3.48Å; K111-Q114 PolarHBondContact O-N 2.99Å; K111-Q114 VanDerWaalsContact O-N 3.13Å; D112-Q114 VanDerWaalsContact C-N 3.25Å; D112-Q114 PolarHBondContact O-N 2.9Å; Q114-R121 PolarHBondContact O-NH2 3Å; Q114-S143 PolarHBondContact NE2-OG 2.76Å
115	H	91.8	Very high	92.5	Very high	36 Å²	36	39.6 Å²	39.6	17%	0.167	20%	0.195	C	C	.	.			trans	-63.5	142.9	-174.2	-169.5	-87.8	0	0	0	112.3	Q74 K111 D112 N117 V120 R121	Q74-H115 PolarHBondContact OE1-NE2 2.97Å; K111-H115 PolarHBondContact O-N 2.76Å; D112-H115 WeakPolarHBondContact O-CB 3.16Å; D112-H115 PolarHBondContact O-N 2.84Å; H115-N117 VanDerWaalsContact C-N 3.26Å; H115-N117 VanDerWaalsContact CE1-CB 3.47Å; H115-N117 WeakPolarHBondContact CE1-CB 3.21Å; H115-N117 VanDerWaalsContact ND1-CB 3.26Å; H115-N117 WeakPolarHBondContact ND1-CB 3.15Å; H115-N117 PolarHBondContact ND1-N 3.01Å; H115-N117 PolarHBondContact O-N 2.89Å; H115-V120 HydrophobicContact CB-CB 4.34Å; H115-V120 HydrophobicContact CB-CG1 4.04Å; H115-R121 WeakPolarHBondContact O-CG 2.9Å; H115-R121 PolarHBondContact O-NE 2.84Å; H115-R121 PolarHBondContact O-NH2 3.11Å
116	P	89.1	Confident	92.5	Very high	98 Å²	98	46.5 Å²	46.5	64%	0.636	22%	0.221	S	C	*	.	S	Bend	trans	-62.6	-29.5	-178.8	22.4	-34.4	0	0	0	114.3	Y150	P116-Y150 PolarHBondContact O-OH 2.76Å; P116-Y150 VanDerWaalsContact O-OH 3.06Å
117	N	90.9	Very high	92.6	Very high	26 Å²	26	46.3 Å²	46.3	14%	0.139	22%	0.219	C	C	.	.			trans	-78	120.9	177.7	-175.2	-19.5	0	0	0	112.4	H76 H115 F119 V120 R121	H76-N117 PolarHBondContact CE1-ND2 3.19Å; H76-N117 PolarHBondContact NE2-ND2 2.91Å; H115-N117 VanDerWaalsContact C-N 3.26Å; H115-N117 VanDerWaalsContact CE1-CB 3.47Å; H115-N117 WeakPolarHBondContact CE1-CB 3.21Å; H115-N117 VanDerWaalsContact ND1-CB 3.26Å; H115-N117 WeakPolarHBondContact ND1-CB 3.15Å; H115-N117 PolarHBondContact ND1-N 3.01Å; H115-N117 PolarHBondContact O-N 2.89Å; N117-F119 VanDerWaalsContact C-N 3.31Å; N117-F119 PolarHBondContact O-N 2.68Å; N117-F119 WeakPolarHBondContact OD1-CB 3.01Å; N117-F119 WeakPolarHBondContact OD1-CD2 3.32Å; N117-F119 PolarHBondContact OD1-N 3.06Å; N117-V120 HydrophobicContact CB-CB 4.44Å; N117-V120 HydrophobicContact CB-CG2 4.04Å; N117-V120 PolarHBondContact O-N 2.84Å; N117-R121 PolarHBondContact O-N 2.89Å
118	E	92.5	Very high	92.7	Very high	46 Å²	46	44 Å²	44	22%	0.215	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-32.2	178.3	61.5	-87.4	-157.2	0	0	114.5	G122 Y150 H152 V155	E118-G122 PolarHBondContact O-N 3.37Å; E118-Y150 HydrophobicContact CB-CE1 4.14Å; E118-H152 HydrophobicContact CB-CB 4.22Å; E118-H152 IonicContact OE2-CD2 3.56Å; E118-V155 HydrophobicContact CB-CG2 3.68Å; E118-V155 WeakPolarHBondContact O-CG2 3.48Å
119	F	91.4	Very high	92.7	Very high	118 Å²	118	45.1 Å²	45.1	52%	0.518	21%	0.214	S	C	.	.	H	α-helix	trans	-72.4	-35.4	-180	-63.6	-71.1	0	0	0	111.9	N117 S123 Y154	N117-F119 VanDerWaalsContact C-N 3.31Å; N117-F119 PolarHBondContact O-N 2.68Å; N117-F119 WeakPolarHBondContact OD1-CB 3.01Å; N117-F119 WeakPolarHBondContact OD1-CD2 3.32Å; N117-F119 PolarHBondContact OD1-N 3.06Å; F119-S123 VanDerWaalsContact O-CB 3.23Å; F119-S123 WeakPolarHBondContact O-CB 3.28Å; F119-S123 PolarHBondContact O-N 3.31Å; F119-S123 PolarHBondContact O-OG 2.84Å; F119-Y154 HydrophobicContact CD1-CE1 4.18Å
120	V	91.8	Very high	92.6	Very high	13 Å²	13	50.3 Å²	50.3	8%	0.079	23%	0.233	C	C	.	.	H	α-helix	trans	-67	-47.5	174.5	178.3	0	0	0	0	109.4	D112 H115 N117 S123 T124	D112-V120 HydrophobicContact CB-CG1 3.94Å; H115-V120 HydrophobicContact CB-CB 4.34Å; H115-V120 HydrophobicContact CB-CG1 4.04Å; N117-V120 HydrophobicContact CB-CB 4.44Å; N117-V120 HydrophobicContact CB-CG2 4.04Å; N117-V120 PolarHBondContact O-N 2.84Å; V120-S123 PolarHBondContact O-N 2.94Å; V120-T124 WeakPolarHBondContact O-CB 3.23Å; V120-T124 PolarHBondContact O-N 3.41Å; V120-T124 PolarHBondContact O-OG1 2.68Å
121	R	93.7	Very high	92.3	Very high	29 Å²	29	45.2 Å²	45.2	11%	0.109	21%	0.214	C	C	.	.	H	α-helix	trans	-57.1	-53.4	174.8	-66.6	-167.6	-178.1	-143.3	-1.3	111.9	L113 Q114 H115 N117 S123 T124 L125 Y150 V155	L113-R121 VanDerWaalsContact O-CD 3.24Å; L113-R121 WeakPolarHBondContact O-CD 3.43Å; L113-R121 WeakPolarHBondContact O-CG 3.34Å; L113-R121 VanDerWaalsContact O-CZ 3.24Å; L113-R121 PolarHBondContact O-NE 3.31Å; L113-R121 PolarHBondContact O-NH1 2.96Å; Q114-R121 PolarHBondContact O-NH2 3Å; H115-R121 WeakPolarHBondContact O-CG 2.9Å; H115-R121 PolarHBondContact O-NE 2.84Å; H115-R121 PolarHBondContact O-NH2 3.11Å; N117-R121 PolarHBondContact O-N 2.89Å; R121-S123 PolarHBondContact O-N 3.47Å; R121-T124 PolarHBondContact O-N 3.23Å; R121-L125 WeakPolarHBondContact O-CG 3.37Å; R121-L125 PolarHBondContact O-N 2.79Å; R121-Y150 VanDerWaalsContact CZ-CE2 3.47Å; R121-Y150 VanDerWaalsContact NH1-CD2 3.32Å; R121-V155 HydrophobicContact CB-CG1 4.03Å; R121-V155 HydrophobicContact CB-CG2 4.04Å
122	G	93.2	Very high	92	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-67	-35.4	-176.1	0	0	0	0	0	113.8	E118 R126	E118-G122 PolarHBondContact O-N 3.37Å; G122-R126 WeakPolarHBondContact O-CB 3.2Å; G122-R126 PolarHBondContact O-N 3.48Å
123	S	92.1	Very high	91.9	Very high	42 Å²	42	47.9 Å²	47.9	29%	0.294	23%	0.226	S	C	.	.	H	α-helix	trans	-66.5	-41.2	173.7	-58.3	0	0	0	0	111.4	F119 V120 R121 R126 F127	F119-S123 VanDerWaalsContact O-CB 3.23Å; F119-S123 WeakPolarHBondContact O-CB 3.28Å; F119-S123 PolarHBondContact O-N 3.31Å; F119-S123 PolarHBondContact O-OG 2.84Å; V120-S123 PolarHBondContact O-N 2.94Å; R121-S123 PolarHBondContact O-N 3.47Å; S123-R126 PolarHBondContact O-N 3.38Å; S123-F127 PolarHBondContact O-N 3.37Å
124	T	94	Very high	91.6	Very high	1 Å²	1	50 Å²	50	1%	0.006	24%	0.239	C	C	.	.	H	α-helix	trans	-64	-46.1	176	-52.5	0	0	0	0	110.8	D112 L113 V120 R121 R126 F127 L128	D112-T124 HydrophobicContact CB-CG2 4.23Å; L113-T124 HydrophobicContact CD2-CG2 3.95Å; L113-T124 HydrophobicContact CG-CG2 4.07Å; V120-T124 WeakPolarHBondContact O-CB 3.23Å; V120-T124 PolarHBondContact O-N 3.41Å; V120-T124 PolarHBondContact O-OG1 2.68Å; R121-T124 PolarHBondContact O-N 3.23Å; T124-R126 VanDerWaalsContact C-N 3.29Å; T124-R126 PolarHBondContact O-N 3.31Å; T124-F127 WeakPolarHBondContact O-CA 3.42Å; T124-F127 WeakPolarHBondContact O-CB 3.04Å; T124-F127 PolarHBondContact O-N 3.09Å; T124-F127 VanDerWaalsContact O-N 3.08Å; T124-L128 WeakPolarHBondContact O-CG 3.37Å; T124-L128 PolarHBondContact O-N 2.96Å
125	L	95.8	Very high	91.4	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.1	-41.1	174.6	-73.5	164.9	0	0	0	112.4	L113 R121 F127 L128 C129 I144 C147 V155 N158 A159 A162	L113-L125 HydrophobicContact CD2-CD2 3.6Å; L113-L125 HydrophobicContact CD2-CG 3.69Å; R121-L125 WeakPolarHBondContact O-CG 3.37Å; R121-L125 PolarHBondContact O-N 2.79Å; L125-F127 VanDerWaalsContact C-N 3.35Å; L125-L128 PolarHBondContact O-N 3.19Å; L125-C129 PolarHBondContact O-N 3.35Å; L125-I144 HydrophobicContact CD2-CG1 4.35Å; L125-I144 HydrophobicContact CD2-CG2 4.24Å; L125-C147 HydrophobicContact CD1-CB 4.05Å; L125-V155 HydrophobicContact CD1-CG1 3.8Å; L125-N158 HydrophobicContact CB-CB 3.88Å; L125-N158 HydrophobicContact CD1-CB 4.17Å; L125-A159 HydrophobicContact CD1-CB 3.89Å; L125-A159 HydrophobicContact CD2-CB 4.3Å; L125-A162 HydrophobicContact CB-CB 4.49Å; L125-A162 HydrophobicContact CD2-CB 4.04Å
126	R	92.8	Very high	91.3	Very high	145 Å²	145	49.4 Å²	49.4	55%	0.547	24%	0.237	S	C	.	.	H	α-helix	trans	-68.6	-33.9	176.7	-170.9	169.2	-176.6	151.4	-0.1	112.7	G122 S123 T124 C129	G122-R126 WeakPolarHBondContact O-CB 3.2Å; G122-R126 PolarHBondContact O-N 3.48Å; S123-R126 PolarHBondContact O-N 3.38Å; T124-R126 VanDerWaalsContact C-N 3.29Å; T124-R126 PolarHBondContact O-N 3.31Å; R126-C129 WeakPolarHBondContact O-CB 3.44Å
127	F	92.4	Very high	91.5	Very high	7 Å²	7	44.8 Å²	44.8	3%	0.031	21%	0.207	C	C	.	.	H	α-helix	trans	-65.3	-40.5	171.5	161.3	-98	0	0	0	111.4	L83 W86 E87 Y109 S123 T124 L125 C129 R130 L131	L83-F127 HydrophobicContact CB-CB 4.35Å; L83-F127 HydrophobicContact CB-CD2 4.37Å; L83-F127 HydrophobicContact CB-CG 4.41Å; L83-F127 HydrophobicContact CD1-CB 4.4Å; L83-F127 HydrophobicContact CD2-CB 3.91Å; L83-F127 HydrophobicContact CD2-CD1 3.91Å; L83-F127 HydrophobicContact CD2-CD2 4.41Å; L83-F127 HydrophobicContact CD2-CG 3.8Å; L83-F127 HydrophobicContact CG-CB 4.44Å; L83-F127 WeakPolarHBondContact O-CD2 3.46Å; L83-F127 WeakPolarHBondContact O-CE2 3.39Å; W86-F127 HydrophobicContact CB-CE2 3.83Å; W86-F127 HydrophobicContact CB-CZ 3.75Å; E87-F127 HydrophobicContact CB-CD2 4.44Å; E87-F127 HydrophobicContact CB-CE2 4.18Å; Y109-F127 HydrophobicContact CD1-CE1 4.27Å; Y109-F127 HydrophobicContact CD2-CE1 4.38Å; Y109-F127 HydrophobicContact CE1-CD1 4.37Å; Y109-F127 AromaticContact CE1-CE1 3.66Å; Y109-F127 HydrophobicContact CE1-CE1 3.66Å; Y109-F127 HydrophobicContact CE1-CZ 4.19Å; Y109-F127 AromaticContact CE2-CE1 3.79Å; Y109-F127 HydrophobicContact CE2-CE1 3.79Å; Y109-F127 HydrophobicContact CE2-CZ 4.3Å; Y109-F127 AromaticContact CZ-CE1 3.37Å; Y109-F127 AromaticContact CZ-CZ 3.68Å; Y109-F127 VanDerWaalsContact OH-CZ 3.32Å; Y109-F127 WeakPolarHBondContact OH-CZ 3.38Å; S123-F127 PolarHBondContact O-N 3.37Å; T124-F127 WeakPolarHBondContact O-CA 3.42Å; T124-F127 WeakPolarHBondContact O-CB 3.04Å; T124-F127 PolarHBondContact O-N 3.09Å; T124-F127 VanDerWaalsContact O-N 3.08Å; L125-F127 VanDerWaalsContact C-N 3.35Å; F127-C129 PolarHBondContact O-N 2.78Å; F127-R130 WeakPolarHBondContact O-CB 3.31Å; F127-R130 PolarHBondContact O-N 3.33Å; F127-L131 HydrophobicContact CZ-CD1 4.17Å
128	L	92.9	Very high	91.6	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-26.5	179	-65.5	175.8	0	0	0	113.4	L113 T124 L125 R130 L131 L140 I144	L113-L128 HydrophobicContact CD1-CD1 3.96Å; L113-L128 HydrophobicContact CD2-CD1 4.05Å; L113-L128 HydrophobicContact CG-CD1 4.44Å; T124-L128 WeakPolarHBondContact O-CG 3.37Å; T124-L128 PolarHBondContact O-N 2.96Å; L125-L128 PolarHBondContact O-N 3.19Å; L128-R130 PolarHBondContact O-N 2.85Å; L128-R130 VanDerWaalsContact O-N 3.08Å; L128-L131 HydrophobicContact CD2-CD2 4.19Å; L128-L131 PolarHBondContact O-N 3.31Å; L128-L140 HydrophobicContact CD1-CD1 4.25Å; L128-L140 HydrophobicContact CD2-CD1 3.62Å; L128-I144 HydrophobicContact CD1-CD1 3.84Å; L128-I144 HydrophobicContact CD1-CG1 4.02Å
129	C	91.3	Very high	91.7	Very high	33 Å²	33	50.6 Å²	50.6	22%	0.223	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-13.7	170.5	-63.2	0	0	0	0	113.9	L125 R126 F127 T165	L125-C129 PolarHBondContact O-N 3.35Å; R126-C129 WeakPolarHBondContact O-CB 3.44Å; F127-C129 PolarHBondContact O-N 2.78Å; C129-T165 HydrophobicContact CB-CG2 4.17Å; C129-T165 VanDerWaalsContact O-CG2 3.29Å; C129-T165 WeakPolarHBondContact O-CG2 3.33Å
130	R	89.7	Confident	91.8	Very high	111 Å²	111	45 Å²	45	42%	0.419	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-5.7	-176.4	-53.3	-177.6	-177.5	156.1	-8.8	113.1	E87 F127 L128	E87-R130 HydrophobicContact CG-CB 4.48Å; E87-R130 WeakPolarHBondContact OE1-CD 3.28Å; E87-R130 IonicContact OE1-CZ 3.42Å; E87-R130 IonicContact OE1-NE 2.69Å; E87-R130 IonicContact OE1-NH1 3.4Å; E87-R130 VanDerWaalsContact OE2-CD 3.29Å; E87-R130 WeakPolarHBondContact OE2-CD 3.2Å; E87-R130 IonicContact OE2-CZ 2.78Å; E87-R130 IonicContact OE2-NE 3.84Å; E87-R130 IonicContact OE2-NH1 2.68Å; E87-R130 PolarHBondContact OE2-NH1 3.2Å; F127-R130 WeakPolarHBondContact O-CB 3.31Å; F127-R130 PolarHBondContact O-N 3.33Å; L128-R130 PolarHBondContact O-N 2.85Å; L128-R130 VanDerWaalsContact O-N 3.08Å
131	L	88.2	Confident	92	Very high	5 Å²	5	45 Å²	45	3%	0.026	21%	0.214	C	C	.	.			trans	-78.8	133.8	-180	-161.4	65	0	0	0	109.7	K91 F127 L128 E133 L136 I137	K91-L131 HydrophobicContact CD-CD1 4.49Å; F127-L131 HydrophobicContact CZ-CD1 4.17Å; L128-L131 HydrophobicContact CD2-CD2 4.19Å; L128-L131 PolarHBondContact O-N 3.31Å; L131-E133 WeakPolarHBondContact CD1-OE2 3.33Å; L131-L136 HydrophobicContact CD1-CD1 4.24Å; L131-L136 HydrophobicContact CD2-CB 3.74Å; L131-L136 HydrophobicContact CD2-CD1 4.21Å; L131-I137 HydrophobicContact CB-CD1 4.35Å; L131-I137 HydrophobicContact CB-CG1 4.49Å; L131-I137 HydrophobicContact CD2-CG1 3.9Å; L131-I137 HydrophobicContact CG-CG1 4.44Å
132	K	87	Confident	92	Very high	151 Å²	151	47.9 Å²	47.9	66%	0.657	24%	0.237	S	C	*	.			trans	-106	-8.9	-173.3	-63.3	-174.9	-179.1	178.9	0	112.9	P134 F170	K132-P134 WeakPolarHBondContact O-CD 3.4Å; K132-F170 WeakPolarHBondContact O-CZ 3.22Å
133	E	89.3	Confident	92.2	Very high	38 Å²	38	48.1 Å²	48.1	18%	0.178	24%	0.238	C	C	.	.			trans	-98.7	108.4	-172.8	-61.9	73.2	-161.3	0	0	110.5	K91 L98 L131 E135 L136	K91-E133 HydrophobicContact CB-CG 3.88Å; K91-E133 HydrophobicContact CG-CG 4.45Å; L98-E133 HydrophobicContact CD1-CG 4.48Å; L131-E133 WeakPolarHBondContact CD1-OE2 3.33Å; E133-E135 VanDerWaalsContact C-N 3.28Å; E133-E135 PolarHBondContact O-N 3.19Å; E133-L136 HydrophobicContact CB-CB 4.5Å; E133-L136 HydrophobicContact CB-CD1 4.09Å; E133-L136 HydrophobicContact CB-CG 4.19Å; E133-L136 PolarHBondContact O-N 3.42Å
134	P	89.5	Confident	92.3	Very high	44 Å²	44	46.1 Å²	46.1	29%	0.286	22%	0.224	S	C	.	.	H	α-helix	trans	-63.7	-32.9	-176.3	24.2	-33.1	0	0	0	112.8	K132 L136 I137 E138 F170 F172 L173	K132-P134 WeakPolarHBondContact O-CD 3.4Å; P134-L136 PolarHBondContact O-N 2.91Å; P134-I137 PolarHBondContact O-N 3.23Å; P134-E138 PolarHBondContact O-N 2.93Å; P134-F170 HydrophobicContact CB-CD1 3.86Å; P134-F170 HydrophobicContact CB-CE1 4.09Å; P134-F170 HydrophobicContact CB-CG 4.27Å; P134-F170 HydrophobicContact CG-CD1 4.31Å; P134-F170 HydrophobicContact CG-CE1 4.2Å; P134-F172 HydrophobicContact CB-CZ 4Å; P134-L173 HydrophobicContact CB-CD1 4.25Å
135	E	89.1	Confident	92.4	Very high	125 Å²	125	50 Å²	50	58%	0.584	24%	0.238	S	C	*	.	H	α-helix	trans	-58.1	-28.2	177.3	-62.7	177.7	-169.7	0	0	113	L98 E133 P139	L98-E135 WeakPolarHBondContact CB-OE2 3.46Å; L98-E135 HydrophobicContact CD2-CB 4.16Å; L98-E135 WeakPolarHBondContact CD2-OE2 3.28Å; E133-E135 VanDerWaalsContact C-N 3.28Å; E133-E135 PolarHBondContact O-N 3.19Å; E135-P139 VanDerWaalsContact O-CD 3.28Å; E135-P139 WeakPolarHBondContact O-CD 3.36Å
136	L	90.9	Very high	92.4	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-86.4	-24.9	176.3	-65.4	-179.8	0	0	0	112.8	K91 L98 M102 C106 L131 E133 P134 L140	K91-L136 HydrophobicContact CB-CD1 4.46Å; K91-L136 HydrophobicContact CG-CD1 4.09Å; L98-L136 HydrophobicContact CD1-CD1 4.07Å; L98-L136 HydrophobicContact CD1-CD2 4.13Å; L98-L136 HydrophobicContact CD1-CG 3.95Å; L98-L136 HydrophobicContact CD2-CD2 3.86Å; L98-L136 HydrophobicContact CD2-CG 4.31Å; M102-L136 HydrophobicContact CB-CD1 4.32Å; M102-L136 HydrophobicContact CB-CD2 3.87Å; C106-L136 HydrophobicContact CB-CD2 4.03Å; C106-L136 PolarHBondContact SG-O 3.42Å; L131-L136 HydrophobicContact CD1-CD1 4.24Å; L131-L136 HydrophobicContact CD2-CB 3.74Å; L131-L136 HydrophobicContact CD2-CD1 4.21Å; E133-L136 HydrophobicContact CB-CB 4.5Å; E133-L136 HydrophobicContact CB-CD1 4.09Å; E133-L136 HydrophobicContact CB-CG 4.19Å; E133-L136 PolarHBondContact O-N 3.42Å; P134-L136 PolarHBondContact O-N 2.91Å; L136-L140 WeakPolarHBondContact O-CD1 3.31Å; L136-L140 WeakPolarHBondContact O-CG 3.29Å
137	I	93	Very high	92.5	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-84.5	-38.4	-177.3	-61.9	171.9	0	0	0	110.5	L131 P134 L140 M141 I166 F170 L173	L131-I137 HydrophobicContact CB-CD1 4.35Å; L131-I137 HydrophobicContact CB-CG1 4.49Å; L131-I137 HydrophobicContact CD2-CG1 3.9Å; L131-I137 HydrophobicContact CG-CG1 4.44Å; P134-I137 PolarHBondContact O-N 3.23Å; I137-L140 WeakPolarHBondContact O-CA 3.47Å; I137-L140 WeakPolarHBondContact O-CB 3.41Å; I137-L140 PolarHBondContact O-N 3.16Å; I137-M141 HydrophobicContact CG2-SD 3.85Å; I137-M141 PolarHBondContact O-N 3.13Å; I137-I166 HydrophobicContact CG2-CD1 3.66Å; I137-I166 HydrophobicContact CG2-CG1 3.94Å; I137-I166 HydrophobicContact CG2-CG2 4.14Å; I137-F170 HydrophobicContact CD1-CD2 3.75Å; I137-F170 HydrophobicContact CD1-CE2 3.46Å; I137-F170 VanDerWaalsContact CD1-CE2 3.46Å; I137-F170 HydrophobicContact CD1-CZ 4.44Å; I137-L173 HydrophobicContact CB-CD1 3.95Å; I137-L173 HydrophobicContact CG2-CD1 3.79Å
138	E	93.1	Very high	92.6	Very high	124 Å²	124	45.8 Å²	45.8	58%	0.579	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-50.4	-48.5	-177.8	-176.7	179.6	-171.1	0	0	113.4	P134 L140 M141 L173	P134-E138 PolarHBondContact O-N 2.93Å; E138-L140 PolarHBondContact O-N 2.95Å; E138-M141 WeakPolarHBondContact O-CB 3.37Å; E138-M141 WeakPolarHBondContact O-CG 3.3Å; E138-M141 PolarHBondContact O-N 3.42Å; E138-L173 HydrophobicContact CB-CD2 3.75Å; E138-L173 HydrophobicContact CG-CD2 3.98Å
139	P	93.9	Very high	92.6	Very high	69 Å²	69	54 Å²	54	45%	0.448	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-68.4	-18.5	179	-18.4	33.6	0	0	0	113.9	E135	E135-P139 VanDerWaalsContact O-CD 3.28Å; E135-P139 WeakPolarHBondContact O-CD 3.36Å
140	L	95.2	Very high	92.7	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-88.2	-18.1	-178.1	-55.3	179.7	0	0	0	112.3	Y109 R110 L113 L128 L136 I137 E138 P142 S143 I144	Y109-L140 HydrophobicContact CD2-CD1 4.12Å; Y109-L140 HydrophobicContact CG-CD1 4.49Å; R110-L140 HydrophobicContact CB-CD2 3.68Å; R110-L140 HydrophobicContact CG-CD2 4.44Å; L113-L140 HydrophobicContact CD1-CB 4.08Å; L113-L140 HydrophobicContact CD1-CD2 4.39Å; L128-L140 HydrophobicContact CD1-CD1 4.25Å; L128-L140 HydrophobicContact CD2-CD1 3.62Å; L136-L140 WeakPolarHBondContact O-CD1 3.31Å; L136-L140 WeakPolarHBondContact O-CG 3.29Å; I137-L140 WeakPolarHBondContact O-CA 3.47Å; I137-L140 WeakPolarHBondContact O-CB 3.41Å; I137-L140 PolarHBondContact O-N 3.16Å; E138-L140 PolarHBondContact O-N 2.95Å; L140-P142 VanDerWaalsContact C-CD 3.48Å; L140-S143 WeakPolarHBondContact O-CA 3.18Å; L140-S143 WeakPolarHBondContact O-CB 3.38Å; L140-S143 PolarHBondContact O-N 3.42Å; L140-I144 HydrophobicContact CB-CD1 4.1Å; L140-I144 HydrophobicContact CB-CG1 4.38Å; L140-I144 WeakPolarHBondContact O-CG1 3.34Å; L140-I144 PolarHBondContact O-N 3.12Å
141	M	94.7	Very high	92.9	Very high	14 Å²	14	57.4 Å²	57.4	7%	0.069	28%	0.278	C	S	.	.	H	α-helix	trans	-50.1	-44.8	-174.9	-69.6	-53.3	-54.6	0	0	114.4	I137 E138 S143 I144 R145 I166 L173 I174	I137-M141 HydrophobicContact CG2-SD 3.85Å; I137-M141 PolarHBondContact O-N 3.13Å; E138-M141 WeakPolarHBondContact O-CB 3.37Å; E138-M141 WeakPolarHBondContact O-CG 3.3Å; E138-M141 PolarHBondContact O-N 3.42Å; M141-S143 VanDerWaalsContact C-N 3.29Å; M141-S143 PolarHBondContact O-N 2.88Å; M141-I144 PolarHBondContact O-N 3.38Å; M141-I144 HydrophobicContact SD-CD1 4.07Å; M141-R145 WeakPolarHBondContact O-CG 3.45Å; M141-R145 PolarHBondContact O-N 3.28Å; M141-I166 HydrophobicContact SD-CD1 4.09Å; M141-I166 HydrophobicContact SD-CG2 4.09Å; M141-L173 HydrophobicContact CG-CB 4.43Å; M141-L173 HydrophobicContact SD-CB 4.32Å; M141-I174 HydrophobicContact CE-CB 3.73Å; M141-I174 HydrophobicContact CE-CD1 3.93Å; M141-I174 HydrophobicContact CE-CG1 4.02Å; M141-I174 HydrophobicContact CE-CG2 4.42Å
142	P	94.9	Very high	93.1	Very high	90 Å²	90	60.1 Å²	60.1	58%	0.584	29%	0.291	S	S	*	.	H	α-helix	trans	-61.7	-37.4	176.3	-23.3	34.9	0	0	0	113	L140 S146	L140-P142 VanDerWaalsContact C-CD 3.48Å; P142-S146 PolarHBondContact O-N 3.18Å
143	S	96	Very high	93.4	Very high	4 Å²	4	55 Å²	55	3%	0.028	27%	0.274	C	S	.	.	H	α-helix	trans	-72.4	-38.1	178.8	-59.1	0	0	0	0	111.3	Q114 L140 M141 S146 C147	Q114-S143 PolarHBondContact NE2-OG 2.76Å; L140-S143 WeakPolarHBondContact O-CA 3.18Å; L140-S143 WeakPolarHBondContact O-CB 3.38Å; L140-S143 PolarHBondContact O-N 3.42Å; M141-S143 VanDerWaalsContact C-N 3.29Å; M141-S143 PolarHBondContact O-N 2.88Å; S143-S146 PolarHBondContact O-N 3.05Å; S143-S146 PolarHBondContact O-OG 2.92Å; S143-C147 PolarHBondContact O-N 3.32Å; S143-C147 PolarHBondContact O-SG 3.14Å
144	I	95.6	Very high	93.6	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-45.7	173.6	-61.5	170.4	0	0	0	110.3	L113 L125 L128 L140 M141 C147 A162 I166	L113-I144 HydrophobicContact CD1-CG1 3.91Å; L125-I144 HydrophobicContact CD2-CG1 4.35Å; L125-I144 HydrophobicContact CD2-CG2 4.24Å; L128-I144 HydrophobicContact CD1-CD1 3.84Å; L128-I144 HydrophobicContact CD1-CG1 4.02Å; L140-I144 HydrophobicContact CB-CD1 4.1Å; L140-I144 HydrophobicContact CB-CG1 4.38Å; L140-I144 WeakPolarHBondContact O-CG1 3.34Å; L140-I144 PolarHBondContact O-N 3.12Å; M141-I144 PolarHBondContact O-N 3.38Å; M141-I144 HydrophobicContact SD-CD1 4.07Å; I144-C147 VanDerWaalsContact O-CB 3.31Å; I144-C147 WeakPolarHBondContact O-CB 3.46Å; I144-C147 PolarHBondContact O-N 3.2Å; I144-C147 VanDerWaalsContact O-N 3.1Å; I144-A162 HydrophobicContact CG2-CB 4.45Å; I144-I166 HydrophobicContact CD1-CD1 3.56Å
145	R	95.2	Very high	93.9	Very high	81 Å²	81	54 Å²	54	31%	0.306	26%	0.263	S	S	.	.	H	α-helix	trans	-60.3	-47.1	176.6	-73.4	-175	-175.7	-131.4	2.5	112.1	M141 C147 L148 D176	M141-R145 WeakPolarHBondContact O-CG 3.45Å; M141-R145 PolarHBondContact O-N 3.28Å; R145-C147 PolarHBondContact O-N 2.97Å; R145-C147 VanDerWaalsContact O-N 3.1Å; R145-L148 VanDerWaalsContact O-CB 3.3Å; R145-L148 WeakPolarHBondContact O-CB 3.4Å; R145-L148 PolarHBondContact O-N 3.17Å; R145-D176 IonicContact CZ-OD1 2.68Å; R145-D176 IonicContact CZ-OD2 2.79Å; R145-D176 IonicContact NH1-OD1 3.86Å; R145-D176 IonicContact NH1-OD2 2.86Å; R145-D176 PolarHBondContact NH1-OD2 3.46Å; R145-D176 IonicContact NH2-OD1 2.67Å; R145-D176 PolarHBondContact NH2-OD1 2.98Å; R145-D176 IonicContact NH2-OD2 3.6Å; R145-D176 PolarHBondContact NH2-OD2 3.24Å
146	S	95.1	Very high	94.2	Very high	55 Å²	55	50.7 Å²	50.7	39%	0.385	25%	0.245	S	C	.	.	H	α-helix	trans	-60.4	-23.2	176.3	70.7	0	0	0	0	113.8	P142 S143 L148 E149	P142-S146 PolarHBondContact O-N 3.18Å; S143-S146 PolarHBondContact O-N 3.05Å; S143-S146 PolarHBondContact O-OG 2.92Å; S146-L148 VanDerWaalsContact C-N 3.29Å; S146-L148 PolarHBondContact O-N 3.02Å; S146-E149 PolarHBondContact O-N 3.29Å
147	C	95.9	Very high	94.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-73.4	-18.8	175.4	-71.1	0	0	0	0	113.3	L113 L125 S143 I144 R145 E149 Y150 V155 A159	L113-C147 PolarHBondContact O-SG 2.89Å; L125-C147 HydrophobicContact CD1-CB 4.05Å; S143-C147 PolarHBondContact O-N 3.32Å; S143-C147 PolarHBondContact O-SG 3.14Å; I144-C147 VanDerWaalsContact O-CB 3.31Å; I144-C147 WeakPolarHBondContact O-CB 3.46Å; I144-C147 PolarHBondContact O-N 3.2Å; I144-C147 VanDerWaalsContact O-N 3.1Å; R145-C147 PolarHBondContact O-N 2.97Å; R145-C147 VanDerWaalsContact O-N 3.1Å; C147-E149 VanDerWaalsContact C-N 3.29Å; C147-Y150 WeakPolarHBondContact O-CB 3.38Å; C147-Y150 PolarHBondContact O-N 2.79Å; C147-V155 HydrophobicContact CB-CG1 3.81Å; C147-A159 HydrophobicContact CB-CB 3.82Å
148	L	94.4	Very high	94.5	Very high	10 Å²	10	54.4 Å²	54.4	5%	0.052	26%	0.259	C	S	.	.	H	α-helix	trans	-69.9	-27.5	173.3	-65.8	167.7	0	0	0	112	R145 S146 Y150 R156 A159 V160 L180 M181 F184	R145-L148 VanDerWaalsContact O-CB 3.3Å; R145-L148 WeakPolarHBondContact O-CB 3.4Å; R145-L148 PolarHBondContact O-N 3.17Å; S146-L148 VanDerWaalsContact C-N 3.29Å; S146-L148 PolarHBondContact O-N 3.02Å; L148-Y150 VanDerWaalsContact C-N 3.35Å; L148-R156 WeakPolarHBondContact O-CD 3.45Å; L148-R156 WeakPolarHBondContact O-CG 3.36Å; L148-A159 HydrophobicContact CD2-CB 3.74Å; L148-A159 HydrophobicContact CG-CB 4.13Å; L148-V160 HydrophobicContact CD2-CB 4.48Å; L148-V160 HydrophobicContact CD2-CG2 3.64Å; L148-L180 HydrophobicContact CD1-CD2 3.45Å; L148-L180 VanDerWaalsContact CD1-CD2 3.45Å; L148-L180 HydrophobicContact CD1-CG 4.17Å; L148-M181 HydrophobicContact CD1-CE 3.84Å; L148-M181 HydrophobicContact CD2-CE 4.06Å; L148-F184 HydrophobicContact CB-CD2 4.44Å; L148-F184 HydrophobicContact CB-CE2 4.43Å; L148-F184 HydrophobicContact CD2-CE2 4.49Å; L148-F184 WeakPolarHBondContact O-CE2 3.49Å
149	E	92.8	Very high	94.6	Very high	175 Å²	175	48.5 Å²	48.5	82%	0.818	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	5.6	178.6	-63.1	176.8	-177.1	0	0	112.6	S146 C147	S146-E149 PolarHBondContact O-N 3.29Å; C147-E149 VanDerWaalsContact C-N 3.29Å
150	Y	94	Very high	94.7	Very high	30 Å²	30	45.2 Å²	45.2	12%	0.118	21%	0.21	C	C	.	.			trans	-71.6	143.5	-173.9	-168.8	-104.3	0	0	0	112.6	P116 E118 R121 C147 L148 H152 V155 R156	P116-Y150 PolarHBondContact O-OH 2.76Å; P116-Y150 VanDerWaalsContact O-OH 3.06Å; E118-Y150 HydrophobicContact CB-CE1 4.14Å; R121-Y150 VanDerWaalsContact CZ-CE2 3.47Å; R121-Y150 VanDerWaalsContact NH1-CD2 3.32Å; C147-Y150 WeakPolarHBondContact O-CB 3.38Å; C147-Y150 PolarHBondContact O-N 2.79Å; L148-Y150 VanDerWaalsContact C-N 3.35Å; Y150-H152 VanDerWaalsContact C-N 3.26Å; Y150-H152 HydrophobicContact CD1-CB 3.98Å; Y150-H152 HydrophobicContact CE1-CB 3.88Å; Y150-H152 AromaticContact CE1-CD2 3.59Å; Y150-H152 PolarHBondContact O-N 3.12Å; Y150-H152 VanDerWaalsContact O-N 3.1Å; Y150-V155 HydrophobicContact CD1-CB 3.57Å; Y150-V155 HydrophobicContact CD1-CG1 3.94Å; Y150-V155 HydrophobicContact CD1-CG2 3.51Å; Y150-V155 HydrophobicContact CE1-CB 4.25Å; Y150-V155 HydrophobicContact CE1-CG2 3.65Å; Y150-V155 HydrophobicContact CG-CB 4.24Å; Y150-V155 HydrophobicContact CG-CG1 4.15Å; Y150-V155 HydrophobicContact CG-CG2 4.48Å; Y150-R156 WeakPolarHBondContact O-CD 3.37Å; Y150-R156 WeakPolarHBondContact O-CG 3.34Å; Y150-R156 PolarHBondContact O-NE 2.91Å
151	R	92.2	Very high	94.6	Very high	185 Å²	185	47.8 Å²	47.8	70%	0.698	22%	0.224	S	C	*	.	S	Bend	trans	-56.5	-32	-173.7	70.9	-177.3	-172.7	-178.3	-0.1	115.3
152	H	93.7	Very high	94.6	Very high	62 Å²	62	47.1 Å²	47.1	29%	0.287	22%	0.221	S	C	.	.	S	Bend	trans	-94.4	124.9	-176	-70	-66.3	0	0	0	111.1	E118 Y150 Y154 V155 R156	E118-H152 HydrophobicContact CB-CB 4.22Å; E118-H152 IonicContact OE2-CD2 3.56Å; Y150-H152 VanDerWaalsContact C-N 3.26Å; Y150-H152 HydrophobicContact CD1-CB 3.98Å; Y150-H152 HydrophobicContact CE1-CB 3.88Å; Y150-H152 AromaticContact CE1-CD2 3.59Å; Y150-H152 PolarHBondContact O-N 3.12Å; Y150-H152 VanDerWaalsContact O-N 3.1Å; H152-Y154 PolarHBondContact O-N 2.94Å; H152-V155 HydrophobicContact CB-CG2 4.49Å; H152-V155 PolarHBondContact O-N 3.47Å; H152-R156 PolarHBondContact O-N 2.84Å
153	S	92.9	Very high	94.5	Very high	43 Å²	43	42.9 Å²	42.9	30%	0.301	19%	0.193	S	C	.	.	H	α-helix	trans	-59.5	-30.7	179.5	60.7	0	0	0	0	113.6	V155 R156 R157 D190 C193	S153-V155 VanDerWaalsContact C-N 3.28Å; S153-V155 PolarHBondContact O-N 2.85Å; S153-R156 PolarHBondContact O-N 2.82Å; S153-R157 WeakPolarHBondContact O-CB 3.47Å; S153-R157 PolarHBondContact O-N 2.94Å; S153-D190 WeakPolarHBondContact CB-OD1 3.47Å; S153-D190 PolarHBondContact OG-OD1 2.99Å; S153-C193 PolarHBondContact O-SG 2.88Å
154	Y	94.1	Very high	94.4	Very high	62 Å²	62	44.4 Å²	44.4	24%	0.243	20%	0.199	C	C	.	.	H	α-helix	trans	-55	-42.2	173.5	175.5	-102.6	0	0	0	112.8	F119 H152 N158	F119-Y154 HydrophobicContact CD1-CE1 4.18Å; H152-Y154 PolarHBondContact O-N 2.94Å; Y154-N158 WeakPolarHBondContact CE2-ND2 3.37Å; Y154-N158 PolarHBondContact O-N 3.02Å; Y154-N158 PolarHBondContact O-ND2 3.37Å
155	V	95.5	Very high	94.3	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-72.3	-49.3	179.2	-179.9	0	0	0	0	109.9	E118 R121 L125 C147 Y150 H152 S153 R157 N158 A159	E118-V155 HydrophobicContact CB-CG2 3.68Å; E118-V155 WeakPolarHBondContact O-CG2 3.48Å; R121-V155 HydrophobicContact CB-CG1 4.03Å; R121-V155 HydrophobicContact CB-CG2 4.04Å; L125-V155 HydrophobicContact CD1-CG1 3.8Å; C147-V155 HydrophobicContact CB-CG1 3.81Å; Y150-V155 HydrophobicContact CD1-CB 3.57Å; Y150-V155 HydrophobicContact CD1-CG1 3.94Å; Y150-V155 HydrophobicContact CD1-CG2 3.51Å; Y150-V155 HydrophobicContact CE1-CB 4.25Å; Y150-V155 HydrophobicContact CE1-CG2 3.65Å; Y150-V155 HydrophobicContact CG-CB 4.24Å; Y150-V155 HydrophobicContact CG-CG1 4.15Å; Y150-V155 HydrophobicContact CG-CG2 4.48Å; H152-V155 HydrophobicContact CB-CG2 4.49Å; H152-V155 PolarHBondContact O-N 3.47Å; S153-V155 VanDerWaalsContact C-N 3.28Å; S153-V155 PolarHBondContact O-N 2.85Å; V155-R157 VanDerWaalsContact C-N 3.32Å; V155-R157 PolarHBondContact O-N 3.47Å; V155-N158 PolarHBondContact O-N 3.02Å; V155-N158 VanDerWaalsContact O-N 3.12Å; V155-A159 WeakPolarHBondContact O-CB 3.33Å; V155-A159 PolarHBondContact O-N 2.77Å
156	R	95.9	Very high	94.2	Very high	55 Å²	55	42.2 Å²	42.2	21%	0.208	20%	0.195	C	C	.	.	H	α-helix	trans	-56.3	-45.5	178.9	-62.6	-169.7	-74.7	169.4	13	111.9	L148 Y150 H152 S153 N158 A159 V160 F184 E188	L148-R156 WeakPolarHBondContact O-CD 3.45Å; L148-R156 WeakPolarHBondContact O-CG 3.36Å; Y150-R156 WeakPolarHBondContact O-CD 3.37Å; Y150-R156 WeakPolarHBondContact O-CG 3.34Å; Y150-R156 PolarHBondContact O-NE 2.91Å; H152-R156 PolarHBondContact O-N 2.84Å; S153-R156 PolarHBondContact O-N 2.82Å; R156-N158 VanDerWaalsContact C-N 3.35Å; R156-N158 PolarHBondContact O-N 3.26Å; R156-A159 WeakPolarHBondContact O-CB 3.49Å; R156-A159 PolarHBondContact O-N 2.86Å; R156-A159 VanDerWaalsContact O-N 3.09Å; R156-V160 WeakPolarHBondContact O-CG2 3.47Å; R156-V160 PolarHBondContact O-N 3.49Å; R156-F184 HydrophobicContact CB-CE2 4.41Å; R156-F184 HydrophobicContact CB-CZ 4.16Å; R156-E188 VanDerWaalsContact CZ-CD 3.44Å; R156-E188 IonicContact CZ-OE1 2.73Å; R156-E188 VanDerWaalsContact CZ-OE1 3.26Å; R156-E188 IonicContact CZ-OE2 3.3Å; R156-E188 IonicContact NE-OE2 2.82Å; R156-E188 PolarHBondContact NE-OE2 2.9Å; R156-E188 IonicContact NH1-OE1 3.63Å; R156-E188 PolarHBondContact NH1-OE1 2.81Å; R156-E188 IonicContact NH1-OE2 3.58Å; R156-E188 PolarHBondContact NH1-OE2 2.98Å; R156-E188 VanDerWaalsContact NH2-CD 3.31Å; R156-E188 IonicContact NH2-OE1 3.65Å; R156-E188 PolarHBondContact NH2-OE1 2.89Å; R156-E188 IonicContact NH2-OE2 3.91Å; R156-E188 PolarHBondContact NH2-OE2 2.88Å; R156-E188 VanDerWaalsContact NH2-OE2 3.09Å
157	R	94.1	Very high	94.1	Very high	81 Å²	81	42.3 Å²	42.3	31%	0.306	19%	0.187	S	C	.	.	H	α-helix	trans	-55.6	-45.5	175.9	-175.6	-176.1	70.3	177.6	-0.9	112.9	S153 V155 L161 N196	S153-R157 WeakPolarHBondContact O-CB 3.47Å; S153-R157 PolarHBondContact O-N 2.94Å; V155-R157 VanDerWaalsContact C-N 3.32Å; V155-R157 PolarHBondContact O-N 3.47Å; R157-L161 PolarHBondContact O-N 3Å; R157-N196 WeakPolarHBondContact CG-ND2 3.29Å; R157-N196 PolarHBondContact O-ND2 3.02Å; R157-N196 VanDerWaalsContact O-ND2 3.16Å
158	N	95	Very high	93.8	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.011	22%	0.218	C	C	.	.	H	α-helix	trans	-75.9	-29.8	178	-71.8	-66.1	0	0	0	111.7	L125 Y154 V155 R156 L161 A162	L125-N158 HydrophobicContact CB-CB 3.88Å; L125-N158 HydrophobicContact CD1-CB 4.17Å; Y154-N158 WeakPolarHBondContact CE2-ND2 3.37Å; Y154-N158 PolarHBondContact O-N 3.02Å; Y154-N158 PolarHBondContact O-ND2 3.37Å; V155-N158 PolarHBondContact O-N 3.02Å; V155-N158 VanDerWaalsContact O-N 3.12Å; R156-N158 VanDerWaalsContact C-N 3.35Å; R156-N158 PolarHBondContact O-N 3.26Å; N158-L161 PolarHBondContact O-N 2.69Å; N158-A162 WeakPolarHBondContact O-CB 3.1Å; N158-A162 PolarHBondContact O-N 3.26Å
159	A	96.2	Very high	93.6	Very high	0 Å²	0	53 Å²	53	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.3	-40.6	175.8	0	0	0	0	0	111	L125 C147 L148 V155 R156 A162 A163	L125-A159 HydrophobicContact CD1-CB 3.89Å; L125-A159 HydrophobicContact CD2-CB 4.3Å; C147-A159 HydrophobicContact CB-CB 3.82Å; L148-A159 HydrophobicContact CD2-CB 3.74Å; L148-A159 HydrophobicContact CG-CB 4.13Å; V155-A159 WeakPolarHBondContact O-CB 3.33Å; V155-A159 PolarHBondContact O-N 2.77Å; R156-A159 WeakPolarHBondContact O-CB 3.49Å; R156-A159 PolarHBondContact O-N 2.86Å; R156-A159 VanDerWaalsContact O-N 3.09Å; A159-A162 PolarHBondContact O-N 3.42Å; A159-A163 WeakPolarHBondContact O-CB 3.47Å; A159-A163 PolarHBondContact O-N 2.73Å
160	V	95.4	Very high	93.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.4	-42.8	171.7	174.4	0	0	0	0	111.6	L148 R156 A163 F164 M181 F184 N196 A197	L148-V160 HydrophobicContact CD2-CB 4.48Å; L148-V160 HydrophobicContact CD2-CG2 3.64Å; R156-V160 WeakPolarHBondContact O-CG2 3.47Å; R156-V160 PolarHBondContact O-N 3.49Å; V160-A163 PolarHBondContact O-N 3.29Å; V160-F164 WeakPolarHBondContact O-CB 3.42Å; V160-F164 PolarHBondContact O-N 3.48Å; V160-M181 HydrophobicContact CB-SD 4.35Å; V160-M181 HydrophobicContact CG1-SD 3.81Å; V160-M181 HydrophobicContact CG2-SD 3.96Å; V160-F184 HydrophobicContact CG2-CD1 4.26Å; V160-F184 HydrophobicContact CG2-CE1 3.8Å; V160-F184 HydrophobicContact CG2-CZ 3.98Å; V160-N196 HydrophobicContact CB-CB 4.21Å; V160-N196 VanDerWaalsContact CG1-C 3.45Å; V160-N196 HydrophobicContact CG1-CB 3.68Å; V160-A197 HydrophobicContact CG1-CB 3.98Å; V160-A197 HydrophobicContact CG2-CB 4.45Å
161	L	93	Very high	93.3	Very high	54 Å²	54	49 Å²	49	28%	0.283	22%	0.222	S	C	.	.	H	α-helix	trans	-64.1	-41.2	176	-71	171.7	0	0	0	112.4	R157 N158 F164 T165 N196	R157-L161 PolarHBondContact O-N 3Å; N158-L161 PolarHBondContact O-N 2.69Å; L161-F164 PolarHBondContact O-N 2.67Å; L161-T165 WeakPolarHBondContact O-CB 3.48Å; L161-T165 PolarHBondContact O-N 3.08Å; L161-T165 PolarHBondContact O-OG1 3.31Å; L161-N196 WeakPolarHBondContact CD1-ND2 3.23Å; L161-N196 HydrophobicContact CD2-CB 4.33Å; L161-N196 HydrophobicContact CG-CB 4.5Å; L161-N196 VanDerWaalsContact CG-ND2 3.27Å; L161-N196 WeakPolarHBondContact CG-ND2 3.46Å
162	A	93.9	Very high	93.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-48.7	175	0	0	0	0	0	110.5	L125 I144 N158 A159 F164 T165 I166	L125-A162 HydrophobicContact CB-CB 4.49Å; L125-A162 HydrophobicContact CD2-CB 4.04Å; I144-A162 HydrophobicContact CG2-CB 4.45Å; N158-A162 WeakPolarHBondContact O-CB 3.1Å; N158-A162 PolarHBondContact O-N 3.26Å; A159-A162 PolarHBondContact O-N 3.42Å; A162-F164 VanDerWaalsContact C-N 3.34Å; A162-F164 PolarHBondContact O-N 2.95Å; A162-T165 PolarHBondContact O-N 3.27Å; A162-I166 WeakPolarHBondContact O-CB 3.31Å; A162-I166 WeakPolarHBondContact O-CD1 3.38Å; A162-I166 WeakPolarHBondContact O-CG1 3.44Å; A162-I166 PolarHBondContact O-N 2.88Å
163	A	94.3	Very high	93.2	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.008	21%	0.208	C	C	.	.	H	α-helix	trans	-57.6	-44.3	176.2	0	0	0	0	0	112.1	A159 V160 I166 Y167 I174	A159-A163 WeakPolarHBondContact O-CB 3.47Å; A159-A163 PolarHBondContact O-N 2.73Å; V160-A163 PolarHBondContact O-N 3.29Å; A163-I166 PolarHBondContact O-N 3.32Å; A163-Y167 WeakPolarHBondContact O-CB 3.38Å; A163-Y167 PolarHBondContact O-N 3.18Å; A163-I174 HydrophobicContact CB-CD1 4.19Å
164	F	93.9	Very high	93.2	Very high	35 Å²	35	42.5 Å²	42.5	15%	0.154	19%	0.194	C	C	.	.	H	α-helix	trans	-61.2	-47.2	175.9	176.3	-148.7	0	0	0	112.1	V160 L161 A162 I166 Y167 K168 M200 H203	V160-F164 WeakPolarHBondContact O-CB 3.42Å; V160-F164 PolarHBondContact O-N 3.48Å; L161-F164 PolarHBondContact O-N 2.67Å; A162-F164 VanDerWaalsContact C-N 3.34Å; A162-F164 PolarHBondContact O-N 2.95Å; F164-I166 VanDerWaalsContact C-N 3.34Å; F164-I166 PolarHBondContact O-N 2.93Å; F164-Y167 PolarHBondContact O-N 2.92Å; F164-K168 WeakPolarHBondContact O-CB 3.47Å; F164-K168 PolarHBondContact O-N 2.77Å; F164-M200 HydrophobicContact CB-CB 3.89Å; F164-M200 HydrophobicContact CB-CG 3.69Å; F164-M200 HydrophobicContact CB-SD 4.02Å; F164-M200 HydrophobicContact CD2-CB 4.07Å; F164-M200 HydrophobicContact CD2-CG 3.6Å; F164-M200 HydrophobicContact CE2-CG 4.48Å; F164-M200 HydrophobicContact CG-CB 3.94Å; F164-M200 HydrophobicContact CG-CG 3.82Å; F164-H203 HydrophobicContact CE2-CB 3.69Å; F164-H203 HydrophobicContact CZ-CB 3.75Å; F164-H203 AromaticContact CZ-CD2 3.52Å; F164-H203 AromaticContact CZ-CG 3.82Å
165	T	91.8	Very high	93.1	Very high	34 Å²	34	43.7 Å²	43.7	21%	0.209	21%	0.209	C	C	.	.	H	α-helix	trans	-66.8	-39.6	-178.1	-50.1	0	0	0	0	111.4	C129 L161 A162 K168 N169	C129-T165 HydrophobicContact CB-CG2 4.17Å; C129-T165 VanDerWaalsContact O-CG2 3.29Å; C129-T165 WeakPolarHBondContact O-CG2 3.33Å; L161-T165 WeakPolarHBondContact O-CB 3.48Å; L161-T165 PolarHBondContact O-N 3.08Å; L161-T165 PolarHBondContact O-OG1 3.31Å; A162-T165 PolarHBondContact O-N 3.27Å; T165-K168 PolarHBondContact O-N 3.19Å; T165-N169 PolarHBondContact O-N 3.22Å; T165-N169 VanDerWaalsContact O-N 3.13Å; T165-N169 PolarHBondContact O-ND2 3.04Å
166	I	93.3	Very high	93	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-65	-47.3	175.5	-67	164.9	0	0	0	110.1	I137 M141 I144 A162 A163 F164 K168 N169 F170 L173 I174	I137-I166 HydrophobicContact CG2-CD1 3.66Å; I137-I166 HydrophobicContact CG2-CG1 3.94Å; I137-I166 HydrophobicContact CG2-CG2 4.14Å; M141-I166 HydrophobicContact SD-CD1 4.09Å; M141-I166 HydrophobicContact SD-CG2 4.09Å; I144-I166 HydrophobicContact CD1-CD1 3.56Å; A162-I166 WeakPolarHBondContact O-CB 3.31Å; A162-I166 WeakPolarHBondContact O-CD1 3.38Å; A162-I166 WeakPolarHBondContact O-CG1 3.44Å; A162-I166 PolarHBondContact O-N 2.88Å; A163-I166 PolarHBondContact O-N 3.32Å; F164-I166 VanDerWaalsContact C-N 3.34Å; F164-I166 PolarHBondContact O-N 2.93Å; I166-K168 VanDerWaalsContact C-N 3.31Å; I166-K168 PolarHBondContact O-N 3.45Å; I166-N169 PolarHBondContact O-N 3.35Å; I166-F170 HydrophobicContact CG2-CB 4.45Å; I166-F170 CarbonylContact O-C 3.41Å; I166-F170 VanDerWaalsContact O-CA 3.23Å; I166-F170 WeakPolarHBondContact O-CA 3.26Å; I166-F170 WeakPolarHBondContact O-CB 3.49Å; I166-F170 PolarHBondContact O-N 3.46Å; I166-L173 HydrophobicContact CG2-CB 4.07Å; I166-L173 HydrophobicContact CG2-CD1 4.25Å; I166-I174 HydrophobicContact CG2-CG2 4.05Å
167	Y	93.6	Very high	92.8	Very high	57 Å²	57	43.8 Å²	43.8	22%	0.224	21%	0.214	C	C	.	.	H	α-helix	trans	-59.3	-42.7	177	-178.8	-97.4	0	0	0	112.3	A163 F164 N169 D171 I174 A177 P178 M200 A204	A163-Y167 WeakPolarHBondContact O-CB 3.38Å; A163-Y167 PolarHBondContact O-N 3.18Å; F164-Y167 PolarHBondContact O-N 2.92Å; Y167-N169 VanDerWaalsContact C-N 3.34Å; Y167-N169 PolarHBondContact O-N 2.88Å; Y167-D171 HydrophobicContact CD2-CB 4.47Å; Y167-D171 HydrophobicContact CE2-CB 4.41Å; Y167-D171 WeakPolarHBondContact O-CA 3.47Å; Y167-D171 PolarHBondContact O-N 3.28Å; Y167-I174 HydrophobicContact CD2-CG2 4.26Å; Y167-I174 WeakPolarHBondContact CD2-O 3.38Å; Y167-A177 HydrophobicContact CD2-CB 3.68Å; Y167-A177 HydrophobicContact CE2-CB 4.35Å; Y167-A177 HydrophobicContact CG-CB 4.14Å; Y167-P178 HydrophobicContact CE2-CG 4.16Å; Y167-M200 HydrophobicContact CD1-CE 4.4Å; Y167-M200 HydrophobicContact CG-CE 4.19Å; Y167-A204 HydrophobicContact CD1-CB 3.8Å; Y167-A204 HydrophobicContact CE1-CB 3.38Å
168	K	90.8	Very high	92.8	Very high	152 Å²	152	40.2 Å²	40.2	66%	0.661	20%	0.201	S	C	*	.	H	α-helix	trans	-63.3	-38.3	179.8	-176.8	179.2	176.9	-178.9	0	112.9	F164 T165 I166	F164-K168 WeakPolarHBondContact O-CB 3.47Å; F164-K168 PolarHBondContact O-N 2.77Å; T165-K168 PolarHBondContact O-N 3.19Å; I166-K168 VanDerWaalsContact C-N 3.31Å; I166-K168 PolarHBondContact O-N 3.45Å
169	N	89.9	Confident	92.7	Very high	82 Å²	82	45.4 Å²	45.4	44%	0.439	23%	0.225	S	C	.	.	H	α-helix	trans	-96.6	-29.6	-175.2	-63.9	-16.7	0	0	0	113.1	T165 I166 Y167	T165-N169 PolarHBondContact O-N 3.22Å; T165-N169 VanDerWaalsContact O-N 3.13Å; T165-N169 PolarHBondContact O-ND2 3.04Å; I166-N169 PolarHBondContact O-N 3.35Å; Y167-N169 VanDerWaalsContact C-N 3.34Å; Y167-N169 PolarHBondContact O-N 2.88Å
170	F	90.9	Very high	92.5	Very high	26 Å²	26	47.3 Å²	47.3	11%	0.114	24%	0.235	C	C	.	.			trans	-145.7	61.1	-169	-45	-63.9	0	0	0	110.5	K132 P134 I137 I166 F172 L173	K132-F170 WeakPolarHBondContact O-CZ 3.22Å; P134-F170 HydrophobicContact CB-CD1 3.86Å; P134-F170 HydrophobicContact CB-CE1 4.09Å; P134-F170 HydrophobicContact CB-CG 4.27Å; P134-F170 HydrophobicContact CG-CD1 4.31Å; P134-F170 HydrophobicContact CG-CE1 4.2Å; I137-F170 HydrophobicContact CD1-CD2 3.75Å; I137-F170 HydrophobicContact CD1-CE2 3.46Å; I137-F170 VanDerWaalsContact CD1-CE2 3.46Å; I137-F170 HydrophobicContact CD1-CZ 4.44Å; I166-F170 HydrophobicContact CG2-CB 4.45Å; I166-F170 CarbonylContact O-C 3.41Å; I166-F170 VanDerWaalsContact O-CA 3.23Å; I166-F170 WeakPolarHBondContact O-CA 3.26Å; I166-F170 WeakPolarHBondContact O-CB 3.49Å; I166-F170 PolarHBondContact O-N 3.46Å; F170-F172 HydrophobicContact CB-CE1 4.15Å; F170-F172 HydrophobicContact CB-CZ 4.35Å; F170-F172 HydrophobicContact CD1-CE1 4.49Å; F170-F172 PolarHBondContact O-N 3.08Å; F170-F172 VanDerWaalsContact O-N 3.16Å; F170-L173 HydrophobicContact CB-CB 4.46Å; F170-L173 HydrophobicContact CB-CD1 3.72Å; F170-L173 HydrophobicContact CB-CG 3.98Å; F170-L173 HydrophobicContact CD2-CD1 4.43Å; F170-L173 HydrophobicContact CG-CD1 4.22Å; F170-L173 WeakPolarHBondContact O-CB 3.23Å; F170-L173 PolarHBondContact O-N 2.88Å
171	D	88.7	Confident	92.4	Very high	97 Å²	97	47.3 Å²	47.3	52%	0.519	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-49.7	-39.4	-178.2	59.4	-3.4	0	0	0	114	Y167 L173 I174 P175	Y167-D171 HydrophobicContact CD2-CB 4.47Å; Y167-D171 HydrophobicContact CE2-CB 4.41Å; Y167-D171 WeakPolarHBondContact O-CA 3.47Å; Y167-D171 PolarHBondContact O-N 3.28Å; D171-L173 PolarHBondContact O-N 3.19Å; D171-I174 CarbonylContact O-C 3.55Å; D171-I174 VanDerWaalsContact O-C 3.23Å; D171-I174 PolarHBondContact O-N 3.05Å; D171-I174 VanDerWaalsContact O-N 3.1Å; D171-P175 WeakPolarHBondContact O-CA 3.18Å; D171-P175 VanDerWaalsContact O-N 3.17Å
172	F	92.2	Very high	92.4	Very high	132 Å²	132	46.4 Å²	46.4	58%	0.579	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-63.1	-19.3	179.4	64.8	-91	0	0	0	114.6	P134 F170	P134-F172 HydrophobicContact CB-CZ 4Å; F170-F172 HydrophobicContact CB-CE1 4.15Å; F170-F172 HydrophobicContact CB-CZ 4.35Å; F170-F172 HydrophobicContact CD1-CE1 4.49Å; F170-F172 PolarHBondContact O-N 3.08Å; F170-F172 VanDerWaalsContact O-N 3.16Å
173	L	92.5	Very high	92.3	Very high	20 Å²	20	49.1 Å²	49.1	11%	0.105	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-78.8	-23.2	175.9	-66	-177.8	0	0	0	112.8	P134 I137 E138 M141 I166 F170 D171	P134-L173 HydrophobicContact CB-CD1 4.25Å; I137-L173 HydrophobicContact CB-CD1 3.95Å; I137-L173 HydrophobicContact CG2-CD1 3.79Å; E138-L173 HydrophobicContact CB-CD2 3.75Å; E138-L173 HydrophobicContact CG-CD2 3.98Å; M141-L173 HydrophobicContact CG-CB 4.43Å; M141-L173 HydrophobicContact SD-CB 4.32Å; I166-L173 HydrophobicContact CG2-CB 4.07Å; I166-L173 HydrophobicContact CG2-CD1 4.25Å; F170-L173 HydrophobicContact CB-CB 4.46Å; F170-L173 HydrophobicContact CB-CD1 3.72Å; F170-L173 HydrophobicContact CB-CG 3.98Å; F170-L173 HydrophobicContact CD2-CD1 4.43Å; F170-L173 HydrophobicContact CG-CD1 4.22Å; F170-L173 WeakPolarHBondContact O-CB 3.23Å; F170-L173 PolarHBondContact O-N 2.88Å; D171-L173 PolarHBondContact O-N 3.19Å
174	I	92.7	Very high	92.2	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	25%	0.252	C	S	.	.	S	Bend	trans	-146.8	63.1	-179.6	-161.2	179.6	0	0	0	110.8	M141 A163 I166 Y167 D171 D176 A177 L180	M141-I174 HydrophobicContact CE-CB 3.73Å; M141-I174 HydrophobicContact CE-CD1 3.93Å; M141-I174 HydrophobicContact CE-CG1 4.02Å; M141-I174 HydrophobicContact CE-CG2 4.42Å; A163-I174 HydrophobicContact CB-CD1 4.19Å; I166-I174 HydrophobicContact CG2-CG2 4.05Å; Y167-I174 HydrophobicContact CD2-CG2 4.26Å; Y167-I174 WeakPolarHBondContact CD2-O 3.38Å; D171-I174 CarbonylContact O-C 3.55Å; D171-I174 VanDerWaalsContact O-C 3.23Å; D171-I174 PolarHBondContact O-N 3.05Å; D171-I174 VanDerWaalsContact O-N 3.1Å; I174-D176 PolarHBondContact O-N 3.42Å; I174-A177 HydrophobicContact CB-CB 4.24Å; I174-A177 HydrophobicContact CD1-CB 3.81Å; I174-A177 HydrophobicContact CG1-CB 3.73Å; I174-A177 HydrophobicContact CG2-CB 3.88Å; I174-A177 WeakPolarHBondContact O-CB 3.24Å; I174-A177 PolarHBondContact O-N 3.28Å; I174-L180 HydrophobicContact CD1-CD2 4.13Å
175	P	91	Very high	91.9	Very high	86 Å²	86	48.2 Å²	48.2	56%	0.558	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-30.3	-172.9	25.7	-34.8	0	0	0	113.1	D171 A177	D171-P175 WeakPolarHBondContact O-CA 3.18Å; D171-P175 VanDerWaalsContact O-N 3.17Å; P175-A177 VanDerWaalsContact C-N 3.28Å; P175-A177 PolarHBondContact O-N 2.86Å
176	D	92.9	Very high	91.7	Very high	58 Å²	58	52.4 Å²	52.4	31%	0.31	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	13.5	177.4	61.5	-42	0	0	0	113.6	R145 I174 P178 E179 L180	R145-D176 IonicContact CZ-OD1 2.68Å; R145-D176 IonicContact CZ-OD2 2.79Å; R145-D176 IonicContact NH1-OD1 3.86Å; R145-D176 IonicContact NH1-OD2 2.86Å; R145-D176 PolarHBondContact NH1-OD2 3.46Å; R145-D176 IonicContact NH2-OD1 2.67Å; R145-D176 PolarHBondContact NH2-OD1 2.98Å; R145-D176 IonicContact NH2-OD2 3.6Å; R145-D176 PolarHBondContact NH2-OD2 3.24Å; I174-D176 PolarHBondContact O-N 3.42Å; D176-P178 VanDerWaalsContact C-CD 3.49Å; D176-E179 WeakPolarHBondContact CA-OE2 3.39Å; D176-E179 PolarHBondContact O-N 2.93Å; D176-L180 VanDerWaalsContact O-CB 3.26Å; D176-L180 WeakPolarHBondContact O-CB 3.29Å; D176-L180 PolarHBondContact O-N 3.42Å
177	A	92.9	Very high	91.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.5	-39.5	-178	0	0	0	0	0	113.8	Y167 I174 P175 L180 M181 M200	Y167-A177 HydrophobicContact CD2-CB 3.68Å; Y167-A177 HydrophobicContact CE2-CB 4.35Å; Y167-A177 HydrophobicContact CG-CB 4.14Å; I174-A177 HydrophobicContact CB-CB 4.24Å; I174-A177 HydrophobicContact CD1-CB 3.81Å; I174-A177 HydrophobicContact CG1-CB 3.73Å; I174-A177 HydrophobicContact CG2-CB 3.88Å; I174-A177 WeakPolarHBondContact O-CB 3.24Å; I174-A177 PolarHBondContact O-N 3.28Å; P175-A177 VanDerWaalsContact C-N 3.28Å; P175-A177 PolarHBondContact O-N 2.86Å; A177-L180 PolarHBondContact O-N 3.3Å; A177-M181 WeakPolarHBondContact O-CG 3.49Å; A177-M181 PolarHBondContact O-N 3.06Å; A177-M200 HydrophobicContact CB-CE 3.27Å
178	P	93	Very high	91.2	Very high	6 Å²	6	54.7 Å²	54.7	4%	0.039	28%	0.282	C	S	.	.	H	α-helix	trans	-60.1	-48.4	175.3	-23.6	35.3	0	0	0	112.5	Y167 D176 L180 M181 H182 L201 A204 D205 L208	Y167-P178 HydrophobicContact CE2-CG 4.16Å; D176-P178 VanDerWaalsContact C-CD 3.49Å; P178-L180 VanDerWaalsContact C-N 3.33Å; P178-L180 PolarHBondContact O-N 2.8Å; P178-M181 PolarHBondContact O-N 2.85Å; P178-H182 PolarHBondContact O-N 3.49Å; P178-L201 HydrophobicContact CB-CD2 4.19Å; P178-L201 WeakPolarHBondContact O-CD2 3.32Å; P178-A204 HydrophobicContact CG-CB 4.19Å; P178-D205 HydrophobicContact CB-CB 4.1Å; P178-L208 HydrophobicContact CB-CD1 3.81Å
179	E	93.5	Very high	91	Very high	111 Å²	111	54.4 Å²	54.4	52%	0.519	28%	0.283	S	S	.	.	H	α-helix	trans	-64.3	-39.3	178.7	-62.9	83.6	174.1	0	0	111.7	D176 H182 S183	D176-E179 WeakPolarHBondContact CA-OE2 3.39Å; D176-E179 PolarHBondContact O-N 2.93Å; E179-H182 PolarHBondContact O-N 2.65Å; E179-S183 PolarHBondContact O-N 3.44Å; E179-S183 PolarHBondContact O-OG 3.13Å; E179-S183 VanDerWaalsContact O-OG 3.1Å
180	L	92.7	Very high	90.9	Very high	40 Å²	40	52.8 Å²	52.8	21%	0.209	27%	0.274	C	S	.	.	H	α-helix	trans	-60.6	-43.5	173.8	-171.4	82	0	0	0	111.5	L148 I174 D176 A177 P178 S183 F184	L148-L180 HydrophobicContact CD1-CD2 3.45Å; L148-L180 VanDerWaalsContact CD1-CD2 3.45Å; L148-L180 HydrophobicContact CD1-CG 4.17Å; I174-L180 HydrophobicContact CD1-CD2 4.13Å; D176-L180 VanDerWaalsContact O-CB 3.26Å; D176-L180 WeakPolarHBondContact O-CB 3.29Å; D176-L180 PolarHBondContact O-N 3.42Å; A177-L180 PolarHBondContact O-N 3.3Å; P178-L180 VanDerWaalsContact C-N 3.33Å; P178-L180 PolarHBondContact O-N 2.8Å; L180-S183 PolarHBondContact O-OG 2.79Å; L180-F184 VanDerWaalsContact O-CB 3.27Å; L180-F184 WeakPolarHBondContact O-CB 3.36Å; L180-F184 PolarHBondContact O-N 3.27Å
181	M	94	Very high	90.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-72.2	-33.3	178.1	-73.2	-50.4	99.7	0	0	112.9	L148 V160 A177 P178 F184 L185 A197 M200 L201	L148-M181 HydrophobicContact CD1-CE 3.84Å; L148-M181 HydrophobicContact CD2-CE 4.06Å; V160-M181 HydrophobicContact CB-SD 4.35Å; V160-M181 HydrophobicContact CG1-SD 3.81Å; V160-M181 HydrophobicContact CG2-SD 3.96Å; A177-M181 WeakPolarHBondContact O-CG 3.49Å; A177-M181 PolarHBondContact O-N 3.06Å; P178-M181 PolarHBondContact O-N 2.85Å; M181-F184 WeakPolarHBondContact O-CB 3.36Å; M181-F184 PolarHBondContact O-N 3.38Å; M181-L185 WeakPolarHBondContact O-CG 3.42Å; M181-L185 PolarHBondContact O-N 3.16Å; M181-A197 HydrophobicContact SD-CB 4.06Å; M181-M200 HydrophobicContact CB-SD 4.43Å; M181-M200 HydrophobicContact CG-CB 4.41Å; M181-M200 HydrophobicContact CG-CE 3.91Å; M181-M200 HydrophobicContact CG-CG 4.26Å; M181-M200 HydrophobicContact CG-SD 3.22Å; M181-M200 WeakPolarHBondContact CG-SD 3.48Å; M181-M200 HydrophobicContact SD-SD 4.06Å; M181-L201 HydrophobicContact CB-CD1 4.5Å; M181-L201 HydrophobicContact CB-CD2 3.84Å; M181-L201 HydrophobicContact CB-CG 3.89Å
182	H	91.2	Very high	90.5	Very high	34 Å²	34	52.1 Å²	52.1	16%	0.157	28%	0.28	C	S	.	.	H	α-helix	trans	-61.7	-51	174.7	-174.2	-79.6	0	0	0	110.9	P178 E179 F184 L185 E186 L201	P178-H182 PolarHBondContact O-N 3.49Å; E179-H182 PolarHBondContact O-N 2.65Å; H182-F184 VanDerWaalsContact C-N 3.3Å; H182-F184 PolarHBondContact O-N 3.46Å; H182-L185 WeakPolarHBondContact O-CB 3.41Å; H182-L185 PolarHBondContact O-N 3.1Å; H182-L185 VanDerWaalsContact O-N 3.15Å; H182-E186 IonicContact CE1-OE1 3.91Å; H182-E186 PolarHBondContact CE1-OE1 2.69Å; H182-E186 VanDerWaalsContact CE1-OE1 3.24Å; H182-E186 IonicContact ND1-OE1 3.79Å; H182-E186 PolarHBondContact O-N 3.49Å; H182-L201 HydrophobicContact CB-CD1 4.34Å
183	S	91.5	Very high	90.4	Very high	58 Å²	58	45.8 Å²	45.8	41%	0.406	25%	0.252	S	S	.	.	H	α-helix	trans	-63.1	-34.4	175.3	56.5	0	0	0	0	113.1	E179 L180 E186 T187	E179-S183 PolarHBondContact O-N 3.44Å; E179-S183 PolarHBondContact O-OG 3.13Å; E179-S183 VanDerWaalsContact O-OG 3.1Å; L180-S183 PolarHBondContact O-OG 2.79Å; S183-E186 PolarHBondContact O-N 3.29Å; S183-T187 PolarHBondContact O-OG1 3.06Å
184	F	92.3	Very high	90.2	Very high	16 Å²	16	45.8 Å²	45.8	7%	0.07	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-41.7	172.5	-177.7	-91.7	0	0	0	112.2	L148 R156 V160 L180 M181 H182 E186 T187 E188 C193 A197	L148-F184 HydrophobicContact CB-CD2 4.44Å; L148-F184 HydrophobicContact CB-CE2 4.43Å; L148-F184 HydrophobicContact CD2-CE2 4.49Å; L148-F184 WeakPolarHBondContact O-CE2 3.49Å; R156-F184 HydrophobicContact CB-CE2 4.41Å; R156-F184 HydrophobicContact CB-CZ 4.16Å; V160-F184 HydrophobicContact CG2-CD1 4.26Å; V160-F184 HydrophobicContact CG2-CE1 3.8Å; V160-F184 HydrophobicContact CG2-CZ 3.98Å; L180-F184 VanDerWaalsContact O-CB 3.27Å; L180-F184 WeakPolarHBondContact O-CB 3.36Å; L180-F184 PolarHBondContact O-N 3.27Å; M181-F184 WeakPolarHBondContact O-CB 3.36Å; M181-F184 PolarHBondContact O-N 3.38Å; H182-F184 VanDerWaalsContact C-N 3.3Å; H182-F184 PolarHBondContact O-N 3.46Å; F184-E186 VanDerWaalsContact C-N 3.34Å; F184-E186 PolarHBondContact O-N 2.94Å; F184-T187 PolarHBondContact O-N 3.22Å; F184-T187 PolarHBondContact O-OG1 3.23Å; F184-E188 HydrophobicContact CD1-CB 4.23Å; F184-E188 HydrophobicContact CE1-CB 3.9Å; F184-E188 HydrophobicContact CE1-CG 3.82Å; F184-E188 HydrophobicContact CZ-CB 4.16Å; F184-E188 HydrophobicContact CZ-CG 3.94Å; F184-E188 WeakPolarHBondContact CZ-OE2 3.41Å; F184-E188 WeakPolarHBondContact O-CB 3.14Å; F184-E188 PolarHBondContact O-N 3.38Å; F184-C193 HydrophobicContact CE1-CB 4Å; F184-C193 HydrophobicContact CZ-CB 4.03Å; F184-A197 HydrophobicContact CD1-CB 3.7Å; F184-A197 HydrophobicContact CE1-CB 4.09Å
185	L	89.1	Confident	90	Very high	1 Å²	1	49 Å²	49	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-67.2	-30.5	179.4	-80.6	178.6	0	0	0	114.3	M181 H182 T187 K194 A197 F198 L201 Y212	M181-L185 WeakPolarHBondContact O-CG 3.42Å; M181-L185 PolarHBondContact O-N 3.16Å; H182-L185 WeakPolarHBondContact O-CB 3.41Å; H182-L185 PolarHBondContact O-N 3.1Å; H182-L185 VanDerWaalsContact O-N 3.15Å; L185-T187 VanDerWaalsContact C-N 3.32Å; L185-K194 HydrophobicContact CD2-CB 4.06Å; L185-K194 HydrophobicContact CD2-CG 4.14Å; L185-K194 WeakPolarHBondContact CD2-O 3.27Å; L185-A197 HydrophobicContact CD2-CB 3.66Å; L185-A197 HydrophobicContact CG-CB 3.83Å; L185-F198 HydrophobicContact CD1-CB 4.26Å; L185-F198 HydrophobicContact CD1-CD2 4.18Å; L185-F198 HydrophobicContact CD2-CB 4.4Å; L185-L201 HydrophobicContact CD1-CD1 3.39Å; L185-L201 HydrophobicContact CD1-CG 4.4Å; L185-Y212 HydrophobicContact CB-CD2 3.97Å; L185-Y212 HydrophobicContact CB-CE1 4.36Å; L185-Y212 HydrophobicContact CB-CE2 3.56Å; L185-Y212 HydrophobicContact CD1-CD1 3.97Å; L185-Y212 HydrophobicContact CD1-CD2 4.37Å; L185-Y212 HydrophobicContact CD1-CE1 4.08Å; L185-Y212 HydrophobicContact CD1-CE2 4.48Å; L185-Y212 HydrophobicContact CD1-CG 4.11Å; L185-Y212 PolarHBondContact O-OH 3Å; L185-Y212 VanDerWaalsContact O-OH 3.11Å
186	E	87.1	Confident	89.9	Confident	121 Å²	121	45.3 Å²	45.3	57%	0.565	24%	0.239	S	C	*	.	H	α-helix	trans	-69	-32.1	176.8	-69.8	179.8	156.4	0	0	112.2	H182 S183 F184	H182-E186 IonicContact CE1-OE1 3.91Å; H182-E186 PolarHBondContact CE1-OE1 2.69Å; H182-E186 VanDerWaalsContact CE1-OE1 3.24Å; H182-E186 IonicContact ND1-OE1 3.79Å; H182-E186 PolarHBondContact O-N 3.49Å; S183-E186 PolarHBondContact O-N 3.29Å; F184-E186 VanDerWaalsContact C-N 3.34Å; F184-E186 PolarHBondContact O-N 2.94Å
187	T	87.7	Confident	89.8	Confident	104 Å²	104	42.5 Å²	42.5	64%	0.638	22%	0.224	S	C	*	.	H	α-helix	trans	-100.2	-33.1	-173.2	55.1	0	0	0	0	113.8	S183 F184 L185	S183-T187 PolarHBondContact O-OG1 3.06Å; F184-T187 PolarHBondContact O-N 3.22Å; F184-T187 PolarHBondContact O-OG1 3.23Å; L185-T187 VanDerWaalsContact C-N 3.32Å
188	E	89.2	Confident	89.6	Confident	3 Å²	3	42.7 Å²	42.7	1%	0.014	23%	0.225	C	C	.	.			trans	-63.8	151.1	-176.7	-177	57.1	-91.3	0	0	112	R156 F184 D190 C193 K194	R156-E188 VanDerWaalsContact CZ-CD 3.44Å; R156-E188 IonicContact CZ-OE1 2.73Å; R156-E188 VanDerWaalsContact CZ-OE1 3.26Å; R156-E188 IonicContact CZ-OE2 3.3Å; R156-E188 IonicContact NE-OE2 2.82Å; R156-E188 PolarHBondContact NE-OE2 2.9Å; R156-E188 IonicContact NH1-OE1 3.63Å; R156-E188 PolarHBondContact NH1-OE1 2.81Å; R156-E188 IonicContact NH1-OE2 3.58Å; R156-E188 PolarHBondContact NH1-OE2 2.98Å; R156-E188 VanDerWaalsContact NH2-CD 3.31Å; R156-E188 IonicContact NH2-OE1 3.65Å; R156-E188 PolarHBondContact NH2-OE1 2.89Å; R156-E188 IonicContact NH2-OE2 3.91Å; R156-E188 PolarHBondContact NH2-OE2 2.88Å; R156-E188 VanDerWaalsContact NH2-OE2 3.09Å; F184-E188 HydrophobicContact CD1-CB 4.23Å; F184-E188 HydrophobicContact CE1-CB 3.9Å; F184-E188 HydrophobicContact CE1-CG 3.82Å; F184-E188 HydrophobicContact CZ-CB 4.16Å; F184-E188 HydrophobicContact CZ-CG 3.94Å; F184-E188 WeakPolarHBondContact CZ-OE2 3.41Å; F184-E188 WeakPolarHBondContact O-CB 3.14Å; F184-E188 PolarHBondContact O-N 3.38Å; E188-D190 PolarHBondContact OE1-N 2.81Å; E188-C193 HydrophobicContact CG-CB 3.61Å; E188-K194 VanDerWaalsContact C-CE 3.45Å; E188-K194 HydrophobicContact CB-CG 4.33Å; E188-K194 HydrophobicContact CG-CG 4.12Å; E188-K194 WeakPolarHBondContact O-CE 3.12Å; E188-K194 PolarHBondContact O-NZ 3.06Å
189	Q	85.8	Confident	89.4	Confident	147 Å²	147	44.9 Å²	44.9	69%	0.687	24%	0.236	S	C	*	.			trans	-120	-27.4	176.9	-60	-58.8	-25.3	0	0	112.4	S191	Q189-S191 PolarHBondContact O-N 2.84Å
190	D	88.5	Confident	89.2	Confident	47 Å²	47	39.6 Å²	39.6	25%	0.251	21%	0.211	S	C	.	.			trans	-69.3	126.5	-179.4	-179.3	99.7	0	0	0	112	S153 E188 S192 C193 K194	S153-D190 WeakPolarHBondContact CB-OD1 3.47Å; S153-D190 PolarHBondContact OG-OD1 2.99Å; E188-D190 PolarHBondContact OE1-N 2.81Å; D190-S192 VanDerWaalsContact C-N 3.34Å; D190-S192 PolarHBondContact O-N 3.24Å; D190-S192 WeakPolarHBondContact OD2-CA 3.44Å; D190-S192 WeakPolarHBondContact OD2-CB 3.46Å; D190-S192 PolarHBondContact OD2-N 2.7Å; D190-C193 HydrophobicContact CB-CB 4.13Å; D190-C193 PolarHBondContact O-N 3.44Å; D190-C193 PolarHBondContact OD2-N 3.06Å; D190-C193 PolarHBondContact OD2-SG 3.35Å; D190-K194 PolarHBondContact O-N 3.26Å
191	S	84.5	Confident	89	Confident	58 Å²	58	37.7 Å²	37.7	41%	0.406	20%	0.201	S	C	.	.	H	α-helix	trans	-63.9	-35.2	-175.1	-46.2	0	0	0	0	113.4	Q189 R195	Q189-S191 PolarHBondContact O-N 2.84Å; S191-R195 WeakPolarHBondContact O-CB 3.44Å; S191-R195 PolarHBondContact O-N 3.1Å
192	S	86.6	Confident	88.6	Confident	51 Å²	51	39.6 Å²	39.6	36%	0.357	21%	0.211	S	C	.	.	H	α-helix	trans	-72.3	-37.2	179.8	-65.6	0	0	0	0	111.8	D190 N196	D190-S192 VanDerWaalsContact C-N 3.34Å; D190-S192 PolarHBondContact O-N 3.24Å; D190-S192 WeakPolarHBondContact OD2-CA 3.44Å; D190-S192 WeakPolarHBondContact OD2-CB 3.46Å; D190-S192 PolarHBondContact OD2-N 2.7Å; S192-N196 PolarHBondContact O-N 3.24Å
193	C	90.1	Very high	88.3	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.9	-47.5	175	-60.8	0	0	0	0	110.7	S153 F184 E188 D190 R195 N196 A197	S153-C193 PolarHBondContact O-SG 2.88Å; F184-C193 HydrophobicContact CE1-CB 4Å; F184-C193 HydrophobicContact CZ-CB 4.03Å; E188-C193 HydrophobicContact CG-CB 3.61Å; D190-C193 HydrophobicContact CB-CB 4.13Å; D190-C193 PolarHBondContact O-N 3.44Å; D190-C193 PolarHBondContact OD2-N 3.06Å; D190-C193 PolarHBondContact OD2-SG 3.35Å; C193-R195 VanDerWaalsContact C-N 3.31Å; C193-R195 PolarHBondContact O-N 3.05Å; C193-N196 PolarHBondContact O-N 3.29Å; C193-A197 PolarHBondContact O-N 2.86Å
194	K	88.7	Confident	88.1	Confident	20 Å²	20	42.2 Å²	42.2	9%	0.087	22%	0.221	C	C	.	.	H	α-helix	trans	-55.8	-45.5	174.1	-74.6	-171.8	178.8	-178.4	0	112.3	L185 E188 D190 N196 A197 F198 L234	L185-K194 HydrophobicContact CD2-CB 4.06Å; L185-K194 HydrophobicContact CD2-CG 4.14Å; L185-K194 WeakPolarHBondContact CD2-O 3.27Å; E188-K194 VanDerWaalsContact C-CE 3.45Å; E188-K194 HydrophobicContact CB-CG 4.33Å; E188-K194 HydrophobicContact CG-CG 4.12Å; E188-K194 WeakPolarHBondContact O-CE 3.12Å; E188-K194 PolarHBondContact O-NZ 3.06Å; D190-K194 PolarHBondContact O-N 3.26Å; K194-N196 PolarHBondContact O-N 2.93Å; K194-A197 PolarHBondContact O-N 3.49Å; K194-F198 VanDerWaalsContact O-CB 3.25Å; K194-F198 WeakPolarHBondContact O-CB 3.44Å; K194-F198 PolarHBondContact O-N 3.1Å; K194-L234 HydrophobicContact CB-CD2 4.22Å
195	R	86.9	Confident	87.9	Confident	67 Å²	67	43.9 Å²	43.9	25%	0.253	23%	0.231	S	C	.	.	H	α-helix	trans	-55.4	-49.9	177	179.4	-88.9	-175.5	-167.4	-5.5	112.1	S191 C193 M199 I233 I237	S191-R195 WeakPolarHBondContact O-CB 3.44Å; S191-R195 PolarHBondContact O-N 3.1Å; C193-R195 VanDerWaalsContact C-N 3.31Å; C193-R195 PolarHBondContact O-N 3.05Å; R195-M199 VanDerWaalsContact CZ-SD 3.53Å; R195-M199 PolarHBondContact NH1-SD 3.32Å; R195-M199 PolarHBondContact NH2-SD 3.09Å; R195-M199 VanDerWaalsContact NH2-SD 3.44Å; R195-M199 VanDerWaalsContact O-CB 3.28Å; R195-M199 WeakPolarHBondContact O-CB 3.38Å; R195-M199 PolarHBondContact O-N 2.72Å; R195-I233 HydrophobicContact CG-CG2 4.05Å; R195-I237 HydrophobicContact CG-CD1 3.57Å
196	N	89.7	Confident	87.7	Confident	9 Å²	9	49.3 Å²	49.3	5%	0.048	25%	0.251	C	S	.	.	H	α-helix	trans	-68.2	-37.6	-178.1	-73.7	-5.4	0	0	0	112	R157 V160 L161 S192 C193 K194 M199 M200	R157-N196 WeakPolarHBondContact CG-ND2 3.29Å; R157-N196 PolarHBondContact O-ND2 3.02Å; R157-N196 VanDerWaalsContact O-ND2 3.16Å; V160-N196 HydrophobicContact CB-CB 4.21Å; V160-N196 VanDerWaalsContact CG1-C 3.45Å; V160-N196 HydrophobicContact CG1-CB 3.68Å; L161-N196 WeakPolarHBondContact CD1-ND2 3.23Å; L161-N196 HydrophobicContact CD2-CB 4.33Å; L161-N196 HydrophobicContact CG-CB 4.5Å; L161-N196 VanDerWaalsContact CG-ND2 3.27Å; L161-N196 WeakPolarHBondContact CG-ND2 3.46Å; S192-N196 PolarHBondContact O-N 3.24Å; C193-N196 PolarHBondContact O-N 3.29Å; K194-N196 PolarHBondContact O-N 2.93Å; N196-M199 PolarHBondContact O-N 3.47Å; N196-M200 PolarHBondContact O-N 2.89Å
197	A	91.1	Very high	87.7	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-70.5	-41.6	-179.5	0	0	0	0	0	110.9	V160 M181 F184 L185 C193 K194 M200 L201	V160-A197 HydrophobicContact CG1-CB 3.98Å; V160-A197 HydrophobicContact CG2-CB 4.45Å; M181-A197 HydrophobicContact SD-CB 4.06Å; F184-A197 HydrophobicContact CD1-CB 3.7Å; F184-A197 HydrophobicContact CE1-CB 4.09Å; L185-A197 HydrophobicContact CD2-CB 3.66Å; L185-A197 HydrophobicContact CG-CB 3.83Å; C193-A197 PolarHBondContact O-N 2.86Å; K194-A197 PolarHBondContact O-N 3.49Å; A197-M200 PolarHBondContact O-N 2.96Å; A197-L201 PolarHBondContact O-N 3.1Å
198	F	89.5	Confident	87.6	Confident	3 Å²	3	49.8 Å²	49.8	1%	0.013	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-41.7	173.6	-170	-103.1	0	0	0	112	L185 K194 M200 L201 L202 A209 Y212 L213 L234 I237 I238 L241	L185-F198 HydrophobicContact CD1-CB 4.26Å; L185-F198 HydrophobicContact CD1-CD2 4.18Å; L185-F198 HydrophobicContact CD2-CB 4.4Å; K194-F198 VanDerWaalsContact O-CB 3.25Å; K194-F198 WeakPolarHBondContact O-CB 3.44Å; K194-F198 PolarHBondContact O-N 3.1Å; F198-M200 VanDerWaalsContact C-N 3.33Å; F198-M200 PolarHBondContact O-N 3.28Å; F198-L201 PolarHBondContact O-N 2.95Å; F198-L202 WeakPolarHBondContact O-CB 3.17Å; F198-L202 PolarHBondContact O-N 3.39Å; F198-A209 HydrophobicContact CE2-CB 4.28Å; F198-Y212 AromaticContact CD2-CD1 3.95Å; F198-Y212 HydrophobicContact CD2-CD1 3.95Å; F198-Y212 HydrophobicContact CD2-CE1 4.38Å; F198-Y212 HydrophobicContact CE2-CD1 4.05Å; F198-L213 HydrophobicContact CE2-CB 4.47Å; F198-L234 HydrophobicContact CB-CD1 4.18Å; F198-L234 HydrophobicContact CD1-CD1 3.97Å; F198-L234 HydrophobicContact CG-CD1 4.21Å; F198-I237 HydrophobicContact CD1-CG2 4.13Å; F198-I237 HydrophobicContact CE1-CG2 4.29Å; F198-I238 HydrophobicContact CD1-CG1 4.49Å; F198-I238 HydrophobicContact CE1-CG1 3.83Å; F198-I238 HydrophobicContact CZ-CG1 4.14Å; F198-L241 HydrophobicContact CE1-CD2 3.72Å; F198-L241 HydrophobicContact CZ-CD2 3.48Å; F198-L241 VanDerWaalsContact CZ-CD2 3.48Å
199	M	86.8	Confident	87.5	Confident	53 Å²	53	49.6 Å²	49.6	26%	0.261	24%	0.238	S	C	.	.	H	α-helix	trans	-62.7	-40.3	175.2	-168.2	-178	-162.7	0	0	111.8	R195 N196 L202 H203	R195-M199 VanDerWaalsContact CZ-SD 3.53Å; R195-M199 PolarHBondContact NH1-SD 3.32Å; R195-M199 PolarHBondContact NH2-SD 3.09Å; R195-M199 VanDerWaalsContact NH2-SD 3.44Å; R195-M199 VanDerWaalsContact O-CB 3.28Å; R195-M199 WeakPolarHBondContact O-CB 3.38Å; R195-M199 PolarHBondContact O-N 2.72Å; N196-M199 PolarHBondContact O-N 3.47Å; M199-L202 PolarHBondContact O-N 3.4Å; M199-H203 PolarHBondContact O-CD2 2.87Å; M199-H203 PolarHBondContact O-N 2.89Å
200	M	89.3	Confident	87.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.2	-52.8	173.3	-179.9	-170.5	151.9	0	0	110.8	F164 Y167 A177 M181 N196 A197 F198 L202 H203 A204	F164-M200 HydrophobicContact CB-CB 3.89Å; F164-M200 HydrophobicContact CB-CG 3.69Å; F164-M200 HydrophobicContact CB-SD 4.02Å; F164-M200 HydrophobicContact CD2-CB 4.07Å; F164-M200 HydrophobicContact CD2-CG 3.6Å; F164-M200 HydrophobicContact CE2-CG 4.48Å; F164-M200 HydrophobicContact CG-CB 3.94Å; F164-M200 HydrophobicContact CG-CG 3.82Å; Y167-M200 HydrophobicContact CD1-CE 4.4Å; Y167-M200 HydrophobicContact CG-CE 4.19Å; A177-M200 HydrophobicContact CB-CE 3.27Å; M181-M200 HydrophobicContact CB-SD 4.43Å; M181-M200 HydrophobicContact CG-CB 4.41Å; M181-M200 HydrophobicContact CG-CE 3.91Å; M181-M200 HydrophobicContact CG-CG 4.26Å; M181-M200 HydrophobicContact CG-SD 3.22Å; M181-M200 WeakPolarHBondContact CG-SD 3.48Å; M181-M200 HydrophobicContact SD-SD 4.06Å; N196-M200 PolarHBondContact O-N 2.89Å; A197-M200 PolarHBondContact O-N 2.96Å; F198-M200 VanDerWaalsContact C-N 3.33Å; F198-M200 PolarHBondContact O-N 3.28Å; M200-L202 PolarHBondContact O-N 2.84Å; M200-H203 PolarHBondContact O-N 2.77Å; M200-A204 HydrophobicContact CE-CB 4.18Å; M200-A204 HydrophobicContact CG-CB 4.48Å; M200-A204 VanDerWaalsContact O-CB 3.3Å; M200-A204 WeakPolarHBondContact O-CB 3.47Å; M200-A204 PolarHBondContact O-N 3.21Å
201	L	89.4	Confident	87.2	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-55.7	-42.5	179.5	-77.2	-176.5	0	0	0	111.2	P178 M181 H182 L185 A197 F198 H203 A204 D205 L208 A209	P178-L201 HydrophobicContact CB-CD2 4.19Å; P178-L201 WeakPolarHBondContact O-CD2 3.32Å; M181-L201 HydrophobicContact CB-CD1 4.5Å; M181-L201 HydrophobicContact CB-CD2 3.84Å; M181-L201 HydrophobicContact CB-CG 3.89Å; H182-L201 HydrophobicContact CB-CD1 4.34Å; L185-L201 HydrophobicContact CD1-CD1 3.39Å; L185-L201 HydrophobicContact CD1-CG 4.4Å; A197-L201 PolarHBondContact O-N 3.1Å; F198-L201 PolarHBondContact O-N 2.95Å; L201-H203 VanDerWaalsContact C-N 3.26Å; L201-H203 PolarHBondContact O-N 3.45Å; L201-A204 PolarHBondContact O-N 2.86Å; L201-D205 CarbonylContact O-C 3.53Å; L201-D205 WeakPolarHBondContact O-CA 3.34Å; L201-D205 PolarHBondContact O-N 3.39Å; L201-L208 HydrophobicContact CD2-CB 4.37Å; L201-A209 HydrophobicContact CB-CB 3.94Å
202	L	85.8	Confident	87.2	Confident	40 Å²	40	43 Å²	43	21%	0.209	20%	0.201	C	C	.	.	H	α-helix	trans	-55.5	-42	177.6	174.5	55.4	0	0	0	112.6	F198 M199 M200 R206 I237 L241	F198-L202 WeakPolarHBondContact O-CB 3.17Å; F198-L202 PolarHBondContact O-N 3.39Å; M199-L202 PolarHBondContact O-N 3.4Å; M200-L202 PolarHBondContact O-N 2.84Å; L202-R206 HydrophobicContact CD1-CG 4.25Å; L202-I237 HydrophobicContact CD2-CG2 4.46Å; L202-L241 HydrophobicContact CD1-CD1 3.14Å; L202-L241 HydrophobicContact CD1-CD2 3.99Å; L202-L241 HydrophobicContact CD1-CG 4.09Å; L202-L241 HydrophobicContact CD2-CB 4.44Å; L202-L241 HydrophobicContact CD2-CD1 4.28Å; L202-L241 HydrophobicContact CG-CD1 4.33Å
203	H	84.7	Confident	87.1	Confident	120 Å²	120	40.7 Å²	40.7	56%	0.556	19%	0.185	S	C	*	.	H	α-helix	trans	-82.7	-31.4	179.3	-73	-64.4	0	0	0	113.9	F164 M199 M200 L201	F164-H203 HydrophobicContact CE2-CB 3.69Å; F164-H203 HydrophobicContact CZ-CB 3.75Å; F164-H203 AromaticContact CZ-CD2 3.52Å; F164-H203 AromaticContact CZ-CG 3.82Å; M199-H203 PolarHBondContact O-CD2 2.87Å; M199-H203 PolarHBondContact O-N 2.89Å; M200-H203 PolarHBondContact O-N 2.77Å; L201-H203 VanDerWaalsContact C-N 3.26Å; L201-H203 PolarHBondContact O-N 3.45Å
204	A	86.9	Confident	86.6	Confident	26 Å²	26	40.9 Å²	40.9	22%	0.215	19%	0.186	C	C	.	.	H	α-helix	trans	-87.9	-52	-175.6	0	0	0	0	0	112.5	Y167 P178 M200 L201	Y167-A204 HydrophobicContact CD1-CB 3.8Å; Y167-A204 HydrophobicContact CE1-CB 3.38Å; P178-A204 HydrophobicContact CG-CB 4.19Å; M200-A204 HydrophobicContact CE-CB 4.18Å; M200-A204 HydrophobicContact CG-CB 4.48Å; M200-A204 VanDerWaalsContact O-CB 3.3Å; M200-A204 WeakPolarHBondContact O-CB 3.47Å; M200-A204 PolarHBondContact O-N 3.21Å; L201-A204 PolarHBondContact O-N 2.86Å
205	D	87.5	Confident	86.3	Confident	52 Å²	52	42.4 Å²	42.4	28%	0.278	20%	0.197	S	C	.	.			trans	-144.1	95.7	176.9	-169.9	-16.5	0	0	0	111.4	P178 L201 R207 L208 A209	P178-D205 HydrophobicContact CB-CB 4.1Å; L201-D205 CarbonylContact O-C 3.53Å; L201-D205 WeakPolarHBondContact O-CA 3.34Å; L201-D205 PolarHBondContact O-N 3.39Å; D205-R207 PolarHBondContact O-N 2.75Å; D205-R207 WeakPolarHBondContact OD1-CB 3.47Å; D205-R207 PolarHBondContact OD1-N 2.91Å; D205-L208 HydrophobicContact CB-CB 4.35Å; D205-L208 HydrophobicContact CB-CD1 4.16Å; D205-L208 HydrophobicContact CB-CG 4.4Å; D205-L208 PolarHBondContact O-N 2.94Å; D205-L208 PolarHBondContact OD1-N 3.1Å; D205-A209 PolarHBondContact O-N 2.77Å
206	R	85	Confident	85.9	Confident	115 Å²	115	39.6 Å²	39.6	43%	0.434	19%	0.188	S	C	.	.	H	α-helix	trans	-59.6	-27	178.6	-168.8	173.5	69.3	149.5	0	112.8	L202 L210	L202-R206 HydrophobicContact CD1-CG 4.25Å; R206-L210 HydrophobicContact CG-CD1 4.21Å; R206-L210 HydrophobicContact CG-CG 4.47Å; R206-L210 VanDerWaalsContact O-CG 3.23Å; R206-L210 WeakPolarHBondContact O-CG 3.21Å; R206-L210 PolarHBondContact O-N 2.92Å; R206-L210 VanDerWaalsContact O-N 3.09Å
207	R	87.3	Confident	85.2	Confident	198 Å²	198	40.4 Å²	40.4	75%	0.747	19%	0.192	S	C	*	.	H	α-helix	trans	-69	-50.5	179.5	-66.7	-177	177.2	135.7	-1.9	110.6	D205 A209 L210 D211	D205-R207 PolarHBondContact O-N 2.75Å; D205-R207 WeakPolarHBondContact OD1-CB 3.47Å; D205-R207 PolarHBondContact OD1-N 2.91Å; R207-A209 VanDerWaalsContact C-N 3.27Å; R207-A209 PolarHBondContact O-N 2.82Å; R207-L210 WeakPolarHBondContact O-CB 3.41Å; R207-L210 PolarHBondContact O-N 2.84Å; R207-D211 PolarHBondContact O-N 3.45Å
208	L	86.6	Confident	84.2	Confident	36 Å²	36	46.9 Å²	46.9	19%	0.188	22%	0.222	C	C	.	.	H	α-helix	trans	-59.8	-37.6	176.1	-72.1	175.1	0	0	0	112.3	P178 L201 D205 L210 D211 Y212	P178-L208 HydrophobicContact CB-CD1 3.81Å; L201-L208 HydrophobicContact CD2-CB 4.37Å; D205-L208 HydrophobicContact CB-CB 4.35Å; D205-L208 HydrophobicContact CB-CD1 4.16Å; D205-L208 HydrophobicContact CB-CG 4.4Å; D205-L208 PolarHBondContact O-N 2.94Å; D205-L208 PolarHBondContact OD1-N 3.1Å; L208-L210 VanDerWaalsContact C-N 3.34Å; L208-L210 PolarHBondContact O-N 3.36Å; L208-D211 PolarHBondContact O-N 2.98Å; L208-Y212 PolarHBondContact O-N 3.05Å
209	A	86.1	Confident	82.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.5	-42	174	0	0	0	0	0	112.3	F198 L201 D205 R207 L213	F198-A209 HydrophobicContact CE2-CB 4.28Å; L201-A209 HydrophobicContact CB-CB 3.94Å; D205-A209 PolarHBondContact O-N 2.77Å; R207-A209 VanDerWaalsContact C-N 3.27Å; R207-A209 PolarHBondContact O-N 2.82Å; A209-L213 WeakPolarHBondContact O-CB 3.5Å; A209-L213 PolarHBondContact O-N 3.18Å
210	L	84.2	Confident	80.9	Confident	19 Å²	19	53.6 Å²	53.6	10%	0.099	26%	0.261	C	S	.	.	H	α-helix	trans	-71.1	-36.1	178	-71.5	170.5	0	0	0	112.3	R206 R207 L208 L213 S214 V245 F256	R206-L210 HydrophobicContact CG-CD1 4.21Å; R206-L210 HydrophobicContact CG-CG 4.47Å; R206-L210 VanDerWaalsContact O-CG 3.23Å; R206-L210 WeakPolarHBondContact O-CG 3.21Å; R206-L210 PolarHBondContact O-N 2.92Å; R206-L210 VanDerWaalsContact O-N 3.09Å; R207-L210 WeakPolarHBondContact O-CB 3.41Å; R207-L210 PolarHBondContact O-N 2.84Å; L208-L210 VanDerWaalsContact C-N 3.34Å; L208-L210 PolarHBondContact O-N 3.36Å; L210-L213 PolarHBondContact O-N 3.41Å; L210-S214 VanDerWaalsContact O-CB 3.29Å; L210-S214 WeakPolarHBondContact O-CB 3.29Å; L210-S214 PolarHBondContact O-N 2.95Å; L210-S214 PolarHBondContact O-OG 3.44Å; L210-V245 HydrophobicContact CD1-CG1 4.17Å; L210-V245 HydrophobicContact CD1-CG2 4.22Å; L210-V245 HydrophobicContact CD2-CG1 4.22Å; L210-V245 HydrophobicContact CD2-CG2 4.05Å; L210-F256 HydrophobicContact CD2-CE1 4.47Å; L210-F256 HydrophobicContact CD2-CE2 4.13Å; L210-F256 HydrophobicContact CD2-CZ 3.66Å
211	D	84.9	Confident	78.9	Confident	77 Å²	77	59.3 Å²	59.3	41%	0.412	30%	0.298	S	S	.	.	H	α-helix	trans	-64.7	-46.9	175.5	-69.8	-21.4	0	0	0	110.4	R207 L208 L213 S214 T215	R207-D211 PolarHBondContact O-N 3.45Å; L208-D211 PolarHBondContact O-N 2.98Å; D211-L213 PolarHBondContact O-N 2.87Å; D211-S214 WeakPolarHBondContact O-CB 3.17Å; D211-S214 PolarHBondContact O-N 3.29Å; D211-S214 VanDerWaalsContact O-N 3.11Å; D211-T215 WeakPolarHBondContact O-CG2 3.5Å; D211-T215 PolarHBondContact O-N 3.37Å
212	Y	84.2	Confident	76.8	Confident	17 Å²	17	62.8 Å²	62.8	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-58.8	-44.6	172.1	178	-98.2	0	0	0	112.6	L185 F198 L208 S214 T215 C216	L185-Y212 HydrophobicContact CB-CD2 3.97Å; L185-Y212 HydrophobicContact CB-CE1 4.36Å; L185-Y212 HydrophobicContact CB-CE2 3.56Å; L185-Y212 HydrophobicContact CD1-CD1 3.97Å; L185-Y212 HydrophobicContact CD1-CD2 4.37Å; L185-Y212 HydrophobicContact CD1-CE1 4.08Å; L185-Y212 HydrophobicContact CD1-CE2 4.48Å; L185-Y212 HydrophobicContact CD1-CG 4.11Å; L185-Y212 PolarHBondContact O-OH 3Å; L185-Y212 VanDerWaalsContact O-OH 3.11Å; F198-Y212 AromaticContact CD2-CD1 3.95Å; F198-Y212 HydrophobicContact CD2-CD1 3.95Å; F198-Y212 HydrophobicContact CD2-CE1 4.38Å; F198-Y212 HydrophobicContact CE2-CD1 4.05Å; L208-Y212 PolarHBondContact O-N 3.05Å; Y212-S214 PolarHBondContact O-N 2.94Å; Y212-T215 PolarHBondContact O-N 3.41Å; Y212-T215 PolarHBondContact O-OG1 3.23Å; Y212-C216 PolarHBondContact O-N 3.25Å; Y212-C216 VanDerWaalsContact O-N 3.11Å; Y212-C216 PolarHBondContact O-SG 3.3Å
213	L	83.4	Confident	74.8	Confident	2 Å²	2	68 Å²	68	1%	0.01	36%	0.361	C	S	.	.	H	α-helix	trans	-62.6	-35.9	177	-177.3	62.8	0	0	0	111.1	F198 A209 L210 D211 C216 I217 V227 I238 I242 F256	F198-L213 HydrophobicContact CE2-CB 4.47Å; A209-L213 WeakPolarHBondContact O-CB 3.5Å; A209-L213 PolarHBondContact O-N 3.18Å; L210-L213 PolarHBondContact O-N 3.41Å; D211-L213 PolarHBondContact O-N 2.87Å; L213-C216 WeakPolarHBondContact O-CB 3.47Å; L213-C216 PolarHBondContact O-N 3.43Å; L213-I217 HydrophobicContact CD1-CD1 4.35Å; L213-I217 HydrophobicContact CG-CD1 3.9Å; L213-I217 WeakPolarHBondContact O-CD1 3.35Å; L213-I217 VanDerWaalsContact O-CG1 3.23Å; L213-I217 WeakPolarHBondContact O-CG1 3.11Å; L213-I217 PolarHBondContact O-N 3.45Å; L213-V227 HydrophobicContact CD1-CG2 4.39Å; L213-I238 HydrophobicContact CD1-CD1 4.13Å; L213-I238 HydrophobicContact CD1-CG1 4.28Å; L213-I238 HydrophobicContact CD1-CG2 3.79Å; L213-I238 HydrophobicContact CD2-CG2 4.16Å; L213-I242 HydrophobicContact CD2-CD1 4.42Å; L213-I242 HydrophobicContact CD2-CG1 4.12Å; L213-F256 HydrophobicContact CD2-CD1 4.13Å; L213-F256 HydrophobicContact CD2-CE1 3.67Å; L213-F256 HydrophobicContact CD2-CZ 4.47Å; L213-F256 HydrophobicContact CG-CE1 4.17Å
214	S	81.5	Confident	73	Confident	5 Å²	5	66.2 Å²	66.2	4%	0.035	37%	0.367	C	S	.	.	H	α-helix	trans	-72.7	-39.3	-179.2	-59.9	0	0	0	0	112.3	L210 D211 Y212 C216 I217 E218 R255	L210-S214 VanDerWaalsContact O-CB 3.29Å; L210-S214 WeakPolarHBondContact O-CB 3.29Å; L210-S214 PolarHBondContact O-N 2.95Å; L210-S214 PolarHBondContact O-OG 3.44Å; D211-S214 WeakPolarHBondContact O-CB 3.17Å; D211-S214 PolarHBondContact O-N 3.29Å; D211-S214 VanDerWaalsContact O-N 3.11Å; Y212-S214 PolarHBondContact O-N 2.94Å; S214-C216 PolarHBondContact O-N 3.1Å; S214-I217 PolarHBondContact O-N 3.45Å; S214-E218 WeakPolarHBondContact O-CB 3.42Å; S214-E218 WeakPolarHBondContact O-CG 3.48Å; S214-E218 PolarHBondContact O-N 2.85Å; S214-R255 PolarHBondContact OG-NE 3.15Å; S214-R255 VanDerWaalsContact OG-NE 3.11Å; S214-R255 PolarHBondContact OG-NH2 3.49Å
215	T	81.6	Confident	71.5	Confident	51 Å²	51	65.8 Å²	65.8	31%	0.313	36%	0.362	S	S	.	.	H	α-helix	trans	-60.8	-38.5	171	60.1	0	0	0	0	110.8	D211 Y212 I217 Q219	D211-T215 WeakPolarHBondContact O-CG2 3.5Å; D211-T215 PolarHBondContact O-N 3.37Å; Y212-T215 PolarHBondContact O-N 3.41Å; Y212-T215 PolarHBondContact O-OG1 3.23Å; T215-I217 VanDerWaalsContact C-N 3.29Å; T215-I217 PolarHBondContact O-N 3.35Å; T215-Q219 VanDerWaalsContact O-CB 3.24Å; T215-Q219 WeakPolarHBondContact O-CB 3.43Å; T215-Q219 WeakPolarHBondContact O-CG 3.35Å; T215-Q219 PolarHBondContact O-N 3.32Å
216	C	77.9	Confident	70.5	Confident	8 Å²	8	67.5 Å²	67.5	5%	0.054	37%	0.368	C	S	.	.	H	α-helix	trans	-66.8	-25.4	174.2	-64.3	0	0	0	0	114	Y212 L213 S214 V227 F230	Y212-C216 PolarHBondContact O-N 3.25Å; Y212-C216 VanDerWaalsContact O-N 3.11Å; Y212-C216 PolarHBondContact O-SG 3.3Å; L213-C216 WeakPolarHBondContact O-CB 3.47Å; L213-C216 PolarHBondContact O-N 3.43Å; S214-C216 PolarHBondContact O-N 3.1Å; C216-V227 HydrophobicContact CB-CG2 4.39Å; C216-F230 HydrophobicContact CB-CZ 4.42Å
217	I	75.7	Confident	69.9	Low	27 Å²	27	62 Å²	62	14%	0.138	35%	0.348	C	S	.	.	H	α-helix	trans	-87.7	-39.6	178.2	-68.9	165.1	0	0	0	111.5	L213 S214 T215 V227 F256 C259	L213-I217 HydrophobicContact CD1-CD1 4.35Å; L213-I217 HydrophobicContact CG-CD1 3.9Å; L213-I217 WeakPolarHBondContact O-CD1 3.35Å; L213-I217 VanDerWaalsContact O-CG1 3.23Å; L213-I217 WeakPolarHBondContact O-CG1 3.11Å; L213-I217 PolarHBondContact O-N 3.45Å; S214-I217 PolarHBondContact O-N 3.45Å; T215-I217 VanDerWaalsContact C-N 3.29Å; T215-I217 PolarHBondContact O-N 3.35Å; I217-V227 HydrophobicContact CG1-CG2 4.31Å; I217-F256 HydrophobicContact CD1-CD1 3.67Å; I217-F256 HydrophobicContact CD1-CE1 3.82Å; I217-C259 HydrophobicContact CD1-CB 3.99Å; I217-C259 HydrophobicContact CG1-CB 4.26Å
218	E	70.2	Confident	69.2	Low	136 Å²	136	54.7 Å²	54.7	64%	0.636	33%	0.325	S	S	*	.	H	α-helix	trans	-83.2	-31.5	-174.1	-72.4	177.9	-169.7	0	0	113.5	S214 S220	S214-E218 WeakPolarHBondContact O-CB 3.42Å; S214-E218 WeakPolarHBondContact O-CG 3.48Å; S214-E218 PolarHBondContact O-N 2.85Å; E218-S220 VanDerWaalsContact C-N 3.32Å; E218-S220 PolarHBondContact O-N 3.3Å
219	Q	60.5	Low	68.8	Low	122 Å²	122	59.7 Å²	59.7	57%	0.57	35%	0.351	S	S	*	.	S	Bend	trans	-66.1	93	177.2	-72.8	179.7	13.8	0	0	110.1	T215	T215-Q219 VanDerWaalsContact O-CB 3.24Å; T215-Q219 WeakPolarHBondContact O-CB 3.43Å; T215-Q219 WeakPolarHBondContact O-CG 3.35Å; T215-Q219 PolarHBondContact O-N 3.32Å
220	S	46.9	Very low	68.6	Low	75 Å²	75	60.7 Å²	60.7	52%	0.524	36%	0.356	S	S	.	.			trans	100.5	94.3	166.8	-49.7	0	0	0	0	116.5	E218 G222	E218-S220 VanDerWaalsContact C-N 3.32Å; E218-S220 PolarHBondContact O-N 3.3Å; S220-G222 VanDerWaalsContact C-N 3.3Å; S220-G222 PolarHBondContact O-N 3.06Å
221	P	45.8	Very low	68.7	Low	119 Å²	119	61.2 Å²	61.2	77%	0.773	36%	0.361	S	S	*	.	S	Bend	trans	-76.4	79.1	164.2	32.1	-30.6	0	0	0	109.7
222	G	46	Very low	68.7	Low	73 Å²	73	61.2 Å²	61.2	75%	0.753	36%	0.361	S	S	*	.	S	Bend	trans	166.3	-23.2	173.5	0	0	0	0	0	117.3	S220	S220-G222 VanDerWaalsContact C-N 3.3Å; S220-G222 PolarHBondContact O-N 3.06Å
223	L	43.6	Very low	68.8	Low	149 Å²	149	64.8 Å²	64.8	78%	0.78	38%	0.38	S	S	*	.	S	Bend	trans	-109.3	131.5	167.9	-118.7	75.5	0	0	0	107.5	V225	L223-V225 PolarHBondContact O-N 3.21Å
224	A	46.4	Very low	68.8	Low	83 Å²	83	65 Å²	65	69%	0.686	38%	0.381	S	S	*	.			trans	-47	109.7	-175.3	0	0	0	0	0	112.4
225	V	57	Low	69.1	Low	18 Å²	18	64.9 Å²	64.9	11%	0.109	38%	0.38	C	S	.	.			trans	-3.5	112.4	168.8	-173.9	0	0	0	0	114.5	L223 V227 T228 N262	L223-V225 PolarHBondContact O-N 3.21Å; V225-V227 HydrophobicContact CG1-CB 3.86Å; V225-V227 HydrophobicContact CG1-CG2 3.83Å; V225-V227 PolarHBondContact O-N 3.1Å; V225-T228 PolarHBondContact O-N 3.22Å; V225-T228 PolarHBondContact O-OG1 3.34Å; V225-N262 VanDerWaalsContact CG2-ND2 3.27Å; V225-N262 WeakPolarHBondContact CG2-ND2 3.27Å
226	Q	66.4	Low	69.4	Low	87 Å²	87	64.5 Å²	64.5	41%	0.407	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-49.4	-24.6	-179.3	-168.9	154.1	-1.2	0	0	114.6	T228 L229 F230	Q226-T228 VanDerWaalsContact C-N 3.32Å; Q226-T228 PolarHBondContact O-N 2.76Å; Q226-L229 WeakPolarHBondContact O-CB 3.33Å; Q226-L229 PolarHBondContact O-N 3.12Å; Q226-L229 VanDerWaalsContact O-N 3.11Å; Q226-F230 HydrophobicContact CG-CE1 4.14Å; Q226-F230 WeakPolarHBondContact O-CD1 3.47Å; Q226-F230 PolarHBondContact O-N 3.36Å
227	V	71.2	Confident	69.8	Low	1 Å²	1	65 Å²	65	1%	0.006	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-60.1	-35.4	172.8	-170.7	0	0	0	0	113	L213 C216 I217 V225 L229 F230 Q235 I238 L263	L213-V227 HydrophobicContact CD1-CG2 4.39Å; C216-V227 HydrophobicContact CB-CG2 4.39Å; I217-V227 HydrophobicContact CG1-CG2 4.31Å; V225-V227 HydrophobicContact CG1-CB 3.86Å; V225-V227 HydrophobicContact CG1-CG2 3.83Å; V225-V227 PolarHBondContact O-N 3.1Å; V227-L229 PolarHBondContact O-N 3.35Å; V227-F230 HydrophobicContact CB-CD2 4.31Å; V227-F230 HydrophobicContact CB-CE2 4.4Å; V227-F230 HydrophobicContact CG1-CD2 4.04Å; V227-F230 HydrophobicContact CG1-CE2 4.39Å; V227-F230 HydrophobicContact CG2-CE2 4.22Å; V227-F230 WeakPolarHBondContact O-CB 3.31Å; V227-F230 PolarHBondContact O-N 3.35Å; V227-F230 VanDerWaalsContact O-N 3.15Å; V227-Q235 PolarHBondContact O-NE2 2.82Å; V227-I238 HydrophobicContact CG1-CD1 4.02Å; V227-I238 HydrophobicContact CG1-CG2 4.32Å; V227-L263 HydrophobicContact CG1-CD2 4.23Å
228	T	74	Confident	70.3	Confident	43 Å²	43	63.8 Å²	63.8	26%	0.264	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-70.3	-18	176.7	62.1	0	0	0	0	112.7	V225 Q226 Q235 N262 L263	V225-T228 PolarHBondContact O-N 3.22Å; V225-T228 PolarHBondContact O-OG1 3.34Å; Q226-T228 VanDerWaalsContact C-N 3.32Å; Q226-T228 PolarHBondContact O-N 2.76Å; T228-Q235 VanDerWaalsContact C-NE2 3.29Å; T228-Q235 PolarHBondContact O-NE2 3.44Å; T228-N262 HydrophobicContact CG2-CB 4.47Å; T228-L263 HydrophobicContact CG2-CD2 4.46Å
229	L	78	Confident	71.2	Confident	141 Å²	141	57.3 Å²	57.3	74%	0.738	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-86.4	-11.7	173.9	-60.8	172	0	0	0	112.9	Q226 V227	Q226-L229 WeakPolarHBondContact O-CB 3.33Å; Q226-L229 PolarHBondContact O-N 3.12Å; Q226-L229 VanDerWaalsContact O-N 3.11Å; V227-L229 PolarHBondContact O-N 3.35Å
230	F	82.4	Confident	72.3	Confident	21 Å²	21	55.7 Å²	55.7	9%	0.092	33%	0.334	C	S	.	.	S	Bend	trans	-66	153	173.7	-65.3	-17.7	0	0	0	111.1	C216 Q226 V227 L234 Q235 I238	C216-F230 HydrophobicContact CB-CZ 4.42Å; Q226-F230 HydrophobicContact CG-CE1 4.14Å; Q226-F230 WeakPolarHBondContact O-CD1 3.47Å; Q226-F230 PolarHBondContact O-N 3.36Å; V227-F230 HydrophobicContact CB-CD2 4.31Å; V227-F230 HydrophobicContact CB-CE2 4.4Å; V227-F230 HydrophobicContact CG1-CD2 4.04Å; V227-F230 HydrophobicContact CG1-CE2 4.39Å; V227-F230 HydrophobicContact CG2-CE2 4.22Å; V227-F230 WeakPolarHBondContact O-CB 3.31Å; V227-F230 PolarHBondContact O-N 3.35Å; V227-F230 VanDerWaalsContact O-N 3.15Å; F230-L234 HydrophobicContact CB-CB 4.29Å; F230-L234 HydrophobicContact CB-CD2 3.94Å; F230-L234 HydrophobicContact CB-CG 4.19Å; F230-L234 HydrophobicContact CD1-CD2 4.24Å; F230-L234 HydrophobicContact CD2-CD2 3.68Å; F230-L234 HydrophobicContact CD2-CG 3.97Å; F230-L234 HydrophobicContact CE2-CD2 4.2Å; F230-L234 HydrophobicContact CG-CD2 3.7Å; F230-L234 HydrophobicContact CG-CG 4.25Å; F230-Q235 HydrophobicContact CB-CG 4.09Å; F230-Q235 PolarHBondContact O-NE2 2.82Å; F230-I238 HydrophobicContact CD2-CD1 3.53Å; F230-I238 HydrophobicContact CE2-CD1 3.77Å
231	S	84.6	Confident	74.1	Confident	31 Å²	31	52.4 Å²	52.4	22%	0.217	31%	0.311	C	S	.	.			trans	-57.7	147	170.1	57	0	0	0	0	110.4	I233 L234 Q235	S231-I233 VanDerWaalsContact C-N 3.27Å; S231-I233 PolarHBondContact O-N 2.8Å; S231-L234 PolarHBondContact O-N 3.32Å; S231-Q235 PolarHBondContact O-N 2.9Å
232	D	86.5	Confident	76	Confident	76 Å²	76	46.8 Å²	46.8	41%	0.406	27%	0.274	S	S	.	.	H	α-helix	trans	-46.2	-43.9	174.8	60.2	-18.2	0	0	0	114.2	L234 Q235 L236 V271	D232-L234 VanDerWaalsContact C-N 3.29Å; D232-L234 PolarHBondContact O-N 3.41Å; D232-Q235 WeakPolarHBondContact O-CB 3.3Å; D232-Q235 PolarHBondContact O-N 3.41Å; D232-L236 WeakPolarHBondContact O-CG 3.41Å; D232-L236 PolarHBondContact O-N 2.93Å; D232-V271 HydrophobicContact CB-CG2 4.12Å
233	I	84.9	Confident	77.9	Confident	92 Å²	92	43.4 Å²	43.4	47%	0.472	24%	0.239	S	C	.	.	H	α-helix	trans	-59.9	-39.8	178.6	-57.2	170.5	0	0	0	111.6	R195 S231 I237	R195-I233 HydrophobicContact CG-CG2 4.05Å; S231-I233 VanDerWaalsContact C-N 3.27Å; S231-I233 PolarHBondContact O-N 2.8Å; I233-I237 HydrophobicContact CG2-CD1 4.43Å; I233-I237 WeakPolarHBondContact O-CD1 3.37Å; I233-I237 WeakPolarHBondContact O-CG1 3.36Å; I233-I237 PolarHBondContact O-N 3.28Å
234	L	84.9	Confident	79.9	Confident	6 Å²	6	38.7 Å²	38.7	3%	0.031	22%	0.221	C	C	.	.	H	α-helix	trans	-74.9	-38.8	178.2	178.7	55.9	0	0	0	110.8	K194 F198 F230 S231 D232 L236 I237 I238	K194-L234 HydrophobicContact CB-CD2 4.22Å; F198-L234 HydrophobicContact CB-CD1 4.18Å; F198-L234 HydrophobicContact CD1-CD1 3.97Å; F198-L234 HydrophobicContact CG-CD1 4.21Å; F230-L234 HydrophobicContact CB-CB 4.29Å; F230-L234 HydrophobicContact CB-CD2 3.94Å; F230-L234 HydrophobicContact CB-CG 4.19Å; F230-L234 HydrophobicContact CD1-CD2 4.24Å; F230-L234 HydrophobicContact CD2-CD2 3.68Å; F230-L234 HydrophobicContact CD2-CG 3.97Å; F230-L234 HydrophobicContact CE2-CD2 4.2Å; F230-L234 HydrophobicContact CG-CD2 3.7Å; F230-L234 HydrophobicContact CG-CG 4.25Å; S231-L234 PolarHBondContact O-N 3.32Å; D232-L234 VanDerWaalsContact C-N 3.29Å; D232-L234 PolarHBondContact O-N 3.41Å; L234-L236 VanDerWaalsContact C-N 3.32Å; L234-L236 PolarHBondContact O-N 3.19Å; L234-I237 PolarHBondContact O-N 3.16Å; L234-I238 HydrophobicContact CD1-CD1 4.06Å; L234-I238 HydrophobicContact CD1-CG1 4.24Å; L234-I238 HydrophobicContact CG-CD1 3.89Å; L234-I238 VanDerWaalsContact O-CG1 3.27Å; L234-I238 WeakPolarHBondContact O-CG1 3.44Å; L234-I238 PolarHBondContact O-N 3.35Å
235	Q	87.8	Confident	81.6	Confident	3 Å²	3	34.9 Å²	34.9	1%	0.014	19%	0.189	C	C	.	.	H	α-helix	trans	-59	-43.3	174.2	-67.9	178.5	-8.1	0	0	111.6	V227 T228 F230 S231 D232 I237 I238 V239 L263 S266 V271	V227-Q235 PolarHBondContact O-NE2 2.82Å; T228-Q235 VanDerWaalsContact C-NE2 3.29Å; T228-Q235 PolarHBondContact O-NE2 3.44Å; F230-Q235 HydrophobicContact CB-CG 4.09Å; F230-Q235 PolarHBondContact O-NE2 2.82Å; S231-Q235 PolarHBondContact O-N 2.9Å; D232-Q235 WeakPolarHBondContact O-CB 3.3Å; D232-Q235 PolarHBondContact O-N 3.41Å; Q235-I237 PolarHBondContact O-N 2.99Å; Q235-I238 PolarHBondContact O-N 3.36Å; Q235-V239 WeakPolarHBondContact O-CG2 3.44Å; Q235-V239 PolarHBondContact O-N 2.92Å; Q235-L263 HydrophobicContact CB-CD2 4.4Å; Q235-L263 HydrophobicContact CG-CD2 4.14Å; Q235-S266 PolarHBondContact OE1-OG 3Å; Q235-V271 HydrophobicContact CB-CB 4.5Å; Q235-V271 HydrophobicContact CB-CG1 3.88Å; Q235-V271 HydrophobicContact CB-CG2 3.74Å
236	L	87.6	Confident	83	Confident	43 Å²	43	34.1 Å²	34.1	23%	0.225	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-45.6	177	-72.9	171.2	0	0	0	112.3	D232 L234 I238 V239 Q240 A270 V271 E274	D232-L236 WeakPolarHBondContact O-CG 3.41Å; D232-L236 PolarHBondContact O-N 2.93Å; L234-L236 VanDerWaalsContact C-N 3.32Å; L234-L236 PolarHBondContact O-N 3.19Å; L236-I238 VanDerWaalsContact C-N 3.3Å; L236-I238 PolarHBondContact O-N 3.37Å; L236-V239 PolarHBondContact O-N 3.17Å; L236-Q240 WeakPolarHBondContact O-CG 3.46Å; L236-Q240 PolarHBondContact O-N 2.91Å; L236-A270 HydrophobicContact CD1-CB 4.45Å; L236-A270 HydrophobicContact CD2-CB 4.39Å; L236-V271 HydrophobicContact CD2-CG2 4.04Å; L236-V271 HydrophobicContact CG-CG2 3.91Å; L236-E274 HydrophobicContact CD2-CB 4.11Å; L236-E274 HydrophobicContact CD2-CG 3.78Å
237	I	84.9	Confident	83.8	Confident	20 Å²	20	32.3 Å²	32.3	10%	0.103	18%	0.177	C	C	.	.	H	α-helix	trans	-63.5	-39.1	177.2	-66.9	164.2	0	0	0	110.7	R195 F198 L202 I233 L234 Q235 Q240 L241	R195-I237 HydrophobicContact CG-CD1 3.57Å; F198-I237 HydrophobicContact CD1-CG2 4.13Å; F198-I237 HydrophobicContact CE1-CG2 4.29Å; L202-I237 HydrophobicContact CD2-CG2 4.46Å; I233-I237 HydrophobicContact CG2-CD1 4.43Å; I233-I237 WeakPolarHBondContact O-CD1 3.37Å; I233-I237 WeakPolarHBondContact O-CG1 3.36Å; I233-I237 PolarHBondContact O-N 3.28Å; L234-I237 PolarHBondContact O-N 3.16Å; Q235-I237 PolarHBondContact O-N 2.99Å; I237-Q240 PolarHBondContact O-N 2.92Å; I237-L241 VanDerWaalsContact O-CB 3.31Å; I237-L241 WeakPolarHBondContact O-CB 3.32Å; I237-L241 PolarHBondContact O-N 3.1Å
238	I	86	Confident	84.3	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-65.5	-42.6	176.8	-70.3	167.2	0	0	0	111	F198 L213 V227 F230 L234 Q235 L236 L241 I242	F198-I238 HydrophobicContact CD1-CG1 4.49Å; F198-I238 HydrophobicContact CE1-CG1 3.83Å; F198-I238 HydrophobicContact CZ-CG1 4.14Å; L213-I238 HydrophobicContact CD1-CD1 4.13Å; L213-I238 HydrophobicContact CD1-CG1 4.28Å; L213-I238 HydrophobicContact CD1-CG2 3.79Å; L213-I238 HydrophobicContact CD2-CG2 4.16Å; V227-I238 HydrophobicContact CG1-CD1 4.02Å; V227-I238 HydrophobicContact CG1-CG2 4.32Å; F230-I238 HydrophobicContact CD2-CD1 3.53Å; F230-I238 HydrophobicContact CE2-CD1 3.77Å; L234-I238 HydrophobicContact CD1-CD1 4.06Å; L234-I238 HydrophobicContact CD1-CG1 4.24Å; L234-I238 HydrophobicContact CG-CD1 3.89Å; L234-I238 VanDerWaalsContact O-CG1 3.27Å; L234-I238 WeakPolarHBondContact O-CG1 3.44Å; L234-I238 PolarHBondContact O-N 3.35Å; Q235-I238 PolarHBondContact O-N 3.36Å; L236-I238 VanDerWaalsContact C-N 3.3Å; L236-I238 PolarHBondContact O-N 3.37Å; I238-L241 PolarHBondContact O-N 3.05Å; I238-I242 HydrophobicContact CG2-CD1 3.68Å; I238-I242 HydrophobicContact CG2-CG1 4.28Å; I238-I242 WeakPolarHBondContact O-CB 3.43Å; I238-I242 VanDerWaalsContact O-CG1 3.25Å; I238-I242 WeakPolarHBondContact O-CG1 3.38Å; I238-I242 PolarHBondContact O-N 3.45Å
239	V	89.1	Confident	84.7	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-46.1	176.8	171.8	0	0	0	0	110.9	Q235 L236 L241 I242 Y243 L263 E274 A275 V278	Q235-V239 WeakPolarHBondContact O-CG2 3.44Å; Q235-V239 PolarHBondContact O-N 2.92Å; L236-V239 PolarHBondContact O-N 3.17Å; V239-L241 VanDerWaalsContact C-N 3.34Å; V239-L241 PolarHBondContact O-N 3.48Å; V239-I242 PolarHBondContact O-N 3.36Å; V239-Y243 WeakPolarHBondContact O-CB 3.32Å; V239-Y243 PolarHBondContact O-N 3.32Å; V239-L263 HydrophobicContact CG2-CD1 3.53Å; V239-E274 HydrophobicContact CG1-CB 4.08Å; V239-A275 HydrophobicContact CG2-CB 4.42Å; V239-V278 HydrophobicContact CG1-CB 4.03Å; V239-V278 HydrophobicContact CG1-CG1 4.45Å; V239-V278 HydrophobicContact CG1-CG2 3.6Å
240	Q	84.9	Confident	85	Confident	88 Å²	88	32.8 Å²	32.8	41%	0.411	19%	0.191	S	C	.	.	H	α-helix	trans	-60.6	-42.9	175.8	-73.1	177.2	-4.6	0	0	112	L236 I237 Y243 A244 F691	L236-Q240 WeakPolarHBondContact O-CG 3.46Å; L236-Q240 PolarHBondContact O-N 2.91Å; I237-Q240 PolarHBondContact O-N 2.92Å; Q240-Y243 PolarHBondContact O-N 3.29Å; Q240-A244 WeakPolarHBondContact O-CB 3.49Å; Q240-A244 PolarHBondContact O-N 2.82Å; Q240-F691 HydrophobicContact CB-CZ 4.49Å; Q240-F691 HydrophobicContact CG-CE1 3.79Å; Q240-F691 HydrophobicContact CG-CE2 4.22Å; Q240-F691 HydrophobicContact CG-CZ 3.63Å
241	L	84.1	Confident	85.1	Confident	6 Å²	6	35.2 Å²	35.2	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-62.3	-50.8	176.2	173.1	54.8	0	0	0	111.9	F198 L202 I237 I238 V239 Y243 A244 V245	F198-L241 HydrophobicContact CE1-CD2 3.72Å; F198-L241 HydrophobicContact CZ-CD2 3.48Å; F198-L241 VanDerWaalsContact CZ-CD2 3.48Å; L202-L241 HydrophobicContact CD1-CD1 3.14Å; L202-L241 HydrophobicContact CD1-CD2 3.99Å; L202-L241 HydrophobicContact CD1-CG 4.09Å; L202-L241 HydrophobicContact CD2-CB 4.44Å; L202-L241 HydrophobicContact CD2-CD1 4.28Å; L202-L241 HydrophobicContact CG-CD1 4.33Å; I237-L241 VanDerWaalsContact O-CB 3.31Å; I237-L241 WeakPolarHBondContact O-CB 3.32Å; I237-L241 PolarHBondContact O-N 3.1Å; I238-L241 PolarHBondContact O-N 3.05Å; V239-L241 VanDerWaalsContact C-N 3.34Å; V239-L241 PolarHBondContact O-N 3.48Å; L241-Y243 PolarHBondContact O-N 3.46Å; L241-A244 PolarHBondContact O-N 3.26Å; L241-V245 HydrophobicContact CD1-CG2 3.57Å; L241-V245 HydrophobicContact CG-CG2 4.31Å; L241-V245 WeakPolarHBondContact O-CB 3.37Å; L241-V245 WeakPolarHBondContact O-CG2 3.36Å; L241-V245 PolarHBondContact O-N 3.42Å
242	I	85.2	Confident	85	Confident	0 Å²	0	36 Å²	36	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56.1	-45.3	179.5	-72.3	167.8	0	0	0	109.3	L213 I238 V239 V245 C246 F256 V260 L282	L213-I242 HydrophobicContact CD2-CD1 4.42Å; L213-I242 HydrophobicContact CD2-CG1 4.12Å; I238-I242 HydrophobicContact CG2-CD1 3.68Å; I238-I242 HydrophobicContact CG2-CG1 4.28Å; I238-I242 WeakPolarHBondContact O-CB 3.43Å; I238-I242 VanDerWaalsContact O-CG1 3.25Å; I238-I242 WeakPolarHBondContact O-CG1 3.38Å; I238-I242 PolarHBondContact O-N 3.45Å; V239-I242 PolarHBondContact O-N 3.36Å; I242-V245 PolarHBondContact O-N 3.45Å; I242-C246 VanDerWaalsContact O-CB 3.26Å; I242-C246 WeakPolarHBondContact O-CB 3.18Å; I242-C246 PolarHBondContact O-N 2.82Å; I242-C246 PolarHBondContact O-SG 2.92Å; I242-F256 HydrophobicContact CB-CB 4.47Å; I242-F256 HydrophobicContact CD1-CB 4.28Å; I242-F256 HydrophobicContact CD1-CD1 4.25Å; I242-F256 HydrophobicContact CD1-CG 4.5Å; I242-F256 HydrophobicContact CG1-CB 4.14Å; I242-F256 HydrophobicContact CG1-CD1 4.01Å; I242-F256 HydrophobicContact CG1-CG 4.06Å; I242-F256 HydrophobicContact CG2-CB 3.54Å; I242-F256 HydrophobicContact CG2-CG 4.12Å; I242-V260 HydrophobicContact CB-CG2 4.43Å; I242-V260 HydrophobicContact CD1-CG2 4.03Å; I242-V260 HydrophobicContact CG2-CG2 3.65Å; I242-L282 HydrophobicContact CG2-CD1 4.15Å
243	Y	87.2	Confident	85	Confident	3 Å²	3	33.2 Å²	33.2	1%	0.012	20%	0.201	C	C	.	.	H	α-helix	trans	-59.5	-51.7	176.6	-178.8	-104.9	0	0	0	112.1	V239 Q240 L241 V245 C246 M247 V278 L282 N689 L690 F691	V239-Y243 WeakPolarHBondContact O-CB 3.32Å; V239-Y243 PolarHBondContact O-N 3.32Å; Q240-Y243 PolarHBondContact O-N 3.29Å; L241-Y243 PolarHBondContact O-N 3.46Å; Y243-V245 VanDerWaalsContact C-N 3.31Å; Y243-V245 PolarHBondContact O-N 2.96Å; Y243-C246 PolarHBondContact O-N 3.12Å; Y243-M247 HydrophobicContact CD1-CG 4.3Å; Y243-M247 HydrophobicContact CD2-CE 4.42Å; Y243-M247 HydrophobicContact CD2-CG 4.19Å; Y243-M247 HydrophobicContact CE1-CG 3.99Å; Y243-M247 HydrophobicContact CE2-CE 3.95Å; Y243-M247 HydrophobicContact CE2-CG 3.83Å; Y243-M247 HydrophobicContact CE2-SD 4.04Å; Y243-M247 HydrophobicContact CG-CG 4.43Å; Y243-M247 WeakPolarHBondContact O-CB 3.05Å; Y243-M247 VanDerWaalsContact O-CG 3.27Å; Y243-M247 WeakPolarHBondContact O-CG 3.19Å; Y243-M247 PolarHBondContact O-N 3.06Å; Y243-V278 HydrophobicContact CD2-CB 4.39Å; Y243-V278 HydrophobicContact CD2-CG1 4.02Å; Y243-V278 HydrophobicContact CD2-CG2 3.99Å; Y243-V278 HydrophobicContact CG-CG1 4.39Å; Y243-V278 HydrophobicContact CG-CG2 4.01Å; Y243-L282 HydrophobicContact CD2-CD2 4.34Å; Y243-N689 WeakPolarHBondContact CE1-OD1 3.48Å; Y243-L690 PolarHBondContact OH-N 3.36Å; Y243-L690 VanDerWaalsContact OH-N 3.13Å; Y243-F691 AromaticContact CD1-CD2 3.37Å; Y243-F691 HydrophobicContact CD1-CD2 3.37Å; Y243-F691 AromaticContact CD1-CE2 3.44Å; Y243-F691 HydrophobicContact CD1-CE2 3.44Å; Y243-F691 VanDerWaalsContact CD1-CE2 3.44Å; Y243-F691 AromaticContact CE1-CD2 3.61Å; Y243-F691 HydrophobicContact CE1-CD2 3.61Å; Y243-F691 HydrophobicContact CE1-CE2 4Å; Y243-F691 HydrophobicContact CG-CD2 4.3Å; Y243-F691 AromaticContact CG-CE2 3.93Å; Y243-F691 HydrophobicContact CG-CE2 3.93Å
244	A	84.1	Confident	85	Confident	49 Å²	49	34.5 Å²	34.5	41%	0.405	21%	0.213	S	C	.	.	H	α-helix	trans	-60.1	-38.3	179.3	0	0	0	0	0	113	Q240 L241 A248	Q240-A244 WeakPolarHBondContact O-CB 3.49Å; Q240-A244 PolarHBondContact O-N 2.82Å; L241-A244 PolarHBondContact O-N 3.26Å; A244-A248 WeakPolarHBondContact O-CB 3.36Å; A244-A248 PolarHBondContact O-N 2.87Å; A244-A248 VanDerWaalsContact O-N 3.08Å
245	V	83.8	Confident	84.8	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.024	23%	0.227	C	C	.	.	H	α-helix	trans	-71.9	-44.4	178.8	168.1	0	0	0	0	111.3	L210 L241 I242 Y243 M247 A248 N249 E252 F256	L210-V245 HydrophobicContact CD1-CG1 4.17Å; L210-V245 HydrophobicContact CD1-CG2 4.22Å; L210-V245 HydrophobicContact CD2-CG1 4.22Å; L210-V245 HydrophobicContact CD2-CG2 4.05Å; L241-V245 HydrophobicContact CD1-CG2 3.57Å; L241-V245 HydrophobicContact CG-CG2 4.31Å; L241-V245 WeakPolarHBondContact O-CB 3.37Å; L241-V245 WeakPolarHBondContact O-CG2 3.36Å; L241-V245 PolarHBondContact O-N 3.42Å; I242-V245 PolarHBondContact O-N 3.45Å; Y243-V245 VanDerWaalsContact C-N 3.31Å; Y243-V245 PolarHBondContact O-N 2.96Å; V245-M247 VanDerWaalsContact C-N 3.34Å; V245-A248 PolarHBondContact O-N 3.15Å; V245-N249 PolarHBondContact O-N 3.27Å; V245-E252 HydrophobicContact CG1-CB 4.2Å; V245-E252 HydrophobicContact CG1-CG 4.15Å; V245-F256 HydrophobicContact CG1-CE2 4.29Å
246	C	85.6	Confident	84.7	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.014	23%	0.227	C	C	.	.	H	α-helix	trans	-69.2	-31.6	178.4	-70.9	0	0	0	0	112.8	I242 Y243 N249 P250 V253 L282	I242-C246 VanDerWaalsContact O-CB 3.26Å; I242-C246 WeakPolarHBondContact O-CB 3.18Å; I242-C246 PolarHBondContact O-N 2.82Å; I242-C246 PolarHBondContact O-SG 2.92Å; Y243-C246 PolarHBondContact O-N 3.12Å; C246-N249 CarbonylContact O-C 3.57Å; C246-N249 VanDerWaalsContact O-C 3.29Å; C246-P250 WeakPolarHBondContact O-CA 3.38Å; C246-V253 HydrophobicContact CB-CG2 3.74Å; C246-L282 HydrophobicContact CB-CD1 4.17Å; C246-L282 HydrophobicContact CB-CD2 3.37Å; C246-L282 HydrophobicContact CB-CG 4.41Å
247	M	82.7	Confident	84.7	Confident	49 Å²	49	38.4 Å²	38.4	24%	0.241	23%	0.227	C	C	.	.	H	α-helix	trans	-67.8	-43.3	171.3	-72.5	-61.9	107.3	0	0	111.3	Y243 V245 L282 L684	Y243-M247 HydrophobicContact CD1-CG 4.3Å; Y243-M247 HydrophobicContact CD2-CE 4.42Å; Y243-M247 HydrophobicContact CD2-CG 4.19Å; Y243-M247 HydrophobicContact CE1-CG 3.99Å; Y243-M247 HydrophobicContact CE2-CE 3.95Å; Y243-M247 HydrophobicContact CE2-CG 3.83Å; Y243-M247 HydrophobicContact CE2-SD 4.04Å; Y243-M247 HydrophobicContact CG-CG 4.43Å; Y243-M247 WeakPolarHBondContact O-CB 3.05Å; Y243-M247 VanDerWaalsContact O-CG 3.27Å; Y243-M247 WeakPolarHBondContact O-CG 3.19Å; Y243-M247 PolarHBondContact O-N 3.06Å; V245-M247 VanDerWaalsContact C-N 3.34Å; M247-L282 HydrophobicContact CE-CD2 3.48Å; M247-L282 VanDerWaalsContact CE-CD2 3.48Å; M247-L684 HydrophobicContact CE-CD2 4.5Å
248	A	82	Confident	84.7	Confident	70 Å²	70	44.1 Å²	44.1	58%	0.579	25%	0.247	S	C	*	.	H	α-helix	trans	-70.9	-32.8	177.4	0	0	0	0	0	113.2	A244 V245	A244-A248 WeakPolarHBondContact O-CB 3.36Å; A244-A248 PolarHBondContact O-N 2.87Å; A244-A248 VanDerWaalsContact O-N 3.08Å; V245-A248 PolarHBondContact O-N 3.15Å
249	N	83.3	Confident	84.6	Confident	73 Å²	73	44.1 Å²	44.1	39%	0.39	25%	0.248	S	C	.	.			trans	-141.4	96.5	178.8	-174.9	4.6	0	0	0	111.3	V245 C246 A251 E252	V245-N249 PolarHBondContact O-N 3.27Å; C246-N249 CarbonylContact O-C 3.57Å; C246-N249 VanDerWaalsContact O-C 3.29Å; N249-A251 PolarHBondContact O-N 3.27Å; N249-A251 VanDerWaalsContact O-N 3.09Å; N249-A251 WeakPolarHBondContact OD1-CB 3Å; N249-A251 PolarHBondContact OD1-N 2.88Å; N249-E252 HydrophobicContact CB-CG 4.37Å; N249-E252 PolarHBondContact O-N 2.77Å; N249-E252 VanDerWaalsContact O-N 3.17Å
250	P	83.8	Confident	84.6	Confident	52 Å²	52	44.1 Å²	44.1	34%	0.338	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-59.9	-20.5	-179.9	-27.4	35.8	0	0	0	115.2	C246 E252 V253	C246-P250 WeakPolarHBondContact O-CA 3.38Å; P250-E252 PolarHBondContact O-N 2.83Å; P250-V253 WeakPolarHBondContact O-CB 3.22Å; P250-V253 VanDerWaalsContact O-CG2 3.23Å; P250-V253 WeakPolarHBondContact O-CG2 3.4Å; P250-V253 PolarHBondContact O-N 3.48Å
251	A	84.2	Confident	84.8	Confident	71 Å²	71	44.7 Å²	44.7	59%	0.587	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-65.1	-26.3	178.3	0	0	0	0	0	112.8	N249 V253 T254	N249-A251 PolarHBondContact O-N 3.27Å; N249-A251 VanDerWaalsContact O-N 3.09Å; N249-A251 WeakPolarHBondContact OD1-CB 3Å; N249-A251 PolarHBondContact OD1-N 2.88Å; A251-V253 VanDerWaalsContact C-N 3.27Å; A251-V253 PolarHBondContact O-N 3.3Å; A251-T254 PolarHBondContact O-OG1 2.94Å
252	E	82.8	Confident	85	Confident	47 Å²	47	46.3 Å²	46.3	22%	0.22	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-76.6	-10.8	179.2	-66.2	-65.1	148.3	0	0	113.1	V245 N249 P250 T254 R255 F256	V245-E252 HydrophobicContact CG1-CB 4.2Å; V245-E252 HydrophobicContact CG1-CG 4.15Å; N249-E252 HydrophobicContact CB-CG 4.37Å; N249-E252 PolarHBondContact O-N 2.77Å; N249-E252 VanDerWaalsContact O-N 3.17Å; P250-E252 PolarHBondContact O-N 2.83Å; E252-T254 VanDerWaalsContact C-N 3.28Å; E252-T254 PolarHBondContact O-N 3.35Å; E252-R255 WeakPolarHBondContact O-CB 3.49Å; E252-R255 PolarHBondContact O-N 2.92Å; E252-R255 WeakPolarHBondContact OE2-CD 3.16Å; E252-R255 IonicContact OE2-NH1 3.3Å; E252-R255 PolarHBondContact OE2-NH1 3.45Å; E252-F256 HydrophobicContact CB-CD2 4.1Å; E252-F256 HydrophobicContact CB-CE2 4.01Å; E252-F256 WeakPolarHBondContact O-CD2 3.35Å; E252-F256 PolarHBondContact O-N 2.9Å
253	V	85.9	Confident	85.3	Confident	18 Å²	18	46.3 Å²	46.3	11%	0.109	26%	0.255	C	S	.	.	H	α-helix	trans	-55.9	-43.4	-178.6	173.2	0	0	0	0	111.3	C246 P250 A251 R255 F256 I257 L282	C246-V253 HydrophobicContact CB-CG2 3.74Å; P250-V253 WeakPolarHBondContact O-CB 3.22Å; P250-V253 VanDerWaalsContact O-CG2 3.23Å; P250-V253 WeakPolarHBondContact O-CG2 3.4Å; P250-V253 PolarHBondContact O-N 3.48Å; A251-V253 VanDerWaalsContact C-N 3.27Å; A251-V253 PolarHBondContact O-N 3.3Å; V253-R255 PolarHBondContact O-N 3.37Å; V253-F256 PolarHBondContact O-N 3.45Å; V253-I257 HydrophobicContact CG1-CB 4.49Å; V253-I257 HydrophobicContact CG1-CD1 4.29Å; V253-I257 VanDerWaalsContact O-CB 3.22Å; V253-I257 WeakPolarHBondContact O-CB 3.27Å; V253-I257 PolarHBondContact O-N 3.19Å; V253-L282 HydrophobicContact CG1-CB 4.4Å; V253-L282 HydrophobicContact CG2-CD2 4.41Å
254	T	84.6	Confident	85.4	Confident	120 Å²	120	46.8 Å²	46.8	74%	0.736	26%	0.258	S	S	*	.	H	α-helix	trans	-62.4	-30.2	-179.2	54	0	0	0	0	112.9	A251 E252	A251-T254 PolarHBondContact O-OG1 2.94Å; E252-T254 VanDerWaalsContact C-N 3.28Å; E252-T254 PolarHBondContact O-N 3.35Å
255	R	82.3	Confident	85.7	Confident	88 Å²	88	52.3 Å²	52.3	33%	0.332	28%	0.276	S	S	.	.	H	α-helix	trans	-71.9	-42.4	178.1	-167.5	-177.7	-172.3	176.3	4.3	111.8	S214 E252 V253	S214-R255 PolarHBondContact OG-NE 3.15Å; S214-R255 VanDerWaalsContact OG-NE 3.11Å; S214-R255 PolarHBondContact OG-NH2 3.49Å; E252-R255 WeakPolarHBondContact O-CB 3.49Å; E252-R255 PolarHBondContact O-N 2.92Å; E252-R255 WeakPolarHBondContact OE2-CD 3.16Å; E252-R255 IonicContact OE2-NH1 3.3Å; E252-R255 PolarHBondContact OE2-NH1 3.45Å; V253-R255 PolarHBondContact O-N 3.37Å
256	F	85.4	Confident	85.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-99.3	-17.3	-172.3	-62.4	-65.1	0	0	0	115.2	L210 L213 I217 I242 V245 E252 V253 R258 C259 V260	L210-F256 HydrophobicContact CD2-CE1 4.47Å; L210-F256 HydrophobicContact CD2-CE2 4.13Å; L210-F256 HydrophobicContact CD2-CZ 3.66Å; L213-F256 HydrophobicContact CD2-CD1 4.13Å; L213-F256 HydrophobicContact CD2-CE1 3.67Å; L213-F256 HydrophobicContact CD2-CZ 4.47Å; L213-F256 HydrophobicContact CG-CE1 4.17Å; I217-F256 HydrophobicContact CD1-CD1 3.67Å; I217-F256 HydrophobicContact CD1-CE1 3.82Å; I242-F256 HydrophobicContact CB-CB 4.47Å; I242-F256 HydrophobicContact CD1-CB 4.28Å; I242-F256 HydrophobicContact CD1-CD1 4.25Å; I242-F256 HydrophobicContact CD1-CG 4.5Å; I242-F256 HydrophobicContact CG1-CB 4.14Å; I242-F256 HydrophobicContact CG1-CD1 4.01Å; I242-F256 HydrophobicContact CG1-CG 4.06Å; I242-F256 HydrophobicContact CG2-CB 3.54Å; I242-F256 HydrophobicContact CG2-CG 4.12Å; V245-F256 HydrophobicContact CG1-CE2 4.29Å; E252-F256 HydrophobicContact CB-CD2 4.1Å; E252-F256 HydrophobicContact CB-CE2 4.01Å; E252-F256 WeakPolarHBondContact O-CD2 3.35Å; E252-F256 PolarHBondContact O-N 2.9Å; V253-F256 PolarHBondContact O-N 3.45Å; F256-R258 VanDerWaalsContact C-N 3.26Å; F256-R258 PolarHBondContact O-N 3.33Å; F256-C259 WeakPolarHBondContact O-CA 3.38Å; F256-C259 VanDerWaalsContact O-CB 3.25Å; F256-C259 WeakPolarHBondContact O-CB 3.22Å; F256-C259 PolarHBondContact O-N 3Å; F256-V260 PolarHBondContact O-N 3.46Å; F256-V260 VanDerWaalsContact O-N 3.07Å
257	I	86.1	Confident	86	Confident	46 Å²	46	58.3 Å²	58.3	24%	0.236	32%	0.318	C	S	.	.	H	α-helix	trans	-56.8	-38.1	-174.2	-164.8	163	0	0	0	113.2	V253 C259 V260 Y261 L279 T283	V253-I257 HydrophobicContact CG1-CB 4.49Å; V253-I257 HydrophobicContact CG1-CD1 4.29Å; V253-I257 VanDerWaalsContact O-CB 3.22Å; V253-I257 WeakPolarHBondContact O-CB 3.27Å; V253-I257 PolarHBondContact O-N 3.19Å; I257-C259 VanDerWaalsContact C-N 3.34Å; I257-V260 PolarHBondContact O-N 3.11Å; I257-Y261 WeakPolarHBondContact O-CB 3.4Å; I257-Y261 PolarHBondContact O-N 3.35Å; I257-L279 HydrophobicContact CD1-CD1 4.49Å; I257-L279 HydrophobicContact CG1-CD1 3.86Å; I257-T283 HydrophobicContact CD1-CG2 3.88Å
258	R	85	Confident	86.4	Confident	139 Å²	139	57 Å²	57	53%	0.525	31%	0.313	S	S	.	.	H	α-helix	trans	-67.6	-35.1	176.8	-176.9	172.2	125.9	170.6	-2.9	112	F256 N262	F256-R258 VanDerWaalsContact C-N 3.26Å; F256-R258 PolarHBondContact O-N 3.33Å; R258-N262 VanDerWaalsContact O-CG 3.24Å; R258-N262 PolarHBondContact O-N 2.94Å; R258-N262 VanDerWaalsContact O-N 3.13Å; R258-N262 PolarHBondContact O-ND2 3.48Å
259	C	85.3	Confident	86.8	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.014	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-50.9	175.4	-174	0	0	0	0	110.4	I217 F256 I257 Y261 N262 L263	I217-C259 HydrophobicContact CD1-CB 3.99Å; I217-C259 HydrophobicContact CG1-CB 4.26Å; F256-C259 WeakPolarHBondContact O-CA 3.38Å; F256-C259 VanDerWaalsContact O-CB 3.25Å; F256-C259 WeakPolarHBondContact O-CB 3.22Å; F256-C259 PolarHBondContact O-N 3Å; I257-C259 VanDerWaalsContact C-N 3.34Å; C259-Y261 VanDerWaalsContact C-N 3.33Å; C259-Y261 PolarHBondContact O-N 3.12Å; C259-N262 PolarHBondContact O-N 3.36Å; C259-L263 WeakPolarHBondContact O-CG 3.35Å; C259-L263 PolarHBondContact O-N 2.85Å; C259-L263 VanDerWaalsContact O-N 3.13Å
260	V	88.6	Confident	87.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.1	-42	177.8	-174.6	0	0	0	0	111.4	I242 F256 I257 N262 L263 A275 V278 L279	I242-V260 HydrophobicContact CB-CG2 4.43Å; I242-V260 HydrophobicContact CD1-CG2 4.03Å; I242-V260 HydrophobicContact CG2-CG2 3.65Å; F256-V260 PolarHBondContact O-N 3.46Å; F256-V260 VanDerWaalsContact O-N 3.07Å; I257-V260 PolarHBondContact O-N 3.11Å; V260-N262 VanDerWaalsContact C-N 3.3Å; V260-N262 PolarHBondContact O-N 3.18Å; V260-L263 WeakPolarHBondContact O-CB 3.26Å; V260-L263 PolarHBondContact O-N 3.23Å; V260-L263 VanDerWaalsContact O-N 3.11Å; V260-A275 HydrophobicContact CG1-CB 4.29Å; V260-A275 WeakPolarHBondContact CG1-O 3.46Å; V260-V278 HydrophobicContact CG1-CG1 4.24Å; V260-L279 HydrophobicContact CB-CD1 4.47Å; V260-L279 HydrophobicContact CG1-CB 3.9Å; V260-L279 HydrophobicContact CG1-CD1 4.31Å
261	Y	89.7	Confident	87.6	Confident	100 Å²	100	51.7 Å²	51.7	39%	0.392	28%	0.282	S	S	.	.	H	α-helix	trans	-58.4	-40.7	176.7	-170	-87.2	0	0	0	112.5	I257 C259 L263 L264 L279 A291	I257-Y261 WeakPolarHBondContact O-CB 3.4Å; I257-Y261 PolarHBondContact O-N 3.35Å; C259-Y261 VanDerWaalsContact C-N 3.33Å; C259-Y261 PolarHBondContact O-N 3.12Å; Y261-L263 VanDerWaalsContact C-N 3.34Å; Y261-L264 HydrophobicContact CD2-CD1 4.44Å; Y261-L264 WeakPolarHBondContact O-CB 3.02Å; Y261-L264 WeakPolarHBondContact O-CG 3.41Å; Y261-L264 PolarHBondContact O-N 3.29Å; Y261-L279 HydrophobicContact CD2-CD2 3.89Å; Y261-A291 HydrophobicContact CE2-CB 3.74Å
262	N	88.4	Confident	88	Confident	39 Å²	39	49.8 Å²	49.8	21%	0.209	26%	0.26	C	S	.	.	H	α-helix	trans	-71.7	-27.8	177.6	-68.8	-24.2	0	0	0	112.9	V225 T228 R258 C259 V260 L264 Q265	V225-N262 VanDerWaalsContact CG2-ND2 3.27Å; V225-N262 WeakPolarHBondContact CG2-ND2 3.27Å; T228-N262 HydrophobicContact CG2-CB 4.47Å; R258-N262 VanDerWaalsContact O-CG 3.24Å; R258-N262 PolarHBondContact O-N 2.94Å; R258-N262 VanDerWaalsContact O-N 3.13Å; R258-N262 PolarHBondContact O-ND2 3.48Å; C259-N262 PolarHBondContact O-N 3.36Å; V260-N262 VanDerWaalsContact C-N 3.3Å; V260-N262 PolarHBondContact O-N 3.18Å; N262-L264 PolarHBondContact O-N 3.49Å; N262-Q265 PolarHBondContact O-N 3.26Å; N262-Q265 VanDerWaalsContact O-N 3.09Å
263	L	90.2	Very high	88.6	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.8	-15.2	176.3	-71.3	172.6	0	0	0	113.5	V227 T228 Q235 V239 C259 V260 Y261 Q265 S266 V271 A275	V227-L263 HydrophobicContact CG1-CD2 4.23Å; T228-L263 HydrophobicContact CG2-CD2 4.46Å; Q235-L263 HydrophobicContact CB-CD2 4.4Å; Q235-L263 HydrophobicContact CG-CD2 4.14Å; V239-L263 HydrophobicContact CG2-CD1 3.53Å; C259-L263 WeakPolarHBondContact O-CG 3.35Å; C259-L263 PolarHBondContact O-N 2.85Å; C259-L263 VanDerWaalsContact O-N 3.13Å; V260-L263 WeakPolarHBondContact O-CB 3.26Å; V260-L263 PolarHBondContact O-N 3.23Å; V260-L263 VanDerWaalsContact O-N 3.11Å; Y261-L263 VanDerWaalsContact C-N 3.34Å; L263-Q265 PolarHBondContact O-N 3.14Å; L263-S266 VanDerWaalsContact O-CB 3.24Å; L263-S266 WeakPolarHBondContact O-CB 3.3Å; L263-S266 PolarHBondContact O-N 3.44Å; L263-V271 HydrophobicContact CB-CG1 4.31Å; L263-V271 HydrophobicContact CD2-CG1 4.22Å; L263-A275 HydrophobicContact CB-CB 3.84Å
264	L	90.9	Very high	88.8	Confident	14 Å²	14	51.1 Å²	51.1	7%	0.073	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-22.4	167.9	-60.6	-178.4	0	0	0	112.8	Y261 N262 R272 A275 A276 L279 A291 T295	Y261-L264 HydrophobicContact CD2-CD1 4.44Å; Y261-L264 WeakPolarHBondContact O-CB 3.02Å; Y261-L264 WeakPolarHBondContact O-CG 3.41Å; Y261-L264 PolarHBondContact O-N 3.29Å; N262-L264 PolarHBondContact O-N 3.49Å; L264-R272 VanDerWaalsContact O-CD 3.29Å; L264-R272 WeakPolarHBondContact O-CD 3.17Å; L264-R272 WeakPolarHBondContact O-CG 3.19Å; L264-A275 HydrophobicContact CD2-CB 4.13Å; L264-A276 HydrophobicContact CD2-CB 3.8Å; L264-L279 HydrophobicContact CD1-CD2 3.77Å; L264-L279 HydrophobicContact CG-CD2 4.36Å; L264-A291 HydrophobicContact CD1-CB 3.87Å; L264-T295 HydrophobicContact CD2-CG2 4.39Å
265	Q	88.8	Confident	89.2	Confident	165 Å²	165	45.4 Å²	45.4	77%	0.771	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	10.3	177.3	-59.5	-179.4	-5.5	0	0	113	N262 L263	N262-Q265 PolarHBondContact O-N 3.26Å; N262-Q265 VanDerWaalsContact O-N 3.09Å; L263-Q265 PolarHBondContact O-N 3.14Å
266	S	88.9	Confident	89.7	Confident	7 Å²	7	41.2 Å²	41.2	5%	0.049	21%	0.212	C	C	.	.			trans	-60.2	146.4	176.6	-179.3	0	0	0	0	111.4	Q235 L263 S268 R272	Q235-S266 PolarHBondContact OE1-OG 3Å; L263-S266 VanDerWaalsContact O-CB 3.24Å; L263-S266 WeakPolarHBondContact O-CB 3.3Å; L263-S266 PolarHBondContact O-N 3.44Å; S266-S268 PolarHBondContact O-N 3.24Å; S266-S268 PolarHBondContact OG-N 2.98Å; S266-R272 WeakPolarHBondContact O-CD 3.22Å; S266-R272 WeakPolarHBondContact O-CG 2.96Å; S266-R272 PolarHBondContact O-NE 3.02Å
267	S	88	Confident	90	Very high	125 Å²	125	41.6 Å²	41.6	87%	0.874	22%	0.215	S	C	*	.	S	Bend	trans	-67.3	-22.6	174.2	55	0	0	0	0	112.7
268	S	90.2	Very high	90.2	Very high	20 Å²	20	39.6 Å²	39.6	14%	0.14	21%	0.205	C	C	.	.			trans	-86	124.6	179.2	177.1	0	0	0	0	111.7	S266 A270 V271 R272	S266-S268 PolarHBondContact O-N 3.24Å; S266-S268 PolarHBondContact OG-N 2.98Å; S268-A270 VanDerWaalsContact C-N 3.31Å; S268-A270 PolarHBondContact O-N 3Å; S268-V271 PolarHBondContact O-N 2.74Å; S268-R272 WeakPolarHBondContact O-CG 3.21Å; S268-R272 PolarHBondContact O-N 2.98Å
269	S	91.3	Very high	90.5	Very high	35 Å²	35	33 Å²	33	25%	0.245	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-37.1	176	-59.5	0	0	0	0	113	R272 Y273 E303	S269-R272 PolarHBondContact O-N 2.95Å; S269-R272 PolarHBondContact OG-NH2 3.21Å; S269-Y273 WeakPolarHBondContact O-CB 3.48Å; S269-Y273 PolarHBondContact O-N 3.09Å; S269-E303 WeakPolarHBondContact CB-OE1 3.41Å; S269-E303 PolarHBondContact OG-OE1 2.87Å
270	A	91.3	Very high	90.8	Very high	50 Å²	50	33 Å²	33	41%	0.413	18%	0.18	S	C	.	.	H	α-helix	trans	-64.1	-42.7	177.1	0	0	0	0	0	111.7	L236 S268 Y273 E274	L236-A270 HydrophobicContact CD1-CB 4.45Å; L236-A270 HydrophobicContact CD2-CB 4.39Å; S268-A270 VanDerWaalsContact C-N 3.31Å; S268-A270 PolarHBondContact O-N 3Å; A270-Y273 PolarHBondContact O-N 3.38Å; A270-E274 WeakPolarHBondContact O-CG 3.46Å; A270-E274 PolarHBondContact O-N 3.22Å
271	V	91.5	Very high	90.7	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-65.5	-42.8	176.9	177.7	0	0	0	0	110.7	D232 Q235 L236 L263 S268 Y273 E274 A275	D232-V271 HydrophobicContact CB-CG2 4.12Å; Q235-V271 HydrophobicContact CB-CB 4.5Å; Q235-V271 HydrophobicContact CB-CG1 3.88Å; Q235-V271 HydrophobicContact CB-CG2 3.74Å; L236-V271 HydrophobicContact CD2-CG2 4.04Å; L236-V271 HydrophobicContact CG-CG2 3.91Å; L263-V271 HydrophobicContact CB-CG1 4.31Å; L263-V271 HydrophobicContact CD2-CG1 4.22Å; S268-V271 PolarHBondContact O-N 2.74Å; V271-Y273 VanDerWaalsContact C-N 3.34Å; V271-Y273 PolarHBondContact O-N 2.99Å; V271-E274 PolarHBondContact O-N 3.21Å; V271-A275 WeakPolarHBondContact O-CB 3.4Å; V271-A275 PolarHBondContact O-N 2.93Å
272	R	93.5	Very high	90.6	Very high	30 Å²	30	29.2 Å²	29.2	11%	0.113	17%	0.167	C	C	.	.	H	α-helix	trans	-60.4	-43.5	176.9	-72.3	-170.6	-72.2	130.3	0.6	112.1	L264 S266 S268 S269 A276 T295 L299	L264-R272 VanDerWaalsContact O-CD 3.29Å; L264-R272 WeakPolarHBondContact O-CD 3.17Å; L264-R272 WeakPolarHBondContact O-CG 3.19Å; S266-R272 WeakPolarHBondContact O-CD 3.22Å; S266-R272 WeakPolarHBondContact O-CG 2.96Å; S266-R272 PolarHBondContact O-NE 3.02Å; S268-R272 WeakPolarHBondContact O-CG 3.21Å; S268-R272 PolarHBondContact O-N 2.98Å; S269-R272 PolarHBondContact O-N 2.95Å; S269-R272 PolarHBondContact OG-NH2 3.21Å; R272-A276 VanDerWaalsContact O-CB 3.26Å; R272-A276 WeakPolarHBondContact O-CB 3.43Å; R272-A276 PolarHBondContact O-N 3.33Å; R272-T295 HydrophobicContact CB-CG2 3.81Å; R272-T295 HydrophobicContact CG-CG2 4.41Å; R272-L299 HydrophobicContact CB-CD1 4.27Å; R272-L299 VanDerWaalsContact CZ-CD2 3.4Å; R272-L299 VanDerWaalsContact NH1-CD2 3.34Å; R272-L299 VanDerWaalsContact NH2-CD2 3.31Å
273	Y	93.9	Very high	90.5	Very high	45 Å²	45	28.5 Å²	28.5	18%	0.176	16%	0.164	C	C	.	.	H	α-helix	trans	-61.6	-50.2	177.3	179.2	-92.1	0	0	0	112	S269 A270 V271 A276 S277 F296 L299 V312 R315	S269-Y273 WeakPolarHBondContact O-CB 3.48Å; S269-Y273 PolarHBondContact O-N 3.09Å; A270-Y273 PolarHBondContact O-N 3.38Å; V271-Y273 VanDerWaalsContact C-N 3.34Å; V271-Y273 PolarHBondContact O-N 2.99Å; Y273-A276 PolarHBondContact O-N 3.21Å; Y273-S277 PolarHBondContact O-N 3.31Å; Y273-S277 PolarHBondContact O-OG 3.19Å; Y273-F296 AromaticContact CD2-CD1 3.93Å; Y273-F296 HydrophobicContact CD2-CD1 3.93Å; Y273-F296 AromaticContact CD2-CE1 3.54Å; Y273-F296 HydrophobicContact CD2-CE1 3.54Å; Y273-F296 HydrophobicContact CE2-CD1 4.22Å; Y273-F296 AromaticContact CE2-CE1 3.74Å; Y273-F296 HydrophobicContact CE2-CE1 3.74Å; Y273-F296 HydrophobicContact CG-CE1 4.21Å; Y273-L299 HydrophobicContact CD2-CD1 4.46Å; Y273-V312 HydrophobicContact CD2-CG2 3.85Å; Y273-V312 HydrophobicContact CE2-CB 4.43Å; Y273-V312 HydrophobicContact CE2-CG2 3.8Å; Y273-R315 HydrophobicContact CE2-CB 4.33Å; Y273-R315 HydrophobicContact CE2-CG 4.29Å; Y273-R315 WeakPolarHBondContact OH-CB 3.06Å; Y273-R315 WeakPolarHBondContact OH-CG 3.37Å
274	E	91.1	Very high	90.2	Very high	48 Å²	48	32.6 Å²	32.6	22%	0.224	19%	0.193	C	C	.	.	H	α-helix	trans	-67.1	-42.8	179.7	-72.8	-59.3	148	0	0	112.1	L236 V239 A270 V271 A276 S277 V278 F691	L236-E274 HydrophobicContact CD2-CB 4.11Å; L236-E274 HydrophobicContact CD2-CG 3.78Å; V239-E274 HydrophobicContact CG1-CB 4.08Å; A270-E274 WeakPolarHBondContact O-CG 3.46Å; A270-E274 PolarHBondContact O-N 3.22Å; V271-E274 PolarHBondContact O-N 3.21Å; E274-A276 PolarHBondContact O-N 3.45Å; E274-S277 PolarHBondContact O-N 2.85Å; E274-V278 WeakPolarHBondContact O-CB 3.39Å; E274-V278 WeakPolarHBondContact O-CG2 3.42Å; E274-V278 PolarHBondContact O-N 3.41Å; E274-F691 WeakPolarHBondContact OE2-CZ 3.32Å
275	A	92.4	Very high	90	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-41.2	177.7	0	0	0	0	0	111.9	V239 V260 L263 L264 V271 L279	V239-A275 HydrophobicContact CG2-CB 4.42Å; V260-A275 HydrophobicContact CG1-CB 4.29Å; V260-A275 WeakPolarHBondContact CG1-O 3.46Å; L263-A275 HydrophobicContact CB-CB 3.84Å; L264-A275 HydrophobicContact CD2-CB 4.13Å; V271-A275 WeakPolarHBondContact O-CB 3.4Å; V271-A275 PolarHBondContact O-N 2.93Å; A275-L279 WeakPolarHBondContact O-CB 3.34Å; A275-L279 PolarHBondContact O-N 3.34Å
276	A	93.5	Very high	90	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.9	-43.5	175.5	0	0	0	0	0	111.9	L264 R272 Y273 E274 L279 I280 T295 F296	L264-A276 HydrophobicContact CD2-CB 3.8Å; R272-A276 VanDerWaalsContact O-CB 3.26Å; R272-A276 WeakPolarHBondContact O-CB 3.43Å; R272-A276 PolarHBondContact O-N 3.33Å; Y273-A276 PolarHBondContact O-N 3.21Å; E274-A276 PolarHBondContact O-N 3.45Å; A276-L279 PolarHBondContact O-N 3.44Å; A276-I280 WeakPolarHBondContact O-CG1 3.41Å; A276-I280 PolarHBondContact O-N 3.47Å; A276-T295 HydrophobicContact CB-CG2 4.48Å; A276-F296 HydrophobicContact CB-CD1 4.43Å; A276-F296 HydrophobicContact CB-CD2 4.24Å; A276-F296 HydrophobicContact CB-CE1 3.93Å; A276-F296 HydrophobicContact CB-CE2 3.71Å; A276-F296 HydrophobicContact CB-CZ 3.54Å
277	S	92.1	Very high	90	Very high	8 Å²	8	33.5 Å²	33.5	6%	0.056	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-51.9	175.7	-73.8	0	0	0	0	111.6	Y273 E274 L279 I280 S281 F296 R315	Y273-S277 PolarHBondContact O-N 3.31Å; Y273-S277 PolarHBondContact O-OG 3.19Å; E274-S277 PolarHBondContact O-N 2.85Å; S277-L279 VanDerWaalsContact C-N 3.34Å; S277-L279 PolarHBondContact O-N 2.94Å; S277-I280 PolarHBondContact O-N 3.29Å; S277-S281 PolarHBondContact O-N 3.15Å; S277-S281 PolarHBondContact O-OG 3.37Å; S277-F296 WeakPolarHBondContact OG-CZ 3.42Å; S277-R315 PolarHBondContact OG-NE 2.96Å
278	V	90.1	Very high	90.1	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.024	18%	0.182	C	C	.	.	H	α-helix	trans	-61.7	-42.2	179.4	166.4	0	0	0	0	111.1	V239 Y243 V260 E274 I280 S281 L282 F691	V239-V278 HydrophobicContact CG1-CB 4.03Å; V239-V278 HydrophobicContact CG1-CG1 4.45Å; V239-V278 HydrophobicContact CG1-CG2 3.6Å; Y243-V278 HydrophobicContact CD2-CB 4.39Å; Y243-V278 HydrophobicContact CD2-CG1 4.02Å; Y243-V278 HydrophobicContact CD2-CG2 3.99Å; Y243-V278 HydrophobicContact CG-CG1 4.39Å; Y243-V278 HydrophobicContact CG-CG2 4.01Å; V260-V278 HydrophobicContact CG1-CG1 4.24Å; E274-V278 WeakPolarHBondContact O-CB 3.39Å; E274-V278 WeakPolarHBondContact O-CG2 3.42Å; E274-V278 PolarHBondContact O-N 3.41Å; V278-I280 PolarHBondContact O-N 2.93Å; V278-S281 PolarHBondContact O-N 2.93Å; V278-S281 VanDerWaalsContact O-N 3.15Å; V278-L282 HydrophobicContact CG1-CD1 3.63Å; V278-L282 HydrophobicContact CG1-CG 4.03Å; V278-L282 VanDerWaalsContact O-CG 3.26Å; V278-L282 WeakPolarHBondContact O-CG 3.48Å; V278-L282 PolarHBondContact O-N 3.46Å; V278-F691 HydrophobicContact CG2-CE2 4.35Å; V278-F691 HydrophobicContact CG2-CZ 4.5Å
279	L	91.2	Very high	90.2	Very high	0 Å²	0	27 Å²	27	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.8	-44.9	-178.3	-173.4	60.1	0	0	0	112.3	I257 V260 Y261 L264 A275 A276 S277 S281 L282 T283 A288 S292	I257-L279 HydrophobicContact CD1-CD1 4.49Å; I257-L279 HydrophobicContact CG1-CD1 3.86Å; V260-L279 HydrophobicContact CB-CD1 4.47Å; V260-L279 HydrophobicContact CG1-CB 3.9Å; V260-L279 HydrophobicContact CG1-CD1 4.31Å; Y261-L279 HydrophobicContact CD2-CD2 3.89Å; L264-L279 HydrophobicContact CD1-CD2 3.77Å; L264-L279 HydrophobicContact CG-CD2 4.36Å; A275-L279 WeakPolarHBondContact O-CB 3.34Å; A275-L279 PolarHBondContact O-N 3.34Å; A276-L279 PolarHBondContact O-N 3.44Å; S277-L279 VanDerWaalsContact C-N 3.34Å; S277-L279 PolarHBondContact O-N 2.94Å; L279-S281 VanDerWaalsContact C-N 3.26Å; L279-S281 PolarHBondContact O-N 3.39Å; L279-L282 PolarHBondContact O-N 3.06Å; L279-T283 HydrophobicContact CD1-CG2 3.98Å; L279-T283 HydrophobicContact CG-CG2 4.32Å; L279-T283 WeakPolarHBondContact O-CG2 3.47Å; L279-T283 PolarHBondContact O-N 3.3Å; L279-T283 VanDerWaalsContact O-N 3.1Å; L279-A288 HydrophobicContact CD1-CB 4.39Å; L279-A288 HydrophobicContact CD2-CB 4.15Å; L279-A288 HydrophobicContact CG-CB 4.17Å; L279-S292 WeakPolarHBondContact CD2-OG 3.39Å
280	I	90.7	Very high	90.3	Very high	4 Å²	4	30 Å²	30	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-62.2	-36.1	176.4	-65.6	172.3	0	0	0	111.1	A276 S277 V278 S292 L293 F296 L319 V325	A276-I280 WeakPolarHBondContact O-CG1 3.41Å; A276-I280 PolarHBondContact O-N 3.47Å; S277-I280 PolarHBondContact O-N 3.29Å; V278-I280 PolarHBondContact O-N 2.93Å; I280-S292 VanDerWaalsContact CG1-CB 3.48Å; I280-L293 HydrophobicContact CD1-CD2 4.29Å; I280-F296 HydrophobicContact CD1-CE2 3.87Å; I280-L319 HydrophobicContact CD1-CD1 3.84Å; I280-L319 HydrophobicContact CG2-CD2 4.16Å; I280-V325 HydrophobicContact CG2-CG2 3.66Å
281	S	86.8	Confident	90.4	Very high	12 Å²	12	28.4 Å²	28.4	8%	0.084	17%	0.168	C	C	.	.	H	α-helix	trans	-69.5	-34.9	177.9	-58.4	0	0	0	0	112.9	S277 V278 L279 K687 L690	S277-S281 PolarHBondContact O-N 3.15Å; S277-S281 PolarHBondContact O-OG 3.37Å; V278-S281 PolarHBondContact O-N 2.93Å; V278-S281 VanDerWaalsContact O-N 3.15Å; L279-S281 VanDerWaalsContact C-N 3.26Å; L279-S281 PolarHBondContact O-N 3.39Å; S281-K687 PolarHBondContact O-NZ 2.83Å; S281-L690 WeakPolarHBondContact OG-CD1 3.49Å
282	L	86.8	Confident	90.5	Very high	7 Å²	7	28.4 Å²	28.4	4%	0.037	17%	0.168	C	C	.	.	H	α-helix	trans	-83.6	-26	-176.2	-66.7	-175.3	0	0	0	114.8	I242 Y243 C246 M247 V253 V278 L279	I242-L282 HydrophobicContact CG2-CD1 4.15Å; Y243-L282 HydrophobicContact CD2-CD2 4.34Å; C246-L282 HydrophobicContact CB-CD1 4.17Å; C246-L282 HydrophobicContact CB-CD2 3.37Å; C246-L282 HydrophobicContact CB-CG 4.41Å; M247-L282 HydrophobicContact CE-CD2 3.48Å; M247-L282 VanDerWaalsContact CE-CD2 3.48Å; V253-L282 HydrophobicContact CG1-CB 4.4Å; V253-L282 HydrophobicContact CG2-CD2 4.41Å; V278-L282 HydrophobicContact CG1-CD1 3.63Å; V278-L282 HydrophobicContact CG1-CG 4.03Å; V278-L282 VanDerWaalsContact O-CG 3.26Å; V278-L282 WeakPolarHBondContact O-CG 3.48Å; V278-L282 PolarHBondContact O-N 3.46Å; L279-L282 PolarHBondContact O-N 3.06Å
283	T	86.4	Confident	90.5	Very high	24 Å²	24	27 Å²	27	15%	0.147	16%	0.163	C	C	.	.			trans	-137.8	143.6	-176.7	-171.3	0	0	0	0	113.8	I257 L279 S285 A288	I257-T283 HydrophobicContact CD1-CG2 3.88Å; L279-T283 HydrophobicContact CD1-CG2 3.98Å; L279-T283 HydrophobicContact CG-CG2 4.32Å; L279-T283 WeakPolarHBondContact O-CG2 3.47Å; L279-T283 PolarHBondContact O-N 3.3Å; L279-T283 VanDerWaalsContact O-N 3.1Å; T283-S285 VanDerWaalsContact C-N 3.35Å; T283-S285 WeakPolarHBondContact OG1-CB 3.42Å; T283-S285 PolarHBondContact OG1-N 3.27Å; T283-S285 VanDerWaalsContact OG1-N 3.15Å; T283-A288 HydrophobicContact CG2-CB 3.43Å; T283-A288 VanDerWaalsContact CG2-CB 3.43Å
284	S	84.4	Confident	90.5	Very high	87 Å²	87	27.5 Å²	27.5	61%	0.608	17%	0.169	S	C	*	.			trans	-94.4	10	171	-50	0	0	0	0	112.7	P286	S284-P286 WeakPolarHBondContact O-CD 3.28Å
285	S	88	Confident	90.6	Very high	53 Å²	53	26 Å²	26	37%	0.371	16%	0.163	S	C	.	.			trans	-66.5	122	179.7	177.1	0	0	0	0	111	T283 A287 A288 I289	T283-S285 VanDerWaalsContact C-N 3.35Å; T283-S285 WeakPolarHBondContact OG1-CB 3.42Å; T283-S285 PolarHBondContact OG1-N 3.27Å; T283-S285 VanDerWaalsContact OG1-N 3.15Å; S285-A287 PolarHBondContact O-N 3Å; S285-A287 VanDerWaalsContact O-N 3.15Å; S285-A288 PolarHBondContact O-N 3.25Å; S285-A288 VanDerWaalsContact O-N 3.08Å; S285-I289 WeakPolarHBondContact O-CG1 3.5Å; S285-I289 PolarHBondContact O-N 3.4Å
286	P	87.6	Confident	90.8	Very high	88 Å²	88	26 Å²	26	57%	0.571	16%	0.163	S	C	*	.	H	α-helix	trans	-58.4	-31.6	-179.2	-26.1	34.7	0	0	0	113.8	S284 R290	S284-P286 WeakPolarHBondContact O-CD 3.28Å; P286-R290 VanDerWaalsContact O-CB 3.28Å; P286-R290 WeakPolarHBondContact O-CB 3.18Å; P286-R290 PolarHBondContact O-N 3.48Å
287	A	89.7	Confident	90.7	Very high	64 Å²	64	26.2 Å²	26.2	53%	0.529	16%	0.164	S	C	.	.	H	α-helix	trans	-69.3	-39.4	178.4	0	0	0	0	0	112.2	S285 A291	S285-A287 PolarHBondContact O-N 3Å; S285-A287 VanDerWaalsContact O-N 3.15Å; A287-A291 WeakPolarHBondContact O-CB 3.48Å; A287-A291 PolarHBondContact O-N 3.39Å
288	A	90.3	Very high	90.8	Very high	7 Å²	7	30.3 Å²	30.3	6%	0.058	18%	0.182	C	C	.	.	H	α-helix	trans	-72.2	-40.5	177.2	0	0	0	0	0	111.5	L279 T283 S285 A291 S292	L279-A288 HydrophobicContact CD1-CB 4.39Å; L279-A288 HydrophobicContact CD2-CB 4.15Å; L279-A288 HydrophobicContact CG-CB 4.17Å; T283-A288 HydrophobicContact CG2-CB 3.43Å; T283-A288 VanDerWaalsContact CG2-CB 3.43Å; S285-A288 PolarHBondContact O-N 3.25Å; S285-A288 VanDerWaalsContact O-N 3.08Å; A288-A291 PolarHBondContact O-N 2.61Å; A288-S292 WeakPolarHBondContact O-CB 3.29Å; A288-S292 PolarHBondContact O-N 3.24Å; A288-S292 PolarHBondContact O-OG 3.03Å
289	I	91.5	Very high	90.9	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-59.4	-49.1	173.1	-65.9	169.8	0	0	0	109.8	S285 A291 S292 L293 A324 V325 V328	S285-I289 WeakPolarHBondContact O-CG1 3.5Å; S285-I289 PolarHBondContact O-N 3.4Å; I289-A291 PolarHBondContact O-N 2.87Å; I289-S292 PolarHBondContact O-N 3.01Å; I289-L293 HydrophobicContact CG2-CD1 3.91Å; I289-L293 HydrophobicContact CG2-CG 4.23Å; I289-L293 WeakPolarHBondContact O-CG 3.49Å; I289-L293 PolarHBondContact O-N 2.69Å; I289-A324 HydrophobicContact CD1-CB 4.05Å; I289-V325 HydrophobicContact CG2-CB 4.44Å; I289-V325 HydrophobicContact CG2-CG1 4.48Å; I289-V325 HydrophobicContact CG2-CG2 4.09Å; I289-V328 HydrophobicContact CG2-CB 4.06Å; I289-V328 HydrophobicContact CG2-CG1 4.38Å; I289-V328 HydrophobicContact CG2-CG2 4.03Å
290	R	93.5	Very high	90.9	Very high	98 Å²	98	30.4 Å²	30.4	37%	0.37	18%	0.183	S	C	.	.	H	α-helix	trans	-59	-44.9	177.9	-171.5	178.8	-64.1	-87.8	-1.8	112.4	P286 S292 L293 N294 V328 D331	P286-R290 VanDerWaalsContact O-CB 3.28Å; P286-R290 WeakPolarHBondContact O-CB 3.18Å; P286-R290 PolarHBondContact O-N 3.48Å; R290-S292 VanDerWaalsContact C-N 3.32Å; R290-S292 PolarHBondContact O-N 3.34Å; R290-L293 PolarHBondContact O-N 3.14Å; R290-N294 WeakPolarHBondContact O-CB 3.44Å; R290-N294 PolarHBondContact O-N 3.15Å; R290-V328 HydrophobicContact CB-CG1 3.77Å; R290-V328 HydrophobicContact CG-CG1 4.07Å; R290-D331 IonicContact CZ-OD2 2.74Å; R290-D331 IonicContact NH1-OD2 3.26Å; R290-D331 IonicContact NH2-OD2 3Å; R290-D331 PolarHBondContact NH2-OD2 2.77Å
291	A	93.3	Very high	90.9	Very high	17 Å²	17	33.1 Å²	33.1	14%	0.14	20%	0.197	C	C	.	.	H	α-helix	trans	-61.6	-41.3	177.1	0	0	0	0	0	112.2	Y261 L264 A287 A288 I289 T295	Y261-A291 HydrophobicContact CE2-CB 3.74Å; L264-A291 HydrophobicContact CD1-CB 3.87Å; A287-A291 WeakPolarHBondContact O-CB 3.48Å; A287-A291 PolarHBondContact O-N 3.39Å; A288-A291 PolarHBondContact O-N 2.61Å; I289-A291 PolarHBondContact O-N 2.87Å; A291-T295 PolarHBondContact O-N 3Å; A291-T295 PolarHBondContact O-OG1 2.88Å
292	S	94.1	Very high	91	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-66.6	-45.2	178.1	-53.2	0	0	0	0	111.8	L279 I280 A288 I289 R290 T295 F296	L279-S292 WeakPolarHBondContact CD2-OG 3.39Å; I280-S292 VanDerWaalsContact CG1-CB 3.48Å; A288-S292 WeakPolarHBondContact O-CB 3.29Å; A288-S292 PolarHBondContact O-N 3.24Å; A288-S292 PolarHBondContact O-OG 3.03Å; I289-S292 PolarHBondContact O-N 3.01Å; R290-S292 VanDerWaalsContact C-N 3.32Å; R290-S292 PolarHBondContact O-N 3.34Å; S292-T295 VanDerWaalsContact O-CB 3.31Å; S292-T295 WeakPolarHBondContact O-CB 3.46Å; S292-T295 PolarHBondContact O-N 3.27Å; S292-T295 VanDerWaalsContact O-N 3.13Å; S292-F296 VanDerWaalsContact O-CD2 3.3Å; S292-F296 WeakPolarHBondContact O-CD2 3.44Å; S292-F296 PolarHBondContact O-N 2.77Å
293	L	93.2	Very high	91.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.4	-43.6	176.6	-69.8	-179.4	0	0	0	112.1	I280 I289 R290 T295 F296 V297 L316 V325 V328 L329	I280-L293 HydrophobicContact CD1-CD2 4.29Å; I289-L293 HydrophobicContact CG2-CD1 3.91Å; I289-L293 HydrophobicContact CG2-CG 4.23Å; I289-L293 WeakPolarHBondContact O-CG 3.49Å; I289-L293 PolarHBondContact O-N 2.69Å; R290-L293 PolarHBondContact O-N 3.14Å; L293-T295 PolarHBondContact O-N 3.38Å; L293-F296 HydrophobicContact CD2-CD2 4.4Å; L293-F296 PolarHBondContact O-N 3.25Å; L293-F296 VanDerWaalsContact O-N 3.17Å; L293-V297 WeakPolarHBondContact O-CG2 3.34Å; L293-V297 PolarHBondContact O-N 3.34Å; L293-L316 HydrophobicContact CD2-CD2 3.71Å; L293-V325 HydrophobicContact CD1-CG1 4.06Å; L293-V325 HydrophobicContact CD2-CG1 3.88Å; L293-V325 HydrophobicContact CG-CG1 4.39Å; L293-V328 HydrophobicContact CD1-CB 3.83Å; L293-V328 HydrophobicContact CD1-CG1 3.76Å; L293-L329 HydrophobicContact CD1-CB 4.09Å; L293-L329 HydrophobicContact CD1-CD1 4.33Å; L293-L329 HydrophobicContact CD2-CD1 4.26Å
294	N	94.1	Very high	91.1	Very high	56 Å²	56	43.4 Å²	43.4	30%	0.299	26%	0.258	S	S	.	.	H	α-helix	trans	-59.4	-37.7	173.4	-73	-6.6	0	0	0	111.3	R290 V297 E298	R290-N294 WeakPolarHBondContact O-CB 3.44Å; R290-N294 PolarHBondContact O-N 3.15Å; N294-V297 PolarHBondContact O-N 3.32Å; N294-E298 WeakPolarHBondContact O-CB 3.47Å; N294-E298 WeakPolarHBondContact O-CG 3.15Å; N294-E298 PolarHBondContact O-N 3.2Å
295	T	94.1	Very high	91.3	Very high	15 Å²	15	42.9 Å²	42.9	9%	0.092	25%	0.248	C	C	.	.	H	α-helix	trans	-63.6	-43.7	176.1	-54.5	0	0	0	0	111.5	L264 R272 A276 A291 S292 L293 E298 L299	L264-T295 HydrophobicContact CD2-CG2 4.39Å; R272-T295 HydrophobicContact CB-CG2 3.81Å; R272-T295 HydrophobicContact CG-CG2 4.41Å; A276-T295 HydrophobicContact CB-CG2 4.48Å; A291-T295 PolarHBondContact O-N 3Å; A291-T295 PolarHBondContact O-OG1 2.88Å; S292-T295 VanDerWaalsContact O-CB 3.31Å; S292-T295 WeakPolarHBondContact O-CB 3.46Å; S292-T295 PolarHBondContact O-N 3.27Å; S292-T295 VanDerWaalsContact O-N 3.13Å; L293-T295 PolarHBondContact O-N 3.38Å; T295-E298 PolarHBondContact O-N 3.39Å; T295-L299 HydrophobicContact CG2-CD1 4.37Å; T295-L299 VanDerWaalsContact O-CG 3.29Å; T295-L299 WeakPolarHBondContact O-CG 3.18Å; T295-L299 PolarHBondContact O-N 3.33Å
296	F	94.9	Very high	91.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62.3	-45.2	173.8	-71.4	-55.2	0	0	0	112.4	Y273 A276 S277 I280 S292 L293 E298 L299 I300 V312 R315 L316 L319	Y273-F296 AromaticContact CD2-CD1 3.93Å; Y273-F296 HydrophobicContact CD2-CD1 3.93Å; Y273-F296 AromaticContact CD2-CE1 3.54Å; Y273-F296 HydrophobicContact CD2-CE1 3.54Å; Y273-F296 HydrophobicContact CE2-CD1 4.22Å; Y273-F296 AromaticContact CE2-CE1 3.74Å; Y273-F296 HydrophobicContact CE2-CE1 3.74Å; Y273-F296 HydrophobicContact CG-CE1 4.21Å; A276-F296 HydrophobicContact CB-CD1 4.43Å; A276-F296 HydrophobicContact CB-CD2 4.24Å; A276-F296 HydrophobicContact CB-CE1 3.93Å; A276-F296 HydrophobicContact CB-CE2 3.71Å; A276-F296 HydrophobicContact CB-CZ 3.54Å; S277-F296 WeakPolarHBondContact OG-CZ 3.42Å; I280-F296 HydrophobicContact CD1-CE2 3.87Å; S292-F296 VanDerWaalsContact O-CD2 3.3Å; S292-F296 WeakPolarHBondContact O-CD2 3.44Å; S292-F296 PolarHBondContact O-N 2.77Å; L293-F296 HydrophobicContact CD2-CD2 4.4Å; L293-F296 PolarHBondContact O-N 3.25Å; L293-F296 VanDerWaalsContact O-N 3.17Å; F296-E298 VanDerWaalsContact C-N 3.32Å; F296-E298 PolarHBondContact O-N 2.86Å; F296-L299 HydrophobicContact CD1-CD1 4.42Å; F296-L299 WeakPolarHBondContact O-CB 3.18Å; F296-L299 PolarHBondContact O-N 3.04Å; F296-L299 VanDerWaalsContact O-N 3.13Å; F296-I300 WeakPolarHBondContact O-CG1 3.28Å; F296-I300 PolarHBondContact O-N 3.18Å; F296-V312 HydrophobicContact CB-CG1 3.87Å; F296-V312 HydrophobicContact CD1-CG1 3.76Å; F296-V312 HydrophobicContact CG-CG1 4.18Å; F296-R315 HydrophobicContact CZ-CG 4.47Å; F296-L316 HydrophobicContact CB-CD2 3.98Å; F296-L316 HydrophobicContact CB-CG 4.45Å; F296-L316 HydrophobicContact CD2-CD2 4.01Å; F296-L316 HydrophobicContact CG-CD2 4.24Å; F296-L319 HydrophobicContact CD2-CD1 4.39Å; F296-L319 HydrophobicContact CE2-CD1 3.72Å; F296-L319 HydrophobicContact CZ-CD1 4.27Å
297	V	92.9	Very high	91.4	Very high	6 Å²	6	43.7 Å²	43.7	4%	0.036	24%	0.244	C	C	.	.	H	α-helix	trans	-64.9	-37.8	179	174.2	0	0	0	0	111.4	L293 N294 N301 V332 D335	L293-V297 WeakPolarHBondContact O-CG2 3.34Å; L293-V297 PolarHBondContact O-N 3.34Å; N294-V297 PolarHBondContact O-N 3.32Å; V297-N301 WeakPolarHBondContact CG1-ND2 3.41Å; V297-N301 WeakPolarHBondContact O-CB 3.25Å; V297-N301 PolarHBondContact O-N 2.99Å; V297-N301 VanDerWaalsContact O-N 3.13Å; V297-N301 PolarHBondContact O-ND2 3.49Å; V297-V332 HydrophobicContact CG2-CG1 4.02Å; V297-D335 HydrophobicContact CG1-CB 3.69Å
298	E	92.5	Very high	91.3	Very high	94 Å²	94	43.1 Å²	43.1	44%	0.439	23%	0.233	S	C	.	.	H	α-helix	trans	-64.4	-39.3	171.7	-79.5	-168	-149.5	0	0	112.7	N294 T295 F296 N301 K302	N294-E298 WeakPolarHBondContact O-CB 3.47Å; N294-E298 WeakPolarHBondContact O-CG 3.15Å; N294-E298 PolarHBondContact O-N 3.2Å; T295-E298 PolarHBondContact O-N 3.39Å; F296-E298 VanDerWaalsContact C-N 3.32Å; F296-E298 PolarHBondContact O-N 2.86Å; E298-N301 PolarHBondContact O-N 3.41Å; E298-K302 VanDerWaalsContact O-CB 3.31Å; E298-K302 WeakPolarHBondContact O-CB 3.5Å; E298-K302 WeakPolarHBondContact O-CG 3.48Å; E298-K302 PolarHBondContact O-N 2.91Å; E298-K302 IonicContact OE2-NZ 3.99Å; E298-K302 PolarHBondContact OE2-NZ 3.06Å
299	L	92.4	Very high	91.4	Very high	4 Å²	4	43.8 Å²	43.8	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-49.2	175.5	-76.5	165.7	0	0	0	111	R272 Y273 T295 F296 N301 K302 E303	R272-L299 HydrophobicContact CB-CD1 4.27Å; R272-L299 VanDerWaalsContact CZ-CD2 3.4Å; R272-L299 VanDerWaalsContact NH1-CD2 3.34Å; R272-L299 VanDerWaalsContact NH2-CD2 3.31Å; Y273-L299 HydrophobicContact CD2-CD1 4.46Å; T295-L299 HydrophobicContact CG2-CD1 4.37Å; T295-L299 VanDerWaalsContact O-CG 3.29Å; T295-L299 WeakPolarHBondContact O-CG 3.18Å; T295-L299 PolarHBondContact O-N 3.33Å; F296-L299 HydrophobicContact CD1-CD1 4.42Å; F296-L299 WeakPolarHBondContact O-CB 3.18Å; F296-L299 PolarHBondContact O-N 3.04Å; F296-L299 VanDerWaalsContact O-N 3.13Å; L299-N301 VanDerWaalsContact C-N 3.28Å; L299-N301 PolarHBondContact O-N 2.87Å; L299-K302 PolarHBondContact O-N 3.09Å; L299-E303 WeakPolarHBondContact O-CB 3.2Å; L299-E303 VanDerWaalsContact O-CG 3.27Å; L299-E303 WeakPolarHBondContact O-CG 3.35Å; L299-E303 PolarHBondContact O-N 3.41Å
300	I	91.5	Very high	91.3	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-40.9	179.3	-58.8	162.5	0	0	0	111.2	F296 K309 V312 I313 L316 V339	F296-I300 WeakPolarHBondContact O-CG1 3.28Å; F296-I300 PolarHBondContact O-N 3.18Å; I300-K309 HydrophobicContact CG2-CB 4.15Å; I300-K309 HydrophobicContact CG2-CD 4.47Å; I300-K309 HydrophobicContact CG2-CG 4.03Å; I300-K309 VanDerWaalsContact O-CE 3.27Å; I300-K309 WeakPolarHBondContact O-CE 3.13Å; I300-V312 HydrophobicContact CD1-CB 4.2Å; I300-V312 HydrophobicContact CD1-CG1 3.71Å; I300-V312 HydrophobicContact CG1-CB 3.65Å; I300-V312 HydrophobicContact CG1-CG1 3.45Å; I300-V312 VanDerWaalsContact CG1-CG1 3.45Å; I300-I313 HydrophobicContact CD1-CG1 4.12Å; I300-L316 HydrophobicContact CD1-CD1 3.66Å; I300-V339 HydrophobicContact CB-CG2 4.04Å; I300-V339 HydrophobicContact CG2-CB 4.08Å; I300-V339 HydrophobicContact CG2-CG1 3.48Å; I300-V339 VanDerWaalsContact CG2-CG1 3.48Å; I300-V339 HydrophobicContact CG2-CG2 3.38Å
301	N	90.4	Very high	91.1	Very high	61 Å²	61	45.1 Å²	45.1	33%	0.326	25%	0.248	S	C	.	.	H	α-helix	trans	-75.6	-30.7	-177.3	-76.5	-52.5	0	0	0	113.8	V297 E298 L299 D335 V339	V297-N301 WeakPolarHBondContact CG1-ND2 3.41Å; V297-N301 WeakPolarHBondContact O-CB 3.25Å; V297-N301 PolarHBondContact O-N 2.99Å; V297-N301 VanDerWaalsContact O-N 3.13Å; V297-N301 PolarHBondContact O-ND2 3.49Å; E298-N301 PolarHBondContact O-N 3.41Å; L299-N301 VanDerWaalsContact C-N 3.28Å; L299-N301 PolarHBondContact O-N 2.87Å; N301-D335 PolarHBondContact ND2-O 2.82Å; N301-V339 WeakPolarHBondContact OD1-CG2 3.4Å; N301-V339 PolarHBondContact OD1-N 2.79Å
302	K	89.5	Confident	91.1	Very high	141 Å²	141	44.4 Å²	44.4	61%	0.613	24%	0.242	S	C	*	.	H	α-helix	trans	-92.5	-30.6	-176.3	-72.7	173.7	178.4	164.8	0	113.7	E298 L299	E298-K302 VanDerWaalsContact O-CB 3.31Å; E298-K302 WeakPolarHBondContact O-CB 3.5Å; E298-K302 WeakPolarHBondContact O-CG 3.48Å; E298-K302 PolarHBondContact O-N 2.91Å; E298-K302 IonicContact OE2-NZ 3.99Å; E298-K302 PolarHBondContact OE2-NZ 3.06Å; L299-K302 PolarHBondContact O-N 3.09Å
303	E	89	Confident	91	Very high	50 Å²	50	44.5 Å²	44.5	23%	0.234	24%	0.243	C	C	.	.			trans	-71	140.1	-176.9	-71.5	-60.3	153.8	0	0	112	S269 L299 V308 K309	S269-E303 WeakPolarHBondContact CB-OE1 3.41Å; S269-E303 PolarHBondContact OG-OE1 2.87Å; L299-E303 WeakPolarHBondContact O-CB 3.2Å; L299-E303 VanDerWaalsContact O-CG 3.27Å; L299-E303 WeakPolarHBondContact O-CG 3.35Å; L299-E303 PolarHBondContact O-N 3.41Å; E303-V308 HydrophobicContact CB-CG1 4.33Å; E303-V308 HydrophobicContact CG-CG1 4.08Å; E303-K309 WeakPolarHBondContact O-CE 3.35Å; E303-K309 PolarHBondContact O-NZ 3.48Å
304	G	86.9	Confident	90.9	Very high	67 Å²	67	47.8 Å²	47.8	69%	0.691	26%	0.26	S	S	*	.			trans	-84.4	-29.4	179.4	0	0	0	0	0	113.5
305	D	88.6	Confident	90.7	Very high	77 Å²	77	46 Å²	46	41%	0.412	25%	0.249	S	C	.	.			trans	-78.6	123.7	-175.7	-170.5	-19.1	0	0	0	111.5	N307 V308 K309	D305-N307 VanDerWaalsContact C-N 3.3Å; D305-N307 PolarHBondContact O-N 2.67Å; D305-N307 WeakPolarHBondContact OD1-CB 3.48Å; D305-N307 PolarHBondContact OD1-N 3.33Å; D305-N307 PolarHBondContact OD1-ND2 2.82Å; D305-V308 HydrophobicContact CB-CB 4.31Å; D305-V308 HydrophobicContact CB-CG2 3.91Å; D305-V308 PolarHBondContact O-N 3.19Å; D305-K309 PolarHBondContact O-N 3.24Å
306	N	88.8	Confident	90.6	Very high	51 Å²	51	45.2 Å²	45.2	27%	0.273	25%	0.245	S	C	.	.	H	α-helix	trans	-65.5	-32.2	178.9	-65.5	-17.2	0	0	0	112.1	V308 K309 L310 D344 V347	N306-V308 PolarHBondContact O-N 2.95Å; N306-K309 WeakPolarHBondContact O-CB 3.33Å; N306-K309 PolarHBondContact O-N 3.33Å; N306-L310 WeakPolarHBondContact O-CG 3.4Å; N306-L310 PolarHBondContact O-N 3.32Å; N306-D344 WeakPolarHBondContact ND2-CB 3.31Å; N306-D344 PolarHBondContact ND2-OD2 2.87Å; N306-V347 HydrophobicContact CB-CG2 4.1Å
307	N	89.1	Confident	90.5	Very high	106 Å²	106	48.3 Å²	48.3	57%	0.567	26%	0.264	S	S	*	.	H	α-helix	trans	-65.2	-41.7	178.2	-62.4	-56.4	0	0	0	111.3	D305 K309 L310 I311	D305-N307 VanDerWaalsContact C-N 3.3Å; D305-N307 PolarHBondContact O-N 2.67Å; D305-N307 WeakPolarHBondContact OD1-CB 3.48Å; D305-N307 PolarHBondContact OD1-N 3.33Å; D305-N307 PolarHBondContact OD1-ND2 2.82Å; N307-K309 VanDerWaalsContact C-N 3.3Å; N307-K309 PolarHBondContact O-N 2.79Å; N307-L310 PolarHBondContact O-N 2.9Å; N307-I311 VanDerWaalsContact O-CG1 3.29Å; N307-I311 WeakPolarHBondContact O-CG1 3.44Å; N307-I311 PolarHBondContact O-N 3.01Å
308	V	87.5	Confident	90.2	Very high	52 Å²	52	50.9 Å²	50.9	32%	0.315	28%	0.275	S	S	.	.	H	α-helix	trans	-62.4	-41.6	176.1	179.1	0	0	0	0	110.1	E303 D305 N306 L310 I311 V312	E303-V308 HydrophobicContact CB-CG1 4.33Å; E303-V308 HydrophobicContact CG-CG1 4.08Å; D305-V308 HydrophobicContact CB-CB 4.31Å; D305-V308 HydrophobicContact CB-CG2 3.91Å; D305-V308 PolarHBondContact O-N 3.19Å; N306-V308 PolarHBondContact O-N 2.95Å; V308-L310 PolarHBondContact O-N 3.21Å; V308-I311 PolarHBondContact O-N 2.89Å; V308-V312 HydrophobicContact CG1-CG2 4.4Å; V308-V312 VanDerWaalsContact O-CG2 3.25Å; V308-V312 WeakPolarHBondContact O-CG2 3.21Å; V308-V312 PolarHBondContact O-N 2.79Å
309	K	91	Very high	90	Very high	22 Å²	22	47.3 Å²	47.3	10%	0.096	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-45.6	175.2	-65.6	177	-173.3	165.1	0	112	I300 E303 D305 N306 N307 V312 I313 V347	I300-K309 HydrophobicContact CG2-CB 4.15Å; I300-K309 HydrophobicContact CG2-CD 4.47Å; I300-K309 HydrophobicContact CG2-CG 4.03Å; I300-K309 VanDerWaalsContact O-CE 3.27Å; I300-K309 WeakPolarHBondContact O-CE 3.13Å; E303-K309 WeakPolarHBondContact O-CE 3.35Å; E303-K309 PolarHBondContact O-NZ 3.48Å; D305-K309 PolarHBondContact O-N 3.24Å; N306-K309 WeakPolarHBondContact O-CB 3.33Å; N306-K309 PolarHBondContact O-N 3.33Å; N307-K309 VanDerWaalsContact C-N 3.3Å; N307-K309 PolarHBondContact O-N 2.79Å; K309-V312 PolarHBondContact O-N 3.07Å; K309-I313 WeakPolarHBondContact O-CB 3.46Å; K309-I313 WeakPolarHBondContact O-CD1 3.22Å; K309-I313 VanDerWaalsContact O-CG1 3.22Å; K309-I313 WeakPolarHBondContact O-CG1 3.46Å; K309-I313 PolarHBondContact O-N 3.11Å; K309-V347 HydrophobicContact CB-CG1 4.26Å; K309-V347 HydrophobicContact CB-CG2 4.3Å; K309-V347 HydrophobicContact CD-CG1 4.21Å
310	L	90.4	Very high	89.8	Confident	31 Å²	31	49.5 Å²	49.5	16%	0.162	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-45.4	177.8	-67.9	170.9	0	0	0	111.3	N306 N307 V308 V312 I313 D314 E346 V347 R350	N306-L310 WeakPolarHBondContact O-CG 3.4Å; N306-L310 PolarHBondContact O-N 3.32Å; N307-L310 PolarHBondContact O-N 2.9Å; V308-L310 PolarHBondContact O-N 3.21Å; L310-V312 VanDerWaalsContact C-N 3.33Å; L310-V312 PolarHBondContact O-N 3.08Å; L310-I313 PolarHBondContact O-N 3.46Å; L310-D314 WeakPolarHBondContact O-CB 3.49Å; L310-D314 VanDerWaalsContact O-CG 3.27Å; L310-D314 PolarHBondContact O-N 2.76Å; L310-E346 HydrophobicContact CD1-CG 4.44Å; L310-E346 HydrophobicContact CD2-CG 4.06Å; L310-V347 HydrophobicContact CD2-CG2 3.99Å; L310-V347 HydrophobicContact CG-CG2 4.07Å; L310-R350 HydrophobicContact CD2-CG 4.31Å
311	I	89.6	Confident	89.5	Confident	95 Å²	95	57.4 Å²	57.4	49%	0.487	30%	0.304	S	S	.	.	H	α-helix	trans	-58.4	-45.3	176.5	-67.8	164.5	0	0	0	110.9	N307 V308 D314 R315	N307-I311 VanDerWaalsContact O-CG1 3.29Å; N307-I311 WeakPolarHBondContact O-CG1 3.44Å; N307-I311 PolarHBondContact O-N 3.01Å; V308-I311 PolarHBondContact O-N 2.89Å; I311-D314 PolarHBondContact O-N 3.4Å; I311-R315 WeakPolarHBondContact O-CB 3.23Å; I311-R315 PolarHBondContact O-N 3.06Å
312	V	92.6	Very high	89.2	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.012	30%	0.301	C	S	.	.	H	α-helix	trans	-70.1	-36.9	-179.6	-174.6	0	0	0	0	111.5	Y273 F296 I300 V308 K309 L310 R315 L316	Y273-V312 HydrophobicContact CD2-CG2 3.85Å; Y273-V312 HydrophobicContact CE2-CB 4.43Å; Y273-V312 HydrophobicContact CE2-CG2 3.8Å; F296-V312 HydrophobicContact CB-CG1 3.87Å; F296-V312 HydrophobicContact CD1-CG1 3.76Å; F296-V312 HydrophobicContact CG-CG1 4.18Å; I300-V312 HydrophobicContact CD1-CB 4.2Å; I300-V312 HydrophobicContact CD1-CG1 3.71Å; I300-V312 HydrophobicContact CG1-CB 3.65Å; I300-V312 HydrophobicContact CG1-CG1 3.45Å; I300-V312 VanDerWaalsContact CG1-CG1 3.45Å; V308-V312 HydrophobicContact CG1-CG2 4.4Å; V308-V312 VanDerWaalsContact O-CG2 3.25Å; V308-V312 WeakPolarHBondContact O-CG2 3.21Å; V308-V312 PolarHBondContact O-N 2.79Å; K309-V312 PolarHBondContact O-N 3.07Å; L310-V312 VanDerWaalsContact C-N 3.33Å; L310-V312 PolarHBondContact O-N 3.08Å; V312-R315 PolarHBondContact O-N 3.36Å; V312-L316 WeakPolarHBondContact O-CG 3.16Å; V312-L316 PolarHBondContact O-N 3.32Å
313	I	93.2	Very high	88.9	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-62.5	-47.8	174	-69.6	163	0	0	0	110.3	I300 K309 L310 R315 L316 V317 V347 R350 T351 L354	I300-I313 HydrophobicContact CD1-CG1 4.12Å; K309-I313 WeakPolarHBondContact O-CB 3.46Å; K309-I313 WeakPolarHBondContact O-CD1 3.22Å; K309-I313 VanDerWaalsContact O-CG1 3.22Å; K309-I313 WeakPolarHBondContact O-CG1 3.46Å; K309-I313 PolarHBondContact O-N 3.11Å; L310-I313 PolarHBondContact O-N 3.46Å; I313-R315 VanDerWaalsContact C-N 3.26Å; I313-R315 PolarHBondContact O-N 2.99Å; I313-L316 WeakPolarHBondContact O-CB 3.28Å; I313-L316 PolarHBondContact O-N 2.85Å; I313-L316 VanDerWaalsContact O-N 3.07Å; I313-V317 WeakPolarHBondContact O-CG2 3.36Å; I313-V317 PolarHBondContact O-N 3Å; I313-V347 HydrophobicContact CD1-CG1 4.02Å; I313-R350 HydrophobicContact CG2-CB 3.98Å; I313-T351 WeakPolarHBondContact CD1-OG1 3.36Å; I313-L354 HydrophobicContact CG2-CD2 4.26Å
314	D	90.5	Very high	88.7	Confident	69 Å²	69	54.7 Å²	54.7	37%	0.369	31%	0.309	S	S	.	.	H	α-helix	trans	-61.4	-38.6	178.3	-70.6	-10.1	0	0	0	111	L310 I311 L316 V317 E318 R350	L310-D314 WeakPolarHBondContact O-CB 3.49Å; L310-D314 VanDerWaalsContact O-CG 3.27Å; L310-D314 PolarHBondContact O-N 2.76Å; I311-D314 PolarHBondContact O-N 3.4Å; D314-L316 PolarHBondContact O-N 3.41Å; D314-V317 WeakPolarHBondContact O-CB 3.43Å; D314-V317 PolarHBondContact O-N 3.28Å; D314-E318 PolarHBondContact O-N 3.44Å; D314-R350 IonicContact OD1-CZ 2.88Å; D314-R350 IonicContact OD1-NH1 2.75Å; D314-R350 PolarHBondContact OD1-NH1 3.22Å; D314-R350 IonicContact OD2-CZ 2.7Å; D314-R350 IonicContact OD2-NH1 3.63Å; D314-R350 PolarHBondContact OD2-NH1 2.93Å
315	R	90	Very high	88.8	Confident	18 Å²	18	51.5 Å²	51.5	7%	0.068	28%	0.276	C	S	.	.	H	α-helix	trans	-63.1	-40.8	173.3	-172	60.1	175.3	164.8	5.8	112.5	Y273 S277 F296 I311 V312 I313 V317 E318 L319 L690	Y273-R315 HydrophobicContact CE2-CB 4.33Å; Y273-R315 HydrophobicContact CE2-CG 4.29Å; Y273-R315 WeakPolarHBondContact OH-CB 3.06Å; Y273-R315 WeakPolarHBondContact OH-CG 3.37Å; S277-R315 PolarHBondContact OG-NE 2.96Å; F296-R315 HydrophobicContact CZ-CG 4.47Å; I311-R315 WeakPolarHBondContact O-CB 3.23Å; I311-R315 PolarHBondContact O-N 3.06Å; V312-R315 PolarHBondContact O-N 3.36Å; I313-R315 VanDerWaalsContact C-N 3.26Å; I313-R315 PolarHBondContact O-N 2.99Å; R315-V317 VanDerWaalsContact C-N 3.35Å; R315-E318 IonicContact CZ-OE2 3.28Å; R315-E318 IonicContact NH1-OE1 2.6Å; R315-E318 PolarHBondContact NH1-OE1 3.45Å; R315-E318 IonicContact NH1-OE2 3.07Å; R315-E318 PolarHBondContact NH1-OE2 3.21Å; R315-E318 PolarHBondContact O-N 3.35Å; R315-L319 HydrophobicContact CG-CD1 4.17Å; R315-L319 HydrophobicContact CG-CG 4.48Å; R315-L319 WeakPolarHBondContact O-CB 3.43Å; R315-L319 WeakPolarHBondContact O-CG 3.15Å; R315-L319 PolarHBondContact O-N 3.43Å; R315-L690 VanDerWaalsContact NH1-CD2 3.34Å; R315-L690 VanDerWaalsContact NH2-CD2 3.27Å
316	L	92.3	Very high	88.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.6	-39.8	174.5	-71.8	175.9	0	0	0	111.6	L293 F296 I300 V312 I313 D314 E318 L319 R320 L329 L336 L354	L293-L316 HydrophobicContact CD2-CD2 3.71Å; F296-L316 HydrophobicContact CB-CD2 3.98Å; F296-L316 HydrophobicContact CB-CG 4.45Å; F296-L316 HydrophobicContact CD2-CD2 4.01Å; F296-L316 HydrophobicContact CG-CD2 4.24Å; I300-L316 HydrophobicContact CD1-CD1 3.66Å; V312-L316 WeakPolarHBondContact O-CG 3.16Å; V312-L316 PolarHBondContact O-N 3.32Å; I313-L316 WeakPolarHBondContact O-CB 3.28Å; I313-L316 PolarHBondContact O-N 2.85Å; I313-L316 VanDerWaalsContact O-N 3.07Å; D314-L316 PolarHBondContact O-N 3.41Å; L316-E318 VanDerWaalsContact C-N 3.35Å; L316-L319 PolarHBondContact O-N 3.21Å; L316-R320 WeakPolarHBondContact O-CG 3.15Å; L316-R320 PolarHBondContact O-N 3.48Å; L316-L329 HydrophobicContact CD2-CD1 4.32Å; L316-L336 HydrophobicContact CD1-CD1 3.8Å; L316-L354 HydrophobicContact CB-CD2 3.87Å; L316-L354 HydrophobicContact CD1-CD2 4.21Å
317	V	91.3	Very high	88.8	Confident	65 Å²	65	53.2 Å²	53.2	39%	0.394	28%	0.279	S	S	.	.	H	α-helix	trans	-60.5	-45	174.7	173.5	0	0	0	0	110.6	I313 D314 R315 R320 L354	I313-V317 WeakPolarHBondContact O-CG2 3.36Å; I313-V317 PolarHBondContact O-N 3Å; D314-V317 WeakPolarHBondContact O-CB 3.43Å; D314-V317 PolarHBondContact O-N 3.28Å; R315-V317 VanDerWaalsContact C-N 3.35Å; V317-R320 WeakPolarHBondContact O-CB 3.21Å; V317-R320 PolarHBondContact O-N 2.95Å; V317-L354 HydrophobicContact CG2-CB 4.35Å; V317-L354 HydrophobicContact CG2-CD1 3.93Å; V317-L354 HydrophobicContact CG2-CD2 4.43Å; V317-L354 HydrophobicContact CG2-CG 4.47Å
318	E	87.4	Confident	88.8	Confident	59 Å²	59	48.6 Å²	48.6	28%	0.276	26%	0.255	S	S	.	.	H	α-helix	trans	-62.8	-46.7	176.9	-170.3	-164.9	154.4	0	0	111.9	D314 R315 L316 R320 Q321	D314-E318 PolarHBondContact O-N 3.44Å; R315-E318 IonicContact CZ-OE2 3.28Å; R315-E318 IonicContact NH1-OE1 2.6Å; R315-E318 PolarHBondContact NH1-OE1 3.45Å; R315-E318 IonicContact NH1-OE2 3.07Å; R315-E318 PolarHBondContact NH1-OE2 3.21Å; R315-E318 PolarHBondContact O-N 3.35Å; L316-E318 VanDerWaalsContact C-N 3.35Å; E318-R320 PolarHBondContact O-N 2.9Å; E318-R320 VanDerWaalsContact O-N 3.11Å; E318-Q321 WeakPolarHBondContact O-CB 3.38Å; E318-Q321 VanDerWaalsContact O-CG 3.32Å; E318-Q321 WeakPolarHBondContact O-CG 2.7Å; E318-Q321 PolarHBondContact O-N 3.11Å; E318-Q321 VanDerWaalsContact O-N 3.14Å
319	L	88.4	Confident	88.9	Confident	19 Å²	19	46.1 Å²	46.1	10%	0.099	24%	0.24	C	C	.	.	H	α-helix	trans	-64	-18.9	-177.8	-72.4	172.8	0	0	0	113.7	I280 F296 R315 L316 Q321 N322 V325	I280-L319 HydrophobicContact CD1-CD1 3.84Å; I280-L319 HydrophobicContact CG2-CD2 4.16Å; F296-L319 HydrophobicContact CD2-CD1 4.39Å; F296-L319 HydrophobicContact CE2-CD1 3.72Å; F296-L319 HydrophobicContact CZ-CD1 4.27Å; R315-L319 HydrophobicContact CG-CD1 4.17Å; R315-L319 HydrophobicContact CG-CG 4.48Å; R315-L319 WeakPolarHBondContact O-CB 3.43Å; R315-L319 WeakPolarHBondContact O-CG 3.15Å; R315-L319 PolarHBondContact O-N 3.43Å; L316-L319 PolarHBondContact O-N 3.21Å; L319-Q321 PolarHBondContact O-N 3.36Å; L319-N322 WeakPolarHBondContact O-CB 3.36Å; L319-N322 PolarHBondContact O-N 2.97Å; L319-N322 VanDerWaalsContact O-N 3.15Å; L319-V325 HydrophobicContact CB-CG1 4.12Å; L319-V325 WeakPolarHBondContact O-CB 3.41Å
320	R	88.8	Confident	88.9	Confident	50 Å²	50	47.5 Å²	47.5	19%	0.189	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-18	175.3	-75.9	177.8	63.3	-135.5	-7.8	114.3	L316 V317 E318 N322 D326 L329 L354 D357	L316-R320 WeakPolarHBondContact O-CG 3.15Å; L316-R320 PolarHBondContact O-N 3.48Å; V317-R320 WeakPolarHBondContact O-CB 3.21Å; V317-R320 PolarHBondContact O-N 2.95Å; E318-R320 PolarHBondContact O-N 2.9Å; E318-R320 VanDerWaalsContact O-N 3.11Å; R320-N322 PolarHBondContact O-N 3.44Å; R320-N322 VanDerWaalsContact O-N 3.11Å; R320-D326 IonicContact CZ-OD1 3.43Å; R320-D326 IonicContact NE-OD1 2.83Å; R320-D326 PolarHBondContact NE-OD1 3.48Å; R320-D326 IonicContact NH2-OD1 3.97Å; R320-D326 PolarHBondContact NH2-OD1 2.91Å; R320-L329 HydrophobicContact CG-CD2 3.6Å; R320-L354 VanDerWaalsContact CD-CD1 3.45Å; R320-D357 IonicContact CZ-OD2 2.9Å; R320-D357 IonicContact NH1-OD2 2.8Å; R320-D357 PolarHBondContact NH1-OD2 3.18Å; R320-D357 VanDerWaalsContact NH2-CB 3.34Å
321	Q	83.6	Confident	88.9	Confident	169 Å²	169	50.2 Å²	50.2	79%	0.79	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-25.1	171.1	-65.8	177.1	2.9	0	0	111.5	E318 L319 P323	E318-Q321 WeakPolarHBondContact O-CB 3.38Å; E318-Q321 VanDerWaalsContact O-CG 3.32Å; E318-Q321 WeakPolarHBondContact O-CG 2.7Å; E318-Q321 PolarHBondContact O-N 3.11Å; E318-Q321 VanDerWaalsContact O-N 3.14Å; L319-Q321 PolarHBondContact O-N 3.36Å; Q321-P323 WeakPolarHBondContact O-CD 3.31Å
322	N	84.1	Confident	88.9	Confident	50 Å²	50	45.9 Å²	45.9	27%	0.267	24%	0.239	S	C	.	.	S	Bend	trans	-84.5	115.5	170.9	-176	-17.5	0	0	0	111.1	L319 R320 A324 V325 D326	L319-N322 WeakPolarHBondContact O-CB 3.36Å; L319-N322 PolarHBondContact O-N 2.97Å; L319-N322 VanDerWaalsContact O-N 3.15Å; R320-N322 PolarHBondContact O-N 3.44Å; R320-N322 VanDerWaalsContact O-N 3.11Å; N322-A324 PolarHBondContact O-N 2.84Å; N322-A324 WeakPolarHBondContact OD1-CB 3.24Å; N322-A324 PolarHBondContact OD1-N 3.24Å; N322-V325 HydrophobicContact CB-CB 4.16Å; N322-V325 HydrophobicContact CB-CG2 3.81Å; N322-V325 WeakPolarHBondContact O-CA 3.49Å; N322-V325 WeakPolarHBondContact O-CB 3.41Å; N322-V325 PolarHBondContact O-N 2.88Å; N322-D326 PolarHBondContact O-N 2.81Å
323	P	83.9	Confident	88.9	Confident	104 Å²	104	45.9 Å²	45.9	68%	0.675	24%	0.239	S	C	*	.	H	α-helix	trans	-63.3	-27.5	-176.6	25.2	-34.7	0	0	0	113.7	Q321 V325 K327	Q321-P323 WeakPolarHBondContact O-CD 3.31Å; P323-V325 VanDerWaalsContact C-N 3.31Å; P323-K327 PolarHBondContact O-N 3.12Å
324	A	85.3	Confident	88.8	Confident	41 Å²	41	48.2 Å²	48.2	34%	0.339	25%	0.25	S	S	.	.	H	α-helix	trans	-68.5	-34.2	174.9	0	0	0	0	0	111.7	I289 N322 V328	I289-A324 HydrophobicContact CD1-CB 4.05Å; N322-A324 PolarHBondContact O-N 2.84Å; N322-A324 WeakPolarHBondContact OD1-CB 3.24Å; N322-A324 PolarHBondContact OD1-N 3.24Å; A324-V328 WeakPolarHBondContact O-CG2 3.44Å
325	V	88.5	Confident	88.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-75.4	-46	177	-178.9	0	0	0	0	110.3	I280 I289 L293 L319 N322 P323 K327 V328 L329	I280-V325 HydrophobicContact CG2-CG2 3.66Å; I289-V325 HydrophobicContact CG2-CB 4.44Å; I289-V325 HydrophobicContact CG2-CG1 4.48Å; I289-V325 HydrophobicContact CG2-CG2 4.09Å; L293-V325 HydrophobicContact CD1-CG1 4.06Å; L293-V325 HydrophobicContact CD2-CG1 3.88Å; L293-V325 HydrophobicContact CG-CG1 4.39Å; L319-V325 HydrophobicContact CB-CG1 4.12Å; L319-V325 WeakPolarHBondContact O-CB 3.41Å; N322-V325 HydrophobicContact CB-CB 4.16Å; N322-V325 HydrophobicContact CB-CG2 3.81Å; N322-V325 WeakPolarHBondContact O-CA 3.49Å; N322-V325 WeakPolarHBondContact O-CB 3.41Å; N322-V325 PolarHBondContact O-N 2.88Å; P323-V325 VanDerWaalsContact C-N 3.31Å; V325-K327 VanDerWaalsContact C-N 3.27Å; V325-K327 PolarHBondContact O-N 2.85Å; V325-V328 PolarHBondContact O-N 3Å; V325-L329 WeakPolarHBondContact O-CB 3.38Å; V325-L329 PolarHBondContact O-N 2.86Å
326	D	88.9	Confident	88.8	Confident	30 Å²	30	46.6 Å²	46.6	16%	0.16	24%	0.243	C	C	.	.	H	α-helix	trans	-55	-44.8	179.2	-172.5	80.6	0	0	0	111.3	R320 N322 V328 L329 Q330	R320-D326 IonicContact CZ-OD1 3.43Å; R320-D326 IonicContact NE-OD1 2.83Å; R320-D326 PolarHBondContact NE-OD1 3.48Å; R320-D326 IonicContact NH2-OD1 3.97Å; R320-D326 PolarHBondContact NH2-OD1 2.91Å; N322-D326 PolarHBondContact O-N 2.81Å; D326-V328 PolarHBondContact O-N 3.49Å; D326-L329 PolarHBondContact O-N 2.86Å; D326-Q330 WeakPolarHBondContact O-CG 3.3Å; D326-Q330 PolarHBondContact O-N 2.81Å; D326-Q330 PolarHBondContact OD2-NE2 3.46Å
327	K	88.7	Confident	88.8	Confident	134 Å²	134	46.6 Å²	46.6	58%	0.583	24%	0.243	S	C	*	.	H	α-helix	trans	-59.6	-41	176.8	-172.5	178.4	-179.3	-179.3	0	113.6	P323 V325	P323-K327 PolarHBondContact O-N 3.12Å; V325-K327 VanDerWaalsContact C-N 3.27Å; V325-K327 PolarHBondContact O-N 2.85Å
328	V	89.1	Confident	88.9	Confident	9 Å²	9	49.4 Å²	49.4	6%	0.055	25%	0.247	C	C	.	.	H	α-helix	trans	-75.8	-33.9	178.7	-177.6	0	0	0	0	110.6	I289 R290 L293 A324 V325 D326 Q330 D331 V332	I289-V328 HydrophobicContact CG2-CB 4.06Å; I289-V328 HydrophobicContact CG2-CG1 4.38Å; I289-V328 HydrophobicContact CG2-CG2 4.03Å; R290-V328 HydrophobicContact CB-CG1 3.77Å; R290-V328 HydrophobicContact CG-CG1 4.07Å; L293-V328 HydrophobicContact CD1-CB 3.83Å; L293-V328 HydrophobicContact CD1-CG1 3.76Å; A324-V328 WeakPolarHBondContact O-CG2 3.44Å; V325-V328 PolarHBondContact O-N 3Å; D326-V328 PolarHBondContact O-N 3.49Å; V328-Q330 VanDerWaalsContact C-N 3.29Å; V328-Q330 PolarHBondContact O-N 3.41Å; V328-D331 WeakPolarHBondContact O-CB 3.31Å; V328-D331 PolarHBondContact O-N 2.82Å; V328-V332 WeakPolarHBondContact O-CG2 3.44Å; V328-V332 PolarHBondContact O-N 3.47Å
329	L	90	Very high	88.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.8	-33.4	177.8	-167.6	59.6	0	0	0	111.7	L293 L316 R320 V325 D326 D331 V332 V333 L336 L354 L358	L293-L329 HydrophobicContact CD1-CB 4.09Å; L293-L329 HydrophobicContact CD1-CD1 4.33Å; L293-L329 HydrophobicContact CD2-CD1 4.26Å; L316-L329 HydrophobicContact CD2-CD1 4.32Å; R320-L329 HydrophobicContact CG-CD2 3.6Å; V325-L329 WeakPolarHBondContact O-CB 3.38Å; V325-L329 PolarHBondContact O-N 2.86Å; D326-L329 PolarHBondContact O-N 2.86Å; L329-D331 PolarHBondContact O-N 3.42Å; L329-V332 PolarHBondContact O-N 3.32Å; L329-V332 VanDerWaalsContact O-N 3.13Å; L329-V333 PolarHBondContact O-N 3.17Å; L329-V333 VanDerWaalsContact O-N 3.12Å; L329-L336 HydrophobicContact CD1-CD1 4.39Å; L329-L354 HydrophobicContact CD2-CD1 4.38Å; L329-L358 HydrophobicContact CB-CD2 3.92Å; L329-L358 HydrophobicContact CD1-CD1 4.49Å; L329-L358 HydrophobicContact CD2-CD1 3.81Å; L329-L358 HydrophobicContact CD2-CD2 3.79Å; L329-L358 HydrophobicContact CD2-CG 4.37Å; L329-L358 HydrophobicContact CG-CD1 3.61Å; L329-L358 HydrophobicContact CG-CD2 3.74Å; L329-L358 HydrophobicContact CG-CG 4.32Å
330	Q	90.9	Very high	89	Confident	51 Å²	51	46 Å²	46	24%	0.238	23%	0.231	C	C	.	.	H	α-helix	trans	-59.1	-32.5	170	-69.1	175.4	25.3	0	0	113	D326 V328 V333 L358 N363	D326-Q330 WeakPolarHBondContact O-CG 3.3Å; D326-Q330 PolarHBondContact O-N 2.81Å; D326-Q330 PolarHBondContact OD2-NE2 3.46Å; V328-Q330 VanDerWaalsContact C-N 3.29Å; V328-Q330 PolarHBondContact O-N 3.41Å; Q330-V333 WeakPolarHBondContact O-CG1 3.32Å; Q330-L358 HydrophobicContact CG-CD2 4.18Å; Q330-N363 PolarHBondContact O-ND2 3.47Å; Q330-N363 VanDerWaalsContact O-ND2 3.15Å
331	D	89.6	Confident	88.9	Confident	88 Å²	88	50.2 Å²	50.2	47%	0.471	25%	0.252	S	S	.	.	H	α-helix	trans	-76.9	-24.9	177.1	-63.7	-21.3	0	0	0	112.5	R290 V328 L329	R290-D331 IonicContact CZ-OD2 2.74Å; R290-D331 IonicContact NH1-OD2 3.26Å; R290-D331 IonicContact NH2-OD2 3Å; R290-D331 PolarHBondContact NH2-OD2 2.77Å; V328-D331 WeakPolarHBondContact O-CB 3.31Å; V328-D331 PolarHBondContact O-N 2.82Å; L329-D331 PolarHBondContact O-N 3.42Å
332	V	89.5	Confident	89	Confident	3 Å²	3	43.1 Å²	43.1	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-100.4	3.8	-176.3	-171	0	0	0	0	111.5	V297 V328 L329 M334 D335 L336	V297-V332 HydrophobicContact CG2-CG1 4.02Å; V328-V332 WeakPolarHBondContact O-CG2 3.44Å; V328-V332 PolarHBondContact O-N 3.47Å; L329-V332 PolarHBondContact O-N 3.32Å; L329-V332 VanDerWaalsContact O-N 3.13Å; V332-M334 PolarHBondContact O-N 2.86Å; V332-M334 VanDerWaalsContact O-N 3.1Å; V332-D335 HydrophobicContact CG1-CB 3.93Å; V332-D335 PolarHBondContact O-N 3.46Å; V332-L336 PolarHBondContact O-N 3.43Å
333	V	92.2	Very high	88.9	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.012	25%	0.25	C	C	.	.	H	α-helix	trans	-54.7	-34.6	-176.5	73.1	0	0	0	0	113.4	L329 Q330 D335 L336 L337 V355 L358 N363 V367	L329-V333 PolarHBondContact O-N 3.17Å; L329-V333 VanDerWaalsContact O-N 3.12Å; Q330-V333 WeakPolarHBondContact O-CG1 3.32Å; V333-D335 VanDerWaalsContact C-N 3.3Å; V333-D335 PolarHBondContact O-N 3.3Å; V333-L336 WeakPolarHBondContact O-CB 3.38Å; V333-L336 PolarHBondContact O-N 2.96Å; V333-L337 PolarHBondContact O-N 2.67Å; V333-V355 HydrophobicContact CG2-CG1 4.05Å; V333-V355 HydrophobicContact CG2-CG2 4.29Å; V333-L358 HydrophobicContact CG2-CB 4.17Å; V333-N363 HydrophobicContact CG1-CB 4.09Å; V333-V367 HydrophobicContact CG1-CG2 4.08Å; V333-V367 HydrophobicContact CG2-CG2 4.31Å
334	M	90.9	Very high	89.1	Confident	51 Å²	51	47 Å²	47	25%	0.251	23%	0.23	S	C	.	.	H	α-helix	trans	-68.6	-29.1	179.5	-64	-54.3	-68.4	0	0	112.9	V332 L337 E366 V367 Y370	V332-M334 PolarHBondContact O-N 2.86Å; V332-M334 VanDerWaalsContact O-N 3.1Å; M334-L337 HydrophobicContact CE-CD1 4.35Å; M334-L337 HydrophobicContact SD-CD1 3.82Å; M334-E366 HydrophobicContact CE-CB 3.9Å; M334-E366 HydrophobicContact SD-CB 3.73Å; M334-V367 HydrophobicContact SD-CG2 4.23Å; M334-Y370 HydrophobicContact CE-CD2 4.24Å
335	D	90.4	Very high	89.2	Confident	51 Å²	51	46.1 Å²	46.1	27%	0.273	22%	0.22	S	C	.	.	H	α-helix	trans	-78.7	-30.7	175.3	-62	-28.2	0	0	0	111.4	V297 N301 V332 V333 R338	V297-D335 HydrophobicContact CG1-CB 3.69Å; N301-D335 PolarHBondContact ND2-O 2.82Å; V332-D335 HydrophobicContact CG1-CB 3.93Å; V332-D335 PolarHBondContact O-N 3.46Å; V333-D335 VanDerWaalsContact C-N 3.3Å; V333-D335 PolarHBondContact O-N 3.3Å; D335-R338 WeakPolarHBondContact O-CB 3.25Å; D335-R338 WeakPolarHBondContact O-CG 3.45Å; D335-R338 PolarHBondContact O-N 2.85Å; D335-R338 IonicContact OD1-CZ 3.8Å; D335-R338 VanDerWaalsContact OD1-CZ 3.25Å; D335-R338 IonicContact OD1-NE 2.69Å; D335-R338 PolarHBondContact OD1-NE 3.3Å; D335-R338 IonicContact OD1-NH2 3.36Å; D335-R338 PolarHBondContact OD1-NH2 2.81Å
336	L	91.7	Very high	89.2	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-69.4	-35.8	173.9	-163.8	138.6	0	0	0	111.8	L316 L329 V332 V333 R338 V339 T351 L354 V355	L316-L336 HydrophobicContact CD1-CD1 3.8Å; L329-L336 HydrophobicContact CD1-CD1 4.39Å; V332-L336 PolarHBondContact O-N 3.43Å; V333-L336 WeakPolarHBondContact O-CB 3.38Å; V333-L336 PolarHBondContact O-N 2.96Å; L336-R338 PolarHBondContact O-N 3.11Å; L336-R338 VanDerWaalsContact O-N 3.15Å; L336-V339 VanDerWaalsContact O-CB 3.23Å; L336-V339 WeakPolarHBondContact O-CB 3.23Å; L336-V339 WeakPolarHBondContact O-CG2 3.39Å; L336-V339 PolarHBondContact O-N 2.86Å; L336-V339 VanDerWaalsContact O-N 3.07Å; L336-T351 HydrophobicContact CD2-CG2 3.59Å; L336-L354 HydrophobicContact CD1-CD2 3.65Å; L336-L354 HydrophobicContact CD1-CG 4.34Å; L336-L354 HydrophobicContact CD2-CD2 4.23Å; L336-L354 HydrophobicContact CD2-CG 4.41Å; L336-V355 HydrophobicContact CD2-CG2 3.44Å; L336-V355 VanDerWaalsContact CD2-CG2 3.44Å
337	L	92.6	Very high	89.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-60.4	-22.4	174.1	-81.9	169.2	0	0	0	113.8	V333 M334 V339 L340 V355 V367 Y370 L371	V333-L337 PolarHBondContact O-N 2.67Å; M334-L337 HydrophobicContact CE-CD1 4.35Å; M334-L337 HydrophobicContact SD-CD1 3.82Å; L337-V339 PolarHBondContact O-N 2.94Å; L337-L340 HydrophobicContact CD2-CD1 3.68Å; L337-L340 WeakPolarHBondContact O-CB 3.44Å; L337-L340 WeakPolarHBondContact O-CG 3.47Å; L337-L340 PolarHBondContact O-N 2.88Å; L337-V355 HydrophobicContact CD2-CG1 4.09Å; L337-V355 HydrophobicContact CD2-CG2 3.92Å; L337-V355 HydrophobicContact CG-CG1 4.46Å; L337-V355 HydrophobicContact CG-CG2 4.15Å; L337-V367 HydrophobicContact CD1-CB 4.41Å; L337-V367 HydrophobicContact CD1-CG1 4.3Å; L337-V367 HydrophobicContact CD1-CG2 4.15Å; L337-Y370 HydrophobicContact CB-CD1 3.98Å; L337-Y370 HydrophobicContact CB-CD2 4.46Å; L337-Y370 HydrophobicContact CB-CE1 3.95Å; L337-Y370 HydrophobicContact CB-CE2 4.42Å; L337-Y370 HydrophobicContact CB-CG 4.25Å; L337-Y370 HydrophobicContact CD1-CD1 4.22Å; L337-Y370 HydrophobicContact CD1-CG 4.01Å; L337-Y370 HydrophobicContact CD2-CD1 4.15Å; L337-Y370 HydrophobicContact CG-CD1 4.36Å; L337-Y370 PolarHBondContact O-OH 3.16Å; L337-L371 HydrophobicContact CD2-CD2 4.05Å
338	R	91.5	Very high	89.5	Confident	125 Å²	125	42.8 Å²	42.8	47%	0.472	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-64.3	-22.9	175.8	-53.6	-177.6	-158.4	-178.1	5.2	112.8	D335 L336 L340 Q341	D335-R338 WeakPolarHBondContact O-CB 3.25Å; D335-R338 WeakPolarHBondContact O-CG 3.45Å; D335-R338 PolarHBondContact O-N 2.85Å; D335-R338 IonicContact OD1-CZ 3.8Å; D335-R338 VanDerWaalsContact OD1-CZ 3.25Å; D335-R338 IonicContact OD1-NE 2.69Å; D335-R338 PolarHBondContact OD1-NE 3.3Å; D335-R338 IonicContact OD1-NH2 3.36Å; D335-R338 PolarHBondContact OD1-NH2 2.81Å; L336-R338 PolarHBondContact O-N 3.11Å; L336-R338 VanDerWaalsContact O-N 3.15Å; R338-L340 PolarHBondContact O-N 2.85Å; R338-Q341 WeakPolarHBondContact O-CB 3.29Å; R338-Q341 VanDerWaalsContact O-CG 3.3Å; R338-Q341 WeakPolarHBondContact O-CG 3.4Å; R338-Q341 PolarHBondContact O-N 2.86Å
339	V	89.3	Confident	89.6	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.03	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-62.3	-25.4	178.1	178	0	0	0	0	111.7	I300 N301 L336 L337 Q341 C342 V347 T351	I300-V339 HydrophobicContact CB-CG2 4.04Å; I300-V339 HydrophobicContact CG2-CB 4.08Å; I300-V339 HydrophobicContact CG2-CG1 3.48Å; I300-V339 VanDerWaalsContact CG2-CG1 3.48Å; I300-V339 HydrophobicContact CG2-CG2 3.38Å; N301-V339 WeakPolarHBondContact OD1-CG2 3.4Å; N301-V339 PolarHBondContact OD1-N 2.79Å; L336-V339 VanDerWaalsContact O-CB 3.23Å; L336-V339 WeakPolarHBondContact O-CB 3.23Å; L336-V339 WeakPolarHBondContact O-CG2 3.39Å; L336-V339 PolarHBondContact O-N 2.86Å; L336-V339 VanDerWaalsContact O-N 3.07Å; L337-V339 PolarHBondContact O-N 2.94Å; V339-Q341 PolarHBondContact O-N 3.48Å; V339-C342 VanDerWaalsContact O-CB 3.25Å; V339-C342 WeakPolarHBondContact O-CB 3.48Å; V339-C342 PolarHBondContact O-N 3.03Å; V339-V347 HydrophobicContact CG1-CG1 3.85Å; V339-T351 HydrophobicContact CB-CG2 4.04Å; V339-T351 HydrophobicContact CG1-CG2 4.28Å
340	L	90.2	Very high	89.6	Confident	2 Å²	2	50 Å²	50	1%	0.01	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-61.5	-13.1	177	-61.7	-178.2	0	0	0	114	L337 R338 C342 Q348 T351 L352 Y370 L371 E374	L337-L340 HydrophobicContact CD2-CD1 3.68Å; L337-L340 WeakPolarHBondContact O-CB 3.44Å; L337-L340 WeakPolarHBondContact O-CG 3.47Å; L337-L340 PolarHBondContact O-N 2.88Å; R338-L340 PolarHBondContact O-N 2.85Å; L340-C342 PolarHBondContact O-N 2.98Å; L340-Q348 HydrophobicContact CD2-CB 4.35Å; L340-Q348 HydrophobicContact CD2-CG 4.41Å; L340-Q348 PolarHBondContact O-NE2 3.31Å; L340-T351 HydrophobicContact CD2-CG2 3.93Å; L340-T351 HydrophobicContact CG-CG2 4.42Å; L340-L352 HydrophobicContact CD1-CD2 3.83Å; L340-L352 HydrophobicContact CD2-CD1 4.46Å; L340-L352 HydrophobicContact CD2-CD2 4Å; L340-L352 HydrophobicContact CD2-CG 3.84Å; L340-Y370 HydrophobicContact CD1-CE1 4.41Å; L340-L371 HydrophobicContact CD1-CD2 4.1Å; L340-E374 HydrophobicContact CD1-CG 4.47Å
341	Q	87	Confident	89.8	Confident	138 Å²	138	47.6 Å²	47.6	65%	0.645	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-69	-12.8	171.3	-63.5	178	8.6	0	0	113.2	R338 V339	R338-Q341 WeakPolarHBondContact O-CB 3.29Å; R338-Q341 VanDerWaalsContact O-CG 3.3Å; R338-Q341 WeakPolarHBondContact O-CG 3.4Å; R338-Q341 PolarHBondContact O-N 2.86Å; V339-Q341 PolarHBondContact O-N 3.48Å
342	C	84.6	Confident	90	Very high	19 Å²	19	43.4 Å²	43.4	13%	0.128	20%	0.2	C	C	.	.	S	Bend	trans	-65.2	144.4	170.4	-168.7	0	0	0	0	110.5	V339 L340 D344 V347 Q348	V339-C342 VanDerWaalsContact O-CB 3.25Å; V339-C342 WeakPolarHBondContact O-CB 3.48Å; V339-C342 PolarHBondContact O-N 3.03Å; L340-C342 PolarHBondContact O-N 2.98Å; C342-D344 VanDerWaalsContact C-N 3.32Å; C342-V347 HydrophobicContact CB-CG1 4.34Å; C342-Q348 PolarHBondContact O-NE2 2.8Å
343	Q	82.6	Confident	90.1	Very high	186 Å²	186	48.1 Å²	48.1	87%	0.869	23%	0.225	S	C	*	.	S	Bend	trans	-80.1	-15.1	179.5	-65.8	-179.6	-0.5	0	0	113.3	L345	Q343-L345 PolarHBondContact O-N 3.08Å
344	D	88.6	Confident	90.1	Very high	49 Å²	49	48.1 Å²	48.1	26%	0.262	23%	0.225	S	C	.	.			trans	-77.6	121	-174.3	-171.4	-78.7	0	0	0	111.8	N306 C342 E346 V347 Q348	N306-D344 WeakPolarHBondContact ND2-CB 3.31Å; N306-D344 PolarHBondContact ND2-OD2 2.87Å; C342-D344 VanDerWaalsContact C-N 3.32Å; D344-E346 VanDerWaalsContact C-N 3.32Å; D344-E346 PolarHBondContact O-N 3.32Å; D344-E346 WeakPolarHBondContact OD1-CA 3.25Å; D344-E346 WeakPolarHBondContact OD1-CB 3.37Å; D344-E346 PolarHBondContact OD1-N 3.4Å; D344-V347 HydrophobicContact CB-CB 4.11Å; D344-V347 HydrophobicContact CB-CG2 3.94Å; D344-V347 PolarHBondContact O-N 2.96Å; D344-V347 PolarHBondContact OD1-N 2.9Å; D344-Q348 VanDerWaalsContact O-CG 3.26Å; D344-Q348 WeakPolarHBondContact O-CG 3.48Å; D344-Q348 PolarHBondContact O-N 3.41Å
345	L	87.2	Confident	90.2	Very high	24 Å²	24	45.7 Å²	45.7	13%	0.126	21%	0.213	C	C	.	.	H	α-helix	trans	-65.8	-32.6	-176.4	-178.4	65.4	0	0	0	112.7	Q343 Q348 K349 K389	Q343-L345 PolarHBondContact O-N 3.08Å; L345-Q348 PolarHBondContact O-N 2.97Å; L345-K349 HydrophobicContact CD1-CG 4.43Å; L345-K349 HydrophobicContact CG-CD 4.19Å; L345-K349 HydrophobicContact CG-CG 4.45Å; L345-K349 WeakPolarHBondContact O-CB 3.32Å; L345-K349 VanDerWaalsContact O-CG 3.26Å; L345-K349 WeakPolarHBondContact O-CG 3.32Å; L345-K349 PolarHBondContact O-N 3.13Å; L345-K389 HydrophobicContact CD1-CB 4.36Å; L345-K389 HydrophobicContact CD2-CB 3.8Å; L345-K389 HydrophobicContact CD2-CD 4.03Å
346	E	88.6	Confident	90.3	Very high	79 Å²	79	46.7 Å²	46.7	37%	0.369	21%	0.213	S	C	.	.	H	α-helix	trans	-73.1	-43.6	-179.5	-176.5	59	-160.7	0	0	110.4	L310 D344 Q348 K349 R350	L310-E346 HydrophobicContact CD1-CG 4.44Å; L310-E346 HydrophobicContact CD2-CG 4.06Å; D344-E346 VanDerWaalsContact C-N 3.32Å; D344-E346 PolarHBondContact O-N 3.32Å; D344-E346 WeakPolarHBondContact OD1-CA 3.25Å; D344-E346 WeakPolarHBondContact OD1-CB 3.37Å; D344-E346 PolarHBondContact OD1-N 3.4Å; E346-Q348 VanDerWaalsContact C-N 3.3Å; E346-Q348 PolarHBondContact O-N 3.08Å; E346-K349 PolarHBondContact O-N 2.86Å; E346-R350 WeakPolarHBondContact O-CG 3.36Å; E346-R350 PolarHBondContact O-N 3.5Å; E346-R350 IonicContact OE1-CZ 3.31Å; E346-R350 IonicContact OE1-NE 2.53Å; E346-R350 PolarHBondContact OE1-NE 2.94Å; E346-R350 IonicContact OE1-NH2 3.94Å
347	V	90.9	Very high	90.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-57.4	-45.8	171.7	176.5	0	0	0	0	110.4	N306 K309 L310 I313 V339 C342 D344 T351	N306-V347 HydrophobicContact CB-CG2 4.1Å; K309-V347 HydrophobicContact CB-CG1 4.26Å; K309-V347 HydrophobicContact CB-CG2 4.3Å; K309-V347 HydrophobicContact CD-CG1 4.21Å; L310-V347 HydrophobicContact CD2-CG2 3.99Å; L310-V347 HydrophobicContact CG-CG2 4.07Å; I313-V347 HydrophobicContact CD1-CG1 4.02Å; V339-V347 HydrophobicContact CG1-CG1 3.85Å; C342-V347 HydrophobicContact CB-CG1 4.34Å; D344-V347 HydrophobicContact CB-CB 4.11Å; D344-V347 HydrophobicContact CB-CG2 3.94Å; D344-V347 PolarHBondContact O-N 2.96Å; D344-V347 PolarHBondContact OD1-N 2.9Å; V347-T351 VanDerWaalsContact O-CB 3.24Å; V347-T351 WeakPolarHBondContact O-CB 3.26Å; V347-T351 PolarHBondContact O-N 3.45Å; V347-T351 PolarHBondContact O-OG1 3.04Å
348	Q	92.6	Very high	90.1	Very high	14 Å²	14	49.9 Å²	49.9	7%	0.065	23%	0.23	C	C	.	.	H	α-helix	trans	-61.4	-47.9	177	-73.1	171.2	-18.5	0	0	112.3	L340 C342 D344 L345 E346 T351 L352 Y390	L340-Q348 HydrophobicContact CD2-CB 4.35Å; L340-Q348 HydrophobicContact CD2-CG 4.41Å; L340-Q348 PolarHBondContact O-NE2 3.31Å; C342-Q348 PolarHBondContact O-NE2 2.8Å; D344-Q348 VanDerWaalsContact O-CG 3.26Å; D344-Q348 WeakPolarHBondContact O-CG 3.48Å; D344-Q348 PolarHBondContact O-N 3.41Å; L345-Q348 PolarHBondContact O-N 2.97Å; E346-Q348 VanDerWaalsContact C-N 3.3Å; E346-Q348 PolarHBondContact O-N 3.08Å; Q348-T351 PolarHBondContact O-N 2.9Å; Q348-L352 WeakPolarHBondContact O-CB 3.42Å; Q348-L352 VanDerWaalsContact O-CG 3.3Å; Q348-L352 WeakPolarHBondContact O-CG 3.31Å; Q348-L352 PolarHBondContact O-N 3.31Å; Q348-Y390 HydrophobicContact CB-CD2 3.99Å; Q348-Y390 HydrophobicContact CB-CE2 3.84Å; Q348-Y390 VanDerWaalsContact CD-CD2 3.41Å; Q348-Y390 VanDerWaalsContact CD-CE2 3.41Å; Q348-Y390 HydrophobicContact CG-CD2 4.15Å; Q348-Y390 HydrophobicContact CG-CE2 3.82Å; Q348-Y390 VanDerWaalsContact OE1-CG 3.31Å
349	K	90.8	Very high	90.2	Very high	73 Å²	73	44.1 Å²	44.1	32%	0.317	21%	0.209	S	C	.	.	H	α-helix	trans	-59.3	-50	178.4	-80.6	173.3	176.9	-179.7	0	112.1	L345 E346 T351 L352 N353 V393	L345-K349 HydrophobicContact CD1-CG 4.43Å; L345-K349 HydrophobicContact CG-CD 4.19Å; L345-K349 HydrophobicContact CG-CG 4.45Å; L345-K349 WeakPolarHBondContact O-CB 3.32Å; L345-K349 VanDerWaalsContact O-CG 3.26Å; L345-K349 WeakPolarHBondContact O-CG 3.32Å; L345-K349 PolarHBondContact O-N 3.13Å; E346-K349 PolarHBondContact O-N 2.86Å; K349-T351 VanDerWaalsContact C-N 3.34Å; K349-T351 PolarHBondContact O-N 3.27Å; K349-L352 PolarHBondContact O-N 2.79Å; K349-N353 PolarHBondContact O-N 2.86Å; K349-V393 HydrophobicContact CD-CG2 4.4Å; K349-V393 HydrophobicContact CG-CG1 3.96Å; K349-V393 HydrophobicContact CG-CG2 3.91Å
350	R	90.9	Very high	90.2	Very high	88 Å²	88	44.5 Å²	44.5	33%	0.332	21%	0.212	S	C	.	.	H	α-helix	trans	-65.1	-38.8	179.2	-67.3	-155.5	-175.4	-161.8	2.9	112.3	L310 I313 D314 E346 N353 L354	L310-R350 HydrophobicContact CD2-CG 4.31Å; I313-R350 HydrophobicContact CG2-CB 3.98Å; D314-R350 IonicContact OD1-CZ 2.88Å; D314-R350 IonicContact OD1-NH1 2.75Å; D314-R350 PolarHBondContact OD1-NH1 3.22Å; D314-R350 IonicContact OD2-CZ 2.7Å; D314-R350 IonicContact OD2-NH1 3.63Å; D314-R350 PolarHBondContact OD2-NH1 2.93Å; E346-R350 WeakPolarHBondContact O-CG 3.36Å; E346-R350 PolarHBondContact O-N 3.5Å; E346-R350 IonicContact OE1-CZ 3.31Å; E346-R350 IonicContact OE1-NE 2.53Å; E346-R350 PolarHBondContact OE1-NE 2.94Å; E346-R350 IonicContact OE1-NH2 3.94Å; R350-N353 PolarHBondContact O-N 3.18Å; R350-L354 PolarHBondContact O-N 3.2Å
351	T	93.7	Very high	90.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.4	-46.4	173.5	-57.6	0	0	0	0	110.9	I313 L336 V339 L340 V347 Q348 K349 N353 L354 V355	I313-T351 WeakPolarHBondContact CD1-OG1 3.36Å; L336-T351 HydrophobicContact CD2-CG2 3.59Å; V339-T351 HydrophobicContact CB-CG2 4.04Å; V339-T351 HydrophobicContact CG1-CG2 4.28Å; L340-T351 HydrophobicContact CD2-CG2 3.93Å; L340-T351 HydrophobicContact CG-CG2 4.42Å; V347-T351 VanDerWaalsContact O-CB 3.24Å; V347-T351 WeakPolarHBondContact O-CB 3.26Å; V347-T351 PolarHBondContact O-N 3.45Å; V347-T351 PolarHBondContact O-OG1 3.04Å; Q348-T351 PolarHBondContact O-N 2.9Å; K349-T351 VanDerWaalsContact C-N 3.34Å; K349-T351 PolarHBondContact O-N 3.27Å; T351-N353 PolarHBondContact O-N 2.9Å; T351-L354 PolarHBondContact O-N 3.43Å; T351-V355 HydrophobicContact CG2-CG2 4.47Å; T351-V355 VanDerWaalsContact O-CG2 3.31Å; T351-V355 WeakPolarHBondContact O-CG2 3.39Å; T351-V355 PolarHBondContact O-N 3.44Å
352	L	93.7	Very high	90.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-38	178.9	-72.8	171	0	0	0	112.6	L340 Q348 K349 V355 Y356 L371 Y390 V393 L394 T397	L340-L352 HydrophobicContact CD1-CD2 3.83Å; L340-L352 HydrophobicContact CD2-CD1 4.46Å; L340-L352 HydrophobicContact CD2-CD2 4Å; L340-L352 HydrophobicContact CD2-CG 3.84Å; Q348-L352 WeakPolarHBondContact O-CB 3.42Å; Q348-L352 VanDerWaalsContact O-CG 3.3Å; Q348-L352 WeakPolarHBondContact O-CG 3.31Å; Q348-L352 PolarHBondContact O-N 3.31Å; K349-L352 PolarHBondContact O-N 2.79Å; L352-V355 PolarHBondContact O-N 2.87Å; L352-Y356 WeakPolarHBondContact O-CB 3.4Å; L352-Y356 PolarHBondContact O-N 2.77Å; L352-L371 HydrophobicContact CD2-CD2 3.61Å; L352-Y390 HydrophobicContact CD1-CE2 4.31Å; L352-V393 HydrophobicContact CD1-CB 4.47Å; L352-V393 HydrophobicContact CD1-CG1 3.56Å; L352-L394 HydrophobicContact CD1-CD2 3.88Å; L352-L394 HydrophobicContact CD1-CG 4.48Å; L352-L394 HydrophobicContact CD2-CD2 4.08Å; L352-T397 HydrophobicContact CB-CG2 4.37Å; L352-T397 HydrophobicContact CD2-CG2 4.3Å
353	N	92	Very high	90.5	Very high	102 Å²	102	51.8 Å²	51.8	55%	0.545	24%	0.243	S	C	.	.	H	α-helix	trans	-62.4	-44.9	173.4	-71	-17.3	0	0	0	111.4	K349 R350 T351 Y356 D357	K349-N353 PolarHBondContact O-N 2.86Å; R350-N353 PolarHBondContact O-N 3.18Å; T351-N353 PolarHBondContact O-N 2.9Å; N353-Y356 PolarHBondContact O-N 3.13Å; N353-D357 PolarHBondContact O-N 2.89Å
354	L	92.7	Very high	91	Very high	2 Å²	2	43 Å²	43	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-62.7	-43.2	175.1	176.7	57.8	0	0	0	111.6	I313 L316 V317 R320 L329 L336 R350 T351 D357 L358	I313-L354 HydrophobicContact CG2-CD2 4.26Å; L316-L354 HydrophobicContact CB-CD2 3.87Å; L316-L354 HydrophobicContact CD1-CD2 4.21Å; V317-L354 HydrophobicContact CG2-CB 4.35Å; V317-L354 HydrophobicContact CG2-CD1 3.93Å; V317-L354 HydrophobicContact CG2-CD2 4.43Å; V317-L354 HydrophobicContact CG2-CG 4.47Å; R320-L354 VanDerWaalsContact CD-CD1 3.45Å; L329-L354 HydrophobicContact CD2-CD1 4.38Å; L336-L354 HydrophobicContact CD1-CD2 3.65Å; L336-L354 HydrophobicContact CD1-CG 4.34Å; L336-L354 HydrophobicContact CD2-CD2 4.23Å; L336-L354 HydrophobicContact CD2-CG 4.41Å; R350-L354 PolarHBondContact O-N 3.2Å; T351-L354 PolarHBondContact O-N 3.43Å; L354-D357 PolarHBondContact O-N 2.89Å; L354-L358 HydrophobicContact CD1-CD1 3.9Å; L354-L358 HydrophobicContact CD1-CG 4.33Å; L354-L358 HydrophobicContact CG-CD1 3.94Å; L354-L358 WeakPolarHBondContact O-CD1 3.46Å; L354-L358 VanDerWaalsContact O-CG 3.25Å; L354-L358 WeakPolarHBondContact O-CG 3.43Å; L354-L358 PolarHBondContact O-N 2.87Å
355	V	93.5	Very high	91.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.3	-48.8	175.9	170.8	0	0	0	0	110.7	V333 L336 L337 T351 L352 D357 L358 V359 V367	V333-V355 HydrophobicContact CG2-CG1 4.05Å; V333-V355 HydrophobicContact CG2-CG2 4.29Å; L336-V355 HydrophobicContact CD2-CG2 3.44Å; L336-V355 VanDerWaalsContact CD2-CG2 3.44Å; L337-V355 HydrophobicContact CD2-CG1 4.09Å; L337-V355 HydrophobicContact CD2-CG2 3.92Å; L337-V355 HydrophobicContact CG-CG1 4.46Å; L337-V355 HydrophobicContact CG-CG2 4.15Å; T351-V355 HydrophobicContact CG2-CG2 4.47Å; T351-V355 VanDerWaalsContact O-CG2 3.31Å; T351-V355 WeakPolarHBondContact O-CG2 3.39Å; T351-V355 PolarHBondContact O-N 3.44Å; L352-V355 PolarHBondContact O-N 2.87Å; V355-D357 PolarHBondContact O-N 3.14Å; V355-L358 CarbonylContact O-C 2.96Å; V355-L358 WeakPolarHBondContact O-CA 3.44Å; V355-L358 PolarHBondContact O-N 3.08Å; V355-V359 HydrophobicContact CG1-CG2 4.39Å; V355-V359 WeakPolarHBondContact O-CG2 3.41Å; V355-V359 PolarHBondContact O-N 3.33Å; V355-V359 VanDerWaalsContact O-N 3.08Å; V355-V367 HydrophobicContact CG1-CG1 3.82Å
356	Y	91.7	Very high	91.3	Very high	73 Å²	73	52 Å²	52	29%	0.286	24%	0.242	S	C	.	.	H	α-helix	trans	-50.8	-43.3	179.9	168.9	-102.7	0	0	0	111.9	L352 N353 L358 V359 S400 I401	L352-Y356 WeakPolarHBondContact O-CB 3.4Å; L352-Y356 PolarHBondContact O-N 2.77Å; N353-Y356 PolarHBondContact O-N 3.13Å; Y356-L358 VanDerWaalsContact C-N 3.34Å; Y356-L358 PolarHBondContact O-N 3.29Å; Y356-V359 PolarHBondContact O-N 3.05Å; Y356-S400 VanDerWaalsContact CE2-CB 3.43Å; Y356-I401 HydrophobicContact CD2-CG1 3.9Å; Y356-I401 HydrophobicContact CE2-CG1 4.47Å
357	D	89.7	Confident	91.5	Very high	68 Å²	68	48.2 Å²	48.2	36%	0.364	22%	0.224	S	C	.	.	H	α-helix	trans	-71.4	-28.7	179.5	-70.7	-17.8	0	0	0	113.8	R320 N353 L354 V355	R320-D357 IonicContact CZ-OD2 2.9Å; R320-D357 IonicContact NH1-OD2 2.8Å; R320-D357 PolarHBondContact NH1-OD2 3.18Å; R320-D357 VanDerWaalsContact NH2-CB 3.34Å; N353-D357 PolarHBondContact O-N 2.89Å; L354-D357 PolarHBondContact O-N 2.89Å; V355-D357 PolarHBondContact O-N 3.14Å
358	L	91.1	Very high	91.6	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-85.5	-5.9	178.9	-66.7	167.7	0	0	0	113.8	L329 Q330 V333 L354 V355 Y356 S360 N363	L329-L358 HydrophobicContact CB-CD2 3.92Å; L329-L358 HydrophobicContact CD1-CD1 4.49Å; L329-L358 HydrophobicContact CD2-CD1 3.81Å; L329-L358 HydrophobicContact CD2-CD2 3.79Å; L329-L358 HydrophobicContact CD2-CG 4.37Å; L329-L358 HydrophobicContact CG-CD1 3.61Å; L329-L358 HydrophobicContact CG-CD2 3.74Å; L329-L358 HydrophobicContact CG-CG 4.32Å; Q330-L358 HydrophobicContact CG-CD2 4.18Å; V333-L358 HydrophobicContact CG2-CB 4.17Å; L354-L358 HydrophobicContact CD1-CD1 3.9Å; L354-L358 HydrophobicContact CD1-CG 4.33Å; L354-L358 HydrophobicContact CG-CD1 3.94Å; L354-L358 WeakPolarHBondContact O-CD1 3.46Å; L354-L358 VanDerWaalsContact O-CG 3.25Å; L354-L358 WeakPolarHBondContact O-CG 3.43Å; L354-L358 PolarHBondContact O-N 2.87Å; V355-L358 CarbonylContact O-C 2.96Å; V355-L358 WeakPolarHBondContact O-CA 3.44Å; V355-L358 PolarHBondContact O-N 3.08Å; Y356-L358 VanDerWaalsContact C-N 3.34Å; Y356-L358 PolarHBondContact O-N 3.29Å; L358-S360 PolarHBondContact O-N 3.2Å; L358-N363 PolarHBondContact O-ND2 3.16Å; L358-N363 VanDerWaalsContact O-ND2 3.12Å
359	V	92.4	Very high	91.5	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.024	24%	0.244	C	C	.	.			trans	-67	127.4	176.5	177.9	0	0	0	0	109.6	V355 Y356 N363 V364 V367 I401 F405	V355-V359 HydrophobicContact CG1-CG2 4.39Å; V355-V359 WeakPolarHBondContact O-CG2 3.41Å; V355-V359 PolarHBondContact O-N 3.33Å; V355-V359 VanDerWaalsContact O-N 3.08Å; Y356-V359 PolarHBondContact O-N 3.05Å; V359-N363 WeakPolarHBondContact CA-OD1 3.28Å; V359-V364 HydrophobicContact CG1-CB 3.79Å; V359-V364 HydrophobicContact CG1-CG2 3.7Å; V359-V367 HydrophobicContact CG2-CG1 4.06Å; V359-V367 HydrophobicContact CG2-CG2 4.5Å; V359-I401 HydrophobicContact CG1-CG2 4.11Å; V359-I401 HydrophobicContact CG2-CD1 3.9Å; V359-I401 HydrophobicContact CG2-CG1 4.15Å; V359-F405 HydrophobicContact CB-CE2 4.13Å; V359-F405 HydrophobicContact CG1-CD2 3.83Å; V359-F405 HydrophobicContact CG1-CE2 3.41Å; V359-F405 VanDerWaalsContact CG1-CE2 3.41Å; V359-F405 HydrophobicContact CG1-CZ 4.15Å
360	S	90.2	Very high	91.6	Very high	14 Å²	14	48.9 Å²	48.9	10%	0.098	24%	0.237	C	C	.	.			trans	-129.3	164.4	176.2	74.7	0	0	0	0	109.6	L358 R362 N363 V364	L358-S360 PolarHBondContact O-N 3.2Å; S360-R362 PolarHBondContact O-N 2.94Å; S360-R362 PolarHBondContact OG-N 3.14Å; S360-N363 PolarHBondContact N-OD1 2.99Å; S360-N363 PolarHBondContact O-N 3.15Å; S360-N363 VanDerWaalsContact O-N 3.14Å; S360-N363 PolarHBondContact O-OD1 3.44Å; S360-N363 PolarHBondContact OG-OD1 2.9Å; S360-V364 WeakPolarHBondContact O-CB 3.39Å; S360-V364 PolarHBondContact O-N 3.18Å
361	P	87.5	Confident	91.6	Very high	90 Å²	90	44.7 Å²	44.7	58%	0.584	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-18.2	175	-24.3	33	0	0	0	114.2	F405	P361-F405 HydrophobicContact CG-CD1 4.4Å; P361-F405 HydrophobicContact CG-CE1 3.84Å
362	R	89.7	Confident	91.3	Very high	210 Å²	210	49.7 Å²	49.7	79%	0.792	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-31.7	-178.5	-63.3	179.9	177.8	179.7	-1.8	113.8	S360	S360-R362 PolarHBondContact O-N 2.94Å; S360-R362 PolarHBondContact OG-N 3.14Å
363	N	91.3	Very high	91.1	Very high	12 Å²	12	56.2 Å²	56.2	6%	0.064	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-8.2	-172.9	62.7	17.8	0	0	0	112.8	Q330 V333 L358 V359 S360 E365 E366 V367	Q330-N363 PolarHBondContact O-ND2 3.47Å; Q330-N363 VanDerWaalsContact O-ND2 3.15Å; V333-N363 HydrophobicContact CG1-CB 4.09Å; L358-N363 PolarHBondContact O-ND2 3.16Å; L358-N363 VanDerWaalsContact O-ND2 3.12Å; V359-N363 WeakPolarHBondContact CA-OD1 3.28Å; S360-N363 PolarHBondContact N-OD1 2.99Å; S360-N363 PolarHBondContact O-N 3.15Å; S360-N363 VanDerWaalsContact O-N 3.14Å; S360-N363 PolarHBondContact O-OD1 3.44Å; S360-N363 PolarHBondContact OG-OD1 2.9Å; N363-E365 VanDerWaalsContact C-N 3.31Å; N363-E365 PolarHBondContact O-N 3.18Å; N363-E366 PolarHBondContact O-N 3.2Å; N363-E366 VanDerWaalsContact O-N 3.15Å; N363-V367 WeakPolarHBondContact O-CG2 3.35Å; N363-V367 PolarHBondContact O-N 3Å
364	V	91.6	Very high	90.9	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-55.8	-40.9	-174.5	65.9	0	0	0	0	113.4	V359 S360 I368 I401 F405 V408	V359-V364 HydrophobicContact CG1-CB 3.79Å; V359-V364 HydrophobicContact CG1-CG2 3.7Å; S360-V364 WeakPolarHBondContact O-CB 3.39Å; S360-V364 PolarHBondContact O-N 3.18Å; V364-I368 HydrophobicContact CG2-CG1 4.39Å; V364-I368 WeakPolarHBondContact O-CB 3.46Å; V364-I368 VanDerWaalsContact O-CG1 3.3Å; V364-I368 WeakPolarHBondContact O-CG1 3.39Å; V364-I368 PolarHBondContact O-N 3.31Å; V364-I401 HydrophobicContact CG2-CG2 3.69Å; V364-F405 HydrophobicContact CG2-CB 3.96Å; V364-F405 HydrophobicContact CG2-CD2 3.93Å; V364-F405 HydrophobicContact CG2-CG 4.01Å; V364-V408 HydrophobicContact CB-CG2 4.28Å; V364-V408 HydrophobicContact CG1-CG2 3.72Å; V364-V408 HydrophobicContact CG2-CG2 3.63Å
365	E	91.4	Very high	90.6	Very high	149 Å²	149	52 Å²	52	70%	0.696	25%	0.245	S	C	*	.	H	α-helix	trans	-64.7	-43.2	179.5	-66.1	-170	167.5	0	0	112	N363 A369	N363-E365 VanDerWaalsContact C-N 3.31Å; N363-E365 PolarHBondContact O-N 3.18Å; E365-A369 WeakPolarHBondContact O-CB 3.17Å; E365-A369 PolarHBondContact O-N 3.18Å
366	E	91.6	Very high	90.1	Very high	113 Å²	113	55 Å²	55	53%	0.528	27%	0.27	S	S	.	.	H	α-helix	trans	-68.6	-42.7	179.6	-62.7	-174	-172.2	0	0	111.7	M334 N363 A369 Y370	M334-E366 HydrophobicContact CE-CB 3.9Å; M334-E366 HydrophobicContact SD-CB 3.73Å; N363-E366 PolarHBondContact O-N 3.2Å; N363-E366 VanDerWaalsContact O-N 3.15Å; E366-A369 PolarHBondContact O-N 2.75Å; E366-Y370 PolarHBondContact O-N 3.42Å
367	V	93.2	Very high	89.7	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.2	-48.2	177	172.1	0	0	0	0	110.2	V333 M334 L337 V355 V359 N363 A369 Y370 L371 I401	V333-V367 HydrophobicContact CG1-CG2 4.08Å; V333-V367 HydrophobicContact CG2-CG2 4.31Å; M334-V367 HydrophobicContact SD-CG2 4.23Å; L337-V367 HydrophobicContact CD1-CB 4.41Å; L337-V367 HydrophobicContact CD1-CG1 4.3Å; L337-V367 HydrophobicContact CD1-CG2 4.15Å; V355-V367 HydrophobicContact CG1-CG1 3.82Å; V359-V367 HydrophobicContact CG2-CG1 4.06Å; V359-V367 HydrophobicContact CG2-CG2 4.5Å; N363-V367 WeakPolarHBondContact O-CG2 3.35Å; N363-V367 PolarHBondContact O-N 3Å; V367-A369 VanDerWaalsContact C-N 3.35Å; V367-A369 PolarHBondContact O-N 2.97Å; V367-Y370 WeakPolarHBondContact O-CB 3.38Å; V367-Y370 PolarHBondContact O-N 2.88Å; V367-L371 HydrophobicContact CG1-CD1 4.05Å; V367-L371 HydrophobicContact CG1-CG 4.36Å; V367-L371 WeakPolarHBondContact O-CG 3.35Å; V367-L371 PolarHBondContact O-N 3.03Å; V367-I401 HydrophobicContact CG1-CD1 4.19Å
368	I	91.4	Very high	89.1	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-63.7	-40.8	178.4	-72.5	-68.1	0	0	0	111.4	V364 Y370 L371 R372 I398 I401 V408 V412	V364-I368 HydrophobicContact CG2-CG1 4.39Å; V364-I368 WeakPolarHBondContact O-CB 3.46Å; V364-I368 VanDerWaalsContact O-CG1 3.3Å; V364-I368 WeakPolarHBondContact O-CG1 3.39Å; V364-I368 PolarHBondContact O-N 3.31Å; I368-Y370 VanDerWaalsContact C-N 3.28Å; I368-Y370 PolarHBondContact O-N 3.28Å; I368-L371 PolarHBondContact O-N 3.32Å; I368-R372 HydrophobicContact CG2-CG 4.35Å; I368-R372 WeakPolarHBondContact O-CB 3.5Å; I368-R372 VanDerWaalsContact O-CG 3.25Å; I368-R372 WeakPolarHBondContact O-CG 3.1Å; I368-R372 PolarHBondContact O-N 3.38Å; I368-I398 HydrophobicContact CD1-CB 4.47Å; I368-I398 HydrophobicContact CD1-CG1 4.22Å; I368-I398 HydrophobicContact CD1-CG2 4.13Å; I368-I401 HydrophobicContact CD1-CB 4.11Å; I368-I401 HydrophobicContact CD1-CD1 4.31Å; I368-I401 HydrophobicContact CD1-CG2 3.75Å; I368-I401 HydrophobicContact CG1-CG2 4.02Å; I368-V408 HydrophobicContact CB-CG1 3.95Å; I368-V408 HydrophobicContact CG1-CG1 3.87Å; I368-V408 HydrophobicContact CG2-CG1 3.8Å; I368-V412 HydrophobicContact CD1-CG2 4.27Å; I368-V412 HydrophobicContact CG2-CG2 3.54Å
369	A	91.4	Very high	88.3	Confident	56 Å²	56	57.6 Å²	57.6	46%	0.463	29%	0.287	S	S	.	.	H	α-helix	trans	-59.7	-39.6	175.3	0	0	0	0	0	112	E365 E366 V367 K373	E365-A369 WeakPolarHBondContact O-CB 3.17Å; E365-A369 PolarHBondContact O-N 3.18Å; E366-A369 PolarHBondContact O-N 2.75Å; V367-A369 VanDerWaalsContact C-N 3.35Å; V367-A369 PolarHBondContact O-N 2.97Å; A369-K373 PolarHBondContact O-N 2.82Å
370	Y	92.6	Very high	87.1	Confident	42 Å²	42	61 Å²	61	17%	0.165	32%	0.323	C	S	.	.	H	α-helix	trans	-66.8	-49.4	175.7	-163.7	-78.9	0	0	0	112.1	M334 L337 L340 E366 V367 I368 R372 K373 E374	M334-Y370 HydrophobicContact CE-CD2 4.24Å; L337-Y370 HydrophobicContact CB-CD1 3.98Å; L337-Y370 HydrophobicContact CB-CD2 4.46Å; L337-Y370 HydrophobicContact CB-CE1 3.95Å; L337-Y370 HydrophobicContact CB-CE2 4.42Å; L337-Y370 HydrophobicContact CB-CG 4.25Å; L337-Y370 HydrophobicContact CD1-CD1 4.22Å; L337-Y370 HydrophobicContact CD1-CG 4.01Å; L337-Y370 HydrophobicContact CD2-CD1 4.15Å; L337-Y370 HydrophobicContact CG-CD1 4.36Å; L337-Y370 PolarHBondContact O-OH 3.16Å; L340-Y370 HydrophobicContact CD1-CE1 4.41Å; E366-Y370 PolarHBondContact O-N 3.42Å; V367-Y370 WeakPolarHBondContact O-CB 3.38Å; V367-Y370 PolarHBondContact O-N 2.88Å; I368-Y370 VanDerWaalsContact C-N 3.28Å; I368-Y370 PolarHBondContact O-N 3.28Å; Y370-R372 VanDerWaalsContact C-N 3.28Å; Y370-R372 PolarHBondContact O-N 2.88Å; Y370-K373 WeakPolarHBondContact O-CA 3.49Å; Y370-K373 WeakPolarHBondContact O-CB 3.27Å; Y370-K373 PolarHBondContact O-N 3Å; Y370-E374 HydrophobicContact CD1-CG 3.87Å; Y370-E374 HydrophobicContact CE1-CG 3.63Å; Y370-E374 PolarHBondContact O-N 3.02Å
371	L	91.7	Very high	85.7	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-61.5	-37.2	-179.8	-65.3	178.3	0	0	0	111.9	L337 L340 L352 V367 I368 K373 E374 I375 L394 T397 I398 I401	L337-L371 HydrophobicContact CD2-CD2 4.05Å; L340-L371 HydrophobicContact CD1-CD2 4.1Å; L352-L371 HydrophobicContact CD2-CD2 3.61Å; V367-L371 HydrophobicContact CG1-CD1 4.05Å; V367-L371 HydrophobicContact CG1-CG 4.36Å; V367-L371 WeakPolarHBondContact O-CG 3.35Å; V367-L371 PolarHBondContact O-N 3.03Å; I368-L371 PolarHBondContact O-N 3.32Å; L371-K373 VanDerWaalsContact C-N 3.33Å; L371-K373 PolarHBondContact O-N 3.11Å; L371-E374 PolarHBondContact O-N 3.38Å; L371-I375 WeakPolarHBondContact O-CG1 3.39Å; L371-I375 PolarHBondContact O-N 3.35Å; L371-L394 HydrophobicContact CD2-CD2 3.88Å; L371-T397 HydrophobicContact CD1-CG2 4.32Å; L371-I398 HydrophobicContact CB-CD1 3.78Å; L371-I398 HydrophobicContact CB-CG1 3.84Å; L371-I398 HydrophobicContact CD1-CG1 3.83Å; L371-I398 HydrophobicContact CG-CG1 4.5Å; L371-I401 HydrophobicContact CD1-CD1 3.86Å
372	R	87.8	Confident	84.2	Confident	105 Å²	105	64.2 Å²	64.2	40%	0.396	35%	0.345	S	S	.	.	H	α-helix	trans	-60.1	-42.7	172.3	-75.2	173.1	62.9	-165.2	-0.5	112.1	I368 Y370 E374 I375 A376	I368-R372 HydrophobicContact CG2-CG 4.35Å; I368-R372 WeakPolarHBondContact O-CB 3.5Å; I368-R372 VanDerWaalsContact O-CG 3.25Å; I368-R372 WeakPolarHBondContact O-CG 3.1Å; I368-R372 PolarHBondContact O-N 3.38Å; Y370-R372 VanDerWaalsContact C-N 3.28Å; Y370-R372 PolarHBondContact O-N 2.88Å; R372-E374 VanDerWaalsContact C-N 3.32Å; R372-I375 PolarHBondContact O-N 2.69Å; R372-A376 PolarHBondContact O-N 2.91Å
373	K	88.8	Confident	82.4	Confident	138 Å²	138	57 Å²	57	60%	0.6	33%	0.326	S	S	*	.	H	α-helix	trans	-65.1	-38	177	-170.7	179.4	-178.8	179	0	111.4	A369 Y370 L371 A376 K377	A369-K373 PolarHBondContact O-N 2.82Å; Y370-K373 WeakPolarHBondContact O-CA 3.49Å; Y370-K373 WeakPolarHBondContact O-CB 3.27Å; Y370-K373 PolarHBondContact O-N 3Å; L371-K373 VanDerWaalsContact C-N 3.33Å; L371-K373 PolarHBondContact O-N 3.11Å; K373-A376 PolarHBondContact O-N 2.86Å; K373-K377 WeakPolarHBondContact O-CG 3.47Å; K373-K377 PolarHBondContact O-N 2.7Å
374	E	87.5	Confident	81	Confident	11 Å²	11	61.5 Å²	61.5	5%	0.051	35%	0.354	C	S	.	.	H	α-helix	trans	-64.7	-45	173.8	-73.8	-55.3	127.6	0	0	111.9	L340 Y370 L371 R372 A376 K377 T378 L394	L340-E374 HydrophobicContact CD1-CG 4.47Å; Y370-E374 HydrophobicContact CD1-CG 3.87Å; Y370-E374 HydrophobicContact CE1-CG 3.63Å; Y370-E374 PolarHBondContact O-N 3.02Å; L371-E374 PolarHBondContact O-N 3.38Å; R372-E374 VanDerWaalsContact C-N 3.32Å; E374-A376 VanDerWaalsContact C-N 3.32Å; E374-A376 PolarHBondContact O-N 3.43Å; E374-K377 WeakPolarHBondContact O-CB 3.15Å; E374-K377 PolarHBondContact O-N 2.91Å; E374-K377 VanDerWaalsContact O-N 3.1Å; E374-K377 IonicContact OE1-NZ 3.69Å; E374-K377 PolarHBondContact OE1-NZ 2.72Å; E374-K377 IonicContact OE2-NZ 3.24Å; E374-T378 PolarHBondContact O-N 3.37Å; E374-L394 HydrophobicContact CB-CD1 4.07Å; E374-L394 HydrophobicContact CB-CD2 4.42Å
375	I	85.5	Confident	79.8	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.026	38%	0.38	C	S	.	.	H	α-helix	trans	-58.2	-45.6	174.3	-69.5	178.2	0	0	0	111	L371 R372 K377 T378 V379 L394 V395 I398 L416 L419	L371-I375 WeakPolarHBondContact O-CG1 3.39Å; L371-I375 PolarHBondContact O-N 3.35Å; R372-I375 PolarHBondContact O-N 2.69Å; I375-K377 PolarHBondContact O-N 3.18Å; I375-T378 WeakPolarHBondContact O-CB 3.34Å; I375-T378 PolarHBondContact O-N 2.89Å; I375-T378 PolarHBondContact O-OG1 2.98Å; I375-V379 PolarHBondContact O-N 3.11Å; I375-L394 HydrophobicContact CD1-CB 4.09Å; I375-L394 HydrophobicContact CG1-CB 3.75Å; I375-L394 HydrophobicContact CG1-CD1 3.82Å; I375-L394 HydrophobicContact CG1-CG 4.39Å; I375-V395 HydrophobicContact CD1-CG2 4.12Å; I375-I398 HydrophobicContact CD1-CD1 3.33Å; I375-I398 HydrophobicContact CG1-CD1 4.42Å; I375-L416 HydrophobicContact CD1-CD2 4.14Å; I375-L419 HydrophobicContact CG2-CD1 3.49Å; I375-L419 VanDerWaalsContact CG2-CD1 3.49Å; I375-L419 HydrophobicContact CG2-CD2 3.64Å; I375-L419 HydrophobicContact CG2-CG 4.19Å
376	A	83.1	Confident	79	Confident	63 Å²	63	64 Å²	64	52%	0.521	37%	0.372	S	S	.	.	H	α-helix	trans	-59.7	-29.9	178.8	0	0	0	0	0	113.1	R372 K373 E374 T378 V379	R372-A376 PolarHBondContact O-N 2.91Å; K373-A376 PolarHBondContact O-N 2.86Å; E374-A376 VanDerWaalsContact C-N 3.32Å; E374-A376 PolarHBondContact O-N 3.43Å; A376-T378 VanDerWaalsContact C-N 3.34Å; A376-V379 PolarHBondContact O-N 2.77Å
377	K	83.3	Confident	78.4	Confident	106 Å²	106	59.8 Å²	59.8	46%	0.461	35%	0.354	S	S	.	.	H	α-helix	trans	-71.7	-26.5	174.1	-68.3	171.7	-177.1	175.5	0	113.3	K373 E374 I375 V379 T381	K373-K377 WeakPolarHBondContact O-CG 3.47Å; K373-K377 PolarHBondContact O-N 2.7Å; E374-K377 WeakPolarHBondContact O-CB 3.15Å; E374-K377 PolarHBondContact O-N 2.91Å; E374-K377 VanDerWaalsContact O-N 3.1Å; E374-K377 IonicContact OE1-NZ 3.69Å; E374-K377 PolarHBondContact OE1-NZ 2.72Å; E374-K377 IonicContact OE2-NZ 3.24Å; I375-K377 PolarHBondContact O-N 3.18Å; K377-V379 VanDerWaalsContact C-N 3.25Å; K377-T381 PolarHBondContact O-OG1 3.24Å
378	T	78.9	Confident	77.7	Confident	8 Å²	8	61.3 Å²	61.3	5%	0.049	36%	0.362	C	S	.	.	H	α-helix	trans	-76.8	-13.5	176.4	70.2	0	0	0	0	113	E374 I375 A376 G380 T381 T387 Y390 L394	E374-T378 PolarHBondContact O-N 3.37Å; I375-T378 WeakPolarHBondContact O-CB 3.34Å; I375-T378 PolarHBondContact O-N 2.89Å; I375-T378 PolarHBondContact O-OG1 2.98Å; A376-T378 VanDerWaalsContact C-N 3.34Å; T378-G380 PolarHBondContact O-N 2.85Å; T378-T381 PolarHBondContact O-OG1 3.26Å; T378-T387 HydrophobicContact CG2-CG2 4.21Å; T378-Y390 HydrophobicContact CG2-CD1 3.96Å; T378-Y390 HydrophobicContact CG2-CE1 4.18Å; T378-L394 HydrophobicContact CG2-CD1 4.41Å
379	V	73.4	Confident	77.3	Confident	81 Å²	81	66.1 Å²	66.1	49%	0.491	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	118	177.9	-177.1	0	0	0	0	109.2	I375 A376 K377 L419	I375-V379 PolarHBondContact O-N 3.11Å; A376-V379 PolarHBondContact O-N 2.77Å; K377-V379 VanDerWaalsContact C-N 3.25Å; V379-L419 HydrophobicContact CG2-CD2 3.83Å
380	G	66.4	Low	77.1	Confident	75 Å²	75	64 Å²	64	77%	0.773	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.2	-4.1	178.3	0	0	0	0	0	115.9	T378	T378-G380 PolarHBondContact O-N 2.85Å
381	T	62.8	Low	76.7	Confident	59 Å²	59	62.2 Å²	62.2	36%	0.362	36%	0.355	S	S	.	.			trans	-80	127.4	174.7	-12.3	0	0	0	0	110.6	K377 T378 K424	K377-T381 PolarHBondContact O-OG1 3.24Å; T378-T381 PolarHBondContact O-OG1 3.26Å; T381-K424 PolarHBondContact O-NZ 3.22Å
382	S	54.2	Low	76.4	Confident	112 Å²	112	64.7 Å²	64.7	78%	0.783	37%	0.367	S	S	*	.			trans	-90.7	8.3	-176.3	57.9	0	0	0	0	114.6	V384	S382-V384 VanDerWaalsContact O-CG2 3.25Å; S382-V384 WeakPolarHBondContact O-CG2 3.38Å; S382-V384 PolarHBondContact O-N 2.88Å
383	S	53.5	Low	76.4	Confident	58 Å²	58	60.9 Å²	60.9	41%	0.406	36%	0.355	S	S	.	.			trans	-73.4	106.9	171.8	39.2	0	0	0	0	109.2	T387	S383-T387 WeakPolarHBondContact O-CB 3.49Å; S383-T387 PolarHBondContact O-OG1 2.88Å; S383-T387 PolarHBondContact OG-OG1 3.2Å
384	V	61.6	Low	76.4	Confident	107 Å²	107	54.3 Å²	54.3	65%	0.648	33%	0.327	S	S	*	.			trans	-71.4	-44.1	-148.4	-171.2	0	0	0	0	113.7	S382	S382-V384 VanDerWaalsContact O-CG2 3.25Å; S382-V384 WeakPolarHBondContact O-CG2 3.38Å; S382-V384 PolarHBondContact O-N 2.88Å
385	D	66.5	Low	76.4	Confident	104 Å²	104	53.9 Å²	53.9	56%	0.556	33%	0.325	S	S	*	.	S	Bend	trans	-104.8	-52.6	-167.8	-70.2	-9.8	0	0	0	114.6	T387 E388 K389	D385-T387 PolarHBondContact O-N 3.32Å; D385-E388 PolarHBondContact O-N 3.02Å; D385-K389 PolarHBondContact O-N 3.29Å
386	D	73.9	Confident	76.4	Confident	98 Å²	98	58.5 Å²	58.5	52%	0.524	35%	0.345	S	S	.	.	H	α-helix	trans	-70.2	-33.3	-173.9	-71.4	-25.3	0	0	0	112.8	E388 K389 Y390	D386-E388 VanDerWaalsContact C-N 3.31Å; D386-E388 PolarHBondContact O-N 2.8Å; D386-K389 PolarHBondContact O-N 3.26Å; D386-Y390 VanDerWaalsContact O-CB 3.28Å; D386-Y390 WeakPolarHBondContact O-CB 3.41Å; D386-Y390 PolarHBondContact O-N 2.92Å
387	T	79.1	Confident	76.7	Confident	25 Å²	25	55.9 Å²	55.9	15%	0.153	32%	0.322	C	S	.	.	H	α-helix	trans	-68.9	-32.7	175.5	-49.5	0	0	0	0	111.5	T378 S383 D385 R391	T378-T387 HydrophobicContact CG2-CG2 4.21Å; S383-T387 WeakPolarHBondContact O-CB 3.49Å; S383-T387 PolarHBondContact O-OG1 2.88Å; S383-T387 PolarHBondContact OG-OG1 3.2Å; D385-T387 PolarHBondContact O-N 3.32Å; T387-R391 WeakPolarHBondContact O-CB 3.24Å; T387-R391 PolarHBondContact O-N 2.79Å
388	E	78.5	Confident	77	Confident	33 Å²	33	50.9 Å²	50.9	15%	0.154	30%	0.301	C	S	.	.	H	α-helix	trans	-69.4	-46.6	174.6	179.8	163.7	-159.1	0	0	111.3	D385 D386 Y390 R391 Q392	D385-E388 PolarHBondContact O-N 3.02Å; D386-E388 VanDerWaalsContact C-N 3.31Å; D386-E388 PolarHBondContact O-N 2.8Å; E388-Y390 VanDerWaalsContact C-N 3.32Å; E388-Y390 PolarHBondContact O-N 2.8Å; E388-R391 PolarHBondContact O-N 2.89Å; E388-R391 IonicContact OE1-NH2 3.27Å; E388-Q392 PolarHBondContact O-N 3.25Å
389	K	82.7	Confident	77.3	Confident	102 Å²	102	51.7 Å²	51.7	44%	0.443	30%	0.304	S	S	.	.	H	α-helix	trans	-59.8	-43	173.9	-69.6	176.2	-176.7	170.7	0	111.4	L345 D385 D386 R391 Q392 V393	L345-K389 HydrophobicContact CD1-CB 4.36Å; L345-K389 HydrophobicContact CD2-CB 3.8Å; L345-K389 HydrophobicContact CD2-CD 4.03Å; D385-K389 PolarHBondContact O-N 3.29Å; D386-K389 PolarHBondContact O-N 3.26Å; K389-R391 PolarHBondContact O-N 2.75Å; K389-Q392 WeakPolarHBondContact O-CB 3.23Å; K389-Q392 PolarHBondContact O-N 3.06Å; K389-V393 VanDerWaalsContact O-CG2 3.27Å; K389-V393 WeakPolarHBondContact O-CG2 3.42Å; K389-V393 PolarHBondContact O-N 3.24Å
390	Y	86.6	Confident	77.9	Confident	13 Å²	13	49.9 Å²	49.9	5%	0.051	30%	0.295	C	S	.	.	H	α-helix	trans	-61	-45.8	176	177	-127.3	0	0	0	111.7	Q348 L352 T378 D386 E388 Q392 V393 L394	Q348-Y390 HydrophobicContact CB-CD2 3.99Å; Q348-Y390 HydrophobicContact CB-CE2 3.84Å; Q348-Y390 VanDerWaalsContact CD-CD2 3.41Å; Q348-Y390 VanDerWaalsContact CD-CE2 3.41Å; Q348-Y390 HydrophobicContact CG-CD2 4.15Å; Q348-Y390 HydrophobicContact CG-CE2 3.82Å; Q348-Y390 VanDerWaalsContact OE1-CG 3.31Å; L352-Y390 HydrophobicContact CD1-CE2 4.31Å; T378-Y390 HydrophobicContact CG2-CD1 3.96Å; T378-Y390 HydrophobicContact CG2-CE1 4.18Å; D386-Y390 VanDerWaalsContact O-CB 3.28Å; D386-Y390 WeakPolarHBondContact O-CB 3.41Å; D386-Y390 PolarHBondContact O-N 2.92Å; E388-Y390 VanDerWaalsContact C-N 3.32Å; E388-Y390 PolarHBondContact O-N 2.8Å; Y390-Q392 VanDerWaalsContact C-N 3.31Å; Y390-Q392 PolarHBondContact O-N 2.93Å; Y390-V393 PolarHBondContact O-N 3.31Å; Y390-V393 VanDerWaalsContact O-N 3.17Å; Y390-L394 HydrophobicContact CD1-CD1 4.01Å; Y390-L394 HydrophobicContact CD2-CD1 4.46Å; Y390-L394 HydrophobicContact CD2-CG 4.23Å; Y390-L394 HydrophobicContact CE1-CD1 3.59Å; Y390-L394 HydrophobicContact CE1-CG 4.3Å; Y390-L394 HydrophobicContact CE2-CD1 4.06Å; Y390-L394 HydrophobicContact CE2-CD2 3.97Å; Y390-L394 HydrophobicContact CE2-CG 3.85Å; Y390-L394 HydrophobicContact CG-CD1 4.44Å; Y390-L394 WeakPolarHBondContact O-CG 3.47Å; Y390-L394 PolarHBondContact O-N 3.24Å
391	R	84.6	Confident	79	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.015	26%	0.258	C	S	.	.	H	α-helix	trans	-59.4	-41.9	174.9	-174	-177.5	64.9	134.3	9.1	111.7	T387 E388 K389 L394 V395 D422 K424 A427	T387-R391 WeakPolarHBondContact O-CB 3.24Å; T387-R391 PolarHBondContact O-N 2.79Å; E388-R391 PolarHBondContact O-N 2.89Å; E388-R391 IonicContact OE1-NH2 3.27Å; K389-R391 PolarHBondContact O-N 2.75Å; R391-L394 PolarHBondContact O-N 3.09Å; R391-V395 WeakPolarHBondContact O-CG2 3.19Å; R391-V395 PolarHBondContact O-N 2.97Å; R391-D422 IonicContact NH1-OD2 3.31Å; R391-K424 PolarHBondContact NH2-O 2.89Å; R391-A427 HydrophobicContact CG-CB 4.29Å; R391-A427 VanDerWaalsContact CZ-CB 3.44Å
392	Q	84.8	Confident	80.1	Confident	52 Å²	52	43.6 Å²	43.6	24%	0.243	24%	0.242	C	C	.	.	H	α-helix	trans	-59.6	-47.3	174.6	-171.2	-169.3	6.1	0	0	111.2	E388 K389 Y390 L394 V395 K396 I426 E430	E388-Q392 PolarHBondContact O-N 3.25Å; K389-Q392 WeakPolarHBondContact O-CB 3.23Å; K389-Q392 PolarHBondContact O-N 3.06Å; Y390-Q392 VanDerWaalsContact C-N 3.31Å; Y390-Q392 PolarHBondContact O-N 2.93Å; Q392-L394 VanDerWaalsContact C-N 3.33Å; Q392-L394 PolarHBondContact O-N 2.78Å; Q392-V395 PolarHBondContact O-N 3.42Å; Q392-K396 WeakPolarHBondContact O-CB 3.25Å; Q392-K396 PolarHBondContact O-N 3.22Å; Q392-I426 VanDerWaalsContact CD-CG2 3.4Å; Q392-I426 HydrophobicContact CG-CG2 4.04Å; Q392-E430 HydrophobicContact CG-CG 4.04Å; Q392-E430 PolarHBondContact NE2-OE1 3.44Å
393	V	88.2	Confident	81.4	Confident	25 Å²	25	40.7 Å²	40.7	15%	0.152	22%	0.219	C	C	.	.	H	α-helix	trans	-62.1	-40.5	178.3	178	0	0	0	0	111.2	K349 L352 K389 Y390 K396 T397	K349-V393 HydrophobicContact CD-CG2 4.4Å; K349-V393 HydrophobicContact CG-CG1 3.96Å; K349-V393 HydrophobicContact CG-CG2 3.91Å; L352-V393 HydrophobicContact CD1-CB 4.47Å; L352-V393 HydrophobicContact CD1-CG1 3.56Å; K389-V393 VanDerWaalsContact O-CG2 3.27Å; K389-V393 WeakPolarHBondContact O-CG2 3.42Å; K389-V393 PolarHBondContact O-N 3.24Å; Y390-V393 PolarHBondContact O-N 3.31Å; Y390-V393 VanDerWaalsContact O-N 3.17Å; V393-K396 PolarHBondContact O-N 2.89Å; V393-T397 WeakPolarHBondContact O-CB 3.42Å; V393-T397 PolarHBondContact O-N 3.34Å; V393-T397 PolarHBondContact O-OG1 3.17Å
394	L	89.4	Confident	82.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-48	175	-72.7	173.1	0	0	0	111.9	L352 L371 E374 I375 T378 Y390 R391 Q392 T397 I398	L352-L394 HydrophobicContact CD1-CD2 3.88Å; L352-L394 HydrophobicContact CD1-CG 4.48Å; L352-L394 HydrophobicContact CD2-CD2 4.08Å; L371-L394 HydrophobicContact CD2-CD2 3.88Å; E374-L394 HydrophobicContact CB-CD1 4.07Å; E374-L394 HydrophobicContact CB-CD2 4.42Å; I375-L394 HydrophobicContact CD1-CB 4.09Å; I375-L394 HydrophobicContact CG1-CB 3.75Å; I375-L394 HydrophobicContact CG1-CD1 3.82Å; I375-L394 HydrophobicContact CG1-CG 4.39Å; T378-L394 HydrophobicContact CG2-CD1 4.41Å; Y390-L394 HydrophobicContact CD1-CD1 4.01Å; Y390-L394 HydrophobicContact CD2-CD1 4.46Å; Y390-L394 HydrophobicContact CD2-CG 4.23Å; Y390-L394 HydrophobicContact CE1-CD1 3.59Å; Y390-L394 HydrophobicContact CE1-CG 4.3Å; Y390-L394 HydrophobicContact CE2-CD1 4.06Å; Y390-L394 HydrophobicContact CE2-CD2 3.97Å; Y390-L394 HydrophobicContact CE2-CG 3.85Å; Y390-L394 HydrophobicContact CG-CD1 4.44Å; Y390-L394 WeakPolarHBondContact O-CG 3.47Å; Y390-L394 PolarHBondContact O-N 3.24Å; R391-L394 PolarHBondContact O-N 3.09Å; Q392-L394 VanDerWaalsContact C-N 3.33Å; Q392-L394 PolarHBondContact O-N 2.78Å; L394-T397 PolarHBondContact O-N 3.22Å; L394-I398 WeakPolarHBondContact O-CG1 3.46Å; L394-I398 PolarHBondContact O-N 2.91Å
395	V	87.4	Confident	84.1	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-60.7	-46.3	177.6	170.7	0	0	0	0	110.6	I375 R391 Q392 T397 I398 H399 L416 E430 V431	I375-V395 HydrophobicContact CD1-CG2 4.12Å; R391-V395 WeakPolarHBondContact O-CG2 3.19Å; R391-V395 PolarHBondContact O-N 2.97Å; Q392-V395 PolarHBondContact O-N 3.42Å; V395-T397 VanDerWaalsContact C-N 3.32Å; V395-T397 PolarHBondContact O-N 2.94Å; V395-I398 PolarHBondContact O-N 3.4Å; V395-H399 WeakPolarHBondContact O-CB 3.47Å; V395-H399 PolarHBondContact O-N 2.84Å; V395-L416 HydrophobicContact CG2-CD2 4.3Å; V395-E430 HydrophobicContact CG1-CB 3.9Å; V395-V431 HydrophobicContact CG1-CG2 3.63Å; V395-V431 HydrophobicContact CG2-CG2 4.11Å
396	K	86.1	Confident	84.9	Confident	102 Å²	102	38.2 Å²	38.2	44%	0.443	19%	0.191	S	C	.	.	H	α-helix	trans	-60	-42.1	177.2	-172	172.8	-176.8	170.7	0	111.6	Q392 V393 H399 S400	Q392-K396 WeakPolarHBondContact O-CB 3.25Å; Q392-K396 PolarHBondContact O-N 3.22Å; V393-K396 PolarHBondContact O-N 2.89Å; K396-H399 WeakPolarHBondContact O-CB 3.4Å; K396-H399 PolarHBondContact O-N 3.41Å; K396-S400 PolarHBondContact O-N 3.08Å; K396-S400 PolarHBondContact O-OG 3.2Å; K396-S400 VanDerWaalsContact O-OG 3.08Å
397	T	89.3	Confident	85.4	Confident	9 Å²	9	39.9 Å²	39.9	6%	0.055	20%	0.196	C	C	.	.	H	α-helix	trans	-64.8	-45.2	177.1	-52.8	0	0	0	0	111.2	L352 L371 V393 L394 V395 H399 S400 I401	L352-T397 HydrophobicContact CB-CG2 4.37Å; L352-T397 HydrophobicContact CD2-CG2 4.3Å; L371-T397 HydrophobicContact CD1-CG2 4.32Å; V393-T397 WeakPolarHBondContact O-CB 3.42Å; V393-T397 PolarHBondContact O-N 3.34Å; V393-T397 PolarHBondContact O-OG1 3.17Å; L394-T397 PolarHBondContact O-N 3.22Å; V395-T397 VanDerWaalsContact C-N 3.32Å; V395-T397 PolarHBondContact O-N 2.94Å; T397-H399 VanDerWaalsContact C-N 3.34Å; T397-H399 PolarHBondContact O-N 2.99Å; T397-S400 PolarHBondContact O-N 3.05Å; T397-I401 HydrophobicContact CG2-CD1 4.01Å; T397-I401 VanDerWaalsContact O-CG1 3.27Å; T397-I401 WeakPolarHBondContact O-CG1 3.35Å; T397-I401 PolarHBondContact O-N 2.84Å
398	I	89.3	Confident	85.7	Confident	1 Å²	1	39 Å²	39	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-61.7	-42.4	175.8	-71.1	-178.8	0	0	0	111.2	I368 L371 I375 L394 V395 I401 A402 V412 L416	I368-I398 HydrophobicContact CD1-CB 4.47Å; I368-I398 HydrophobicContact CD1-CG1 4.22Å; I368-I398 HydrophobicContact CD1-CG2 4.13Å; L371-I398 HydrophobicContact CB-CD1 3.78Å; L371-I398 HydrophobicContact CB-CG1 3.84Å; L371-I398 HydrophobicContact CD1-CG1 3.83Å; L371-I398 HydrophobicContact CG-CG1 4.5Å; I375-I398 HydrophobicContact CD1-CD1 3.33Å; I375-I398 HydrophobicContact CG1-CD1 4.42Å; L394-I398 WeakPolarHBondContact O-CG1 3.46Å; L394-I398 PolarHBondContact O-N 2.91Å; V395-I398 PolarHBondContact O-N 3.4Å; I398-I401 PolarHBondContact O-N 3.08Å; I398-A402 VanDerWaalsContact O-CB 3.29Å; I398-A402 WeakPolarHBondContact O-CB 3.41Å; I398-A402 PolarHBondContact O-N 3.13Å; I398-V412 HydrophobicContact CG2-CB 4.43Å; I398-V412 HydrophobicContact CG2-CG1 3.31Å; I398-V412 HydrophobicContact CG2-CG2 4.21Å; I398-L416 HydrophobicContact CG2-CD1 4.16Å
399	H	85.3	Confident	85.9	Confident	24 Å²	24	37.5 Å²	37.5	11%	0.111	18%	0.183	C	C	.	.	H	α-helix	trans	-55.2	-56.7	173.9	178.1	161.2	0	0	0	109.6	V395 K396 T397 I401 A402 V403 F434 E437	V395-H399 WeakPolarHBondContact O-CB 3.47Å; V395-H399 PolarHBondContact O-N 2.84Å; K396-H399 WeakPolarHBondContact O-CB 3.4Å; K396-H399 PolarHBondContact O-N 3.41Å; T397-H399 VanDerWaalsContact C-N 3.34Å; T397-H399 PolarHBondContact O-N 2.99Å; H399-I401 VanDerWaalsContact C-N 3.26Å; H399-I401 PolarHBondContact O-N 3.18Å; H399-A402 PolarHBondContact O-N 2.91Å; H399-A402 VanDerWaalsContact O-N 3.11Å; H399-V403 VanDerWaalsContact CD2-CG2 3.42Å; H399-V403 WeakPolarHBondContact CD2-CG2 3.04Å; H399-V403 WeakPolarHBondContact O-CG2 3.41Å; H399-V403 PolarHBondContact O-N 2.77Å; H399-F434 HydrophobicContact CB-CB 4.22Å; H399-F434 HydrophobicContact CB-CD2 3.91Å; H399-F434 HydrophobicContact CB-CG 4.23Å; H399-F434 AromaticContact CD2-CD2 3.61Å; H399-F434 AromaticContact CG-CD2 3.58Å; H399-F434 WeakPolarHBondContact ND1-CB 3.26Å; H399-E437 IonicContact CD2-OE2 3.18Å; H399-E437 IonicContact CE1-OE2 3.21Å; H399-E437 IonicContact NE2-OE2 3.09Å; H399-E437 PolarHBondContact NE2-OE2 2.91Å
400	S	85.7	Confident	86	Confident	43 Å²	43	34.3 Å²	34.3	30%	0.301	18%	0.179	S	C	.	.	H	α-helix	trans	-58.7	-37.5	-178.2	-57.1	0	0	0	0	112.6	Y356 K396 T397 R404	Y356-S400 VanDerWaalsContact CE2-CB 3.43Å; K396-S400 PolarHBondContact O-N 3.08Å; K396-S400 PolarHBondContact O-OG 3.2Å; K396-S400 VanDerWaalsContact O-OG 3.08Å; T397-S400 PolarHBondContact O-N 3.05Å; S400-R404 PolarHBondContact O-N 3.07Å
401	I	88.8	Confident	85.8	Confident	1 Å²	1	37 Å²	37	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-67.1	-47.7	174.9	-66.6	168.7	0	0	0	111	Y356 V359 V364 V367 I368 L371 T397 I398 H399 V403 R404 F405	Y356-I401 HydrophobicContact CD2-CG1 3.9Å; Y356-I401 HydrophobicContact CE2-CG1 4.47Å; V359-I401 HydrophobicContact CG1-CG2 4.11Å; V359-I401 HydrophobicContact CG2-CD1 3.9Å; V359-I401 HydrophobicContact CG2-CG1 4.15Å; V364-I401 HydrophobicContact CG2-CG2 3.69Å; V367-I401 HydrophobicContact CG1-CD1 4.19Å; I368-I401 HydrophobicContact CD1-CB 4.11Å; I368-I401 HydrophobicContact CD1-CD1 4.31Å; I368-I401 HydrophobicContact CD1-CG2 3.75Å; I368-I401 HydrophobicContact CG1-CG2 4.02Å; L371-I401 HydrophobicContact CD1-CD1 3.86Å; T397-I401 HydrophobicContact CG2-CD1 4.01Å; T397-I401 VanDerWaalsContact O-CG1 3.27Å; T397-I401 WeakPolarHBondContact O-CG1 3.35Å; T397-I401 PolarHBondContact O-N 2.84Å; I398-I401 PolarHBondContact O-N 3.08Å; H399-I401 VanDerWaalsContact C-N 3.26Å; H399-I401 PolarHBondContact O-N 3.18Å; I401-V403 VanDerWaalsContact C-N 3.31Å; I401-V403 PolarHBondContact O-N 2.85Å; I401-R404 PolarHBondContact O-N 3.37Å; I401-R404 VanDerWaalsContact O-N 3.12Å; I401-F405 HydrophobicContact CG2-CD2 4.2Å; I401-F405 PolarHBondContact O-N 3.3Å
402	A	85.8	Confident	85.9	Confident	2 Å²	2	36.9 Å²	36.9	2%	0.017	20%	0.197	C	C	.	.	H	α-helix	trans	-67.2	-30.2	-177.3	0	0	0	0	0	113	I398 H399 F405 F434	I398-A402 VanDerWaalsContact O-CB 3.29Å; I398-A402 WeakPolarHBondContact O-CB 3.41Å; I398-A402 PolarHBondContact O-N 3.13Å; H399-A402 PolarHBondContact O-N 2.91Å; H399-A402 VanDerWaalsContact O-N 3.11Å; A402-F405 CarbonylContact O-C 3.58Å; A402-F434 HydrophobicContact CB-CE2 3.58Å; A402-F434 HydrophobicContact CB-CZ 3.64Å
403	V	82.5	Confident	85.9	Confident	51 Å²	51	34.5 Å²	34.5	31%	0.309	19%	0.186	S	C	.	.	H	α-helix	trans	-69.4	-37.8	171.8	169	0	0	0	0	111.2	H399 I401	H399-V403 VanDerWaalsContact CD2-CG2 3.42Å; H399-V403 WeakPolarHBondContact CD2-CG2 3.04Å; H399-V403 WeakPolarHBondContact O-CG2 3.41Å; H399-V403 PolarHBondContact O-N 2.77Å; I401-V403 VanDerWaalsContact C-N 3.31Å; I401-V403 PolarHBondContact O-N 2.85Å
404	R	83.3	Confident	85.8	Confident	125 Å²	125	35.4 Å²	35.4	47%	0.472	19%	0.193	S	C	.	.	H	α-helix	trans	-74	-34.1	176.8	-171.1	175.5	177.5	-165.4	-1.6	112.8	S400 I401	S400-R404 PolarHBondContact O-N 3.07Å; I401-R404 PolarHBondContact O-N 3.37Å; I401-R404 VanDerWaalsContact O-N 3.12Å
405	F	87.5	Confident	85.5	Confident	21 Å²	21	36.4 Å²	36.4	9%	0.092	20%	0.201	C	C	.	.			trans	-126.5	82.8	-178.6	-57.9	-79.5	0	0	0	111.2	V359 P361 V364 I401 A402 E407 V408	V359-F405 HydrophobicContact CB-CE2 4.13Å; V359-F405 HydrophobicContact CG1-CD2 3.83Å; V359-F405 HydrophobicContact CG1-CE2 3.41Å; V359-F405 VanDerWaalsContact CG1-CE2 3.41Å; V359-F405 HydrophobicContact CG1-CZ 4.15Å; P361-F405 HydrophobicContact CG-CD1 4.4Å; P361-F405 HydrophobicContact CG-CE1 3.84Å; V364-F405 HydrophobicContact CG2-CB 3.96Å; V364-F405 HydrophobicContact CG2-CD2 3.93Å; V364-F405 HydrophobicContact CG2-CG 4.01Å; I401-F405 HydrophobicContact CG2-CD2 4.2Å; I401-F405 PolarHBondContact O-N 3.3Å; A402-F405 CarbonylContact O-C 3.58Å; F405-E407 PolarHBondContact O-N 3.15Å; F405-E407 VanDerWaalsContact O-N 3.08Å; F405-V408 HydrophobicContact CB-CG2 4.49Å; F405-V408 PolarHBondContact O-N 3.45Å
406	P	83.2	Confident	85.4	Confident	71 Å²	71	36.6 Å²	36.6	46%	0.461	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-59.5	-23.1	-174.7	-27.6	36.5	0	0	0	115.1	V408 A409 I442	P406-V408 PolarHBondContact O-N 3.48Å; P406-A409 WeakPolarHBondContact O-CB 3.27Å; P406-A409 PolarHBondContact O-N 3.43Å; P406-I442 HydrophobicContact CB-CD1 3.76Å; P406-I442 HydrophobicContact CB-CG1 4.28Å
407	E	85.2	Confident	85.4	Confident	132 Å²	132	31.9 Å²	31.9	62%	0.617	18%	0.181	S	C	*	.	G	3₁₀ helix	trans	-59.5	-30.9	179.5	61.9	-157.1	166.8	0	0	113.3	F405	F405-E407 PolarHBondContact O-N 3.15Å; F405-E407 VanDerWaalsContact O-N 3.08Å
408	V	85.8	Confident	85	Confident	7 Å²	7	38.9 Å²	38.9	4%	0.042	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-87	-16.3	-177.1	-162.2	0	0	0	0	112.5	V364 I368 F405 P406 G410 T411 V412	V364-V408 HydrophobicContact CB-CG2 4.28Å; V364-V408 HydrophobicContact CG1-CG2 3.72Å; V364-V408 HydrophobicContact CG2-CG2 3.63Å; I368-V408 HydrophobicContact CB-CG1 3.95Å; I368-V408 HydrophobicContact CG1-CG1 3.87Å; I368-V408 HydrophobicContact CG2-CG1 3.8Å; F405-V408 HydrophobicContact CB-CG2 4.49Å; F405-V408 PolarHBondContact O-N 3.45Å; P406-V408 PolarHBondContact O-N 3.48Å; V408-G410 PolarHBondContact O-N 3.37Å; V408-G410 VanDerWaalsContact O-N 3.07Å; V408-T411 PolarHBondContact O-N 3.45Å; V408-T411 PolarHBondContact O-OG1 2.95Å; V408-V412 HydrophobicContact CG1-CG2 4.21Å; V408-V412 PolarHBondContact O-N 3.25Å
409	A	83.5	Confident	84.6	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-58.2	-29	-174.2	0	0	0	0	0	113.2	P406 T411 V412 V413 I442 L445	P406-A409 WeakPolarHBondContact O-CB 3.27Å; P406-A409 PolarHBondContact O-N 3.43Å; A409-T411 VanDerWaalsContact C-N 3.28Å; A409-T411 PolarHBondContact O-N 3.24Å; A409-V412 PolarHBondContact O-N 2.97Å; A409-V413 WeakPolarHBondContact O-CG2 3.34Å; A409-V413 PolarHBondContact O-N 3.34Å; A409-I442 HydrophobicContact CB-CD1 3.55Å; A409-L445 HydrophobicContact CB-CD1 3.46Å; A409-L445 VanDerWaalsContact CB-CD1 3.46Å
410	G	83.5	Confident	84.4	Confident	35 Å²	35	38.8 Å²	38.8	36%	0.361	21%	0.214	S	C	.	.	H	α-helix	trans	-62.6	-29.9	175.4	0	0	0	0	0	114.9	V408 P414 L445	V408-G410 PolarHBondContact O-N 3.37Å; V408-G410 VanDerWaalsContact O-N 3.07Å; G410-P414 VanDerWaalsContact O-CD 3.27Å; G410-P414 WeakPolarHBondContact O-CD 3.32Å; G410-L445 VanDerWaalsContact CA-CD2 3.41Å
411	T	83.2	Confident	83.9	Confident	71 Å²	71	37.8 Å²	37.8	44%	0.436	21%	0.21	S	C	.	.	H	α-helix	trans	-88.4	-26.7	176.7	67.9	0	0	0	0	112.7	V408 A409	V408-T411 PolarHBondContact O-N 3.45Å; V408-T411 PolarHBondContact O-OG1 2.95Å; A409-T411 VanDerWaalsContact C-N 3.28Å; A409-T411 PolarHBondContact O-N 3.24Å
412	V	85.7	Confident	83	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-79.5	-47.2	-175.6	172	0	0	0	0	111.6	I368 I398 V408 A409 A415 L416 F434	I368-V412 HydrophobicContact CD1-CG2 4.27Å; I368-V412 HydrophobicContact CG2-CG2 3.54Å; I398-V412 HydrophobicContact CG2-CB 4.43Å; I398-V412 HydrophobicContact CG2-CG1 3.31Å; I398-V412 HydrophobicContact CG2-CG2 4.21Å; V408-V412 HydrophobicContact CG1-CG2 4.21Å; V408-V412 PolarHBondContact O-N 3.25Å; A409-V412 PolarHBondContact O-N 2.97Å; V412-A415 PolarHBondContact O-N 3Å; V412-A415 VanDerWaalsContact O-N 3.14Å; V412-L416 HydrophobicContact CG1-CD1 3.54Å; V412-L416 HydrophobicContact CG1-CG 3.91Å; V412-L416 PolarHBondContact O-N 3.42Å; V412-F434 HydrophobicContact CG1-CE1 3.82Å; V412-F434 HydrophobicContact CG1-CZ 4.01Å
413	V	86	Confident	81.8	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.012	24%	0.24	C	C	.	.	H	α-helix	trans	-56.3	-49.7	-172.7	168	0	0	0	0	112.7	A409 A415 L416 I417 F434 A438 L445 A449	A409-V413 WeakPolarHBondContact O-CG2 3.34Å; A409-V413 PolarHBondContact O-N 3.34Å; V413-A415 VanDerWaalsContact C-N 3.31Å; V413-A415 PolarHBondContact O-N 3.47Å; V413-L416 PolarHBondContact O-N 2.95Å; V413-I417 HydrophobicContact CG1-CD1 3.64Å; V413-I417 HydrophobicContact CG1-CG1 4.38Å; V413-I417 VanDerWaalsContact O-CG1 3.28Å; V413-I417 WeakPolarHBondContact O-CG1 3.18Å; V413-I417 PolarHBondContact O-N 3.06Å; V413-F434 HydrophobicContact CG2-CE1 3.73Å; V413-F434 HydrophobicContact CG2-CZ 4.14Å; V413-A438 HydrophobicContact CG2-CB 4.34Å; V413-L445 HydrophobicContact CG2-CD1 4.26Å; V413-A449 HydrophobicContact CG1-CB 4.03Å
414	P	84.6	Confident	81.1	Confident	44 Å²	44	41.9 Å²	41.9	29%	0.286	23%	0.234	S	C	.	.	H	α-helix	trans	-60.6	-40.4	178.2	-23.2	34.5	0	0	0	112.9	G410 I417 E418 T448	G410-P414 VanDerWaalsContact O-CD 3.27Å; G410-P414 WeakPolarHBondContact O-CD 3.32Å; P414-I417 PolarHBondContact O-N 3.3Å; P414-E418 PolarHBondContact O-N 2.74Å; P414-T448 HydrophobicContact CG-CG2 4.22Å
415	A	83.2	Confident	80.5	Confident	21 Å²	21	39.4 Å²	39.4	17%	0.174	23%	0.228	C	C	.	.	H	α-helix	trans	-67.7	-36.4	-178.9	0	0	0	0	0	112.4	V412 V413	V412-A415 PolarHBondContact O-N 3Å; V412-A415 VanDerWaalsContact O-N 3.14Å; V413-A415 VanDerWaalsContact C-N 3.31Å; V413-A415 PolarHBondContact O-N 3.47Å
416	L	85.9	Confident	79.9	Confident	5 Å²	5	42.2 Å²	42.2	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-74	-36.4	175.7	-66.8	-177.9	0	0	0	112.1	I375 V395 I398 V412 V413 E418 L419 V431 F434	I375-L416 HydrophobicContact CD1-CD2 4.14Å; V395-L416 HydrophobicContact CG2-CD2 4.3Å; I398-L416 HydrophobicContact CG2-CD1 4.16Å; V412-L416 HydrophobicContact CG1-CD1 3.54Å; V412-L416 HydrophobicContact CG1-CG 3.91Å; V412-L416 PolarHBondContact O-N 3.42Å; V413-L416 PolarHBondContact O-N 2.95Å; L416-E418 PolarHBondContact O-N 3.35Å; L416-L419 HydrophobicContact CD2-CD1 3.76Å; L416-L419 VanDerWaalsContact O-CB 3.3Å; L416-L419 WeakPolarHBondContact O-CB 3.21Å; L416-L419 PolarHBondContact O-N 2.99Å; L416-V431 HydrophobicContact CB-CG1 3.8Å; L416-V431 HydrophobicContact CB-CG2 4.13Å; L416-V431 HydrophobicContact CD2-CG2 4.32Å; L416-F434 HydrophobicContact CD1-CD1 3.46Å; L416-F434 VanDerWaalsContact CD1-CD1 3.46Å; L416-F434 HydrophobicContact CD1-CE1 3.64Å; L416-F434 HydrophobicContact CD1-CG 4.38Å
417	I	85.8	Confident	79.7	Confident	2 Å²	2	39 Å²	39	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-60.4	-36.1	176.9	-71.3	168.7	0	0	0	111.4	V413 P414 L419 L420 I435 N452 V456	V413-I417 HydrophobicContact CG1-CD1 3.64Å; V413-I417 HydrophobicContact CG1-CG1 4.38Å; V413-I417 VanDerWaalsContact O-CG1 3.28Å; V413-I417 WeakPolarHBondContact O-CG1 3.18Å; V413-I417 PolarHBondContact O-N 3.06Å; P414-I417 PolarHBondContact O-N 3.3Å; I417-L419 PolarHBondContact O-N 2.99Å; I417-L420 HydrophobicContact CG2-CD1 4.42Å; I417-L420 WeakPolarHBondContact O-CB 3.26Å; I417-L420 PolarHBondContact O-N 3.31Å; I417-I435 HydrophobicContact CD1-CD1 4.17Å; I417-I435 HydrophobicContact CG1-CD1 3.43Å; I417-I435 VanDerWaalsContact CG1-CD1 3.43Å; I417-I435 HydrophobicContact CG1-CG1 4.26Å; I417-N452 HydrophobicContact CB-CB 4.41Å; I417-N452 HydrophobicContact CD1-CB 3.72Å; I417-N452 HydrophobicContact CG2-CB 3.9Å; I417-V456 HydrophobicContact CG2-CB 4.19Å; I417-V456 HydrophobicContact CG2-CG2 3.76Å
418	E	82	Confident	79.6	Confident	157 Å²	157	32.8 Å²	32.8	73%	0.734	19%	0.194	S	C	*	.	H	α-helix	trans	-58.1	-28.8	176.2	-166.1	175.7	179.8	0	0	112.7	P414 L416 L420	P414-E418 PolarHBondContact O-N 2.74Å; L416-E418 PolarHBondContact O-N 3.35Å; E418-L420 VanDerWaalsContact C-N 3.29Å; E418-L420 PolarHBondContact O-N 3.11Å
419	L	79.9	Confident	79.5	Confident	21 Å²	21	34 Å²	34	11%	0.11	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-74.9	-16.3	179.3	-53.8	167.4	0	0	0	113.5	I375 V379 L416 I417 G421 D422	I375-L419 HydrophobicContact CG2-CD1 3.49Å; I375-L419 VanDerWaalsContact CG2-CD1 3.49Å; I375-L419 HydrophobicContact CG2-CD2 3.64Å; I375-L419 HydrophobicContact CG2-CG 4.19Å; V379-L419 HydrophobicContact CG2-CD2 3.83Å; L416-L419 HydrophobicContact CD2-CD1 3.76Å; L416-L419 VanDerWaalsContact O-CB 3.3Å; L416-L419 WeakPolarHBondContact O-CB 3.21Å; L416-L419 PolarHBondContact O-N 2.99Å; I417-L419 PolarHBondContact O-N 2.99Å; L419-G421 PolarHBondContact O-N 3.42Å; L419-D422 WeakPolarHBondContact O-CB 3.23Å; L419-D422 PolarHBondContact O-N 2.82Å
420	L	81.6	Confident	79.5	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.01	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-71.4	-16.9	-177.9	-63.6	176.1	0	0	0	113.5	I417 E418 A428 V431 L432 I435 L453 V456	I417-L420 HydrophobicContact CG2-CD1 4.42Å; I417-L420 WeakPolarHBondContact O-CB 3.26Å; I417-L420 PolarHBondContact O-N 3.31Å; E418-L420 VanDerWaalsContact C-N 3.29Å; E418-L420 PolarHBondContact O-N 3.11Å; L420-A428 HydrophobicContact CD2-CB 3.89Å; L420-A428 WeakPolarHBondContact CD2-O 3.42Å; L420-V431 HydrophobicContact CD1-CG1 4.24Å; L420-V431 HydrophobicContact CD2-CB 3.91Å; L420-V431 HydrophobicContact CD2-CG1 3.68Å; L420-V431 HydrophobicContact CG-CG1 3.94Å; L420-L432 HydrophobicContact CD1-CD2 3.68Å; L420-L432 HydrophobicContact CD1-CG 4.16Å; L420-L432 HydrophobicContact CD2-CD1 4.09Å; L420-L432 HydrophobicContact CD2-CD2 4.26Å; L420-L432 HydrophobicContact CD2-CG 3.79Å; L420-I435 HydrophobicContact CD1-CD1 4.13Å; L420-L453 HydrophobicContact CD1-CD1 3.76Å; L420-V456 HydrophobicContact CB-CG1 3.93Å
421	G	74.5	Confident	79.7	Confident	22 Å²	22	34.2 Å²	34.2	23%	0.227	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-75.7	-11.9	174.4	0	0	0	0	0	113.9	L419	L419-G421 PolarHBondContact O-N 3.42Å
422	D	71.1	Confident	80	Confident	51 Å²	51	30.8 Å²	30.8	27%	0.273	17%	0.17	S	C	.	.	S	Bend	trans	-75.1	152.8	177.7	-163.1	4.3	0	0	0	111.3	R391 L419 K424	R391-D422 IonicContact NH1-OD2 3.31Å; L419-D422 WeakPolarHBondContact O-CB 3.23Å; L419-D422 PolarHBondContact O-N 2.82Å; D422-K424 PolarHBondContact O-N 2.85Å
423	A	59.2	Low	80	Confident	45 Å²	45	32.3 Å²	32.3	37%	0.372	18%	0.18	S	C	.	.	S	Bend	trans	-73.5	-8.6	-177.1	0	0	0	0	0	113.6	N462	A423-N462 VanDerWaalsContact C-ND2 3.34Å; A423-N462 PolarHBondContact O-ND2 2.81Å; A423-N462 PolarHBondContact O-OD1 3.14Å
424	K	69.3	Low	80	Confident	43 Å²	43	32.3 Å²	32.3	19%	0.187	18%	0.179	C	C	.	.			trans	-87.3	116.4	-170.2	-63	-179	-177.2	-176.5	0	112.6	T381 R391 D422	T381-K424 PolarHBondContact O-NZ 3.22Å; R391-K424 PolarHBondContact NH2-O 2.89Å; D422-K424 PolarHBondContact O-N 2.85Å
425	E	70.2	Confident	80.2	Confident	73 Å²	73	30.2 Å²	30.2	34%	0.341	17%	0.166	S	C	.	.	H	α-helix	trans	-72.4	-44.9	-165	-174	172	-175.5	0	0	115	A428 I429 N462 N464	E425-A428 PolarHBondContact O-N 2.93Å; E425-I429 HydrophobicContact CG-CD1 3.94Å; E425-I429 PolarHBondContact O-N 2.7Å; E425-N462 VanDerWaalsContact CA-ND2 3.3Å; E425-N462 WeakPolarHBondContact CA-ND2 3.39Å; E425-N462 HydrophobicContact CB-CB 4.46Å; E425-N462 HydrophobicContact CG-CB 4.3Å; E425-N462 PolarHBondContact N-ND2 2.92Å; E425-N464 WeakPolarHBondContact OE1-CB 3.25Å; E425-N464 PolarHBondContact OE1-ND2 3Å
426	I	75.5	Confident	80.5	Confident	81 Å²	81	31.7 Å²	31.7	42%	0.415	17%	0.167	S	C	.	.	H	α-helix	trans	-65.7	-52	-165	-58.9	172.3	0	0	0	111.3	Q392 A428 I429 E430	Q392-I426 VanDerWaalsContact CD-CG2 3.4Å; Q392-I426 HydrophobicContact CG-CG2 4.04Å; I426-A428 VanDerWaalsContact C-N 3.26Å; I426-A428 PolarHBondContact O-N 3.22Å; I426-I429 PolarHBondContact O-N 3.31Å; I426-E430 PolarHBondContact O-N 2.98Å
427	A	77.9	Confident	80.6	Confident	3 Å²	3	32.6 Å²	32.6	3%	0.025	17%	0.171	C	C	.	.	H	α-helix	trans	-69.4	-25.2	179.9	0	0	0	0	0	112.6	R391 E430 V431	R391-A427 HydrophobicContact CG-CB 4.29Å; R391-A427 VanDerWaalsContact CZ-CB 3.44Å; A427-E430 PolarHBondContact O-N 3.06Å; A427-V431 WeakPolarHBondContact O-CG2 3.49Å; A427-V431 PolarHBondContact O-N 3.26Å
428	A	83.2	Confident	80.6	Confident	2 Å²	2	32.9 Å²	32.9	2%	0.017	17%	0.173	C	C	.	.	H	α-helix	trans	-68.8	-36	177.7	0	0	0	0	0	111.7	L420 E425 I426 L432 S465	L420-A428 HydrophobicContact CD2-CB 3.89Å; L420-A428 WeakPolarHBondContact CD2-O 3.42Å; E425-A428 PolarHBondContact O-N 2.93Å; I426-A428 VanDerWaalsContact C-N 3.26Å; I426-A428 PolarHBondContact O-N 3.22Å; A428-L432 WeakPolarHBondContact O-CD1 3.12Å; A428-L432 VanDerWaalsContact O-CG 3.32Å; A428-L432 WeakPolarHBondContact O-CG 3.3Å; A428-L432 PolarHBondContact O-N 3.29Å; A428-L432 VanDerWaalsContact O-N 3.11Å; A428-S465 WeakPolarHBondContact CB-OG 3.43Å
429	I	84.5	Confident	80.8	Confident	33 Å²	33	25.4 Å²	25.4	17%	0.169	14%	0.139	C	C	.	.	H	α-helix	trans	-64.3	-48.1	174.1	-65.5	169.7	0	0	0	110.1	E425 I426 V431 L432 V433 N464 F468	E425-I429 HydrophobicContact CG-CD1 3.94Å; E425-I429 PolarHBondContact O-N 2.7Å; I426-I429 PolarHBondContact O-N 3.31Å; I429-V431 VanDerWaalsContact C-N 3.32Å; I429-V431 PolarHBondContact O-N 2.93Å; I429-L432 PolarHBondContact O-N 3.31Å; I429-V433 HydrophobicContact CG2-CG2 4.31Å; I429-V433 WeakPolarHBondContact O-CG2 3.38Å; I429-V433 PolarHBondContact O-N 2.92Å; I429-N464 HydrophobicContact CD1-CB 4.1Å; I429-F468 HydrophobicContact CG2-CD2 4.43Å; I429-F468 HydrophobicContact CG2-CE2 3.99Å; I429-F468 HydrophobicContact CG2-CZ 4.27Å
430	E	82.6	Confident	81.2	Confident	38 Å²	38	27.2 Å²	27.2	18%	0.178	15%	0.146	C	C	.	.	H	α-helix	trans	-56.4	-44.5	176.9	-66.9	-77.3	-169.4	0	0	112	Q392 V395 I426 A427 L432 V433 F434	Q392-E430 HydrophobicContact CG-CG 4.04Å; Q392-E430 PolarHBondContact NE2-OE1 3.44Å; V395-E430 HydrophobicContact CG1-CB 3.9Å; I426-E430 PolarHBondContact O-N 2.98Å; A427-E430 PolarHBondContact O-N 3.06Å; E430-L432 VanDerWaalsContact C-N 3.3Å; E430-L432 PolarHBondContact O-N 3.07Å; E430-V433 PolarHBondContact O-N 3.45Å; E430-F434 PolarHBondContact O-N 3.24Å
431	V	87	Confident	81.2	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.006	16%	0.163	C	C	.	.	H	α-helix	trans	-58.3	-42.7	174.3	167.3	0	0	0	0	111.4	V395 L416 L420 A427 I429 F434 I435	V395-V431 HydrophobicContact CG1-CG2 3.63Å; V395-V431 HydrophobicContact CG2-CG2 4.11Å; L416-V431 HydrophobicContact CB-CG1 3.8Å; L416-V431 HydrophobicContact CB-CG2 4.13Å; L416-V431 HydrophobicContact CD2-CG2 4.32Å; L420-V431 HydrophobicContact CD1-CG1 4.24Å; L420-V431 HydrophobicContact CD2-CB 3.91Å; L420-V431 HydrophobicContact CD2-CG1 3.68Å; L420-V431 HydrophobicContact CG-CG1 3.94Å; A427-V431 WeakPolarHBondContact O-CG2 3.49Å; A427-V431 PolarHBondContact O-N 3.26Å; I429-V431 VanDerWaalsContact C-N 3.32Å; I429-V431 PolarHBondContact O-N 2.93Å; V431-F434 WeakPolarHBondContact O-CB 3.4Å; V431-F434 PolarHBondContact O-N 2.86Å; V431-I435 HydrophobicContact CG1-CD1 3.6Å; V431-I435 HydrophobicContact CG1-CG1 4.33Å; V431-I435 WeakPolarHBondContact O-CD1 3.11Å; V431-I435 WeakPolarHBondContact O-CG1 3.03Å; V431-I435 PolarHBondContact O-N 3.39Å
432	L	89.7	Confident	81.7	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-72.4	-35.4	-178.9	-71.2	163.3	0	0	0	112.6	L420 A428 I429 E430 F434 I435 R436 L453 M460 S465 F468 A469 I472	L420-L432 HydrophobicContact CD1-CD2 3.68Å; L420-L432 HydrophobicContact CD1-CG 4.16Å; L420-L432 HydrophobicContact CD2-CD1 4.09Å; L420-L432 HydrophobicContact CD2-CD2 4.26Å; L420-L432 HydrophobicContact CD2-CG 3.79Å; A428-L432 WeakPolarHBondContact O-CD1 3.12Å; A428-L432 VanDerWaalsContact O-CG 3.32Å; A428-L432 WeakPolarHBondContact O-CG 3.3Å; A428-L432 PolarHBondContact O-N 3.29Å; A428-L432 VanDerWaalsContact O-N 3.11Å; I429-L432 PolarHBondContact O-N 3.31Å; E430-L432 VanDerWaalsContact C-N 3.3Å; E430-L432 PolarHBondContact O-N 3.07Å; L432-F434 VanDerWaalsContact C-N 3.33Å; L432-I435 HydrophobicContact CD2-CD1 4.37Å; L432-I435 PolarHBondContact O-N 3.48Å; L432-R436 WeakPolarHBondContact O-CB 3Å; L432-R436 PolarHBondContact O-N 2.83Å; L432-L453 HydrophobicContact CD2-CD1 4.19Å; L432-M460 HydrophobicContact CD1-CE 4.09Å; L432-S465 WeakPolarHBondContact CD1-O 3.31Å; L432-F468 HydrophobicContact CB-CB 3.87Å; L432-F468 HydrophobicContact CD1-CB 3.71Å; L432-F468 HydrophobicContact CG-CB 4.3Å; L432-A469 HydrophobicContact CD2-CB 3.97Å; L432-I472 HydrophobicContact CB-CD1 4.47Å; L432-I472 HydrophobicContact CD2-CD1 3.98Å
433	V	86.3	Confident	82.4	Confident	33 Å²	33	31.5 Å²	31.5	20%	0.2	17%	0.171	C	C	.	.	H	α-helix	trans	-61.8	-44.2	171.7	174.2	0	0	0	0	110	I429 E430 R436 E437 F468	I429-V433 HydrophobicContact CG2-CG2 4.31Å; I429-V433 WeakPolarHBondContact O-CG2 3.38Å; I429-V433 PolarHBondContact O-N 2.92Å; E430-V433 PolarHBondContact O-N 3.45Å; V433-R436 WeakPolarHBondContact O-CB 3.47Å; V433-R436 PolarHBondContact O-N 3.43Å; V433-E437 PolarHBondContact O-N 3.03Å; V433-E437 VanDerWaalsContact O-N 3.09Å; V433-F468 HydrophobicContact CG2-CE1 4.37Å
434	F	86.4	Confident	83.7	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.009	19%	0.188	C	C	.	.	H	α-helix	trans	-59.2	-50.4	172.9	170.4	-113	0	0	0	112.2	H399 A402 V412 V413 L416 E430 V431 L432 R436 E437 A438	H399-F434 HydrophobicContact CB-CB 4.22Å; H399-F434 HydrophobicContact CB-CD2 3.91Å; H399-F434 HydrophobicContact CB-CG 4.23Å; H399-F434 AromaticContact CD2-CD2 3.61Å; H399-F434 AromaticContact CG-CD2 3.58Å; H399-F434 WeakPolarHBondContact ND1-CB 3.26Å; A402-F434 HydrophobicContact CB-CE2 3.58Å; A402-F434 HydrophobicContact CB-CZ 3.64Å; V412-F434 HydrophobicContact CG1-CE1 3.82Å; V412-F434 HydrophobicContact CG1-CZ 4.01Å; V413-F434 HydrophobicContact CG2-CE1 3.73Å; V413-F434 HydrophobicContact CG2-CZ 4.14Å; L416-F434 HydrophobicContact CD1-CD1 3.46Å; L416-F434 VanDerWaalsContact CD1-CD1 3.46Å; L416-F434 HydrophobicContact CD1-CE1 3.64Å; L416-F434 HydrophobicContact CD1-CG 4.38Å; E430-F434 PolarHBondContact O-N 3.24Å; V431-F434 WeakPolarHBondContact O-CB 3.4Å; V431-F434 PolarHBondContact O-N 2.86Å; L432-F434 VanDerWaalsContact C-N 3.33Å; F434-R436 VanDerWaalsContact C-N 3.28Å; F434-R436 PolarHBondContact O-N 3.47Å; F434-E437 PolarHBondContact O-N 3.4Å; F434-A438 HydrophobicContact CE2-CB 4.19Å; F434-A438 HydrophobicContact CZ-CB 4.16Å; F434-A438 VanDerWaalsContact O-CB 3.31Å; F434-A438 WeakPolarHBondContact O-CB 3.4Å; F434-A438 PolarHBondContact O-N 2.99Å
435	I	88.8	Confident	84.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.1	-42.2	-179.9	-66.6	159.9	0	0	0	110.2	I417 L420 V431 L432 E437 A438 V439 A449 I472	I417-I435 HydrophobicContact CD1-CD1 4.17Å; I417-I435 HydrophobicContact CG1-CD1 3.43Å; I417-I435 VanDerWaalsContact CG1-CD1 3.43Å; I417-I435 HydrophobicContact CG1-CG1 4.26Å; L420-I435 HydrophobicContact CD1-CD1 4.13Å; V431-I435 HydrophobicContact CG1-CD1 3.6Å; V431-I435 HydrophobicContact CG1-CG1 4.33Å; V431-I435 WeakPolarHBondContact O-CD1 3.11Å; V431-I435 WeakPolarHBondContact O-CG1 3.03Å; V431-I435 PolarHBondContact O-N 3.39Å; L432-I435 HydrophobicContact CD2-CD1 4.37Å; L432-I435 PolarHBondContact O-N 3.48Å; I435-E437 VanDerWaalsContact C-N 3.34Å; I435-E437 PolarHBondContact O-N 3.4Å; I435-A438 PolarHBondContact O-N 3.18Å; I435-V439 HydrophobicContact CG2-CG2 3.78Å; I435-V439 VanDerWaalsContact O-CB 3.23Å; I435-V439 WeakPolarHBondContact O-CB 3.43Å; I435-V439 WeakPolarHBondContact O-CG2 3.38Å; I435-V439 PolarHBondContact O-N 3.13Å; I435-A449 HydrophobicContact CG2-CB 4.3Å; I435-I472 HydrophobicContact CB-CD1 4.22Å; I435-I472 HydrophobicContact CG2-CD1 4.04Å; I435-I472 HydrophobicContact CG2-CG2 4.38Å
436	R	89.7	Confident	85.3	Confident	51 Å²	51	32 Å²	32	19%	0.192	18%	0.179	C	C	.	.	H	α-helix	trans	-57.1	-46.9	176.5	-179.7	178.3	69.8	171.3	1.2	111.7	L432 V433 F434 F440 W471 I472 L642	L432-R436 WeakPolarHBondContact O-CB 3Å; L432-R436 PolarHBondContact O-N 2.83Å; V433-R436 WeakPolarHBondContact O-CB 3.47Å; V433-R436 PolarHBondContact O-N 3.43Å; F434-R436 VanDerWaalsContact C-N 3.28Å; F434-R436 PolarHBondContact O-N 3.47Å; R436-F440 WeakPolarHBondContact O-CB 3.29Å; R436-F440 PolarHBondContact O-N 2.85Å; R436-W471 HydrophobicContact CG-CE3 4.24Å; R436-W471 HydrophobicContact CG-CH2 4.37Å; R436-W471 HydrophobicContact CG-CZ3 3.63Å; R436-I472 HydrophobicContact CB-CD1 4.19Å; R436-I472 HydrophobicContact CB-CG1 4.24Å; R436-L642 HydrophobicContact CG-CD1 4.07Å; R436-L642 HydrophobicContact CG-CD2 3.76Å
437	E	87.1	Confident	86	Confident	25 Å²	25	32.1 Å²	32.1	12%	0.117	18%	0.178	C	C	.	.	H	α-helix	trans	-67.8	-42.9	177.7	-178.2	175	-175.6	0	0	112.3	H399 V433 F434 I435 F440 S441 L646	H399-E437 IonicContact CD2-OE2 3.18Å; H399-E437 IonicContact CE1-OE2 3.21Å; H399-E437 IonicContact NE2-OE2 3.09Å; H399-E437 PolarHBondContact NE2-OE2 2.91Å; V433-E437 PolarHBondContact O-N 3.03Å; V433-E437 VanDerWaalsContact O-N 3.09Å; F434-E437 PolarHBondContact O-N 3.4Å; I435-E437 VanDerWaalsContact C-N 3.34Å; I435-E437 PolarHBondContact O-N 3.4Å; E437-F440 PolarHBondContact O-N 3.33Å; E437-S441 VanDerWaalsContact O-CB 3.31Å; E437-S441 WeakPolarHBondContact O-CB 3.45Å; E437-S441 PolarHBondContact O-N 3.05Å; E437-S441 PolarHBondContact O-OG 2.79Å; E437-L646 HydrophobicContact CB-CD2 4.1Å; E437-L646 HydrophobicContact CG-CD1 4.28Å; E437-L646 HydrophobicContact CG-CD2 3.86Å
438	A	85.4	Confident	86.5	Confident	7 Å²	7	34.9 Å²	34.9	6%	0.058	20%	0.195	C	C	.	.	H	α-helix	trans	-65.6	-44.5	-178.5	0	0	0	0	0	111.9	V413 F434 I435 F440 S441 I442	V413-A438 HydrophobicContact CG2-CB 4.34Å; F434-A438 HydrophobicContact CE2-CB 4.19Å; F434-A438 HydrophobicContact CZ-CB 4.16Å; F434-A438 VanDerWaalsContact O-CB 3.31Å; F434-A438 WeakPolarHBondContact O-CB 3.4Å; F434-A438 PolarHBondContact O-N 2.99Å; I435-A438 PolarHBondContact O-N 3.18Å; A438-F440 VanDerWaalsContact C-N 3.29Å; A438-F440 PolarHBondContact O-N 3.46Å; A438-S441 PolarHBondContact O-N 2.81Å; A438-I442 WeakPolarHBondContact O-CA 3.35Å; A438-I442 WeakPolarHBondContact O-CB 3.25Å; A438-I442 PolarHBondContact O-N 3.48Å
439	V	87.7	Confident	86.8	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-67.1	-32.7	178.1	174.2	0	0	0	0	110.8	I435 R446 A449 Y476	I435-V439 HydrophobicContact CG2-CG2 3.78Å; I435-V439 VanDerWaalsContact O-CB 3.23Å; I435-V439 WeakPolarHBondContact O-CB 3.43Å; I435-V439 WeakPolarHBondContact O-CG2 3.38Å; I435-V439 PolarHBondContact O-N 3.13Å; V439-R446 HydrophobicContact CG1-CB 4.19Å; V439-R446 HydrophobicContact CG1-CG 3.69Å; V439-R446 VanDerWaalsContact O-CG 3.3Å; V439-R446 WeakPolarHBondContact O-CG 3.48Å; V439-R446 PolarHBondContact O-NE 2.8Å; V439-A449 HydrophobicContact CG2-CB 3.43Å; V439-A449 VanDerWaalsContact CG2-CB 3.43Å; V439-Y476 HydrophobicContact CB-CD2 4.48Å; V439-Y476 HydrophobicContact CB-CE2 4.26Å; V439-Y476 HydrophobicContact CG1-CD1 3.52Å; V439-Y476 HydrophobicContact CG1-CD2 3.41Å; V439-Y476 VanDerWaalsContact CG1-CD2 3.41Å; V439-Y476 HydrophobicContact CG1-CE1 3.62Å; V439-Y476 HydrophobicContact CG1-CE2 3.51Å; V439-Y476 HydrophobicContact CG1-CG 3.42Å; V439-Y476 VanDerWaalsContact CG1-CG 3.42Å
440	F	86.5	Confident	87.1	Confident	59 Å²	59	33.3 Å²	33.3	26%	0.259	19%	0.187	S	C	.	.	H	α-helix	trans	-67.8	-55.1	171.3	-176.2	-93.5	0	0	0	111.5	R436 E437 A438 R446 Y476 R639 L642 L646	R436-F440 WeakPolarHBondContact O-CB 3.29Å; R436-F440 PolarHBondContact O-N 2.85Å; E437-F440 PolarHBondContact O-N 3.33Å; A438-F440 VanDerWaalsContact C-N 3.29Å; A438-F440 PolarHBondContact O-N 3.46Å; F440-R446 PolarHBondContact O-NH2 2.88Å; F440-Y476 WeakPolarHBondContact CA-OH 2.82Å; F440-R639 HydrophobicContact CE2-CG 4.5Å; F440-L642 HydrophobicContact CB-CD2 4.04Å; F440-L642 HydrophobicContact CD2-CD2 3.9Å; F440-L642 HydrophobicContact CD2-CG 4.21Å; F440-L642 HydrophobicContact CG-CD2 4.18Å; F440-L646 HydrophobicContact CB-CD1 3.9Å; F440-L646 HydrophobicContact CD1-CD1 3.44Å; F440-L646 VanDerWaalsContact CD1-CD1 3.44Å; F440-L646 HydrophobicContact CE1-CD1 4.12Å; F440-L646 HydrophobicContact CG-CD1 3.73Å
441	S	83.2	Confident	87.5	Confident	53 Å²	53	34.2 Å²	34.2	37%	0.371	19%	0.193	S	C	.	.	H	α-helix	trans	-75.5	-28.6	-170.3	-58	0	0	0	0	114.2	E437 A438 P443	E437-S441 VanDerWaalsContact O-CB 3.31Å; E437-S441 WeakPolarHBondContact O-CB 3.45Å; E437-S441 PolarHBondContact O-N 3.05Å; E437-S441 PolarHBondContact O-OG 2.79Å; A438-S441 PolarHBondContact O-N 2.81Å; S441-P443 WeakPolarHBondContact O-CD 3.42Å
442	I	84.8	Confident	87.7	Confident	35 Å²	35	36 Å²	36	18%	0.179	20%	0.202	C	C	.	.			trans	-123.6	89.8	-174.2	-49.3	172.2	0	0	0	109.2	P406 A409 A438 A444 L445	P406-I442 HydrophobicContact CB-CD1 3.76Å; P406-I442 HydrophobicContact CB-CG1 4.28Å; A409-I442 HydrophobicContact CB-CD1 3.55Å; A438-I442 WeakPolarHBondContact O-CA 3.35Å; A438-I442 WeakPolarHBondContact O-CB 3.25Å; A438-I442 PolarHBondContact O-N 3.48Å; I442-A444 PolarHBondContact O-N 2.71Å; I442-A444 VanDerWaalsContact O-N 3.11Å; I442-L445 HydrophobicContact CB-CD1 4.01Å; I442-L445 HydrophobicContact CB-CG 4.2Å; I442-L445 HydrophobicContact CD1-CD1 3.85Å; I442-L445 HydrophobicContact CG2-CB 4.45Å; I442-L445 HydrophobicContact CG2-CD1 3.86Å; I442-L445 HydrophobicContact CG2-CG 3.73Å; I442-L445 PolarHBondContact O-N 2.79Å; I442-L445 VanDerWaalsContact O-N 3.08Å
443	P	85	Confident	87.7	Confident	76 Å²	76	36 Å²	36	49%	0.494	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-55.9	-31.7	-177	-27	33.6	0	0	0	115.1	S441 L445 R446	S441-P443 WeakPolarHBondContact O-CD 3.42Å; P443-L445 PolarHBondContact O-N 3.36Å; P443-R446 WeakPolarHBondContact O-CB 3.24Å; P443-R446 VanDerWaalsContact O-CG 3.24Å; P443-R446 WeakPolarHBondContact O-CG 3.37Å; P443-R446 PolarHBondContact O-N 3.24Å
444	A	86.3	Confident	87.9	Confident	87 Å²	87	34.6 Å²	34.6	72%	0.719	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-63.9	-24.9	-179.8	0	0	0	0	0	113.5	I442	I442-A444 PolarHBondContact O-N 2.71Å; I442-A444 VanDerWaalsContact O-N 3.11Å
445	L	85.5	Confident	88.1	Confident	20 Å²	20	40.7 Å²	40.7	11%	0.105	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-88.1	-9.5	-178.4	-62.8	-179.4	0	0	0	113.8	A409 G410 V413 I442 P443 Q447 T448 A449	A409-L445 HydrophobicContact CB-CD1 3.46Å; A409-L445 VanDerWaalsContact CB-CD1 3.46Å; G410-L445 VanDerWaalsContact CA-CD2 3.41Å; V413-L445 HydrophobicContact CG2-CD1 4.26Å; I442-L445 HydrophobicContact CB-CD1 4.01Å; I442-L445 HydrophobicContact CB-CG 4.2Å; I442-L445 HydrophobicContact CD1-CD1 3.85Å; I442-L445 HydrophobicContact CG2-CB 4.45Å; I442-L445 HydrophobicContact CG2-CD1 3.86Å; I442-L445 HydrophobicContact CG2-CG 3.73Å; I442-L445 PolarHBondContact O-N 2.79Å; I442-L445 VanDerWaalsContact O-N 3.08Å; P443-L445 PolarHBondContact O-N 3.36Å; L445-Q447 PolarHBondContact O-N 3.38Å; L445-T448 PolarHBondContact O-N 2.92Å; L445-A449 WeakPolarHBondContact O-CB 3.43Å; L445-A449 PolarHBondContact O-N 3.49Å
446	R	89.1	Confident	88	Confident	64 Å²	64	41.9 Å²	41.9	24%	0.242	23%	0.229	C	C	.	.	H	α-helix	trans	-58.3	-49.9	-172.2	-65	177.6	175.9	158.8	5.1	112	V439 F440 P443 A449 V450 Y476	V439-R446 HydrophobicContact CG1-CB 4.19Å; V439-R446 HydrophobicContact CG1-CG 3.69Å; V439-R446 VanDerWaalsContact O-CG 3.3Å; V439-R446 WeakPolarHBondContact O-CG 3.48Å; V439-R446 PolarHBondContact O-NE 2.8Å; F440-R446 PolarHBondContact O-NH2 2.88Å; P443-R446 WeakPolarHBondContact O-CB 3.24Å; P443-R446 VanDerWaalsContact O-CG 3.24Å; P443-R446 WeakPolarHBondContact O-CG 3.37Å; P443-R446 PolarHBondContact O-N 3.24Å; R446-A449 PolarHBondContact O-N 3.43Å; R446-V450 WeakPolarHBondContact O-CB 3.13Å; R446-V450 VanDerWaalsContact O-CG2 3.27Å; R446-V450 WeakPolarHBondContact O-CG2 3.26Å; R446-V450 PolarHBondContact O-N 3.29Å; R446-Y476 HydrophobicContact CG-CD1 4.46Å
447	Q	89.1	Confident	87.9	Confident	85 Å²	85	39.8 Å²	39.8	40%	0.397	22%	0.222	S	C	.	.	H	α-helix	trans	-61.9	-49.1	-178.5	-169	63.7	41.1	0	0	111.2	L445 A449 V450 D451 E482	L445-Q447 PolarHBondContact O-N 3.38Å; Q447-A449 VanDerWaalsContact C-N 3.32Å; Q447-A449 PolarHBondContact O-N 2.89Å; Q447-V450 PolarHBondContact O-N 3.46Å; Q447-D451 PolarHBondContact NE2-OD1 3.07Å; Q447-D451 PolarHBondContact NE2-OD2 3.45Å; Q447-D451 WeakPolarHBondContact O-CB 3.49Å; Q447-D451 PolarHBondContact O-N 2.88Å; Q447-E482 PolarHBondContact NE2-OE1 3.43Å; Q447-E482 PolarHBondContact OE1-OE1 3.17Å
448	T	89.2	Confident	87.8	Confident	61 Å²	61	43 Å²	43	37%	0.374	24%	0.244	S	C	.	.	H	α-helix	trans	-61	-40.9	179.4	-50.9	0	0	0	0	112.1	P414 L445 N452	P414-T448 HydrophobicContact CG-CG2 4.22Å; L445-T448 PolarHBondContact O-N 2.92Å; T448-N452 WeakPolarHBondContact O-CB 3.49Å; T448-N452 VanDerWaalsContact O-CG 3.3Å; T448-N452 PolarHBondContact O-N 2.92Å; T448-N452 VanDerWaalsContact O-N 3.14Å; T448-N452 PolarHBondContact O-ND2 3.38Å
449	A	88.9	Confident	87.7	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-45.4	177.2	0	0	0	0	0	111.7	V413 I435 V439 L445 R446 Q447 L453	V413-A449 HydrophobicContact CG1-CB 4.03Å; I435-A449 HydrophobicContact CG2-CB 4.3Å; V439-A449 HydrophobicContact CG2-CB 3.43Å; V439-A449 VanDerWaalsContact CG2-CB 3.43Å; L445-A449 WeakPolarHBondContact O-CB 3.43Å; L445-A449 PolarHBondContact O-N 3.49Å; R446-A449 PolarHBondContact O-N 3.43Å; Q447-A449 VanDerWaalsContact C-N 3.32Å; Q447-A449 PolarHBondContact O-N 2.89Å; A449-L453 WeakPolarHBondContact O-CB 3.11Å; A449-L453 PolarHBondContact O-N 2.95Å
450	V	91.4	Very high	87.5	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-47	178.3	170.1	0	0	0	0	111	R446 Q447 N452 L453 L454 L473 E482	R446-V450 WeakPolarHBondContact O-CB 3.13Å; R446-V450 VanDerWaalsContact O-CG2 3.27Å; R446-V450 WeakPolarHBondContact O-CG2 3.26Å; R446-V450 PolarHBondContact O-N 3.29Å; Q447-V450 PolarHBondContact O-N 3.46Å; V450-N452 PolarHBondContact O-N 3.17Å; V450-L453 PolarHBondContact O-N 3.4Å; V450-L454 HydrophobicContact CG1-CD1 3.83Å; V450-L454 HydrophobicContact CG1-CG 4.35Å; V450-L454 WeakPolarHBondContact O-CB 3.45Å; V450-L454 VanDerWaalsContact O-CG 3.28Å; V450-L454 WeakPolarHBondContact O-CG 3.25Å; V450-L454 PolarHBondContact O-N 2.99Å; V450-L473 HydrophobicContact CG1-CD2 4.25Å; V450-E482 HydrophobicContact CG1-CG 4.27Å
451	D	91	Very high	87.2	Confident	57 Å²	57	48.3 Å²	48.3	31%	0.305	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-44.7	-178.7	-74.1	-30.6	0	0	0	112.2	Q447 Q455	Q447-D451 PolarHBondContact NE2-OD1 3.07Å; Q447-D451 PolarHBondContact NE2-OD2 3.45Å; Q447-D451 WeakPolarHBondContact O-CB 3.49Å; Q447-D451 PolarHBondContact O-N 2.88Å; D451-Q455 WeakPolarHBondContact O-CG 3.46Å; D451-Q455 PolarHBondContact O-N 3.14Å
452	N	89.9	Confident	87.2	Confident	38 Å²	38	47.1 Å²	47.1	20%	0.203	26%	0.264	C	S	.	.	H	α-helix	trans	-68.4	-41.1	177	-71.9	-33.2	0	0	0	111.7	I417 T448 V450 L454 Q455 V456	I417-N452 HydrophobicContact CB-CB 4.41Å; I417-N452 HydrophobicContact CD1-CB 3.72Å; I417-N452 HydrophobicContact CG2-CB 3.9Å; T448-N452 WeakPolarHBondContact O-CB 3.49Å; T448-N452 VanDerWaalsContact O-CG 3.3Å; T448-N452 PolarHBondContact O-N 2.92Å; T448-N452 VanDerWaalsContact O-N 3.14Å; T448-N452 PolarHBondContact O-ND2 3.38Å; V450-N452 PolarHBondContact O-N 3.17Å; N452-L454 PolarHBondContact O-N 3.23Å; N452-Q455 WeakPolarHBondContact O-CB 3.35Å; N452-Q455 PolarHBondContact O-N 3.15Å; N452-Q455 VanDerWaalsContact O-N 3.12Å; N452-V456 PolarHBondContact O-N 3.24Å
453	L	91	Very high	87.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.6	-37.6	179.5	-170	63	0	0	0	111.5	L420 L432 A449 V450 Q455 V456 F457 A469 I472 L473	L420-L453 HydrophobicContact CD1-CD1 3.76Å; L432-L453 HydrophobicContact CD2-CD1 4.19Å; A449-L453 WeakPolarHBondContact O-CB 3.11Å; A449-L453 PolarHBondContact O-N 2.95Å; V450-L453 PolarHBondContact O-N 3.4Å; L453-Q455 VanDerWaalsContact C-N 3.26Å; L453-Q455 PolarHBondContact O-N 2.7Å; L453-V456 PolarHBondContact O-N 3.38Å; L453-F457 WeakPolarHBondContact O-CB 3.43Å; L453-F457 PolarHBondContact O-N 3.43Å; L453-A469 HydrophobicContact CD1-CB 3.97Å; L453-A469 HydrophobicContact CD2-CB 4.29Å; L453-A469 HydrophobicContact CG-CB 4.38Å; L453-I472 HydrophobicContact CD2-CB 3.95Å; L453-I472 HydrophobicContact CD2-CD1 4.5Å; L453-I472 HydrophobicContact CD2-CG2 3.85Å; L453-L473 HydrophobicContact CB-CD2 4.04Å; L453-L473 HydrophobicContact CD2-CD1 4.39Å; L453-L473 HydrophobicContact CD2-CD2 3.86Å; L453-L473 HydrophobicContact CD2-CG 3.75Å; L453-L473 HydrophobicContact CG-CD1 4.25Å; L453-L473 HydrophobicContact CG-CD2 4.02Å; L453-L473 HydrophobicContact CG-CG 4.07Å
454	L	90.7	Very high	87.1	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.016	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-30.2	172.2	-74.6	169.8	0	0	0	112.8	V450 N452 L473 E482 K485 F486 L489	V450-L454 HydrophobicContact CG1-CD1 3.83Å; V450-L454 HydrophobicContact CG1-CG 4.35Å; V450-L454 WeakPolarHBondContact O-CB 3.45Å; V450-L454 VanDerWaalsContact O-CG 3.28Å; V450-L454 WeakPolarHBondContact O-CG 3.25Å; V450-L454 PolarHBondContact O-N 2.99Å; N452-L454 PolarHBondContact O-N 3.23Å; L454-L473 HydrophobicContact CD2-CD1 4.01Å; L454-L473 HydrophobicContact CD2-CD2 3.85Å; L454-L473 HydrophobicContact CD2-CG 4.49Å; L454-L473 HydrophobicContact CG-CD2 3.74Å; L454-E482 HydrophobicContact CD1-CG 4.47Å; L454-K485 HydrophobicContact CD1-CD 4.28Å; L454-F486 HydrophobicContact CD2-CB 4.1Å; L454-F486 HydrophobicContact CD2-CD2 4.28Å; L454-L489 HydrophobicContact CB-CD1 4.37Å; L454-L489 HydrophobicContact CD2-CD1 3.82Å; L454-L489 WeakPolarHBondContact O-CD1 3.26Å
455	Q	88.9	Confident	87.1	Confident	131 Å²	131	42.2 Å²	42.2	61%	0.612	23%	0.225	S	C	*	.	H	α-helix	trans	-75.7	-39.7	176.7	-71.5	176.5	25.7	0	0	112.4	D451 N452 L453 P458	D451-Q455 WeakPolarHBondContact O-CG 3.46Å; D451-Q455 PolarHBondContact O-N 3.14Å; N452-Q455 WeakPolarHBondContact O-CB 3.35Å; N452-Q455 PolarHBondContact O-N 3.15Å; N452-Q455 VanDerWaalsContact O-N 3.12Å; L453-Q455 VanDerWaalsContact C-N 3.26Å; L453-Q455 PolarHBondContact O-N 2.7Å; Q455-P458 WeakPolarHBondContact O-CD 3.46Å
456	V	87.9	Confident	87.2	Confident	25 Å²	25	41.4 Å²	41.4	15%	0.152	22%	0.221	C	C	.	.	H	α-helix	trans	-83.4	-20.5	-178.9	179.2	0	0	0	0	112.5	I417 L420 N452 L453 P458 S459	I417-V456 HydrophobicContact CG2-CB 4.19Å; I417-V456 HydrophobicContact CG2-CG2 3.76Å; L420-V456 HydrophobicContact CB-CG1 3.93Å; N452-V456 PolarHBondContact O-N 3.24Å; L453-V456 PolarHBondContact O-N 3.38Å; V456-P458 VanDerWaalsContact C-N 3.32Å; V456-P458 VanDerWaalsContact O-N 3.08Å; V456-S459 PolarHBondContact O-N 3.45Å; V456-S459 PolarHBondContact O-OG 2.87Å
457	F	87.2	Confident	87.2	Confident	7 Å²	7	42 Å²	42	3%	0.031	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-44.2	-44.7	-179.6	-178	-94.1	0	0	0	115.3	L453 S459 L466 L470 L473 L489 V490	L453-F457 WeakPolarHBondContact O-CB 3.43Å; L453-F457 PolarHBondContact O-N 3.43Å; F457-S459 VanDerWaalsContact C-N 3.3Å; F457-S459 PolarHBondContact O-N 3.45Å; F457-L466 HydrophobicContact CD2-CD1 3.84Å; F457-L466 HydrophobicContact CE2-CD1 3.35Å; F457-L466 HydrophobicContact CE2-CG 4.34Å; F457-L466 HydrophobicContact CZ-CD1 3.77Å; F457-L470 HydrophobicContact CE2-CD2 3.41Å; F457-L470 VanDerWaalsContact CE2-CD2 3.41Å; F457-L470 HydrophobicContact CE2-CG 3.81Å; F457-L470 HydrophobicContact CZ-CD2 3.61Å; F457-L470 HydrophobicContact CZ-CG 4.32Å; F457-L473 HydrophobicContact CD2-CD1 3.88Å; F457-L473 HydrophobicContact CE2-CD1 4.46Å; F457-L473 HydrophobicContact CG-CD1 4.47Å; F457-L489 HydrophobicContact CD1-CB 3.94Å; F457-L489 HydrophobicContact CD1-CD1 4.45Å; F457-L489 HydrophobicContact CE1-CB 4.1Å; F457-V490 HydrophobicContact CZ-CG2 4.25Å
458	P	84.2	Confident	87.2	Confident	91 Å²	91	40.7 Å²	40.7	59%	0.591	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-69.7	-19.8	-179.5	-19.6	34.8	0	0	0	115.2	Q455 V456 L489	Q455-P458 WeakPolarHBondContact O-CD 3.46Å; V456-P458 VanDerWaalsContact C-N 3.32Å; V456-P458 VanDerWaalsContact O-N 3.08Å; P458-L489 HydrophobicContact CG-CD2 4.03Å
459	S	83.5	Confident	87.3	Confident	57 Å²	57	37.8 Å²	37.8	40%	0.399	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-92.6	-9.1	-177.5	63	0	0	0	0	113.8	V456 F457 Q461	V456-S459 PolarHBondContact O-N 3.45Å; V456-S459 PolarHBondContact O-OG 2.87Å; F457-S459 VanDerWaalsContact C-N 3.3Å; F457-S459 PolarHBondContact O-N 3.45Å; S459-Q461 WeakPolarHBondContact O-CG 3.18Å; S459-Q461 PolarHBondContact O-N 3.24Å
460	M	84.6	Confident	87.5	Confident	9 Å²	9	37.7 Å²	37.7	4%	0.044	20%	0.198	C	C	.	.			trans	-65.3	131.6	-179.7	-61.1	-174.6	73.9	0	0	111.8	L432 S465 L466 A469 L544	L432-M460 HydrophobicContact CD1-CE 4.09Å; M460-S465 WeakPolarHBondContact CE-O 3.48Å; M460-L466 HydrophobicContact CB-CD1 4.25Å; M460-L466 HydrophobicContact SD-CD1 4.14Å; M460-A469 HydrophobicContact CE-CB 3.83Å; M460-A469 HydrophobicContact SD-CB 3.63Å; M460-L544 WeakPolarHBondContact O-CD2 3.27Å
461	Q	80.2	Confident	87.6	Confident	113 Å²	113	41.1 Å²	41.1	53%	0.528	21%	0.211	S	C	.	.			trans	-108	-12.1	-174.8	-56.6	-173.8	30.6	0	0	114.4	S459 L544	S459-Q461 WeakPolarHBondContact O-CG 3.18Å; S459-Q461 PolarHBondContact O-N 3.24Å; Q461-L544 VanDerWaalsContact C-CD2 3.43Å; Q461-L544 VanDerWaalsContact O-CD1 3.23Å; Q461-L544 WeakPolarHBondContact O-CD1 3.46Å
462	N	82.2	Confident	87.6	Confident	28 Å²	28	38.5 Å²	38.5	15%	0.15	20%	0.197	C	C	.	.			trans	-107.6	133.3	-174.6	-64	-36.6	0	0	0	112.2	A423 E425 L466	A423-N462 VanDerWaalsContact C-ND2 3.34Å; A423-N462 PolarHBondContact O-ND2 2.81Å; A423-N462 PolarHBondContact O-OD1 3.14Å; E425-N462 VanDerWaalsContact CA-ND2 3.3Å; E425-N462 WeakPolarHBondContact CA-ND2 3.39Å; E425-N462 HydrophobicContact CB-CB 4.46Å; E425-N462 HydrophobicContact CG-CB 4.3Å; E425-N462 PolarHBondContact N-ND2 2.92Å; N462-L466 VanDerWaalsContact O-CB 3.28Å; N462-L466 WeakPolarHBondContact O-CB 3.42Å; N462-L466 PolarHBondContact O-N 3.25Å
463	A	83.3	Confident	87.7	Confident	21 Å²	21	36.7 Å²	36.7	17%	0.174	19%	0.188	C	C	.	.	H	α-helix	trans	-63.2	-46	-176.5	0	0	0	0	0	112.5	L466 R467 L548	A463-L466 PolarHBondContact O-N 2.91Å; A463-R467 PolarHBondContact O-N 3.41Å; A463-L548 HydrophobicContact CB-CD1 3.78Å; A463-L548 HydrophobicContact CB-CD2 3.57Å; A463-L548 HydrophobicContact CB-CG 4.3Å
464	N	84.8	Confident	87.8	Confident	72 Å²	72	36.8 Å²	36.8	39%	0.385	19%	0.188	S	C	.	.	H	α-helix	trans	-63.6	-51.5	179.3	-73.9	-33.7	0	0	0	110.8	E425 I429 L466 R467 F468	E425-N464 WeakPolarHBondContact OE1-CB 3.25Å; E425-N464 PolarHBondContact OE1-ND2 3Å; I429-N464 HydrophobicContact CD1-CB 4.1Å; N464-L466 VanDerWaalsContact C-N 3.28Å; N464-L466 PolarHBondContact O-N 3.49Å; N464-R467 WeakPolarHBondContact O-CB 3.47Å; N464-R467 PolarHBondContact O-N 3.37Å; N464-F468 VanDerWaalsContact O-CD2 3.23Å; N464-F468 WeakPolarHBondContact O-CD2 3.18Å; N464-F468 PolarHBondContact O-N 3.49Å
465	S	86.4	Confident	87.8	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.014	19%	0.187	C	C	.	.	H	α-helix	trans	-56.5	-43.6	175.7	-45.4	0	0	0	0	111.4	A428 L432 M460 R467 F468 A469	A428-S465 WeakPolarHBondContact CB-OG 3.43Å; L432-S465 WeakPolarHBondContact CD1-O 3.31Å; M460-S465 WeakPolarHBondContact CE-O 3.48Å; S465-R467 VanDerWaalsContact C-N 3.31Å; S465-R467 PolarHBondContact O-N 3.43Å; S465-F468 PolarHBondContact O-N 3.24Å; S465-A469 WeakPolarHBondContact O-CB 3.22Å; S465-A469 PolarHBondContact O-N 3.13Å
466	L	88.3	Confident	87.9	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.021	16%	0.159	C	C	.	.	H	α-helix	trans	-60.4	-41.6	177.1	-173.8	69.7	0	0	0	111.7	F457 M460 N462 A463 N464 A469 L470 L544 I545 F556	F457-L466 HydrophobicContact CD2-CD1 3.84Å; F457-L466 HydrophobicContact CE2-CD1 3.35Å; F457-L466 HydrophobicContact CE2-CG 4.34Å; F457-L466 HydrophobicContact CZ-CD1 3.77Å; M460-L466 HydrophobicContact CB-CD1 4.25Å; M460-L466 HydrophobicContact SD-CD1 4.14Å; N462-L466 VanDerWaalsContact O-CB 3.28Å; N462-L466 WeakPolarHBondContact O-CB 3.42Å; N462-L466 PolarHBondContact O-N 3.25Å; A463-L466 PolarHBondContact O-N 2.91Å; N464-L466 VanDerWaalsContact C-N 3.28Å; N464-L466 PolarHBondContact O-N 3.49Å; L466-A469 PolarHBondContact O-N 3.18Å; L466-L470 HydrophobicContact CG-CD1 4.13Å; L466-L470 HydrophobicContact CG-CG 4.39Å; L466-L470 WeakPolarHBondContact O-CB 3.26Å; L466-L470 VanDerWaalsContact O-CG 3.23Å; L466-L470 WeakPolarHBondContact O-CG 3.32Å; L466-L470 PolarHBondContact O-N 3.03Å; L466-L544 HydrophobicContact CB-CD2 4.16Å; L466-L544 HydrophobicContact CD2-CD2 3.88Å; L466-L544 HydrophobicContact CD2-CG 4.32Å; L466-I545 HydrophobicContact CD2-CD1 3.87Å; L466-I545 HydrophobicContact CD2-CG1 3.53Å; L466-F556 HydrophobicContact CB-CE2 4.3Å; L466-F556 HydrophobicContact CD2-CE2 3.94Å; L466-F556 HydrophobicContact CD2-CZ 3.58Å; L466-F556 HydrophobicContact CG-CE2 4.17Å; L466-F556 HydrophobicContact CG-CZ 4.15Å
467	R	89.3	Confident	88	Confident	75 Å²	75	29.4 Å²	29.4	28%	0.283	15%	0.152	S	C	.	.	H	α-helix	trans	-61.2	-44.8	177.2	-172.7	-176.5	179.2	-150.4	2.7	112.2	A463 N464 S465 L470 W471 F555 F556 S559	A463-R467 PolarHBondContact O-N 3.41Å; N464-R467 WeakPolarHBondContact O-CB 3.47Å; N464-R467 PolarHBondContact O-N 3.37Å; S465-R467 VanDerWaalsContact C-N 3.31Å; S465-R467 PolarHBondContact O-N 3.43Å; R467-L470 PolarHBondContact O-N 2.84Å; R467-W471 PolarHBondContact O-N 3.46Å; R467-W471 VanDerWaalsContact O-N 3.08Å; R467-F555 VanDerWaalsContact CZ-CZ 3.47Å; R467-F555 VanDerWaalsContact NH1-CZ 3.31Å; R467-F556 HydrophobicContact CB-CD2 4.04Å; R467-F556 HydrophobicContact CB-CE2 4.1Å; R467-F556 HydrophobicContact CG-CD2 4.49Å; R467-S559 VanDerWaalsContact CZ-OG 3.28Å; R467-S559 PolarHBondContact NE-OG 2.81Å; R467-S559 PolarHBondContact NH2-OG 3.42Å
468	F	89.3	Confident	88.1	Confident	58 Å²	58	33 Å²	33	25%	0.254	17%	0.169	S	C	.	.	H	α-helix	trans	-63.6	-43.1	175.5	-80.7	-83.4	0	0	0	111.7	I429 L432 V433 N464 S465 W471 I472	I429-F468 HydrophobicContact CG2-CD2 4.43Å; I429-F468 HydrophobicContact CG2-CE2 3.99Å; I429-F468 HydrophobicContact CG2-CZ 4.27Å; L432-F468 HydrophobicContact CB-CB 3.87Å; L432-F468 HydrophobicContact CD1-CB 3.71Å; L432-F468 HydrophobicContact CG-CB 4.3Å; V433-F468 HydrophobicContact CG2-CE1 4.37Å; N464-F468 VanDerWaalsContact O-CD2 3.23Å; N464-F468 WeakPolarHBondContact O-CD2 3.18Å; N464-F468 PolarHBondContact O-N 3.49Å; S465-F468 PolarHBondContact O-N 3.24Å; F468-W471 WeakPolarHBondContact O-CB 3.44Å; F468-W471 PolarHBondContact O-N 2.83Å; F468-I472 WeakPolarHBondContact O-CG1 3.16Å; F468-I472 PolarHBondContact O-N 2.97Å; F468-I472 VanDerWaalsContact O-N 3.15Å
469	A	91.3	Very high	88.3	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.1	-44.7	176.9	0	0	0	0	0	112.4	L432 L453 M460 S465 L466 W471 I472 L473	L432-A469 HydrophobicContact CD2-CB 3.97Å; L453-A469 HydrophobicContact CD1-CB 3.97Å; L453-A469 HydrophobicContact CD2-CB 4.29Å; L453-A469 HydrophobicContact CG-CB 4.38Å; M460-A469 HydrophobicContact CE-CB 3.83Å; M460-A469 HydrophobicContact SD-CB 3.63Å; S465-A469 WeakPolarHBondContact O-CB 3.22Å; S465-A469 PolarHBondContact O-N 3.13Å; L466-A469 PolarHBondContact O-N 3.18Å; A469-W471 PolarHBondContact O-N 3.15Å; A469-I472 PolarHBondContact O-N 3.21Å; A469-L473 WeakPolarHBondContact O-CG 3.43Å; A469-L473 PolarHBondContact O-N 3.32Å
470	L	92.2	Very high	88.6	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-56.8	-40.5	174.5	-76.4	167.9	0	0	0	111.5	F457 L466 R467 L473 S474 F486 V490 F556 L560 M563	F457-L470 HydrophobicContact CE2-CD2 3.41Å; F457-L470 VanDerWaalsContact CE2-CD2 3.41Å; F457-L470 HydrophobicContact CE2-CG 3.81Å; F457-L470 HydrophobicContact CZ-CD2 3.61Å; F457-L470 HydrophobicContact CZ-CG 4.32Å; L466-L470 HydrophobicContact CG-CD1 4.13Å; L466-L470 HydrophobicContact CG-CG 4.39Å; L466-L470 WeakPolarHBondContact O-CB 3.26Å; L466-L470 VanDerWaalsContact O-CG 3.23Å; L466-L470 WeakPolarHBondContact O-CG 3.32Å; L466-L470 PolarHBondContact O-N 3.03Å; R467-L470 PolarHBondContact O-N 2.84Å; L470-L473 PolarHBondContact O-N 2.9Å; L470-S474 VanDerWaalsContact O-CB 3.27Å; L470-S474 WeakPolarHBondContact O-CB 3.22Å; L470-S474 PolarHBondContact O-N 2.71Å; L470-S474 PolarHBondContact O-OG 2.98Å; L470-F486 HydrophobicContact CD2-CE2 3.7Å; L470-F486 HydrophobicContact CD2-CZ 3.76Å; L470-V490 HydrophobicContact CD2-CG2 3.98Å; L470-F556 HydrophobicContact CD1-CE1 4.44Å; L470-F556 HydrophobicContact CD1-CE2 3.83Å; L470-F556 HydrophobicContact CD1-CZ 3.48Å; L470-F556 VanDerWaalsContact CD1-CZ 3.48Å; L470-L560 HydrophobicContact CD1-CD1 3.98Å; L470-L560 HydrophobicContact CD2-CD1 4.07Å; L470-M563 HydrophobicContact CB-CE 3.46Å; L470-M563 VanDerWaalsContact CB-CE 3.46Å; L470-M563 HydrophobicContact CB-SD 3.55Å; L470-M563 VanDerWaalsContact CB-SD 3.55Å; L470-M563 HydrophobicContact CD1-CE 3.88Å; L470-M563 HydrophobicContact CG-CE 4.28Å
471	W	92.6	Very high	88.8	Confident	73 Å²	73	39.6 Å²	39.6	28%	0.277	19%	0.186	S	C	.	.	H	α-helix	trans	-63.9	-47.8	179.7	-174.4	91.2	0	0	0	110.9	R436 R467 F468 A469 L473 S474 E475 Y476 M563 L642	R436-W471 HydrophobicContact CG-CE3 4.24Å; R436-W471 HydrophobicContact CG-CH2 4.37Å; R436-W471 HydrophobicContact CG-CZ3 3.63Å; R467-W471 PolarHBondContact O-N 3.46Å; R467-W471 VanDerWaalsContact O-N 3.08Å; F468-W471 WeakPolarHBondContact O-CB 3.44Å; F468-W471 PolarHBondContact O-N 2.83Å; A469-W471 PolarHBondContact O-N 3.15Å; W471-L473 PolarHBondContact O-N 2.82Å; W471-S474 PolarHBondContact O-N 3.32Å; W471-S474 PolarHBondContact O-OG 2.74Å; W471-E475 HydrophobicContact CH2-CB 4.45Å; W471-E475 HydrophobicContact CH2-CG 4.24Å; W471-E475 HydrophobicContact CZ3-CB 4.35Å; W471-E475 HydrophobicContact CZ3-CG 4.49Å; W471-E475 WeakPolarHBondContact O-CB 3.47Å; W471-E475 PolarHBondContact O-N 3.16Å; W471-Y476 HydrophobicContact CZ3-CE2 4.43Å; W471-M563 WeakPolarHBondContact CA-SD 3.47Å; W471-M563 HydrophobicContact CB-SD 3.83Å; W471-M563 PolarHBondContact N-SD 3Å; W471-L642 HydrophobicContact CH2-CB 4.34Å; W471-L642 HydrophobicContact CH2-CD2 3.63Å; W471-L642 HydrophobicContact CH2-CG 4.42Å; W471-L642 HydrophobicContact CZ3-CD2 4.07Å
472	I	91.8	Very high	89.3	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-59.6	-47.2	177.8	-62.7	167.7	0	0	0	110.4	L432 I435 R436 L453 F468 A469 S474 E475 Y476	L432-I472 HydrophobicContact CB-CD1 4.47Å; L432-I472 HydrophobicContact CD2-CD1 3.98Å; I435-I472 HydrophobicContact CB-CD1 4.22Å; I435-I472 HydrophobicContact CG2-CD1 4.04Å; I435-I472 HydrophobicContact CG2-CG2 4.38Å; R436-I472 HydrophobicContact CB-CD1 4.19Å; R436-I472 HydrophobicContact CB-CG1 4.24Å; L453-I472 HydrophobicContact CD2-CB 3.95Å; L453-I472 HydrophobicContact CD2-CD1 4.5Å; L453-I472 HydrophobicContact CD2-CG2 3.85Å; F468-I472 WeakPolarHBondContact O-CG1 3.16Å; F468-I472 PolarHBondContact O-N 2.97Å; F468-I472 VanDerWaalsContact O-N 3.15Å; A469-I472 PolarHBondContact O-N 3.21Å; I472-S474 PolarHBondContact O-N 2.98Å; I472-E475 PolarHBondContact O-N 2.96Å; I472-Y476 HydrophobicContact CG2-CD2 4.06Å; I472-Y476 WeakPolarHBondContact O-CD2 3.36Å; I472-Y476 PolarHBondContact O-N 3.37Å
473	L	92.8	Very high	89.7	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.5	-43.4	177.7	-67.5	174.3	0	0	0	111.6	V450 L453 L454 F457 A469 L470 W471 E475 Y476 C477 F486	V450-L473 HydrophobicContact CG1-CD2 4.25Å; L453-L473 HydrophobicContact CB-CD2 4.04Å; L453-L473 HydrophobicContact CD2-CD1 4.39Å; L453-L473 HydrophobicContact CD2-CD2 3.86Å; L453-L473 HydrophobicContact CD2-CG 3.75Å; L453-L473 HydrophobicContact CG-CD1 4.25Å; L453-L473 HydrophobicContact CG-CD2 4.02Å; L453-L473 HydrophobicContact CG-CG 4.07Å; L454-L473 HydrophobicContact CD2-CD1 4.01Å; L454-L473 HydrophobicContact CD2-CD2 3.85Å; L454-L473 HydrophobicContact CD2-CG 4.49Å; L454-L473 HydrophobicContact CG-CD2 3.74Å; F457-L473 HydrophobicContact CD2-CD1 3.88Å; F457-L473 HydrophobicContact CE2-CD1 4.46Å; F457-L473 HydrophobicContact CG-CD1 4.47Å; A469-L473 WeakPolarHBondContact O-CG 3.43Å; A469-L473 PolarHBondContact O-N 3.32Å; L470-L473 PolarHBondContact O-N 2.9Å; W471-L473 PolarHBondContact O-N 2.82Å; L473-E475 PolarHBondContact O-N 2.98Å; L473-Y476 PolarHBondContact O-N 2.53Å; L473-C477 VanDerWaalsContact O-CB 3.24Å; L473-C477 WeakPolarHBondContact O-CB 3.42Å; L473-C477 PolarHBondContact O-N 2.83Å; L473-C477 PolarHBondContact O-SG 3.42Å; L473-F486 HydrophobicContact CB-CD2 3.72Å; L473-F486 HydrophobicContact CB-CE2 3.56Å; L473-F486 HydrophobicContact CB-CZ 4.3Å; L473-F486 HydrophobicContact CD1-CD2 3.83Å; L473-F486 HydrophobicContact CD1-CE2 3.84Å; L473-F486 HydrophobicContact CG-CD2 4.37Å; L473-F486 HydrophobicContact CG-CE2 4.35Å
474	S	91.7	Very high	90.1	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	16%	0.164	C	C	.	.	H	α-helix	trans	-62.6	-31.1	178.6	78.2	0	0	0	0	113.4	L470 W471 I472 I567	L470-S474 VanDerWaalsContact O-CB 3.27Å; L470-S474 WeakPolarHBondContact O-CB 3.22Å; L470-S474 PolarHBondContact O-N 2.71Å; L470-S474 PolarHBondContact O-OG 2.98Å; W471-S474 PolarHBondContact O-N 3.32Å; W471-S474 PolarHBondContact O-OG 2.74Å; I472-S474 PolarHBondContact O-N 2.98Å; S474-I567 WeakPolarHBondContact O-CD1 3.47Å
475	E	90.7	Very high	90.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-80.8	-42.4	-179.7	-173.5	61.4	-115.6	0	0	112.3	W471 I472 L473 K566 R570 R639	W471-E475 HydrophobicContact CH2-CB 4.45Å; W471-E475 HydrophobicContact CH2-CG 4.24Å; W471-E475 HydrophobicContact CZ3-CB 4.35Å; W471-E475 HydrophobicContact CZ3-CG 4.49Å; W471-E475 WeakPolarHBondContact O-CB 3.47Å; W471-E475 PolarHBondContact O-N 3.16Å; I472-E475 PolarHBondContact O-N 2.96Å; L473-E475 PolarHBondContact O-N 2.98Å; E475-K566 WeakPolarHBondContact OE1-CE 3.44Å; E475-K566 IonicContact OE1-NZ 2.91Å; E475-K566 PolarHBondContact OE1-NZ 2.95Å; E475-K566 WeakPolarHBondContact OE2-CE 3.36Å; E475-K566 IonicContact OE2-NZ 3.79Å; E475-K566 PolarHBondContact OE2-NZ 3.38Å; E475-R570 PolarHBondContact O-NH2 3.46Å; E475-R570 IonicContact OE1-NH2 3.48Å; E475-R570 PolarHBondContact OE1-NH2 2.96Å; E475-R639 PolarHBondContact O-NH2 3.28Å; E475-R639 IonicContact OE1-CZ 2.88Å; E475-R639 VanDerWaalsContact OE1-CZ 3.28Å; E475-R639 IonicContact OE1-NE 3.24Å; E475-R639 PolarHBondContact OE1-NE 3.33Å; E475-R639 IonicContact OE1-NH2 2.82Å; E475-R639 PolarHBondContact OE1-NH2 3.31Å
476	Y	90.8	Very high	90.7	Very high	5 Å²	5	36.6 Å²	36.6	2%	0.02	16%	0.164	C	C	.	.	H	α-helix	trans	-111.7	-6.6	-164.7	-65.1	-75.6	0	0	0	115.5	V439 F440 R446 W471 I472 L473 Q478	V439-Y476 HydrophobicContact CB-CD2 4.48Å; V439-Y476 HydrophobicContact CB-CE2 4.26Å; V439-Y476 HydrophobicContact CG1-CD1 3.52Å; V439-Y476 HydrophobicContact CG1-CD2 3.41Å; V439-Y476 VanDerWaalsContact CG1-CD2 3.41Å; V439-Y476 HydrophobicContact CG1-CE1 3.62Å; V439-Y476 HydrophobicContact CG1-CE2 3.51Å; V439-Y476 HydrophobicContact CG1-CG 3.42Å; V439-Y476 VanDerWaalsContact CG1-CG 3.42Å; F440-Y476 WeakPolarHBondContact CA-OH 2.82Å; R446-Y476 HydrophobicContact CG-CD1 4.46Å; W471-Y476 HydrophobicContact CZ3-CE2 4.43Å; I472-Y476 HydrophobicContact CG2-CD2 4.06Å; I472-Y476 WeakPolarHBondContact O-CD2 3.36Å; I472-Y476 PolarHBondContact O-N 3.37Å; L473-Y476 PolarHBondContact O-N 2.53Å; Y476-Q478 WeakPolarHBondContact O-CG 3.36Å; Y476-Q478 PolarHBondContact O-N 3.01Å
477	C	90.9	Very high	90.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	16%	0.163	C	C	.	.			trans	-65.8	105.2	164.2	-72.3	0	0	0	0	109.2	L473 E482 I483 I567 R570	L473-C477 VanDerWaalsContact O-CB 3.24Å; L473-C477 WeakPolarHBondContact O-CB 3.42Å; L473-C477 PolarHBondContact O-N 2.83Å; L473-C477 PolarHBondContact O-SG 3.42Å; C477-E482 WeakPolarHBondContact CA-OE2 3.27Å; C477-E482 HydrophobicContact CB-CB 3.94Å; C477-I483 HydrophobicContact CB-CG1 4.18Å; C477-I567 HydrophobicContact CB-CD1 4.17Å; C477-R570 WeakPolarHBondContact O-CD 3.13Å
478	Q	88.4	Confident	90.8	Very high	83 Å²	83	35 Å²	35	39%	0.388	16%	0.164	S	C	.	.			trans	-109.6	-22.4	-172.7	-73	178.4	21	0	0	112.7	Y476 E482 L574	Y476-Q478 WeakPolarHBondContact O-CG 3.36Å; Y476-Q478 PolarHBondContact O-N 3.01Å; Q478-E482 PolarHBondContact N-OE2 3.43Å; Q478-L574 WeakPolarHBondContact O-CD1 3.25Å
479	T	90	Very high	90.7	Very high	60 Å²	60	33.1 Å²	33.1	37%	0.368	16%	0.157	S	C	.	.	S	Bend	trans	-93.2	153.6	178.1	72.2	0	0	0	0	111.2	Q481 E482 I483	T479-Q481 VanDerWaalsContact C-N 3.26Å; T479-Q481 PolarHBondContact O-N 2.94Å; T479-E482 WeakPolarHBondContact CG2-OE1 3.27Å; T479-E482 PolarHBondContact N-OE2 3.17Å; T479-E482 VanDerWaalsContact N-OE2 3.15Å; T479-E482 PolarHBondContact O-N 3.41Å; T479-E482 WeakPolarHBondContact OG1-CB 3.42Å; T479-E482 WeakPolarHBondContact OG1-CG 3.5Å; T479-E482 PolarHBondContact OG1-N 3.29Å; T479-E482 PolarHBondContact OG1-OE1 3.01Å; T479-E482 PolarHBondContact OG1-OE2 3.09Å; T479-I483 WeakPolarHBondContact O-CG1 3.33Å; T479-I483 PolarHBondContact O-N 3.29Å; T479-I483 VanDerWaalsContact O-N 3.12Å
480	R	88.4	Confident	90.6	Very high	77 Å²	77	33.1 Å²	33.1	29%	0.291	16%	0.157	S	C	.	.	H	α-helix	trans	-56.9	-42	177.7	-169.7	-172.9	158.3	177.4	-11.4	112.1	I483 E484 Y571 E580	R480-I483 PolarHBondContact O-N 3.38Å; R480-E484 IonicContact CZ-OE1 2.76Å; R480-E484 VanDerWaalsContact CZ-OE1 3.31Å; R480-E484 IonicContact NE-OE1 3.38Å; R480-E484 PolarHBondContact NE-OE1 3.13Å; R480-E484 IonicContact NH2-OE1 2.67Å; R480-E484 PolarHBondContact NH2-OE1 3.35Å; R480-E484 WeakPolarHBondContact O-CG 3.29Å; R480-E484 PolarHBondContact O-N 3.2Å; R480-Y571 HydrophobicContact CG-CD2 4.24Å; R480-Y571 HydrophobicContact CG-CE2 3.41Å; R480-Y571 VanDerWaalsContact CG-CE2 3.41Å; R480-Y571 PolarHBondContact NE-OH 3.02Å; R480-Y571 PolarHBondContact NH2-OH 3.19Å; R480-E580 VanDerWaalsContact CZ-CD 3.43Å; R480-E580 IonicContact CZ-OE1 2.8Å; R480-E580 IonicContact CZ-OE2 2.7Å; R480-E580 VanDerWaalsContact CZ-OE2 3.24Å; R480-E580 IonicContact NH1-OE1 2.93Å; R480-E580 PolarHBondContact NH1-OE1 2.96Å; R480-E580 IonicContact NH1-OE2 3.68Å; R480-E580 PolarHBondContact NH1-OE2 2.83Å; R480-E580 IonicContact NH2-OE1 3.76Å; R480-E580 PolarHBondContact NH2-OE1 2.88Å; R480-E580 IonicContact NH2-OE2 3.24Å; R480-E580 PolarHBondContact NH2-OE2 3.49Å
481	Q	89.3	Confident	90.4	Very high	158 Å²	158	36.1 Å²	36.1	74%	0.738	17%	0.168	S	C	*	.	H	α-helix	trans	-67.1	-40.4	-178.7	-65.1	178	5.7	0	0	111.9	T479 I483 K485	T479-Q481 VanDerWaalsContact C-N 3.26Å; T479-Q481 PolarHBondContact O-N 2.94Å; Q481-I483 VanDerWaalsContact C-N 3.34Å; Q481-K485 VanDerWaalsContact O-CB 3.26Å; Q481-K485 WeakPolarHBondContact O-CB 3.39Å; Q481-K485 PolarHBondContact O-N 2.87Å
482	E	91.1	Very high	90	Very high	11 Å²	11	38.9 Å²	38.9	5%	0.051	18%	0.184	C	C	.	.	H	α-helix	trans	-60.8	-43.6	173.9	-77.4	153.8	-143.2	0	0	111.7	Q447 V450 L454 C477 Q478 T479 K485 F486	Q447-E482 PolarHBondContact NE2-OE1 3.43Å; Q447-E482 PolarHBondContact OE1-OE1 3.17Å; V450-E482 HydrophobicContact CG1-CG 4.27Å; L454-E482 HydrophobicContact CD1-CG 4.47Å; C477-E482 WeakPolarHBondContact CA-OE2 3.27Å; C477-E482 HydrophobicContact CB-CB 3.94Å; Q478-E482 PolarHBondContact N-OE2 3.43Å; T479-E482 WeakPolarHBondContact CG2-OE1 3.27Å; T479-E482 PolarHBondContact N-OE2 3.17Å; T479-E482 VanDerWaalsContact N-OE2 3.15Å; T479-E482 PolarHBondContact O-N 3.41Å; T479-E482 WeakPolarHBondContact OG1-CB 3.42Å; T479-E482 WeakPolarHBondContact OG1-CG 3.5Å; T479-E482 PolarHBondContact OG1-N 3.29Å; T479-E482 PolarHBondContact OG1-OE1 3.01Å; T479-E482 PolarHBondContact OG1-OE2 3.09Å; E482-K485 PolarHBondContact O-N 2.88Å; E482-F486 VanDerWaalsContact O-CB 3.27Å; E482-F486 WeakPolarHBondContact O-CB 3.15Å; E482-F486 PolarHBondContact O-N 3.21Å
483	I	90.6	Very high	89.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64	-49.3	179.6	-68.5	170	0	0	0	111	C477 T479 R480 Q481 K485 F486 V487 I567 R570 Y571 L574 L584	C477-I483 HydrophobicContact CB-CG1 4.18Å; T479-I483 WeakPolarHBondContact O-CG1 3.33Å; T479-I483 PolarHBondContact O-N 3.29Å; T479-I483 VanDerWaalsContact O-N 3.12Å; R480-I483 PolarHBondContact O-N 3.38Å; Q481-I483 VanDerWaalsContact C-N 3.34Å; I483-K485 VanDerWaalsContact C-N 3.29Å; I483-K485 PolarHBondContact O-N 3.11Å; I483-F486 PolarHBondContact O-N 3.19Å; I483-V487 HydrophobicContact CG2-CG2 4.49Å; I483-V487 WeakPolarHBondContact O-CG2 3.29Å; I483-V487 PolarHBondContact O-N 3.32Å; I483-I567 HydrophobicContact CB-CG2 4.47Å; I483-I567 HydrophobicContact CG1-CD1 4.18Å; I483-I567 HydrophobicContact CG1-CG2 4.48Å; I483-I567 HydrophobicContact CG2-CG2 3.44Å; I483-I567 VanDerWaalsContact CG2-CG2 3.44Å; I483-R570 HydrophobicContact CD1-CB 4.43Å; I483-R570 HydrophobicContact CD1-CG 4.34Å; I483-Y571 HydrophobicContact CB-CD2 4.08Å; I483-Y571 HydrophobicContact CD1-CD2 4.12Å; I483-Y571 HydrophobicContact CG2-CD2 3.58Å; I483-Y571 HydrophobicContact CG2-CE2 4.29Å; I483-Y571 HydrophobicContact CG2-CG 4.27Å; I483-L574 HydrophobicContact CD1-CD1 3.81Å; I483-L584 HydrophobicContact CG2-CD2 3.7Å
484	E	91.4	Very high	89	Confident	73 Å²	73	39.9 Å²	39.9	34%	0.341	19%	0.191	S	C	.	.	H	α-helix	trans	-59.5	-43	177.5	-72.1	174.1	177.7	0	0	110.9	R480 S488 Y571	R480-E484 IonicContact CZ-OE1 2.76Å; R480-E484 VanDerWaalsContact CZ-OE1 3.31Å; R480-E484 IonicContact NE-OE1 3.38Å; R480-E484 PolarHBondContact NE-OE1 3.13Å; R480-E484 IonicContact NH2-OE1 2.67Å; R480-E484 PolarHBondContact NH2-OE1 3.35Å; R480-E484 WeakPolarHBondContact O-CG 3.29Å; R480-E484 PolarHBondContact O-N 3.2Å; E484-S488 VanDerWaalsContact O-CB 3.3Å; E484-S488 WeakPolarHBondContact O-CB 3.34Å; E484-S488 PolarHBondContact O-N 3.07Å; E484-S488 PolarHBondContact O-OG 3.19Å; E484-Y571 HydrophobicContact CG-CE2 4.06Å; E484-Y571 PolarHBondContact OE1-OH 2.99Å
485	K	90.8	Very high	88.1	Confident	89 Å²	89	41.2 Å²	41.2	39%	0.387	21%	0.205	S	C	.	.	H	α-helix	trans	-62.9	-46.8	175.7	-174.6	176.2	175.3	-171.1	0	111.6	L454 Q481 E482 I483 S488 L489	L454-K485 HydrophobicContact CD1-CD 4.28Å; Q481-K485 VanDerWaalsContact O-CB 3.26Å; Q481-K485 WeakPolarHBondContact O-CB 3.39Å; Q481-K485 PolarHBondContact O-N 2.87Å; E482-K485 PolarHBondContact O-N 2.88Å; I483-K485 VanDerWaalsContact C-N 3.29Å; I483-K485 PolarHBondContact O-N 3.11Å; K485-S488 PolarHBondContact O-N 2.95Å; K485-S488 PolarHBondContact O-OG 3.03Å; K485-L489 HydrophobicContact CG-CD1 4.28Å; K485-L489 WeakPolarHBondContact O-CG 3.37Å; K485-L489 PolarHBondContact O-N 3.46Å
486	F	92	Very high	87.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.2	-51.8	178.2	172.6	-112.3	0	0	0	112	L454 L470 L473 E482 I483 S488 L489 V490 L564 I567	L454-F486 HydrophobicContact CD2-CB 4.1Å; L454-F486 HydrophobicContact CD2-CD2 4.28Å; L470-F486 HydrophobicContact CD2-CE2 3.7Å; L470-F486 HydrophobicContact CD2-CZ 3.76Å; L473-F486 HydrophobicContact CB-CD2 3.72Å; L473-F486 HydrophobicContact CB-CE2 3.56Å; L473-F486 HydrophobicContact CB-CZ 4.3Å; L473-F486 HydrophobicContact CD1-CD2 3.83Å; L473-F486 HydrophobicContact CD1-CE2 3.84Å; L473-F486 HydrophobicContact CG-CD2 4.37Å; L473-F486 HydrophobicContact CG-CE2 4.35Å; E482-F486 VanDerWaalsContact O-CB 3.27Å; E482-F486 WeakPolarHBondContact O-CB 3.15Å; E482-F486 PolarHBondContact O-N 3.21Å; I483-F486 PolarHBondContact O-N 3.19Å; F486-S488 VanDerWaalsContact C-N 3.29Å; F486-S488 PolarHBondContact O-N 2.76Å; F486-L489 PolarHBondContact O-N 2.91Å; F486-L489 VanDerWaalsContact O-N 3.16Å; F486-V490 HydrophobicContact CD2-CG2 4.39Å; F486-V490 HydrophobicContact CE1-CG2 4.37Å; F486-V490 HydrophobicContact CE2-CG2 3.99Å; F486-V490 HydrophobicContact CZ-CG2 3.98Å; F486-V490 WeakPolarHBondContact O-CG2 3.49Å; F486-V490 PolarHBondContact O-N 2.88Å; F486-L564 HydrophobicContact CE1-CD2 4.24Å; F486-I567 HydrophobicContact CD1-CD1 4.34Å; F486-I567 HydrophobicContact CD1-CG1 4.05Å; F486-I567 HydrophobicContact CE1-CG1 3.91Å
487	V	90.7	Very high	85.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.8	-39.7	178.5	175.3	0	0	0	0	110.6	I483 L489 V490 R491 I567 L584 E587 I588	I483-V487 HydrophobicContact CG2-CG2 4.49Å; I483-V487 WeakPolarHBondContact O-CG2 3.29Å; I483-V487 PolarHBondContact O-N 3.32Å; V487-L489 PolarHBondContact O-N 3.43Å; V487-V490 PolarHBondContact O-N 2.92Å; V487-R491 WeakPolarHBondContact O-CB 3.48Å; V487-R491 PolarHBondContact O-N 3.3Å; V487-I567 HydrophobicContact CG2-CG2 4.07Å; V487-L584 HydrophobicContact CB-CD1 4.01Å; V487-L584 HydrophobicContact CG1-CD1 4.04Å; V487-L584 HydrophobicContact CG2-CD1 4.04Å; V487-E587 HydrophobicContact CG1-CG 4.34Å; V487-I588 HydrophobicContact CG1-CG1 4.43Å; V487-I588 HydrophobicContact CG2-CD1 4.38Å; V487-I588 HydrophobicContact CG2-CG1 4.49Å
488	S	89.7	Confident	84.3	Confident	44 Å²	44	51.5 Å²	51.5	31%	0.308	26%	0.255	S	S	.	.	H	α-helix	trans	-62.8	-39.4	176.1	80.8	0	0	0	0	112.9	E484 K485 F486 R491 Q492	E484-S488 VanDerWaalsContact O-CB 3.3Å; E484-S488 WeakPolarHBondContact O-CB 3.34Å; E484-S488 PolarHBondContact O-N 3.07Å; E484-S488 PolarHBondContact O-OG 3.19Å; K485-S488 PolarHBondContact O-N 2.95Å; K485-S488 PolarHBondContact O-OG 3.03Å; F486-S488 VanDerWaalsContact C-N 3.29Å; F486-S488 PolarHBondContact O-N 2.76Å; S488-R491 PolarHBondContact O-N 2.98Å; S488-Q492 WeakPolarHBondContact O-CB 3.33Å; S488-Q492 WeakPolarHBondContact O-CG 3.27Å; S488-Q492 PolarHBondContact O-N 3.42Å
489	L	88.2	Confident	82.6	Confident	20 Å²	20	49 Å²	49	11%	0.105	25%	0.25	C	C	.	.	H	α-helix	trans	-67.1	-43.6	177.2	-73.1	171.8	0	0	0	111.1	L454 F457 P458 K485 F486 V487 R491 Q492 S493	L454-L489 HydrophobicContact CB-CD1 4.37Å; L454-L489 HydrophobicContact CD2-CD1 3.82Å; L454-L489 WeakPolarHBondContact O-CD1 3.26Å; F457-L489 HydrophobicContact CD1-CB 3.94Å; F457-L489 HydrophobicContact CD1-CD1 4.45Å; F457-L489 HydrophobicContact CE1-CB 4.1Å; P458-L489 HydrophobicContact CG-CD2 4.03Å; K485-L489 HydrophobicContact CG-CD1 4.28Å; K485-L489 WeakPolarHBondContact O-CG 3.37Å; K485-L489 PolarHBondContact O-N 3.46Å; F486-L489 PolarHBondContact O-N 2.91Å; F486-L489 VanDerWaalsContact O-N 3.16Å; V487-L489 PolarHBondContact O-N 3.43Å; L489-R491 VanDerWaalsContact C-N 3.34Å; L489-R491 PolarHBondContact O-N 2.87Å; L489-Q492 PolarHBondContact O-N 3.29Å; L489-S493 PolarHBondContact O-N 3Å; L489-S493 PolarHBondContact O-OG 3.11Å
490	V	89.2	Confident	80.5	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.3	-49.4	172.7	174.4	0	0	0	0	109.4	F457 L470 F486 V487 Q492 S493 F494 L560 I591	F457-V490 HydrophobicContact CZ-CG2 4.25Å; L470-V490 HydrophobicContact CD2-CG2 3.98Å; F486-V490 HydrophobicContact CD2-CG2 4.39Å; F486-V490 HydrophobicContact CE1-CG2 4.37Å; F486-V490 HydrophobicContact CE2-CG2 3.99Å; F486-V490 HydrophobicContact CZ-CG2 3.98Å; F486-V490 WeakPolarHBondContact O-CG2 3.49Å; F486-V490 PolarHBondContact O-N 2.88Å; V487-V490 PolarHBondContact O-N 2.92Å; V490-Q492 PolarHBondContact O-N 3.11Å; V490-S493 PolarHBondContact O-N 2.95Å; V490-S493 VanDerWaalsContact O-N 3.11Å; V490-S493 PolarHBondContact O-OG 3.15Å; V490-F494 HydrophobicContact CG1-CD2 4.23Å; V490-F494 HydrophobicContact CG1-CE2 3.8Å; V490-F494 VanDerWaalsContact O-CD2 3.27Å; V490-F494 WeakPolarHBondContact O-CD2 3.22Å; V490-F494 PolarHBondContact O-N 3.3Å; V490-L560 HydrophobicContact CG1-CD1 4.3Å; V490-L560 HydrophobicContact CG1-CD2 4.31Å; V490-I591 HydrophobicContact CG1-CD1 4.49Å
491	R	86.4	Confident	78.6	Confident	62 Å²	62	58 Å²	58	23%	0.234	29%	0.291	C	S	.	.	H	α-helix	trans	-58.8	-43	178.7	-177.7	69.5	-169.4	81.7	-0.4	112.9	V487 S488 L489 S493 F494 G495 E587	V487-R491 WeakPolarHBondContact O-CB 3.48Å; V487-R491 PolarHBondContact O-N 3.3Å; S488-R491 PolarHBondContact O-N 2.98Å; L489-R491 VanDerWaalsContact C-N 3.34Å; L489-R491 PolarHBondContact O-N 2.87Å; R491-S493 VanDerWaalsContact C-N 3.31Å; R491-S493 PolarHBondContact O-N 3.18Å; R491-F494 PolarHBondContact O-N 3.04Å; R491-G495 PolarHBondContact NH1-O 3.03Å; R491-E587 WeakPolarHBondContact CG-OE1 3.37Å
492	Q	85.6	Confident	76.2	Confident	132 Å²	132	58 Å²	58	62%	0.617	29%	0.292	S	S	*	.	H	α-helix	trans	-62.9	-38.1	177.1	-75.1	171.6	17.9	0	0	111.7	S488 L489 V490 F494 G495	S488-Q492 WeakPolarHBondContact O-CB 3.33Å; S488-Q492 WeakPolarHBondContact O-CG 3.27Å; S488-Q492 PolarHBondContact O-N 3.42Å; L489-Q492 PolarHBondContact O-N 3.29Å; V490-Q492 PolarHBondContact O-N 3.11Å; Q492-F494 VanDerWaalsContact C-N 3.25Å; Q492-F494 PolarHBondContact O-N 3.1Å; Q492-G495 PolarHBondContact O-N 3.15Å
493	S	83.5	Confident	73.7	Confident	19 Å²	19	63.4 Å²	63.4	13%	0.133	32%	0.321	C	S	.	.	H	α-helix	trans	-69.3	-18.1	179	72.9	0	0	0	0	114.3	L489 V490 R491 A543 I545	L489-S493 PolarHBondContact O-N 3Å; L489-S493 PolarHBondContact O-OG 3.11Å; V490-S493 PolarHBondContact O-N 2.95Å; V490-S493 VanDerWaalsContact O-N 3.11Å; V490-S493 PolarHBondContact O-OG 3.15Å; R491-S493 VanDerWaalsContact C-N 3.31Å; R491-S493 PolarHBondContact O-N 3.18Å; S493-A543 WeakPolarHBondContact O-CB 3.34Å; S493-I545 WeakPolarHBondContact OG-CD1 3.36Å; S493-I545 WeakPolarHBondContact OG-CG1 3.45Å
494	F	79.9	Confident	71	Confident	4 Å²	4	69.5 Å²	69.5	2%	0.018	35%	0.353	C	S	.	.	H	α-helix	trans	-78.9	-24.7	167.9	-79.2	-86	0	0	0	113.1	V490 R491 Q492 L497 I545 F557 L560 I591 V595	V490-F494 HydrophobicContact CG1-CD2 4.23Å; V490-F494 HydrophobicContact CG1-CE2 3.8Å; V490-F494 VanDerWaalsContact O-CD2 3.27Å; V490-F494 WeakPolarHBondContact O-CD2 3.22Å; V490-F494 PolarHBondContact O-N 3.3Å; R491-F494 PolarHBondContact O-N 3.04Å; Q492-F494 VanDerWaalsContact C-N 3.25Å; Q492-F494 PolarHBondContact O-N 3.1Å; F494-L497 HydrophobicContact CB-CD2 3.87Å; F494-L497 HydrophobicContact CB-CG 4.31Å; F494-L497 HydrophobicContact CD1-CD2 3.81Å; F494-L497 HydrophobicContact CG-CD2 3.95Å; F494-I545 HydrophobicContact CD1-CG2 4Å; F494-I545 HydrophobicContact CD2-CG2 4.15Å; F494-I545 HydrophobicContact CE1-CG2 3.68Å; F494-I545 HydrophobicContact CE2-CG2 3.82Å; F494-I545 HydrophobicContact CG-CG2 4.23Å; F494-I545 HydrophobicContact CZ-CG2 3.57Å; F494-F557 HydrophobicContact CE1-CD1 4.28Å; F494-F557 AromaticContact CE1-CE1 3.58Å; F494-F557 HydrophobicContact CE1-CE1 3.58Å; F494-F557 HydrophobicContact CE1-CZ 4.44Å; F494-F557 HydrophobicContact CZ-CD1 4.06Å; F494-F557 AromaticContact CZ-CE1 3.64Å; F494-F557 HydrophobicContact CZ-CE1 3.64Å; F494-L560 HydrophobicContact CE2-CD2 3.97Å; F494-L560 HydrophobicContact CZ-CD2 3.84Å; F494-I591 HydrophobicContact CD2-CG2 4.34Å; F494-I591 HydrophobicContact CE2-CG2 3.63Å; F494-I591 HydrophobicContact CZ-CG2 3.78Å; F494-V595 HydrophobicContact CE1-CG2 3.91Å; F494-V595 HydrophobicContact CZ-CG2 4.11Å
495	G	73.5	Confident	68.4	Low	29 Å²	29	74.7 Å²	74.7	30%	0.299	38%	0.377	S	S	.	.			trans	67.6	-151.7	-169.7	0	0	0	0	0	112.4	R491 Q492 L497	R491-G495 PolarHBondContact NH1-O 3.03Å; Q492-G495 PolarHBondContact O-N 3.15Å; G495-L497 PolarHBondContact O-N 3.46Å
496	K	69.4	Low	65.6	Low	148 Å²	148	74.6 Å²	74.6	64%	0.643	39%	0.394	S	S	*	.	S	Bend	trans	-63.5	119.5	169.2	-78.8	-173	173.7	-170.7	0	109.1
497	L	64.8	Low	62.6	Low	18 Å²	18	81.5 Å²	81.5	9%	0.094	43%	0.43	C	S	.	.			trans	-71.4	133.4	177.1	-78.4	162.7	0	0	0	108	F494 G495 A499 F590 I591 C594	F494-L497 HydrophobicContact CB-CD2 3.87Å; F494-L497 HydrophobicContact CB-CG 4.31Å; F494-L497 HydrophobicContact CD1-CD2 3.81Å; F494-L497 HydrophobicContact CG-CD2 3.95Å; G495-L497 PolarHBondContact O-N 3.46Å; L497-A499 PolarHBondContact O-N 3.4Å; L497-F590 HydrophobicContact CB-CE1 4.18Å; L497-F590 HydrophobicContact CB-CZ 4.48Å; L497-F590 HydrophobicContact CD1-CD1 3.55Å; L497-F590 HydrophobicContact CD1-CE1 3.33Å; L497-F590 HydrophobicContact CD1-CZ 4.29Å; L497-F590 HydrophobicContact CG-CE1 4.37Å; L497-I591 HydrophobicContact CD1-CG1 4.44Å; L497-C594 HydrophobicContact CD2-CB 3.87Å
498	P	57.7	Low	59.8	Low	54 Å²	54	87.6 Å²	87.6	35%	0.351	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	70.7	177	31	-33.2	0	0	0	109.7	F598	P498-F598 HydrophobicContact CB-CD2 4.46Å; P498-F598 HydrophobicContact CG-CD2 3.57Å; P498-F598 HydrophobicContact CG-CE2 3.89Å
499	A	53	Low	56.8	Low	32 Å²	32	92.7 Å²	92.7	26%	0.264	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-31.5	171	0	0	0	0	0	111.1	L497 F590	L497-A499 PolarHBondContact O-N 3.4Å; A499-F590 HydrophobicContact CB-CE2 4.03Å; A499-F590 HydrophobicContact CB-CZ 3.77Å
500	D	45	Very low	54	Low	125 Å²	125	97.7 Å²	97.7	67%	0.668	52%	0.518	S	S	*	.			trans	-90.5	124.3	-176.7	-65	-31.8	0	0	0	110.7	E502	D500-E502 PolarHBondContact O-N 3.12Å; D500-E502 VanDerWaalsContact O-N 3.15Å
501	K	48.7	Very low	51.1	Low	200 Å²	200	104.8 Å²	104.8	87%	0.87	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-5.9	169.8	-69.6	-177.3	176.2	178.8	0	112.9
502	E	39.6	Very low	48.3	Very low	159 Å²	159	107.8 Å²	107.8	74%	0.743	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	6.9	-168.5	-64.3	-173.3	171.6	0	0	115	D500 D504	D500-E502 PolarHBondContact O-N 3.12Å; D500-E502 VanDerWaalsContact O-N 3.15Å; E502-D504 PolarHBondContact O-N 3.14Å
503	D	38.2	Very low	45.6	Very low	124 Å²	124	109.7 Å²	109.7	66%	0.663	59%	0.587	S	S	*	*	S	Bend	trans	-77.5	75.5	162.1	-87.3	-17.1	0	0	0	108.1
504	D	33.8	Very low	43	Very low	127 Å²	127	113.6 Å²	113.6	68%	0.679	62%	0.621	S	S	*	*			trans	-42	135.9	-178.7	-74.4	-41.8	0	0	0	114.1	E502 A506	E502-D504 PolarHBondContact O-N 3.14Å; D504-A506 PolarHBondContact O-N 3.36Å
505	E	35.7	Very low	40.8	Very low	182 Å²	182	118.6 Å²	118.6	85%	0.85	65%	0.652	S	S	*	*			trans	29.7	40.9	138.9	-60.8	-170.4	160.8	0	0	118.5	N507	E505-N507 PolarHBondContact O-N 3.43Å
506	A	32.2	Very low	39.2	Very low	88 Å²	88	122 Å²	122	73%	0.727	67%	0.67	S	S	*	*			trans	-76.5	69.6	167.1	0	0	0	0	0	108.9	D504 V508	D504-A506 PolarHBondContact O-N 3.36Å; A506-V508 VanDerWaalsContact C-N 3.31Å; A506-V508 PolarHBondContact O-N 3.27Å
507	N	28.9	Very low	37.6	Very low	144 Å²	144	122.8 Å²	122.8	77%	0.77	67%	0.674	S	S	*	*			trans	22.7	63	155.6	-80.9	-18.6	0	0	0	115	E505 E509	E505-N507 PolarHBondContact O-N 3.43Å; N507-E509 PolarHBondContact O-N 2.99Å
508	V	33.2	Very low	36.6	Very low	128 Å²	128	128.7 Å²	128.7	78%	0.776	70%	0.701	S	S	*	*			trans	-92.1	75.6	148.3	-170.4	0	0	0	0	103.9	A506 V510	A506-V508 VanDerWaalsContact C-N 3.31Å; A506-V508 PolarHBondContact O-N 3.27Å; V508-V510 VanDerWaalsContact C-N 3.26Å; V508-V510 PolarHBondContact O-N 3.1Å
509	E	26.4	Very low	35.7	Very low	151 Å²	151	132 Å²	132	71%	0.706	72%	0.715	S	S	*	*			trans	-48.2	109	155.1	-79.9	-176.3	163.3	0	0	104.7	N507 Q511	N507-E509 PolarHBondContact O-N 2.99Å; E509-Q511 PolarHBondContact O-N 2.89Å
510	V	30	Very low	35.1	Very low	126 Å²	126	135.1 Å²	135.1	76%	0.764	73%	0.727	S	S	*	*			trans	-60.5	89.3	167.1	178.8	0	0	0	0	103.3	V508 T512	V508-V510 VanDerWaalsContact C-N 3.26Å; V508-V510 PolarHBondContact O-N 3.1Å; V510-T512 PolarHBondContact O-N 3.05Å
511	Q	26.5	Very low	35	Very low	148 Å²	148	132.2 Å²	132.2	69%	0.692	71%	0.711	S	S	*	*			trans	-56.5	99.8	165.9	-78.6	-177.2	-3.8	0	0	103.7	E509 M513	E509-Q511 PolarHBondContact O-N 2.89Å; Q511-M513 VanDerWaalsContact C-N 3.3Å; Q511-M513 PolarHBondContact O-N 2.84Å
512	T	28.8	Very low	35.1	Very low	126 Å²	126	129.6 Å²	129.6	77%	0.773	72%	0.715	S	S	*	*			trans	-44.4	104.6	167.7	35.3	0	0	0	0	105.4	V510 A514	V510-T512 PolarHBondContact O-N 3.05Å; T512-A514 PolarHBondContact O-N 2.7Å
513	M	29.5	Very low	36.2	Very low	172 Å²	172	128 Å²	128	85%	0.847	71%	0.711	S	S	*	*			trans	-49.2	116	-177.7	-78	175.1	67.3	0	0	106.5	Q511 T515	Q511-M513 VanDerWaalsContact C-N 3.3Å; Q511-M513 PolarHBondContact O-N 2.84Å; M513-T515 PolarHBondContact O-N 3.35Å
514	A	28.5	Very low	36.3	Very low	101 Å²	101	124.1 Å²	124.1	84%	0.835	70%	0.701	S	S	*	*			trans	-56.3	100	166.5	0	0	0	0	0	105.5	T512 S516	T512-A514 PolarHBondContact O-N 2.7Å; A514-S516 PolarHBondContact O-N 3.16Å; A514-S516 VanDerWaalsContact O-N 3.16Å
515	T	33.5	Very low	37.1	Very low	109 Å²	109	121.7 Å²	121.7	67%	0.669	69%	0.691	S	S	*	*			trans	-58.3	121.3	172.9	27.6	0	0	0	0	105.8	M513 K517	M513-T515 PolarHBondContact O-N 3.35Å; T515-K517 PolarHBondContact O-N 3.02Å
516	S	39	Very low	38.2	Very low	99 Å²	99	121.2 Å²	121.2	69%	0.692	68%	0.682	S	S	*	*			trans	-56.4	87.5	172.2	39.8	0	0	0	0	108.6	A514 Q518	A514-S516 PolarHBondContact O-N 3.16Å; A514-S516 VanDerWaalsContact O-N 3.16Å; S516-Q518 PolarHBondContact O-N 2.94Å; S516-Q518 VanDerWaalsContact O-N 3.13Å
517	K	37.2	Very low	38.6	Very low	165 Å²	165	120.1 Å²	120.1	72%	0.717	67%	0.667	S	S	*	*			trans	-73.9	106.9	178.1	-80.7	-175.8	176.6	-179.9	0	108.2	T515 L519	T515-K517 PolarHBondContact O-N 3.02Å; K517-L519 PolarHBondContact O-N 2.79Å
518	Q	43.8	Very low	39.2	Very low	143 Å²	143	119.2 Å²	119.2	67%	0.668	66%	0.659	S	S	*	*			trans	-57.4	112.2	158.4	-76.3	173.5	-19.7	0	0	107.8	S516 M528	S516-Q518 PolarHBondContact O-N 2.94Å; S516-Q518 VanDerWaalsContact O-N 3.13Å; Q518-M528 HydrophobicContact CG-SD 3.9Å
519	L	38.7	Very low	39.4	Very low	122 Å²	122	121.7 Å²	121.7	64%	0.639	66%	0.662	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.5	126.3	169.1	-87.3	153.9	0	0	0	108.2	K517	K517-L519 PolarHBondContact O-N 2.79Å
520	L	40.6	Very low	40.1	Very low	99 Å²	99	120.6 Å²	120.6	52%	0.518	67%	0.666	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.8	121.1	177.6	-173	75.6	0	0	0	107.9	Y526	L520-Y526 HydrophobicContact CD1-CD1 3.98Å; L520-Y526 HydrophobicContact CD1-CD2 4.39Å; L520-Y526 HydrophobicContact CD1-CE1 3.64Å; L520-Y526 HydrophobicContact CD1-CE2 4.07Å; L520-Y526 HydrophobicContact CD1-CG 4.34Å
521	N	42.8	Very low	40.5	Very low	64 Å²	64	119.5 Å²	119.5	34%	0.342	67%	0.67	S	S	.	*			trans	-70.7	157.7	174.4	-70.6	-25.5	0	0	0	110.5	D523 G524 T525 T527	N521-D523 WeakPolarHBondContact CB-OD1 3.49Å; N521-D523 PolarHBondContact O-N 3.47Å; N521-G524 PolarHBondContact O-N 3.22Å; N521-T525 PolarHBondContact N-O 2.94Å; N521-T527 PolarHBondContact ND2-OG1 3.42Å; N521-T527 VanDerWaalsContact ND2-OG1 3.15Å
522	P	50.2	Low	40.8	Very low	145 Å²	145	120.2 Å²	120.2	94%	0.942	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-15	-176.7	-18.4	27.4	0	0	0	115
523	D	62.6	Low	41	Very low	124 Å²	124	119.2 Å²	119.2	66%	0.663	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	3.4	174.2	65.5	-25.4	0	0	0	113.7	N521 T525	N521-D523 WeakPolarHBondContact CB-OD1 3.49Å; N521-D523 PolarHBondContact O-N 3.47Å; D523-T525 PolarHBondContact OD1-OG1 3.04Å; D523-T525 PolarHBondContact OD2-OG1 3.45Å
524	G	40.6	Very low	41.2	Very low	43 Å²	43	115.7 Å²	115.7	44%	0.443	67%	0.674	S	S	.	*	S	Bend	trans	86.3	8.6	171.2	0	0	0	0	0	115.8	N521	N521-G524 PolarHBondContact O-N 3.22Å
525	T	50	Low	41.3	Very low	77 Å²	77	117.1 Å²	117.1	47%	0.472	67%	0.667	S	S	.	*			trans	-93.3	142	173.6	40.3	0	0	0	0	112.7	N521 D523	N521-T525 PolarHBondContact N-O 2.94Å; D523-T525 PolarHBondContact OD1-OG1 3.04Å; D523-T525 PolarHBondContact OD2-OG1 3.45Å
526	Y	59.3	Low	41.4	Very low	171 Å²	171	116.7 Å²	116.7	67%	0.671	67%	0.666	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90.3	122.3	178.6	-61.2	-87.3	0	0	0	110	L520	L520-Y526 HydrophobicContact CD1-CD1 3.98Å; L520-Y526 HydrophobicContact CD1-CD2 4.39Å; L520-Y526 HydrophobicContact CD1-CE1 3.64Å; L520-Y526 HydrophobicContact CD1-CE2 4.07Å; L520-Y526 HydrophobicContact CD1-CG 4.34Å
527	T	40.2	Very low	41.3	Very low	66 Å²	66	118.8 Å²	118.8	41%	0.405	67%	0.67	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-122.1	125.3	173.2	33.7	0	0	0	0	111.5	N521	N521-T527 PolarHBondContact ND2-OG1 3.42Å; N521-T527 VanDerWaalsContact ND2-OG1 3.15Å
528	M	41.1	Very low	41.1	Very low	125 Å²	125	119.8 Å²	119.8	62%	0.616	67%	0.674	S	S	*	*			trans	-94.6	113.6	176.3	-66.3	-70.6	-75.5	0	0	108.9	Q518	Q518-M528 HydrophobicContact CG-SD 3.9Å
529	H	37.7	Very low	40.9	Very low	180 Å²	180	117.3 Å²	117.3	83%	0.833	67%	0.669	S	S	*	*			trans	-91.8	107.3	170.2	-83.1	-73.1	0	0	0	110.2	A531	H529-A531 PolarHBondContact O-N 2.82Å
530	T	40.8	Very low	40.9	Very low	128 Å²	128	115.8 Å²	115.8	79%	0.785	67%	0.668	S	S	*	*			trans	-80.1	100.6	167.9	-16.9	0	0	0	0	108	L532	T530-L532 PolarHBondContact O-N 3.45Å
531	A	38.9	Very low	41.2	Very low	103 Å²	103	121.2 Å²	121.2	85%	0.851	69%	0.688	S	S	*	*			trans	-67.5	99.2	174.9	0	0	0	0	0	109.4	H529 S533	H529-A531 PolarHBondContact O-N 2.82Å; A531-S533 PolarHBondContact O-N 3.5Å
532	L	33.5	Very low	41.7	Very low	162 Å²	162	123.4 Å²	123.4	85%	0.848	69%	0.694	S	S	*	*			trans	-67	106	173.6	-138.1	104.6	0	0	0	108.7	T530	T530-L532 PolarHBondContact O-N 3.45Å
533	S	32.6	Very low	42.7	Very low	105 Å²	105	118.5 Å²	118.5	73%	0.734	67%	0.666	S	S	*	*			trans	-141.5	96.3	153.2	-79.1	0	0	0	0	106.2	A531 L535	A531-S533 PolarHBondContact O-N 3.5Å; S533-L535 PolarHBondContact O-N 3.37Å
534	A	34.1	Very low	43.5	Very low	98 Å²	98	114.1 Å²	114.1	81%	0.81	64%	0.642	S	S	*	*			trans	-63.1	81.1	170.7	0	0	0	0	0	108.4	P536	A534-P536 WeakPolarHBondContact O-CD 3.37Å
535	L	29.7	Very low	45.6	Very low	132 Å²	132	112.1 Å²	112.1	69%	0.691	62%	0.621	S	S	*	*			trans	-62	116.9	159.4	-76.5	159.3	0	0	0	105.2	S533 D537	S533-L535 PolarHBondContact O-N 3.37Å; L535-D537 PolarHBondContact O-N 2.76Å; L535-D537 VanDerWaalsContact O-N 3.16Å
536	P	36	Very low	47.3	Very low	100 Å²	100	112 Å²	112	65%	0.649	61%	0.612	S	S	*	*			trans	-61	126.8	179.9	25.8	-30.8	0	0	0	106.6	A534 K538	A534-P536 WeakPolarHBondContact O-CD 3.37Å; P536-K538 PolarHBondContact O-N 3.03Å
537	D	36.4	Very low	48.4	Very low	143 Å²	143	109.6 Å²	109.6	77%	0.765	61%	0.605	S	S	*	*			trans	-56.1	86	-179.3	-126.4	-33	0	0	0	109.3	L535 T539	L535-D537 PolarHBondContact O-N 2.76Å; L535-D537 VanDerWaalsContact O-N 3.16Å; D537-T539 PolarHBondContact O-N 3.02Å; D537-T539 VanDerWaalsContact O-N 3.1Å; D537-T539 PolarHBondContact OD1-OG1 3.32Å
538	K	33.2	Very low	50.6	Low	186 Å²	186	107.1 Å²	107.1	81%	0.809	59%	0.59	S	S	*	*			trans	-79.4	31.5	170.6	-77.5	-171	178.3	-179.2	0	109.6	P536 S540	P536-K538 PolarHBondContact O-N 3.03Å; K538-S540 PolarHBondContact O-N 2.96Å
539	T	39.3	Very low	52.8	Low	91 Å²	91	101.5 Å²	101.5	56%	0.558	56%	0.562	S	S	*	*			trans	-69.5	70.9	158	36	0	0	0	0	107.9	D537 K541	D537-T539 PolarHBondContact O-N 3.02Å; D537-T539 VanDerWaalsContact O-N 3.1Å; D537-T539 PolarHBondContact OD1-OG1 3.32Å; T539-K541 PolarHBondContact O-N 2.98Å
540	S	39.1	Very low	55.1	Low	89 Å²	89	96.5 Å²	96.5	62%	0.622	54%	0.536	S	S	*	.			trans	-40.7	97.6	171.7	56.6	0	0	0	0	110.8	K538 K542	K538-S540 PolarHBondContact O-N 2.96Å; S540-K542 WeakPolarHBondContact O-CA 3.31Å; S540-K542 WeakPolarHBondContact O-CG 3.35Å; S540-K542 PolarHBondContact O-N 3.13Å
541	K	47.6	Very low	57.2	Low	214 Å²	214	92.8 Å²	92.8	93%	0.93	51%	0.511	S	S	*	.			trans	16.3	56.3	166.8	-65.1	-176.4	177.4	-177.4	0	114.5	T539 A543	T539-K541 PolarHBondContact O-N 2.98Å; K541-A543 PolarHBondContact O-N 2.78Å
542	K	53.5	Low	59.3	Low	109 Å²	109	88.3 Å²	88.3	47%	0.474	48%	0.475	S	S	.	.			trans	-71	127.4	-178.9	-74.5	-174.9	-179.6	177.7	0	105.2	S540 L544	S540-K542 WeakPolarHBondContact O-CA 3.31Å; S540-K542 WeakPolarHBondContact O-CG 3.35Å; S540-K542 PolarHBondContact O-N 3.13Å; K542-L544 PolarHBondContact O-N 3.46Å
543	A	71.5	Confident	61.9	Low	42 Å²	42	83.1 Å²	83.1	35%	0.347	45%	0.449	S	S	.	.			trans	-53	139.2	174.7	0	0	0	0	0	109.9	S493 K541 I545 R546 K547	S493-A543 WeakPolarHBondContact O-CB 3.34Å; K541-A543 PolarHBondContact O-N 2.78Å; A543-I545 VanDerWaalsContact C-N 3.31Å; A543-I545 PolarHBondContact O-N 2.95Å; A543-R546 WeakPolarHBondContact O-CA 3.17Å; A543-R546 WeakPolarHBondContact O-CB 3.39Å; A543-R546 PolarHBondContact O-N 3.13Å; A543-K547 PolarHBondContact O-N 2.93Å
544	L	79.3	Confident	64.6	Low	33 Å²	33	78.4 Å²	78.4	17%	0.173	42%	0.415	C	S	.	.	H	α-helix	trans	-52.3	-45.6	-168.5	177.3	61.1	0	0	0	112.9	M460 Q461 L466 K542 R546 K547 L548	M460-L544 WeakPolarHBondContact O-CD2 3.27Å; Q461-L544 VanDerWaalsContact C-CD2 3.43Å; Q461-L544 VanDerWaalsContact O-CD1 3.23Å; Q461-L544 WeakPolarHBondContact O-CD1 3.46Å; L466-L544 HydrophobicContact CB-CD2 4.16Å; L466-L544 HydrophobicContact CD2-CD2 3.88Å; L466-L544 HydrophobicContact CD2-CG 4.32Å; K542-L544 PolarHBondContact O-N 3.46Å; L544-R546 VanDerWaalsContact C-N 3.27Å; L544-R546 PolarHBondContact O-N 3.25Å; L544-K547 WeakPolarHBondContact O-CA 3.43Å; L544-K547 WeakPolarHBondContact O-CB 3.39Å; L544-K547 PolarHBondContact O-N 3.23Å; L544-L548 HydrophobicContact CD1-CG 4.45Å; L544-L548 HydrophobicContact CG-CD1 4.25Å; L544-L548 WeakPolarHBondContact O-CG 3.3Å; L544-L548 PolarHBondContact O-N 3.47Å
545	I	84.7	Confident	67.2	Low	1 Å²	1	79 Å²	79	1%	0.005	40%	0.399	C	S	.	.	H	α-helix	trans	-59.2	-40.2	179.1	-59	-158.7	0	0	0	111.5	L466 S493 F494 A543 K547 L548 L549 F556 F557	L466-I545 HydrophobicContact CD2-CD1 3.87Å; L466-I545 HydrophobicContact CD2-CG1 3.53Å; S493-I545 WeakPolarHBondContact OG-CD1 3.36Å; S493-I545 WeakPolarHBondContact OG-CG1 3.45Å; F494-I545 HydrophobicContact CD1-CG2 4Å; F494-I545 HydrophobicContact CD2-CG2 4.15Å; F494-I545 HydrophobicContact CE1-CG2 3.68Å; F494-I545 HydrophobicContact CE2-CG2 3.82Å; F494-I545 HydrophobicContact CG-CG2 4.23Å; F494-I545 HydrophobicContact CZ-CG2 3.57Å; A543-I545 VanDerWaalsContact C-N 3.31Å; A543-I545 PolarHBondContact O-N 2.95Å; I545-K547 VanDerWaalsContact C-N 3.33Å; I545-K547 PolarHBondContact O-N 2.65Å; I545-L548 PolarHBondContact O-N 2.89Å; I545-L549 PolarHBondContact O-N 3.37Å; I545-F556 HydrophobicContact CD1-CE1 4.24Å; I545-F556 HydrophobicContact CD1-CZ 4.13Å; I545-F556 HydrophobicContact CG1-CE1 4.34Å; I545-F556 HydrophobicContact CG1-CZ 4.28Å; I545-F556 HydrophobicContact CG2-CE1 4.3Å; I545-F557 HydrophobicContact CG2-CE1 3.61Å; I545-F557 HydrophobicContact CG2-CZ 4Å
546	R	84.3	Confident	70.1	Confident	75 Å²	75	72.8 Å²	72.8	28%	0.283	37%	0.367	S	S	.	.	H	α-helix	trans	-64.4	-39.3	176.1	-170.2	171.8	-172.7	174.3	1	111.5	A543 L544 L549 Y550	A543-R546 WeakPolarHBondContact O-CA 3.17Å; A543-R546 WeakPolarHBondContact O-CB 3.39Å; A543-R546 PolarHBondContact O-N 3.13Å; L544-R546 VanDerWaalsContact C-N 3.27Å; L544-R546 PolarHBondContact O-N 3.25Å; R546-L549 PolarHBondContact O-N 2.93Å; R546-Y550 HydrophobicContact CG-CD2 4.09Å; R546-Y550 HydrophobicContact CG-CE2 3.74Å; R546-Y550 WeakPolarHBondContact O-CD2 3.45Å; R546-Y550 PolarHBondContact O-N 3.33Å
547	K	83.8	Confident	72.8	Confident	119 Å²	119	68.2 Å²	68.2	52%	0.517	34%	0.337	S	S	.	.	H	α-helix	trans	-60.5	-47.1	174.2	-176.7	-175.7	173	-172.3	0	110.9	A543 L544 I545 L549 Y550 D551	A543-K547 PolarHBondContact O-N 2.93Å; L544-K547 WeakPolarHBondContact O-CA 3.43Å; L544-K547 WeakPolarHBondContact O-CB 3.39Å; L544-K547 PolarHBondContact O-N 3.23Å; I545-K547 VanDerWaalsContact C-N 3.33Å; I545-K547 PolarHBondContact O-N 2.65Å; K547-L549 VanDerWaalsContact C-N 3.27Å; K547-L549 PolarHBondContact O-N 3.37Å; K547-Y550 PolarHBondContact O-N 2.95Å; K547-Y550 VanDerWaalsContact O-N 3.15Å; K547-D551 WeakPolarHBondContact CG-OD2 3.41Å; K547-D551 PolarHBondContact O-N 3.13Å
548	L	86	Confident	75.4	Confident	15 Å²	15	61.7 Å²	61.7	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-59.9	-35.8	177.6	-64.2	172.1	0	0	0	112.9	A463 L544 I545 D551 G552 D553 F556 F557	A463-L548 HydrophobicContact CB-CD1 3.78Å; A463-L548 HydrophobicContact CB-CD2 3.57Å; A463-L548 HydrophobicContact CB-CG 4.3Å; L544-L548 HydrophobicContact CD1-CG 4.45Å; L544-L548 HydrophobicContact CG-CD1 4.25Å; L544-L548 WeakPolarHBondContact O-CG 3.3Å; L544-L548 PolarHBondContact O-N 3.47Å; I545-L548 PolarHBondContact O-N 2.89Å; L548-D551 PolarHBondContact O-N 3.02Å; L548-G552 PolarHBondContact O-N 2.75Å; L548-D553 HydrophobicContact CB-CB 4.49Å; L548-D553 HydrophobicContact CD2-CB 4.3Å; L548-D553 PolarHBondContact O-N 2.85Å; L548-D553 VanDerWaalsContact O-N 3.16Å; L548-F556 HydrophobicContact CD1-CD1 4.06Å; L548-F556 HydrophobicContact CD1-CD2 4.1Å; L548-F556 HydrophobicContact CD1-CE1 4.11Å; L548-F556 HydrophobicContact CD1-CE2 4.14Å; L548-F556 HydrophobicContact CD1-CG 4.07Å; L548-F556 HydrophobicContact CD1-CZ 4.15Å; L548-F557 HydrophobicContact CB-CE2 4.21Å; L548-F557 HydrophobicContact CB-CZ 4.19Å
549	L	86.5	Confident	78.2	Confident	6 Å²	6	53.8 Å²	53.8	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-43.8	175.9	-172.2	63.8	0	0	0	112	I545 R546 K547 G552 F557 V595 F598 A604	I545-L549 PolarHBondContact O-N 3.37Å; R546-L549 PolarHBondContact O-N 2.93Å; K547-L549 VanDerWaalsContact C-N 3.27Å; K547-L549 PolarHBondContact O-N 3.37Å; L549-G552 PolarHBondContact O-N 2.95Å; L549-F557 HydrophobicContact CB-CE2 4.01Å; L549-F557 HydrophobicContact CB-CZ 3.64Å; L549-F557 HydrophobicContact CD1-CD2 4.37Å; L549-F557 HydrophobicContact CD1-CE1 4.39Å; L549-F557 HydrophobicContact CD1-CE2 3.91Å; L549-F557 HydrophobicContact CD1-CZ 3.92Å; L549-F557 HydrophobicContact CG-CZ 4.36Å; L549-V595 HydrophobicContact CD1-CG1 4.39Å; L549-V595 HydrophobicContact CD1-CG2 4.4Å; L549-F598 HydrophobicContact CD1-CB 4.27Å; L549-F598 HydrophobicContact CD1-CD1 3.68Å; L549-F598 HydrophobicContact CD1-CE1 4.3Å; L549-F598 HydrophobicContact CD1-CG 4.09Å; L549-F598 HydrophobicContact CD2-CD1 4.1Å; L549-F598 HydrophobicContact CD2-CD2 4.18Å; L549-F598 HydrophobicContact CD2-CE1 4.36Å; L549-F598 HydrophobicContact CD2-CE2 4.43Å; L549-F598 HydrophobicContact CD2-CG 4Å; L549-F598 HydrophobicContact CG-CD1 3.55Å; L549-F598 HydrophobicContact CG-CE1 3.72Å; L549-F598 HydrophobicContact CG-CG 3.97Å; L549-F598 HydrophobicContact CG-CZ 4.28Å; L549-F598 WeakPolarHBondContact O-CE1 3.4Å; L549-A604 WeakPolarHBondContact O-CB 3.38Å
550	Y	85.9	Confident	80.8	Confident	75 Å²	75	49.6 Å²	49.6	29%	0.294	25%	0.245	S	C	.	.	H	α-helix	trans	-71.9	-36.2	176.6	-76.2	-74.3	0	0	0	112.6	R546 K547 G552 F598 A604 K605	R546-Y550 HydrophobicContact CG-CD2 4.09Å; R546-Y550 HydrophobicContact CG-CE2 3.74Å; R546-Y550 WeakPolarHBondContact O-CD2 3.45Å; R546-Y550 PolarHBondContact O-N 3.33Å; K547-Y550 PolarHBondContact O-N 2.95Å; K547-Y550 VanDerWaalsContact O-N 3.15Å; Y550-G552 PolarHBondContact O-N 3.25Å; Y550-F598 HydrophobicContact CD1-CE1 4.48Å; Y550-F598 AromaticContact CD1-CZ 3.7Å; Y550-F598 HydrophobicContact CD1-CZ 3.7Å; Y550-F598 HydrophobicContact CE1-CE2 4.17Å; Y550-F598 AromaticContact CE1-CZ 3.67Å; Y550-F598 HydrophobicContact CE1-CZ 3.67Å; Y550-F598 HydrophobicContact CG-CZ 4.35Å; Y550-A604 WeakPolarHBondContact O-CA 3.44Å; Y550-K605 PolarHBondContact O-N 3.49Å
551	D	84.9	Confident	83.4	Confident	50 Å²	50	45.5 Å²	45.5	27%	0.267	22%	0.216	S	C	.	.	H	α-helix	trans	-70.5	-21	176.3	-70.8	-25.8	0	0	0	112	K547 L548 K605	K547-D551 WeakPolarHBondContact CG-OD2 3.41Å; K547-D551 PolarHBondContact O-N 3.13Å; L548-D551 PolarHBondContact O-N 3.02Å; D551-K605 IonicContact OD1-NZ 3.33Å; D551-K605 PolarHBondContact OD1-NZ 3.08Å
552	G	83.8	Confident	85.5	Confident	9 Å²	9	36.4 Å²	36.4	9%	0.093	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.2	32	174.4	0	0	0	0	0	113.8	L548 L549 Y550 F554	L548-G552 PolarHBondContact O-N 2.75Å; L549-G552 PolarHBondContact O-N 2.95Å; Y550-G552 PolarHBondContact O-N 3.25Å; G552-F554 WeakPolarHBondContact O-CD2 3.32Å; G552-F554 PolarHBondContact O-N 3.35Å
553	D	87.3	Confident	87.4	Confident	54 Å²	54	31.7 Å²	31.7	29%	0.289	16%	0.16	S	C	.	.			trans	-76.2	73.2	171.7	-173.8	-2.3	0	0	0	110.5	L548 F555 F556 F557	L548-D553 HydrophobicContact CB-CB 4.49Å; L548-D553 HydrophobicContact CD2-CB 4.3Å; L548-D553 PolarHBondContact O-N 2.85Å; L548-D553 VanDerWaalsContact O-N 3.16Å; D553-F555 VanDerWaalsContact C-N 3.27Å; D553-F555 PolarHBondContact O-N 2.85Å; D553-F556 HydrophobicContact CB-CB 4.45Å; D553-F556 WeakPolarHBondContact O-CB 3.27Å; D553-F556 PolarHBondContact O-N 3.28Å; D553-F556 PolarHBondContact OD1-N 2.99Å; D553-F557 WeakPolarHBondContact O-CD2 3.4Å
554	F	89.3	Confident	88.4	Confident	5 Å²	5	29.8 Å²	29.8	2%	0.022	14%	0.143	C	C	.	.	H	α-helix	trans	-71.1	-20.7	-176.2	-66.9	-71.1	0	0	0	114.2	G552 F556 F557 A558 G599 A604 C606 L608 D612	G552-F554 WeakPolarHBondContact O-CD2 3.32Å; G552-F554 PolarHBondContact O-N 3.35Å; F554-F556 VanDerWaalsContact C-N 3.33Å; F554-F557 HydrophobicContact CD1-CD2 4.47Å; F554-F557 PolarHBondContact O-N 3.49Å; F554-F557 VanDerWaalsContact O-N 3.14Å; F554-A558 PolarHBondContact O-N 3.41Å; F554-G599 VanDerWaalsContact CZ-CA 3.46Å; F554-A604 HydrophobicContact CE2-CB 4.01Å; F554-A604 HydrophobicContact CZ-CB 3.67Å; F554-C606 WeakPolarHBondContact CE2-O 3.31Å; F554-L608 HydrophobicContact CB-CD1 3.61Å; F554-L608 HydrophobicContact CD1-CB 4.37Å; F554-L608 HydrophobicContact CD1-CD1 3.48Å; F554-L608 VanDerWaalsContact CD1-CD1 3.48Å; F554-L608 HydrophobicContact CD1-CG 4.46Å; F554-L608 VanDerWaalsContact CD2-CA 3.43Å; F554-L608 HydrophobicContact CD2-CB 4.05Å; F554-L608 HydrophobicContact CD2-CD1 4.09Å; F554-L608 HydrophobicContact CE1-CB 4.31Å; F554-L608 HydrophobicContact CE1-CD1 4.15Å; F554-L608 HydrophobicContact CE2-CB 3.98Å; F554-L608 HydrophobicContact CG-CB 4.23Å; F554-L608 HydrophobicContact CG-CD1 3.44Å; F554-L608 VanDerWaalsContact CG-CD1 3.44Å; F554-L608 HydrophobicContact CG-CG 4.43Å; F554-L608 HydrophobicContact CZ-CB 4.12Å; F554-D612 HydrophobicContact CB-CB 4.03Å
555	F	89.1	Confident	89	Confident	110 Å²	110	28.2 Å²	28.2	48%	0.482	14%	0.135	S	C	.	.	H	α-helix	trans	-64.4	-39.7	173.7	175.6	-117.4	0	0	0	111.7	R467 D553 F557 A558 S559	R467-F555 VanDerWaalsContact CZ-CZ 3.47Å; R467-F555 VanDerWaalsContact NH1-CZ 3.31Å; D553-F555 VanDerWaalsContact C-N 3.27Å; D553-F555 PolarHBondContact O-N 2.85Å; F555-F557 VanDerWaalsContact C-N 3.32Å; F555-F557 PolarHBondContact O-N 3.43Å; F555-A558 PolarHBondContact O-N 3.37Å; F555-S559 PolarHBondContact O-N 3.39Å; F555-S559 VanDerWaalsContact O-N 3.1Å; F555-S559 PolarHBondContact O-OG 2.82Å
556	F	90.8	Very high	89.3	Confident	3 Å²	3	28.6 Å²	28.6	1%	0.013	14%	0.137	C	C	.	.	H	α-helix	trans	-56.7	-46.6	169.8	174.7	-90.2	0	0	0	111.2	L466 R467 L470 I545 L548 D553 F554 S559 L560	L466-F556 HydrophobicContact CB-CE2 4.3Å; L466-F556 HydrophobicContact CD2-CE2 3.94Å; L466-F556 HydrophobicContact CD2-CZ 3.58Å; L466-F556 HydrophobicContact CG-CE2 4.17Å; L466-F556 HydrophobicContact CG-CZ 4.15Å; R467-F556 HydrophobicContact CB-CD2 4.04Å; R467-F556 HydrophobicContact CB-CE2 4.1Å; R467-F556 HydrophobicContact CG-CD2 4.49Å; L470-F556 HydrophobicContact CD1-CE1 4.44Å; L470-F556 HydrophobicContact CD1-CE2 3.83Å; L470-F556 HydrophobicContact CD1-CZ 3.48Å; L470-F556 VanDerWaalsContact CD1-CZ 3.48Å; I545-F556 HydrophobicContact CD1-CE1 4.24Å; I545-F556 HydrophobicContact CD1-CZ 4.13Å; I545-F556 HydrophobicContact CG1-CE1 4.34Å; I545-F556 HydrophobicContact CG1-CZ 4.28Å; I545-F556 HydrophobicContact CG2-CE1 4.3Å; L548-F556 HydrophobicContact CD1-CD1 4.06Å; L548-F556 HydrophobicContact CD1-CD2 4.1Å; L548-F556 HydrophobicContact CD1-CE1 4.11Å; L548-F556 HydrophobicContact CD1-CE2 4.14Å; L548-F556 HydrophobicContact CD1-CG 4.07Å; L548-F556 HydrophobicContact CD1-CZ 4.15Å; D553-F556 HydrophobicContact CB-CB 4.45Å; D553-F556 WeakPolarHBondContact O-CB 3.27Å; D553-F556 PolarHBondContact O-N 3.28Å; D553-F556 PolarHBondContact OD1-N 2.99Å; F554-F556 VanDerWaalsContact C-N 3.33Å; F556-S559 WeakPolarHBondContact O-CB 3.46Å; F556-S559 PolarHBondContact O-N 2.91Å; F556-L560 HydrophobicContact CE1-CD2 4.43Å; F556-L560 PolarHBondContact O-N 2.87Å
557	F	91.9	Very high	89.6	Confident	4 Å²	4	25 Å²	25	2%	0.018	12%	0.124	C	C	.	.	H	α-helix	trans	-73.2	-33	-178	-66.2	-73.9	0	0	0	114.4	F494 I545 L548 L549 D553 F554 F555 S559 L560 A561 V595 I616	F494-F557 HydrophobicContact CE1-CD1 4.28Å; F494-F557 AromaticContact CE1-CE1 3.58Å; F494-F557 HydrophobicContact CE1-CE1 3.58Å; F494-F557 HydrophobicContact CE1-CZ 4.44Å; F494-F557 HydrophobicContact CZ-CD1 4.06Å; F494-F557 AromaticContact CZ-CE1 3.64Å; F494-F557 HydrophobicContact CZ-CE1 3.64Å; I545-F557 HydrophobicContact CG2-CE1 3.61Å; I545-F557 HydrophobicContact CG2-CZ 4Å; L548-F557 HydrophobicContact CB-CE2 4.21Å; L548-F557 HydrophobicContact CB-CZ 4.19Å; L549-F557 HydrophobicContact CB-CE2 4.01Å; L549-F557 HydrophobicContact CB-CZ 3.64Å; L549-F557 HydrophobicContact CD1-CD2 4.37Å; L549-F557 HydrophobicContact CD1-CE1 4.39Å; L549-F557 HydrophobicContact CD1-CE2 3.91Å; L549-F557 HydrophobicContact CD1-CZ 3.92Å; L549-F557 HydrophobicContact CG-CZ 4.36Å; D553-F557 WeakPolarHBondContact O-CD2 3.4Å; F554-F557 HydrophobicContact CD1-CD2 4.47Å; F554-F557 PolarHBondContact O-N 3.49Å; F554-F557 VanDerWaalsContact O-N 3.14Å; F555-F557 VanDerWaalsContact C-N 3.32Å; F555-F557 PolarHBondContact O-N 3.43Å; F557-S559 VanDerWaalsContact C-N 3.26Å; F557-S559 PolarHBondContact O-N 3.46Å; F557-L560 HydrophobicContact CD1-CD2 4.17Å; F557-L560 PolarHBondContact O-N 3.18Å; F557-A561 WeakPolarHBondContact O-CB 3.33Å; F557-A561 PolarHBondContact O-N 2.97Å; F557-V595 HydrophobicContact CB-CG1 3.63Å; F557-V595 HydrophobicContact CD1-CG1 4.11Å; F557-V595 HydrophobicContact CD1-CG2 3.76Å; F557-V595 HydrophobicContact CD2-CG1 4.35Å; F557-V595 HydrophobicContact CE1-CG2 4.24Å; F557-V595 HydrophobicContact CG-CG1 3.77Å; F557-V595 HydrophobicContact CG-CG2 4.28Å; F557-I616 HydrophobicContact CB-CD1 4.42Å
558	A	92.3	Very high	90	Very high	6 Å²	6	19.4 Å²	19.4	5%	0.05	10%	0.099	C	C	.	.	H	α-helix	trans	-63.2	-36.9	171.4	0	0	0	0	0	111.3	F554 F555 S562 D612 R615 I616	F554-A558 PolarHBondContact O-N 3.41Å; F555-A558 PolarHBondContact O-N 3.37Å; A558-S562 PolarHBondContact O-N 3.04Å; A558-S562 PolarHBondContact O-OG 2.79Å; A558-S562 VanDerWaalsContact O-OG 3.11Å; A558-D612 HydrophobicContact CB-CB 4.06Å; A558-R615 HydrophobicContact CB-CB 4.26Å; A558-R615 HydrophobicContact CB-CG 4.22Å; A558-I616 HydrophobicContact CB-CG1 4.3Å
559	S	92.2	Very high	90.2	Very high	19 Å²	19	19.1 Å²	19.1	13%	0.133	10%	0.097	C	C	.	.	H	α-helix	trans	-65.9	-45.4	170.9	-54.4	0	0	0	0	111	R467 F555 F556 F557 A561 S562 M563	R467-S559 VanDerWaalsContact CZ-OG 3.28Å; R467-S559 PolarHBondContact NE-OG 2.81Å; R467-S559 PolarHBondContact NH2-OG 3.42Å; F555-S559 PolarHBondContact O-N 3.39Å; F555-S559 VanDerWaalsContact O-N 3.1Å; F555-S559 PolarHBondContact O-OG 2.82Å; F556-S559 WeakPolarHBondContact O-CB 3.46Å; F556-S559 PolarHBondContact O-N 2.91Å; F557-S559 VanDerWaalsContact C-N 3.26Å; F557-S559 PolarHBondContact O-N 3.46Å; S559-A561 PolarHBondContact O-N 3.19Å; S559-S562 WeakPolarHBondContact O-CB 3.5Å; S559-S562 PolarHBondContact O-N 2.85Å; S559-M563 WeakPolarHBondContact O-CG 3.44Å; S559-M563 PolarHBondContact O-N 3.07Å
560	L	93.1	Very high	90.4	Very high	3 Å²	3	20.1 Å²	20.1	2%	0.016	10%	0.101	C	C	.	.	H	α-helix	trans	-59.8	-43.3	177.7	-179.9	63.5	0	0	0	112.4	L470 V490 F494 F556 F557 S562 M563 L564	L470-L560 HydrophobicContact CD1-CD1 3.98Å; L470-L560 HydrophobicContact CD2-CD1 4.07Å; V490-L560 HydrophobicContact CG1-CD1 4.3Å; V490-L560 HydrophobicContact CG1-CD2 4.31Å; F494-L560 HydrophobicContact CE2-CD2 3.97Å; F494-L560 HydrophobicContact CZ-CD2 3.84Å; F556-L560 HydrophobicContact CE1-CD2 4.43Å; F556-L560 PolarHBondContact O-N 2.87Å; F557-L560 HydrophobicContact CD1-CD2 4.17Å; F557-L560 PolarHBondContact O-N 3.18Å; L560-S562 VanDerWaalsContact C-N 3.31Å; L560-S562 PolarHBondContact O-N 3.19Å; L560-M563 HydrophobicContact CB-CE 4.31Å; L560-M563 HydrophobicContact CD1-CE 4.42Å; L560-M563 WeakPolarHBondContact O-CB 3.41Å; L560-M563 PolarHBondContact O-N 2.92Å; L560-M563 VanDerWaalsContact O-N 3.13Å; L560-L564 HydrophobicContact CD1-CD1 4.28Å; L560-L564 HydrophobicContact CD1-CD2 4.5Å; L560-L564 HydrophobicContact CD1-CG 4.06Å; L560-L564 HydrophobicContact CG-CD1 4.03Å; L560-L564 HydrophobicContact CG-CG 4.24Å; L560-L564 WeakPolarHBondContact O-CG 3.47Å; L560-L564 PolarHBondContact O-N 3.25Å
561	A	93.2	Very high	90.6	Very high	3 Å²	3	16.7 Å²	16.7	3%	0.025	9%	0.087	C	C	.	.	H	α-helix	trans	-59.2	-43	175.7	0	0	0	0	0	111.5	F557 S559 M563 L564 T565 E592 I616 C619	F557-A561 WeakPolarHBondContact O-CB 3.33Å; F557-A561 PolarHBondContact O-N 2.97Å; S559-A561 PolarHBondContact O-N 3.19Å; A561-M563 VanDerWaalsContact C-N 3.32Å; A561-M563 PolarHBondContact O-N 3.42Å; A561-L564 PolarHBondContact O-N 3.39Å; A561-T565 WeakPolarHBondContact O-CB 3.43Å; A561-T565 PolarHBondContact O-N 3.26Å; A561-T565 PolarHBondContact O-OG1 2.86Å; A561-E592 WeakPolarHBondContact CA-OE1 3.5Å; A561-E592 HydrophobicContact CB-CG 4.07Å; A561-I616 HydrophobicContact CB-CG1 4.13Å; A561-C619 HydrophobicContact CB-CB 3.82Å
562	S	91.9	Very high	90.7	Very high	24 Å²	24	15.9 Å²	15.9	17%	0.168	9%	0.085	C	C	.	.	H	α-helix	trans	-62.5	-39.3	175.3	-57.7	0	0	0	0	112.1	A558 S559 L560 K566 R615	A558-S562 PolarHBondContact O-N 3.04Å; A558-S562 PolarHBondContact O-OG 2.79Å; A558-S562 VanDerWaalsContact O-OG 3.11Å; S559-S562 WeakPolarHBondContact O-CB 3.5Å; S559-S562 PolarHBondContact O-N 2.85Å; L560-S562 VanDerWaalsContact C-N 3.31Å; L560-S562 PolarHBondContact O-N 3.19Å; S562-K566 PolarHBondContact O-N 3.29Å; S562-K566 VanDerWaalsContact O-N 3.12Å; S562-R615 PolarHBondContact OG-NE 3Å; S562-R615 PolarHBondContact OG-NH2 2.94Å
563	M	92.8	Very high	90.8	Very high	10 Å²	10	21.1 Å²	21.1	5%	0.049	10%	0.102	C	C	.	.	H	α-helix	trans	-69.6	-41.3	177.9	-69.5	-177	-70.2	0	0	112.5	L470 W471 S559 L560 A561 K566 I567	L470-M563 HydrophobicContact CB-CE 3.46Å; L470-M563 VanDerWaalsContact CB-CE 3.46Å; L470-M563 HydrophobicContact CB-SD 3.55Å; L470-M563 VanDerWaalsContact CB-SD 3.55Å; L470-M563 HydrophobicContact CD1-CE 3.88Å; L470-M563 HydrophobicContact CG-CE 4.28Å; W471-M563 WeakPolarHBondContact CA-SD 3.47Å; W471-M563 HydrophobicContact CB-SD 3.83Å; W471-M563 PolarHBondContact N-SD 3Å; S559-M563 WeakPolarHBondContact O-CG 3.44Å; S559-M563 PolarHBondContact O-N 3.07Å; L560-M563 HydrophobicContact CB-CE 4.31Å; L560-M563 HydrophobicContact CD1-CE 4.42Å; L560-M563 WeakPolarHBondContact O-CB 3.41Å; L560-M563 PolarHBondContact O-N 2.92Å; L560-M563 VanDerWaalsContact O-N 3.13Å; A561-M563 VanDerWaalsContact C-N 3.32Å; A561-M563 PolarHBondContact O-N 3.42Å; M563-K566 WeakPolarHBondContact O-CB 3.45Å; M563-K566 PolarHBondContact O-N 3.3Å; M563-I567 PolarHBondContact O-N 3.15Å; M563-I567 VanDerWaalsContact O-N 3.11Å
564	L	93.1	Very high	90.8	Very high	1 Å²	1	22 Å²	22	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-68.4	-38.8	175.7	-69.3	176.7	0	0	0	111.7	F486 L560 A561 K566 I567 A568 I588 I591	F486-L564 HydrophobicContact CE1-CD2 4.24Å; L560-L564 HydrophobicContact CD1-CD1 4.28Å; L560-L564 HydrophobicContact CD1-CD2 4.5Å; L560-L564 HydrophobicContact CD1-CG 4.06Å; L560-L564 HydrophobicContact CG-CD1 4.03Å; L560-L564 HydrophobicContact CG-CG 4.24Å; L560-L564 WeakPolarHBondContact O-CG 3.47Å; L560-L564 PolarHBondContact O-N 3.25Å; A561-L564 PolarHBondContact O-N 3.39Å; L564-K566 VanDerWaalsContact C-N 3.31Å; L564-K566 PolarHBondContact O-N 3.21Å; L564-I567 PolarHBondContact O-N 3.34Å; L564-A568 WeakPolarHBondContact O-CB 3.38Å; L564-A568 PolarHBondContact O-N 3.08Å; L564-I588 HydrophobicContact CB-CG2 3.75Å; L564-I588 HydrophobicContact CD1-CG2 4.44Å; L564-I591 HydrophobicContact CD1-CB 4.49Å; L564-I591 HydrophobicContact CD1-CG2 4.04Å
565	T	92	Very high	90.5	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-58.9	-43.2	173	-63.4	0	0	0	0	111.2	A561 I567 A568 F569 C619 L622 V623 F634	A561-T565 WeakPolarHBondContact O-CB 3.43Å; A561-T565 PolarHBondContact O-N 3.26Å; A561-T565 PolarHBondContact O-OG1 2.86Å; T565-I567 PolarHBondContact O-N 2.96Å; T565-A568 WeakPolarHBondContact O-CB 3.47Å; T565-A568 PolarHBondContact O-N 3.15Å; T565-F569 HydrophobicContact CG2-CD2 3.91Å; T565-F569 HydrophobicContact CG2-CE2 3.47Å; T565-F569 VanDerWaalsContact CG2-CE2 3.47Å; T565-F569 HydrophobicContact CG2-CZ 4.23Å; T565-F569 VanDerWaalsContact O-CD2 3.3Å; T565-F569 WeakPolarHBondContact O-CD2 3.43Å; T565-F569 PolarHBondContact O-N 3.44Å; T565-C619 VanDerWaalsContact OG1-CB 3.25Å; T565-C619 WeakPolarHBondContact OG1-CB 3.41Å; T565-L622 HydrophobicContact CG2-CB 4.13Å; T565-L622 HydrophobicContact CG2-CD1 4.44Å; T565-V623 HydrophobicContact CG2-CG2 4.09Å; T565-F634 HydrophobicContact CG2-CD1 4.41Å; T565-F634 HydrophobicContact CG2-CE1 4.13Å; T565-F634 HydrophobicContact CG2-CZ 4.22Å
566	K	91.4	Very high	90.1	Very high	10 Å²	10	25.7 Å²	25.7	4%	0.043	13%	0.126	C	C	.	.	H	α-helix	trans	-60.5	-44.4	174.8	-174.1	172.2	-179.7	135.1	0	112	E475 S562 M563 L564 F569 R570 F634 L635	E475-K566 WeakPolarHBondContact OE1-CE 3.44Å; E475-K566 IonicContact OE1-NZ 2.91Å; E475-K566 PolarHBondContact OE1-NZ 2.95Å; E475-K566 WeakPolarHBondContact OE2-CE 3.36Å; E475-K566 IonicContact OE2-NZ 3.79Å; E475-K566 PolarHBondContact OE2-NZ 3.38Å; S562-K566 PolarHBondContact O-N 3.29Å; S562-K566 VanDerWaalsContact O-N 3.12Å; M563-K566 WeakPolarHBondContact O-CB 3.45Å; M563-K566 PolarHBondContact O-N 3.3Å; L564-K566 VanDerWaalsContact C-N 3.31Å; L564-K566 PolarHBondContact O-N 3.21Å; K566-F569 PolarHBondContact O-N 2.84Å; K566-R570 PolarHBondContact O-N 3.35Å; K566-F634 HydrophobicContact CB-CD1 4.39Å; K566-F634 WeakPolarHBondContact CD-O 3.31Å; K566-F634 WeakPolarHBondContact CE-O 3.4Å; K566-F634 PolarHBondContact NZ-O 2.64Å; K566-L635 HydrophobicContact CG-CD2 3.99Å; K566-L635 PolarHBondContact NZ-O 3.33Å
567	I	91.7	Very high	89.8	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.6	-40.6	176.7	-75.4	-70.1	0	0	0	112	S474 C477 I483 F486 V487 M563 L564 T565 F569 R570 Y571	S474-I567 WeakPolarHBondContact O-CD1 3.47Å; C477-I567 HydrophobicContact CB-CD1 4.17Å; I483-I567 HydrophobicContact CB-CG2 4.47Å; I483-I567 HydrophobicContact CG1-CD1 4.18Å; I483-I567 HydrophobicContact CG1-CG2 4.48Å; I483-I567 HydrophobicContact CG2-CG2 3.44Å; I483-I567 VanDerWaalsContact CG2-CG2 3.44Å; F486-I567 HydrophobicContact CD1-CD1 4.34Å; F486-I567 HydrophobicContact CD1-CG1 4.05Å; F486-I567 HydrophobicContact CE1-CG1 3.91Å; V487-I567 HydrophobicContact CG2-CG2 4.07Å; M563-I567 PolarHBondContact O-N 3.15Å; M563-I567 VanDerWaalsContact O-N 3.11Å; L564-I567 PolarHBondContact O-N 3.34Å; T565-I567 PolarHBondContact O-N 2.96Å; I567-F569 PolarHBondContact O-N 2.92Å; I567-R570 PolarHBondContact O-N 2.97Å; I567-Y571 WeakPolarHBondContact O-CB 3.31Å; I567-Y571 PolarHBondContact O-N 3.4Å
568	A	91.2	Very high	89.6	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.008	16%	0.163	C	C	.	.	H	α-helix	trans	-56.3	-50.6	175.3	0	0	0	0	0	111.1	L564 T565 R570 Y571 C572 L585 I588 V623	L564-A568 WeakPolarHBondContact O-CB 3.38Å; L564-A568 PolarHBondContact O-N 3.08Å; T565-A568 WeakPolarHBondContact O-CB 3.47Å; T565-A568 PolarHBondContact O-N 3.15Å; A568-R570 PolarHBondContact O-N 3.05Å; A568-Y571 PolarHBondContact O-N 3.09Å; A568-C572 PolarHBondContact O-N 2.8Å; A568-C572 PolarHBondContact O-SG 3.23Å; A568-L585 HydrophobicContact CB-CD2 3.5Å; A568-L585 VanDerWaalsContact CB-CD2 3.5Å; A568-I588 HydrophobicContact CB-CD1 3.84Å; A568-V623 HydrophobicContact CB-CG1 4.11Å; A568-V623 HydrophobicContact CB-CG2 4.06Å
569	F	90.5	Very high	89.4	Confident	8 Å²	8	36.1 Å²	36.1	4%	0.035	19%	0.19	C	C	.	.	H	α-helix	trans	-63.2	-40.9	177.1	-71.3	-45.3	0	0	0	112.9	T565 K566 I567 Y571 C572 R573 L622 A631 F634 L635	T565-F569 HydrophobicContact CG2-CD2 3.91Å; T565-F569 HydrophobicContact CG2-CE2 3.47Å; T565-F569 VanDerWaalsContact CG2-CE2 3.47Å; T565-F569 HydrophobicContact CG2-CZ 4.23Å; T565-F569 VanDerWaalsContact O-CD2 3.3Å; T565-F569 WeakPolarHBondContact O-CD2 3.43Å; T565-F569 PolarHBondContact O-N 3.44Å; K566-F569 PolarHBondContact O-N 2.84Å; I567-F569 PolarHBondContact O-N 2.92Å; F569-Y571 VanDerWaalsContact C-N 3.33Å; F569-Y571 PolarHBondContact O-N 3.01Å; F569-C572 WeakPolarHBondContact O-CB 3.26Å; F569-C572 PolarHBondContact O-N 2.75Å; F569-R573 PolarHBondContact O-N 3.18Å; F569-L622 HydrophobicContact CE2-CB 4.44Å; F569-L622 HydrophobicContact CZ-CB 4.02Å; F569-A631 HydrophobicContact CB-CB 3.96Å; F569-A631 HydrophobicContact CD1-CB 3.81Å; F569-A631 HydrophobicContact CD2-CB 4.16Å; F569-A631 HydrophobicContact CE1-CB 4.31Å; F569-A631 HydrophobicContact CG-CB 3.73Å; F569-F634 HydrophobicContact CD2-CB 4.17Å; F569-F634 HydrophobicContact CD2-CD2 4.46Å; F569-F634 HydrophobicContact CD2-CG 4.34Å; F569-F634 HydrophobicContact CE2-CD2 4.08Å; F569-F634 HydrophobicContact CE2-CG 4.37Å; F569-L635 HydrophobicContact CB-CD1 4.15Å; F569-L635 HydrophobicContact CB-CG 4.41Å
570	R	90.3	Very high	89.1	Confident	28 Å²	28	38.4 Å²	38.4	11%	0.106	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-43.3	175.7	-162.4	-179.4	-64.5	-76.6	0.7	111.3	E475 C477 I483 K566 I567 A568 R573 L574 L635	E475-R570 PolarHBondContact O-NH2 3.46Å; E475-R570 IonicContact OE1-NH2 3.48Å; E475-R570 PolarHBondContact OE1-NH2 2.96Å; C477-R570 WeakPolarHBondContact O-CD 3.13Å; I483-R570 HydrophobicContact CD1-CB 4.43Å; I483-R570 HydrophobicContact CD1-CG 4.34Å; K566-R570 PolarHBondContact O-N 3.35Å; I567-R570 PolarHBondContact O-N 2.97Å; A568-R570 PolarHBondContact O-N 3.05Å; R570-R573 PolarHBondContact O-N 3.28Å; R570-L574 HydrophobicContact CG-CD1 4.28Å; R570-L574 WeakPolarHBondContact O-CG 3.28Å; R570-L574 PolarHBondContact O-N 3.11Å; R570-L635 HydrophobicContact CB-CD2 3.74Å; R570-L635 HydrophobicContact CG-CD2 4.24Å
571	Y	89.9	Confident	88.9	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-65.1	-38.5	177.6	-165.6	-99.9	0	0	0	112.1	R480 I483 E484 I567 A568 F569 R573 L574 A575 L584	R480-Y571 HydrophobicContact CG-CD2 4.24Å; R480-Y571 HydrophobicContact CG-CE2 3.41Å; R480-Y571 VanDerWaalsContact CG-CE2 3.41Å; R480-Y571 PolarHBondContact NE-OH 3.02Å; R480-Y571 PolarHBondContact NH2-OH 3.19Å; I483-Y571 HydrophobicContact CB-CD2 4.08Å; I483-Y571 HydrophobicContact CD1-CD2 4.12Å; I483-Y571 HydrophobicContact CG2-CD2 3.58Å; I483-Y571 HydrophobicContact CG2-CE2 4.29Å; I483-Y571 HydrophobicContact CG2-CG 4.27Å; E484-Y571 HydrophobicContact CG-CE2 4.06Å; E484-Y571 PolarHBondContact OE1-OH 2.99Å; I567-Y571 WeakPolarHBondContact O-CB 3.31Å; I567-Y571 PolarHBondContact O-N 3.4Å; A568-Y571 PolarHBondContact O-N 3.09Å; F569-Y571 VanDerWaalsContact C-N 3.33Å; F569-Y571 PolarHBondContact O-N 3.01Å; Y571-R573 PolarHBondContact O-N 2.7Å; Y571-L574 PolarHBondContact O-N 3.32Å; Y571-A575 HydrophobicContact CD1-CB 3.74Å; Y571-A575 HydrophobicContact CE1-CB 3.45Å; Y571-A575 VanDerWaalsContact CE1-CB 3.45Å; Y571-A575 HydrophobicContact CG-CB 4.38Å; Y571-A575 WeakPolarHBondContact O-CB 3.44Å; Y571-A575 PolarHBondContact O-N 2.89Å; Y571-L584 HydrophobicContact CD1-CB 4.1Å; Y571-L584 HydrophobicContact CD1-CD2 3.49Å; Y571-L584 VanDerWaalsContact CD1-CD2 3.49Å; Y571-L584 HydrophobicContact CD1-CG 4.44Å; Y571-L584 HydrophobicContact CD2-CD2 3.56Å; Y571-L584 HydrophobicContact CE1-CB 3.9Å; Y571-L584 HydrophobicContact CE1-CD2 3.91Å; Y571-L584 HydrophobicContact CE2-CD2 3.94Å; Y571-L584 HydrophobicContact CG-CD2 3.3Å
572	C	88	Confident	88.8	Confident	34 Å²	34	45.4 Å²	45.4	23%	0.23	23%	0.23	C	C	.	.	H	α-helix	trans	-58.9	-33.6	173.3	-71.9	0	0	0	0	113	A568 F569	A568-C572 PolarHBondContact O-N 2.8Å; A568-C572 PolarHBondContact O-SG 3.23Å; F569-C572 WeakPolarHBondContact O-CB 3.26Å; F569-C572 PolarHBondContact O-N 2.75Å
573	R	85.5	Confident	88.7	Confident	118 Å²	118	53.2 Å²	53.2	45%	0.445	26%	0.256	S	S	.	.	H	α-helix	trans	-73.2	-24.5	174.6	-69.1	-173.7	177.8	176.5	-0.2	113.1	F569 R570 Y571 E632 D636	F569-R573 PolarHBondContact O-N 3.18Å; R570-R573 PolarHBondContact O-N 3.28Å; Y571-R573 PolarHBondContact O-N 2.7Å; R573-E632 VanDerWaalsContact NH2-CG 3.29Å; R573-D636 IonicContact NH1-OD2 3.17Å; R573-D636 PolarHBondContact NH1-OD2 3.1Å; R573-D636 IonicContact NH2-OD2 3.25Å
574	L	86.6	Confident	88.6	Confident	72 Å²	72	53.2 Å²	53.2	38%	0.377	26%	0.256	S	S	.	.	H	α-helix	trans	-100.7	-33.6	-174.3	-64.9	168	0	0	0	113.8	Q478 I483 R570 Y571 H576	Q478-L574 WeakPolarHBondContact O-CD1 3.25Å; I483-L574 HydrophobicContact CD1-CD1 3.81Å; R570-L574 HydrophobicContact CG-CD1 4.28Å; R570-L574 WeakPolarHBondContact O-CG 3.28Å; R570-L574 PolarHBondContact O-N 3.11Å; Y571-L574 PolarHBondContact O-N 3.32Å; L574-H576 PolarHBondContact O-N 3.25Å
575	A	83.1	Confident	88.6	Confident	6 Å²	6	53.5 Å²	53.5	5%	0.05	26%	0.258	C	S	.	.			trans	-92.2	104.3	-173.3	0	0	0	0	0	111.4	Y571 N577 R581	Y571-A575 HydrophobicContact CD1-CB 3.74Å; Y571-A575 HydrophobicContact CE1-CB 3.45Å; Y571-A575 VanDerWaalsContact CE1-CB 3.45Å; Y571-A575 HydrophobicContact CG-CB 4.38Å; Y571-A575 WeakPolarHBondContact O-CB 3.44Å; Y571-A575 PolarHBondContact O-N 2.89Å; A575-N577 VanDerWaalsContact C-N 3.34Å; A575-R581 HydrophobicContact CB-CB 4.35Å
576	H	79.9	Confident	88.6	Confident	187 Å²	187	56.7 Å²	56.7	87%	0.866	28%	0.28	S	S	*	.			trans	-74.6	-23.1	176.2	-58	-59.1	0	0	0	113.6	L574 S578	L574-H576 PolarHBondContact O-N 3.25Å; H576-S578 PolarHBondContact O-N 3.5Å
577	N	86.4	Confident	88.6	Confident	68 Å²	68	59.1 Å²	59.1	36%	0.364	29%	0.291	S	S	.	.			trans	-83.5	115.5	179.3	-175	-9.1	0	0	0	110.6	A575 T579 E580 R581	A575-N577 VanDerWaalsContact C-N 3.34Å; N577-T579 PolarHBondContact O-N 3.18Å; N577-T579 WeakPolarHBondContact OD1-CB 3.37Å; N577-T579 PolarHBondContact OD1-N 3.23Å; N577-T579 PolarHBondContact OD1-OG1 3.22Å; N577-E580 HydrophobicContact CB-CB 4.3Å; N577-E580 HydrophobicContact CB-CG 4.24Å; N577-E580 WeakPolarHBondContact CB-OE2 3.39Å; N577-E580 VanDerWaalsContact ND2-CD 3.29Å; N577-E580 PolarHBondContact ND2-OE2 2.96Å; N577-E580 VanDerWaalsContact ND2-OE2 3.1Å; N577-E580 PolarHBondContact O-N 3.25Å; N577-R581 WeakPolarHBondContact O-CB 3.27Å; N577-R581 PolarHBondContact O-N 3.07Å
578	S	86	Confident	88.6	Confident	65 Å²	65	59.1 Å²	59.1	46%	0.455	29%	0.291	S	S	.	.	H	α-helix	trans	-58.6	-35	-180	57	0	0	0	0	113	H576 N582	H576-S578 PolarHBondContact O-N 3.5Å; S578-N582 VanDerWaalsContact O-CB 3.29Å; S578-N582 WeakPolarHBondContact O-CB 3.4Å; S578-N582 PolarHBondContact O-N 3.41Å; S578-N582 PolarHBondContact O-ND2 2.88Å; S578-N582 PolarHBondContact O-OD1 3.28Å
579	T	89.2	Confident	88.7	Confident	99 Å²	99	61.9 Å²	61.9	61%	0.607	31%	0.305	S	S	*	.	H	α-helix	trans	-66.2	-45.5	-178.6	-50.6	0	0	0	0	111.2	N577 N582 R583	N577-T579 PolarHBondContact O-N 3.18Å; N577-T579 WeakPolarHBondContact OD1-CB 3.37Å; N577-T579 PolarHBondContact OD1-N 3.23Å; N577-T579 PolarHBondContact OD1-OG1 3.22Å; T579-N582 PolarHBondContact O-N 3.44Å; T579-R583 WeakPolarHBondContact O-CB 3.24Å; T579-R583 PolarHBondContact O-N 2.95Å
580	E	86.4	Confident	88.8	Confident	67 Å²	67	65.8 Å²	65.8	31%	0.313	32%	0.322	S	S	.	.	H	α-helix	trans	-72.4	-38	-178.5	-64.8	173	132.3	0	0	111.3	R480 N577 R583 L584	R480-E580 VanDerWaalsContact CZ-CD 3.43Å; R480-E580 IonicContact CZ-OE1 2.8Å; R480-E580 IonicContact CZ-OE2 2.7Å; R480-E580 VanDerWaalsContact CZ-OE2 3.24Å; R480-E580 IonicContact NH1-OE1 2.93Å; R480-E580 PolarHBondContact NH1-OE1 2.96Å; R480-E580 IonicContact NH1-OE2 3.68Å; R480-E580 PolarHBondContact NH1-OE2 2.83Å; R480-E580 IonicContact NH2-OE1 3.76Å; R480-E580 PolarHBondContact NH2-OE1 2.88Å; R480-E580 IonicContact NH2-OE2 3.24Å; R480-E580 PolarHBondContact NH2-OE2 3.49Å; N577-E580 HydrophobicContact CB-CB 4.3Å; N577-E580 HydrophobicContact CB-CG 4.24Å; N577-E580 WeakPolarHBondContact CB-OE2 3.39Å; N577-E580 VanDerWaalsContact ND2-CD 3.29Å; N577-E580 PolarHBondContact ND2-OE2 2.96Å; N577-E580 VanDerWaalsContact ND2-OE2 3.1Å; N577-E580 PolarHBondContact O-N 3.25Å; E580-R583 PolarHBondContact O-N 3.31Å; E580-L584 PolarHBondContact O-N 3.32Å
581	R	87.8	Confident	88.8	Confident	73 Å²	73	64.5 Å²	64.5	28%	0.275	32%	0.317	S	S	.	.	H	α-helix	trans	-57	-54.8	170.4	-170.7	-178.4	68.8	179.3	5.8	111.3	A575 N577 R583 L584 L585	A575-R581 HydrophobicContact CB-CB 4.35Å; N577-R581 WeakPolarHBondContact O-CB 3.27Å; N577-R581 PolarHBondContact O-N 3.07Å; R581-R583 VanDerWaalsContact C-N 3.26Å; R581-R583 PolarHBondContact O-N 2.72Å; R581-L584 PolarHBondContact O-N 3.33Å; R581-L585 HydrophobicContact CG-CD1 3.9Å; R581-L585 HydrophobicContact CG-CG 4.41Å; R581-L585 VanDerWaalsContact O-CG 3.26Å; R581-L585 WeakPolarHBondContact O-CG 3.3Å; R581-L585 PolarHBondContact O-N 3.21Å
582	N	90.5	Very high	88.9	Confident	81 Å²	81	64.6 Å²	64.6	43%	0.433	32%	0.318	S	S	.	.	H	α-helix	trans	-63.6	-34.3	-177.7	-67.8	-9.5	0	0	0	112	S578 T579 S586	S578-N582 VanDerWaalsContact O-CB 3.29Å; S578-N582 WeakPolarHBondContact O-CB 3.4Å; S578-N582 PolarHBondContact O-N 3.41Å; S578-N582 PolarHBondContact O-ND2 2.88Å; S578-N582 PolarHBondContact O-OD1 3.28Å; T579-N582 PolarHBondContact O-N 3.44Å; N582-S586 VanDerWaalsContact O-CB 3.25Å; N582-S586 WeakPolarHBondContact O-CB 3.47Å; N582-S586 PolarHBondContact O-N 3.43Å; N582-S586 PolarHBondContact O-OG 3.4Å
583	R	91.4	Very high	89.1	Confident	188 Å²	188	64.8 Å²	64.8	71%	0.709	32%	0.322	S	S	*	.	H	α-helix	trans	-60	-53.3	174.8	-176	177.9	179.3	163.7	0.9	111.8	T579 E580 R581 S586 E587	T579-R583 WeakPolarHBondContact O-CB 3.24Å; T579-R583 PolarHBondContact O-N 2.95Å; E580-R583 PolarHBondContact O-N 3.31Å; R581-R583 VanDerWaalsContact C-N 3.26Å; R581-R583 PolarHBondContact O-N 2.72Å; R583-S586 PolarHBondContact O-N 3.17Å; R583-S586 PolarHBondContact O-OG 2.97Å; R583-E587 PolarHBondContact O-N 3.15Å; R583-E587 VanDerWaalsContact O-N 3.15Å
584	L	90.7	Very high	89.2	Confident	10 Å²	10	59.4 Å²	59.4	5%	0.052	30%	0.302	C	S	.	.	H	α-helix	trans	-64	-44	-179.5	-167.4	84.3	0	0	0	111.8	I483 V487 Y571 E580 R581 S586 E587 I588	I483-L584 HydrophobicContact CG2-CD2 3.7Å; V487-L584 HydrophobicContact CB-CD1 4.01Å; V487-L584 HydrophobicContact CG1-CD1 4.04Å; V487-L584 HydrophobicContact CG2-CD1 4.04Å; Y571-L584 HydrophobicContact CD1-CB 4.1Å; Y571-L584 HydrophobicContact CD1-CD2 3.49Å; Y571-L584 VanDerWaalsContact CD1-CD2 3.49Å; Y571-L584 HydrophobicContact CD1-CG 4.44Å; Y571-L584 HydrophobicContact CD2-CD2 3.56Å; Y571-L584 HydrophobicContact CE1-CB 3.9Å; Y571-L584 HydrophobicContact CE1-CD2 3.91Å; Y571-L584 HydrophobicContact CE2-CD2 3.94Å; Y571-L584 HydrophobicContact CG-CD2 3.3Å; E580-L584 PolarHBondContact O-N 3.32Å; R581-L584 PolarHBondContact O-N 3.33Å; L584-S586 VanDerWaalsContact C-N 3.33Å; L584-S586 PolarHBondContact O-N 3.39Å; L584-E587 WeakPolarHBondContact O-CB 3.18Å; L584-E587 PolarHBondContact O-N 3.18Å; L584-E587 VanDerWaalsContact O-N 3.16Å; L584-I588 HydrophobicContact CD2-CD1 4.38Å; L584-I588 HydrophobicContact CG-CD1 4.33Å; L584-I588 PolarHBondContact O-N 3.36Å
585	L	92.1	Very high	89.4	Confident	6 Å²	6	56.3 Å²	56.3	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-61.5	-42	178.4	-64.6	176.2	0	0	0	111.6	A568 R581 E587 I588 M589 V623 Q626	A568-L585 HydrophobicContact CB-CD2 3.5Å; A568-L585 VanDerWaalsContact CB-CD2 3.5Å; R581-L585 HydrophobicContact CG-CD1 3.9Å; R581-L585 HydrophobicContact CG-CG 4.41Å; R581-L585 VanDerWaalsContact O-CG 3.26Å; R581-L585 WeakPolarHBondContact O-CG 3.3Å; R581-L585 PolarHBondContact O-N 3.21Å; L585-E587 VanDerWaalsContact C-N 3.25Å; L585-E587 PolarHBondContact O-N 3.34Å; L585-I588 PolarHBondContact O-N 2.89Å; L585-M589 WeakPolarHBondContact O-CB 3.23Å; L585-M589 VanDerWaalsContact O-CG 3.28Å; L585-M589 WeakPolarHBondContact O-CG 3.35Å; L585-M589 PolarHBondContact O-N 2.98Å; L585-V623 HydrophobicContact CB-CG1 4.31Å; L585-V623 HydrophobicContact CD2-CG1 3.82Å; L585-Q626 HydrophobicContact CD1-CG 4.19Å
586	S	91.8	Very high	89.7	Confident	68 Å²	68	57 Å²	57	48%	0.476	29%	0.289	S	S	.	.	H	α-helix	trans	-61.7	-35.3	176.5	72.6	0	0	0	0	112.4	N582 R583 L584 F590	N582-S586 VanDerWaalsContact O-CB 3.25Å; N582-S586 WeakPolarHBondContact O-CB 3.47Å; N582-S586 PolarHBondContact O-N 3.43Å; N582-S586 PolarHBondContact O-OG 3.4Å; R583-S586 PolarHBondContact O-N 3.17Å; R583-S586 PolarHBondContact O-OG 2.97Å; L584-S586 VanDerWaalsContact C-N 3.33Å; L584-S586 PolarHBondContact O-N 3.39Å; S586-F590 WeakPolarHBondContact O-CB 3.31Å; S586-F590 PolarHBondContact O-N 3.24Å
587	E	90.6	Very high	90	Very high	60 Å²	60	51.9 Å²	51.9	28%	0.28	27%	0.265	S	S	.	.	H	α-helix	trans	-70.4	-42	177.7	-172	165.3	-170.6	0	0	111.7	V487 R491 R583 L584 L585 F590 I591	V487-E587 HydrophobicContact CG1-CG 4.34Å; R491-E587 WeakPolarHBondContact CG-OE1 3.37Å; R583-E587 PolarHBondContact O-N 3.15Å; R583-E587 VanDerWaalsContact O-N 3.15Å; L584-E587 WeakPolarHBondContact O-CB 3.18Å; L584-E587 PolarHBondContact O-N 3.18Å; L584-E587 VanDerWaalsContact O-N 3.16Å; L585-E587 VanDerWaalsContact C-N 3.25Å; L585-E587 PolarHBondContact O-N 3.34Å; E587-F590 PolarHBondContact O-N 3.22Å; E587-I591 WeakPolarHBondContact O-CG1 3.39Å; E587-I591 PolarHBondContact O-N 3.41Å
588	I	92.9	Very high	90	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-49.9	174.4	-70.2	170.7	0	0	0	110.8	V487 L564 A568 L584 L585 F590 I591 E592 V623	V487-I588 HydrophobicContact CG1-CG1 4.43Å; V487-I588 HydrophobicContact CG2-CD1 4.38Å; V487-I588 HydrophobicContact CG2-CG1 4.49Å; L564-I588 HydrophobicContact CB-CG2 3.75Å; L564-I588 HydrophobicContact CD1-CG2 4.44Å; A568-I588 HydrophobicContact CB-CD1 3.84Å; L584-I588 HydrophobicContact CD2-CD1 4.38Å; L584-I588 HydrophobicContact CG-CD1 4.33Å; L584-I588 PolarHBondContact O-N 3.36Å; L585-I588 PolarHBondContact O-N 2.89Å; I588-F590 PolarHBondContact O-N 2.96Å; I588-I591 PolarHBondContact O-N 3.05Å; I588-I591 VanDerWaalsContact O-N 3.15Å; I588-E592 PolarHBondContact O-N 2.6Å; I588-V623 HydrophobicContact CG2-CG1 4.36Å; I588-V623 HydrophobicContact CG2-CG2 4.3Å
589	M	93.2	Very high	90	Very high	59 Å²	59	46.2 Å²	46.2	29%	0.291	23%	0.231	S	C	.	.	H	α-helix	trans	-59.8	-37.9	177.7	-70.5	175.9	65.3	0	0	111.7	L585 E592 A593 L620 V623 A624	L585-M589 WeakPolarHBondContact O-CB 3.23Å; L585-M589 VanDerWaalsContact O-CG 3.28Å; L585-M589 WeakPolarHBondContact O-CG 3.35Å; L585-M589 PolarHBondContact O-N 2.98Å; M589-E592 PolarHBondContact O-N 2.99Å; M589-A593 WeakPolarHBondContact O-CB 3.47Å; M589-A593 PolarHBondContact O-N 3.48Å; M589-L620 HydrophobicContact CB-CD1 3.76Å; M589-L620 HydrophobicContact CE-CD1 4.39Å; M589-L620 HydrophobicContact CG-CD1 4Å; M589-L620 WeakPolarHBondContact O-CD1 3.35Å; M589-V623 HydrophobicContact CG-CB 4.13Å; M589-V623 HydrophobicContact CG-CG1 3.64Å; M589-V623 HydrophobicContact SD-CG1 4.23Å; M589-A624 HydrophobicContact CE-CB 3.69Å; M589-A624 HydrophobicContact SD-CB 4.22Å
590	F	91.7	Very high	89.9	Confident	91 Å²	91	46.5 Å²	46.5	40%	0.399	23%	0.226	S	C	.	.	H	α-helix	trans	-64.8	-42	176.6	-177.1	-117.3	0	0	0	112.1	L497 A499 S586 E587 I588 C594	L497-F590 HydrophobicContact CB-CE1 4.18Å; L497-F590 HydrophobicContact CB-CZ 4.48Å; L497-F590 HydrophobicContact CD1-CD1 3.55Å; L497-F590 HydrophobicContact CD1-CE1 3.33Å; L497-F590 HydrophobicContact CD1-CZ 4.29Å; L497-F590 HydrophobicContact CG-CE1 4.37Å; A499-F590 HydrophobicContact CB-CE2 4.03Å; A499-F590 HydrophobicContact CB-CZ 3.77Å; S586-F590 WeakPolarHBondContact O-CB 3.31Å; S586-F590 PolarHBondContact O-N 3.24Å; E587-F590 PolarHBondContact O-N 3.22Å; I588-F590 PolarHBondContact O-N 2.96Å; F590-C594 WeakPolarHBondContact O-CB 3.41Å; F590-C594 PolarHBondContact O-N 2.89Å; F590-C594 PolarHBondContact O-SG 2.88Å
591	I	90.5	Very high	89.8	Confident	1 Å²	1	48 Å²	48	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-60.6	-50.4	175.4	-68.1	164.8	0	0	0	110.4	V490 F494 L497 L564 E587 I588 A593 C594 V595	V490-I591 HydrophobicContact CG1-CD1 4.49Å; F494-I591 HydrophobicContact CD2-CG2 4.34Å; F494-I591 HydrophobicContact CE2-CG2 3.63Å; F494-I591 HydrophobicContact CZ-CG2 3.78Å; L497-I591 HydrophobicContact CD1-CG1 4.44Å; L564-I591 HydrophobicContact CD1-CB 4.49Å; L564-I591 HydrophobicContact CD1-CG2 4.04Å; E587-I591 WeakPolarHBondContact O-CG1 3.39Å; E587-I591 PolarHBondContact O-N 3.41Å; I588-I591 PolarHBondContact O-N 3.05Å; I588-I591 VanDerWaalsContact O-N 3.15Å; I591-A593 PolarHBondContact O-N 3.29Å; I591-C594 PolarHBondContact O-N 3.42Å; I591-V595 WeakPolarHBondContact O-CG2 3.25Å; I591-V595 PolarHBondContact O-N 3.28Å; I591-V595 VanDerWaalsContact O-N 3.08Å
592	E	92.4	Very high	89.5	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.019	25%	0.249	C	C	.	.	H	α-helix	trans	-63.1	-42.6	-179.1	-69.1	179.8	172.5	0	0	112.3	A561 I588 M589 V595 L596 I616 L620	A561-E592 WeakPolarHBondContact CA-OE1 3.5Å; A561-E592 HydrophobicContact CB-CG 4.07Å; I588-E592 PolarHBondContact O-N 2.6Å; M589-E592 PolarHBondContact O-N 2.99Å; E592-V595 PolarHBondContact O-N 2.92Å; E592-L596 WeakPolarHBondContact O-CB 3.37Å; E592-L596 PolarHBondContact O-N 2.72Å; E592-I616 HydrophobicContact CB-CG2 4.31Å; E592-L620 HydrophobicContact CB-CD1 4.07Å; E592-L620 WeakPolarHBondContact OE2-CA 3.38Å; E592-L620 PolarHBondContact OE2-N 3.45Å; E592-L620 VanDerWaalsContact OE2-N 3.13Å
593	A	91.8	Very high	89	Confident	37 Å²	37	47.8 Å²	47.8	31%	0.306	25%	0.252	S	S	.	.	H	α-helix	trans	-64.5	-41.2	176.6	0	0	0	0	0	112.2	M589 I591 L596 Q597	M589-A593 WeakPolarHBondContact O-CB 3.47Å; M589-A593 PolarHBondContact O-N 3.48Å; I591-A593 PolarHBondContact O-N 3.29Å; A593-L596 PolarHBondContact O-N 3.12Å; A593-Q597 WeakPolarHBondContact O-CB 3.42Å; A593-Q597 PolarHBondContact O-N 2.95Å
594	C	88.6	Confident	88.7	Confident	6 Å²	6	39.5 Å²	39.5	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-44.7	176.6	-74	0	0	0	0	111.6	L497 F590 I591 L596 Q597 F598	L497-C594 HydrophobicContact CD2-CB 3.87Å; F590-C594 WeakPolarHBondContact O-CB 3.41Å; F590-C594 PolarHBondContact O-N 2.89Å; F590-C594 PolarHBondContact O-SG 2.88Å; I591-C594 PolarHBondContact O-N 3.42Å; C594-L596 VanDerWaalsContact C-N 3.33Å; C594-L596 PolarHBondContact O-N 3.44Å; C594-Q597 PolarHBondContact O-N 3.46Å; C594-F598 VanDerWaalsContact O-CB 3.22Å; C594-F598 WeakPolarHBondContact O-CB 3.28Å; C594-F598 PolarHBondContact O-N 2.85Å
595	V	89.5	Confident	88.4	Confident	6 Å²	6	46.8 Å²	46.8	4%	0.036	26%	0.255	C	S	.	.	H	α-helix	trans	-60.4	-45.5	176.3	171.2	0	0	0	0	110.6	F494 L549 F557 I591 E592 F598 G599 I616	F494-V595 HydrophobicContact CE1-CG2 3.91Å; F494-V595 HydrophobicContact CZ-CG2 4.11Å; L549-V595 HydrophobicContact CD1-CG1 4.39Å; L549-V595 HydrophobicContact CD1-CG2 4.4Å; F557-V595 HydrophobicContact CB-CG1 3.63Å; F557-V595 HydrophobicContact CD1-CG1 4.11Å; F557-V595 HydrophobicContact CD1-CG2 3.76Å; F557-V595 HydrophobicContact CD2-CG1 4.35Å; F557-V595 HydrophobicContact CE1-CG2 4.24Å; F557-V595 HydrophobicContact CG-CG1 3.77Å; F557-V595 HydrophobicContact CG-CG2 4.28Å; I591-V595 WeakPolarHBondContact O-CG2 3.25Å; I591-V595 PolarHBondContact O-N 3.28Å; I591-V595 VanDerWaalsContact O-N 3.08Å; E592-V595 PolarHBondContact O-N 2.92Å; V595-F598 PolarHBondContact O-N 2.82Å; V595-G599 PolarHBondContact O-N 3.08Å; V595-I616 HydrophobicContact CG1-CD1 3.99Å
596	L	89.2	Confident	87.9	Confident	21 Å²	21	50 Å²	50	11%	0.11	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-47.5	179.8	-165.6	106.8	0	0	0	111.6	E592 A593 C594 G599 Q600 I616 K617	E592-L596 WeakPolarHBondContact O-CB 3.37Å; E592-L596 PolarHBondContact O-N 2.72Å; A593-L596 PolarHBondContact O-N 3.12Å; C594-L596 VanDerWaalsContact C-N 3.33Å; C594-L596 PolarHBondContact O-N 3.44Å; L596-G599 PolarHBondContact O-N 3.1Å; L596-Q600 VanDerWaalsContact CD2-NE2 3.34Å; L596-Q600 WeakPolarHBondContact O-CB 3.29Å; L596-Q600 VanDerWaalsContact O-CG 3.26Å; L596-Q600 WeakPolarHBondContact O-CG 3.35Å; L596-Q600 PolarHBondContact O-N 2.95Å; L596-I616 HydrophobicContact CB-CG2 4.36Å; L596-I616 HydrophobicContact CD1-CB 4.1Å; L596-I616 HydrophobicContact CD1-CG2 3.85Å; L596-K617 HydrophobicContact CD1-CD 4.41Å; L596-K617 HydrophobicContact CD1-CG 3.61Å; L596-K617 HydrophobicContact CD2-CG 4.43Å
597	Q	88.1	Confident	87.5	Confident	79 Å²	79	55.9 Å²	55.9	37%	0.369	29%	0.294	S	S	.	.	H	α-helix	trans	-64.1	-41.3	178.6	-175.9	177	-0.7	0	0	111.3	A593 C594 G599 Q600 N601	A593-Q597 WeakPolarHBondContact O-CB 3.42Å; A593-Q597 PolarHBondContact O-N 2.95Å; C594-Q597 PolarHBondContact O-N 3.46Å; Q597-G599 PolarHBondContact O-N 2.92Å; Q597-Q600 PolarHBondContact O-N 3.32Å; Q597-N601 VanDerWaalsContact O-CB 3.28Å; Q597-N601 WeakPolarHBondContact O-CB 3.35Å; Q597-N601 PolarHBondContact O-N 3.35Å; Q597-N601 PolarHBondContact O-ND2 2.96Å
598	F	86.1	Confident	87.3	Confident	7 Å²	7	54.4 Å²	54.4	3%	0.031	29%	0.288	C	S	.	.	H	α-helix	trans	-61	-45.2	177.3	-167.1	-88.7	0	0	0	111.8	P498 L549 Y550 C594 V595 L603 A604	P498-F598 HydrophobicContact CB-CD2 4.46Å; P498-F598 HydrophobicContact CG-CD2 3.57Å; P498-F598 HydrophobicContact CG-CE2 3.89Å; L549-F598 HydrophobicContact CD1-CB 4.27Å; L549-F598 HydrophobicContact CD1-CD1 3.68Å; L549-F598 HydrophobicContact CD1-CE1 4.3Å; L549-F598 HydrophobicContact CD1-CG 4.09Å; L549-F598 HydrophobicContact CD2-CD1 4.1Å; L549-F598 HydrophobicContact CD2-CD2 4.18Å; L549-F598 HydrophobicContact CD2-CE1 4.36Å; L549-F598 HydrophobicContact CD2-CE2 4.43Å; L549-F598 HydrophobicContact CD2-CG 4Å; L549-F598 HydrophobicContact CG-CD1 3.55Å; L549-F598 HydrophobicContact CG-CE1 3.72Å; L549-F598 HydrophobicContact CG-CG 3.97Å; L549-F598 HydrophobicContact CG-CZ 4.28Å; L549-F598 WeakPolarHBondContact O-CE1 3.4Å; Y550-F598 HydrophobicContact CD1-CE1 4.48Å; Y550-F598 AromaticContact CD1-CZ 3.7Å; Y550-F598 HydrophobicContact CD1-CZ 3.7Å; Y550-F598 HydrophobicContact CE1-CE2 4.17Å; Y550-F598 AromaticContact CE1-CZ 3.67Å; Y550-F598 HydrophobicContact CE1-CZ 3.67Å; Y550-F598 HydrophobicContact CG-CZ 4.35Å; C594-F598 VanDerWaalsContact O-CB 3.22Å; C594-F598 WeakPolarHBondContact O-CB 3.28Å; C594-F598 PolarHBondContact O-N 2.85Å; V595-F598 PolarHBondContact O-N 2.82Å; F598-L603 HydrophobicContact CD1-CB 4.05Å; F598-L603 HydrophobicContact CD2-CB 3.89Å; F598-L603 HydrophobicContact CD2-CD1 3.59Å; F598-L603 HydrophobicContact CD2-CG 4.39Å; F598-L603 HydrophobicContact CE1-CB 3.73Å; F598-L603 HydrophobicContact CE2-CB 3.58Å; F598-L603 HydrophobicContact CE2-CD1 3.75Å; F598-L603 HydrophobicContact CE2-CG 4.32Å; F598-L603 HydrophobicContact CG-CB 4.12Å; F598-L603 HydrophobicContact CG-CD1 4.26Å; F598-L603 HydrophobicContact CZ-CB 3.49Å; F598-L603 VanDerWaalsContact CZ-CB 3.49Å; F598-L603 PolarHBondContact O-N 3.47Å; F598-A604 HydrophobicContact CD1-CB 4.3Å; F598-A604 HydrophobicContact CE1-CB 3.93Å
599	G	85.6	Confident	87	Confident	7 Å²	7	56.8 Å²	56.8	7%	0.072	31%	0.305	C	S	.	.	H	α-helix	trans	-69.1	-39.1	177.3	0	0	0	0	0	114	F554 V595 L596 Q597 G602	F554-G599 VanDerWaalsContact CZ-CA 3.46Å; V595-G599 PolarHBondContact O-N 3.08Å; L596-G599 PolarHBondContact O-N 3.1Å; Q597-G599 PolarHBondContact O-N 2.92Å; G599-G602 PolarHBondContact O-N 3.36Å
600	Q	86.4	Confident	86.8	Confident	106 Å²	106	59.5 Å²	59.5	50%	0.495	33%	0.325	S	S	.	.	H	α-helix	trans	-70.9	-34.3	178.8	-75	177.2	-7.1	0	0	113.2	L596 Q597 G602 L608	L596-Q600 VanDerWaalsContact CD2-NE2 3.34Å; L596-Q600 WeakPolarHBondContact O-CB 3.29Å; L596-Q600 VanDerWaalsContact O-CG 3.26Å; L596-Q600 WeakPolarHBondContact O-CG 3.35Å; L596-Q600 PolarHBondContact O-N 2.95Å; Q597-Q600 PolarHBondContact O-N 3.32Å; Q600-G602 PolarHBondContact O-N 3.26Å; Q600-L608 HydrophobicContact CG-CD2 4.23Å
601	N	85.7	Confident	86.6	Confident	99 Å²	99	57 Å²	57	53%	0.529	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-4.2	176.2	-69.6	-15.3	0	0	0	113.1	Q597 L603	Q597-N601 VanDerWaalsContact O-CB 3.28Å; Q597-N601 WeakPolarHBondContact O-CB 3.35Å; Q597-N601 PolarHBondContact O-N 3.35Å; Q597-N601 PolarHBondContact O-ND2 2.96Å; N601-L603 VanDerWaalsContact C-N 3.3Å; N601-L603 HydrophobicContact CB-CD1 4.18Å; N601-L603 HydrophobicContact CB-CG 3.98Å; N601-L603 PolarHBondContact O-N 3.44Å
602	G	80.7	Confident	86.6	Confident	53 Å²	53	58.4 Å²	58.4	55%	0.546	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	28.7	179.3	0	0	0	0	0	113.7	G599 Q600 A604	G599-G602 PolarHBondContact O-N 3.36Å; Q600-G602 PolarHBondContact O-N 3.26Å; G602-A604 VanDerWaalsContact C-N 3.29Å
603	L	80.8	Confident	86.5	Confident	96 Å²	96	58.8 Å²	58.8	50%	0.503	34%	0.335	S	S	.	.			trans	-78	-15.2	179.4	-64.1	172.8	0	0	0	113.1	F598 N601	F598-L603 HydrophobicContact CD1-CB 4.05Å; F598-L603 HydrophobicContact CD2-CB 3.89Å; F598-L603 HydrophobicContact CD2-CD1 3.59Å; F598-L603 HydrophobicContact CD2-CG 4.39Å; F598-L603 HydrophobicContact CE1-CB 3.73Å; F598-L603 HydrophobicContact CE2-CB 3.58Å; F598-L603 HydrophobicContact CE2-CD1 3.75Å; F598-L603 HydrophobicContact CE2-CG 4.32Å; F598-L603 HydrophobicContact CG-CB 4.12Å; F598-L603 HydrophobicContact CG-CD1 4.26Å; F598-L603 HydrophobicContact CZ-CB 3.49Å; F598-L603 VanDerWaalsContact CZ-CB 3.49Å; F598-L603 PolarHBondContact O-N 3.47Å; N601-L603 VanDerWaalsContact C-N 3.3Å; N601-L603 HydrophobicContact CB-CD1 4.18Å; N601-L603 HydrophobicContact CB-CG 3.98Å; N601-L603 PolarHBondContact O-N 3.44Å
604	A	84	Confident	86.6	Confident	13 Å²	13	63 Å²	63	11%	0.107	35%	0.349	C	S	.	.	S	Bend	trans	-89.4	155.4	175.9	0	0	0	0	0	111.6	L549 Y550 F554 F598 G602 C606	L549-A604 WeakPolarHBondContact O-CB 3.38Å; Y550-A604 WeakPolarHBondContact O-CA 3.44Å; F554-A604 HydrophobicContact CE2-CB 4.01Å; F554-A604 HydrophobicContact CZ-CB 3.67Å; F598-A604 HydrophobicContact CD1-CB 4.3Å; F598-A604 HydrophobicContact CE1-CB 3.93Å; G602-A604 VanDerWaalsContact C-N 3.29Å; A604-C606 WeakPolarHBondContact CB-O 3.46Å
605	K	83.7	Confident	86.7	Confident	164 Å²	164	68 Å²	68	71%	0.713	37%	0.367	S	S	*	.	S	Bend	trans	-61.2	-46.5	175.8	-68.1	177	-173.2	162	0	112.1	Y550 D551	Y550-K605 PolarHBondContact O-N 3.49Å; D551-K605 IonicContact OD1-NZ 3.33Å; D551-K605 PolarHBondContact OD1-NZ 3.08Å
606	C	82.7	Confident	86.9	Confident	72 Å²	72	67.8 Å²	67.8	49%	0.486	37%	0.366	S	S	.	.	S	Bend	trans	-91.1	151	173.9	-68.2	0	0	0	0	110.3	F554 A604	F554-C606 WeakPolarHBondContact CE2-O 3.31Å; A604-C606 WeakPolarHBondContact CB-O 3.46Å
607	K	83.4	Confident	87	Confident	192 Å²	192	71.5 Å²	71.5	84%	0.835	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-81.3	146.1	176.4	-68.9	-176.3	178.9	-180	0	110.7	S609	K607-S609 PolarHBondContact O-N 2.92Å
608	L	85.6	Confident	87.2	Confident	29 Å²	29	71.2 Å²	71.2	15%	0.152	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-62.4	120.1	171.3	176.7	62.8	0	0	0	109.9	F554 Q600 D612	F554-L608 HydrophobicContact CB-CD1 3.61Å; F554-L608 HydrophobicContact CD1-CB 4.37Å; F554-L608 HydrophobicContact CD1-CD1 3.48Å; F554-L608 VanDerWaalsContact CD1-CD1 3.48Å; F554-L608 HydrophobicContact CD1-CG 4.46Å; F554-L608 VanDerWaalsContact CD2-CA 3.43Å; F554-L608 HydrophobicContact CD2-CB 4.05Å; F554-L608 HydrophobicContact CD2-CD1 4.09Å; F554-L608 HydrophobicContact CE1-CB 4.31Å; F554-L608 HydrophobicContact CE1-CD1 4.15Å; F554-L608 HydrophobicContact CE2-CB 3.98Å; F554-L608 HydrophobicContact CG-CB 4.23Å; F554-L608 HydrophobicContact CG-CD1 3.44Å; F554-L608 VanDerWaalsContact CG-CD1 3.44Å; F554-L608 HydrophobicContact CG-CG 4.43Å; F554-L608 HydrophobicContact CZ-CB 4.12Å; Q600-L608 HydrophobicContact CG-CD2 4.23Å; L608-D612 HydrophobicContact CD1-CB 3.88Å
609	S	87.5	Confident	87.5	Confident	50 Å²	50	70.9 Å²	70.9	35%	0.35	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-66.8	152.1	176.1	86.5	0	0	0	0	110.4	K607 G611 D612 S613	K607-S609 PolarHBondContact O-N 2.92Å; S609-G611 VanDerWaalsContact C-N 3.33Å; S609-G611 PolarHBondContact O-N 3.12Å; S609-D612 WeakPolarHBondContact CB-OD2 3.39Å; S609-D612 PolarHBondContact O-N 3.35Å; S609-D612 WeakPolarHBondContact OG-CB 3.25Å; S609-D612 PolarHBondContact OG-N 3.32Å; S609-D612 PolarHBondContact OG-OD2 3.33Å; S609-S613 WeakPolarHBondContact O-CB 3.34Å; S609-S613 PolarHBondContact O-N 3.13Å
610	T	88.6	Confident	87.7	Confident	117 Å²	117	72.6 Å²	72.6	72%	0.718	39%	0.39	S	S	*	.	H	α-helix	trans	-60.8	-44.6	178	47.4	0	0	0	0	111.2	S613 E614	T610-S613 PolarHBondContact O-N 3.44Å; T610-E614 WeakPolarHBondContact O-CG 3.34Å; T610-E614 PolarHBondContact O-N 3.06Å
611	G	88.1	Confident	88	Confident	39 Å²	39	74 Å²	74	40%	0.402	40%	0.395	S	S	.	.	H	α-helix	trans	-62.1	-43.3	178.5	0	0	0	0	0	113.4	S609 E614 R615	S609-G611 VanDerWaalsContact C-N 3.33Å; S609-G611 PolarHBondContact O-N 3.12Å; G611-E614 PolarHBondContact O-N 3.15Å; G611-R615 WeakPolarHBondContact O-CB 3.36Å; G611-R615 PolarHBondContact O-N 2.98Å
612	D	90.2	Very high	88.2	Confident	29 Å²	29	70.2 Å²	70.2	16%	0.155	37%	0.374	C	S	.	.	H	α-helix	trans	-67.7	-39.9	176.9	-63.5	-42.9	0	0	0	111.2	F554 A558 L608 S609 R615 I616	F554-D612 HydrophobicContact CB-CB 4.03Å; A558-D612 HydrophobicContact CB-CB 4.06Å; L608-D612 HydrophobicContact CD1-CB 3.88Å; S609-D612 WeakPolarHBondContact CB-OD2 3.39Å; S609-D612 PolarHBondContact O-N 3.35Å; S609-D612 WeakPolarHBondContact OG-CB 3.25Å; S609-D612 PolarHBondContact OG-N 3.32Å; S609-D612 PolarHBondContact OG-OD2 3.33Å; D612-R615 PolarHBondContact O-N 3.01Å; D612-I616 VanDerWaalsContact O-CG1 3.26Å; D612-I616 WeakPolarHBondContact O-CG1 3.37Å; D612-I616 PolarHBondContact O-N 3.26Å
613	S	90.8	Very high	88.6	Confident	12 Å²	12	67.9 Å²	67.9	8%	0.084	35%	0.349	C	S	.	.	H	α-helix	trans	-61.3	-46.3	176.2	-167.3	0	0	0	0	111.7	S609 T610 I616 K617	S609-S613 WeakPolarHBondContact O-CB 3.34Å; S609-S613 PolarHBondContact O-N 3.13Å; T610-S613 PolarHBondContact O-N 3.44Å; S613-I616 PolarHBondContact O-N 3.48Å; S613-K617 WeakPolarHBondContact O-CB 3.44Å; S613-K617 VanDerWaalsContact O-CG 3.26Å; S613-K617 WeakPolarHBondContact O-CG 3.34Å; S613-K617 PolarHBondContact O-N 2.73Å; S613-K617 WeakPolarHBondContact OG-CE 3.3Å
614	E	92.5	Very high	89.1	Confident	126 Å²	126	65.5 Å²	65.5	59%	0.589	34%	0.344	S	S	*	.	H	α-helix	trans	-62.7	-44.2	177.3	-75.4	178.2	-179.7	0	0	111	T610 G611 I616 K617 V618	T610-E614 WeakPolarHBondContact O-CG 3.34Å; T610-E614 PolarHBondContact O-N 3.06Å; G611-E614 PolarHBondContact O-N 3.15Å; E614-I616 PolarHBondContact O-N 3.49Å; E614-K617 PolarHBondContact O-N 3.16Å; E614-V618 VanDerWaalsContact O-CG2 3.29Å; E614-V618 WeakPolarHBondContact O-CG2 3.16Å; E614-V618 PolarHBondContact O-N 3.25Å
615	R	91.4	Very high	89.3	Confident	111 Å²	111	69.7 Å²	69.7	42%	0.419	36%	0.364	S	S	.	.	H	α-helix	trans	-60.6	-45.2	178.3	-173.4	61.6	179.7	-176.2	1.4	112.2	A558 S562 G611 D612 V618 C619	A558-R615 HydrophobicContact CB-CB 4.26Å; A558-R615 HydrophobicContact CB-CG 4.22Å; S562-R615 PolarHBondContact OG-NE 3Å; S562-R615 PolarHBondContact OG-NH2 2.94Å; G611-R615 WeakPolarHBondContact O-CB 3.36Å; G611-R615 PolarHBondContact O-N 2.98Å; D612-R615 PolarHBondContact O-N 3.01Å; R615-V618 PolarHBondContact O-N 3.4Å; R615-C619 PolarHBondContact O-N 3.47Å; R615-C619 PolarHBondContact O-SG 3.02Å
616	I	92.9	Very high	89.2	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-64.7	-42.9	177.6	-65	165.8	0	0	0	110.7	F557 A558 A561 E592 V595 L596 D612 S613 E614 V618 C619 L620	F557-I616 HydrophobicContact CB-CD1 4.42Å; A558-I616 HydrophobicContact CB-CG1 4.3Å; A561-I616 HydrophobicContact CB-CG1 4.13Å; E592-I616 HydrophobicContact CB-CG2 4.31Å; V595-I616 HydrophobicContact CG1-CD1 3.99Å; L596-I616 HydrophobicContact CB-CG2 4.36Å; L596-I616 HydrophobicContact CD1-CB 4.1Å; L596-I616 HydrophobicContact CD1-CG2 3.85Å; D612-I616 VanDerWaalsContact O-CG1 3.26Å; D612-I616 WeakPolarHBondContact O-CG1 3.37Å; D612-I616 PolarHBondContact O-N 3.26Å; S613-I616 PolarHBondContact O-N 3.48Å; E614-I616 PolarHBondContact O-N 3.49Å; I616-V618 VanDerWaalsContact C-N 3.34Å; I616-V618 PolarHBondContact O-N 2.94Å; I616-C619 WeakPolarHBondContact O-CB 3.3Å; I616-C619 PolarHBondContact O-N 2.92Å; I616-L620 WeakPolarHBondContact O-CB 3.4Å; I616-L620 PolarHBondContact O-N 2.77Å
617	K	93.3	Very high	88.9	Confident	99 Å²	99	64.2 Å²	64.2	43%	0.43	34%	0.336	S	S	.	.	H	α-helix	trans	-61.6	-41.3	176.5	-73.9	170.3	-176.1	171.9	0	112.5	L596 S613 E614 L620 K621	L596-K617 HydrophobicContact CD1-CD 4.41Å; L596-K617 HydrophobicContact CD1-CG 3.61Å; L596-K617 HydrophobicContact CD2-CG 4.43Å; S613-K617 WeakPolarHBondContact O-CB 3.44Å; S613-K617 VanDerWaalsContact O-CG 3.26Å; S613-K617 WeakPolarHBondContact O-CG 3.34Å; S613-K617 PolarHBondContact O-N 2.73Å; S613-K617 WeakPolarHBondContact OG-CE 3.3Å; E614-K617 PolarHBondContact O-N 3.16Å; K617-L620 PolarHBondContact O-N 2.74Å; K617-K621 WeakPolarHBondContact O-CB 3.35Å; K617-K621 PolarHBondContact O-N 2.84Å
618	V	91.3	Very high	88.3	Confident	73 Å²	73	59.9 Å²	59.9	44%	0.442	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-47.2	176.4	169.8	0	0	0	0	109.9	E614 R615 I616 L620 K621 L622	E614-V618 VanDerWaalsContact O-CG2 3.29Å; E614-V618 WeakPolarHBondContact O-CG2 3.16Å; E614-V618 PolarHBondContact O-N 3.25Å; R615-V618 PolarHBondContact O-N 3.4Å; I616-V618 VanDerWaalsContact C-N 3.34Å; I616-V618 PolarHBondContact O-N 2.94Å; V618-L620 PolarHBondContact O-N 3.36Å; V618-K621 PolarHBondContact O-N 2.7Å; V618-L622 HydrophobicContact CG1-CD1 3.86Å; V618-L622 HydrophobicContact CG1-CG 4.28Å; V618-L622 WeakPolarHBondContact O-CB 3.47Å; V618-L622 WeakPolarHBondContact O-CG 3.46Å; V618-L622 PolarHBondContact O-N 2.91Å
619	C	91.7	Very high	87.7	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-56.5	-49.1	175.4	-66.9	0	0	0	0	111.8	A561 T565 R615 I616 K621 L622 V623	A561-C619 HydrophobicContact CB-CB 3.82Å; T565-C619 VanDerWaalsContact OG1-CB 3.25Å; T565-C619 WeakPolarHBondContact OG1-CB 3.41Å; R615-C619 PolarHBondContact O-N 3.47Å; R615-C619 PolarHBondContact O-SG 3.02Å; I616-C619 WeakPolarHBondContact O-CB 3.3Å; I616-C619 PolarHBondContact O-N 2.92Å; C619-K621 VanDerWaalsContact C-N 3.31Å; C619-K621 PolarHBondContact O-N 3.34Å; C619-L622 WeakPolarHBondContact O-CB 3.36Å; C619-L622 PolarHBondContact O-N 3.25Å; C619-L622 VanDerWaalsContact O-N 3.07Å; C619-V623 WeakPolarHBondContact O-CG2 3.42Å; C619-V623 PolarHBondContact O-N 3.41Å
620	L	91.4	Very high	87.3	Confident	43 Å²	43	65 Å²	65	23%	0.225	35%	0.348	C	S	.	.	H	α-helix	trans	-57.6	-43.8	178.5	-175.4	71.9	0	0	0	112.2	M589 E592 I616 K617 V618 A624	M589-L620 HydrophobicContact CB-CD1 3.76Å; M589-L620 HydrophobicContact CE-CD1 4.39Å; M589-L620 HydrophobicContact CG-CD1 4Å; M589-L620 WeakPolarHBondContact O-CD1 3.35Å; E592-L620 HydrophobicContact CB-CD1 4.07Å; E592-L620 WeakPolarHBondContact OE2-CA 3.38Å; E592-L620 PolarHBondContact OE2-N 3.45Å; E592-L620 VanDerWaalsContact OE2-N 3.13Å; I616-L620 WeakPolarHBondContact O-CB 3.4Å; I616-L620 PolarHBondContact O-N 2.77Å; K617-L620 PolarHBondContact O-N 2.74Å; V618-L620 PolarHBondContact O-N 3.36Å; L620-A624 WeakPolarHBondContact O-CB 3.44Å; L620-A624 PolarHBondContact O-N 3.43Å; L620-A624 VanDerWaalsContact O-N 3.08Å
621	K	91.3	Very high	86.9	Confident	136 Å²	136	59.7 Å²	59.7	59%	0.591	32%	0.317	S	S	*	.	H	α-helix	trans	-65.2	-42.1	176.8	-176.7	174.3	179.3	178.6	0	111.7	K617 V618 C619 V623 A624 D625	K617-K621 WeakPolarHBondContact O-CB 3.35Å; K617-K621 PolarHBondContact O-N 2.84Å; V618-K621 PolarHBondContact O-N 2.7Å; C619-K621 VanDerWaalsContact C-N 3.31Å; C619-K621 PolarHBondContact O-N 3.34Å; K621-V623 PolarHBondContact O-N 3.4Å; K621-A624 PolarHBondContact O-N 3.31Å; K621-D625 WeakPolarHBondContact CE-OD2 3.32Å; K621-D625 WeakPolarHBondContact CG-OD2 3.41Å; K621-D625 WeakPolarHBondContact O-CB 3.48Å; K621-D625 PolarHBondContact O-N 3.28Å
622	L	89.9	Confident	86.6	Confident	19 Å²	19	63.3 Å²	63.3	10%	0.099	32%	0.323	C	S	.	.	H	α-helix	trans	-62.3	-41.8	178.9	-71.7	172.6	0	0	0	112.3	T565 F569 V618 C619 Q626 L630 F634	T565-L622 HydrophobicContact CG2-CB 4.13Å; T565-L622 HydrophobicContact CG2-CD1 4.44Å; F569-L622 HydrophobicContact CE2-CB 4.44Å; F569-L622 HydrophobicContact CZ-CB 4.02Å; V618-L622 HydrophobicContact CG1-CD1 3.86Å; V618-L622 HydrophobicContact CG1-CG 4.28Å; V618-L622 WeakPolarHBondContact O-CB 3.47Å; V618-L622 WeakPolarHBondContact O-CG 3.46Å; V618-L622 PolarHBondContact O-N 2.91Å; C619-L622 WeakPolarHBondContact O-CB 3.36Å; C619-L622 PolarHBondContact O-N 3.25Å; C619-L622 VanDerWaalsContact O-N 3.07Å; L622-Q626 PolarHBondContact O-N 3.48Å; L622-Q626 VanDerWaalsContact O-N 3.13Å; L622-L630 HydrophobicContact CD2-CB 4.34Å; L622-L630 HydrophobicContact CD2-CD1 3.29Å; L622-L630 HydrophobicContact CD2-CG 4.43Å; L622-F634 HydrophobicContact CD1-CE2 3.72Å; L622-F634 HydrophobicContact CD1-CZ 3.89Å
623	V	90.5	Very high	86.3	Confident	3 Å²	3	66 Å²	66	2%	0.018	34%	0.336	C	S	.	.	H	α-helix	trans	-66.4	-39.7	175.9	-179.7	0	0	0	0	111.1	T565 A568 L585 I588 M589 C619 K621	T565-V623 HydrophobicContact CG2-CG2 4.09Å; A568-V623 HydrophobicContact CB-CG1 4.11Å; A568-V623 HydrophobicContact CB-CG2 4.06Å; L585-V623 HydrophobicContact CB-CG1 4.31Å; L585-V623 HydrophobicContact CD2-CG1 3.82Å; I588-V623 HydrophobicContact CG2-CG1 4.36Å; I588-V623 HydrophobicContact CG2-CG2 4.3Å; M589-V623 HydrophobicContact CG-CB 4.13Å; M589-V623 HydrophobicContact CG-CG1 3.64Å; M589-V623 HydrophobicContact SD-CG1 4.23Å; C619-V623 WeakPolarHBondContact O-CG2 3.42Å; C619-V623 PolarHBondContact O-N 3.41Å; K621-V623 PolarHBondContact O-N 3.4Å
624	A	90	Very high	85.9	Confident	47 Å²	47	66.7 Å²	66.7	39%	0.388	34%	0.337	S	S	.	.	H	α-helix	trans	-66.7	-46	178.2	0	0	0	0	0	112.9	M589 L620 K621 Q626	M589-A624 HydrophobicContact CE-CB 3.69Å; M589-A624 HydrophobicContact SD-CB 4.22Å; L620-A624 WeakPolarHBondContact O-CB 3.44Å; L620-A624 PolarHBondContact O-N 3.43Å; L620-A624 VanDerWaalsContact O-N 3.08Å; K621-A624 PolarHBondContact O-N 3.31Å; A624-Q626 VanDerWaalsContact C-N 3.29Å; A624-Q626 PolarHBondContact O-N 3.31Å
625	D	87.9	Confident	85.6	Confident	100 Å²	100	60.8 Å²	60.8	54%	0.535	31%	0.31	S	S	.	.	H	α-helix	trans	-75.5	-18.4	-176.6	-70.2	-14.4	0	0	0	112.4	K621 N627	K621-D625 WeakPolarHBondContact CE-OD2 3.32Å; K621-D625 WeakPolarHBondContact CG-OD2 3.41Å; K621-D625 WeakPolarHBondContact O-CB 3.48Å; K621-D625 PolarHBondContact O-N 3.28Å; D625-N627 PolarHBondContact O-N 2.92Å
626	Q	81.8	Confident	85.2	Confident	64 Å²	64	58.6 Å²	58.6	30%	0.299	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	38.7	-175.4	-60.1	179	24.1	0	0	112.6	L585 L622 A624 V628	L585-Q626 HydrophobicContact CD1-CG 4.19Å; L622-Q626 PolarHBondContact O-N 3.48Å; L622-Q626 VanDerWaalsContact O-N 3.13Å; A624-Q626 VanDerWaalsContact C-N 3.29Å; A624-Q626 PolarHBondContact O-N 3.31Å; Q626-V628 PolarHBondContact O-N 3.43Å; Q626-V628 VanDerWaalsContact O-N 3.12Å
627	N	76.4	Confident	84.9	Confident	57 Å²	57	63.1 Å²	63.1	31%	0.305	33%	0.327	S	S	.	.			trans	-63.9	114.7	-175	-171.6	-19.4	0	0	0	111.1	D625 D629 L630 A631	D625-N627 PolarHBondContact O-N 2.92Å; N627-D629 PolarHBondContact OD1-N 3.42Å; N627-D629 VanDerWaalsContact OD1-N 3.11Å; N627-L630 HydrophobicContact CB-CD1 4.49Å; N627-A631 PolarHBondContact O-N 3.15Å
628	V	71.1	Confident	84.4	Confident	101 Å²	101	61 Å²	61	61%	0.612	33%	0.325	S	S	*	.	H	α-helix	trans	-69.9	-36.8	-174.8	-177.7	0	0	0	0	111.9	Q626 L630 A631	Q626-V628 PolarHBondContact O-N 3.43Å; Q626-V628 VanDerWaalsContact O-N 3.12Å; V628-L630 PolarHBondContact O-N 3.44Å; V628-A631 VanDerWaalsContact O-CB 3.22Å; V628-A631 WeakPolarHBondContact O-CB 3.39Å; V628-A631 PolarHBondContact O-N 3.32Å; V628-A631 VanDerWaalsContact O-N 3.11Å
629	D	73.9	Confident	84	Confident	129 Å²	129	60.1 Å²	60.1	69%	0.69	31%	0.313	S	S	*	.	H	α-helix	trans	-65.7	-42.4	-175.8	-59.3	-26.4	0	0	0	110.8	N627 A631	N627-D629 PolarHBondContact OD1-N 3.42Å; N627-D629 VanDerWaalsContact OD1-N 3.11Å; D629-A631 VanDerWaalsContact C-N 3.27Å; D629-A631 PolarHBondContact O-N 2.94Å
630	L	78.7	Confident	83.8	Confident	58 Å²	58	66.1 Å²	66.1	30%	0.304	34%	0.341	S	S	.	.	H	α-helix	trans	-73.8	-19.6	177	-66.3	173.5	0	0	0	112.4	L622 N627 V628 E632 M633 F634	L622-L630 HydrophobicContact CD2-CB 4.34Å; L622-L630 HydrophobicContact CD2-CD1 3.29Å; L622-L630 HydrophobicContact CD2-CG 4.43Å; N627-L630 HydrophobicContact CB-CD1 4.49Å; V628-L630 PolarHBondContact O-N 3.44Å; L630-E632 VanDerWaalsContact C-N 3.28Å; L630-E632 PolarHBondContact O-N 2.91Å; L630-M633 HydrophobicContact CD2-SD 3.62Å; L630-M633 PolarHBondContact O-N 3.16Å; L630-F634 WeakPolarHBondContact O-CD2 3.43Å; L630-F634 PolarHBondContact O-N 2.84Å
631	A	79.4	Confident	83.5	Confident	6 Å²	6	67.4 Å²	67.4	5%	0.05	35%	0.354	C	S	.	.	H	α-helix	trans	-64.4	-34.3	177.6	0	0	0	0	0	112	F569 N627 V628 D629 F634 L635	F569-A631 HydrophobicContact CB-CB 3.96Å; F569-A631 HydrophobicContact CD1-CB 3.81Å; F569-A631 HydrophobicContact CD2-CB 4.16Å; F569-A631 HydrophobicContact CE1-CB 4.31Å; F569-A631 HydrophobicContact CG-CB 3.73Å; N627-A631 PolarHBondContact O-N 3.15Å; V628-A631 VanDerWaalsContact O-CB 3.22Å; V628-A631 WeakPolarHBondContact O-CB 3.39Å; V628-A631 PolarHBondContact O-N 3.32Å; V628-A631 VanDerWaalsContact O-N 3.11Å; D629-A631 VanDerWaalsContact C-N 3.27Å; D629-A631 PolarHBondContact O-N 2.94Å; A631-F634 PolarHBondContact O-N 3.42Å; A631-L635 VanDerWaalsContact O-CB 3.31Å; A631-L635 WeakPolarHBondContact O-CB 3.49Å; A631-L635 VanDerWaalsContact O-CG 3.24Å; A631-L635 WeakPolarHBondContact O-CG 3.39Å; A631-L635 PolarHBondContact O-N 3.2Å
632	E	82.3	Confident	83.2	Confident	115 Å²	115	61.3 Å²	61.3	54%	0.537	33%	0.327	S	S	.	.	H	α-helix	trans	-62.9	-44.5	175.2	-73	-173.7	175.8	0	0	111.7	R573 L630 F634 L635 D636 E637	R573-E632 VanDerWaalsContact NH2-CG 3.29Å; L630-E632 VanDerWaalsContact C-N 3.28Å; L630-E632 PolarHBondContact O-N 2.91Å; E632-F634 VanDerWaalsContact C-N 3.35Å; E632-F634 PolarHBondContact O-N 3.25Å; E632-L635 PolarHBondContact O-N 2.95Å; E632-D636 WeakPolarHBondContact O-CB 3.37Å; E632-D636 PolarHBondContact O-N 3.23Å; E632-E637 PolarHBondContact O-N 3.32Å
633	M	83.3	Confident	83	Confident	86 Å²	86	61.2 Å²	61.2	42%	0.424	33%	0.332	S	S	.	.	I	π-helix	trans	-58.4	-45.9	176	-61.2	-178.1	68.3	0	0	112	L630 E637 C638	L630-M633 HydrophobicContact CD2-SD 3.62Å; L630-M633 PolarHBondContact O-N 3.16Å; M633-E637 WeakPolarHBondContact O-CB 3.49Å; M633-C638 PolarHBondContact O-N 3.42Å; M633-C638 PolarHBondContact O-SG 3.42Å
634	F	83.8	Confident	82.7	Confident	26 Å²	26	65.9 Å²	65.9	11%	0.114	36%	0.355	C	S	.	.	I	π-helix	trans	-68.5	-38	179.8	-87	-92.8	0	0	0	112.8	T565 K566 F569 L622 L630 A631 E632 C638	T565-F634 HydrophobicContact CG2-CD1 4.41Å; T565-F634 HydrophobicContact CG2-CE1 4.13Å; T565-F634 HydrophobicContact CG2-CZ 4.22Å; K566-F634 HydrophobicContact CB-CD1 4.39Å; K566-F634 WeakPolarHBondContact CD-O 3.31Å; K566-F634 WeakPolarHBondContact CE-O 3.4Å; K566-F634 PolarHBondContact NZ-O 2.64Å; F569-F634 HydrophobicContact CD2-CB 4.17Å; F569-F634 HydrophobicContact CD2-CD2 4.46Å; F569-F634 HydrophobicContact CD2-CG 4.34Å; F569-F634 HydrophobicContact CE2-CD2 4.08Å; F569-F634 HydrophobicContact CE2-CG 4.37Å; L622-F634 HydrophobicContact CD1-CE2 3.72Å; L622-F634 HydrophobicContact CD1-CZ 3.89Å; L630-F634 WeakPolarHBondContact O-CD2 3.43Å; L630-F634 PolarHBondContact O-N 2.84Å; A631-F634 PolarHBondContact O-N 3.42Å; E632-F634 VanDerWaalsContact C-N 3.35Å; E632-F634 PolarHBondContact O-N 3.25Å; F634-C638 WeakPolarHBondContact O-CB 3.27Å
635	L	85.1	Confident	82.2	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.01	36%	0.356	C	S	.	.	I	π-helix	trans	-86.8	-45.2	-172.3	-68.1	171.4	0	0	0	113	K566 F569 R570 A631 E632	K566-L635 HydrophobicContact CG-CD2 3.99Å; K566-L635 PolarHBondContact NZ-O 3.33Å; F569-L635 HydrophobicContact CB-CD1 4.15Å; F569-L635 HydrophobicContact CB-CG 4.41Å; R570-L635 HydrophobicContact CB-CD2 3.74Å; R570-L635 HydrophobicContact CG-CD2 4.24Å; A631-L635 VanDerWaalsContact O-CB 3.31Å; A631-L635 WeakPolarHBondContact O-CB 3.49Å; A631-L635 VanDerWaalsContact O-CG 3.24Å; A631-L635 WeakPolarHBondContact O-CG 3.39Å; A631-L635 PolarHBondContact O-N 3.2Å; E632-L635 PolarHBondContact O-N 2.95Å
636	D	84.2	Confident	82	Confident	64 Å²	64	62.9 Å²	62.9	34%	0.342	33%	0.332	S	S	.	.	I	π-helix	trans	-104.4	-52.1	-166.6	-60.9	-47.6	0	0	0	111.4	R573 E632 C638 R639 Q640	R573-D636 IonicContact NH1-OD2 3.17Å; R573-D636 PolarHBondContact NH1-OD2 3.1Å; R573-D636 IonicContact NH2-OD2 3.25Å; E632-D636 WeakPolarHBondContact O-CB 3.37Å; E632-D636 PolarHBondContact O-N 3.23Å; D636-C638 PolarHBondContact O-N 2.95Å; D636-R639 PolarHBondContact O-N 2.91Å; D636-Q640 WeakPolarHBondContact O-CG 3.39Å; D636-Q640 PolarHBondContact O-N 2.93Å
637	E	84.9	Confident	81.9	Confident	98 Å²	98	62 Å²	62	46%	0.458	34%	0.336	S	S	.	.	I	π-helix	trans	-63.4	-44.5	-178.8	-63.5	-178.4	179.1	0	0	112.2	E632 M633 R639 Q640 S641	E632-E637 PolarHBondContact O-N 3.32Å; M633-E637 WeakPolarHBondContact O-CB 3.49Å; E637-R639 PolarHBondContact O-N 3.4Å; E637-R639 VanDerWaalsContact O-N 3.15Å; E637-Q640 WeakPolarHBondContact O-CB 3.42Å; E637-Q640 PolarHBondContact O-N 3.38Å; E637-S641 PolarHBondContact O-N 2.67Å; E637-S641 PolarHBondContact O-OG 2.91Å; E637-S641 VanDerWaalsContact O-OG 3.09Å
638	C	83.8	Confident	81.8	Confident	55 Å²	55	60.4 Å²	60.4	37%	0.372	33%	0.328	S	S	.	.	H	α-helix	trans	-57	-33.7	177.3	-69.9	0	0	0	0	112.8	M633 F634 D636	M633-C638 PolarHBondContact O-N 3.42Å; M633-C638 PolarHBondContact O-SG 3.42Å; F634-C638 WeakPolarHBondContact O-CB 3.27Å; D636-C638 PolarHBondContact O-N 2.95Å
639	R	83.7	Confident	82	Confident	54 Å²	54	58.9 Å²	58.9	20%	0.204	32%	0.317	C	S	.	.	H	α-helix	trans	-76.3	-38.7	177	-176.1	-177.6	-65.4	-173.6	-5.5	111.2	F440 E475 D636 E637 S641 L642 G643	F440-R639 HydrophobicContact CE2-CG 4.5Å; E475-R639 PolarHBondContact O-NH2 3.28Å; E475-R639 IonicContact OE1-CZ 2.88Å; E475-R639 VanDerWaalsContact OE1-CZ 3.28Å; E475-R639 IonicContact OE1-NE 3.24Å; E475-R639 PolarHBondContact OE1-NE 3.33Å; E475-R639 IonicContact OE1-NH2 2.82Å; E475-R639 PolarHBondContact OE1-NH2 3.31Å; D636-R639 PolarHBondContact O-N 2.91Å; E637-R639 PolarHBondContact O-N 3.4Å; E637-R639 VanDerWaalsContact O-N 3.15Å; R639-S641 VanDerWaalsContact C-N 3.28Å; R639-S641 PolarHBondContact O-N 3.36Å; R639-L642 WeakPolarHBondContact O-CB 3.47Å; R639-L642 PolarHBondContact O-N 3.03Å; R639-G643 PolarHBondContact O-N 2.91Å
640	Q	86.5	Confident	81.9	Confident	126 Å²	126	57 Å²	57	59%	0.589	30%	0.302	S	S	*	.	H	α-helix	trans	-62.8	-36.9	175.4	-68.5	174.2	19.7	0	0	111.2	D636 E637 L642 G643 I644	D636-Q640 WeakPolarHBondContact O-CG 3.39Å; D636-Q640 PolarHBondContact O-N 2.93Å; E637-Q640 WeakPolarHBondContact O-CB 3.42Å; E637-Q640 PolarHBondContact O-N 3.38Å; Q640-L642 VanDerWaalsContact C-N 3.27Å; Q640-L642 PolarHBondContact O-N 3.46Å; Q640-G643 CarbonylContact O-C 3.55Å; Q640-G643 WeakPolarHBondContact O-CA 3.38Å; Q640-G643 PolarHBondContact O-N 3.37Å; Q640-I644 WeakPolarHBondContact O-CG1 3.46Å; Q640-I644 PolarHBondContact O-N 3.24Å
641	S	84.2	Confident	81.4	Confident	70 Å²	70	59.8 Å²	59.8	49%	0.49	31%	0.314	S	S	.	.	H	α-helix	trans	-58.5	-36.8	173.7	-52.4	0	0	0	0	112.9	E637 R639 G643 I644 L645	E637-S641 PolarHBondContact O-N 2.67Å; E637-S641 PolarHBondContact O-OG 2.91Å; E637-S641 VanDerWaalsContact O-OG 3.09Å; R639-S641 VanDerWaalsContact C-N 3.28Å; R639-S641 PolarHBondContact O-N 3.36Å; S641-G643 VanDerWaalsContact C-N 3.33Å; S641-I644 PolarHBondContact O-N 3.34Å; S641-L645 WeakPolarHBondContact O-CB 3.37Å; S641-L645 PolarHBondContact O-N 2.97Å
642	L	85.7	Confident	80.7	Confident	7 Å²	7	62.7 Å²	62.7	4%	0.037	33%	0.331	C	S	.	.	H	α-helix	trans	-64.9	-39.8	171.8	177.4	64	0	0	0	111.2	R436 F440 W471 R639 Q640 L645 L646	R436-L642 HydrophobicContact CG-CD1 4.07Å; R436-L642 HydrophobicContact CG-CD2 3.76Å; F440-L642 HydrophobicContact CB-CD2 4.04Å; F440-L642 HydrophobicContact CD2-CD2 3.9Å; F440-L642 HydrophobicContact CD2-CG 4.21Å; F440-L642 HydrophobicContact CG-CD2 4.18Å; W471-L642 HydrophobicContact CH2-CB 4.34Å; W471-L642 HydrophobicContact CH2-CD2 3.63Å; W471-L642 HydrophobicContact CH2-CG 4.42Å; W471-L642 HydrophobicContact CZ3-CD2 4.07Å; R639-L642 WeakPolarHBondContact O-CB 3.47Å; R639-L642 PolarHBondContact O-N 3.03Å; Q640-L642 VanDerWaalsContact C-N 3.27Å; Q640-L642 PolarHBondContact O-N 3.46Å; L642-L645 HydrophobicContact CD1-CD2 4.41Å; L642-L645 PolarHBondContact O-N 3.46Å; L642-L646 HydrophobicContact CD1-CD1 4.03Å; L642-L646 HydrophobicContact CD1-CD2 4.5Å; L642-L646 HydrophobicContact CD1-CG 3.98Å; L642-L646 HydrophobicContact CD2-CD1 4.4Å; L642-L646 HydrophobicContact CG-CD1 3.9Å; L642-L646 HydrophobicContact CG-CG 4.27Å; L642-L646 WeakPolarHBondContact O-CB 3.36Å; L642-L646 VanDerWaalsContact O-CG 3.27Å; L642-L646 WeakPolarHBondContact O-CG 3.45Å; L642-L646 PolarHBondContact O-N 2.94Å
643	G	85.1	Confident	79.8	Confident	18 Å²	18	63.6 Å²	63.6	19%	0.186	34%	0.335	C	S	.	.	H	α-helix	trans	-61.6	-42.6	176.6	0	0	0	0	0	113.1	R639 Q640 S641 L646 A647	R639-G643 PolarHBondContact O-N 2.91Å; Q640-G643 CarbonylContact O-C 3.55Å; Q640-G643 WeakPolarHBondContact O-CA 3.38Å; Q640-G643 PolarHBondContact O-N 3.37Å; S641-G643 VanDerWaalsContact C-N 3.33Å; G643-L646 PolarHBondContact O-N 3.03Å; G643-A647 WeakPolarHBondContact O-CB 3.36Å; G643-A647 PolarHBondContact O-N 2.6Å
644	I	84.2	Confident	78.7	Confident	101 Å²	101	66.3 Å²	66.3	52%	0.518	35%	0.345	S	S	.	.	H	α-helix	trans	-62	-52.3	174.9	-63.2	167	0	0	0	109.5	Q640 S641 L646 A647 T648	Q640-I644 WeakPolarHBondContact O-CG1 3.46Å; Q640-I644 PolarHBondContact O-N 3.24Å; S641-I644 PolarHBondContact O-N 3.34Å; I644-L646 VanDerWaalsContact C-N 3.31Å; I644-L646 PolarHBondContact O-N 3.34Å; I644-A647 WeakPolarHBondContact O-CB 3.47Å; I644-A647 PolarHBondContact O-N 3.31Å; I644-T648 PolarHBondContact O-N 3.3Å; I644-T648 PolarHBondContact O-OG1 3.5Å
645	L	81.4	Confident	77.2	Confident	75 Å²	75	70.1 Å²	70.1	39%	0.393	36%	0.363	S	S	.	.	H	α-helix	trans	-54.3	-45	178.3	-180	70	0	0	0	112.7	S641 L642 A647 T648 N649	S641-L645 WeakPolarHBondContact O-CB 3.37Å; S641-L645 PolarHBondContact O-N 2.97Å; L642-L645 HydrophobicContact CD1-CD2 4.41Å; L642-L645 PolarHBondContact O-N 3.46Å; L645-A647 VanDerWaalsContact C-N 3.35Å; L645-T648 PolarHBondContact O-N 3.36Å; L645-N649 WeakPolarHBondContact O-CB 3.47Å; L645-N649 VanDerWaalsContact O-CG 3.22Å; L645-N649 PolarHBondContact O-N 3.14Å; L645-N649 PolarHBondContact O-OD1 2.88Å
646	L	82.7	Confident	75.5	Confident	9 Å²	9	71.8 Å²	71.8	5%	0.047	38%	0.381	C	S	.	.	H	α-helix	trans	-70	-31.2	179.4	-69	175.4	0	0	0	112.5	E437 F440 L642 G643 I644 K650	E437-L646 HydrophobicContact CB-CD2 4.1Å; E437-L646 HydrophobicContact CG-CD1 4.28Å; E437-L646 HydrophobicContact CG-CD2 3.86Å; F440-L646 HydrophobicContact CB-CD1 3.9Å; F440-L646 HydrophobicContact CD1-CD1 3.44Å; F440-L646 VanDerWaalsContact CD1-CD1 3.44Å; F440-L646 HydrophobicContact CE1-CD1 4.12Å; F440-L646 HydrophobicContact CG-CD1 3.73Å; L642-L646 HydrophobicContact CD1-CD1 4.03Å; L642-L646 HydrophobicContact CD1-CD2 4.5Å; L642-L646 HydrophobicContact CD1-CG 3.98Å; L642-L646 HydrophobicContact CD2-CD1 4.4Å; L642-L646 HydrophobicContact CG-CD1 3.9Å; L642-L646 HydrophobicContact CG-CG 4.27Å; L642-L646 WeakPolarHBondContact O-CB 3.36Å; L642-L646 VanDerWaalsContact O-CG 3.27Å; L642-L646 WeakPolarHBondContact O-CG 3.45Å; L642-L646 PolarHBondContact O-N 2.94Å; G643-L646 PolarHBondContact O-N 3.03Å; I644-L646 VanDerWaalsContact C-N 3.31Å; I644-L646 PolarHBondContact O-N 3.34Å; L646-K650 WeakPolarHBondContact O-CG 3.47Å; L646-K650 PolarHBondContact O-N 3.3Å
647	A	79.8	Confident	73.6	Confident	46 Å²	46	73.5 Å²	73.5	38%	0.38	39%	0.393	S	S	.	.	H	α-helix	trans	-67.2	-49.2	173.2	0	0	0	0	0	110.8	G643 I644 L645 N649 K650 E651	G643-A647 WeakPolarHBondContact O-CB 3.36Å; G643-A647 PolarHBondContact O-N 2.6Å; I644-A647 WeakPolarHBondContact O-CB 3.47Å; I644-A647 PolarHBondContact O-N 3.31Å; L645-A647 VanDerWaalsContact C-N 3.35Å; A647-N649 VanDerWaalsContact C-N 3.32Å; A647-N649 PolarHBondContact O-N 3.47Å; A647-K650 WeakPolarHBondContact O-CB 3.43Å; A647-K650 PolarHBondContact O-N 2.9Å; A647-E651 PolarHBondContact O-N 2.98Å
648	T	75.1	Confident	71.3	Confident	22 Å²	22	72.2 Å²	72.2	14%	0.135	39%	0.392	C	S	.	.	H	α-helix	trans	-60.2	-40.5	177	-45.8	0	0	0	0	111.8	I644 L645 K650 E651 T652	I644-T648 PolarHBondContact O-N 3.3Å; I644-T648 PolarHBondContact O-OG1 3.5Å; L645-T648 PolarHBondContact O-N 3.36Å; T648-K650 VanDerWaalsContact C-N 3.31Å; T648-K650 PolarHBondContact O-N 3.1Å; T648-E651 PolarHBondContact O-N 2.84Å; T648-T652 WeakPolarHBondContact O-CG2 3.37Å; T648-T652 PolarHBondContact O-N 3.07Å; T648-T652 PolarHBondContact O-OG1 3.01Å
649	N	73.7	Confident	69.2	Low	70 Å²	70	74.3 Å²	74.3	37%	0.374	40%	0.403	S	S	.	.	H	α-helix	trans	-63.5	-34.5	175	-75.9	-1.7	0	0	0	112.8	L645 A647 T652 Q653	L645-N649 WeakPolarHBondContact O-CB 3.47Å; L645-N649 VanDerWaalsContact O-CG 3.22Å; L645-N649 PolarHBondContact O-N 3.14Å; L645-N649 PolarHBondContact O-OD1 2.88Å; A647-N649 VanDerWaalsContact C-N 3.32Å; A647-N649 PolarHBondContact O-N 3.47Å; N649-T652 VanDerWaalsContact CA-OG1 3.31Å; N649-T652 WeakPolarHBondContact CA-OG1 3.49Å; N649-T652 PolarHBondContact O-OG1 3.11Å; N649-Q653 WeakPolarHBondContact O-CB 3.42Å; N649-Q653 VanDerWaalsContact O-CG 3.29Å; N649-Q653 WeakPolarHBondContact O-CG 3.35Å; N649-Q653 PolarHBondContact O-N 3.38Å; N649-Q653 VanDerWaalsContact O-N 3.15Å
650	K	71.6	Confident	67.1	Low	89 Å²	89	75.1 Å²	75.1	39%	0.387	43%	0.428	S	S	.	.	H	α-helix	trans	-73	-35.4	176.1	-77.2	176.6	-178.9	178.2	0	112.1	L646 A647 T648 K654	L646-K650 WeakPolarHBondContact O-CG 3.47Å; L646-K650 PolarHBondContact O-N 3.3Å; A647-K650 WeakPolarHBondContact O-CB 3.43Å; A647-K650 PolarHBondContact O-N 2.9Å; T648-K650 VanDerWaalsContact C-N 3.31Å; T648-K650 PolarHBondContact O-N 3.1Å; K650-K654 WeakPolarHBondContact O-CG 3.45Å; K650-K654 PolarHBondContact O-N 2.9Å; K650-K654 VanDerWaalsContact O-N 3.11Å
651	E	68.4	Low	64.5	Low	117 Å²	117	77 Å²	77	55%	0.547	44%	0.435	S	S	.	.	H	α-helix	trans	-67.4	-48.2	176.4	-72.3	176.5	175.4	0	0	111.1	A647 T648 Q653 K654 E655	A647-E651 PolarHBondContact O-N 2.98Å; T648-E651 PolarHBondContact O-N 2.84Å; E651-Q653 VanDerWaalsContact C-N 3.32Å; E651-Q653 PolarHBondContact O-N 2.88Å; E651-K654 WeakPolarHBondContact O-CB 3.41Å; E651-K654 PolarHBondContact O-N 3.39Å; E651-K654 VanDerWaalsContact O-N 3.09Å; E651-E655 PolarHBondContact O-N 3.26Å
652	T	65.6	Low	62.2	Low	66 Å²	66	78 Å²	78	41%	0.405	44%	0.438	S	S	.	.	H	α-helix	trans	-59.9	-38	175.2	47.9	0	0	0	0	113	T648 N649 E655 G656	T648-T652 WeakPolarHBondContact O-CG2 3.37Å; T648-T652 PolarHBondContact O-N 3.07Å; T648-T652 PolarHBondContact O-OG1 3.01Å; N649-T652 VanDerWaalsContact CA-OG1 3.31Å; N649-T652 WeakPolarHBondContact CA-OG1 3.49Å; N649-T652 PolarHBondContact O-OG1 3.11Å; T652-E655 PolarHBondContact O-N 3.28Å; T652-G656 PolarHBondContact O-N 3.06Å
653	Q	62.6	Low	59.8	Low	135 Å²	135	85.9 Å²	85.9	63%	0.631	47%	0.474	S	S	*	.	H	α-helix	trans	-66.8	-37	173.8	-77.8	-178	11.1	0	0	113.4	N649 E651 G656 T657	N649-Q653 WeakPolarHBondContact O-CB 3.42Å; N649-Q653 VanDerWaalsContact O-CG 3.29Å; N649-Q653 WeakPolarHBondContact O-CG 3.35Å; N649-Q653 PolarHBondContact O-N 3.38Å; N649-Q653 VanDerWaalsContact O-N 3.15Å; E651-Q653 VanDerWaalsContact C-N 3.32Å; E651-Q653 PolarHBondContact O-N 2.88Å; Q653-G656 PolarHBondContact O-N 2.99Å; Q653-T657 PolarHBondContact O-N 2.97Å; Q653-T657 VanDerWaalsContact O-N 3.14Å; Q653-T657 PolarHBondContact O-OG1 3.36Å
654	K	60.8	Low	57.7	Low	142 Å²	142	93.6 Å²	93.6	62%	0.617	51%	0.505	S	S	*	.	H	α-helix	trans	-65.1	-43.5	175	-76.9	175.7	-179.4	179.9	0	111.2	K650 E651 G656 T657 T658	K650-K654 WeakPolarHBondContact O-CG 3.45Å; K650-K654 PolarHBondContact O-N 2.9Å; K650-K654 VanDerWaalsContact O-N 3.11Å; E651-K654 WeakPolarHBondContact O-CB 3.41Å; E651-K654 PolarHBondContact O-N 3.39Å; E651-K654 VanDerWaalsContact O-N 3.09Å; K654-G656 VanDerWaalsContact C-N 3.3Å; K654-G656 PolarHBondContact O-N 3.47Å; K654-T657 WeakPolarHBondContact CA-OG1 3.48Å; K654-T657 PolarHBondContact O-N 3.44Å; K654-T657 VanDerWaalsContact O-N 3.12Å; K654-T657 PolarHBondContact O-OG1 2.95Å; K654-T657 VanDerWaalsContact O-OG1 3.05Å; K654-T658 WeakPolarHBondContact O-CG2 3.45Å; K654-T658 PolarHBondContact O-N 3.33Å; K654-T658 PolarHBondContact O-OG1 2.83Å; K654-T658 VanDerWaalsContact O-OG1 3.1Å
655	E	53	Low	55.7	Low	107 Å²	107	91.8 Å²	91.8	50%	0.5	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-37.6	174.7	-70.1	-177	177.9	0	0	112.4	E651 T652 T657 T658 V659	E651-E655 PolarHBondContact O-N 3.26Å; T652-E655 PolarHBondContact O-N 3.28Å; E655-T657 VanDerWaalsContact C-N 3.28Å; E655-T657 PolarHBondContact O-N 3.03Å; E655-T658 WeakPolarHBondContact CA-OG1 3.23Å; E655-T658 PolarHBondContact O-OG1 3.45Å; E655-V659 WeakPolarHBondContact O-CB 3.36Å; E655-V659 WeakPolarHBondContact O-CG2 3.18Å; E655-V659 PolarHBondContact O-N 3.16Å
656	G	48.8	Very low	54.5	Low	37 Å²	37	97.1 Å²	97.1	38%	0.381	53%	0.528	S	S	.	.	H	α-helix	trans	-61.6	-34.9	173.4	0	0	0	0	0	113.3	T652 Q653 K654	T652-G656 PolarHBondContact O-N 3.06Å; Q653-G656 PolarHBondContact O-N 2.99Å; K654-G656 VanDerWaalsContact C-N 3.3Å; K654-G656 PolarHBondContact O-N 3.47Å
657	T	44.9	Very low	52.9	Low	99 Å²	99	100.3 Å²	100.3	61%	0.607	55%	0.551	S	S	*	*	H	α-helix	trans	-84	-31	179.3	26.3	0	0	0	0	113.5	Q653 K654 E655 K661	Q653-T657 PolarHBondContact O-N 2.97Å; Q653-T657 VanDerWaalsContact O-N 3.14Å; Q653-T657 PolarHBondContact O-OG1 3.36Å; K654-T657 WeakPolarHBondContact CA-OG1 3.48Å; K654-T657 PolarHBondContact O-N 3.44Å; K654-T657 VanDerWaalsContact O-N 3.12Å; K654-T657 PolarHBondContact O-OG1 2.95Å; K654-T657 VanDerWaalsContact O-OG1 3.05Å; E655-T657 VanDerWaalsContact C-N 3.28Å; E655-T657 PolarHBondContact O-N 3.03Å; T657-K661 PolarHBondContact O-N 2.98Å
658	T	36.4	Very low	51.8	Low	72 Å²	72	101.7 Å²	101.7	44%	0.442	55%	0.55	S	S	.	.	H	α-helix	trans	-77.8	-28.3	175.3	53.6	0	0	0	0	112.7	K654 E655 G660 K661 V662	K654-T658 WeakPolarHBondContact O-CG2 3.45Å; K654-T658 PolarHBondContact O-N 3.33Å; K654-T658 PolarHBondContact O-OG1 2.83Å; K654-T658 VanDerWaalsContact O-OG1 3.1Å; E655-T658 WeakPolarHBondContact CA-OG1 3.23Å; E655-T658 PolarHBondContact O-OG1 3.45Å; T658-G660 PolarHBondContact O-N 3.35Å; T658-K661 CarbonylContact O-C 3.56Å; T658-K661 WeakPolarHBondContact O-CA 3.42Å; T658-K661 PolarHBondContact O-N 3.25Å; T658-V662 PolarHBondContact O-N 3.39Å
659	V	38.8	Very low	51	Low	99 Å²	99	106.9 Å²	106.9	60%	0.6	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-10.3	-180	176.4	0	0	0	0	113.3	E655	E655-V659 WeakPolarHBondContact O-CB 3.36Å; E655-V659 WeakPolarHBondContact O-CG2 3.18Å; E655-V659 PolarHBondContact O-N 3.16Å
660	G	39.9	Very low	50.6	Low	71 Å²	71	109.5 Å²	109.5	73%	0.732	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-22.2	163.6	0	0	0	0	0	114.3	T658	T658-G660 PolarHBondContact O-N 3.35Å
661	K	31.5	Very low	49.7	Very low	165 Å²	165	110.8 Å²	110.8	72%	0.717	61%	0.605	S	S	*	*	S	Bend	trans	-107.8	77.7	172	-70.1	-174.7	177.4	-175.6	0	107.7	T657 T658 E663	T657-K661 PolarHBondContact O-N 2.98Å; T658-K661 CarbonylContact O-C 3.56Å; T658-K661 WeakPolarHBondContact O-CA 3.42Å; T658-K661 PolarHBondContact O-N 3.25Å; K661-E663 PolarHBondContact O-N 3.11Å
662	V	37.2	Very low	48.8	Very low	91 Å²	91	111.7 Å²	111.7	55%	0.552	62%	0.618	S	S	*	*			trans	-35.6	115.8	156.9	176.8	0	0	0	0	105.2	T658 E664	T658-V662 PolarHBondContact O-N 3.39Å; V662-E664 VanDerWaalsContact C-N 3.29Å; V662-E664 PolarHBondContact O-N 3.38Å
663	E	34.5	Very low	48.6	Very low	173 Å²	173	113.7 Å²	113.7	81%	0.808	63%	0.63	S	S	*	*			trans	-44.8	106.6	175.8	-76.5	-174.9	149.3	0	0	105.2	K661 P665	K661-E663 PolarHBondContact O-N 3.11Å; E663-P665 WeakPolarHBondContact O-CD 3.49Å
664	E	40.8	Very low	47.9	Very low	180 Å²	180	109.3 Å²	109.3	84%	0.841	62%	0.621	S	S	*	*			trans	-61.7	110.2	-178.6	-79.8	179.7	162.1	0	0	102.9	V662 L666	V662-E664 VanDerWaalsContact C-N 3.29Å; V662-E664 PolarHBondContact O-N 3.38Å; E664-L666 PolarHBondContact O-N 3.09Å; E664-L666 VanDerWaalsContact O-N 3.15Å
665	P	41.7	Very low	47.6	Very low	63 Å²	63	108.2 Å²	108.2	41%	0.409	62%	0.617	S	S	.	*			trans	-56.9	132.1	175.7	24.2	-30	0	0	0	105.2	E663 S667 Q668	E663-P665 WeakPolarHBondContact O-CD 3.49Å; P665-S667 WeakPolarHBondContact O-CA 3.42Å; P665-S667 PolarHBondContact O-N 2.89Å; P665-Q668 HydrophobicContact CG-CG 4.16Å
666	L	55.9	Low	47.1	Very low	187 Å²	187	107.2 Å²	107.2	98%	0.979	62%	0.622	S	S	*	*	S	Bend	trans	-49.7	-26.4	-171.7	-150.4	97.9	0	0	0	112.4	E664	E664-L666 PolarHBondContact O-N 3.09Å; E664-L666 VanDerWaalsContact O-N 3.15Å
667	S	50.3	Low	47.3	Very low	76 Å²	76	113.2 Å²	113.2	53%	0.531	64%	0.64	S	S	.	*	S	Bend	trans	-153.9	147	155.1	60	0	0	0	0	110.7	P665 E671	P665-S667 WeakPolarHBondContact O-CA 3.42Å; P665-S667 PolarHBondContact O-N 2.89Å; S667-E671 WeakPolarHBondContact CA-OE2 3.33Å; S667-E671 WeakPolarHBondContact CB-OE2 3.41Å
668	Q	55.9	Low	47.4	Very low	75 Å²	75	115.3 Å²	115.3	35%	0.35	65%	0.646	S	S	.	*			trans	-71.9	144.8	168.5	-68.4	-81.9	-16.7	0	0	109.7	P665 D670 E671	P665-Q668 HydrophobicContact CG-CG 4.16Å; Q668-D670 PolarHBondContact O-N 2.82Å; Q668-D670 VanDerWaalsContact O-N 3.14Å; Q668-E671 HydrophobicContact CB-CB 4.14Å; Q668-E671 PolarHBondContact N-OE2 3.38Å; Q668-E671 WeakPolarHBondContact O-CB 3.28Å; Q668-E671 PolarHBondContact O-N 3.18Å
669	P	58.8	Low	47.3	Very low	130 Å²	130	116.3 Å²	116.3	84%	0.844	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-23.1	179.5	22.2	-30	0	0	0	113.6
670	D	65.2	Low	47.3	Very low	126 Å²	126	120 Å²	120	67%	0.674	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	2.6	176.4	43.1	-47.4	0	0	0	113.3	Q668 V672	Q668-D670 PolarHBondContact O-N 2.82Å; Q668-D670 VanDerWaalsContact O-N 3.14Å; D670-V672 PolarHBondContact O-N 3.35Å; D670-V672 VanDerWaalsContact O-N 3.16Å
671	E	52.3	Low	46.9	Very low	116 Å²	116	126.6 Å²	126.6	54%	0.542	67%	0.668	S	S	.	*			trans	-65.7	116.1	174.8	-159.2	171.3	173.3	0	0	110	S667 Q668 V673	S667-E671 WeakPolarHBondContact CA-OE2 3.33Å; S667-E671 WeakPolarHBondContact CB-OE2 3.41Å; Q668-E671 HydrophobicContact CB-CB 4.14Å; Q668-E671 PolarHBondContact N-OE2 3.38Å; Q668-E671 WeakPolarHBondContact O-CB 3.28Å; Q668-E671 PolarHBondContact O-N 3.18Å; E671-V673 PolarHBondContact O-N 2.92Å
672	V	50.7	Low	47.1	Very low	135 Å²	135	121.3 Å²	121.3	82%	0.818	65%	0.651	S	S	*	*			trans	-65.3	112	-176.3	-175.7	0	0	0	0	108.7	D670 G674	D670-V672 PolarHBondContact O-N 3.35Å; D670-V672 VanDerWaalsContact O-N 3.16Å; V672-G674 PolarHBondContact O-N 3.11Å
673	V	59.8	Low	47.2	Very low	108 Å²	108	124 Å²	124	66%	0.655	66%	0.663	S	S	*	*			trans	-64.7	100.7	173.8	-178.1	0	0	0	0	108.7	E671 F675	E671-V673 PolarHBondContact O-N 2.92Å; V673-F675 HydrophobicContact CG1-CZ 4.41Å; V673-F675 VanDerWaalsContact O-CD2 3.31Å; V673-F675 WeakPolarHBondContact O-CD2 3.36Å; V673-F675 PolarHBondContact O-N 3.02Å; V673-F675 VanDerWaalsContact O-N 3.07Å
674	G	49.1	Very low	47.5	Very low	43 Å²	43	118.5 Å²	118.5	44%	0.443	64%	0.638	S	S	.	*			trans	-69.5	99.5	176.3	0	0	0	0	0	110.8	V672 S676	V672-G674 PolarHBondContact O-N 3.11Å; G674-S676 PolarHBondContact O-N 2.86Å
675	F	53.6	Low	47.3	Very low	119 Å²	119	114.9 Å²	114.9	52%	0.522	63%	0.633	S	S	.	*			trans	-69.7	113.2	171	-63.4	-86.7	0	0	0	109.1	V673 Q677 L678 Q679	V673-F675 HydrophobicContact CG1-CZ 4.41Å; V673-F675 VanDerWaalsContact O-CD2 3.31Å; V673-F675 WeakPolarHBondContact O-CD2 3.36Å; V673-F675 PolarHBondContact O-N 3.02Å; V673-F675 VanDerWaalsContact O-N 3.07Å; F675-Q677 PolarHBondContact O-N 3.4Å; F675-Q677 VanDerWaalsContact O-N 3.08Å; F675-L678 HydrophobicContact CB-CB 4.02Å; F675-L678 HydrophobicContact CB-CD1 3.88Å; F675-L678 HydrophobicContact CB-CG 3.92Å; F675-L678 HydrophobicContact CD2-CD1 3.91Å; F675-L678 HydrophobicContact CG-CD1 4.07Å; F675-L678 CarbonylContact O-C 3.34Å; F675-L678 WeakPolarHBondContact O-CA 3.48Å; F675-L678 PolarHBondContact O-N 2.98Å; F675-Q679 PolarHBondContact O-N 3.15Å
676	S	42.2	Very low	47.2	Very low	87 Å²	87	116.6 Å²	116.6	61%	0.608	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.9	-25.6	178.4	60.4	0	0	0	0	113.3	G674	G674-S676 PolarHBondContact O-N 2.86Å
677	Q	54.4	Low	46.7	Very low	163 Å²	163	111.5 Å²	111.5	76%	0.762	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-20.8	173.7	-58.1	92	-3.2	0	0	114	F675	F675-Q677 PolarHBondContact O-N 3.4Å; F675-Q677 VanDerWaalsContact O-N 3.08Å
678	L	47.1	Very low	46.7	Very low	142 Å²	142	114.5 Å²	114.5	74%	0.743	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	-19.6	176.4	-62.2	176.4	0	0	0	112.3	F675 M680	F675-L678 HydrophobicContact CB-CB 4.02Å; F675-L678 HydrophobicContact CB-CD1 3.88Å; F675-L678 HydrophobicContact CB-CG 3.92Å; F675-L678 HydrophobicContact CD2-CD1 3.91Å; F675-L678 HydrophobicContact CG-CD1 4.07Å; F675-L678 CarbonylContact O-C 3.34Å; F675-L678 WeakPolarHBondContact O-CA 3.48Å; F675-L678 PolarHBondContact O-N 2.98Å; L678-M680 PolarHBondContact O-N 2.79Å; L678-M680 VanDerWaalsContact O-N 3.08Å
679	Q	34.5	Very low	46.6	Very low	93 Å²	93	113.9 Å²	113.9	44%	0.435	63%	0.627	S	S	.	*			trans	-74.4	97.8	171.9	-75.9	178.5	-27.6	0	0	109.8	F675 K681	F675-Q679 PolarHBondContact O-N 3.15Å; Q679-K681 PolarHBondContact O-N 3.25Å
680	M	37	Very low	46.6	Very low	176 Å²	176	109 Å²	109	87%	0.867	59%	0.594	S	S	*	*			trans	-54.9	92.1	154.2	-78.8	-92.7	-164.7	0	0	107.7	L678 S682	L678-M680 PolarHBondContact O-N 2.79Å; L678-M680 VanDerWaalsContact O-N 3.08Å; M680-S682 PolarHBondContact O-N 3.14Å; M680-S682 PolarHBondContact O-OG 2.89Å
681	K	32.8	Very low	46.1	Very low	211 Å²	211	105.6 Å²	105.6	92%	0.917	57%	0.573	S	S	*	*	S	Bend	trans	3.6	82.6	172	-71	-178.2	174.8	179.1	0	114.3	Q679	Q679-K681 PolarHBondContact O-N 3.25Å
682	S	35.1	Very low	46.3	Very low	54 Å²	54	104.4 Å²	104.4	38%	0.378	57%	0.571	S	S	.	*			trans	-158.7	69.8	166.5	56.4	0	0	0	0	112	M680 L684 S685	M680-S682 PolarHBondContact O-N 3.14Å; M680-S682 PolarHBondContact O-OG 2.89Å; S682-L684 PolarHBondContact O-N 3.2Å; S682-S685 PolarHBondContact O-N 3.03Å; S682-S685 PolarHBondContact O-OG 3.42Å
683	D	39.2	Very low	46.4	Very low	148 Å²	148	101.2 Å²	101.2	79%	0.791	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	13.1	165.1	-80.8	-23.3	0	0	0	114
684	L	40.7	Very low	46.2	Very low	56 Å²	56	98.7 Å²	98.7	29%	0.293	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-8.2	-179.5	-90.1	126.5	0	0	0	114.1	M247 S682 A686 K687	M247-L684 HydrophobicContact CE-CD2 4.5Å; S682-L684 PolarHBondContact O-N 3.2Å; L684-A686 PolarHBondContact O-N 3.4Å; L684-K687 HydrophobicContact CD2-CD 4.41Å
685	S	37.4	Very low	46.5	Very low	104 Å²	104	101.5 Å²	101.5	73%	0.727	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-12.3	-171.2	55.3	0	0	0	0	115.5	S682 K687	S682-S685 PolarHBondContact O-N 3.03Å; S682-S685 PolarHBondContact O-OG 3.42Å; S685-K687 VanDerWaalsContact C-N 3.34Å
686	A	39.9	Very low	46.5	Very low	99 Å²	99	97.9 Å²	97.9	82%	0.818	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	10.3	176.1	0	0	0	0	0	114	L684 E688	L684-A686 PolarHBondContact O-N 3.4Å; A686-E688 PolarHBondContact O-N 3.12Å
687	K	45.6	Very low	46.9	Very low	80 Å²	80	98.1 Å²	98.1	35%	0.348	52%	0.519	S	S	.	.			trans	-87.4	106.4	174.7	-74.7	-179.6	173.2	175.6	0	109.2	S281 L684 S685	S281-K687 PolarHBondContact O-NZ 2.83Å; L684-K687 HydrophobicContact CD2-CD 4.41Å; S685-K687 VanDerWaalsContact C-N 3.34Å
688	E	49.1	Very low	46.7	Very low	140 Å²	140	94.6 Å²	94.6	65%	0.654	52%	0.518	S	S	*	.			trans	-51.1	140.7	171.3	-66.9	-176.3	156.5	0	0	110.6	A686 L690	A686-E688 PolarHBondContact O-N 3.12Å; E688-L690 PolarHBondContact O-N 2.92Å
689	N	54.6	Low	46.9	Very low	61 Å²	61	92.9 Å²	92.9	33%	0.326	51%	0.509	S	S	.	.			trans	-65.2	103.4	180	-174.9	-2.9	0	0	0	109.1	Y243 F691 D692 Q693	Y243-N689 WeakPolarHBondContact CE1-OD1 3.48Å; N689-F691 PolarHBondContact O-N 3.09Å; N689-F691 VanDerWaalsContact O-N 3.08Å; N689-F691 PolarHBondContact OD1-N 3.28Å; N689-D692 HydrophobicContact CB-CB 4.18Å; N689-D692 PolarHBondContact ND2-OD2 2.93Å; N689-D692 PolarHBondContact O-N 3.27Å; N689-Q693 PolarHBondContact O-N 3.2Å
690	L	57.5	Low	47.2	Very low	29 Å²	29	89.8 Å²	89.8	15%	0.152	50%	0.502	C	S	.	.	H	α-helix	trans	-54	-31.5	-176.8	-87.8	153.6	0	0	0	112.9	Y243 S281 R315 E688 S694	Y243-L690 PolarHBondContact OH-N 3.36Å; Y243-L690 VanDerWaalsContact OH-N 3.13Å; S281-L690 WeakPolarHBondContact OG-CD1 3.49Å; R315-L690 VanDerWaalsContact NH1-CD2 3.34Å; R315-L690 VanDerWaalsContact NH2-CD2 3.27Å; E688-L690 PolarHBondContact O-N 2.92Å; L690-S694 VanDerWaalsContact O-CB 3.23Å; L690-S694 WeakPolarHBondContact O-CB 3.35Å; L690-S694 PolarHBondContact O-N 3.31Å; L690-S694 PolarHBondContact O-OG 3.47Å
691	F	55.3	Low	47.2	Very low	53 Å²	53	87.5 Å²	87.5	23%	0.232	49%	0.489	C	S	.	.	H	α-helix	trans	-71.5	-42.4	176.9	-76	-73.9	0	0	0	112.3	Q240 Y243 E274 V278 N689 Q693 S694 L695	Q240-F691 HydrophobicContact CB-CZ 4.49Å; Q240-F691 HydrophobicContact CG-CE1 3.79Å; Q240-F691 HydrophobicContact CG-CE2 4.22Å; Q240-F691 HydrophobicContact CG-CZ 3.63Å; Y243-F691 AromaticContact CD1-CD2 3.37Å; Y243-F691 HydrophobicContact CD1-CD2 3.37Å; Y243-F691 AromaticContact CD1-CE2 3.44Å; Y243-F691 HydrophobicContact CD1-CE2 3.44Å; Y243-F691 VanDerWaalsContact CD1-CE2 3.44Å; Y243-F691 AromaticContact CE1-CD2 3.61Å; Y243-F691 HydrophobicContact CE1-CD2 3.61Å; Y243-F691 HydrophobicContact CE1-CE2 4Å; Y243-F691 HydrophobicContact CG-CD2 4.3Å; Y243-F691 AromaticContact CG-CE2 3.93Å; Y243-F691 HydrophobicContact CG-CE2 3.93Å; E274-F691 WeakPolarHBondContact OE2-CZ 3.32Å; V278-F691 HydrophobicContact CG2-CE2 4.35Å; V278-F691 HydrophobicContact CG2-CZ 4.5Å; N689-F691 PolarHBondContact O-N 3.09Å; N689-F691 VanDerWaalsContact O-N 3.08Å; N689-F691 PolarHBondContact OD1-N 3.28Å; F691-Q693 VanDerWaalsContact C-N 3.29Å; F691-Q693 PolarHBondContact O-N 3.46Å; F691-S694 PolarHBondContact O-N 3.22Å; F691-L695 WeakPolarHBondContact O-CB 3.35Å; F691-L695 PolarHBondContact O-N 2.91Å
692	D	55.9	Low	47.5	Very low	92 Å²	92	83.3 Å²	83.3	49%	0.492	47%	0.473	S	S	.	.	H	α-helix	trans	-66.3	-37.3	176.9	-70.8	-28.5	0	0	0	110.5	N689 S696	N689-D692 HydrophobicContact CB-CB 4.18Å; N689-D692 PolarHBondContact ND2-OD2 2.93Å; N689-D692 PolarHBondContact O-N 3.27Å; D692-S696 WeakPolarHBondContact O-CB 3.23Å; D692-S696 PolarHBondContact O-N 2.66Å; D692-S696 PolarHBondContact O-OG 3.1Å
693	Q	54.5	Low	47.4	Very low	67 Å²	67	92 Å²	92	31%	0.313	50%	0.497	S	S	.	.	H	α-helix	trans	-67.5	-47.3	175.5	-165.9	-178.6	28.6	0	0	111.7	N689 F691 L695 S696 Q697	N689-Q693 PolarHBondContact O-N 3.2Å; F691-Q693 VanDerWaalsContact C-N 3.29Å; F691-Q693 PolarHBondContact O-N 3.46Å; Q693-L695 VanDerWaalsContact C-N 3.34Å; Q693-L695 PolarHBondContact O-N 3.02Å; Q693-S696 PolarHBondContact O-N 3.4Å; Q693-Q697 WeakPolarHBondContact O-CB 3.08Å; Q693-Q697 VanDerWaalsContact O-CG 3.31Å; Q693-Q697 WeakPolarHBondContact O-CG 3.41Å; Q693-Q697 PolarHBondContact O-N 2.85Å
694	S	54.1	Low	47.1	Very low	56 Å²	56	92.9 Å²	92.9	39%	0.392	49%	0.494	S	S	.	.	H	α-helix	trans	-63.5	-40.3	177.6	-59.7	0	0	0	0	111.5	L690 F691 Q697 A698	L690-S694 VanDerWaalsContact O-CB 3.23Å; L690-S694 WeakPolarHBondContact O-CB 3.35Å; L690-S694 PolarHBondContact O-N 3.31Å; L690-S694 PolarHBondContact O-OG 3.47Å; F691-S694 PolarHBondContact O-N 3.22Å; S694-Q697 PolarHBondContact O-N 3.32Å; S694-A698 VanDerWaalsContact O-CB 3.3Å; S694-A698 WeakPolarHBondContact O-CB 3.32Å; S694-A698 PolarHBondContact O-N 3.26Å
695	L	56.6	Low	46.7	Very low	102 Å²	102	94.9 Å²	94.9	53%	0.534	52%	0.519	S	S	.	.	H	α-helix	trans	-65.6	-42.8	175.4	-173	69.9	0	0	0	110.8	F691 Q693 A698 L699	F691-L695 WeakPolarHBondContact O-CB 3.35Å; F691-L695 PolarHBondContact O-N 2.91Å; Q693-L695 VanDerWaalsContact C-N 3.34Å; Q693-L695 PolarHBondContact O-N 3.02Å; L695-A698 PolarHBondContact O-N 3.03Å; L695-L699 HydrophobicContact CD1-CD1 4.34Å; L695-L699 HydrophobicContact CD2-CD1 4.49Å; L695-L699 HydrophobicContact CG-CD1 3.88Å; L695-L699 VanDerWaalsContact O-CB 3.31Å; L695-L699 WeakPolarHBondContact O-CB 3.44Å; L695-L699 WeakPolarHBondContact O-CD1 3.44Å; L695-L699 WeakPolarHBondContact O-CG 3.21Å; L695-L699 PolarHBondContact O-N 3.35Å
696	S	52.9	Low	46.4	Very low	42 Å²	42	96.3 Å²	96.3	29%	0.294	51%	0.514	S	S	.	.	H	α-helix	trans	-63.9	-40.9	175.8	-59.7	0	0	0	0	111.5	D692 Q693 L699 G700 Q701	D692-S696 WeakPolarHBondContact O-CB 3.23Å; D692-S696 PolarHBondContact O-N 2.66Å; D692-S696 PolarHBondContact O-OG 3.1Å; Q693-S696 PolarHBondContact O-N 3.4Å; S696-L699 CarbonylContact O-C 3.56Å; S696-L699 PolarHBondContact O-N 3Å; S696-G700 PolarHBondContact O-N 3.46Å; S696-G700 VanDerWaalsContact O-N 3.15Å; S696-Q701 CarbonylContact O-C 3.57Å; S696-Q701 WeakPolarHBondContact O-CA 3.44Å; S696-Q701 PolarHBondContact O-N 2.84Å
697	Q	51.1	Low	45.9	Very low	93 Å²	93	97.6 Å²	97.6	44%	0.435	50%	0.501	S	S	.	.	H	α-helix	trans	-64.1	-45.3	174.2	-74.1	178.1	8.8	0	0	111.7	Q693 S694 L699 G700 Q702	Q693-Q697 WeakPolarHBondContact O-CB 3.08Å; Q693-Q697 VanDerWaalsContact O-CG 3.31Å; Q693-Q697 WeakPolarHBondContact O-CG 3.41Å; Q693-Q697 PolarHBondContact O-N 2.85Å; S694-Q697 PolarHBondContact O-N 3.32Å; Q697-L699 VanDerWaalsContact C-N 3.27Å; Q697-L699 PolarHBondContact O-N 3.28Å; Q697-G700 PolarHBondContact O-N 3.03Å; Q697-Q702 HydrophobicContact CG-CG 4.31Å
698	A	48.9	Very low	45.2	Very low	89 Å²	89	102 Å²	102	74%	0.736	52%	0.521	S	S	*	.	H	α-helix	trans	-64.7	-31.7	177.4	0	0	0	0	0	112.6	S694 L695 G700	S694-A698 VanDerWaalsContact O-CB 3.3Å; S694-A698 WeakPolarHBondContact O-CB 3.32Å; S694-A698 PolarHBondContact O-N 3.26Å; L695-A698 PolarHBondContact O-N 3.03Å; A698-G700 VanDerWaalsContact C-N 3.26Å
699	L	51.3	Low	44.4	Very low	106 Å²	106	100.5 Å²	100.5	56%	0.555	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	0.3	173	-70.1	166.7	0	0	0	113.2	L695 S696 Q697 Q701	L695-L699 HydrophobicContact CD1-CD1 4.34Å; L695-L699 HydrophobicContact CD2-CD1 4.49Å; L695-L699 HydrophobicContact CG-CD1 3.88Å; L695-L699 VanDerWaalsContact O-CB 3.31Å; L695-L699 WeakPolarHBondContact O-CB 3.44Å; L695-L699 WeakPolarHBondContact O-CD1 3.44Å; L695-L699 WeakPolarHBondContact O-CG 3.21Å; L695-L699 PolarHBondContact O-N 3.35Å; S696-L699 CarbonylContact O-C 3.56Å; S696-L699 PolarHBondContact O-N 3Å; Q697-L699 VanDerWaalsContact C-N 3.27Å; Q697-L699 PolarHBondContact O-N 3.28Å; L699-Q701 HydrophobicContact CB-CG 4.27Å; L699-Q701 PolarHBondContact O-N 2.98Å
700	G	41.2	Very low	43.6	Very low	28 Å²	28	103.4 Å²	103.4	29%	0.289	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.9	13.6	-177.1	0	0	0	0	0	114.3	S696 Q697 A698 Q702 S737	S696-G700 PolarHBondContact O-N 3.46Å; S696-G700 VanDerWaalsContact O-N 3.15Å; Q697-G700 PolarHBondContact O-N 3.03Å; A698-G700 VanDerWaalsContact C-N 3.26Å; G700-Q702 VanDerWaalsContact C-N 3.31Å; G700-Q702 PolarHBondContact O-N 3.18Å; G700-S737 PolarHBondContact O-OG 2.95Å
701	Q	38.3	Very low	42.8	Very low	127 Å²	127	105.6 Å²	105.6	59%	0.593	56%	0.558	S	S	*	*			trans	-93.5	49.8	178.6	-63.1	-175.4	-7.9	0	0	111.2	S696 L699 R703	S696-Q701 CarbonylContact O-C 3.57Å; S696-Q701 WeakPolarHBondContact O-CA 3.44Å; S696-Q701 PolarHBondContact O-N 2.84Å; L699-Q701 HydrophobicContact CB-CG 4.27Å; L699-Q701 PolarHBondContact O-N 2.98Å; Q701-R703 PolarHBondContact O-N 3.31Å
702	Q	37.8	Very low	42.1	Very low	123 Å²	123	106.6 Å²	106.6	58%	0.575	57%	0.571	S	S	*	*			trans	-59	104.4	168	-90.7	-169.1	-22.3	0	0	108.7	Q697 G700 K704	Q697-Q702 HydrophobicContact CG-CG 4.31Å; G700-Q702 VanDerWaalsContact C-N 3.31Å; G700-Q702 PolarHBondContact O-N 3.18Å; Q702-K704 PolarHBondContact O-N 3.21Å
703	R	33.9	Very low	41.7	Very low	238 Å²	238	106 Å²	106	90%	0.898	57%	0.57	S	S	*	*			trans	-66.2	95.4	155.5	-71.4	-175.4	-178.8	179	0.7	105.7	Q701 A705	Q701-R703 PolarHBondContact O-N 3.31Å; R703-A705 PolarHBondContact O-N 2.95Å
704	K	32.7	Very low	41.4	Very low	166 Å²	166	108.6 Å²	108.6	72%	0.722	58%	0.581	S	S	*	*			trans	-48.7	128.9	158.8	-80.5	-178.8	177.3	173.5	0	105.6	Q702 E706	Q702-K704 PolarHBondContact O-N 3.21Å; K704-E706 VanDerWaalsContact C-N 3.31Å; K704-E706 PolarHBondContact O-N 3.26Å
705	A	32.6	Very low	41.5	Very low	98 Å²	98	111.6 Å²	111.6	81%	0.81	59%	0.592	S	S	*	*			trans	-52	102.9	173.9	0	0	0	0	0	107.3	R703 K707	R703-A705 PolarHBondContact O-N 2.95Å; A705-K707 PolarHBondContact O-N 3.49Å
706	E	30.6	Very low	41.8	Very low	134 Å²	134	113 Å²	113	63%	0.626	60%	0.6	S	S	*	*			trans	-69	84.1	-174.8	-76.3	179.7	165.5	0	0	107.3	K704	K704-E706 VanDerWaalsContact C-N 3.31Å; K704-E706 PolarHBondContact O-N 3.26Å
707	K	30	Very low	42.6	Very low	125 Å²	125	114.9 Å²	114.9	54%	0.543	61%	0.607	S	S	.	*			trans	-68.5	129	144.7	-72.6	-175.6	176.4	178.6	0	105.2	A705	A705-K707 PolarHBondContact O-N 3.49Å
708	F	30.7	Very low	44.1	Very low	174 Å²	174	113.4 Å²	113.4	76%	0.763	60%	0.601	S	S	*	*	S	Bend	trans	104.3	130.4	179.1	-58.6	-73.6	0	0	0	116.5	I710	F708-I710 PolarHBondContact O-N 3.34Å
709	T	32.3	Very low	45.9	Very low	108 Å²	108	111.4 Å²	111.4	66%	0.663	58%	0.58	S	S	*	*			trans	-53.6	117.2	-164.1	-21.4	0	0	0	0	113.1	A711 S712	T709-A711 PolarHBondContact O-N 3.22Å; T709-S712 PolarHBondContact O-N 3.43Å
710	I	36.9	Very low	47.7	Very low	122 Å²	122	110 Å²	110	63%	0.626	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50	-17.6	-171.3	-69.1	162.1	0	0	0	116.2	F708	F708-I710 PolarHBondContact O-N 3.34Å
711	A	41.9	Very low	50.1	Low	75 Å²	75	109.1 Å²	109.1	62%	0.62	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-30.5	-170.2	0	0	0	0	0	115.3	T709	T709-A711 PolarHBondContact O-N 3.22Å
712	S	39.6	Very low	52.7	Low	73 Å²	73	103.3 Å²	103.3	51%	0.51	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-43.4	-172	46.5	0	0	0	0	112.9	T709 K714 L715	T709-S712 PolarHBondContact O-N 3.43Å; S712-K714 PolarHBondContact O-N 2.96Å; S712-L715 PolarHBondContact O-N 3.37Å
713	T	47.3	Very low	55.1	Low	79 Å²	79	98.9 Å²	98.9	49%	0.485	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-25.8	-169.3	-4.4	0	0	0	0	114.2	L715	T713-L715 VanDerWaalsContact C-N 3.31Å
714	K	49.2	Very low	57.7	Low	123 Å²	123	94 Å²	94	54%	0.535	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-28.1	177.8	-75.7	-173.3	177.8	178.2	0	112.6	S712 N717 L733	S712-K714 PolarHBondContact O-N 2.96Å; K714-N717 PolarHBondContact O-N 3.49Å; K714-L733 WeakPolarHBondContact O-CD1 3.37Å
715	L	55.8	Low	60.3	Low	118 Å²	118	91.9 Å²	91.9	62%	0.618	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-28.3	179.5	-66.2	173.9	0	0	0	111.9	S712 T713 N717 I718	S712-L715 PolarHBondContact O-N 3.37Å; T713-L715 VanDerWaalsContact C-N 3.31Å; L715-N717 PolarHBondContact O-N 2.87Å; L715-I718 HydrophobicContact CD2-CD1 3.63Å; L715-I718 PolarHBondContact O-N 2.88Å
716	D	62.5	Low	63	Low	133 Å²	133	89.6 Å²	89.6	71%	0.711	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-21.4	175.1	-71.7	-16	0	0	0	112.7
717	N	70.6	Confident	65.8	Low	81 Å²	81	85.7 Å²	85.7	43%	0.433	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	9.3	-179.8	-69	-2.3	0	0	0	113.9	K714 L715 L733 I734	K714-N717 PolarHBondContact O-N 3.49Å; L715-N717 PolarHBondContact O-N 2.87Å; N717-L733 HydrophobicContact CB-CD1 4.08Å; N717-I734 PolarHBondContact O-N 3.49Å; N717-I734 VanDerWaalsContact O-N 3.1Å
718	I	82	Confident	68.7	Low	62 Å²	62	79.7 Å²	79.7	32%	0.318	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	122.2	177.5	-59.1	176	0	0	0	109	L715 E731 L733	L715-I718 HydrophobicContact CD2-CD1 3.63Å; L715-I718 PolarHBondContact O-N 2.88Å; I718-E731 HydrophobicContact CG2-CB 4.18Å; I718-E731 HydrophobicContact CG2-CG 4.48Å; I718-L733 HydrophobicContact CG1-CD1 3.85Å
719	T	86	Confident	71.8	Confident	47 Å²	47	72.8 Å²	72.8	29%	0.288	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	125.7	177.6	49.2	0	0	0	0	110.2	L721 E731 A732 I734	T719-L721 PolarHBondContact O-N 3.48Å; T719-E731 CarbonylContact O-C 3.57Å; T719-E731 WeakPolarHBondContact O-CA 3.44Å; T719-A732 PolarHBondContact N-O 3.44Å; T719-A732 PolarHBondContact O-N 3.39Å; T719-A732 PolarHBondContact OG1-O 2.99Å; T719-A732 VanDerWaalsContact OG1-O 3.06Å; T719-I734 HydrophobicContact CG2-CD1 3.73Å
720	Q	90.7	Very high	74.6	Confident	77 Å²	77	67.8 Å²	67.8	36%	0.36	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	122.9	173.8	-179.3	174.7	3.2	0	0	109.7	S722 F724 Y729	Q720-S722 VanDerWaalsContact CG-O 3.22Å; Q720-S722 WeakPolarHBondContact CG-O 3.26Å; Q720-S722 PolarHBondContact NE2-O 3.41Å; Q720-F724 VanDerWaalsContact NE2-CE2 3.32Å; Q720-Y729 HydrophobicContact CG-CE2 4.21Å
721	L	91.4	Very high	77.3	Confident	8 Å²	8	64.4 Å²	64.4	4%	0.042	37%	0.366	C	S	.	.			trans	-100.9	-33.8	-176.9	-60.7	-176.2	0	0	0	113	T719 A730 A732 L821 N822 I824	T719-L721 PolarHBondContact O-N 3.48Å; L721-A730 WeakPolarHBondContact CA-O 3.37Å; L721-A730 HydrophobicContact CB-CB 4.14Å; L721-A730 WeakPolarHBondContact CB-O 3.26Å; L721-A730 PolarHBondContact N-O 2.84Å; L721-A732 HydrophobicContact CD1-CB 3.63Å; L721-A732 HydrophobicContact CD2-CB 4.41Å; L721-A732 HydrophobicContact CG-CB 4.05Å; L721-L821 HydrophobicContact CB-CB 4.23Å; L721-L821 HydrophobicContact CB-CD2 3.97Å; L721-L821 HydrophobicContact CB-CG 4.48Å; L721-L821 HydrophobicContact CD1-CD1 4.33Å; L721-L821 CarbonylContact O-C 3.49Å; L721-L821 WeakPolarHBondContact O-CA 3.36Å; L721-N822 PolarHBondContact O-N 3.41Å; L721-I824 HydrophobicContact CD2-CD1 3.77Å; L721-I824 HydrophobicContact CD2-CG1 3.58Å
722	S	91.7	Very high	79.6	Confident	5 Å²	5	60.8 Å²	60.8	4%	0.035	34%	0.336	C	S	.	.	S	Bend	trans	-126.1	160.3	174.6	71.5	0	0	0	0	112.2	Q720 D726 V728 Y729 A730	Q720-S722 VanDerWaalsContact CG-O 3.22Å; Q720-S722 WeakPolarHBondContact CG-O 3.26Å; Q720-S722 PolarHBondContact NE2-O 3.41Å; S722-D726 WeakPolarHBondContact CB-OD2 3.35Å; S722-V728 PolarHBondContact OG-O 3.06Å; S722-Y729 VanDerWaalsContact OG-CA 3.23Å; S722-Y729 WeakPolarHBondContact OG-CA 3.48Å; S722-A730 PolarHBondContact N-O 3.31Å; S722-A730 VanDerWaalsContact N-O 3.11Å; S722-A730 PolarHBondContact OG-N 3.06Å
723	G	89.3	Confident	81.9	Confident	30 Å²	30	59.8 Å²	59.8	31%	0.309	32%	0.324	S	S	.	.			trans	-71.5	153.7	-178.5	0	0	0	0	0	112	S725 D726	G723-S725 PolarHBondContact O-N 3.17Å; G723-S725 VanDerWaalsContact O-N 3.08Å; G723-D726 PolarHBondContact N-OD2 3.39Å; G723-D726 WeakPolarHBondContact O-CB 3.5Å; G723-D726 PolarHBondContact O-N 3.24Å; G723-D726 VanDerWaalsContact O-N 3.1Å
724	F	87.3	Confident	83.7	Confident	137 Å²	137	57.1 Å²	57.1	60%	0.601	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-10.2	174.6	-63.5	-69.1	0	0	0	114.1	Q720 Y729 Q750	Q720-F724 VanDerWaalsContact NE2-CE2 3.32Å; F724-Y729 AromaticContact CD1-CD2 3.96Å; F724-Y729 HydrophobicContact CD1-CD2 3.96Å; F724-Y729 AromaticContact CD1-CE2 3.61Å; F724-Y729 HydrophobicContact CD1-CE2 3.61Å; F724-Y729 HydrophobicContact CE1-CD2 4.24Å; F724-Y729 AromaticContact CE1-CE2 3.44Å; F724-Y729 HydrophobicContact CE1-CE2 3.44Å; F724-Y729 VanDerWaalsContact CE1-CE2 3.44Å; F724-Y729 AromaticContact CE1-CZ 3.83Å; F724-Y729 HydrophobicContact CZ-CE2 4.23Å; F724-Q750 PolarHBondContact O-NE2 3.33Å; F724-Q750 PolarHBondContact O-OE1 2.92Å; F724-Q750 VanDerWaalsContact O-OE1 3.07Å
725	S	87.4	Confident	85.1	Confident	120 Å²	120	54.5 Å²	54.5	84%	0.839	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-1.9	177.6	-54.9	0	0	0	0	113.1	G723	G723-S725 PolarHBondContact O-N 3.17Å; G723-S725 VanDerWaalsContact O-N 3.08Å
726	D	90.7	Very high	85.9	Confident	51 Å²	51	51.8 Å²	51.8	27%	0.273	29%	0.287	S	S	.	.	S	Bend	trans	-77.5	145	178.3	-68.4	-31.5	0	0	0	110.4	S722 G723 V728 Q750 I819	S722-D726 WeakPolarHBondContact CB-OD2 3.35Å; G723-D726 PolarHBondContact N-OD2 3.39Å; G723-D726 WeakPolarHBondContact O-CB 3.5Å; G723-D726 PolarHBondContact O-N 3.24Å; G723-D726 VanDerWaalsContact O-N 3.1Å; D726-V728 PolarHBondContact O-N 2.99Å; D726-Q750 PolarHBondContact O-OE1 2.94Å; D726-Q750 VanDerWaalsContact O-OE1 3.06Å; D726-I819 HydrophobicContact CB-CD1 4.29Å
727	P	88.5	Confident	86.4	Confident	51 Å²	51	47.2 Å²	47.2	33%	0.331	27%	0.266	S	S	.	.	S	Bend	trans	-55.9	-28.7	178.5	-25.7	34	0	0	0	113.7	Q750 T751 Y807	P727-Q750 WeakPolarHBondContact O-CB 3.49Å; P727-Q750 PolarHBondContact O-N 3.18Å; P727-T751 HydrophobicContact CB-CG2 3.62Å; P727-Y807 WeakPolarHBondContact CB-OH 3.46Å; P727-Y807 WeakPolarHBondContact CG-OH 3.31Å
728	V	92	Very high	86.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	116.2	174.7	-174.7	0	0	0	0	108.5	S722 D726 I747 V748 L755 L758 L805 Y807 I819	S722-V728 PolarHBondContact OG-O 3.06Å; D726-V728 PolarHBondContact O-N 2.99Å; V728-I747 HydrophobicContact CG1-CG2 3.3Å; V728-V748 WeakPolarHBondContact CA-O 3.29Å; V728-L755 HydrophobicContact CG2-CD1 3.43Å; V728-L755 VanDerWaalsContact CG2-CD1 3.43Å; V728-L758 HydrophobicContact CG1-CD1 4.09Å; V728-L758 HydrophobicContact CG2-CD1 4.14Å; V728-L805 HydrophobicContact CG1-CD1 3.94Å; V728-Y807 HydrophobicContact CG2-CD1 3.9Å; V728-Y807 HydrophobicContact CG2-CE1 3.69Å; V728-Y807 HydrophobicContact CG2-CG 4.5Å; V728-I819 HydrophobicContact CB-CD1 3.67Å; V728-I819 HydrophobicContact CG2-CD1 4.04Å
729	Y	94	Very high	86	Confident	29 Å²	29	50 Å²	50	11%	0.114	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	136	172.6	175.7	-99.3	0	0	0	110.4	Q720 S722 F724 E731 I747 V748	Q720-Y729 HydrophobicContact CG-CE2 4.21Å; S722-Y729 VanDerWaalsContact OG-CA 3.23Å; S722-Y729 WeakPolarHBondContact OG-CA 3.48Å; F724-Y729 AromaticContact CD1-CD2 3.96Å; F724-Y729 HydrophobicContact CD1-CD2 3.96Å; F724-Y729 AromaticContact CD1-CE2 3.61Å; F724-Y729 HydrophobicContact CD1-CE2 3.61Å; F724-Y729 HydrophobicContact CE1-CD2 4.24Å; F724-Y729 AromaticContact CE1-CE2 3.44Å; F724-Y729 HydrophobicContact CE1-CE2 3.44Å; F724-Y729 VanDerWaalsContact CE1-CE2 3.44Å; F724-Y729 AromaticContact CE1-CZ 3.83Å; F724-Y729 HydrophobicContact CZ-CE2 4.23Å; Y729-E731 HydrophobicContact CE1-CB 4.18Å; Y729-E731 HydrophobicContact CE1-CG 4.01Å; Y729-E731 VanDerWaalsContact CE1-OE2 3.3Å; Y729-E731 WeakPolarHBondContact CE1-OE2 3.42Å; Y729-E731 PolarHBondContact OH-OE2 3.3Å; Y729-I747 CarbonylContact O-C 3.53Å; Y729-I747 WeakPolarHBondContact O-CA 3.48Å; Y729-V748 HydrophobicContact CD1-CB 4.38Å; Y729-V748 HydrophobicContact CD1-CG2 4.13Å; Y729-V748 PolarHBondContact N-O 3.03Å; Y729-V748 PolarHBondContact O-N 3.14Å
730	A	92.7	Very high	85.7	Confident	2 Å²	2	50.3 Å²	50.3	2%	0.017	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	132.8	-178.6	0	0	0	0	0	111.3	L721 S722 L746 L805 L821	L721-A730 WeakPolarHBondContact CA-O 3.37Å; L721-A730 HydrophobicContact CB-CB 4.14Å; L721-A730 WeakPolarHBondContact CB-O 3.26Å; L721-A730 PolarHBondContact N-O 2.84Å; S722-A730 PolarHBondContact N-O 3.31Å; S722-A730 VanDerWaalsContact N-O 3.11Å; S722-A730 PolarHBondContact OG-N 3.06Å; A730-L746 VanDerWaalsContact CA-O 3.29Å; A730-L746 WeakPolarHBondContact CA-O 3.49Å; A730-L805 HydrophobicContact CB-CD1 3.72Å; A730-L821 HydrophobicContact CB-CD2 4.18Å
731	E	92.4	Very high	85.4	Confident	51 Å²	51	46.6 Å²	46.6	24%	0.238	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	144.8	172.5	62	-176.1	-152.4	0	0	109.7	I718 T719 Y729 C745 L746	I718-E731 HydrophobicContact CG2-CB 4.18Å; I718-E731 HydrophobicContact CG2-CG 4.48Å; T719-E731 CarbonylContact O-C 3.57Å; T719-E731 WeakPolarHBondContact O-CA 3.44Å; Y729-E731 HydrophobicContact CE1-CB 4.18Å; Y729-E731 HydrophobicContact CE1-CG 4.01Å; Y729-E731 VanDerWaalsContact CE1-OE2 3.3Å; Y729-E731 WeakPolarHBondContact CE1-OE2 3.42Å; Y729-E731 PolarHBondContact OH-OE2 3.3Å; E731-C745 CarbonylContact O-C 3.6Å; E731-C745 VanDerWaalsContact O-CA 3.31Å; E731-C745 WeakPolarHBondContact O-CA 3.34Å; E731-L746 HydrophobicContact CG-CB 3.83Å; E731-L746 HydrophobicContact CG-CD2 4.13Å; E731-L746 HydrophobicContact CG-CG 4.43Å; E731-L746 PolarHBondContact N-O 3.2Å; E731-L746 PolarHBondContact O-N 3.46Å; E731-L746 VanDerWaalsContact OE1-CD2 3.31Å; E731-L746 WeakPolarHBondContact OE1-CD2 3.48Å
732	A	90.3	Very high	85.1	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.6	-179.6	0	0	0	0	0	111.5	T719 L721 D744 I824	T719-A732 PolarHBondContact N-O 3.44Å; T719-A732 PolarHBondContact O-N 3.39Å; T719-A732 PolarHBondContact OG1-O 2.99Å; T719-A732 VanDerWaalsContact OG1-O 3.06Å; L721-A732 HydrophobicContact CD1-CB 3.63Å; L721-A732 HydrophobicContact CD2-CB 4.41Å; L721-A732 HydrophobicContact CG-CB 4.05Å; A732-D744 WeakPolarHBondContact CA-O 3.46Å; A732-I824 HydrophobicContact CB-CD1 4.27Å
733	L	87.8	Confident	84.9	Confident	51 Å²	51	48.3 Å²	48.3	27%	0.267	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	117.8	165.2	175.8	68	0	0	0	108.8	K714 N717 I718 D744	K714-L733 WeakPolarHBondContact O-CD1 3.37Å; N717-L733 HydrophobicContact CB-CD1 4.08Å; I718-L733 HydrophobicContact CG1-CD1 3.85Å; L733-D744 HydrophobicContact CB-CB 4.19Å; L733-D744 PolarHBondContact N-O 2.98Å; L733-D744 PolarHBondContact O-N 3.08Å
734	I	84.4	Confident	85	Confident	24 Å²	24	48.7 Å²	48.7	12%	0.123	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	119.4	-179.1	-52.1	171.3	0	0	0	108.6	N717 T719 L736 I741 L743 I824	N717-I734 PolarHBondContact O-N 3.49Å; N717-I734 VanDerWaalsContact O-N 3.1Å; T719-I734 HydrophobicContact CG2-CD1 3.73Å; I734-L736 HydrophobicContact CG2-CD2 4.11Å; I734-L736 HydrophobicContact CG2-CG 4.24Å; I734-I741 HydrophobicContact CG2-CG2 3.83Å; I734-L743 HydrophobicContact CB-CD2 4.32Å; I734-L743 HydrophobicContact CG1-CD2 3.77Å; I734-L743 HydrophobicContact CG2-CD2 4.15Å; I734-I824 HydrophobicContact CD1-CG2 3.36Å; I734-I824 HydrophobicContact CG1-CG2 4.42Å
735	T	79.7	Confident	85.1	Confident	68 Å²	68	42.3 Å²	42.3	42%	0.417	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	119.5	170.1	-50.3	0	0	0	0	109.3	T742	T735-T742 WeakPolarHBondContact CB-OG1 3.46Å; T735-T742 PolarHBondContact N-O 3.38Å; T735-T742 PolarHBondContact O-N 3.38Å; T735-T742 PolarHBondContact O-OG1 2.85Å
736	L	73.1	Confident	85.4	Confident	60 Å²	60	38.7 Å²	38.7	31%	0.314	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	118.1	-178.4	-60.3	163.4	0	0	0	109	I734 I741 D830 Y831	I734-L736 HydrophobicContact CG2-CD2 4.11Å; I734-L736 HydrophobicContact CG2-CG 4.24Å; L736-I741 HydrophobicContact CD2-CB 4.47Å; L736-I741 HydrophobicContact CD2-CD1 4.09Å; L736-I741 HydrophobicContact CD2-CG1 3.87Å; L736-I741 HydrophobicContact CD2-CG2 4.07Å; L736-D830 HydrophobicContact CD1-CB 3.76Å; L736-D830 WeakPolarHBondContact CD1-OD2 3.29Å; L736-Y831 WeakPolarHBondContact CD2-OH 3.39Å
737	S	72.6	Confident	85.5	Confident	38 Å²	38	36.3 Å²	36.3	27%	0.266	19%	0.191	S	C	.	.			trans	-102.8	171	164.5	-177	0	0	0	0	109.7	G700 Y739 D740	G700-S737 PolarHBondContact O-OG 2.95Å; S737-Y739 PolarHBondContact O-N 3.31Å; S737-Y739 VanDerWaalsContact O-N 3.12Å; S737-D740 WeakPolarHBondContact CA-O 3.39Å; S737-D740 VanDerWaalsContact CB-O 3.32Å; S737-D740 WeakPolarHBondContact CB-O 3.47Å; S737-D740 PolarHBondContact N-O 3.01Å
738	N	67.9	Low	85.7	Confident	67 Å²	67	35.6 Å²	35.6	36%	0.358	19%	0.186	S	C	.	.	S	Bend	trans	-54	-35.2	-176	-68.7	-13.5	0	0	0	113.4	F903	N738-F903 WeakPolarHBondContact O-CE1 3.22Å
739	Y	75.3	Confident	85.8	Confident	135 Å²	135	35.7 Å²	35.7	53%	0.529	19%	0.186	S	C	.	.	S	Bend	trans	-130.3	-7.1	-177.3	-58.8	-77.8	0	0	0	114.2	S737 V793 F903	S737-Y739 PolarHBondContact O-N 3.31Å; S737-Y739 VanDerWaalsContact O-N 3.12Å; Y739-V793 PolarHBondContact O-N 2.86Å; Y739-F903 HydrophobicContact CD1-CD1 4.12Å; Y739-F903 AromaticContact CD1-CE1 3.8Å; Y739-F903 HydrophobicContact CD1-CE1 3.8Å; Y739-F903 AromaticContact CE1-CD1 3.85Å; Y739-F903 HydrophobicContact CE1-CD1 3.85Å; Y739-F903 AromaticContact CE1-CE1 4Å; Y739-F903 HydrophobicContact CE1-CE1 4Å
740	D	81.3	Confident	85.7	Confident	52 Å²	52	37.8 Å²	37.8	28%	0.278	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	134.8	-173.5	-66.7	-41.9	0	0	0	110.1	S737 I791 K792	S737-D740 WeakPolarHBondContact CA-O 3.39Å; S737-D740 VanDerWaalsContact CB-O 3.32Å; S737-D740 WeakPolarHBondContact CB-O 3.47Å; S737-D740 PolarHBondContact N-O 3.01Å; D740-I791 CarbonylContact C-O 3.46Å; D740-I791 WeakPolarHBondContact CA-O 3.37Å; D740-K792 WeakPolarHBondContact OD1-CE 3.33Å; D740-K792 WeakPolarHBondContact OD1-CG 3.46Å
741	I	83.7	Confident	85.5	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	116.2	169.2	-52.4	179.7	0	0	0	106.5	I734 L736 L743 L768 S790 I791 V793 V826	I734-I741 HydrophobicContact CG2-CG2 3.83Å; L736-I741 HydrophobicContact CD2-CB 4.47Å; L736-I741 HydrophobicContact CD2-CD1 4.09Å; L736-I741 HydrophobicContact CD2-CG1 3.87Å; L736-I741 HydrophobicContact CD2-CG2 4.07Å; I741-L743 HydrophobicContact CG2-CD2 4.13Å; I741-L768 HydrophobicContact CD1-CD2 4.41Å; I741-S790 WeakPolarHBondContact O-CA 3.27Å; I741-I791 HydrophobicContact CB-CB 4.31Å; I741-I791 PolarHBondContact N-O 3.45Å; I741-I791 PolarHBondContact O-N 3.21Å; I741-V793 HydrophobicContact CD1-CG2 3.59Å; I741-V793 HydrophobicContact CG1-CG2 3.53Å; I741-V826 HydrophobicContact CD1-CB 4.25Å; I741-V826 HydrophobicContact CD1-CG1 3.57Å; I741-V826 HydrophobicContact CD1-CG2 3.62Å
742	T	85.8	Confident	85.3	Confident	48 Å²	48	39.3 Å²	39.3	29%	0.294	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	121.1	173.3	56.1	0	0	0	0	109.1	T735 T789	T735-T742 WeakPolarHBondContact CB-OG1 3.46Å; T735-T742 PolarHBondContact N-O 3.38Å; T735-T742 PolarHBondContact O-N 3.38Å; T735-T742 PolarHBondContact O-OG1 2.85Å; T742-T789 WeakPolarHBondContact CA-O 3.38Å
743	L	87.9	Confident	85.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	112.9	174	-60.8	179.7	0	0	0	108.8	I734 I741 L762 K788 T789 I791 I801 I824	I734-L743 HydrophobicContact CB-CD2 4.32Å; I734-L743 HydrophobicContact CG1-CD2 3.77Å; I734-L743 HydrophobicContact CG2-CD2 4.15Å; I741-L743 HydrophobicContact CG2-CD2 4.13Å; L743-L762 HydrophobicContact CD1-CD1 3.91Å; L743-K788 CarbonylContact O-C 3.58Å; L743-K788 WeakPolarHBondContact O-CA 3.32Å; L743-T789 PolarHBondContact N-O 3.12Å; L743-T789 PolarHBondContact O-N 2.99Å; L743-I791 HydrophobicContact CD1-CD1 3.61Å; L743-I791 HydrophobicContact CG-CD1 4.23Å; L743-I801 HydrophobicContact CD1-CD1 4.31Å; L743-I801 HydrophobicContact CD1-CG2 4.17Å; L743-I824 HydrophobicContact CD1-CD1 4.19Å; L743-I824 HydrophobicContact CD2-CD1 4.03Å
744	D	89.7	Confident	85.3	Confident	39 Å²	39	43.4 Å²	43.4	21%	0.209	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	96.9	169.8	-80.5	-10	0	0	0	107.9	A732 L733 K788	A732-D744 WeakPolarHBondContact CA-O 3.46Å; L733-D744 HydrophobicContact CB-CB 4.19Å; L733-D744 PolarHBondContact N-O 2.98Å; L733-D744 PolarHBondContact O-N 3.08Å; D744-K788 WeakPolarHBondContact OD1-CD 3.36Å; D744-K788 VanDerWaalsContact OD1-CE 3.29Å; D744-K788 WeakPolarHBondContact OD1-CE 3.17Å; D744-K788 WeakPolarHBondContact OD1-CG 3.48Å; D744-K788 IonicContact OD1-NZ 2.79Å; D744-K788 PolarHBondContact OD1-NZ 3.33Å; D744-K788 IonicContact OD2-NZ 3.6Å; D744-K788 PolarHBondContact OD2-NZ 3.26Å
745	C	90.8	Very high	85.5	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.014	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	113.9	-178.2	-58.2	0	0	0	0	110.2	E731 L760 T786 M787	E731-C745 CarbonylContact O-C 3.6Å; E731-C745 VanDerWaalsContact O-CA 3.31Å; E731-C745 WeakPolarHBondContact O-CA 3.34Å; C745-L760 HydrophobicContact CB-CD2 3.99Å; C745-T786 CarbonylContact O-C 3.51Å; C745-T786 WeakPolarHBondContact O-CA 3.28Å; C745-M787 WeakPolarHBondContact CB-O 3.48Å; C745-M787 PolarHBondContact N-O 2.91Å; C745-M787 PolarHBondContact O-N 3.43Å
746	L	92.6	Very high	85.9	Confident	44 Å²	44	42.6 Å²	42.6	23%	0.23	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	127.8	167.1	178	69.5	0	0	0	108.8	A730 E731 V748 F784 T786	A730-L746 VanDerWaalsContact CA-O 3.29Å; A730-L746 WeakPolarHBondContact CA-O 3.49Å; E731-L746 HydrophobicContact CG-CB 3.83Å; E731-L746 HydrophobicContact CG-CD2 4.13Å; E731-L746 HydrophobicContact CG-CG 4.43Å; E731-L746 PolarHBondContact N-O 3.2Å; E731-L746 PolarHBondContact O-N 3.46Å; E731-L746 VanDerWaalsContact OE1-CD2 3.31Å; E731-L746 WeakPolarHBondContact OE1-CD2 3.48Å; L746-V748 HydrophobicContact CD2-CG2 4.29Å; L746-V748 HydrophobicContact CG-CG2 4.13Å; L746-F784 HydrophobicContact CD1-CB 4.37Å; L746-F784 HydrophobicContact CD1-CD2 3.88Å; L746-F784 HydrophobicContact CD1-CG 4.5Å; L746-T786 HydrophobicContact CB-CG2 4.37Å; L746-T786 HydrophobicContact CD1-CG2 3.73Å
747	I	93.3	Very high	86.5	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128	-179.6	-56.1	178.1	0	0	0	108.2	V728 Y729 L758 L779 F784 A785 M787 L805	V728-I747 HydrophobicContact CG1-CG2 3.3Å; Y729-I747 CarbonylContact O-C 3.53Å; Y729-I747 WeakPolarHBondContact O-CA 3.48Å; I747-L758 HydrophobicContact CD1-CD2 3.85Å; I747-L758 HydrophobicContact CG2-CD1 4.2Å; I747-L758 HydrophobicContact CG2-CD2 4Å; I747-L779 HydrophobicContact CG2-CD1 3.99Å; I747-F784 CarbonylContact O-C 3.47Å; I747-F784 WeakPolarHBondContact O-CA 3.35Å; I747-F784 WeakPolarHBondContact O-CB 3.38Å; I747-A785 PolarHBondContact N-O 3.46Å; I747-A785 PolarHBondContact O-N 3.07Å; I747-M787 HydrophobicContact CD1-CB 4.32Å; I747-M787 HydrophobicContact CD1-CG 3.92Å; I747-M787 HydrophobicContact CD1-SD 3.28Å; I747-M787 WeakPolarHBondContact CD1-SD 3.49Å; I747-L805 HydrophobicContact CD1-CD2 3.8Å; I747-L805 HydrophobicContact CG2-CD1 4.49Å
748	V	93.1	Very high	87.3	Confident	37 Å²	37	40.9 Å²	40.9	22%	0.224	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	124.1	-175.7	-173.9	0	0	0	0	109.1	V728 Y729 L746 Q750 F784	V728-V748 WeakPolarHBondContact CA-O 3.29Å; Y729-V748 HydrophobicContact CD1-CB 4.38Å; Y729-V748 HydrophobicContact CD1-CG2 4.13Å; Y729-V748 PolarHBondContact N-O 3.03Å; Y729-V748 PolarHBondContact O-N 3.14Å; L746-V748 HydrophobicContact CD2-CG2 4.29Å; L746-V748 HydrophobicContact CG-CG2 4.13Å; V748-Q750 PolarHBondContact O-N 2.98Å; V748-F784 HydrophobicContact CB-CB 4.35Å; V748-F784 HydrophobicContact CG1-CB 4.37Å; V748-F784 HydrophobicContact CG2-CB 3.91Å
749	N	94.3	Very high	88.3	Confident	1 Å²	1	39 Å²	39	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	114.2	170.9	-179.5	9.2	0	0	0	109.2	T751 D753 L755 L779 A780 H782 D783	N749-T751 VanDerWaalsContact C-N 3.35Å; N749-T751 WeakPolarHBondContact OD1-CB 3.43Å; N749-T751 PolarHBondContact OD1-N 3.28Å; N749-T751 PolarHBondContact OD1-OG1 2.86Å; N749-D753 PolarHBondContact ND2-O 2.87Å; N749-L755 HydrophobicContact CB-CD1 4.09Å; N749-L755 WeakPolarHBondContact OD1-CD1 3.41Å; N749-L779 HydrophobicContact CB-CB 4.19Å; N749-L779 HydrophobicContact CB-CD1 4.35Å; N749-A780 PolarHBondContact ND2-O 3.33Å; N749-H782 VanDerWaalsContact O-CA 3.24Å; N749-H782 WeakPolarHBondContact O-CA 3.36Å; N749-D783 PolarHBondContact N-O 2.97Å
750	Q	90.3	Very high	89.1	Confident	74 Å²	74	33 Å²	33	35%	0.346	20%	0.196	S	C	.	.			trans	-87.9	-7.5	176.7	-61.9	-164.7	-13.3	0	0	113	F724 D726 P727 V748 H782	F724-Q750 PolarHBondContact O-NE2 3.33Å; F724-Q750 PolarHBondContact O-OE1 2.92Å; F724-Q750 VanDerWaalsContact O-OE1 3.07Å; D726-Q750 PolarHBondContact O-OE1 2.94Å; D726-Q750 VanDerWaalsContact O-OE1 3.06Å; P727-Q750 WeakPolarHBondContact O-CB 3.49Å; P727-Q750 PolarHBondContact O-N 3.18Å; V748-Q750 PolarHBondContact O-N 2.98Å; Q750-H782 PolarHBondContact O-CE1 3.27Å
751	T	88.4	Confident	89.5	Confident	30 Å²	30	35.1 Å²	35.1	18%	0.184	21%	0.205	C	C	.	.	S	Bend	trans	-90.5	162.7	-175.3	74.3	0	0	0	0	112.9	P727 N749 D753 H782	P727-T751 HydrophobicContact CB-CG2 3.62Å; N749-T751 VanDerWaalsContact C-N 3.35Å; N749-T751 WeakPolarHBondContact OD1-CB 3.43Å; N749-T751 PolarHBondContact OD1-N 3.28Å; N749-T751 PolarHBondContact OD1-OG1 2.86Å; T751-D753 PolarHBondContact OG1-N 3.38Å; T751-D753 PolarHBondContact OG1-O 3.39Å; T751-H782 PolarHBondContact O-N 3.45Å
752	G	88.9	Confident	89.8	Confident	54 Å²	54	36.1 Å²	36.1	56%	0.557	21%	0.21	S	C	*	.	S	Bend	trans	-81.4	0.2	171	0	0	0	0	0	113.9	P781	G752-P781 WeakPolarHBondContact O-CB 3.35Å; G752-P781 VanDerWaalsContact O-CG 3.27Å; G752-P781 WeakPolarHBondContact O-CG 3.26Å
753	D	89	Confident	89.9	Confident	93 Å²	93	35.7 Å²	35.7	50%	0.497	21%	0.211	S	C	.	.	S	Bend	trans	-104	151.3	-176	-59	-51.9	0	0	0	111	N749 T751 V809	N749-D753 PolarHBondContact ND2-O 2.87Å; T751-D753 PolarHBondContact OG1-N 3.38Å; T751-D753 PolarHBondContact OG1-O 3.39Å; D753-V809 HydrophobicContact CB-CG1 3.76Å
754	T	89.2	Confident	89.9	Confident	45 Å²	45	37.6 Å²	37.6	28%	0.276	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-77.3	126.3	173.2	-52.5	0	0	0	0	109.2	T778 H810	T754-T778 HydrophobicContact CG2-CG2 3.93Å; T754-H810 VanDerWaalsContact O-CB 3.25Å; T754-H810 WeakPolarHBondContact O-CB 3.22Å; T754-H810 PolarHBondContact O-N 3.17Å
755	L	88.4	Confident	89.6	Confident	1 Å²	1	41 Å²	41	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	116.9	178.4	-52	-176.3	0	0	0	109.4	V728 N749 L758 T778 L779 Y807 D808 V809	V728-L755 HydrophobicContact CG2-CD1 3.43Å; V728-L755 VanDerWaalsContact CG2-CD1 3.43Å; N749-L755 HydrophobicContact CB-CD1 4.09Å; N749-L755 WeakPolarHBondContact OD1-CD1 3.41Å; L755-L758 HydrophobicContact CD1-CD1 4.15Å; L755-T778 CarbonylContact O-C 3.54Å; L755-T778 VanDerWaalsContact O-CA 3.3Å; L755-T778 WeakPolarHBondContact O-CA 3.39Å; L755-T778 WeakPolarHBondContact O-CG2 3.49Å; L755-L779 PolarHBondContact N-O 3.46Å; L755-L779 PolarHBondContact O-N 3.13Å; L755-Y807 HydrophobicContact CB-CD2 4.37Å; L755-Y807 HydrophobicContact CD1-CD2 4.14Å; L755-Y807 HydrophobicContact CD1-CE2 4.38Å; L755-Y807 HydrophobicContact CD1-CG 4.41Å; L755-Y807 HydrophobicContact CD2-CD2 3.68Å; L755-Y807 HydrophobicContact CD2-CE2 3.81Å; L755-Y807 HydrophobicContact CG-CD2 4.27Å; L755-D808 CarbonylContact C-O 3.6Å; L755-V809 HydrophobicContact CD2-CG2 4.22Å
756	E	87.5	Confident	88.9	Confident	73 Å²	73	42.8 Å²	42.8	34%	0.341	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	152.5	178.3	-64.4	-173.9	160.5	0	0	111	L758 T778 D808 H810	E756-L758 PolarHBondContact O-N 3Å; E756-L758 VanDerWaalsContact O-N 3.13Å; E756-T778 HydrophobicContact CG-CG2 4.06Å; E756-D808 PolarHBondContact N-O 3.22Å; E756-D808 PolarHBondContact O-N 3.39Å; E756-H810 VanDerWaalsContact CD-ND1 3.3Å; E756-H810 HydrophobicContact CG-CB 4.36Å; E756-H810 IonicContact OE1-CE1 3.71Å; E756-H810 PolarHBondContact OE1-CE1 3.42Å; E756-H810 IonicContact OE1-CG 2.7Å; E756-H810 IonicContact OE1-ND1 3.44Å; E756-H810 PolarHBondContact OE1-ND1 3.15Å; E756-H810 IonicContact OE2-ND1 3.83Å
757	S	86.5	Confident	88.1	Confident	63 Å²	63	44.9 Å²	44.9	44%	0.441	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.5	33.4	176.1	-54.7	0	0	0	0	114.2	T759	S757-T759 PolarHBondContact O-N 3.42Å
758	L	89.4	Confident	87.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	117.6	178.8	-175	145.7	0	0	0	109.6	V728 I747 L755 E756 P776 I777 L779 M787 L805 S806	V728-L758 HydrophobicContact CG1-CD1 4.09Å; V728-L758 HydrophobicContact CG2-CD1 4.14Å; I747-L758 HydrophobicContact CD1-CD2 3.85Å; I747-L758 HydrophobicContact CG2-CD1 4.2Å; I747-L758 HydrophobicContact CG2-CD2 4Å; L755-L758 HydrophobicContact CD1-CD1 4.15Å; E756-L758 PolarHBondContact O-N 3Å; E756-L758 VanDerWaalsContact O-N 3.13Å; L758-P776 WeakPolarHBondContact O-CA 3.23Å; L758-I777 HydrophobicContact CB-CG1 4.16Å; L758-I777 WeakPolarHBondContact CB-O 3.5Å; L758-I777 HydrophobicContact CD2-CD1 4.01Å; L758-I777 HydrophobicContact CD2-CG1 3.8Å; L758-I777 PolarHBondContact N-O 3.2Å; L758-I777 PolarHBondContact O-N 2.82Å; L758-L779 HydrophobicContact CD1-CD1 3.97Å; L758-M787 HydrophobicContact CD2-SD 4.15Å; L758-L805 HydrophobicContact CD2-CD2 4.17Å; L758-S806 CarbonylContact C-O 3.55Å; L758-S806 WeakPolarHBondContact CA-O 3.42Å
759	T	90	Very high	87.1	Confident	28 Å²	28	50.8 Å²	50.8	17%	0.172	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129.4	-173	41.5	0	0	0	0	110.5	S757 P776 L805 S806	S757-T759 PolarHBondContact O-N 3.42Å; T759-P776 HydrophobicContact CG2-CB 3.57Å; T759-P776 HydrophobicContact CG2-CG 4.45Å; T759-L805 WeakPolarHBondContact O-CA 3.27Å; T759-S806 PolarHBondContact N-O 3.3Å; T759-S806 PolarHBondContact O-N 2.97Å; T759-S806 PolarHBondContact OG1-O 3.21Å; T759-S806 VanDerWaalsContact OG1-O 3.12Å; T759-S806 PolarHBondContact OG1-OG 3.42Å
760	L	90.9	Very high	86.6	Confident	8 Å²	8	52.5 Å²	52.5	4%	0.042	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	107	171	177.9	64.6	0	0	0	109	C745 L762 P774 M787 L805 L821	C745-L760 HydrophobicContact CB-CD2 3.99Å; L760-L762 HydrophobicContact CD1-CD2 3.95Å; L760-L762 HydrophobicContact CD1-CG 4.36Å; L760-L762 HydrophobicContact CD2-CD1 4.21Å; L760-L762 HydrophobicContact CD2-CD2 4.43Å; L760-L762 HydrophobicContact CD2-CG 4.26Å; L760-L762 HydrophobicContact CG-CD1 4.48Å; L760-L762 HydrophobicContact CG-CD2 4.14Å; L760-L762 HydrophobicContact CG-CG 4Å; L760-P774 HydrophobicContact CB-CG 3.99Å; L760-P774 HydrophobicContact CD2-CG 4.35Å; L760-P774 HydrophobicContact CG-CG 4.44Å; L760-M787 HydrophobicContact CB-CE 3.63Å; L760-M787 HydrophobicContact CB-SD 4.13Å; L760-L805 HydrophobicContact CB-CD2 3.86Å; L760-L805 HydrophobicContact CD1-CD2 3.72Å; L760-L805 HydrophobicContact CD1-CG 4.13Å; L760-L805 HydrophobicContact CG-CD2 4.38Å; L760-L821 HydrophobicContact CD1-CD1 3.49Å; L760-L821 VanDerWaalsContact CD1-CD1 3.49Å
761	E	89.4	Confident	86.2	Confident	97 Å²	97	52.1 Å²	52.1	45%	0.453	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	103.7	177.1	-65.3	-173	-176.4	0	0	109.1	G803 T804 R816	E761-G803 CarbonylContact O-C 3.57Å; E761-G803 WeakPolarHBondContact O-CA 3.32Å; E761-T804 PolarHBondContact N-O 3.34Å; E761-T804 PolarHBondContact O-N 3.25Å; E761-R816 IonicContact OE1-NH2 2.75Å; E761-R816 PolarHBondContact OE1-NH2 3.43Å
762	L	90.3	Very high	85.9	Confident	20 Å²	20	55.2 Å²	55.2	11%	0.105	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	142.8	175.2	-62.6	175.6	0	0	0	111	L743 L760 L770 T789 I801	L743-L762 HydrophobicContact CD1-CD1 3.91Å; L760-L762 HydrophobicContact CD1-CD2 3.95Å; L760-L762 HydrophobicContact CD1-CG 4.36Å; L760-L762 HydrophobicContact CD2-CD1 4.21Å; L760-L762 HydrophobicContact CD2-CD2 4.43Å; L760-L762 HydrophobicContact CD2-CG 4.26Å; L760-L762 HydrophobicContact CG-CD1 4.48Å; L760-L762 HydrophobicContact CG-CD2 4.14Å; L760-L762 HydrophobicContact CG-CG 4Å; L762-L770 HydrophobicContact CB-CD1 4.25Å; L762-L770 HydrophobicContact CB-CD2 4.4Å; L762-T789 HydrophobicContact CD1-CG2 3.78Å; L762-I801 HydrophobicContact CD2-CG2 4.4Å
763	A	89	Confident	85.4	Confident	39 Å²	39	61 Å²	61	32%	0.322	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	152.5	170.9	0	0	0	0	0	109.6	F802	A763-F802 HydrophobicContact CB-CD2 4.03Å; A763-F802 HydrophobicContact CB-CE1 4.22Å; A763-F802 HydrophobicContact CB-CE2 3.51Å; A763-F802 HydrophobicContact CB-CZ 3.62Å; A763-F802 PolarHBondContact N-O 2.84Å; A763-F802 PolarHBondContact O-N 3.4Å
764	T	87.4	Confident	85	Confident	40 Å²	40	57.8 Å²	57.8	25%	0.245	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	137.8	-177.4	53.6	0	0	0	0	110.4	L768 I791 V800 I801	T764-L768 HydrophobicContact CG2-CB 3.95Å; T764-L768 HydrophobicContact CG2-CD1 4.47Å; T764-L768 PolarHBondContact OG1-O 3.44Å; T764-I791 HydrophobicContact CG2-CD1 4.42Å; T764-I791 HydrophobicContact CG2-CG2 4.32Å; T764-V800 CarbonylContact C-O 3.55Å; T764-V800 WeakPolarHBondContact CA-O 3.38Å; T764-I801 HydrophobicContact CG2-CG1 4.18Å; T764-I801 HydrophobicContact CG2-CG2 4.47Å
765	L	82.7	Confident	84.7	Confident	111 Å²	111	59.4 Å²	59.4	58%	0.581	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.2	168.1	-163.4	75.7	0	0	0	108.6	G799 V800 F802	L765-G799 WeakPolarHBondContact O-CA 3.33Å; L765-V800 HydrophobicContact CB-CB 4.13Å; L765-V800 PolarHBondContact N-O 3.26Å; L765-V800 PolarHBondContact O-N 3.15Å; L765-V800 VanDerWaalsContact O-N 3.1Å; L765-F802 HydrophobicContact CB-CE1 3.98Å
766	G	75.7	Confident	84.7	Confident	40 Å²	40	63.3 Å²	63.3	41%	0.412	35%	0.353	S	S	.	.	S	Bend	trans	93.6	-169	-174.9	0	0	0	0	0	112.9	L768	G766-L768 PolarHBondContact O-N 3.45Å
767	D	76.9	Confident	84.9	Confident	87 Å²	87	61.7 Å²	61.7	47%	0.465	35%	0.346	S	S	.	.	S	Bend	trans	-80.4	49.8	-175.7	-80.7	-13.6	0	0	0	113.3	S794 S795	D767-S794 PolarHBondContact O-N 3.31Å; D767-S794 PolarHBondContact O-OG 2.8Å; D767-S795 WeakPolarHBondContact OD2-CB 3.3Å; D767-S795 PolarHBondContact OD2-OG 3.23Å
768	L	81.9	Confident	85.1	Confident	14 Å²	14	62.9 Å²	62.9	7%	0.073	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	129.5	174.4	-68	179.8	0	0	0	109.8	I741 T764 G766 I791 V793 I801 V826	I741-L768 HydrophobicContact CD1-CD2 4.41Å; T764-L768 HydrophobicContact CG2-CB 3.95Å; T764-L768 HydrophobicContact CG2-CD1 4.47Å; T764-L768 PolarHBondContact OG1-O 3.44Å; G766-L768 PolarHBondContact O-N 3.45Å; L768-I791 HydrophobicContact CB-CG2 3.92Å; L768-I791 HydrophobicContact CD2-CG2 4.28Å; L768-I791 HydrophobicContact CG-CG2 4.48Å; L768-V793 HydrophobicContact CD2-CB 4.19Å; L768-V793 HydrophobicContact CD2-CG1 4.1Å; L768-V793 HydrophobicContact CD2-CG2 3.82Å; L768-I801 HydrophobicContact CD1-CD1 4.4Å; L768-I801 HydrophobicContact CD1-CG1 3.91Å; L768-V826 HydrophobicContact CD1-CG2 4.14Å
769	K	83.6	Confident	85.1	Confident	148 Å²	148	63 Å²	63	64%	0.643	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.7	114	179.9	-172.2	177.6	-179.2	178.9	0	111.3	V771 K792	K769-V771 PolarHBondContact O-N 2.77Å; K769-K792 HydrophobicContact CB-CB 4.39Å; K769-K792 PolarHBondContact N-O 3.01Å; K769-K792 PolarHBondContact O-N 3.35Å
770	L	83.3	Confident	85.2	Confident	38 Å²	38	63.8 Å²	63.8	20%	0.199	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	118.2	169.6	-167.5	70.9	0	0	0	109.5	L762 K773 T789 I791	L762-L770 HydrophobicContact CB-CD1 4.25Å; L762-L770 HydrophobicContact CB-CD2 4.4Å; L770-K773 HydrophobicContact CD2-CG 3.9Å; L770-T789 HydrophobicContact CD1-CG2 3.43Å; L770-T789 VanDerWaalsContact CD1-CG2 3.43Å; L770-I791 HydrophobicContact CD1-CD1 4.29Å; L770-I791 HydrophobicContact CD1-CG1 3.7Å
771	V	81.9	Confident	85.1	Confident	65 Å²	65	66 Å²	66	39%	0.394	38%	0.376	S	S	.	.			trans	-87.2	-49.3	-176.9	-178.2	0	0	0	0	110.6	K769 S790 K792	K769-V771 PolarHBondContact O-N 2.77Å; V771-S790 WeakPolarHBondContact CB-O 3.49Å; V771-S790 PolarHBondContact N-O 2.97Å; V771-K792 HydrophobicContact CG2-CB 3.99Å; V771-K792 HydrophobicContact CG2-CD 3.67Å; V771-K792 HydrophobicContact CG2-CG 3.6Å
772	D	81.1	Confident	85.1	Confident	95 Å²	95	67.7 Å²	67.7	51%	0.508	38%	0.384	S	S	.	.			trans	-121.4	134.8	-175.7	-69.4	-35.8	0	0	0	110.4	T789	D772-T789 WeakPolarHBondContact O-CG2 3.43Å
773	K	79.3	Confident	85.2	Confident	177 Å²	177	70.2 Å²	70.2	77%	0.77	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-97.1	126.9	168.3	-69.5	-172.9	178.4	-170.9	0	108.2	L770	L770-K773 HydrophobicContact CD2-CG 3.9Å
774	P	80.9	Confident	85.3	Confident	25 Å²	25	74.7 Å²	74.7	16%	0.162	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-71.7	146.2	-176.8	33.2	-37	0	0	0	110.4	L760 M787 T789	L760-P774 HydrophobicContact CB-CG 3.99Å; L760-P774 HydrophobicContact CD2-CG 4.35Å; L760-P774 HydrophobicContact CG-CG 4.44Å; P774-M787 HydrophobicContact CB-CB 4.33Å; P774-M787 HydrophobicContact CB-CE 3.36Å; P774-M787 HydrophobicContact CG-CE 3.45Å; P774-M787 VanDerWaalsContact CG-CE 3.45Å; P774-T789 WeakPolarHBondContact CD-OG1 3.48Å
775	S	83.3	Confident	85.6	Confident	78 Å²	78	74 Å²	74	55%	0.545	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-72.4	151.1	-176.6	44.7	0	0	0	0	112.1	M787	S775-M787 WeakPolarHBondContact O-CE 3.49Å
776	P	88.4	Confident	86	Confident	84 Å²	84	73.2 Å²	73.2	55%	0.545	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-60.4	138	172.3	22.9	-31.8	0	0	0	111	L758 T759	L758-P776 WeakPolarHBondContact O-CA 3.23Å; T759-P776 HydrophobicContact CG2-CB 3.57Å; T759-P776 HydrophobicContact CG2-CG 4.45Å
777	I	91	Very high	86.6	Confident	38 Å²	38	71.7 Å²	71.7	20%	0.195	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	157.6	176.3	60.1	169.6	0	0	0	111	L758 L779 A785 M787	L758-I777 HydrophobicContact CB-CG1 4.16Å; L758-I777 WeakPolarHBondContact CB-O 3.5Å; L758-I777 HydrophobicContact CD2-CD1 4.01Å; L758-I777 HydrophobicContact CD2-CG1 3.8Å; L758-I777 PolarHBondContact N-O 3.2Å; L758-I777 PolarHBondContact O-N 2.82Å; I777-L779 HydrophobicContact CD1-CD1 4.35Å; I777-L779 HydrophobicContact CD1-CD2 4.11Å; I777-L779 HydrophobicContact CD1-CG 4.08Å; I777-A785 HydrophobicContact CD1-CB 3.46Å; I777-A785 VanDerWaalsContact CD1-CB 3.46Å; I777-M787 HydrophobicContact CD1-CG 4.16Å; I777-M787 HydrophobicContact CD1-SD 3.87Å; I777-M787 HydrophobicContact CG1-SD 4.13Å
778	T	90.4	Very high	87.1	Confident	89 Å²	89	74 Å²	74	55%	0.546	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.8	170	-61.3	0	0	0	0	108.1	T754 L755 E756	T754-T778 HydrophobicContact CG2-CG2 3.93Å; L755-T778 CarbonylContact O-C 3.54Å; L755-T778 VanDerWaalsContact O-CA 3.3Å; L755-T778 WeakPolarHBondContact O-CA 3.39Å; L755-T778 WeakPolarHBondContact O-CG2 3.49Å; E756-T778 HydrophobicContact CG-CG2 4.06Å
779	L	90.7	Very high	87.3	Confident	3 Å²	3	73.4 Å²	73.4	2%	0.016	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	128	178.7	-71.7	-179.6	0	0	0	110.4	I747 N749 L755 L758 I777 A785	I747-L779 HydrophobicContact CG2-CD1 3.99Å; N749-L779 HydrophobicContact CB-CB 4.19Å; N749-L779 HydrophobicContact CB-CD1 4.35Å; L755-L779 PolarHBondContact N-O 3.46Å; L755-L779 PolarHBondContact O-N 3.13Å; L758-L779 HydrophobicContact CD1-CD1 3.97Å; I777-L779 HydrophobicContact CD1-CD1 4.35Å; I777-L779 HydrophobicContact CD1-CD2 4.11Å; I777-L779 HydrophobicContact CD1-CG 4.08Å; L779-A785 HydrophobicContact CD2-CB 3.64Å
780	A	90.4	Very high	87.5	Confident	43 Å²	43	68.2 Å²	68.2	36%	0.355	38%	0.375	S	S	.	.			trans	-70	165.5	171.4	0	0	0	0	0	111.1	N749 H782 D783	N749-A780 PolarHBondContact ND2-O 3.33Å; A780-H782 PolarHBondContact O-N 3.35Å; A780-D783 HydrophobicContact CB-CB 3.93Å; A780-D783 VanDerWaalsContact O-CB 3.3Å; A780-D783 WeakPolarHBondContact O-CB 3.25Å; A780-D783 PolarHBondContact O-N 2.87Å; A780-D783 VanDerWaalsContact O-N 3.11Å
781	P	89.9	Confident	87.7	Confident	55 Å²	55	66.4 Å²	66.4	36%	0.357	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	129.3	173.6	-27.5	36.3	0	0	0	111.6	G752 D783	G752-P781 WeakPolarHBondContact O-CB 3.35Å; G752-P781 VanDerWaalsContact O-CG 3.27Å; G752-P781 WeakPolarHBondContact O-CG 3.26Å; P781-D783 PolarHBondContact O-N 2.97Å; P781-D783 VanDerWaalsContact O-N 3.12Å
782	H	88.6	Confident	87.8	Confident	133 Å²	133	68.3 Å²	68.3	62%	0.616	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	16	-178.3	-55.1	-54.8	0	0	0	116.3	N749 Q750 T751 A780	N749-H782 VanDerWaalsContact O-CA 3.24Å; N749-H782 WeakPolarHBondContact O-CA 3.36Å; Q750-H782 PolarHBondContact O-CE1 3.27Å; T751-H782 PolarHBondContact O-N 3.45Å; A780-H782 PolarHBondContact O-N 3.35Å
783	D	92.9	Very high	87.7	Confident	72 Å²	72	64.4 Å²	64.4	39%	0.385	35%	0.348	S	S	.	.			trans	-89.8	164.7	177.2	-157.4	7.5	0	0	0	111.7	N749 A780 P781	N749-D783 PolarHBondContact N-O 2.97Å; A780-D783 HydrophobicContact CB-CB 3.93Å; A780-D783 VanDerWaalsContact O-CB 3.3Å; A780-D783 WeakPolarHBondContact O-CB 3.25Å; A780-D783 PolarHBondContact O-N 2.87Å; A780-D783 VanDerWaalsContact O-N 3.11Å; P781-D783 PolarHBondContact O-N 2.97Å; P781-D783 VanDerWaalsContact O-N 3.12Å
784	F	92.2	Very high	87.4	Confident	133 Å²	133	60.3 Å²	60.3	58%	0.583	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.3	152.9	179.6	65.6	-88.7	0	0	0	111.8	L746 I747 V748	L746-F784 HydrophobicContact CD1-CB 4.37Å; L746-F784 HydrophobicContact CD1-CD2 3.88Å; L746-F784 HydrophobicContact CD1-CG 4.5Å; I747-F784 CarbonylContact O-C 3.47Å; I747-F784 WeakPolarHBondContact O-CA 3.35Å; I747-F784 WeakPolarHBondContact O-CB 3.38Å; V748-F784 HydrophobicContact CB-CB 4.35Å; V748-F784 HydrophobicContact CG1-CB 4.37Å; V748-F784 HydrophobicContact CG2-CB 3.91Å
785	A	92.2	Very high	86.9	Confident	25 Å²	25	60.3 Å²	60.3	21%	0.207	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	159.4	172.8	0	0	0	0	0	110.9	I747 I777 L779	I747-A785 PolarHBondContact N-O 3.46Å; I747-A785 PolarHBondContact O-N 3.07Å; I777-A785 HydrophobicContact CD1-CB 3.46Å; I777-A785 VanDerWaalsContact CD1-CB 3.46Å; L779-A785 HydrophobicContact CD2-CB 3.64Å
786	T	90.6	Very high	86.1	Confident	95 Å²	95	56.7 Å²	56.7	58%	0.583	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	129.2	172.9	44.8	0	0	0	0	110	C745 L746	C745-T786 CarbonylContact O-C 3.51Å; C745-T786 WeakPolarHBondContact O-CA 3.28Å; L746-T786 HydrophobicContact CB-CG2 4.37Å; L746-T786 HydrophobicContact CD1-CG2 3.73Å
787	M	88.5	Confident	85.4	Confident	8 Å²	8	56.6 Å²	56.6	4%	0.039	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121.8	175.4	-67.5	-179.4	66	0	0	108.5	C745 I747 L758 L760 P774 S775 I777	C745-M787 WeakPolarHBondContact CB-O 3.48Å; C745-M787 PolarHBondContact N-O 2.91Å; C745-M787 PolarHBondContact O-N 3.43Å; I747-M787 HydrophobicContact CD1-CB 4.32Å; I747-M787 HydrophobicContact CD1-CG 3.92Å; I747-M787 HydrophobicContact CD1-SD 3.28Å; I747-M787 WeakPolarHBondContact CD1-SD 3.49Å; L758-M787 HydrophobicContact CD2-SD 4.15Å; L760-M787 HydrophobicContact CB-CE 3.63Å; L760-M787 HydrophobicContact CB-SD 4.13Å; P774-M787 HydrophobicContact CB-CB 4.33Å; P774-M787 HydrophobicContact CB-CE 3.36Å; P774-M787 HydrophobicContact CG-CE 3.45Å; P774-M787 VanDerWaalsContact CG-CE 3.45Å; S775-M787 WeakPolarHBondContact O-CE 3.49Å; I777-M787 HydrophobicContact CD1-CG 4.16Å; I777-M787 HydrophobicContact CD1-SD 3.87Å; I777-M787 HydrophobicContact CG1-SD 4.13Å
788	K	88.1	Confident	84.6	Confident	135 Å²	135	57.5 Å²	57.5	59%	0.587	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	140.2	179.6	-55.9	-164.4	168.4	-117.7	0	110.3	L743 D744	L743-K788 CarbonylContact O-C 3.58Å; L743-K788 WeakPolarHBondContact O-CA 3.32Å; D744-K788 WeakPolarHBondContact OD1-CD 3.36Å; D744-K788 VanDerWaalsContact OD1-CE 3.29Å; D744-K788 WeakPolarHBondContact OD1-CE 3.17Å; D744-K788 WeakPolarHBondContact OD1-CG 3.48Å; D744-K788 IonicContact OD1-NZ 2.79Å; D744-K788 PolarHBondContact OD1-NZ 3.33Å; D744-K788 IonicContact OD2-NZ 3.6Å; D744-K788 PolarHBondContact OD2-NZ 3.26Å
789	T	87.2	Confident	84	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	136.7	176.7	-65.5	0	0	0	0	110.6	T742 L743 L762 L770 D772 P774	T742-T789 WeakPolarHBondContact CA-O 3.38Å; L743-T789 PolarHBondContact N-O 3.12Å; L743-T789 PolarHBondContact O-N 2.99Å; L762-T789 HydrophobicContact CD1-CG2 3.78Å; L770-T789 HydrophobicContact CD1-CG2 3.43Å; L770-T789 VanDerWaalsContact CD1-CG2 3.43Å; D772-T789 WeakPolarHBondContact O-CG2 3.43Å; P774-T789 WeakPolarHBondContact CD-OG1 3.48Å
790	S	87.3	Confident	83.8	Confident	39 Å²	39	54.4 Å²	54.4	27%	0.273	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131.1	-179.7	-59.4	0	0	0	0	110.6	I741 V771	I741-S790 WeakPolarHBondContact O-CA 3.27Å; V771-S790 WeakPolarHBondContact CB-O 3.49Å; V771-S790 PolarHBondContact N-O 2.97Å
791	I	86.7	Confident	83.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.4	179.5	-61.5	166	0	0	0	108.2	D740 I741 L743 T764 L768 L770 I801	D740-I791 CarbonylContact C-O 3.46Å; D740-I791 WeakPolarHBondContact CA-O 3.37Å; I741-I791 HydrophobicContact CB-CB 4.31Å; I741-I791 PolarHBondContact N-O 3.45Å; I741-I791 PolarHBondContact O-N 3.21Å; L743-I791 HydrophobicContact CD1-CD1 3.61Å; L743-I791 HydrophobicContact CG-CD1 4.23Å; T764-I791 HydrophobicContact CG2-CD1 4.42Å; T764-I791 HydrophobicContact CG2-CG2 4.32Å; L768-I791 HydrophobicContact CB-CG2 3.92Å; L768-I791 HydrophobicContact CD2-CG2 4.28Å; L768-I791 HydrophobicContact CG-CG2 4.48Å; L770-I791 HydrophobicContact CD1-CD1 4.29Å; L770-I791 HydrophobicContact CD1-CG1 3.7Å; I791-I801 HydrophobicContact CD1-CD1 3.47Å; I791-I801 VanDerWaalsContact CD1-CD1 3.47Å; I791-I801 HydrophobicContact CD1-CG1 3.87Å; I791-I801 HydrophobicContact CD1-CG2 3.92Å
792	K	83.5	Confident	83.7	Confident	106 Å²	106	53.7 Å²	53.7	46%	0.461	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	132	176.1	-88.6	178.2	-177.5	-161.9	0	111.2	D740 K769 V771	D740-K792 WeakPolarHBondContact OD1-CE 3.33Å; D740-K792 WeakPolarHBondContact OD1-CG 3.46Å; K769-K792 HydrophobicContact CB-CB 4.39Å; K769-K792 PolarHBondContact N-O 3.01Å; K769-K792 PolarHBondContact O-N 3.35Å; V771-K792 HydrophobicContact CG2-CB 3.99Å; V771-K792 HydrophobicContact CG2-CD 3.67Å; V771-K792 HydrophobicContact CG2-CG 3.6Å
793	V	78.8	Confident	83.8	Confident	13 Å²	13	47.8 Å²	47.8	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	116.8	174.6	-170.6	0	0	0	0	108.4	Y739 I741 L768 S795 F903	Y739-V793 PolarHBondContact O-N 2.86Å; I741-V793 HydrophobicContact CD1-CG2 3.59Å; I741-V793 HydrophobicContact CG1-CG2 3.53Å; L768-V793 HydrophobicContact CD2-CB 4.19Å; L768-V793 HydrophobicContact CD2-CG1 4.1Å; L768-V793 HydrophobicContact CD2-CG2 3.82Å; V793-S795 WeakPolarHBondContact CG1-O 3.37Å; V793-F903 HydrophobicContact CB-CZ 4.35Å; V793-F903 HydrophobicContact CG1-CZ 3.85Å
794	S	73.5	Confident	83.8	Confident	90 Å²	90	45.7 Å²	45.7	63%	0.629	25%	0.245	S	C	*	.			trans	-105.4	-11.1	178.1	34.3	0	0	0	0	114.3	D767	D767-S794 PolarHBondContact O-N 3.31Å; D767-S794 PolarHBondContact O-OG 2.8Å
795	S	70.8	Confident	83.8	Confident	25 Å²	25	39.3 Å²	39.3	18%	0.175	22%	0.217	C	C	.	.	S	Bend	trans	-145.3	161.2	-170.7	-173	0	0	0	0	111.5	D767 V793 E797	D767-S795 WeakPolarHBondContact OD2-CB 3.3Å; D767-S795 PolarHBondContact OD2-OG 3.23Å; V793-S795 WeakPolarHBondContact CG1-O 3.37Å; S795-E797 PolarHBondContact O-N 2.87Å
796	T	67.5	Low	83.7	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.018	21%	0.209	C	C	.	.	S	Bend	trans	-88.9	27.7	175.4	53.8	0	0	0	0	112.3	I828 F903 E905 M937	T796-I828 WeakPolarHBondContact O-CD1 3.39Å; T796-F903 HydrophobicContact CG2-CB 4.32Å; T796-F903 HydrophobicContact CG2-CD2 3.49Å; T796-F903 VanDerWaalsContact CG2-CD2 3.49Å; T796-F903 HydrophobicContact CG2-CE2 4.15Å; T796-F903 HydrophobicContact CG2-CG 4.19Å; T796-E905 WeakPolarHBondContact CB-OE2 3.21Å; T796-E905 HydrophobicContact CG2-CG 4.33Å; T796-E905 VanDerWaalsContact CG2-OE2 3.31Å; T796-E905 WeakPolarHBondContact CG2-OE2 3.43Å; T796-E905 PolarHBondContact OG1-OE2 3.38Å; T796-M937 VanDerWaalsContact CB-CE 3.4Å; T796-M937 HydrophobicContact CG2-CE 3.4Å; T796-M937 VanDerWaalsContact CG2-CE 3.4Å
797	E	72.7	Confident	83.7	Confident	81 Å²	81	34.3 Å²	34.3	38%	0.379	18%	0.183	S	C	.	.	S	Bend	trans	-92.9	151.4	177.9	-74.7	-174.7	-177.9	0	0	112.2	S795 G799	S795-E797 PolarHBondContact O-N 2.87Å; E797-G799 PolarHBondContact O-N 2.97Å
798	N	73.7	Confident	83.7	Confident	58 Å²	58	36.7 Å²	36.7	31%	0.31	20%	0.195	S	C	.	.			trans	-67.8	108.5	176.1	-82	-32.3	0	0	0	108.2	I828 S940	N798-I828 HydrophobicContact CB-CD1 4.48Å; N798-I828 VanDerWaalsContact OD1-CD1 3.22Å; N798-I828 WeakPolarHBondContact OD1-CD1 3.31Å; N798-S940 WeakPolarHBondContact ND2-CB 3.35Å
799	G	78.3	Confident	83.6	Confident	3 Å²	3	31.7 Å²	31.7	3%	0.031	18%	0.176	C	C	.	.			trans	-90.8	143.1	176.2	0	0	0	0	0	111.9	L765 E797 V826	L765-G799 WeakPolarHBondContact O-CA 3.33Å; E797-G799 PolarHBondContact O-N 2.97Å; G799-V826 PolarHBondContact O-N 3.24Å
800	V	86	Confident	83.2	Confident	24 Å²	24	37 Å²	37	15%	0.145	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.8	169.9	-172.3	0	0	0	0	108.3	T764 L765 D823	T764-V800 CarbonylContact C-O 3.55Å; T764-V800 WeakPolarHBondContact CA-O 3.38Å; L765-V800 HydrophobicContact CB-CB 4.13Å; L765-V800 PolarHBondContact N-O 3.26Å; L765-V800 PolarHBondContact O-N 3.15Å; L765-V800 VanDerWaalsContact O-N 3.1Å; V800-D823 HydrophobicContact CG1-CB 3.81Å
801	I	88.4	Confident	82.7	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	119.6	174.3	-52.7	156.3	0	0	0	106.1	L743 L762 T764 L768 I791 I824 V826	L743-I801 HydrophobicContact CD1-CD1 4.31Å; L743-I801 HydrophobicContact CD1-CG2 4.17Å; L762-I801 HydrophobicContact CD2-CG2 4.4Å; T764-I801 HydrophobicContact CG2-CG1 4.18Å; T764-I801 HydrophobicContact CG2-CG2 4.47Å; L768-I801 HydrophobicContact CD1-CD1 4.4Å; L768-I801 HydrophobicContact CD1-CG1 3.91Å; I791-I801 HydrophobicContact CD1-CD1 3.47Å; I791-I801 VanDerWaalsContact CD1-CD1 3.47Å; I791-I801 HydrophobicContact CD1-CG1 3.87Å; I791-I801 HydrophobicContact CD1-CG2 3.92Å; I801-I824 HydrophobicContact CB-CB 4.21Å; I801-I824 HydrophobicContact CD1-CG2 4.5Å; I801-I824 PolarHBondContact N-O 3.28Å; I801-I824 PolarHBondContact O-N 3.24Å; I801-V826 HydrophobicContact CD1-CG2 3.58Å; I801-V826 HydrophobicContact CG1-CG2 4.18Å
802	F	90.7	Very high	82	Confident	81 Å²	81	41.2 Å²	41.2	36%	0.355	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	157	179.8	58.2	-84.8	0	0	0	108.5	A763 L765 D823	A763-F802 HydrophobicContact CB-CD2 4.03Å; A763-F802 HydrophobicContact CB-CE1 4.22Å; A763-F802 HydrophobicContact CB-CE2 3.51Å; A763-F802 HydrophobicContact CB-CZ 3.62Å; A763-F802 PolarHBondContact N-O 2.84Å; A763-F802 PolarHBondContact O-N 3.4Å; L765-F802 HydrophobicContact CB-CE1 3.98Å; F802-D823 WeakPolarHBondContact CB-OD1 3.23Å
803	G	90.4	Very high	81	Confident	10 Å²	10	43 Å²	43	10%	0.103	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168	175.1	-175.6	0	0	0	0	0	114.4	E761 L821	E761-G803 CarbonylContact O-C 3.57Å; E761-G803 WeakPolarHBondContact O-CA 3.32Å; G803-L821 VanDerWaalsContact O-CB 3.31Å; G803-L821 WeakPolarHBondContact O-CB 3.49Å; G803-L821 PolarHBondContact O-N 3.08Å
804	T	92.9	Very high	80.3	Confident	27 Å²	27	46 Å²	46	17%	0.166	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	143	179.7	54.2	0	0	0	0	110.5	E761 I819 Y820	E761-T804 PolarHBondContact N-O 3.34Å; E761-T804 PolarHBondContact O-N 3.25Å; T804-I819 CarbonylContact C-O 3.58Å; T804-I819 VanDerWaalsContact CA-O 3.27Å; T804-I819 WeakPolarHBondContact CA-O 3.25Å; T804-Y820 HydrophobicContact CG2-CD1 3.57Å; T804-Y820 HydrophobicContact CG2-CE1 3.89Å; T804-Y820 HydrophobicContact CG2-CG 4.4Å
805	L	91.8	Very high	80	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	122	166.9	-77.3	171.6	0	0	0	109.1	V728 A730 I747 L758 T759 L760 C818 I819 L821	V728-L805 HydrophobicContact CG1-CD1 3.94Å; A730-L805 HydrophobicContact CB-CD1 3.72Å; I747-L805 HydrophobicContact CD1-CD2 3.8Å; I747-L805 HydrophobicContact CG2-CD1 4.49Å; L758-L805 HydrophobicContact CD2-CD2 4.17Å; T759-L805 WeakPolarHBondContact O-CA 3.27Å; L760-L805 HydrophobicContact CB-CD2 3.86Å; L760-L805 HydrophobicContact CD1-CD2 3.72Å; L760-L805 HydrophobicContact CD1-CG 4.13Å; L760-L805 HydrophobicContact CG-CD2 4.38Å; L805-C818 CarbonylContact O-C 3.52Å; L805-C818 WeakPolarHBondContact O-CA 3.5Å; L805-I819 HydrophobicContact CB-CB 4.39Å; L805-I819 PolarHBondContact N-O 3.46Å; L805-I819 PolarHBondContact O-N 3.31Å; L805-L821 HydrophobicContact CD1-CD2 3.85Å; L805-L821 HydrophobicContact CG-CD1 4.22Å; L805-L821 HydrophobicContact CG-CD2 4.06Å; L805-L821 HydrophobicContact CG-CG 4.47Å
806	S	90.8	Very high	80.3	Confident	4 Å²	4	53 Å²	53	3%	0.028	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	136.9	174.2	81.6	0	0	0	0	111.3	L758 T759 R816 N817	L758-S806 CarbonylContact C-O 3.55Å; L758-S806 WeakPolarHBondContact CA-O 3.42Å; T759-S806 PolarHBondContact N-O 3.3Å; T759-S806 PolarHBondContact O-N 2.97Å; T759-S806 PolarHBondContact OG1-O 3.21Å; T759-S806 VanDerWaalsContact OG1-O 3.12Å; T759-S806 PolarHBondContact OG1-OG 3.42Å; S806-R816 PolarHBondContact OG-NE 2.8Å; S806-R816 PolarHBondContact OG-NH2 2.81Å; S806-N817 VanDerWaalsContact CA-O 3.27Å; S806-N817 WeakPolarHBondContact CA-O 3.21Å
807	Y	90.6	Very high	81.2	Confident	11 Å²	11	55.8 Å²	55.8	4%	0.043	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	155.9	-176.4	62.4	-88.6	0	0	0	111.1	P727 V728 L755 V809 N817 I819	P727-Y807 WeakPolarHBondContact CB-OH 3.46Å; P727-Y807 WeakPolarHBondContact CG-OH 3.31Å; V728-Y807 HydrophobicContact CG2-CD1 3.9Å; V728-Y807 HydrophobicContact CG2-CE1 3.69Å; V728-Y807 HydrophobicContact CG2-CG 4.5Å; L755-Y807 HydrophobicContact CB-CD2 4.37Å; L755-Y807 HydrophobicContact CD1-CD2 4.14Å; L755-Y807 HydrophobicContact CD1-CE2 4.38Å; L755-Y807 HydrophobicContact CD1-CG 4.41Å; L755-Y807 HydrophobicContact CD2-CD2 3.68Å; L755-Y807 HydrophobicContact CD2-CE2 3.81Å; L755-Y807 HydrophobicContact CG-CD2 4.27Å; Y807-V809 HydrophobicContact CD2-CG2 4.33Å; Y807-V809 HydrophobicContact CE2-CG2 4.03Å; Y807-N817 HydrophobicContact CD1-CB 4.41Å; Y807-N817 HydrophobicContact CD2-CB 4.14Å; Y807-N817 HydrophobicContact CE1-CB 3.88Å; Y807-N817 HydrophobicContact CE2-CB 3.62Å; Y807-N817 VanDerWaalsContact CZ-CB 3.45Å; Y807-N817 PolarHBondContact N-O 3.41Å; Y807-N817 PolarHBondContact O-N 3.01Å; Y807-I819 HydrophobicContact CE1-CD1 3.68Å; Y807-I819 HydrophobicContact CE1-CG1 4.13Å
808	D	88.8	Confident	81.9	Confident	57 Å²	57	54.9 Å²	54.9	31%	0.305	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	138.2	174.5	-61.4	-34	0	0	0	109.3	L755 E756 R816	L755-D808 CarbonylContact C-O 3.6Å; E756-D808 PolarHBondContact N-O 3.22Å; E756-D808 PolarHBondContact O-N 3.39Å; D808-R816 WeakPolarHBondContact OD1-CA 3.33Å; D808-R816 WeakPolarHBondContact OD1-CB 3.3Å; D808-R816 WeakPolarHBondContact OD1-CG 3.45Å
809	V	85.4	Confident	82.7	Confident	30 Å²	30	52.8 Å²	52.8	18%	0.182	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	127.2	176.4	-177.6	0	0	0	0	109	D753 L755 Y807 G811 A812	D753-V809 HydrophobicContact CB-CG1 3.76Å; L755-V809 HydrophobicContact CD2-CG2 4.22Å; Y807-V809 HydrophobicContact CD2-CG2 4.33Å; Y807-V809 HydrophobicContact CE2-CG2 4.03Å; V809-G811 PolarHBondContact O-N 2.69Å; V809-G811 VanDerWaalsContact O-N 3.13Å; V809-A812 HydrophobicContact CB-CB 4.14Å; V809-A812 WeakPolarHBondContact O-CB 3.36Å; V809-A812 PolarHBondContact O-N 2.53Å
810	H	79.3	Confident	83.4	Confident	114 Å²	114	61.7 Å²	61.7	53%	0.528	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	119.1	-178.5	-175.4	77.6	0	0	0	111.6	T754 E756	T754-H810 VanDerWaalsContact O-CB 3.25Å; T754-H810 WeakPolarHBondContact O-CB 3.22Å; T754-H810 PolarHBondContact O-N 3.17Å; E756-H810 VanDerWaalsContact CD-ND1 3.3Å; E756-H810 HydrophobicContact CG-CB 4.36Å; E756-H810 IonicContact OE1-CE1 3.71Å; E756-H810 PolarHBondContact OE1-CE1 3.42Å; E756-H810 IonicContact OE1-CG 2.7Å; E756-H810 IonicContact OE1-ND1 3.44Å; E756-H810 PolarHBondContact OE1-ND1 3.15Å; E756-H810 IonicContact OE2-ND1 3.83Å
811	G	75.4	Confident	83.7	Confident	75 Å²	75	61.2 Å²	61.2	77%	0.773	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	-10.4	-179.5	0	0	0	0	0	115.6	V809	V809-G811 PolarHBondContact O-N 2.69Å; V809-G811 VanDerWaalsContact O-N 3.13Å
812	A	72.4	Confident	83.8	Confident	52 Å²	52	66.3 Å²	66.3	43%	0.43	38%	0.379	S	S	.	.			trans	-80.4	129.8	169.9	0	0	0	0	0	109.9	V809	V809-A812 HydrophobicContact CB-CB 4.14Å; V809-A812 WeakPolarHBondContact O-CB 3.36Å; V809-A812 PolarHBondContact O-N 2.53Å
813	T	62.5	Low	83.7	Confident	144 Å²	144	65.9 Å²	65.9	88%	0.883	38%	0.381	S	S	*	.	S	Bend	trans	-98.1	102.7	178.1	35.9	0	0	0	0	110
814	G	64.9	Low	83.5	Confident	75 Å²	75	65.9 Å²	65.9	77%	0.773	38%	0.378	S	S	*	.	S	Bend	trans	100.3	-2.5	165.4	0	0	0	0	0	117.6	R816	G814-R816 PolarHBondContact O-N 3.07Å
815	D	66.5	Low	83	Confident	116 Å²	116	70.1 Å²	70.1	62%	0.62	40%	0.396	S	S	*	.			trans	-96.4	88.1	176.5	-72.9	-21.9	0	0	0	110.6	N817	D815-N817 PolarHBondContact O-N 2.9Å
816	R	78	Confident	82.3	Confident	148 Å²	148	70.8 Å²	70.8	56%	0.558	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	108.7	169.6	-174.8	168.9	171.7	-171	-5.7	108.5	E761 S806 D808 G814	E761-R816 IonicContact OE1-NH2 2.75Å; E761-R816 PolarHBondContact OE1-NH2 3.43Å; S806-R816 PolarHBondContact OG-NE 2.8Å; S806-R816 PolarHBondContact OG-NH2 2.81Å; D808-R816 WeakPolarHBondContact OD1-CA 3.33Å; D808-R816 WeakPolarHBondContact OD1-CB 3.3Å; D808-R816 WeakPolarHBondContact OD1-CG 3.45Å; G814-R816 PolarHBondContact O-N 3.07Å
817	N	85.2	Confident	81.4	Confident	60 Å²	60	72.4 Å²	72.4	32%	0.321	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	142.8	-178.8	-69.4	-36.1	0	0	0	110.2	S806 Y807 D815	S806-N817 VanDerWaalsContact CA-O 3.27Å; S806-N817 WeakPolarHBondContact CA-O 3.21Å; Y807-N817 HydrophobicContact CD1-CB 4.41Å; Y807-N817 HydrophobicContact CD2-CB 4.14Å; Y807-N817 HydrophobicContact CE1-CB 3.88Å; Y807-N817 HydrophobicContact CE2-CB 3.62Å; Y807-N817 VanDerWaalsContact CZ-CB 3.45Å; Y807-N817 PolarHBondContact N-O 3.41Å; Y807-N817 PolarHBondContact O-N 3.01Å; D815-N817 PolarHBondContact O-N 2.9Å
818	C	88.6	Confident	80.4	Confident	63 Å²	63	72.2 Å²	72.2	43%	0.426	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	128.8	-177.9	-171	0	0	0	0	110.3	L805	L805-C818 CarbonylContact O-C 3.52Å; L805-C818 WeakPolarHBondContact O-CA 3.5Å
819	I	90.5	Very high	79.4	Confident	13 Å²	13	69.9 Å²	69.9	7%	0.067	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124.6	175.5	-62.5	164.4	0	0	0	107.9	D726 V728 T804 L805 Y807	D726-I819 HydrophobicContact CB-CD1 4.29Å; V728-I819 HydrophobicContact CB-CD1 3.67Å; V728-I819 HydrophobicContact CG2-CD1 4.04Å; T804-I819 CarbonylContact C-O 3.58Å; T804-I819 VanDerWaalsContact CA-O 3.27Å; T804-I819 WeakPolarHBondContact CA-O 3.25Å; L805-I819 HydrophobicContact CB-CB 4.39Å; L805-I819 PolarHBondContact N-O 3.46Å; L805-I819 PolarHBondContact O-N 3.31Å; Y807-I819 HydrophobicContact CE1-CD1 3.68Å; Y807-I819 HydrophobicContact CE1-CG1 4.13Å
820	Y	91.7	Very high	78.6	Confident	191 Å²	191	73.2 Å²	73.2	75%	0.749	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	124	172.8	-64.6	-81.3	0	0	0	109.4	T804	T804-Y820 HydrophobicContact CG2-CD1 3.57Å; T804-Y820 HydrophobicContact CG2-CE1 3.89Å; T804-Y820 HydrophobicContact CG2-CG 4.4Å
821	L	92.1	Very high	78.3	Confident	14 Å²	14	68.3 Å²	68.3	7%	0.073	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-85.7	154.8	179.6	-57.9	174.9	0	0	0	110.6	L721 A730 L760 G803 L805	L721-L821 HydrophobicContact CB-CB 4.23Å; L721-L821 HydrophobicContact CB-CD2 3.97Å; L721-L821 HydrophobicContact CB-CG 4.48Å; L721-L821 HydrophobicContact CD1-CD1 4.33Å; L721-L821 CarbonylContact O-C 3.49Å; L721-L821 WeakPolarHBondContact O-CA 3.36Å; A730-L821 HydrophobicContact CB-CD2 4.18Å; L760-L821 HydrophobicContact CD1-CD1 3.49Å; L760-L821 VanDerWaalsContact CD1-CD1 3.49Å; G803-L821 VanDerWaalsContact O-CB 3.31Å; G803-L821 WeakPolarHBondContact O-CB 3.49Å; G803-L821 PolarHBondContact O-N 3.08Å; L805-L821 HydrophobicContact CD1-CD2 3.85Å; L805-L821 HydrophobicContact CG-CD1 4.22Å; L805-L821 HydrophobicContact CG-CD2 4.06Å; L805-L821 HydrophobicContact CG-CG 4.47Å
822	N	90.8	Very high	78.5	Confident	107 Å²	107	65.1 Å²	65.1	57%	0.572	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-67	143.9	169.8	-167.1	26.2	0	0	0	110.5	L721	L721-N822 PolarHBondContact O-N 3.41Å
823	D	89.8	Confident	78.7	Confident	73 Å²	73	65.4 Å²	65.4	39%	0.39	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-74.7	134.3	-176.3	-67.2	-12.4	0	0	0	110.9	V800 F802	V800-D823 HydrophobicContact CG1-CB 3.81Å; F802-D823 WeakPolarHBondContact CB-OD1 3.23Å
824	I	86.6	Confident	79.6	Confident	10 Å²	10	62.2 Å²	62.2	5%	0.051	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	114.4	171.9	-55.4	172.7	0	0	0	108.3	L721 A732 I734 L743 I801	L721-I824 HydrophobicContact CD2-CD1 3.77Å; L721-I824 HydrophobicContact CD2-CG1 3.58Å; A732-I824 HydrophobicContact CB-CD1 4.27Å; I734-I824 HydrophobicContact CD1-CG2 3.36Å; I734-I824 HydrophobicContact CG1-CG2 4.42Å; L743-I824 HydrophobicContact CD1-CD1 4.19Å; L743-I824 HydrophobicContact CD2-CD1 4.03Å; I801-I824 HydrophobicContact CB-CB 4.21Å; I801-I824 HydrophobicContact CD1-CG2 4.5Å; I801-I824 PolarHBondContact N-O 3.28Å; I801-I824 PolarHBondContact O-N 3.24Å
825	H	81.4	Confident	80.2	Confident	115 Å²	115	60.5 Å²	60.5	53%	0.532	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	112.8	174.5	-65.6	-69.9	0	0	0	110.7	N827	H825-N827 PolarHBondContact O-N 3.46Å
826	V	76.5	Confident	80.7	Confident	15 Å²	15	58.5 Å²	58.5	9%	0.091	30%	0.295	C	S	.	.			trans	-77.8	119.7	173.7	-178.6	0	0	0	0	108.6	I741 L768 G799 I801 Y831	I741-V826 HydrophobicContact CD1-CB 4.25Å; I741-V826 HydrophobicContact CD1-CG1 3.57Å; I741-V826 HydrophobicContact CD1-CG2 3.62Å; L768-V826 HydrophobicContact CD1-CG2 4.14Å; G799-V826 PolarHBondContact O-N 3.24Å; I801-V826 HydrophobicContact CD1-CG2 3.58Å; I801-V826 HydrophobicContact CG1-CG2 4.18Å; V826-Y831 HydrophobicContact CG1-CE2 4.31Å
827	N	72	Confident	80.8	Confident	37 Å²	37	52.3 Å²	52.3	20%	0.198	28%	0.275	C	S	.	.			trans	-95.4	125.8	-177.3	-171.3	7.7	0	0	0	110.9	H825 M829 R944	H825-N827 PolarHBondContact O-N 3.46Å; N827-M829 PolarHBondContact O-N 2.68Å; N827-M829 WeakPolarHBondContact OD1-CG 3.45Å; N827-M829 PolarHBondContact OD1-N 2.65Å; N827-R944 PolarHBondContact ND2-NH1 3.29Å; N827-R944 VanDerWaalsContact ND2-NH1 3.18Å
828	I	69.1	Low	80.3	Confident	8 Å²	8	52 Å²	52	4%	0.041	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-65.4	-22	179.5	-65.3	150.1	0	0	0	112.2	T796 N798 D830 Y831 I832 M937 S940	T796-I828 WeakPolarHBondContact O-CD1 3.39Å; N798-I828 HydrophobicContact CB-CD1 4.48Å; N798-I828 VanDerWaalsContact OD1-CD1 3.22Å; N798-I828 WeakPolarHBondContact OD1-CD1 3.31Å; I828-D830 PolarHBondContact O-N 2.85Å; I828-Y831 WeakPolarHBondContact O-CA 3.12Å; I828-Y831 WeakPolarHBondContact O-CB 3.45Å; I828-Y831 PolarHBondContact O-N 2.79Å; I828-I832 HydrophobicContact CG2-CD1 3.87Å; I828-I832 HydrophobicContact CG2-CG1 3.97Å; I828-I832 PolarHBondContact O-N 2.77Å; I828-M937 HydrophobicContact CG2-CE 4.41Å; I828-M937 HydrophobicContact CG2-SD 4.12Å; I828-S940 WeakPolarHBondContact CD1-OG 3.32Å
829	M	69.8	Low	79.7	Confident	7 Å²	7	52.6 Å²	52.6	3%	0.034	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-55.7	-28.2	-178	-72.5	-48.9	-44.5	0	0	114.6	N827 Y831 I832 T875 N876 L941 R944	N827-M829 PolarHBondContact O-N 2.68Å; N827-M829 WeakPolarHBondContact OD1-CG 3.45Å; N827-M829 PolarHBondContact OD1-N 2.65Å; M829-Y831 PolarHBondContact O-N 3.31Å; M829-I832 HydrophobicContact CE-CB 4.33Å; M829-I832 PolarHBondContact O-N 3.45Å; M829-I832 HydrophobicContact SD-CD1 4.17Å; M829-T875 WeakPolarHBondContact CE-O 3.19Å; M829-N876 HydrophobicContact CE-CB 3.71Å; M829-N876 PolarHBondContact O-ND2 3.08Å; M829-L941 HydrophobicContact SD-CD2 4.11Å; M829-R944 HydrophobicContact CG-CG 3.75Å; M829-R944 HydrophobicContact SD-CG 4Å
830	D	67.7	Low	79	Confident	100 Å²	100	57.9 Å²	57.9	54%	0.535	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-71.6	-18.1	179.2	-57.6	-30.6	0	0	0	111.9	L736 I828	L736-D830 HydrophobicContact CD1-CB 3.76Å; L736-D830 WeakPolarHBondContact CD1-OD2 3.29Å; I828-D830 PolarHBondContact O-N 2.85Å
831	Y	73.2	Confident	78.4	Confident	12 Å²	12	52.6 Å²	52.6	5%	0.047	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-100.2	-8.1	178.7	-60.4	-70.9	0	0	0	113.4	L736 V826 I828 M829 S901 V902 F903	L736-Y831 WeakPolarHBondContact CD2-OH 3.39Å; V826-Y831 HydrophobicContact CG1-CE2 4.31Å; I828-Y831 WeakPolarHBondContact O-CA 3.12Å; I828-Y831 WeakPolarHBondContact O-CB 3.45Å; I828-Y831 PolarHBondContact O-N 2.79Å; M829-Y831 PolarHBondContact O-N 3.31Å; Y831-S901 CarbonylContact O-C 3.5Å; Y831-S901 VanDerWaalsContact O-CA 3.25Å; Y831-S901 WeakPolarHBondContact O-CA 3.31Å; Y831-V902 HydrophobicContact CD1-CG2 3.66Å; Y831-V902 HydrophobicContact CG-CG2 4.25Å; Y831-V902 PolarHBondContact O-N 2.85Å; Y831-F903 HydrophobicContact CD1-CE2 4.01Å; Y831-F903 HydrophobicContact CD1-CZ 4.08Å; Y831-F903 HydrophobicContact CD2-CE2 4.49Å; Y831-F903 HydrophobicContact CE1-CZ 4.3Å; Y831-F903 AromaticContact CG-CE2 3.92Å; Y831-F903 HydrophobicContact CG-CE2 3.92Å; Y831-F903 HydrophobicContact CG-CZ 4.39Å
832	I	79	Confident	78.1	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.041	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	125.5	-177.9	-64.5	-177.7	0	0	0	109.9	I828 M829 N876 A899 M937 L941	I828-I832 HydrophobicContact CG2-CD1 3.87Å; I828-I832 HydrophobicContact CG2-CG1 3.97Å; I828-I832 PolarHBondContact O-N 2.77Å; M829-I832 HydrophobicContact CE-CB 4.33Å; M829-I832 PolarHBondContact O-N 3.45Å; M829-I832 HydrophobicContact SD-CD1 4.17Å; I832-N876 HydrophobicContact CG2-CB 4.49Å; I832-A899 HydrophobicContact CG2-CB 3.42Å; I832-A899 VanDerWaalsContact CG2-CB 3.42Å; I832-M937 HydrophobicContact CD1-SD 3.91Å; I832-M937 HydrophobicContact CG1-SD 4.49Å; I832-L941 HydrophobicContact CD1-CD1 4.26Å; I832-L941 HydrophobicContact CD1-CD2 3.55Å; I832-L941 HydrophobicContact CD1-CG 3.99Å
833	T	77.2	Confident	77.9	Confident	58 Å²	58	54.7 Å²	54.7	36%	0.356	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	140.5	178.4	59.9	0	0	0	0	111.6	V835 A899 R900 V902	T833-V835 PolarHBondContact O-N 3.34Å; T833-A899 WeakPolarHBondContact O-CA 3.39Å; T833-A899 WeakPolarHBondContact O-CB 3.24Å; T833-R900 PolarHBondContact N-O 3.35Å; T833-R900 PolarHBondContact O-N 2.93Å; T833-R900 PolarHBondContact OG1-O 2.87Å; T833-V902 HydrophobicContact CG2-CG1 4.45Å
834	P	80.2	Confident	77.6	Confident	77 Å²	77	56.4 Å²	56.4	50%	0.5	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	128.4	176.3	27	-32	0	0	0	110.4	N876 R878	P834-N876 WeakPolarHBondContact CA-O 3.3Å; P834-N876 WeakPolarHBondContact CB-O 3.4Å; P834-R878 HydrophobicContact CB-CB 4.02Å
835	V	77.6	Confident	77.5	Confident	38 Å²	38	57.1 Å²	57.1	23%	0.23	29%	0.291	C	S	.	.			trans	-130.5	153.7	179.2	-174.9	0	0	0	0	109.6	T833 Y898 R900	T833-V835 PolarHBondContact O-N 3.34Å; V835-Y898 HydrophobicContact CB-CD1 4.19Å; V835-Y898 HydrophobicContact CB-CE1 3.75Å; V835-Y898 HydrophobicContact CG1-CE1 3.78Å; V835-Y898 WeakPolarHBondContact O-CD1 3.4Å; V835-R900 HydrophobicContact CB-CB 4.4Å; V835-R900 HydrophobicContact CG2-CB 3.69Å
836	L	76.9	Confident	77.9	Confident	74 Å²	74	54.1 Å²	54.1	39%	0.387	28%	0.275	S	S	.	.			trans	-96.6	138.8	171	-75.6	169.6	0	0	0	110.1	R878 L880	L836-R878 HydrophobicContact CD2-CG 4.23Å; L836-L880 HydrophobicContact CD2-CD2 4.02Å
837	C	80.6	Confident	78.4	Confident	19 Å²	19	57.8 Å²	57.8	13%	0.128	30%	0.301	C	S	.	.			trans	-132.8	161.4	162.3	70.9	0	0	0	0	109.1	E841 M845 L880 Y898	C837-E841 HydrophobicContact CB-CB 4.17Å; C837-M845 HydrophobicContact CB-CE 4.02Å; C837-L880 VanDerWaalsContact SG-CD1 3.56Å; C837-Y898 HydrophobicContact CB-CD1 3.84Å; C837-Y898 HydrophobicContact CB-CE1 3.64Å
838	S	75.5	Confident	79.1	Confident	53 Å²	53	61.5 Å²	61.5	37%	0.371	32%	0.317	S	S	.	.			trans	-70.9	160.1	172.4	64.4	0	0	0	0	111.7	E840 E841 F842	S838-E840 PolarHBondContact O-N 3.41Å; S838-E841 PolarHBondContact N-OE2 2.85Å; S838-E841 PolarHBondContact O-N 3.3Å; S838-E841 WeakPolarHBondContact OG-CB 3.47Å; S838-E841 WeakPolarHBondContact OG-CG 3.15Å; S838-E841 PolarHBondContact OG-N 3.34Å; S838-E841 PolarHBondContact OG-OE2 3.08Å; S838-F842 WeakPolarHBondContact O-CB 3.15Å; S838-F842 PolarHBondContact O-N 2.88Å
839	D	76.7	Confident	80	Confident	76 Å²	76	61.9 Å²	61.9	41%	0.406	32%	0.319	S	S	.	.	H	α-helix	trans	-59.4	-32.6	173.9	-86.8	-6.9	0	0	0	112.8	R843	D839-R843 VanDerWaalsContact O-CG 3.27Å; D839-R843 WeakPolarHBondContact O-CG 3.36Å; D839-R843 PolarHBondContact O-N 3.26Å
840	E	74.8	Confident	80.7	Confident	123 Å²	123	69.7 Å²	69.7	58%	0.575	36%	0.355	S	S	*	.	H	α-helix	trans	-71.2	-47.7	178.1	-68.4	-179.4	178.1	0	0	110.9	S838 F842 R843 Q844	S838-E840 PolarHBondContact O-N 3.41Å; E840-F842 VanDerWaalsContact C-N 3.3Å; E840-F842 PolarHBondContact O-N 3.11Å; E840-R843 PolarHBondContact O-N 3.33Å; E840-Q844 WeakPolarHBondContact O-CB 3.47Å; E840-Q844 PolarHBondContact O-N 2.95Å
841	E	79.4	Confident	81.6	Confident	81 Å²	81	70.1 Å²	70.1	38%	0.379	35%	0.349	S	S	.	.	H	α-helix	trans	-59.2	-42.7	173.3	-72.5	163.4	165.2	0	0	110.8	C837 S838 R843 Q844 M845	C837-E841 HydrophobicContact CB-CB 4.17Å; S838-E841 PolarHBondContact N-OE2 2.85Å; S838-E841 PolarHBondContact O-N 3.3Å; S838-E841 WeakPolarHBondContact OG-CB 3.47Å; S838-E841 WeakPolarHBondContact OG-CG 3.15Å; S838-E841 PolarHBondContact OG-N 3.34Å; S838-E841 PolarHBondContact OG-OE2 3.08Å; E841-R843 PolarHBondContact O-N 2.61Å; E841-Q844 PolarHBondContact O-N 3.49Å; E841-M845 HydrophobicContact CB-CE 4.27Å; E841-M845 WeakPolarHBondContact O-CB 3.47Å; E841-M845 WeakPolarHBondContact O-CE 3.39Å; E841-M845 VanDerWaalsContact O-CG 3.25Å; E841-M845 WeakPolarHBondContact O-CG 3.48Å; E841-M845 PolarHBondContact O-N 2.9Å
842	F	86	Confident	82.4	Confident	8 Å²	8	73.1 Å²	73.1	4%	0.035	36%	0.364	C	S	.	.	H	α-helix	trans	-58.1	-48.3	175.5	-176.3	-87.2	0	0	0	111.3	S838 E840 W846 L880 N896 L908	S838-F842 WeakPolarHBondContact O-CB 3.15Å; S838-F842 PolarHBondContact O-N 2.88Å; E840-F842 VanDerWaalsContact C-N 3.3Å; E840-F842 PolarHBondContact O-N 3.11Å; F842-W846 HydrophobicContact CE1-CB 4.5Å; F842-W846 HydrophobicContact CE1-CD2 4.26Å; F842-W846 AromaticContact CE1-CE3 3.84Å; F842-W846 HydrophobicContact CE1-CE3 3.84Å; F842-W846 HydrophobicContact CE1-CZ3 4.5Å; F842-W846 HydrophobicContact CE2-CE3 4.46Å; F842-W846 HydrophobicContact CZ-CD2 4.47Å; F842-W846 AromaticContact CZ-CE3 3.62Å; F842-W846 HydrophobicContact CZ-CE3 3.62Å; F842-W846 AromaticContact CZ-CZ3 3.96Å; F842-W846 HydrophobicContact CZ-CZ3 3.96Å; F842-W846 WeakPolarHBondContact O-CB 3.43Å; F842-W846 PolarHBondContact O-N 3.47Å; F842-L880 HydrophobicContact CB-CD1 4.3Å; F842-L880 HydrophobicContact CD2-CD1 3.51Å; F842-L880 HydrophobicContact CE2-CD1 4.19Å; F842-L880 HydrophobicContact CG-CD1 4.17Å; F842-N896 HydrophobicContact CD2-CB 4.47Å; F842-N896 HydrophobicContact CE1-CB 4.07Å; F842-N896 HydrophobicContact CE2-CB 3.97Å; F842-N896 HydrophobicContact CZ-CB 3.75Å; F842-L908 HydrophobicContact CD2-CD2 3.48Å; F842-L908 VanDerWaalsContact CD2-CD2 3.48Å; F842-L908 HydrophobicContact CD2-CG 4.42Å; F842-L908 HydrophobicContact CE2-CB 3.86Å; F842-L908 HydrophobicContact CE2-CD2 3.58Å; F842-L908 HydrophobicContact CE2-CG 4.16Å; F842-L908 HydrophobicContact CG-CD2 4.42Å; F842-L908 HydrophobicContact CZ-CB 4.27Å
843	R	85.2	Confident	82.9	Confident	157 Å²	157	74.2 Å²	74.2	59%	0.592	37%	0.37	S	S	*	.	H	α-helix	trans	-65.4	-39.8	179.3	-74.1	174.6	-171.9	127	7.9	112.2	D839 E840 E841 W846 S847	D839-R843 VanDerWaalsContact O-CG 3.27Å; D839-R843 WeakPolarHBondContact O-CG 3.36Å; D839-R843 PolarHBondContact O-N 3.26Å; E840-R843 PolarHBondContact O-N 3.33Å; E841-R843 PolarHBondContact O-N 2.61Å; R843-W846 PolarHBondContact O-N 3.05Å; R843-S847 PolarHBondContact O-N 3.38Å; R843-S847 PolarHBondContact O-OG 3.37Å
844	Q	83.3	Confident	83.6	Confident	109 Å²	109	77.5 Å²	77.5	51%	0.509	38%	0.379	S	S	.	.	H	α-helix	trans	-62.4	-57.1	176.3	-178	176.3	1	0	0	109.9	E840 E841 W846 S847 E848	E840-Q844 WeakPolarHBondContact O-CB 3.47Å; E840-Q844 PolarHBondContact O-N 2.95Å; E841-Q844 PolarHBondContact O-N 3.49Å; Q844-W846 VanDerWaalsContact C-N 3.26Å; Q844-W846 PolarHBondContact O-N 3.49Å; Q844-S847 PolarHBondContact O-N 3.32Å; Q844-S847 PolarHBondContact O-OG 3.13Å; Q844-E848 HydrophobicContact CG-CG 4.42Å; Q844-E848 VanDerWaalsContact CG-OE1 3.27Å; Q844-E848 WeakPolarHBondContact CG-OE1 3.36Å; Q844-E848 PolarHBondContact NE2-OE1 2.95Å; Q844-E848 WeakPolarHBondContact O-CG 3.47Å; Q844-E848 PolarHBondContact O-N 3.49Å
845	M	85.8	Confident	84.1	Confident	24 Å²	24	74.3 Å²	74.3	12%	0.118	36%	0.358	C	S	.	.	H	α-helix	trans	-56.9	-40.1	177.5	-67.8	-174.8	-67.7	0	0	111.7	C837 E841 S847 E848 F849 Y898 D906 L908	C837-M845 HydrophobicContact CB-CE 4.02Å; E841-M845 HydrophobicContact CB-CE 4.27Å; E841-M845 WeakPolarHBondContact O-CB 3.47Å; E841-M845 WeakPolarHBondContact O-CE 3.39Å; E841-M845 VanDerWaalsContact O-CG 3.25Å; E841-M845 WeakPolarHBondContact O-CG 3.48Å; E841-M845 PolarHBondContact O-N 2.9Å; M845-S847 VanDerWaalsContact C-N 3.26Å; M845-S847 PolarHBondContact O-N 2.89Å; M845-E848 PolarHBondContact O-N 3.2Å; M845-F849 HydrophobicContact CB-CD1 4.48Å; M845-F849 HydrophobicContact CB-CE1 3.89Å; M845-F849 HydrophobicContact CB-CE2 4.19Å; M845-F849 HydrophobicContact CB-CZ 3.71Å; M845-F849 HydrophobicContact CG-CE1 4.27Å; M845-F849 HydrophobicContact CG-CZ 4.09Å; M845-F849 WeakPolarHBondContact O-CB 3.1Å; M845-F849 WeakPolarHBondContact O-CD1 3.12Å; M845-F849 WeakPolarHBondContact O-CG 3.35Å; M845-F849 PolarHBondContact O-N 3.41Å; M845-F849 HydrophobicContact SD-CZ 4.15Å; M845-Y898 HydrophobicContact CE-CE2 4.16Å; M845-D906 HydrophobicContact SD-CB 4.49Å; M845-L908 HydrophobicContact CB-CD1 3.69Å; M845-L908 HydrophobicContact CE-CD2 3.91Å
846	W	90.1	Very high	84.8	Confident	53 Å²	53	75.2 Å²	75.2	20%	0.201	37%	0.369	C	S	.	.	H	α-helix	trans	-61.2	-34.8	176.7	-170.1	-87.7	0	0	0	112.8	F842 R843 Q844 L908 N910 R929 R931	F842-W846 HydrophobicContact CE1-CB 4.5Å; F842-W846 HydrophobicContact CE1-CD2 4.26Å; F842-W846 AromaticContact CE1-CE3 3.84Å; F842-W846 HydrophobicContact CE1-CE3 3.84Å; F842-W846 HydrophobicContact CE1-CZ3 4.5Å; F842-W846 HydrophobicContact CE2-CE3 4.46Å; F842-W846 HydrophobicContact CZ-CD2 4.47Å; F842-W846 AromaticContact CZ-CE3 3.62Å; F842-W846 HydrophobicContact CZ-CE3 3.62Å; F842-W846 AromaticContact CZ-CZ3 3.96Å; F842-W846 HydrophobicContact CZ-CZ3 3.96Å; F842-W846 WeakPolarHBondContact O-CB 3.43Å; F842-W846 PolarHBondContact O-N 3.47Å; R843-W846 PolarHBondContact O-N 3.05Å; Q844-W846 VanDerWaalsContact C-N 3.26Å; Q844-W846 PolarHBondContact O-N 3.49Å; W846-L908 HydrophobicContact CB-CD1 4.18Å; W846-L908 HydrophobicContact CE3-CB 3.78Å; W846-L908 HydrophobicContact CE3-CD1 3.99Å; W846-L908 HydrophobicContact CZ3-CB 3.87Å; W846-N910 HydrophobicContact CH2-CB 3.49Å; W846-N910 VanDerWaalsContact CH2-CB 3.49Å; W846-N910 HydrophobicContact CZ2-CB 4.06Å; W846-N910 HydrophobicContact CZ3-CB 3.99Å; W846-R929 HydrophobicContact CH2-CB 3.93Å; W846-R929 WeakPolarHBondContact CH2-O 3.41Å; W846-R929 HydrophobicContact CZ2-CB 4.2Å; W846-R931 HydrophobicContact CD2-CG 4.46Å; W846-R931 HydrophobicContact CE3-CB 4.26Å; W846-R931 HydrophobicContact CE3-CG 4.37Å; W846-R931 HydrophobicContact CH2-CB 4.48Å; W846-R931 HydrophobicContact CH2-CG 4Å; W846-R931 HydrophobicContact CZ2-CG 4.1Å; W846-R931 HydrophobicContact CZ3-CB 4.14Å; W846-R931 HydrophobicContact CZ3-CG 4.15Å; W846-R931 PolarHBondContact O-NH1 3.45Å
847	S	85.9	Confident	85.2	Confident	91 Å²	91	72 Å²	72	64%	0.636	35%	0.353	S	S	*	.	H	α-helix	trans	-81.6	-29.3	176.8	63.3	0	0	0	0	113.5	R843 Q844 M845	R843-S847 PolarHBondContact O-N 3.38Å; R843-S847 PolarHBondContact O-OG 3.37Å; Q844-S847 PolarHBondContact O-N 3.32Å; Q844-S847 PolarHBondContact O-OG 3.13Å; M845-S847 VanDerWaalsContact C-N 3.26Å; M845-S847 PolarHBondContact O-N 2.89Å
848	E	86.4	Confident	85.1	Confident	116 Å²	116	77.7 Å²	77.7	54%	0.542	38%	0.379	S	S	.	.	H	α-helix	trans	-79.3	-30.7	177.1	-71.7	178.5	-172	0	0	113.3	Q844 M845 E850	Q844-E848 HydrophobicContact CG-CG 4.42Å; Q844-E848 VanDerWaalsContact CG-OE1 3.27Å; Q844-E848 WeakPolarHBondContact CG-OE1 3.36Å; Q844-E848 PolarHBondContact NE2-OE1 2.95Å; Q844-E848 WeakPolarHBondContact O-CG 3.47Å; Q844-E848 PolarHBondContact O-N 3.49Å; M845-E848 PolarHBondContact O-N 3.2Å; E848-E850 PolarHBondContact O-N 3.27Å
849	F	88.2	Confident	85.3	Confident	15 Å²	15	75.8 Å²	75.8	7%	0.066	37%	0.365	C	S	.	.			trans	-73.1	125.7	-174.3	-69.8	1.7	0	0	0	112.1	M845 D906 L908 R931	M845-F849 HydrophobicContact CB-CD1 4.48Å; M845-F849 HydrophobicContact CB-CE1 3.89Å; M845-F849 HydrophobicContact CB-CE2 4.19Å; M845-F849 HydrophobicContact CB-CZ 3.71Å; M845-F849 HydrophobicContact CG-CE1 4.27Å; M845-F849 HydrophobicContact CG-CZ 4.09Å; M845-F849 WeakPolarHBondContact O-CB 3.1Å; M845-F849 WeakPolarHBondContact O-CD1 3.12Å; M845-F849 WeakPolarHBondContact O-CG 3.35Å; M845-F849 PolarHBondContact O-N 3.41Å; M845-F849 HydrophobicContact SD-CZ 4.15Å; F849-D906 HydrophobicContact CE2-CB 4.04Å; F849-D906 HydrophobicContact CZ-CB 3.62Å; F849-L908 HydrophobicContact CD2-CD1 3.62Å; F849-L908 HydrophobicContact CD2-CG 4.08Å; F849-L908 HydrophobicContact CE2-CD1 3.51Å; F849-L908 HydrophobicContact CE2-CG 3.68Å; F849-L908 HydrophobicContact CZ-CD1 4.33Å; F849-R931 HydrophobicContact CB-CB 4.15Å; F849-R931 HydrophobicContact CD2-CB 4.26Å
850	E	84.4	Confident	85.3	Confident	171 Å²	171	76.4 Å²	76.4	80%	0.799	37%	0.372	S	S	*	.			trans	-80.6	-35.1	-173.3	-62.1	-176.5	171.1	0	0	113.3	E848	E848-E850 PolarHBondContact O-N 3.27Å
851	W	87.4	Confident	85.5	Confident	109 Å²	109	71.3 Å²	71.3	41%	0.413	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	127.3	-173.3	-65.4	92.5	0	0	0	111.7	R931 A932 K933 Q935 A938	W851-R931 VanDerWaalsContact O-CA 3.24Å; W851-R931 WeakPolarHBondContact O-CA 3.27Å; W851-A932 PolarHBondContact N-O 3.3Å; W851-A932 PolarHBondContact O-N 3.26Å; W851-K933 VanDerWaalsContact CD1-O 3.31Å; W851-Q935 HydrophobicContact CD2-CB 3.71Å; W851-Q935 HydrophobicContact CD2-CG 4.05Å; W851-Q935 HydrophobicContact CE3-CB 3.92Å; W851-Q935 HydrophobicContact CE3-CG 3.7Å; W851-Q935 HydrophobicContact CG-CB 4.2Å; W851-Q935 HydrophobicContact CH2-CB 4.22Å; W851-Q935 HydrophobicContact CH2-CG 4.07Å; W851-Q935 HydrophobicContact CZ2-CB 4.04Å; W851-Q935 HydrophobicContact CZ2-CG 4.41Å; W851-Q935 HydrophobicContact CZ3-CB 4.17Å; W851-Q935 HydrophobicContact CZ3-CG 3.71Å; W851-A938 HydrophobicContact CB-CB 4.26Å
852	E	89.3	Confident	85.5	Confident	76 Å²	76	69.7 Å²	69.7	36%	0.355	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	131.3	174.8	-178	177	166	0	0	110.5	R929 I930 R931	E852-R929 WeakPolarHBondContact OE1-CD 3.22Å; E852-R929 IonicContact OE1-NH1 2.74Å; E852-I930 CarbonylContact C-O 3.59Å; E852-I930 VanDerWaalsContact CA-O 3.32Å; E852-I930 WeakPolarHBondContact CA-O 3.33Å; E852-R931 HydrophobicContact CB-CG 4Å; E852-R931 HydrophobicContact CG-CG 4.1Å; E852-R931 IonicContact OE2-CZ 3.56Å; E852-R931 IonicContact OE2-NE 2.65Å; E852-R931 PolarHBondContact OE2-NE 3.05Å; E852-R931 IonicContact OE2-NH2 3.46Å; E852-R931 PolarHBondContact OE2-NH2 3.28Å
853	N	90.4	Very high	85.3	Confident	31 Å²	31	72.5 Å²	72.5	17%	0.166	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	129.2	169.7	-171.5	12	0	0	0	110	I930 A938	N853-I930 PolarHBondContact N-O 2.95Å; N853-I930 PolarHBondContact O-N 2.84Å; N853-A938 HydrophobicContact CB-CB 4.31Å; N853-A938 WeakPolarHBondContact CB-O 3.43Å; N853-A938 PolarHBondContact ND2-O 3.46Å
854	K	92.2	Very high	85.3	Confident	126 Å²	126	65.5 Å²	65.5	55%	0.548	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	112.6	-177	-175.4	-178.6	178	-176.4	0	110.3	H927 I928 R929	K854-H927 HydrophobicContact CG-CB 4.38Å; K854-I928 WeakPolarHBondContact CA-O 3.12Å; K854-R929 HydrophobicContact CG-CG 4.33Å
855	V	91	Very high	85.3	Confident	10 Å²	10	65.8 Å²	65.8	6%	0.061	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.4	179.1	-175.1	0	0	0	0	109.6	H927 I928 I930 I945 S946	V855-H927 CarbonylContact O-C 3.59Å; V855-H927 WeakPolarHBondContact O-CA 3.28Å; V855-I928 HydrophobicContact CB-CB 4.49Å; V855-I928 PolarHBondContact N-O 2.89Å; V855-I928 PolarHBondContact O-N 3.38Å; V855-I930 HydrophobicContact CG2-CD1 4.26Å; V855-I945 HydrophobicContact CG1-CG2 4Å; V855-S946 WeakPolarHBondContact CG1-OG 3.29Å
856	A	90.4	Very high	85.2	Confident	57 Å²	57	69.7 Å²	69.7	47%	0.471	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	141.3	172.6	0	0	0	0	0	110.1	Q949	A856-Q949 PolarHBondContact O-OE1 2.82Å
857	V	85.4	Confident	85	Confident	7 Å²	7	67.3 Å²	67.3	4%	0.042	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	118.1	177.1	175.1	0	0	0	0	109.5	T859 Y867 I913 V924 G926 I928	V857-T859 HydrophobicContact CG1-CG2 4.09Å; V857-Y867 HydrophobicContact CG1-CE1 3.9Å; V857-Y867 HydrophobicContact CG1-CE2 3.9Å; V857-Y867 VanDerWaalsContact CG1-CZ 3.48Å; V857-Y867 WeakPolarHBondContact CG1-OH 3.13Å; V857-Y867 HydrophobicContact CG2-CE1 4.21Å; V857-I913 HydrophobicContact CB-CG2 4.34Å; V857-I913 HydrophobicContact CG1-CG2 4.3Å; V857-I913 HydrophobicContact CG2-CG2 3.85Å; V857-V924 HydrophobicContact CG1-CG1 4.36Å; V857-G926 PolarHBondContact N-O 3.43Å; V857-I928 HydrophobicContact CG2-CD1 3.75Å; V857-I928 HydrophobicContact CG2-CG1 3.81Å
858	M	78.9	Confident	85.1	Confident	138 Å²	138	63.5 Å²	63.5	68%	0.68	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	103.8	172	-63.5	-176.3	-177.7	0	0	108.9
859	T	79.8	Confident	85	Confident	13 Å²	13	61.7 Å²	61.7	8%	0.08	31%	0.314	C	S	.	.			trans	-139.6	155.6	-179.9	-176.4	0	0	0	0	111.7	V857 L861 Y867 P923 V924	V857-T859 HydrophobicContact CG1-CG2 4.09Å; T859-L861 HydrophobicContact CG2-CB 4.2Å; T859-L861 PolarHBondContact OG1-N 3.36Å; T859-L861 VanDerWaalsContact OG1-N 3.07Å; T859-Y867 HydrophobicContact CG2-CD2 3.65Å; T859-Y867 HydrophobicContact CG2-CE2 3.84Å; T859-Y867 HydrophobicContact CG2-CG 4.46Å; T859-P923 WeakPolarHBondContact O-CB 3.27Å; T859-V924 HydrophobicContact CG2-CB 3.76Å; T859-V924 HydrophobicContact CG2-CG1 4.41Å
860	T	77.6	Confident	84.9	Confident	90 Å²	90	62.5 Å²	62.5	55%	0.552	32%	0.317	S	S	*	.	S	Bend	trans	-87.4	-8.4	169.5	48.1	0	0	0	0	112.5	H952 V953	T860-H952 PolarHBondContact OG1-CE1 2.76Å; T860-H952 VanDerWaalsContact OG1-CE1 3.26Å; T860-H952 PolarHBondContact OG1-ND1 3.17Å; T860-H952 VanDerWaalsContact OG1-ND1 3.14Å; T860-V953 HydrophobicContact CG2-CG2 4.5Å
861	L	79.2	Confident	85	Confident	16 Å²	16	54.5 Å²	54.5	8%	0.084	28%	0.28	C	S	.	.			trans	-66.5	137.9	175.9	-65.8	177.8	0	0	0	110.8	T859 E866 Y867 V924 H952	T859-L861 HydrophobicContact CG2-CB 4.2Å; T859-L861 PolarHBondContact OG1-N 3.36Å; T859-L861 VanDerWaalsContact OG1-N 3.07Å; L861-E866 HydrophobicContact CD1-CG 4.33Å; L861-E866 HydrophobicContact CD2-CG 4.3Å; L861-Y867 HydrophobicContact CD1-CD2 4.13Å; L861-V924 WeakPolarHBondContact O-CG2 3.41Å; L861-V924 PolarHBondContact O-N 3.35Å; L861-H952 VanDerWaalsContact CD2-CE1 3.46Å; L861-H952 WeakPolarHBondContact CD2-CE1 3.14Å; L861-H952 WeakPolarHBondContact CD2-NE2 3.41Å; L861-H952 VanDerWaalsContact CG-CE1 3.44Å; L861-H952 WeakPolarHBondContact CG-CE1 3.34Å
862	S	79	Confident	84.9	Confident	46 Å²	46	51.4 Å²	51.4	32%	0.322	27%	0.272	S	S	.	.			trans	-102.2	-17.4	176.7	54.6	0	0	0	0	113.2	K915	S862-K915 WeakPolarHBondContact O-CE 3.28Å; S862-K915 PolarHBondContact O-NZ 3.12Å
863	D	82.1	Confident	84.6	Confident	68 Å²	68	55.3 Å²	55.3	36%	0.364	29%	0.288	S	S	.	.			trans	-95.2	129.2	175.4	-175	29.2	0	0	0	111.7	R865 E866 Y867	D863-R865 PolarHBondContact OD1-N 3.08Å; D863-E866 HydrophobicContact CB-CB 3.86Å; D863-E866 PolarHBondContact OD2-N 3.26Å; D863-Y867 PolarHBondContact O-N 3.01Å
864	L	84.5	Confident	84.3	Confident	10 Å²	10	56.6 Å²	56.6	5%	0.052	29%	0.293	C	S	.	.	H	α-helix	trans	-69.4	-35.9	-178.4	-64	170.7	0	0	0	111	L868 L893 I913 K915 V924	L864-L868 PolarHBondContact O-N 3.33Å; L864-L868 VanDerWaalsContact O-N 3.13Å; L864-L893 HydrophobicContact CB-CB 4.15Å; L864-L893 HydrophobicContact CB-CD1 4.07Å; L864-L893 HydrophobicContact CD1-CB 4.1Å; L864-I913 HydrophobicContact CB-CD1 4.13Å; L864-I913 HydrophobicContact CD2-CB 4.22Å; L864-I913 HydrophobicContact CD2-CD1 3.74Å; L864-I913 HydrophobicContact CD2-CG1 3.9Å; L864-K915 HydrophobicContact CD1-CG 4.33Å; L864-K915 HydrophobicContact CD2-CG 4.34Å; L864-K915 HydrophobicContact CG-CG 4.3Å; L864-V924 HydrophobicContact CD2-CB 4.25Å; L864-V924 HydrophobicContact CD2-CG1 3.68Å; L864-V924 HydrophobicContact CD2-CG2 3.61Å; L864-V924 HydrophobicContact CG-CG2 4.34Å
865	R	83.3	Confident	83.8	Confident	114 Å²	114	50.7 Å²	50.7	43%	0.43	27%	0.268	S	S	.	.	H	α-helix	trans	-75.6	-44	-179.2	-63.8	-172.2	-160.2	174.4	14.5	111.5	D863 Y867 L868 S869 L886 S887 L893	D863-R865 PolarHBondContact OD1-N 3.08Å; R865-Y867 PolarHBondContact O-N 2.98Å; R865-L868 PolarHBondContact O-N 3.47Å; R865-L868 VanDerWaalsContact O-N 3.08Å; R865-S869 PolarHBondContact O-N 3.46Å; R865-S869 PolarHBondContact O-OG 3.24Å; R865-L886 PolarHBondContact NE-O 3.12Å; R865-L886 PolarHBondContact NH2-O 3.27Å; R865-S887 VanDerWaalsContact NH2-C 3.26Å; R865-S887 VanDerWaalsContact NH2-CA 3.33Å; R865-S887 PolarHBondContact NH2-O 3.19Å; R865-L893 HydrophobicContact CG-CD1 4.38Å
866	E	84	Confident	83.4	Confident	106 Å²	106	53.4 Å²	53.4	50%	0.495	28%	0.282	S	S	.	.	H	α-helix	trans	-54.2	-43.9	173	-169.3	175.4	-163.2	0	0	111.4	L861 D863 S869 Y870	L861-E866 HydrophobicContact CD1-CG 4.33Å; L861-E866 HydrophobicContact CD2-CG 4.3Å; D863-E866 HydrophobicContact CB-CB 3.86Å; D863-E866 PolarHBondContact OD2-N 3.26Å; E866-S869 PolarHBondContact O-N 3.19Å; E866-Y870 WeakPolarHBondContact O-CB 3.32Å; E866-Y870 PolarHBondContact O-N 3.11Å
867	Y	86.5	Confident	83.2	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.016	26%	0.26	C	S	.	.	H	α-helix	trans	-62.4	-43.4	174.8	-177.5	-96.2	0	0	0	113.1	V857 T859 L861 D863 R865 Y870 L871 L911 I913 Q949	V857-Y867 HydrophobicContact CG1-CE1 3.9Å; V857-Y867 HydrophobicContact CG1-CE2 3.9Å; V857-Y867 VanDerWaalsContact CG1-CZ 3.48Å; V857-Y867 WeakPolarHBondContact CG1-OH 3.13Å; V857-Y867 HydrophobicContact CG2-CE1 4.21Å; T859-Y867 HydrophobicContact CG2-CD2 3.65Å; T859-Y867 HydrophobicContact CG2-CE2 3.84Å; T859-Y867 HydrophobicContact CG2-CG 4.46Å; L861-Y867 HydrophobicContact CD1-CD2 4.13Å; D863-Y867 PolarHBondContact O-N 3.01Å; R865-Y867 PolarHBondContact O-N 2.98Å; Y867-Y870 PolarHBondContact O-N 3.04Å; Y867-L871 HydrophobicContact CE1-CD1 4.13Å; Y867-L871 WeakPolarHBondContact O-CB 3.44Å; Y867-L871 PolarHBondContact O-N 3.44Å; Y867-L911 HydrophobicContact CD1-CD1 4.46Å; Y867-L911 HydrophobicContact CE1-CD1 3.89Å; Y867-I913 HydrophobicContact CD1-CD1 3.88Å; Y867-I913 HydrophobicContact CD1-CG2 4.48Å; Y867-I913 HydrophobicContact CE1-CG2 4.31Å; Y867-Q949 PolarHBondContact OH-NE2 2.88Å
868	L	86.5	Confident	83.1	Confident	10 Å²	10	53.3 Å²	53.3	5%	0.052	27%	0.269	C	S	.	.	H	α-helix	trans	-61.7	-48.9	176.7	172.2	64.5	0	0	0	111.5	L864 R865 Y870 L871 V872 L886 L893 A895 L897 L911	L864-L868 PolarHBondContact O-N 3.33Å; L864-L868 VanDerWaalsContact O-N 3.13Å; R865-L868 PolarHBondContact O-N 3.47Å; R865-L868 VanDerWaalsContact O-N 3.08Å; L868-Y870 VanDerWaalsContact C-N 3.31Å; L868-Y870 PolarHBondContact O-N 3.07Å; L868-L871 PolarHBondContact O-N 3.37Å; L868-V872 HydrophobicContact CD1-CG2 4.06Å; L868-V872 HydrophobicContact CG-CG2 4.5Å; L868-V872 WeakPolarHBondContact O-CB 3.24Å; L868-V872 WeakPolarHBondContact O-CG2 3.27Å; L868-V872 PolarHBondContact O-N 3.3Å; L868-L886 HydrophobicContact CD2-CD1 3.8Å; L868-L886 HydrophobicContact CD2-CD2 4.19Å; L868-L893 HydrophobicContact CD2-CD2 4.31Å; L868-A895 HydrophobicContact CD1-CB 3.97Å; L868-A895 HydrophobicContact CD2-CB 4.24Å; L868-L897 HydrophobicContact CD1-CD2 4.09Å; L868-L911 HydrophobicContact CB-CD2 4.23Å; L868-L911 HydrophobicContact CD1-CD2 3.58Å; L868-L911 HydrophobicContact CG-CD2 4.45Å
869	S	85.8	Confident	83.5	Confident	78 Å²	78	48.4 Å²	48.4	55%	0.545	25%	0.247	S	C	.	.	H	α-helix	trans	-62.8	-39.7	178.4	-62.5	0	0	0	0	111.8	R865 E866 K873	R865-S869 PolarHBondContact O-N 3.46Å; R865-S869 PolarHBondContact O-OG 3.24Å; E866-S869 PolarHBondContact O-N 3.19Å; S869-K873 WeakPolarHBondContact O-CB 3.48Å; S869-K873 PolarHBondContact O-N 3.31Å
870	Y	84.6	Confident	83.7	Confident	32 Å²	32	48.8 Å²	48.8	13%	0.125	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-46.3	174	-178.5	-100.4	0	0	0	111.3	E866 Y867 L868 K873 H874 V948 H952	E866-Y870 WeakPolarHBondContact O-CB 3.32Å; E866-Y870 PolarHBondContact O-N 3.11Å; Y867-Y870 PolarHBondContact O-N 3.04Å; L868-Y870 VanDerWaalsContact C-N 3.31Å; L868-Y870 PolarHBondContact O-N 3.07Å; Y870-K873 PolarHBondContact O-N 3.47Å; Y870-H874 AromaticContact CD2-CE1 3.54Å; Y870-H874 AromaticContact CD2-ND1 3.77Å; Y870-H874 AromaticContact CE2-CE1 3.16Å; Y870-H874 WeakPolarHBondContact CE2-CE1 3.41Å; Y870-H874 AromaticContact CE2-ND1 3.66Å; Y870-H874 AromaticContact CZ-CE1 3.58Å; Y870-H874 AromaticContact CZ-ND1 3.81Å; Y870-H874 PolarHBondContact O-N 2.79Å; Y870-H874 PolarHBondContact O-ND1 2.91Å; Y870-V948 HydrophobicContact CD1-CG1 4.17Å; Y870-V948 HydrophobicContact CE1-CG1 3.39Å; Y870-V948 PolarHBondContact OH-O 3.03Å; Y870-H952 HydrophobicContact CE1-CB 4.21Å; Y870-H952 AromaticContact CE2-CD2 3.94Å; Y870-H952 AromaticContact CZ-CD2 3.87Å
871	L	86.9	Confident	83.9	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-49.7	179.2	-172	139	0	0	0	111.6	Y867 L868 K873 H874 T875 L897 I928 I945	Y867-L871 HydrophobicContact CE1-CD1 4.13Å; Y867-L871 WeakPolarHBondContact O-CB 3.44Å; Y867-L871 PolarHBondContact O-N 3.44Å; L868-L871 PolarHBondContact O-N 3.37Å; L871-K873 VanDerWaalsContact C-N 3.26Å; L871-K873 PolarHBondContact O-N 3.05Å; L871-H874 PolarHBondContact O-N 3.28Å; L871-H874 VanDerWaalsContact O-N 3.08Å; L871-T875 HydrophobicContact CD2-CG2 4.11Å; L871-T875 HydrophobicContact CG-CG2 4.03Å; L871-T875 WeakPolarHBondContact O-CG2 3.42Å; L871-T875 PolarHBondContact O-N 2.98Å; L871-T875 PolarHBondContact O-OG1 3.41Å; L871-L897 HydrophobicContact CD2-CD1 3.25Å; L871-I928 HydrophobicContact CD1-CD1 3.4Å; L871-I928 HydrophobicContact CD1-CG1 4.39Å; L871-I945 HydrophobicContact CD1-CG2 4.3Å
872	V	86.5	Confident	83.7	Confident	43 Å²	43	47.1 Å²	47.1	26%	0.261	24%	0.241	S	C	.	.	H	α-helix	trans	-53.5	-43.4	177.3	160.9	0	0	0	0	111.7	L868 H874 N876 M877 C879 L897	L868-V872 HydrophobicContact CD1-CG2 4.06Å; L868-V872 HydrophobicContact CG-CG2 4.5Å; L868-V872 WeakPolarHBondContact O-CB 3.24Å; L868-V872 WeakPolarHBondContact O-CG2 3.27Å; L868-V872 PolarHBondContact O-N 3.3Å; V872-H874 PolarHBondContact O-N 2.98Å; V872-N876 PolarHBondContact O-N 3.28Å; V872-M877 WeakPolarHBondContact CG1-O 3.42Å; V872-C879 HydrophobicContact CG2-CB 4.29Å; V872-L897 HydrophobicContact CG2-CD2 3.84Å
873	K	82.8	Confident	83.3	Confident	158 Å²	158	51.4 Å²	51.4	69%	0.687	26%	0.26	S	S	*	.	H	α-helix	trans	-64.8	-37.2	179.1	-172.8	-177.9	177.4	-170.8	0	112.9	S869 Y870 L871	S869-K873 WeakPolarHBondContact O-CB 3.48Å; S869-K873 PolarHBondContact O-N 3.31Å; Y870-K873 PolarHBondContact O-N 3.47Å; L871-K873 VanDerWaalsContact C-N 3.26Å; L871-K873 PolarHBondContact O-N 3.05Å
874	H	82.8	Confident	82.7	Confident	59 Å²	59	53.5 Å²	53.5	27%	0.273	27%	0.267	S	S	.	.	H	α-helix	trans	-93.4	-18.4	-175.2	-69.2	88.8	0	0	0	114.3	Y870 L871 V872 V948	Y870-H874 AromaticContact CD2-CE1 3.54Å; Y870-H874 AromaticContact CD2-ND1 3.77Å; Y870-H874 AromaticContact CE2-CE1 3.16Å; Y870-H874 WeakPolarHBondContact CE2-CE1 3.41Å; Y870-H874 AromaticContact CE2-ND1 3.66Å; Y870-H874 AromaticContact CZ-CE1 3.58Å; Y870-H874 AromaticContact CZ-ND1 3.81Å; Y870-H874 PolarHBondContact O-N 2.79Å; Y870-H874 PolarHBondContact O-ND1 2.91Å; L871-H874 PolarHBondContact O-N 3.28Å; L871-H874 VanDerWaalsContact O-N 3.08Å; V872-H874 PolarHBondContact O-N 2.98Å; H874-V948 HydrophobicContact CB-CG1 3.81Å; H874-V948 HydrophobicContact CB-CG2 3.9Å
875	T	82.3	Confident	82	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-100.6	2.7	177.9	64.8	0	0	0	0	113.4	M829 L871 M877 I945	M829-T875 WeakPolarHBondContact CE-O 3.19Å; L871-T875 HydrophobicContact CD2-CG2 4.11Å; L871-T875 HydrophobicContact CG-CG2 4.03Å; L871-T875 WeakPolarHBondContact O-CG2 3.42Å; L871-T875 PolarHBondContact O-N 2.98Å; L871-T875 PolarHBondContact O-OG1 3.41Å; T875-M877 WeakPolarHBondContact O-CG 3.45Å; T875-M877 PolarHBondContact O-N 3.29Å; T875-I945 HydrophobicContact CG2-CD1 4.16Å; T875-I945 HydrophobicContact CG2-CG1 3.68Å
876	N	82.4	Confident	81.3	Confident	67 Å²	67	53.1 Å²	53.1	36%	0.358	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.4	28.2	-175.9	-66.7	-21.6	0	0	0	113.2	M829 I832 P834 V872	M829-N876 HydrophobicContact CE-CB 3.71Å; M829-N876 PolarHBondContact O-ND2 3.08Å; I832-N876 HydrophobicContact CG2-CB 4.49Å; P834-N876 WeakPolarHBondContact CA-O 3.3Å; P834-N876 WeakPolarHBondContact CB-O 3.4Å; V872-N876 PolarHBondContact O-N 3.28Å
877	M	86.1	Confident	80.5	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.01	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-101	141	179.9	-70.9	-174.4	164.7	0	0	109.7	V872 T875 L897 A899 A907 A909 L941	V872-M877 WeakPolarHBondContact CG1-O 3.42Å; T875-M877 WeakPolarHBondContact O-CG 3.45Å; T875-M877 PolarHBondContact O-N 3.29Å; M877-L897 HydrophobicContact CB-CB 4.06Å; M877-L897 HydrophobicContact SD-CB 4.06Å; M877-A899 HydrophobicContact CB-CB 4.39Å; M877-A899 HydrophobicContact CG-CB 3.75Å; M877-A907 HydrophobicContact CE-CB 4.06Å; M877-A909 HydrophobicContact CE-CB 4.4Å; M877-A909 HydrophobicContact SD-CB 3.85Å; M877-L941 HydrophobicContact CE-CD1 3.59Å; M877-L941 HydrophobicContact CE-CD2 3.87Å; M877-L941 HydrophobicContact CE-CG 4.34Å
878	R	84.3	Confident	79.5	Confident	60 Å²	60	52.8 Å²	52.8	23%	0.226	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	136.4	175.6	-167.1	160.9	-179.3	170	-0.8	110.4	P834 L836 L897 Y898	P834-R878 HydrophobicContact CB-CB 4.02Å; L836-R878 HydrophobicContact CD2-CG 4.23Å; R878-L897 CarbonylContact O-C 3.54Å; R878-L897 VanDerWaalsContact O-CA 3.26Å; R878-L897 WeakPolarHBondContact O-CA 3.43Å; R878-Y898 PolarHBondContact N-O 3.2Å; R878-Y898 PolarHBondContact O-N 3Å
879	C	86.8	Confident	78.4	Confident	35 Å²	35	62 Å²	62	24%	0.236	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	124.5	169.4	-171.5	0	0	0	0	110	V872 L897	V872-C879 HydrophobicContact CG2-CB 4.29Å; C879-L897 HydrophobicContact CB-CD2 3.77Å
880	L	83	Confident	77.5	Confident	21 Å²	21	60.6 Å²	60.6	11%	0.11	33%	0.326	C	S	.	.			trans	-91.2	-21.6	176.5	-58.7	-179	0	0	0	112	L836 C837 F842 P882 N896	L836-L880 HydrophobicContact CD2-CD2 4.02Å; C837-L880 VanDerWaalsContact SG-CD1 3.56Å; F842-L880 HydrophobicContact CB-CD1 4.3Å; F842-L880 HydrophobicContact CD2-CD1 3.51Å; F842-L880 HydrophobicContact CE2-CD1 4.19Å; F842-L880 HydrophobicContact CG-CD1 4.17Å; L880-P882 WeakPolarHBondContact O-CD 3.32Å; L880-N896 HydrophobicContact CB-CB 4.35Å; L880-N896 PolarHBondContact N-O 3.11Å
881	T	82.4	Confident	77.1	Confident	20 Å²	20	61.2 Å²	61.2	12%	0.123	34%	0.342	C	S	.	.	S	Bend	trans	-73.3	124.9	-179.2	-56.5	0	0	0	0	110.3	V885 L886 A895 N896	T881-V885 HydrophobicContact CG2-CB 4.06Å; T881-V885 HydrophobicContact CG2-CG1 4.18Å; T881-L886 HydrophobicContact CG2-CD2 3.88Å; T881-L886 HydrophobicContact CG2-CG 4.03Å; T881-A895 WeakPolarHBondContact OG1-CA 3.24Å; T881-N896 PolarHBondContact OG1-N 3.48Å
882	P	74.3	Confident	77	Confident	52 Å²	52	67.2 Å²	67.2	34%	0.338	37%	0.369	S	S	.	.			trans	-61.6	145.1	179.7	-23	32.8	0	0	0	112.9	L880 E884 V885 L886	L880-P882 WeakPolarHBondContact O-CD 3.32Å; P882-E884 PolarHBondContact O-N 2.87Å; P882-E884 VanDerWaalsContact O-N 3.16Å; P882-V885 PolarHBondContact O-N 3.11Å; P882-L886 PolarHBondContact O-N 3.11Å
883	D	72.2	Confident	76.9	Confident	135 Å²	135	65.8 Å²	65.8	72%	0.722	36%	0.359	S	S	*	.	H	α-helix	trans	-58.6	-29.5	178.8	-78	-15.8	0	0	0	112.9	V885 L886 S887	D883-V885 VanDerWaalsContact C-N 3.28Å; D883-V885 PolarHBondContact O-N 3.11Å; D883-L886 CarbonylContact O-C 3.59Å; D883-L886 PolarHBondContact O-N 3.36Å; D883-L886 VanDerWaalsContact O-N 3.13Å; D883-S887 VanDerWaalsContact O-CB 3.31Å; D883-S887 WeakPolarHBondContact O-CB 3.3Å; D883-S887 PolarHBondContact O-N 3.15Å
884	E	68.1	Low	77.2	Confident	113 Å²	113	60.8 Å²	60.8	53%	0.528	35%	0.348	S	S	.	.	H	α-helix	trans	-57	-41.5	175	-64.3	175.2	177.9	0	0	111.9	P882 S887	P882-E884 PolarHBondContact O-N 2.87Å; P882-E884 VanDerWaalsContact O-N 3.16Å; E884-S887 PolarHBondContact O-N 2.82Å; E884-S887 PolarHBondContact O-OG 3.13Å
885	V	70.4	Confident	77.5	Confident	102 Å²	102	58 Å²	58	62%	0.618	34%	0.335	S	S	*	.	H	α-helix	trans	-74.7	-33.3	178.5	-177.1	0	0	0	0	110.8	T881 P882 D883 S887	T881-V885 HydrophobicContact CG2-CB 4.06Å; T881-V885 HydrophobicContact CG2-CG1 4.18Å; P882-V885 PolarHBondContact O-N 3.11Å; D883-V885 VanDerWaalsContact C-N 3.28Å; D883-V885 PolarHBondContact O-N 3.11Å; V885-S887 VanDerWaalsContact C-N 3.29Å
886	L	69.6	Low	78	Confident	14 Å²	14	59.6 Å²	59.6	7%	0.073	34%	0.343	C	S	.	.	H	α-helix	trans	-77.6	-15.6	177.6	-57.9	172.9	0	0	0	112.8	R865 L868 T881 P882 D883 G888 L893 A895	R865-L886 PolarHBondContact NE-O 3.12Å; R865-L886 PolarHBondContact NH2-O 3.27Å; L868-L886 HydrophobicContact CD2-CD1 3.8Å; L868-L886 HydrophobicContact CD2-CD2 4.19Å; T881-L886 HydrophobicContact CG2-CD2 3.88Å; T881-L886 HydrophobicContact CG2-CG 4.03Å; P882-L886 PolarHBondContact O-N 3.11Å; D883-L886 CarbonylContact O-C 3.59Å; D883-L886 PolarHBondContact O-N 3.36Å; D883-L886 VanDerWaalsContact O-N 3.13Å; L886-G888 VanDerWaalsContact C-N 3.3Å; L886-G888 PolarHBondContact O-N 2.86Å; L886-L893 HydrophobicContact CD2-CD1 4.01Å; L886-L893 HydrophobicContact CD2-CD2 4.11Å; L886-L893 HydrophobicContact CD2-CG 3.92Å; L886-A895 HydrophobicContact CD2-CB 4.23Å
887	S	66	Low	78.4	Confident	63 Å²	63	56.4 Å²	56.4	44%	0.441	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-16.7	-175.6	75.4	0	0	0	0	114.1	R865 D883 E884 V885	R865-S887 VanDerWaalsContact NH2-C 3.26Å; R865-S887 VanDerWaalsContact NH2-CA 3.33Å; R865-S887 PolarHBondContact NH2-O 3.19Å; D883-S887 VanDerWaalsContact O-CB 3.31Å; D883-S887 WeakPolarHBondContact O-CB 3.3Å; D883-S887 PolarHBondContact O-N 3.15Å; E884-S887 PolarHBondContact O-N 2.82Å; E884-S887 PolarHBondContact O-OG 3.13Å; V885-S887 VanDerWaalsContact C-N 3.29Å
888	G	65.8	Low	78.6	Confident	40 Å²	40	56.4 Å²	56.4	41%	0.412	33%	0.326	S	S	.	.	S	Bend	trans	-64.1	136.9	-178.7	0	0	0	0	0	113.1	L886 S890	L886-G888 VanDerWaalsContact C-N 3.3Å; L886-G888 PolarHBondContact O-N 2.86Å; G888-S890 PolarHBondContact O-N 2.68Å
889	E	64.4	Low	78.8	Confident	203 Å²	203	53.6 Å²	53.6	95%	0.949	32%	0.316	S	S	*	.			trans	-77.2	42.9	169.7	-67.5	-172.3	162.2	0	0	111.9
890	S	66.1	Low	78.7	Confident	48 Å²	48	56.6 Å²	56.6	34%	0.336	32%	0.322	S	S	.	.			trans	-78.8	138.8	169.4	47.1	0	0	0	0	109.4	G888 F892	G888-S890 PolarHBondContact O-N 2.68Å; S890-F892 PolarHBondContact O-N 3.01Å; S890-F892 PolarHBondContact OG-O 3.31Å
891	G	76.5	Confident	78.6	Confident	45 Å²	45	55.9 Å²	55.9	46%	0.464	32%	0.318	S	S	.	.	S	Bend	trans	-63.6	5.2	173.4	0	0	0	0	0	114.8	E914 K915	G891-E914 CarbonylContact O-C 3.49Å; G891-E914 VanDerWaalsContact O-CA 3.28Å; G891-E914 WeakPolarHBondContact O-CA 3.33Å; G891-E914 WeakPolarHBondContact O-CB 3.41Å; G891-K915 PolarHBondContact O-N 2.69Å
892	F	83.9	Confident	78.1	Confident	130 Å²	130	57.4 Å²	57.4	57%	0.57	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.3	150.4	176.9	67.3	-89.9	0	0	0	110.3	S890 I913 E914	S890-F892 PolarHBondContact O-N 3.01Å; S890-F892 PolarHBondContact OG-O 3.31Å; F892-I913 CarbonylContact C-O 3.57Å; F892-I913 VanDerWaalsContact CA-O 3.3Å; F892-I913 WeakPolarHBondContact CA-O 3.22Å; F892-E914 HydrophobicContact CB-CB 4.08Å
893	L	85.6	Confident	78	Confident	13 Å²	13	57.4 Å²	57.4	7%	0.068	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	131.8	176.4	-179.7	153.6	0	0	0	109.3	L864 R865 L868 L886 A895 L911 I913	L864-L893 HydrophobicContact CB-CB 4.15Å; L864-L893 HydrophobicContact CB-CD1 4.07Å; L864-L893 HydrophobicContact CD1-CB 4.1Å; R865-L893 HydrophobicContact CG-CD1 4.38Å; L868-L893 HydrophobicContact CD2-CD2 4.31Å; L886-L893 HydrophobicContact CD2-CD1 4.01Å; L886-L893 HydrophobicContact CD2-CD2 4.11Å; L886-L893 HydrophobicContact CD2-CG 3.92Å; L893-A895 HydrophobicContact CD2-CB 4.07Å; L893-L911 HydrophobicContact CD2-CD2 4.01Å; L893-I913 HydrophobicContact CB-CD1 4.32Å; L893-I913 HydrophobicContact CB-CG1 3.95Å; L893-I913 HydrophobicContact CD2-CD1 4.02Å; L893-I913 HydrophobicContact CD2-CG1 4.02Å; L893-I913 PolarHBondContact N-O 2.8Å; L893-I913 WeakPolarHBondContact O-CG1 3.33Å; L893-I913 PolarHBondContact O-N 3.26Å
894	A	88.4	Confident	78.1	Confident	53 Å²	53	53.2 Å²	53.2	44%	0.438	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.4	172.8	0	0	0	0	0	109.8	L911	A894-L911 CarbonylContact C-O 3.57Å; A894-L911 WeakPolarHBondContact CA-O 3.45Å
895	A	89.6	Confident	78.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	142.1	-178.7	0	0	0	0	0	111.8	L868 T881 L886 L893 L911	L868-A895 HydrophobicContact CD1-CB 3.97Å; L868-A895 HydrophobicContact CD2-CB 4.24Å; T881-A895 WeakPolarHBondContact OG1-CA 3.24Å; L886-A895 HydrophobicContact CD2-CB 4.23Å; L893-A895 HydrophobicContact CD2-CB 4.07Å; A895-L911 HydrophobicContact CB-CB 4.32Å; A895-L911 HydrophobicContact CB-CD2 4.36Å; A895-L911 PolarHBondContact N-O 2.94Å; A895-L911 PolarHBondContact O-N 2.94Å
896	N	92	Very high	79.6	Confident	36 Å²	36	47.4 Å²	47.4	19%	0.193	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	134.3	173	-67.3	-29.5	0	0	0	109.6	F842 L880 T881 N910	F842-N896 HydrophobicContact CD2-CB 4.47Å; F842-N896 HydrophobicContact CE1-CB 4.07Å; F842-N896 HydrophobicContact CE2-CB 3.97Å; F842-N896 HydrophobicContact CZ-CB 3.75Å; L880-N896 HydrophobicContact CB-CB 4.35Å; L880-N896 PolarHBondContact N-O 3.11Å; T881-N896 PolarHBondContact OG1-N 3.48Å; N896-N910 PolarHBondContact OD1-ND2 2.99Å
897	L	90.9	Very high	80.5	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	145.6	-177.9	-53.6	176.7	0	0	0	110	L868 L871 V872 M877 R878 C879 A909	L868-L897 HydrophobicContact CD1-CD2 4.09Å; L871-L897 HydrophobicContact CD2-CD1 3.25Å; V872-L897 HydrophobicContact CG2-CD2 3.84Å; M877-L897 HydrophobicContact CB-CB 4.06Å; M877-L897 HydrophobicContact SD-CB 4.06Å; R878-L897 CarbonylContact O-C 3.54Å; R878-L897 VanDerWaalsContact O-CA 3.26Å; R878-L897 WeakPolarHBondContact O-CA 3.43Å; C879-L897 HydrophobicContact CB-CD2 3.77Å; L897-A909 HydrophobicContact CB-CB 4.14Å; L897-A909 HydrophobicContact CD1-CB 4.42Å; L897-A909 PolarHBondContact N-O 3.45Å; L897-A909 PolarHBondContact O-N 3.35Å
898	Y	90.6	Very high	81.8	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.008	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	141.6	-179.2	174.9	-128.2	0	0	0	112.4	V835 C837 M845 R878 R900 D906 A907 L908	V835-Y898 HydrophobicContact CB-CD1 4.19Å; V835-Y898 HydrophobicContact CB-CE1 3.75Å; V835-Y898 HydrophobicContact CG1-CE1 3.78Å; V835-Y898 WeakPolarHBondContact O-CD1 3.4Å; C837-Y898 HydrophobicContact CB-CD1 3.84Å; C837-Y898 HydrophobicContact CB-CE1 3.64Å; M845-Y898 HydrophobicContact CE-CE2 4.16Å; R878-Y898 PolarHBondContact N-O 3.2Å; R878-Y898 PolarHBondContact O-N 3Å; Y898-R900 PolarHBondContact OH-NH2 3.35Å; Y898-D906 HydrophobicContact CE2-CB 4.07Å; Y898-D906 PolarHBondContact OH-OD1 3.32Å; Y898-A907 WeakPolarHBondContact CD2-O 3.32Å; Y898-L908 HydrophobicContact CD2-CD2 3.4Å; Y898-L908 VanDerWaalsContact CD2-CD2 3.4Å; Y898-L908 HydrophobicContact CE2-CD2 3.99Å; Y898-L908 HydrophobicContact CG-CD2 4.15Å
899	A	88.3	Confident	83.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	163.4	170.6	0	0	0	0	0	111.5	I832 T833 M877 A907	I832-A899 HydrophobicContact CG2-CB 3.42Å; I832-A899 VanDerWaalsContact CG2-CB 3.42Å; T833-A899 WeakPolarHBondContact O-CA 3.39Å; T833-A899 WeakPolarHBondContact O-CB 3.24Å; M877-A899 HydrophobicContact CB-CB 4.39Å; M877-A899 HydrophobicContact CG-CB 3.75Å; A899-A907 PolarHBondContact N-O 3.27Å; A899-A907 PolarHBondContact O-N 3.37Å
900	R	83.9	Confident	84.4	Confident	99 Å²	99	33.9 Å²	33.9	37%	0.374	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136.2	175.3	-175.6	176.1	-71.4	174.8	-7.2	109.8	T833 V835 Y898 E905 D906	T833-R900 PolarHBondContact N-O 3.35Å; T833-R900 PolarHBondContact O-N 2.93Å; T833-R900 PolarHBondContact OG1-O 2.87Å; V835-R900 HydrophobicContact CB-CB 4.4Å; V835-R900 HydrophobicContact CG2-CB 3.69Å; Y898-R900 PolarHBondContact OH-NH2 3.35Å; R900-E905 WeakPolarHBondContact CA-O 3.38Å; R900-D906 IonicContact CZ-OD1 2.67Å; R900-D906 VanDerWaalsContact CZ-OD1 3.25Å; R900-D906 IonicContact NE-OD1 3.25Å; R900-D906 PolarHBondContact NE-OD1 3.35Å; R900-D906 IonicContact NH2-OD1 3.98Å; R900-D906 PolarHBondContact NH2-OD1 2.95Å; R900-D906 IonicContact NH2-OD2 3.56Å
901	S	80.9	Confident	85.7	Confident	5 Å²	5	31.6 Å²	31.6	4%	0.035	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	156.8	172.5	66.6	0	0	0	0	111.6	Y831 F903 G904 E905	Y831-S901 CarbonylContact O-C 3.5Å; Y831-S901 VanDerWaalsContact O-CA 3.25Å; Y831-S901 WeakPolarHBondContact O-CA 3.31Å; S901-F903 PolarHBondContact O-N 3.49Å; S901-F903 VanDerWaalsContact O-N 3.12Å; S901-F903 PolarHBondContact OG-N 3.34Å; S901-G904 PolarHBondContact O-N 3.05Å; S901-E905 PolarHBondContact N-O 3.04Å; S901-E905 WeakPolarHBondContact OG-CB 3.39Å; S901-E905 PolarHBondContact OG-N 3.15Å; S901-E905 PolarHBondContact OG-O 2.93Å
902	V	73.5	Confident	86.4	Confident	53 Å²	53	31.1 Å²	31.1	32%	0.321	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-19	171.1	-65.9	0	0	0	0	113.1	Y831 T833 G904	Y831-V902 HydrophobicContact CD1-CG2 3.66Å; Y831-V902 HydrophobicContact CG-CG2 4.25Å; Y831-V902 PolarHBondContact O-N 2.85Å; T833-V902 HydrophobicContact CG2-CG1 4.45Å; V902-G904 PolarHBondContact O-N 3.37Å
903	F	72.2	Confident	86.7	Confident	52 Å²	52	25.1 Å²	25.1	23%	0.228	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-1.6	173.7	-52	-74.8	0	0	0	113.2	N738 Y739 V793 T796 Y831 S901	N738-F903 WeakPolarHBondContact O-CE1 3.22Å; Y739-F903 HydrophobicContact CD1-CD1 4.12Å; Y739-F903 AromaticContact CD1-CE1 3.8Å; Y739-F903 HydrophobicContact CD1-CE1 3.8Å; Y739-F903 AromaticContact CE1-CD1 3.85Å; Y739-F903 HydrophobicContact CE1-CD1 3.85Å; Y739-F903 AromaticContact CE1-CE1 4Å; Y739-F903 HydrophobicContact CE1-CE1 4Å; V793-F903 HydrophobicContact CB-CZ 4.35Å; V793-F903 HydrophobicContact CG1-CZ 3.85Å; T796-F903 HydrophobicContact CG2-CB 4.32Å; T796-F903 HydrophobicContact CG2-CD2 3.49Å; T796-F903 VanDerWaalsContact CG2-CD2 3.49Å; T796-F903 HydrophobicContact CG2-CE2 4.15Å; T796-F903 HydrophobicContact CG2-CG 4.19Å; Y831-F903 HydrophobicContact CD1-CE2 4.01Å; Y831-F903 HydrophobicContact CD1-CZ 4.08Å; Y831-F903 HydrophobicContact CD2-CE2 4.49Å; Y831-F903 HydrophobicContact CE1-CZ 4.3Å; Y831-F903 AromaticContact CG-CE2 3.92Å; Y831-F903 HydrophobicContact CG-CE2 3.92Å; Y831-F903 HydrophobicContact CG-CZ 4.39Å; S901-F903 PolarHBondContact O-N 3.49Å; S901-F903 VanDerWaalsContact O-N 3.12Å; S901-F903 PolarHBondContact OG-N 3.34Å
904	G	74.5	Confident	86.8	Confident	47 Å²	47	29.8 Å²	29.8	49%	0.485	17%	0.167	S	C	.	.	S	Bend	trans	82.8	9.5	179.7	0	0	0	0	0	114.7	S901 V902	S901-G904 PolarHBondContact O-N 3.05Å; V902-G904 PolarHBondContact O-N 3.37Å
905	E	80.9	Confident	86.5	Confident	59 Å²	59	30.4 Å²	30.4	28%	0.276	16%	0.16	S	C	.	.			trans	-82.9	131.5	173.1	-56	-168.2	160	0	0	111.5	T796 R900 S901 S934 M937	T796-E905 WeakPolarHBondContact CB-OE2 3.21Å; T796-E905 HydrophobicContact CG2-CG 4.33Å; T796-E905 VanDerWaalsContact CG2-OE2 3.31Å; T796-E905 WeakPolarHBondContact CG2-OE2 3.43Å; T796-E905 PolarHBondContact OG1-OE2 3.38Å; R900-E905 WeakPolarHBondContact CA-O 3.38Å; S901-E905 PolarHBondContact N-O 3.04Å; S901-E905 WeakPolarHBondContact OG-CB 3.39Å; S901-E905 PolarHBondContact OG-N 3.15Å; S901-E905 PolarHBondContact OG-O 2.93Å; E905-S934 PolarHBondContact OE2-OG 3.47Å; E905-M937 HydrophobicContact CB-CE 4.2Å
906	D	88.1	Confident	85.7	Confident	33 Å²	33	33 Å²	33	18%	0.176	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	137.2	179.5	-64.6	-48	0	0	0	111.6	M845 F849 Y898 R900	M845-D906 HydrophobicContact SD-CB 4.49Å; F849-D906 HydrophobicContact CE2-CB 4.04Å; F849-D906 HydrophobicContact CZ-CB 3.62Å; Y898-D906 HydrophobicContact CE2-CB 4.07Å; Y898-D906 PolarHBondContact OH-OD1 3.32Å; R900-D906 IonicContact CZ-OD1 2.67Å; R900-D906 VanDerWaalsContact CZ-OD1 3.25Å; R900-D906 IonicContact NE-OD1 3.25Å; R900-D906 PolarHBondContact NE-OD1 3.35Å; R900-D906 IonicContact NH2-OD1 3.98Å; R900-D906 PolarHBondContact NH2-OD1 2.95Å; R900-D906 IonicContact NH2-OD2 3.56Å
907	A	89.5	Confident	84.8	Confident	2 Å²	2	34.9 Å²	34.9	2%	0.017	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	124	176.6	0	0	0	0	0	111	M877 Y898 A899 M937 L941	M877-A907 HydrophobicContact CE-CB 4.06Å; Y898-A907 WeakPolarHBondContact CD2-O 3.32Å; A899-A907 PolarHBondContact N-O 3.27Å; A899-A907 PolarHBondContact O-N 3.37Å; A907-M937 HydrophobicContact CB-CG 4.05Å; A907-L941 HydrophobicContact CB-CD1 3.52Å
908	L	92.5	Very high	83.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	141.7	179.7	-54.6	168.5	0	0	0	109.4	F842 M845 W846 F849 Y898 I930 R931	F842-L908 HydrophobicContact CD2-CD2 3.48Å; F842-L908 VanDerWaalsContact CD2-CD2 3.48Å; F842-L908 HydrophobicContact CD2-CG 4.42Å; F842-L908 HydrophobicContact CE2-CB 3.86Å; F842-L908 HydrophobicContact CE2-CD2 3.58Å; F842-L908 HydrophobicContact CE2-CG 4.16Å; F842-L908 HydrophobicContact CG-CD2 4.42Å; F842-L908 HydrophobicContact CZ-CB 4.27Å; M845-L908 HydrophobicContact CB-CD1 3.69Å; M845-L908 HydrophobicContact CE-CD2 3.91Å; W846-L908 HydrophobicContact CB-CD1 4.18Å; W846-L908 HydrophobicContact CE3-CB 3.78Å; W846-L908 HydrophobicContact CE3-CD1 3.99Å; W846-L908 HydrophobicContact CZ3-CB 3.87Å; F849-L908 HydrophobicContact CD2-CD1 3.62Å; F849-L908 HydrophobicContact CD2-CG 4.08Å; F849-L908 HydrophobicContact CE2-CD1 3.51Å; F849-L908 HydrophobicContact CE2-CG 3.68Å; F849-L908 HydrophobicContact CZ-CD1 4.33Å; Y898-L908 HydrophobicContact CD2-CD2 3.4Å; Y898-L908 VanDerWaalsContact CD2-CD2 3.4Å; Y898-L908 HydrophobicContact CE2-CD2 3.99Å; Y898-L908 HydrophobicContact CG-CD2 4.15Å; L908-I930 CarbonylContact O-C 3.29Å; L908-I930 VanDerWaalsContact O-CA 3.32Å; L908-I930 WeakPolarHBondContact O-CA 3.46Å; L908-R931 PolarHBondContact N-O 3.15Å; L908-R931 PolarHBondContact O-N 3.47Å
909	A	92.4	Very high	82.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	138.6	168.1	0	0	0	0	0	111.6	M877 L897 I928 R929 I930	M877-A909 HydrophobicContact CE-CB 4.4Å; M877-A909 HydrophobicContact SD-CB 3.85Å; L897-A909 HydrophobicContact CB-CB 4.14Å; L897-A909 HydrophobicContact CD1-CB 4.42Å; L897-A909 PolarHBondContact N-O 3.45Å; L897-A909 PolarHBondContact O-N 3.35Å; A909-I928 HydrophobicContact CB-CG2 4.33Å; A909-R929 CarbonylContact C-O 3.19Å; A909-R929 VanDerWaalsContact CA-O 3.25Å; A909-R929 WeakPolarHBondContact CA-O 3.27Å; A909-I930 HydrophobicContact CB-CG1 4.29Å
910	N	93.1	Very high	81.5	Confident	35 Å²	35	53.6 Å²	53.6	19%	0.187	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	116.6	171.2	178.2	-91.9	0	0	0	108.5	W846 N896 S912 I928 R929	W846-N910 HydrophobicContact CH2-CB 3.49Å; W846-N910 VanDerWaalsContact CH2-CB 3.49Å; W846-N910 HydrophobicContact CZ2-CB 4.06Å; W846-N910 HydrophobicContact CZ3-CB 3.99Å; N896-N910 PolarHBondContact OD1-ND2 2.99Å; N910-S912 PolarHBondContact OD1-OG 3.16Å; N910-I928 CarbonylContact O-C 3.58Å; N910-I928 WeakPolarHBondContact O-CA 3.46Å; N910-R929 PolarHBondContact N-O 2.85Å; N910-R929 PolarHBondContact O-N 3.35Å
911	L	92.1	Very high	80.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	126	175.5	177.2	69	0	0	0	108.7	Y867 L868 L893 A894 A895 I913 I928	Y867-L911 HydrophobicContact CD1-CD1 4.46Å; Y867-L911 HydrophobicContact CE1-CD1 3.89Å; L868-L911 HydrophobicContact CB-CD2 4.23Å; L868-L911 HydrophobicContact CD1-CD2 3.58Å; L868-L911 HydrophobicContact CG-CD2 4.45Å; L893-L911 HydrophobicContact CD2-CD2 4.01Å; A894-L911 CarbonylContact C-O 3.57Å; A894-L911 WeakPolarHBondContact CA-O 3.45Å; A895-L911 HydrophobicContact CB-CB 4.32Å; A895-L911 HydrophobicContact CB-CD2 4.36Å; A895-L911 PolarHBondContact N-O 2.94Å; A895-L911 PolarHBondContact O-N 2.94Å; L911-I913 HydrophobicContact CD1-CG1 4.47Å; L911-I913 HydrophobicContact CD1-CG2 3.54Å; L911-I913 HydrophobicContact CD2-CD1 4.02Å; L911-I913 HydrophobicContact CD2-CG1 4.33Å; L911-I913 HydrophobicContact CG-CD1 4.37Å; L911-I913 HydrophobicContact CG-CG1 4.2Å; L911-I913 HydrophobicContact CG-CG2 4.13Å; L911-I928 HydrophobicContact CD1-CD1 4.06Å; L911-I928 HydrophobicContact CD1-CG1 3.43Å; L911-I928 VanDerWaalsContact CD1-CG1 3.43Å
912	S	91.6	Very high	80.6	Confident	35 Å²	35	57.5 Å²	57.5	25%	0.245	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	103.5	172.5	-69	0	0	0	0	109.2	N910 G926 H927	N910-S912 PolarHBondContact OD1-OG 3.16Å; S912-G926 CarbonylContact O-C 2.9Å; S912-G926 VanDerWaalsContact O-CA 3.26Å; S912-G926 WeakPolarHBondContact O-CA 3.28Å; S912-H927 PolarHBondContact N-O 3.4Å; S912-H927 PolarHBondContact O-N 3.41Å
913	I	89.9	Confident	80.9	Confident	4 Å²	4	58 Å²	58	2%	0.021	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	150.6	-174.1	54.3	170.8	0	0	0	112.1	V857 L864 Y867 F892 L893 L911 V924 V925	V857-I913 HydrophobicContact CB-CG2 4.34Å; V857-I913 HydrophobicContact CG1-CG2 4.3Å; V857-I913 HydrophobicContact CG2-CG2 3.85Å; L864-I913 HydrophobicContact CB-CD1 4.13Å; L864-I913 HydrophobicContact CD2-CB 4.22Å; L864-I913 HydrophobicContact CD2-CD1 3.74Å; L864-I913 HydrophobicContact CD2-CG1 3.9Å; Y867-I913 HydrophobicContact CD1-CD1 3.88Å; Y867-I913 HydrophobicContact CD1-CG2 4.48Å; Y867-I913 HydrophobicContact CE1-CG2 4.31Å; F892-I913 CarbonylContact C-O 3.57Å; F892-I913 VanDerWaalsContact CA-O 3.3Å; F892-I913 WeakPolarHBondContact CA-O 3.22Å; L893-I913 HydrophobicContact CB-CD1 4.32Å; L893-I913 HydrophobicContact CB-CG1 3.95Å; L893-I913 HydrophobicContact CD2-CD1 4.02Å; L893-I913 HydrophobicContact CD2-CG1 4.02Å; L893-I913 PolarHBondContact N-O 2.8Å; L893-I913 WeakPolarHBondContact O-CG1 3.33Å; L893-I913 PolarHBondContact O-N 3.26Å; L911-I913 HydrophobicContact CD1-CG1 4.47Å; L911-I913 HydrophobicContact CD1-CG2 3.54Å; L911-I913 HydrophobicContact CD2-CD1 4.02Å; L911-I913 HydrophobicContact CD2-CG1 4.33Å; L911-I913 HydrophobicContact CG-CD1 4.37Å; L911-I913 HydrophobicContact CG-CG1 4.2Å; L911-I913 HydrophobicContact CG-CG2 4.13Å; I913-V924 HydrophobicContact CB-CG1 3.72Å; I913-V924 HydrophobicContact CD1-CG1 3.99Å; I913-V924 HydrophobicContact CG1-CG1 4.38Å; I913-V924 HydrophobicContact CG2-CG1 4Å; I913-V925 CarbonylContact C-O 3.23Å; I913-V925 WeakPolarHBondContact CA-O 3.39Å
914	E	87.8	Confident	81.4	Confident	110 Å²	110	55.6 Å²	55.6	51%	0.514	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	162.3	178.8	65.3	-176.7	-179	0	0	111.3	G891 F892 V925	G891-E914 CarbonylContact O-C 3.49Å; G891-E914 VanDerWaalsContact O-CA 3.28Å; G891-E914 WeakPolarHBondContact O-CA 3.33Å; G891-E914 WeakPolarHBondContact O-CB 3.41Å; F892-E914 HydrophobicContact CB-CB 4.08Å; E914-V925 PolarHBondContact N-O 3.16Å; E914-V925 PolarHBondContact O-N 3.29Å
915	K	81.3	Confident	82	Confident	66 Å²	66	56.5 Å²	56.5	29%	0.287	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	125.4	170.7	-66.2	-165.3	-179.6	-164.3	0	109.3	S862 L864 G891 T917	S862-K915 WeakPolarHBondContact O-CE 3.28Å; S862-K915 PolarHBondContact O-NZ 3.12Å; L864-K915 HydrophobicContact CD1-CG 4.33Å; L864-K915 HydrophobicContact CD2-CG 4.34Å; L864-K915 HydrophobicContact CG-CG 4.3Å; G891-K915 PolarHBondContact O-N 2.69Å; K915-T917 PolarHBondContact O-N 3.26Å
916	A	74.5	Confident	82.4	Confident	56 Å²	56	54.5 Å²	54.5	46%	0.463	31%	0.313	S	S	.	.	S	Bend	trans	-59.2	-31	-175.4	0	0	0	0	0	113.6	P923 V925	A916-P923 PolarHBondContact N-O 2.9Å; A916-V925 HydrophobicContact CB-CG2 3.83Å
917	T	71.6	Confident	82.6	Confident	75 Å²	75	55.3 Å²	55.3	46%	0.46	32%	0.315	S	S	.	.	S	Bend	trans	-138.5	162.1	173.2	49.8	0	0	0	0	110.2	K915 D919 S922	K915-T917 PolarHBondContact O-N 3.26Å; T917-D919 PolarHBondContact O-N 3.48Å; T917-S922 PolarHBondContact O-OG 3.14Å; T917-S922 WeakPolarHBondContact OG1-CB 3.41Å
918	A	67.3	Low	82.7	Confident	110 Å²	110	55.2 Å²	55.2	91%	0.909	32%	0.315	S	S	*	.	S	Bend	trans	-66.3	-4.7	177.8	0	0	0	0	0	113.9
919	D	69.1	Low	82.8	Confident	113 Å²	113	59.5 Å²	59.5	60%	0.604	33%	0.331	S	S	*	.	S	Bend	trans	-73.3	139.1	178.4	-64.5	-35.4	0	0	0	111.3	T917 Q921 S922	T917-D919 PolarHBondContact O-N 3.48Å; D919-Q921 PolarHBondContact O-N 2.88Å; D919-Q921 VanDerWaalsContact O-N 3.14Å; D919-S922 WeakPolarHBondContact O-CB 3.34Å; D919-S922 PolarHBondContact O-N 3.47Å; D919-S922 VanDerWaalsContact O-N 3.11Å; D919-S922 PolarHBondContact O-OG 3.04Å
920	Q	65.4	Low	82.8	Confident	171 Å²	171	59.5 Å²	59.5	80%	0.799	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-24.2	-176.6	-73.1	179.8	-7.2	0	0	114.2
921	Q	68.8	Low	82.8	Confident	182 Å²	182	60.4 Å²	60.4	85%	0.85	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	7.3	-178.9	-66.2	-174.6	-15	0	0	113.6	D919	D919-Q921 PolarHBondContact O-N 2.88Å; D919-Q921 VanDerWaalsContact O-N 3.14Å
922	S	75.8	Confident	82.7	Confident	5 Å²	5	60.4 Å²	60.4	4%	0.035	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-68.9	140.9	179.2	64.6	0	0	0	0	111.2	T917 D919	T917-S922 PolarHBondContact O-OG 3.14Å; T917-S922 WeakPolarHBondContact OG1-CB 3.41Å; D919-S922 WeakPolarHBondContact O-CB 3.34Å; D919-S922 PolarHBondContact O-N 3.47Å; D919-S922 VanDerWaalsContact O-N 3.11Å; D919-S922 PolarHBondContact O-OG 3.04Å
923	P	80.2	Confident	82.5	Confident	64 Å²	64	66.4 Å²	66.4	42%	0.416	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-68.6	148.1	177.9	28.6	-34	0	0	0	110.5	T859 A916 V925	T859-P923 WeakPolarHBondContact O-CB 3.27Å; A916-P923 PolarHBondContact N-O 2.9Å; P923-V925 PolarHBondContact O-N 3.03Å
924	V	83.2	Confident	82.1	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.006	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	127.3	172	174.7	0	0	0	0	109.8	V857 T859 L861 L864 I913	V857-V924 HydrophobicContact CG1-CG1 4.36Å; T859-V924 HydrophobicContact CG2-CB 3.76Å; T859-V924 HydrophobicContact CG2-CG1 4.41Å; L861-V924 WeakPolarHBondContact O-CG2 3.41Å; L861-V924 PolarHBondContact O-N 3.35Å; L864-V924 HydrophobicContact CD2-CB 4.25Å; L864-V924 HydrophobicContact CD2-CG1 3.68Å; L864-V924 HydrophobicContact CD2-CG2 3.61Å; L864-V924 HydrophobicContact CG-CG2 4.34Å; I913-V924 HydrophobicContact CB-CG1 3.72Å; I913-V924 HydrophobicContact CD1-CG1 3.99Å; I913-V924 HydrophobicContact CG1-CG1 4.38Å; I913-V924 HydrophobicContact CG2-CG1 4Å
925	V	86.4	Confident	82	Confident	65 Å²	65	66.7 Å²	66.7	39%	0.394	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	147.7	178.2	-179.8	0	0	0	0	108.8	I913 E914 A916 P923	I913-V925 CarbonylContact C-O 3.23Å; I913-V925 WeakPolarHBondContact CA-O 3.39Å; E914-V925 PolarHBondContact N-O 3.16Å; E914-V925 PolarHBondContact O-N 3.29Å; A916-V925 HydrophobicContact CB-CG2 3.83Å; P923-V925 PolarHBondContact O-N 3.03Å
926	G	89.4	Confident	81.9	Confident	18 Å²	18	64 Å²	64	19%	0.186	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.2	-160.7	-179.8	0	0	0	0	0	113.6	V857 S912	V857-G926 PolarHBondContact N-O 3.43Å; S912-G926 CarbonylContact O-C 2.9Å; S912-G926 VanDerWaalsContact O-CA 3.26Å; S912-G926 WeakPolarHBondContact O-CA 3.28Å
927	H	92.1	Very high	82.2	Confident	50 Å²	50	61.3 Å²	61.3	23%	0.231	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	145.4	178	59	-76.3	0	0	0	111.9	K854 V855 S912 R929	K854-H927 HydrophobicContact CG-CB 4.38Å; V855-H927 CarbonylContact O-C 3.59Å; V855-H927 WeakPolarHBondContact O-CA 3.28Å; S912-H927 PolarHBondContact N-O 3.4Å; S912-H927 PolarHBondContact O-N 3.41Å; H927-R929 PolarHBondContact CD2-NE 2.9Å; H927-R929 VanDerWaalsContact CD2-NE 3.3Å; H927-R929 PolarHBondContact NE2-NE 3.26Å; H927-R929 PolarHBondContact NE2-NH2 3.49Å
928	I	92.7	Very high	82.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124	172.6	-60.4	155.2	0	0	0	107	K854 V855 V857 L871 A909 N910 L911 I930 I945	K854-I928 WeakPolarHBondContact CA-O 3.12Å; V855-I928 HydrophobicContact CB-CB 4.49Å; V855-I928 PolarHBondContact N-O 2.89Å; V855-I928 PolarHBondContact O-N 3.38Å; V857-I928 HydrophobicContact CG2-CD1 3.75Å; V857-I928 HydrophobicContact CG2-CG1 3.81Å; L871-I928 HydrophobicContact CD1-CD1 3.4Å; L871-I928 HydrophobicContact CD1-CG1 4.39Å; A909-I928 HydrophobicContact CB-CG2 4.33Å; N910-I928 CarbonylContact O-C 3.58Å; N910-I928 WeakPolarHBondContact O-CA 3.46Å; L911-I928 HydrophobicContact CD1-CD1 4.06Å; L911-I928 HydrophobicContact CD1-CG1 3.43Å; L911-I928 VanDerWaalsContact CD1-CG1 3.43Å; I928-I930 HydrophobicContact CG2-CG1 4.05Å; I928-I945 HydrophobicContact CD1-CG2 3.58Å; I928-I945 HydrophobicContact CG2-CD1 4.04Å
929	R	94.3	Very high	83.7	Confident	90 Å²	90	56.3 Å²	56.3	34%	0.34	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	122.8	174.1	-60.9	178.8	-169.5	-151.2	7.5	108.2	W846 E852 K854 A909 N910 H927	W846-R929 HydrophobicContact CH2-CB 3.93Å; W846-R929 WeakPolarHBondContact CH2-O 3.41Å; W846-R929 HydrophobicContact CZ2-CB 4.2Å; E852-R929 WeakPolarHBondContact OE1-CD 3.22Å; E852-R929 IonicContact OE1-NH1 2.74Å; K854-R929 HydrophobicContact CG-CG 4.33Å; A909-R929 CarbonylContact C-O 3.19Å; A909-R929 VanDerWaalsContact CA-O 3.25Å; A909-R929 WeakPolarHBondContact CA-O 3.27Å; N910-R929 PolarHBondContact N-O 2.85Å; N910-R929 PolarHBondContact O-N 3.35Å; H927-R929 PolarHBondContact CD2-NE 2.9Å; H927-R929 VanDerWaalsContact CD2-NE 3.3Å; H927-R929 PolarHBondContact NE2-NE 3.26Å; H927-R929 PolarHBondContact NE2-NH2 3.49Å
930	I	92.8	Very high	84.3	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	129.2	179.5	-51.2	169.2	0	0	0	106.8	E852 N853 V855 L908 A909 I928 L941 G942 I945	E852-I930 CarbonylContact C-O 3.59Å; E852-I930 VanDerWaalsContact CA-O 3.32Å; E852-I930 WeakPolarHBondContact CA-O 3.33Å; N853-I930 PolarHBondContact N-O 2.95Å; N853-I930 PolarHBondContact O-N 2.84Å; V855-I930 HydrophobicContact CG2-CD1 4.26Å; L908-I930 CarbonylContact O-C 3.29Å; L908-I930 VanDerWaalsContact O-CA 3.32Å; L908-I930 WeakPolarHBondContact O-CA 3.46Å; A909-I930 HydrophobicContact CB-CG1 4.29Å; I928-I930 HydrophobicContact CG2-CG1 4.05Å; I930-L941 HydrophobicContact CD1-CB 3.98Å; I930-L941 HydrophobicContact CG2-CB 4.11Å; I930-L941 HydrophobicContact CG2-CD1 4.09Å; I930-G942 VanDerWaalsContact CD1-CA 3.45Å; I930-I945 HydrophobicContact CD1-CD1 3.6Å; I930-I945 HydrophobicContact CG1-CD1 4.26Å
931	R	93.3	Very high	85.2	Confident	54 Å²	54	43.2 Å²	43.2	20%	0.204	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.1	173.4	-71.8	-165.7	172.7	-158.2	-8.6	110.6	W846 F849 W851 E852 L908	W846-R931 HydrophobicContact CD2-CG 4.46Å; W846-R931 HydrophobicContact CE3-CB 4.26Å; W846-R931 HydrophobicContact CE3-CG 4.37Å; W846-R931 HydrophobicContact CH2-CB 4.48Å; W846-R931 HydrophobicContact CH2-CG 4Å; W846-R931 HydrophobicContact CZ2-CG 4.1Å; W846-R931 HydrophobicContact CZ3-CB 4.14Å; W846-R931 HydrophobicContact CZ3-CG 4.15Å; W846-R931 PolarHBondContact O-NH1 3.45Å; F849-R931 HydrophobicContact CB-CB 4.15Å; F849-R931 HydrophobicContact CD2-CB 4.26Å; W851-R931 VanDerWaalsContact O-CA 3.24Å; W851-R931 WeakPolarHBondContact O-CA 3.27Å; E852-R931 HydrophobicContact CB-CG 4Å; E852-R931 HydrophobicContact CG-CG 4.1Å; E852-R931 IonicContact OE2-CZ 3.56Å; E852-R931 IonicContact OE2-NE 2.65Å; E852-R931 PolarHBondContact OE2-NE 3.05Å; E852-R931 IonicContact OE2-NH2 3.46Å; E852-R931 PolarHBondContact OE2-NH2 3.28Å; L908-R931 PolarHBondContact N-O 3.15Å; L908-R931 PolarHBondContact O-N 3.47Å
932	A	89.9	Confident	86.1	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	166.1	175.9	0	0	0	0	0	110	W851 M937 A938	W851-A932 PolarHBondContact N-O 3.3Å; W851-A932 PolarHBondContact O-N 3.26Å; A932-M937 HydrophobicContact CB-CB 3.88Å; A932-M937 HydrophobicContact CB-CG 3.93Å; A932-A938 HydrophobicContact CB-CB 4.14Å
933	K	86	Confident	86.5	Confident	161 Å²	161	38.1 Å²	38.1	70%	0.7	20%	0.196	S	C	*	.	S	Bend	trans	-75.9	-34.1	176.9	-153.5	174.9	-172.1	173.2	0	112.3	W851	W851-K933 VanDerWaalsContact CD1-O 3.31Å
934	S	83.4	Confident	86.5	Confident	26 Å²	26	38.8 Å²	38.8	18%	0.182	19%	0.19	C	C	.	.	S	Bend	trans	-100.5	141.4	177	60.8	0	0	0	0	110.8	E905 G936 M937 A938	E905-S934 PolarHBondContact OE2-OG 3.47Å; S934-G936 VanDerWaalsContact C-N 3.31Å; S934-G936 PolarHBondContact O-N 3.47Å; S934-M937 WeakPolarHBondContact OG-CB 3.47Å; S934-A938 PolarHBondContact O-N 2.94Å
935	Q	83.7	Confident	86.6	Confident	93 Å²	93	38.9 Å²	38.9	44%	0.435	19%	0.19	S	C	.	.	H	α-helix	trans	-61.5	-42.1	175.5	-175.9	-179.3	3.4	0	0	111.3	W851 M937 A938 L939	W851-Q935 HydrophobicContact CD2-CB 3.71Å; W851-Q935 HydrophobicContact CD2-CG 4.05Å; W851-Q935 HydrophobicContact CE3-CB 3.92Å; W851-Q935 HydrophobicContact CE3-CG 3.7Å; W851-Q935 HydrophobicContact CG-CB 4.2Å; W851-Q935 HydrophobicContact CH2-CB 4.22Å; W851-Q935 HydrophobicContact CH2-CG 4.07Å; W851-Q935 HydrophobicContact CZ2-CB 4.04Å; W851-Q935 HydrophobicContact CZ2-CG 4.41Å; W851-Q935 HydrophobicContact CZ3-CB 4.17Å; W851-Q935 HydrophobicContact CZ3-CG 3.71Å; Q935-M937 PolarHBondContact O-N 3.28Å; Q935-A938 PolarHBondContact O-N 3.31Å; Q935-L939 HydrophobicContact CG-CD1 3.82Å; Q935-L939 HydrophobicContact CG-CG 4.27Å; Q935-L939 PolarHBondContact O-N 3.18Å
936	G	79.4	Confident	86.5	Confident	9 Å²	9	37.7 Å²	37.7	9%	0.093	19%	0.185	C	C	.	.	H	α-helix	trans	-54.2	-47.7	179.5	0	0	0	0	0	113.1	S934 S940	S934-G936 VanDerWaalsContact C-N 3.31Å; S934-G936 PolarHBondContact O-N 3.47Å; G936-S940 WeakPolarHBondContact O-CB 3.05Å; G936-S940 PolarHBondContact O-N 3.15Å; G936-S940 PolarHBondContact O-OG 3.17Å
937	M	82.1	Confident	86.1	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-65.1	-43.8	178.4	-172.3	65.2	76.9	0	0	112.5	T796 I828 I832 E905 A907 A932 S934 Q935 S940 L941	T796-M937 VanDerWaalsContact CB-CE 3.4Å; T796-M937 HydrophobicContact CG2-CE 3.4Å; T796-M937 VanDerWaalsContact CG2-CE 3.4Å; I828-M937 HydrophobicContact CG2-CE 4.41Å; I828-M937 HydrophobicContact CG2-SD 4.12Å; I832-M937 HydrophobicContact CD1-SD 3.91Å; I832-M937 HydrophobicContact CG1-SD 4.49Å; E905-M937 HydrophobicContact CB-CE 4.2Å; A907-M937 HydrophobicContact CB-CG 4.05Å; A932-M937 HydrophobicContact CB-CB 3.88Å; A932-M937 HydrophobicContact CB-CG 3.93Å; S934-M937 WeakPolarHBondContact OG-CB 3.47Å; Q935-M937 PolarHBondContact O-N 3.28Å; M937-S940 WeakPolarHBondContact CA-OG 3.47Å; M937-S940 PolarHBondContact O-OG 3.28Å; M937-L941 HydrophobicContact CG-CD1 3.95Å; M937-L941 WeakPolarHBondContact O-CB 3.26Å; M937-L941 WeakPolarHBondContact O-CG 3.4Å; M937-L941 PolarHBondContact O-N 3.22Å; M937-L941 VanDerWaalsContact O-N 3.14Å; M937-L941 HydrophobicContact SD-CD1 3.96Å; M937-L941 HydrophobicContact SD-CG 4.33Å
938	A	85.3	Confident	85.6	Confident	3 Å²	3	41.4 Å²	41.4	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-66.2	-40.6	-179.4	0	0	0	0	0	112.6	W851 N853 A932 S934 Q935 G942	W851-A938 HydrophobicContact CB-CB 4.26Å; N853-A938 HydrophobicContact CB-CB 4.31Å; N853-A938 WeakPolarHBondContact CB-O 3.43Å; N853-A938 PolarHBondContact ND2-O 3.46Å; A932-A938 HydrophobicContact CB-CB 4.14Å; S934-A938 PolarHBondContact O-N 2.94Å; Q935-A938 PolarHBondContact O-N 3.31Å; A938-G942 PolarHBondContact O-N 3.25Å
939	L	85	Confident	85.1	Confident	77 Å²	77	42 Å²	42	40%	0.403	20%	0.195	S	C	.	.	H	α-helix	trans	-71.4	-48.3	178.5	-72	179.2	0	0	0	111.8	Q935 L941 G942 D943	Q935-L939 HydrophobicContact CG-CD1 3.82Å; Q935-L939 HydrophobicContact CG-CG 4.27Å; Q935-L939 PolarHBondContact O-N 3.18Å; L939-L941 PolarHBondContact O-N 2.71Å; L939-G942 WeakPolarHBondContact O-CA 3.4Å; L939-G942 PolarHBondContact O-N 2.9Å; L939-D943 PolarHBondContact O-N 3.36Å
940	S	81.5	Confident	84.3	Confident	7 Å²	7	44.4 Å²	44.4	5%	0.049	21%	0.208	C	C	.	.	H	α-helix	trans	-62.6	-42.6	-177.1	55.6	0	0	0	0	113.9	N798 I828 G936 M937 G942 D943 R944	N798-S940 WeakPolarHBondContact ND2-CB 3.35Å; I828-S940 WeakPolarHBondContact CD1-OG 3.32Å; G936-S940 WeakPolarHBondContact O-CB 3.05Å; G936-S940 PolarHBondContact O-N 3.15Å; G936-S940 PolarHBondContact O-OG 3.17Å; M937-S940 WeakPolarHBondContact CA-OG 3.47Å; M937-S940 PolarHBondContact O-OG 3.28Å; S940-G942 VanDerWaalsContact C-N 3.28Å; S940-G942 PolarHBondContact O-N 3.03Å; S940-D943 PolarHBondContact O-N 2.95Å; S940-R944 WeakPolarHBondContact O-CB 3.48Å; S940-R944 PolarHBondContact O-N 3.12Å
941	L	84.7	Confident	83.2	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-40.2	172.7	-83.4	168	0	0	0	111	M829 I832 M877 A907 I930 M937 L939 R944 I945	M829-L941 HydrophobicContact SD-CD2 4.11Å; I832-L941 HydrophobicContact CD1-CD1 4.26Å; I832-L941 HydrophobicContact CD1-CD2 3.55Å; I832-L941 HydrophobicContact CD1-CG 3.99Å; M877-L941 HydrophobicContact CE-CD1 3.59Å; M877-L941 HydrophobicContact CE-CD2 3.87Å; M877-L941 HydrophobicContact CE-CG 4.34Å; A907-L941 HydrophobicContact CB-CD1 3.52Å; I930-L941 HydrophobicContact CD1-CB 3.98Å; I930-L941 HydrophobicContact CG2-CB 4.11Å; I930-L941 HydrophobicContact CG2-CD1 4.09Å; M937-L941 HydrophobicContact CG-CD1 3.95Å; M937-L941 WeakPolarHBondContact O-CB 3.26Å; M937-L941 WeakPolarHBondContact O-CG 3.4Å; M937-L941 PolarHBondContact O-N 3.22Å; M937-L941 VanDerWaalsContact O-N 3.14Å; M937-L941 HydrophobicContact SD-CD1 3.96Å; M937-L941 HydrophobicContact SD-CG 4.33Å; L939-L941 PolarHBondContact O-N 2.71Å; L941-R944 PolarHBondContact O-N 3.33Å; L941-I945 VanDerWaalsContact O-CG1 3.28Å; L941-I945 WeakPolarHBondContact O-CG1 3.41Å; L941-I945 PolarHBondContact O-N 3.44Å
942	G	86.2	Confident	82	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-39.8	177.9	0	0	0	0	0	113.5	I930 A938 L939 S940 R944 I945 S946	I930-G942 VanDerWaalsContact CD1-CA 3.45Å; A938-G942 PolarHBondContact O-N 3.25Å; L939-G942 WeakPolarHBondContact O-CA 3.4Å; L939-G942 PolarHBondContact O-N 2.9Å; S940-G942 VanDerWaalsContact C-N 3.28Å; S940-G942 PolarHBondContact O-N 3.03Å; G942-R944 VanDerWaalsContact C-N 3.35Å; G942-I945 PolarHBondContact O-N 3Å; G942-S946 WeakPolarHBondContact O-CB 3.48Å; G942-S946 PolarHBondContact O-N 3.31Å; G942-S946 PolarHBondContact O-OG 3.5Å
943	D	84.2	Confident	80.7	Confident	79 Å²	79	49 Å²	49	42%	0.422	24%	0.243	S	C	.	.	H	α-helix	trans	-63.8	-41.6	173.6	-74.8	-19	0	0	0	111.1	L939 S940 S946 R947	L939-D943 PolarHBondContact O-N 3.36Å; S940-D943 PolarHBondContact O-N 2.95Å; D943-S946 WeakPolarHBondContact O-CB 3.3Å; D943-S946 PolarHBondContact O-N 3.01Å; D943-R947 WeakPolarHBondContact O-CG 3.26Å; D943-R947 PolarHBondContact O-N 3.34Å
944	R	80.3	Confident	79.3	Confident	77 Å²	77	47 Å²	47	29%	0.291	24%	0.24	S	C	.	.	H	α-helix	trans	-63.4	-48	176.5	-175.9	67.2	-178.6	179.4	4.3	111.3	N827 M829 S940 L941 G942 S946 R947 V948	N827-R944 PolarHBondContact ND2-NH1 3.29Å; N827-R944 VanDerWaalsContact ND2-NH1 3.18Å; M829-R944 HydrophobicContact CG-CG 3.75Å; M829-R944 HydrophobicContact SD-CG 4Å; S940-R944 WeakPolarHBondContact O-CB 3.48Å; S940-R944 PolarHBondContact O-N 3.12Å; L941-R944 PolarHBondContact O-N 3.33Å; G942-R944 VanDerWaalsContact C-N 3.35Å; R944-S946 PolarHBondContact O-N 3.43Å; R944-R947 PolarHBondContact O-N 2.9Å; R944-R947 VanDerWaalsContact O-N 3.11Å; R944-V948 HydrophobicContact CG-CG2 4.34Å; R944-V948 WeakPolarHBondContact O-CB 3.25Å; R944-V948 VanDerWaalsContact O-CG2 3.29Å; R944-V948 WeakPolarHBondContact O-CG2 3.42Å; R944-V948 PolarHBondContact O-N 2.82Å
945	I	85.4	Confident	77.9	Confident	3 Å²	3	48.8 Å²	48.8	2%	0.015	26%	0.262	C	S	.	.	H	α-helix	trans	-57.6	-42.4	175.9	-70.9	178.5	0	0	0	110.2	V855 L871 T875 I928 I930 L941 G942 R947 V948 Q949	V855-I945 HydrophobicContact CG1-CG2 4Å; L871-I945 HydrophobicContact CD1-CG2 4.3Å; T875-I945 HydrophobicContact CG2-CD1 4.16Å; T875-I945 HydrophobicContact CG2-CG1 3.68Å; I928-I945 HydrophobicContact CD1-CG2 3.58Å; I928-I945 HydrophobicContact CG2-CD1 4.04Å; I930-I945 HydrophobicContact CD1-CD1 3.6Å; I930-I945 HydrophobicContact CG1-CD1 4.26Å; L941-I945 VanDerWaalsContact O-CG1 3.28Å; L941-I945 WeakPolarHBondContact O-CG1 3.41Å; L941-I945 PolarHBondContact O-N 3.44Å; G942-I945 PolarHBondContact O-N 3Å; I945-R947 PolarHBondContact O-N 3.33Å; I945-V948 PolarHBondContact O-N 2.81Å; I945-Q949 WeakPolarHBondContact O-CB 3.21Å; I945-Q949 VanDerWaalsContact O-CG 3.28Å; I945-Q949 WeakPolarHBondContact O-CG 3.48Å; I945-Q949 PolarHBondContact O-N 3.31Å
946	S	85.5	Confident	76.1	Confident	40 Å²	40	51.6 Å²	51.6	28%	0.28	27%	0.269	S	S	.	.	H	α-helix	trans	-63.5	-38.8	176.8	-59.4	0	0	0	0	112.6	V855 G942 D943 R944 K950	V855-S946 WeakPolarHBondContact CG1-OG 3.29Å; G942-S946 WeakPolarHBondContact O-CB 3.48Å; G942-S946 PolarHBondContact O-N 3.31Å; G942-S946 PolarHBondContact O-OG 3.5Å; D943-S946 WeakPolarHBondContact O-CB 3.3Å; D943-S946 PolarHBondContact O-N 3.01Å; R944-S946 PolarHBondContact O-N 3.43Å; S946-K950 WeakPolarHBondContact O-CG 3.47Å; S946-K950 PolarHBondContact O-N 3.39Å; S946-K950 VanDerWaalsContact O-N 3.12Å
947	R	81.1	Confident	74.3	Confident	135 Å²	135	57.2 Å²	57.2	51%	0.509	29%	0.293	S	S	.	.	H	α-helix	trans	-67.8	-44.3	174.9	-72.7	-179.9	-167.9	-179.1	4.5	111.9	D943 R944 I945 Q949 K950 A951	D943-R947 WeakPolarHBondContact O-CG 3.26Å; D943-R947 PolarHBondContact O-N 3.34Å; R944-R947 PolarHBondContact O-N 2.9Å; R944-R947 VanDerWaalsContact O-N 3.11Å; I945-R947 PolarHBondContact O-N 3.33Å; R947-Q949 VanDerWaalsContact C-N 3.32Å; R947-Q949 PolarHBondContact O-N 2.81Å; R947-K950 PolarHBondContact O-N 3.32Å; R947-K950 VanDerWaalsContact O-N 3.15Å; R947-A951 PolarHBondContact O-N 3.26Å
948	V	81	Confident	72	Confident	11 Å²	11	65.4 Å²	65.4	7%	0.067	34%	0.337	C	S	.	.	H	α-helix	trans	-59.3	-44.1	177.3	167.2	0	0	0	0	110.5	Y870 H874 R944 I945 K950 A951 H952	Y870-V948 HydrophobicContact CD1-CG1 4.17Å; Y870-V948 HydrophobicContact CE1-CG1 3.39Å; Y870-V948 PolarHBondContact OH-O 3.03Å; H874-V948 HydrophobicContact CB-CG1 3.81Å; H874-V948 HydrophobicContact CB-CG2 3.9Å; R944-V948 HydrophobicContact CG-CG2 4.34Å; R944-V948 WeakPolarHBondContact O-CB 3.25Å; R944-V948 VanDerWaalsContact O-CG2 3.29Å; R944-V948 WeakPolarHBondContact O-CG2 3.42Å; R944-V948 PolarHBondContact O-N 2.82Å; I945-V948 PolarHBondContact O-N 2.81Å; V948-K950 PolarHBondContact O-N 3.33Å; V948-A951 PolarHBondContact O-N 3.43Å; V948-H952 PolarHBondContact O-N 3.31Å
949	Q	81.2	Confident	69.4	Low	12 Å²	12	72.2 Å²	72.2	6%	0.056	39%	0.385	C	S	.	.	H	α-helix	trans	-61.4	-43.3	174.2	-71.9	179.9	28.6	0	0	112.5	A856 Y867 I945 R947 V953	A856-Q949 PolarHBondContact O-OE1 2.82Å; Y867-Q949 PolarHBondContact OH-NE2 2.88Å; I945-Q949 WeakPolarHBondContact O-CB 3.21Å; I945-Q949 VanDerWaalsContact O-CG 3.28Å; I945-Q949 WeakPolarHBondContact O-CG 3.48Å; I945-Q949 PolarHBondContact O-N 3.31Å; R947-Q949 VanDerWaalsContact C-N 3.32Å; R947-Q949 PolarHBondContact O-N 2.81Å; Q949-V953 WeakPolarHBondContact O-CG2 3.35Å; Q949-V953 PolarHBondContact O-N 2.97Å
950	K	78	Confident	68.6	Low	142 Å²	142	72 Å²	72	62%	0.617	38%	0.384	S	S	*	.	H	α-helix	trans	-66.6	-40.4	178	-75.3	176.7	-178.6	179.5	0	113.2	S946 R947 V948 H952 V953 L954	S946-K950 WeakPolarHBondContact O-CG 3.47Å; S946-K950 PolarHBondContact O-N 3.39Å; S946-K950 VanDerWaalsContact O-N 3.12Å; R947-K950 PolarHBondContact O-N 3.32Å; R947-K950 VanDerWaalsContact O-N 3.15Å; V948-K950 PolarHBondContact O-N 3.33Å; K950-H952 VanDerWaalsContact C-N 3.28Å; K950-H952 PolarHBondContact O-N 3.06Å; K950-V953 PolarHBondContact O-N 3.3Å; K950-L954 WeakPolarHBondContact O-CG 3.47Å; K950-L954 PolarHBondContact O-N 3.06Å
951	A	71.1	Confident	67.9	Low	36 Å²	36	75.4 Å²	75.4	30%	0.298	40%	0.401	S	S	.	.	H	α-helix	trans	-59.3	-42.3	179.4	0	0	0	0	0	111.1	R947 V948 L954 G955 Y956	R947-A951 PolarHBondContact O-N 3.26Å; V948-A951 PolarHBondContact O-N 3.43Å; A951-L954 PolarHBondContact O-N 2.67Å; A951-G955 PolarHBondContact O-N 3.5Å; A951-G955 VanDerWaalsContact O-N 3.1Å; A951-Y956 PolarHBondContact O-N 3.46Å
952	H	66.7	Low	67	Low	35 Å²	35	79.4 Å²	79.4	16%	0.162	42%	0.423	C	S	.	.	H	α-helix	trans	-62.9	-44.3	174.4	-169.6	-81.8	0	0	0	112.7	T860 L861 Y870 V948 K950 L954 G955	T860-H952 PolarHBondContact OG1-CE1 2.76Å; T860-H952 VanDerWaalsContact OG1-CE1 3.26Å; T860-H952 PolarHBondContact OG1-ND1 3.17Å; T860-H952 VanDerWaalsContact OG1-ND1 3.14Å; L861-H952 VanDerWaalsContact CD2-CE1 3.46Å; L861-H952 WeakPolarHBondContact CD2-CE1 3.14Å; L861-H952 WeakPolarHBondContact CD2-NE2 3.41Å; L861-H952 VanDerWaalsContact CG-CE1 3.44Å; L861-H952 WeakPolarHBondContact CG-CE1 3.34Å; Y870-H952 HydrophobicContact CE1-CB 4.21Å; Y870-H952 AromaticContact CE2-CD2 3.94Å; Y870-H952 AromaticContact CZ-CD2 3.87Å; V948-H952 PolarHBondContact O-N 3.31Å; K950-H952 VanDerWaalsContact C-N 3.28Å; K950-H952 PolarHBondContact O-N 3.06Å; H952-L954 VanDerWaalsContact C-N 3.26Å; H952-L954 PolarHBondContact O-N 3.38Å; H952-G955 PolarHBondContact O-N 3.07Å
953	V	62.7	Low	65.9	Low	78 Å²	78	84.1 Å²	84.1	47%	0.473	45%	0.447	S	S	.	.	H	α-helix	trans	-62.4	-34.5	177.8	173.7	0	0	0	0	111.9	T860 Q949 K950	T860-V953 HydrophobicContact CG2-CG2 4.5Å; Q949-V953 WeakPolarHBondContact O-CG2 3.35Å; Q949-V953 PolarHBondContact O-N 2.97Å; K950-V953 PolarHBondContact O-N 3.3Å
954	L	57.8	Low	64.7	Low	120 Å²	120	84.4 Å²	84.4	63%	0.628	45%	0.449	S	S	*	.	H	α-helix	trans	-86.4	-5.9	-179.4	-65.9	168.5	0	0	0	113.7	K950 A951 H952 Y956	K950-L954 WeakPolarHBondContact O-CG 3.47Å; K950-L954 PolarHBondContact O-N 3.06Å; A951-L954 PolarHBondContact O-N 2.67Å; H952-L954 VanDerWaalsContact C-N 3.26Å; H952-L954 PolarHBondContact O-N 3.38Å; L954-Y956 VanDerWaalsContact C-N 3.31Å; L954-Y956 HydrophobicContact CB-CD2 3.66Å; L954-Y956 HydrophobicContact CB-CE2 4.09Å; L954-Y956 WeakPolarHBondContact O-CD2 3.15Å; L954-Y956 PolarHBondContact O-N 3.49Å
955	G	53.1	Low	63.7	Low	63 Å²	63	84.9 Å²	84.9	65%	0.649	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	18.1	178.4	0	0	0	0	0	115.1	A951 H952 E957	A951-G955 PolarHBondContact O-N 3.5Å; A951-G955 VanDerWaalsContact O-N 3.1Å; H952-G955 PolarHBondContact O-N 3.07Å; G955-E957 PolarHBondContact O-N 3.1Å
956	Y	45.9	Very low	62.1	Low	152 Å²	152	90.7 Å²	90.7	60%	0.596	49%	0.491	S	S	*	.			trans	-90.7	78.4	175.5	-72.3	-88.5	0	0	0	109.6	A951 L954	A951-Y956 PolarHBondContact O-N 3.46Å; L954-Y956 VanDerWaalsContact C-N 3.31Å; L954-Y956 HydrophobicContact CB-CD2 3.66Å; L954-Y956 HydrophobicContact CB-CE2 4.09Å; L954-Y956 WeakPolarHBondContact O-CD2 3.15Å; L954-Y956 PolarHBondContact O-N 3.49Å
957	E	42.5	Very low	60.3	Low	127 Å²	127	94.6 Å²	94.6	59%	0.593	51%	0.507	S	S	*	.	S	Bend	trans	-92.2	-8	168.9	-76.7	-161.6	145.7	0	0	113.4	G955	G955-E957 PolarHBondContact O-N 3.1Å
958	N	33.8	Very low	58.6	Low	174 Å²	174	91.3 Å²	91.3	93%	0.93	51%	0.507	S	S	*	.			trans	-122	29.5	-175.5	-76.6	-19.7	0	0	0	114.6
959	S	29.6	Very low	56.6	Low	145 Å²	145	98.5 Å²	98.5	100%	1.014	55%	0.547	S	S	*	.			trans	-132.8	0	165.4	64.8	0	0	0	0	109.3

Retrieved 959 of 959 residues in 377.5 ms (Link to these results)

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