A0A087XU13_POEFO Loading...

FAST kinase domains 1

AlphaFold DB , UniProt , Accession A0A087XU13, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 830 aa.

						>A0A087XU13_POEFO|A0A087XU13
MFRLQCVRPCLRRLLHLGVGSRDHVLEGLQVCSTDDQVLDVVGKNRTKLTVEHVSCAVRMLWDFQKERPELLRTVHLIKCHPEFLTLRVLAENKISLMDDLTLVNMLYVFLRLSVEPHDSLVQQMVSEAWRRVDGLPMSSLSKFAVILHDQLLHSSPLMGHITNILDQRLSSIDNARVLAALMVSVSNLVSTRLRDALISRAECLLDTNNPLNYNTPRRMVQFLRSVKYTHRPLLDKCNEIFLRNIPRLDAENLSIILGLYQSLQFNNCDFRLAAKERLIELIDTSTDPYTFSKLFAALAPISSPEIRERLENTTFLVADEFSAQQALAIVEALEESQSRNLSLLNKITSVIQKKLPVYRSVEVARITQALFLLHYQNPELFAALRTILVSFLQRSFYPYEVTMLTRVLAMLPSPRLDEGVAQHVDNVIAQCNLSELNTISFAVAKWIRTDPSYRHNTHSKYVRLLQRLSQCGRERLQTADRLDLVLEEIKFAPGEWFEEMLLEETFVTLNRMIDQINPSNIADLAFFLTRINRLNPPLMERIASVAIEHIDEIHFSATYPTLLPFSVLNYEPAHVDELYDVCIKRFTPHISSFDPHLLVLLAYCLALADHFPEELIREIFSIGFLGKLDCQLESLHDSLKMRTKQRLMELNRAVCLECPEFQVPWFHERYCQHLQKKVNGSVSPVQQQIHTMLGGVLGGINFVRAAVVTPYFYTIDFECKLDKHLKPLPYSGPSTLQISERGKVLWDSNSLENARDELPAGAHRVAIDFMDSKFFCKNSHHMKGEALMRKRHLEILGYRVVQIPHFEWNSMELSTPHAWKRYLRKKILG
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.9	Very low	28	Very low	231 Å²	231	173.5 Å²	173.5	100%	1.138	87%	0.868	S	S	*	*				0	141.8	0	-90.7	-171.8	-164.7	0	0	108.8
2	F	23.8	Very low	28.4	Very low	206 Å²	206	179.2 Å²	179.2	90%	0.904	87%	0.872	S	S	*	*			trans	76.1	109.9	176.3	-71.3	-78.7	0	0	0	119.8
3	R	32.7	Very low	28.5	Very low	233 Å²	233	184.2 Å²	184.2	88%	0.879	88%	0.876	S	S	*	*			trans	-66.2	155.1	168.7	-66.2	171.9	168	178.1	-3.8	111.4
4	L	25.3	Very low	28.7	Very low	176 Å²	176	183 Å²	183	92%	0.921	88%	0.876	S	S	*	*			trans	-155.4	121.1	134.2	-107.5	153.4	0	0	0	111.2
5	Q	31.5	Very low	28.8	Very low	169 Å²	169	182.2 Å²	182.2	79%	0.79	88%	0.877	S	S	*	*			trans	-67.5	144	166.7	-75	165.4	-44.8	0	0	110.6
6	C	23.5	Very low	29.1	Very low	128 Å²	128	182.6 Å²	182.6	87%	0.865	88%	0.877	S	S	*	*			trans	-154.3	85.5	154	-120.8	0	0	0	0	105.6
7	V	31.1	Very low	29	Very low	119 Å²	119	182.1 Å²	182.1	72%	0.721	88%	0.879	S	S	*	*				36.4	103.3	89.4	-172	0	0	0	0	113.2
8	R	26	Very low	28.9	Very low	244 Å²	244	176 Å²	176	92%	0.921	87%	0.872	S	S	*	*			trans	-145.2	151.4	138.6	-92.9	-153.4	174.9	173.7	-0.9	112.1
9	P	33.2	Very low	29.4	Very low	103 Å²	103	175.5 Å²	175.5	67%	0.669	88%	0.879	S	S	*	*			trans	-122	-169.4	-142.7	31.9	-10	0	0	0	112.3
10	C	24.4	Very low	29.7	Very low	118 Å²	118	169.9 Å²	169.9	80%	0.797	87%	0.868	S	S	*	*			trans	88.6	82.1	170.1	-65	0	0	0	0	116.7
11	L	29.9	Very low	30.3	Very low	181 Å²	181	167.4 Å²	167.4	95%	0.948	87%	0.866	S	S	*	*				-155.3	65.4	118.3	-95.3	166	0	0	0	108.5
12	R	33.1	Very low	31.5	Very low	242 Å²	242	165.4 Å²	165.4	91%	0.913	85%	0.845	S	S	*	*			trans	-126.8	91	162.2	-91.5	-169.6	178	-174.4	0.5	107.3
13	R	28.7	Very low	34	Very low	244 Å²	244	158.5 Å²	158.5	92%	0.921	82%	0.818	S	S	*	*			trans	167.5	94	145.2	-95.5	172.2	-169.4	-170.5	3.8	109.4
14	L	31.4	Very low	36.1	Very low	168 Å²	168	154 Å²	154	88%	0.88	81%	0.807	S	S	*	*	S	Bend		177.2	106.6	118.7	-94.6	156.5	0	0	0	106.1
15	L	31	Very low	38.7	Very low	171 Å²	171	146.3 Å²	146.3	90%	0.895	77%	0.767	S	S	*	*			trans	168.7	78.7	146.1	-87.6	164.8	0	0	0	107.2
16	H	32.6	Very low	41.2	Very low	188 Å²	188	139.8 Å²	139.8	87%	0.87	74%	0.737	S	S	*	*			trans	-112.2	99.4	148.9	-94.6	-56	0	0	0	106.1
17	L	28.6	Very low	43.9	Very low	174 Å²	174	137.9 Å²	137.9	91%	0.911	72%	0.715	S	S	*	*				-178.5	120.3	120.9	-115.1	92	0	0	0	109
18	G	27.1	Very low	46.2	Very low	73 Å²	73	133.6 Å²	133.6	75%	0.753	70%	0.695	S	S	*	*			trans	151.4	96.4	175.6	0	0	0	0	0	110.1	G20	G18-G20 PolarHBondContact O-N 2.99Å
19	V	38.2	Very low	48.9	Very low	166 Å²	166	122 Å²	122	100%	1.006	65%	0.652	S	S	*	*			trans	-59.3	102.7	173.9	176.6	0	0	0	0	108.3
20	G	35.9	Very low	51.3	Low	63 Å²	63	123.2 Å²	123.2	65%	0.649	65%	0.649	S	S	*	*			trans	-130	135.5	179.9	0	0	0	0	0	110	G18 R22	G18-G20 PolarHBondContact O-N 2.99Å; G20-R22 PolarHBondContact O-N 3.18Å
21	S	42.3	Very low	54.2	Low	118 Å²	118	123.3 Å²	123.3	83%	0.825	65%	0.645	S	S	*	*			trans	-42.7	129.4	-175.5	56	0	0	0	0	113.7	D23	S21-D23 PolarHBondContact O-N 3.45Å
22	R	51.5	Low	56.9	Low	190 Å²	190	115.4 Å²	115.4	72%	0.717	61%	0.605	S	S	*	*			trans	-62.3	116.7	168.5	-71.2	-175.2	178.5	176.1	-1.7	108.9	G20 H24	G20-R22 PolarHBondContact O-N 3.18Å; R22-H24 PolarHBondContact O-N 3.06Å
23	D	76.3	Confident	59.3	Low	60 Å²	60	107.7 Å²	107.7	32%	0.321	59%	0.588	S	S	.	*			trans	-78.4	92.4	176.7	-158.3	-35.2	0	0	0	109.9	S21 V25 L26 E27 H53	S21-D23 PolarHBondContact O-N 3.45Å; D23-V25 PolarHBondContact O-N 3.04Å; D23-V25 VanDerWaalsContact O-N 3.15Å; D23-V25 PolarHBondContact OD1-N 3.16Å; D23-L26 HydrophobicContact CB-CB 3.99Å; D23-L26 PolarHBondContact O-N 3.27Å; D23-L26 VanDerWaalsContact O-N 3.1Å; D23-E27 PolarHBondContact O-N 2.92Å; D23-H53 IonicContact OD1-CE1 2.99Å; D23-H53 PolarHBondContact OD1-CE1 3.35Å; D23-H53 IonicContact OD1-NE2 2.92Å; D23-H53 PolarHBondContact OD1-NE2 2.98Å; D23-H53 IonicContact OD2-CE1 3.66Å; D23-H53 PolarHBondContact OD2-CE1 2.99Å; D23-H53 IonicContact OD2-NE2 3.42Å; D23-H53 PolarHBondContact OD2-NE2 3.04Å
24	H	76.4	Confident	61.9	Low	139 Å²	139	98.7 Å²	98.7	64%	0.644	56%	0.56	S	S	*	*	H	α-helix	trans	-59.8	-22.8	-177.6	-69.2	-60	0	0	0	113.6	R22 E27 G28	R22-H24 PolarHBondContact O-N 3.06Å; H24-E27 IonicContact ND1-OE2 3.96Å; H24-G28 PolarHBondContact O-N 2.91Å; H24-G28 VanDerWaalsContact O-N 3.08Å
25	V	80.6	Confident	64.4	Low	14 Å²	14	91.2 Å²	91.2	9%	0.085	52%	0.521	C	S	.	.	H	α-helix	trans	-76.4	-40.2	176.9	-178.4	0	0	0	0	110.2	D23 G28 L29 V41 N45 L49	D23-V25 PolarHBondContact O-N 3.04Å; D23-V25 VanDerWaalsContact O-N 3.15Å; D23-V25 PolarHBondContact OD1-N 3.16Å; V25-G28 PolarHBondContact O-N 3.17Å; V25-L29 HydrophobicContact CG1-CD1 4.43Å; V25-L29 WeakPolarHBondContact O-CG 3.48Å; V25-L29 PolarHBondContact O-N 3.29Å; V25-V41 HydrophobicContact CG1-CG1 4.48Å; V25-N45 HydrophobicContact CG1-CB 4.42Å; V25-N45 HydrophobicContact CG2-CB 4.29Å; V25-L49 HydrophobicContact CG1-CD2 3.89Å
26	L	82.7	Confident	66.9	Low	33 Å²	33	87.8 Å²	87.8	17%	0.173	50%	0.504	C	S	.	.	H	α-helix	trans	-69.5	-40.6	178.4	-132.6	152.4	0	0	0	111.6	D23 G28 L29 Q30 E52	D23-L26 HydrophobicContact CB-CB 3.99Å; D23-L26 PolarHBondContact O-N 3.27Å; D23-L26 VanDerWaalsContact O-N 3.1Å; L26-G28 VanDerWaalsContact C-N 3.34Å; L26-L29 PolarHBondContact O-N 3.49Å; L26-Q30 VanDerWaalsContact CD2-NE2 3.34Å; L26-Q30 VanDerWaalsContact O-CG 3.3Å; L26-Q30 WeakPolarHBondContact O-CG 3.12Å; L26-Q30 PolarHBondContact O-N 3.27Å; L26-E52 HydrophobicContact CD1-CB 4.35Å
27	E	80.8	Confident	69.4	Low	87 Å²	87	82.6 Å²	82.6	41%	0.407	48%	0.48	S	S	.	.	H	α-helix	trans	-61.1	-42.3	169.9	-72.1	179.5	172.4	0	0	111.4	D23 H24 Q30 V31	D23-E27 PolarHBondContact O-N 2.92Å; H24-E27 IonicContact ND1-OE2 3.96Å; E27-Q30 PolarHBondContact O-N 3.48Å; E27-V31 WeakPolarHBondContact O-CG2 3.48Å; E27-V31 PolarHBondContact O-N 2.85Å
28	G	79.2	Confident	72.2	Confident	29 Å²	29	74.3 Å²	74.3	30%	0.299	44%	0.437	S	S	.	.	H	α-helix	trans	-62.8	-40.9	177	0	0	0	0	0	113.4	H24 V25 L26 C32	H24-G28 PolarHBondContact O-N 2.91Å; H24-G28 VanDerWaalsContact O-N 3.08Å; V25-G28 PolarHBondContact O-N 3.17Å; L26-G28 VanDerWaalsContact C-N 3.34Å; G28-C32 PolarHBondContact O-SG 3.1Å; G28-C32 VanDerWaalsContact O-SG 3.36Å
29	L	83.2	Confident	75.1	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-65.5	-42.3	175.4	-74.7	169.5	0	0	0	111.8	V25 L26 V31 C32 V38 V41 H53 C56 A57 M60	V25-L29 HydrophobicContact CG1-CD1 4.43Å; V25-L29 WeakPolarHBondContact O-CG 3.48Å; V25-L29 PolarHBondContact O-N 3.29Å; L26-L29 PolarHBondContact O-N 3.49Å; L29-V31 PolarHBondContact O-N 2.92Å; L29-C32 WeakPolarHBondContact O-CB 3.39Å; L29-C32 PolarHBondContact O-N 3.29Å; L29-C32 VanDerWaalsContact O-N 3.11Å; L29-V38 HydrophobicContact CD2-CG1 4.01Å; L29-V41 HydrophobicContact CD2-CB 4.15Å; L29-V41 HydrophobicContact CD2-CG1 3.84Å; L29-V41 HydrophobicContact CG-CG1 3.95Å; L29-H53 HydrophobicContact CD1-CB 4.48Å; L29-C56 HydrophobicContact CD1-CB 4.4Å; L29-A57 HydrophobicContact CD1-CB 4.39Å; L29-A57 HydrophobicContact CD2-CB 4.11Å; L29-M60 HydrophobicContact CB-SD 4.28Å; L29-M60 WeakPolarHBondContact O-CE 3.3Å
30	Q	82.4	Confident	77.3	Confident	130 Å²	130	67 Å²	67	61%	0.607	38%	0.375	S	S	*	.	H	α-helix	trans	-65.2	-19.1	-177.8	-74.2	176.4	10.2	0	0	114.4	L26 E27	L26-Q30 VanDerWaalsContact CD2-NE2 3.34Å; L26-Q30 VanDerWaalsContact O-CG 3.3Å; L26-Q30 WeakPolarHBondContact O-CG 3.12Å; L26-Q30 PolarHBondContact O-N 3.27Å; E27-Q30 PolarHBondContact O-N 3.48Å
31	V	86.3	Confident	79.7	Confident	120 Å²	120	65.3 Å²	65.3	73%	0.727	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-14.2	178.2	178.7	0	0	0	0	112.1	E27 L29	E27-V31 WeakPolarHBondContact O-CG2 3.48Å; E27-V31 PolarHBondContact O-N 2.85Å; L29-V31 PolarHBondContact O-N 2.92Å
32	C	86.9	Confident	81.7	Confident	14 Å²	14	59.7 Å²	59.7	10%	0.095	31%	0.312	C	S	.	.			trans	-63.9	138.6	179.8	-62.7	0	0	0	0	111.7	G28 L29 Q37 V38 M60 F64	G28-C32 PolarHBondContact O-SG 3.1Å; G28-C32 VanDerWaalsContact O-SG 3.36Å; L29-C32 WeakPolarHBondContact O-CB 3.39Å; L29-C32 PolarHBondContact O-N 3.29Å; L29-C32 VanDerWaalsContact O-N 3.11Å; C32-Q37 HydrophobicContact CB-CB 4.02Å; C32-V38 HydrophobicContact CB-CG2 3.55Å; C32-M60 HydrophobicContact CB-CE 3.96Å; C32-F64 WeakPolarHBondContact O-CZ 3.12Å
33	S	82.4	Confident	83.3	Confident	81 Å²	81	51.7 Å²	51.7	57%	0.566	29%	0.289	S	S	*	.			trans	-117.1	-5	176.1	59.5	0	0	0	0	113.8	Q37	S33-Q37 PolarHBondContact OG-OE1 3.36Å
34	T	83.7	Confident	83.7	Confident	54 Å²	54	56.9 Å²	56.9	33%	0.331	31%	0.308	S	S	.	.	S	Bend	trans	-136.7	159.2	179.7	67.8	0	0	0	0	112.6	D36 Q37 V38 F64	T34-D36 VanDerWaalsContact C-N 3.32Å; T34-D36 PolarHBondContact O-N 3.21Å; T34-Q37 PolarHBondContact O-N 2.93Å; T34-Q37 VanDerWaalsContact OG1-CG 3.28Å; T34-Q37 WeakPolarHBondContact OG1-CG 3.29Å; T34-Q37 PolarHBondContact OG1-N 3.07Å; T34-V38 PolarHBondContact O-N 3.44Å; T34-F64 WeakPolarHBondContact O-CE2 3.09Å
35	D	85	Confident	84.1	Confident	11 Å²	11	52.2 Å²	52.2	6%	0.059	29%	0.288	C	S	.	.	H	α-helix	trans	-56.7	-45.2	178	-53.1	-56.7	0	0	0	111.4	Q37 V38 L39 L61 F64 Q65 R68 I78	D35-Q37 PolarHBondContact O-N 3.41Å; D35-V38 PolarHBondContact O-N 2.72Å; D35-L39 WeakPolarHBondContact O-CG 3.31Å; D35-L39 PolarHBondContact O-N 2.74Å; D35-L39 VanDerWaalsContact O-N 3.09Å; D35-L61 HydrophobicContact CB-CD2 3.96Å; D35-F64 WeakPolarHBondContact OD1-CB 3.42Å; D35-Q65 PolarHBondContact OD1-NE2 3.15Å; D35-Q65 PolarHBondContact OD2-NE2 3.43Å; D35-Q65 VanDerWaalsContact OD2-NE2 3.13Å; D35-R68 IonicContact OD2-CZ 3.38Å; D35-R68 IonicContact OD2-NH1 3.34Å; D35-R68 IonicContact OD2-NH2 3.26Å; D35-R68 PolarHBondContact OD2-NH2 3.03Å; D35-I78 HydrophobicContact CB-CD1 4.41Å; D35-I78 HydrophobicContact CB-CG1 4.3Å
36	D	83.3	Confident	84	Confident	100 Å²	100	57.7 Å²	57.7	54%	0.535	31%	0.308	S	S	.	.	H	α-helix	trans	-64.9	-38.5	-178.3	-61.3	-34.7	0	0	0	112.4	T34 V38 L39 D40	T34-D36 VanDerWaalsContact C-N 3.32Å; T34-D36 PolarHBondContact O-N 3.21Å; D36-V38 VanDerWaalsContact C-N 3.33Å; D36-V38 PolarHBondContact O-N 3.44Å; D36-L39 PolarHBondContact O-N 3.27Å; D36-D40 WeakPolarHBondContact O-CB 3.4Å; D36-D40 PolarHBondContact O-N 3.05Å
37	Q	85.4	Confident	83.6	Confident	79 Å²	79	62.9 Å²	62.9	37%	0.369	34%	0.341	S	S	.	.	H	α-helix	trans	-64.5	-38.5	177.2	-73.5	172.9	6.3	0	0	111.9	C32 S33 T34 D35 D40 V41	C32-Q37 HydrophobicContact CB-CB 4.02Å; S33-Q37 PolarHBondContact OG-OE1 3.36Å; T34-Q37 PolarHBondContact O-N 2.93Å; T34-Q37 VanDerWaalsContact OG1-CG 3.28Å; T34-Q37 WeakPolarHBondContact OG1-CG 3.29Å; T34-Q37 PolarHBondContact OG1-N 3.07Å; D35-Q37 PolarHBondContact O-N 3.41Å; Q37-D40 PolarHBondContact O-N 3.08Å; Q37-V41 VanDerWaalsContact O-CG2 3.31Å; Q37-V41 WeakPolarHBondContact O-CG2 3.26Å; Q37-V41 PolarHBondContact O-N 3.22Å; Q37-V41 VanDerWaalsContact O-N 3.07Å
38	V	86.7	Confident	83.6	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-63.9	-46	175.1	172.4	0	0	0	0	110	L29 C32 T34 D35 D36 D40 V41 V42 A57 M60 L61 F64	L29-V38 HydrophobicContact CD2-CG1 4.01Å; C32-V38 HydrophobicContact CB-CG2 3.55Å; T34-V38 PolarHBondContact O-N 3.44Å; D35-V38 PolarHBondContact O-N 2.72Å; D36-V38 VanDerWaalsContact C-N 3.33Å; D36-V38 PolarHBondContact O-N 3.44Å; V38-D40 VanDerWaalsContact C-N 3.34Å; V38-D40 PolarHBondContact O-N 2.77Å; V38-V41 PolarHBondContact O-N 2.74Å; V38-V42 VanDerWaalsContact O-CG2 3.3Å; V38-V42 WeakPolarHBondContact O-CG2 3.47Å; V38-V42 PolarHBondContact O-N 3.3Å; V38-A57 HydrophobicContact CG1-CB 3.82Å; V38-M60 HydrophobicContact CG2-CB 4.25Å; V38-M60 HydrophobicContact CG2-CE 4.09Å; V38-L61 HydrophobicContact CB-CD2 4.28Å; V38-L61 HydrophobicContact CG1-CD2 4.26Å; V38-L61 HydrophobicContact CG1-CG 4.17Å; V38-F64 HydrophobicContact CG2-CE2 3.74Å; V38-F64 HydrophobicContact CG2-CZ 4.49Å
39	L	87.8	Confident	83.9	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	34%	0.34	C	S	.	.	H	α-helix	trans	-66.6	-34.3	-179.9	-67.3	164.5	0	0	0	112.2	D35 D36 V42 G43 L61 H81 E83 F84 L87	D35-L39 WeakPolarHBondContact O-CG 3.31Å; D35-L39 PolarHBondContact O-N 2.74Å; D35-L39 VanDerWaalsContact O-N 3.09Å; D36-L39 PolarHBondContact O-N 3.27Å; L39-V42 WeakPolarHBondContact O-CB 3.43Å; L39-V42 PolarHBondContact O-N 3.3Å; L39-G43 PolarHBondContact O-N 3.2Å; L39-L61 HydrophobicContact CD1-CD2 4.35Å; L39-L61 HydrophobicContact CD2-CD1 4.17Å; L39-L61 HydrophobicContact CG-CD2 4.21Å; L39-H81 HydrophobicContact CD1-CB 3.94Å; L39-E83 HydrophobicContact CB-CB 4.22Å; L39-E83 HydrophobicContact CD2-CB 4.07Å; L39-F84 HydrophobicContact CD2-CB 4.32Å; L39-L87 HydrophobicContact CD2-CD1 4.07Å
40	D	85.3	Confident	84.1	Confident	85 Å²	85	67.6 Å²	67.6	46%	0.455	36%	0.357	S	S	.	.	H	α-helix	trans	-65.4	-42.4	172.9	-84.3	-12.2	0	0	0	112.5	D36 Q37 V38 V42 G43 K44	D36-D40 WeakPolarHBondContact O-CB 3.4Å; D36-D40 PolarHBondContact O-N 3.05Å; Q37-D40 PolarHBondContact O-N 3.08Å; V38-D40 VanDerWaalsContact C-N 3.34Å; V38-D40 PolarHBondContact O-N 2.77Å; D40-V42 VanDerWaalsContact C-N 3.31Å; D40-G43 PolarHBondContact O-N 3.48Å; D40-K44 WeakPolarHBondContact O-CG 3.43Å; D40-K44 PolarHBondContact O-N 3.21Å
41	V	84.6	Confident	84.3	Confident	26 Å²	26	62.7 Å²	62.7	16%	0.158	34%	0.336	C	S	.	.	H	α-helix	trans	-65	-38.4	176.8	171.6	0	0	0	0	110.6	V25 L29 Q37 V38 N45	V25-V41 HydrophobicContact CG1-CG1 4.48Å; L29-V41 HydrophobicContact CD2-CB 4.15Å; L29-V41 HydrophobicContact CD2-CG1 3.84Å; L29-V41 HydrophobicContact CG-CG1 3.95Å; Q37-V41 VanDerWaalsContact O-CG2 3.31Å; Q37-V41 WeakPolarHBondContact O-CG2 3.26Å; Q37-V41 PolarHBondContact O-N 3.22Å; Q37-V41 VanDerWaalsContact O-N 3.07Å; V38-V41 PolarHBondContact O-N 2.74Å; V41-N45 PolarHBondContact O-N 2.93Å; V41-N45 PolarHBondContact O-ND2 3.09Å
42	V	85.8	Confident	84.3	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.006	33%	0.331	C	S	.	.	H	α-helix	trans	-63	-47.9	172.7	168.7	0	0	0	0	110.8	V38 L39 D40 K44 N45 R46 L49 A57 E83 L87	V38-V42 VanDerWaalsContact O-CG2 3.3Å; V38-V42 WeakPolarHBondContact O-CG2 3.47Å; V38-V42 PolarHBondContact O-N 3.3Å; L39-V42 WeakPolarHBondContact O-CB 3.43Å; L39-V42 PolarHBondContact O-N 3.3Å; D40-V42 VanDerWaalsContact C-N 3.31Å; V42-K44 VanDerWaalsContact C-N 3.3Å; V42-K44 PolarHBondContact O-N 2.98Å; V42-N45 PolarHBondContact O-N 3.36Å; V42-N45 VanDerWaalsContact O-N 3.15Å; V42-R46 PolarHBondContact O-N 3.04Å; V42-L49 HydrophobicContact CB-CD1 4.4Å; V42-L49 HydrophobicContact CG1-CD1 3.82Å; V42-A57 HydrophobicContact CG2-CB 3.91Å; V42-E83 HydrophobicContact CG1-CB 4.48Å; V42-L87 HydrophobicContact CB-CD2 4.48Å; V42-L87 HydrophobicContact CG1-CD2 3.79Å; V42-L87 HydrophobicContact CG1-CG 3.86Å; V42-L87 HydrophobicContact CG2-CD1 4.31Å; V42-L87 HydrophobicContact CG2-CD2 3.81Å; V42-L87 HydrophobicContact CG2-CG 4.27Å
43	G	84.1	Confident	84.4	Confident	22 Å²	22	63 Å²	63	23%	0.227	33%	0.328	C	S	.	.	H	α-helix	trans	-61	-35.7	179.7	0	0	0	0	0	113.4	L39 D40 N45 R46 E83	L39-G43 PolarHBondContact O-N 3.2Å; D40-G43 PolarHBondContact O-N 3.48Å; G43-N45 VanDerWaalsContact C-N 3.33Å; G43-N45 PolarHBondContact O-N 3.24Å; G43-R46 WeakPolarHBondContact O-CG 3.43Å; G43-E83 VanDerWaalsContact CA-CD 3.49Å; G43-E83 VanDerWaalsContact CA-OE1 3.28Å; G43-E83 WeakPolarHBondContact CA-OE1 2.91Å
44	K	85.2	Confident	84.7	Confident	168 Å²	168	59.2 Å²	59.2	73%	0.73	30%	0.301	S	S	*	.	H	α-helix	trans	-74.1	-19.8	177.5	-72	169.7	-174.8	168.7	0	114.1	D40 V42	D40-K44 WeakPolarHBondContact O-CG 3.43Å; D40-K44 PolarHBondContact O-N 3.21Å; V42-K44 VanDerWaalsContact C-N 3.3Å; V42-K44 PolarHBondContact O-N 2.98Å
45	N	84.5	Confident	85	Confident	41 Å²	41	57.7 Å²	57.7	22%	0.219	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	19.7	-170.1	-66.4	-72.2	0	0	0	114.4	V25 V41 V42 G43 T47 K48 L49	V25-N45 HydrophobicContact CG1-CB 4.42Å; V25-N45 HydrophobicContact CG2-CB 4.29Å; V41-N45 PolarHBondContact O-N 2.93Å; V41-N45 PolarHBondContact O-ND2 3.09Å; V42-N45 PolarHBondContact O-N 3.36Å; V42-N45 VanDerWaalsContact O-N 3.15Å; G43-N45 VanDerWaalsContact C-N 3.33Å; G43-N45 PolarHBondContact O-N 3.24Å; N45-T47 PolarHBondContact O-N 2.87Å; N45-K48 PolarHBondContact O-N 3.33Å; N45-L49 HydrophobicContact CB-CD2 4.33Å; N45-L49 WeakPolarHBondContact O-CG 3.39Å; N45-L49 PolarHBondContact O-N 3.46Å
46	R	78.1	Confident	85.2	Confident	130 Å²	130	57.6 Å²	57.6	49%	0.491	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.6	-37.7	-170.9	-63.9	-177.8	-177.4	170.8	3.9	115.8	V42 G43 E83 T86	V42-R46 PolarHBondContact O-N 3.04Å; G43-R46 WeakPolarHBondContact O-CG 3.43Å; R46-E83 IonicContact CZ-OE1 2.75Å; R46-E83 IonicContact CZ-OE2 2.81Å; R46-E83 IonicContact NE-OE1 2.74Å; R46-E83 PolarHBondContact NE-OE1 2.59Å; R46-E83 IonicContact NE-OE2 2.85Å; R46-E83 PolarHBondContact NE-OE2 3.48Å; R46-E83 VanDerWaalsContact NE-OE2 3.09Å; R46-E83 IonicContact NH2-OE1 3.74Å; R46-E83 PolarHBondContact NH2-OE1 2.8Å; R46-E83 IonicContact NH2-OE2 3.76Å; R46-E83 PolarHBondContact NH2-OE2 3.09Å; R46-T86 HydrophobicContact CG-CG2 4.1Å
47	T	74.9	Confident	85.4	Confident	141 Å²	141	52.9 Å²	52.9	87%	0.865	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-12.1	-177.6	54	0	0	0	0	114.9	N45	N45-T47 PolarHBondContact O-N 2.87Å
48	K	81.3	Confident	85.6	Confident	149 Å²	149	49.1 Å²	49.1	65%	0.648	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	2.1	-176.3	-63.9	-178.7	180	177.6	0	113.7	N45 T50	N45-K48 PolarHBondContact O-N 3.33Å; K48-T50 PolarHBondContact O-N 3.27Å
49	L	84.5	Confident	85.8	Confident	8 Å²	8	55.3 Å²	55.3	4%	0.042	27%	0.274	C	S	.	.			trans	-75.3	113	-176.7	-65.5	171	0	0	0	111.4	V25 V42 N45 H53 V54 L90 K94	V25-L49 HydrophobicContact CG1-CD2 3.89Å; V42-L49 HydrophobicContact CB-CD1 4.4Å; V42-L49 HydrophobicContact CG1-CD1 3.82Å; N45-L49 HydrophobicContact CB-CD2 4.33Å; N45-L49 WeakPolarHBondContact O-CG 3.39Å; N45-L49 PolarHBondContact O-N 3.46Å; L49-H53 HydrophobicContact CB-CB 4.27Å; L49-H53 HydrophobicContact CD2-CB 3.62Å; L49-V54 HydrophobicContact CB-CG2 4.16Å; L49-L90 HydrophobicContact CB-CD1 4.32Å; L49-L90 HydrophobicContact CD1-CD1 3.6Å; L49-K94 WeakPolarHBondContact O-CE 3.23Å; L49-K94 PolarHBondContact O-NZ 3.11Å
50	T	87.3	Confident	85.8	Confident	59 Å²	59	56.3 Å²	56.3	36%	0.362	28%	0.278	S	S	.	.			trans	-77.5	173.6	171	64.9	0	0	0	0	110.5	K48 E52 H53 V54	K48-T50 PolarHBondContact O-N 3.27Å; T50-E52 VanDerWaalsContact C-N 3.26Å; T50-E52 PolarHBondContact O-N 3.41Å; T50-E52 PolarHBondContact OG1-N 3.38Å; T50-H53 PolarHBondContact N-ND1 3.47Å; T50-H53 PolarHBondContact O-N 2.87Å; T50-H53 VanDerWaalsContact OG1-CG 3.3Å; T50-H53 PolarHBondContact OG1-N 2.95Å; T50-H53 PolarHBondContact OG1-ND1 3.15Å; T50-H53 VanDerWaalsContact OG1-ND1 3.17Å; T50-V54 WeakPolarHBondContact O-CG2 3.28Å; T50-V54 PolarHBondContact O-N 3.4Å; T50-V54 VanDerWaalsContact O-N 3.11Å
51	V	87.1	Confident	86	Confident	26 Å²	26	52.2 Å²	52.2	16%	0.158	26%	0.257	C	S	.	.	H	α-helix	trans	-57.7	-41.6	172.9	177.1	0	0	0	0	111	H53 V54 S55 K94 L97 M98 T102	V51-H53 VanDerWaalsContact C-N 3.35Å; V51-H53 PolarHBondContact O-N 3.23Å; V51-V54 PolarHBondContact O-N 3.05Å; V51-S55 WeakPolarHBondContact O-CB 3.21Å; V51-S55 PolarHBondContact O-N 3.4Å; V51-K94 HydrophobicContact CG2-CB 4.04Å; V51-K94 HydrophobicContact CG2-CD 3.98Å; V51-L97 HydrophobicContact CG2-CB 3.94Å; V51-M98 HydrophobicContact CG1-CB 4.44Å; V51-M98 HydrophobicContact CG1-CG 3.74Å; V51-T102 HydrophobicContact CG1-CG2 3.89Å
52	E	86.2	Confident	86.3	Confident	137 Å²	137	52.4 Å²	52.4	64%	0.64	26%	0.255	S	S	*	.	H	α-helix	trans	-63	-40.1	178.6	-64.3	-171.2	166.1	0	0	112	L26 T50 C56	L26-E52 HydrophobicContact CD1-CB 4.35Å; T50-E52 VanDerWaalsContact C-N 3.26Å; T50-E52 PolarHBondContact O-N 3.41Å; T50-E52 PolarHBondContact OG1-N 3.38Å; E52-C56 WeakPolarHBondContact O-CB 3.39Å; E52-C56 PolarHBondContact O-N 3.17Å
53	H	89.4	Confident	86.3	Confident	3 Å²	3	55.3 Å²	55.3	1%	0.014	27%	0.27	C	S	.	.	H	α-helix	trans	-63.1	-47.1	175.5	-62.8	151.1	0	0	0	112.4	D23 L29 L49 T50 V51 C56 A57	D23-H53 IonicContact OD1-CE1 2.99Å; D23-H53 PolarHBondContact OD1-CE1 3.35Å; D23-H53 IonicContact OD1-NE2 2.92Å; D23-H53 PolarHBondContact OD1-NE2 2.98Å; D23-H53 IonicContact OD2-CE1 3.66Å; D23-H53 PolarHBondContact OD2-CE1 2.99Å; D23-H53 IonicContact OD2-NE2 3.42Å; D23-H53 PolarHBondContact OD2-NE2 3.04Å; L29-H53 HydrophobicContact CD1-CB 4.48Å; L49-H53 HydrophobicContact CB-CB 4.27Å; L49-H53 HydrophobicContact CD2-CB 3.62Å; T50-H53 PolarHBondContact N-ND1 3.47Å; T50-H53 PolarHBondContact O-N 2.87Å; T50-H53 VanDerWaalsContact OG1-CG 3.3Å; T50-H53 PolarHBondContact OG1-N 2.95Å; T50-H53 PolarHBondContact OG1-ND1 3.15Å; T50-H53 VanDerWaalsContact OG1-ND1 3.17Å; V51-H53 VanDerWaalsContact C-N 3.35Å; V51-H53 PolarHBondContact O-N 3.23Å; H53-C56 PolarHBondContact O-N 3.36Å; H53-A57 WeakPolarHBondContact O-CB 3.44Å; H53-A57 PolarHBondContact O-N 3.38Å
54	V	88.8	Confident	86.4	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.012	27%	0.265	C	S	.	.	H	α-helix	trans	-63.9	-47.1	179	177.1	0	0	0	0	110.3	L49 T50 V51 C56 A57 V58 L87 L90 A91 M106	L49-V54 HydrophobicContact CB-CG2 4.16Å; T50-V54 WeakPolarHBondContact O-CG2 3.28Å; T50-V54 PolarHBondContact O-N 3.4Å; T50-V54 VanDerWaalsContact O-N 3.11Å; V51-V54 PolarHBondContact O-N 3.05Å; V54-C56 VanDerWaalsContact C-N 3.32Å; V54-C56 PolarHBondContact O-N 3.07Å; V54-A57 PolarHBondContact O-N 3.11Å; V54-V58 HydrophobicContact CG1-CG2 4.34Å; V54-V58 WeakPolarHBondContact O-CB 3.31Å; V54-V58 VanDerWaalsContact O-CG2 3.27Å; V54-V58 WeakPolarHBondContact O-CG2 3.33Å; V54-V58 PolarHBondContact O-N 2.75Å; V54-L87 HydrophobicContact CG1-CD2 4.27Å; V54-L90 HydrophobicContact CG2-CB 4.2Å; V54-A91 HydrophobicContact CG1-CB 3.99Å; V54-M106 HydrophobicContact CG1-SD 4.28Å
55	S	89.4	Confident	86.4	Confident	23 Å²	23	47.5 Å²	47.5	16%	0.161	23%	0.23	C	C	.	.	H	α-helix	trans	-62.6	-38.2	177.9	-176.7	0	0	0	0	112.4	V51 R59 M106	V51-S55 WeakPolarHBondContact O-CB 3.21Å; V51-S55 PolarHBondContact O-N 3.4Å; S55-R59 WeakPolarHBondContact O-CB 3.35Å; S55-R59 PolarHBondContact O-N 3.01Å; S55-M106 VanDerWaalsContact CA-SD 3.57Å
56	C	88.9	Confident	86.3	Confident	9 Å²	9	52.2 Å²	52.2	6%	0.061	25%	0.248	C	C	.	.	H	α-helix	trans	-68	-47.4	178.1	-169.1	0	0	0	0	111.2	L29 E52 H53 V54 R59 M60	L29-C56 HydrophobicContact CD1-CB 4.4Å; E52-C56 WeakPolarHBondContact O-CB 3.39Å; E52-C56 PolarHBondContact O-N 3.17Å; H53-C56 PolarHBondContact O-N 3.36Å; V54-C56 VanDerWaalsContact C-N 3.32Å; V54-C56 PolarHBondContact O-N 3.07Å; C56-R59 PolarHBondContact O-N 3.09Å; C56-M60 VanDerWaalsContact O-CG 3.32Å; C56-M60 WeakPolarHBondContact O-CG 3.47Å; C56-M60 PolarHBondContact O-N 3.14Å
57	A	89.1	Confident	86.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.4	-49.1	178.5	0	0	0	0	0	111.7	L29 V38 V42 H53 V54 R59 M60 L61 L87	L29-A57 HydrophobicContact CD1-CB 4.39Å; L29-A57 HydrophobicContact CD2-CB 4.11Å; V38-A57 HydrophobicContact CG1-CB 3.82Å; V42-A57 HydrophobicContact CG2-CB 3.91Å; H53-A57 WeakPolarHBondContact O-CB 3.44Å; H53-A57 PolarHBondContact O-N 3.38Å; V54-A57 PolarHBondContact O-N 3.11Å; A57-R59 VanDerWaalsContact C-N 3.35Å; A57-R59 PolarHBondContact O-N 3.09Å; A57-M60 PolarHBondContact O-N 3.25Å; A57-L61 WeakPolarHBondContact O-CG 3.08Å; A57-L61 PolarHBondContact O-N 2.72Å; A57-L87 HydrophobicContact CB-CD1 4.44Å; A57-L87 HydrophobicContact CB-CD2 4.15Å
58	V	89.6	Confident	86.5	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.2	-42.3	179.3	172	0	0	0	0	111.3	V54 L61 W62 L87 V109 F110 L113	V54-V58 HydrophobicContact CG1-CG2 4.34Å; V54-V58 WeakPolarHBondContact O-CB 3.31Å; V54-V58 VanDerWaalsContact O-CG2 3.27Å; V54-V58 WeakPolarHBondContact O-CG2 3.33Å; V54-V58 PolarHBondContact O-N 2.75Å; V58-L61 PolarHBondContact O-N 2.79Å; V58-W62 PolarHBondContact O-N 3.1Å; V58-L87 HydrophobicContact CG2-CD1 4.31Å; V58-V109 HydrophobicContact CG1-CB 3.94Å; V58-V109 HydrophobicContact CG1-CG1 3.41Å; V58-V109 VanDerWaalsContact CG1-CG1 3.41Å; V58-V109 WeakPolarHBondContact O-CG1 3.38Å; V58-F110 HydrophobicContact CG1-CD1 4.41Å; V58-F110 HydrophobicContact CG1-CE1 4.14Å; V58-F110 HydrophobicContact CG1-CE2 4.35Å; V58-F110 HydrophobicContact CG1-CZ 4.11Å; V58-F110 HydrophobicContact CG2-CE1 3.95Å; V58-F110 HydrophobicContact CG2-CE2 4.45Å; V58-F110 HydrophobicContact CG2-CZ 3.66Å; V58-L113 HydrophobicContact CG1-CD1 4.45Å
59	R	89.9	Confident	86	Confident	131 Å²	131	47.5 Å²	47.5	49%	0.494	23%	0.228	S	C	.	.	H	α-helix	trans	-61.4	-46.5	175.4	178	-178.1	60.1	141.4	-0.4	111.9	S55 C56 A57 L61 W62 D63	S55-R59 WeakPolarHBondContact O-CB 3.35Å; S55-R59 PolarHBondContact O-N 3.01Å; C56-R59 PolarHBondContact O-N 3.09Å; A57-R59 VanDerWaalsContact C-N 3.35Å; A57-R59 PolarHBondContact O-N 3.09Å; R59-L61 PolarHBondContact O-N 3.42Å; R59-W62 PolarHBondContact O-N 2.94Å; R59-W62 VanDerWaalsContact O-N 3.13Å; R59-D63 WeakPolarHBondContact CG-OD2 3.43Å; R59-D63 PolarHBondContact O-N 2.89Å
60	M	88.8	Confident	85	Confident	21 Å²	21	54.2 Å²	54.2	10%	0.103	26%	0.26	C	S	.	.	H	α-helix	trans	-61.9	-42.2	179.7	-73.3	-175.1	66.5	0	0	112.3	L29 C32 V38 C56 A57 W62 D63 F64	L29-M60 HydrophobicContact CB-SD 4.28Å; L29-M60 WeakPolarHBondContact O-CE 3.3Å; C32-M60 HydrophobicContact CB-CE 3.96Å; V38-M60 HydrophobicContact CG2-CB 4.25Å; V38-M60 HydrophobicContact CG2-CE 4.09Å; C56-M60 VanDerWaalsContact O-CG 3.32Å; C56-M60 WeakPolarHBondContact O-CG 3.47Å; C56-M60 PolarHBondContact O-N 3.14Å; A57-M60 PolarHBondContact O-N 3.25Å; M60-W62 PolarHBondContact O-N 3.37Å; M60-D63 PolarHBondContact O-N 3.46Å; M60-D63 VanDerWaalsContact O-N 3.14Å; M60-F64 HydrophobicContact CB-CE2 4.34Å; M60-F64 HydrophobicContact CE-CE2 4.2Å; M60-F64 HydrophobicContact CE-CZ 3.69Å; M60-F64 VanDerWaalsContact O-CD2 3.26Å; M60-F64 WeakPolarHBondContact O-CD2 3.45Å; M60-F64 WeakPolarHBondContact O-CG 3.4Å; M60-F64 PolarHBondContact O-N 3.36Å
61	L	89.4	Confident	83.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-54.9	-42.6	174	-71.2	173.1	0	0	0	111.2	D35 V38 L39 A57 V58 R59 Q65 I78 F84 L87 L113	D35-L61 HydrophobicContact CB-CD2 3.96Å; V38-L61 HydrophobicContact CB-CD2 4.28Å; V38-L61 HydrophobicContact CG1-CD2 4.26Å; V38-L61 HydrophobicContact CG1-CG 4.17Å; L39-L61 HydrophobicContact CD1-CD2 4.35Å; L39-L61 HydrophobicContact CD2-CD1 4.17Å; L39-L61 HydrophobicContact CG-CD2 4.21Å; A57-L61 WeakPolarHBondContact O-CG 3.08Å; A57-L61 PolarHBondContact O-N 2.72Å; V58-L61 PolarHBondContact O-N 2.79Å; R59-L61 PolarHBondContact O-N 3.42Å; L61-Q65 VanDerWaalsContact O-CG 3.31Å; L61-Q65 WeakPolarHBondContact O-CG 3.46Å; L61-Q65 PolarHBondContact O-N 2.97Å; L61-I78 HydrophobicContact CB-CD1 4.48Å; L61-I78 HydrophobicContact CD1-CG2 4.23Å; L61-I78 HydrophobicContact CD2-CD1 4.35Å; L61-F84 HydrophobicContact CD1-CD2 4.13Å; L61-F84 HydrophobicContact CD1-CE2 4.39Å; L61-L87 HydrophobicContact CD1-CD1 3.86Å; L61-L113 HydrophobicContact CB-CD1 4.28Å
62	W	89.6	Confident	82.8	Confident	30 Å²	30	63.9 Å²	63.9	11%	0.114	31%	0.307	C	S	.	.	H	α-helix	trans	-73.6	-37.6	176.4	178.2	-111.8	0	0	0	113.9	V58 R59 M60 F64 Q65 K66 V109 R112 L113	V58-W62 PolarHBondContact O-N 3.1Å; R59-W62 PolarHBondContact O-N 2.94Å; R59-W62 VanDerWaalsContact O-N 3.13Å; M60-W62 PolarHBondContact O-N 3.37Å; W62-F64 VanDerWaalsContact C-N 3.3Å; W62-F64 PolarHBondContact O-N 3.33Å; W62-Q65 HydrophobicContact CE3-CB 4.03Å; W62-Q65 HydrophobicContact CZ3-CB 4.18Å; W62-Q65 PolarHBondContact O-N 3.34Å; W62-Q65 VanDerWaalsContact O-N 3.11Å; W62-K66 WeakPolarHBondContact O-CB 3.49Å; W62-K66 PolarHBondContact O-N 3.37Å; W62-V109 HydrophobicContact CB-CG1 3.5Å; W62-V109 HydrophobicContact CB-CG2 4.42Å; W62-V109 HydrophobicContact CG-CG1 4.11Å; W62-V109 HydrophobicContact CG-CG2 4.48Å; W62-R112 HydrophobicContact CD2-CB 3.83Å; W62-R112 HydrophobicContact CE3-CB 3.73Å; W62-R112 HydrophobicContact CH2-CB 3.71Å; W62-R112 HydrophobicContact CH2-CG 4.19Å; W62-R112 HydrophobicContact CZ2-CB 3.79Å; W62-R112 HydrophobicContact CZ2-CG 3.92Å; W62-R112 HydrophobicContact CZ3-CB 3.67Å; W62-R112 WeakPolarHBondContact CZ3-O 3.4Å; W62-L113 HydrophobicContact CE3-CD2 4.02Å; W62-L113 HydrophobicContact CE3-CG 4.43Å
63	D	86.5	Confident	82.5	Confident	62 Å²	62	61.3 Å²	61.3	33%	0.332	29%	0.291	S	S	.	.	H	α-helix	trans	-60.3	-41.2	177.2	-72.4	-26.5	0	0	0	111	R59 M60 Q65 K66 E67	R59-D63 WeakPolarHBondContact CG-OD2 3.43Å; R59-D63 PolarHBondContact O-N 2.89Å; M60-D63 PolarHBondContact O-N 3.46Å; M60-D63 VanDerWaalsContact O-N 3.14Å; D63-Q65 VanDerWaalsContact C-N 3.34Å; D63-Q65 PolarHBondContact O-N 3.22Å; D63-K66 WeakPolarHBondContact O-CB 3.46Å; D63-K66 PolarHBondContact O-N 3.09Å; D63-K66 VanDerWaalsContact O-N 3.12Å; D63-E67 PolarHBondContact O-N 2.88Å; D63-E67 VanDerWaalsContact O-N 3.08Å
64	F	86.8	Confident	82.1	Confident	25 Å²	25	62.9 Å²	62.9	11%	0.11	30%	0.301	C	S	.	.	H	α-helix	trans	-63.4	-36.3	173.4	-63.6	-36.9	0	0	0	113.4	C32 T34 D35 V38 M60 W62 K66 R68	C32-F64 WeakPolarHBondContact O-CZ 3.12Å; T34-F64 WeakPolarHBondContact O-CE2 3.09Å; D35-F64 WeakPolarHBondContact OD1-CB 3.42Å; V38-F64 HydrophobicContact CG2-CE2 3.74Å; V38-F64 HydrophobicContact CG2-CZ 4.49Å; M60-F64 HydrophobicContact CB-CE2 4.34Å; M60-F64 HydrophobicContact CE-CE2 4.2Å; M60-F64 HydrophobicContact CE-CZ 3.69Å; M60-F64 VanDerWaalsContact O-CD2 3.26Å; M60-F64 WeakPolarHBondContact O-CD2 3.45Å; M60-F64 WeakPolarHBondContact O-CG 3.4Å; M60-F64 PolarHBondContact O-N 3.36Å; W62-F64 VanDerWaalsContact C-N 3.3Å; W62-F64 PolarHBondContact O-N 3.33Å; F64-K66 VanDerWaalsContact C-N 3.31Å; F64-R68 WeakPolarHBondContact O-CG 3.18Å
65	Q	85.3	Confident	81.8	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-72	-28	174.5	-62.8	-53.7	-49	0	0	112.6	D35 L61 W62 D63 R68 R73 T74 V75 I78 L113	D35-Q65 PolarHBondContact OD1-NE2 3.15Å; D35-Q65 PolarHBondContact OD2-NE2 3.43Å; D35-Q65 VanDerWaalsContact OD2-NE2 3.13Å; L61-Q65 VanDerWaalsContact O-CG 3.31Å; L61-Q65 WeakPolarHBondContact O-CG 3.46Å; L61-Q65 PolarHBondContact O-N 2.97Å; W62-Q65 HydrophobicContact CE3-CB 4.03Å; W62-Q65 HydrophobicContact CZ3-CB 4.18Å; W62-Q65 PolarHBondContact O-N 3.34Å; W62-Q65 VanDerWaalsContact O-N 3.11Å; D63-Q65 VanDerWaalsContact C-N 3.34Å; D63-Q65 PolarHBondContact O-N 3.22Å; Q65-R68 PolarHBondContact O-N 3.3Å; Q65-R73 WeakPolarHBondContact O-CG 3.34Å; Q65-R73 PolarHBondContact O-NE 3.1Å; Q65-R73 VanDerWaalsContact O-NE 3.13Å; Q65-R73 VanDerWaalsContact OE1-CA 3.31Å; Q65-T74 PolarHBondContact NE2-OG1 3.46Å; Q65-T74 VanDerWaalsContact NE2-OG1 3.09Å; Q65-V75 HydrophobicContact CB-CG2 4.44Å; Q65-V75 HydrophobicContact CG-CG2 4.02Å; Q65-I78 HydrophobicContact CG-CD1 3.82Å; Q65-L113 HydrophobicContact CG-CD2 4.39Å
66	K	81.6	Confident	81.3	Confident	141 Å²	141	69 Å²	69	61%	0.613	33%	0.327	S	S	*	.	H	α-helix	trans	-74.6	-32.1	178.7	-171.3	-177.3	170.2	-169.5	0	112.4	W62 D63 F64 R68	W62-K66 WeakPolarHBondContact O-CB 3.49Å; W62-K66 PolarHBondContact O-N 3.37Å; D63-K66 WeakPolarHBondContact O-CB 3.46Å; D63-K66 PolarHBondContact O-N 3.09Å; D63-K66 VanDerWaalsContact O-N 3.12Å; F64-K66 VanDerWaalsContact C-N 3.31Å; K66-R68 PolarHBondContact O-N 2.86Å
67	E	81	Confident	80.8	Confident	160 Å²	160	74.2 Å²	74.2	75%	0.748	35%	0.354	S	S	*	.	H	α-helix	trans	-69.3	-21.2	174.2	-71	-177.2	172.3	0	0	112.8	D63	D63-E67 PolarHBondContact O-N 2.88Å; D63-E67 VanDerWaalsContact O-N 3.08Å
68	R	76.8	Confident	80.5	Confident	78 Å²	78	74.4 Å²	74.4	29%	0.294	36%	0.355	S	S	.	.	S	Bend	trans	-87.2	142.2	178.2	-63.2	-179.8	-166.3	171.3	15.1	111.8	D35 F64 Q65 K66 L72 R73 T74	D35-R68 IonicContact OD2-CZ 3.38Å; D35-R68 IonicContact OD2-NH1 3.34Å; D35-R68 IonicContact OD2-NH2 3.26Å; D35-R68 PolarHBondContact OD2-NH2 3.03Å; F64-R68 WeakPolarHBondContact O-CG 3.18Å; Q65-R68 PolarHBondContact O-N 3.3Å; K66-R68 PolarHBondContact O-N 2.86Å; R68-L72 HydrophobicContact CB-CB 4.49Å; R68-R73 HydrophobicContact CB-CG 4.45Å; R68-T74 VanDerWaalsContact NH1-CG2 3.3Å; R68-T74 PolarHBondContact NH1-OG1 3.25Å
69	P	69.9	Low	80.2	Confident	83 Å²	83	77.8 Å²	77.8	54%	0.539	37%	0.37	S	S	.	.			trans	-52.5	146.4	164.6	-24.5	33.6	0	0	0	111	L71 L72 R73	P69-L71 VanDerWaalsContact C-N 3.25Å; P69-L71 PolarHBondContact O-N 2.9Å; P69-L71 VanDerWaalsContact O-N 3.14Å; P69-L72 HydrophobicContact CB-CD1 4.37Å; P69-L72 HydrophobicContact CB-CG 4.43Å; P69-L72 HydrophobicContact CG-CD1 4.01Å; P69-L72 WeakPolarHBondContact O-CA 3.46Å; P69-L72 PolarHBondContact O-N 3.39Å; P69-R73 PolarHBondContact O-N 3.42Å
70	E	63.6	Low	79.8	Confident	149 Å²	149	75.7 Å²	75.7	70%	0.696	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-55.8	-37.8	-171.2	-173.2	155.4	-132.5	0	0	113.7	L72 R73	E70-L72 VanDerWaalsContact C-N 3.27Å; E70-L72 PolarHBondContact O-N 3.19Å; E70-R73 WeakPolarHBondContact O-CB 3.41Å; E70-R73 PolarHBondContact O-N 3.03Å; E70-R73 IonicContact OE1-NH1 2.63Å; E70-R73 PolarHBondContact OE1-NH1 2.97Å
71	L	58.5	Low	79.7	Confident	173 Å²	173	76.9 Å²	76.9	91%	0.906	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-67.9	-21.5	176.1	-69.9	164.2	0	0	0	114.2	P69	P69-L71 VanDerWaalsContact C-N 3.25Å; P69-L71 PolarHBondContact O-N 2.9Å; P69-L71 VanDerWaalsContact O-N 3.14Å
72	L	69.8	Low	79.5	Confident	115 Å²	115	81.2 Å²	81.2	60%	0.602	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-101.2	5.1	-178.6	-61.3	-179.7	0	0	0	112.6	R68 P69 E70 T74	R68-L72 HydrophobicContact CB-CB 4.49Å; P69-L72 HydrophobicContact CB-CD1 4.37Å; P69-L72 HydrophobicContact CB-CG 4.43Å; P69-L72 HydrophobicContact CG-CD1 4.01Å; P69-L72 WeakPolarHBondContact O-CA 3.46Å; P69-L72 PolarHBondContact O-N 3.39Å; E70-L72 VanDerWaalsContact C-N 3.27Å; E70-L72 PolarHBondContact O-N 3.19Å; L72-T74 PolarHBondContact O-N 2.89Å
73	R	79.4	Confident	79.4	Confident	83 Å²	83	80.8 Å²	80.8	31%	0.313	41%	0.407	S	S	.	.			trans	-68.2	131.3	176.4	-71.7	-176.1	-178.8	150.3	7.2	110.2	Q65 R68 P69 E70 V75	Q65-R73 WeakPolarHBondContact O-CG 3.34Å; Q65-R73 PolarHBondContact O-NE 3.1Å; Q65-R73 VanDerWaalsContact O-NE 3.13Å; Q65-R73 VanDerWaalsContact OE1-CA 3.31Å; R68-R73 HydrophobicContact CB-CG 4.45Å; P69-R73 PolarHBondContact O-N 3.42Å; E70-R73 WeakPolarHBondContact O-CB 3.41Å; E70-R73 PolarHBondContact O-N 3.03Å; E70-R73 IonicContact OE1-NH1 2.63Å; E70-R73 PolarHBondContact OE1-NH1 2.97Å; R73-V75 HydrophobicContact CB-CG2 4.3Å
74	T	81	Confident	79.6	Confident	35 Å²	35	77.9 Å²	77.9	22%	0.215	39%	0.391	C	S	.	.			trans	-105.1	33.4	-178.9	60.4	0	0	0	0	112	Q65 R68 L72 H76 L77 I78	Q65-T74 PolarHBondContact NE2-OG1 3.46Å; Q65-T74 VanDerWaalsContact NE2-OG1 3.09Å; R68-T74 VanDerWaalsContact NH1-CG2 3.3Å; R68-T74 PolarHBondContact NH1-OG1 3.25Å; L72-T74 PolarHBondContact O-N 2.89Å; T74-H76 PolarHBondContact O-N 2.86Å; T74-H76 VanDerWaalsContact O-N 3.15Å; T74-L77 HydrophobicContact CG2-CD1 3.96Å; T74-L77 WeakPolarHBondContact O-CB 3.45Å; T74-L77 PolarHBondContact O-N 3.45Å; T74-I78 PolarHBondContact O-N 3.43Å
75	V	81.9	Confident	79.5	Confident	17 Å²	17	81.3 Å²	81.3	10%	0.103	41%	0.41	C	S	.	.	H	α-helix	trans	-55.1	-35.3	-179.8	177.1	0	0	0	0	111.6	Q65 R73 L77 I78 K79 L113	Q65-V75 HydrophobicContact CB-CG2 4.44Å; Q65-V75 HydrophobicContact CG-CG2 4.02Å; R73-V75 HydrophobicContact CB-CG2 4.3Å; V75-L77 VanDerWaalsContact C-N 3.34Å; V75-L77 PolarHBondContact O-N 3.47Å; V75-I78 PolarHBondContact O-N 2.98Å; V75-K79 PolarHBondContact O-N 3.05Å; V75-L113 VanDerWaalsContact CG1-C 3.41Å; V75-L113 HydrophobicContact CG1-CB 4.49Å; V75-L113 VanDerWaalsContact CG1-O 3.29Å; V75-L113 WeakPolarHBondContact CG1-O 3.29Å
76	H	78.9	Confident	79.6	Confident	136 Å²	136	82.7 Å²	82.7	63%	0.63	42%	0.419	S	S	*	.	H	α-helix	trans	-63	-38	175.9	-173	60	0	0	0	112.9	T74 K79 C80	T74-H76 PolarHBondContact O-N 2.86Å; T74-H76 VanDerWaalsContact O-N 3.15Å; H76-K79 PolarHBondContact O-N 3.34Å; H76-C80 PolarHBondContact O-N 3.43Å; H76-C80 VanDerWaalsContact O-N 3.08Å; H76-C80 PolarHBondContact O-SG 2.97Å
77	L	79.4	Confident	80	Confident	120 Å²	120	76 Å²	76	63%	0.628	39%	0.39	S	S	*	.	H	α-helix	trans	-67.1	-39	177.3	-63.8	180	0	0	0	111.2	T74 V75 C80 H81	T74-L77 HydrophobicContact CG2-CD1 3.96Å; T74-L77 WeakPolarHBondContact O-CB 3.45Å; T74-L77 PolarHBondContact O-N 3.45Å; V75-L77 VanDerWaalsContact C-N 3.34Å; V75-L77 PolarHBondContact O-N 3.47Å; L77-C80 PolarHBondContact O-N 2.98Å; L77-H81 PolarHBondContact O-N 2.92Å
78	I	83.6	Confident	80.4	Confident	3 Å²	3	70.5 Å²	70.5	2%	0.015	36%	0.362	C	S	.	.	H	α-helix	trans	-62.5	-46.4	173	-61.8	171.4	0	0	0	110.3	D35 L61 Q65 T74 V75 C80 H81 F84 L113	D35-I78 HydrophobicContact CB-CD1 4.41Å; D35-I78 HydrophobicContact CB-CG1 4.3Å; L61-I78 HydrophobicContact CB-CD1 4.48Å; L61-I78 HydrophobicContact CD1-CG2 4.23Å; L61-I78 HydrophobicContact CD2-CD1 4.35Å; Q65-I78 HydrophobicContact CG-CD1 3.82Å; T74-I78 PolarHBondContact O-N 3.43Å; V75-I78 PolarHBondContact O-N 2.98Å; I78-C80 VanDerWaalsContact C-N 3.25Å; I78-C80 PolarHBondContact O-N 3.38Å; I78-H81 WeakPolarHBondContact O-CB 3.22Å; I78-H81 PolarHBondContact O-N 3.42Å; I78-H81 VanDerWaalsContact O-N 3.09Å; I78-F84 HydrophobicContact CG2-CB 4.4Å; I78-F84 HydrophobicContact CG2-CD1 4.44Å; I78-F84 HydrophobicContact CG2-CD2 3.58Å; I78-F84 HydrophobicContact CG2-CE2 3.88Å; I78-F84 HydrophobicContact CG2-CG 3.89Å; I78-F84 HydrophobicContact CG2-CZ 4.42Å; I78-F84 WeakPolarHBondContact O-CB 3.27Å; I78-F84 WeakPolarHBondContact O-CG 3.2Å; I78-L113 HydrophobicContact CD1-CD2 4.21Å
79	K	82.5	Confident	81	Confident	72 Å²	72	69.9 Å²	69.9	31%	0.313	37%	0.367	S	S	.	.	H	α-helix	trans	-59.4	-35.7	-179.6	-172.3	174.3	178.2	171.5	0	112.4	V75 H76 S114 E116	V75-K79 PolarHBondContact O-N 3.05Å; H76-K79 PolarHBondContact O-N 3.34Å; K79-S114 PolarHBondContact NZ-O 2.83Å; K79-E116 IonicContact NZ-OE1 3.84Å; K79-E116 PolarHBondContact NZ-OE1 2.98Å
80	C	82.4	Confident	81.9	Confident	86 Å²	86	67.3 Å²	67.3	58%	0.581	35%	0.348	S	S	*	.	H	α-helix	trans	-82.4	-9.6	179.7	-66.5	0	0	0	0	113.9	H76 L77 I78	H76-C80 PolarHBondContact O-N 3.43Å; H76-C80 VanDerWaalsContact O-N 3.08Å; H76-C80 PolarHBondContact O-SG 2.97Å; L77-C80 PolarHBondContact O-N 2.98Å; I78-C80 VanDerWaalsContact C-N 3.25Å; I78-C80 PolarHBondContact O-N 3.38Å
81	H	86.2	Confident	83.1	Confident	47 Å²	47	60.2 Å²	60.2	22%	0.218	32%	0.315	C	S	.	.			trans	-76.5	132.8	-177.7	-165.5	-83.6	0	0	0	111.7	L39 L77 I78 E83 F84	L39-H81 HydrophobicContact CD1-CB 3.94Å; L77-H81 PolarHBondContact O-N 2.92Å; I78-H81 WeakPolarHBondContact O-CB 3.22Å; I78-H81 PolarHBondContact O-N 3.42Å; I78-H81 VanDerWaalsContact O-N 3.09Å; H81-E83 VanDerWaalsContact C-N 3.3Å; H81-E83 PolarHBondContact ND1-N 3.35Å; H81-E83 VanDerWaalsContact ND1-N 3.15Å; H81-E83 PolarHBondContact O-N 3.3Å; H81-F84 HydrophobicContact CB-CB 4.45Å; H81-F84 WeakPolarHBondContact O-CB 3.33Å; H81-F84 PolarHBondContact O-N 3.38Å
82	P	85.1	Confident	84.7	Confident	90 Å²	90	53.7 Å²	53.7	58%	0.584	28%	0.28	S	S	*	.	H	α-helix	trans	-60.4	-36.8	-176.2	22.3	-33.5	0	0	0	113.2	F84 L85 T86	P82-F84 PolarHBondContact O-N 3.26Å; P82-L85 WeakPolarHBondContact O-CB 3.27Å; P82-L85 PolarHBondContact O-N 2.63Å; P82-T86 PolarHBondContact O-N 3.27Å; P82-T86 PolarHBondContact O-OG1 3.09Å
83	E	88.1	Confident	85.7	Confident	21 Å²	21	53.8 Å²	53.8	10%	0.098	28%	0.281	C	S	.	.	H	α-helix	trans	-73.1	-15.3	178.8	-55.8	-63.1	-174.8	0	0	114.2	L39 V42 G43 R46 H81 T86 L87	L39-E83 HydrophobicContact CB-CB 4.22Å; L39-E83 HydrophobicContact CD2-CB 4.07Å; V42-E83 HydrophobicContact CG1-CB 4.48Å; G43-E83 VanDerWaalsContact CA-CD 3.49Å; G43-E83 VanDerWaalsContact CA-OE1 3.28Å; G43-E83 WeakPolarHBondContact CA-OE1 2.91Å; R46-E83 IonicContact CZ-OE1 2.75Å; R46-E83 IonicContact CZ-OE2 2.81Å; R46-E83 IonicContact NE-OE1 2.74Å; R46-E83 PolarHBondContact NE-OE1 2.59Å; R46-E83 IonicContact NE-OE2 2.85Å; R46-E83 PolarHBondContact NE-OE2 3.48Å; R46-E83 VanDerWaalsContact NE-OE2 3.09Å; R46-E83 IonicContact NH2-OE1 3.74Å; R46-E83 PolarHBondContact NH2-OE1 2.8Å; R46-E83 IonicContact NH2-OE2 3.76Å; R46-E83 PolarHBondContact NH2-OE2 3.09Å; H81-E83 VanDerWaalsContact C-N 3.3Å; H81-E83 PolarHBondContact ND1-N 3.35Å; H81-E83 VanDerWaalsContact ND1-N 3.15Å; H81-E83 PolarHBondContact O-N 3.3Å; E83-T86 WeakPolarHBondContact O-CB 3.36Å; E83-T86 PolarHBondContact O-N 2.78Å; E83-T86 WeakPolarHBondContact OE2-CB 3.43Å; E83-T86 PolarHBondContact OE2-OG1 3.25Å; E83-L87 PolarHBondContact O-N 3.3Å
84	F	88.9	Confident	86.2	Confident	1 Å²	1	51.8 Å²	51.8	0%	0.004	28%	0.275	C	S	.	.	H	α-helix	trans	-71.9	-35.7	170.6	-173.7	-112.4	0	0	0	111	L39 L61 I78 H81 P82 T86 L87 R88 F110 L113 V115	L39-F84 HydrophobicContact CD2-CB 4.32Å; L61-F84 HydrophobicContact CD1-CD2 4.13Å; L61-F84 HydrophobicContact CD1-CE2 4.39Å; I78-F84 HydrophobicContact CG2-CB 4.4Å; I78-F84 HydrophobicContact CG2-CD1 4.44Å; I78-F84 HydrophobicContact CG2-CD2 3.58Å; I78-F84 HydrophobicContact CG2-CE2 3.88Å; I78-F84 HydrophobicContact CG2-CG 3.89Å; I78-F84 HydrophobicContact CG2-CZ 4.42Å; I78-F84 WeakPolarHBondContact O-CB 3.27Å; I78-F84 WeakPolarHBondContact O-CG 3.2Å; H81-F84 HydrophobicContact CB-CB 4.45Å; H81-F84 WeakPolarHBondContact O-CB 3.33Å; H81-F84 PolarHBondContact O-N 3.38Å; P82-F84 PolarHBondContact O-N 3.26Å; F84-T86 VanDerWaalsContact C-N 3.32Å; F84-L87 HydrophobicContact CD2-CD1 4.48Å; F84-L87 PolarHBondContact O-N 3.47Å; F84-R88 HydrophobicContact CE1-CG 4.32Å; F84-R88 WeakPolarHBondContact O-CG 3.43Å; F84-R88 PolarHBondContact O-N 2.87Å; F84-F110 HydrophobicContact CE2-CE1 4.36Å; F84-F110 HydrophobicContact CZ-CD1 4.26Å; F84-F110 HydrophobicContact CZ-CE1 4.43Å; F84-L113 HydrophobicContact CE2-CD1 3.83Å; F84-L113 HydrophobicContact CZ-CB 4.06Å; F84-L113 HydrophobicContact CZ-CD1 4.13Å; F84-V115 HydrophobicContact CE1-CG2 4.06Å; F84-V115 HydrophobicContact CZ-CG2 4.02Å
85	L	86.5	Confident	86.8	Confident	97 Å²	97	50.6 Å²	50.6	51%	0.508	27%	0.267	S	S	.	.	H	α-helix	trans	-62.5	-41.7	169.2	-177.2	65.5	0	0	0	110.8	P82 L87 R88 V89	P82-L85 WeakPolarHBondContact O-CB 3.27Å; P82-L85 PolarHBondContact O-N 2.63Å; L85-L87 VanDerWaalsContact C-N 3.34Å; L85-L87 PolarHBondContact O-N 2.93Å; L85-R88 WeakPolarHBondContact O-CB 3.38Å; L85-R88 PolarHBondContact O-N 3.31Å; L85-V89 WeakPolarHBondContact O-CG2 3.47Å; L85-V89 PolarHBondContact O-N 3.44Å
86	T	86.6	Confident	87.1	Confident	30 Å²	30	53.9 Å²	53.9	18%	0.184	29%	0.291	C	S	.	.	H	α-helix	trans	-57	-46.6	173.9	-51.3	0	0	0	0	111.4	R46 P82 E83 F84 R88 V89 L90	R46-T86 HydrophobicContact CG-CG2 4.1Å; P82-T86 PolarHBondContact O-N 3.27Å; P82-T86 PolarHBondContact O-OG1 3.09Å; E83-T86 WeakPolarHBondContact O-CB 3.36Å; E83-T86 PolarHBondContact O-N 2.78Å; E83-T86 WeakPolarHBondContact OE2-CB 3.43Å; E83-T86 PolarHBondContact OE2-OG1 3.25Å; F84-T86 VanDerWaalsContact C-N 3.32Å; T86-R88 VanDerWaalsContact C-N 3.32Å; T86-R88 PolarHBondContact O-N 3.03Å; T86-V89 PolarHBondContact O-N 3.27Å; T86-L90 HydrophobicContact CG2-CD1 3.86Å; T86-L90 HydrophobicContact CG2-CG 4.31Å; T86-L90 WeakPolarHBondContact O-CB 3.32Å; T86-L90 VanDerWaalsContact O-CG 3.23Å; T86-L90 WeakPolarHBondContact O-CG 3.39Å; T86-L90 PolarHBondContact O-N 3.32Å
87	L	89.1	Confident	87.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60	-41.2	176.1	-77.1	172.7	0	0	0	112.6	L39 V42 V54 A57 V58 L61 E83 F84 L85 L90 A91	L39-L87 HydrophobicContact CD2-CD1 4.07Å; V42-L87 HydrophobicContact CB-CD2 4.48Å; V42-L87 HydrophobicContact CG1-CD2 3.79Å; V42-L87 HydrophobicContact CG1-CG 3.86Å; V42-L87 HydrophobicContact CG2-CD1 4.31Å; V42-L87 HydrophobicContact CG2-CD2 3.81Å; V42-L87 HydrophobicContact CG2-CG 4.27Å; V54-L87 HydrophobicContact CG1-CD2 4.27Å; A57-L87 HydrophobicContact CB-CD1 4.44Å; A57-L87 HydrophobicContact CB-CD2 4.15Å; V58-L87 HydrophobicContact CG2-CD1 4.31Å; L61-L87 HydrophobicContact CD1-CD1 3.86Å; E83-L87 PolarHBondContact O-N 3.3Å; F84-L87 HydrophobicContact CD2-CD1 4.48Å; F84-L87 PolarHBondContact O-N 3.47Å; L85-L87 VanDerWaalsContact C-N 3.34Å; L85-L87 PolarHBondContact O-N 2.93Å; L87-L90 PolarHBondContact O-N 3.48Å; L87-A91 VanDerWaalsContact O-CB 3.27Å; L87-A91 WeakPolarHBondContact O-CB 3.3Å; L87-A91 PolarHBondContact O-N 3.44Å
88	R	90.9	Very high	88.3	Confident	44 Å²	44	48 Å²	48	17%	0.166	26%	0.263	C	S	.	.	H	α-helix	trans	-63.3	-49.5	178.5	-72.5	171.7	56.7	-161.2	-11.3	111.8	F84 L85 T86 L90 A91 E92 F110 D119 L121	F84-R88 HydrophobicContact CE1-CG 4.32Å; F84-R88 WeakPolarHBondContact O-CG 3.43Å; F84-R88 PolarHBondContact O-N 2.87Å; L85-R88 WeakPolarHBondContact O-CB 3.38Å; L85-R88 PolarHBondContact O-N 3.31Å; T86-R88 VanDerWaalsContact C-N 3.32Å; T86-R88 PolarHBondContact O-N 3.03Å; R88-L90 VanDerWaalsContact C-N 3.34Å; R88-L90 PolarHBondContact O-N 3.46Å; R88-A91 PolarHBondContact O-N 3.33Å; R88-E92 WeakPolarHBondContact O-CB 3.48Å; R88-E92 PolarHBondContact O-N 3.38Å; R88-F110 HydrophobicContact CG-CD1 4.4Å; R88-F110 HydrophobicContact CG-CE1 3.93Å; R88-D119 IonicContact CZ-OD1 2.84Å; R88-D119 IonicContact CZ-OD2 3.94Å; R88-D119 IonicContact NE-OD1 2.78Å; R88-D119 IonicContact NH2-OD1 3.17Å; R88-D119 PolarHBondContact NH2-OD1 3.39Å; R88-D119 IonicContact NH2-OD2 3.82Å; R88-D119 PolarHBondContact NH2-OD2 2.72Å; R88-L121 HydrophobicContact CB-CD2 3.95Å; R88-L121 HydrophobicContact CG-CD2 3.95Å
89	V	88.6	Confident	88.7	Confident	66 Å²	66	52.1 Å²	52.1	40%	0.4	29%	0.286	S	S	.	.	H	α-helix	trans	-63.4	-40.9	178	174.7	0	0	0	0	111.2	L85 T86 A91 E92 N93	L85-V89 WeakPolarHBondContact O-CG2 3.47Å; L85-V89 PolarHBondContact O-N 3.44Å; T86-V89 PolarHBondContact O-N 3.27Å; V89-A91 VanDerWaalsContact C-N 3.35Å; V89-E92 PolarHBondContact O-N 3.27Å; V89-N93 WeakPolarHBondContact O-CB 3.4Å; V89-N93 VanDerWaalsContact O-CG 3.3Å; V89-N93 PolarHBondContact O-N 3.37Å; V89-N93 PolarHBondContact O-ND2 3.11Å
90	L	87.9	Confident	89.2	Confident	28 Å²	28	50.7 Å²	50.7	15%	0.147	28%	0.281	C	S	.	.	H	α-helix	trans	-67.7	-34.6	177.2	-72.6	174.7	0	0	0	112.8	L49 V54 T86 L87 R88 K94	L49-L90 HydrophobicContact CB-CD1 4.32Å; L49-L90 HydrophobicContact CD1-CD1 3.6Å; V54-L90 HydrophobicContact CG2-CB 4.2Å; T86-L90 HydrophobicContact CG2-CD1 3.86Å; T86-L90 HydrophobicContact CG2-CG 4.31Å; T86-L90 WeakPolarHBondContact O-CB 3.32Å; T86-L90 VanDerWaalsContact O-CG 3.23Å; T86-L90 WeakPolarHBondContact O-CG 3.39Å; T86-L90 PolarHBondContact O-N 3.32Å; L87-L90 PolarHBondContact O-N 3.48Å; R88-L90 VanDerWaalsContact C-N 3.34Å; R88-L90 PolarHBondContact O-N 3.46Å; L90-K94 WeakPolarHBondContact O-CB 3.28Å; L90-K94 VanDerWaalsContact O-CG 3.26Å; L90-K94 WeakPolarHBondContact O-CG 3.38Å
91	A	90.5	Very high	89.6	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-67	-47.6	172.9	0	0	0	0	0	110.4	V54 L87 R88 V89 N93 K94 I95 M98 F110 L121	V54-A91 HydrophobicContact CG1-CB 3.99Å; L87-A91 VanDerWaalsContact O-CB 3.27Å; L87-A91 WeakPolarHBondContact O-CB 3.3Å; L87-A91 PolarHBondContact O-N 3.44Å; R88-A91 PolarHBondContact O-N 3.33Å; V89-A91 VanDerWaalsContact C-N 3.35Å; A91-N93 PolarHBondContact O-N 2.82Å; A91-K94 CarbonylContact O-C 3.19Å; A91-K94 PolarHBondContact O-N 3.44Å; A91-I95 WeakPolarHBondContact O-CG1 3.45Å; A91-I95 PolarHBondContact O-N 3.27Å; A91-M98 HydrophobicContact CB-CE 4.35Å; A91-M98 WeakPolarHBondContact O-CE 3.38Å; A91-F110 HydrophobicContact CB-CE2 3.8Å; A91-F110 HydrophobicContact CB-CZ 3.77Å; A91-L121 HydrophobicContact CB-CD1 3.92Å
92	E	91.8	Very high	89.9	Confident	36 Å²	36	49.3 Å²	49.3	17%	0.168	27%	0.271	C	S	.	.	H	α-helix	trans	-57.2	-48.9	-179.3	-166.8	170.3	175.5	0	0	111.5	R88 V89 K94 I95 S120 L121 Q124	R88-E92 WeakPolarHBondContact O-CB 3.48Å; R88-E92 PolarHBondContact O-N 3.38Å; V89-E92 PolarHBondContact O-N 3.27Å; E92-K94 PolarHBondContact O-N 3.36Å; E92-K94 VanDerWaalsContact O-N 3.09Å; E92-I95 HydrophobicContact CG-CD1 4.42Å; E92-I95 WeakPolarHBondContact O-CG1 3.43Å; E92-I95 PolarHBondContact O-N 3.43Å; E92-S120 WeakPolarHBondContact OE1-CB 3.37Å; E92-S120 PolarHBondContact OE1-OG 2.84Å; E92-S120 PolarHBondContact OE2-OG 3.17Å; E92-S120 VanDerWaalsContact OE2-OG 3.09Å; E92-L121 HydrophobicContact CB-CB 4.46Å; E92-L121 HydrophobicContact CB-CD1 3.8Å; E92-L121 HydrophobicContact CG-CD1 4.42Å; E92-Q124 PolarHBondContact OE1-NE2 3.19Å
93	N	90.1	Very high	90.3	Very high	117 Å²	117	45 Å²	45	63%	0.626	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-15.1	179	-70.2	-28.7	0	0	0	114.3	V89 A91	V89-N93 WeakPolarHBondContact O-CB 3.4Å; V89-N93 VanDerWaalsContact O-CG 3.3Å; V89-N93 PolarHBondContact O-N 3.37Å; V89-N93 PolarHBondContact O-ND2 3.11Å; A91-N93 PolarHBondContact O-N 2.82Å
94	K	91.1	Very high	90.6	Very high	41 Å²	41	44.1 Å²	44.1	18%	0.178	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.2	7.2	-175.6	-67.2	-171.5	-178.8	85.8	0	113.8	L49 V51 L90 A91 E92 S96 L97 M98	L49-K94 WeakPolarHBondContact O-CE 3.23Å; L49-K94 PolarHBondContact O-NZ 3.11Å; V51-K94 HydrophobicContact CG2-CB 4.04Å; V51-K94 HydrophobicContact CG2-CD 3.98Å; L90-K94 WeakPolarHBondContact O-CB 3.28Å; L90-K94 VanDerWaalsContact O-CG 3.26Å; L90-K94 WeakPolarHBondContact O-CG 3.38Å; A91-K94 CarbonylContact O-C 3.19Å; A91-K94 PolarHBondContact O-N 3.44Å; E92-K94 PolarHBondContact O-N 3.36Å; E92-K94 VanDerWaalsContact O-N 3.09Å; K94-S96 VanDerWaalsContact C-N 3.27Å; K94-S96 PolarHBondContact O-N 3.01Å; K94-L97 WeakPolarHBondContact O-CB 3.2Å; K94-L97 PolarHBondContact O-N 3.31Å; K94-M98 HydrophobicContact CB-CE 4.31Å; K94-M98 PolarHBondContact O-N 3.39Å
95	I	91.8	Very high	90.7	Very high	11 Å²	11	46.2 Å²	46.2	6%	0.056	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-53.2	-43.6	-176.6	-70.6	170.2	0	0	0	112.2	A91 E92 L97 M98 L103 L121 Q124 M125 E128	A91-I95 WeakPolarHBondContact O-CG1 3.45Å; A91-I95 PolarHBondContact O-N 3.27Å; E92-I95 HydrophobicContact CG-CD1 4.42Å; E92-I95 WeakPolarHBondContact O-CG1 3.43Å; E92-I95 PolarHBondContact O-N 3.43Å; I95-L97 PolarHBondContact O-N 2.73Å; I95-M98 HydrophobicContact CG1-CE 4.22Å; I95-M98 HydrophobicContact CG1-SD 4.42Å; I95-M98 PolarHBondContact O-N 3.23Å; I95-L103 HydrophobicContact CG2-CD1 4.04Å; I95-L121 HydrophobicContact CD1-CD1 4.33Å; I95-Q124 HydrophobicContact CD1-CB 3.55Å; I95-M125 HydrophobicContact CD1-CG 3.59Å; I95-M125 HydrophobicContact CG1-CG 3.87Å; I95-E128 HydrophobicContact CG2-CB 3.64Å; I95-E128 HydrophobicContact CG2-CG 3.74Å
96	S	89.4	Confident	91	Very high	86 Å²	86	41.7 Å²	41.7	60%	0.601	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-62.7	-25.7	-179.6	56.8	0	0	0	0	113.7	K94 R132	K94-S96 VanDerWaalsContact C-N 3.27Å; K94-S96 PolarHBondContact O-N 3.01Å; S96-R132 PolarHBondContact O-NH2 3.39Å
97	L	90.7	Very high	91.3	Very high	125 Å²	125	40.3 Å²	40.3	65%	0.654	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-90	-7.6	-177.9	-57.5	176.1	0	0	0	113.4	V51 K94 I95	V51-L97 HydrophobicContact CG2-CB 3.94Å; K94-L97 WeakPolarHBondContact O-CB 3.2Å; K94-L97 PolarHBondContact O-N 3.31Å; I95-L97 PolarHBondContact O-N 2.73Å
98	M	92.8	Very high	91.4	Very high	6 Å²	6	43.5 Å²	43.5	3%	0.03	23%	0.23	C	C	.	.			trans	-76.9	143	-179.5	-62.3	168.6	-172.6	0	0	110.8	V51 A91 K94 I95 L103 M106 M125 R132	V51-M98 HydrophobicContact CG1-CB 4.44Å; V51-M98 HydrophobicContact CG1-CG 3.74Å; A91-M98 HydrophobicContact CB-CE 4.35Å; A91-M98 WeakPolarHBondContact O-CE 3.38Å; K94-M98 HydrophobicContact CB-CE 4.31Å; K94-M98 PolarHBondContact O-N 3.39Å; I95-M98 HydrophobicContact CG1-CE 4.22Å; I95-M98 HydrophobicContact CG1-SD 4.42Å; I95-M98 PolarHBondContact O-N 3.23Å; M98-L103 HydrophobicContact CB-CB 4.17Å; M98-L103 HydrophobicContact SD-CD1 4.06Å; M98-M106 HydrophobicContact CE-CE 3.18Å; M98-M106 HydrophobicContact CE-SD 4.39Å; M98-M106 HydrophobicContact CG-CE 3.81Å; M98-M106 HydrophobicContact SD-CE 3.09Å; M98-M106 WeakPolarHBondContact SD-CE 3.27Å; M98-M125 HydrophobicContact SD-CE 4.29Å; M98-R132 PolarHBondContact O-NH1 2.67Å
99	D	92.7	Very high	91.4	Very high	90 Å²	90	42 Å²	42	48%	0.481	23%	0.226	S	C	.	.			trans	-75.4	167.4	163.7	76	-5.8	0	0	0	110.8	L101 T102 L103	D99-L101 VanDerWaalsContact C-N 3.28Å; D99-L101 PolarHBondContact O-N 2.95Å; D99-T102 PolarHBondContact O-N 3.03Å; D99-T102 WeakPolarHBondContact OD1-CA 3.36Å; D99-T102 WeakPolarHBondContact OD1-CB 3.32Å; D99-T102 PolarHBondContact OD1-N 3.4Å; D99-T102 PolarHBondContact OD1-OG1 3.39Å; D99-L103 VanDerWaalsContact O-CB 3.31Å; D99-L103 WeakPolarHBondContact O-CB 3.34Å; D99-L103 PolarHBondContact O-N 2.63Å
100	D	91.8	Very high	91.5	Very high	42 Å²	42	38.9 Å²	38.9	23%	0.225	21%	0.207	C	C	.	.	H	α-helix	trans	-62.7	-35.1	-173.1	-67.8	-10.8	0	0	0	113	V104 R132 L136	D100-V104 WeakPolarHBondContact O-CG2 3.39Å; D100-V104 PolarHBondContact O-N 2.88Å; D100-R132 VanDerWaalsContact OD1-CD 3.29Å; D100-R132 WeakPolarHBondContact OD1-CD 3.5Å; D100-R132 IonicContact OD1-NH1 3.75Å; D100-R132 PolarHBondContact OD1-NH1 3.02Å; D100-L136 HydrophobicContact CB-CD2 3.61Å
101	L	90.8	Very high	91.5	Very high	78 Å²	78	39.4 Å²	39.4	41%	0.408	21%	0.21	S	C	.	.	H	α-helix	trans	-71.1	-44.7	179.1	-179.3	63.2	0	0	0	111.1	D99 N105	D99-L101 VanDerWaalsContact C-N 3.28Å; D99-L101 PolarHBondContact O-N 2.95Å; L101-N105 WeakPolarHBondContact CD1-ND2 3.22Å; L101-N105 WeakPolarHBondContact CG-ND2 3.42Å; L101-N105 VanDerWaalsContact O-CB 3.22Å; L101-N105 WeakPolarHBondContact O-CB 3.21Å; L101-N105 PolarHBondContact O-N 3.02Å; L101-N105 PolarHBondContact O-ND2 2.88Å; L101-N105 VanDerWaalsContact O-ND2 3.1Å
102	T	92.4	Very high	91.4	Very high	27 Å²	27	43.8 Å²	43.8	17%	0.166	23%	0.226	C	C	.	.	H	α-helix	trans	-68.7	-41.3	-179	-58.8	0	0	0	0	111	V51 D99 N105 M106	V51-T102 HydrophobicContact CG1-CG2 3.89Å; D99-T102 PolarHBondContact O-N 3.03Å; D99-T102 WeakPolarHBondContact OD1-CA 3.36Å; D99-T102 WeakPolarHBondContact OD1-CB 3.32Å; D99-T102 PolarHBondContact OD1-N 3.4Å; D99-T102 PolarHBondContact OD1-OG1 3.39Å; T102-N105 PolarHBondContact O-N 2.92Å; T102-M106 HydrophobicContact CG2-CE 3.48Å; T102-M106 VanDerWaalsContact CG2-CE 3.48Å; T102-M106 HydrophobicContact CG2-CG 4.47Å; T102-M106 HydrophobicContact CG2-SD 4.29Å; T102-M106 WeakPolarHBondContact O-CB 3.43Å; T102-M106 PolarHBondContact O-N 2.84Å
103	L	93.9	Very high	91.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-54.9	-56.2	174.5	179.3	62	0	0	0	111.5	I95 M98 D99 L107 M125 E128 A129	I95-L103 HydrophobicContact CG2-CD1 4.04Å; M98-L103 HydrophobicContact CB-CB 4.17Å; M98-L103 HydrophobicContact SD-CD1 4.06Å; D99-L103 VanDerWaalsContact O-CB 3.31Å; D99-L103 WeakPolarHBondContact O-CB 3.34Å; D99-L103 PolarHBondContact O-N 2.63Å; L103-L107 WeakPolarHBondContact O-CB 3.41Å; L103-L107 PolarHBondContact O-N 2.91Å; L103-M125 HydrophobicContact CD1-CB 4.23Å; L103-M125 HydrophobicContact CD1-CE 3.91Å; L103-M125 HydrophobicContact CD1-CG 4.2Å; L103-M125 WeakPolarHBondContact O-CE 3.22Å; L103-E128 HydrophobicContact CD2-CB 4.32Å; L103-E128 HydrophobicContact CD2-CG 3.97Å; L103-A129 HydrophobicContact CD2-CB 4.13Å
104	V	93.5	Very high	90.9	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-69.3	-37.8	-177.3	178	0	0	0	0	111.9	D100 L107 Y108 K143 F144 I147	D100-V104 WeakPolarHBondContact O-CG2 3.39Å; D100-V104 PolarHBondContact O-N 2.88Å; V104-L107 PolarHBondContact O-N 3.29Å; V104-Y108 WeakPolarHBondContact O-CB 3.19Å; V104-Y108 PolarHBondContact O-N 2.94Å; V104-K143 HydrophobicContact CG1-CB 3.71Å; V104-F144 HydrophobicContact CG1-CB 4.08Å; V104-F144 HydrophobicContact CG2-CB 4.39Å; V104-I147 HydrophobicContact CG1-CD1 4.2Å
105	N	91.3	Very high	90.6	Very high	45 Å²	45	38 Å²	38	24%	0.241	20%	0.204	C	C	.	.	H	α-helix	trans	-66.1	-43.9	177.7	-76.2	-28.4	0	0	0	112.1	L101 T102 Y108 V109 K143	L101-N105 WeakPolarHBondContact CD1-ND2 3.22Å; L101-N105 WeakPolarHBondContact CG-ND2 3.42Å; L101-N105 VanDerWaalsContact O-CB 3.22Å; L101-N105 WeakPolarHBondContact O-CB 3.21Å; L101-N105 PolarHBondContact O-N 3.02Å; L101-N105 PolarHBondContact O-ND2 2.88Å; L101-N105 VanDerWaalsContact O-ND2 3.1Å; T102-N105 PolarHBondContact O-N 2.92Å; N105-Y108 WeakPolarHBondContact O-CB 3.37Å; N105-Y108 PolarHBondContact O-N 2.92Å; N105-V109 VanDerWaalsContact O-CG2 3.29Å; N105-V109 WeakPolarHBondContact O-CG2 3.32Å; N105-V109 PolarHBondContact O-N 2.92Å; N105-K143 PolarHBondContact OD1-NZ 3.34Å
106	M	92.9	Very high	90.4	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.015	23%	0.226	C	C	.	.	H	α-helix	trans	-66.7	-40.5	177.1	-79.4	-168.4	-59.2	0	0	111.3	V54 S55 M98 T102 Y108 V109 F110 M125	V54-M106 HydrophobicContact CG1-SD 4.28Å; S55-M106 VanDerWaalsContact CA-SD 3.57Å; M98-M106 HydrophobicContact CE-CE 3.18Å; M98-M106 HydrophobicContact CE-SD 4.39Å; M98-M106 HydrophobicContact CG-CE 3.81Å; M98-M106 HydrophobicContact SD-CE 3.09Å; M98-M106 WeakPolarHBondContact SD-CE 3.27Å; T102-M106 HydrophobicContact CG2-CE 3.48Å; T102-M106 VanDerWaalsContact CG2-CE 3.48Å; T102-M106 HydrophobicContact CG2-CG 4.47Å; T102-M106 HydrophobicContact CG2-SD 4.29Å; T102-M106 WeakPolarHBondContact O-CB 3.43Å; T102-M106 PolarHBondContact O-N 2.84Å; M106-Y108 VanDerWaalsContact C-N 3.3Å; M106-Y108 PolarHBondContact O-N 3.47Å; M106-V109 PolarHBondContact O-N 3.47Å; M106-V109 VanDerWaalsContact O-N 3.17Å; M106-F110 HydrophobicContact CB-CD2 4.25Å; M106-F110 HydrophobicContact CB-CE2 4.13Å; M106-F110 WeakPolarHBondContact O-CD2 3.41Å; M106-F110 PolarHBondContact O-N 2.89Å; M106-M125 HydrophobicContact CB-CE 3.65Å; M106-M125 HydrophobicContact CE-CE 4.48Å
107	L	93.1	Very high	90.1	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-56.4	-47.4	173.6	175.7	61.2	0	0	0	110.9	L103 V104 V109 L111 V122 M125 V126 F144 I147	L103-L107 WeakPolarHBondContact O-CB 3.41Å; L103-L107 PolarHBondContact O-N 2.91Å; V104-L107 PolarHBondContact O-N 3.29Å; L107-V109 PolarHBondContact O-N 2.84Å; L107-L111 HydrophobicContact CD1-CD1 4.13Å; L107-L111 HydrophobicContact CD1-CG 4.49Å; L107-L111 HydrophobicContact CG-CD1 4.32Å; L107-L111 WeakPolarHBondContact O-CG 3.4Å; L107-L111 PolarHBondContact O-N 3.07Å; L107-V122 HydrophobicContact CD1-CG1 3.93Å; L107-M125 HydrophobicContact CB-CB 4.41Å; L107-M125 HydrophobicContact CB-CE 3.94Å; L107-M125 HydrophobicContact CB-SD 4.36Å; L107-M125 HydrophobicContact CD1-CB 4.01Å; L107-M125 VanDerWaalsContact N-CE 3.34Å; L107-V126 HydrophobicContact CD1-CG2 4.07Å; L107-V126 HydrophobicContact CD2-CG2 3.87Å; L107-F144 HydrophobicContact CD2-CD2 4.01Å; L107-F144 HydrophobicContact CD2-CE2 3.89Å; L107-I147 HydrophobicContact CB-CD1 4.36Å; L107-I147 HydrophobicContact CD2-CD1 4Å; L107-I147 HydrophobicContact CD2-CG2 4.17Å; L107-I147 HydrophobicContact CG-CD1 3.95Å; L107-I147 HydrophobicContact CG-CG2 4.29Å
108	Y	90.9	Very high	89.9	Confident	68 Å²	68	43 Å²	43	27%	0.267	22%	0.219	S	C	.	.	H	α-helix	trans	-57.8	-47.2	176.1	179.1	-96.1	0	0	0	111.9	V104 N105 M106 R112 I147	V104-Y108 WeakPolarHBondContact O-CB 3.19Å; V104-Y108 PolarHBondContact O-N 2.94Å; N105-Y108 WeakPolarHBondContact O-CB 3.37Å; N105-Y108 PolarHBondContact O-N 2.92Å; M106-Y108 VanDerWaalsContact C-N 3.3Å; M106-Y108 PolarHBondContact O-N 3.47Å; Y108-R112 HydrophobicContact CD1-CG 4.25Å; Y108-R112 HydrophobicContact CE1-CG 3.83Å; Y108-R112 HydrophobicContact CE2-CG 4.45Å; Y108-R112 VanDerWaalsContact O-CG 3.31Å; Y108-R112 WeakPolarHBondContact O-CG 3.44Å; Y108-R112 PolarHBondContact O-N 3.46Å; Y108-R112 VanDerWaalsContact O-N 3.12Å; Y108-R112 PolarHBondContact OH-NE 3.39Å; Y108-I147 HydrophobicContact CD2-CD1 4.33Å; Y108-I147 HydrophobicContact CD2-CG1 3.96Å
109	V	90.4	Very high	89.7	Confident	13 Å²	13	44.4 Å²	44.4	8%	0.079	23%	0.227	C	C	.	.	H	α-helix	trans	-68.7	-42.5	-177.1	174.7	0	0	0	0	111.9	V58 W62 N105 M106 L107 L111 R112 L113	V58-V109 HydrophobicContact CG1-CB 3.94Å; V58-V109 HydrophobicContact CG1-CG1 3.41Å; V58-V109 VanDerWaalsContact CG1-CG1 3.41Å; V58-V109 WeakPolarHBondContact O-CG1 3.38Å; W62-V109 HydrophobicContact CB-CG1 3.5Å; W62-V109 HydrophobicContact CB-CG2 4.42Å; W62-V109 HydrophobicContact CG-CG1 4.11Å; W62-V109 HydrophobicContact CG-CG2 4.48Å; N105-V109 VanDerWaalsContact O-CG2 3.29Å; N105-V109 WeakPolarHBondContact O-CG2 3.32Å; N105-V109 PolarHBondContact O-N 2.92Å; M106-V109 PolarHBondContact O-N 3.47Å; M106-V109 VanDerWaalsContact O-N 3.17Å; L107-V109 PolarHBondContact O-N 2.84Å; V109-L111 VanDerWaalsContact C-N 3.3Å; V109-L111 PolarHBondContact O-N 3.18Å; V109-R112 CarbonylContact O-C 3.55Å; V109-R112 WeakPolarHBondContact O-CA 3.49Å; V109-R112 WeakPolarHBondContact O-CB 3.45Å; V109-R112 PolarHBondContact O-N 3.49Å; V109-R112 VanDerWaalsContact O-N 3.08Å; V109-L113 HydrophobicContact CG1-CD1 3.82Å; V109-L113 HydrophobicContact CG1-CG 4.22Å; V109-L113 WeakPolarHBondContact O-CG 3.46Å; V109-L113 PolarHBondContact O-N 2.87Å
110	F	91.3	Very high	89.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60	-41	177.9	-79.6	-59	0	0	0	112.2	V58 F84 R88 A91 M106 R112 L113 S114 V115 L121 M125	V58-F110 HydrophobicContact CG1-CD1 4.41Å; V58-F110 HydrophobicContact CG1-CE1 4.14Å; V58-F110 HydrophobicContact CG1-CE2 4.35Å; V58-F110 HydrophobicContact CG1-CZ 4.11Å; V58-F110 HydrophobicContact CG2-CE1 3.95Å; V58-F110 HydrophobicContact CG2-CE2 4.45Å; V58-F110 HydrophobicContact CG2-CZ 3.66Å; F84-F110 HydrophobicContact CE2-CE1 4.36Å; F84-F110 HydrophobicContact CZ-CD1 4.26Å; F84-F110 HydrophobicContact CZ-CE1 4.43Å; R88-F110 HydrophobicContact CG-CD1 4.4Å; R88-F110 HydrophobicContact CG-CE1 3.93Å; A91-F110 HydrophobicContact CB-CE2 3.8Å; A91-F110 HydrophobicContact CB-CZ 3.77Å; M106-F110 HydrophobicContact CB-CD2 4.25Å; M106-F110 HydrophobicContact CB-CE2 4.13Å; M106-F110 WeakPolarHBondContact O-CD2 3.41Å; M106-F110 PolarHBondContact O-N 2.89Å; F110-R112 VanDerWaalsContact C-N 3.34Å; F110-R112 PolarHBondContact O-N 3.09Å; F110-L113 CarbonylContact O-C 3.59Å; F110-L113 PolarHBondContact O-N 2.74Å; F110-S114 PolarHBondContact O-N 2.81Å; F110-V115 HydrophobicContact CB-CB 4.32Å; F110-V115 HydrophobicContact CB-CG2 4.14Å; F110-V115 HydrophobicContact CD1-CG2 4.06Å; F110-V115 WeakPolarHBondContact O-CB 3.11Å; F110-V115 WeakPolarHBondContact O-CG2 3.33Å; F110-V115 PolarHBondContact O-N 3.19Å; F110-V115 VanDerWaalsContact O-N 3.1Å; F110-L121 HydrophobicContact CD1-CD2 4.09Å; F110-L121 HydrophobicContact CD2-CD2 3.87Å; F110-L121 HydrophobicContact CE1-CD2 4.04Å; F110-L121 HydrophobicContact CE2-CD2 3.83Å; F110-L121 HydrophobicContact CG-CD2 4.02Å; F110-L121 HydrophobicContact CZ-CD2 3.91Å; F110-M125 HydrophobicContact CD2-SD 4.08Å; F110-M125 HydrophobicContact CE2-SD 4.41Å
111	L	89.1	Confident	89.8	Confident	39 Å²	39	40.7 Å²	40.7	20%	0.204	21%	0.211	C	C	.	.	H	α-helix	trans	-64.7	-38.3	174.3	-69.7	168.5	0	0	0	112.2	L107 V109 L113 S114 V122 I147 Q151	L107-L111 HydrophobicContact CD1-CD1 4.13Å; L107-L111 HydrophobicContact CD1-CG 4.49Å; L107-L111 HydrophobicContact CG-CD1 4.32Å; L107-L111 WeakPolarHBondContact O-CG 3.4Å; L107-L111 PolarHBondContact O-N 3.07Å; V109-L111 VanDerWaalsContact C-N 3.3Å; V109-L111 PolarHBondContact O-N 3.18Å; L111-L113 VanDerWaalsContact C-N 3.28Å; L111-L113 PolarHBondContact O-N 2.94Å; L111-S114 PolarHBondContact O-N 3.36Å; L111-S114 VanDerWaalsContact O-N 3.1Å; L111-V122 HydrophobicContact CD2-CG1 4.09Å; L111-V122 HydrophobicContact CD2-CG2 4.27Å; L111-I147 HydrophobicContact CD1-CB 4.37Å; L111-I147 HydrophobicContact CD1-CG1 4.36Å; L111-I147 HydrophobicContact CD1-CG2 3.32Å; L111-Q151 VanDerWaalsContact CD1-NE2 3.35Å
112	R	86.9	Confident	89.8	Confident	92 Å²	92	37 Å²	37	35%	0.347	19%	0.191	S	C	.	.	H	α-helix	trans	-69	-26	174.9	-70.2	-67.3	179.7	-142.3	-12	113.4	W62 Y108 V109 F110 S114 D150	W62-R112 HydrophobicContact CD2-CB 3.83Å; W62-R112 HydrophobicContact CE3-CB 3.73Å; W62-R112 HydrophobicContact CH2-CB 3.71Å; W62-R112 HydrophobicContact CH2-CG 4.19Å; W62-R112 HydrophobicContact CZ2-CB 3.79Å; W62-R112 HydrophobicContact CZ2-CG 3.92Å; W62-R112 HydrophobicContact CZ3-CB 3.67Å; W62-R112 WeakPolarHBondContact CZ3-O 3.4Å; Y108-R112 HydrophobicContact CD1-CG 4.25Å; Y108-R112 HydrophobicContact CE1-CG 3.83Å; Y108-R112 HydrophobicContact CE2-CG 4.45Å; Y108-R112 VanDerWaalsContact O-CG 3.31Å; Y108-R112 WeakPolarHBondContact O-CG 3.44Å; Y108-R112 PolarHBondContact O-N 3.46Å; Y108-R112 VanDerWaalsContact O-N 3.12Å; Y108-R112 PolarHBondContact OH-NE 3.39Å; V109-R112 CarbonylContact O-C 3.55Å; V109-R112 WeakPolarHBondContact O-CA 3.49Å; V109-R112 WeakPolarHBondContact O-CB 3.45Å; V109-R112 PolarHBondContact O-N 3.49Å; V109-R112 VanDerWaalsContact O-N 3.08Å; F110-R112 VanDerWaalsContact C-N 3.34Å; F110-R112 PolarHBondContact O-N 3.09Å; R112-S114 PolarHBondContact O-N 3.27Å; R112-D150 IonicContact CZ-OD2 3.26Å; R112-D150 IonicContact NH1-OD2 3.58Å; R112-D150 IonicContact NH2-OD2 2.75Å; R112-D150 PolarHBondContact NH2-OD2 3.18Å
113	L	87.8	Confident	89.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	17.6	170.4	-66	173.2	0	0	0	112.9	V58 L61 W62 Q65 V75 I78 F84 V109 F110 L111 V115	V58-L113 HydrophobicContact CG1-CD1 4.45Å; L61-L113 HydrophobicContact CB-CD1 4.28Å; W62-L113 HydrophobicContact CE3-CD2 4.02Å; W62-L113 HydrophobicContact CE3-CG 4.43Å; Q65-L113 HydrophobicContact CG-CD2 4.39Å; V75-L113 VanDerWaalsContact CG1-C 3.41Å; V75-L113 HydrophobicContact CG1-CB 4.49Å; V75-L113 VanDerWaalsContact CG1-O 3.29Å; V75-L113 WeakPolarHBondContact CG1-O 3.29Å; I78-L113 HydrophobicContact CD1-CD2 4.21Å; F84-L113 HydrophobicContact CE2-CD1 3.83Å; F84-L113 HydrophobicContact CZ-CB 4.06Å; F84-L113 HydrophobicContact CZ-CD1 4.13Å; V109-L113 HydrophobicContact CG1-CD1 3.82Å; V109-L113 HydrophobicContact CG1-CG 4.22Å; V109-L113 WeakPolarHBondContact O-CG 3.46Å; V109-L113 PolarHBondContact O-N 2.87Å; F110-L113 CarbonylContact O-C 3.59Å; F110-L113 PolarHBondContact O-N 2.74Å; L111-L113 VanDerWaalsContact C-N 3.28Å; L111-L113 PolarHBondContact O-N 2.94Å; L113-V115 VanDerWaalsContact C-N 3.3Å; L113-V115 PolarHBondContact O-N 3.13Å
114	S	84.3	Confident	89.7	Confident	66 Å²	66	44.7 Å²	44.7	46%	0.462	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	32.1	174.6	-55.1	0	0	0	0	114.8	K79 F110 L111 R112	K79-S114 PolarHBondContact NZ-O 2.83Å; F110-S114 PolarHBondContact O-N 2.81Å; L111-S114 PolarHBondContact O-N 3.36Å; L111-S114 VanDerWaalsContact O-N 3.1Å; R112-S114 PolarHBondContact O-N 3.27Å
115	V	86	Confident	89.7	Confident	6 Å²	6	44.6 Å²	44.6	4%	0.036	23%	0.225	C	C	.	.			trans	-72.6	132.3	162.3	-177.4	0	0	0	0	108.4	F84 F110 L113 D119 V122	F84-V115 HydrophobicContact CE1-CG2 4.06Å; F84-V115 HydrophobicContact CZ-CG2 4.02Å; F110-V115 HydrophobicContact CB-CB 4.32Å; F110-V115 HydrophobicContact CB-CG2 4.14Å; F110-V115 HydrophobicContact CD1-CG2 4.06Å; F110-V115 WeakPolarHBondContact O-CB 3.11Å; F110-V115 WeakPolarHBondContact O-CG2 3.33Å; F110-V115 PolarHBondContact O-N 3.19Å; F110-V115 VanDerWaalsContact O-N 3.1Å; L113-V115 VanDerWaalsContact C-N 3.3Å; L113-V115 PolarHBondContact O-N 3.13Å; V115-D119 HydrophobicContact CG1-CB 3.77Å; V115-V122 HydrophobicContact CB-CG2 4.42Å; V115-V122 HydrophobicContact CG1-CG2 3.76Å
116	E	85.8	Confident	89.7	Confident	113 Å²	113	43.5 Å²	43.5	53%	0.528	22%	0.22	S	C	.	.			trans	-70.7	143.7	-172.6	-74.4	166.1	-145.7	0	0	111.6	K79 H118 D119	K79-E116 IonicContact NZ-OE1 3.84Å; K79-E116 PolarHBondContact NZ-OE1 2.98Å; E116-H118 PolarHBondContact O-N 3.11Å; E116-H118 VanDerWaalsContact O-N 3.12Å; E116-D119 WeakPolarHBondContact O-CB 3.48Å; E116-D119 PolarHBondContact O-N 3.4Å
117	P	84.1	Confident	89.7	Confident	59 Å²	59	46.8 Å²	46.8	38%	0.383	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.3	178	-26.1	35.2	0	0	0	114.4	D119 Q151	P117-D119 VanDerWaalsContact C-N 3.3Å; P117-Q151 HydrophobicContact CB-CG 4.5Å; P117-Q151 HydrophobicContact CG-CG 4.42Å
118	H	85.4	Confident	89.7	Confident	156 Å²	156	48.2 Å²	48.2	72%	0.722	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-2	178.9	-56.7	-57.9	0	0	0	113.7	E116 Q123	E116-H118 PolarHBondContact O-N 3.11Å; E116-H118 VanDerWaalsContact O-N 3.12Å; H118-Q123 PolarHBondContact O-NE2 3.02Å
119	D	90.4	Very high	89.8	Confident	35 Å²	35	45 Å²	45	19%	0.187	24%	0.237	C	C	.	.	S	Bend	trans	-67	142.7	178.5	-159.4	-102.8	0	0	0	111.8	R88 V115 E116 P117 L121 V122 Q123	R88-D119 IonicContact CZ-OD1 2.84Å; R88-D119 IonicContact CZ-OD2 3.94Å; R88-D119 IonicContact NE-OD1 2.78Å; R88-D119 IonicContact NH2-OD1 3.17Å; R88-D119 PolarHBondContact NH2-OD1 3.39Å; R88-D119 IonicContact NH2-OD2 3.82Å; R88-D119 PolarHBondContact NH2-OD2 2.72Å; V115-D119 HydrophobicContact CG1-CB 3.77Å; E116-D119 WeakPolarHBondContact O-CB 3.48Å; E116-D119 PolarHBondContact O-N 3.4Å; P117-D119 VanDerWaalsContact C-N 3.3Å; D119-L121 VanDerWaalsContact C-N 3.28Å; D119-L121 PolarHBondContact O-N 3.34Å; D119-V122 HydrophobicContact CB-CB 4.49Å; D119-V122 HydrophobicContact CB-CG2 4.3Å; D119-V122 PolarHBondContact O-N 2.95Å; D119-Q123 WeakPolarHBondContact O-CG 3.29Å; D119-Q123 PolarHBondContact O-N 3.45Å
120	S	92.6	Very high	89.9	Confident	53 Å²	53	50.7 Å²	50.7	37%	0.371	26%	0.257	S	S	.	.	H	α-helix	trans	-57.7	-41	-176.1	59.6	0	0	0	0	112.4	E92 V122 Q123 Q124	E92-S120 WeakPolarHBondContact OE1-CB 3.37Å; E92-S120 PolarHBondContact OE1-OG 2.84Å; E92-S120 PolarHBondContact OE2-OG 3.17Å; E92-S120 VanDerWaalsContact OE2-OG 3.09Å; S120-V122 PolarHBondContact O-N 2.94Å; S120-Q123 PolarHBondContact O-N 3.48Å; S120-Q124 WeakPolarHBondContact O-CB 3.4Å; S120-Q124 VanDerWaalsContact O-CG 3.32Å; S120-Q124 WeakPolarHBondContact O-CG 3.44Å; S120-Q124 PolarHBondContact O-N 3.17Å
121	L	93.2	Very high	90	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-56.6	-50.3	174.9	171.6	65	0	0	0	111.3	R88 A91 E92 I95 F110 D119 Q124 M125	R88-L121 HydrophobicContact CB-CD2 3.95Å; R88-L121 HydrophobicContact CG-CD2 3.95Å; A91-L121 HydrophobicContact CB-CD1 3.92Å; E92-L121 HydrophobicContact CB-CB 4.46Å; E92-L121 HydrophobicContact CB-CD1 3.8Å; E92-L121 HydrophobicContact CG-CD1 4.42Å; I95-L121 HydrophobicContact CD1-CD1 4.33Å; F110-L121 HydrophobicContact CD1-CD2 4.09Å; F110-L121 HydrophobicContact CD2-CD2 3.87Å; F110-L121 HydrophobicContact CE1-CD2 4.04Å; F110-L121 HydrophobicContact CE2-CD2 3.83Å; F110-L121 HydrophobicContact CG-CD2 4.02Å; F110-L121 HydrophobicContact CZ-CD2 3.91Å; D119-L121 VanDerWaalsContact C-N 3.28Å; D119-L121 PolarHBondContact O-N 3.34Å; L121-Q124 PolarHBondContact O-N 3.44Å; L121-M125 HydrophobicContact CD1-CG 4.06Å; L121-M125 HydrophobicContact CD1-SD 3.69Å; L121-M125 HydrophobicContact CG-SD 4.02Å; L121-M125 WeakPolarHBondContact O-CB 3.17Å; L121-M125 WeakPolarHBondContact O-CG 3.35Å; L121-M125 PolarHBondContact O-N 3.18Å
122	V	91.1	Very high	90.2	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.006	29%	0.287	C	S	.	.	H	α-helix	trans	-65.5	-44.9	-178.1	175.1	0	0	0	0	110.4	L107 L111 V115 D119 S120 Q124 M125 V126	L107-V122 HydrophobicContact CD1-CG1 3.93Å; L111-V122 HydrophobicContact CD2-CG1 4.09Å; L111-V122 HydrophobicContact CD2-CG2 4.27Å; V115-V122 HydrophobicContact CB-CG2 4.42Å; V115-V122 HydrophobicContact CG1-CG2 3.76Å; D119-V122 HydrophobicContact CB-CB 4.49Å; D119-V122 HydrophobicContact CB-CG2 4.3Å; D119-V122 PolarHBondContact O-N 2.95Å; S120-V122 PolarHBondContact O-N 2.94Å; V122-Q124 PolarHBondContact O-N 3.26Å; V122-M125 PolarHBondContact O-N 3.23Å; V122-V126 HydrophobicContact CG1-CG2 4.27Å; V122-V126 WeakPolarHBondContact O-CB 3.31Å; V122-V126 VanDerWaalsContact O-CG2 3.26Å; V122-V126 WeakPolarHBondContact O-CG2 3.37Å; V122-V126 PolarHBondContact O-N 3.44Å
123	Q	90.9	Very high	90.5	Very high	100 Å²	100	55 Å²	55	47%	0.467	27%	0.271	S	S	.	.	H	α-helix	trans	-61.3	-43.5	178.9	-70.5	-178.2	-8.7	0	0	112.4	H118 D119 S120 S127	H118-Q123 PolarHBondContact O-NE2 3.02Å; D119-Q123 WeakPolarHBondContact O-CG 3.29Å; D119-Q123 PolarHBondContact O-N 3.45Å; S120-Q123 PolarHBondContact O-N 3.48Å; Q123-S127 WeakPolarHBondContact O-CB 3.42Å; Q123-S127 PolarHBondContact O-N 2.93Å; Q123-S127 PolarHBondContact O-OG 3.28Å
124	Q	92.6	Very high	90.7	Very high	88 Å²	88	58.9 Å²	58.9	41%	0.411	29%	0.292	S	S	.	.	H	α-helix	trans	-68.8	-40.7	177.8	-71.9	177.5	22.8	0	0	111.9	E92 I95 S120 L121 V122 S127 E128	E92-Q124 PolarHBondContact OE1-NE2 3.19Å; I95-Q124 HydrophobicContact CD1-CB 3.55Å; S120-Q124 WeakPolarHBondContact O-CB 3.4Å; S120-Q124 VanDerWaalsContact O-CG 3.32Å; S120-Q124 WeakPolarHBondContact O-CG 3.44Å; S120-Q124 PolarHBondContact O-N 3.17Å; L121-Q124 PolarHBondContact O-N 3.44Å; V122-Q124 PolarHBondContact O-N 3.26Å; Q124-S127 PolarHBondContact O-N 3.26Å; Q124-E128 WeakPolarHBondContact O-CB 3.37Å; Q124-E128 PolarHBondContact O-N 3.18Å
125	M	93.7	Very high	91.1	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-64.7	-40.9	176	-72.1	-176.7	87.9	0	0	112.1	I95 M98 L103 M106 L107 F110 L121 V122 A129	I95-M125 HydrophobicContact CD1-CG 3.59Å; I95-M125 HydrophobicContact CG1-CG 3.87Å; M98-M125 HydrophobicContact SD-CE 4.29Å; L103-M125 HydrophobicContact CD1-CB 4.23Å; L103-M125 HydrophobicContact CD1-CE 3.91Å; L103-M125 HydrophobicContact CD1-CG 4.2Å; L103-M125 WeakPolarHBondContact O-CE 3.22Å; M106-M125 HydrophobicContact CB-CE 3.65Å; M106-M125 HydrophobicContact CE-CE 4.48Å; L107-M125 HydrophobicContact CB-CB 4.41Å; L107-M125 HydrophobicContact CB-CE 3.94Å; L107-M125 HydrophobicContact CB-SD 4.36Å; L107-M125 HydrophobicContact CD1-CB 4.01Å; L107-M125 VanDerWaalsContact N-CE 3.34Å; F110-M125 HydrophobicContact CD2-SD 4.08Å; F110-M125 HydrophobicContact CE2-SD 4.41Å; L121-M125 HydrophobicContact CD1-CG 4.06Å; L121-M125 HydrophobicContact CD1-SD 3.69Å; L121-M125 HydrophobicContact CG-SD 4.02Å; L121-M125 WeakPolarHBondContact O-CB 3.17Å; L121-M125 WeakPolarHBondContact O-CG 3.35Å; L121-M125 PolarHBondContact O-N 3.18Å; V122-M125 PolarHBondContact O-N 3.23Å; M125-A129 VanDerWaalsContact O-CB 3.22Å; M125-A129 WeakPolarHBondContact O-CB 3.39Å; M125-A129 PolarHBondContact O-N 3.03Å
126	V	91.8	Very high	91.4	Very high	22 Å²	22	58.2 Å²	58.2	13%	0.133	30%	0.296	C	S	.	.	H	α-helix	trans	-64.5	-42.1	173.9	170.7	0	0	0	0	110.7	L107 V122 A129 W130 F144	L107-V126 HydrophobicContact CD1-CG2 4.07Å; L107-V126 HydrophobicContact CD2-CG2 3.87Å; V122-V126 HydrophobicContact CG1-CG2 4.27Å; V122-V126 WeakPolarHBondContact O-CB 3.31Å; V122-V126 VanDerWaalsContact O-CG2 3.26Å; V122-V126 WeakPolarHBondContact O-CG2 3.37Å; V122-V126 PolarHBondContact O-N 3.44Å; V126-A129 PolarHBondContact O-N 3.25Å; V126-W130 WeakPolarHBondContact O-CB 3.26Å; V126-W130 PolarHBondContact O-N 3.15Å; V126-F144 HydrophobicContact CG1-CZ 4.42Å
127	S	91.6	Very high	91.8	Very high	71 Å²	71	55.9 Å²	55.9	50%	0.497	29%	0.29	S	S	.	.	H	α-helix	trans	-64.1	-43.3	178.6	-59.8	0	0	0	0	112	Q123 Q124 W130 R131	Q123-S127 WeakPolarHBondContact O-CB 3.42Å; Q123-S127 PolarHBondContact O-N 2.93Å; Q123-S127 PolarHBondContact O-OG 3.28Å; Q124-S127 PolarHBondContact O-N 3.26Å; S127-W130 PolarHBondContact O-N 3.47Å; S127-R131 PolarHBondContact O-N 2.86Å
128	E	93.5	Very high	92.2	Very high	31 Å²	31	54.2 Å²	54.2	15%	0.145	28%	0.278	C	S	.	.	H	α-helix	trans	-69.5	-39	176.7	-174.7	63.8	-174.1	0	0	111.7	I95 L103 Q124 W130 R131 R132	I95-E128 HydrophobicContact CG2-CB 3.64Å; I95-E128 HydrophobicContact CG2-CG 3.74Å; L103-E128 HydrophobicContact CD2-CB 4.32Å; L103-E128 HydrophobicContact CD2-CG 3.97Å; Q124-E128 WeakPolarHBondContact O-CB 3.37Å; Q124-E128 PolarHBondContact O-N 3.18Å; E128-W130 VanDerWaalsContact C-N 3.31Å; E128-W130 PolarHBondContact O-N 3.33Å; E128-R131 PolarHBondContact O-N 3.14Å; E128-R131 IonicContact OE1-CZ 3.04Å; E128-R131 IonicContact OE1-NE 2.74Å; E128-R131 PolarHBondContact OE1-NE 3.13Å; E128-R131 IonicContact OE1-NH2 3.79Å; E128-R131 PolarHBondContact OE1-NH2 3.47Å; E128-R131 IonicContact OE2-CZ 3.74Å; E128-R131 IonicContact OE2-NE 3.44Å; E128-R131 PolarHBondContact OE2-NE 3.29Å; E128-R131 IonicContact OE2-NH2 3.16Å; E128-R132 WeakPolarHBondContact O-CG 3.46Å; E128-R132 PolarHBondContact O-N 3.37Å; E128-R132 VanDerWaalsContact O-N 3.14Å; E128-R132 IonicContact OE1-CZ 3.46Å; E128-R132 IonicContact OE1-NE 2.72Å; E128-R132 PolarHBondContact OE1-NE 3.42Å; E128-R132 IonicContact OE1-NH2 3.15Å; E128-R132 PolarHBondContact OE1-NH2 3.21Å
129	A	93.1	Very high	92.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64.2	-36.7	174.4	0	0	0	0	0	111.9	L103 M125 V126 R132 V133 F144	L103-A129 HydrophobicContact CD2-CB 4.13Å; M125-A129 VanDerWaalsContact O-CB 3.22Å; M125-A129 WeakPolarHBondContact O-CB 3.39Å; M125-A129 PolarHBondContact O-N 3.03Å; V126-A129 PolarHBondContact O-N 3.25Å; A129-R132 PolarHBondContact O-N 2.95Å; A129-V133 PolarHBondContact O-N 3.03Å; A129-V133 VanDerWaalsContact O-N 3.09Å; A129-F144 HydrophobicContact CB-CD2 4.13Å; A129-F144 HydrophobicContact CB-CE1 4.14Å; A129-F144 HydrophobicContact CB-CE2 3.62Å; A129-F144 HydrophobicContact CB-CZ 3.61Å
130	W	92.7	Very high	92.8	Very high	132 Å²	132	47.9 Å²	47.9	50%	0.5	25%	0.254	S	S	.	.	H	α-helix	trans	-63.4	-48.1	171.8	-174.5	-3.7	0	0	0	110.7	V126 S127 E128 R132 V133 L158	V126-W130 WeakPolarHBondContact O-CB 3.26Å; V126-W130 PolarHBondContact O-N 3.15Å; S127-W130 PolarHBondContact O-N 3.47Å; E128-W130 VanDerWaalsContact C-N 3.31Å; E128-W130 PolarHBondContact O-N 3.33Å; W130-R132 PolarHBondContact O-N 3.36Å; W130-R132 VanDerWaalsContact O-N 3.09Å; W130-V133 VanDerWaalsContact O-CB 3.27Å; W130-V133 WeakPolarHBondContact O-CB 3.47Å; W130-V133 WeakPolarHBondContact O-CG1 3.49Å; W130-V133 PolarHBondContact O-N 3.49Å; W130-L158 HydrophobicContact CB-CD1 4.16Å; W130-L158 HydrophobicContact CB-CD2 4.4Å; W130-L158 VanDerWaalsContact CD1-CD1 3.48Å; W130-L158 HydrophobicContact CD2-CD1 3.98Å; W130-L158 HydrophobicContact CD2-CD2 4.33Å; W130-L158 HydrophobicContact CE3-CD2 4.42Å; W130-L158 HydrophobicContact CG-CD1 3.63Å; W130-L158 HydrophobicContact CG-CD2 4.34Å
131	R	93	Very high	92.9	Very high	173 Å²	173	45.4 Å²	45.4	65%	0.653	24%	0.236	S	C	*	.	H	α-helix	trans	-56	-32.3	178.5	-166.3	-176.3	71.6	84.6	0.3	113.1	S127 E128	S127-R131 PolarHBondContact O-N 2.86Å; E128-R131 PolarHBondContact O-N 3.14Å; E128-R131 IonicContact OE1-CZ 3.04Å; E128-R131 IonicContact OE1-NE 2.74Å; E128-R131 PolarHBondContact OE1-NE 3.13Å; E128-R131 IonicContact OE1-NH2 3.79Å; E128-R131 PolarHBondContact OE1-NH2 3.47Å; E128-R131 IonicContact OE2-CZ 3.74Å; E128-R131 IonicContact OE2-NE 3.44Å; E128-R131 PolarHBondContact OE2-NE 3.29Å; E128-R131 IonicContact OE2-NH2 3.16Å
132	R	94	Very high	93	Very high	46 Å²	46	45.7 Å²	45.7	17%	0.174	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	2.9	-179.3	-58.9	-177	-167.9	-170.1	4.6	114.2	S96 M98 D100 E128 A129 W130 D134 G135 L136	S96-R132 PolarHBondContact O-NH2 3.39Å; M98-R132 PolarHBondContact O-NH1 2.67Å; D100-R132 VanDerWaalsContact OD1-CD 3.29Å; D100-R132 WeakPolarHBondContact OD1-CD 3.5Å; D100-R132 IonicContact OD1-NH1 3.75Å; D100-R132 PolarHBondContact OD1-NH1 3.02Å; E128-R132 WeakPolarHBondContact O-CG 3.46Å; E128-R132 PolarHBondContact O-N 3.37Å; E128-R132 VanDerWaalsContact O-N 3.14Å; E128-R132 IonicContact OE1-CZ 3.46Å; E128-R132 IonicContact OE1-NE 2.72Å; E128-R132 PolarHBondContact OE1-NE 3.42Å; E128-R132 IonicContact OE1-NH2 3.15Å; E128-R132 PolarHBondContact OE1-NH2 3.21Å; A129-R132 PolarHBondContact O-N 2.95Å; W130-R132 PolarHBondContact O-N 3.36Å; W130-R132 VanDerWaalsContact O-N 3.09Å; R132-D134 VanDerWaalsContact C-N 3.26Å; R132-D134 PolarHBondContact O-N 3.37Å; R132-D134 VanDerWaalsContact O-N 3.1Å; R132-G135 PolarHBondContact O-N 3.35Å; R132-L136 HydrophobicContact CB-CD2 4.49Å; R132-L136 PolarHBondContact O-N 3.19Å
133	V	94.1	Very high	93.1	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.018	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-55.4	-37.4	-165.9	72.6	0	0	0	0	113.6	A129 W130 G135 L136 L141 H161 I162 I165	A129-V133 PolarHBondContact O-N 3.03Å; A129-V133 VanDerWaalsContact O-N 3.09Å; W130-V133 VanDerWaalsContact O-CB 3.27Å; W130-V133 WeakPolarHBondContact O-CB 3.47Å; W130-V133 WeakPolarHBondContact O-CG1 3.49Å; W130-V133 PolarHBondContact O-N 3.49Å; V133-G135 VanDerWaalsContact C-N 3.28Å; V133-G135 PolarHBondContact O-N 2.96Å; V133-L136 HydrophobicContact CG2-CD1 4.4Å; V133-L136 PolarHBondContact O-N 2.9Å; V133-L141 HydrophobicContact CG2-CD1 3.74Å; V133-H161 VanDerWaalsContact CG1-CD2 3.43Å; V133-H161 WeakPolarHBondContact CG1-CD2 3.31Å; V133-I162 HydrophobicContact CG2-CG1 4.07Å; V133-I165 HydrophobicContact CG1-CD1 4.27Å; V133-I165 HydrophobicContact CG2-CD1 3.97Å
134	D	91.8	Very high	93.3	Very high	82 Å²	82	44.9 Å²	44.9	44%	0.439	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-67.7	-26.8	179.2	-64.1	-46.4	0	0	0	113	R132 H161 R169	R132-D134 VanDerWaalsContact C-N 3.26Å; R132-D134 PolarHBondContact O-N 3.37Å; R132-D134 VanDerWaalsContact O-N 3.1Å; D134-H161 IonicContact OD1-CD2 3.97Å; D134-H161 IonicContact OD1-CE1 3.77Å; D134-H161 IonicContact OD1-NE2 3.91Å; D134-H161 PolarHBondContact OD1-NE2 2.9Å; D134-H161 IonicContact OD2-NE2 2.64Å; D134-R169 PolarHBondContact O-NH1 3.2Å; D134-R169 PolarHBondContact O-NH2 3.31Å
135	G	91	Very high	93.4	Very high	55 Å²	55	40.7 Å²	40.7	57%	0.567	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-89.2	-13.7	179	0	0	0	0	0	114.1	R132 V133	R132-G135 PolarHBondContact O-N 3.35Å; V133-G135 VanDerWaalsContact C-N 3.28Å; V133-G135 PolarHBondContact O-N 2.96Å
136	L	93.4	Very high	93.4	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.01	22%	0.223	C	C	.	.			trans	-63.1	133	-171.3	-67.5	-179.7	0	0	0	111.8	D100 R132 V133 L141 F144	D100-L136 HydrophobicContact CB-CD2 3.61Å; R132-L136 HydrophobicContact CB-CD2 4.49Å; R132-L136 PolarHBondContact O-N 3.19Å; V133-L136 HydrophobicContact CG2-CD1 4.4Å; V133-L136 PolarHBondContact O-N 2.9Å; L136-L141 HydrophobicContact CB-CB 4.34Å; L136-L141 HydrophobicContact CB-CD1 4.42Å; L136-L141 HydrophobicContact CD1-CD1 4.2Å; L136-F144 HydrophobicContact CD1-CD1 4.31Å
137	P	93.6	Very high	93.4	Very high	64 Å²	64	41.4 Å²	41.4	42%	0.416	22%	0.218	S	C	.	.			trans	-58	147.7	167.3	-23.1	32.6	0	0	0	111	S139 S140 L141	P137-S139 PolarHBondContact O-N 3.18Å; P137-S139 VanDerWaalsContact O-N 3.09Å; P137-S140 WeakPolarHBondContact O-CA 3.4Å; P137-S140 WeakPolarHBondContact O-CB 3.45Å; P137-S140 PolarHBondContact O-N 2.73Å; P137-L141 PolarHBondContact O-N 3.03Å
138	M	93.8	Very high	93.3	Very high	24 Å²	24	38 Å²	38	12%	0.118	20%	0.195	C	C	.	.	H	α-helix	trans	-55.8	-33.8	-177.2	-77.2	-63.9	172.4	0	0	114	S140 L141 S142 I165 R169 I173 V178 L182	M138-S140 VanDerWaalsContact C-N 3.34Å; M138-S140 PolarHBondContact O-N 3.21Å; M138-L141 HydrophobicContact CE-CD2 4.42Å; M138-L141 HydrophobicContact SD-CD2 3.94Å; M138-S142 WeakPolarHBondContact O-CB 3.47Å; M138-S142 PolarHBondContact O-N 2.96Å; M138-I165 HydrophobicContact CE-CG2 4.2Å; M138-R169 HydrophobicContact CE-CB 3.14Å; M138-R169 HydrophobicContact CE-CG 4.07Å; M138-I173 HydrophobicContact CB-CG1 4.32Å; M138-I173 HydrophobicContact CG-CG1 3.87Å; M138-I173 HydrophobicContact SD-CD1 3.99Å; M138-I173 HydrophobicContact SD-CG1 4.01Å; M138-V178 HydrophobicContact CB-CG1 4.1Å; M138-V178 WeakPolarHBondContact O-CG1 3.38Å; M138-L182 HydrophobicContact SD-CD1 4.46Å
139	S	92.9	Very high	93	Very high	57 Å²	57	39.3 Å²	39.3	40%	0.399	20%	0.201	S	C	.	.	H	α-helix	trans	-64.2	-37.1	174.4	53.8	0	0	0	0	113.4	P137 K143	P137-S139 PolarHBondContact O-N 3.18Å; P137-S139 VanDerWaalsContact O-N 3.09Å; S139-K143 WeakPolarHBondContact O-CG 3.47Å; S139-K143 PolarHBondContact O-N 3.43Å
140	S	94.1	Very high	92.8	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.014	22%	0.222	C	C	.	.	H	α-helix	trans	-78.7	-42.5	178	-59.8	0	0	0	0	110.4	P137 M138 S142 K143 F144	P137-S140 WeakPolarHBondContact O-CA 3.4Å; P137-S140 WeakPolarHBondContact O-CB 3.45Å; P137-S140 PolarHBondContact O-N 2.73Å; M138-S140 VanDerWaalsContact C-N 3.34Å; M138-S140 PolarHBondContact O-N 3.21Å; S140-S142 VanDerWaalsContact C-N 3.3Å; S140-S142 PolarHBondContact O-N 3.07Å; S140-K143 PolarHBondContact O-N 3.2Å; S140-F144 WeakPolarHBondContact O-CB 3.43Å; S140-F144 PolarHBondContact O-N 2.97Å
141	L	95	Very high	92.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-57.7	-43	175.2	-168.7	70	0	0	0	111.6	V133 L136 P137 M138 F144 A145 I162 I165	V133-L141 HydrophobicContact CG2-CD1 3.74Å; L136-L141 HydrophobicContact CB-CB 4.34Å; L136-L141 HydrophobicContact CB-CD1 4.42Å; L136-L141 HydrophobicContact CD1-CD1 4.2Å; P137-L141 PolarHBondContact O-N 3.03Å; M138-L141 HydrophobicContact CE-CD2 4.42Å; M138-L141 HydrophobicContact SD-CD2 3.94Å; L141-F144 PolarHBondContact O-N 3.36Å; L141-A145 WeakPolarHBondContact O-CB 3.43Å; L141-A145 PolarHBondContact O-N 3.26Å; L141-I162 HydrophobicContact CD1-CG1 4.01Å; L141-I162 HydrophobicContact CD1-CG2 4.23Å; L141-I162 HydrophobicContact CD2-CG2 4.32Å; L141-I162 HydrophobicContact CG-CG2 4.1Å; L141-I165 HydrophobicContact CD2-CB 4.24Å; L141-I165 HydrophobicContact CD2-CG2 3.68Å
142	S	95.4	Very high	92	Very high	7 Å²	7	37.2 Å²	37.2	5%	0.049	21%	0.21	C	C	.	.	H	α-helix	trans	-60.9	-45.4	175.6	176.1	0	0	0	0	113.1	M138 S140 F144 A145 V146 V178 A181	M138-S142 WeakPolarHBondContact O-CB 3.47Å; M138-S142 PolarHBondContact O-N 2.96Å; S140-S142 VanDerWaalsContact C-N 3.3Å; S140-S142 PolarHBondContact O-N 3.07Å; S142-F144 VanDerWaalsContact C-N 3.34Å; S142-A145 PolarHBondContact O-N 3.4Å; S142-V146 WeakPolarHBondContact O-CG2 3.42Å; S142-V146 PolarHBondContact O-N 3.48Å; S142-V146 VanDerWaalsContact O-N 3.08Å; S142-V178 PolarHBondContact OG-O 2.77Å; S142-V178 VanDerWaalsContact OG-O 3.14Å; S142-A181 VanDerWaalsContact OG-CB 3.24Å; S142-A181 WeakPolarHBondContact OG-CB 3.28Å
143	K	94.1	Very high	91.6	Very high	83 Å²	83	38.5 Å²	38.5	36%	0.361	22%	0.22	S	C	.	.	H	α-helix	trans	-64.3	-40.7	174.8	-73.4	176.1	178.7	175.5	0	111.6	V104 N105 S139 S140 V146 I147	V104-K143 HydrophobicContact CG1-CB 3.71Å; N105-K143 PolarHBondContact OD1-NZ 3.34Å; S139-K143 WeakPolarHBondContact O-CG 3.47Å; S139-K143 PolarHBondContact O-N 3.43Å; S140-K143 PolarHBondContact O-N 3.2Å; K143-V146 PolarHBondContact O-N 2.84Å; K143-I147 VanDerWaalsContact O-CG1 3.31Å; K143-I147 WeakPolarHBondContact O-CG1 3.26Å; K143-I147 PolarHBondContact O-N 3.28Å
144	F	94.8	Very high	91.1	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.9	-40.8	178.1	-172.1	-130.5	0	0	0	111.9	V104 L107 V126 A129 L136 S140 L141 S142 V146 I147 L148 L158 I162	V104-F144 HydrophobicContact CG1-CB 4.08Å; V104-F144 HydrophobicContact CG2-CB 4.39Å; L107-F144 HydrophobicContact CD2-CD2 4.01Å; L107-F144 HydrophobicContact CD2-CE2 3.89Å; V126-F144 HydrophobicContact CG1-CZ 4.42Å; A129-F144 HydrophobicContact CB-CD2 4.13Å; A129-F144 HydrophobicContact CB-CE1 4.14Å; A129-F144 HydrophobicContact CB-CE2 3.62Å; A129-F144 HydrophobicContact CB-CZ 3.61Å; L136-F144 HydrophobicContact CD1-CD1 4.31Å; S140-F144 WeakPolarHBondContact O-CB 3.43Å; S140-F144 PolarHBondContact O-N 2.97Å; L141-F144 PolarHBondContact O-N 3.36Å; S142-F144 VanDerWaalsContact C-N 3.34Å; F144-V146 VanDerWaalsContact C-N 3.34Å; F144-V146 PolarHBondContact O-N 3.27Å; F144-I147 WeakPolarHBondContact O-CB 3.46Å; F144-I147 PolarHBondContact O-N 3.49Å; F144-L148 HydrophobicContact CD1-CD1 4.32Å; F144-L148 HydrophobicContact CE1-CD1 4.08Å; F144-L148 HydrophobicContact CE2-CD2 4.42Å; F144-L148 HydrophobicContact CE2-CG 4.44Å; F144-L148 HydrophobicContact CZ-CD1 4.25Å; F144-L148 HydrophobicContact CZ-CD2 4.39Å; F144-L148 HydrophobicContact CZ-CG 4.47Å; F144-L148 WeakPolarHBondContact O-CG 3.39Å; F144-L148 PolarHBondContact O-N 3.22Å; F144-L158 HydrophobicContact CE1-CD1 4.32Å; F144-L158 HydrophobicContact CE1-CD2 4Å; F144-L158 HydrophobicContact CE1-CG 4.43Å; F144-L158 HydrophobicContact CZ-CD2 3.9Å; F144-I162 HydrophobicContact CD1-CD1 4.02Å; F144-I162 HydrophobicContact CE1-CD1 4.38Å
145	A	94.3	Very high	90.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.6	-40.5	173.5	0	0	0	0	0	112.3	L141 S142 I147 L148 H149 M159 I162 L182 S185	L141-A145 WeakPolarHBondContact O-CB 3.43Å; L141-A145 PolarHBondContact O-N 3.26Å; S142-A145 PolarHBondContact O-N 3.4Å; A145-I147 VanDerWaalsContact C-N 3.34Å; A145-I147 PolarHBondContact O-N 3.44Å; A145-L148 PolarHBondContact O-N 3.5Å; A145-H149 WeakPolarHBondContact O-CB 3.31Å; A145-H149 PolarHBondContact O-N 3.08Å; A145-M159 HydrophobicContact CB-CE 4.47Å; A145-M159 HydrophobicContact CB-SD 4.34Å; A145-M159 WeakPolarHBondContact O-CE 3.24Å; A145-I162 HydrophobicContact CB-CD1 4.4Å; A145-I162 HydrophobicContact CB-CG2 4.22Å; A145-L182 HydrophobicContact CB-CD2 3.87Å; A145-S185 PolarHBondContact O-OG 3.13Å
146	V	92.9	Very high	90.8	Very high	33 Å²	33	39.2 Å²	39.2	20%	0.2	22%	0.216	C	C	.	.	H	α-helix	trans	-62.7	-41.1	174.3	171.5	0	0	0	0	111.3	S142 K143 F144 H149 D150 A181 S185	S142-V146 WeakPolarHBondContact O-CG2 3.42Å; S142-V146 PolarHBondContact O-N 3.48Å; S142-V146 VanDerWaalsContact O-N 3.08Å; K143-V146 PolarHBondContact O-N 2.84Å; F144-V146 VanDerWaalsContact C-N 3.34Å; F144-V146 PolarHBondContact O-N 3.27Å; V146-H149 PolarHBondContact O-N 3.41Å; V146-D150 WeakPolarHBondContact O-CB 3.46Å; V146-D150 PolarHBondContact O-N 3.08Å; V146-A181 HydrophobicContact CG2-CB 4.02Å; V146-S185 PolarHBondContact N-OG 3.07Å
147	I	92.1	Very high	90.6	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	25%	0.25	C	S	.	.	H	α-helix	trans	-59.9	-49.3	176.7	-70.1	163.3	0	0	0	111.1	V104 L107 Y108 L111 K143 F144 A145 H149 D150 Q151	V104-I147 HydrophobicContact CG1-CD1 4.2Å; L107-I147 HydrophobicContact CB-CD1 4.36Å; L107-I147 HydrophobicContact CD2-CD1 4Å; L107-I147 HydrophobicContact CD2-CG2 4.17Å; L107-I147 HydrophobicContact CG-CD1 3.95Å; L107-I147 HydrophobicContact CG-CG2 4.29Å; Y108-I147 HydrophobicContact CD2-CD1 4.33Å; Y108-I147 HydrophobicContact CD2-CG1 3.96Å; L111-I147 HydrophobicContact CD1-CB 4.37Å; L111-I147 HydrophobicContact CD1-CG1 4.36Å; L111-I147 HydrophobicContact CD1-CG2 3.32Å; K143-I147 VanDerWaalsContact O-CG1 3.31Å; K143-I147 WeakPolarHBondContact O-CG1 3.26Å; K143-I147 PolarHBondContact O-N 3.28Å; F144-I147 WeakPolarHBondContact O-CB 3.46Å; F144-I147 PolarHBondContact O-N 3.49Å; A145-I147 VanDerWaalsContact C-N 3.34Å; A145-I147 PolarHBondContact O-N 3.44Å; I147-H149 VanDerWaalsContact C-N 3.3Å; I147-H149 PolarHBondContact O-N 3.41Å; I147-D150 PolarHBondContact O-N 3.03Å; I147-Q151 WeakPolarHBondContact O-CG 3.3Å; I147-Q151 PolarHBondContact O-N 3.02Å
148	L	90	Very high	90.6	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-39.2	178.9	-65.4	174	0	0	0	111.7	F144 A145 Q151 L152 L153 L158 M159 I162	F144-L148 HydrophobicContact CD1-CD1 4.32Å; F144-L148 HydrophobicContact CE1-CD1 4.08Å; F144-L148 HydrophobicContact CE2-CD2 4.42Å; F144-L148 HydrophobicContact CE2-CG 4.44Å; F144-L148 HydrophobicContact CZ-CD1 4.25Å; F144-L148 HydrophobicContact CZ-CD2 4.39Å; F144-L148 HydrophobicContact CZ-CG 4.47Å; F144-L148 WeakPolarHBondContact O-CG 3.39Å; F144-L148 PolarHBondContact O-N 3.22Å; A145-L148 PolarHBondContact O-N 3.5Å; L148-Q151 CarbonylContact O-C 3.48Å; L148-Q151 PolarHBondContact O-N 3.49Å; L148-L152 PolarHBondContact O-N 3.28Å; L148-L153 HydrophobicContact CB-CB 4.33Å; L148-L153 HydrophobicContact CD2-CD1 3.99Å; L148-L153 WeakPolarHBondContact O-CA 3.38Å; L148-L153 WeakPolarHBondContact O-CB 3.12Å; L148-L153 PolarHBondContact O-N 3.47Å; L148-L158 HydrophobicContact CD1-CD2 3.55Å; L148-L158 HydrophobicContact CD1-CG 3.68Å; L148-L158 HydrophobicContact CD2-CD2 3.84Å; L148-L158 HydrophobicContact CG-CD2 4.34Å; L148-M159 HydrophobicContact CB-CE 3.72Å; L148-M159 HydrophobicContact CD1-CE 4.4Å; L148-I162 HydrophobicContact CD1-CD1 3.57Å
149	H	88.1	Confident	90.6	Very high	58 Å²	58	40.7 Å²	40.7	27%	0.269	23%	0.227	S	C	.	.	H	α-helix	trans	-62.1	-47.2	175.3	177.5	-81.8	0	0	0	111.8	A145 V146 I147 Q151 L152 M159	A145-H149 WeakPolarHBondContact O-CB 3.31Å; A145-H149 PolarHBondContact O-N 3.08Å; V146-H149 PolarHBondContact O-N 3.41Å; I147-H149 VanDerWaalsContact C-N 3.3Å; I147-H149 PolarHBondContact O-N 3.41Å; H149-Q151 PolarHBondContact O-N 3Å; H149-L152 PolarHBondContact O-N 2.57Å; H149-M159 HydrophobicContact CB-CE 4.48Å
150	D	87.1	Confident	90.7	Very high	83 Å²	83	39.4 Å²	39.4	44%	0.444	22%	0.224	S	C	.	.	H	α-helix	trans	-62.8	-27.7	177.8	-75.3	1	0	0	0	112.1	R112 V146 I147 L152	R112-D150 IonicContact CZ-OD2 3.26Å; R112-D150 IonicContact NH1-OD2 3.58Å; R112-D150 IonicContact NH2-OD2 2.75Å; R112-D150 PolarHBondContact NH2-OD2 3.18Å; V146-D150 WeakPolarHBondContact O-CB 3.46Å; V146-D150 PolarHBondContact O-N 3.08Å; I147-D150 PolarHBondContact O-N 3.03Å; D150-L152 VanDerWaalsContact C-N 3.27Å; D150-L152 PolarHBondContact O-N 2.75Å
151	Q	86.1	Confident	90.7	Very high	39 Å²	39	42.4 Å²	42.4	18%	0.182	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	8.8	172.9	-68.5	-178.2	-4.3	0	0	114.2	L111 P117 I147 L148 H149 L153	L111-Q151 VanDerWaalsContact CD1-NE2 3.35Å; P117-Q151 HydrophobicContact CB-CG 4.5Å; P117-Q151 HydrophobicContact CG-CG 4.42Å; I147-Q151 WeakPolarHBondContact O-CG 3.3Å; I147-Q151 PolarHBondContact O-N 3.02Å; L148-Q151 CarbonylContact O-C 3.48Å; L148-Q151 PolarHBondContact O-N 3.49Å; H149-Q151 PolarHBondContact O-N 3Å; Q151-L153 HydrophobicContact CB-CD1 4.25Å; Q151-L153 HydrophobicContact CB-CG 4.26Å; Q151-L153 PolarHBondContact O-N 3.32Å
152	L	84.3	Confident	90.7	Very high	139 Å²	139	42.4 Å²	42.4	73%	0.728	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.3	23.2	-177.3	-52.5	172.7	0	0	0	114.3	L148 H149 D150 H154	L148-L152 PolarHBondContact O-N 3.28Å; H149-L152 PolarHBondContact O-N 2.57Å; D150-L152 VanDerWaalsContact C-N 3.27Å; D150-L152 PolarHBondContact O-N 2.75Å; L152-H154 VanDerWaalsContact C-N 3.33Å; L152-H154 PolarHBondContact O-N 3.43Å
153	L	85.6	Confident	90.7	Very high	73 Å²	73	42.6 Å²	42.6	38%	0.382	24%	0.238	S	C	.	.			trans	-95.7	26.9	177.6	-61.3	174.5	0	0	0	113	L148 Q151 S155 S156	L148-L153 HydrophobicContact CB-CB 4.33Å; L148-L153 HydrophobicContact CD2-CD1 3.99Å; L148-L153 WeakPolarHBondContact O-CA 3.38Å; L148-L153 WeakPolarHBondContact O-CB 3.12Å; L148-L153 PolarHBondContact O-N 3.47Å; Q151-L153 HydrophobicContact CB-CD1 4.25Å; Q151-L153 HydrophobicContact CB-CG 4.26Å; Q151-L153 PolarHBondContact O-N 3.32Å; L153-S155 PolarHBondContact O-N 3.05Å; L153-S156 VanDerWaalsContact O-CB 3.28Å; L153-S156 WeakPolarHBondContact O-CB 3.35Å; L153-S156 PolarHBondContact O-N 3.44Å; L153-S156 VanDerWaalsContact O-N 3.13Å; L153-S156 PolarHBondContact O-OG 3.34Å
154	H	83.3	Confident	90.8	Very high	54 Å²	54	42.2 Å²	42.2	25%	0.25	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-18.3	-175.9	53.1	-97.8	0	0	0	114.4	L152 M159 N188	L152-H154 VanDerWaalsContact C-N 3.33Å; L152-H154 PolarHBondContact O-N 3.43Å; H154-M159 WeakPolarHBondContact O-CG 3.41Å; H154-N188 PolarHBondContact CD2-ND2 3.25Å
155	S	85.1	Confident	90.8	Very high	78 Å²	78	42.4 Å²	42.4	55%	0.545	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	18	174.3	-56.4	0	0	0	0	113	L153	L153-S155 PolarHBondContact O-N 3.05Å
156	S	90.3	Very high	90.9	Very high	22 Å²	22	42.4 Å²	42.4	15%	0.154	24%	0.241	C	C	.	.	S	Bend	trans	-74.9	156.3	-179.3	65	0	0	0	0	112.3	L153 L158 M159 G160	L153-S156 VanDerWaalsContact O-CB 3.28Å; L153-S156 WeakPolarHBondContact O-CB 3.35Å; L153-S156 PolarHBondContact O-N 3.44Å; L153-S156 VanDerWaalsContact O-N 3.13Å; L153-S156 PolarHBondContact O-OG 3.34Å; S156-L158 PolarHBondContact O-N 2.94Å; S156-M159 PolarHBondContact O-N 3.14Å; S156-M159 PolarHBondContact OG-N 2.96Å; S156-G160 PolarHBondContact O-N 3.21Å
157	P	90.5	Very high	91	Very high	111 Å²	111	43 Å²	43	72%	0.721	24%	0.243	S	C	*	.	H	α-helix	trans	-55.4	-34.5	172.1	-25.3	34.3	0	0	0	112.8	G160 H161	P157-G160 WeakPolarHBondContact O-CA 3.37Å; P157-G160 PolarHBondContact O-N 3.35Å; P157-H161 PolarHBondContact O-N 3.37Å
158	L	92.4	Very high	91.1	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.052	27%	0.27	C	S	.	.	H	α-helix	trans	-63.2	-44	175	179.1	56.7	0	0	0	111.9	W130 F144 L148 S156 G160 H161 I162	W130-L158 HydrophobicContact CB-CD1 4.16Å; W130-L158 HydrophobicContact CB-CD2 4.4Å; W130-L158 VanDerWaalsContact CD1-CD1 3.48Å; W130-L158 HydrophobicContact CD2-CD1 3.98Å; W130-L158 HydrophobicContact CD2-CD2 4.33Å; W130-L158 HydrophobicContact CE3-CD2 4.42Å; W130-L158 HydrophobicContact CG-CD1 3.63Å; W130-L158 HydrophobicContact CG-CD2 4.34Å; F144-L158 HydrophobicContact CE1-CD1 4.32Å; F144-L158 HydrophobicContact CE1-CD2 4Å; F144-L158 HydrophobicContact CE1-CG 4.43Å; F144-L158 HydrophobicContact CZ-CD2 3.9Å; L148-L158 HydrophobicContact CD1-CD2 3.55Å; L148-L158 HydrophobicContact CD1-CG 3.68Å; L148-L158 HydrophobicContact CD2-CD2 3.84Å; L148-L158 HydrophobicContact CG-CD2 4.34Å; S156-L158 PolarHBondContact O-N 2.94Å; L158-G160 VanDerWaalsContact C-N 3.27Å; L158-G160 PolarHBondContact O-N 3.43Å; L158-H161 WeakPolarHBondContact O-CB 3.39Å; L158-H161 PolarHBondContact O-N 3.12Å; L158-I162 HydrophobicContact CG-CD1 4.5Å; L158-I162 WeakPolarHBondContact O-CG1 3.28Å; L158-I162 PolarHBondContact O-N 3.1Å
159	M	94.6	Very high	91.4	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.1	-35.3	173.8	-168.3	62.7	76.6	0	0	111.4	A145 L148 H149 H154 S156 I162 T163 V186 L189	A145-M159 HydrophobicContact CB-CE 4.47Å; A145-M159 HydrophobicContact CB-SD 4.34Å; A145-M159 WeakPolarHBondContact O-CE 3.24Å; L148-M159 HydrophobicContact CB-CE 3.72Å; L148-M159 HydrophobicContact CD1-CE 4.4Å; H149-M159 HydrophobicContact CB-CE 4.48Å; H154-M159 WeakPolarHBondContact O-CG 3.41Å; S156-M159 PolarHBondContact O-N 3.14Å; S156-M159 PolarHBondContact OG-N 2.96Å; M159-I162 PolarHBondContact O-N 3.32Å; M159-I162 HydrophobicContact SD-CB 4.47Å; M159-I162 HydrophobicContact SD-CD1 4.38Å; M159-T163 WeakPolarHBondContact O-CB 3.33Å; M159-T163 PolarHBondContact O-N 3.43Å; M159-T163 PolarHBondContact O-OG1 3.14Å; M159-V186 HydrophobicContact SD-CG1 4.06Å; M159-L189 HydrophobicContact CB-CD1 3.83Å; M159-L189 HydrophobicContact CG-CD1 3.72Å
160	G	94.4	Very high	91.7	Very high	31 Å²	31	51.2 Å²	51.2	32%	0.32	28%	0.278	S	S	.	.	H	α-helix	trans	-59.5	-43.7	171	0	0	0	0	0	112.9	S156 P157 L158 T163 N164	S156-G160 PolarHBondContact O-N 3.21Å; P157-G160 WeakPolarHBondContact O-CA 3.37Å; P157-G160 PolarHBondContact O-N 3.35Å; L158-G160 VanDerWaalsContact C-N 3.27Å; L158-G160 PolarHBondContact O-N 3.43Å; G160-T163 WeakPolarHBondContact O-CB 3.33Å; G160-T163 PolarHBondContact O-N 3.22Å; G160-N164 PolarHBondContact O-N 3.12Å
161	H	94.7	Very high	91.9	Very high	64 Å²	64	52.1 Å²	52.1	30%	0.296	29%	0.291	S	S	.	.	H	α-helix	trans	-64	-43	175.4	-162.5	83.8	0	0	0	112.1	V133 D134 P157 L158 T163 N164 I165	V133-H161 VanDerWaalsContact CG1-CD2 3.43Å; V133-H161 WeakPolarHBondContact CG1-CD2 3.31Å; D134-H161 IonicContact OD1-CD2 3.97Å; D134-H161 IonicContact OD1-CE1 3.77Å; D134-H161 IonicContact OD1-NE2 3.91Å; D134-H161 PolarHBondContact OD1-NE2 2.9Å; D134-H161 IonicContact OD2-NE2 2.64Å; P157-H161 PolarHBondContact O-N 3.37Å; L158-H161 WeakPolarHBondContact O-CB 3.39Å; L158-H161 PolarHBondContact O-N 3.12Å; H161-T163 VanDerWaalsContact C-N 3.26Å; H161-T163 PolarHBondContact O-N 3.5Å; H161-N164 WeakPolarHBondContact O-CB 3.45Å; H161-N164 PolarHBondContact O-N 3.06Å; H161-I165 WeakPolarHBondContact O-CG1 3.49Å; H161-I165 PolarHBondContact O-N 2.94Å
162	I	95.6	Very high	92.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-39.4	173.4	-66.6	172.6	0	0	0	111	V133 L141 F144 A145 L148 L158 M159 N164 I165 L166 L182 V186	V133-I162 HydrophobicContact CG2-CG1 4.07Å; L141-I162 HydrophobicContact CD1-CG1 4.01Å; L141-I162 HydrophobicContact CD1-CG2 4.23Å; L141-I162 HydrophobicContact CD2-CG2 4.32Å; L141-I162 HydrophobicContact CG-CG2 4.1Å; F144-I162 HydrophobicContact CD1-CD1 4.02Å; F144-I162 HydrophobicContact CE1-CD1 4.38Å; A145-I162 HydrophobicContact CB-CD1 4.4Å; A145-I162 HydrophobicContact CB-CG2 4.22Å; L148-I162 HydrophobicContact CD1-CD1 3.57Å; L158-I162 HydrophobicContact CG-CD1 4.5Å; L158-I162 WeakPolarHBondContact O-CG1 3.28Å; L158-I162 PolarHBondContact O-N 3.1Å; M159-I162 PolarHBondContact O-N 3.32Å; M159-I162 HydrophobicContact SD-CB 4.47Å; M159-I162 HydrophobicContact SD-CD1 4.38Å; I162-N164 VanDerWaalsContact C-N 3.33Å; I162-N164 PolarHBondContact O-N 2.86Å; I162-I165 PolarHBondContact O-N 3.08Å; I162-L166 WeakPolarHBondContact O-CB 3.5Å; I162-L166 PolarHBondContact O-N 3.28Å; I162-L182 HydrophobicContact CG2-CD2 4.24Å; I162-V186 HydrophobicContact CG2-CG1 4.48Å
163	T	95.6	Very high	92.6	Very high	12 Å²	12	46.8 Å²	46.8	7%	0.074	27%	0.269	C	S	.	.	H	α-helix	trans	-65.1	-38.8	179.1	-55	0	0	0	0	110.9	M159 G160 H161 L166 D167 V186 L189 L194	M159-T163 WeakPolarHBondContact O-CB 3.33Å; M159-T163 PolarHBondContact O-N 3.43Å; M159-T163 PolarHBondContact O-OG1 3.14Å; G160-T163 WeakPolarHBondContact O-CB 3.33Å; G160-T163 PolarHBondContact O-N 3.22Å; H161-T163 VanDerWaalsContact C-N 3.26Å; H161-T163 PolarHBondContact O-N 3.5Å; T163-L166 WeakPolarHBondContact O-CB 3.5Å; T163-L166 PolarHBondContact O-N 2.92Å; T163-D167 PolarHBondContact O-N 2.75Å; T163-V186 HydrophobicContact CG2-CB 4.36Å; T163-V186 WeakPolarHBondContact OG1-CG1 3.4Å; T163-L189 HydrophobicContact CG2-CB 4.38Å; T163-L194 HydrophobicContact CG2-CD2 3.63Å
164	N	95.5	Very high	92.9	Very high	75 Å²	75	49.3 Å²	49.3	40%	0.401	28%	0.283	S	S	.	.	H	α-helix	trans	-66.5	-42.4	174	-173.8	37	0	0	0	112.5	G160 H161 I162 L166 D167 Q168	G160-N164 PolarHBondContact O-N 3.12Å; H161-N164 WeakPolarHBondContact O-CB 3.45Å; H161-N164 PolarHBondContact O-N 3.06Å; I162-N164 VanDerWaalsContact C-N 3.33Å; I162-N164 PolarHBondContact O-N 2.86Å; N164-L166 VanDerWaalsContact C-N 3.29Å; N164-L166 PolarHBondContact O-N 3.08Å; N164-D167 PolarHBondContact O-N 3.3Å; N164-Q168 PolarHBondContact ND2-NE2 3.32Å; N164-Q168 WeakPolarHBondContact O-CG 3.43Å; N164-Q168 PolarHBondContact O-N 3.41Å; N164-Q168 VanDerWaalsContact O-N 3.11Å; N164-Q168 PolarHBondContact OD1-NE2 3.18Å
165	I	95.4	Very high	93.3	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-60.9	-41.9	174.6	-65.5	167.3	0	0	0	110.6	V133 M138 L141 H161 I162 Q168 R169	V133-I165 HydrophobicContact CG1-CD1 4.27Å; V133-I165 HydrophobicContact CG2-CD1 3.97Å; M138-I165 HydrophobicContact CE-CG2 4.2Å; L141-I165 HydrophobicContact CD2-CB 4.24Å; L141-I165 HydrophobicContact CD2-CG2 3.68Å; H161-I165 WeakPolarHBondContact O-CG1 3.49Å; H161-I165 PolarHBondContact O-N 2.94Å; I162-I165 PolarHBondContact O-N 3.08Å; I165-Q168 PolarHBondContact O-N 3.03Å; I165-R169 WeakPolarHBondContact O-CB 3.29Å; I165-R169 PolarHBondContact O-N 2.88Å
166	L	95.8	Very high	93.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.8	-45.6	176.4	173.7	58.6	0	0	0	111.6	I162 T163 N164 Q168 R169 L170 I173 L182 V186 L198	I162-L166 WeakPolarHBondContact O-CB 3.5Å; I162-L166 PolarHBondContact O-N 3.28Å; T163-L166 WeakPolarHBondContact O-CB 3.5Å; T163-L166 PolarHBondContact O-N 2.92Å; N164-L166 VanDerWaalsContact C-N 3.29Å; N164-L166 PolarHBondContact O-N 3.08Å; L166-Q168 VanDerWaalsContact C-N 3.34Å; L166-Q168 PolarHBondContact O-N 2.98Å; L166-R169 PolarHBondContact O-N 3.11Å; L166-L170 HydrophobicContact CD1-CD1 4.09Å; L166-L170 WeakPolarHBondContact O-CA 3.41Å; L166-L170 WeakPolarHBondContact O-CB 3.33Å; L166-L170 PolarHBondContact O-N 3.24Å; L166-I173 HydrophobicContact CD1-CD1 3.49Å; L166-I173 VanDerWaalsContact CD1-CD1 3.49Å; L166-L182 HydrophobicContact CD1-CD1 4.14Å; L166-L182 HydrophobicContact CD2-CB 4.16Å; L166-V186 HydrophobicContact CD2-CG1 4.28Å; L166-V186 HydrophobicContact CD2-CG2 3.79Å; L166-L198 HydrophobicContact CD1-CD2 4.16Å; L166-L198 HydrophobicContact CD2-CD1 4.45Å; L166-L198 HydrophobicContact CD2-CD2 3.98Å; L166-L198 HydrophobicContact CG-CD2 4.21Å
167	D	95.1	Very high	93.7	Very high	45 Å²	45	53.3 Å²	53.3	24%	0.241	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-43.5	177.7	-167.4	27.1	0	0	0	111.8	T163 N164 R193 L194	T163-D167 PolarHBondContact O-N 2.75Å; N164-D167 PolarHBondContact O-N 3.3Å; D167-R193 IonicContact OD1-NH2 3.54Å; D167-R193 IonicContact OD2-CZ 3.37Å; D167-R193 IonicContact OD2-NH2 3.09Å; D167-R193 PolarHBondContact OD2-NH2 3.18Å; D167-L194 HydrophobicContact CB-CD1 3.96Å; D167-L194 HydrophobicContact CB-CD2 4.23Å
168	Q	94.6	Very high	93.9	Very high	126 Å²	126	48.9 Å²	48.9	59%	0.589	26%	0.259	S	S	*	.	H	α-helix	trans	-71.6	-33.3	-178.7	-67.4	173.7	14.1	0	0	113.8	N164 I165 L166	N164-Q168 PolarHBondContact ND2-NE2 3.32Å; N164-Q168 WeakPolarHBondContact O-CG 3.43Å; N164-Q168 PolarHBondContact O-N 3.41Å; N164-Q168 VanDerWaalsContact O-N 3.11Å; N164-Q168 PolarHBondContact OD1-NE2 3.18Å; I165-Q168 PolarHBondContact O-N 3.03Å; L166-Q168 VanDerWaalsContact C-N 3.34Å; L166-Q168 PolarHBondContact O-N 2.98Å
169	R	95	Very high	94.1	Very high	91 Å²	91	48.4 Å²	48.4	34%	0.343	26%	0.257	S	S	.	.	H	α-helix	trans	-117.2	17.5	-169.5	-63.1	-177.7	-169.8	174.9	6.2	113.2	D134 M138 I165 L166 S171 S172	D134-R169 PolarHBondContact O-NH1 3.2Å; D134-R169 PolarHBondContact O-NH2 3.31Å; M138-R169 HydrophobicContact CE-CB 3.14Å; M138-R169 HydrophobicContact CE-CG 4.07Å; I165-R169 WeakPolarHBondContact O-CB 3.29Å; I165-R169 PolarHBondContact O-N 2.88Å; L166-R169 PolarHBondContact O-N 3.11Å; R169-S171 VanDerWaalsContact C-N 3.25Å; R169-S171 PolarHBondContact O-N 3.27Å; R169-S172 WeakPolarHBondContact O-CB 3.37Å; R169-S172 PolarHBondContact O-N 3.42Å; R169-S172 PolarHBondContact O-OG 3.09Å
170	L	94.4	Very high	94.1	Very high	20 Å²	20	48.4 Å²	48.4	11%	0.105	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-54.5	-40.4	-177.8	179.7	57.2	0	0	0	113	L166 S172 I173 L179 A197 L198 R201	L166-L170 HydrophobicContact CD1-CD1 4.09Å; L166-L170 WeakPolarHBondContact O-CA 3.41Å; L166-L170 WeakPolarHBondContact O-CB 3.33Å; L166-L170 PolarHBondContact O-N 3.24Å; L170-S172 PolarHBondContact O-N 3.08Å; L170-I173 HydrophobicContact CD1-CD1 4.27Å; L170-I173 PolarHBondContact O-N 3.45Å; L170-L179 HydrophobicContact CD1-CD1 3.73Å; L170-A197 HydrophobicContact CD2-CB 3.68Å; L170-L198 HydrophobicContact CD1-CD2 3.68Å; L170-L198 HydrophobicContact CD2-CD2 4.46Å; L170-R201 HydrophobicContact CD1-CB 4.17Å; L170-R201 HydrophobicContact CD1-CG 4.08Å; L170-R201 HydrophobicContact CD2-CB 4.39Å; L170-R201 HydrophobicContact CG-CB 4.28Å; L170-R201 HydrophobicContact CG-CG 4.33Å
171	S	92.2	Very high	94.1	Very high	101 Å²	101	47.2 Å²	47.2	71%	0.706	24%	0.244	S	C	*	.	G	3₁₀ helix	trans	-62.2	-24.5	179.6	56	0	0	0	0	113.7	R169 I173	R169-S171 VanDerWaalsContact C-N 3.25Å; R169-S171 PolarHBondContact O-N 3.27Å; S171-I173 VanDerWaalsContact C-N 3.28Å; S171-I173 PolarHBondContact O-N 2.99Å
172	S	92.9	Very high	94.2	Very high	64 Å²	64	44.1 Å²	44.1	45%	0.448	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-78.3	-7.6	179.1	73.3	0	0	0	0	114.1	R169 L170 D174	R169-S172 WeakPolarHBondContact O-CB 3.37Å; R169-S172 PolarHBondContact O-N 3.42Å; R169-S172 PolarHBondContact O-OG 3.09Å; L170-S172 PolarHBondContact O-N 3.08Å; S172-D174 PolarHBondContact O-N 3.44Å
173	I	92.6	Very high	94.2	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.015	23%	0.23	C	C	.	.			trans	-89.4	100.5	-175.6	-55.7	176	0	0	0	109.5	M138 L166 L170 S171 V178 L179 L182 R201	M138-I173 HydrophobicContact CB-CG1 4.32Å; M138-I173 HydrophobicContact CG-CG1 3.87Å; M138-I173 HydrophobicContact SD-CD1 3.99Å; M138-I173 HydrophobicContact SD-CG1 4.01Å; L166-I173 HydrophobicContact CD1-CD1 3.49Å; L166-I173 VanDerWaalsContact CD1-CD1 3.49Å; L170-I173 HydrophobicContact CD1-CD1 4.27Å; L170-I173 PolarHBondContact O-N 3.45Å; S171-I173 VanDerWaalsContact C-N 3.28Å; S171-I173 PolarHBondContact O-N 2.99Å; I173-V178 HydrophobicContact CG2-CB 4.25Å; I173-V178 HydrophobicContact CG2-CG1 4.11Å; I173-L179 HydrophobicContact CD1-CD1 4.22Å; I173-L179 HydrophobicContact CG2-CB 3.89Å; I173-L182 HydrophobicContact CD1-CD1 3.99Å; I173-R201 VanDerWaalsContact O-CZ 3.31Å; I173-R201 PolarHBondContact O-NE 3.1Å; I173-R201 VanDerWaalsContact O-NE 3.07Å; I173-R201 PolarHBondContact O-NH2 3.18Å
174	D	90.8	Very high	94.2	Very high	126 Å²	126	44.3 Å²	44.3	67%	0.674	23%	0.231	S	C	*	.			trans	-94.5	-12	176.7	-61.4	-41.6	0	0	0	113.7	S172 R201 L205	S172-D174 PolarHBondContact O-N 3.44Å; D174-R201 IonicContact OD1-NH2 2.94Å; D174-R201 PolarHBondContact OD1-NH2 3.25Å; D174-L205 WeakPolarHBondContact O-CD2 3.43Å
175	N	91.3	Very high	94.1	Very high	84 Å²	84	40.9 Å²	40.9	45%	0.449	21%	0.213	S	C	.	.			trans	-99.3	111.9	-177.9	-170	-35.5	0	0	0	111.2	R177 V178 L179	N175-R177 PolarHBondContact O-N 3.12Å; N175-R177 VanDerWaalsContact O-N 3.11Å; N175-R177 VanDerWaalsContact OD1-CB 3.29Å; N175-R177 WeakPolarHBondContact OD1-CB 3.5Å; N175-R177 PolarHBondContact OD1-N 3.09Å; N175-V178 HydrophobicContact CB-CB 4.15Å; N175-V178 HydrophobicContact CB-CG2 3.81Å; N175-V178 WeakPolarHBondContact O-CB 3.44Å; N175-V178 PolarHBondContact O-N 3.42Å; N175-L179 PolarHBondContact O-N 2.75Å; N175-L179 VanDerWaalsContact O-N 3.13Å
176	A	92.3	Very high	94.1	Very high	6 Å²	6	40.8 Å²	40.8	5%	0.05	21%	0.212	C	C	.	.	H	α-helix	trans	-56.4	-30.2	180	0	0	0	0	0	113.5	A180 L205 N209 T216	A176-A180 VanDerWaalsContact O-CB 3.28Å; A176-A180 WeakPolarHBondContact O-CB 3.4Å; A176-A180 PolarHBondContact O-N 3.07Å; A176-L205 HydrophobicContact CB-CB 4.02Å; A176-L205 HydrophobicContact CB-CD1 4.46Å; A176-N209 HydrophobicContact CB-CB 4.5Å; A176-T216 HydrophobicContact CB-CG2 3.74Å; A176-T216 WeakPolarHBondContact O-CG2 3.43Å
177	R	92.8	Very high	94	Very high	147 Å²	147	41.3 Å²	41.3	56%	0.555	22%	0.216	S	C	*	.	H	α-helix	trans	-69.2	-37.8	176.6	-62.4	177.9	175.9	173.2	0.6	112.3	N175 A181 N213 T216	N175-R177 PolarHBondContact O-N 3.12Å; N175-R177 VanDerWaalsContact O-N 3.11Å; N175-R177 VanDerWaalsContact OD1-CB 3.29Å; N175-R177 WeakPolarHBondContact OD1-CB 3.5Å; N175-R177 PolarHBondContact OD1-N 3.09Å; R177-A181 WeakPolarHBondContact O-CB 3.49Å; R177-A181 PolarHBondContact O-N 3.35Å; R177-A181 VanDerWaalsContact O-N 3.14Å; R177-N213 PolarHBondContact NE-ND2 3.14Å; R177-N213 VanDerWaalsContact NE-ND2 3.18Å; R177-T216 WeakPolarHBondContact CG-OG1 3.35Å
178	V	94.4	Very high	93.6	Very high	18 Å²	18	43.4 Å²	43.4	11%	0.109	23%	0.227	C	C	.	.	H	α-helix	trans	-67.3	-47.9	178.1	173.2	0	0	0	0	109.2	M138 S142 I173 N175 A181 L182	M138-V178 HydrophobicContact CB-CG1 4.1Å; M138-V178 WeakPolarHBondContact O-CG1 3.38Å; S142-V178 PolarHBondContact OG-O 2.77Å; S142-V178 VanDerWaalsContact OG-O 3.14Å; I173-V178 HydrophobicContact CG2-CB 4.25Å; I173-V178 HydrophobicContact CG2-CG1 4.11Å; N175-V178 HydrophobicContact CB-CB 4.15Å; N175-V178 HydrophobicContact CB-CG2 3.81Å; N175-V178 WeakPolarHBondContact O-CB 3.44Å; N175-V178 PolarHBondContact O-N 3.42Å; V178-A181 PolarHBondContact O-N 3.5Å; V178-L182 HydrophobicContact CG1-CD1 4.1Å; V178-L182 PolarHBondContact O-N 3.28Å; V178-L182 VanDerWaalsContact O-N 3.08Å
179	L	95.8	Very high	93.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.5	-53.3	176.2	-175.8	65.1	0	0	0	111.5	L170 I173 N175 A181 L182 M183 L198 R201 A202 L205	L170-L179 HydrophobicContact CD1-CD1 3.73Å; I173-L179 HydrophobicContact CD1-CD1 4.22Å; I173-L179 HydrophobicContact CG2-CB 3.89Å; N175-L179 PolarHBondContact O-N 2.75Å; N175-L179 VanDerWaalsContact O-N 3.13Å; L179-A181 VanDerWaalsContact C-N 3.27Å; L179-A181 PolarHBondContact O-N 3.13Å; L179-L182 PolarHBondContact O-N 3.09Å; L179-L182 VanDerWaalsContact O-N 3.07Å; L179-M183 HydrophobicContact CD1-CG 4.36Å; L179-M183 HydrophobicContact CD1-SD 4.48Å; L179-M183 HydrophobicContact CD2-SD 4.23Å; L179-M183 HydrophobicContact CG-CG 4.22Å; L179-M183 HydrophobicContact CG-SD 3.82Å; L179-M183 VanDerWaalsContact O-CG 3.3Å; L179-M183 WeakPolarHBondContact O-CG 3.44Å; L179-M183 PolarHBondContact O-N 3.42Å; L179-L198 HydrophobicContact CD1-CD2 3.72Å; L179-R201 HydrophobicContact CD2-CB 4.24Å; L179-R201 HydrophobicContact CD2-CG 3.96Å; L179-A202 HydrophobicContact CD2-CB 4.03Å; L179-L205 HydrophobicContact CB-CD1 4.18Å; L179-L205 HydrophobicContact CD2-CD1 3.74Å
180	A	95.1	Very high	93.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64	-31.7	-175.9	0	0	0	0	0	113.3	A176 V184 T216 R219 M220	A176-A180 VanDerWaalsContact O-CB 3.28Å; A176-A180 WeakPolarHBondContact O-CB 3.4Å; A176-A180 PolarHBondContact O-N 3.07Å; A180-V184 WeakPolarHBondContact O-CG2 3.38Å; A180-V184 PolarHBondContact O-N 3.13Å; A180-T216 HydrophobicContact CB-CG2 3.92Å; A180-R219 HydrophobicContact CB-CB 3.9Å; A180-M220 HydrophobicContact CB-CE 4.32Å; A180-M220 HydrophobicContact CB-CG 4.05Å
181	A	94.9	Very high	93.1	Very high	6 Å²	6	39.1 Å²	39.1	5%	0.05	22%	0.22	C	C	.	.	H	α-helix	trans	-67.6	-44.7	172.1	0	0	0	0	0	111.8	S142 V146 R177 V178 L179 V184 S185	S142-A181 VanDerWaalsContact OG-CB 3.24Å; S142-A181 WeakPolarHBondContact OG-CB 3.28Å; V146-A181 HydrophobicContact CG2-CB 4.02Å; R177-A181 WeakPolarHBondContact O-CB 3.49Å; R177-A181 PolarHBondContact O-N 3.35Å; R177-A181 VanDerWaalsContact O-N 3.14Å; V178-A181 PolarHBondContact O-N 3.5Å; L179-A181 VanDerWaalsContact C-N 3.27Å; L179-A181 PolarHBondContact O-N 3.13Å; A181-V184 PolarHBondContact O-N 3.27Å; A181-S185 PolarHBondContact O-N 3.47Å; A181-S185 VanDerWaalsContact O-N 3.1Å; A181-S185 PolarHBondContact O-OG 2.73Å
182	L	96.1	Very high	92.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.5	-45.7	176.3	-76.2	163.7	0	0	0	111.6	M138 A145 I162 L166 I173 V178 L179 V184 S185 V186	M138-L182 HydrophobicContact SD-CD1 4.46Å; A145-L182 HydrophobicContact CB-CD2 3.87Å; I162-L182 HydrophobicContact CG2-CD2 4.24Å; L166-L182 HydrophobicContact CD1-CD1 4.14Å; L166-L182 HydrophobicContact CD2-CB 4.16Å; I173-L182 HydrophobicContact CD1-CD1 3.99Å; V178-L182 HydrophobicContact CG1-CD1 4.1Å; V178-L182 PolarHBondContact O-N 3.28Å; V178-L182 VanDerWaalsContact O-N 3.08Å; L179-L182 PolarHBondContact O-N 3.09Å; L179-L182 VanDerWaalsContact O-N 3.07Å; L182-V184 VanDerWaalsContact C-N 3.32Å; L182-V184 PolarHBondContact O-N 2.83Å; L182-S185 PolarHBondContact O-N 3.02Å; L182-V186 VanDerWaalsContact O-CG2 3.27Å; L182-V186 WeakPolarHBondContact O-CG2 3.29Å; L182-V186 PolarHBondContact O-N 3.38Å
183	M	96.1	Very high	92.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-51.1	-50.2	177.1	-72.5	171.2	77.5	0	0	111.5	L179 S187 L198 A202 M220 F223	L179-M183 HydrophobicContact CD1-CG 4.36Å; L179-M183 HydrophobicContact CD1-SD 4.48Å; L179-M183 HydrophobicContact CD2-SD 4.23Å; L179-M183 HydrophobicContact CG-CG 4.22Å; L179-M183 HydrophobicContact CG-SD 3.82Å; L179-M183 VanDerWaalsContact O-CG 3.3Å; L179-M183 WeakPolarHBondContact O-CG 3.44Å; L179-M183 PolarHBondContact O-N 3.42Å; M183-S187 PolarHBondContact O-N 3.36Å; M183-L198 HydrophobicContact CG-CB 4.46Å; M183-L198 HydrophobicContact CG-CD1 4.46Å; M183-L198 HydrophobicContact CG-CD2 4.18Å; M183-A202 HydrophobicContact CE-CB 4.19Å; M183-A202 HydrophobicContact SD-CB 4.19Å; M183-M220 HydrophobicContact CE-CG 4.34Å; M183-M220 HydrophobicContact SD-CG 4.16Å; M183-F223 HydrophobicContact CB-CB 3.9Å; M183-F223 HydrophobicContact CB-CD1 4.43Å; M183-F223 HydrophobicContact CB-CD2 3.79Å; M183-F223 HydrophobicContact CB-CE2 4.36Å; M183-F223 HydrophobicContact CB-CG 3.78Å; M183-F223 HydrophobicContact CE-CB 4.12Å; M183-F223 HydrophobicContact CE-CD1 3.18Å; M183-F223 HydrophobicContact CE-CE1 3.61Å; M183-F223 HydrophobicContact CE-CG 3.71Å; M183-F223 HydrophobicContact CE-CZ 4.44Å; M183-F223 HydrophobicContact CG-CG 4.44Å; M183-F223 WeakPolarHBondContact O-CD2 3.46Å
184	V	95	Very high	92.7	Very high	16 Å²	16	41.6 Å²	41.6	10%	0.097	21%	0.21	C	C	.	.	H	α-helix	trans	-64.2	-43.2	177.7	175.4	0	0	0	0	111.6	A180 A181 L182 S187 R219 Q222	A180-V184 WeakPolarHBondContact O-CG2 3.38Å; A180-V184 PolarHBondContact O-N 3.13Å; A181-V184 PolarHBondContact O-N 3.27Å; L182-V184 VanDerWaalsContact C-N 3.32Å; L182-V184 PolarHBondContact O-N 2.83Å; V184-S187 PolarHBondContact O-OG 3.46Å; V184-R219 HydrophobicContact CG2-CB 3.92Å; V184-R219 HydrophobicContact CG2-CG 4.32Å; V184-R219 VanDerWaalsContact CG2-O 3.31Å; V184-R219 WeakPolarHBondContact CG2-O 3.19Å; V184-Q222 HydrophobicContact CG2-CB 4.4Å; V184-Q222 HydrophobicContact CG2-CG 4.4Å
185	S	94.3	Very high	92.9	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-66.1	-37.6	-177.5	-66.8	0	0	0	0	113.9	A145 V146 A181 L182	A145-S185 PolarHBondContact O-OG 3.13Å; V146-S185 PolarHBondContact N-OG 3.07Å; A181-S185 PolarHBondContact O-N 3.47Å; A181-S185 VanDerWaalsContact O-N 3.1Å; A181-S185 PolarHBondContact O-OG 2.73Å; L182-S185 PolarHBondContact O-N 3.02Å
186	V	94.6	Very high	92.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-92.7	-1.9	-175.4	-58.1	0	0	0	0	113.9	M159 I162 T163 L166 L182 N188 L189 V190	M159-V186 HydrophobicContact SD-CG1 4.06Å; I162-V186 HydrophobicContact CG2-CG1 4.48Å; T163-V186 HydrophobicContact CG2-CB 4.36Å; T163-V186 WeakPolarHBondContact OG1-CG1 3.4Å; L166-V186 HydrophobicContact CD2-CG1 4.28Å; L166-V186 HydrophobicContact CD2-CG2 3.79Å; L182-V186 VanDerWaalsContact O-CG2 3.27Å; L182-V186 WeakPolarHBondContact O-CG2 3.29Å; L182-V186 PolarHBondContact O-N 3.38Å; V186-N188 PolarHBondContact O-N 2.94Å; V186-L189 PolarHBondContact O-N 2.84Å; V186-V190 HydrophobicContact CB-CG2 4.17Å; V186-V190 HydrophobicContact CG2-CG2 3.49Å; V186-V190 VanDerWaalsContact CG2-CG2 3.49Å; V186-V190 VanDerWaalsContact O-CG2 3.3Å; V186-V190 WeakPolarHBondContact O-CG2 3.3Å; V186-V190 PolarHBondContact O-N 2.9Å
187	S	93.7	Very high	93	Very high	11 Å²	11	38.2 Å²	38.2	8%	0.077	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-32.4	-164.2	64.6	0	0	0	0	115.5	M183 V184 L189 S226	M183-S187 PolarHBondContact O-N 3.36Å; V184-S187 PolarHBondContact O-OG 3.46Å; S187-L189 VanDerWaalsContact C-N 3.32Å; S187-L189 PolarHBondContact O-N 2.94Å; S187-S226 VanDerWaalsContact CB-CB 3.44Å; S187-S226 WeakPolarHBondContact OG-CB 3.36Å
188	N	87.9	Confident	93.2	Very high	89 Å²	89	31.2 Å²	31.2	48%	0.476	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-11	-176.6	-61.1	-9.4	0	0	0	113.8	H154 V186	H154-N188 PolarHBondContact CD2-ND2 3.25Å; V186-N188 PolarHBondContact O-N 2.94Å
189	L	91.4	Very high	93.2	Very high	62 Å²	62	30.5 Å²	30.5	33%	0.325	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-1.8	-175.3	-57.7	179.6	0	0	0	112.8	M159 T163 V186 S187 S191	M159-L189 HydrophobicContact CB-CD1 3.83Å; M159-L189 HydrophobicContact CG-CD1 3.72Å; T163-L189 HydrophobicContact CG2-CB 4.38Å; V186-L189 PolarHBondContact O-N 2.84Å; S187-L189 VanDerWaalsContact C-N 3.32Å; S187-L189 PolarHBondContact O-N 2.94Å; L189-S191 PolarHBondContact O-N 2.91Å
190	V	92.6	Very high	93.1	Very high	26 Å²	26	34.2 Å²	34.2	16%	0.158	19%	0.189	C	C	.	.			trans	-73.7	126.2	-175	179.9	0	0	0	0	110.8	V186 L194 R195 L198 F223	V186-V190 HydrophobicContact CB-CG2 4.17Å; V186-V190 HydrophobicContact CG2-CG2 3.49Å; V186-V190 VanDerWaalsContact CG2-CG2 3.49Å; V186-V190 VanDerWaalsContact O-CG2 3.3Å; V186-V190 WeakPolarHBondContact O-CG2 3.3Å; V186-V190 PolarHBondContact O-N 2.9Å; V190-L194 HydrophobicContact CG1-CB 3.97Å; V190-L194 HydrophobicContact CG1-CD2 4.3Å; V190-L194 HydrophobicContact CG1-CG 3.99Å; V190-R195 HydrophobicContact CG1-CB 3.7Å; V190-L198 HydrophobicContact CG1-CD1 4.15Å; V190-L198 HydrophobicContact CG2-CD1 4.21Å; V190-F223 HydrophobicContact CG1-CZ 4.46Å; V190-F223 HydrophobicContact CG2-CE2 4.09Å
191	S	89.1	Confident	93.1	Very high	59 Å²	59	36.6 Å²	36.6	41%	0.413	20%	0.198	S	C	.	.			trans	-75	160.1	169.6	70.4	0	0	0	0	111.2	L189 R193 L194 R195	L189-S191 PolarHBondContact O-N 2.91Å; S191-R193 VanDerWaalsContact C-N 3.27Å; S191-R193 PolarHBondContact O-N 3.34Å; S191-L194 PolarHBondContact O-N 3.34Å; S191-L194 VanDerWaalsContact O-N 3.13Å; S191-L194 PolarHBondContact OG-N 3.06Å; S191-R195 WeakPolarHBondContact O-CB 3.27Å; S191-R195 PolarHBondContact O-N 3.24Å
192	T	86.3	Confident	93.1	Very high	51 Å²	51	36.3 Å²	36.3	31%	0.313	20%	0.195	S	C	.	.	H	α-helix	trans	-58.5	-39.2	178.6	49.7	0	0	0	0	112.6	L194 R195 D196 R482	T192-L194 PolarHBondContact O-N 2.95Å; T192-R195 WeakPolarHBondContact O-CB 3.45Å; T192-R195 PolarHBondContact O-N 3.08Å; T192-D196 PolarHBondContact O-N 2.86Å; T192-D196 VanDerWaalsContact O-OD2 3.13Å; T192-R482 PolarHBondContact OG1-NH2 3.5Å
193	R	89.5	Confident	92.9	Very high	166 Å²	166	38 Å²	38	63%	0.626	20%	0.203	S	C	*	.	H	α-helix	trans	-58.8	-49.8	174.1	-173.5	-172.4	78.9	177	2.2	112.1	D167 S191 R195 D196 A197	D167-R193 IonicContact OD1-NH2 3.54Å; D167-R193 IonicContact OD2-CZ 3.37Å; D167-R193 IonicContact OD2-NH2 3.09Å; D167-R193 PolarHBondContact OD2-NH2 3.18Å; S191-R193 VanDerWaalsContact C-N 3.27Å; S191-R193 PolarHBondContact O-N 3.34Å; R193-R195 VanDerWaalsContact C-N 3.35Å; R193-D196 PolarHBondContact O-N 3.32Å; R193-A197 PolarHBondContact O-N 3.44Å; R193-A197 VanDerWaalsContact O-N 3.09Å
194	L	93.9	Very high	92.7	Very high	4 Å²	4	41 Å²	41	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-68.6	-36.2	-179	177.9	59.3	0	0	0	111.2	T163 D167 V190 S191 T192 D196 A197 L198	T163-L194 HydrophobicContact CG2-CD2 3.63Å; D167-L194 HydrophobicContact CB-CD1 3.96Å; D167-L194 HydrophobicContact CB-CD2 4.23Å; V190-L194 HydrophobicContact CG1-CB 3.97Å; V190-L194 HydrophobicContact CG1-CD2 4.3Å; V190-L194 HydrophobicContact CG1-CG 3.99Å; S191-L194 PolarHBondContact O-N 3.34Å; S191-L194 VanDerWaalsContact O-N 3.13Å; S191-L194 PolarHBondContact OG-N 3.06Å; T192-L194 PolarHBondContact O-N 2.95Å; L194-D196 VanDerWaalsContact C-N 3.34Å; L194-D196 PolarHBondContact O-N 3.32Å; L194-A197 PolarHBondContact O-N 2.89Å; L194-L198 HydrophobicContact CD1-CD1 4.24Å; L194-L198 HydrophobicContact CD1-CG 4Å; L194-L198 HydrophobicContact CG-CD1 3.93Å; L194-L198 HydrophobicContact CG-CG 4.2Å; L194-L198 WeakPolarHBondContact O-CB 3.38Å; L194-L198 WeakPolarHBondContact O-CG 3.45Å; L194-L198 PolarHBondContact O-N 3.31Å
195	R	93.8	Very high	92.6	Very high	36 Å²	36	40.6 Å²	40.6	14%	0.136	22%	0.221	C	C	.	.	H	α-helix	trans	-55.2	-51.4	174.1	178.5	-161	66.5	-165.2	-2.9	110.3	V190 S191 T192 R193 L198 I199 F223 V227	V190-R195 HydrophobicContact CG1-CB 3.7Å; S191-R195 WeakPolarHBondContact O-CB 3.27Å; S191-R195 PolarHBondContact O-N 3.24Å; T192-R195 WeakPolarHBondContact O-CB 3.45Å; T192-R195 PolarHBondContact O-N 3.08Å; R193-R195 VanDerWaalsContact C-N 3.35Å; R195-L198 PolarHBondContact O-N 3.06Å; R195-I199 HydrophobicContact CG-CD1 3.88Å; R195-I199 VanDerWaalsContact O-CG1 3.29Å; R195-I199 WeakPolarHBondContact O-CG1 3.38Å; R195-I199 PolarHBondContact O-N 3.1Å; R195-F223 HydrophobicContact CG-CE1 4.37Å; R195-F223 HydrophobicContact CG-CZ 4.23Å; R195-V227 HydrophobicContact CG-CG2 4.26Å
196	D	91.4	Very high	92.3	Very high	71 Å²	71	41 Å²	41	38%	0.38	22%	0.223	S	C	.	.	H	α-helix	trans	-67.3	-39.3	-176.1	-59.7	-20	0	0	0	110.9	T192 R193 L194 I199 S200	T192-D196 PolarHBondContact O-N 2.86Å; T192-D196 VanDerWaalsContact O-OD2 3.13Å; R193-D196 PolarHBondContact O-N 3.32Å; L194-D196 VanDerWaalsContact C-N 3.34Å; L194-D196 PolarHBondContact O-N 3.32Å; D196-I199 PolarHBondContact O-N 2.93Å; D196-S200 WeakPolarHBondContact O-CB 3.46Å; D196-S200 PolarHBondContact O-N 3.44Å
197	A	94.6	Very high	91.8	Very high	37 Å²	37	46.3 Å²	46.3	31%	0.306	25%	0.251	S	S	.	.	H	α-helix	trans	-62.6	-42.3	173.1	0	0	0	0	0	112.6	L170 R193 L194 S200 R201	L170-A197 HydrophobicContact CD2-CB 3.68Å; R193-A197 PolarHBondContact O-N 3.44Å; R193-A197 VanDerWaalsContact O-N 3.09Å; L194-A197 PolarHBondContact O-N 2.89Å; A197-S200 PolarHBondContact O-N 3.4Å; A197-R201 WeakPolarHBondContact O-CB 3.32Å; A197-R201 PolarHBondContact O-N 3.01Å
198	L	96.4	Very high	91.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.9	-41.6	176.4	-74.3	169.5	0	0	0	111.8	L166 L170 L179 M183 V190 L194 R195 R201 A202 F223	L166-L198 HydrophobicContact CD1-CD2 4.16Å; L166-L198 HydrophobicContact CD2-CD1 4.45Å; L166-L198 HydrophobicContact CD2-CD2 3.98Å; L166-L198 HydrophobicContact CG-CD2 4.21Å; L170-L198 HydrophobicContact CD1-CD2 3.68Å; L170-L198 HydrophobicContact CD2-CD2 4.46Å; L179-L198 HydrophobicContact CD1-CD2 3.72Å; M183-L198 HydrophobicContact CG-CB 4.46Å; M183-L198 HydrophobicContact CG-CD1 4.46Å; M183-L198 HydrophobicContact CG-CD2 4.18Å; V190-L198 HydrophobicContact CG1-CD1 4.15Å; V190-L198 HydrophobicContact CG2-CD1 4.21Å; L194-L198 HydrophobicContact CD1-CD1 4.24Å; L194-L198 HydrophobicContact CD1-CG 4Å; L194-L198 HydrophobicContact CG-CD1 3.93Å; L194-L198 HydrophobicContact CG-CG 4.2Å; L194-L198 WeakPolarHBondContact O-CB 3.38Å; L194-L198 WeakPolarHBondContact O-CG 3.45Å; L194-L198 PolarHBondContact O-N 3.31Å; R195-L198 PolarHBondContact O-N 3.06Å; L198-R201 PolarHBondContact O-N 2.8Å; L198-A202 VanDerWaalsContact O-CB 3.25Å; L198-A202 WeakPolarHBondContact O-CB 3.33Å; L198-A202 PolarHBondContact O-N 3.28Å; L198-F223 HydrophobicContact CD1-CE2 4.31Å; L198-F223 HydrophobicContact CD1-CZ 4Å
199	I	95.1	Very high	90.8	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-50.1	176.9	-71.3	169.1	0	0	0	110.1	R195 D196 R201 A202 E203 F223 L224 Y229 H231 L234	R195-I199 HydrophobicContact CG-CD1 3.88Å; R195-I199 VanDerWaalsContact O-CG1 3.29Å; R195-I199 WeakPolarHBondContact O-CG1 3.38Å; R195-I199 PolarHBondContact O-N 3.1Å; D196-I199 PolarHBondContact O-N 2.93Å; I199-R201 VanDerWaalsContact C-N 3.32Å; I199-R201 PolarHBondContact O-N 3.46Å; I199-A202 WeakPolarHBondContact O-CB 3.4Å; I199-A202 PolarHBondContact O-N 3.3Å; I199-A202 VanDerWaalsContact O-N 3.08Å; I199-E203 WeakPolarHBondContact O-CG 3.25Å; I199-E203 PolarHBondContact O-N 3.41Å; I199-F223 HydrophobicContact CG1-CE1 4.26Å; I199-L224 HydrophobicContact CD1-CD2 3.81Å; I199-L224 HydrophobicContact CG1-CD2 4.12Å; I199-Y229 HydrophobicContact CD1-CD1 3.66Å; I199-Y229 HydrophobicContact CD1-CE1 3.73Å; I199-H231 HydrophobicContact CD1-CB 4.17Å; I199-H231 HydrophobicContact CG2-CB 4.36Å; I199-H231 VanDerWaalsContact CG2-ND1 3.33Å; I199-H231 WeakPolarHBondContact CG2-ND1 3.1Å; I199-L234 HydrophobicContact CG1-CD2 4.34Å; I199-L234 HydrophobicContact CG2-CB 4.48Å; I199-L234 HydrophobicContact CG2-CD2 4.12Å
200	S	93.7	Very high	90.2	Very high	78 Å²	78	50 Å²	50	55%	0.545	27%	0.274	S	S	.	.	H	α-helix	trans	-58.2	-43.7	178.1	-179.6	0	0	0	0	111.9	D196 A197 A202 E203 C204	D196-S200 WeakPolarHBondContact O-CB 3.46Å; D196-S200 PolarHBondContact O-N 3.44Å; A197-S200 PolarHBondContact O-N 3.4Å; S200-A202 PolarHBondContact O-N 3.12Å; S200-E203 PolarHBondContact O-N 3.15Å; S200-C204 PolarHBondContact O-N 3.12Å
201	R	94.6	Very high	89.5	Confident	49 Å²	49	51.7 Å²	51.7	19%	0.185	29%	0.286	C	S	.	.	H	α-helix	trans	-66.3	-38.5	175.7	-172.7	57.9	176.5	169.5	-3.5	112.1	L170 I173 D174 L179 A197 L198 I199 E203 C204 L205	L170-R201 HydrophobicContact CD1-CB 4.17Å; L170-R201 HydrophobicContact CD1-CG 4.08Å; L170-R201 HydrophobicContact CD2-CB 4.39Å; L170-R201 HydrophobicContact CG-CB 4.28Å; L170-R201 HydrophobicContact CG-CG 4.33Å; I173-R201 VanDerWaalsContact O-CZ 3.31Å; I173-R201 PolarHBondContact O-NE 3.1Å; I173-R201 VanDerWaalsContact O-NE 3.07Å; I173-R201 PolarHBondContact O-NH2 3.18Å; D174-R201 IonicContact OD1-NH2 2.94Å; D174-R201 PolarHBondContact OD1-NH2 3.25Å; L179-R201 HydrophobicContact CD2-CB 4.24Å; L179-R201 HydrophobicContact CD2-CG 3.96Å; A197-R201 WeakPolarHBondContact O-CB 3.32Å; A197-R201 PolarHBondContact O-N 3.01Å; L198-R201 PolarHBondContact O-N 2.8Å; I199-R201 VanDerWaalsContact C-N 3.32Å; I199-R201 PolarHBondContact O-N 3.46Å; R201-E203 VanDerWaalsContact C-N 3.34Å; R201-C204 PolarHBondContact O-N 3.31Å; R201-L205 HydrophobicContact CG-CD1 4.33Å; R201-L205 HydrophobicContact CG-CG 4.49Å; R201-L205 WeakPolarHBondContact O-CG 3.48Å; R201-L205 PolarHBondContact O-N 3.48Å
202	A	94.9	Very high	89.1	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.5	-42.5	176.9	0	0	0	0	0	111.7	L179 M183 L198 I199 S200 L205 L206 M220 L234	L179-A202 HydrophobicContact CD2-CB 4.03Å; M183-A202 HydrophobicContact CE-CB 4.19Å; M183-A202 HydrophobicContact SD-CB 4.19Å; L198-A202 VanDerWaalsContact O-CB 3.25Å; L198-A202 WeakPolarHBondContact O-CB 3.33Å; L198-A202 PolarHBondContact O-N 3.28Å; I199-A202 WeakPolarHBondContact O-CB 3.4Å; I199-A202 PolarHBondContact O-N 3.3Å; I199-A202 VanDerWaalsContact O-N 3.08Å; S200-A202 PolarHBondContact O-N 3.12Å; A202-L205 PolarHBondContact O-N 3.15Å; A202-L206 WeakPolarHBondContact O-CG 3.47Å; A202-L206 PolarHBondContact O-N 3.2Å; A202-M220 HydrophobicContact CB-CE 3.68Å; A202-M220 HydrophobicContact CB-SD 4.03Å; A202-L234 HydrophobicContact CB-CD1 4.34Å; A202-L234 HydrophobicContact CB-CD2 4.36Å
203	E	93	Very high	89.1	Confident	36 Å²	36	51.3 Å²	51.3	17%	0.168	28%	0.277	C	S	.	.	H	α-helix	trans	-62.4	-44.9	177.7	-70.8	-177.6	160	0	0	112.5	I199 S200 R201 L205 L206 D207 H231 L234 K237	I199-E203 WeakPolarHBondContact O-CG 3.25Å; I199-E203 PolarHBondContact O-N 3.41Å; S200-E203 PolarHBondContact O-N 3.15Å; R201-E203 VanDerWaalsContact C-N 3.34Å; E203-L205 VanDerWaalsContact C-N 3.34Å; E203-L205 PolarHBondContact O-N 3.21Å; E203-L206 PolarHBondContact O-N 3.36Å; E203-D207 PolarHBondContact O-N 3.46Å; E203-H231 IonicContact OE1-CE1 3.81Å; E203-H231 PolarHBondContact OE1-CE1 3.13Å; E203-H231 IonicContact OE1-ND1 2.67Å; E203-H231 PolarHBondContact OE1-ND1 3.05Å; E203-H231 VanDerWaalsContact OE1-ND1 3.14Å; E203-L234 HydrophobicContact CG-CB 4.13Å; E203-L234 HydrophobicContact CG-CD1 3.89Å; E203-L234 WeakPolarHBondContact OE1-CB 3.39Å; E203-L234 PolarHBondContact OE1-N 3.4Å; E203-L234 VanDerWaalsContact OE1-N 3.15Å; E203-K237 PolarHBondContact O-NZ 3.16Å
204	C	91.9	Very high	89.2	Confident	64 Å²	64	45.3 Å²	45.3	43%	0.432	26%	0.255	S	S	.	.	H	α-helix	trans	-61.8	-41.3	176.4	177.2	0	0	0	0	112.1	S200 R201	S200-C204 PolarHBondContact O-N 3.12Å; R201-C204 PolarHBondContact O-N 3.31Å
205	L	91.4	Very high	89.1	Confident	7 Å²	7	48 Å²	48	4%	0.037	27%	0.269	C	S	.	.	H	α-helix	trans	-74.4	-26.9	179.5	-68.7	-175.9	0	0	0	113.3	D174 A176 L179 R201 A202 E203 D207 T208 N209	D174-L205 WeakPolarHBondContact O-CD2 3.43Å; A176-L205 HydrophobicContact CB-CB 4.02Å; A176-L205 HydrophobicContact CB-CD1 4.46Å; L179-L205 HydrophobicContact CB-CD1 4.18Å; L179-L205 HydrophobicContact CD2-CD1 3.74Å; R201-L205 HydrophobicContact CG-CD1 4.33Å; R201-L205 HydrophobicContact CG-CG 4.49Å; R201-L205 WeakPolarHBondContact O-CG 3.48Å; R201-L205 PolarHBondContact O-N 3.48Å; A202-L205 PolarHBondContact O-N 3.15Å; E203-L205 VanDerWaalsContact C-N 3.34Å; E203-L205 PolarHBondContact O-N 3.21Å; L205-D207 VanDerWaalsContact C-N 3.32Å; L205-T208 PolarHBondContact O-N 2.93Å; L205-T208 PolarHBondContact O-OG1 3.26Å; L205-N209 WeakPolarHBondContact O-CB 3.49Å; L205-N209 PolarHBondContact O-N 2.79Å
206	L	89.4	Confident	89	Confident	11 Å²	11	46.4 Å²	46.4	6%	0.058	26%	0.264	C	S	.	.	H	α-helix	trans	-68.2	-32.9	176.1	-78.3	-179.5	0	0	0	112.3	A202 E203 T208 N209 P217 M220 L234 K237 I241	A202-L206 WeakPolarHBondContact O-CG 3.47Å; A202-L206 PolarHBondContact O-N 3.2Å; E203-L206 PolarHBondContact O-N 3.36Å; L206-T208 PolarHBondContact O-N 3.15Å; L206-N209 PolarHBondContact O-N 2.81Å; L206-P217 HydrophobicContact CD2-CG 4.05Å; L206-M220 HydrophobicContact CD1-SD 3.74Å; L206-M220 HydrophobicContact CD2-CE 4.2Å; L206-M220 HydrophobicContact CD2-SD 3.77Å; L206-M220 HydrophobicContact CG-CE 4.17Å; L206-M220 HydrophobicContact CG-SD 3.76Å; L206-L234 HydrophobicContact CD1-CD1 3.51Å; L206-K237 HydrophobicContact CD1-CB 4.29Å; L206-I241 HydrophobicContact CD2-CD1 3.94Å
207	D	83.6	Confident	89.2	Confident	111 Å²	111	43 Å²	43	59%	0.594	25%	0.246	S	C	*	.	H	α-helix	trans	-64.4	-24.4	179	-62.7	-25.2	0	0	0	112.7	E203 L205 K237	E203-D207 PolarHBondContact O-N 3.46Å; L205-D207 VanDerWaalsContact C-N 3.32Å; D207-K237 WeakPolarHBondContact OD1-CE 3.5Å; D207-K237 IonicContact OD1-NZ 3.31Å; D207-K237 PolarHBondContact OD1-NZ 3.13Å; D207-K237 IonicContact OD2-NZ 3.23Å; D207-K237 PolarHBondContact OD2-NZ 3.45Å
208	T	81.3	Confident	89.2	Confident	115 Å²	115	43.4 Å²	43.4	71%	0.706	24%	0.239	S	C	*	.	H	α-helix	trans	-106.1	-6.8	-179.2	58	0	0	0	0	113.6	L205 L206	L205-T208 PolarHBondContact O-N 2.93Å; L205-T208 PolarHBondContact O-OG1 3.26Å; L206-T208 PolarHBondContact O-N 3.15Å
209	N	78.8	Confident	89.2	Confident	35 Å²	35	48.1 Å²	48.1	19%	0.187	26%	0.257	C	S	.	.	S	Bend	trans	-76.2	154.1	-175.4	-170.1	20.4	0	0	0	111.7	A176 L205 L206 P211	A176-N209 HydrophobicContact CB-CB 4.5Å; L205-N209 WeakPolarHBondContact O-CB 3.49Å; L205-N209 PolarHBondContact O-N 2.79Å; L206-N209 PolarHBondContact O-N 2.81Å; N209-P211 WeakPolarHBondContact O-CD 3.46Å
210	N	79.3	Confident	89.2	Confident	89 Å²	89	47.9 Å²	47.9	48%	0.476	26%	0.256	S	S	.	.			trans	-62.5	119.5	174.9	-178.2	-15.4	0	0	0	109.6	L212 N213	N210-L212 PolarHBondContact O-N 3.33Å; N210-L212 WeakPolarHBondContact OD1-CB 3.19Å; N210-L212 PolarHBondContact OD1-N 2.85Å; N210-N213 PolarHBondContact O-N 3.47Å
211	P	77.7	Confident	89.3	Confident	62 Å²	62	44.2 Å²	44.2	40%	0.403	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-11	-176.1	26.8	-36	0	0	0	113.3	N209 N245	N209-P211 WeakPolarHBondContact O-CD 3.46Å; P211-N245 PolarHBondContact O-ND2 3.27Å
212	L	80.5	Confident	89.4	Confident	86 Å²	86	45 Å²	45	45%	0.45	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-7	176.9	-61.3	175.4	0	0	0	113.9	N210 N245	N210-L212 PolarHBondContact O-N 3.33Å; N210-L212 WeakPolarHBondContact OD1-CB 3.19Å; N210-L212 PolarHBondContact OD1-N 2.85Å; L212-N245 WeakPolarHBondContact CA-OD1 3.31Å; L212-N245 PolarHBondContact O-OD1 2.96Å
213	N	86.6	Confident	89.5	Confident	17 Å²	17	45 Å²	45	9%	0.091	24%	0.235	C	C	.	.			trans	-99.2	91.5	-177.6	178.8	17.4	0	0	0	111.8	R177 N210 N215 T216 P217	R177-N213 PolarHBondContact NE-ND2 3.14Å; R177-N213 VanDerWaalsContact NE-ND2 3.18Å; N210-N213 PolarHBondContact O-N 3.47Å; N213-N215 PolarHBondContact OD1-N 3.34Å; N213-T216 PolarHBondContact ND2-OG1 2.88Å; N213-T216 VanDerWaalsContact ND2-OG1 3.12Å; N213-P217 WeakPolarHBondContact O-CD 3.5Å
214	Y	90.8	Very high	89.6	Confident	39 Å²	39	43.2 Å²	43.2	15%	0.153	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-14.1	178.9	61.5	-101.1	0	0	0	114.6	T216 P217 R218 F242 N245 L249 N253	Y214-T216 PolarHBondContact O-N 3.07Å; Y214-P217 WeakPolarHBondContact O-CD 3.5Å; Y214-R218 WeakPolarHBondContact O-CB 3.43Å; Y214-R218 PolarHBondContact O-N 3.29Å; Y214-R218 VanDerWaalsContact O-N 3.11Å; Y214-F242 WeakPolarHBondContact O-CE1 3.48Å; Y214-N245 HydrophobicContact CD1-CB 4.02Å; Y214-L249 HydrophobicContact CD1-CD2 3.9Å; Y214-L249 HydrophobicContact CD2-CD2 3.56Å; Y214-L249 HydrophobicContact CE1-CD2 3.97Å; Y214-L249 HydrophobicContact CE2-CD2 3.68Å; Y214-L249 HydrophobicContact CG-CD2 3.68Å; Y214-N253 HydrophobicContact CE2-CB 4.45Å
215	N	91.8	Very high	89.6	Confident	60 Å²	60	46.8 Å²	46.8	32%	0.321	23%	0.232	S	C	.	.	H	α-helix	trans	-69.1	-34.1	-178.1	-81.1	-58.4	0	0	0	113.2	N213 R218 R219	N213-N215 PolarHBondContact OD1-N 3.34Å; N215-R218 PolarHBondContact OD1-NH2 3.36Å; N215-R218 VanDerWaalsContact OD1-NH2 3.15Å; N215-R219 WeakPolarHBondContact O-CG 3.47Å; N215-R219 PolarHBondContact O-N 3.47Å; N215-R219 VanDerWaalsContact O-N 3.16Å
216	T	92.8	Very high	89.6	Confident	4 Å²	4	48.7 Å²	48.7	3%	0.025	25%	0.245	C	C	.	.	H	α-helix	trans	-67.3	-53.4	178.7	-64.4	0	0	0	0	111.3	A176 R177 A180 N213 Y214 R218 R219 M220	A176-T216 HydrophobicContact CB-CG2 3.74Å; A176-T216 WeakPolarHBondContact O-CG2 3.43Å; R177-T216 WeakPolarHBondContact CG-OG1 3.35Å; A180-T216 HydrophobicContact CB-CG2 3.92Å; N213-T216 PolarHBondContact ND2-OG1 2.88Å; N213-T216 VanDerWaalsContact ND2-OG1 3.12Å; Y214-T216 PolarHBondContact O-N 3.07Å; T216-R218 VanDerWaalsContact C-N 3.31Å; T216-R218 PolarHBondContact O-N 2.96Å; T216-R219 PolarHBondContact O-N 3.46Å; T216-M220 HydrophobicContact CG2-CE 3.85Å; T216-M220 HydrophobicContact CG2-SD 4.3Å; T216-M220 WeakPolarHBondContact O-CG 3.47Å; T216-M220 PolarHBondContact O-N 3.09Å; T216-M220 VanDerWaalsContact O-N 3.12Å
217	P	94.8	Very high	89.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-53.7	-43.9	171	-27.2	33.5	0	0	0	113.2	L206 N213 Y214 R219 M220 V221 C238 I241 F242	L206-P217 HydrophobicContact CD2-CG 4.05Å; N213-P217 WeakPolarHBondContact O-CD 3.5Å; Y214-P217 WeakPolarHBondContact O-CD 3.5Å; P217-R219 VanDerWaalsContact C-N 3.29Å; P217-R219 PolarHBondContact O-N 3.49Å; P217-M220 WeakPolarHBondContact O-CA 3.33Å; P217-M220 WeakPolarHBondContact O-CB 3.47Å; P217-M220 PolarHBondContact O-N 3.13Å; P217-V221 WeakPolarHBondContact O-CG2 3.29Å; P217-V221 PolarHBondContact O-N 3.41Å; P217-C238 HydrophobicContact CB-CB 3.93Å; P217-I241 HydrophobicContact CG-CB 4.12Å; P217-I241 HydrophobicContact CG-CD1 3.66Å; P217-I241 HydrophobicContact CG-CG2 3.88Å; P217-F242 HydrophobicContact CB-CE1 3.67Å; P217-F242 HydrophobicContact CB-CZ 3.68Å
218	R	95.3	Very high	89.8	Confident	45 Å²	45	51.4 Å²	51.4	17%	0.17	25%	0.254	C	S	.	.	H	α-helix	trans	-56.1	-42.5	178.7	-174.9	176.7	65.1	113.5	-7.8	112.6	Y214 N215 T216 V221 Q222 F242 N253 I256 I257 L260	Y214-R218 WeakPolarHBondContact O-CB 3.43Å; Y214-R218 PolarHBondContact O-N 3.29Å; Y214-R218 VanDerWaalsContact O-N 3.11Å; N215-R218 PolarHBondContact OD1-NH2 3.36Å; N215-R218 VanDerWaalsContact OD1-NH2 3.15Å; T216-R218 VanDerWaalsContact C-N 3.31Å; T216-R218 PolarHBondContact O-N 2.96Å; R218-V221 PolarHBondContact O-N 3.15Å; R218-Q222 WeakPolarHBondContact O-CB 3.41Å; R218-Q222 PolarHBondContact O-N 3.29Å; R218-F242 HydrophobicContact CB-CE1 4.18Å; R218-F242 HydrophobicContact CB-CZ 4.25Å; R218-N253 PolarHBondContact NE-OD1 3.3Å; R218-I256 HydrophobicContact CG-CG2 4.3Å; R218-I257 HydrophobicContact CG-CG1 4.38Å; R218-L260 HydrophobicContact CG-CD1 4.35Å
219	R	95.4	Very high	90	Very high	98 Å²	98	48.4 Å²	48.4	37%	0.37	23%	0.23	S	C	.	.	H	α-helix	trans	-68.4	-34.8	175.7	-73.9	179.8	-176.9	-175.1	-1.9	112.8	A180 V184 N215 T216 P217 Q222 F223	A180-R219 HydrophobicContact CB-CB 3.9Å; V184-R219 HydrophobicContact CG2-CB 3.92Å; V184-R219 HydrophobicContact CG2-CG 4.32Å; V184-R219 VanDerWaalsContact CG2-O 3.31Å; V184-R219 WeakPolarHBondContact CG2-O 3.19Å; N215-R219 WeakPolarHBondContact O-CG 3.47Å; N215-R219 PolarHBondContact O-N 3.47Å; N215-R219 VanDerWaalsContact O-N 3.16Å; T216-R219 PolarHBondContact O-N 3.46Å; P217-R219 VanDerWaalsContact C-N 3.29Å; P217-R219 PolarHBondContact O-N 3.49Å; R219-Q222 WeakPolarHBondContact O-CB 3.48Å; R219-Q222 PolarHBondContact O-N 3.49Å; R219-F223 PolarHBondContact O-N 3.33Å
220	M	95.8	Very high	90.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.7	-42.3	174.9	-67.4	170.2	167.6	0	0	111.5	A180 M183 A202 L206 T216 P217 Q222 F223 L224	A180-M220 HydrophobicContact CB-CE 4.32Å; A180-M220 HydrophobicContact CB-CG 4.05Å; M183-M220 HydrophobicContact CE-CG 4.34Å; M183-M220 HydrophobicContact SD-CG 4.16Å; A202-M220 HydrophobicContact CB-CE 3.68Å; A202-M220 HydrophobicContact CB-SD 4.03Å; L206-M220 HydrophobicContact CD1-SD 3.74Å; L206-M220 HydrophobicContact CD2-CE 4.2Å; L206-M220 HydrophobicContact CD2-SD 3.77Å; L206-M220 HydrophobicContact CG-CE 4.17Å; L206-M220 HydrophobicContact CG-SD 3.76Å; T216-M220 HydrophobicContact CG2-CE 3.85Å; T216-M220 HydrophobicContact CG2-SD 4.3Å; T216-M220 WeakPolarHBondContact O-CG 3.47Å; T216-M220 PolarHBondContact O-N 3.09Å; T216-M220 VanDerWaalsContact O-N 3.12Å; P217-M220 WeakPolarHBondContact O-CA 3.33Å; P217-M220 WeakPolarHBondContact O-CB 3.47Å; P217-M220 PolarHBondContact O-N 3.13Å; M220-Q222 VanDerWaalsContact C-N 3.32Å; M220-Q222 PolarHBondContact O-N 3.46Å; M220-F223 WeakPolarHBondContact O-CB 3.45Å; M220-F223 PolarHBondContact O-N 3.01Å; M220-L224 PolarHBondContact O-N 3.26Å
221	V	96.4	Very high	90.9	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.2	-39.4	172.9	-176.4	0	0	0	0	110.9	P217 R218 F223 L224 R225 L235 C238 F242 L260 Y261 L264	P217-V221 WeakPolarHBondContact O-CG2 3.29Å; P217-V221 PolarHBondContact O-N 3.41Å; R218-V221 PolarHBondContact O-N 3.15Å; V221-F223 VanDerWaalsContact C-N 3.32Å; V221-F223 PolarHBondContact O-N 2.88Å; V221-L224 PolarHBondContact O-N 2.9Å; V221-R225 PolarHBondContact O-N 3.14Å; V221-L235 HydrophobicContact CB-CD2 4.49Å; V221-L235 HydrophobicContact CG1-CD2 3.91Å; V221-L235 HydrophobicContact CG2-CD2 4.02Å; V221-C238 HydrophobicContact CG2-CB 3.85Å; V221-F242 HydrophobicContact CG2-CE2 4.07Å; V221-F242 HydrophobicContact CG2-CZ 4.2Å; V221-L260 HydrophobicContact CB-CD1 4.14Å; V221-L260 HydrophobicContact CG1-CB 3.77Å; V221-L260 HydrophobicContact CG1-CD1 3.98Å; V221-L260 HydrophobicContact CG1-CG 4.42Å; V221-Y261 HydrophobicContact CG1-CD1 4.23Å; V221-Y261 HydrophobicContact CG1-CE1 4.22Å; V221-L264 HydrophobicContact CG1-CD1 3.72Å
222	Q	95.8	Very high	91.5	Very high	65 Å²	65	48 Å²	48	30%	0.304	22%	0.219	S	C	.	.	H	α-helix	trans	-60.4	-41.1	173.5	-177.7	179.1	-1.7	0	0	112	V184 R218 R219 M220 R225 S226 L260	V184-Q222 HydrophobicContact CG2-CB 4.4Å; V184-Q222 HydrophobicContact CG2-CG 4.4Å; R218-Q222 WeakPolarHBondContact O-CB 3.41Å; R218-Q222 PolarHBondContact O-N 3.29Å; R219-Q222 WeakPolarHBondContact O-CB 3.48Å; R219-Q222 PolarHBondContact O-N 3.49Å; M220-Q222 VanDerWaalsContact C-N 3.32Å; M220-Q222 PolarHBondContact O-N 3.46Å; Q222-R225 WeakPolarHBondContact O-CB 3.39Å; Q222-R225 PolarHBondContact O-N 3.04Å; Q222-S226 PolarHBondContact O-N 3.27Å; Q222-S226 PolarHBondContact O-OG 2.98Å; Q222-S226 VanDerWaalsContact O-OG 3.14Å; Q222-L260 HydrophobicContact CB-CD1 4.31Å; Q222-L260 HydrophobicContact CB-CD2 4.34Å
223	F	96.1	Very high	92	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.4	-49.8	173.7	166	-102.7	0	0	0	111.8	M183 V190 R195 L198 I199 R219 M220 V221 R225 S226 V227	M183-F223 HydrophobicContact CB-CB 3.9Å; M183-F223 HydrophobicContact CB-CD1 4.43Å; M183-F223 HydrophobicContact CB-CD2 3.79Å; M183-F223 HydrophobicContact CB-CE2 4.36Å; M183-F223 HydrophobicContact CB-CG 3.78Å; M183-F223 HydrophobicContact CE-CB 4.12Å; M183-F223 HydrophobicContact CE-CD1 3.18Å; M183-F223 HydrophobicContact CE-CE1 3.61Å; M183-F223 HydrophobicContact CE-CG 3.71Å; M183-F223 HydrophobicContact CE-CZ 4.44Å; M183-F223 HydrophobicContact CG-CG 4.44Å; M183-F223 WeakPolarHBondContact O-CD2 3.46Å; V190-F223 HydrophobicContact CG1-CZ 4.46Å; V190-F223 HydrophobicContact CG2-CE2 4.09Å; R195-F223 HydrophobicContact CG-CE1 4.37Å; R195-F223 HydrophobicContact CG-CZ 4.23Å; L198-F223 HydrophobicContact CD1-CE2 4.31Å; L198-F223 HydrophobicContact CD1-CZ 4Å; I199-F223 HydrophobicContact CG1-CE1 4.26Å; R219-F223 PolarHBondContact O-N 3.33Å; M220-F223 WeakPolarHBondContact O-CB 3.45Å; M220-F223 PolarHBondContact O-N 3.01Å; V221-F223 VanDerWaalsContact C-N 3.32Å; V221-F223 PolarHBondContact O-N 2.88Å; F223-R225 PolarHBondContact O-N 3.48Å; F223-S226 WeakPolarHBondContact O-CB 3.41Å; F223-S226 PolarHBondContact O-N 3.06Å; F223-V227 HydrophobicContact CD1-CG2 4.49Å; F223-V227 HydrophobicContact CD2-CG1 3.99Å; F223-V227 HydrophobicContact CE1-CG1 4.45Å; F223-V227 HydrophobicContact CE1-CG2 4.2Å; F223-V227 HydrophobicContact CE2-CG1 3.48Å; F223-V227 VanDerWaalsContact CE2-CG1 3.48Å; F223-V227 HydrophobicContact CZ-CG1 3.77Å; F223-V227 HydrophobicContact CZ-CG2 4.29Å; F223-V227 WeakPolarHBondContact O-CG2 3.36Å; F223-V227 PolarHBondContact O-N 3.3Å
224	L	95.1	Very high	92.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-54.8	-42.6	177.9	-70.7	178.9	0	0	0	111.8	I199 M220 V221 V227 K228 Y229 H231 L234 L235 L264	I199-L224 HydrophobicContact CD1-CD2 3.81Å; I199-L224 HydrophobicContact CG1-CD2 4.12Å; M220-L224 PolarHBondContact O-N 3.26Å; V221-L224 PolarHBondContact O-N 2.9Å; L224-V227 WeakPolarHBondContact O-CG2 3.44Å; L224-K228 PolarHBondContact O-N 3.39Å; L224-K228 VanDerWaalsContact O-N 3.12Å; L224-Y229 WeakPolarHBondContact CB-O 3.32Å; L224-Y229 HydrophobicContact CD2-CD1 4.43Å; L224-Y229 PolarHBondContact O-N 2.95Å; L224-H231 HydrophobicContact CD1-CB 4.33Å; L224-H231 HydrophobicContact CD2-CB 3.95Å; L224-L234 HydrophobicContact CD1-CD2 4.06Å; L224-L234 HydrophobicContact CD1-CG 4.33Å; L224-L234 HydrophobicContact CD2-CD2 4.36Å; L224-L234 HydrophobicContact CG-CD2 4.36Å; L224-L235 HydrophobicContact CD1-CD1 4.46Å; L224-L235 HydrophobicContact CD1-CD2 3.8Å; L224-L235 HydrophobicContact CD1-CG 3.82Å; L224-L264 HydrophobicContact CB-CD1 3.98Å; L224-L264 HydrophobicContact CB-CD2 4.26Å
225	R	93.9	Very high	92.5	Very high	138 Å²	138	43.6 Å²	43.6	52%	0.521	20%	0.201	S	C	.	.	H	α-helix	trans	-60.4	-48.2	173.3	174.9	-170.7	172	-155.8	1.3	111.5	V221 Q222 F223 V227 K228 L260 S263 L264	V221-R225 PolarHBondContact O-N 3.14Å; Q222-R225 WeakPolarHBondContact O-CB 3.39Å; Q222-R225 PolarHBondContact O-N 3.04Å; F223-R225 PolarHBondContact O-N 3.48Å; R225-V227 VanDerWaalsContact C-N 3.31Å; R225-V227 PolarHBondContact O-N 3.28Å; R225-K228 PolarHBondContact O-N 3.45Å; R225-K228 VanDerWaalsContact O-N 3.07Å; R225-L260 HydrophobicContact CB-CD2 4.13Å; R225-L260 VanDerWaalsContact CD-CD2 3.48Å; R225-L260 HydrophobicContact CG-CD2 4.42Å; R225-S263 WeakPolarHBondContact CD-OG 3.37Å; R225-S263 WeakPolarHBondContact CG-OG 3.45Å; R225-L264 HydrophobicContact CB-CD1 4.49Å; R225-L264 HydrophobicContact CB-CD2 4.39Å; R225-L264 HydrophobicContact CB-CG 4.31Å
226	S	91.4	Very high	92.5	Very high	47 Å²	47	42.9 Å²	42.9	33%	0.329	20%	0.197	S	C	.	.	H	α-helix	trans	-62.1	-38.2	-177.4	-63.8	0	0	0	0	112.5	S187 Q222 F223 K228	S187-S226 VanDerWaalsContact CB-CB 3.44Å; S187-S226 WeakPolarHBondContact OG-CB 3.36Å; Q222-S226 PolarHBondContact O-N 3.27Å; Q222-S226 PolarHBondContact O-OG 2.98Å; Q222-S226 VanDerWaalsContact O-OG 3.14Å; F223-S226 WeakPolarHBondContact O-CB 3.41Å; F223-S226 PolarHBondContact O-N 3.06Å; S226-K228 VanDerWaalsContact C-N 3.27Å; S226-K228 PolarHBondContact O-N 2.96Å
227	V	89.6	Confident	92.5	Very high	30 Å²	30	45.5 Å²	45.5	18%	0.182	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	4.5	176	-58.6	0	0	0	0	113.7	R195 F223 L224 R225 Y229	R195-V227 HydrophobicContact CG-CG2 4.26Å; F223-V227 HydrophobicContact CD1-CG2 4.49Å; F223-V227 HydrophobicContact CD2-CG1 3.99Å; F223-V227 HydrophobicContact CE1-CG1 4.45Å; F223-V227 HydrophobicContact CE1-CG2 4.2Å; F223-V227 HydrophobicContact CE2-CG1 3.48Å; F223-V227 VanDerWaalsContact CE2-CG1 3.48Å; F223-V227 HydrophobicContact CZ-CG1 3.77Å; F223-V227 HydrophobicContact CZ-CG2 4.29Å; F223-V227 WeakPolarHBondContact O-CG2 3.36Å; F223-V227 PolarHBondContact O-N 3.3Å; L224-V227 WeakPolarHBondContact O-CG2 3.44Å; R225-V227 VanDerWaalsContact C-N 3.31Å; R225-V227 PolarHBondContact O-N 3.28Å; V227-Y229 PolarHBondContact O-N 3.38Å
228	K	85.9	Confident	92.5	Very high	149 Å²	149	45.5 Å²	45.5	65%	0.648	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	35.4	-179	-56.7	179.5	-178.1	176	0	114.3	L224 R225 S226 E488	L224-K228 PolarHBondContact O-N 3.39Å; L224-K228 VanDerWaalsContact O-N 3.12Å; R225-K228 PolarHBondContact O-N 3.45Å; R225-K228 VanDerWaalsContact O-N 3.07Å; S226-K228 VanDerWaalsContact C-N 3.27Å; S226-K228 PolarHBondContact O-N 2.96Å; K228-E488 WeakPolarHBondContact CD-OE1 3.39Å
229	Y	86.4	Confident	92.4	Very high	53 Å²	53	43.6 Å²	43.6	21%	0.208	20%	0.202	C	C	.	.			trans	-122.2	122.3	-175.4	-175.4	-112.7	0	0	0	111.6	I199 L224 V227 H231	I199-Y229 HydrophobicContact CD1-CD1 3.66Å; I199-Y229 HydrophobicContact CD1-CE1 3.73Å; L224-Y229 WeakPolarHBondContact CB-O 3.32Å; L224-Y229 HydrophobicContact CD2-CD1 4.43Å; L224-Y229 PolarHBondContact O-N 2.95Å; V227-Y229 PolarHBondContact O-N 3.38Å; Y229-H231 HydrophobicContact CD1-CB 4.1Å; Y229-H231 HydrophobicContact CE1-CB 3.83Å; Y229-H231 AromaticContact CE1-CD2 3.82Å; Y229-H231 PolarHBondContact O-N 2.89Å
230	T	86.5	Confident	92.3	Very high	54 Å²	54	44 Å²	44	33%	0.331	21%	0.208	S	C	.	.			trans	-93.6	90.2	-179.6	-56.5	0	0	0	0	110.4	R232 L235 L264	T230-R232 PolarHBondContact O-N 3.1Å; T230-L235 HydrophobicContact CG2-CD1 3.81Å; T230-L264 WeakPolarHBondContact CG2-O 3.5Å; T230-L264 PolarHBondContact OG1-O 3.45Å
231	H	90.3	Very high	92.2	Very high	37 Å²	37	44.7 Å²	44.7	17%	0.171	21%	0.211	C	C	.	.			trans	-88.4	96.6	173.3	-164.3	-103.8	0	0	0	111.3	I199 E203 L224 Y229 L234 L235	I199-H231 HydrophobicContact CD1-CB 4.17Å; I199-H231 HydrophobicContact CG2-CB 4.36Å; I199-H231 VanDerWaalsContact CG2-ND1 3.33Å; I199-H231 WeakPolarHBondContact CG2-ND1 3.1Å; E203-H231 IonicContact OE1-CE1 3.81Å; E203-H231 PolarHBondContact OE1-CE1 3.13Å; E203-H231 IonicContact OE1-ND1 2.67Å; E203-H231 PolarHBondContact OE1-ND1 3.05Å; E203-H231 VanDerWaalsContact OE1-ND1 3.14Å; L224-H231 HydrophobicContact CD1-CB 4.33Å; L224-H231 HydrophobicContact CD2-CB 3.95Å; Y229-H231 HydrophobicContact CD1-CB 4.1Å; Y229-H231 HydrophobicContact CE1-CB 3.83Å; Y229-H231 AromaticContact CE1-CD2 3.82Å; Y229-H231 PolarHBondContact O-N 2.89Å; H231-L234 HydrophobicContact CB-CB 4.4Å; H231-L234 WeakPolarHBondContact ND1-CB 3.45Å; H231-L234 PolarHBondContact ND1-N 3.28Å; H231-L234 PolarHBondContact O-N 2.9Å; H231-L235 VanDerWaalsContact O-CG 3.32Å; H231-L235 WeakPolarHBondContact O-CG 3.45Å; H231-L235 PolarHBondContact O-N 3.35Å; H231-L235 VanDerWaalsContact O-N 3.13Å
232	R	89.6	Confident	92.2	Very high	86 Å²	86	44.8 Å²	44.8	33%	0.325	21%	0.212	S	C	.	.	H	α-helix	trans	-58	-47.1	-174.8	-66.9	-169	-178.2	-131.9	-1.1	114.3	T230 L234 L235 D236 S557	T230-R232 PolarHBondContact O-N 3.1Å; R232-L234 VanDerWaalsContact C-N 3.33Å; R232-L234 PolarHBondContact O-N 3.45Å; R232-L235 WeakPolarHBondContact O-CB 3.37Å; R232-L235 PolarHBondContact O-N 2.91Å; R232-D236 PolarHBondContact O-N 3.48Å; R232-S557 WeakPolarHBondContact CD-OG 3.49Å; R232-S557 VanDerWaalsContact CZ-OG 3.29Å; R232-S557 PolarHBondContact NE-OG 3.47Å; R232-S557 VanDerWaalsContact NH1-CB 3.35Å; R232-S557 PolarHBondContact NH1-OG 3.24Å
233	P	91.1	Very high	92.1	Very high	50 Å²	50	44.4 Å²	44.4	33%	0.325	21%	0.212	S	C	.	.	H	α-helix	trans	-58.1	-42.4	-178.5	-23.7	32.1	0	0	0	113.6	D236 K237	P233-D236 PolarHBondContact O-N 3.22Å; P233-K237 PolarHBondContact O-N 3.49Å; P233-K237 VanDerWaalsContact O-N 3.1Å
234	L	94.1	Very high	92	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67.7	-38.4	177.1	178.8	57.8	0	0	0	111.5	I199 A202 E203 L206 L224 H231 R232 K237 C238	I199-L234 HydrophobicContact CG1-CD2 4.34Å; I199-L234 HydrophobicContact CG2-CB 4.48Å; I199-L234 HydrophobicContact CG2-CD2 4.12Å; A202-L234 HydrophobicContact CB-CD1 4.34Å; A202-L234 HydrophobicContact CB-CD2 4.36Å; E203-L234 HydrophobicContact CG-CB 4.13Å; E203-L234 HydrophobicContact CG-CD1 3.89Å; E203-L234 WeakPolarHBondContact OE1-CB 3.39Å; E203-L234 PolarHBondContact OE1-N 3.4Å; E203-L234 VanDerWaalsContact OE1-N 3.15Å; L206-L234 HydrophobicContact CD1-CD1 3.51Å; L224-L234 HydrophobicContact CD1-CD2 4.06Å; L224-L234 HydrophobicContact CD1-CG 4.33Å; L224-L234 HydrophobicContact CD2-CD2 4.36Å; L224-L234 HydrophobicContact CG-CD2 4.36Å; H231-L234 HydrophobicContact CB-CB 4.4Å; H231-L234 WeakPolarHBondContact ND1-CB 3.45Å; H231-L234 PolarHBondContact ND1-N 3.28Å; H231-L234 PolarHBondContact O-N 2.9Å; R232-L234 VanDerWaalsContact C-N 3.33Å; R232-L234 PolarHBondContact O-N 3.45Å; L234-K237 PolarHBondContact O-N 2.98Å; L234-C238 WeakPolarHBondContact O-CB 3.31Å; L234-C238 PolarHBondContact O-N 3.01Å; L234-C238 PolarHBondContact O-SG 3.44Å
235	L	94.3	Very high	92	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.3	-42.6	176.2	-71.7	167.3	0	0	0	111.8	V221 L224 T230 H231 R232 C238 N239 L264 F266	V221-L235 HydrophobicContact CB-CD2 4.49Å; V221-L235 HydrophobicContact CG1-CD2 3.91Å; V221-L235 HydrophobicContact CG2-CD2 4.02Å; L224-L235 HydrophobicContact CD1-CD1 4.46Å; L224-L235 HydrophobicContact CD1-CD2 3.8Å; L224-L235 HydrophobicContact CD1-CG 3.82Å; T230-L235 HydrophobicContact CG2-CD1 3.81Å; H231-L235 VanDerWaalsContact O-CG 3.32Å; H231-L235 WeakPolarHBondContact O-CG 3.45Å; H231-L235 PolarHBondContact O-N 3.35Å; H231-L235 VanDerWaalsContact O-N 3.13Å; R232-L235 WeakPolarHBondContact O-CB 3.37Å; R232-L235 PolarHBondContact O-N 2.91Å; L235-C238 PolarHBondContact O-N 3.11Å; L235-N239 VanDerWaalsContact O-CB 3.31Å; L235-N239 WeakPolarHBondContact O-CB 3.48Å; L235-N239 PolarHBondContact O-N 2.94Å; L235-L264 HydrophobicContact CD1-CD1 4.49Å; L235-L264 HydrophobicContact CD2-CD1 3.89Å; L235-F266 HydrophobicContact CB-CD1 4.33Å; L235-F266 HydrophobicContact CB-CD2 3.96Å; L235-F266 HydrophobicContact CB-CE1 4.23Å; L235-F266 HydrophobicContact CB-CE2 3.86Å; L235-F266 HydrophobicContact CB-CG 4.2Å; L235-F266 HydrophobicContact CB-CZ 3.99Å; L235-F266 HydrophobicContact CD1-CB 4.02Å; L235-F266 HydrophobicContact CD1-CD2 3.92Å; L235-F266 HydrophobicContact CD1-CG 3.97Å
236	D	92.2	Very high	92.1	Very high	44 Å²	44	46.5 Å²	46.5	24%	0.235	22%	0.221	C	C	.	.	H	α-helix	trans	-62.6	-45.7	176.7	-69.5	-34.8	0	0	0	111.1	R232 P233 C238 N239 E240 F266 H555	R232-D236 PolarHBondContact O-N 3.48Å; P233-D236 PolarHBondContact O-N 3.22Å; D236-C238 VanDerWaalsContact C-N 3.32Å; D236-C238 PolarHBondContact O-N 2.81Å; D236-N239 WeakPolarHBondContact O-CB 3.4Å; D236-N239 PolarHBondContact O-N 3.36Å; D236-N239 VanDerWaalsContact O-N 3.11Å; D236-E240 PolarHBondContact O-N 3.22Å; D236-F266 WeakPolarHBondContact OD1-CE2 3.43Å; D236-F266 VanDerWaalsContact OD1-CZ 3.24Å; D236-F266 WeakPolarHBondContact OD1-CZ 3.44Å; D236-H555 IonicContact OD2-CE1 3.62Å; D236-H555 IonicContact OD2-NE2 3.59Å; D236-H555 PolarHBondContact OD2-NE2 3.15Å
237	K	92.4	Very high	92.2	Very high	59 Å²	59	48.7 Å²	48.7	26%	0.257	23%	0.234	S	C	.	.	H	α-helix	trans	-58.2	-42.1	173	-73.4	-170.5	179.1	-163.1	0	112.6	E203 L206 D207 P233 L234 N239 I241	E203-K237 PolarHBondContact O-NZ 3.16Å; L206-K237 HydrophobicContact CD1-CB 4.29Å; D207-K237 WeakPolarHBondContact OD1-CE 3.5Å; D207-K237 IonicContact OD1-NZ 3.31Å; D207-K237 PolarHBondContact OD1-NZ 3.13Å; D207-K237 IonicContact OD2-NZ 3.23Å; D207-K237 PolarHBondContact OD2-NZ 3.45Å; P233-K237 PolarHBondContact O-N 3.49Å; P233-K237 VanDerWaalsContact O-N 3.1Å; L234-K237 PolarHBondContact O-N 2.98Å; K237-N239 VanDerWaalsContact C-N 3.35Å; K237-I241 WeakPolarHBondContact O-CG1 3.28Å; K237-I241 PolarHBondContact O-N 3.5Å
238	C	94.8	Very high	92.2	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.7	-40.3	176.3	-68.9	0	0	0	0	111.5	P217 V221 L234 L235 D236 I241 F242	P217-C238 HydrophobicContact CB-CB 3.93Å; V221-C238 HydrophobicContact CG2-CB 3.85Å; L234-C238 WeakPolarHBondContact O-CB 3.31Å; L234-C238 PolarHBondContact O-N 3.01Å; L234-C238 PolarHBondContact O-SG 3.44Å; L235-C238 PolarHBondContact O-N 3.11Å; D236-C238 VanDerWaalsContact C-N 3.32Å; D236-C238 PolarHBondContact O-N 2.81Å; C238-I241 PolarHBondContact O-N 3.11Å; C238-F242 HydrophobicContact CB-CE2 3.95Å; C238-F242 HydrophobicContact CB-CZ 4.31Å; C238-F242 WeakPolarHBondContact O-CD2 3.46Å; C238-F242 VanDerWaalsContact O-CG 3.31Å; C238-F242 WeakPolarHBondContact O-CG 3.38Å; C238-F242 PolarHBondContact O-N 3.15Å
239	N	94.5	Very high	92.6	Very high	6 Å²	6	47 Å²	47	3%	0.032	22%	0.22	C	C	.	.	H	α-helix	trans	-62.3	-43.4	-179.7	-169.1	69.5	0	0	0	112.3	L235 D236 K237 I241 F242 L243 Y261 F266 N268 F271	L235-N239 VanDerWaalsContact O-CB 3.31Å; L235-N239 WeakPolarHBondContact O-CB 3.48Å; L235-N239 PolarHBondContact O-N 2.94Å; D236-N239 WeakPolarHBondContact O-CB 3.4Å; D236-N239 PolarHBondContact O-N 3.36Å; D236-N239 VanDerWaalsContact O-N 3.11Å; K237-N239 VanDerWaalsContact C-N 3.35Å; N239-I241 VanDerWaalsContact C-N 3.27Å; N239-I241 PolarHBondContact O-N 3.35Å; N239-F242 PolarHBondContact O-N 3.14Å; N239-F242 VanDerWaalsContact O-N 3.15Å; N239-L243 WeakPolarHBondContact ND2-CD1 3.31Å; N239-L243 WeakPolarHBondContact O-CB 3.49Å; N239-L243 WeakPolarHBondContact O-CG 3.21Å; N239-L243 PolarHBondContact O-N 3.26Å; N239-Y261 VanDerWaalsContact CA-OH 3.29Å; N239-Y261 WeakPolarHBondContact CA-OH 3.49Å; N239-Y261 VanDerWaalsContact CB-OH 3.26Å; N239-Y261 WeakPolarHBondContact CB-OH 3.23Å; N239-Y261 WeakPolarHBondContact OD1-CE2 3.47Å; N239-Y261 PolarHBondContact OD1-OH 2.85Å; N239-F266 HydrophobicContact CB-CE1 4.19Å; N239-F266 HydrophobicContact CB-CZ 4.38Å; N239-N268 PolarHBondContact ND2-ND2 3.43Å; N239-N268 VanDerWaalsContact ND2-ND2 3.2Å; N239-N268 PolarHBondContact ND2-OD1 3.05Å; N239-F271 VanDerWaalsContact OD1-CB 3.31Å; N239-F271 WeakPolarHBondContact OD1-CB 3.1Å
240	E	92.8	Very high	92.8	Very high	106 Å²	106	47.6 Å²	47.6	50%	0.495	23%	0.227	S	C	.	.	H	α-helix	trans	-57.6	-41.6	174.6	-71.3	-172.6	-173.7	0	0	112.2	D236 R244	D236-E240 PolarHBondContact O-N 3.22Å; E240-R244 WeakPolarHBondContact O-CG 3.42Å; E240-R244 PolarHBondContact O-N 3.16Å; E240-R244 VanDerWaalsContact O-N 3.16Å; E240-R244 IonicContact OE2-NH2 3.42Å
241	I	93.9	Very high	93	Very high	15 Å²	15	45 Å²	45	8%	0.077	21%	0.211	C	C	.	.	H	α-helix	trans	-67.4	-40.6	177.6	-61.9	167.4	0	0	0	110.4	L206 P217 K237 C238 N239 R244 N245	L206-I241 HydrophobicContact CD2-CD1 3.94Å; P217-I241 HydrophobicContact CG-CB 4.12Å; P217-I241 HydrophobicContact CG-CD1 3.66Å; P217-I241 HydrophobicContact CG-CG2 3.88Å; K237-I241 WeakPolarHBondContact O-CG1 3.28Å; K237-I241 PolarHBondContact O-N 3.5Å; C238-I241 PolarHBondContact O-N 3.11Å; N239-I241 VanDerWaalsContact C-N 3.27Å; N239-I241 PolarHBondContact O-N 3.35Å; I241-R244 PolarHBondContact O-N 3.21Å; I241-N245 PolarHBondContact O-N 2.87Å; I241-N245 PolarHBondContact O-ND2 2.86Å
242	F	95.6	Very high	93.1	Very high	1 Å²	1	46.5 Å²	46.5	0%	0.004	22%	0.218	C	C	.	.	H	α-helix	trans	-65.2	-44.3	177.1	-59.8	-41.1	0	0	0	112.3	Y214 P217 R218 V221 C238 N239 R244 N245 I246 I257 Y261 F271	Y214-F242 WeakPolarHBondContact O-CE1 3.48Å; P217-F242 HydrophobicContact CB-CE1 3.67Å; P217-F242 HydrophobicContact CB-CZ 3.68Å; R218-F242 HydrophobicContact CB-CE1 4.18Å; R218-F242 HydrophobicContact CB-CZ 4.25Å; V221-F242 HydrophobicContact CG2-CE2 4.07Å; V221-F242 HydrophobicContact CG2-CZ 4.2Å; C238-F242 HydrophobicContact CB-CE2 3.95Å; C238-F242 HydrophobicContact CB-CZ 4.31Å; C238-F242 WeakPolarHBondContact O-CD2 3.46Å; C238-F242 VanDerWaalsContact O-CG 3.31Å; C238-F242 WeakPolarHBondContact O-CG 3.38Å; C238-F242 PolarHBondContact O-N 3.15Å; N239-F242 PolarHBondContact O-N 3.14Å; N239-F242 VanDerWaalsContact O-N 3.15Å; F242-R244 VanDerWaalsContact C-N 3.3Å; F242-R244 PolarHBondContact O-N 3.35Å; F242-N245 CarbonylContact O-C 3.58Å; F242-N245 PolarHBondContact O-N 3.44Å; F242-I246 PolarHBondContact O-N 3.32Å; F242-I246 VanDerWaalsContact O-N 3.08Å; F242-I257 HydrophobicContact CD1-CD1 3.79Å; F242-I257 HydrophobicContact CD2-CD1 4.4Å; F242-I257 HydrophobicContact CD2-CG2 3.9Å; F242-I257 HydrophobicContact CE1-CD1 3.9Å; F242-I257 HydrophobicContact CE1-CG1 4.37Å; F242-I257 HydrophobicContact CE2-CG1 4.47Å; F242-I257 HydrophobicContact CE2-CG2 3.95Å; F242-I257 HydrophobicContact CG-CD1 4.07Å; F242-I257 HydrophobicContact CZ-CD1 4.29Å; F242-I257 HydrophobicContact CZ-CG1 4.3Å; F242-Y261 HydrophobicContact CD2-CE1 4.5Å; F242-Y261 VanDerWaalsContact CD2-OH 3.28Å; F242-Y261 WeakPolarHBondContact CD2-OH 3.38Å; F242-Y261 HydrophobicContact CE2-CE1 4.17Å; F242-F271 HydrophobicContact CB-CD2 3.91Å; F242-F271 HydrophobicContact CB-CE2 3.58Å; F242-F271 HydrophobicContact CB-CZ 4.49Å; F242-F271 HydrophobicContact CG-CE2 4.44Å
243	L	94.4	Very high	93.2	Very high	58 Å²	58	43 Å²	43	30%	0.304	21%	0.206	S	C	.	.	H	α-helix	trans	-55.8	-43.8	176.4	-78.8	172.7	0	0	0	112	N239 N245 I246 D270 F271 A274	N239-L243 WeakPolarHBondContact ND2-CD1 3.31Å; N239-L243 WeakPolarHBondContact O-CB 3.49Å; N239-L243 WeakPolarHBondContact O-CG 3.21Å; N239-L243 PolarHBondContact O-N 3.26Å; L243-N245 PolarHBondContact O-N 2.99Å; L243-I246 WeakPolarHBondContact O-CG1 3.45Å; L243-I246 PolarHBondContact O-N 3.38Å; L243-D270 HydrophobicContact CD1-CB 4.34Å; L243-D270 HydrophobicContact CD2-CB 4.35Å; L243-F271 HydrophobicContact CD2-CB 4.07Å; L243-F271 HydrophobicContact CD2-CD2 4.3Å; L243-F271 HydrophobicContact CG-CB 4.43Å; L243-F271 HydrophobicContact CG-CD2 4.47Å; L243-A274 HydrophobicContact CD2-CB 4.3Å
244	R	93.9	Very high	93.4	Very high	162 Å²	162	40.7 Å²	40.7	61%	0.611	19%	0.191	S	C	*	.	H	α-helix	trans	-65.2	-21.4	176.2	-68.9	174.3	-169.5	178.1	8.9	113.9	E240 I241 F242	E240-R244 WeakPolarHBondContact O-CG 3.42Å; E240-R244 PolarHBondContact O-N 3.16Å; E240-R244 VanDerWaalsContact O-N 3.16Å; E240-R244 IonicContact OE2-NH2 3.42Å; I241-R244 PolarHBondContact O-N 3.21Å; F242-R244 VanDerWaalsContact C-N 3.3Å; F242-R244 PolarHBondContact O-N 3.35Å
245	N	94.9	Very high	93.3	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-108	4.8	-176.5	-72.6	-82.4	0	0	0	114	P211 L212 Y214 I241 F242 L243 P247 R248 L249	P211-N245 PolarHBondContact O-ND2 3.27Å; L212-N245 WeakPolarHBondContact CA-OD1 3.31Å; L212-N245 PolarHBondContact O-OD1 2.96Å; Y214-N245 HydrophobicContact CD1-CB 4.02Å; I241-N245 PolarHBondContact O-N 2.87Å; I241-N245 PolarHBondContact O-ND2 2.86Å; F242-N245 CarbonylContact O-C 3.58Å; F242-N245 PolarHBondContact O-N 3.44Å; L243-N245 PolarHBondContact O-N 2.99Å; N245-P247 VanDerWaalsContact C-CD 3.44Å; N245-P247 VanDerWaalsContact C-N 3.33Å; N245-P247 VanDerWaalsContact O-N 3.16Å; N245-R248 WeakPolarHBondContact O-CA 3.38Å; N245-R248 WeakPolarHBondContact O-CB 3.31Å; N245-R248 PolarHBondContact O-N 3.24Å; N245-L249 PolarHBondContact O-N 3.08Å
246	I	95	Very high	93.3	Very high	19 Å²	19	44.1 Å²	44.1	10%	0.097	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-44.6	-48.5	-179.4	-70	-75.5	0	0	0	113.4	F242 L243 R248 L249 L254 F271 A274 R278	F242-I246 PolarHBondContact O-N 3.32Å; F242-I246 VanDerWaalsContact O-N 3.08Å; L243-I246 WeakPolarHBondContact O-CG1 3.45Å; L243-I246 PolarHBondContact O-N 3.38Å; I246-R248 PolarHBondContact O-N 2.74Å; I246-L249 HydrophobicContact CD1-CD1 4.27Å; I246-L249 PolarHBondContact O-N 3.44Å; I246-L249 VanDerWaalsContact O-N 3.08Å; I246-L254 HydrophobicContact CD1-CD2 4.29Å; I246-F271 HydrophobicContact CD1-CD2 3.83Å; I246-F271 HydrophobicContact CD1-CE2 3.56Å; I246-F271 HydrophobicContact CD1-CZ 4.44Å; I246-A274 HydrophobicContact CD1-CB 3.93Å; I246-A274 HydrophobicContact CG1-CB 3.94Å; I246-A274 HydrophobicContact CG2-CB 4.31Å; I246-R278 HydrophobicContact CG2-CB 3.84Å; I246-R278 HydrophobicContact CG2-CG 4.2Å
247	P	93.2	Very high	93.4	Very high	92 Å²	92	42 Å²	42	60%	0.597	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-63	-20.7	-178.5	-23.3	34.9	0	0	0	114.2	N245 R278	N245-P247 VanDerWaalsContact C-CD 3.44Å; N245-P247 VanDerWaalsContact C-N 3.33Å; N245-P247 VanDerWaalsContact O-N 3.16Å; P247-R278 PolarHBondContact O-NH2 2.92Å; P247-R278 VanDerWaalsContact O-NH2 3.17Å
248	R	90.9	Very high	93.4	Very high	143 Å²	143	40.4 Å²	40.4	54%	0.54	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-96.9	-9.2	-179.5	-61.6	-179.4	177.2	178.1	0.8	113.4	N245 I246	N245-R248 WeakPolarHBondContact O-CA 3.38Å; N245-R248 WeakPolarHBondContact O-CB 3.31Å; N245-R248 PolarHBondContact O-N 3.24Å; I246-R248 PolarHBondContact O-N 2.74Å
249	L	93	Very high	93.2	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.208	C	C	.	.			trans	-80.4	132.2	177.4	-62.8	174.1	0	0	0	109.2	Y214 N245 I246 N253 L254 I257 F271 R278	Y214-L249 HydrophobicContact CD1-CD2 3.9Å; Y214-L249 HydrophobicContact CD2-CD2 3.56Å; Y214-L249 HydrophobicContact CE1-CD2 3.97Å; Y214-L249 HydrophobicContact CE2-CD2 3.68Å; Y214-L249 HydrophobicContact CG-CD2 3.68Å; N245-L249 PolarHBondContact O-N 3.08Å; I246-L249 HydrophobicContact CD1-CD1 4.27Å; I246-L249 PolarHBondContact O-N 3.44Å; I246-L249 VanDerWaalsContact O-N 3.08Å; L249-N253 HydrophobicContact CD2-CB 4.01Å; L249-L254 HydrophobicContact CB-CD1 4.32Å; L249-L254 HydrophobicContact CB-CD2 3.79Å; L249-L254 HydrophobicContact CB-CG 3.77Å; L249-L254 HydrophobicContact CD1-CD2 3.68Å; L249-L254 HydrophobicContact CD1-CG 4.49Å; L249-L254 HydrophobicContact CG-CD2 4.38Å; L249-I257 HydrophobicContact CD1-CD1 4.09Å; L249-I257 HydrophobicContact CD2-CD1 4.37Å; L249-F271 HydrophobicContact CD1-CE2 4.36Å; L249-R278 PolarHBondContact O-NE 3.03Å
250	D	91.2	Very high	93.2	Very high	65 Å²	65	41.9 Å²	41.9	35%	0.348	21%	0.208	S	C	.	.			trans	-87.7	174.7	171	57.1	20.1	0	0	0	110.7	E252 N253 L254	D250-E252 PolarHBondContact O-N 3.17Å; D250-E252 PolarHBondContact OD1-N 3.36Å; D250-N253 PolarHBondContact O-N 3.17Å; D250-N253 VanDerWaalsContact OD1-CB 3.28Å; D250-N253 WeakPolarHBondContact OD1-CB 3.47Å; D250-N253 PolarHBondContact OD1-N 2.81Å; D250-N253 PolarHBondContact OD1-ND2 3.33Å; D250-N253 PolarHBondContact OD2-ND2 3.28Å; D250-L254 WeakPolarHBondContact O-CB 3.05Å; D250-L254 VanDerWaalsContact O-CG 3.29Å; D250-L254 WeakPolarHBondContact O-CG 3.47Å; D250-L254 PolarHBondContact O-N 2.95Å
251	A	91.6	Very high	93.1	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-60.8	-33.6	-179.3	0	0	0	0	0	112.7	S255 L279 T291 L295	A251-S255 WeakPolarHBondContact O-CB 3.29Å; A251-S255 PolarHBondContact O-N 3.35Å; A251-L279 HydrophobicContact CB-CD2 4.17Å; A251-T291 HydrophobicContact CB-CG2 3.98Å; A251-L295 HydrophobicContact CB-CB 3.84Å; A251-L295 HydrophobicContact CB-CD1 4.38Å; A251-L295 HydrophobicContact CB-CG 4.45Å
252	E	91.1	Very high	92.8	Very high	68 Å²	68	41.6 Å²	41.6	32%	0.318	21%	0.206	S	C	.	.	H	α-helix	trans	-67.3	-52.1	179	-171.6	-171.9	162.9	0	0	111.4	D250 L254 S255 I256	D250-E252 PolarHBondContact O-N 3.17Å; D250-E252 PolarHBondContact OD1-N 3.36Å; E252-L254 VanDerWaalsContact C-N 3.34Å; E252-L254 PolarHBondContact O-N 3.08Å; E252-S255 WeakPolarHBondContact O-CB 3.48Å; E252-S255 PolarHBondContact O-N 3.06Å; E252-I256 HydrophobicContact CG-CD1 4.02Å; E252-I256 VanDerWaalsContact O-CG1 3.31Å; E252-I256 WeakPolarHBondContact O-CG1 3.31Å; E252-I256 PolarHBondContact O-N 3.14Å
253	N	92.9	Very high	92.4	Very high	13 Å²	13	44.2 Å²	44.2	7%	0.07	23%	0.225	C	C	.	.	H	α-helix	trans	-66.1	-37.3	-178.8	-74.1	-77.9	0	0	0	111.5	Y214 R218 L249 D250 I256 I257	Y214-N253 HydrophobicContact CE2-CB 4.45Å; R218-N253 PolarHBondContact NE-OD1 3.3Å; L249-N253 HydrophobicContact CD2-CB 4.01Å; D250-N253 PolarHBondContact O-N 3.17Å; D250-N253 VanDerWaalsContact OD1-CB 3.28Å; D250-N253 WeakPolarHBondContact OD1-CB 3.47Å; D250-N253 PolarHBondContact OD1-N 2.81Å; D250-N253 PolarHBondContact OD1-ND2 3.33Å; D250-N253 PolarHBondContact OD2-ND2 3.28Å; N253-I256 PolarHBondContact O-N 3.37Å; N253-I257 WeakPolarHBondContact O-CD1 3.33Å; N253-I257 VanDerWaalsContact O-CG1 3.24Å; N253-I257 WeakPolarHBondContact O-CG1 3.43Å; N253-I257 PolarHBondContact O-N 3.44Å
254	L	94.6	Very high	92.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-46.9	173.5	-70.4	169.5	0	0	0	111.5	I246 L249 D250 E252 I256 I257 L258 F271 A275 R278 L279 L282	I246-L254 HydrophobicContact CD1-CD2 4.29Å; L249-L254 HydrophobicContact CB-CD1 4.32Å; L249-L254 HydrophobicContact CB-CD2 3.79Å; L249-L254 HydrophobicContact CB-CG 3.77Å; L249-L254 HydrophobicContact CD1-CD2 3.68Å; L249-L254 HydrophobicContact CD1-CG 4.49Å; L249-L254 HydrophobicContact CG-CD2 4.38Å; D250-L254 WeakPolarHBondContact O-CB 3.05Å; D250-L254 VanDerWaalsContact O-CG 3.29Å; D250-L254 WeakPolarHBondContact O-CG 3.47Å; D250-L254 PolarHBondContact O-N 2.95Å; E252-L254 VanDerWaalsContact C-N 3.34Å; E252-L254 PolarHBondContact O-N 3.08Å; L254-I256 VanDerWaalsContact C-N 3.33Å; L254-I256 PolarHBondContact O-N 3.02Å; L254-I257 PolarHBondContact O-N 3.05Å; L254-L258 WeakPolarHBondContact O-CB 3.25Å; L254-L258 WeakPolarHBondContact O-CG 3.33Å; L254-L258 PolarHBondContact O-N 3Å; L254-F271 HydrophobicContact CD2-CZ 4.2Å; L254-A275 HydrophobicContact CD2-CB 3.92Å; L254-R278 HydrophobicContact CD1-CB 4.1Å; L254-R278 HydrophobicContact CD1-CG 3.7Å; L254-L279 HydrophobicContact CB-CD2 4.14Å; L254-L279 HydrophobicContact CB-CG 4.42Å; L254-L279 HydrophobicContact CD1-CD2 3.89Å; L254-L279 HydrophobicContact CD1-CG 3.87Å; L254-L282 HydrophobicContact CD1-CD1 4.47Å
255	S	92.6	Very high	91.5	Very high	22 Å²	22	39.1 Å²	39.1	15%	0.154	21%	0.206	C	C	.	.	H	α-helix	trans	-57.8	-44.4	176	-179.2	0	0	0	0	111.9	A251 E252 G259	A251-S255 WeakPolarHBondContact O-CB 3.29Å; A251-S255 PolarHBondContact O-N 3.35Å; E252-S255 WeakPolarHBondContact O-CB 3.48Å; E252-S255 PolarHBondContact O-N 3.06Å; S255-G259 PolarHBondContact O-N 3.15Å
256	I	93.1	Very high	91.1	Very high	50 Å²	50	39.7 Å²	39.7	26%	0.256	21%	0.209	S	C	.	.	H	α-helix	trans	-63.7	-48.9	177.9	-67.5	168.2	0	0	0	111	R218 E252 N253 L254 G259 L260	R218-I256 HydrophobicContact CG-CG2 4.3Å; E252-I256 HydrophobicContact CG-CD1 4.02Å; E252-I256 VanDerWaalsContact O-CG1 3.31Å; E252-I256 WeakPolarHBondContact O-CG1 3.31Å; E252-I256 PolarHBondContact O-N 3.14Å; N253-I256 PolarHBondContact O-N 3.37Å; L254-I256 VanDerWaalsContact C-N 3.33Å; L254-I256 PolarHBondContact O-N 3.02Å; I256-G259 PolarHBondContact O-N 2.92Å; I256-L260 HydrophobicContact CG2-CD1 3.97Å; I256-L260 HydrophobicContact CG2-CG 4.23Å; I256-L260 WeakPolarHBondContact O-CB 3.25Å; I256-L260 VanDerWaalsContact O-CG 3.26Å; I256-L260 WeakPolarHBondContact O-CG 3.48Å; I256-L260 PolarHBondContact O-N 3.28Å
257	I	95	Very high	90.4	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-64.1	-44.6	-177.2	-64.3	162.2	0	0	0	110.6	R218 F242 L249 N253 L254 G259 L260 Y261 F271	R218-I257 HydrophobicContact CG-CG1 4.38Å; F242-I257 HydrophobicContact CD1-CD1 3.79Å; F242-I257 HydrophobicContact CD2-CD1 4.4Å; F242-I257 HydrophobicContact CD2-CG2 3.9Å; F242-I257 HydrophobicContact CE1-CD1 3.9Å; F242-I257 HydrophobicContact CE1-CG1 4.37Å; F242-I257 HydrophobicContact CE2-CG1 4.47Å; F242-I257 HydrophobicContact CE2-CG2 3.95Å; F242-I257 HydrophobicContact CG-CD1 4.07Å; F242-I257 HydrophobicContact CZ-CD1 4.29Å; F242-I257 HydrophobicContact CZ-CG1 4.3Å; L249-I257 HydrophobicContact CD1-CD1 4.09Å; L249-I257 HydrophobicContact CD2-CD1 4.37Å; N253-I257 WeakPolarHBondContact O-CD1 3.33Å; N253-I257 VanDerWaalsContact O-CG1 3.24Å; N253-I257 WeakPolarHBondContact O-CG1 3.43Å; N253-I257 PolarHBondContact O-N 3.44Å; L254-I257 PolarHBondContact O-N 3.05Å; I257-G259 PolarHBondContact O-N 3.49Å; I257-L260 PolarHBondContact O-N 2.97Å; I257-Y261 HydrophobicContact CG2-CD1 4.23Å; I257-Y261 HydrophobicContact CG2-CD2 4.45Å; I257-Y261 HydrophobicContact CG2-CE1 4.02Å; I257-Y261 HydrophobicContact CG2-CE2 4.23Å; I257-Y261 HydrophobicContact CG2-CG 4.46Å; I257-Y261 WeakPolarHBondContact O-CB 3.41Å; I257-Y261 PolarHBondContact O-N 2.91Å; I257-F271 HydrophobicContact CB-CE1 4.17Å; I257-F271 HydrophobicContact CB-CZ 3.93Å; I257-F271 HydrophobicContact CD1-CZ 4.25Å; I257-F271 HydrophobicContact CG2-CD1 4.4Å; I257-F271 HydrophobicContact CG2-CE1 3.48Å; I257-F271 VanDerWaalsContact CG2-CE1 3.48Å; I257-F271 HydrophobicContact CG2-CE2 4.3Å; I257-F271 HydrophobicContact CG2-CZ 3.42Å; I257-F271 VanDerWaalsContact CG2-CZ 3.42Å
258	L	92	Very high	90.1	Very high	25 Å²	25	38.3 Å²	38.3	13%	0.131	20%	0.196	C	C	.	.	H	α-helix	trans	-59.2	-45	176.1	-72.9	168.9	0	0	0	111.7	L254 L260 Y261 Q262 F271 A275 L279 A298	L254-L258 WeakPolarHBondContact O-CB 3.25Å; L254-L258 WeakPolarHBondContact O-CG 3.33Å; L254-L258 PolarHBondContact O-N 3Å; L258-L260 PolarHBondContact O-N 2.97Å; L258-Y261 PolarHBondContact O-N 3.13Å; L258-Q262 WeakPolarHBondContact O-CB 3.35Å; L258-Q262 PolarHBondContact O-N 2.59Å; L258-F271 HydrophobicContact CD2-CD1 4.27Å; L258-F271 HydrophobicContact CD2-CE1 3.97Å; L258-F271 HydrophobicContact CG-CE1 4.22Å; L258-A275 HydrophobicContact CD1-CB 4.31Å; L258-A275 HydrophobicContact CD2-CB 4.43Å; L258-L279 HydrophobicContact CD1-CD1 4.2Å; L258-A298 HydrophobicContact CD1-CB 4.09Å
259	G	90.9	Very high	89.8	Confident	30 Å²	30	31.6 Å²	31.6	31%	0.309	17%	0.172	S	C	.	.	H	α-helix	trans	-65.1	-37.4	176.5	0	0	0	0	0	113.4	S255 I256 I257 S263	S255-G259 PolarHBondContact O-N 3.15Å; I256-G259 PolarHBondContact O-N 2.92Å; I257-G259 PolarHBondContact O-N 3.49Å; G259-S263 WeakPolarHBondContact O-CB 3.44Å; G259-S263 PolarHBondContact O-N 3.01Å
260	L	93.8	Very high	89.6	Confident	6 Å²	6	34.7 Å²	34.7	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-63.7	-46.7	174	-72.1	177.3	0	0	0	111.2	R218 V221 Q222 R225 I256 I257 L258 S263 L264	R218-L260 HydrophobicContact CG-CD1 4.35Å; V221-L260 HydrophobicContact CB-CD1 4.14Å; V221-L260 HydrophobicContact CG1-CB 3.77Å; V221-L260 HydrophobicContact CG1-CD1 3.98Å; V221-L260 HydrophobicContact CG1-CG 4.42Å; Q222-L260 HydrophobicContact CB-CD1 4.31Å; Q222-L260 HydrophobicContact CB-CD2 4.34Å; R225-L260 HydrophobicContact CB-CD2 4.13Å; R225-L260 VanDerWaalsContact CD-CD2 3.48Å; R225-L260 HydrophobicContact CG-CD2 4.42Å; I256-L260 HydrophobicContact CG2-CD1 3.97Å; I256-L260 HydrophobicContact CG2-CG 4.23Å; I256-L260 WeakPolarHBondContact O-CB 3.25Å; I256-L260 VanDerWaalsContact O-CG 3.26Å; I256-L260 WeakPolarHBondContact O-CG 3.48Å; I256-L260 PolarHBondContact O-N 3.28Å; I257-L260 PolarHBondContact O-N 2.97Å; L258-L260 PolarHBondContact O-N 2.97Å; L260-S263 PolarHBondContact O-N 3.33Å; L260-S263 PolarHBondContact O-OG 3.04Å; L260-L264 PolarHBondContact O-N 3.48Å
261	Y	91.9	Very high	89.7	Confident	8 Å²	8	31.7 Å²	31.7	3%	0.031	17%	0.172	C	C	.	.	H	α-helix	trans	-60.5	-45.4	177.8	-82.4	14.7	0	0	0	112.2	V221 N239 F242 I257 L258 S263 L264 Q265 F266 N268 F271	V221-Y261 HydrophobicContact CG1-CD1 4.23Å; V221-Y261 HydrophobicContact CG1-CE1 4.22Å; N239-Y261 VanDerWaalsContact CA-OH 3.29Å; N239-Y261 WeakPolarHBondContact CA-OH 3.49Å; N239-Y261 VanDerWaalsContact CB-OH 3.26Å; N239-Y261 WeakPolarHBondContact CB-OH 3.23Å; N239-Y261 WeakPolarHBondContact OD1-CE2 3.47Å; N239-Y261 PolarHBondContact OD1-OH 2.85Å; F242-Y261 HydrophobicContact CD2-CE1 4.5Å; F242-Y261 VanDerWaalsContact CD2-OH 3.28Å; F242-Y261 WeakPolarHBondContact CD2-OH 3.38Å; F242-Y261 HydrophobicContact CE2-CE1 4.17Å; I257-Y261 HydrophobicContact CG2-CD1 4.23Å; I257-Y261 HydrophobicContact CG2-CD2 4.45Å; I257-Y261 HydrophobicContact CG2-CE1 4.02Å; I257-Y261 HydrophobicContact CG2-CE2 4.23Å; I257-Y261 HydrophobicContact CG2-CG 4.46Å; I257-Y261 WeakPolarHBondContact O-CB 3.41Å; I257-Y261 PolarHBondContact O-N 2.91Å; L258-Y261 PolarHBondContact O-N 3.13Å; Y261-S263 VanDerWaalsContact C-N 3.34Å; Y261-S263 PolarHBondContact O-N 3.2Å; Y261-L264 CarbonylContact O-C 3.56Å; Y261-L264 PolarHBondContact O-N 2.91Å; Y261-Q265 PolarHBondContact O-N 3.17Å; Y261-F266 WeakPolarHBondContact CB-O 3.26Å; Y261-F266 AromaticContact CD1-CD1 3.91Å; Y261-F266 HydrophobicContact CD1-CD1 3.91Å; Y261-F266 AromaticContact CD2-CD1 3.81Å; Y261-F266 HydrophobicContact CD2-CD1 3.81Å; Y261-F266 HydrophobicContact CD2-CE1 4.27Å; Y261-F266 AromaticContact CE1-CD1 3.84Å; Y261-F266 HydrophobicContact CE1-CD1 3.84Å; Y261-F266 HydrophobicContact CE1-CE1 4.17Å; Y261-F266 AromaticContact CE2-CD1 3.75Å; Y261-F266 HydrophobicContact CE2-CD1 3.75Å; Y261-F266 AromaticContact CE2-CE1 3.75Å; Y261-F266 HydrophobicContact CE2-CE1 3.75Å; Y261-F266 AromaticContact CG-CD1 3.88Å; Y261-F266 HydrophobicContact CG-CD1 3.88Å; Y261-F266 AromaticContact CZ-CD1 3.74Å; Y261-F266 AromaticContact CZ-CE1 3.68Å; Y261-F266 PolarHBondContact O-N 3.13Å; Y261-N268 HydrophobicContact CE2-CB 4.47Å; Y261-F271 AromaticContact CD2-CD1 3.98Å; Y261-F271 HydrophobicContact CD2-CD1 3.98Å; Y261-F271 HydrophobicContact CD2-CE1 4.42Å; Y261-F271 HydrophobicContact CE2-CB 4.4Å; Y261-F271 AromaticContact CE2-CD1 3.69Å; Y261-F271 HydrophobicContact CE2-CD1 3.69Å; Y261-F271 HydrophobicContact CE2-CE1 4.24Å; Y261-F271 HydrophobicContact CE2-CG 4.07Å
262	Q	87.4	Confident	89.6	Confident	108 Å²	108	34.2 Å²	34.2	51%	0.505	18%	0.181	S	C	.	.	H	α-helix	trans	-58.5	-44.8	174.5	-173.3	178.7	23.4	0	0	111.6	L258 L264 Q265 E336	L258-Q262 WeakPolarHBondContact O-CB 3.35Å; L258-Q262 PolarHBondContact O-N 2.59Å; Q262-L264 VanDerWaalsContact C-N 3.31Å; Q262-L264 PolarHBondContact O-N 3.3Å; Q262-Q265 PolarHBondContact O-N 2.92Å; Q262-E336 PolarHBondContact NE2-OE1 2.94Å
263	S	87.2	Confident	89.5	Confident	56 Å²	56	32.8 Å²	32.8	39%	0.392	18%	0.175	S	C	.	.	H	α-helix	trans	-65.3	-32.5	179.9	74.1	0	0	0	0	113.8	R225 G259 L260 Y261 Q265	R225-S263 WeakPolarHBondContact CD-OG 3.37Å; R225-S263 WeakPolarHBondContact CG-OG 3.45Å; G259-S263 WeakPolarHBondContact O-CB 3.44Å; G259-S263 PolarHBondContact O-N 3.01Å; L260-S263 PolarHBondContact O-N 3.33Å; L260-S263 PolarHBondContact O-OG 3.04Å; Y261-S263 VanDerWaalsContact C-N 3.34Å; Y261-S263 PolarHBondContact O-N 3.2Å; S263-Q265 VanDerWaalsContact C-N 3.34Å
264	L	88.3	Confident	89.5	Confident	7 Å²	7	33.2 Å²	33.2	4%	0.037	18%	0.181	C	C	.	.	H	α-helix	trans	-88.7	-2.2	178.3	-72.8	171.7	0	0	0	113.3	V221 L224 R225 T230 L235 L260 Y261 Q262 F266	V221-L264 HydrophobicContact CG1-CD1 3.72Å; L224-L264 HydrophobicContact CB-CD1 3.98Å; L224-L264 HydrophobicContact CB-CD2 4.26Å; R225-L264 HydrophobicContact CB-CD1 4.49Å; R225-L264 HydrophobicContact CB-CD2 4.39Å; R225-L264 HydrophobicContact CB-CG 4.31Å; T230-L264 WeakPolarHBondContact CG2-O 3.5Å; T230-L264 PolarHBondContact OG1-O 3.45Å; L235-L264 HydrophobicContact CD1-CD1 4.49Å; L235-L264 HydrophobicContact CD2-CD1 3.89Å; L260-L264 PolarHBondContact O-N 3.48Å; Y261-L264 CarbonylContact O-C 3.56Å; Y261-L264 PolarHBondContact O-N 2.91Å; Q262-L264 VanDerWaalsContact C-N 3.31Å; Q262-L264 PolarHBondContact O-N 3.3Å; L264-F266 HydrophobicContact CB-CB 4.44Å; L264-F266 PolarHBondContact O-N 2.99Å
265	Q	81.9	Confident	89.5	Confident	106 Å²	106	33.2 Å²	33.2	50%	0.495	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	31.4	-172.9	-54.8	177.5	6.2	0	0	112.9	Y261 Q262 S263 F492	Y261-Q265 PolarHBondContact O-N 3.17Å; Q262-Q265 PolarHBondContact O-N 2.92Å; S263-Q265 VanDerWaalsContact C-N 3.34Å; Q265-F492 VanDerWaalsContact NE2-CE1 3.32Å; Q265-F492 VanDerWaalsContact NE2-CZ 3.29Å
266	F	86.2	Confident	89.5	Confident	13 Å²	13	33.4 Å²	33.4	6%	0.057	18%	0.179	C	C	.	.			trans	-95.1	105.1	176.4	-178.3	-105	0	0	0	109.1	L235 D236 N239 Y261 L264 N268	L235-F266 HydrophobicContact CB-CD1 4.33Å; L235-F266 HydrophobicContact CB-CD2 3.96Å; L235-F266 HydrophobicContact CB-CE1 4.23Å; L235-F266 HydrophobicContact CB-CE2 3.86Å; L235-F266 HydrophobicContact CB-CG 4.2Å; L235-F266 HydrophobicContact CB-CZ 3.99Å; L235-F266 HydrophobicContact CD1-CB 4.02Å; L235-F266 HydrophobicContact CD1-CD2 3.92Å; L235-F266 HydrophobicContact CD1-CG 3.97Å; D236-F266 WeakPolarHBondContact OD1-CE2 3.43Å; D236-F266 VanDerWaalsContact OD1-CZ 3.24Å; D236-F266 WeakPolarHBondContact OD1-CZ 3.44Å; N239-F266 HydrophobicContact CB-CE1 4.19Å; N239-F266 HydrophobicContact CB-CZ 4.38Å; Y261-F266 WeakPolarHBondContact CB-O 3.26Å; Y261-F266 AromaticContact CD1-CD1 3.91Å; Y261-F266 HydrophobicContact CD1-CD1 3.91Å; Y261-F266 AromaticContact CD2-CD1 3.81Å; Y261-F266 HydrophobicContact CD2-CD1 3.81Å; Y261-F266 HydrophobicContact CD2-CE1 4.27Å; Y261-F266 AromaticContact CE1-CD1 3.84Å; Y261-F266 HydrophobicContact CE1-CD1 3.84Å; Y261-F266 HydrophobicContact CE1-CE1 4.17Å; Y261-F266 AromaticContact CE2-CD1 3.75Å; Y261-F266 HydrophobicContact CE2-CD1 3.75Å; Y261-F266 AromaticContact CE2-CE1 3.75Å; Y261-F266 HydrophobicContact CE2-CE1 3.75Å; Y261-F266 AromaticContact CG-CD1 3.88Å; Y261-F266 HydrophobicContact CG-CD1 3.88Å; Y261-F266 AromaticContact CZ-CD1 3.74Å; Y261-F266 AromaticContact CZ-CE1 3.68Å; Y261-F266 PolarHBondContact O-N 3.13Å; L264-F266 HydrophobicContact CB-CB 4.44Å; L264-F266 PolarHBondContact O-N 2.99Å; F266-N268 HydrophobicContact CD1-CB 4.49Å; F266-N268 HydrophobicContact CE1-CB 3.81Å; F266-N268 HydrophobicContact CZ-CB 4.18Å
267	N	78.6	Confident	89.4	Confident	62 Å²	62	37.2 Å²	37.2	33%	0.332	20%	0.196	S	C	.	.			trans	-107.3	69.9	-170.3	-71.8	-32.8	0	0	0	112.6	C269	N267-C269 PolarHBondContact O-N 3.48Å
268	N	87.7	Confident	89.4	Confident	19 Å²	19	39.7 Å²	39.7	10%	0.102	21%	0.205	C	C	.	.			trans	-76.4	117.1	178.1	-171.2	-91	0	0	0	112.4	N239 Y261 F266 D270 F271 R272	N239-N268 PolarHBondContact ND2-ND2 3.43Å; N239-N268 VanDerWaalsContact ND2-ND2 3.2Å; N239-N268 PolarHBondContact ND2-OD1 3.05Å; Y261-N268 HydrophobicContact CE2-CB 4.47Å; F266-N268 HydrophobicContact CD1-CB 4.49Å; F266-N268 HydrophobicContact CE1-CB 3.81Å; F266-N268 HydrophobicContact CZ-CB 4.18Å; N268-D270 PolarHBondContact OD1-N 3.12Å; N268-F271 HydrophobicContact CB-CB 4.31Å; N268-F271 PolarHBondContact OD1-N 3.07Å; N268-R272 WeakPolarHBondContact O-CB 3.46Å; N268-R272 PolarHBondContact O-N 3.39Å; N268-R272 VanDerWaalsContact O-N 3.15Å
269	C	85.3	Confident	89.5	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.02	20%	0.199	C	C	.	.	H	α-helix	trans	-60.3	-48.4	-178.4	-169.2	0	0	0	0	113	N267 F271 R272 L273 D595 Q632	N267-C269 PolarHBondContact O-N 3.48Å; C269-F271 VanDerWaalsContact C-N 3.35Å; C269-F271 PolarHBondContact O-N 2.98Å; C269-R272 PolarHBondContact O-N 3.03Å; C269-L273 WeakPolarHBondContact O-CG 3.46Å; C269-L273 PolarHBondContact O-N 2.94Å; C269-D595 WeakPolarHBondContact CB-OD1 3.32Å; C269-D595 PolarHBondContact N-OD1 3.49Å; C269-Q632 HydrophobicContact CB-CG 4.4Å; C269-Q632 VanDerWaalsContact CB-NE2 3.33Å; C269-Q632 VanDerWaalsContact SG-CB 3.57Å; C269-Q632 VanDerWaalsContact SG-CG 3.56Å
270	D	89.2	Confident	89.7	Confident	66 Å²	66	39.6 Å²	39.6	35%	0.353	20%	0.197	S	C	.	.	H	α-helix	trans	-66.1	-42.1	-171.7	-61.7	-31.4	0	0	0	110.3	L243 N268 A274 K628	L243-D270 HydrophobicContact CD1-CB 4.34Å; L243-D270 HydrophobicContact CD2-CB 4.35Å; N268-D270 PolarHBondContact OD1-N 3.12Å; D270-A274 VanDerWaalsContact O-CB 3.31Å; D270-A274 WeakPolarHBondContact O-CB 3.41Å; D270-A274 PolarHBondContact O-N 3.21Å; D270-K628 WeakPolarHBondContact OD1-CE 3.47Å; D270-K628 IonicContact OD1-NZ 2.92Å; D270-K628 PolarHBondContact OD1-NZ 3.47Å; D270-K628 IonicContact OD2-NZ 2.96Å; D270-K628 PolarHBondContact OD2-NZ 3.42Å
271	F	92.4	Very high	89.6	Confident	1 Å²	1	45.2 Å²	45.2	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-65.7	-42.3	175.2	-178.3	-96.6	0	0	0	112	N239 F242 L243 I246 L249 L254 I257 L258 Y261 N268 C269 L273 A274 A275	N239-F271 VanDerWaalsContact OD1-CB 3.31Å; N239-F271 WeakPolarHBondContact OD1-CB 3.1Å; F242-F271 HydrophobicContact CB-CD2 3.91Å; F242-F271 HydrophobicContact CB-CE2 3.58Å; F242-F271 HydrophobicContact CB-CZ 4.49Å; F242-F271 HydrophobicContact CG-CE2 4.44Å; L243-F271 HydrophobicContact CD2-CB 4.07Å; L243-F271 HydrophobicContact CD2-CD2 4.3Å; L243-F271 HydrophobicContact CG-CB 4.43Å; L243-F271 HydrophobicContact CG-CD2 4.47Å; I246-F271 HydrophobicContact CD1-CD2 3.83Å; I246-F271 HydrophobicContact CD1-CE2 3.56Å; I246-F271 HydrophobicContact CD1-CZ 4.44Å; L249-F271 HydrophobicContact CD1-CE2 4.36Å; L254-F271 HydrophobicContact CD2-CZ 4.2Å; I257-F271 HydrophobicContact CB-CE1 4.17Å; I257-F271 HydrophobicContact CB-CZ 3.93Å; I257-F271 HydrophobicContact CD1-CZ 4.25Å; I257-F271 HydrophobicContact CG2-CD1 4.4Å; I257-F271 HydrophobicContact CG2-CE1 3.48Å; I257-F271 VanDerWaalsContact CG2-CE1 3.48Å; I257-F271 HydrophobicContact CG2-CE2 4.3Å; I257-F271 HydrophobicContact CG2-CZ 3.42Å; I257-F271 VanDerWaalsContact CG2-CZ 3.42Å; L258-F271 HydrophobicContact CD2-CD1 4.27Å; L258-F271 HydrophobicContact CD2-CE1 3.97Å; L258-F271 HydrophobicContact CG-CE1 4.22Å; Y261-F271 AromaticContact CD2-CD1 3.98Å; Y261-F271 HydrophobicContact CD2-CD1 3.98Å; Y261-F271 HydrophobicContact CD2-CE1 4.42Å; Y261-F271 HydrophobicContact CE2-CB 4.4Å; Y261-F271 AromaticContact CE2-CD1 3.69Å; Y261-F271 HydrophobicContact CE2-CD1 3.69Å; Y261-F271 HydrophobicContact CE2-CE1 4.24Å; Y261-F271 HydrophobicContact CE2-CG 4.07Å; N268-F271 HydrophobicContact CB-CB 4.31Å; N268-F271 PolarHBondContact OD1-N 3.07Å; C269-F271 VanDerWaalsContact C-N 3.35Å; C269-F271 PolarHBondContact O-N 2.98Å; F271-L273 PolarHBondContact O-N 3.17Å; F271-A274 PolarHBondContact O-N 2.84Å; F271-A275 HydrophobicContact CE1-CB 4.24Å; F271-A275 HydrophobicContact CZ-CB 4.39Å; F271-A275 WeakPolarHBondContact O-CB 3.44Å; F271-A275 PolarHBondContact O-N 3.19Å
272	R	89.5	Confident	89.7	Confident	55 Å²	55	45.8 Å²	45.8	21%	0.208	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-41.8	179.8	-169.2	179.7	-178.9	103.9	-3	111.7	N268 C269 K276 S635	N268-R272 WeakPolarHBondContact O-CB 3.46Å; N268-R272 PolarHBondContact O-N 3.39Å; N268-R272 VanDerWaalsContact O-N 3.15Å; C269-R272 PolarHBondContact O-N 3.03Å; R272-K276 WeakPolarHBondContact O-CB 3.33Å; R272-K276 PolarHBondContact O-N 2.78Å; R272-S635 WeakPolarHBondContact CD-OG 3.36Å; R272-S635 VanDerWaalsContact CZ-O 3.27Å; R272-S635 PolarHBondContact NE-O 3.36Å; R272-S635 PolarHBondContact NE-OG 3.14Å; R272-S635 PolarHBondContact NH2-O 3.47Å
273	L	89.4	Confident	89.8	Confident	37 Å²	37	41.1 Å²	41.1	19%	0.194	21%	0.205	C	C	.	.	H	α-helix	trans	-67.9	-48.6	176.9	-69.3	174.3	0	0	0	111.5	C269 F271 A275 K276 E277 C631	C269-L273 WeakPolarHBondContact O-CG 3.46Å; C269-L273 PolarHBondContact O-N 2.94Å; F271-L273 PolarHBondContact O-N 3.17Å; L273-A275 VanDerWaalsContact C-N 3.31Å; L273-A275 PolarHBondContact O-N 3.08Å; L273-K276 WeakPolarHBondContact O-CB 2.99Å; L273-K276 PolarHBondContact O-N 2.79Å; L273-K276 VanDerWaalsContact O-N 3.16Å; L273-E277 PolarHBondContact O-N 3.39Å; L273-C631 HydrophobicContact CD1-CB 4.03Å; L273-C631 HydrophobicContact CD2-CB 4.26Å
274	A	92.8	Very high	89.8	Confident	22 Å²	22	44.1 Å²	44.1	18%	0.182	22%	0.217	C	C	.	.	H	α-helix	trans	-62.4	-38.4	177.9	0	0	0	0	0	112.4	L243 I246 D270 F271 R278	L243-A274 HydrophobicContact CD2-CB 4.3Å; I246-A274 HydrophobicContact CD1-CB 3.93Å; I246-A274 HydrophobicContact CG1-CB 3.94Å; I246-A274 HydrophobicContact CG2-CB 4.31Å; D270-A274 VanDerWaalsContact O-CB 3.31Å; D270-A274 WeakPolarHBondContact O-CB 3.41Å; D270-A274 PolarHBondContact O-N 3.21Å; F271-A274 PolarHBondContact O-N 2.84Å; A274-R278 WeakPolarHBondContact O-CB 3.32Å; A274-R278 PolarHBondContact O-N 2.96Å
275	A	93.7	Very high	89.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-65.7	-41.3	174.6	0	0	0	0	0	111.8	L254 L258 F271 L273 R278 L279	L254-A275 HydrophobicContact CD2-CB 3.92Å; L258-A275 HydrophobicContact CD1-CB 4.31Å; L258-A275 HydrophobicContact CD2-CB 4.43Å; F271-A275 HydrophobicContact CE1-CB 4.24Å; F271-A275 HydrophobicContact CZ-CB 4.39Å; F271-A275 WeakPolarHBondContact O-CB 3.44Å; F271-A275 PolarHBondContact O-N 3.19Å; L273-A275 VanDerWaalsContact C-N 3.31Å; L273-A275 PolarHBondContact O-N 3.08Å; A275-R278 PolarHBondContact O-N 3.03Å; A275-L279 WeakPolarHBondContact O-CB 3.29Å; A275-L279 WeakPolarHBondContact O-CD1 3.48Å; A275-L279 WeakPolarHBondContact O-CG 3.26Å; A275-L279 PolarHBondContact O-N 3.28Å
276	K	92.2	Very high	89.8	Confident	26 Å²	26	43.7 Å²	43.7	11%	0.113	22%	0.222	C	C	.	.	H	α-helix	trans	-58.2	-51	175.1	178.7	-175.9	171.8	-178.8	0	111	R272 L273 R278 L279 I280 L299 I302 E634	R272-K276 WeakPolarHBondContact O-CB 3.33Å; R272-K276 PolarHBondContact O-N 2.78Å; L273-K276 WeakPolarHBondContact O-CB 2.99Å; L273-K276 PolarHBondContact O-N 2.79Å; L273-K276 VanDerWaalsContact O-N 3.16Å; K276-R278 PolarHBondContact O-N 3.33Å; K276-L279 PolarHBondContact O-N 2.88Å; K276-I280 HydrophobicContact CG-CD1 4.05Å; K276-I280 VanDerWaalsContact O-CG1 3.28Å; K276-I280 WeakPolarHBondContact O-CG1 3.24Å; K276-I280 PolarHBondContact O-N 2.89Å; K276-L299 HydrophobicContact CG-CD1 4.13Å; K276-I302 HydrophobicContact CB-CD1 3.83Å; K276-I302 HydrophobicContact CB-CG1 4.35Å; K276-I302 WeakPolarHBondContact CD-O 3.31Å; K276-I302 VanDerWaalsContact CE-O 3.26Å; K276-I302 WeakPolarHBondContact CE-O 3.43Å; K276-I302 HydrophobicContact CG-CD1 4.3Å; K276-I302 HydrophobicContact CG-CG1 4.28Å; K276-I302 PolarHBondContact NZ-O 3.43Å; K276-E634 IonicContact NZ-OE2 3.87Å
277	E	92.8	Very high	89.4	Confident	130 Å²	130	48.8 Å²	48.8	61%	0.607	26%	0.255	S	S	*	.	H	α-helix	trans	-58.8	-47.9	178.8	-70.5	176.7	171.7	0	0	111.3	L273 L279 I280 E281	L273-E277 PolarHBondContact O-N 3.39Å; E277-L279 VanDerWaalsContact C-N 3.35Å; E277-L279 PolarHBondContact O-N 3.23Å; E277-I280 WeakPolarHBondContact O-CB 3.35Å; E277-I280 PolarHBondContact O-N 3.32Å; E277-I280 VanDerWaalsContact O-N 3.14Å; E277-E281 PolarHBondContact O-N 3.39Å; E277-E281 VanDerWaalsContact O-N 3.15Å
278	R	94.6	Very high	89.6	Confident	53 Å²	53	48.7 Å²	48.7	20%	0.2	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-39.8	178.2	-177.5	56.9	-179.7	154	2.8	113.1	I246 P247 L249 L254 A274 A275 K276 I280 E281 L282	I246-R278 HydrophobicContact CG2-CB 3.84Å; I246-R278 HydrophobicContact CG2-CG 4.2Å; P247-R278 PolarHBondContact O-NH2 2.92Å; P247-R278 VanDerWaalsContact O-NH2 3.17Å; L249-R278 PolarHBondContact O-NE 3.03Å; L254-R278 HydrophobicContact CD1-CB 4.1Å; L254-R278 HydrophobicContact CD1-CG 3.7Å; A274-R278 WeakPolarHBondContact O-CB 3.32Å; A274-R278 PolarHBondContact O-N 2.96Å; A275-R278 PolarHBondContact O-N 3.03Å; K276-R278 PolarHBondContact O-N 3.33Å; R278-I280 VanDerWaalsContact C-N 3.31Å; R278-I280 PolarHBondContact O-N 3.21Å; R278-E281 WeakPolarHBondContact CD-OE2 3.26Å; R278-E281 IonicContact CZ-OE2 2.57Å; R278-E281 IonicContact NE-OE2 3.67Å; R278-E281 IonicContact NH1-OE2 2.85Å; R278-E281 PolarHBondContact NH1-OE2 3.27Å; R278-E281 WeakPolarHBondContact O-CB 3.28Å; R278-E281 PolarHBondContact O-N 2.8Å; R278-L282 HydrophobicContact CG-CD1 4.29Å; R278-L282 WeakPolarHBondContact O-CG 3.31Å; R278-L282 PolarHBondContact O-N 3.29Å
279	L	94.5	Very high	89.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.6	-34.9	176.5	-74.7	165.9	0	0	0	111.8	A251 L254 L258 A275 K276 E277 L282 I283 L295 A298 L299	A251-L279 HydrophobicContact CB-CD2 4.17Å; L254-L279 HydrophobicContact CB-CD2 4.14Å; L254-L279 HydrophobicContact CB-CG 4.42Å; L254-L279 HydrophobicContact CD1-CD2 3.89Å; L254-L279 HydrophobicContact CD1-CG 3.87Å; L258-L279 HydrophobicContact CD1-CD1 4.2Å; A275-L279 WeakPolarHBondContact O-CB 3.29Å; A275-L279 WeakPolarHBondContact O-CD1 3.48Å; A275-L279 WeakPolarHBondContact O-CG 3.26Å; A275-L279 PolarHBondContact O-N 3.28Å; K276-L279 PolarHBondContact O-N 2.88Å; E277-L279 VanDerWaalsContact C-N 3.35Å; E277-L279 PolarHBondContact O-N 3.23Å; L279-L282 PolarHBondContact O-N 3.45Å; L279-I283 PolarHBondContact O-N 2.91Å; L279-L295 HydrophobicContact CD2-CG 4.32Å; L279-A298 HydrophobicContact CD1-CB 3.63Å; L279-A298 HydrophobicContact CD2-CB 4.25Å; L279-L299 HydrophobicContact CB-CB 4.18Å; L279-L299 HydrophobicContact CB-CD1 4.04Å; L279-L299 HydrophobicContact CB-CD2 4.13Å; L279-L299 HydrophobicContact CB-CG 4.33Å; L279-L299 HydrophobicContact CD1-CB 4.25Å
280	I	93.4	Very high	89.6	Confident	54 Å²	54	54 Å²	54	28%	0.277	28%	0.277	S	S	.	.	H	α-helix	trans	-64.1	-42.6	175.6	-68.1	163.7	0	0	0	110.7	K276 E277 R278 L282 I283 L299 I307	K276-I280 HydrophobicContact CG-CD1 4.05Å; K276-I280 VanDerWaalsContact O-CG1 3.28Å; K276-I280 WeakPolarHBondContact O-CG1 3.24Å; K276-I280 PolarHBondContact O-N 2.89Å; E277-I280 WeakPolarHBondContact O-CB 3.35Å; E277-I280 PolarHBondContact O-N 3.32Å; E277-I280 VanDerWaalsContact O-N 3.14Å; R278-I280 VanDerWaalsContact C-N 3.31Å; R278-I280 PolarHBondContact O-N 3.21Å; I280-L282 PolarHBondContact O-N 3.45Å; I280-I283 HydrophobicContact CB-CD1 4.48Å; I280-I283 HydrophobicContact CG2-CD1 4.33Å; I280-I283 WeakPolarHBondContact O-CG1 3.43Å; I280-I283 PolarHBondContact O-N 2.86Å; I280-L299 HydrophobicContact CG1-CD1 3.98Å; I280-L299 HydrophobicContact CG1-CD2 4.03Å; I280-I307 HydrophobicContact CD1-CD1 3.61Å; I280-I307 HydrophobicContact CG1-CD1 4.03Å
281	E	93.3	Very high	89.6	Confident	124 Å²	124	52.7 Å²	52.7	58%	0.579	27%	0.271	S	S	*	.	H	α-helix	trans	-60.5	-32.3	175.2	-65	173.6	176.1	0	0	112.7	E277 R278	E277-E281 PolarHBondContact O-N 3.39Å; E277-E281 VanDerWaalsContact O-N 3.15Å; R278-E281 WeakPolarHBondContact CD-OE2 3.26Å; R278-E281 IonicContact CZ-OE2 2.57Å; R278-E281 IonicContact NE-OE2 3.67Å; R278-E281 IonicContact NH1-OE2 2.85Å; R278-E281 PolarHBondContact NH1-OE2 3.27Å; R278-E281 WeakPolarHBondContact O-CB 3.28Å; R278-E281 PolarHBondContact O-N 2.8Å
282	L	92.9	Very high	89.5	Confident	19 Å²	19	52.9 Å²	52.9	10%	0.099	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-5.4	-175.8	-69.6	174	0	0	0	114.1	L254 R278 L279 I280 D284 T285 S286 L295	L254-L282 HydrophobicContact CD1-CD1 4.47Å; R278-L282 HydrophobicContact CG-CD1 4.29Å; R278-L282 WeakPolarHBondContact O-CG 3.31Å; R278-L282 PolarHBondContact O-N 3.29Å; L279-L282 PolarHBondContact O-N 3.45Å; I280-L282 PolarHBondContact O-N 3.45Å; L282-D284 VanDerWaalsContact C-N 3.35Å; L282-D284 PolarHBondContact O-N 3.31Å; L282-T285 WeakPolarHBondContact CA-OG1 3.43Å; L282-T285 PolarHBondContact O-N 3.2Å; L282-T285 PolarHBondContact O-OG1 2.97Å; L282-S286 WeakPolarHBondContact O-CB 3.31Å; L282-S286 PolarHBondContact O-N 3.03Å; L282-S286 VanDerWaalsContact O-N 3.14Å; L282-S286 PolarHBondContact O-OG 3.42Å; L282-L295 HydrophobicContact CB-CD1 3.83Å; L282-L295 WeakPolarHBondContact O-CD1 3.03Å
283	I	90.4	Very high	89.6	Confident	11 Å²	11	50.3 Å²	50.3	6%	0.056	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-50.5	-177.6	-68	171.6	0	0	0	110.6	L279 I280 T285 S286 L295 L299 I307 L311	L279-I283 PolarHBondContact O-N 2.91Å; I280-I283 HydrophobicContact CB-CD1 4.48Å; I280-I283 HydrophobicContact CG2-CD1 4.33Å; I280-I283 WeakPolarHBondContact O-CG1 3.43Å; I280-I283 PolarHBondContact O-N 2.86Å; I283-T285 VanDerWaalsContact C-N 3.33Å; I283-T285 PolarHBondContact O-N 2.95Å; I283-S286 PolarHBondContact O-N 2.95Å; I283-L295 HydrophobicContact CG1-CD1 4.49Å; I283-L295 HydrophobicContact CG1-CD2 4.1Å; I283-L299 HydrophobicContact CD1-CD2 3.88Å; I283-L299 HydrophobicContact CG1-CD2 4.03Å; I283-I307 HydrophobicContact CD1-CG2 4.2Å; I283-L311 HydrophobicContact CD1-CD2 4.44Å; I283-L311 HydrophobicContact CG1-CD2 4.32Å
284	D	87.2	Confident	89.8	Confident	118 Å²	118	51.5 Å²	51.5	63%	0.631	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-21.1	-173.1	-68.8	-54.1	0	0	0	113.4	L282 R310	L282-D284 VanDerWaalsContact C-N 3.35Å; L282-D284 PolarHBondContact O-N 3.31Å; D284-R310 IonicContact OD1-CZ 3.6Å; D284-R310 IonicContact OD1-NH2 3.68Å; D284-R310 PolarHBondContact OD1-NH2 3.27Å; D284-R310 IonicContact OD2-CZ 2.8Å; D284-R310 IonicContact OD2-NH2 3.25Å; D284-R310 PolarHBondContact OD2-NH2 3.05Å
285	T	85.6	Confident	89.8	Confident	95 Å²	95	50.4 Å²	50.4	58%	0.583	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-16.7	178	54.3	0	0	0	0	113.5	L282 I283 T287	L282-T285 WeakPolarHBondContact CA-OG1 3.43Å; L282-T285 PolarHBondContact O-N 3.2Å; L282-T285 PolarHBondContact O-OG1 2.97Å; I283-T285 VanDerWaalsContact C-N 3.33Å; I283-T285 PolarHBondContact O-N 2.95Å; T285-T287 PolarHBondContact O-N 3.32Å; T285-T287 VanDerWaalsContact O-N 3.17Å
286	S	83.1	Confident	89.8	Confident	10 Å²	10	50.4 Å²	50.4	7%	0.07	26%	0.257	C	S	.	.			trans	-89.7	75.4	-175.6	-57.7	0	0	0	0	110.6	L282 I283 L295	L282-S286 WeakPolarHBondContact O-CB 3.31Å; L282-S286 PolarHBondContact O-N 3.03Å; L282-S286 VanDerWaalsContact O-N 3.14Å; L282-S286 PolarHBondContact O-OG 3.42Å; I283-S286 PolarHBondContact O-N 2.95Å; S286-L295 WeakPolarHBondContact OG-CD1 3.48Å
287	T	78.4	Confident	89.8	Confident	120 Å²	120	50.3 Å²	50.3	74%	0.736	26%	0.261	S	S	*	.			trans	-87.3	-24.3	-177.2	55.3	0	0	0	0	113.6	T285	T285-T287 PolarHBondContact O-N 3.32Å; T285-T287 VanDerWaalsContact O-N 3.17Å
288	D	84.1	Confident	89.7	Confident	60 Å²	60	44.6 Å²	44.6	32%	0.321	24%	0.236	S	C	.	.	S	Bend	trans	-79.7	139.4	-179.4	75.6	94.6	0	0	0	111.4	Y290 T291 F292	D288-Y290 PolarHBondContact O-N 3.42Å; D288-Y290 WeakPolarHBondContact OD1-CA 3.34Å; D288-Y290 WeakPolarHBondContact OD1-CB 3.44Å; D288-Y290 PolarHBondContact OD1-N 3.4Å; D288-T291 PolarHBondContact O-N 2.82Å; D288-T291 WeakPolarHBondContact OD1-CB 3.4Å; D288-T291 PolarHBondContact OD1-N 2.93Å; D288-T291 PolarHBondContact OD1-OG1 3.28Å; D288-T291 WeakPolarHBondContact OD2-CB 3.31Å; D288-T291 PolarHBondContact OD2-OG1 3.45Å; D288-F292 WeakPolarHBondContact O-CB 3.5Å; D288-F292 PolarHBondContact O-N 3.19Å
289	P	86.3	Confident	89.6	Confident	28 Å²	28	42.1 Å²	42.1	18%	0.182	23%	0.227	C	C	.	.	H	α-helix	trans	-58	-25.4	-177.7	-26.7	33.4	0	0	0	114.2	S293 E321 F322	P289-S293 WeakPolarHBondContact O-CB 3.24Å; P289-S293 PolarHBondContact O-N 3.05Å; P289-S293 VanDerWaalsContact O-N 3.11Å; P289-S293 PolarHBondContact O-OG 3Å; P289-E321 HydrophobicContact CB-CB 4.38Å; P289-E321 HydrophobicContact CG-CB 3.87Å; P289-E321 WeakPolarHBondContact CG-OE2 3.33Å; P289-F322 HydrophobicContact CB-CD1 3.91Å; P289-F322 HydrophobicContact CB-CE1 3.95Å
290	Y	86.6	Confident	89.5	Confident	105 Å²	105	42.1 Å²	42.1	41%	0.412	23%	0.227	S	C	.	.	H	α-helix	trans	-73.6	-59.5	-179.7	178.7	-89.5	0	0	0	112.5	D288 F292 S293 K294	D288-Y290 PolarHBondContact O-N 3.42Å; D288-Y290 WeakPolarHBondContact OD1-CA 3.34Å; D288-Y290 WeakPolarHBondContact OD1-CB 3.44Å; D288-Y290 PolarHBondContact OD1-N 3.4Å; Y290-F292 VanDerWaalsContact C-N 3.26Å; Y290-F292 PolarHBondContact O-N 3.46Å; Y290-S293 PolarHBondContact O-N 3.3Å; Y290-S293 PolarHBondContact O-OG 3.18Å; Y290-K294 PolarHBondContact O-N 2.75Å
291	T	87.5	Confident	89.2	Confident	38 Å²	38	40.6 Å²	40.6	23%	0.233	22%	0.221	C	C	.	.	H	α-helix	trans	-60.3	-40.9	176.5	-51.2	0	0	0	0	110.5	A251 D288 S293 K294 L295	A251-T291 HydrophobicContact CB-CG2 3.98Å; D288-T291 PolarHBondContact O-N 2.82Å; D288-T291 WeakPolarHBondContact OD1-CB 3.4Å; D288-T291 PolarHBondContact OD1-N 2.93Å; D288-T291 PolarHBondContact OD1-OG1 3.28Å; D288-T291 WeakPolarHBondContact OD2-CB 3.31Å; D288-T291 PolarHBondContact OD2-OG1 3.45Å; T291-S293 PolarHBondContact O-N 2.66Å; T291-K294 WeakPolarHBondContact O-CB 3.46Å; T291-K294 PolarHBondContact O-N 3.03Å; T291-K294 VanDerWaalsContact O-N 3.15Å; T291-L295 PolarHBondContact O-N 3.02Å
292	F	91.6	Very high	88.8	Confident	5 Å²	5	35.1 Å²	35.1	2%	0.022	20%	0.195	C	C	.	.	H	α-helix	trans	-61.4	-41.7	178.2	-175.3	-97.9	0	0	0	112.4	D288 Y290 K294 L295 F296 L311 T314 T315 V318 F322	D288-F292 WeakPolarHBondContact O-CB 3.5Å; D288-F292 PolarHBondContact O-N 3.19Å; Y290-F292 VanDerWaalsContact C-N 3.26Å; Y290-F292 PolarHBondContact O-N 3.46Å; F292-K294 VanDerWaalsContact C-N 3.28Å; F292-K294 PolarHBondContact O-N 3.47Å; F292-L295 PolarHBondContact O-N 3.17Å; F292-F296 WeakPolarHBondContact O-CB 3.35Å; F292-F296 PolarHBondContact O-N 3.38Å; F292-L311 HydrophobicContact CE2-CD2 4.35Å; F292-L311 HydrophobicContact CZ-CD2 4.43Å; F292-T314 HydrophobicContact CD2-CG2 4.32Å; F292-T314 HydrophobicContact CE1-CG2 4.14Å; F292-T314 HydrophobicContact CE2-CG2 3.57Å; F292-T314 HydrophobicContact CZ-CG2 3.47Å; F292-T314 VanDerWaalsContact CZ-CG2 3.47Å; F292-T315 VanDerWaalsContact CE1-OG1 3.3Å; F292-T315 WeakPolarHBondContact CE1-OG1 3.18Å; F292-V318 HydrophobicContact CD1-CG2 4.05Å; F292-V318 HydrophobicContact CE1-CG2 4.22Å; F292-F322 HydrophobicContact CD1-CZ 4.35Å
293	S	92.1	Very high	88.5	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.014	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-35.4	176.2	73.3	0	0	0	0	113	P289 Y290 T291 A297 Q326	P289-S293 WeakPolarHBondContact O-CB 3.24Å; P289-S293 PolarHBondContact O-N 3.05Å; P289-S293 VanDerWaalsContact O-N 3.11Å; P289-S293 PolarHBondContact O-OG 3Å; Y290-S293 PolarHBondContact O-N 3.3Å; Y290-S293 PolarHBondContact O-OG 3.18Å; T291-S293 PolarHBondContact O-N 2.66Å; S293-A297 WeakPolarHBondContact O-CB 3.35Å; S293-A297 PolarHBondContact O-N 3.23Å; S293-Q326 WeakPolarHBondContact OG-CG 3.29Å
294	K	91.9	Very high	88.2	Confident	61 Å²	61	35.7 Å²	35.7	27%	0.265	20%	0.202	S	C	.	.	H	α-helix	trans	-70.8	-41.6	175.9	-62	-58.6	-175.3	-178.1	0	111.5	Y290 T291 F292 A297 A298	Y290-K294 PolarHBondContact O-N 2.75Å; T291-K294 WeakPolarHBondContact O-CB 3.46Å; T291-K294 PolarHBondContact O-N 3.03Å; T291-K294 VanDerWaalsContact O-N 3.15Å; F292-K294 VanDerWaalsContact C-N 3.28Å; F292-K294 PolarHBondContact O-N 3.47Å; K294-A297 PolarHBondContact O-N 2.76Å; K294-A298 WeakPolarHBondContact O-CB 3.45Å; K294-A298 PolarHBondContact O-N 3.32Å
295	L	94.2	Very high	88.1	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60	-49.7	174.1	-173.9	150	0	0	0	110.7	A251 L279 L282 I283 S286 T291 F292 A297 A298 L299 L311	A251-L295 HydrophobicContact CB-CB 3.84Å; A251-L295 HydrophobicContact CB-CD1 4.38Å; A251-L295 HydrophobicContact CB-CG 4.45Å; L279-L295 HydrophobicContact CD2-CG 4.32Å; L282-L295 HydrophobicContact CB-CD1 3.83Å; L282-L295 WeakPolarHBondContact O-CD1 3.03Å; I283-L295 HydrophobicContact CG1-CD1 4.49Å; I283-L295 HydrophobicContact CG1-CD2 4.1Å; S286-L295 WeakPolarHBondContact OG-CD1 3.48Å; T291-L295 PolarHBondContact O-N 3.02Å; F292-L295 PolarHBondContact O-N 3.17Å; L295-A297 PolarHBondContact O-N 3.18Å; L295-A298 PolarHBondContact O-N 3.1Å; L295-L299 HydrophobicContact CD2-CB 4.44Å; L295-L299 HydrophobicContact CD2-CD2 4.14Å; L295-L299 VanDerWaalsContact O-CB 3.26Å; L295-L299 WeakPolarHBondContact O-CB 3.44Å; L295-L299 PolarHBondContact O-N 3.11Å; L295-L311 HydrophobicContact CD2-CD2 3.64Å
296	F	93.7	Very high	88.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-57.8	-49.8	178.3	-174.1	-82.4	0	0	0	111	F292 A298 L299 A300 L311 E312 T315 I330 A333 L334	F292-F296 WeakPolarHBondContact O-CB 3.35Å; F292-F296 PolarHBondContact O-N 3.38Å; F296-A298 VanDerWaalsContact C-N 3.25Å; F296-A298 PolarHBondContact O-N 2.67Å; F296-L299 PolarHBondContact O-N 3.26Å; F296-A300 HydrophobicContact CD1-CB 4.14Å; F296-A300 HydrophobicContact CE1-CB 3.89Å; F296-A300 HydrophobicContact CE2-CB 4.35Å; F296-A300 HydrophobicContact CG-CB 4.49Å; F296-A300 HydrophobicContact CZ-CB 3.99Å; F296-A300 WeakPolarHBondContact O-CB 3.45Å; F296-A300 PolarHBondContact O-N 3.4Å; F296-L311 HydrophobicContact CD2-CB 3.79Å; F296-L311 HydrophobicContact CE2-CB 3.79Å; F296-E312 HydrophobicContact CE2-CG 4.34Å; F296-E312 HydrophobicContact CZ-CG 4.39Å; F296-T315 WeakPolarHBondContact CD2-OG1 3.37Å; F296-T315 VanDerWaalsContact CE2-OG1 3.24Å; F296-T315 WeakPolarHBondContact CE2-OG1 3.4Å; F296-I330 HydrophobicContact CB-CD1 3.67Å; F296-I330 HydrophobicContact CD1-CD1 3.35Å; F296-I330 HydrophobicContact CD1-CG2 4.45Å; F296-I330 HydrophobicContact CD2-CD1 4.37Å; F296-I330 HydrophobicContact CE1-CD1 4.09Å; F296-I330 HydrophobicContact CE1-CG2 4.13Å; F296-I330 HydrophobicContact CG-CD1 3.53Å; F296-A333 HydrophobicContact CD1-CB 3.85Å; F296-A333 HydrophobicContact CE1-CB 3.81Å; F296-L334 HydrophobicContact CE1-CD2 4.28Å; F296-L334 HydrophobicContact CE1-CG 4.23Å; F296-L334 HydrophobicContact CZ-CD2 3.83Å; F296-L334 HydrophobicContact CZ-CG 4.26Å
297	A	91.3	Very high	88.5	Confident	24 Å²	24	37 Å²	37	20%	0.198	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-34.2	-178.6	0	0	0	0	0	113.2	S293 K294 L295 P301 A329 A333	S293-A297 WeakPolarHBondContact O-CB 3.35Å; S293-A297 PolarHBondContact O-N 3.23Å; K294-A297 PolarHBondContact O-N 2.76Å; L295-A297 PolarHBondContact O-N 3.18Å; A297-P301 WeakPolarHBondContact O-CD 3.33Å; A297-A329 HydrophobicContact CB-CB 4.49Å; A297-A333 HydrophobicContact CB-CB 4.29Å
298	A	91.9	Very high	89	Confident	10 Å²	10	34 Å²	34	8%	0.083	18%	0.18	C	C	.	.	H	α-helix	trans	-81.7	-38.9	178.5	0	0	0	0	0	113.4	L258 L279 K294 L295 F296 I302	L258-A298 HydrophobicContact CD1-CB 4.09Å; L279-A298 HydrophobicContact CD1-CB 3.63Å; L279-A298 HydrophobicContact CD2-CB 4.25Å; K294-A298 WeakPolarHBondContact O-CB 3.45Å; K294-A298 PolarHBondContact O-N 3.32Å; L295-A298 PolarHBondContact O-N 3.1Å; F296-A298 VanDerWaalsContact C-N 3.25Å; F296-A298 PolarHBondContact O-N 2.67Å; A298-I302 WeakPolarHBondContact O-CD1 3.5Å
299	L	92.6	Very high	89.3	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-90.4	-39.7	-170.1	-176	56	0	0	0	113.1	K276 L279 I280 I283 L295 F296 P301 I302 S303 I307 L311	K276-L299 HydrophobicContact CG-CD1 4.13Å; L279-L299 HydrophobicContact CB-CB 4.18Å; L279-L299 HydrophobicContact CB-CD1 4.04Å; L279-L299 HydrophobicContact CB-CD2 4.13Å; L279-L299 HydrophobicContact CB-CG 4.33Å; L279-L299 HydrophobicContact CD1-CB 4.25Å; I280-L299 HydrophobicContact CG1-CD1 3.98Å; I280-L299 HydrophobicContact CG1-CD2 4.03Å; I283-L299 HydrophobicContact CD1-CD2 3.88Å; I283-L299 HydrophobicContact CG1-CD2 4.03Å; L295-L299 HydrophobicContact CD2-CB 4.44Å; L295-L299 HydrophobicContact CD2-CD2 4.14Å; L295-L299 VanDerWaalsContact O-CB 3.26Å; L295-L299 WeakPolarHBondContact O-CB 3.44Å; L295-L299 PolarHBondContact O-N 3.11Å; F296-L299 PolarHBondContact O-N 3.26Å; L299-P301 VanDerWaalsContact C-CD 3.47Å; L299-I302 HydrophobicContact CD1-CG1 4.19Å; L299-I302 WeakPolarHBondContact O-CG1 3.42Å; L299-I302 PolarHBondContact O-N 3.07Å; L299-S303 VanDerWaalsContact O-CB 3.25Å; L299-S303 WeakPolarHBondContact O-CB 3.42Å; L299-S303 PolarHBondContact O-N 3.13Å; L299-S303 PolarHBondContact O-OG 3.49Å; L299-I307 HydrophobicContact CD2-CG2 4.14Å; L299-I307 HydrophobicContact CG-CG2 4.48Å; L299-L311 HydrophobicContact CB-CD1 4.12Å; L299-L311 HydrophobicContact CD2-CD1 3.93Å; L299-L311 HydrophobicContact CD2-CD2 4.47Å; L299-L311 HydrophobicContact CG-CD1 3.89Å
300	A	90.6	Very high	89.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-38.8	-174	0	0	0	0	0	114.4	F296 I302 S303 R308 L311 S337	F296-A300 HydrophobicContact CD1-CB 4.14Å; F296-A300 HydrophobicContact CE1-CB 3.89Å; F296-A300 HydrophobicContact CE2-CB 4.35Å; F296-A300 HydrophobicContact CG-CB 4.49Å; F296-A300 HydrophobicContact CZ-CB 3.99Å; F296-A300 WeakPolarHBondContact O-CB 3.45Å; F296-A300 PolarHBondContact O-N 3.4Å; A300-I302 VanDerWaalsContact C-N 3.31Å; A300-I302 PolarHBondContact O-N 3.33Å; A300-S303 PolarHBondContact O-OG 3.29Å; A300-R308 PolarHBondContact O-NE 3.15Å; A300-L311 HydrophobicContact CB-CD1 4.38Å; A300-S337 WeakPolarHBondContact O-CB 3.43Å
301	P	86.9	Confident	89.8	Confident	23 Å²	23	35.6 Å²	35.6	15%	0.149	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-25	176.8	-23.8	36.6	0	0	0	114.7	A297 L299 E336	A297-P301 WeakPolarHBondContact O-CD 3.33Å; L299-P301 VanDerWaalsContact C-CD 3.47Å; P301-E336 HydrophobicContact CB-CB 4.32Å; P301-E336 HydrophobicContact CB-CG 3.85Å; P301-E336 HydrophobicContact CG-CB 4.11Å; P301-E336 HydrophobicContact CG-CG 4.08Å; P301-E336 WeakPolarHBondContact CG-OE2 3.41Å
302	I	86	Confident	90.1	Very high	8 Å²	8	34.5 Å²	34.5	4%	0.041	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	-2.6	-172.3	66.1	-179.4	0	0	0	113.7	K276 A298 L299 A300	K276-I302 HydrophobicContact CB-CD1 3.83Å; K276-I302 HydrophobicContact CB-CG1 4.35Å; K276-I302 WeakPolarHBondContact CD-O 3.31Å; K276-I302 VanDerWaalsContact CE-O 3.26Å; K276-I302 WeakPolarHBondContact CE-O 3.43Å; K276-I302 HydrophobicContact CG-CD1 4.3Å; K276-I302 HydrophobicContact CG-CG1 4.28Å; K276-I302 PolarHBondContact NZ-O 3.43Å; A298-I302 WeakPolarHBondContact O-CD1 3.5Å; L299-I302 HydrophobicContact CD1-CG1 4.19Å; L299-I302 WeakPolarHBondContact O-CG1 3.42Å; L299-I302 PolarHBondContact O-N 3.07Å; A300-I302 VanDerWaalsContact C-N 3.31Å; A300-I302 PolarHBondContact O-N 3.33Å
303	S	86.3	Confident	90.1	Very high	7 Å²	7	38.3 Å²	38.3	5%	0.049	20%	0.195	C	C	.	.	S	Bend	trans	-86.7	156.3	-177.1	70.4	0	0	0	0	112.9	L299 A300 R308	L299-S303 VanDerWaalsContact O-CB 3.25Å; L299-S303 WeakPolarHBondContact O-CB 3.42Å; L299-S303 PolarHBondContact O-N 3.13Å; L299-S303 PolarHBondContact O-OG 3.49Å; A300-S303 PolarHBondContact O-OG 3.29Å; S303-R308 PolarHBondContact O-NH2 3.29Å
304	S	84.7	Confident	90	Very high	35 Å²	35	40.6 Å²	40.6	25%	0.245	21%	0.209	C	C	.	.			trans	-65.3	162.8	169.4	77.1	0	0	0	0	111	E306 I307 R308	S304-E306 VanDerWaalsContact C-N 3.25Å; S304-E306 WeakPolarHBondContact CB-OE2 3.26Å; S304-E306 PolarHBondContact O-N 2.67Å; S304-E306 PolarHBondContact OG-OE2 2.91Å; S304-I307 PolarHBondContact O-N 3.06Å; S304-R308 WeakPolarHBondContact O-CB 3.4Å; S304-R308 PolarHBondContact O-N 2.96Å
305	P	85.4	Confident	90	Very high	87 Å²	87	37.7 Å²	37.7	57%	0.565	20%	0.196	S	C	*	.	H	α-helix	trans	-55.2	-38.8	178.8	-25	35.1	0	0	0	113.4	R308 E309	P305-R308 WeakPolarHBondContact O-CB 3.21Å; P305-R308 PolarHBondContact O-N 3.36Å; P305-E309 PolarHBondContact O-N 3.48Å
306	E	87.2	Confident	89.9	Confident	128 Å²	128	41.8 Å²	41.8	60%	0.598	21%	0.214	S	C	*	.	H	α-helix	trans	-68.3	-44.2	-176.9	-53.1	75.1	-160	0	0	111.5	S304 R308 E309 R310	S304-E306 VanDerWaalsContact C-N 3.25Å; S304-E306 WeakPolarHBondContact CB-OE2 3.26Å; S304-E306 PolarHBondContact O-N 2.67Å; S304-E306 PolarHBondContact OG-OE2 2.91Å; E306-R308 VanDerWaalsContact C-N 3.3Å; E306-R308 PolarHBondContact O-N 2.93Å; E306-E309 PolarHBondContact O-N 3.32Å; E306-R310 PolarHBondContact O-N 3.27Å; E306-R310 VanDerWaalsContact O-N 3.17Å
307	I	89.1	Confident	89.7	Confident	37 Å²	37	48.3 Å²	48.3	19%	0.19	25%	0.249	C	C	.	.	H	α-helix	trans	-66.6	-38.1	176.6	-63.7	173	0	0	0	109.9	I280 I283 L299 S304 R310 L311	I280-I307 HydrophobicContact CD1-CD1 3.61Å; I280-I307 HydrophobicContact CG1-CD1 4.03Å; I283-I307 HydrophobicContact CD1-CG2 4.2Å; L299-I307 HydrophobicContact CD2-CG2 4.14Å; L299-I307 HydrophobicContact CG-CG2 4.48Å; S304-I307 PolarHBondContact O-N 3.06Å; I307-R310 PolarHBondContact O-N 2.99Å; I307-L311 HydrophobicContact CG2-CD1 4.27Å; I307-L311 HydrophobicContact CG2-CG 4.48Å; I307-L311 WeakPolarHBondContact O-CG 3.36Å; I307-L311 PolarHBondContact O-N 3.01Å
308	R	89.6	Confident	89.7	Confident	57 Å²	57	48.7 Å²	48.7	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-63.1	-45.6	178.2	-166.6	-178.8	-57.7	152.5	9.6	111.6	A300 S303 S304 P305 E306 R310 L311 E312 S337	A300-R308 PolarHBondContact O-NE 3.15Å; S303-R308 PolarHBondContact O-NH2 3.29Å; S304-R308 WeakPolarHBondContact O-CB 3.4Å; S304-R308 PolarHBondContact O-N 2.96Å; P305-R308 WeakPolarHBondContact O-CB 3.21Å; P305-R308 PolarHBondContact O-N 3.36Å; E306-R308 VanDerWaalsContact C-N 3.3Å; E306-R308 PolarHBondContact O-N 2.93Å; R308-R310 VanDerWaalsContact C-N 3.32Å; R308-R310 PolarHBondContact O-N 2.97Å; R308-L311 WeakPolarHBondContact O-CB 3.48Å; R308-L311 PolarHBondContact O-N 3.24Å; R308-E312 WeakPolarHBondContact CG-OE1 3.13Å; R308-E312 VanDerWaalsContact O-CG 3.32Å; R308-E312 WeakPolarHBondContact O-CG 3.21Å; R308-E312 PolarHBondContact O-N 3.5Å; R308-S337 PolarHBondContact NH1-O 2.99Å; R308-S337 VanDerWaalsContact NH1-O 3.1Å
309	E	90.5	Very high	89.6	Confident	122 Å²	122	48.2 Å²	48.2	57%	0.57	24%	0.244	S	C	*	.	H	α-helix	trans	-59.4	-43.2	176.3	-175	178	-172.9	0	0	111.5	P305 E306 L311 E312 N313	P305-E309 PolarHBondContact O-N 3.48Å; E306-E309 PolarHBondContact O-N 3.32Å; E309-L311 PolarHBondContact O-N 3.44Å; E309-E312 PolarHBondContact O-N 3.46Å; E309-N313 WeakPolarHBondContact O-CB 3.36Å; E309-N313 VanDerWaalsContact O-CG 3.27Å; E309-N313 PolarHBondContact O-N 2.87Å; E309-N313 PolarHBondContact O-ND2 3.48Å
310	R	91.3	Very high	89.5	Confident	104 Å²	104	52.6 Å²	52.6	39%	0.392	27%	0.268	S	S	.	.	H	α-helix	trans	-58.4	-47.3	174	-178.4	-179.6	171	-165.1	-0.8	111.7	D284 E306 I307 R308 N313 T314	D284-R310 IonicContact OD1-CZ 3.6Å; D284-R310 IonicContact OD1-NH2 3.68Å; D284-R310 PolarHBondContact OD1-NH2 3.27Å; D284-R310 IonicContact OD2-CZ 2.8Å; D284-R310 IonicContact OD2-NH2 3.25Å; D284-R310 PolarHBondContact OD2-NH2 3.05Å; E306-R310 PolarHBondContact O-N 3.27Å; E306-R310 VanDerWaalsContact O-N 3.17Å; I307-R310 PolarHBondContact O-N 2.99Å; R308-R310 VanDerWaalsContact C-N 3.32Å; R308-R310 PolarHBondContact O-N 2.97Å; R310-N313 PolarHBondContact O-N 3.2Å; R310-T314 PolarHBondContact O-N 2.82Å; R310-T314 VanDerWaalsContact O-N 3.11Å; R310-T314 PolarHBondContact O-OG1 2.77Å
311	L	92.4	Very high	89.5	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61.6	-44.5	177.8	-71.8	173.8	0	0	0	111.8	I283 F292 L295 F296 L299 A300 I307 R308 E309 N313 T314 T315	I283-L311 HydrophobicContact CD1-CD2 4.44Å; I283-L311 HydrophobicContact CG1-CD2 4.32Å; F292-L311 HydrophobicContact CE2-CD2 4.35Å; F292-L311 HydrophobicContact CZ-CD2 4.43Å; L295-L311 HydrophobicContact CD2-CD2 3.64Å; F296-L311 HydrophobicContact CD2-CB 3.79Å; F296-L311 HydrophobicContact CE2-CB 3.79Å; L299-L311 HydrophobicContact CB-CD1 4.12Å; L299-L311 HydrophobicContact CD2-CD1 3.93Å; L299-L311 HydrophobicContact CD2-CD2 4.47Å; L299-L311 HydrophobicContact CG-CD1 3.89Å; A300-L311 HydrophobicContact CB-CD1 4.38Å; I307-L311 HydrophobicContact CG2-CD1 4.27Å; I307-L311 HydrophobicContact CG2-CG 4.48Å; I307-L311 WeakPolarHBondContact O-CG 3.36Å; I307-L311 PolarHBondContact O-N 3.01Å; R308-L311 WeakPolarHBondContact O-CB 3.48Å; R308-L311 PolarHBondContact O-N 3.24Å; E309-L311 PolarHBondContact O-N 3.44Å; L311-N313 VanDerWaalsContact C-N 3.34Å; L311-N313 PolarHBondContact O-N 3.35Å; L311-T314 PolarHBondContact O-N 3.44Å; L311-T315 WeakPolarHBondContact O-CB 3.38Å; L311-T315 PolarHBondContact O-N 3.22Å; L311-T315 PolarHBondContact O-OG1 3.31Å
312	E	92.8	Very high	89.8	Confident	14 Å²	14	58 Å²	58	7%	0.065	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-41.6	179	-73.3	175.5	-168	0	0	112.3	F296 R308 E309 T315 F316 L334 S339 N341 L344	F296-E312 HydrophobicContact CE2-CG 4.34Å; F296-E312 HydrophobicContact CZ-CG 4.39Å; R308-E312 WeakPolarHBondContact CG-OE1 3.13Å; R308-E312 VanDerWaalsContact O-CG 3.32Å; R308-E312 WeakPolarHBondContact O-CG 3.21Å; R308-E312 PolarHBondContact O-N 3.5Å; E309-E312 PolarHBondContact O-N 3.46Å; E312-T315 PolarHBondContact O-N 3.05Å; E312-F316 WeakPolarHBondContact O-CB 3.42Å; E312-F316 PolarHBondContact O-N 2.9Å; E312-L334 HydrophobicContact CG-CD2 4.38Å; E312-S339 VanDerWaalsContact CD-OG 3.26Å; E312-S339 WeakPolarHBondContact OE1-CB 3.37Å; E312-S339 PolarHBondContact OE1-OG 3.38Å; E312-N341 VanDerWaalsContact OE2-CB 3.23Å; E312-N341 WeakPolarHBondContact OE2-CB 3.42Å; E312-N341 PolarHBondContact OE2-ND2 3.43Å; E312-L344 HydrophobicContact CB-CD2 3.82Å; E312-L344 HydrophobicContact CG-CD2 3.8Å
313	N	91.3	Very high	90.1	Very high	85 Å²	85	59.9 Å²	59.9	46%	0.455	31%	0.305	S	S	.	.	H	α-helix	trans	-63.6	-43.6	176.3	-72	-29.5	0	0	0	111.7	E309 R310 L311 F316 L317	E309-N313 WeakPolarHBondContact O-CB 3.36Å; E309-N313 VanDerWaalsContact O-CG 3.27Å; E309-N313 PolarHBondContact O-N 2.87Å; E309-N313 PolarHBondContact O-ND2 3.48Å; R310-N313 PolarHBondContact O-N 3.2Å; L311-N313 VanDerWaalsContact C-N 3.34Å; L311-N313 PolarHBondContact O-N 3.35Å; N313-F316 WeakPolarHBondContact O-CB 3.32Å; N313-F316 PolarHBondContact O-N 3.34Å; N313-L317 PolarHBondContact O-N 2.82Å
314	T	90.6	Very high	90.3	Very high	50 Å²	50	60.1 Å²	60.1	31%	0.307	31%	0.307	S	S	.	.	H	α-helix	trans	-64.7	-44.8	175.1	-56.7	0	0	0	0	111.4	F292 R310 L311 F316 L317 V318	F292-T314 HydrophobicContact CD2-CG2 4.32Å; F292-T314 HydrophobicContact CE1-CG2 4.14Å; F292-T314 HydrophobicContact CE2-CG2 3.57Å; F292-T314 HydrophobicContact CZ-CG2 3.47Å; F292-T314 VanDerWaalsContact CZ-CG2 3.47Å; R310-T314 PolarHBondContact O-N 2.82Å; R310-T314 VanDerWaalsContact O-N 3.11Å; R310-T314 PolarHBondContact O-OG1 2.77Å; L311-T314 PolarHBondContact O-N 3.44Å; T314-F316 VanDerWaalsContact C-N 3.27Å; T314-F316 PolarHBondContact O-N 3.21Å; T314-L317 WeakPolarHBondContact O-CB 3.35Å; T314-L317 PolarHBondContact O-N 2.92Å; T314-L317 VanDerWaalsContact O-N 3.1Å; T314-V318 PolarHBondContact O-N 2.68Å
315	T	92.4	Very high	90.6	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-57	-40.7	176	-57.4	0	0	0	0	111.7	F292 F296 L311 E312 L317 V318 A319 F322 I330 L344 I348	F292-T315 VanDerWaalsContact CE1-OG1 3.3Å; F292-T315 WeakPolarHBondContact CE1-OG1 3.18Å; F296-T315 WeakPolarHBondContact CD2-OG1 3.37Å; F296-T315 VanDerWaalsContact CE2-OG1 3.24Å; F296-T315 WeakPolarHBondContact CE2-OG1 3.4Å; L311-T315 WeakPolarHBondContact O-CB 3.38Å; L311-T315 PolarHBondContact O-N 3.22Å; L311-T315 PolarHBondContact O-OG1 3.31Å; E312-T315 PolarHBondContact O-N 3.05Å; T315-L317 VanDerWaalsContact C-N 3.26Å; T315-L317 PolarHBondContact O-N 3.25Å; T315-V318 PolarHBondContact O-N 3.36Å; T315-A319 WeakPolarHBondContact O-CA 3.41Å; T315-A319 VanDerWaalsContact O-CB 3.3Å; T315-A319 WeakPolarHBondContact O-CB 3.35Å; T315-A319 PolarHBondContact O-N 3.42Å; T315-F322 HydrophobicContact CG2-CE2 3.72Å; T315-F322 HydrophobicContact CG2-CZ 4.09Å; T315-I330 HydrophobicContact CG2-CD1 4.13Å; T315-I330 HydrophobicContact CG2-CG1 4.34Å; T315-I330 HydrophobicContact CG2-CG2 3.87Å; T315-L344 HydrophobicContact CG2-CD1 3.78Å; T315-L344 HydrophobicContact CG2-CD2 4.39Å; T315-I348 HydrophobicContact CG2-CD1 4.23Å
316	F	91.8	Very high	91	Very high	86 Å²	86	60.1 Å²	60.1	38%	0.377	30%	0.296	S	S	.	.	H	α-helix	trans	-59.1	-37.3	178.6	-174.4	-89.9	0	0	0	112.5	E312 N313 T314 L344 K347	E312-F316 WeakPolarHBondContact O-CB 3.42Å; E312-F316 PolarHBondContact O-N 2.9Å; N313-F316 WeakPolarHBondContact O-CB 3.32Å; N313-F316 PolarHBondContact O-N 3.34Å; T314-F316 VanDerWaalsContact C-N 3.27Å; T314-F316 PolarHBondContact O-N 3.21Å; F316-L344 HydrophobicContact CB-CD1 4.17Å; F316-L344 HydrophobicContact CD2-CD1 4.47Å; F316-K347 HydrophobicContact CD2-CB 4.24Å; F316-K347 HydrophobicContact CD2-CG 4.47Å; F316-K347 HydrophobicContact CE2-CB 4.1Å; F316-K347 HydrophobicContact CE2-CG 4.42Å
317	L	89.8	Confident	91.4	Very high	138 Å²	138	54 Å²	54	72%	0.723	27%	0.267	S	S	*	.	H	α-helix	trans	-71.7	-40.4	-179.8	-63	172.3	0	0	0	112.5	N313 T314 T315	N313-L317 PolarHBondContact O-N 2.82Å; T314-L317 WeakPolarHBondContact O-CB 3.35Å; T314-L317 PolarHBondContact O-N 2.92Å; T314-L317 VanDerWaalsContact O-N 3.1Å; T315-L317 VanDerWaalsContact C-N 3.26Å; T315-L317 PolarHBondContact O-N 3.25Å
318	V	91.1	Very high	91.6	Very high	31 Å²	31	52.3 Å²	52.3	19%	0.188	26%	0.259	C	S	.	.	H	α-helix	trans	-93.7	-3.1	-176	-59.3	0	0	0	0	113.9	F292 T314 T315 D320 E321 F322	F292-V318 HydrophobicContact CD1-CG2 4.05Å; F292-V318 HydrophobicContact CE1-CG2 4.22Å; T314-V318 PolarHBondContact O-N 2.68Å; T315-V318 PolarHBondContact O-N 3.36Å; V318-D320 VanDerWaalsContact C-N 3.25Å; V318-D320 PolarHBondContact O-N 3.15Å; V318-D320 VanDerWaalsContact O-N 3.09Å; V318-E321 PolarHBondContact O-N 2.62Å; V318-F322 HydrophobicContact CG2-CE1 3.91Å; V318-F322 HydrophobicContact CG2-CE2 4.41Å; V318-F322 HydrophobicContact CG2-CZ 3.58Å
319	A	90.4	Very high	91.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-54.4	-35	-170.7	0	0	0	0	0	114.9	T315 E321 F322 K347 I348 V351	T315-A319 WeakPolarHBondContact O-CA 3.41Å; T315-A319 VanDerWaalsContact O-CB 3.3Å; T315-A319 WeakPolarHBondContact O-CB 3.35Å; T315-A319 PolarHBondContact O-N 3.42Å; A319-E321 PolarHBondContact O-N 3.43Å; A319-F322 HydrophobicContact CB-CD2 4.39Å; A319-F322 HydrophobicContact CB-CE2 4.38Å; A319-F322 PolarHBondContact O-N 3.28Å; A319-K347 HydrophobicContact CB-CG 3.62Å; A319-I348 HydrophobicContact CB-CD1 3.76Å; A319-V351 WeakPolarHBondContact O-CG2 3.48Å
320	D	90.7	Very high	91.9	Very high	92 Å²	92	44.6 Å²	44.6	49%	0.492	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-68.3	-21.8	-177.9	-69.8	-41.4	0	0	0	113.1	V318 K347	V318-D320 VanDerWaalsContact C-N 3.25Å; V318-D320 PolarHBondContact O-N 3.15Å; V318-D320 VanDerWaalsContact O-N 3.09Å; D320-K347 VanDerWaalsContact CG-CE 3.47Å; D320-K347 WeakPolarHBondContact OD1-CE 3.36Å; D320-K347 IonicContact OD1-NZ 3.99Å; D320-K347 PolarHBondContact OD1-NZ 2.98Å; D320-K347 WeakPolarHBondContact OD2-CE 3.26Å; D320-K347 IonicContact OD2-NZ 3.63Å; D320-K347 PolarHBondContact OD2-NZ 3.03Å
321	E	90.6	Very high	92.1	Very high	136 Å²	136	39.7 Å²	39.7	64%	0.636	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-84.5	-11.9	-179.6	-59.7	-175.9	-171.9	0	0	112.6	P289 V318 A319 S323	P289-E321 HydrophobicContact CB-CB 4.38Å; P289-E321 HydrophobicContact CG-CB 3.87Å; P289-E321 WeakPolarHBondContact CG-OE2 3.33Å; V318-E321 PolarHBondContact O-N 2.62Å; A319-E321 PolarHBondContact O-N 3.43Å; E321-S323 PolarHBondContact O-N 2.94Å
322	F	91.9	Very high	92.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.222	C	C	.	.			trans	-68.8	130.2	-175.9	-68.2	-31.5	0	0	0	113.2	P289 F292 T315 V318 A319 Q326 I330 I348 K355	P289-F322 HydrophobicContact CB-CD1 3.91Å; P289-F322 HydrophobicContact CB-CE1 3.95Å; F292-F322 HydrophobicContact CD1-CZ 4.35Å; T315-F322 HydrophobicContact CG2-CE2 3.72Å; T315-F322 HydrophobicContact CG2-CZ 4.09Å; V318-F322 HydrophobicContact CG2-CE1 3.91Å; V318-F322 HydrophobicContact CG2-CE2 4.41Å; V318-F322 HydrophobicContact CG2-CZ 3.58Å; A319-F322 HydrophobicContact CB-CD2 4.39Å; A319-F322 HydrophobicContact CB-CE2 4.38Å; A319-F322 PolarHBondContact O-N 3.28Å; F322-Q326 HydrophobicContact CB-CB 3.92Å; F322-Q326 HydrophobicContact CD1-CB 4.02Å; F322-Q326 HydrophobicContact CG-CB 4.08Å; F322-I330 HydrophobicContact CD2-CG1 4.33Å; F322-I330 HydrophobicContact CE2-CD1 4.39Å; F322-I330 HydrophobicContact CE2-CG1 3.87Å; F322-I330 HydrophobicContact CZ-CD1 4.39Å; F322-I330 HydrophobicContact CZ-CG1 4.28Å; F322-I348 HydrophobicContact CD2-CD1 3.89Å; F322-I348 HydrophobicContact CE2-CD1 3.95Å; F322-K355 PolarHBondContact O-NZ 2.98Å
323	S	92.1	Very high	92	Very high	48 Å²	48	41.9 Å²	41.9	34%	0.336	22%	0.22	S	C	.	.			trans	-59.8	166.6	160.8	71.1	0	0	0	0	112.2	E321 Q325 Q326 A327	E321-S323 PolarHBondContact O-N 2.94Å; S323-Q325 VanDerWaalsContact C-N 3.33Å; S323-Q325 PolarHBondContact O-N 3.22Å; S323-Q326 VanDerWaalsContact CB-OE1 3.31Å; S323-Q326 PolarHBondContact O-N 3.04Å; S323-Q326 VanDerWaalsContact OG-CG 3.26Å; S323-Q326 WeakPolarHBondContact OG-CG 3.43Å; S323-Q326 PolarHBondContact OG-N 3.19Å; S323-Q326 PolarHBondContact OG-OE1 2.69Å; S323-A327 PolarHBondContact O-N 3.34Å
324	A	91.4	Very high	92.1	Very high	12 Å²	12	37.8 Å²	37.8	10%	0.099	20%	0.199	C	C	.	.	H	α-helix	trans	-56.5	-45.3	177.5	0	0	0	0	0	112.3	Q326 A327 L328 K355 V358 Y359	A324-Q326 VanDerWaalsContact C-N 3.34Å; A324-Q326 PolarHBondContact O-N 3.02Å; A324-A327 PolarHBondContact O-N 3.06Å; A324-L328 PolarHBondContact O-N 3.39Å; A324-K355 HydrophobicContact CB-CB 4.26Å; A324-K355 HydrophobicContact CB-CD 4.33Å; A324-V358 HydrophobicContact CB-CG1 4.47Å; A324-Y359 VanDerWaalsContact CA-OH 3.29Å; A324-Y359 WeakPolarHBondContact CA-OH 3.49Å; A324-Y359 HydrophobicContact CB-CD1 4.28Å; A324-Y359 HydrophobicContact CB-CE1 3.59Å; A324-Y359 HydrophobicContact CB-CE2 4.32Å; A324-Y359 WeakPolarHBondContact O-CE1 3.28Å; A324-Y359 PolarHBondContact O-OH 3.26Å
325	Q	91.6	Very high	92.1	Very high	102 Å²	102	38.4 Å²	38.4	48%	0.477	20%	0.198	S	C	.	.	H	α-helix	trans	-64.6	-37.8	179.4	-66.5	-65.1	-23.5	0	0	112.8	S323 A329 E363	S323-Q325 VanDerWaalsContact C-N 3.33Å; S323-Q325 PolarHBondContact O-N 3.22Å; Q325-A329 PolarHBondContact O-N 3Å; Q325-A329 VanDerWaalsContact O-N 3.08Å; Q325-E363 PolarHBondContact NE2-OE1 3.42Å
326	Q	93.1	Very high	91.8	Very high	20 Å²	20	42 Å²	42	9%	0.093	22%	0.215	C	C	.	.	H	α-helix	trans	-68.6	-45.3	178.2	-68.4	161.7	-36.3	0	0	110.6	S293 F322 S323 A324 L328 A329 I330	S293-Q326 WeakPolarHBondContact OG-CG 3.29Å; F322-Q326 HydrophobicContact CB-CB 3.92Å; F322-Q326 HydrophobicContact CD1-CB 4.02Å; F322-Q326 HydrophobicContact CG-CB 4.08Å; S323-Q326 VanDerWaalsContact CB-OE1 3.31Å; S323-Q326 PolarHBondContact O-N 3.04Å; S323-Q326 VanDerWaalsContact OG-CG 3.26Å; S323-Q326 WeakPolarHBondContact OG-CG 3.43Å; S323-Q326 PolarHBondContact OG-N 3.19Å; S323-Q326 PolarHBondContact OG-OE1 2.69Å; A324-Q326 VanDerWaalsContact C-N 3.34Å; A324-Q326 PolarHBondContact O-N 3.02Å; Q326-L328 VanDerWaalsContact C-N 3.3Å; Q326-L328 PolarHBondContact O-N 2.93Å; Q326-A329 PolarHBondContact O-N 3.32Å; Q326-A329 VanDerWaalsContact O-N 3.15Å; Q326-I330 WeakPolarHBondContact O-CG1 3.23Å; Q326-I330 PolarHBondContact O-N 2.7Å
327	A	94.2	Very high	91.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.1	-39.2	177.1	0	0	0	0	0	112.4	S323 A324 I330 V331 I348 V351 I352	S323-A327 PolarHBondContact O-N 3.34Å; A324-A327 PolarHBondContact O-N 3.06Å; A327-I330 PolarHBondContact O-N 3.12Å; A327-V331 PolarHBondContact O-N 3.07Å; A327-V331 VanDerWaalsContact O-N 3.11Å; A327-I348 HydrophobicContact CB-CG2 4.34Å; A327-V351 HydrophobicContact CB-CG1 4.03Å; A327-I352 HydrophobicContact CB-CG1 3.97Å
328	L	94.4	Very high	91.2	Very high	2 Å²	2	37 Å²	37	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-60.3	-50.4	172.1	169.7	58.8	0	0	0	111.8	A324 Q326 I330 V331 E332 Y359 E363 R366 I367	A324-L328 PolarHBondContact O-N 3.39Å; Q326-L328 VanDerWaalsContact C-N 3.3Å; Q326-L328 PolarHBondContact O-N 2.93Å; L328-I330 VanDerWaalsContact C-N 3.26Å; L328-I330 PolarHBondContact O-N 3.35Å; L328-V331 PolarHBondContact O-N 3.5Å; L328-V331 VanDerWaalsContact O-N 3.14Å; L328-E332 HydrophobicContact CD1-CG 3.85Å; L328-E332 WeakPolarHBondContact O-CG 3.43Å; L328-E332 PolarHBondContact O-N 2.81Å; L328-Y359 HydrophobicContact CB-CE1 4.36Å; L328-E363 HydrophobicContact CD2-CB 4.02Å; L328-E363 HydrophobicContact CD2-CG 3.92Å; L328-R366 HydrophobicContact CD1-CB 4.15Å; L328-I367 HydrophobicContact CD1-CG1 3.66Å
329	A	92.3	Very high	90.9	Very high	17 Å²	17	36 Å²	36	14%	0.14	18%	0.184	C	C	.	.	H	α-helix	trans	-59	-37.5	179.9	0	0	0	0	0	112.5	A297 Q325 Q326 A333	A297-A329 HydrophobicContact CB-CB 4.49Å; Q325-A329 PolarHBondContact O-N 3Å; Q325-A329 VanDerWaalsContact O-N 3.08Å; Q326-A329 PolarHBondContact O-N 3.32Å; Q326-A329 VanDerWaalsContact O-N 3.15Å; A329-A333 WeakPolarHBondContact O-CB 3.29Å; A329-A333 PolarHBondContact O-N 3.34Å
330	I	94.8	Very high	90.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.6	-45.8	175.3	-63.8	-60.7	0	0	0	111.4	F296 T315 F322 Q326 A327 L328 A333 L334 I348	F296-I330 HydrophobicContact CB-CD1 3.67Å; F296-I330 HydrophobicContact CD1-CD1 3.35Å; F296-I330 HydrophobicContact CD1-CG2 4.45Å; F296-I330 HydrophobicContact CD2-CD1 4.37Å; F296-I330 HydrophobicContact CE1-CD1 4.09Å; F296-I330 HydrophobicContact CE1-CG2 4.13Å; F296-I330 HydrophobicContact CG-CD1 3.53Å; T315-I330 HydrophobicContact CG2-CD1 4.13Å; T315-I330 HydrophobicContact CG2-CG1 4.34Å; T315-I330 HydrophobicContact CG2-CG2 3.87Å; F322-I330 HydrophobicContact CD2-CG1 4.33Å; F322-I330 HydrophobicContact CE2-CD1 4.39Å; F322-I330 HydrophobicContact CE2-CG1 3.87Å; F322-I330 HydrophobicContact CZ-CD1 4.39Å; F322-I330 HydrophobicContact CZ-CG1 4.28Å; Q326-I330 WeakPolarHBondContact O-CG1 3.23Å; Q326-I330 PolarHBondContact O-N 2.7Å; A327-I330 PolarHBondContact O-N 3.12Å; L328-I330 VanDerWaalsContact C-N 3.26Å; L328-I330 PolarHBondContact O-N 3.35Å; I330-A333 PolarHBondContact O-N 3.44Å; I330-L334 HydrophobicContact CG2-CD1 3.99Å; I330-L334 HydrophobicContact CG2-CG 4.37Å; I330-L334 VanDerWaalsContact O-CG 3.31Å; I330-L334 WeakPolarHBondContact O-CG 3.3Å; I330-L334 PolarHBondContact O-N 2.68Å; I330-I348 HydrophobicContact CG2-CD1 3.96Å; I330-I348 HydrophobicContact CG2-CG1 3.98Å; I330-I348 HydrophobicContact CG2-CG2 4.46Å
331	V	94.6	Very high	90.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.1	-40.4	179.3	168.7	0	0	0	0	112.1	A327 L328 A333 L334 E335 I348 I352 A370 L371	A327-V331 PolarHBondContact O-N 3.07Å; A327-V331 VanDerWaalsContact O-N 3.11Å; L328-V331 PolarHBondContact O-N 3.5Å; L328-V331 VanDerWaalsContact O-N 3.14Å; V331-A333 VanDerWaalsContact C-N 3.33Å; V331-L334 PolarHBondContact O-N 2.75Å; V331-E335 PolarHBondContact O-N 3.29Å; V331-I348 HydrophobicContact CG2-CB 4.36Å; V331-I348 HydrophobicContact CG2-CG2 3.38Å; V331-I352 HydrophobicContact CB-CD1 4.36Å; V331-I352 HydrophobicContact CG2-CD1 3.5Å; V331-A370 HydrophobicContact CG1-CB 3.58Å; V331-L371 HydrophobicContact CG1-CD2 4.22Å; V331-L371 HydrophobicContact CG1-CG 4.47Å
332	E	92.5	Very high	90.3	Very high	56 Å²	56	40.8 Å²	40.8	26%	0.262	20%	0.2	S	C	.	.	H	α-helix	trans	-60.7	-43.8	174.4	-71	176.9	149.8	0	0	110.9	L328 L334 E335 E336 R366	L328-E332 HydrophobicContact CD1-CG 3.85Å; L328-E332 WeakPolarHBondContact O-CG 3.43Å; L328-E332 PolarHBondContact O-N 2.81Å; E332-L334 PolarHBondContact O-N 3.15Å; E332-E335 PolarHBondContact O-N 2.98Å; E332-E336 PolarHBondContact O-N 2.69Å; E332-R366 WeakPolarHBondContact OE1-CB 2.96Å; E332-R366 WeakPolarHBondContact OE1-CD 3.39Å; E332-R366 IonicContact OE1-CZ 2.75Å; E332-R366 IonicContact OE1-NE 3.64Å; E332-R366 IonicContact OE1-NH1 3.54Å; E332-R366 PolarHBondContact OE1-NH1 3.19Å; E332-R366 IonicContact OE2-NH1 2.77Å; E332-R366 PolarHBondContact OE2-NH1 3.11Å
333	A	91.3	Very high	90.3	Very high	4 Å²	4	43.9 Å²	43.9	3%	0.033	22%	0.222	C	C	.	.	H	α-helix	trans	-68.5	-33.3	177.9	0	0	0	0	0	113.7	F296 A297 A329 I330 V331 E335 S337	F296-A333 HydrophobicContact CD1-CB 3.85Å; F296-A333 HydrophobicContact CE1-CB 3.81Å; A297-A333 HydrophobicContact CB-CB 4.29Å; A329-A333 WeakPolarHBondContact O-CB 3.29Å; A329-A333 PolarHBondContact O-N 3.34Å; I330-A333 PolarHBondContact O-N 3.44Å; V331-A333 VanDerWaalsContact C-N 3.33Å; A333-E335 VanDerWaalsContact C-N 3.35Å; A333-S337 VanDerWaalsContact O-CB 3.29Å; A333-S337 WeakPolarHBondContact O-CB 3.29Å; A333-S337 PolarHBondContact O-N 2.81Å; A333-S337 PolarHBondContact O-OG 3.4Å
334	L	92	Very high	90.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-66.1	-38.6	172.5	-72.8	170.9	0	0	0	111.5	F296 E312 I330 V331 E332 S337 Q338 S339 L344 L345 L374	F296-L334 HydrophobicContact CE1-CD2 4.28Å; F296-L334 HydrophobicContact CE1-CG 4.23Å; F296-L334 HydrophobicContact CZ-CD2 3.83Å; F296-L334 HydrophobicContact CZ-CG 4.26Å; E312-L334 HydrophobicContact CG-CD2 4.38Å; I330-L334 HydrophobicContact CG2-CD1 3.99Å; I330-L334 HydrophobicContact CG2-CG 4.37Å; I330-L334 VanDerWaalsContact O-CG 3.31Å; I330-L334 WeakPolarHBondContact O-CG 3.3Å; I330-L334 PolarHBondContact O-N 2.68Å; V331-L334 PolarHBondContact O-N 2.75Å; E332-L334 PolarHBondContact O-N 3.15Å; L334-S337 WeakPolarHBondContact CA-OG 3.49Å; L334-S337 PolarHBondContact O-OG 2.99Å; L334-Q338 PolarHBondContact O-N 3.46Å; L334-Q338 VanDerWaalsContact O-N 3.1Å; L334-S339 PolarHBondContact O-N 2.81Å; L334-L344 HydrophobicContact CD1-CD2 4.08Å; L334-L344 HydrophobicContact CD1-CG 4.23Å; L334-L344 HydrophobicContact CD2-CD2 3.91Å; L334-L345 HydrophobicContact CB-CD2 4.44Å; L334-L345 HydrophobicContact CD1-CD2 3.76Å; L334-L374 HydrophobicContact CB-CD1 4.32Å
335	E	91.4	Very high	90.4	Very high	63 Å²	63	41.1 Å²	41.1	29%	0.294	20%	0.202	S	C	.	.	H	α-helix	trans	-65.3	-48.6	174.2	-175.6	-92.5	154.3	0	0	111.8	V331 E332 A333 S337 Q338 A370 L373 L374	V331-E335 PolarHBondContact O-N 3.29Å; E332-E335 PolarHBondContact O-N 2.98Å; A333-E335 VanDerWaalsContact C-N 3.35Å; E335-S337 VanDerWaalsContact C-N 3.32Å; E335-S337 PolarHBondContact O-N 2.83Å; E335-Q338 WeakPolarHBondContact O-CA 3.3Å; E335-Q338 PolarHBondContact O-N 3.23Å; E335-A370 HydrophobicContact CB-CB 4.05Å; E335-A370 HydrophobicContact CG-CB 4.35Å; E335-L373 HydrophobicContact CG-CB 3.86Å; E335-L373 HydrophobicContact CG-CD1 4.26Å; E335-L373 VanDerWaalsContact OE1-CD1 3.29Å; E335-L373 WeakPolarHBondContact OE1-CD1 3.44Å; E335-L374 HydrophobicContact CB-CD1 4.09Å; E335-L374 HydrophobicContact CB-CD2 4.4Å; E335-L374 HydrophobicContact CB-CG 4Å; E335-L374 HydrophobicContact CG-CG 4.33Å
336	E	86.8	Confident	90.4	Very high	74 Å²	74	40.3 Å²	40.3	35%	0.346	20%	0.201	S	C	.	.	H	α-helix	trans	-63.1	-37.7	179.5	-166.9	178.9	-179.5	0	0	112.4	Q262 P301 E332 Q338	Q262-E336 PolarHBondContact NE2-OE1 2.94Å; P301-E336 HydrophobicContact CB-CB 4.32Å; P301-E336 HydrophobicContact CB-CG 3.85Å; P301-E336 HydrophobicContact CG-CB 4.11Å; P301-E336 HydrophobicContact CG-CG 4.08Å; P301-E336 WeakPolarHBondContact CG-OE2 3.41Å; E332-E336 PolarHBondContact O-N 2.69Å; E336-Q338 PolarHBondContact O-N 3Å
337	S	84.6	Confident	90.5	Very high	8 Å²	8	42 Å²	42	6%	0.056	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-2.5	174.4	63.1	0	0	0	0	114.1	A300 R308 A333 L334 E335 S339	A300-S337 WeakPolarHBondContact O-CB 3.43Å; R308-S337 PolarHBondContact NH1-O 2.99Å; R308-S337 VanDerWaalsContact NH1-O 3.1Å; A333-S337 VanDerWaalsContact O-CB 3.29Å; A333-S337 WeakPolarHBondContact O-CB 3.29Å; A333-S337 PolarHBondContact O-N 2.81Å; A333-S337 PolarHBondContact O-OG 3.4Å; L334-S337 WeakPolarHBondContact CA-OG 3.49Å; L334-S337 PolarHBondContact O-OG 2.99Å; E335-S337 VanDerWaalsContact C-N 3.32Å; E335-S337 PolarHBondContact O-N 2.83Å; S337-S339 PolarHBondContact O-N 3.44Å; S337-S339 VanDerWaalsContact O-N 3.16Å
338	Q	83.6	Confident	90.4	Very high	111 Å²	111	42 Å²	42	52%	0.519	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	32.6	-174.1	-58.7	-175.5	4.3	0	0	113.5	L334 E335 E336 R340	L334-Q338 PolarHBondContact O-N 3.46Å; L334-Q338 VanDerWaalsContact O-N 3.1Å; E335-Q338 WeakPolarHBondContact O-CA 3.3Å; E335-Q338 PolarHBondContact O-N 3.23Å; E336-Q338 PolarHBondContact O-N 3Å; Q338-R340 PolarHBondContact O-N 3.16Å
339	S	84.4	Confident	90.4	Very high	10 Å²	10	41.9 Å²	41.9	7%	0.07	21%	0.207	C	C	.	.			trans	-74.2	127.9	180	179.1	0	0	0	0	111.2	E312 L334 S337 N341 L374	E312-S339 VanDerWaalsContact CD-OG 3.26Å; E312-S339 WeakPolarHBondContact OE1-CB 3.37Å; E312-S339 PolarHBondContact OE1-OG 3.38Å; L334-S339 PolarHBondContact O-N 2.81Å; S337-S339 PolarHBondContact O-N 3.44Å; S337-S339 VanDerWaalsContact O-N 3.16Å; S339-N341 PolarHBondContact OG-N 3.23Å; S339-L374 VanDerWaalsContact O-CD2 3.31Å; S339-L374 WeakPolarHBondContact O-CD2 3.33Å
340	R	82.6	Confident	90.4	Very high	176 Å²	176	43.2 Å²	43.2	66%	0.664	22%	0.215	S	C	*	.			trans	-106.4	27	179.4	-61.4	-174.7	-179.2	-174.4	-1.7	112.5	Q338 L342	Q338-R340 PolarHBondContact O-N 3.16Å; R340-L342 PolarHBondContact O-N 2.93Å
341	N	88.3	Confident	90.3	Very high	40 Å²	40	43.5 Å²	43.5	21%	0.214	22%	0.217	C	C	.	.			trans	-66.5	95	177.5	-170.9	-24.1	0	0	0	110.8	E312 S339 S343 L344 L345	E312-N341 VanDerWaalsContact OE2-CB 3.23Å; E312-N341 WeakPolarHBondContact OE2-CB 3.42Å; E312-N341 PolarHBondContact OE2-ND2 3.43Å; S339-N341 PolarHBondContact OG-N 3.23Å; N341-S343 VanDerWaalsContact C-N 3.31Å; N341-S343 PolarHBondContact O-N 3.46Å; N341-S343 PolarHBondContact OD1-N 3.42Å; N341-S343 PolarHBondContact OD1-OG 3.33Å; N341-L344 HydrophobicContact CB-CB 4.3Å; N341-L344 PolarHBondContact O-N 3.15Å; N341-L344 PolarHBondContact OD1-N 3.23Å; N341-L345 WeakPolarHBondContact O-CB 3.47Å; N341-L345 VanDerWaalsContact O-CG 3.31Å; N341-L345 WeakPolarHBondContact O-CG 3.42Å; N341-L345 PolarHBondContact O-N 3.11Å
342	L	88.8	Confident	90.3	Very high	114 Å²	114	43.5 Å²	43.5	60%	0.597	22%	0.217	S	C	*	.	H	α-helix	trans	-63.5	-33	-172.6	-67	176.5	0	0	0	113.1	R340 N346	R340-L342 PolarHBondContact O-N 2.93Å; L342-N346 WeakPolarHBondContact O-CB 3.46Å; L342-N346 PolarHBondContact O-N 2.96Å; L342-N346 PolarHBondContact O-ND2 3.33Å; L342-N346 VanDerWaalsContact O-ND2 3.13Å
343	S	90.9	Very high	90.3	Very high	65 Å²	65	44.6 Å²	44.6	46%	0.455	22%	0.222	S	C	.	.	H	α-helix	trans	-68.1	-45.6	-179.7	61.8	0	0	0	0	110.8	N341 N346 K347	N341-S343 VanDerWaalsContact C-N 3.31Å; N341-S343 PolarHBondContact O-N 3.46Å; N341-S343 PolarHBondContact OD1-N 3.42Å; N341-S343 PolarHBondContact OD1-OG 3.33Å; S343-N346 PolarHBondContact O-N 3.46Å; S343-K347 WeakPolarHBondContact O-CB 3.19Å; S343-K347 PolarHBondContact O-N 3.48Å
344	L	92.8	Very high	90.3	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.9	-44.2	174.9	-179.4	60.7	0	0	0	111.6	E312 T315 F316 L334 N341 N346 K347 I348	E312-L344 HydrophobicContact CB-CD2 3.82Å; E312-L344 HydrophobicContact CG-CD2 3.8Å; T315-L344 HydrophobicContact CG2-CD1 3.78Å; T315-L344 HydrophobicContact CG2-CD2 4.39Å; F316-L344 HydrophobicContact CB-CD1 4.17Å; F316-L344 HydrophobicContact CD2-CD1 4.47Å; L334-L344 HydrophobicContact CD1-CD2 4.08Å; L334-L344 HydrophobicContact CD1-CG 4.23Å; L334-L344 HydrophobicContact CD2-CD2 3.91Å; N341-L344 HydrophobicContact CB-CB 4.3Å; N341-L344 PolarHBondContact O-N 3.15Å; N341-L344 PolarHBondContact OD1-N 3.23Å; L344-N346 VanDerWaalsContact C-N 3.34Å; L344-N346 PolarHBondContact O-N 3.05Å; L344-K347 WeakPolarHBondContact O-CB 3.5Å; L344-K347 PolarHBondContact O-N 3.42Å; L344-K347 VanDerWaalsContact O-N 3.16Å; L344-I348 HydrophobicContact CD1-CD1 4.27Å; L344-I348 HydrophobicContact CD1-CG1 3.81Å; L344-I348 HydrophobicContact CG-CG1 4.24Å; L344-I348 WeakPolarHBondContact O-CG1 2.97Å; L344-I348 PolarHBondContact O-N 3.49Å
345	L	92.8	Very high	90.3	Very high	2 Å²	2	55 Å²	55	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-59.4	-43.8	177	-73.2	172.6	0	0	0	112	L334 N341 K347 T349 L374 Y376	L334-L345 HydrophobicContact CB-CD2 4.44Å; L334-L345 HydrophobicContact CD1-CD2 3.76Å; N341-L345 WeakPolarHBondContact O-CB 3.47Å; N341-L345 VanDerWaalsContact O-CG 3.31Å; N341-L345 WeakPolarHBondContact O-CG 3.42Å; N341-L345 PolarHBondContact O-N 3.11Å; L345-K347 VanDerWaalsContact C-N 3.35Å; L345-K347 PolarHBondContact O-N 3.39Å; L345-T349 WeakPolarHBondContact O-CB 3.44Å; L345-T349 PolarHBondContact O-N 3.41Å; L345-T349 PolarHBondContact O-OG1 2.88Å; L345-L374 HydrophobicContact CD2-CD1 3.74Å; L345-Y376 HydrophobicContact CB-CD2 4.3Å; L345-Y376 HydrophobicContact CB-CE2 4.31Å
346	N	92.7	Very high	90.3	Very high	84 Å²	84	53.1 Å²	53.1	45%	0.449	26%	0.259	S	S	.	.	H	α-helix	trans	-61.6	-43.2	175.3	-76.1	-29.1	0	0	0	111.9	L342 S343 L344 S350 Y376	L342-N346 WeakPolarHBondContact O-CB 3.46Å; L342-N346 PolarHBondContact O-N 2.96Å; L342-N346 PolarHBondContact O-ND2 3.33Å; L342-N346 VanDerWaalsContact O-ND2 3.13Å; S343-N346 PolarHBondContact O-N 3.46Å; L344-N346 VanDerWaalsContact C-N 3.34Å; L344-N346 PolarHBondContact O-N 3.05Å; N346-S350 WeakPolarHBondContact O-CB 3.31Å; N346-S350 PolarHBondContact O-N 3.35Å; N346-Y376 VanDerWaalsContact OD1-CE2 3.24Å; N346-Y376 WeakPolarHBondContact OD1-CE2 3.26Å; N346-Y376 PolarHBondContact OD1-OH 2.98Å
347	K	93.9	Very high	90.5	Very high	55 Å²	55	55.4 Å²	55.4	24%	0.239	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-51.9	179.5	-173.4	67.9	170.7	179.3	0	111.8	F316 A319 D320 S343 L344 L345 T349 S350 V351	F316-K347 HydrophobicContact CD2-CB 4.24Å; F316-K347 HydrophobicContact CD2-CG 4.47Å; F316-K347 HydrophobicContact CE2-CB 4.1Å; F316-K347 HydrophobicContact CE2-CG 4.42Å; A319-K347 HydrophobicContact CB-CG 3.62Å; D320-K347 VanDerWaalsContact CG-CE 3.47Å; D320-K347 WeakPolarHBondContact OD1-CE 3.36Å; D320-K347 IonicContact OD1-NZ 3.99Å; D320-K347 PolarHBondContact OD1-NZ 2.98Å; D320-K347 WeakPolarHBondContact OD2-CE 3.26Å; D320-K347 IonicContact OD2-NZ 3.63Å; D320-K347 PolarHBondContact OD2-NZ 3.03Å; S343-K347 WeakPolarHBondContact O-CB 3.19Å; S343-K347 PolarHBondContact O-N 3.48Å; L344-K347 WeakPolarHBondContact O-CB 3.5Å; L344-K347 PolarHBondContact O-N 3.42Å; L344-K347 VanDerWaalsContact O-N 3.16Å; L345-K347 VanDerWaalsContact C-N 3.35Å; L345-K347 PolarHBondContact O-N 3.39Å; K347-T349 VanDerWaalsContact C-N 3.35Å; K347-T349 PolarHBondContact O-N 3.24Å; K347-S350 WeakPolarHBondContact O-CB 3.12Å; K347-S350 PolarHBondContact O-N 3.24Å; K347-V351 PolarHBondContact O-N 3.15Å
348	I	94	Very high	90.9	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-66.7	-38.2	-179.8	-60.8	-66.8	0	0	0	111.1	T315 A319 F322 A327 I330 V331 L344 S350 V351 I352	T315-I348 HydrophobicContact CG2-CD1 4.23Å; A319-I348 HydrophobicContact CB-CD1 3.76Å; F322-I348 HydrophobicContact CD2-CD1 3.89Å; F322-I348 HydrophobicContact CE2-CD1 3.95Å; A327-I348 HydrophobicContact CB-CG2 4.34Å; I330-I348 HydrophobicContact CG2-CD1 3.96Å; I330-I348 HydrophobicContact CG2-CG1 3.98Å; I330-I348 HydrophobicContact CG2-CG2 4.46Å; V331-I348 HydrophobicContact CG2-CB 4.36Å; V331-I348 HydrophobicContact CG2-CG2 3.38Å; L344-I348 HydrophobicContact CD1-CD1 4.27Å; L344-I348 HydrophobicContact CD1-CG1 3.81Å; L344-I348 HydrophobicContact CG-CG1 4.24Å; L344-I348 WeakPolarHBondContact O-CG1 2.97Å; L344-I348 PolarHBondContact O-N 3.49Å; I348-S350 VanDerWaalsContact C-N 3.3Å; I348-S350 PolarHBondContact O-N 3.14Å; I348-V351 WeakPolarHBondContact O-CB 3.41Å; I348-V351 PolarHBondContact O-N 3.04Å; I348-V351 VanDerWaalsContact O-N 3.12Å; I348-I352 HydrophobicContact CG2-CD1 4.1Å; I348-I352 WeakPolarHBondContact O-CG1 3.2Å; I348-I352 PolarHBondContact O-N 2.73Å
349	T	92.9	Very high	91.4	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.006	29%	0.285	C	S	.	.	H	α-helix	trans	-63.7	-36.5	175.8	-58.9	0	0	0	0	111.7	L345 K347 V351 I352 Q353 Y376 L381	L345-T349 WeakPolarHBondContact O-CB 3.44Å; L345-T349 PolarHBondContact O-N 3.41Å; L345-T349 PolarHBondContact O-OG1 2.88Å; K347-T349 VanDerWaalsContact C-N 3.35Å; K347-T349 PolarHBondContact O-N 3.24Å; T349-V351 VanDerWaalsContact C-N 3.34Å; T349-V351 PolarHBondContact O-N 3.39Å; T349-I352 PolarHBondContact O-N 3.29Å; T349-Q353 HydrophobicContact CG2-CG 4.46Å; T349-Q353 WeakPolarHBondContact O-CB 3.49Å; T349-Q353 WeakPolarHBondContact O-CG 3.33Å; T349-Q353 PolarHBondContact O-N 3.14Å; T349-Y376 HydrophobicContact CG2-CE1 3.84Å; T349-L381 HydrophobicContact CG2-CD2 3.29Å
350	S	93.2	Very high	91.8	Very high	44 Å²	44	63.7 Å²	63.7	31%	0.308	32%	0.315	S	S	.	.	H	α-helix	trans	-60.8	-41.9	172.1	-173.8	0	0	0	0	112.1	N346 K347 I348 Q353 K354	N346-S350 WeakPolarHBondContact O-CB 3.31Å; N346-S350 PolarHBondContact O-N 3.35Å; K347-S350 WeakPolarHBondContact O-CB 3.12Å; K347-S350 PolarHBondContact O-N 3.24Å; I348-S350 VanDerWaalsContact C-N 3.3Å; I348-S350 PolarHBondContact O-N 3.14Å; S350-Q353 PolarHBondContact O-N 3.33Å; S350-K354 WeakPolarHBondContact O-CG 3.39Å; S350-K354 PolarHBondContact O-N 3.47Å
351	V	93.3	Very high	92.3	Very high	6 Å²	6	55.9 Å²	55.9	4%	0.036	29%	0.288	C	S	.	.	H	α-helix	trans	-63.2	-43.4	175.4	177.7	0	0	0	0	110.9	A319 A327 K347 I348 T349 K354 K355	A319-V351 WeakPolarHBondContact O-CG2 3.48Å; A327-V351 HydrophobicContact CB-CG1 4.03Å; K347-V351 PolarHBondContact O-N 3.15Å; I348-V351 WeakPolarHBondContact O-CB 3.41Å; I348-V351 PolarHBondContact O-N 3.04Å; I348-V351 VanDerWaalsContact O-N 3.12Å; T349-V351 VanDerWaalsContact C-N 3.34Å; T349-V351 PolarHBondContact O-N 3.39Å; V351-K354 PolarHBondContact O-N 3.45Å; V351-K355 HydrophobicContact CG1-CD 4.43Å; V351-K355 PolarHBondContact O-N 2.75Å
352	I	93.5	Very high	92.5	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.3	-46.5	176.4	-72.6	170.9	0	0	0	111.3	A327 V331 I348 T349 K354 K355 L356 Y359 I367	A327-I352 HydrophobicContact CB-CG1 3.97Å; V331-I352 HydrophobicContact CB-CD1 4.36Å; V331-I352 HydrophobicContact CG2-CD1 3.5Å; I348-I352 HydrophobicContact CG2-CD1 4.1Å; I348-I352 WeakPolarHBondContact O-CG1 3.2Å; I348-I352 PolarHBondContact O-N 2.73Å; T349-I352 PolarHBondContact O-N 3.29Å; I352-K354 PolarHBondContact O-N 3.32Å; I352-K355 CarbonylContact O-C 3.53Å; I352-K355 PolarHBondContact O-N 3.31Å; I352-K355 VanDerWaalsContact O-N 3.15Å; I352-L356 WeakPolarHBondContact O-CA 3.39Å; I352-L356 PolarHBondContact O-N 3.4Å; I352-Y359 HydrophobicContact CG2-CE2 4.16Å; I352-I367 HydrophobicContact CD1-CG2 4.26Å; I352-I367 HydrophobicContact CG2-CD1 3.91Å; I352-I367 HydrophobicContact CG2-CG2 3.93Å
353	Q	92.3	Very high	92.8	Very high	80 Å²	80	52 Å²	52	37%	0.374	27%	0.268	S	S	.	.	H	α-helix	trans	-59.6	-45.1	178.5	-79	176.8	-14	0	0	112	T349 S350 K355 L356 L381	T349-Q353 HydrophobicContact CG2-CG 4.46Å; T349-Q353 WeakPolarHBondContact O-CB 3.49Å; T349-Q353 WeakPolarHBondContact O-CG 3.33Å; T349-Q353 PolarHBondContact O-N 3.14Å; S350-Q353 PolarHBondContact O-N 3.33Å; Q353-K355 PolarHBondContact O-N 3.09Å; Q353-L356 WeakPolarHBondContact O-CB 3.36Å; Q353-L356 PolarHBondContact O-N 3.42Å; Q353-L381 HydrophobicContact CG-CD1 3.71Å; Q353-L381 HydrophobicContact CG-CD2 4.42Å
354	K	92.5	Very high	93	Very high	152 Å²	152	48.9 Å²	48.9	66%	0.661	25%	0.247	S	C	*	.	H	α-helix	trans	-61.3	-32.3	177.2	-71.4	173.6	-173.7	177.8	0	112.7	S350 V351 I352	S350-K354 WeakPolarHBondContact O-CG 3.39Å; S350-K354 PolarHBondContact O-N 3.47Å; V351-K354 PolarHBondContact O-N 3.45Å; I352-K354 PolarHBondContact O-N 3.32Å
355	K	92.1	Very high	93.1	Very high	69 Å²	69	48.9 Å²	48.9	30%	0.3	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	12	-176.7	-62.3	-175.1	-179.4	-179	0	113.3	F322 A324 V351 I352 Q353 P357 V358 Y359	F322-K355 PolarHBondContact O-NZ 2.98Å; A324-K355 HydrophobicContact CB-CB 4.26Å; A324-K355 HydrophobicContact CB-CD 4.33Å; V351-K355 HydrophobicContact CG1-CD 4.43Å; V351-K355 PolarHBondContact O-N 2.75Å; I352-K355 CarbonylContact O-C 3.53Å; I352-K355 PolarHBondContact O-N 3.31Å; I352-K355 VanDerWaalsContact O-N 3.15Å; Q353-K355 PolarHBondContact O-N 3.09Å; K355-P357 VanDerWaalsContact C-CD 3.4Å; K355-V358 WeakPolarHBondContact O-CB 3.5Å; K355-V358 PolarHBondContact O-N 3.32Å; K355-V358 VanDerWaalsContact O-N 3.07Å; K355-Y359 HydrophobicContact CB-CE2 4.36Å; K355-Y359 WeakPolarHBondContact O-CD2 3.45Å
356	L	90.4	Very high	93.3	Very high	25 Å²	25	53 Å²	53	13%	0.131	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-54.4	-40.8	-173.8	-165.3	62.4	0	0	0	114.4	I352 Q353 V358 Y359 L385 I388	I352-L356 WeakPolarHBondContact O-CA 3.39Å; I352-L356 PolarHBondContact O-N 3.4Å; Q353-L356 WeakPolarHBondContact O-CB 3.36Å; Q353-L356 PolarHBondContact O-N 3.42Å; L356-V358 PolarHBondContact O-N 2.75Å; L356-Y359 HydrophobicContact CD1-CD2 4.4Å; L356-Y359 PolarHBondContact O-N 3.43Å; L356-L385 HydrophobicContact CD1-CD2 3.85Å; L356-I388 HydrophobicContact CD1-CD1 4.35Å; L356-I388 HydrophobicContact CD2-CD1 3.47Å; L356-I388 VanDerWaalsContact CD2-CD1 3.47Å; L356-I388 HydrophobicContact CG-CD1 3.72Å
357	P	91.1	Very high	93.4	Very high	122 Å²	122	49 Å²	49	79%	0.792	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-66.3	-16.5	-179.9	-22.2	34.6	0	0	0	115.2	K355	K355-P357 VanDerWaalsContact C-CD 3.4Å
358	V	92.9	Very high	93.4	Very high	106 Å²	106	46.3 Å²	46.3	64%	0.642	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-81.3	-25	-177.5	-176.9	0	0	0	0	111.5	A324 K355 L356	A324-V358 HydrophobicContact CB-CG1 4.47Å; K355-V358 WeakPolarHBondContact O-CB 3.5Å; K355-V358 PolarHBondContact O-N 3.32Å; K355-V358 VanDerWaalsContact O-N 3.07Å; L356-V358 PolarHBondContact O-N 2.75Å
359	Y	93.3	Very high	93.5	Very high	8 Å²	8	48.8 Å²	48.8	3%	0.031	24%	0.241	C	C	.	.			trans	-75.7	141.9	-173.9	-66.9	-71.4	0	0	0	112.9	A324 L328 I352 K355 L356 E363 I367	A324-Y359 VanDerWaalsContact CA-OH 3.29Å; A324-Y359 WeakPolarHBondContact CA-OH 3.49Å; A324-Y359 HydrophobicContact CB-CD1 4.28Å; A324-Y359 HydrophobicContact CB-CE1 3.59Å; A324-Y359 HydrophobicContact CB-CE2 4.32Å; A324-Y359 WeakPolarHBondContact O-CE1 3.28Å; A324-Y359 PolarHBondContact O-OH 3.26Å; L328-Y359 HydrophobicContact CB-CE1 4.36Å; I352-Y359 HydrophobicContact CG2-CE2 4.16Å; K355-Y359 HydrophobicContact CB-CE2 4.36Å; K355-Y359 WeakPolarHBondContact O-CD2 3.45Å; L356-Y359 HydrophobicContact CD1-CD2 4.4Å; L356-Y359 PolarHBondContact O-N 3.43Å; Y359-E363 VanDerWaalsContact CA-OE2 3.3Å; Y359-E363 WeakPolarHBondContact CA-OE2 3.4Å; Y359-E363 HydrophobicContact CD1-CB 3.73Å; Y359-E363 HydrophobicContact CD1-CG 4.41Å; Y359-E363 HydrophobicContact CG-CB 4.29Å; Y359-I367 HydrophobicContact CD1-CD1 4.02Å; Y359-I367 HydrophobicContact CD2-CD1 3.93Å; Y359-I367 HydrophobicContact CE1-CD1 3.82Å; Y359-I367 HydrophobicContact CE2-CD1 3.77Å; Y359-I367 HydrophobicContact CG-CD1 4.05Å
360	R	93.3	Very high	93.5	Very high	188 Å²	188	48.9 Å²	48.9	71%	0.709	24%	0.242	S	C	*	.			trans	-83.7	167.4	171.5	-60	-177.7	-179.5	-177.4	0.5	111	V362 E363 V364	R360-V362 VanDerWaalsContact C-N 3.34Å; R360-V362 PolarHBondContact O-N 3.09Å; R360-E363 PolarHBondContact N-OE2 3.49Å; R360-E363 WeakPolarHBondContact O-CB 3.47Å; R360-E363 PolarHBondContact O-N 3.46Å; R360-V364 WeakPolarHBondContact O-CG2 3.34Å; R360-V364 PolarHBondContact O-N 3.25Å
361	S	93.3	Very high	93.5	Very high	12 Å²	12	46.8 Å²	46.8	8%	0.084	23%	0.227	C	C	.	.	H	α-helix	trans	-47.9	-49.4	179.5	53.8	0	0	0	0	114.2	E363 V364 A365 E401	S361-E363 VanDerWaalsContact C-N 3.29Å; S361-E363 PolarHBondContact O-N 3.41Å; S361-V364 PolarHBondContact O-N 2.98Å; S361-A365 VanDerWaalsContact O-CB 3.31Å; S361-A365 WeakPolarHBondContact O-CB 3.32Å; S361-A365 PolarHBondContact O-N 3.5Å; S361-E401 WeakPolarHBondContact CB-OE1 3.28Å; S361-E401 PolarHBondContact OG-OE1 3.15Å
362	V	93.1	Very high	93.5	Very high	50 Å²	50	49.6 Å²	49.6	30%	0.303	24%	0.239	S	C	.	.	H	α-helix	trans	-63.8	-35	180	-178.6	0	0	0	0	111.9	R360 R366 M404	R360-V362 VanDerWaalsContact C-N 3.34Å; R360-V362 PolarHBondContact O-N 3.09Å; V362-R366 VanDerWaalsContact O-CG 3.28Å; V362-R366 WeakPolarHBondContact O-CG 3.21Å; V362-R366 PolarHBondContact O-N 3.4Å; V362-R366 PolarHBondContact O-NE 2.92Å; V362-M404 HydrophobicContact CB-CE 4.47Å; V362-M404 HydrophobicContact CG2-CE 4.21Å
363	E	94.8	Very high	93.4	Very high	22 Å²	22	53 Å²	53	10%	0.103	26%	0.257	C	S	.	.	H	α-helix	trans	-75	-49	180	-65.3	160.3	172.2	0	0	110.5	Q325 L328 Y359 R360 S361 A365 R366 I367	Q325-E363 PolarHBondContact NE2-OE1 3.42Å; L328-E363 HydrophobicContact CD2-CB 4.02Å; L328-E363 HydrophobicContact CD2-CG 3.92Å; Y359-E363 VanDerWaalsContact CA-OE2 3.3Å; Y359-E363 WeakPolarHBondContact CA-OE2 3.4Å; Y359-E363 HydrophobicContact CD1-CB 3.73Å; Y359-E363 HydrophobicContact CD1-CG 4.41Å; Y359-E363 HydrophobicContact CG-CB 4.29Å; R360-E363 PolarHBondContact N-OE2 3.49Å; R360-E363 WeakPolarHBondContact O-CB 3.47Å; R360-E363 PolarHBondContact O-N 3.46Å; S361-E363 VanDerWaalsContact C-N 3.29Å; S361-E363 PolarHBondContact O-N 3.41Å; E363-A365 PolarHBondContact O-N 2.84Å; E363-R366 PolarHBondContact O-N 3.33Å; E363-R366 VanDerWaalsContact O-N 3.11Å; E363-I367 VanDerWaalsContact O-CG1 3.32Å; E363-I367 WeakPolarHBondContact O-CG1 3.34Å; E363-I367 PolarHBondContact O-N 3.32Å
364	V	95.4	Very high	93.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-56.9	-39.8	176.8	177.6	0	0	0	0	111	R360 S361 T368 L385 I388 L389 F392	R360-V364 WeakPolarHBondContact O-CG2 3.34Å; R360-V364 PolarHBondContact O-N 3.25Å; S361-V364 PolarHBondContact O-N 2.98Å; V364-T368 WeakPolarHBondContact O-CB 3.16Å; V364-T368 PolarHBondContact O-N 3.11Å; V364-T368 PolarHBondContact O-OG1 3.45Å; V364-L385 HydrophobicContact CG1-CD2 3.77Å; V364-I388 HydrophobicContact CG1-CG2 4.1Å; V364-I388 HydrophobicContact CG2-CG2 4.34Å; V364-L389 HydrophobicContact CB-CD2 4.38Å; V364-L389 HydrophobicContact CG1-CD2 3.9Å; V364-L389 HydrophobicContact CG1-CG 4.06Å; V364-F392 HydrophobicContact CB-CE2 4.38Å; V364-F392 HydrophobicContact CG2-CE2 4.03Å
365	A	95.3	Very high	93.1	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-67.9	-40.5	178.3	0	0	0	0	0	113.1	S361 E363 T368 Q369 L389 M404 L405 V408	S361-A365 VanDerWaalsContact O-CB 3.31Å; S361-A365 WeakPolarHBondContact O-CB 3.32Å; S361-A365 PolarHBondContact O-N 3.5Å; E363-A365 PolarHBondContact O-N 2.84Å; A365-T368 PolarHBondContact O-N 2.89Å; A365-Q369 WeakPolarHBondContact O-CB 3.12Å; A365-Q369 PolarHBondContact O-N 3.24Å; A365-L389 HydrophobicContact CB-CD2 3.95Å; A365-M404 HydrophobicContact CB-CE 3.68Å; A365-M404 HydrophobicContact CB-SD 3.08Å; A365-M404 WeakPolarHBondContact CB-SD 3.29Å; A365-L405 HydrophobicContact CB-CD2 4.15Å; A365-V408 HydrophobicContact CB-CB 4.48Å; A365-V408 HydrophobicContact CB-CG1 4.47Å; A365-V408 HydrophobicContact CB-CG2 4.13Å
366	R	95.2	Very high	93.1	Very high	87 Å²	87	45.8 Å²	45.8	33%	0.328	23%	0.226	S	C	.	.	H	α-helix	trans	-64.6	-43.4	174.1	-73.5	-177.1	-62.7	143.7	-12.6	112.1	L328 E332 V362 E363 T368 Q369 A370	L328-R366 HydrophobicContact CD1-CB 4.15Å; E332-R366 WeakPolarHBondContact OE1-CB 2.96Å; E332-R366 WeakPolarHBondContact OE1-CD 3.39Å; E332-R366 IonicContact OE1-CZ 2.75Å; E332-R366 IonicContact OE1-NE 3.64Å; E332-R366 IonicContact OE1-NH1 3.54Å; E332-R366 PolarHBondContact OE1-NH1 3.19Å; E332-R366 IonicContact OE2-NH1 2.77Å; E332-R366 PolarHBondContact OE2-NH1 3.11Å; V362-R366 VanDerWaalsContact O-CG 3.28Å; V362-R366 WeakPolarHBondContact O-CG 3.21Å; V362-R366 PolarHBondContact O-N 3.4Å; V362-R366 PolarHBondContact O-NE 2.92Å; E363-R366 PolarHBondContact O-N 3.33Å; E363-R366 VanDerWaalsContact O-N 3.11Å; R366-T368 VanDerWaalsContact C-N 3.34Å; R366-T368 PolarHBondContact O-N 2.77Å; R366-Q369 PolarHBondContact O-N 2.86Å; R366-A370 WeakPolarHBondContact O-CB 3.25Å; R366-A370 PolarHBondContact O-N 3.23Å
367	I	95.4	Very high	93	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-56.2	-50.8	172.4	-66.2	172.6	0	0	0	110.3	L328 I352 Y359 E363 Q369 A370 L371	L328-I367 HydrophobicContact CD1-CG1 3.66Å; I352-I367 HydrophobicContact CD1-CG2 4.26Å; I352-I367 HydrophobicContact CG2-CD1 3.91Å; I352-I367 HydrophobicContact CG2-CG2 3.93Å; Y359-I367 HydrophobicContact CD1-CD1 4.02Å; Y359-I367 HydrophobicContact CD2-CD1 3.93Å; Y359-I367 HydrophobicContact CE1-CD1 3.82Å; Y359-I367 HydrophobicContact CE2-CD1 3.77Å; Y359-I367 HydrophobicContact CG-CD1 4.05Å; E363-I367 VanDerWaalsContact O-CG1 3.32Å; E363-I367 WeakPolarHBondContact O-CG1 3.34Å; E363-I367 PolarHBondContact O-N 3.32Å; I367-Q369 VanDerWaalsContact C-N 3.34Å; I367-Q369 PolarHBondContact O-N 2.91Å; I367-A370 PolarHBondContact O-N 3.32Å; I367-L371 HydrophobicContact CG2-CD1 3.79Å; I367-L371 HydrophobicContact CG2-CG 4.31Å; I367-L371 WeakPolarHBondContact O-CB 3.35Å; I367-L371 WeakPolarHBondContact O-CG 3.49Å; I367-L371 PolarHBondContact O-N 2.96Å
368	T	95	Very high	92.9	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-44.5	-177.1	-57.4	0	0	0	0	111.2	V364 A365 R366 F372 F382 L385 L389 V408 L412	V364-T368 WeakPolarHBondContact O-CB 3.16Å; V364-T368 PolarHBondContact O-N 3.11Å; V364-T368 PolarHBondContact O-OG1 3.45Å; A365-T368 PolarHBondContact O-N 2.89Å; R366-T368 VanDerWaalsContact C-N 3.34Å; R366-T368 PolarHBondContact O-N 2.77Å; T368-F372 VanDerWaalsContact O-CB 3.29Å; T368-F372 WeakPolarHBondContact O-CB 3.36Å; T368-F372 PolarHBondContact O-N 3.15Å; T368-F382 HydrophobicContact CG2-CD1 4.5Å; T368-L385 HydrophobicContact CG2-CD1 4.43Å; T368-L389 HydrophobicContact CG2-CD1 3.98Å; T368-V408 HydrophobicContact CG2-CG1 3.61Å; T368-L412 HydrophobicContact CG2-CD1 3.96Å; T368-L412 HydrophobicContact CG2-CD2 3.68Å; T368-L412 HydrophobicContact CG2-CG 4.07Å
369	Q	94.9	Very high	92.7	Very high	51 Å²	51	48 Å²	48	24%	0.238	23%	0.228	C	C	.	.	H	α-helix	trans	-61.3	-49.1	176.6	175	173.8	-13.4	0	0	111.3	A365 R366 I367 F372 L373 R407 V408 M411	A365-Q369 WeakPolarHBondContact O-CB 3.12Å; A365-Q369 PolarHBondContact O-N 3.24Å; R366-Q369 PolarHBondContact O-N 2.86Å; I367-Q369 VanDerWaalsContact C-N 3.34Å; I367-Q369 PolarHBondContact O-N 2.91Å; Q369-F372 PolarHBondContact O-N 3.35Å; Q369-L373 HydrophobicContact CG-CD1 3.77Å; Q369-L373 HydrophobicContact CG-CG 4.37Å; Q369-L373 WeakPolarHBondContact O-CG 3.32Å; Q369-L373 PolarHBondContact O-N 3Å; Q369-R407 VanDerWaalsContact CD-NH1 3.3Å; Q369-R407 VanDerWaalsContact OE1-CZ 3.3Å; Q369-V408 HydrophobicContact CB-CG2 4.45Å; Q369-M411 HydrophobicContact CB-SD 4.4Å; Q369-M411 HydrophobicContact CG-CE 4.04Å; Q369-M411 HydrophobicContact CG-SD 4.18Å
370	A	93.9	Very high	92.6	Very high	4 Å²	4	55.2 Å²	55.2	3%	0.033	26%	0.262	C	S	.	.	H	α-helix	trans	-62.7	-47.3	-177.7	0	0	0	0	0	112	V331 E335 R366 I367 F372 L373 L374	V331-A370 HydrophobicContact CG1-CB 3.58Å; E335-A370 HydrophobicContact CB-CB 4.05Å; E335-A370 HydrophobicContact CG-CB 4.35Å; R366-A370 WeakPolarHBondContact O-CB 3.25Å; R366-A370 PolarHBondContact O-N 3.23Å; I367-A370 PolarHBondContact O-N 3.32Å; A370-F372 VanDerWaalsContact C-N 3.29Å; A370-F372 PolarHBondContact O-N 3.1Å; A370-L373 PolarHBondContact O-N 2.93Å; A370-L374 WeakPolarHBondContact O-CB 3.48Å; A370-L374 WeakPolarHBondContact O-CG 3.24Å; A370-L374 PolarHBondContact O-N 3.48Å
371	L	93.4	Very high	92.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.3	-37.3	176.4	-67.9	177.3	0	0	0	112.6	V331 I367 H375 Y376 L381 F382 L385	V331-L371 HydrophobicContact CG1-CD2 4.22Å; V331-L371 HydrophobicContact CG1-CG 4.47Å; I367-L371 HydrophobicContact CG2-CD1 3.79Å; I367-L371 HydrophobicContact CG2-CG 4.31Å; I367-L371 WeakPolarHBondContact O-CB 3.35Å; I367-L371 WeakPolarHBondContact O-CG 3.49Å; I367-L371 PolarHBondContact O-N 2.96Å; L371-H375 PolarHBondContact O-N 3.09Å; L371-Y376 HydrophobicContact CD2-CD1 4.33Å; L371-Y376 HydrophobicContact CD2-CG 4.39Å; L371-Y376 WeakPolarHBondContact O-CB 3.49Å; L371-Y376 PolarHBondContact O-N 3.19Å; L371-L381 HydrophobicContact CD1-CD2 3.87Å; L371-F382 HydrophobicContact CB-CE1 4.22Å; L371-F382 HydrophobicContact CB-CZ 4.02Å; L371-L385 HydrophobicContact CD1-CD1 4.41Å
372	F	92.1	Very high	92.4	Very high	65 Å²	65	47.1 Å²	47.1	29%	0.285	23%	0.231	S	C	.	.	H	α-helix	trans	-68	-44.8	177.1	-176.9	-86.6	0	0	0	112.1	T368 Q369 A370 L374 H375 F382 M411	T368-F372 VanDerWaalsContact O-CB 3.29Å; T368-F372 WeakPolarHBondContact O-CB 3.36Å; T368-F372 PolarHBondContact O-N 3.15Å; Q369-F372 PolarHBondContact O-N 3.35Å; A370-F372 VanDerWaalsContact C-N 3.29Å; A370-F372 PolarHBondContact O-N 3.1Å; F372-L374 VanDerWaalsContact C-N 3.29Å; F372-L374 PolarHBondContact O-N 2.86Å; F372-H375 WeakPolarHBondContact O-CA 3.32Å; F372-H375 PolarHBondContact O-N 2.75Å; F372-F382 HydrophobicContact CB-CE1 4.41Å; F372-M411 HydrophobicContact CB-CE 4.11Å; F372-M411 HydrophobicContact CD1-CB 4.22Å; F372-M411 HydrophobicContact CD1-CE 3.3Å; F372-M411 HydrophobicContact CD2-CB 4.4Å; F372-M411 HydrophobicContact CE1-CB 4.32Å; F372-M411 HydrophobicContact CE1-CE 3.99Å; F372-M411 WeakPolarHBondContact CE2-O 3.35Å; F372-M411 HydrophobicContact CG-CB 4.25Å; F372-M411 HydrophobicContact CG-CE 3.93Å; F372-M411 HydrophobicContact CZ-CB 4.47Å; F372-M411 VanDerWaalsContact CZ-O 3.29Å; F372-M411 WeakPolarHBondContact CZ-O 3.23Å
373	L	91.3	Very high	92.3	Very high	70 Å²	70	47.2 Å²	47.2	37%	0.366	24%	0.237	S	C	.	.	H	α-helix	trans	-67	-31.1	178.5	-69.3	174.4	0	0	0	112.2	E335 Q369 A370 H375 M411	E335-L373 HydrophobicContact CG-CB 3.86Å; E335-L373 HydrophobicContact CG-CD1 4.26Å; E335-L373 VanDerWaalsContact OE1-CD1 3.29Å; E335-L373 WeakPolarHBondContact OE1-CD1 3.44Å; Q369-L373 HydrophobicContact CG-CD1 3.77Å; Q369-L373 HydrophobicContact CG-CG 4.37Å; Q369-L373 WeakPolarHBondContact O-CG 3.32Å; Q369-L373 PolarHBondContact O-N 3Å; A370-L373 PolarHBondContact O-N 2.93Å; L373-H375 PolarHBondContact O-N 3.46Å; L373-M411 HydrophobicContact CD2-CE 4.17Å; L373-M411 HydrophobicContact CG-CE 4.16Å
374	L	90.8	Very high	92.1	Very high	13 Å²	13	48.1 Å²	48.1	7%	0.068	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-2.8	170.2	-74.2	169.3	0	0	0	114.1	L334 E335 S339 L345 A370 F372 Y376	L334-L374 HydrophobicContact CB-CD1 4.32Å; E335-L374 HydrophobicContact CB-CD1 4.09Å; E335-L374 HydrophobicContact CB-CD2 4.4Å; E335-L374 HydrophobicContact CB-CG 4Å; E335-L374 HydrophobicContact CG-CG 4.33Å; S339-L374 VanDerWaalsContact O-CD2 3.31Å; S339-L374 WeakPolarHBondContact O-CD2 3.33Å; L345-L374 HydrophobicContact CD2-CD1 3.74Å; A370-L374 WeakPolarHBondContact O-CB 3.48Å; A370-L374 WeakPolarHBondContact O-CG 3.24Å; A370-L374 PolarHBondContact O-N 3.48Å; F372-L374 VanDerWaalsContact C-N 3.29Å; F372-L374 PolarHBondContact O-N 2.86Å; L374-Y376 PolarHBondContact O-N 2.92Å
375	H	89	Confident	92	Very high	117 Å²	117	48.1 Å²	48.1	54%	0.542	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	31.1	-175.5	-56.6	-61.8	0	0	0	114	L371 F372 L373 Q377	L371-H375 PolarHBondContact O-N 3.09Å; F372-H375 WeakPolarHBondContact O-CA 3.32Å; F372-H375 PolarHBondContact O-N 2.75Å; L373-H375 PolarHBondContact O-N 3.46Å; H375-Q377 PolarHBondContact O-NE2 3.46Å
376	Y	90.8	Very high	91.8	Very high	20 Å²	20	50.9 Å²	50.9	8%	0.078	26%	0.259	C	S	.	.			trans	-61.1	138	178.7	-173.4	-111.7	0	0	0	110.8	L345 N346 T349 L371 L374 N378 L381 F382	L345-Y376 HydrophobicContact CB-CD2 4.3Å; L345-Y376 HydrophobicContact CB-CE2 4.31Å; N346-Y376 VanDerWaalsContact OD1-CE2 3.24Å; N346-Y376 WeakPolarHBondContact OD1-CE2 3.26Å; N346-Y376 PolarHBondContact OD1-OH 2.98Å; T349-Y376 HydrophobicContact CG2-CE1 3.84Å; L371-Y376 HydrophobicContact CD2-CD1 4.33Å; L371-Y376 HydrophobicContact CD2-CG 4.39Å; L371-Y376 WeakPolarHBondContact O-CB 3.49Å; L371-Y376 PolarHBondContact O-N 3.19Å; L374-Y376 PolarHBondContact O-N 2.92Å; Y376-N378 HydrophobicContact CD1-CB 3.95Å; Y376-N378 HydrophobicContact CE1-CB 3.43Å; Y376-N378 VanDerWaalsContact CE1-CB 3.43Å; Y376-L381 HydrophobicContact CE1-CD2 4.4Å; Y376-F382 WeakPolarHBondContact O-CE2 3.45Å
377	Q	88.6	Confident	91.6	Very high	164 Å²	164	51.5 Å²	51.5	77%	0.766	27%	0.272	S	S	*	.			trans	-107.8	94.1	-175	-62	-60.8	-42.2	0	0	110.3	H375	H375-Q377 PolarHBondContact O-NE2 3.46Å
378	N	89.1	Confident	91.5	Very high	31 Å²	31	53.4 Å²	53.4	17%	0.166	28%	0.282	C	S	.	.			trans	-150.9	90.7	171.5	-170.4	-35.8	0	0	0	110.6	Y376 E380 L381 F382	Y376-N378 HydrophobicContact CD1-CB 3.95Å; Y376-N378 HydrophobicContact CE1-CB 3.43Å; Y376-N378 VanDerWaalsContact CE1-CB 3.43Å; N378-E380 VanDerWaalsContact C-N 3.31Å; N378-E380 PolarHBondContact O-N 3.17Å; N378-E380 PolarHBondContact OD1-N 3.41Å; N378-L381 HydrophobicContact CB-CB 4.01Å; N378-L381 PolarHBondContact O-N 2.97Å; N378-L381 WeakPolarHBondContact OD1-CB 3.5Å; N378-L381 PolarHBondContact OD1-N 2.9Å; N378-F382 WeakPolarHBondContact O-CD2 3.43Å; N378-F382 PolarHBondContact O-N 3.41Å; N378-F382 VanDerWaalsContact O-N 3.16Å
379	P	89.4	Confident	91.5	Very high	104 Å²	104	53.4 Å²	53.4	68%	0.675	28%	0.282	S	S	*	.	H	α-helix	trans	-64.9	-33.5	-174.1	25.6	-33.5	0	0	0	113	F382 A383	P379-F382 PolarHBondContact O-N 3.24Å; P379-A383 WeakPolarHBondContact O-CB 3.21Å; P379-A383 PolarHBondContact O-N 3.47Å
380	E	89.7	Confident	91.4	Very high	161 Å²	161	51.9 Å²	51.9	75%	0.752	28%	0.276	S	S	*	.	H	α-helix	trans	-64.9	-45.5	178.6	-63.9	179.8	-179.9	0	0	111.3	N378 A383 A384	N378-E380 VanDerWaalsContact C-N 3.31Å; N378-E380 PolarHBondContact O-N 3.17Å; N378-E380 PolarHBondContact OD1-N 3.41Å; E380-A383 PolarHBondContact O-N 2.84Å; E380-A384 PolarHBondContact O-N 3.33Å
381	L	91.1	Very high	91.3	Very high	5 Å²	5	53.6 Å²	53.6	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-61.4	-46	175.4	178.6	57.2	0	0	0	111.6	T349 Q353 L371 Y376 N378 A383 A384 L385	T349-L381 HydrophobicContact CG2-CD2 3.29Å; Q353-L381 HydrophobicContact CG-CD1 3.71Å; Q353-L381 HydrophobicContact CG-CD2 4.42Å; L371-L381 HydrophobicContact CD1-CD2 3.87Å; Y376-L381 HydrophobicContact CE1-CD2 4.4Å; N378-L381 HydrophobicContact CB-CB 4.01Å; N378-L381 PolarHBondContact O-N 2.97Å; N378-L381 WeakPolarHBondContact OD1-CB 3.5Å; N378-L381 PolarHBondContact OD1-N 2.9Å; L381-A383 VanDerWaalsContact C-N 3.28Å; L381-A383 PolarHBondContact O-N 3.12Å; L381-A384 PolarHBondContact O-N 3.26Å; L381-L385 HydrophobicContact CD1-CD1 4.07Å; L381-L385 HydrophobicContact CD1-CG 3.99Å; L381-L385 HydrophobicContact CD2-CD1 4.46Å; L381-L385 HydrophobicContact CG-CD1 3.83Å; L381-L385 HydrophobicContact CG-CG 4.23Å; L381-L385 WeakPolarHBondContact O-CB 3.48Å; L381-L385 VanDerWaalsContact O-CG 3.3Å; L381-L385 WeakPolarHBondContact O-CG 3.38Å; L381-L385 PolarHBondContact O-N 2.94Å
382	F	91.8	Very high	91.4	Very high	24 Å²	24	56 Å²	56	11%	0.105	30%	0.298	C	S	.	.	H	α-helix	trans	-65.1	-32.5	178.7	-75.3	-62.6	0	0	0	112.6	T368 L371 F372 Y376 N378 P379 L385 R386 L412	T368-F382 HydrophobicContact CG2-CD1 4.5Å; L371-F382 HydrophobicContact CB-CE1 4.22Å; L371-F382 HydrophobicContact CB-CZ 4.02Å; F372-F382 HydrophobicContact CB-CE1 4.41Å; Y376-F382 WeakPolarHBondContact O-CE2 3.45Å; N378-F382 WeakPolarHBondContact O-CD2 3.43Å; N378-F382 PolarHBondContact O-N 3.41Å; N378-F382 VanDerWaalsContact O-N 3.16Å; P379-F382 PolarHBondContact O-N 3.24Å; F382-L385 HydrophobicContact CD1-CD1 4.26Å; F382-R386 WeakPolarHBondContact O-CB 3.25Å; F382-R386 PolarHBondContact O-N 3Å; F382-L412 HydrophobicContact CB-CD2 4.37Å; F382-L412 HydrophobicContact CD1-CD2 3.38Å; F382-L412 HydrophobicContact CE1-CD2 3.95Å; F382-L412 HydrophobicContact CG-CD2 4.14Å
383	A	90.5	Very high	91.4	Very high	53 Å²	53	53 Å²	53	44%	0.438	29%	0.285	S	S	.	.	H	α-helix	trans	-66.3	-42.1	172.4	0	0	0	0	0	112	P379 E380 L381 T387	P379-A383 WeakPolarHBondContact O-CB 3.21Å; P379-A383 PolarHBondContact O-N 3.47Å; E380-A383 PolarHBondContact O-N 2.84Å; L381-A383 VanDerWaalsContact C-N 3.28Å; L381-A383 PolarHBondContact O-N 3.12Å; A383-T387 PolarHBondContact O-N 3.3Å; A383-T387 VanDerWaalsContact O-N 3.11Å; A383-T387 PolarHBondContact O-OG1 3Å
384	A	91.3	Very high	91.4	Very high	41 Å²	41	53.9 Å²	53.9	34%	0.339	29%	0.287	S	S	.	.	H	α-helix	trans	-64	-49.2	174.8	0	0	0	0	0	111.9	E380 L381 R386 T387 I388	E380-A384 PolarHBondContact O-N 3.33Å; L381-A384 PolarHBondContact O-N 3.26Å; A384-R386 VanDerWaalsContact C-N 3.32Å; A384-R386 PolarHBondContact O-N 3.23Å; A384-T387 PolarHBondContact O-N 2.76Å; A384-I388 WeakPolarHBondContact O-CG1 3.3Å; A384-I388 PolarHBondContact O-N 3.1Å; A384-I388 VanDerWaalsContact O-N 3.09Å
385	L	92.9	Very high	91.4	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58	-44.3	176.6	-71.1	171.4	0	0	0	111.3	L356 V364 T368 L371 L381 F382 T387 I388 L389	L356-L385 HydrophobicContact CD1-CD2 3.85Å; V364-L385 HydrophobicContact CG1-CD2 3.77Å; T368-L385 HydrophobicContact CG2-CD1 4.43Å; L371-L385 HydrophobicContact CD1-CD1 4.41Å; L381-L385 HydrophobicContact CD1-CD1 4.07Å; L381-L385 HydrophobicContact CD1-CG 3.99Å; L381-L385 HydrophobicContact CD2-CD1 4.46Å; L381-L385 HydrophobicContact CG-CD1 3.83Å; L381-L385 HydrophobicContact CG-CG 4.23Å; L381-L385 WeakPolarHBondContact O-CB 3.48Å; L381-L385 VanDerWaalsContact O-CG 3.3Å; L381-L385 WeakPolarHBondContact O-CG 3.38Å; L381-L385 PolarHBondContact O-N 2.94Å; F382-L385 HydrophobicContact CD1-CD1 4.26Å; L385-T387 VanDerWaalsContact C-N 3.34Å; L385-T387 PolarHBondContact O-N 3.47Å; L385-I388 PolarHBondContact O-N 3.03Å; L385-L389 WeakPolarHBondContact O-CB 3.34Å; L385-L389 WeakPolarHBondContact O-CG 3.42Å; L385-L389 PolarHBondContact O-N 3.01Å
386	R	91.9	Very high	91.5	Very high	59 Å²	59	57 Å²	57	22%	0.223	29%	0.294	C	S	.	.	H	α-helix	trans	-56.2	-48.3	175.6	-177.2	-166.9	174.3	96.8	9.2	111.7	F382 A384 I388 L389 V390 L409 L412 P413 S414	F382-R386 WeakPolarHBondContact O-CB 3.25Å; F382-R386 PolarHBondContact O-N 3Å; A384-R386 VanDerWaalsContact C-N 3.32Å; A384-R386 PolarHBondContact O-N 3.23Å; R386-I388 VanDerWaalsContact C-N 3.31Å; R386-I388 PolarHBondContact O-N 3.31Å; R386-L389 PolarHBondContact O-N 3.07Å; R386-V390 HydrophobicContact CG-CG2 4.49Å; R386-V390 WeakPolarHBondContact O-CG2 3.46Å; R386-V390 PolarHBondContact O-N 3.07Å; R386-L409 HydrophobicContact CG-CD2 4.12Å; R386-L412 HydrophobicContact CB-CD1 3.79Å; R386-L412 HydrophobicContact CG-CD1 4.33Å; R386-P413 PolarHBondContact NH1-O 2.58Å; R386-S414 PolarHBondContact NH1-OG 3.07Å; R386-S414 PolarHBondContact NH2-OG 3.21Å
387	T	91.6	Very high	91.4	Very high	99 Å²	99	63.4 Å²	63.4	61%	0.607	32%	0.323	S	S	*	.	H	α-helix	trans	-60.5	-43.8	-178.6	-55.8	0	0	0	0	110.9	A383 A384 L385 S391	A383-T387 PolarHBondContact O-N 3.3Å; A383-T387 VanDerWaalsContact O-N 3.11Å; A383-T387 PolarHBondContact O-OG1 3Å; A384-T387 PolarHBondContact O-N 2.76Å; L385-T387 VanDerWaalsContact C-N 3.34Å; L385-T387 PolarHBondContact O-N 3.47Å; T387-S391 PolarHBondContact O-N 2.96Å; T387-S391 VanDerWaalsContact O-N 3.09Å
388	I	93.3	Very high	91.4	Very high	41 Å²	41	63.7 Å²	63.7	21%	0.21	32%	0.318	C	S	.	.	H	α-helix	trans	-63.5	-47.4	176.4	-66.3	168.6	0	0	0	110.9	L356 V364 A384 L385 R386 V390 S391 F392	L356-I388 HydrophobicContact CD1-CD1 4.35Å; L356-I388 HydrophobicContact CD2-CD1 3.47Å; L356-I388 VanDerWaalsContact CD2-CD1 3.47Å; L356-I388 HydrophobicContact CG-CD1 3.72Å; V364-I388 HydrophobicContact CG1-CG2 4.1Å; V364-I388 HydrophobicContact CG2-CG2 4.34Å; A384-I388 WeakPolarHBondContact O-CG1 3.3Å; A384-I388 PolarHBondContact O-N 3.1Å; A384-I388 VanDerWaalsContact O-N 3.09Å; L385-I388 PolarHBondContact O-N 3.03Å; R386-I388 VanDerWaalsContact C-N 3.31Å; R386-I388 PolarHBondContact O-N 3.31Å; I388-V390 PolarHBondContact O-N 3.42Å; I388-S391 WeakPolarHBondContact O-CB 3.4Å; I388-S391 PolarHBondContact O-N 2.48Å; I388-S391 VanDerWaalsContact O-N 3.15Å; I388-S391 PolarHBondContact O-OG 3.15Å; I388-F392 HydrophobicContact CG2-CD2 3.66Å; I388-F392 HydrophobicContact CG2-CE2 3.24Å; I388-F392 HydrophobicContact CG2-CZ 3.98Å; I388-F392 WeakPolarHBondContact O-CD2 3.41Å; I388-F392 PolarHBondContact O-N 2.82Å
389	L	93.8	Very high	91.5	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.8	-41.5	179.6	-71.9	169.6	0	0	0	112.6	V364 A365 T368 L385 R386 S391 F392 L393 L405 V408 L409 L412	V364-L389 HydrophobicContact CB-CD2 4.38Å; V364-L389 HydrophobicContact CG1-CD2 3.9Å; V364-L389 HydrophobicContact CG1-CG 4.06Å; A365-L389 HydrophobicContact CB-CD2 3.95Å; T368-L389 HydrophobicContact CG2-CD1 3.98Å; L385-L389 WeakPolarHBondContact O-CB 3.34Å; L385-L389 WeakPolarHBondContact O-CG 3.42Å; L385-L389 PolarHBondContact O-N 3.01Å; R386-L389 PolarHBondContact O-N 3.07Å; L389-S391 VanDerWaalsContact C-N 3.32Å; L389-F392 PolarHBondContact O-N 3.35Å; L389-L393 WeakPolarHBondContact O-CB 3.36Å; L389-L393 PolarHBondContact O-N 3.13Å; L389-L405 HydrophobicContact CD2-CD2 3.47Å; L389-L405 VanDerWaalsContact CD2-CD2 3.47Å; L389-V408 HydrophobicContact CD1-CG1 3.89Å; L389-L409 HydrophobicContact CB-CD2 3.65Å; L389-L409 HydrophobicContact CB-CG 4.08Å; L389-L409 HydrophobicContact CD1-CD2 4.26Å; L389-L412 HydrophobicContact CD1-CD1 4.18Å
390	V	92.6	Very high	91.5	Very high	18 Å²	18	65.4 Å²	65.4	11%	0.109	31%	0.313	C	S	.	.	H	α-helix	trans	-61.2	-43.7	174	170.5	0	0	0	0	110.3	R386 I388 F392 L393 Q394 L409 V421	R386-V390 HydrophobicContact CG-CG2 4.49Å; R386-V390 WeakPolarHBondContact O-CG2 3.46Å; R386-V390 PolarHBondContact O-N 3.07Å; I388-V390 PolarHBondContact O-N 3.42Å; V390-F392 VanDerWaalsContact C-N 3.33Å; V390-F392 PolarHBondContact O-N 2.96Å; V390-L393 PolarHBondContact O-N 3.21Å; V390-Q394 HydrophobicContact CG1-CG 4.45Å; V390-Q394 WeakPolarHBondContact O-CG 3.47Å; V390-Q394 PolarHBondContact O-N 3Å; V390-L409 HydrophobicContact CG2-CD1 4.17Å; V390-L409 HydrophobicContact CG2-CD2 3.87Å; V390-V421 HydrophobicContact CG1-CG2 3.93Å; V390-V421 HydrophobicContact CG2-CG2 4.2Å
391	S	92.8	Very high	91.7	Very high	40 Å²	40	59.3 Å²	59.3	28%	0.28	28%	0.284	S	S	.	.	H	α-helix	trans	-63.7	-37.2	178.9	82.4	0	0	0	0	112.9	T387 I388 L389 R395	T387-S391 PolarHBondContact O-N 2.96Å; T387-S391 VanDerWaalsContact O-N 3.09Å; I388-S391 WeakPolarHBondContact O-CB 3.4Å; I388-S391 PolarHBondContact O-N 2.48Å; I388-S391 VanDerWaalsContact O-N 3.15Å; I388-S391 PolarHBondContact O-OG 3.15Å; L389-S391 VanDerWaalsContact C-N 3.32Å; S391-R395 WeakPolarHBondContact O-CG 3.35Å
392	F	94.4	Very high	91.8	Very high	52 Å²	52	59.1 Å²	59.1	23%	0.228	28%	0.283	C	S	.	.	H	α-helix	trans	-69.4	-42.7	174.6	-73.1	-44.5	0	0	0	111.8	V364 I388 L389 V390 Q394 R395 S396 L405	V364-F392 HydrophobicContact CB-CE2 4.38Å; V364-F392 HydrophobicContact CG2-CE2 4.03Å; I388-F392 HydrophobicContact CG2-CD2 3.66Å; I388-F392 HydrophobicContact CG2-CE2 3.24Å; I388-F392 HydrophobicContact CG2-CZ 3.98Å; I388-F392 WeakPolarHBondContact O-CD2 3.41Å; I388-F392 PolarHBondContact O-N 2.82Å; L389-F392 PolarHBondContact O-N 3.35Å; V390-F392 VanDerWaalsContact C-N 3.33Å; V390-F392 PolarHBondContact O-N 2.96Å; F392-Q394 VanDerWaalsContact C-N 3.34Å; F392-Q394 PolarHBondContact O-N 3.39Å; F392-R395 PolarHBondContact O-N 3.15Å; F392-R395 VanDerWaalsContact O-N 3.12Å; F392-S396 PolarHBondContact O-N 3.25Å; F392-L405 HydrophobicContact CB-CD1 3.92Å
393	L	93.4	Very high	91.9	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.5	-46	-179.5	-175.1	154.8	0	0	0	110.8	L389 V390 R395 S396 L405 L409 V421 H424	L389-L393 WeakPolarHBondContact O-CB 3.36Å; L389-L393 PolarHBondContact O-N 3.13Å; V390-L393 PolarHBondContact O-N 3.21Å; L393-R395 PolarHBondContact O-N 3.26Å; L393-S396 PolarHBondContact O-N 2.95Å; L393-L405 HydrophobicContact CB-CB 4.19Å; L393-L405 HydrophobicContact CB-CD1 3.98Å; L393-L405 HydrophobicContact CD1-CB 4.02Å; L393-L405 HydrophobicContact CG-CB 4.41Å; L393-L409 HydrophobicContact CD1-CD1 3.68Å; L393-V421 HydrophobicContact CD1-CG1 3.9Å; L393-V421 HydrophobicContact CD2-CB 4.35Å; L393-V421 HydrophobicContact CD2-CG1 4.02Å; L393-V421 HydrophobicContact CD2-CG2 4.32Å; L393-H424 HydrophobicContact CD2-CB 3.97Å; L393-H424 PolarHBondContact O-CD2 3.04Å; L393-H424 PolarHBondContact O-NE2 3.3Å; L393-H424 VanDerWaalsContact O-NE2 3.09Å
394	Q	90.6	Very high	92.1	Very high	89 Å²	89	56.5 Å²	56.5	42%	0.416	26%	0.263	S	S	.	.	H	α-helix	trans	-64.2	-18.5	179.3	-71.4	174.8	-13.3	0	0	113.9	V390 F392	V390-Q394 HydrophobicContact CG1-CG 4.45Å; V390-Q394 WeakPolarHBondContact O-CG 3.47Å; V390-Q394 PolarHBondContact O-N 3Å; F392-Q394 VanDerWaalsContact C-N 3.34Å; F392-Q394 PolarHBondContact O-N 3.39Å
395	R	91.1	Very high	92.2	Very high	189 Å²	189	54.6 Å²	54.6	71%	0.713	25%	0.247	S	C	*	.	H	α-helix	trans	-103	-16.1	-179.8	-67.6	176.5	-177	-174.9	2.1	113.7	S391 F392 L393 F397	S391-R395 WeakPolarHBondContact O-CG 3.35Å; F392-R395 PolarHBondContact O-N 3.15Å; F392-R395 VanDerWaalsContact O-N 3.12Å; L393-R395 PolarHBondContact O-N 3.26Å; R395-F397 WeakPolarHBondContact O-CD2 3.33Å; R395-F397 VanDerWaalsContact O-CE2 3.25Å; R395-F397 WeakPolarHBondContact O-CE2 3.48Å
396	S	90.9	Very high	92.2	Very high	6 Å²	6	54.6 Å²	54.6	4%	0.042	25%	0.247	C	C	.	.			trans	-82.9	137.1	-176.8	179.2	0	0	0	0	110.9	F392 L393 Y398 E401 H424	F392-S396 PolarHBondContact O-N 3.25Å; L393-S396 PolarHBondContact O-N 2.95Å; S396-Y398 PolarHBondContact OG-N 3.01Å; S396-E401 WeakPolarHBondContact CB-OE2 3.3Å; S396-E401 WeakPolarHBondContact OG-CB 3.41Å; S396-E401 PolarHBondContact OG-OE2 2.81Å; S396-H424 PolarHBondContact O-CE1 3.09Å; S396-H424 VanDerWaalsContact O-CE1 3.25Å; S396-H424 PolarHBondContact O-NE2 3.43Å
397	F	87.9	Confident	92.3	Very high	156 Å²	156	55.2 Å²	55.2	68%	0.684	25%	0.25	S	C	*	.			trans	-110.4	3.3	173.3	-58.2	-86	0	0	0	112.3	R395	R395-F397 WeakPolarHBondContact O-CD2 3.33Å; R395-F397 VanDerWaalsContact O-CE2 3.25Å; R395-F397 WeakPolarHBondContact O-CE2 3.48Å
398	Y	89.1	Confident	92.4	Very high	170 Å²	170	50.5 Å²	50.5	67%	0.667	22%	0.221	S	C	*	.			trans	-92.1	120.8	-175.8	-61.9	-74.4	0	0	0	110.7	S396 Y400 E401 V402	S396-Y398 PolarHBondContact OG-N 3.01Å; Y398-Y400 VanDerWaalsContact C-N 3.32Å; Y398-Y400 PolarHBondContact O-N 3.34Å; Y398-E401 PolarHBondContact O-N 3.07Å; Y398-V402 PolarHBondContact O-N 3.38Å
399	P	91.1	Very high	92.3	Very high	25 Å²	25	48.9 Å²	48.9	16%	0.162	21%	0.212	C	C	.	.	H	α-helix	trans	-52.4	-44.1	-177.1	-29.2	35.1	0	0	0	114.8	E401 T403 V428 Q431	P399-E401 PolarHBondContact O-N 2.96Å; P399-T403 VanDerWaalsContact O-CB 3.28Å; P399-T403 WeakPolarHBondContact O-CB 3.4Å; P399-T403 PolarHBondContact O-N 2.79Å; P399-T403 PolarHBondContact O-OG1 3.42Å; P399-V428 HydrophobicContact CB-CG1 3.89Å; P399-V428 HydrophobicContact CG-CG1 3.94Å; P399-Q431 HydrophobicContact CB-CB 4.5Å; P399-Q431 HydrophobicContact CG-CB 3.61Å
400	Y	90.4	Very high	92.2	Very high	146 Å²	146	49.1 Å²	49.1	57%	0.573	22%	0.215	S	C	*	.	H	α-helix	trans	-59.5	-45.5	176.5	168.3	-99.9	0	0	0	112.6	Y398 M404 E436	Y398-Y400 VanDerWaalsContact C-N 3.32Å; Y398-Y400 PolarHBondContact O-N 3.34Å; Y400-M404 VanDerWaalsContact O-CB 3.25Å; Y400-M404 WeakPolarHBondContact O-CB 3.38Å; Y400-M404 PolarHBondContact O-N 3.19Å; Y400-E436 WeakPolarHBondContact CA-OE1 3.39Å
401	E	92.7	Very high	92	Very high	32 Å²	32	49.6 Å²	49.6	15%	0.15	22%	0.216	C	C	.	.	H	α-helix	trans	-69.5	-44.8	-177.7	-174	-178.5	-168.4	0	0	111	S361 S396 Y398 P399 T403 M404 L405	S361-E401 WeakPolarHBondContact CB-OE1 3.28Å; S361-E401 PolarHBondContact OG-OE1 3.15Å; S396-E401 WeakPolarHBondContact CB-OE2 3.3Å; S396-E401 WeakPolarHBondContact OG-CB 3.41Å; S396-E401 PolarHBondContact OG-OE2 2.81Å; Y398-E401 PolarHBondContact O-N 3.07Å; P399-E401 PolarHBondContact O-N 2.96Å; E401-T403 VanDerWaalsContact C-N 3.32Å; E401-T403 PolarHBondContact O-N 2.88Å; E401-M404 PolarHBondContact O-N 3.23Å; E401-L405 HydrophobicContact CG-CD1 3.96Å; E401-L405 HydrophobicContact CG-CG 4.41Å; E401-L405 WeakPolarHBondContact O-CB 3.32Å; E401-L405 VanDerWaalsContact O-CG 3.24Å; E401-L405 WeakPolarHBondContact O-CG 3.37Å; E401-L405 PolarHBondContact O-N 3.32Å
402	V	93.9	Very high	91.7	Very high	1 Å²	1	48 Å²	48	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-61.2	-41.3	176.4	173.7	0	0	0	0	111.3	Y398 T406 V425 V428	Y398-V402 PolarHBondContact O-N 3.38Å; V402-T406 WeakPolarHBondContact O-CB 3.47Å; V402-T406 PolarHBondContact O-N 2.89Å; V402-T406 PolarHBondContact O-OG1 3.34Å; V402-V425 HydrophobicContact CG1-CG2 4.19Å; V402-V428 HydrophobicContact CB-CG1 4.28Å; V402-V428 HydrophobicContact CG1-CB 4.38Å; V402-V428 HydrophobicContact CG1-CG1 4.41Å; V402-V428 HydrophobicContact CG1-CG2 4.49Å; V402-V428 HydrophobicContact CG2-CG1 4.48Å; V402-V428 HydrophobicContact CG2-CG2 4.31Å
403	T	93.3	Very high	90.7	Very high	7 Å²	7	50.6 Å²	50.6	4%	0.043	23%	0.226	C	C	.	.	H	α-helix	trans	-63	-48.4	175.8	-62.2	0	0	0	0	111.5	P399 E401 T406 R407 E436 T439 I440	P399-T403 VanDerWaalsContact O-CB 3.28Å; P399-T403 WeakPolarHBondContact O-CB 3.4Å; P399-T403 PolarHBondContact O-N 2.79Å; P399-T403 PolarHBondContact O-OG1 3.42Å; E401-T403 VanDerWaalsContact C-N 3.32Å; E401-T403 PolarHBondContact O-N 2.88Å; T403-T406 WeakPolarHBondContact O-CB 3.48Å; T403-T406 PolarHBondContact O-N 3.48Å; T403-R407 PolarHBondContact O-N 3.07Å; T403-E436 HydrophobicContact CG2-CB 3.97Å; T403-E436 HydrophobicContact CG2-CG 4.04Å; T403-T439 HydrophobicContact CG2-CG2 3.72Å; T403-I440 HydrophobicContact CG2-CG1 4.12Å
404	M	94.4	Very high	89.6	Confident	16 Å²	16	51.4 Å²	51.4	8%	0.079	23%	0.232	C	C	.	.	H	α-helix	trans	-61.5	-46.5	180	179.6	-75.8	-67.7	0	0	111.2	V362 A365 Y400 E401 R407 V408	V362-M404 HydrophobicContact CB-CE 4.47Å; V362-M404 HydrophobicContact CG2-CE 4.21Å; A365-M404 HydrophobicContact CB-CE 3.68Å; A365-M404 HydrophobicContact CB-SD 3.08Å; A365-M404 WeakPolarHBondContact CB-SD 3.29Å; Y400-M404 VanDerWaalsContact O-CB 3.25Å; Y400-M404 WeakPolarHBondContact O-CB 3.38Å; Y400-M404 PolarHBondContact O-N 3.19Å; E401-M404 PolarHBondContact O-N 3.23Å; M404-R407 PolarHBondContact O-N 3.08Å; M404-V408 WeakPolarHBondContact O-CG2 3.35Å; M404-V408 PolarHBondContact O-N 3.23Å; M404-V408 VanDerWaalsContact O-N 3.09Å; M404-V408 HydrophobicContact SD-CG2 4.34Å
405	L	94.8	Very high	88.2	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-42	177.4	-68.1	172.6	0	0	0	111.7	A365 L389 F392 L393 E401 R407 V408 L409	A365-L405 HydrophobicContact CB-CD2 4.15Å; L389-L405 HydrophobicContact CD2-CD2 3.47Å; L389-L405 VanDerWaalsContact CD2-CD2 3.47Å; F392-L405 HydrophobicContact CB-CD1 3.92Å; L393-L405 HydrophobicContact CB-CB 4.19Å; L393-L405 HydrophobicContact CB-CD1 3.98Å; L393-L405 HydrophobicContact CD1-CB 4.02Å; L393-L405 HydrophobicContact CG-CB 4.41Å; E401-L405 HydrophobicContact CG-CD1 3.96Å; E401-L405 HydrophobicContact CG-CG 4.41Å; E401-L405 WeakPolarHBondContact O-CB 3.32Å; E401-L405 VanDerWaalsContact O-CG 3.24Å; E401-L405 WeakPolarHBondContact O-CG 3.37Å; E401-L405 PolarHBondContact O-N 3.32Å; L405-R407 PolarHBondContact O-N 3.1Å; L405-V408 PolarHBondContact O-N 3.08Å; L405-L409 WeakPolarHBondContact O-CB 3.39Å; L405-L409 VanDerWaalsContact O-CG 3.29Å; L405-L409 WeakPolarHBondContact O-CG 3.5Å; L405-L409 PolarHBondContact O-N 3.07Å
406	T	93	Very high	87.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-57.1	-47.9	174.5	-66.3	0	0	0	0	111.8	V402 T403 V408 L409 A410 V425 A443 W447	V402-T406 WeakPolarHBondContact O-CB 3.47Å; V402-T406 PolarHBondContact O-N 2.89Å; V402-T406 PolarHBondContact O-OG1 3.34Å; T403-T406 WeakPolarHBondContact O-CB 3.48Å; T403-T406 PolarHBondContact O-N 3.48Å; T406-V408 PolarHBondContact O-N 3.39Å; T406-L409 PolarHBondContact O-N 3.39Å; T406-A410 PolarHBondContact O-N 2.92Å; T406-V425 HydrophobicContact CG2-CG2 4.37Å; T406-V425 VanDerWaalsContact OG1-CG2 3.26Å; T406-V425 WeakPolarHBondContact OG1-CG2 3.2Å; T406-A443 HydrophobicContact CG2-CB 3.66Å; T406-W447 HydrophobicContact CG2-CH2 3.63Å; T406-W447 HydrophobicContact CG2-CZ2 4.18Å; T406-W447 HydrophobicContact CG2-CZ3 4.34Å
407	R	92.9	Very high	86.2	Confident	73 Å²	73	52.2 Å²	52.2	28%	0.275	24%	0.244	S	C	.	.	H	α-helix	trans	-58.3	-48.5	177.4	-177.4	-176.7	59.4	86.9	2.8	111.5	Q369 T403 M404 L405 A410 M411 T439	Q369-R407 VanDerWaalsContact CD-NH1 3.3Å; Q369-R407 VanDerWaalsContact OE1-CZ 3.3Å; T403-R407 PolarHBondContact O-N 3.07Å; M404-R407 PolarHBondContact O-N 3.08Å; L405-R407 PolarHBondContact O-N 3.1Å; R407-A410 PolarHBondContact O-N 3.02Å; R407-M411 WeakPolarHBondContact O-CG 3.14Å; R407-M411 PolarHBondContact O-N 3.15Å; R407-T439 HydrophobicContact CB-CG2 3.77Å; R407-T439 HydrophobicContact CG-CG2 3.95Å
408	V	93.6	Very high	85.7	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-69.1	-38.8	-178.6	175.9	0	0	0	0	111.6	A365 T368 Q369 L389 M404 L405 T406 A410 M411	A365-V408 HydrophobicContact CB-CB 4.48Å; A365-V408 HydrophobicContact CB-CG1 4.47Å; A365-V408 HydrophobicContact CB-CG2 4.13Å; T368-V408 HydrophobicContact CG2-CG1 3.61Å; Q369-V408 HydrophobicContact CB-CG2 4.45Å; L389-V408 HydrophobicContact CD1-CG1 3.89Å; M404-V408 WeakPolarHBondContact O-CG2 3.35Å; M404-V408 PolarHBondContact O-N 3.23Å; M404-V408 VanDerWaalsContact O-N 3.09Å; M404-V408 HydrophobicContact SD-CG2 4.34Å; L405-V408 PolarHBondContact O-N 3.08Å; T406-V408 PolarHBondContact O-N 3.39Å; V408-A410 VanDerWaalsContact C-N 3.29Å; V408-A410 PolarHBondContact O-N 2.88Å; V408-M411 WeakPolarHBondContact O-CA 3.25Å; V408-M411 VanDerWaalsContact O-CB 3.24Å; V408-M411 WeakPolarHBondContact O-CB 3.05Å; V408-M411 PolarHBondContact O-N 3.08Å
409	L	92.3	Very high	85.3	Confident	6 Å²	6	46.8 Å²	46.8	3%	0.031	23%	0.229	C	C	.	.	H	α-helix	trans	-62	-36.5	174.2	-77.5	170.3	0	0	0	112.5	R386 L389 V390 L393 L405 T406 M411 L412	R386-L409 HydrophobicContact CG-CD2 4.12Å; L389-L409 HydrophobicContact CB-CD2 3.65Å; L389-L409 HydrophobicContact CB-CG 4.08Å; L389-L409 HydrophobicContact CD1-CD2 4.26Å; V390-L409 HydrophobicContact CG2-CD1 4.17Å; V390-L409 HydrophobicContact CG2-CD2 3.87Å; L393-L409 HydrophobicContact CD1-CD1 3.68Å; L405-L409 WeakPolarHBondContact O-CB 3.39Å; L405-L409 VanDerWaalsContact O-CG 3.29Å; L405-L409 WeakPolarHBondContact O-CG 3.5Å; L405-L409 PolarHBondContact O-N 3.07Å; T406-L409 PolarHBondContact O-N 3.39Å; L409-M411 PolarHBondContact O-N 3.42Å; L409-L412 PolarHBondContact O-N 2.88Å
410	A	90.3	Very high	84.9	Confident	6 Å²	6	47 Å²	47	5%	0.05	24%	0.236	C	C	.	.	H	α-helix	trans	-67.7	-20.1	172.9	0	0	0	0	0	113	T406 R407 V408 L412 A443 K446 W447	T406-A410 PolarHBondContact O-N 2.92Å; R407-A410 PolarHBondContact O-N 3.02Å; V408-A410 VanDerWaalsContact C-N 3.29Å; V408-A410 PolarHBondContact O-N 2.88Å; A410-L412 VanDerWaalsContact C-N 3.34Å; A410-A443 HydrophobicContact CB-CB 3.66Å; A410-K446 WeakPolarHBondContact O-CD 3.22Å; A410-K446 WeakPolarHBondContact O-CE 3.5Å; A410-K446 PolarHBondContact O-NZ 3.27Å; A410-W447 HydrophobicContact CB-CZ2 4.34Å
411	M	88.5	Confident	84.7	Confident	27 Å²	27	40.2 Å²	40.2	13%	0.133	21%	0.21	C	C	.	.	H	α-helix	trans	-66.5	-39.6	172.6	-62	176.7	66	0	0	111.3	Q369 F372 L373 R407 V408 L409 K446	Q369-M411 HydrophobicContact CB-SD 4.4Å; Q369-M411 HydrophobicContact CG-CE 4.04Å; Q369-M411 HydrophobicContact CG-SD 4.18Å; F372-M411 HydrophobicContact CB-CE 4.11Å; F372-M411 HydrophobicContact CD1-CB 4.22Å; F372-M411 HydrophobicContact CD1-CE 3.3Å; F372-M411 HydrophobicContact CD2-CB 4.4Å; F372-M411 HydrophobicContact CE1-CB 4.32Å; F372-M411 HydrophobicContact CE1-CE 3.99Å; F372-M411 WeakPolarHBondContact CE2-O 3.35Å; F372-M411 HydrophobicContact CG-CB 4.25Å; F372-M411 HydrophobicContact CG-CE 3.93Å; F372-M411 HydrophobicContact CZ-CB 4.47Å; F372-M411 VanDerWaalsContact CZ-O 3.29Å; F372-M411 WeakPolarHBondContact CZ-O 3.23Å; L373-M411 HydrophobicContact CD2-CE 4.17Å; L373-M411 HydrophobicContact CG-CE 4.16Å; R407-M411 WeakPolarHBondContact O-CG 3.14Å; R407-M411 PolarHBondContact O-N 3.15Å; V408-M411 WeakPolarHBondContact O-CA 3.25Å; V408-M411 VanDerWaalsContact O-CB 3.24Å; V408-M411 WeakPolarHBondContact O-CB 3.05Å; V408-M411 PolarHBondContact O-N 3.08Å; L409-M411 PolarHBondContact O-N 3.42Å; M411-K446 VanDerWaalsContact CA-NZ 3.31Å; M411-K446 PolarHBondContact O-NZ 3.45Å
412	L	86.8	Confident	84.4	Confident	8 Å²	8	39.4 Å²	39.4	4%	0.042	21%	0.208	C	C	.	.	S	Bend	trans	-74.7	142.6	-173.5	-59.3	-178.3	0	0	0	113.2	T368 F382 R386 L389 L409 A410 S414	T368-L412 HydrophobicContact CG2-CD1 3.96Å; T368-L412 HydrophobicContact CG2-CD2 3.68Å; T368-L412 HydrophobicContact CG2-CG 4.07Å; F382-L412 HydrophobicContact CB-CD2 4.37Å; F382-L412 HydrophobicContact CD1-CD2 3.38Å; F382-L412 HydrophobicContact CE1-CD2 3.95Å; F382-L412 HydrophobicContact CG-CD2 4.14Å; R386-L412 HydrophobicContact CB-CD1 3.79Å; R386-L412 HydrophobicContact CG-CD1 4.33Å; L389-L412 HydrophobicContact CD1-CD1 4.18Å; L409-L412 PolarHBondContact O-N 2.88Å; A410-L412 VanDerWaalsContact C-N 3.34Å; L412-S414 PolarHBondContact O-N 3.45Å
413	P	73.6	Confident	84.1	Confident	106 Å²	106	44.5 Å²	44.5	69%	0.688	23%	0.232	S	C	*	.			trans	-60.4	131.3	176.3	23.6	-31.2	0	0	0	110.7	R386	R386-P413 PolarHBondContact NH1-O 2.58Å
414	S	69.9	Low	83.9	Confident	17 Å²	17	45.2 Å²	45.2	12%	0.119	24%	0.235	C	C	.	.			trans	-148.3	133.1	177.4	-161.1	0	0	0	0	111.6	R386 L412 R416	R386-S414 PolarHBondContact NH1-OG 3.07Å; R386-S414 PolarHBondContact NH2-OG 3.21Å; L412-S414 PolarHBondContact O-N 3.45Å; S414-R416 PolarHBondContact OG-N 3.2Å; S414-R416 PolarHBondContact OG-O 3.15Å
415	P	61.3	Low	83.7	Confident	98 Å²	98	44.4 Å²	44.4	64%	0.636	23%	0.231	S	C	*	.	S	Bend	trans	-77.2	-23.8	170.4	29.4	-32.1	0	0	0	112.8
416	R	68.6	Low	83.5	Confident	188 Å²	188	45.5 Å²	45.5	71%	0.709	24%	0.237	S	C	*	.	S	Bend	trans	-151	139.3	-174.7	-63.2	-174.7	-177.2	179.7	0.7	112.6	S414	S414-R416 PolarHBondContact OG-N 3.2Å; S414-R416 PolarHBondContact OG-O 3.15Å
417	L	71.9	Confident	83.4	Confident	15 Å²	15	49.9 Å²	49.9	8%	0.079	26%	0.26	C	S	.	.			trans	-72.2	127.2	169.3	-178.3	64	0	0	0	110.9	E419 V421 A422 W447 K461 Y462	L417-E419 PolarHBondContact O-N 2.68Å; L417-V421 HydrophobicContact CD1-CB 4.37Å; L417-V421 HydrophobicContact CD1-CG1 4.14Å; L417-A422 HydrophobicContact CD2-CB 3.65Å; L417-A422 HydrophobicContact CG-CB 4.26Å; L417-W447 HydrophobicContact CD1-CD2 3.72Å; L417-W447 HydrophobicContact CD1-CE3 3.72Å; L417-W447 HydrophobicContact CD1-CG 4.46Å; L417-W447 HydrophobicContact CD1-CH2 3.6Å; L417-W447 HydrophobicContact CD1-CZ2 3.62Å; L417-W447 HydrophobicContact CD1-CZ3 3.66Å; L417-W447 HydrophobicContact CD2-CD2 4.23Å; L417-W447 HydrophobicContact CD2-CE3 3.58Å; L417-W447 HydrophobicContact CD2-CH2 4.49Å; L417-W447 HydrophobicContact CD2-CZ3 3.74Å; L417-W447 HydrophobicContact CG-CD2 4.45Å; L417-W447 HydrophobicContact CG-CE3 4.23Å; L417-W447 HydrophobicContact CG-CZ3 4.37Å; L417-K461 PolarHBondContact O-NZ 3.25Å; L417-Y462 HydrophobicContact CB-CE1 3.9Å; L417-Y462 VanDerWaalsContact CB-OH 3.25Å; L417-Y462 WeakPolarHBondContact CB-OH 3.5Å; L417-Y462 HydrophobicContact CD2-CD1 4.16Å; L417-Y462 HydrophobicContact CD2-CE1 3.5Å; L417-Y462 VanDerWaalsContact CD2-CE1 3.5Å; L417-Y462 HydrophobicContact CG-CE1 4.33Å
418	D	77.3	Confident	83.4	Confident	66 Å²	66	46.8 Å²	46.8	35%	0.353	25%	0.249	S	C	.	.			trans	-61.7	127.7	170.7	-174.7	-36.9	0	0	0	110.1	G420 V421 A422	D418-G420 VanDerWaalsContact C-N 3.3Å; D418-G420 PolarHBondContact O-N 3.18Å; D418-G420 WeakPolarHBondContact OD1-CA 3.49Å; D418-G420 PolarHBondContact OD1-N 3.36Å; D418-V421 HydrophobicContact CB-CB 4.15Å; D418-V421 HydrophobicContact CB-CG2 3.79Å; D418-V421 WeakPolarHBondContact O-CB 3.47Å; D418-V421 PolarHBondContact O-N 3.28Å; D418-A422 PolarHBondContact O-N 3.07Å; D418-A422 VanDerWaalsContact O-N 3.09Å
419	E	79.8	Confident	83.3	Confident	146 Å²	146	46.8 Å²	46.8	68%	0.682	25%	0.249	S	C	*	.	H	α-helix	trans	-64.4	-34.5	-178.6	-68	-171.8	165.3	0	0	112.8	L417 V421 A422 Q423	L417-E419 PolarHBondContact O-N 2.68Å; E419-V421 VanDerWaalsContact C-N 3.29Å; E419-V421 PolarHBondContact O-N 3.27Å; E419-A422 PolarHBondContact O-N 3.06Å; E419-Q423 WeakPolarHBondContact O-CB 3.47Å; E419-Q423 PolarHBondContact O-N 3.01Å
420	G	83.3	Confident	83.3	Confident	30 Å²	30	49.7 Å²	49.7	31%	0.309	27%	0.274	S	S	.	.	H	α-helix	trans	-64.1	-36.3	174.9	0	0	0	0	0	111.9	D418 H424	D418-G420 VanDerWaalsContact C-N 3.3Å; D418-G420 PolarHBondContact O-N 3.18Å; D418-G420 WeakPolarHBondContact OD1-CA 3.49Å; D418-G420 PolarHBondContact OD1-N 3.36Å; G420-H424 VanDerWaalsContact O-CB 3.27Å; G420-H424 WeakPolarHBondContact O-CB 3.45Å; G420-H424 PolarHBondContact O-N 2.65Å
421	V	85.9	Confident	83.3	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.018	30%	0.299	C	S	.	.	H	α-helix	trans	-67.4	-47	174.8	174.9	0	0	0	0	110.7	V390 L393 L417 D418 E419 Q423 H424 V425 W447	V390-V421 HydrophobicContact CG1-CG2 3.93Å; V390-V421 HydrophobicContact CG2-CG2 4.2Å; L393-V421 HydrophobicContact CD1-CG1 3.9Å; L393-V421 HydrophobicContact CD2-CB 4.35Å; L393-V421 HydrophobicContact CD2-CG1 4.02Å; L393-V421 HydrophobicContact CD2-CG2 4.32Å; L417-V421 HydrophobicContact CD1-CB 4.37Å; L417-V421 HydrophobicContact CD1-CG1 4.14Å; D418-V421 HydrophobicContact CB-CB 4.15Å; D418-V421 HydrophobicContact CB-CG2 3.79Å; D418-V421 WeakPolarHBondContact O-CB 3.47Å; D418-V421 PolarHBondContact O-N 3.28Å; E419-V421 VanDerWaalsContact C-N 3.29Å; E419-V421 PolarHBondContact O-N 3.27Å; V421-Q423 PolarHBondContact O-N 3Å; V421-H424 PolarHBondContact O-N 3.43Å; V421-V425 HydrophobicContact CG1-CG2 4.48Å; V421-V425 VanDerWaalsContact O-CG2 3.32Å; V421-V425 WeakPolarHBondContact O-CG2 3.42Å; V421-V425 PolarHBondContact O-N 3.35Å; V421-W447 HydrophobicContact CG1-CH2 4.21Å
422	A	86.2	Confident	83.5	Confident	15 Å²	15	54.1 Å²	54.1	12%	0.124	29%	0.294	C	S	.	.	H	α-helix	trans	-59.8	-46.2	179.6	0	0	0	0	0	112.1	L417 D418 E419 V425 D426	L417-A422 HydrophobicContact CD2-CB 3.65Å; L417-A422 HydrophobicContact CG-CB 4.26Å; D418-A422 PolarHBondContact O-N 3.07Å; D418-A422 VanDerWaalsContact O-N 3.09Å; E419-A422 PolarHBondContact O-N 3.06Å; A422-V425 PolarHBondContact O-N 3.04Å; A422-D426 PolarHBondContact O-N 2.74Å
423	Q	87.7	Confident	83.6	Confident	107 Å²	107	55.6 Å²	55.6	50%	0.5	30%	0.301	S	S	.	.	H	α-helix	trans	-64.8	-41	179.5	-174.7	60.1	48.9	0	0	111.6	E419 V421 D426 N427	E419-Q423 WeakPolarHBondContact O-CB 3.47Å; E419-Q423 PolarHBondContact O-N 3.01Å; V421-Q423 PolarHBondContact O-N 3Å; Q423-D426 WeakPolarHBondContact O-CB 3.32Å; Q423-D426 PolarHBondContact O-N 3.25Å; Q423-N427 PolarHBondContact NE2-OD1 3.38Å; Q423-N427 PolarHBondContact O-N 3.08Å; Q423-N427 PolarHBondContact O-ND2 3.46Å; Q423-N427 PolarHBondContact O-OD1 3.11Å
424	H	89.9	Confident	84.4	Confident	22 Å²	22	50.6 Å²	50.6	10%	0.102	27%	0.269	C	S	.	.	H	α-helix	trans	-67.9	-40.7	-179.7	-165.3	71.4	0	0	0	112.4	L393 S396 G420 V421 D426 N427 V428	L393-H424 HydrophobicContact CD2-CB 3.97Å; L393-H424 PolarHBondContact O-CD2 3.04Å; L393-H424 PolarHBondContact O-NE2 3.3Å; L393-H424 VanDerWaalsContact O-NE2 3.09Å; S396-H424 PolarHBondContact O-CE1 3.09Å; S396-H424 VanDerWaalsContact O-CE1 3.25Å; S396-H424 PolarHBondContact O-NE2 3.43Å; G420-H424 VanDerWaalsContact O-CB 3.27Å; G420-H424 WeakPolarHBondContact O-CB 3.45Å; G420-H424 PolarHBondContact O-N 2.65Å; V421-H424 PolarHBondContact O-N 3.43Å; H424-D426 VanDerWaalsContact C-N 3.31Å; H424-D426 PolarHBondContact O-N 3.24Å; H424-N427 PolarHBondContact O-N 2.81Å; H424-V428 WeakPolarHBondContact O-CG2 3.22Å; H424-V428 PolarHBondContact O-N 3Å
425	V	91	Very high	85.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-58.6	-45.8	171	173.2	0	0	0	0	110.1	V402 T406 V421 A422 N427 V428 I429 I440 L465	V402-V425 HydrophobicContact CG1-CG2 4.19Å; T406-V425 HydrophobicContact CG2-CG2 4.37Å; T406-V425 VanDerWaalsContact OG1-CG2 3.26Å; T406-V425 WeakPolarHBondContact OG1-CG2 3.2Å; V421-V425 HydrophobicContact CG1-CG2 4.48Å; V421-V425 VanDerWaalsContact O-CG2 3.32Å; V421-V425 WeakPolarHBondContact O-CG2 3.42Å; V421-V425 PolarHBondContact O-N 3.35Å; A422-V425 PolarHBondContact O-N 3.04Å; V425-N427 VanDerWaalsContact C-N 3.25Å; V425-N427 PolarHBondContact O-N 3.35Å; V425-V428 PolarHBondContact O-N 3.36Å; V425-I429 HydrophobicContact CG1-CD1 4.07Å; V425-I429 HydrophobicContact CG1-CG1 4.19Å; V425-I429 VanDerWaalsContact O-CG1 3.31Å; V425-I429 WeakPolarHBondContact O-CG1 3.24Å; V425-I429 PolarHBondContact O-N 3.47Å; V425-I429 VanDerWaalsContact O-N 3.09Å; V425-I440 HydrophobicContact CG1-CD1 4.32Å; V425-I440 HydrophobicContact CG1-CG2 3.65Å; V425-L465 HydrophobicContact CG1-CD1 4.38Å; V425-L465 HydrophobicContact CG1-CD2 4.43Å
426	D	90.4	Very high	86.8	Confident	23 Å²	23	47.5 Å²	47.5	12%	0.123	25%	0.247	C	C	.	.	H	α-helix	trans	-59.4	-33.5	178.8	-164	50.7	0	0	0	114.1	A422 Q423 H424 V428 L465 R468	A422-D426 PolarHBondContact O-N 2.74Å; Q423-D426 WeakPolarHBondContact O-CB 3.32Å; Q423-D426 PolarHBondContact O-N 3.25Å; H424-D426 VanDerWaalsContact C-N 3.31Å; H424-D426 PolarHBondContact O-N 3.24Å; D426-V428 VanDerWaalsContact C-N 3.3Å; D426-V428 PolarHBondContact O-N 3.16Å; D426-L465 HydrophobicContact CB-CD1 3.84Å; D426-R468 PolarHBondContact O-NH1 2.9Å; D426-R468 VanDerWaalsContact OD1-CD 3.31Å; D426-R468 WeakPolarHBondContact OD1-CD 3.26Å; D426-R468 IonicContact OD1-CZ 3.75Å; D426-R468 IonicContact OD1-NE 3.89Å; D426-R468 IonicContact OD1-NH1 2.9Å; D426-R468 PolarHBondContact OD1-NH1 3.43Å; D426-R468 IonicContact OD2-CZ 3.21Å; D426-R468 IonicContact OD2-NH1 2.96Å; D426-R468 PolarHBondContact OD2-NH1 3.04Å
427	N	90.3	Very high	87.9	Confident	92 Å²	92	38.6 Å²	38.6	49%	0.492	21%	0.214	S	C	.	.	H	α-helix	trans	-71.1	-25.8	177.8	-65	-18.1	0	0	0	112.9	Q423 H424 V425	Q423-N427 PolarHBondContact NE2-OD1 3.38Å; Q423-N427 PolarHBondContact O-N 3.08Å; Q423-N427 PolarHBondContact O-ND2 3.46Å; Q423-N427 PolarHBondContact O-OD1 3.11Å; H424-N427 PolarHBondContact O-N 2.81Å; V425-N427 VanDerWaalsContact C-N 3.25Å; V425-N427 PolarHBondContact O-N 3.35Å
428	V	92.2	Very high	88.8	Confident	7 Å²	7	38.3 Å²	38.3	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-100.3	-22.8	-172.2	177.7	0	0	0	0	112.6	P399 V402 H424 V425 D426 A430 Q431	P399-V428 HydrophobicContact CB-CG1 3.89Å; P399-V428 HydrophobicContact CG-CG1 3.94Å; V402-V428 HydrophobicContact CB-CG1 4.28Å; V402-V428 HydrophobicContact CG1-CB 4.38Å; V402-V428 HydrophobicContact CG1-CG1 4.41Å; V402-V428 HydrophobicContact CG1-CG2 4.49Å; V402-V428 HydrophobicContact CG2-CG1 4.48Å; V402-V428 HydrophobicContact CG2-CG2 4.31Å; H424-V428 WeakPolarHBondContact O-CG2 3.22Å; H424-V428 PolarHBondContact O-N 3Å; V425-V428 PolarHBondContact O-N 3.36Å; D426-V428 VanDerWaalsContact C-N 3.3Å; D426-V428 PolarHBondContact O-N 3.16Å; V428-A430 PolarHBondContact O-N 2.85Å; V428-A430 VanDerWaalsContact O-N 3.07Å; V428-Q431 WeakPolarHBondContact O-CB 3.48Å; V428-Q431 PolarHBondContact O-N 3.49Å
429	I	92.3	Very high	89.5	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-48.1	-40.7	-177	-82.2	169.3	0	0	0	113.9	V425 Q431 C432 L437 I440 L465 L469 C472	V425-I429 HydrophobicContact CG1-CD1 4.07Å; V425-I429 HydrophobicContact CG1-CG1 4.19Å; V425-I429 VanDerWaalsContact O-CG1 3.31Å; V425-I429 WeakPolarHBondContact O-CG1 3.24Å; V425-I429 PolarHBondContact O-N 3.47Å; V425-I429 VanDerWaalsContact O-N 3.09Å; I429-Q431 PolarHBondContact O-N 2.94Å; I429-Q431 VanDerWaalsContact O-N 3.15Å; I429-C432 WeakPolarHBondContact O-CB 3.44Å; I429-C432 PolarHBondContact O-N 2.94Å; I429-C432 VanDerWaalsContact O-N 3.09Å; I429-L437 HydrophobicContact CB-CD2 4.48Å; I429-L437 HydrophobicContact CG2-CD2 3.76Å; I429-I440 HydrophobicContact CG1-CD1 4.26Å; I429-L465 HydrophobicContact CD1-CD1 3.34Å; I429-L465 HydrophobicContact CD1-CG 4.08Å; I429-L469 HydrophobicContact CB-CD2 4.45Å; I429-L469 HydrophobicContact CD1-CD2 3.45Å; I429-L469 VanDerWaalsContact CD1-CD2 3.45Å; I429-L469 HydrophobicContact CD1-CG 3.71Å; I429-L469 HydrophobicContact CG1-CD2 3.61Å; I429-L469 HydrophobicContact CG1-CG 4.4Å; I429-L469 HydrophobicContact CG2-CD2 3.98Å; I429-C472 HydrophobicContact CG2-CB 3.92Å
430	A	91.8	Very high	90	Very high	66 Å²	66	29.9 Å²	29.9	55%	0.545	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-64.6	-19.8	-177.9	0	0	0	0	0	113.6	V428	V428-A430 PolarHBondContact O-N 2.85Å; V428-A430 VanDerWaalsContact O-N 3.07Å
431	Q	91.4	Very high	90.4	Very high	125 Å²	125	28.7 Å²	28.7	58%	0.584	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-96.2	-7.6	179.1	-58.7	174.2	40.8	0	0	112.5	P399 V428 I429	P399-Q431 HydrophobicContact CB-CB 4.5Å; P399-Q431 HydrophobicContact CG-CB 3.61Å; V428-Q431 WeakPolarHBondContact O-CB 3.48Å; V428-Q431 PolarHBondContact O-N 3.49Å; I429-Q431 PolarHBondContact O-N 2.94Å; I429-Q431 VanDerWaalsContact O-N 3.15Å
432	C	91.4	Very high	90.5	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.014	19%	0.188	C	C	.	.			trans	-76	147.9	-176.6	-70.6	0	0	0	0	112.5	I429 E436 L437	I429-C432 WeakPolarHBondContact O-CB 3.44Å; I429-C432 PolarHBondContact O-N 2.94Å; I429-C432 VanDerWaalsContact O-N 3.09Å; C432-E436 WeakPolarHBondContact CA-OE2 3.3Å; C432-E436 HydrophobicContact CB-CB 3.82Å; C432-L437 HydrophobicContact CB-CD2 3.72Å; C432-L437 HydrophobicContact CB-CG 3.92Å
433	N	90.4	Very high	90.7	Very high	38 Å²	38	34.5 Å²	34.5	20%	0.203	18%	0.183	C	C	.	.			trans	-79.8	170.8	168.2	67.2	50	0	0	0	112.2	S435 E436 L437 E489	N433-S435 VanDerWaalsContact C-N 3.32Å; N433-S435 PolarHBondContact O-N 3.42Å; N433-S435 WeakPolarHBondContact OD1-CB 3.42Å; N433-S435 PolarHBondContact OD1-N 2.83Å; N433-S435 VanDerWaalsContact OD1-N 3.12Å; N433-E436 PolarHBondContact N-OE2 3.03Å; N433-E436 PolarHBondContact ND2-OE1 3.46Å; N433-E436 PolarHBondContact ND2-OE2 3.02Å; N433-E436 WeakPolarHBondContact O-CB 3.39Å; N433-E436 PolarHBondContact O-N 3.35Å; N433-E436 VanDerWaalsContact O-N 3.14Å; N433-E436 WeakPolarHBondContact OD1-CB 3.45Å; N433-E436 WeakPolarHBondContact OD1-CG 3.32Å; N433-E436 PolarHBondContact OD1-N 3.31Å; N433-L437 WeakPolarHBondContact O-CG 3.47Å; N433-L437 PolarHBondContact O-N 2.87Å; N433-E489 HydrophobicContact CB-CG 3.99Å; N433-E489 WeakPolarHBondContact CB-OE2 3.37Å
434	L	90.3	Very high	90.7	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-61.7	-37.2	-176.2	-61.6	169.4	0	0	0	113.2	E436 L437 N438 R476 L477 E489 I490 L502	L434-E436 VanDerWaalsContact C-N 3.33Å; L434-L437 HydrophobicContact CD2-CD1 4.44Å; L434-L437 PolarHBondContact O-N 3.03Å; L434-N438 WeakPolarHBondContact O-CB 3.43Å; L434-N438 PolarHBondContact O-N 3.32Å; L434-R476 HydrophobicContact CD2-CB 4.43Å; L434-L477 HydrophobicContact CD1-CD2 3.61Å; L434-L477 HydrophobicContact CD1-CG 4.09Å; L434-L477 HydrophobicContact CD2-CG 4.16Å; L434-E489 HydrophobicContact CB-CB 4.04Å; L434-E489 HydrophobicContact CD1-CB 4.32Å; L434-E489 HydrophobicContact CG-CB 4.44Å; L434-E489 WeakPolarHBondContact CG-OE2 3.48Å; L434-E489 PolarHBondContact N-OE2 2.92Å; L434-I490 HydrophobicContact CD1-CG2 3.62Å; L434-L502 HydrophobicContact CD2-CD1 4.19Å
435	S	89.6	Confident	90.6	Very high	28 Å²	28	30 Å²	30	20%	0.196	17%	0.168	C	C	.	.	H	α-helix	trans	-64.6	-39.2	176.1	-176.7	0	0	0	0	111.8	N433 T439 E489	N433-S435 VanDerWaalsContact C-N 3.32Å; N433-S435 PolarHBondContact O-N 3.42Å; N433-S435 WeakPolarHBondContact OD1-CB 3.42Å; N433-S435 PolarHBondContact OD1-N 2.83Å; N433-S435 VanDerWaalsContact OD1-N 3.12Å; S435-T439 WeakPolarHBondContact O-CB 3.26Å; S435-T439 PolarHBondContact O-N 3.09Å; S435-T439 PolarHBondContact O-OG1 3.34Å; S435-E489 WeakPolarHBondContact CB-O 3.39Å; S435-E489 PolarHBondContact N-O 3.01Å
436	E	91.3	Very high	90.4	Very high	22 Å²	22	32.9 Å²	32.9	10%	0.103	18%	0.18	C	C	.	.	H	α-helix	trans	-68.5	-46.1	177.9	-74.2	167.5	171.9	0	0	111	Y400 T403 C432 N433 L434 N438 T439 I440	Y400-E436 WeakPolarHBondContact CA-OE1 3.39Å; T403-E436 HydrophobicContact CG2-CB 3.97Å; T403-E436 HydrophobicContact CG2-CG 4.04Å; C432-E436 WeakPolarHBondContact CA-OE2 3.3Å; C432-E436 HydrophobicContact CB-CB 3.82Å; N433-E436 PolarHBondContact N-OE2 3.03Å; N433-E436 PolarHBondContact ND2-OE1 3.46Å; N433-E436 PolarHBondContact ND2-OE2 3.02Å; N433-E436 WeakPolarHBondContact O-CB 3.39Å; N433-E436 PolarHBondContact O-N 3.35Å; N433-E436 VanDerWaalsContact O-N 3.14Å; N433-E436 WeakPolarHBondContact OD1-CB 3.45Å; N433-E436 WeakPolarHBondContact OD1-CG 3.32Å; N433-E436 PolarHBondContact OD1-N 3.31Å; L434-E436 VanDerWaalsContact C-N 3.33Å; E436-N438 VanDerWaalsContact C-N 3.3Å; E436-N438 PolarHBondContact O-N 3.33Å; E436-T439 WeakPolarHBondContact O-CB 3.35Å; E436-T439 PolarHBondContact O-N 3Å; E436-I440 WeakPolarHBondContact O-CG1 3.29Å; E436-I440 PolarHBondContact O-N 3.05Å
437	L	92.4	Very high	90.1	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-57.1	-44	175.2	-67.4	176	0	0	0	111.8	I429 C432 N433 L434 T439 I440 S441 L469 C472 W497	I429-L437 HydrophobicContact CB-CD2 4.48Å; I429-L437 HydrophobicContact CG2-CD2 3.76Å; C432-L437 HydrophobicContact CB-CD2 3.72Å; C432-L437 HydrophobicContact CB-CG 3.92Å; N433-L437 WeakPolarHBondContact O-CG 3.47Å; N433-L437 PolarHBondContact O-N 2.87Å; L434-L437 HydrophobicContact CD2-CD1 4.44Å; L434-L437 PolarHBondContact O-N 3.03Å; L437-T439 VanDerWaalsContact C-N 3.33Å; L437-T439 PolarHBondContact O-N 2.64Å; L437-I440 PolarHBondContact O-N 3.37Å; L437-S441 PolarHBondContact O-N 3.34Å; L437-L469 HydrophobicContact CB-CD2 4.46Å; L437-L469 HydrophobicContact CD2-CD2 3.61Å; L437-C472 HydrophobicContact CD1-CB 4.46Å; L437-W497 HydrophobicContact CB-CH2 4.02Å; L437-W497 HydrophobicContact CB-CZ3 4.35Å
438	N	90.9	Very high	89.8	Confident	9 Å²	9	29.4 Å²	29.4	5%	0.048	16%	0.16	C	C	.	.	H	α-helix	trans	-65.4	-36	176	-175.9	66.2	0	0	0	112.6	L434 E436 S441 F442 A493 P494 W497	L434-N438 WeakPolarHBondContact O-CB 3.43Å; L434-N438 PolarHBondContact O-N 3.32Å; E436-N438 VanDerWaalsContact C-N 3.3Å; E436-N438 PolarHBondContact O-N 3.33Å; N438-S441 PolarHBondContact O-N 2.81Å; N438-S441 PolarHBondContact O-OG 3.38Å; N438-F442 PolarHBondContact O-N 3.48Å; N438-F442 VanDerWaalsContact O-N 3.11Å; N438-A493 HydrophobicContact CB-CB 4.18Å; N438-P494 PolarHBondContact ND2-O 3.4Å; N438-P494 PolarHBondContact OD1-O 3.13Å; N438-W497 HydrophobicContact CB-CE3 4.28Å; N438-W497 HydrophobicContact CB-CZ3 4.12Å
439	T	90.6	Very high	89.3	Confident	33 Å²	33	38 Å²	38	20%	0.202	19%	0.192	C	C	.	.	H	α-helix	trans	-66.4	-41.9	175.3	-61.3	0	0	0	0	111.6	T403 R407 S435 E436 L437 F442 A443	T403-T439 HydrophobicContact CG2-CG2 3.72Å; R407-T439 HydrophobicContact CB-CG2 3.77Å; R407-T439 HydrophobicContact CG-CG2 3.95Å; S435-T439 WeakPolarHBondContact O-CB 3.26Å; S435-T439 PolarHBondContact O-N 3.09Å; S435-T439 PolarHBondContact O-OG1 3.34Å; E436-T439 WeakPolarHBondContact O-CB 3.35Å; E436-T439 PolarHBondContact O-N 3Å; L437-T439 VanDerWaalsContact C-N 3.33Å; L437-T439 PolarHBondContact O-N 2.64Å; T439-F442 PolarHBondContact O-N 2.85Å; T439-A443 PolarHBondContact O-N 3.33Å; T439-A443 VanDerWaalsContact O-N 3.16Å
440	I	91.4	Very high	88.7	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-65.6	-42.6	175.8	-63.3	167	0	0	0	110	T403 V425 I429 E436 L437 F442 A443 V444 L469	T403-I440 HydrophobicContact CG2-CG1 4.12Å; V425-I440 HydrophobicContact CG1-CD1 4.32Å; V425-I440 HydrophobicContact CG1-CG2 3.65Å; I429-I440 HydrophobicContact CG1-CD1 4.26Å; E436-I440 WeakPolarHBondContact O-CG1 3.29Å; E436-I440 PolarHBondContact O-N 3.05Å; L437-I440 PolarHBondContact O-N 3.37Å; I440-F442 VanDerWaalsContact C-N 3.29Å; I440-F442 PolarHBondContact O-N 2.91Å; I440-A443 WeakPolarHBondContact O-CB 3.35Å; I440-A443 PolarHBondContact O-N 3.49Å; I440-A443 VanDerWaalsContact O-N 3.1Å; I440-V444 HydrophobicContact CG2-CG2 4.16Å; I440-V444 VanDerWaalsContact O-CG2 3.31Å; I440-V444 WeakPolarHBondContact O-CG2 3.47Å; I440-V444 PolarHBondContact O-N 3.12Å; I440-L469 HydrophobicContact CB-CD2 4.11Å; I440-L469 HydrophobicContact CG2-CD1 4.02Å; I440-L469 HydrophobicContact CG2-CD2 3.94Å
441	S	91.1	Very high	88	Confident	5 Å²	5	38.5 Å²	38.5	4%	0.035	19%	0.188	C	C	.	.	H	α-helix	trans	-60.3	-39.9	179	77.3	0	0	0	0	111.8	L437 N438 V444 A445 W497	L437-S441 PolarHBondContact O-N 3.34Å; N438-S441 PolarHBondContact O-N 2.81Å; N438-S441 PolarHBondContact O-OG 3.38Å; S441-V444 PolarHBondContact O-N 3.31Å; S441-A445 WeakPolarHBondContact O-CB 3.45Å; S441-A445 PolarHBondContact O-N 2.86Å; S441-W497 VanDerWaalsContact CB-CD2 3.5Å
442	F	88.8	Confident	87.1	Confident	138 Å²	138	36.7 Å²	36.7	61%	0.605	19%	0.187	S	C	*	.	H	α-helix	trans	-62	-43.7	173.3	-175.9	-95	0	0	0	112.5	N438 T439 I440 V444 A445 K446	N438-F442 PolarHBondContact O-N 3.48Å; N438-F442 VanDerWaalsContact O-N 3.11Å; T439-F442 PolarHBondContact O-N 2.85Å; I440-F442 VanDerWaalsContact C-N 3.29Å; I440-F442 PolarHBondContact O-N 2.91Å; F442-V444 VanDerWaalsContact C-N 3.35Å; F442-V444 PolarHBondContact O-N 3Å; F442-A445 PolarHBondContact O-N 3.36Å; F442-K446 PolarHBondContact O-N 3.5Å
443	A	89.9	Confident	86.1	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-61.1	-44.1	176.2	0	0	0	0	0	111.7	T406 A410 T439 I440 K446 W447	T406-A443 HydrophobicContact CG2-CB 3.66Å; A410-A443 HydrophobicContact CB-CB 3.66Å; T439-A443 PolarHBondContact O-N 3.33Å; T439-A443 VanDerWaalsContact O-N 3.16Å; I440-A443 WeakPolarHBondContact O-CB 3.35Å; I440-A443 PolarHBondContact O-N 3.49Å; I440-A443 VanDerWaalsContact O-N 3.1Å; A443-K446 PolarHBondContact O-N 3.34Å; A443-W447 PolarHBondContact O-N 3.24Å
444	V	88.3	Confident	84.9	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-64.3	-45	177.3	175.5	0	0	0	0	111.4	I440 S441 F442 K446 W447 I448 Y462 L465 L466	I440-V444 HydrophobicContact CG2-CG2 4.16Å; I440-V444 VanDerWaalsContact O-CG2 3.31Å; I440-V444 WeakPolarHBondContact O-CG2 3.47Å; I440-V444 PolarHBondContact O-N 3.12Å; S441-V444 PolarHBondContact O-N 3.31Å; F442-V444 VanDerWaalsContact C-N 3.35Å; F442-V444 PolarHBondContact O-N 3Å; V444-K446 PolarHBondContact O-N 2.95Å; V444-W447 HydrophobicContact CB-CE3 4.48Å; V444-W447 HydrophobicContact CG2-CE3 4.05Å; V444-W447 HydrophobicContact CG2-CZ3 4.07Å; V444-W447 PolarHBondContact O-N 2.92Å; V444-W447 VanDerWaalsContact O-N 3.14Å; V444-I448 HydrophobicContact CG1-CD1 4.1Å; V444-I448 WeakPolarHBondContact O-CG1 3.34Å; V444-I448 PolarHBondContact O-N 3.25Å; V444-Y462 HydrophobicContact CG1-CD1 4.22Å; V444-L465 HydrophobicContact CG2-CD2 3.47Å; V444-L465 VanDerWaalsContact CG2-CD2 3.47Å; V444-L465 HydrophobicContact CG2-CG 4.31Å; V444-L466 HydrophobicContact CB-CD2 4.25Å; V444-L466 HydrophobicContact CG1-CD1 4.28Å; V444-L466 HydrophobicContact CG1-CD2 3.88Å; V444-L466 HydrophobicContact CG1-CG 3.83Å
445	A	86.8	Confident	83.6	Confident	35 Å²	35	52.6 Å²	52.6	29%	0.289	25%	0.254	S	S	.	.	H	α-helix	trans	-58.6	-38.5	175.7	0	0	0	0	0	111.7	S441 F442 I448 R449	S441-A445 WeakPolarHBondContact O-CB 3.45Å; S441-A445 PolarHBondContact O-N 2.86Å; F442-A445 PolarHBondContact O-N 3.36Å; A445-I448 PolarHBondContact O-N 3.17Å; A445-R449 WeakPolarHBondContact O-CG 3.47Å; A445-R449 PolarHBondContact O-N 3.27Å
446	K	86.3	Confident	82.2	Confident	61 Å²	61	59 Å²	59	27%	0.265	28%	0.281	S	S	.	.	H	α-helix	trans	-67.3	-42.5	175.3	-171.6	168.5	175.5	-161.9	0	112.1	A410 M411 F442 A443 V444 I448 R449 T450	A410-K446 WeakPolarHBondContact O-CD 3.22Å; A410-K446 WeakPolarHBondContact O-CE 3.5Å; A410-K446 PolarHBondContact O-NZ 3.27Å; M411-K446 VanDerWaalsContact CA-NZ 3.31Å; M411-K446 PolarHBondContact O-NZ 3.45Å; F442-K446 PolarHBondContact O-N 3.5Å; A443-K446 PolarHBondContact O-N 3.34Å; V444-K446 PolarHBondContact O-N 2.95Å; K446-I448 VanDerWaalsContact C-N 3.34Å; K446-I448 PolarHBondContact O-N 3.27Å; K446-R449 PolarHBondContact O-N 3.05Å; K446-T450 PolarHBondContact O-N 3.05Å; K446-T450 VanDerWaalsContact O-N 3.14Å; K446-T450 PolarHBondContact O-OG1 3.16Å
447	W	85.5	Confident	80.6	Confident	14 Å²	14	62.9 Å²	62.9	5%	0.053	30%	0.302	C	S	.	.	H	α-helix	trans	-60.5	-42.2	175.2	-66.9	-31.6	0	0	0	112.7	T406 A410 L417 V421 A443 V444 R449 T450 D451 Y462	T406-W447 HydrophobicContact CG2-CH2 3.63Å; T406-W447 HydrophobicContact CG2-CZ2 4.18Å; T406-W447 HydrophobicContact CG2-CZ3 4.34Å; A410-W447 HydrophobicContact CB-CZ2 4.34Å; L417-W447 HydrophobicContact CD1-CD2 3.72Å; L417-W447 HydrophobicContact CD1-CE3 3.72Å; L417-W447 HydrophobicContact CD1-CG 4.46Å; L417-W447 HydrophobicContact CD1-CH2 3.6Å; L417-W447 HydrophobicContact CD1-CZ2 3.62Å; L417-W447 HydrophobicContact CD1-CZ3 3.66Å; L417-W447 HydrophobicContact CD2-CD2 4.23Å; L417-W447 HydrophobicContact CD2-CE3 3.58Å; L417-W447 HydrophobicContact CD2-CH2 4.49Å; L417-W447 HydrophobicContact CD2-CZ3 3.74Å; L417-W447 HydrophobicContact CG-CD2 4.45Å; L417-W447 HydrophobicContact CG-CE3 4.23Å; L417-W447 HydrophobicContact CG-CZ3 4.37Å; V421-W447 HydrophobicContact CG1-CH2 4.21Å; A443-W447 PolarHBondContact O-N 3.24Å; V444-W447 HydrophobicContact CB-CE3 4.48Å; V444-W447 HydrophobicContact CG2-CE3 4.05Å; V444-W447 HydrophobicContact CG2-CZ3 4.07Å; V444-W447 PolarHBondContact O-N 2.92Å; V444-W447 VanDerWaalsContact O-N 3.14Å; W447-R449 VanDerWaalsContact C-N 3.29Å; W447-R449 PolarHBondContact O-N 3.07Å; W447-T450 WeakPolarHBondContact CA-OG1 3.45Å; W447-T450 PolarHBondContact O-N 3.47Å; W447-T450 VanDerWaalsContact O-N 3.16Å; W447-T450 PolarHBondContact O-OG1 3.05Å; W447-D451 WeakPolarHBondContact O-CB 3.34Å; W447-D451 PolarHBondContact O-N 3.38Å; W447-Y462 HydrophobicContact CB-CD1 4.42Å; W447-Y462 HydrophobicContact CB-CE1 3.73Å; W447-Y462 HydrophobicContact CE3-CE1 4.44Å
448	I	83.4	Confident	78.6	Confident	27 Å²	27	68.8 Å²	68.8	14%	0.138	34%	0.338	C	S	.	.	H	α-helix	trans	-56.7	-44.1	175	-70	168	0	0	0	111	V444 A445 K446 T450 Y454 Y462 L466	V444-I448 HydrophobicContact CG1-CD1 4.1Å; V444-I448 WeakPolarHBondContact O-CG1 3.34Å; V444-I448 PolarHBondContact O-N 3.25Å; A445-I448 PolarHBondContact O-N 3.17Å; K446-I448 VanDerWaalsContact C-N 3.34Å; K446-I448 PolarHBondContact O-N 3.27Å; I448-T450 VanDerWaalsContact C-N 3.32Å; I448-T450 PolarHBondContact O-N 3.29Å; I448-Y454 HydrophobicContact CD1-CE2 4.43Å; I448-Y454 HydrophobicContact CG1-CD2 4.34Å; I448-Y454 HydrophobicContact CG1-CE2 4.16Å; I448-Y454 HydrophobicContact CG2-CD1 3.67Å; I448-Y454 HydrophobicContact CG2-CD2 3.89Å; I448-Y454 HydrophobicContact CG2-CE1 3.56Å; I448-Y454 HydrophobicContact CG2-CE2 3.78Å; I448-Y454 HydrophobicContact CG2-CG 3.84Å; I448-Y462 HydrophobicContact CD1-CG 4.49Å; I448-Y462 HydrophobicContact CG1-CD1 4.19Å; I448-Y462 HydrophobicContact CG1-CD2 4.16Å; I448-Y462 HydrophobicContact CG1-CG 3.77Å; I448-L466 HydrophobicContact CD1-CD1 3.74Å
449	R	82.3	Confident	76.9	Confident	189 Å²	189	76.9 Å²	76.9	71%	0.713	38%	0.375	S	S	*	.	H	α-helix	trans	-67.5	-30.7	179.9	-69.2	174.2	-172.7	-179.3	2.7	112.9	A445 K446 W447 E496	A445-R449 WeakPolarHBondContact O-CG 3.47Å; A445-R449 PolarHBondContact O-N 3.27Å; K446-R449 PolarHBondContact O-N 3.05Å; W447-R449 VanDerWaalsContact C-N 3.29Å; W447-R449 PolarHBondContact O-N 3.07Å; R449-E496 IonicContact NH2-OE2 2.84Å
450	T	79.8	Confident	75.9	Confident	68 Å²	68	76.1 Å²	76.1	42%	0.417	37%	0.371	S	S	.	.	H	α-helix	trans	-89.5	-19.8	-177.6	52.3	0	0	0	0	114.4	K446 W447 I448 P452	K446-T450 PolarHBondContact O-N 3.05Å; K446-T450 VanDerWaalsContact O-N 3.14Å; K446-T450 PolarHBondContact O-OG1 3.16Å; W447-T450 WeakPolarHBondContact CA-OG1 3.45Å; W447-T450 PolarHBondContact O-N 3.47Å; W447-T450 VanDerWaalsContact O-N 3.16Å; W447-T450 PolarHBondContact O-OG1 3.05Å; I448-T450 VanDerWaalsContact C-N 3.32Å; I448-T450 PolarHBondContact O-N 3.29Å; T450-P452 VanDerWaalsContact O-CD 3.27Å; T450-P452 WeakPolarHBondContact O-CD 3.36Å
451	D	76.6	Confident	75.2	Confident	9 Å²	9	79.8 Å²	79.8	5%	0.048	39%	0.387	C	S	.	.			trans	-86.2	110.2	-175.6	-168.1	-24.3	0	0	0	111.2	W447 S453 Y454 Y462	W447-D451 WeakPolarHBondContact O-CB 3.34Å; W447-D451 PolarHBondContact O-N 3.38Å; D451-S453 VanDerWaalsContact CG-OG 3.26Å; D451-S453 PolarHBondContact O-N 3.38Å; D451-S453 VanDerWaalsContact OD1-CB 3.31Å; D451-S453 WeakPolarHBondContact OD1-CB 3.34Å; D451-S453 PolarHBondContact OD1-N 2.57Å; D451-S453 PolarHBondContact OD1-OG 3.08Å; D451-S453 PolarHBondContact OD2-OG 3.05Å; D451-Y454 WeakPolarHBondContact O-CB 3.08Å; D451-Y454 PolarHBondContact O-N 2.73Å; D451-Y462 HydrophobicContact CB-CE2 4.41Å; D451-Y462 WeakPolarHBondContact OD2-CE2 3.23Å; D451-Y462 PolarHBondContact OD2-OH 3.29Å
452	P	72.1	Confident	74.7	Confident	87 Å²	87	79.7 Å²	79.7	57%	0.565	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-66	-21.3	-179.2	26.7	-33.2	0	0	0	112.9	T450 Y454	T450-P452 VanDerWaalsContact O-CD 3.27Å; T450-P452 WeakPolarHBondContact O-CD 3.36Å; P452-Y454 VanDerWaalsContact C-N 3.3Å; P452-Y454 PolarHBondContact O-N 2.93Å
453	S	69.9	Low	74.5	Confident	63 Å²	63	75.2 Å²	75.2	44%	0.441	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-74	-20.1	179.9	72.5	0	0	0	0	113.4	D451 R455 H456	D451-S453 VanDerWaalsContact CG-OG 3.26Å; D451-S453 PolarHBondContact O-N 3.38Å; D451-S453 VanDerWaalsContact OD1-CB 3.31Å; D451-S453 WeakPolarHBondContact OD1-CB 3.34Å; D451-S453 PolarHBondContact OD1-N 2.57Å; D451-S453 PolarHBondContact OD1-OG 3.08Å; D451-S453 PolarHBondContact OD2-OG 3.05Å; S453-R455 VanDerWaalsContact C-N 3.27Å; S453-R455 PolarHBondContact O-N 3.14Å; S453-H456 PolarHBondContact O-N 3.32Å; S453-H456 VanDerWaalsContact O-N 3.16Å
454	Y	66.6	Low	74.3	Confident	87 Å²	87	83.6 Å²	83.6	34%	0.341	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-61.3	-34.4	-179.3	-175.9	-96.8	0	0	0	112.7	I448 D451 P452 H456 N457 S460 Y462	I448-Y454 HydrophobicContact CD1-CE2 4.43Å; I448-Y454 HydrophobicContact CG1-CD2 4.34Å; I448-Y454 HydrophobicContact CG1-CE2 4.16Å; I448-Y454 HydrophobicContact CG2-CD1 3.67Å; I448-Y454 HydrophobicContact CG2-CD2 3.89Å; I448-Y454 HydrophobicContact CG2-CE1 3.56Å; I448-Y454 HydrophobicContact CG2-CE2 3.78Å; I448-Y454 HydrophobicContact CG2-CG 3.84Å; D451-Y454 WeakPolarHBondContact O-CB 3.08Å; D451-Y454 PolarHBondContact O-N 2.73Å; P452-Y454 VanDerWaalsContact C-N 3.3Å; P452-Y454 PolarHBondContact O-N 2.93Å; Y454-H456 PolarHBondContact O-N 3.09Å; Y454-H456 VanDerWaalsContact O-N 3.07Å; Y454-N457 PolarHBondContact O-N 3.46Å; Y454-S460 WeakPolarHBondContact CD2-OG 3.27Å; Y454-S460 VanDerWaalsContact CE2-OG 3.3Å; Y454-S460 WeakPolarHBondContact CE2-OG 3.04Å; Y454-Y462 HydrophobicContact CD2-CD2 4.18Å
455	R	62	Low	74.3	Confident	225 Å²	225	83.9 Å²	83.9	85%	0.849	40%	0.403	S	S	*	.	G	3₁₀ helix	trans	-62.7	-17	179.7	-66.6	-174.3	179.7	-173.2	0	113.8	S453	S453-R455 VanDerWaalsContact C-N 3.27Å; S453-R455 PolarHBondContact O-N 3.14Å
456	H	61	Low	74.4	Confident	164 Å²	164	84.3 Å²	84.3	76%	0.759	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-114.4	-6	-171.7	-60.9	-64.9	0	0	0	114.1	S453 Y454	S453-H456 PolarHBondContact O-N 3.32Å; S453-H456 VanDerWaalsContact O-N 3.16Å; Y454-H456 PolarHBondContact O-N 3.09Å; Y454-H456 VanDerWaalsContact O-N 3.07Å
457	N	57.5	Low	74.6	Confident	102 Å²	102	87.3 Å²	87.3	55%	0.545	42%	0.415	S	S	.	.			trans	-143.1	102.6	-175.2	-151.1	-8.2	0	0	0	112.7	Y454 H459	Y454-N457 PolarHBondContact O-N 3.46Å; N457-H459 VanDerWaalsContact C-N 3.3Å; N457-H459 PolarHBondContact O-N 3.09Å
458	T	50	Low	74.9	Confident	125 Å²	125	90.6 Å²	90.6	77%	0.767	43%	0.428	S	S	*	.	S	Bend	trans	-68.9	-23.4	-175.1	-30.9	0	0	0	0	113.4	S460	T458-S460 VanDerWaalsContact C-N 3.28Å; T458-S460 PolarHBondContact O-N 2.67Å
459	H	54.8	Low	75.3	Confident	179 Å²	179	89.3 Å²	89.3	83%	0.829	42%	0.421	S	S	*	.	S	Bend	trans	-91.9	42.1	178.9	-69.5	87.4	0	0	0	112.5	N457	N457-H459 VanDerWaalsContact C-N 3.3Å; N457-H459 PolarHBondContact O-N 3.09Å
460	S	70.1	Confident	75.8	Confident	17 Å²	17	80.4 Å²	80.4	12%	0.119	39%	0.388	C	S	.	.			trans	-73.6	145	-175.5	71.9	0	0	0	0	112	Y454 T458 Y462 V463	Y454-S460 WeakPolarHBondContact CD2-OG 3.27Å; Y454-S460 VanDerWaalsContact CE2-OG 3.3Å; Y454-S460 WeakPolarHBondContact CE2-OG 3.04Å; T458-S460 VanDerWaalsContact C-N 3.28Å; T458-S460 PolarHBondContact O-N 2.67Å; S460-Y462 PolarHBondContact O-N 3.08Å; S460-V463 WeakPolarHBondContact O-CB 3.43Å; S460-V463 PolarHBondContact O-N 2.79Å
461	K	76.2	Confident	76.5	Confident	79 Å²	79	82 Å²	82	34%	0.343	39%	0.391	S	S	.	.	H	α-helix	trans	-44.6	-30.9	171.5	56	-173.7	176.7	-178.8	0	114.2	L417 R464 L465	L417-K461 PolarHBondContact O-NZ 3.25Å; K461-R464 PolarHBondContact O-N 3.01Å; K461-L465 PolarHBondContact O-N 3.48Å; K461-L465 VanDerWaalsContact O-N 3.16Å
462	Y	81.8	Confident	77.4	Confident	4 Å²	4	82.2 Å²	82.2	2%	0.016	39%	0.392	C	S	.	.	H	α-helix	trans	-65.2	-37.8	177.2	-53.6	-73.8	0	0	0	113	L417 V444 W447 I448 D451 Y454 S460 L465 L466	L417-Y462 HydrophobicContact CB-CE1 3.9Å; L417-Y462 VanDerWaalsContact CB-OH 3.25Å; L417-Y462 WeakPolarHBondContact CB-OH 3.5Å; L417-Y462 HydrophobicContact CD2-CD1 4.16Å; L417-Y462 HydrophobicContact CD2-CE1 3.5Å; L417-Y462 VanDerWaalsContact CD2-CE1 3.5Å; L417-Y462 HydrophobicContact CG-CE1 4.33Å; V444-Y462 HydrophobicContact CG1-CD1 4.22Å; W447-Y462 HydrophobicContact CB-CD1 4.42Å; W447-Y462 HydrophobicContact CB-CE1 3.73Å; W447-Y462 HydrophobicContact CE3-CE1 4.44Å; I448-Y462 HydrophobicContact CD1-CG 4.49Å; I448-Y462 HydrophobicContact CG1-CD1 4.19Å; I448-Y462 HydrophobicContact CG1-CD2 4.16Å; I448-Y462 HydrophobicContact CG1-CG 3.77Å; D451-Y462 HydrophobicContact CB-CE2 4.41Å; D451-Y462 WeakPolarHBondContact OD2-CE2 3.23Å; D451-Y462 PolarHBondContact OD2-OH 3.29Å; Y454-Y462 HydrophobicContact CD2-CD2 4.18Å; S460-Y462 PolarHBondContact O-N 3.08Å; Y462-L465 PolarHBondContact O-N 2.9Å; Y462-L466 WeakPolarHBondContact O-CG 3.48Å; Y462-L466 PolarHBondContact O-N 3.06Å
463	V	83.3	Confident	78.4	Confident	44 Å²	44	78.1 Å²	78.1	27%	0.267	37%	0.366	S	S	.	.	H	α-helix	trans	-65.3	-43.7	178.8	176.9	0	0	0	0	110.5	S460 L465 L466 Q467	S460-V463 WeakPolarHBondContact O-CB 3.43Å; S460-V463 PolarHBondContact O-N 2.79Å; V463-L465 VanDerWaalsContact C-N 3.33Å; V463-L465 PolarHBondContact O-N 3.11Å; V463-L466 PolarHBondContact O-N 3.08Å; V463-Q467 HydrophobicContact CG1-CG 4.47Å; V463-Q467 WeakPolarHBondContact O-CB 3.37Å; V463-Q467 WeakPolarHBondContact O-CG 3.25Å; V463-Q467 PolarHBondContact O-N 3.37Å
464	R	86	Confident	79.5	Confident	177 Å²	177	80 Å²	80	67%	0.668	36%	0.363	S	S	*	.	H	α-helix	trans	-60.2	-44.5	175.8	-173.6	-175.4	-61.4	179.7	1.1	111.3	K461 Q467 R468	K461-R464 PolarHBondContact O-N 3.01Å; R464-Q467 PolarHBondContact O-N 3.02Å; R464-R468 PolarHBondContact O-N 3.43Å
465	L	88.1	Confident	80.8	Confident	6 Å²	6	80.1 Å²	80.1	3%	0.031	37%	0.367	C	S	.	.	H	α-helix	trans	-62.6	-45.1	178.1	-166.7	66	0	0	0	111.4	V425 D426 I429 V444 K461 Y462 V463 Q467 R468 L469	V425-L465 HydrophobicContact CG1-CD1 4.38Å; V425-L465 HydrophobicContact CG1-CD2 4.43Å; D426-L465 HydrophobicContact CB-CD1 3.84Å; I429-L465 HydrophobicContact CD1-CD1 3.34Å; I429-L465 HydrophobicContact CD1-CG 4.08Å; V444-L465 HydrophobicContact CG2-CD2 3.47Å; V444-L465 VanDerWaalsContact CG2-CD2 3.47Å; V444-L465 HydrophobicContact CG2-CG 4.31Å; K461-L465 PolarHBondContact O-N 3.48Å; K461-L465 VanDerWaalsContact O-N 3.16Å; Y462-L465 PolarHBondContact O-N 2.9Å; V463-L465 VanDerWaalsContact C-N 3.33Å; V463-L465 PolarHBondContact O-N 3.11Å; L465-Q467 PolarHBondContact O-N 2.84Å; L465-R468 PolarHBondContact O-N 2.72Å; L465-L469 WeakPolarHBondContact O-CB 3.42Å; L465-L469 VanDerWaalsContact O-CG 3.27Å; L465-L469 WeakPolarHBondContact O-CG 3.49Å; L465-L469 PolarHBondContact O-N 3.17Å
466	L	89.1	Confident	82.3	Confident	44 Å²	44	73.4 Å²	73.4	23%	0.23	34%	0.341	C	S	.	.	H	α-helix	trans	-62.9	-38.9	175.7	-72.7	172.8	0	0	0	112.8	V444 I448 Y462 V463 L469 S470	V444-L466 HydrophobicContact CB-CD2 4.25Å; V444-L466 HydrophobicContact CG1-CD1 4.28Å; V444-L466 HydrophobicContact CG1-CD2 3.88Å; V444-L466 HydrophobicContact CG1-CG 3.83Å; I448-L466 HydrophobicContact CD1-CD1 3.74Å; Y462-L466 WeakPolarHBondContact O-CG 3.48Å; Y462-L466 PolarHBondContact O-N 3.06Å; V463-L466 PolarHBondContact O-N 3.08Å; L466-L469 HydrophobicContact CD2-CD1 4.17Å; L466-S470 WeakPolarHBondContact O-CB 3.21Å; L466-S470 PolarHBondContact O-N 2.94Å; L466-S470 PolarHBondContact O-OG 3.17Å
467	Q	90.1	Very high	83.9	Confident	124 Å²	124	65.6 Å²	65.6	58%	0.579	31%	0.305	S	S	*	.	H	α-helix	trans	-63	-47	174.3	-75.5	173.2	-16	0	0	111.1	V463 R464 L465 S470 Q471	V463-Q467 HydrophobicContact CG1-CG 4.47Å; V463-Q467 WeakPolarHBondContact O-CB 3.37Å; V463-Q467 WeakPolarHBondContact O-CG 3.25Å; V463-Q467 PolarHBondContact O-N 3.37Å; R464-Q467 PolarHBondContact O-N 3.02Å; L465-Q467 PolarHBondContact O-N 2.84Å; Q467-S470 PolarHBondContact O-N 3.26Å; Q467-Q471 PolarHBondContact O-N 3.01Å
468	R	92.4	Very high	85.7	Confident	83 Å²	83	65.2 Å²	65.2	31%	0.313	30%	0.3	S	S	.	.	H	α-helix	trans	-63.8	-42.1	176.9	-74.2	-154.1	64.5	-154.3	-2.2	112.9	D426 R464 L465 S470 Q471 C472	D426-R468 PolarHBondContact O-NH1 2.9Å; D426-R468 VanDerWaalsContact OD1-CD 3.31Å; D426-R468 WeakPolarHBondContact OD1-CD 3.26Å; D426-R468 IonicContact OD1-CZ 3.75Å; D426-R468 IonicContact OD1-NE 3.89Å; D426-R468 IonicContact OD1-NH1 2.9Å; D426-R468 PolarHBondContact OD1-NH1 3.43Å; D426-R468 IonicContact OD2-CZ 3.21Å; D426-R468 IonicContact OD2-NH1 2.96Å; D426-R468 PolarHBondContact OD2-NH1 3.04Å; R464-R468 PolarHBondContact O-N 3.43Å; L465-R468 PolarHBondContact O-N 2.72Å; R468-S470 VanDerWaalsContact C-N 3.28Å; R468-S470 PolarHBondContact O-N 3.12Å; R468-Q471 PolarHBondContact O-N 3.41Å; R468-C472 WeakPolarHBondContact O-CB 3.45Å; R468-C472 PolarHBondContact O-N 3.43Å; R468-C472 PolarHBondContact O-SG 3.03Å
469	L	92.8	Very high	87.7	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-54.7	-46.9	172.1	-75.4	168.7	0	0	0	111.1	I429 L437 I440 L465 L466 C472 G473 W497	I429-L469 HydrophobicContact CB-CD2 4.45Å; I429-L469 HydrophobicContact CD1-CD2 3.45Å; I429-L469 VanDerWaalsContact CD1-CD2 3.45Å; I429-L469 HydrophobicContact CD1-CG 3.71Å; I429-L469 HydrophobicContact CG1-CD2 3.61Å; I429-L469 HydrophobicContact CG1-CG 4.4Å; I429-L469 HydrophobicContact CG2-CD2 3.98Å; L437-L469 HydrophobicContact CB-CD2 4.46Å; L437-L469 HydrophobicContact CD2-CD2 3.61Å; I440-L469 HydrophobicContact CB-CD2 4.11Å; I440-L469 HydrophobicContact CG2-CD1 4.02Å; I440-L469 HydrophobicContact CG2-CD2 3.94Å; L465-L469 WeakPolarHBondContact O-CB 3.42Å; L465-L469 VanDerWaalsContact O-CG 3.27Å; L465-L469 WeakPolarHBondContact O-CG 3.49Å; L465-L469 PolarHBondContact O-N 3.17Å; L466-L469 HydrophobicContact CD2-CD1 4.17Å; L469-C472 PolarHBondContact O-N 3.22Å; L469-G473 PolarHBondContact O-N 3.45Å; L469-W497 HydrophobicContact CB-CZ2 3.9Å
470	S	92.4	Very high	89.6	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.014	27%	0.266	C	S	.	.	H	α-helix	trans	-70.3	-33.2	-177.1	-52.6	0	0	0	0	112.6	L466 Q467 R468 R474 W497 M501	L466-S470 WeakPolarHBondContact O-CB 3.21Å; L466-S470 PolarHBondContact O-N 2.94Å; L466-S470 PolarHBondContact O-OG 3.17Å; Q467-S470 PolarHBondContact O-N 3.26Å; R468-S470 VanDerWaalsContact C-N 3.28Å; R468-S470 PolarHBondContact O-N 3.12Å; S470-R474 WeakPolarHBondContact O-CG 3.43Å; S470-R474 PolarHBondContact O-N 3.48Å; S470-R474 PolarHBondContact O-NE 3.07Å; S470-W497 PolarHBondContact OG-NE1 3.48Å; S470-M501 WeakPolarHBondContact OG-CE 2.81Å
471	Q	94.3	Very high	90.7	Very high	102 Å²	102	61.8 Å²	61.8	48%	0.477	29%	0.289	S	S	.	.	H	α-helix	trans	-67.8	-51	173	179.2	177.4	-0	0	0	110.9	Q467 R468 G473 R474 E475	Q467-Q471 PolarHBondContact O-N 3.01Å; R468-Q471 PolarHBondContact O-N 3.41Å; Q471-G473 VanDerWaalsContact C-N 3.3Å; Q471-G473 PolarHBondContact O-N 3.16Å; Q471-R474 PolarHBondContact O-N 3.08Å; Q471-R474 VanDerWaalsContact O-N 3.12Å; Q471-E475 HydrophobicContact CG-CG 4.4Å; Q471-E475 VanDerWaalsContact CG-OE1 3.23Å; Q471-E475 WeakPolarHBondContact CG-OE1 3.43Å; Q471-E475 PolarHBondContact NE2-OE1 2.95Å; Q471-E475 WeakPolarHBondContact O-CG 3.23Å; Q471-E475 PolarHBondContact O-N 3.44Å
472	C	94.2	Very high	91.4	Very high	13 Å²	13	62.2 Å²	62.2	9%	0.088	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-38.3	-179	-62.4	0	0	0	0	111.6	I429 L437 R468 L469 E475 R476	I429-C472 HydrophobicContact CG2-CB 3.92Å; L437-C472 HydrophobicContact CD1-CB 4.46Å; R468-C472 WeakPolarHBondContact O-CB 3.45Å; R468-C472 PolarHBondContact O-N 3.43Å; R468-C472 PolarHBondContact O-SG 3.03Å; L469-C472 PolarHBondContact O-N 3.22Å; C472-E475 PolarHBondContact O-N 2.98Å; C472-R476 VanDerWaalsContact O-CB 3.32Å; C472-R476 WeakPolarHBondContact O-CB 3.43Å; C472-R476 PolarHBondContact O-N 3.35Å
473	G	93.2	Very high	91.9	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.8	-41.9	174.5	0	0	0	0	0	113	L469 Q471 L477	L469-G473 PolarHBondContact O-N 3.45Å; Q471-G473 VanDerWaalsContact C-N 3.3Å; Q471-G473 PolarHBondContact O-N 3.16Å; G473-L477 WeakPolarHBondContact O-CG 3.42Å; G473-L477 PolarHBondContact O-N 3.09Å; G473-L477 VanDerWaalsContact O-N 3.11Å
474	R	94.3	Very high	92.1	Very high	104 Å²	104	62.7 Å²	62.7	39%	0.392	29%	0.29	S	S	.	.	H	α-helix	trans	-67.5	-47.2	175.7	-76.2	-175.6	-114.6	-154	-6.6	112.3	S470 Q471 R476 L477 Q478 L502 E505	S470-R474 WeakPolarHBondContact O-CG 3.43Å; S470-R474 PolarHBondContact O-N 3.48Å; S470-R474 PolarHBondContact O-NE 3.07Å; Q471-R474 PolarHBondContact O-N 3.08Å; Q471-R474 VanDerWaalsContact O-N 3.12Å; R474-R476 PolarHBondContact O-N 2.88Å; R474-L477 PolarHBondContact O-N 3.36Å; R474-Q478 WeakPolarHBondContact O-CB 3.25Å; R474-Q478 VanDerWaalsContact O-CG 3.25Å; R474-Q478 WeakPolarHBondContact O-CG 3.44Å; R474-Q478 PolarHBondContact O-N 2.96Å; R474-L502 HydrophobicContact CG-CD2 3.83Å; R474-E505 HydrophobicContact CG-CB 4.45Å; R474-E505 HydrophobicContact CG-CG 4.31Å
475	E	94.3	Very high	92.1	Very high	89 Å²	89	57.6 Å²	57.6	42%	0.416	28%	0.276	S	S	.	.	H	α-helix	trans	-57.6	-40.9	177.4	-72.4	171.4	-176.3	0	0	111.3	Q471 C472 Q478 T479	Q471-E475 HydrophobicContact CG-CG 4.4Å; Q471-E475 VanDerWaalsContact CG-OE1 3.23Å; Q471-E475 WeakPolarHBondContact CG-OE1 3.43Å; Q471-E475 PolarHBondContact NE2-OE1 2.95Å; Q471-E475 WeakPolarHBondContact O-CG 3.23Å; Q471-E475 PolarHBondContact O-N 3.44Å; C472-E475 PolarHBondContact O-N 2.98Å; E475-Q478 PolarHBondContact O-N 2.72Å; E475-T479 WeakPolarHBondContact O-CB 3.4Å; E475-T479 WeakPolarHBondContact O-CG2 3.4Å; E475-T479 PolarHBondContact O-N 2.66Å; E475-T479 PolarHBondContact O-OG1 3.28Å
476	R	93.6	Very high	92.3	Very high	84 Å²	84	57.6 Å²	57.6	32%	0.317	28%	0.276	S	S	.	.	H	α-helix	trans	-64.3	-45.2	176.4	-170.4	174.1	-174.6	85.4	5.6	112.7	L434 C472 R474 T479 A480 E489	L434-R476 HydrophobicContact CD2-CB 4.43Å; C472-R476 VanDerWaalsContact O-CB 3.32Å; C472-R476 WeakPolarHBondContact O-CB 3.43Å; C472-R476 PolarHBondContact O-N 3.35Å; R474-R476 PolarHBondContact O-N 2.88Å; R476-T479 PolarHBondContact O-N 3.36Å; R476-T479 PolarHBondContact O-OG1 3.37Å; R476-A480 WeakPolarHBondContact O-CB 3.32Å; R476-A480 PolarHBondContact O-N 2.86Å; R476-E489 IonicContact CZ-OE1 3.61Å; R476-E489 IonicContact CZ-OE2 2.83Å; R476-E489 IonicContact NE-OE1 3.79Å; R476-E489 PolarHBondContact NE-OE1 3.48Å; R476-E489 IonicContact NE-OE2 2.62Å; R476-E489 PolarHBondContact NE-OE2 3.36Å; R476-E489 IonicContact NH2-OE1 2.98Å; R476-E489 PolarHBondContact NH2-OE1 2.91Å; R476-E489 IonicContact NH2-OE2 2.75Å
477	L	94.5	Very high	92.4	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.7	-44.7	175.5	-75.7	168.6	0	0	0	111.4	L434 G473 R474 T479 A480 V486 L502 E505 T506 T509 R512	L434-L477 HydrophobicContact CD1-CD2 3.61Å; L434-L477 HydrophobicContact CD1-CG 4.09Å; L434-L477 HydrophobicContact CD2-CG 4.16Å; G473-L477 WeakPolarHBondContact O-CG 3.42Å; G473-L477 PolarHBondContact O-N 3.09Å; G473-L477 VanDerWaalsContact O-N 3.11Å; R474-L477 PolarHBondContact O-N 3.36Å; L477-T479 VanDerWaalsContact C-N 3.29Å; L477-T479 PolarHBondContact O-N 2.74Å; L477-A480 PolarHBondContact O-N 3.19Å; L477-V486 HydrophobicContact CD2-CG1 4.34Å; L477-L502 HydrophobicContact CD1-CB 4.18Å; L477-L502 HydrophobicContact CD1-CD2 4.42Å; L477-E505 HydrophobicContact CB-CG 3.87Å; L477-E505 HydrophobicContact CD1-CB 4.01Å; L477-E505 HydrophobicContact CD1-CG 4.03Å; L477-T506 WeakPolarHBondContact CD1-OG1 3.49Å; L477-T509 HydrophobicContact CD2-CG2 4.42Å; L477-T509 WeakPolarHBondContact O-CG2 3.31Å; L477-T509 PolarHBondContact O-OG1 2.88Å; L477-R512 PolarHBondContact O-NH2 2.81Å; L477-R512 VanDerWaalsContact O-NH2 3.11Å
478	Q	93.8	Very high	92.2	Very high	93 Å²	93	53.5 Å²	53.5	44%	0.435	26%	0.256	S	S	.	.	H	α-helix	trans	-62.6	-34.7	179.1	-73.6	172.8	-2.3	0	0	112.9	R474 E475 E505 R512	R474-Q478 WeakPolarHBondContact O-CB 3.25Å; R474-Q478 VanDerWaalsContact O-CG 3.25Å; R474-Q478 WeakPolarHBondContact O-CG 3.44Å; R474-Q478 PolarHBondContact O-N 2.96Å; E475-Q478 PolarHBondContact O-N 2.72Å; Q478-E505 HydrophobicContact CG-CG 4.35Å; Q478-E505 WeakPolarHBondContact CG-OE1 3.27Å; Q478-E505 PolarHBondContact NE2-OE1 3.19Å; Q478-E505 PolarHBondContact NE2-OE2 3.35Å; Q478-R512 PolarHBondContact O-NH1 2.95Å; Q478-R512 PolarHBondContact O-NH2 3.35Å; Q478-R512 VanDerWaalsContact O-NH2 3.09Å
479	T	93.3	Very high	91.9	Very high	114 Å²	114	51.1 Å²	51.1	70%	0.699	25%	0.248	S	C	*	.	H	α-helix	trans	-89	-11.8	-179.9	52.3	0	0	0	0	114.1	E475 R476 L477	E475-T479 WeakPolarHBondContact O-CB 3.4Å; E475-T479 WeakPolarHBondContact O-CG2 3.4Å; E475-T479 PolarHBondContact O-N 2.66Å; E475-T479 PolarHBondContact O-OG1 3.28Å; R476-T479 PolarHBondContact O-N 3.36Å; R476-T479 PolarHBondContact O-OG1 3.37Å; L477-T479 VanDerWaalsContact C-N 3.29Å; L477-T479 PolarHBondContact O-N 2.74Å
480	A	93.6	Very high	91.7	Very high	21 Å²	21	51.2 Å²	51.2	17%	0.174	25%	0.248	C	C	.	.			trans	-68.2	132.1	-177.3	0	0	0	0	0	113.3	R476 L477 V486 T509 R512	R476-A480 WeakPolarHBondContact O-CB 3.32Å; R476-A480 PolarHBondContact O-N 2.86Å; L477-A480 PolarHBondContact O-N 3.19Å; A480-V486 HydrophobicContact CB-CG2 3.47Å; A480-V486 VanDerWaalsContact CB-CG2 3.47Å; A480-T509 HydrophobicContact CB-CG2 4.44Å; A480-R512 PolarHBondContact O-NH2 2.65Å
481	D	92.8	Very high	91.1	Very high	114 Å²	114	53.9 Å²	53.9	61%	0.61	26%	0.26	S	S	*	.			trans	-121.9	-6.2	-175.2	65.8	-20.6	0	0	0	113.9	M513 Q516	D481-M513 WeakPolarHBondContact O-CE 3.49Å; D481-Q516 PolarHBondContact O-NE2 3.33Å; D481-Q516 PolarHBondContact O-OE1 3.33Å
482	R	91.6	Very high	89.7	Confident	88 Å²	88	54 Å²	54	33%	0.332	26%	0.259	S	S	.	.			trans	-123.7	117.7	180	-65	-176.9	65.3	-174.9	3.8	113.5	T192 D484 L485 V486 M513	T192-R482 PolarHBondContact OG1-NH2 3.5Å; R482-D484 PolarHBondContact O-N 3.02Å; R482-L485 HydrophobicContact CB-CB 4.4Å; R482-L485 HydrophobicContact CB-CD1 4.02Å; R482-L485 HydrophobicContact CB-CG 4.1Å; R482-L485 PolarHBondContact O-N 3.24Å; R482-V486 PolarHBondContact O-N 3.05Å; R482-M513 VanDerWaalsContact CA-CE 3.47Å
483	L	92.4	Very high	88.3	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-43.4	-171.8	178.1	59	0	0	0	111.6	L485 V486 L487 L510 M513 Q516 I517	L483-L485 VanDerWaalsContact C-N 3.27Å; L483-L485 PolarHBondContact O-N 3.48Å; L483-V486 PolarHBondContact O-N 3.14Å; L483-V486 VanDerWaalsContact O-N 3.15Å; L483-L487 HydrophobicContact CD1-CD1 4.04Å; L483-L487 HydrophobicContact CD1-CD2 4.36Å; L483-L487 HydrophobicContact CD1-CG 3.9Å; L483-L487 HydrophobicContact CD2-CD1 4.44Å; L483-L487 HydrophobicContact CG-CD1 3.84Å; L483-L487 HydrophobicContact CG-CG 4.16Å; L483-L487 WeakPolarHBondContact O-CG 3.41Å; L483-L487 PolarHBondContact O-N 3.24Å; L483-L510 HydrophobicContact CD1-CD2 3.5Å; L483-M513 HydrophobicContact CB-CE 4.03Å; L483-Q516 HydrophobicContact CB-CB 3.95Å; L483-Q516 HydrophobicContact CD2-CB 4.26Å; L483-I517 HydrophobicContact CD2-CG1 3.74Å
484	D	87.6	Confident	86.8	Confident	57 Å²	57	57.8 Å²	57.8	31%	0.305	28%	0.283	S	S	.	.	H	α-helix	trans	-58.7	-38.9	-178.2	-51.9	-33.1	0	0	0	112.3	R482 E488 N521	R482-D484 PolarHBondContact O-N 3.02Å; D484-E488 WeakPolarHBondContact O-CB 3.38Å; D484-E488 PolarHBondContact O-N 2.94Å; D484-N521 VanDerWaalsContact OD1-CB 3.25Å; D484-N521 WeakPolarHBondContact OD1-CB 3.38Å; D484-N521 PolarHBondContact OD1-ND2 3.29Å
485	L	86.6	Confident	85.6	Confident	70 Å²	70	54.2 Å²	54.2	37%	0.366	28%	0.279	S	S	.	.	H	α-helix	trans	-69.6	-43.2	178.3	-63.1	-178	0	0	0	111.2	R482 L483 L487 E488 E489	R482-L485 HydrophobicContact CB-CB 4.4Å; R482-L485 HydrophobicContact CB-CD1 4.02Å; R482-L485 HydrophobicContact CB-CG 4.1Å; R482-L485 PolarHBondContact O-N 3.24Å; L483-L485 VanDerWaalsContact C-N 3.27Å; L483-L485 PolarHBondContact O-N 3.48Å; L485-L487 VanDerWaalsContact C-N 3.33Å; L485-L487 PolarHBondContact O-N 3.31Å; L485-E488 PolarHBondContact O-N 3.43Å; L485-E489 WeakPolarHBondContact O-CG 3.43Å; L485-E489 PolarHBondContact O-N 2.99Å
486	V	91.7	Very high	84.9	Confident	6 Å²	6	56.2 Å²	56.2	4%	0.036	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-44.6	176.5	176.4	0	0	0	0	110.4	L477 A480 R482 L483 E488 E489 I490	L477-V486 HydrophobicContact CD2-CG1 4.34Å; A480-V486 HydrophobicContact CB-CG2 3.47Å; A480-V486 VanDerWaalsContact CB-CG2 3.47Å; R482-V486 PolarHBondContact O-N 3.05Å; L483-V486 PolarHBondContact O-N 3.14Å; L483-V486 VanDerWaalsContact O-N 3.15Å; V486-E488 PolarHBondContact O-N 3.27Å; V486-E489 PolarHBondContact O-N 2.93Å; V486-I490 HydrophobicContact CG1-CD1 4.35Å; V486-I490 HydrophobicContact CG1-CG2 4.43Å; V486-I490 WeakPolarHBondContact O-CG1 3.2Å; V486-I490 WeakPolarHBondContact O-CG2 3.34Å; V486-I490 PolarHBondContact O-N 3.45Å
487	L	90.6	Very high	84.6	Confident	5 Å²	5	53.6 Å²	53.6	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-61.2	-43.5	177.1	-70.8	177	0	0	0	111.7	L483 L485 E489 I490 K491 L510 N521 D524 L525	L483-L487 HydrophobicContact CD1-CD1 4.04Å; L483-L487 HydrophobicContact CD1-CD2 4.36Å; L483-L487 HydrophobicContact CD1-CG 3.9Å; L483-L487 HydrophobicContact CD2-CD1 4.44Å; L483-L487 HydrophobicContact CG-CD1 3.84Å; L483-L487 HydrophobicContact CG-CG 4.16Å; L483-L487 WeakPolarHBondContact O-CG 3.41Å; L483-L487 PolarHBondContact O-N 3.24Å; L485-L487 VanDerWaalsContact C-N 3.33Å; L485-L487 PolarHBondContact O-N 3.31Å; L487-E489 VanDerWaalsContact C-N 3.31Å; L487-E489 PolarHBondContact O-N 3.04Å; L487-I490 HydrophobicContact CD2-CD1 4.09Å; L487-I490 PolarHBondContact O-N 3.11Å; L487-K491 VanDerWaalsContact O-CB 3.3Å; L487-K491 WeakPolarHBondContact O-CB 3.31Å; L487-K491 PolarHBondContact O-N 3.33Å; L487-L510 HydrophobicContact CD2-CD2 4.34Å; L487-N521 HydrophobicContact CD1-CB 3.91Å; L487-D524 HydrophobicContact CD1-CB 4.4Å; L487-L525 HydrophobicContact CD1-CB 4.08Å; L487-L525 HydrophobicContact CD2-CB 4.16Å; L487-L525 HydrophobicContact CD2-CD1 3.96Å
488	E	85.3	Confident	84.1	Confident	76 Å²	76	53.7 Å²	53.7	36%	0.355	28%	0.279	S	S	.	.	H	α-helix	trans	-58.3	-43.6	175.5	-169.1	-173.6	162.6	0	0	111.5	K228 D484 L485 V486 K491	K228-E488 WeakPolarHBondContact CD-OE1 3.39Å; D484-E488 WeakPolarHBondContact O-CB 3.38Å; D484-E488 PolarHBondContact O-N 2.94Å; L485-E488 PolarHBondContact O-N 3.43Å; V486-E488 PolarHBondContact O-N 3.27Å; E488-K491 WeakPolarHBondContact O-CB 3.12Å
489	E	88.1	Confident	83.7	Confident	34 Å²	34	52.8 Å²	52.8	16%	0.159	28%	0.275	C	S	.	.	H	α-helix	trans	-71.2	-36.7	-178.9	-68.4	-176.2	-155.2	0	0	113.5	N433 L434 S435 R476 L485 V486 L487	N433-E489 HydrophobicContact CB-CG 3.99Å; N433-E489 WeakPolarHBondContact CB-OE2 3.37Å; L434-E489 HydrophobicContact CB-CB 4.04Å; L434-E489 HydrophobicContact CD1-CB 4.32Å; L434-E489 HydrophobicContact CG-CB 4.44Å; L434-E489 WeakPolarHBondContact CG-OE2 3.48Å; L434-E489 PolarHBondContact N-OE2 2.92Å; S435-E489 WeakPolarHBondContact CB-O 3.39Å; S435-E489 PolarHBondContact N-O 3.01Å; R476-E489 IonicContact CZ-OE1 3.61Å; R476-E489 IonicContact CZ-OE2 2.83Å; R476-E489 IonicContact NE-OE1 3.79Å; R476-E489 PolarHBondContact NE-OE1 3.48Å; R476-E489 IonicContact NE-OE2 2.62Å; R476-E489 PolarHBondContact NE-OE2 3.36Å; R476-E489 IonicContact NH2-OE1 2.98Å; R476-E489 PolarHBondContact NH2-OE1 2.91Å; R476-E489 IonicContact NH2-OE2 2.75Å; L485-E489 WeakPolarHBondContact O-CG 3.43Å; L485-E489 PolarHBondContact O-N 2.99Å; V486-E489 PolarHBondContact O-N 2.93Å; L487-E489 VanDerWaalsContact C-N 3.31Å; L487-E489 PolarHBondContact O-N 3.04Å
490	I	87.9	Confident	83.3	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-86.8	-14.8	-179.9	71.3	-173.1	0	0	0	112.9	L434 V486 L487 F492 A493 F498 T506 F528 R531	L434-I490 HydrophobicContact CD1-CG2 3.62Å; V486-I490 HydrophobicContact CG1-CD1 4.35Å; V486-I490 HydrophobicContact CG1-CG2 4.43Å; V486-I490 WeakPolarHBondContact O-CG1 3.2Å; V486-I490 WeakPolarHBondContact O-CG2 3.34Å; V486-I490 PolarHBondContact O-N 3.45Å; L487-I490 HydrophobicContact CD2-CD1 4.09Å; L487-I490 PolarHBondContact O-N 3.11Å; I490-F492 PolarHBondContact O-N 2.7Å; I490-F492 VanDerWaalsContact O-N 3.08Å; I490-A493 PolarHBondContact O-N 2.92Å; I490-A493 VanDerWaalsContact O-N 3.11Å; I490-F498 HydrophobicContact CB-CZ 4.25Å; I490-F498 HydrophobicContact CG2-CE2 4.05Å; I490-F498 HydrophobicContact CG2-CZ 3.88Å; I490-T506 HydrophobicContact CD1-CG2 4.17Å; I490-F528 HydrophobicContact CB-CD2 4.4Å; I490-F528 HydrophobicContact CB-CE2 4.06Å; I490-F528 HydrophobicContact CD1-CD1 4.2Å; I490-F528 HydrophobicContact CD1-CD2 3.64Å; I490-F528 HydrophobicContact CD1-CE1 4.07Å; I490-F528 HydrophobicContact CD1-CE2 3.5Å; I490-F528 HydrophobicContact CD1-CG 4Å; I490-F528 HydrophobicContact CD1-CZ 3.73Å; I490-F528 HydrophobicContact CG1-CD2 3.76Å; I490-F528 HydrophobicContact CG1-CE2 3.8Å; I490-F528 HydrophobicContact CG1-CG 4.44Å; I490-R531 PolarHBondContact O-NH2 3Å
491	K	79.1	Confident	83.1	Confident	58 Å²	58	56.9 Å²	56.9	25%	0.252	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-35.1	177.6	-172.5	166.3	-175.4	154.2	0	112.2	L487 E488 D524 R531	L487-K491 VanDerWaalsContact O-CB 3.3Å; L487-K491 WeakPolarHBondContact O-CB 3.31Å; L487-K491 PolarHBondContact O-N 3.33Å; E488-K491 WeakPolarHBondContact O-CB 3.12Å; K491-D524 IonicContact NZ-OD1 3.46Å; K491-D524 PolarHBondContact NZ-OD1 3.22Å; K491-D524 IonicContact NZ-OD2 3.59Å; K491-R531 PolarHBondContact O-NH1 3.25Å
492	F	65.1	Low	83.1	Confident	106 Å²	106	51.5 Å²	51.5	47%	0.465	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.4	25.1	-178.9	-54.7	-74.1	0	0	0	114.3	Q265 I490 P494	Q265-F492 VanDerWaalsContact NE2-CE1 3.32Å; Q265-F492 VanDerWaalsContact NE2-CZ 3.29Å; I490-F492 PolarHBondContact O-N 2.7Å; I490-F492 VanDerWaalsContact O-N 3.08Å; F492-P494 WeakPolarHBondContact O-CD 3.42Å
493	A	65.1	Low	83	Confident	2 Å²	2	47.8 Å²	47.8	2%	0.017	24%	0.241	C	C	.	.			trans	-98.7	72.8	174.9	0	0	0	0	0	112.4	N438 I490 F498	N438-A493 HydrophobicContact CB-CB 4.18Å; I490-A493 PolarHBondContact O-N 2.92Å; I490-A493 VanDerWaalsContact O-N 3.11Å; A493-F498 HydrophobicContact CB-CD2 3.8Å; A493-F498 HydrophobicContact CB-CE2 4.06Å; A493-F498 HydrophobicContact CB-CG 4.16Å
494	P	60.8	Low	83	Confident	89 Å²	89	52.4 Å²	52.4	58%	0.578	26%	0.263	S	S	*	.			trans	-83.1	142.9	168.4	35.4	-33	0	0	0	109.9	N438 F492	N438-P494 PolarHBondContact ND2-O 3.4Å; N438-P494 PolarHBondContact OD1-O 3.13Å; F492-P494 WeakPolarHBondContact O-CD 3.42Å
495	G	70.7	Confident	83.3	Confident	30 Å²	30	51.8 Å²	51.8	31%	0.309	26%	0.258	S	S	.	.	S	Bend	trans	148	154.4	164.6	0	0	0	0	0	113.9	W497 F498 E499	G495-W497 PolarHBondContact O-N 2.7Å; G495-F498 PolarHBondContact O-N 3.25Å; G495-E499 WeakPolarHBondContact O-CG 3.15Å; G495-E499 PolarHBondContact O-N 2.97Å
496	E	78.6	Confident	83.6	Confident	130 Å²	130	48.5 Å²	48.5	61%	0.607	24%	0.241	S	C	*	.	H	α-helix	trans	-53.2	-42.7	177.6	-65.3	172	169.4	0	0	111.1	R449 F498 E499 E500	R449-E496 IonicContact NH2-OE2 2.84Å; E496-F498 PolarHBondContact O-N 2.95Å; E496-E499 PolarHBondContact O-N 3.14Å; E496-E500 WeakPolarHBondContact O-CB 3.5Å; E496-E500 VanDerWaalsContact O-CG 3.28Å; E496-E500 WeakPolarHBondContact O-CG 3.29Å; E496-E500 PolarHBondContact O-N 3.3Å
497	W	86.7	Confident	83.7	Confident	30 Å²	30	48.5 Å²	48.5	11%	0.114	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-45.7	179.4	175.3	81.2	0	0	0	113.5	L437 N438 S441 L469 S470 G495 E499 E500 M501 L502	L437-W497 HydrophobicContact CB-CH2 4.02Å; L437-W497 HydrophobicContact CB-CZ3 4.35Å; N438-W497 HydrophobicContact CB-CE3 4.28Å; N438-W497 HydrophobicContact CB-CZ3 4.12Å; S441-W497 VanDerWaalsContact CB-CD2 3.5Å; L469-W497 HydrophobicContact CB-CZ2 3.9Å; S470-W497 PolarHBondContact OG-NE1 3.48Å; G495-W497 PolarHBondContact O-N 2.7Å; W497-E499 VanDerWaalsContact C-N 3.34Å; W497-E500 PolarHBondContact O-N 3.36Å; W497-M501 HydrophobicContact CG-CG 4.29Å; W497-M501 VanDerWaalsContact O-CB 3.22Å; W497-M501 WeakPolarHBondContact O-CB 3.37Å; W497-M501 WeakPolarHBondContact O-CG 3.43Å; W497-M501 PolarHBondContact O-N 3.46Å; W497-L502 HydrophobicContact CH2-CD1 3.47Å; W497-L502 VanDerWaalsContact CH2-CD1 3.47Å; W497-L502 HydrophobicContact CH2-CG 4.12Å; W497-L502 HydrophobicContact CZ2-CD1 4.28Å; W497-L502 HydrophobicContact CZ2-CG 4.48Å; W497-L502 HydrophobicContact CZ3-CD1 3.64Å; W497-L502 HydrophobicContact CZ3-CG 4.38Å
498	F	85.5	Confident	83.9	Confident	1 Å²	1	52.6 Å²	52.6	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-63.8	-44.8	179	-179.2	-87.8	0	0	0	110.4	I490 A493 G495 E496 E500 L502 L503 T506 F528 I532	I490-F498 HydrophobicContact CB-CZ 4.25Å; I490-F498 HydrophobicContact CG2-CE2 4.05Å; I490-F498 HydrophobicContact CG2-CZ 3.88Å; A493-F498 HydrophobicContact CB-CD2 3.8Å; A493-F498 HydrophobicContact CB-CE2 4.06Å; A493-F498 HydrophobicContact CB-CG 4.16Å; G495-F498 PolarHBondContact O-N 3.25Å; E496-F498 PolarHBondContact O-N 2.95Å; F498-E500 PolarHBondContact O-N 3.48Å; F498-L502 HydrophobicContact CD2-CB 4.16Å; F498-L502 HydrophobicContact CD2-CD1 3.97Å; F498-L502 HydrophobicContact CE2-CB 4.2Å; F498-L502 HydrophobicContact CE2-CD1 4.21Å; F498-L502 PolarHBondContact O-N 2.93Å; F498-L503 HydrophobicContact CE1-CD1 4.41Å; F498-L503 PolarHBondContact O-N 3.15Å; F498-L503 VanDerWaalsContact O-N 3.15Å; F498-T506 HydrophobicContact CZ-CG2 4.28Å; F498-F528 HydrophobicContact CE1-CE2 4.36Å; F498-F528 HydrophobicContact CE1-CZ 4.45Å; F498-I532 HydrophobicContact CE1-CD1 4.48Å
499	E	84.2	Confident	84.4	Confident	74 Å²	74	49 Å²	49	35%	0.346	25%	0.249	S	C	.	.	H	α-helix	trans	-64.2	-38.2	179.6	-66.7	-172.1	177	0	0	113	G495 E496 W497 L503 K778	G495-E499 WeakPolarHBondContact O-CG 3.15Å; G495-E499 PolarHBondContact O-N 2.97Å; E496-E499 PolarHBondContact O-N 3.14Å; W497-E499 VanDerWaalsContact C-N 3.34Å; E499-L503 WeakPolarHBondContact O-CB 3.24Å; E499-K778 IonicContact OE1-NZ 2.68Å; E499-K778 PolarHBondContact OE1-NZ 2.86Å; E499-K778 IonicContact OE2-NZ 2.77Å; E499-K778 PolarHBondContact OE2-NZ 2.99Å
500	E	86.3	Confident	84.7	Confident	150 Å²	150	47.5 Å²	47.5	70%	0.701	24%	0.241	S	C	*	.	H	α-helix	trans	-80.4	-40	-179.5	-71.6	175.8	-177.1	0	0	112.7	E496 W497 F498	E496-E500 WeakPolarHBondContact O-CB 3.5Å; E496-E500 VanDerWaalsContact O-CG 3.28Å; E496-E500 WeakPolarHBondContact O-CG 3.29Å; E496-E500 PolarHBondContact O-N 3.3Å; W497-E500 PolarHBondContact O-N 3.36Å; F498-E500 PolarHBondContact O-N 3.48Å
501	M	89.1	Confident	85.1	Confident	72 Å²	72	50.2 Å²	50.2	36%	0.355	26%	0.256	S	S	.	.	H	α-helix	trans	-101.1	-29.2	-166.5	-58.2	-60.6	-79.5	0	0	114.1	S470 W497	S470-M501 WeakPolarHBondContact OG-CE 2.81Å; W497-M501 HydrophobicContact CG-CG 4.29Å; W497-M501 VanDerWaalsContact O-CB 3.22Å; W497-M501 WeakPolarHBondContact O-CB 3.37Å; W497-M501 WeakPolarHBondContact O-CG 3.43Å; W497-M501 PolarHBondContact O-N 3.46Å
502	L	91.8	Very high	85.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.8	-11.3	-170.2	-61.9	-174.6	0	0	0	114.3	L434 R474 L477 W497 F498 E504 E505 T506	L434-L502 HydrophobicContact CD2-CD1 4.19Å; R474-L502 HydrophobicContact CG-CD2 3.83Å; L477-L502 HydrophobicContact CD1-CB 4.18Å; L477-L502 HydrophobicContact CD1-CD2 4.42Å; W497-L502 HydrophobicContact CH2-CD1 3.47Å; W497-L502 VanDerWaalsContact CH2-CD1 3.47Å; W497-L502 HydrophobicContact CH2-CG 4.12Å; W497-L502 HydrophobicContact CZ2-CD1 4.28Å; W497-L502 HydrophobicContact CZ2-CG 4.48Å; W497-L502 HydrophobicContact CZ3-CD1 3.64Å; W497-L502 HydrophobicContact CZ3-CG 4.38Å; F498-L502 HydrophobicContact CD2-CB 4.16Å; F498-L502 HydrophobicContact CD2-CD1 3.97Å; F498-L502 HydrophobicContact CE2-CB 4.2Å; F498-L502 HydrophobicContact CE2-CD1 4.21Å; F498-L502 PolarHBondContact O-N 2.93Å; L502-E504 PolarHBondContact O-N 3.3Å; L502-E505 PolarHBondContact O-N 3.12Å; L502-T506 WeakPolarHBondContact O-CB 3.41Å; L502-T506 PolarHBondContact O-N 2.9Å; L502-T506 PolarHBondContact O-OG1 3.29Å
503	L	90.2	Very high	87.4	Confident	10 Å²	10	48.9 Å²	48.9	5%	0.052	25%	0.247	C	C	.	.	H	α-helix	trans	-60.9	-47.7	-171.1	-170.5	62.8	0	0	0	113.3	F498 E499 T506 F507 I532	F498-L503 HydrophobicContact CE1-CD1 4.41Å; F498-L503 PolarHBondContact O-N 3.15Å; F498-L503 VanDerWaalsContact O-N 3.15Å; E499-L503 WeakPolarHBondContact O-CB 3.24Å; L503-T506 WeakPolarHBondContact O-CB 3.45Å; L503-T506 PolarHBondContact O-N 2.75Å; L503-F507 HydrophobicContact CD1-CD2 4.06Å; L503-F507 HydrophobicContact CD1-CE2 3.6Å; L503-F507 HydrophobicContact CD2-CE2 4.46Å; L503-F507 HydrophobicContact CG-CD2 4.03Å; L503-F507 HydrophobicContact CG-CE2 3.85Å; L503-F507 VanDerWaalsContact O-CD2 3.27Å; L503-F507 WeakPolarHBondContact O-CD2 3.43Å; L503-F507 PolarHBondContact O-N 3.02Å; L503-I532 HydrophobicContact CD1-CD1 3.97Å; L503-I532 HydrophobicContact CD1-CG1 4.3Å; L503-I532 HydrophobicContact CD1-CG2 3.73Å; L503-I532 HydrophobicContact CD2-CG2 4.21Å
504	E	91.6	Very high	88.9	Confident	99 Å²	99	50.6 Å²	50.6	46%	0.463	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-48	179.1	-63.5	-53.8	140.1	0	0	111.6	L502 T506 F507 V508 R534	L502-E504 PolarHBondContact O-N 3.3Å; E504-T506 VanDerWaalsContact C-N 3.25Å; E504-T506 PolarHBondContact O-N 2.97Å; E504-F507 PolarHBondContact O-N 3.29Å; E504-V508 WeakPolarHBondContact O-CG2 3.39Å; E504-V508 PolarHBondContact O-N 3.37Å; E504-R534 IonicContact OE1-CZ 3.29Å; E504-R534 VanDerWaalsContact OE1-CZ 3.26Å; E504-R534 IonicContact OE1-NH1 2.86Å; E504-R534 PolarHBondContact OE1-NH1 3.18Å; E504-R534 IonicContact OE1-NH2 3.33Å; E504-R534 PolarHBondContact OE1-NH2 3.33Å; E504-R534 IonicContact OE2-CZ 3.24Å; E504-R534 VanDerWaalsContact OE2-CZ 3.31Å; E504-R534 IonicContact OE2-NH1 2.7Å; E504-R534 PolarHBondContact OE2-NH1 3.1Å; E504-R534 IonicContact OE2-NH2 3.14Å; E504-R534 PolarHBondContact OE2-NH2 3.06Å
505	E	93.7	Very high	90.6	Very high	45 Å²	45	52.8 Å²	52.8	21%	0.21	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-35.6	177.4	-166.4	70.2	-134.4	0	0	111.6	R474 L477 Q478 L502 V508 T509	R474-E505 HydrophobicContact CG-CB 4.45Å; R474-E505 HydrophobicContact CG-CG 4.31Å; L477-E505 HydrophobicContact CB-CG 3.87Å; L477-E505 HydrophobicContact CD1-CB 4.01Å; L477-E505 HydrophobicContact CD1-CG 4.03Å; Q478-E505 HydrophobicContact CG-CG 4.35Å; Q478-E505 WeakPolarHBondContact CG-OE1 3.27Å; Q478-E505 PolarHBondContact NE2-OE1 3.19Å; Q478-E505 PolarHBondContact NE2-OE2 3.35Å; L502-E505 PolarHBondContact O-N 3.12Å; E505-V508 PolarHBondContact O-N 3.05Å; E505-T509 WeakPolarHBondContact O-CB 3.05Å; E505-T509 PolarHBondContact O-N 3.12Å; E505-T509 PolarHBondContact O-OG1 3.26Å
506	T	93.7	Very high	91.7	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.2	-47.1	175.8	-57.1	0	0	0	0	110.2	L477 I490 F498 L502 L503 E504 V508 T509 L510 F528	L477-T506 WeakPolarHBondContact CD1-OG1 3.49Å; I490-T506 HydrophobicContact CD1-CG2 4.17Å; F498-T506 HydrophobicContact CZ-CG2 4.28Å; L502-T506 WeakPolarHBondContact O-CB 3.41Å; L502-T506 PolarHBondContact O-N 2.9Å; L502-T506 PolarHBondContact O-OG1 3.29Å; L503-T506 WeakPolarHBondContact O-CB 3.45Å; L503-T506 PolarHBondContact O-N 2.75Å; E504-T506 VanDerWaalsContact C-N 3.25Å; E504-T506 PolarHBondContact O-N 2.97Å; T506-V508 PolarHBondContact O-N 3.25Å; T506-T509 WeakPolarHBondContact O-CB 3.45Å; T506-T509 PolarHBondContact O-N 3.21Å; T506-L510 HydrophobicContact CG2-CD1 4.05Å; T506-L510 HydrophobicContact CG2-CG 4.3Å; T506-L510 WeakPolarHBondContact O-CB 3.2Å; T506-L510 VanDerWaalsContact O-CG 3.26Å; T506-L510 WeakPolarHBondContact O-CG 3.08Å; T506-L510 PolarHBondContact O-N 3.33Å; T506-F528 HydrophobicContact CG2-CE1 4.37Å; T506-F528 HydrophobicContact CG2-CZ 3.94Å
507	F	93.2	Very high	92.6	Very high	7 Å²	7	49.1 Å²	49.1	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-66.3	-37.4	177.6	-82.6	-73.5	0	0	0	113	L503 E504 T509 L510 N511 L529 I532 R534 N536 L539	L503-F507 HydrophobicContact CD1-CD2 4.06Å; L503-F507 HydrophobicContact CD1-CE2 3.6Å; L503-F507 HydrophobicContact CD2-CE2 4.46Å; L503-F507 HydrophobicContact CG-CD2 4.03Å; L503-F507 HydrophobicContact CG-CE2 3.85Å; L503-F507 VanDerWaalsContact O-CD2 3.27Å; L503-F507 WeakPolarHBondContact O-CD2 3.43Å; L503-F507 PolarHBondContact O-N 3.02Å; E504-F507 PolarHBondContact O-N 3.29Å; F507-T509 VanDerWaalsContact C-N 3.31Å; F507-T509 PolarHBondContact O-N 3.11Å; F507-L510 PolarHBondContact O-N 3.46Å; F507-N511 WeakPolarHBondContact O-CB 3.31Å; F507-N511 VanDerWaalsContact O-CG 3.23Å; F507-N511 PolarHBondContact O-N 2.93Å; F507-N511 PolarHBondContact O-ND2 2.92Å; F507-N511 VanDerWaalsContact O-ND2 3.11Å; F507-L529 HydrophobicContact CE1-CD2 3.54Å; F507-L529 HydrophobicContact CZ-CD2 4.09Å; F507-I532 HydrophobicContact CE2-CG2 3.99Å; F507-I532 HydrophobicContact CZ-CG2 4.03Å; F507-R534 VanDerWaalsContact CD2-NH1 3.33Å; F507-R534 HydrophobicContact CE2-CB 4.28Å; F507-R534 HydrophobicContact CE2-CG 4.34Å; F507-R534 HydrophobicContact CZ-CB 4.08Å; F507-R534 HydrophobicContact CZ-CG 4.3Å; F507-N536 HydrophobicContact CD1-CB 4.09Å; F507-N536 WeakPolarHBondContact CD1-ND2 3.12Å; F507-N536 HydrophobicContact CE1-CB 3.87Å; F507-L539 HydrophobicContact CD1-CD1 4.22Å; F507-L539 HydrophobicContact CE1-CD1 4.47Å
508	V	95.3	Very high	92.9	Very high	90 Å²	90	50.2 Å²	50.2	55%	0.545	25%	0.245	S	C	.	.	H	α-helix	trans	-59.4	-45.8	172.2	172.2	0	0	0	0	110.5	E504 E505 T506 N511 R512	E504-V508 WeakPolarHBondContact O-CG2 3.39Å; E504-V508 PolarHBondContact O-N 3.37Å; E505-V508 PolarHBondContact O-N 3.05Å; T506-V508 PolarHBondContact O-N 3.25Å; V508-N511 PolarHBondContact O-N 2.92Å; V508-R512 PolarHBondContact O-N 3.21Å
509	T	95.6	Very high	93.2	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.006	25%	0.253	C	S	.	.	H	α-helix	trans	-63.5	-46.8	178.5	-57.4	0	0	0	0	111.7	L477 A480 E505 T506 F507 N511 R512 M513	L477-T509 HydrophobicContact CD2-CG2 4.42Å; L477-T509 WeakPolarHBondContact O-CG2 3.31Å; L477-T509 PolarHBondContact O-OG1 2.88Å; A480-T509 HydrophobicContact CB-CG2 4.44Å; E505-T509 WeakPolarHBondContact O-CB 3.05Å; E505-T509 PolarHBondContact O-N 3.12Å; E505-T509 PolarHBondContact O-OG1 3.26Å; T506-T509 WeakPolarHBondContact O-CB 3.45Å; T506-T509 PolarHBondContact O-N 3.21Å; F507-T509 VanDerWaalsContact C-N 3.31Å; F507-T509 PolarHBondContact O-N 3.11Å; T509-N511 PolarHBondContact O-N 3.19Å; T509-R512 WeakPolarHBondContact O-CB 3.47Å; T509-R512 PolarHBondContact O-N 3.34Å; T509-M513 HydrophobicContact CG2-SD 3.81Å; T509-M513 VanDerWaalsContact O-CG 3.31Å; T509-M513 WeakPolarHBondContact O-CG 3.39Å; T509-M513 PolarHBondContact O-N 2.99Å
510	L	95.6	Very high	93.3	Very high	2 Å²	2	51 Å²	51	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-61.9	-42.5	177.5	-68.5	175.3	0	0	0	111.6	L483 L487 T506 F507 R512 M513 I514 L525 F528 L539	L483-L510 HydrophobicContact CD1-CD2 3.5Å; L487-L510 HydrophobicContact CD2-CD2 4.34Å; T506-L510 HydrophobicContact CG2-CD1 4.05Å; T506-L510 HydrophobicContact CG2-CG 4.3Å; T506-L510 WeakPolarHBondContact O-CB 3.2Å; T506-L510 VanDerWaalsContact O-CG 3.26Å; T506-L510 WeakPolarHBondContact O-CG 3.08Å; T506-L510 PolarHBondContact O-N 3.33Å; F507-L510 PolarHBondContact O-N 3.46Å; L510-R512 PolarHBondContact O-N 2.86Å; L510-M513 CarbonylContact O-C 3.54Å; L510-M513 PolarHBondContact O-N 3.32Å; L510-M513 VanDerWaalsContact O-N 3.1Å; L510-I514 PolarHBondContact O-N 3.5Å; L510-L525 HydrophobicContact CD1-CD1 4.14Å; L510-L525 HydrophobicContact CD2-CD1 4.21Å; L510-F528 HydrophobicContact CD1-CD1 4.13Å; L510-F528 HydrophobicContact CD1-CE1 3.71Å; L510-L539 HydrophobicContact CB-CD1 3.91Å; L510-L539 HydrophobicContact CB-CD2 4.4Å; L510-L539 HydrophobicContact CD1-CD1 4.34Å
511	N	95.9	Very high	93.6	Very high	58 Å²	58	44 Å²	44	31%	0.31	23%	0.226	S	C	.	.	H	α-helix	trans	-64.5	-38	176.5	-75.1	-32.5	0	0	0	112.3	F507 V508 T509 M513 I514 N536 L539	F507-N511 WeakPolarHBondContact O-CB 3.31Å; F507-N511 VanDerWaalsContact O-CG 3.23Å; F507-N511 PolarHBondContact O-N 2.93Å; F507-N511 PolarHBondContact O-ND2 2.92Å; F507-N511 VanDerWaalsContact O-ND2 3.11Å; V508-N511 PolarHBondContact O-N 2.92Å; T509-N511 PolarHBondContact O-N 3.19Å; N511-M513 PolarHBondContact O-N 3.14Å; N511-I514 WeakPolarHBondContact O-CB 3.38Å; N511-I514 WeakPolarHBondContact O-CG2 3.35Å; N511-I514 PolarHBondContact O-N 3.28Å; N511-N536 PolarHBondContact ND2-ND2 3.06Å; N511-N536 PolarHBondContact OD1-ND2 3.41Å; N511-N536 VanDerWaalsContact OD1-ND2 3.09Å; N511-N536 PolarHBondContact OD1-OD1 3.42Å; N511-L539 WeakPolarHBondContact OD1-CG 3.28Å
512	R	95.9	Very high	93.8	Very high	131 Å²	131	40.7 Å²	40.7	49%	0.494	21%	0.209	S	C	.	.	H	α-helix	trans	-59.5	-25.4	174	179.8	179.5	67.4	-170.6	-3.8	112.3	L477 Q478 A480 V508 T509 L510	L477-R512 PolarHBondContact O-NH2 2.81Å; L477-R512 VanDerWaalsContact O-NH2 3.11Å; Q478-R512 PolarHBondContact O-NH1 2.95Å; Q478-R512 PolarHBondContact O-NH2 3.35Å; Q478-R512 VanDerWaalsContact O-NH2 3.09Å; A480-R512 PolarHBondContact O-NH2 2.65Å; V508-R512 PolarHBondContact O-N 3.21Å; T509-R512 WeakPolarHBondContact O-CB 3.47Å; T509-R512 PolarHBondContact O-N 3.34Å; L510-R512 PolarHBondContact O-N 2.86Å
513	M	96.1	Very high	93.9	Very high	6 Å²	6	41.6 Å²	41.6	3%	0.03	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	18.1	-171	-57.8	169.2	70.1	0	0	112.3	D481 R482 L483 T509 L510 N511 D515 Q516	D481-M513 WeakPolarHBondContact O-CE 3.49Å; R482-M513 VanDerWaalsContact CA-CE 3.47Å; L483-M513 HydrophobicContact CB-CE 4.03Å; T509-M513 HydrophobicContact CG2-SD 3.81Å; T509-M513 VanDerWaalsContact O-CG 3.31Å; T509-M513 WeakPolarHBondContact O-CG 3.39Å; T509-M513 PolarHBondContact O-N 2.99Å; L510-M513 CarbonylContact O-C 3.54Å; L510-M513 PolarHBondContact O-N 3.32Å; L510-M513 VanDerWaalsContact O-N 3.1Å; N511-M513 PolarHBondContact O-N 3.14Å; M513-D515 PolarHBondContact O-N 3.35Å; M513-D515 VanDerWaalsContact O-N 3.17Å; M513-Q516 WeakPolarHBondContact O-CB 3.45Å; M513-Q516 PolarHBondContact O-N 3.17Å
514	I	96.5	Very high	93.9	Very high	38 Å²	38	44 Å²	44	20%	0.195	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-56.2	-32.2	-177.5	-165.8	164.1	0	0	0	112.9	L510 N511 Q516 I517 P538 L539 R542	L510-I514 PolarHBondContact O-N 3.5Å; N511-I514 WeakPolarHBondContact O-CB 3.38Å; N511-I514 WeakPolarHBondContact O-CG2 3.35Å; N511-I514 PolarHBondContact O-N 3.28Å; I514-Q516 PolarHBondContact O-N 2.98Å; I514-I517 HydrophobicContact CG1-CD1 3.99Å; I514-I517 WeakPolarHBondContact O-CB 3.32Å; I514-I517 WeakPolarHBondContact O-CD1 3.48Å; I514-I517 VanDerWaalsContact O-CG1 3.26Å; I514-I517 WeakPolarHBondContact O-CG1 3.35Å; I514-I517 PolarHBondContact O-N 2.88Å; I514-P538 HydrophobicContact CD1-CB 4.06Å; I514-L539 HydrophobicContact CB-CD2 4.5Å; I514-L539 HydrophobicContact CD1-CD2 4.3Å; I514-L539 HydrophobicContact CG1-CD2 4.18Å; I514-R542 HydrophobicContact CD1-CB 4.1Å; I514-R542 HydrophobicContact CG1-CB 3.88Å; I514-R542 HydrophobicContact CG1-CG 3.87Å
515	D	95.9	Very high	94.1	Very high	134 Å²	134	39.3 Å²	39.3	72%	0.717	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-71.9	-14.9	179	-59.4	-41.8	0	0	0	113.2	M513 I517	M513-D515 PolarHBondContact O-N 3.35Å; M513-D515 VanDerWaalsContact O-N 3.17Å; D515-I517 VanDerWaalsContact C-N 3.33Å
516	Q	95.4	Very high	94.1	Very high	77 Å²	77	37.1 Å²	37.1	36%	0.36	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-86.8	-3.1	177.1	-55.9	-175.2	14.8	0	0	113.1	D481 L483 M513 I514 N518 N521	D481-Q516 PolarHBondContact O-NE2 3.33Å; D481-Q516 PolarHBondContact O-OE1 3.33Å; L483-Q516 HydrophobicContact CB-CB 3.95Å; L483-Q516 HydrophobicContact CD2-CB 4.26Å; M513-Q516 WeakPolarHBondContact O-CB 3.45Å; M513-Q516 PolarHBondContact O-N 3.17Å; I514-Q516 PolarHBondContact O-N 2.98Å; Q516-N518 PolarHBondContact O-N 3.47Å; Q516-N518 PolarHBondContact O-ND2 3.42Å; Q516-N521 PolarHBondContact O-ND2 2.87Å
517	I	96.2	Very high	94.1	Very high	7 Å²	7	41 Å²	41	4%	0.036	22%	0.215	C	C	.	.			trans	-66.3	124	176.7	-63.1	174.3	0	0	0	108.9	L483 I514 D515 N521 I522 L525 L539 R542 V546	L483-I517 HydrophobicContact CD2-CG1 3.74Å; I514-I517 HydrophobicContact CG1-CD1 3.99Å; I514-I517 WeakPolarHBondContact O-CB 3.32Å; I514-I517 WeakPolarHBondContact O-CD1 3.48Å; I514-I517 VanDerWaalsContact O-CG1 3.26Å; I514-I517 WeakPolarHBondContact O-CG1 3.35Å; I514-I517 PolarHBondContact O-N 2.88Å; D515-I517 VanDerWaalsContact C-N 3.33Å; I517-N521 WeakPolarHBondContact CA-OD1 3.48Å; I517-I522 HydrophobicContact CG2-CG2 3.59Å; I517-L525 HydrophobicContact CD1-CD2 3.52Å; I517-L525 HydrophobicContact CG1-CD2 3.84Å; I517-L539 HydrophobicContact CD1-CD2 4.01Å; I517-R542 HydrophobicContact CB-CG 4.07Å; I517-R542 HydrophobicContact CD1-CB 4.06Å; I517-R542 HydrophobicContact CD1-CG 3.75Å; I517-R542 HydrophobicContact CG1-CG 4.43Å; I517-R542 HydrophobicContact CG2-CG 4.3Å; I517-V546 HydrophobicContact CG2-CG2 4.21Å
518	N	93.2	Very high	94	Very high	53 Å²	53	40.9 Å²	40.9	28%	0.283	21%	0.214	S	C	.	.			trans	-148.4	168.7	-175	69	63	0	0	0	110.8	Q516 S520 N521 I522	Q516-N518 PolarHBondContact O-N 3.47Å; Q516-N518 PolarHBondContact O-ND2 3.42Å; N518-S520 PolarHBondContact O-N 3.38Å; N518-S520 WeakPolarHBondContact OD1-CB 3.25Å; N518-S520 PolarHBondContact OD1-N 3.32Å; N518-S520 PolarHBondContact OD1-OG 3.47Å; N518-N521 PolarHBondContact N-OD1 3.1Å; N518-N521 PolarHBondContact ND2-ND2 3.32Å; N518-N521 VanDerWaalsContact ND2-ND2 3.13Å; N518-N521 PolarHBondContact O-N 3.31Å; N518-N521 PolarHBondContact O-OD1 3.44Å; N518-I522 WeakPolarHBondContact O-CG2 3.42Å; N518-I522 PolarHBondContact O-N 3.11Å; N518-I522 VanDerWaalsContact O-N 3.15Å
519	P	91.7	Very high	93.9	Very high	27 Å²	27	36.6 Å²	36.6	18%	0.175	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-25.2	-175.2	-30.8	39.3	0	0	0	115.5	V546 H550 E553 I554	P519-V546 HydrophobicContact CG-CG1 4.39Å; P519-H550 HydrophobicContact CG-CB 3.43Å; P519-H550 VanDerWaalsContact CG-CB 3.43Å; P519-E553 HydrophobicContact CB-CB 3.96Å; P519-E553 HydrophobicContact CG-CB 4.13Å; P519-I554 HydrophobicContact CB-CG1 3.95Å
520	S	87.1	Confident	93.8	Very high	64 Å²	64	37.5 Å²	37.5	45%	0.448	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-23.2	-178.9	77.5	0	0	0	0	114.1	N518	N518-S520 PolarHBondContact O-N 3.38Å; N518-S520 WeakPolarHBondContact OD1-CB 3.25Å; N518-S520 PolarHBondContact OD1-N 3.32Å; N518-S520 PolarHBondContact OD1-OG 3.47Å
521	N	91.3	Very high	93.5	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.021	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-12.4	-173.5	66.9	24.1	0	0	0	115	D484 L487 Q516 I517 N518 A523 D524 L525	D484-N521 VanDerWaalsContact OD1-CB 3.25Å; D484-N521 WeakPolarHBondContact OD1-CB 3.38Å; D484-N521 PolarHBondContact OD1-ND2 3.29Å; L487-N521 HydrophobicContact CD1-CB 3.91Å; Q516-N521 PolarHBondContact O-ND2 2.87Å; I517-N521 WeakPolarHBondContact CA-OD1 3.48Å; N518-N521 PolarHBondContact N-OD1 3.1Å; N518-N521 PolarHBondContact ND2-ND2 3.32Å; N518-N521 VanDerWaalsContact ND2-ND2 3.13Å; N518-N521 PolarHBondContact O-N 3.31Å; N518-N521 PolarHBondContact O-OD1 3.44Å; N521-A523 PolarHBondContact O-N 2.93Å; N521-D524 PolarHBondContact O-N 3.17Å; N521-L525 PolarHBondContact O-N 3.34Å
522	I	94.4	Very high	93.2	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-55.4	-38.2	-179.5	61.1	169.3	0	0	0	113	I517 N518 L525 A526 V546 A547 I554 T562	I517-I522 HydrophobicContact CG2-CG2 3.59Å; N518-I522 WeakPolarHBondContact O-CG2 3.42Å; N518-I522 PolarHBondContact O-N 3.11Å; N518-I522 VanDerWaalsContact O-N 3.15Å; I522-L525 PolarHBondContact O-N 3.32Å; I522-A526 WeakPolarHBondContact O-CB 3.48Å; I522-A526 PolarHBondContact O-N 3.37Å; I522-V546 HydrophobicContact CG2-CB 4.33Å; I522-V546 HydrophobicContact CG2-CG1 3.8Å; I522-A547 HydrophobicContact CD1-CB 4.43Å; I522-I554 HydrophobicContact CD1-CD1 3.19Å; I522-I554 HydrophobicContact CD1-CG1 3.71Å; I522-I554 HydrophobicContact CD1-CG2 4.48Å; I522-T562 HydrophobicContact CD1-CG2 4.04Å
523	A	92.6	Very high	92.9	Very high	19 Å²	19	33.4 Å²	33.4	16%	0.157	18%	0.175	C	C	.	.	H	α-helix	trans	-69.9	-39.8	-175.9	0	0	0	0	0	111.5	N521 F527 A558 P561	N521-A523 PolarHBondContact O-N 2.93Å; A523-F527 WeakPolarHBondContact O-CB 3.44Å; A523-F527 PolarHBondContact O-N 2.91Å; A523-A558 HydrophobicContact CB-CB 4.2Å; A523-P561 HydrophobicContact CB-CB 4.25Å; A523-P561 HydrophobicContact CB-CG 3.8Å
524	D	91.1	Very high	92.5	Very high	61 Å²	61	35.5 Å²	35.5	33%	0.326	18%	0.183	S	C	.	.	H	α-helix	trans	-70.2	-40.5	176.9	-79.1	-35	0	0	0	110.9	L487 K491 N521 F528	L487-D524 HydrophobicContact CD1-CB 4.4Å; K491-D524 IonicContact NZ-OD1 3.46Å; K491-D524 PolarHBondContact NZ-OD1 3.22Å; K491-D524 IonicContact NZ-OD2 3.59Å; N521-D524 PolarHBondContact O-N 3.17Å; D524-F528 WeakPolarHBondContact O-CB 3.45Å; D524-F528 PolarHBondContact O-N 2.75Å
525	L	94.9	Very high	92.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.7	-48.5	175.1	179.6	62.7	0	0	0	111.8	L487 L510 I517 N521 I522 F527 F528 L529 I543	L487-L525 HydrophobicContact CD1-CB 4.08Å; L487-L525 HydrophobicContact CD2-CB 4.16Å; L487-L525 HydrophobicContact CD2-CD1 3.96Å; L510-L525 HydrophobicContact CD1-CD1 4.14Å; L510-L525 HydrophobicContact CD2-CD1 4.21Å; I517-L525 HydrophobicContact CD1-CD2 3.52Å; I517-L525 HydrophobicContact CG1-CD2 3.84Å; N521-L525 PolarHBondContact O-N 3.34Å; I522-L525 PolarHBondContact O-N 3.32Å; L525-F527 VanDerWaalsContact C-N 3.35Å; L525-F527 PolarHBondContact O-N 3.4Å; L525-F528 WeakPolarHBondContact O-CB 3.39Å; L525-F528 PolarHBondContact O-N 2.84Å; L525-L529 HydrophobicContact CG-CD1 4.49Å; L525-L529 WeakPolarHBondContact O-CG 3.38Å; L525-L529 PolarHBondContact O-N 3.21Å; L525-I543 HydrophobicContact CD2-CD1 3.91Å; L525-I543 HydrophobicContact CD2-CG1 4.02Å; L525-I543 HydrophobicContact CG-CD1 3.98Å
526	A	95.2	Very high	92.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.6	-46.1	178.6	0	0	0	0	0	111.2	I522 F528 L529 T530 I543 P561 P565	I522-A526 WeakPolarHBondContact O-CB 3.48Å; I522-A526 PolarHBondContact O-N 3.37Å; A526-F528 VanDerWaalsContact C-N 3.33Å; A526-F528 PolarHBondContact O-N 3.17Å; A526-L529 PolarHBondContact O-N 3.3Å; A526-T530 PolarHBondContact O-N 2.78Å; A526-T530 PolarHBondContact O-OG1 3.23Å; A526-T530 VanDerWaalsContact O-OG1 3.07Å; A526-I543 HydrophobicContact CB-CD1 4.36Å; A526-P561 WeakPolarHBondContact CB-O 3.42Å; A526-P565 HydrophobicContact CB-CG 3.84Å
527	F	92.3	Very high	92.1	Very high	81 Å²	81	28.8 Å²	28.8	36%	0.355	15%	0.153	S	C	.	.	H	α-helix	trans	-60.9	-40.9	175.1	-176.6	-96.1	0	0	0	112.4	A523 L525 T530 R531 P561 L564	A523-F527 WeakPolarHBondContact O-CB 3.44Å; A523-F527 PolarHBondContact O-N 2.91Å; L525-F527 VanDerWaalsContact C-N 3.35Å; L525-F527 PolarHBondContact O-N 3.4Å; F527-T530 PolarHBondContact O-N 3.21Å; F527-R531 WeakPolarHBondContact O-CB 3.31Å; F527-R531 PolarHBondContact O-N 2.86Å; F527-P561 HydrophobicContact CB-CB 4.41Å; F527-L564 HydrophobicContact CD2-CD1 3.85Å; F527-L564 HydrophobicContact CE2-CD1 4.45Å
528	F	92.4	Very high	92.1	Very high	5 Å²	5	31.8 Å²	31.8	2%	0.022	17%	0.173	C	C	.	.	H	α-helix	trans	-59.7	-48.7	175.5	171.5	-96.8	0	0	0	111.8	I490 F498 T506 L510 D524 L525 A526 T530 R531 I532	I490-F528 HydrophobicContact CB-CD2 4.4Å; I490-F528 HydrophobicContact CB-CE2 4.06Å; I490-F528 HydrophobicContact CD1-CD1 4.2Å; I490-F528 HydrophobicContact CD1-CD2 3.64Å; I490-F528 HydrophobicContact CD1-CE1 4.07Å; I490-F528 HydrophobicContact CD1-CE2 3.5Å; I490-F528 HydrophobicContact CD1-CG 4Å; I490-F528 HydrophobicContact CD1-CZ 3.73Å; I490-F528 HydrophobicContact CG1-CD2 3.76Å; I490-F528 HydrophobicContact CG1-CE2 3.8Å; I490-F528 HydrophobicContact CG1-CG 4.44Å; F498-F528 HydrophobicContact CE1-CE2 4.36Å; F498-F528 HydrophobicContact CE1-CZ 4.45Å; T506-F528 HydrophobicContact CG2-CE1 4.37Å; T506-F528 HydrophobicContact CG2-CZ 3.94Å; L510-F528 HydrophobicContact CD1-CD1 4.13Å; L510-F528 HydrophobicContact CD1-CE1 3.71Å; D524-F528 WeakPolarHBondContact O-CB 3.45Å; D524-F528 PolarHBondContact O-N 2.75Å; L525-F528 WeakPolarHBondContact O-CB 3.39Å; L525-F528 PolarHBondContact O-N 2.84Å; A526-F528 VanDerWaalsContact C-N 3.33Å; A526-F528 PolarHBondContact O-N 3.17Å; F528-T530 PolarHBondContact O-N 3.01Å; F528-R531 PolarHBondContact O-N 3.3Å; F528-I532 HydrophobicContact CD1-CG1 4.39Å; F528-I532 HydrophobicContact CD2-CG1 4.12Å; F528-I532 HydrophobicContact CE1-CG1 3.94Å; F528-I532 HydrophobicContact CE2-CD1 3.95Å; F528-I532 HydrophobicContact CE2-CG1 3.64Å; F528-I532 HydrophobicContact CG-CG1 4.46Å; F528-I532 HydrophobicContact CZ-CD1 4.07Å; F528-I532 HydrophobicContact CZ-CG1 3.54Å; F528-I532 WeakPolarHBondContact O-CG1 3.38Å; F528-I532 PolarHBondContact O-N 3.43Å
529	L	92.7	Very high	92.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.4	-45.7	179	-67.8	176.3	0	0	0	111.9	F507 L525 A526 R531 I532 N533 L539 M540 I543 P565	F507-L529 HydrophobicContact CE1-CD2 3.54Å; F507-L529 HydrophobicContact CZ-CD2 4.09Å; L525-L529 HydrophobicContact CG-CD1 4.49Å; L525-L529 WeakPolarHBondContact O-CG 3.38Å; L525-L529 PolarHBondContact O-N 3.21Å; A526-L529 PolarHBondContact O-N 3.3Å; L529-R531 VanDerWaalsContact C-N 3.34Å; L529-R531 PolarHBondContact O-N 2.94Å; L529-I532 PolarHBondContact O-N 2.91Å; L529-N533 PolarHBondContact O-N 3.39Å; L529-L539 HydrophobicContact CD1-CB 4.21Å; L529-L539 HydrophobicContact CD2-CD1 4.22Å; L529-M540 HydrophobicContact CD1-CG 4.14Å; L529-I543 HydrophobicContact CD1-CD1 3.65Å; L529-P565 HydrophobicContact CB-CB 4.45Å
530	T	93.1	Very high	92.5	Very high	20 Å²	20	28 Å²	28	12%	0.123	15%	0.151	C	C	.	.	H	α-helix	trans	-60.1	-43.5	176.7	-53.9	0	0	0	0	111.9	A526 F527 F528 N533 L564 P565 V568	A526-T530 PolarHBondContact O-N 2.78Å; A526-T530 PolarHBondContact O-OG1 3.23Å; A526-T530 VanDerWaalsContact O-OG1 3.07Å; F527-T530 PolarHBondContact O-N 3.21Å; F528-T530 PolarHBondContact O-N 3.01Å; T530-N533 PolarHBondContact O-N 3.02Å; T530-L564 HydrophobicContact CG2-CB 4.15Å; T530-L564 WeakPolarHBondContact OG1-CB 3.29Å; T530-P565 VanDerWaalsContact OG1-CA 3.29Å; T530-P565 WeakPolarHBondContact OG1-CA 3.4Å; T530-P565 WeakPolarHBondContact OG1-CD 3.11Å; T530-P565 VanDerWaalsContact OG1-N 3.1Å; T530-V568 HydrophobicContact CG2-CB 3.8Å; T530-V568 HydrophobicContact CG2-CG1 3.85Å; T530-V568 HydrophobicContact CG2-CG2 3.97Å
531	R	90.4	Very high	92.9	Very high	82 Å²	82	28 Å²	28	31%	0.309	14%	0.144	S	C	.	.	H	α-helix	trans	-66.2	-44.3	-179	-176.7	-173	66.4	175.5	-3	112.3	I490 K491 F527 F528 L529 N533	I490-R531 PolarHBondContact O-NH2 3Å; K491-R531 PolarHBondContact O-NH1 3.25Å; F527-R531 WeakPolarHBondContact O-CB 3.31Å; F527-R531 PolarHBondContact O-N 2.86Å; F528-R531 PolarHBondContact O-N 3.3Å; L529-R531 VanDerWaalsContact C-N 3.34Å; L529-R531 PolarHBondContact O-N 2.94Å; R531-N533 PolarHBondContact O-N 3.49Å
532	I	89.1	Confident	93.2	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.015	16%	0.157	C	C	.	.	H	α-helix	trans	-65.2	-26.9	177.9	-70.3	-59.1	0	0	0	111.3	F498 L503 F507 F528 L529 R534 K778	F498-I532 HydrophobicContact CE1-CD1 4.48Å; L503-I532 HydrophobicContact CD1-CD1 3.97Å; L503-I532 HydrophobicContact CD1-CG1 4.3Å; L503-I532 HydrophobicContact CD1-CG2 3.73Å; L503-I532 HydrophobicContact CD2-CG2 4.21Å; F507-I532 HydrophobicContact CE2-CG2 3.99Å; F507-I532 HydrophobicContact CZ-CG2 4.03Å; F528-I532 HydrophobicContact CD1-CG1 4.39Å; F528-I532 HydrophobicContact CD2-CG1 4.12Å; F528-I532 HydrophobicContact CE1-CG1 3.94Å; F528-I532 HydrophobicContact CE2-CD1 3.95Å; F528-I532 HydrophobicContact CE2-CG1 3.64Å; F528-I532 HydrophobicContact CG-CG1 4.46Å; F528-I532 HydrophobicContact CZ-CD1 4.07Å; F528-I532 HydrophobicContact CZ-CG1 3.54Å; F528-I532 WeakPolarHBondContact O-CG1 3.38Å; F528-I532 PolarHBondContact O-N 3.43Å; L529-I532 PolarHBondContact O-N 2.91Å; I532-R534 VanDerWaalsContact C-N 3.3Å; I532-R534 HydrophobicContact CG2-CB 3.8Å; I532-R534 PolarHBondContact O-N 2.99Å; I532-K778 VanDerWaalsContact O-CD 3.29Å; I532-K778 WeakPolarHBondContact O-CD 3.48Å; I532-K778 VanDerWaalsContact O-CE 3.29Å; I532-K778 WeakPolarHBondContact O-CE 3.42Å; I532-K778 PolarHBondContact O-NZ 3.15Å
533	N	89.3	Confident	93.3	Very high	20 Å²	20	31.4 Å²	31.4	11%	0.107	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	35.6	178.7	-174.3	57.4	0	0	0	112.5	L529 T530 R531 L569 F776 K778 K784	L529-N533 PolarHBondContact O-N 3.39Å; T530-N533 PolarHBondContact O-N 3.02Å; R531-N533 PolarHBondContact O-N 3.49Å; N533-L569 WeakPolarHBondContact OD1-CD2 3.39Å; N533-F776 PolarHBondContact ND2-O 2.94Å; N533-K778 HydrophobicContact CB-CG 4.4Å; N533-K778 WeakPolarHBondContact O-CB 3.41Å; N533-K778 PolarHBondContact O-N 3.02Å; N533-K784 VanDerWaalsContact CG-CE 3.43Å; N533-K784 WeakPolarHBondContact ND2-CE 3.49Å; N533-K784 PolarHBondContact ND2-NZ 3.3Å; N533-K784 WeakPolarHBondContact OD1-CE 3.21Å; N533-K784 PolarHBondContact OD1-NZ 3.49Å
534	R	88.8	Confident	93.5	Very high	50 Å²	50	30.7 Å²	30.7	19%	0.189	15%	0.151	C	C	.	.			trans	-123.7	134.6	175.5	-177.4	-179.7	174.9	-172.5	7.3	109.4	E504 F507 I532	E504-R534 IonicContact OE1-CZ 3.29Å; E504-R534 VanDerWaalsContact OE1-CZ 3.26Å; E504-R534 IonicContact OE1-NH1 2.86Å; E504-R534 PolarHBondContact OE1-NH1 3.18Å; E504-R534 IonicContact OE1-NH2 3.33Å; E504-R534 PolarHBondContact OE1-NH2 3.33Å; E504-R534 IonicContact OE2-CZ 3.24Å; E504-R534 VanDerWaalsContact OE2-CZ 3.31Å; E504-R534 IonicContact OE2-NH1 2.7Å; E504-R534 PolarHBondContact OE2-NH1 3.1Å; E504-R534 IonicContact OE2-NH2 3.14Å; E504-R534 PolarHBondContact OE2-NH2 3.06Å; F507-R534 VanDerWaalsContact CD2-NH1 3.33Å; F507-R534 HydrophobicContact CE2-CB 4.28Å; F507-R534 HydrophobicContact CE2-CG 4.34Å; F507-R534 HydrophobicContact CZ-CB 4.08Å; F507-R534 HydrophobicContact CZ-CG 4.3Å; I532-R534 VanDerWaalsContact C-N 3.3Å; I532-R534 HydrophobicContact CG2-CB 3.8Å; I532-R534 PolarHBondContact O-N 2.99Å
535	L	91.2	Very high	93.8	Very high	34 Å²	34	29.4 Å²	29.4	18%	0.178	15%	0.147	C	C	.	.			trans	-75.1	138.4	176.5	-69.2	169.7	0	0	0	111.1	M540 L569 Y571 C777 H782	L535-M540 HydrophobicContact CD2-SD 3.99Å; L535-L569 HydrophobicContact CD2-CB 3.69Å; L535-L569 HydrophobicContact CD2-CD1 4.15Å; L535-Y571 HydrophobicContact CD2-CD2 4.32Å; L535-C777 HydrophobicContact CD1-CB 4.25Å; L535-C777 HydrophobicContact CG-CB 4.15Å; L535-H782 HydrophobicContact CD1-CB 3.6Å
536	N	93.9	Very high	93.9	Very high	14 Å²	14	29.5 Å²	29.5	8%	0.075	15%	0.147	C	C	.	.			trans	-140.2	92.7	167	-179.2	-49.9	0	0	0	107.6	F507 N511 P538 L539 M540	F507-N536 HydrophobicContact CD1-CB 4.09Å; F507-N536 WeakPolarHBondContact CD1-ND2 3.12Å; F507-N536 HydrophobicContact CE1-CB 3.87Å; N511-N536 PolarHBondContact ND2-ND2 3.06Å; N511-N536 PolarHBondContact OD1-ND2 3.41Å; N511-N536 VanDerWaalsContact OD1-ND2 3.09Å; N511-N536 PolarHBondContact OD1-OD1 3.42Å; N536-P538 VanDerWaalsContact OD1-CD 3.24Å; N536-P538 WeakPolarHBondContact OD1-CD 3.26Å; N536-L539 HydrophobicContact CB-CB 4.35Å; N536-L539 HydrophobicContact CB-CD1 4.13Å; N536-L539 HydrophobicContact CB-CG 4.44Å; N536-L539 PolarHBondContact O-N 3.22Å; N536-L539 WeakPolarHBondContact OD1-CB 3.43Å; N536-L539 WeakPolarHBondContact OD1-CG 3.24Å; N536-L539 PolarHBondContact OD1-N 3.04Å; N536-M540 VanDerWaalsContact O-CG 3.25Å; N536-M540 WeakPolarHBondContact O-CG 3.48Å; N536-M540 PolarHBondContact O-N 3.46Å; N536-M540 VanDerWaalsContact O-N 3.08Å
537	P	94.4	Very high	93.9	Very high	60 Å²	60	29.5 Å²	29.5	39%	0.39	15%	0.147	S	C	.	.	H	α-helix	trans	-54.2	-46	-176.6	-25.9	34.2	0	0	0	113.9	L539 M540 E541 Y571	P537-L539 PolarHBondContact O-N 3.47Å; P537-M540 PolarHBondContact O-N 2.94Å; P537-M540 VanDerWaalsContact O-N 3.1Å; P537-E541 WeakPolarHBondContact O-CG 3.3Å; P537-E541 PolarHBondContact O-N 2.71Å; P537-Y571 HydrophobicContact CB-CE2 3.86Å; P537-Y571 HydrophobicContact CG-CE2 4.02Å
538	P	95.9	Very high	94.2	Very high	70 Å²	70	27 Å²	27	46%	0.455	14%	0.137	S	C	.	.	H	α-helix	trans	-54.6	-48	177.9	-27.4	34.2	0	0	0	114.3	I514 N536 M540 R542	I514-P538 HydrophobicContact CD1-CB 4.06Å; N536-P538 VanDerWaalsContact OD1-CD 3.24Å; N536-P538 WeakPolarHBondContact OD1-CD 3.26Å; P538-M540 VanDerWaalsContact C-N 3.32Å; P538-M540 PolarHBondContact O-N 3.01Å; P538-R542 PolarHBondContact O-N 3.31Å; P538-R542 VanDerWaalsContact O-N 3.13Å
539	L	96.3	Very high	94.3	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-65.5	-38.4	178	-66.9	175.3	0	0	0	111.4	F507 L510 N511 I514 I517 L529 N536 P537 R542 I543	F507-L539 HydrophobicContact CD1-CD1 4.22Å; F507-L539 HydrophobicContact CE1-CD1 4.47Å; L510-L539 HydrophobicContact CB-CD1 3.91Å; L510-L539 HydrophobicContact CB-CD2 4.4Å; L510-L539 HydrophobicContact CD1-CD1 4.34Å; N511-L539 WeakPolarHBondContact OD1-CG 3.28Å; I514-L539 HydrophobicContact CB-CD2 4.5Å; I514-L539 HydrophobicContact CD1-CD2 4.3Å; I514-L539 HydrophobicContact CG1-CD2 4.18Å; I517-L539 HydrophobicContact CD1-CD2 4.01Å; L529-L539 HydrophobicContact CD1-CB 4.21Å; L529-L539 HydrophobicContact CD2-CD1 4.22Å; N536-L539 HydrophobicContact CB-CB 4.35Å; N536-L539 HydrophobicContact CB-CD1 4.13Å; N536-L539 HydrophobicContact CB-CG 4.44Å; N536-L539 PolarHBondContact O-N 3.22Å; N536-L539 WeakPolarHBondContact OD1-CB 3.43Å; N536-L539 WeakPolarHBondContact OD1-CG 3.24Å; N536-L539 PolarHBondContact OD1-N 3.04Å; P537-L539 PolarHBondContact O-N 3.47Å; L539-R542 PolarHBondContact O-N 3.3Å; L539-I543 WeakPolarHBondContact O-CD1 3.47Å; L539-I543 WeakPolarHBondContact O-CG1 3.3Å; L539-I543 PolarHBondContact O-N 3.21Å
540	M	95.4	Very high	94.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-69.6	-40.7	-179.1	-67.1	-175.9	71.1	0	0	112.5	L529 L535 N536 P537 P538 R542 I543 A544 P565 F566 Y571	L529-M540 HydrophobicContact CD1-CG 4.14Å; L535-M540 HydrophobicContact CD2-SD 3.99Å; N536-M540 VanDerWaalsContact O-CG 3.25Å; N536-M540 WeakPolarHBondContact O-CG 3.48Å; N536-M540 PolarHBondContact O-N 3.46Å; N536-M540 VanDerWaalsContact O-N 3.08Å; P537-M540 PolarHBondContact O-N 2.94Å; P537-M540 VanDerWaalsContact O-N 3.1Å; P538-M540 VanDerWaalsContact C-N 3.32Å; P538-M540 PolarHBondContact O-N 3.01Å; M540-R542 VanDerWaalsContact C-N 3.33Å; M540-R542 PolarHBondContact O-N 3.19Å; M540-I543 PolarHBondContact O-N 3.46Å; M540-A544 PolarHBondContact O-N 2.86Å; M540-P565 HydrophobicContact CE-CB 3.83Å; M540-F566 HydrophobicContact CB-CE1 4.16Å; M540-F566 HydrophobicContact CE-CD1 3.87Å; M540-F566 HydrophobicContact CE-CE1 4.01Å; M540-F566 WeakPolarHBondContact O-CZ 3.06Å; M540-Y571 HydrophobicContact CB-CD1 3.88Å; M540-Y571 HydrophobicContact CB-CE1 3.85Å; M540-Y571 HydrophobicContact CE-CD1 3.58Å; M540-Y571 HydrophobicContact CE-CG 3.56Å; M540-Y571 HydrophobicContact SD-CD1 4.09Å; M540-Y571 HydrophobicContact SD-CD2 4.38Å; M540-Y571 HydrophobicContact SD-CG 3.87Å
541	E	96.6	Very high	94.6	Very high	64 Å²	64	36.1 Å²	36.1	30%	0.299	18%	0.179	S	C	.	.	H	α-helix	trans	-60.6	-43.4	172	-69.7	-56.2	146.3	0	0	111.3	P537 A544 S545 Y571 P573 A574	P537-E541 WeakPolarHBondContact O-CG 3.3Å; P537-E541 PolarHBondContact O-N 2.71Å; E541-A544 PolarHBondContact O-N 2.76Å; E541-S545 PolarHBondContact O-N 3.43Å; E541-Y571 WeakPolarHBondContact OE1-CE1 3.46Å; E541-Y571 PolarHBondContact OE1-OH 3.06Å; E541-P573 VanDerWaalsContact OE1-CA 3.3Å; E541-P573 WeakPolarHBondContact OE1-CA 3.45Å; E541-A574 PolarHBondContact OE2-N 2.79Å
542	R	96.9	Very high	94.7	Very high	76 Å²	76	38.5 Å²	38.5	29%	0.287	20%	0.197	S	C	.	.	H	α-helix	trans	-67.1	-38.1	178.7	-172.3	60.5	176.2	153.9	3.4	112.6	I514 I517 P538 L539 M540 A544 S545 V546	I514-R542 HydrophobicContact CD1-CB 4.1Å; I514-R542 HydrophobicContact CG1-CB 3.88Å; I514-R542 HydrophobicContact CG1-CG 3.87Å; I517-R542 HydrophobicContact CB-CG 4.07Å; I517-R542 HydrophobicContact CD1-CB 4.06Å; I517-R542 HydrophobicContact CD1-CG 3.75Å; I517-R542 HydrophobicContact CG1-CG 4.43Å; I517-R542 HydrophobicContact CG2-CG 4.3Å; P538-R542 PolarHBondContact O-N 3.31Å; P538-R542 VanDerWaalsContact O-N 3.13Å; L539-R542 PolarHBondContact O-N 3.3Å; M540-R542 VanDerWaalsContact C-N 3.33Å; M540-R542 PolarHBondContact O-N 3.19Å; R542-A544 VanDerWaalsContact C-N 3.34Å; R542-S545 PolarHBondContact NH1-OG 3.44Å; R542-S545 PolarHBondContact O-N 2.88Å; R542-S545 PolarHBondContact O-OG 3.49Å; R542-V546 HydrophobicContact CG-CG2 4.42Å; R542-V546 WeakPolarHBondContact O-CB 3.46Å; R542-V546 VanDerWaalsContact O-CG2 3.31Å; R542-V546 WeakPolarHBondContact O-CG2 3.13Å; R542-V546 PolarHBondContact O-N 3.11Å
543	I	96.6	Very high	94.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61	-46.1	173.2	-70.7	162.9	0	0	0	110	L525 A526 L529 L539 M540 A547 T562 F566	L525-I543 HydrophobicContact CD2-CD1 3.91Å; L525-I543 HydrophobicContact CD2-CG1 4.02Å; L525-I543 HydrophobicContact CG-CD1 3.98Å; A526-I543 HydrophobicContact CB-CD1 4.36Å; L529-I543 HydrophobicContact CD1-CD1 3.65Å; L539-I543 WeakPolarHBondContact O-CD1 3.47Å; L539-I543 WeakPolarHBondContact O-CG1 3.3Å; L539-I543 PolarHBondContact O-N 3.21Å; M540-I543 PolarHBondContact O-N 3.46Å; I543-A547 WeakPolarHBondContact O-CB 3.39Å; I543-A547 PolarHBondContact O-N 2.77Å; I543-T562 HydrophobicContact CG2-CG2 4.19Å; I543-F566 HydrophobicContact CB-CZ 4.36Å; I543-F566 HydrophobicContact CG2-CE2 4.01Å; I543-F566 HydrophobicContact CG2-CZ 4.07Å
544	A	97.1	Very high	95	Very high	4 Å²	4	43.9 Å²	43.9	3%	0.033	22%	0.222	C	C	.	.	H	α-helix	trans	-61.1	-47.7	178.7	0	0	0	0	0	111.4	M540 E541 R542 V546 A547 I548 F566 P573 L579	M540-A544 PolarHBondContact O-N 2.86Å; E541-A544 PolarHBondContact O-N 2.76Å; R542-A544 VanDerWaalsContact C-N 3.34Å; A544-V546 PolarHBondContact O-N 2.89Å; A544-A547 PolarHBondContact O-N 3.1Å; A544-I548 VanDerWaalsContact O-CG1 3.29Å; A544-I548 WeakPolarHBondContact O-CG1 3.35Å; A544-I548 PolarHBondContact O-N 3.35Å; A544-F566 HydrophobicContact CB-CE1 4.23Å; A544-F566 HydrophobicContact CB-CZ 3.89Å; A544-P573 HydrophobicContact CB-CB 3.93Å; A544-P573 HydrophobicContact CB-CG 4.04Å; A544-L579 HydrophobicContact CB-CD2 4.06Å
545	S	96.8	Very high	95.2	Very high	34 Å²	34	43.1 Å²	43.1	24%	0.238	22%	0.22	C	C	.	.	H	α-helix	trans	-61.2	-48.3	-179.4	82.1	0	0	0	0	112	E541 R542 A547 I548 E549	E541-S545 PolarHBondContact O-N 3.43Å; R542-S545 PolarHBondContact NH1-OG 3.44Å; R542-S545 PolarHBondContact O-N 2.88Å; R542-S545 PolarHBondContact O-OG 3.49Å; S545-A547 VanDerWaalsContact C-N 3.33Å; S545-A547 PolarHBondContact O-N 3.33Å; S545-I548 PolarHBondContact O-N 3.46Å; S545-E549 WeakPolarHBondContact O-CB 3.47Å; S545-E549 VanDerWaalsContact O-CG 3.29Å; S545-E549 WeakPolarHBondContact O-CG 3.32Å; S545-E549 PolarHBondContact O-N 3.16Å
546	V	96.7	Very high	95.2	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.012	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-38.2	-179.5	172.4	0	0	0	0	111	I517 P519 I522 R542 A544 I548 H550	I517-V546 HydrophobicContact CG2-CG2 4.21Å; P519-V546 HydrophobicContact CG-CG1 4.39Å; I522-V546 HydrophobicContact CG2-CB 4.33Å; I522-V546 HydrophobicContact CG2-CG1 3.8Å; R542-V546 HydrophobicContact CG-CG2 4.42Å; R542-V546 WeakPolarHBondContact O-CB 3.46Å; R542-V546 VanDerWaalsContact O-CG2 3.31Å; R542-V546 WeakPolarHBondContact O-CG2 3.13Å; R542-V546 PolarHBondContact O-N 3.11Å; A544-V546 PolarHBondContact O-N 2.89Å; V546-I548 VanDerWaalsContact C-N 3.34Å; V546-H550 WeakPolarHBondContact O-CB 3.49Å; V546-H550 PolarHBondContact O-N 3.42Å
547	A	96.8	Very high	95.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65	-38	177.3	0	0	0	0	0	112.4	I522 I543 A544 S545 I551 I554 T562 L579	I522-A547 HydrophobicContact CD1-CB 4.43Å; I543-A547 WeakPolarHBondContact O-CB 3.39Å; I543-A547 PolarHBondContact O-N 2.77Å; A544-A547 PolarHBondContact O-N 3.1Å; S545-A547 VanDerWaalsContact C-N 3.33Å; S545-A547 PolarHBondContact O-N 3.33Å; A547-I551 WeakPolarHBondContact O-CA 3.15Å; A547-I551 VanDerWaalsContact O-CB 3.31Å; A547-I551 WeakPolarHBondContact O-CB 3.42Å; A547-I551 PolarHBondContact O-N 3.3Å; A547-I554 HydrophobicContact CB-CD1 4.23Å; A547-T562 HydrophobicContact CB-CG2 3.89Å; A547-L579 HydrophobicContact CB-CD1 3.67Å
548	I	97	Very high	95	Very high	29 Å²	29	40 Å²	40	15%	0.149	20%	0.202	C	C	.	.	H	α-helix	trans	-70.1	-49.3	175.7	-66.9	165.6	0	0	0	110.8	A544 S545 V546 H550 H575 E578 L579 V582	A544-I548 VanDerWaalsContact O-CG1 3.29Å; A544-I548 WeakPolarHBondContact O-CG1 3.35Å; A544-I548 PolarHBondContact O-N 3.35Å; S545-I548 PolarHBondContact O-N 3.46Å; V546-I548 VanDerWaalsContact C-N 3.34Å; I548-H550 PolarHBondContact O-N 3.11Å; I548-H575 HydrophobicContact CD1-CB 3.9Å; I548-E578 HydrophobicContact CD1-CB 4.39Å; I548-E578 HydrophobicContact CD1-CG 4.26Å; I548-E578 HydrophobicContact CG1-CG 4.44Å; I548-E578 HydrophobicContact CG2-CG 4.13Å; I548-E578 WeakPolarHBondContact CG2-OE1 3.44Å; I548-L579 HydrophobicContact CD1-CB 4.16Å; I548-L579 HydrophobicContact CG1-CB 4.24Å; I548-L579 HydrophobicContact CG1-CD1 4.17Å; I548-V582 HydrophobicContact CG1-CG2 4.25Å
549	E	96.1	Very high	95	Very high	124 Å²	124	36.7 Å²	36.7	58%	0.579	18%	0.181	S	C	*	.	H	α-helix	trans	-64.6	-36	-176	-73.3	170.4	179	0	0	113.2	S545	S545-E549 WeakPolarHBondContact O-CB 3.47Å; S545-E549 VanDerWaalsContact O-CG 3.29Å; S545-E549 WeakPolarHBondContact O-CG 3.32Å; S545-E549 PolarHBondContact O-N 3.16Å
550	H	95.8	Very high	94.9	Very high	71 Å²	71	37.6 Å²	37.6	33%	0.329	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124	32	-169.8	-63.5	-83	0	0	0	113.4	P519 V546 I548 D552 E553 I554	P519-H550 HydrophobicContact CG-CB 3.43Å; P519-H550 VanDerWaalsContact CG-CB 3.43Å; V546-H550 WeakPolarHBondContact O-CB 3.49Å; V546-H550 PolarHBondContact O-N 3.42Å; I548-H550 PolarHBondContact O-N 3.11Å; H550-D552 PolarHBondContact O-N 3.01Å; H550-D552 VanDerWaalsContact O-N 3.13Å; H550-E553 IonicContact CE1-OE1 3.66Å; H550-E553 IonicContact CG-OE1 2.91Å; H550-E553 IonicContact ND1-OE1 2.81Å; H550-E553 PolarHBondContact ND1-OE1 3.34Å; H550-E553 PolarHBondContact O-N 3.29Å; H550-E553 VanDerWaalsContact O-N 3.09Å; H550-I554 PolarHBondContact O-N 3.34Å
551	I	95.5	Very high	94.8	Very high	21 Å²	21	38.4 Å²	38.4	11%	0.108	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-31.8	-176.2	-166.9	60	0	0	0	114	A547 E553 I554 V582 R586	A547-I551 WeakPolarHBondContact O-CA 3.15Å; A547-I551 VanDerWaalsContact O-CB 3.31Å; A547-I551 WeakPolarHBondContact O-CB 3.42Å; A547-I551 PolarHBondContact O-N 3.3Å; I551-E553 VanDerWaalsContact C-N 3.33Å; I551-E553 PolarHBondContact O-N 3.47Å; I551-I554 HydrophobicContact CD1-CD1 4.3Å; I551-I554 PolarHBondContact O-N 3.47Å; I551-V582 HydrophobicContact CB-CB 4.48Å; I551-V582 HydrophobicContact CD1-CG2 4.37Å; I551-V582 HydrophobicContact CG1-CB 4.18Å; I551-V582 HydrophobicContact CG1-CG2 4.27Å; I551-V582 HydrophobicContact CG2-CB 4.48Å; I551-R586 HydrophobicContact CD1-CB 4.03Å; I551-R586 HydrophobicContact CD1-CG 4.09Å; I551-R586 HydrophobicContact CG1-CB 3.75Å; I551-R586 HydrophobicContact CG1-CG 3.94Å; I551-R586 PolarHBondContact O-NE 3.4Å
552	D	93.6	Very high	94.8	Very high	131 Å²	131	35.4 Å²	35.4	70%	0.701	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-30.7	-178.9	-66.4	-41	0	0	0	112.7	H550 I554 R586	H550-D552 PolarHBondContact O-N 3.01Å; H550-D552 VanDerWaalsContact O-N 3.13Å; D552-I554 VanDerWaalsContact C-N 3.32Å; D552-R586 PolarHBondContact O-NH2 2.84Å
553	E	91.9	Very high	94.8	Very high	133 Å²	133	31.8 Å²	31.8	62%	0.621	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-21.2	176.6	-62.3	178.1	-138.2	0	0	112	P519 H550 I551	P519-E553 HydrophobicContact CB-CB 3.96Å; P519-E553 HydrophobicContact CG-CB 4.13Å; H550-E553 IonicContact CE1-OE1 3.66Å; H550-E553 IonicContact CG-OE1 2.91Å; H550-E553 IonicContact ND1-OE1 2.81Å; H550-E553 PolarHBondContact ND1-OE1 3.34Å; H550-E553 PolarHBondContact O-N 3.29Å; H550-E553 VanDerWaalsContact O-N 3.09Å; I551-E553 VanDerWaalsContact C-N 3.33Å; I551-E553 PolarHBondContact O-N 3.47Å
554	I	92.2	Very high	94.7	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.015	16%	0.164	C	C	.	.	S	Bend	trans	-80.5	127.2	179.7	-60.3	163.8	0	0	0	109	P519 I522 A547 H550 I551 D552 F556 A558 R586	P519-I554 HydrophobicContact CB-CG1 3.95Å; I522-I554 HydrophobicContact CD1-CD1 3.19Å; I522-I554 HydrophobicContact CD1-CG1 3.71Å; I522-I554 HydrophobicContact CD1-CG2 4.48Å; A547-I554 HydrophobicContact CB-CD1 4.23Å; H550-I554 PolarHBondContact O-N 3.34Å; I551-I554 HydrophobicContact CD1-CD1 4.3Å; I551-I554 PolarHBondContact O-N 3.47Å; D552-I554 VanDerWaalsContact C-N 3.32Å; I554-F556 PolarHBondContact O-N 3.32Å; I554-A558 HydrophobicContact CG2-CB 3.85Å; I554-R586 PolarHBondContact O-NE 3Å; I554-R586 PolarHBondContact O-NH2 2.9Å; I554-R586 VanDerWaalsContact O-NH2 3.13Å
555	H	91.8	Very high	94.6	Very high	34 Å²	34	32 Å²	32	16%	0.157	16%	0.162	C	C	.	.			trans	-61.1	137.3	174.4	-167.9	-99.8	0	0	0	110.5	D236 S557 A558	D236-H555 IonicContact OD2-CE1 3.62Å; D236-H555 IonicContact OD2-NE2 3.59Å; D236-H555 PolarHBondContact OD2-NE2 3.15Å; H555-S557 PolarHBondContact ND1-N 2.86Å; H555-S557 PolarHBondContact ND1-OG 3.18Å; H555-S557 PolarHBondContact O-N 3.27Å; H555-A558 HydrophobicContact CB-CB 4.35Å; H555-A558 WeakPolarHBondContact O-CA 3.31Å; H555-A558 VanDerWaalsContact O-CB 3.3Å; H555-A558 WeakPolarHBondContact O-CB 3.41Å; H555-A558 PolarHBondContact O-N 3.46Å
556	F	92.9	Very high	94.6	Very high	23 Å²	23	30.5 Å²	30.5	10%	0.101	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-53	-35.5	-176	62.7	-97.3	0	0	0	113.3	I554 A558 T559 F587 H590 F594	I554-F556 PolarHBondContact O-N 3.32Å; F556-A558 VanDerWaalsContact C-N 3.3Å; F556-A558 PolarHBondContact O-N 3.09Å; F556-T559 WeakPolarHBondContact O-CB 3.39Å; F556-T559 VanDerWaalsContact O-CG2 3.29Å; F556-T559 WeakPolarHBondContact O-CG2 3.1Å; F556-T559 PolarHBondContact O-N 2.92Å; F556-T559 PolarHBondContact O-OG1 3.29Å; F556-F587 HydrophobicContact CB-CB 4.34Å; F556-H590 HydrophobicContact CB-CB 4.11Å; F556-H590 HydrophobicContact CD1-CB 3.88Å; F556-H590 AromaticContact CD1-CD2 3.76Å; F556-H590 AromaticContact CD1-CG 3.63Å; F556-H590 HydrophobicContact CD2-CB 3.7Å; F556-H590 HydrophobicContact CE1-CB 4.21Å; F556-H590 HydrophobicContact CE2-CB 4.06Å; F556-H590 HydrophobicContact CG-CB 3.62Å; F556-H590 AromaticContact CG-CD2 3.87Å; F556-H590 AromaticContact CG-CG 3.78Å; F556-H590 HydrophobicContact CZ-CB 4.3Å; F556-F594 AromaticContact CD2-CD2 3.99Å; F556-F594 HydrophobicContact CD2-CD2 3.99Å; F556-F594 HydrophobicContact CD2-CE1 4.41Å; F556-F594 AromaticContact CD2-CE2 3.4Å; F556-F594 HydrophobicContact CD2-CE2 3.4Å; F556-F594 AromaticContact CD2-CZ 3.64Å; F556-F594 HydrophobicContact CD2-CZ 3.64Å; F556-F594 HydrophobicContact CE2-CD2 4.03Å; F556-F594 AromaticContact CE2-CE2 3.91Å; F556-F594 HydrophobicContact CE2-CE2 3.91Å; F556-F594 HydrophobicContact CE2-CZ 4.28Å; F556-F594 HydrophobicContact CG-CE2 4.47Å
557	S	90.9	Very high	94.6	Very high	4 Å²	4	30.5 Å²	30.5	3%	0.028	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-74.1	-18.7	178.2	73.1	0	0	0	0	114.1	R232 H555 T559 P561	R232-S557 WeakPolarHBondContact CD-OG 3.49Å; R232-S557 VanDerWaalsContact CZ-OG 3.29Å; R232-S557 PolarHBondContact NE-OG 3.47Å; R232-S557 VanDerWaalsContact NH1-CB 3.35Å; R232-S557 PolarHBondContact NH1-OG 3.24Å; H555-S557 PolarHBondContact ND1-N 2.86Å; H555-S557 PolarHBondContact ND1-OG 3.18Å; H555-S557 PolarHBondContact O-N 3.27Å; S557-T559 VanDerWaalsContact C-N 3.28Å; S557-P561 WeakPolarHBondContact O-CD 3.45Å
558	A	92.4	Very high	94.5	Very high	15 Å²	15	32.2 Å²	32.2	12%	0.124	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-80.8	-9.6	176.8	0	0	0	0	0	112.2	A523 I554 H555 F556 Y560 P561 T562	A523-A558 HydrophobicContact CB-CB 4.2Å; I554-A558 HydrophobicContact CG2-CB 3.85Å; H555-A558 HydrophobicContact CB-CB 4.35Å; H555-A558 WeakPolarHBondContact O-CA 3.31Å; H555-A558 VanDerWaalsContact O-CB 3.3Å; H555-A558 WeakPolarHBondContact O-CB 3.41Å; H555-A558 PolarHBondContact O-N 3.46Å; F556-A558 VanDerWaalsContact C-N 3.3Å; F556-A558 PolarHBondContact O-N 3.09Å; A558-Y560 VanDerWaalsContact C-N 3.29Å; A558-Y560 PolarHBondContact O-N 3.35Å; A558-P561 VanDerWaalsContact O-CD 3.23Å; A558-P561 WeakPolarHBondContact O-CD 3.29Å; A558-P561 VanDerWaalsContact O-CG 3.29Å; A558-P561 WeakPolarHBondContact O-CG 3.27Å; A558-T562 WeakPolarHBondContact O-CB 3.29Å; A558-T562 PolarHBondContact O-N 2.85Å; A558-T562 VanDerWaalsContact O-N 3.15Å; A558-T562 PolarHBondContact O-OG1 3.17Å
559	T	94.9	Very high	94.5	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	16%	0.155	C	C	.	.	H	α-helix	trans	-58.5	-40.7	169.4	60	0	0	0	0	111.5	F556 S557 T562 L563 C583 R586	F556-T559 WeakPolarHBondContact O-CB 3.39Å; F556-T559 VanDerWaalsContact O-CG2 3.29Å; F556-T559 WeakPolarHBondContact O-CG2 3.1Å; F556-T559 PolarHBondContact O-N 2.92Å; F556-T559 PolarHBondContact O-OG1 3.29Å; S557-T559 VanDerWaalsContact C-N 3.28Å; T559-T562 PolarHBondContact O-N 3.37Å; T559-L563 WeakPolarHBondContact O-CB 3.48Å; T559-L563 WeakPolarHBondContact O-CG 3.41Å; T559-L563 PolarHBondContact O-N 3.42Å; T559-C583 HydrophobicContact CG2-CB 4.32Å; T559-R586 HydrophobicContact CG2-CB 4.31Å; T559-R586 HydrophobicContact CG2-CG 4.12Å
560	Y	94.6	Very high	94.4	Very high	20 Å²	20	26.4 Å²	26.4	8%	0.078	14%	0.135	C	C	.	.	H	α-helix	trans	-54.5	-62.4	176.6	168.7	-118.2	0	0	0	113.1	A558 T562 L563 L564 L598 L601 L602 C605	A558-Y560 VanDerWaalsContact C-N 3.29Å; A558-Y560 PolarHBondContact O-N 3.35Å; Y560-T562 PolarHBondContact O-N 3.09Å; Y560-L563 PolarHBondContact O-N 3.4Å; Y560-L564 HydrophobicContact CD2-CD2 4.37Å; Y560-L564 HydrophobicContact CD2-CG 4.36Å; Y560-L564 HydrophobicContact CE1-CD1 4.18Å; Y560-L564 HydrophobicContact CE2-CD1 4.42Å; Y560-L564 HydrophobicContact CE2-CD2 3.55Å; Y560-L564 HydrophobicContact CE2-CG 3.94Å; Y560-L564 WeakPolarHBondContact O-CG 3.26Å; Y560-L564 PolarHBondContact O-N 2.96Å; Y560-L564 VanDerWaalsContact O-N 3.15Å; Y560-L598 HydrophobicContact CD1-CD1 3.41Å; Y560-L598 VanDerWaalsContact CD1-CD1 3.41Å; Y560-L598 HydrophobicContact CE1-CD1 3.96Å; Y560-L598 HydrophobicContact CG-CD1 4.03Å; Y560-L601 HydrophobicContact CE1-CB 4.2Å; Y560-L601 HydrophobicContact CE1-CD1 4.38Å; Y560-L601 HydrophobicContact CE2-CB 3.93Å; Y560-L601 VanDerWaalsContact CE2-O 3.32Å; Y560-L601 WeakPolarHBondContact CE2-O 3.32Å; Y560-L602 HydrophobicContact CD2-CB 4.13Å; Y560-L602 HydrophobicContact CD2-CD1 4.29Å; Y560-L602 HydrophobicContact CG-CB 4.45Å; Y560-C605 HydrophobicContact CD2-CB 4.12Å; Y560-C605 HydrophobicContact CE2-CB 3.94Å
561	P	94.1	Very high	94.3	Very high	17 Å²	17	25 Å²	25	11%	0.11	13%	0.127	C	C	.	.	H	α-helix	trans	-63.5	-27.4	179.7	25	-34.5	0	0	0	113.2	A523 A526 F527 S557 A558 L564	A523-P561 HydrophobicContact CB-CB 4.25Å; A523-P561 HydrophobicContact CB-CG 3.8Å; A526-P561 WeakPolarHBondContact CB-O 3.42Å; F527-P561 HydrophobicContact CB-CB 4.41Å; S557-P561 WeakPolarHBondContact O-CD 3.45Å; A558-P561 VanDerWaalsContact O-CD 3.23Å; A558-P561 WeakPolarHBondContact O-CD 3.29Å; A558-P561 VanDerWaalsContact O-CG 3.29Å; A558-P561 WeakPolarHBondContact O-CG 3.27Å; P561-L564 HydrophobicContact CB-CD1 4.47Å
562	T	95.9	Very high	94.2	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.006	15%	0.153	C	C	.	.	H	α-helix	trans	-68.2	-37.9	176.1	-55.8	0	0	0	0	112.3	I522 I543 A547 A558 T559 Y560 P565 F566	I522-T562 HydrophobicContact CD1-CG2 4.04Å; I543-T562 HydrophobicContact CG2-CG2 4.19Å; A547-T562 HydrophobicContact CB-CG2 3.89Å; A558-T562 WeakPolarHBondContact O-CB 3.29Å; A558-T562 PolarHBondContact O-N 2.85Å; A558-T562 VanDerWaalsContact O-N 3.15Å; A558-T562 PolarHBondContact O-OG1 3.17Å; T559-T562 PolarHBondContact O-N 3.37Å; Y560-T562 PolarHBondContact O-N 3.09Å; T562-P565 WeakPolarHBondContact O-CD 3.2Å; T562-F566 WeakPolarHBondContact O-CD2 3.38Å; T562-F566 WeakPolarHBondContact O-CE2 3.36Å
563	L	96.9	Very high	94.1	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-80.7	-21.8	179	-70.1	176.3	0	0	0	113.8	T559 Y560 P565 F566 S567 L579 Y580 C583 L602 L606	T559-L563 WeakPolarHBondContact O-CB 3.48Å; T559-L563 WeakPolarHBondContact O-CG 3.41Å; T559-L563 PolarHBondContact O-N 3.42Å; Y560-L563 PolarHBondContact O-N 3.4Å; L563-P565 VanDerWaalsContact C-CD 3.48Å; L563-F566 PolarHBondContact O-N 2.85Å; L563-F566 VanDerWaalsContact O-N 3.16Å; L563-S567 PolarHBondContact O-N 3.42Å; L563-S567 VanDerWaalsContact O-N 3.13Å; L563-L579 HydrophobicContact CD2-CD2 4.35Å; L563-L579 HydrophobicContact CD2-CG 4.1Å; L563-Y580 HydrophobicContact CB-CE1 4.49Å; L563-Y580 HydrophobicContact CD1-CD1 4.12Å; L563-Y580 HydrophobicContact CD1-CE1 4.21Å; L563-Y580 HydrophobicContact CD2-CD1 3.82Å; L563-Y580 HydrophobicContact CD2-CE1 3.78Å; L563-Y580 HydrophobicContact CD2-CG 4.43Å; L563-Y580 HydrophobicContact CG-CE1 4.39Å; L563-C583 HydrophobicContact CD1-CB 3.83Å; L563-C583 HydrophobicContact CD2-CB 4.18Å; L563-C583 HydrophobicContact CG-CB 4.22Å; L563-L602 HydrophobicContact CD1-CD1 4.46Å; L563-L606 HydrophobicContact CD1-CD2 3.88Å
564	L	95.4	Very high	94	Very high	8 Å²	8	22.1 Å²	22.1	4%	0.042	12%	0.123	C	C	.	.	H	α-helix	trans	-47.8	-48.7	-177.7	-84.3	179.9	0	0	0	115.5	F527 T530 Y560 P561 F566 V568	F527-L564 HydrophobicContact CD2-CD1 3.85Å; F527-L564 HydrophobicContact CE2-CD1 4.45Å; T530-L564 HydrophobicContact CG2-CB 4.15Å; T530-L564 WeakPolarHBondContact OG1-CB 3.29Å; Y560-L564 HydrophobicContact CD2-CD2 4.37Å; Y560-L564 HydrophobicContact CD2-CG 4.36Å; Y560-L564 HydrophobicContact CE1-CD1 4.18Å; Y560-L564 HydrophobicContact CE2-CD1 4.42Å; Y560-L564 HydrophobicContact CE2-CD2 3.55Å; Y560-L564 HydrophobicContact CE2-CG 3.94Å; Y560-L564 WeakPolarHBondContact O-CG 3.26Å; Y560-L564 PolarHBondContact O-N 2.96Å; Y560-L564 VanDerWaalsContact O-N 3.15Å; P561-L564 HydrophobicContact CB-CD1 4.47Å; L564-F566 VanDerWaalsContact C-N 3.3Å; L564-F566 PolarHBondContact O-N 2.98Å; L564-V568 HydrophobicContact CD2-CG2 3.97Å; L564-V568 WeakPolarHBondContact O-CB 3.5Å; L564-V568 VanDerWaalsContact O-CG2 3.31Å; L564-V568 WeakPolarHBondContact O-CG2 3.29Å; L564-V568 PolarHBondContact O-N 2.95Å
565	P	95.3	Very high	93.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-67.8	-32.4	-175.4	29.2	-37.8	0	0	0	111.9	A526 L529 T530 M540 T562 L563 L569	A526-P565 HydrophobicContact CB-CG 3.84Å; L529-P565 HydrophobicContact CB-CB 4.45Å; T530-P565 VanDerWaalsContact OG1-CA 3.29Å; T530-P565 WeakPolarHBondContact OG1-CA 3.4Å; T530-P565 WeakPolarHBondContact OG1-CD 3.11Å; T530-P565 VanDerWaalsContact OG1-N 3.1Å; M540-P565 HydrophobicContact CE-CB 3.83Å; T562-P565 WeakPolarHBondContact O-CD 3.2Å; L563-P565 VanDerWaalsContact C-CD 3.48Å; P565-L569 HydrophobicContact CB-CD1 4.31Å; P565-L569 WeakPolarHBondContact O-CA 3.48Å; P565-L569 WeakPolarHBondContact O-CB 3.44Å; P565-L569 WeakPolarHBondContact O-CG 3.37Å; P565-L569 PolarHBondContact O-N 3.1Å; P565-L569 VanDerWaalsContact O-N 3.08Å
566	F	96.4	Very high	93.9	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.018	15%	0.148	C	C	.	.	H	α-helix	trans	-69.9	-49.2	177.6	-54.3	-72.3	0	0	0	111.1	M540 I543 A544 T562 L563 L564 N570 Y571 P573 L579	M540-F566 HydrophobicContact CB-CE1 4.16Å; M540-F566 HydrophobicContact CE-CD1 3.87Å; M540-F566 HydrophobicContact CE-CE1 4.01Å; M540-F566 WeakPolarHBondContact O-CZ 3.06Å; I543-F566 HydrophobicContact CB-CZ 4.36Å; I543-F566 HydrophobicContact CG2-CE2 4.01Å; I543-F566 HydrophobicContact CG2-CZ 4.07Å; A544-F566 HydrophobicContact CB-CE1 4.23Å; A544-F566 HydrophobicContact CB-CZ 3.89Å; T562-F566 WeakPolarHBondContact O-CD2 3.38Å; T562-F566 WeakPolarHBondContact O-CE2 3.36Å; L563-F566 PolarHBondContact O-N 2.85Å; L563-F566 VanDerWaalsContact O-N 3.16Å; L564-F566 VanDerWaalsContact C-N 3.3Å; L564-F566 PolarHBondContact O-N 2.98Å; F566-N570 CarbonylContact O-C 3.55Å; F566-N570 WeakPolarHBondContact O-CA 3.41Å; F566-N570 PolarHBondContact O-N 3.07Å; F566-Y571 HydrophobicContact CD1-CD1 4.06Å; F566-Y571 HydrophobicContact CE1-CD1 4.13Å; F566-Y571 PolarHBondContact O-N 3.3Å; F566-P573 HydrophobicContact CD1-CG 3.89Å; F566-P573 HydrophobicContact CE1-CB 4.25Å; F566-P573 HydrophobicContact CE1-CG 3.78Å; F566-L579 HydrophobicContact CD1-CD2 4.34Å; F566-L579 HydrophobicContact CD2-CD2 3.63Å; F566-L579 HydrophobicContact CE1-CD2 4.24Å; F566-L579 HydrophobicContact CE2-CD2 3.53Å; F566-L579 HydrophobicContact CG-CD2 4.04Å; F566-L579 HydrophobicContact CZ-CD2 3.84Å
567	S	95.9	Very high	93.9	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.007	17%	0.171	C	C	.	.	H	α-helix	trans	-71.2	-43.2	179.9	-62.1	0	0	0	0	113.9	L563 Y580 C605	L563-S567 PolarHBondContact O-N 3.42Å; L563-S567 VanDerWaalsContact O-N 3.13Å; S567-Y580 PolarHBondContact N-OH 2.98Å; S567-Y580 PolarHBondContact OG-OH 3.29Å; S567-C605 WeakPolarHBondContact CB-O 2.9Å; S567-C605 WeakPolarHBondContact CB-SG 3.47Å; S567-C605 PolarHBondContact OG-O 3.46Å; S567-C605 PolarHBondContact OG-SG 2.64Å; S567-C605 VanDerWaalsContact OG-SG 3.37Å
568	V	95.7	Very high	94.2	Very high	36 Å²	36	35.5 Å²	35.5	22%	0.218	19%	0.191	C	C	.	.	H	α-helix	trans	-81.2	-44.5	-173.4	176.3	0	0	0	0	111.5	T530 L564 N570 L608 K784 G785	T530-V568 HydrophobicContact CG2-CB 3.8Å; T530-V568 HydrophobicContact CG2-CG1 3.85Å; T530-V568 HydrophobicContact CG2-CG2 3.97Å; L564-V568 HydrophobicContact CD2-CG2 3.97Å; L564-V568 WeakPolarHBondContact O-CB 3.5Å; L564-V568 VanDerWaalsContact O-CG2 3.31Å; L564-V568 WeakPolarHBondContact O-CG2 3.29Å; L564-V568 PolarHBondContact O-N 2.95Å; V568-N570 VanDerWaalsContact C-N 3.25Å; V568-L608 HydrophobicContact CG2-CD1 4.04Å; V568-K784 WeakPolarHBondContact O-CB 3.34Å; V568-G785 PolarHBondContact O-N 3.27Å; V568-G785 VanDerWaalsContact O-N 3.11Å
569	L	95.4	Very high	94.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-84.6	-4.6	178.6	-46.6	178.5	0	0	0	111.9	N533 L535 P565 Y571 H782	N533-L569 WeakPolarHBondContact OD1-CD2 3.39Å; L535-L569 HydrophobicContact CD2-CB 3.69Å; L535-L569 HydrophobicContact CD2-CD1 4.15Å; P565-L569 HydrophobicContact CB-CD1 4.31Å; P565-L569 WeakPolarHBondContact O-CA 3.48Å; P565-L569 WeakPolarHBondContact O-CB 3.44Å; P565-L569 WeakPolarHBondContact O-CG 3.37Å; P565-L569 PolarHBondContact O-N 3.1Å; P565-L569 VanDerWaalsContact O-N 3.08Å; L569-Y571 PolarHBondContact O-N 3.43Å; L569-H782 PolarHBondContact O-CD2 2.9Å; L569-H782 PolarHBondContact O-NE2 2.66Å
570	N	94.7	Very high	94.5	Very high	32 Å²	32	35 Å²	35	17%	0.171	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	48.8	-179.3	-165.4	79.1	0	0	0	112.7	F566 V568 H782 M783 L788	F566-N570 CarbonylContact O-C 3.55Å; F566-N570 WeakPolarHBondContact O-CA 3.41Å; F566-N570 PolarHBondContact O-N 3.07Å; V568-N570 VanDerWaalsContact C-N 3.25Å; N570-H782 PolarHBondContact O-CE1 3.17Å; N570-H782 VanDerWaalsContact O-CE1 3.22Å; N570-H782 PolarHBondContact O-NE2 3.02Å; N570-M783 WeakPolarHBondContact CB-O 3.47Å; N570-L788 HydrophobicContact CB-CD1 3.99Å; N570-L788 WeakPolarHBondContact ND2-CD1 3.37Å; N570-L788 WeakPolarHBondContact OD1-CD1 3.28Å
571	Y	94	Very high	94.6	Very high	40 Å²	40	37.9 Å²	37.9	16%	0.157	20%	0.202	C	C	.	.			trans	-101.6	129.5	176.2	180	-93.2	0	0	0	109.2	L535 P537 M540 E541 F566 L569 P573	L535-Y571 HydrophobicContact CD2-CD2 4.32Å; P537-Y571 HydrophobicContact CB-CE2 3.86Å; P537-Y571 HydrophobicContact CG-CE2 4.02Å; M540-Y571 HydrophobicContact CB-CD1 3.88Å; M540-Y571 HydrophobicContact CB-CE1 3.85Å; M540-Y571 HydrophobicContact CE-CD1 3.58Å; M540-Y571 HydrophobicContact CE-CG 3.56Å; M540-Y571 HydrophobicContact SD-CD1 4.09Å; M540-Y571 HydrophobicContact SD-CD2 4.38Å; M540-Y571 HydrophobicContact SD-CG 3.87Å; E541-Y571 WeakPolarHBondContact OE1-CE1 3.46Å; E541-Y571 PolarHBondContact OE1-OH 3.06Å; F566-Y571 HydrophobicContact CD1-CD1 4.06Å; F566-Y571 HydrophobicContact CE1-CD1 4.13Å; F566-Y571 PolarHBondContact O-N 3.3Å; L569-Y571 PolarHBondContact O-N 3.43Å; Y571-P573 HydrophobicContact CD1-CB 4.5Å; Y571-P573 HydrophobicContact CE1-CB 4.04Å; Y571-P573 VanDerWaalsContact O-CD 3.32Å; Y571-P573 WeakPolarHBondContact O-CD 3.39Å
572	E	92.5	Very high	94.7	Very high	141 Å²	141	38.3 Å²	38.3	66%	0.659	21%	0.205	S	C	*	.			trans	-104.6	102.4	-180	-70	171.3	-162.9	0	0	109.1
573	P	92	Very high	94.8	Very high	7 Å²	7	38.3 Å²	38.3	5%	0.045	21%	0.205	C	C	.	.			trans	-70.5	167.9	173.8	29.9	-36.1	0	0	0	111.3	E541 A544 F566 Y571 H575 V576 L579	E541-P573 VanDerWaalsContact OE1-CA 3.3Å; E541-P573 WeakPolarHBondContact OE1-CA 3.45Å; A544-P573 HydrophobicContact CB-CB 3.93Å; A544-P573 HydrophobicContact CB-CG 4.04Å; F566-P573 HydrophobicContact CD1-CG 3.89Å; F566-P573 HydrophobicContact CE1-CB 4.25Å; F566-P573 HydrophobicContact CE1-CG 3.78Å; Y571-P573 HydrophobicContact CD1-CB 4.5Å; Y571-P573 HydrophobicContact CE1-CB 4.04Å; Y571-P573 VanDerWaalsContact O-CD 3.32Å; Y571-P573 WeakPolarHBondContact O-CD 3.39Å; P573-H575 PolarHBondContact O-N 3.12Å; P573-V576 HydrophobicContact CG-CB 3.95Å; P573-V576 HydrophobicContact CG-CG2 4.32Å; P573-V576 PolarHBondContact O-N 2.96Å; P573-L579 HydrophobicContact CG-CD2 4.34Å
574	A	89.9	Confident	94.8	Very high	78 Å²	78	39.6 Å²	39.6	65%	0.645	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-31.3	-177.3	0	0	0	0	0	114	E541	E541-A574 PolarHBondContact OE2-N 2.79Å
575	H	90.3	Very high	94.9	Very high	114 Å²	114	46 Å²	46	53%	0.528	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.6	45.1	-178.7	-59	-72.2	0	0	0	111.6	I548 P573 D577 E578 L579	I548-H575 HydrophobicContact CD1-CB 3.9Å; P573-H575 PolarHBondContact O-N 3.12Å; H575-D577 PolarHBondContact O-N 3.37Å; H575-E578 HydrophobicContact CB-CB 4.26Å; H575-E578 IonicContact ND1-OE2 3.84Å; H575-E578 PolarHBondContact O-N 3.13Å; H575-L579 PolarHBondContact O-N 2.88Å
576	V	91.8	Very high	94.9	Very high	28 Å²	28	48.9 Å²	48.9	17%	0.17	25%	0.25	C	C	.	.	H	α-helix	trans	-57.4	-45.7	-175.9	65.6	0	0	0	0	113.5	P573 E578 L579 Y580	P573-V576 HydrophobicContact CG-CB 3.95Å; P573-V576 HydrophobicContact CG-CG2 4.32Å; P573-V576 PolarHBondContact O-N 2.96Å; V576-E578 PolarHBondContact O-N 3.4Å; V576-L579 WeakPolarHBondContact O-CB 3.47Å; V576-L579 PolarHBondContact O-N 3.37Å; V576-Y580 HydrophobicContact CG2-CD2 3.81Å; V576-Y580 HydrophobicContact CG2-CE2 3.6Å; V576-Y580 VanDerWaalsContact O-CD2 3.29Å; V576-Y580 WeakPolarHBondContact O-CD2 3.2Å; V576-Y580 PolarHBondContact O-N 2.94Å; V576-Y580 VanDerWaalsContact O-N 3.1Å
577	D	93.2	Very high	94.9	Very high	110 Å²	110	48.7 Å²	48.7	59%	0.588	25%	0.249	S	C	*	.	H	α-helix	trans	-63.5	-43.7	-179.2	-62.5	-40.2	0	0	0	111.3	H575 L579 Y580 D581	H575-D577 PolarHBondContact O-N 3.37Å; D577-L579 VanDerWaalsContact C-N 3.34Å; D577-L579 PolarHBondContact O-N 3.44Å; D577-Y580 PolarHBondContact O-N 3.01Å; D577-D581 WeakPolarHBondContact O-CB 3.32Å; D577-D581 PolarHBondContact O-N 3.43Å
578	E	96.3	Very high	95	Very high	93 Å²	93	50.2 Å²	50.2	44%	0.435	26%	0.258	S	S	.	.	H	α-helix	trans	-61.7	-42.1	176.8	-175.8	174.3	-173.9	0	0	111.4	I548 H575 V576 D581 V582	I548-E578 HydrophobicContact CD1-CB 4.39Å; I548-E578 HydrophobicContact CD1-CG 4.26Å; I548-E578 HydrophobicContact CG1-CG 4.44Å; I548-E578 HydrophobicContact CG2-CG 4.13Å; I548-E578 WeakPolarHBondContact CG2-OE1 3.44Å; H575-E578 HydrophobicContact CB-CB 4.26Å; H575-E578 IonicContact ND1-OE2 3.84Å; H575-E578 PolarHBondContact O-N 3.13Å; V576-E578 PolarHBondContact O-N 3.4Å; E578-D581 PolarHBondContact O-N 3.45Å; E578-V582 HydrophobicContact CG-CG1 4.37Å; E578-V582 WeakPolarHBondContact O-CG1 3.48Å; E578-V582 WeakPolarHBondContact O-CG2 3.33Å; E578-V582 PolarHBondContact O-N 3.38Å
579	L	96.8	Very high	95	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-58.9	-48.3	176.7	176.3	65.7	0	0	0	112.1	A544 A547 I548 L563 F566 P573 H575 V576 D577 V582 C583	A544-L579 HydrophobicContact CB-CD2 4.06Å; A547-L579 HydrophobicContact CB-CD1 3.67Å; I548-L579 HydrophobicContact CD1-CB 4.16Å; I548-L579 HydrophobicContact CG1-CB 4.24Å; I548-L579 HydrophobicContact CG1-CD1 4.17Å; L563-L579 HydrophobicContact CD2-CD2 4.35Å; L563-L579 HydrophobicContact CD2-CG 4.1Å; F566-L579 HydrophobicContact CD1-CD2 4.34Å; F566-L579 HydrophobicContact CD2-CD2 3.63Å; F566-L579 HydrophobicContact CE1-CD2 4.24Å; F566-L579 HydrophobicContact CE2-CD2 3.53Å; F566-L579 HydrophobicContact CG-CD2 4.04Å; F566-L579 HydrophobicContact CZ-CD2 3.84Å; P573-L579 HydrophobicContact CG-CD2 4.34Å; H575-L579 PolarHBondContact O-N 2.88Å; V576-L579 WeakPolarHBondContact O-CB 3.47Å; V576-L579 PolarHBondContact O-N 3.37Å; D577-L579 VanDerWaalsContact C-N 3.34Å; D577-L579 PolarHBondContact O-N 3.44Å; L579-V582 WeakPolarHBondContact O-CG2 3.3Å; L579-C583 WeakPolarHBondContact O-CB 3.45Å; L579-C583 PolarHBondContact O-N 2.96Å; L579-C583 VanDerWaalsContact O-N 3.17Å; L579-C583 PolarHBondContact O-SG 3.06Å
580	Y	96.8	Very high	94.9	Very high	5 Å²	5	55.7 Å²	55.7	2%	0.02	29%	0.289	C	S	.	.	H	α-helix	trans	-65.9	-42.6	177.4	-79.1	-76.6	0	0	0	110.9	L563 S567 V576 D577 C583 I584 L606 A609 H611	L563-Y580 HydrophobicContact CB-CE1 4.49Å; L563-Y580 HydrophobicContact CD1-CD1 4.12Å; L563-Y580 HydrophobicContact CD1-CE1 4.21Å; L563-Y580 HydrophobicContact CD2-CD1 3.82Å; L563-Y580 HydrophobicContact CD2-CE1 3.78Å; L563-Y580 HydrophobicContact CD2-CG 4.43Å; L563-Y580 HydrophobicContact CG-CE1 4.39Å; S567-Y580 PolarHBondContact N-OH 2.98Å; S567-Y580 PolarHBondContact OG-OH 3.29Å; V576-Y580 HydrophobicContact CG2-CD2 3.81Å; V576-Y580 HydrophobicContact CG2-CE2 3.6Å; V576-Y580 VanDerWaalsContact O-CD2 3.29Å; V576-Y580 WeakPolarHBondContact O-CD2 3.2Å; V576-Y580 PolarHBondContact O-N 2.94Å; V576-Y580 VanDerWaalsContact O-N 3.1Å; D577-Y580 PolarHBondContact O-N 3.01Å; Y580-C583 PolarHBondContact O-N 3.45Å; Y580-I584 WeakPolarHBondContact O-CB 3.4Å; Y580-I584 WeakPolarHBondContact O-CD1 3.43Å; Y580-I584 WeakPolarHBondContact O-CG1 3.45Å; Y580-I584 PolarHBondContact O-N 3.24Å; Y580-L606 HydrophobicContact CD1-CD2 3.74Å; Y580-L606 HydrophobicContact CE1-CD2 3.97Å; Y580-A609 HydrophobicContact CE1-CB 3.97Å; Y580-A609 HydrophobicContact CE2-CB 4.21Å; Y580-A609 VanDerWaalsContact OH-CB 3.23Å; Y580-A609 WeakPolarHBondContact OH-CB 3.29Å; Y580-H611 AromaticContact CD1-CD2 3.72Å; Y580-H611 AromaticContact CD2-CD2 3.84Å; Y580-H611 AromaticContact CD2-NE2 3.35Å; Y580-H611 WeakPolarHBondContact CD2-NE2 3.33Å; Y580-H611 AromaticContact CE2-NE2 3.92Å; Y580-H611 AromaticContact CG-CD2 3.63Å; Y580-H611 AromaticContact CG-NE2 3.45Å
581	D	96.8	Very high	94.9	Very high	80 Å²	80	54.9 Å²	54.9	43%	0.428	29%	0.285	S	S	.	.	H	α-helix	trans	-59.4	-48.9	179.2	-85.1	-7.1	0	0	0	112.9	D577 E578 C583 I584 K585	D577-D581 WeakPolarHBondContact O-CB 3.32Å; D577-D581 PolarHBondContact O-N 3.43Å; E578-D581 PolarHBondContact O-N 3.45Å; D581-C583 VanDerWaalsContact C-N 3.34Å; D581-I584 PolarHBondContact O-N 2.83Å; D581-K585 WeakPolarHBondContact O-CB 3.44Å; D581-K585 WeakPolarHBondContact O-CD 3.36Å; D581-K585 VanDerWaalsContact O-CG 3.23Å; D581-K585 WeakPolarHBondContact O-CG 3.35Å; D581-K585 PolarHBondContact O-N 3.35Å
582	V	97.3	Very high	94.7	Very high	27 Å²	27	57.3 Å²	57.3	16%	0.164	31%	0.308	C	S	.	.	H	α-helix	trans	-66.2	-38.8	179.1	-61.5	0	0	0	0	111.1	I548 I551 E578 L579 R586	I548-V582 HydrophobicContact CG1-CG2 4.25Å; I551-V582 HydrophobicContact CB-CB 4.48Å; I551-V582 HydrophobicContact CD1-CG2 4.37Å; I551-V582 HydrophobicContact CG1-CB 4.18Å; I551-V582 HydrophobicContact CG1-CG2 4.27Å; I551-V582 HydrophobicContact CG2-CB 4.48Å; E578-V582 HydrophobicContact CG-CG1 4.37Å; E578-V582 WeakPolarHBondContact O-CG1 3.48Å; E578-V582 WeakPolarHBondContact O-CG2 3.33Å; E578-V582 PolarHBondContact O-N 3.38Å; L579-V582 WeakPolarHBondContact O-CG2 3.3Å; V582-R586 VanDerWaalsContact O-CB 3.25Å; V582-R586 WeakPolarHBondContact O-CB 3.29Å; V582-R586 PolarHBondContact O-N 3.03Å
583	C	96.9	Very high	94.5	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.007	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-44.4	177.2	-72	0	0	0	0	111.9	T559 L563 L579 Y580 D581 R586 F587	T559-C583 HydrophobicContact CG2-CB 4.32Å; L563-C583 HydrophobicContact CD1-CB 3.83Å; L563-C583 HydrophobicContact CD2-CB 4.18Å; L563-C583 HydrophobicContact CG-CB 4.22Å; L579-C583 WeakPolarHBondContact O-CB 3.45Å; L579-C583 PolarHBondContact O-N 2.96Å; L579-C583 VanDerWaalsContact O-N 3.17Å; L579-C583 PolarHBondContact O-SG 3.06Å; Y580-C583 PolarHBondContact O-N 3.45Å; D581-C583 VanDerWaalsContact C-N 3.34Å; C583-R586 WeakPolarHBondContact O-CB 3.5Å; C583-R586 PolarHBondContact O-N 3.43Å; C583-F587 WeakPolarHBondContact O-CD1 3.48Å; C583-F587 PolarHBondContact O-N 2.95Å; C583-F587 VanDerWaalsContact O-N 3.08Å
584	I	97.5	Very high	94.4	Very high	26 Å²	26	54 Å²	54	13%	0.133	30%	0.299	C	S	.	.	H	α-helix	trans	-59.9	-52.9	176.2	-68.7	161.7	0	0	0	109.6	Y580 D581 R586 F587 T588 L606 P613	Y580-I584 WeakPolarHBondContact O-CB 3.4Å; Y580-I584 WeakPolarHBondContact O-CD1 3.43Å; Y580-I584 WeakPolarHBondContact O-CG1 3.45Å; Y580-I584 PolarHBondContact O-N 3.24Å; D581-I584 PolarHBondContact O-N 2.83Å; I584-R586 PolarHBondContact O-N 2.87Å; I584-R586 VanDerWaalsContact O-N 3.17Å; I584-F587 VanDerWaalsContact CA-CE1 3.43Å; I584-F587 HydrophobicContact CB-CE1 4.19Å; I584-F587 HydrophobicContact CB-CZ 4.17Å; I584-F587 HydrophobicContact CG1-CE1 3.87Å; I584-F587 HydrophobicContact CG1-CZ 3.86Å; I584-F587 HydrophobicContact CG2-CZ 4.26Å; I584-F587 PolarHBondContact O-N 2.87Å; I584-T588 WeakPolarHBondContact O-CB 3.49Å; I584-T588 PolarHBondContact O-N 3.15Å; I584-T588 PolarHBondContact O-OG1 3.31Å; I584-L606 HydrophobicContact CG1-CD2 4.46Å; I584-P613 HydrophobicContact CD1-CG 3.9Å; I584-P613 HydrophobicContact CG1-CG 3.99Å; I584-P613 HydrophobicContact CG2-CB 4.13Å; I584-P613 HydrophobicContact CG2-CG 3.96Å
585	K	97.1	Very high	94.3	Very high	144 Å²	144	51.4 Å²	51.4	63%	0.626	28%	0.275	S	S	*	.	H	α-helix	trans	-54.7	-37.4	175.8	-72.5	167.9	-173	163.7	0	112.4	D581 P589	D581-K585 WeakPolarHBondContact O-CB 3.44Å; D581-K585 WeakPolarHBondContact O-CD 3.36Å; D581-K585 VanDerWaalsContact O-CG 3.23Å; D581-K585 WeakPolarHBondContact O-CG 3.35Å; D581-K585 PolarHBondContact O-N 3.35Å; K585-P589 VanDerWaalsContact O-CD 3.26Å; K585-P589 WeakPolarHBondContact O-CD 3.39Å
586	R	96.3	Very high	94.4	Very high	60 Å²	60	46 Å²	46	23%	0.226	25%	0.25	C	C	.	.	H	α-helix	trans	-67.7	-42.4	-179.7	-178.8	60.4	178.5	136.1	-12.1	113.2	I551 D552 I554 T559 V582 C583 I584	I551-R586 HydrophobicContact CD1-CB 4.03Å; I551-R586 HydrophobicContact CD1-CG 4.09Å; I551-R586 HydrophobicContact CG1-CB 3.75Å; I551-R586 HydrophobicContact CG1-CG 3.94Å; I551-R586 PolarHBondContact O-NE 3.4Å; D552-R586 PolarHBondContact O-NH2 2.84Å; I554-R586 PolarHBondContact O-NE 3Å; I554-R586 PolarHBondContact O-NH2 2.9Å; I554-R586 VanDerWaalsContact O-NH2 3.13Å; T559-R586 HydrophobicContact CG2-CB 4.31Å; T559-R586 HydrophobicContact CG2-CG 4.12Å; V582-R586 VanDerWaalsContact O-CB 3.25Å; V582-R586 WeakPolarHBondContact O-CB 3.29Å; V582-R586 PolarHBondContact O-N 3.03Å; C583-R586 WeakPolarHBondContact O-CB 3.5Å; C583-R586 PolarHBondContact O-N 3.43Å; I584-R586 PolarHBondContact O-N 2.87Å; I584-R586 VanDerWaalsContact O-N 3.17Å
587	F	96.1	Very high	94.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-91.5	-22.3	-176	74.1	-114.7	0	0	0	114.1	F556 C583 I584 H590 I591 F594 L602 L606 P613 L616	F556-F587 HydrophobicContact CB-CB 4.34Å; C583-F587 WeakPolarHBondContact O-CD1 3.48Å; C583-F587 PolarHBondContact O-N 2.95Å; C583-F587 VanDerWaalsContact O-N 3.08Å; I584-F587 VanDerWaalsContact CA-CE1 3.43Å; I584-F587 HydrophobicContact CB-CE1 4.19Å; I584-F587 HydrophobicContact CB-CZ 4.17Å; I584-F587 HydrophobicContact CG1-CE1 3.87Å; I584-F587 HydrophobicContact CG1-CZ 3.86Å; I584-F587 HydrophobicContact CG2-CZ 4.26Å; I584-F587 PolarHBondContact O-N 2.87Å; F587-H590 CarbonylContact O-C 3.6Å; F587-H590 WeakPolarHBondContact O-CA 3.32Å; F587-H590 PolarHBondContact O-N 3.27Å; F587-I591 HydrophobicContact CD2-CG1 4.33Å; F587-I591 PolarHBondContact O-N 2.85Å; F587-F594 HydrophobicContact CB-CE2 3.93Å; F587-F594 HydrophobicContact CB-CZ 3.95Å; F587-L602 HydrophobicContact CD1-CD2 3.89Å; F587-L602 HydrophobicContact CD2-CD2 4.05Å; F587-L602 HydrophobicContact CE1-CD1 4.26Å; F587-L602 HydrophobicContact CE1-CD2 3.96Å; F587-L602 HydrophobicContact CE1-CG 4.44Å; F587-L602 HydrophobicContact CE2-CD2 4.16Å; F587-L602 HydrophobicContact CG-CD2 3.98Å; F587-L602 HydrophobicContact CZ-CD2 4.12Å; F587-L606 HydrophobicContact CE1-CD1 4.1Å; F587-L606 HydrophobicContact CZ-CD1 3.66Å; F587-P613 HydrophobicContact CZ-CG 4.48Å; F587-L616 HydrophobicContact CE2-CD2 4.07Å; F587-L616 HydrophobicContact CZ-CD2 4.18Å
588	T	96.8	Very high	94.4	Very high	32 Å²	32	41.1 Å²	41.1	20%	0.196	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-52	-47.6	-176.7	-69.3	0	0	0	0	113.8	I584 H590 I591 E615	I584-T588 WeakPolarHBondContact O-CB 3.49Å; I584-T588 PolarHBondContact O-N 3.15Å; I584-T588 PolarHBondContact O-OG1 3.31Å; T588-H590 PolarHBondContact O-N 3.4Å; T588-I591 HydrophobicContact CG2-CD1 4.28Å; T588-I591 WeakPolarHBondContact O-CD1 3.42Å; T588-I591 VanDerWaalsContact O-CG1 3.32Å; T588-I591 WeakPolarHBondContact O-CG1 3.12Å; T588-I591 PolarHBondContact O-N 3.48Å; T588-E615 WeakPolarHBondContact CG2-OE2 3.36Å
589	P	96.3	Very high	94.4	Very high	95 Å²	95	36.7 Å²	36.7	62%	0.617	20%	0.201	S	C	*	.	G	3₁₀ helix	trans	-64	-14.7	178.3	-21.7	34.1	0	0	0	114.3	K585	K585-P589 VanDerWaalsContact O-CD 3.26Å; K585-P589 WeakPolarHBondContact O-CD 3.39Å
590	H	94.3	Very high	94.4	Very high	56 Å²	56	36.7 Å²	36.7	26%	0.259	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-112.9	10.5	-173.6	-60.3	-67.9	0	0	0	113	F556 F587 T588 S592 S593 F594	F556-H590 HydrophobicContact CB-CB 4.11Å; F556-H590 HydrophobicContact CD1-CB 3.88Å; F556-H590 AromaticContact CD1-CD2 3.76Å; F556-H590 AromaticContact CD1-CG 3.63Å; F556-H590 HydrophobicContact CD2-CB 3.7Å; F556-H590 HydrophobicContact CE1-CB 4.21Å; F556-H590 HydrophobicContact CE2-CB 4.06Å; F556-H590 HydrophobicContact CG-CB 3.62Å; F556-H590 AromaticContact CG-CD2 3.87Å; F556-H590 AromaticContact CG-CG 3.78Å; F556-H590 HydrophobicContact CZ-CB 4.3Å; F587-H590 CarbonylContact O-C 3.6Å; F587-H590 WeakPolarHBondContact O-CA 3.32Å; F587-H590 PolarHBondContact O-N 3.27Å; T588-H590 PolarHBondContact O-N 3.4Å; H590-S592 VanDerWaalsContact C-N 3.26Å; H590-S592 PolarHBondContact O-N 3.3Å; H590-S593 WeakPolarHBondContact O-CA 3.34Å; H590-S593 VanDerWaalsContact O-CB 3.31Å; H590-S593 WeakPolarHBondContact O-CB 3.35Å; H590-S593 PolarHBondContact O-N 3.06Å; H590-F594 VanDerWaalsContact O-CD2 3.3Å; H590-F594 WeakPolarHBondContact O-CD2 3.25Å; H590-F594 PolarHBondContact O-N 3.43Å
591	I	94.6	Very high	94.4	Very high	15 Å²	15	37 Å²	37	8%	0.077	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-50	-45.7	-178.8	-77.9	168.4	0	0	0	112	F587 T588 S593 F594 L599 E615 L616 E619	F587-I591 HydrophobicContact CD2-CG1 4.33Å; F587-I591 PolarHBondContact O-N 2.85Å; T588-I591 HydrophobicContact CG2-CD1 4.28Å; T588-I591 WeakPolarHBondContact O-CD1 3.42Å; T588-I591 VanDerWaalsContact O-CG1 3.32Å; T588-I591 WeakPolarHBondContact O-CG1 3.12Å; T588-I591 PolarHBondContact O-N 3.48Å; I591-S593 PolarHBondContact O-N 3.25Å; I591-F594 PolarHBondContact O-N 3Å; I591-L599 HydrophobicContact CG2-CD2 4Å; I591-E615 HydrophobicContact CD1-CB 4.17Å; I591-L616 HydrophobicContact CD1-CB 4.24Å; I591-L616 HydrophobicContact CG1-CD1 4.39Å; I591-E619 HydrophobicContact CG2-CB 3.88Å; I591-E619 HydrophobicContact CG2-CG 3.65Å
592	S	89.2	Confident	94.4	Very high	91 Å²	91	33.1 Å²	33.1	64%	0.636	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-68.7	-18.1	179	57.5	0	0	0	0	114.3	H590	H590-S592 VanDerWaalsContact C-N 3.26Å; H590-S592 PolarHBondContact O-N 3.3Å
593	S	88.6	Confident	94.4	Very high	70 Å²	70	32 Å²	32	49%	0.49	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-87.7	-10	179.6	-56.1	0	0	0	0	112.9	H590 I591	H590-S593 WeakPolarHBondContact O-CA 3.34Å; H590-S593 VanDerWaalsContact O-CB 3.31Å; H590-S593 WeakPolarHBondContact O-CB 3.35Å; H590-S593 PolarHBondContact O-N 3.06Å; I591-S593 PolarHBondContact O-N 3.25Å
594	F	89.6	Confident	94.5	Very high	10 Å²	10	32.4 Å²	32.4	4%	0.044	18%	0.177	C	C	.	.	S	Bend	trans	-72.9	147.8	175.4	-83.5	-100.8	0	0	0	112.2	F556 F587 H590 I591 L598 L599 L602	F556-F594 AromaticContact CD2-CD2 3.99Å; F556-F594 HydrophobicContact CD2-CD2 3.99Å; F556-F594 HydrophobicContact CD2-CE1 4.41Å; F556-F594 AromaticContact CD2-CE2 3.4Å; F556-F594 HydrophobicContact CD2-CE2 3.4Å; F556-F594 AromaticContact CD2-CZ 3.64Å; F556-F594 HydrophobicContact CD2-CZ 3.64Å; F556-F594 HydrophobicContact CE2-CD2 4.03Å; F556-F594 AromaticContact CE2-CE2 3.91Å; F556-F594 HydrophobicContact CE2-CE2 3.91Å; F556-F594 HydrophobicContact CE2-CZ 4.28Å; F556-F594 HydrophobicContact CG-CE2 4.47Å; F587-F594 HydrophobicContact CB-CE2 3.93Å; F587-F594 HydrophobicContact CB-CZ 3.95Å; H590-F594 VanDerWaalsContact O-CD2 3.3Å; H590-F594 WeakPolarHBondContact O-CD2 3.25Å; H590-F594 PolarHBondContact O-N 3.43Å; I591-F594 PolarHBondContact O-N 3Å; F594-L598 HydrophobicContact CD1-CB 4.28Å; F594-L598 HydrophobicContact CD1-CD2 3.72Å; F594-L598 HydrophobicContact CD1-CG 3.82Å; F594-L598 HydrophobicContact CE1-CD2 3.96Å; F594-L598 HydrophobicContact CE1-CG 4.14Å; F594-L599 HydrophobicContact CB-CB 4.05Å; F594-L599 HydrophobicContact CB-CD1 3.88Å; F594-L599 HydrophobicContact CB-CG 4.44Å; F594-L599 HydrophobicContact CD1-CD1 4.25Å; F594-L599 HydrophobicContact CD2-CD1 3.89Å; F594-L599 HydrophobicContact CE2-CD1 4.46Å; F594-L599 HydrophobicContact CG-CD1 3.77Å; F594-L602 HydrophobicContact CE1-CD2 4.07Å; F594-L602 HydrophobicContact CZ-CD2 3.96Å
595	D	87.6	Confident	94.5	Very high	23 Å²	23	31.3 Å²	31.3	12%	0.123	17%	0.171	C	C	.	.			trans	-64.3	134.7	160.3	-67.8	-59.3	0	0	0	110.1	C269 H597 L598 L599	C269-D595 WeakPolarHBondContact CB-OD1 3.32Å; C269-D595 PolarHBondContact N-OD1 3.49Å; D595-H597 VanDerWaalsContact C-N 3.33Å; D595-H597 PolarHBondContact O-N 3.01Å; D595-L598 HydrophobicContact CB-CB 4.35Å; D595-L598 WeakPolarHBondContact O-CB 3.47Å; D595-L598 PolarHBondContact O-N 3.32Å; D595-L599 PolarHBondContact O-N 3.38Å; D595-L599 VanDerWaalsContact O-N 3.08Å
596	P	92.8	Very high	94.5	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.006	14%	0.142	C	C	.	.	H	α-helix	trans	-52.9	-45.6	-174.6	-29.2	32.6	0	0	0	114.2	L598 L599 V600 F625 K628 L629	P596-L598 VanDerWaalsContact C-N 3.28Å; P596-L598 PolarHBondContact O-N 2.93Å; P596-L599 PolarHBondContact O-N 2.85Å; P596-V600 WeakPolarHBondContact O-CG2 3.38Å; P596-V600 PolarHBondContact O-N 2.88Å; P596-V600 VanDerWaalsContact O-N 3.07Å; P596-F625 HydrophobicContact CB-CE1 4.37Å; P596-F625 HydrophobicContact CB-CE2 3.91Å; P596-F625 HydrophobicContact CB-CZ 3.73Å; P596-F625 HydrophobicContact CG-CE2 4.46Å; P596-F625 WeakPolarHBondContact O-CZ 3.18Å; P596-K628 HydrophobicContact CG-CB 4.43Å; P596-K628 HydrophobicContact CG-CD 3.91Å; P596-K628 HydrophobicContact CG-CG 3.85Å; P596-L629 HydrophobicContact CB-CB 3.97Å; P596-L629 HydrophobicContact CB-CD1 3.71Å; P596-L629 HydrophobicContact CB-CG 4.43Å
597	H	92.4	Very high	94.6	Very high	15 Å²	15	21.6 Å²	21.6	7%	0.069	13%	0.131	C	C	.	.	H	α-helix	trans	-59.9	-37.2	177.4	74.7	-78.7	0	0	0	112.9	D595 L601 Q632 L636 T644	D595-H597 VanDerWaalsContact C-N 3.33Å; D595-H597 PolarHBondContact O-N 3.01Å; H597-L601 VanDerWaalsContact O-CG 3.26Å; H597-L601 WeakPolarHBondContact O-CG 3.35Å; H597-L601 PolarHBondContact O-N 2.91Å; H597-L601 VanDerWaalsContact O-N 3.1Å; H597-Q632 PolarHBondContact ND1-NE2 3.29Å; H597-Q632 VanDerWaalsContact ND1-NE2 3.15Å; H597-Q632 PolarHBondContact ND1-OE1 3.41Å; H597-L636 HydrophobicContact CB-CD1 4.2Å; H597-T644 HydrophobicContact CB-CG2 3.68Å
598	L	92.6	Very high	94.6	Very high	19 Å²	19	21.8 Å²	21.8	10%	0.099	13%	0.132	C	C	.	.	H	α-helix	trans	-70.9	-38	179.9	-176.4	60.9	0	0	0	110.9	Y560 F594 D595 P596 L601 L602	Y560-L598 HydrophobicContact CD1-CD1 3.41Å; Y560-L598 VanDerWaalsContact CD1-CD1 3.41Å; Y560-L598 HydrophobicContact CE1-CD1 3.96Å; Y560-L598 HydrophobicContact CG-CD1 4.03Å; F594-L598 HydrophobicContact CD1-CB 4.28Å; F594-L598 HydrophobicContact CD1-CD2 3.72Å; F594-L598 HydrophobicContact CD1-CG 3.82Å; F594-L598 HydrophobicContact CE1-CD2 3.96Å; F594-L598 HydrophobicContact CE1-CG 4.14Å; D595-L598 HydrophobicContact CB-CB 4.35Å; D595-L598 WeakPolarHBondContact O-CB 3.47Å; D595-L598 PolarHBondContact O-N 3.32Å; P596-L598 VanDerWaalsContact C-N 3.28Å; P596-L598 PolarHBondContact O-N 2.93Å; L598-L601 PolarHBondContact O-N 3.16Å; L598-L602 WeakPolarHBondContact O-CB 3.37Å; L598-L602 PolarHBondContact O-N 3.43Å
599	L	95.3	Very high	94.5	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-64.6	-40.9	176.7	-160.1	69.2	0	0	0	111.7	I591 F594 D595 P596 L601 L602 A603 L616 E619 I620 F625	I591-L599 HydrophobicContact CG2-CD2 4Å; F594-L599 HydrophobicContact CB-CB 4.05Å; F594-L599 HydrophobicContact CB-CD1 3.88Å; F594-L599 HydrophobicContact CB-CG 4.44Å; F594-L599 HydrophobicContact CD1-CD1 4.25Å; F594-L599 HydrophobicContact CD2-CD1 3.89Å; F594-L599 HydrophobicContact CE2-CD1 4.46Å; F594-L599 HydrophobicContact CG-CD1 3.77Å; D595-L599 PolarHBondContact O-N 3.38Å; D595-L599 VanDerWaalsContact O-N 3.08Å; P596-L599 PolarHBondContact O-N 2.85Å; L599-L601 VanDerWaalsContact C-N 3.35Å; L599-L601 PolarHBondContact O-N 3.12Å; L599-L602 PolarHBondContact O-N 2.96Å; L599-A603 WeakPolarHBondContact O-CB 3.43Å; L599-A603 PolarHBondContact O-N 3.1Å; L599-L616 HydrophobicContact CD1-CD1 3.32Å; L599-L616 HydrophobicContact CD2-CD1 3.93Å; L599-L616 HydrophobicContact CG-CD1 3.52Å; L599-E619 HydrophobicContact CD2-CG 4.37Å; L599-I620 HydrophobicContact CD2-CD1 4.36Å; L599-I620 HydrophobicContact CD2-CG1 3.8Å; L599-I620 HydrophobicContact CG-CD1 4.09Å; L599-I620 HydrophobicContact CG-CG1 4.06Å; L599-F625 HydrophobicContact CB-CE2 4.18Å; L599-F625 HydrophobicContact CB-CZ 4.11Å; L599-F625 HydrophobicContact CD2-CD2 4.24Å; L599-F625 HydrophobicContact CD2-CE2 3.5Å; L599-F625 VanDerWaalsContact CD2-CE2 3.5Å; L599-F625 HydrophobicContact CD2-CZ 4.02Å; L599-F625 HydrophobicContact CG-CE2 4.43Å
600	V	97.2	Very high	94.5	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.4	-43.8	172	171.6	0	0	0	0	111.4	P596 Y604 I620 F625 L629 T644 R647 L648	P596-V600 WeakPolarHBondContact O-CG2 3.38Å; P596-V600 PolarHBondContact O-N 2.88Å; P596-V600 VanDerWaalsContact O-N 3.07Å; V600-Y604 WeakPolarHBondContact O-CB 3.48Å; V600-Y604 PolarHBondContact O-N 3.1Å; V600-I620 HydrophobicContact CG2-CG2 4.45Å; V600-F625 HydrophobicContact CG2-CE1 4.01Å; V600-F625 HydrophobicContact CG2-CZ 4.17Å; V600-L629 HydrophobicContact CG2-CD2 3.97Å; V600-T644 HydrophobicContact CB-CG2 4.48Å; V600-T644 HydrophobicContact CG1-CG2 4.45Å; V600-R647 HydrophobicContact CG1-CB 4.23Å; V600-L648 HydrophobicContact CG1-CB 3.88Å; V600-L648 HydrophobicContact CG1-CD1 4.43Å; V600-L648 HydrophobicContact CG2-CD1 4.14Å
601	L	96.4	Very high	94.6	Very high	10 Å²	10	20.4 Å²	20.4	5%	0.052	12%	0.122	C	C	.	.	H	α-helix	trans	-65.6	-39	178.5	-70.4	177.2	0	0	0	112.4	Y560 H597 L598 L599 C605 R643 R647	Y560-L601 HydrophobicContact CE1-CB 4.2Å; Y560-L601 HydrophobicContact CE1-CD1 4.38Å; Y560-L601 HydrophobicContact CE2-CB 3.93Å; Y560-L601 VanDerWaalsContact CE2-O 3.32Å; Y560-L601 WeakPolarHBondContact CE2-O 3.32Å; H597-L601 VanDerWaalsContact O-CG 3.26Å; H597-L601 WeakPolarHBondContact O-CG 3.35Å; H597-L601 PolarHBondContact O-N 2.91Å; H597-L601 VanDerWaalsContact O-N 3.1Å; L598-L601 PolarHBondContact O-N 3.16Å; L599-L601 VanDerWaalsContact C-N 3.35Å; L599-L601 PolarHBondContact O-N 3.12Å; L601-C605 WeakPolarHBondContact O-CB 3.47Å; L601-C605 PolarHBondContact O-N 3.38Å; L601-R643 HydrophobicContact CD2-CG 4.39Å; L601-R647 HydrophobicContact CD2-CB 4.12Å; L601-R647 HydrophobicContact CD2-CG 3.82Å
602	L	97.4	Very high	94.7	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.8	-49.9	175.4	173.7	61	0	0	0	111.5	Y560 L563 F587 F594 L598 L599 Y604 C605 L606	Y560-L602 HydrophobicContact CD2-CB 4.13Å; Y560-L602 HydrophobicContact CD2-CD1 4.29Å; Y560-L602 HydrophobicContact CG-CB 4.45Å; L563-L602 HydrophobicContact CD1-CD1 4.46Å; F587-L602 HydrophobicContact CD1-CD2 3.89Å; F587-L602 HydrophobicContact CD2-CD2 4.05Å; F587-L602 HydrophobicContact CE1-CD1 4.26Å; F587-L602 HydrophobicContact CE1-CD2 3.96Å; F587-L602 HydrophobicContact CE1-CG 4.44Å; F587-L602 HydrophobicContact CE2-CD2 4.16Å; F587-L602 HydrophobicContact CG-CD2 3.98Å; F587-L602 HydrophobicContact CZ-CD2 4.12Å; F594-L602 HydrophobicContact CE1-CD2 4.07Å; F594-L602 HydrophobicContact CZ-CD2 3.96Å; L598-L602 WeakPolarHBondContact O-CB 3.37Å; L598-L602 PolarHBondContact O-N 3.43Å; L599-L602 PolarHBondContact O-N 2.96Å; L602-Y604 VanDerWaalsContact C-N 3.31Å; L602-Y604 PolarHBondContact O-N 2.92Å; L602-C605 WeakPolarHBondContact O-CA 3.34Å; L602-C605 WeakPolarHBondContact O-CB 3.43Å; L602-C605 PolarHBondContact O-N 3.4Å; L602-L606 HydrophobicContact CD1-CD1 4.32Å; L602-L606 HydrophobicContact CD1-CG 4.35Å; L602-L606 HydrophobicContact CG-CD1 4.32Å; L602-L606 WeakPolarHBondContact O-CG 3.44Å; L602-L606 PolarHBondContact O-N 2.96Å
603	A	98.1	Very high	95.1	Very high	2 Å²	2	17.8 Å²	17.8	2%	0.017	10%	0.101	C	C	.	.	H	α-helix	trans	-61.6	-39.7	178.9	0	0	0	0	0	112.2	L599 C605 L606 A607 L616 I620 L651	L599-A603 WeakPolarHBondContact O-CB 3.43Å; L599-A603 PolarHBondContact O-N 3.1Å; A603-C605 VanDerWaalsContact C-N 3.33Å; A603-C605 PolarHBondContact O-N 2.94Å; A603-L606 PolarHBondContact O-N 3.19Å; A603-A607 PolarHBondContact O-N 2.89Å; A603-L616 HydrophobicContact CB-CD2 3.82Å; A603-L616 HydrophobicContact CB-CG 4.13Å; A603-I620 HydrophobicContact CB-CD1 3.27Å; A603-L651 HydrophobicContact CB-CD1 4.01Å; A603-L651 HydrophobicContact CB-CD2 3.52Å; A603-L651 HydrophobicContact CB-CG 4.42Å
604	Y	98.2	Very high	95.4	Very high	11 Å²	11	19 Å²	19	4%	0.043	10%	0.099	C	C	.	.	H	α-helix	trans	-62.5	-39.9	171.6	175.6	-95.7	0	0	0	112.3	V600 L602 L606 A607 L608 R647 E650 M789	V600-Y604 WeakPolarHBondContact O-CB 3.48Å; V600-Y604 PolarHBondContact O-N 3.1Å; L602-Y604 VanDerWaalsContact C-N 3.31Å; L602-Y604 PolarHBondContact O-N 2.92Å; Y604-L606 VanDerWaalsContact C-N 3.29Å; Y604-L606 PolarHBondContact O-N 2.67Å; Y604-A607 PolarHBondContact O-N 3.48Å; Y604-L608 HydrophobicContact CD1-CD1 4.2Å; Y604-L608 HydrophobicContact CD1-CG 4.31Å; Y604-L608 HydrophobicContact CE1-CD1 3.6Å; Y604-L608 HydrophobicContact CE1-CD2 4.17Å; Y604-L608 HydrophobicContact CE1-CG 3.82Å; Y604-L608 HydrophobicContact CE2-CD2 4.43Å; Y604-L608 WeakPolarHBondContact O-CG 3.43Å; Y604-L608 PolarHBondContact O-N 3.12Å; Y604-R647 VanDerWaalsContact CE1-CD 3.4Å; Y604-R647 HydrophobicContact CG-CB 4.38Å; Y604-R647 VanDerWaalsContact CZ-NH1 3.34Å; Y604-R647 PolarHBondContact OH-NH1 3.16Å; Y604-E650 HydrophobicContact CD2-CB 3.9Å; Y604-E650 HydrophobicContact CE2-CB 3.54Å; Y604-E650 HydrophobicContact CE2-CG 4.39Å; Y604-E650 WeakPolarHBondContact CE2-OE2 3.22Å; Y604-M789 HydrophobicContact CE2-CE 3.94Å
605	C	97.4	Very high	95.8	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.014	13%	0.126	C	C	.	.	H	α-helix	trans	-60.5	-39.6	175.6	-168.8	0	0	0	0	111.9	Y560 S567 L601 L602 A603	Y560-C605 HydrophobicContact CD2-CB 4.12Å; Y560-C605 HydrophobicContact CE2-CB 3.94Å; S567-C605 WeakPolarHBondContact CB-O 2.9Å; S567-C605 WeakPolarHBondContact CB-SG 3.47Å; S567-C605 PolarHBondContact OG-O 3.46Å; S567-C605 PolarHBondContact OG-SG 2.64Å; S567-C605 VanDerWaalsContact OG-SG 3.37Å; L601-C605 WeakPolarHBondContact O-CB 3.47Å; L601-C605 PolarHBondContact O-N 3.38Å; L602-C605 WeakPolarHBondContact O-CA 3.34Å; L602-C605 WeakPolarHBondContact O-CB 3.43Å; L602-C605 PolarHBondContact O-N 3.4Å; A603-C605 VanDerWaalsContact C-N 3.33Å; A603-C605 PolarHBondContact O-N 2.94Å
606	L	97.9	Very high	96.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-70	-42.6	176.5	-64.6	170.5	0	0	0	111.5	L563 Y580 I584 F587 L602 A603 Y604 L608 A609 D610 H611 P613 L616	L563-L606 HydrophobicContact CD1-CD2 3.88Å; Y580-L606 HydrophobicContact CD1-CD2 3.74Å; Y580-L606 HydrophobicContact CE1-CD2 3.97Å; I584-L606 HydrophobicContact CG1-CD2 4.46Å; F587-L606 HydrophobicContact CE1-CD1 4.1Å; F587-L606 HydrophobicContact CZ-CD1 3.66Å; L602-L606 HydrophobicContact CD1-CD1 4.32Å; L602-L606 HydrophobicContact CD1-CG 4.35Å; L602-L606 HydrophobicContact CG-CD1 4.32Å; L602-L606 WeakPolarHBondContact O-CG 3.44Å; L602-L606 PolarHBondContact O-N 2.96Å; A603-L606 PolarHBondContact O-N 3.19Å; Y604-L606 VanDerWaalsContact C-N 3.29Å; Y604-L606 PolarHBondContact O-N 2.67Å; L606-L608 VanDerWaalsContact C-N 3.29Å; L606-L608 PolarHBondContact O-N 3.4Å; L606-A609 CarbonylContact O-C 3.46Å; L606-A609 VanDerWaalsContact O-C 3.32Å; L606-A609 WeakPolarHBondContact O-CA 3.12Å; L606-A609 PolarHBondContact O-N 2.89Å; L606-D610 PolarHBondContact O-N 3.24Å; L606-D610 VanDerWaalsContact O-N 3.14Å; L606-H611 CarbonylContact C-O 3.6Å; L606-H611 HydrophobicContact CB-CB 4.14Å; L606-H611 VanDerWaalsContact CB-O 3.24Å; L606-H611 WeakPolarHBondContact CB-O 3.44Å; L606-H611 HydrophobicContact CD2-CB 4.37Å; L606-H611 PolarHBondContact O-N 3.29Å; L606-P613 HydrophobicContact CD1-CG 3.99Å; L606-L616 HydrophobicContact CD1-CD2 3.68Å
607	A	97.8	Very high	96.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.7	-36.8	176.5	0	0	0	0	0	113	A603 Y604 A609 D610 H611 F612 L651 A654 M789 R792	A603-A607 PolarHBondContact O-N 2.89Å; Y604-A607 PolarHBondContact O-N 3.48Å; A607-A609 PolarHBondContact O-N 3.49Å; A607-D610 PolarHBondContact O-N 2.98Å; A607-H611 PolarHBondContact N-O 2.97Å; A607-F612 HydrophobicContact CB-CD1 4.33Å; A607-F612 HydrophobicContact CB-CE1 3.52Å; A607-F612 HydrophobicContact CB-CZ 3.81Å; A607-L651 HydrophobicContact CB-CD1 4.11Å; A607-A654 HydrophobicContact CB-CB 4.06Å; A607-M789 HydrophobicContact CB-SD 4.45Å; A607-R792 PolarHBondContact O-NH2 2.91Å; A607-R792 VanDerWaalsContact O-NH2 3.1Å
608	L	96.7	Very high	96.6	Very high	4 Å²	4	29.4 Å²	29.4	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-55.5	-37.6	172.4	-75.8	-179.1	0	0	0	112.4	V568 Y604 L606 E786 M789 R792	V568-L608 HydrophobicContact CG2-CD1 4.04Å; Y604-L608 HydrophobicContact CD1-CD1 4.2Å; Y604-L608 HydrophobicContact CD1-CG 4.31Å; Y604-L608 HydrophobicContact CE1-CD1 3.6Å; Y604-L608 HydrophobicContact CE1-CD2 4.17Å; Y604-L608 HydrophobicContact CE1-CG 3.82Å; Y604-L608 HydrophobicContact CE2-CD2 4.43Å; Y604-L608 WeakPolarHBondContact O-CG 3.43Å; Y604-L608 PolarHBondContact O-N 3.12Å; L606-L608 VanDerWaalsContact C-N 3.29Å; L606-L608 PolarHBondContact O-N 3.4Å; L608-E786 HydrophobicContact CD2-CB 4.16Å; L608-M789 HydrophobicContact CD2-CB 4.31Å; L608-M789 HydrophobicContact CD2-CE 3.87Å; L608-M789 HydrophobicContact CD2-SD 3.97Å; L608-R792 PolarHBondContact O-NH1 3.44Å
609	A	95.2	Very high	96.9	Very high	23 Å²	23	31.9 Å²	31.9	19%	0.19	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	14.4	179.6	0	0	0	0	0	113.4	Y580 L606 A607 H611	Y580-A609 HydrophobicContact CE1-CB 3.97Å; Y580-A609 HydrophobicContact CE2-CB 4.21Å; Y580-A609 VanDerWaalsContact OH-CB 3.23Å; Y580-A609 WeakPolarHBondContact OH-CB 3.29Å; L606-A609 CarbonylContact O-C 3.46Å; L606-A609 VanDerWaalsContact O-C 3.32Å; L606-A609 WeakPolarHBondContact O-CA 3.12Å; L606-A609 PolarHBondContact O-N 2.89Å; A607-A609 PolarHBondContact O-N 3.49Å; A609-H611 VanDerWaalsContact C-N 3.28Å; A609-H611 PolarHBondContact O-CD2 3.4Å; A609-H611 PolarHBondContact O-N 3.21Å
610	D	94.8	Very high	96.9	Very high	89 Å²	89	31.8 Å²	31.8	48%	0.476	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	27.3	177.9	-158.4	23.7	0	0	0	114.7	L606 A607	L606-D610 PolarHBondContact O-N 3.24Å; L606-D610 VanDerWaalsContact O-N 3.14Å; A607-D610 PolarHBondContact O-N 2.98Å
611	H	96.3	Very high	96.9	Very high	43 Å²	43	33.2 Å²	33.2	20%	0.199	16%	0.158	C	C	.	.			trans	-109.1	126.1	174.1	-66.6	-79.8	0	0	0	111.2	Y580 L606 A607 A609	Y580-H611 AromaticContact CD1-CD2 3.72Å; Y580-H611 AromaticContact CD2-CD2 3.84Å; Y580-H611 AromaticContact CD2-NE2 3.35Å; Y580-H611 WeakPolarHBondContact CD2-NE2 3.33Å; Y580-H611 AromaticContact CE2-NE2 3.92Å; Y580-H611 AromaticContact CG-CD2 3.63Å; Y580-H611 AromaticContact CG-NE2 3.45Å; L606-H611 CarbonylContact C-O 3.6Å; L606-H611 HydrophobicContact CB-CB 4.14Å; L606-H611 VanDerWaalsContact CB-O 3.24Å; L606-H611 WeakPolarHBondContact CB-O 3.44Å; L606-H611 HydrophobicContact CD2-CB 4.37Å; L606-H611 PolarHBondContact O-N 3.29Å; A607-H611 PolarHBondContact N-O 2.97Å; A609-H611 VanDerWaalsContact C-N 3.28Å; A609-H611 PolarHBondContact O-CD2 3.4Å; A609-H611 PolarHBondContact O-N 3.21Å
612	F	97.4	Very high	96.9	Very high	29 Å²	29	34.5 Å²	34.5	13%	0.127	17%	0.168	C	C	.	.			trans	-131.3	76.8	-178.8	-60.7	-91.2	0	0	0	112.2	A607 E614 I617 A654 V655 E658 C659 F662	A607-F612 HydrophobicContact CB-CD1 4.33Å; A607-F612 HydrophobicContact CB-CE1 3.52Å; A607-F612 HydrophobicContact CB-CZ 3.81Å; F612-E614 PolarHBondContact O-N 3.5Å; F612-E614 VanDerWaalsContact O-N 3.15Å; F612-I617 HydrophobicContact CB-CG1 4.45Å; F612-I617 HydrophobicContact CD1-CD1 4.47Å; F612-A654 HydrophobicContact CE1-CB 3.97Å; F612-A654 HydrophobicContact CZ-CB 4.16Å; F612-V655 HydrophobicContact CD1-CG2 4.11Å; F612-V655 HydrophobicContact CE1-CG2 4.23Å; F612-E658 HydrophobicContact CE2-CB 3.94Å; F612-E658 HydrophobicContact CE2-CG 4.49Å; F612-E658 HydrophobicContact CZ-CB 3.9Å; F612-E658 HydrophobicContact CZ-CG 4.21Å; F612-E658 WeakPolarHBondContact CZ-OE1 3.32Å; F612-C659 VanDerWaalsContact CD2-SG 3.55Å; F612-C659 WeakPolarHBondContact CG-SG 3.46Å; F612-F662 HydrophobicContact CB-CE2 4.07Å
613	P	97.1	Very high	96.8	Very high	21 Å²	21	42.1 Å²	42.1	14%	0.136	21%	0.207	C	C	.	.			trans	-59.8	119.8	177.8	-20.6	32	0	0	0	111.2	I584 F587 L606 E615 L616 I617	I584-P613 HydrophobicContact CD1-CG 3.9Å; I584-P613 HydrophobicContact CG1-CG 3.99Å; I584-P613 HydrophobicContact CG2-CB 4.13Å; I584-P613 HydrophobicContact CG2-CG 3.96Å; F587-P613 HydrophobicContact CZ-CG 4.48Å; L606-P613 HydrophobicContact CD1-CG 3.99Å; P613-E615 PolarHBondContact O-N 2.64Å; P613-L616 HydrophobicContact CB-CB 4.08Å; P613-L616 HydrophobicContact CG-CD2 4.44Å; P613-L616 WeakPolarHBondContact O-CB 3.49Å; P613-L616 PolarHBondContact O-N 2.81Å; P613-L616 VanDerWaalsContact O-N 3.12Å; P613-I617 WeakPolarHBondContact O-CG1 3.35Å; P613-I617 PolarHBondContact O-N 2.52Å; P613-I617 VanDerWaalsContact O-N 3.08Å
614	E	96	Very high	96.5	Very high	97 Å²	97	44.8 Å²	44.8	45%	0.453	23%	0.234	S	C	.	.	H	α-helix	trans	-58.3	-44.5	-171.4	-178.5	175.2	179.3	0	0	112.7	F612 L616 I617 R618 F662	F612-E614 PolarHBondContact O-N 3.5Å; F612-E614 VanDerWaalsContact O-N 3.15Å; E614-L616 VanDerWaalsContact C-N 3.28Å; E614-L616 PolarHBondContact O-N 3.19Å; E614-I617 PolarHBondContact O-N 3.48Å; E614-R618 HydrophobicContact CG-CG 4.19Å; E614-R618 WeakPolarHBondContact O-CB 3.48Å; E614-R618 WeakPolarHBondContact O-CG 3.27Å; E614-R618 PolarHBondContact O-N 3.16Å; E614-R618 IonicContact OE1-CZ 3.83Å; E614-R618 IonicContact OE1-NE 2.64Å; E614-R618 PolarHBondContact OE1-NE 3.05Å; E614-R618 IonicContact OE1-NH2 2.64Å; E614-R618 PolarHBondContact OE1-NH2 2.95Å; E614-F662 HydrophobicContact CB-CE1 3.93Å; E614-F662 HydrophobicContact CB-CZ 4.05Å; E614-F662 HydrophobicContact CG-CD1 4.23Å; E614-F662 HydrophobicContact CG-CE1 3.69Å; E614-F662 HydrophobicContact CG-CZ 4.27Å
615	E	96.6	Very high	96.4	Very high	130 Å²	130	44.7 Å²	44.7	61%	0.607	23%	0.234	S	C	*	.	H	α-helix	trans	-58.5	-40.8	178.8	-64.5	-177.1	-163.4	0	0	112.1	T588 I591 P613 E619	T588-E615 WeakPolarHBondContact CG2-OE2 3.36Å; I591-E615 HydrophobicContact CD1-CB 4.17Å; P613-E615 PolarHBondContact O-N 2.64Å; E615-E619 WeakPolarHBondContact O-CB 3.15Å; E615-E619 PolarHBondContact O-N 2.94Å; E615-E619 VanDerWaalsContact O-N 3.07Å
616	L	97.2	Very high	96.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.7	-46.7	178.3	177.6	63.4	0	0	0	111.6	F587 I591 L599 A603 L606 P613 E614 E619 I620	F587-L616 HydrophobicContact CE2-CD2 4.07Å; F587-L616 HydrophobicContact CZ-CD2 4.18Å; I591-L616 HydrophobicContact CD1-CB 4.24Å; I591-L616 HydrophobicContact CG1-CD1 4.39Å; L599-L616 HydrophobicContact CD1-CD1 3.32Å; L599-L616 HydrophobicContact CD2-CD1 3.93Å; L599-L616 HydrophobicContact CG-CD1 3.52Å; A603-L616 HydrophobicContact CB-CD2 3.82Å; A603-L616 HydrophobicContact CB-CG 4.13Å; L606-L616 HydrophobicContact CD1-CD2 3.68Å; P613-L616 HydrophobicContact CB-CB 4.08Å; P613-L616 HydrophobicContact CG-CD2 4.44Å; P613-L616 WeakPolarHBondContact O-CB 3.49Å; P613-L616 PolarHBondContact O-N 2.81Å; P613-L616 VanDerWaalsContact O-N 3.12Å; E614-L616 VanDerWaalsContact C-N 3.28Å; E614-L616 PolarHBondContact O-N 3.19Å; L616-E619 PolarHBondContact O-N 2.99Å; L616-I620 HydrophobicContact CD1-CD1 3.91Å; L616-I620 HydrophobicContact CD1-CG1 4.4Å; L616-I620 HydrophobicContact CG-CD1 4.05Å; L616-I620 WeakPolarHBondContact O-CG1 3.5Å; L616-I620 PolarHBondContact O-N 3.47Å
617	I	97.6	Very high	96.1	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-44.1	-179.5	-60.8	-53.4	0	0	0	110.6	F612 P613 E614 E619 I620 F621 L651 V655 F662 V664	F612-I617 HydrophobicContact CB-CG1 4.45Å; F612-I617 HydrophobicContact CD1-CD1 4.47Å; P613-I617 WeakPolarHBondContact O-CG1 3.35Å; P613-I617 PolarHBondContact O-N 2.52Å; P613-I617 VanDerWaalsContact O-N 3.08Å; E614-I617 PolarHBondContact O-N 3.48Å; I617-E619 VanDerWaalsContact C-N 3.33Å; I617-E619 PolarHBondContact O-N 3.18Å; I617-I620 PolarHBondContact O-N 3.41Å; I617-F621 HydrophobicContact CG2-CD2 3.77Å; I617-F621 HydrophobicContact CG2-CE2 4.07Å; I617-F621 WeakPolarHBondContact O-CD2 3.48Å; I617-F621 PolarHBondContact O-N 2.69Å; I617-F621 VanDerWaalsContact O-N 3.09Å; I617-L651 HydrophobicContact CD1-CD1 4.22Å; I617-V655 HydrophobicContact CD1-CG2 3.9Å; I617-V655 HydrophobicContact CG1-CG2 4.4Å; I617-V655 HydrophobicContact CG2-CG1 3.9Å; I617-V655 HydrophobicContact CG2-CG2 3.95Å; I617-F662 HydrophobicContact CB-CD2 4.27Å; I617-F662 HydrophobicContact CB-CE2 4.33Å; I617-F662 HydrophobicContact CG1-CD2 4.48Å; I617-F662 HydrophobicContact CG1-CE2 4.19Å; I617-F662 HydrophobicContact CG2-CD2 3.78Å; I617-F662 HydrophobicContact CG2-CE2 4.3Å; I617-F662 HydrophobicContact CG2-CG 4.46Å; I617-V664 HydrophobicContact CG2-CG2 4.41Å
618	R	96.3	Very high	95.7	Very high	134 Å²	134	51.1 Å²	51.1	51%	0.506	27%	0.273	S	S	.	.	H	α-helix	trans	-61.3	-40.5	177.6	-73.4	-173.3	-178.6	-69.8	-3.1	112.3	E614 S622	E614-R618 HydrophobicContact CG-CG 4.19Å; E614-R618 WeakPolarHBondContact O-CB 3.48Å; E614-R618 WeakPolarHBondContact O-CG 3.27Å; E614-R618 PolarHBondContact O-N 3.16Å; E614-R618 IonicContact OE1-CZ 3.83Å; E614-R618 IonicContact OE1-NE 2.64Å; E614-R618 PolarHBondContact OE1-NE 3.05Å; E614-R618 IonicContact OE1-NH2 2.64Å; E614-R618 PolarHBondContact OE1-NH2 2.95Å; R618-S622 PolarHBondContact O-N 3.47Å
619	E	97.1	Very high	95.6	Very high	71 Å²	71	51 Å²	51	33%	0.332	27%	0.273	S	S	.	.	H	α-helix	trans	-63.7	-52.1	175.5	178.6	62.2	-163.3	0	0	111.2	I591 L599 E615 L616 I617 F621 S622 F625	I591-E619 HydrophobicContact CG2-CB 3.88Å; I591-E619 HydrophobicContact CG2-CG 3.65Å; L599-E619 HydrophobicContact CD2-CG 4.37Å; E615-E619 WeakPolarHBondContact O-CB 3.15Å; E615-E619 PolarHBondContact O-N 2.94Å; E615-E619 VanDerWaalsContact O-N 3.07Å; L616-E619 PolarHBondContact O-N 2.99Å; I617-E619 VanDerWaalsContact C-N 3.33Å; I617-E619 PolarHBondContact O-N 3.18Å; E619-F621 VanDerWaalsContact C-N 3.3Å; E619-F621 PolarHBondContact O-N 2.89Å; E619-S622 VanDerWaalsContact O-CB 3.23Å; E619-S622 WeakPolarHBondContact O-CB 3.34Å; E619-S622 PolarHBondContact O-N 3.32Å; E619-S622 PolarHBondContact O-OG 3.31Å; E619-F625 HydrophobicContact CG-CD2 4.17Å; E619-F625 WeakPolarHBondContact O-CB 3.49Å
620	I	97.3	Very high	95.4	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-59.7	-39.8	-175.5	-71.5	171.5	0	0	0	112.3	L599 V600 A603 L616 I617 S622 F625 L626 L648 L651	L599-I620 HydrophobicContact CD2-CD1 4.36Å; L599-I620 HydrophobicContact CD2-CG1 3.8Å; L599-I620 HydrophobicContact CG-CD1 4.09Å; L599-I620 HydrophobicContact CG-CG1 4.06Å; V600-I620 HydrophobicContact CG2-CG2 4.45Å; A603-I620 HydrophobicContact CB-CD1 3.27Å; L616-I620 HydrophobicContact CD1-CD1 3.91Å; L616-I620 HydrophobicContact CD1-CG1 4.4Å; L616-I620 HydrophobicContact CG-CD1 4.05Å; L616-I620 WeakPolarHBondContact O-CG1 3.5Å; L616-I620 PolarHBondContact O-N 3.47Å; I617-I620 PolarHBondContact O-N 3.41Å; I620-S622 VanDerWaalsContact C-N 3.31Å; I620-F625 HydrophobicContact CB-CD1 4.36Å; I620-F625 HydrophobicContact CB-CE1 4.21Å; I620-F625 HydrophobicContact CG1-CE1 4.14Å; I620-F625 HydrophobicContact CG1-CZ 4.08Å; I620-F625 HydrophobicContact CG2-CD1 4.32Å; I620-F625 HydrophobicContact CG2-CE1 3.99Å; I620-F625 WeakPolarHBondContact O-CD1 3.49Å; I620-L626 WeakPolarHBondContact O-CD2 3.48Å; I620-L648 HydrophobicContact CG2-CD1 4.11Å; I620-L651 HydrophobicContact CD1-CD2 4.05Å; I620-L651 HydrophobicContact CG2-CD2 4.14Å
621	F	96.7	Very high	95	Very high	30 Å²	30	53 Å²	53	13%	0.132	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	9.2	-179.8	-67.3	-71.1	0	0	0	113.6	I617 E619 L648 L651 N652 V655 V664 F667	I617-F621 HydrophobicContact CG2-CD2 3.77Å; I617-F621 HydrophobicContact CG2-CE2 4.07Å; I617-F621 WeakPolarHBondContact O-CD2 3.48Å; I617-F621 PolarHBondContact O-N 2.69Å; I617-F621 VanDerWaalsContact O-N 3.09Å; E619-F621 VanDerWaalsContact C-N 3.3Å; E619-F621 PolarHBondContact O-N 2.89Å; F621-L648 HydrophobicContact CE1-CD1 4.28Å; F621-L651 HydrophobicContact CE2-CD2 4.41Å; F621-L651 HydrophobicContact CE2-CG 4.28Å; F621-L651 HydrophobicContact CZ-CD2 4.37Å; F621-L651 HydrophobicContact CZ-CG 4.14Å; F621-N652 HydrophobicContact CE1-CB 3.76Å; F621-N652 HydrophobicContact CZ-CB 3.86Å; F621-V655 HydrophobicContact CE2-CB 4.38Å; F621-V655 HydrophobicContact CE2-CG2 3.99Å; F621-V664 HydrophobicContact CB-CG1 4.07Å; F621-V664 HydrophobicContact CB-CG2 4.07Å; F621-V664 HydrophobicContact CD1-CG1 3.6Å; F621-V664 HydrophobicContact CD2-CG1 3.92Å; F621-V664 HydrophobicContact CD2-CG2 3.93Å; F621-V664 HydrophobicContact CE1-CG1 3.99Å; F621-V664 HydrophobicContact CE2-CG1 4.3Å; F621-V664 HydrophobicContact CG-CB 4.49Å; F621-V664 HydrophobicContact CG-CG1 3.56Å; F621-V664 HydrophobicContact CG-CG2 4.04Å; F621-V664 HydrophobicContact CZ-CG1 4.33Å; F621-F667 AromaticContact CD1-CE1 3.81Å; F621-F667 HydrophobicContact CD1-CE1 3.81Å; F621-F667 AromaticContact CD1-CZ 4Å; F621-F667 HydrophobicContact CD1-CZ 4Å; F621-F667 AromaticContact CE1-CE1 3.89Å; F621-F667 HydrophobicContact CE1-CE1 3.89Å; F621-F667 AromaticContact CE1-CZ 3.89Å; F621-F667 HydrophobicContact CE1-CZ 3.89Å
622	S	95.9	Very high	94.6	Very high	37 Å²	37	51.1 Å²	51.1	26%	0.259	28%	0.275	S	S	.	.	S	Bend	trans	-70.9	148.8	169.8	78.4	0	0	0	0	111.3	R618 E619 I620 G624 F625 L626	R618-S622 PolarHBondContact O-N 3.47Å; E619-S622 VanDerWaalsContact O-CB 3.23Å; E619-S622 WeakPolarHBondContact O-CB 3.34Å; E619-S622 PolarHBondContact O-N 3.32Å; E619-S622 PolarHBondContact O-OG 3.31Å; I620-S622 VanDerWaalsContact C-N 3.31Å; S622-G624 PolarHBondContact O-N 3.33Å; S622-F625 PolarHBondContact O-N 3.16Å; S622-F625 VanDerWaalsContact OG-CB 3.27Å; S622-F625 WeakPolarHBondContact OG-CB 3.49Å; S622-F625 PolarHBondContact OG-N 3.45Å; S622-F625 VanDerWaalsContact OG-N 3.08Å; S622-L626 WeakPolarHBondContact O-CG 3.22Å; S622-L626 PolarHBondContact O-N 3.22Å
623	I	94.3	Very high	94.2	Very high	159 Å²	159	50 Å²	50	82%	0.815	27%	0.271	S	S	*	.	H	α-helix	trans	-60.4	-37.6	176.6	-62.9	170.1	0	0	0	110.7	G627	I623-G627 PolarHBondContact O-N 2.92Å
624	G	93.6	Very high	93.5	Very high	58 Å²	58	55.3 Å²	55.3	60%	0.598	29%	0.294	S	S	*	.	H	α-helix	trans	-63	-47.7	178.9	0	0	0	0	0	112.3	S622 G627 K628	S622-G624 PolarHBondContact O-N 3.33Å; G624-G627 PolarHBondContact O-N 3.19Å; G624-K628 PolarHBondContact O-N 2.88Å
625	F	95.2	Very high	92.6	Very high	10 Å²	10	50.9 Å²	50.9	4%	0.044	27%	0.273	C	S	.	.	H	α-helix	trans	-64.8	-46.9	177.8	-178.5	-86.2	0	0	0	112.1	P596 L599 V600 E619 I620 S622 G627 K628 L629	P596-F625 HydrophobicContact CB-CE1 4.37Å; P596-F625 HydrophobicContact CB-CE2 3.91Å; P596-F625 HydrophobicContact CB-CZ 3.73Å; P596-F625 HydrophobicContact CG-CE2 4.46Å; P596-F625 WeakPolarHBondContact O-CZ 3.18Å; L599-F625 HydrophobicContact CB-CE2 4.18Å; L599-F625 HydrophobicContact CB-CZ 4.11Å; L599-F625 HydrophobicContact CD2-CD2 4.24Å; L599-F625 HydrophobicContact CD2-CE2 3.5Å; L599-F625 VanDerWaalsContact CD2-CE2 3.5Å; L599-F625 HydrophobicContact CD2-CZ 4.02Å; L599-F625 HydrophobicContact CG-CE2 4.43Å; V600-F625 HydrophobicContact CG2-CE1 4.01Å; V600-F625 HydrophobicContact CG2-CZ 4.17Å; E619-F625 HydrophobicContact CG-CD2 4.17Å; E619-F625 WeakPolarHBondContact O-CB 3.49Å; I620-F625 HydrophobicContact CB-CD1 4.36Å; I620-F625 HydrophobicContact CB-CE1 4.21Å; I620-F625 HydrophobicContact CG1-CE1 4.14Å; I620-F625 HydrophobicContact CG1-CZ 4.08Å; I620-F625 HydrophobicContact CG2-CD1 4.32Å; I620-F625 HydrophobicContact CG2-CE1 3.99Å; I620-F625 WeakPolarHBondContact O-CD1 3.49Å; S622-F625 PolarHBondContact O-N 3.16Å; S622-F625 VanDerWaalsContact OG-CB 3.27Å; S622-F625 WeakPolarHBondContact OG-CB 3.49Å; S622-F625 PolarHBondContact OG-N 3.45Å; S622-F625 VanDerWaalsContact OG-N 3.08Å; F625-G627 VanDerWaalsContact C-N 3.29Å; F625-G627 PolarHBondContact O-N 3.47Å; F625-K628 WeakPolarHBondContact O-CB 3.27Å; F625-K628 PolarHBondContact O-N 3.04Å; F625-K628 VanDerWaalsContact O-N 3.11Å; F625-L629 HydrophobicContact CE1-CB 4.29Å; F625-L629 HydrophobicContact CE1-CD2 4.17Å; F625-L629 WeakPolarHBondContact O-CB 3.33Å; F625-L629 PolarHBondContact O-N 3.31Å
626	L	95.1	Very high	91.8	Very high	40 Å²	40	45.6 Å²	45.6	21%	0.209	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-39	-179.9	-68.8	176.2	0	0	0	111.6	I620 S622 L629 D630 L648 F667	I620-L626 WeakPolarHBondContact O-CD2 3.48Å; S622-L626 WeakPolarHBondContact O-CG 3.22Å; S622-L626 PolarHBondContact O-N 3.22Å; L626-L629 PolarHBondContact O-N 3.09Å; L626-D630 PolarHBondContact O-N 3.19Å; L626-L648 HydrophobicContact CD2-CD1 4.47Å; L626-L648 HydrophobicContact CD2-CD2 4.19Å; L626-F667 HydrophobicContact CD1-CZ 4.38Å
627	G	92.9	Very high	90.7	Very high	34 Å²	34	50.6 Å²	50.6	35%	0.351	27%	0.272	S	S	.	.	H	α-helix	trans	-61.3	-45.4	171.9	0	0	0	0	0	112.7	I623 G624 F625 L629 D630 C631	I623-G627 PolarHBondContact O-N 2.92Å; G624-G627 PolarHBondContact O-N 3.19Å; F625-G627 VanDerWaalsContact C-N 3.29Å; F625-G627 PolarHBondContact O-N 3.47Å; G627-L629 VanDerWaalsContact C-N 3.33Å; G627-L629 PolarHBondContact O-N 3.43Å; G627-D630 PolarHBondContact O-N 3.43Å; G627-C631 PolarHBondContact O-N 3.46Å; G627-C631 VanDerWaalsContact O-N 3.13Å; G627-C631 PolarHBondContact O-SG 2.92Å; G627-C631 VanDerWaalsContact O-SG 3.4Å
628	K	91.3	Very high	89.7	Confident	62 Å²	62	54.6 Å²	54.6	27%	0.27	29%	0.294	S	S	.	.	H	α-helix	trans	-62.2	-40.8	175.8	-169.7	179.8	-179.8	172.2	0	111.7	D270 P596 G624 F625 C631 Q632	D270-K628 WeakPolarHBondContact OD1-CE 3.47Å; D270-K628 IonicContact OD1-NZ 2.92Å; D270-K628 PolarHBondContact OD1-NZ 3.47Å; D270-K628 IonicContact OD2-NZ 2.96Å; D270-K628 PolarHBondContact OD2-NZ 3.42Å; P596-K628 HydrophobicContact CG-CB 4.43Å; P596-K628 HydrophobicContact CG-CD 3.91Å; P596-K628 HydrophobicContact CG-CG 3.85Å; G624-K628 PolarHBondContact O-N 2.88Å; F625-K628 WeakPolarHBondContact O-CB 3.27Å; F625-K628 PolarHBondContact O-N 3.04Å; F625-K628 VanDerWaalsContact O-N 3.11Å; K628-C631 PolarHBondContact O-N 2.86Å; K628-Q632 PolarHBondContact O-N 3.49Å
629	L	92.9	Very high	88.9	Confident	2 Å²	2	52 Å²	52	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-64	-43.1	177.1	178.7	62.7	0	0	0	111.4	P596 V600 F625 L626 G627 Q632 L633 T644 L648	P596-L629 HydrophobicContact CB-CB 3.97Å; P596-L629 HydrophobicContact CB-CD1 3.71Å; P596-L629 HydrophobicContact CB-CG 4.43Å; V600-L629 HydrophobicContact CG2-CD2 3.97Å; F625-L629 HydrophobicContact CE1-CB 4.29Å; F625-L629 HydrophobicContact CE1-CD2 4.17Å; F625-L629 WeakPolarHBondContact O-CB 3.33Å; F625-L629 PolarHBondContact O-N 3.31Å; L626-L629 PolarHBondContact O-N 3.09Å; G627-L629 VanDerWaalsContact C-N 3.33Å; G627-L629 PolarHBondContact O-N 3.43Å; L629-Q632 WeakPolarHBondContact O-CB 3.36Å; L629-Q632 PolarHBondContact O-N 2.62Å; L629-Q632 VanDerWaalsContact O-N 3.16Å; L629-L633 HydrophobicContact CD1-CD1 4.22Å; L629-L633 HydrophobicContact CD1-CG 4.13Å; L629-L633 HydrophobicContact CG-CD1 3.89Å; L629-L633 HydrophobicContact CG-CG 4.27Å; L629-L633 WeakPolarHBondContact O-CB 3.24Å; L629-L633 WeakPolarHBondContact O-CG 3.33Å; L629-L633 PolarHBondContact O-N 2.86Å; L629-T644 HydrophobicContact CD1-CG2 3.97Å; L629-L648 HydrophobicContact CD2-CD2 3.79Å
630	D	91.5	Very high	88.3	Confident	97 Å²	97	50.5 Å²	50.5	52%	0.519	29%	0.29	S	S	.	.	H	α-helix	trans	-60.9	-45.9	176.9	-82.5	-27.2	0	0	0	111.7	L626 G627 Q632 L633 E634	L626-D630 PolarHBondContact O-N 3.19Å; G627-D630 PolarHBondContact O-N 3.43Å; D630-Q632 VanDerWaalsContact C-N 3.29Å; D630-Q632 PolarHBondContact O-N 2.83Å; D630-L633 PolarHBondContact O-N 3.01Å; D630-E634 PolarHBondContact O-N 2.81Å
631	C	87.6	Confident	87.8	Confident	58 Å²	58	52.9 Å²	52.9	39%	0.392	30%	0.301	S	S	.	.	H	α-helix	trans	-57.8	-41.8	172.9	-65.5	0	0	0	0	111.9	L273 G627 K628 E634	L273-C631 HydrophobicContact CD1-CB 4.03Å; L273-C631 HydrophobicContact CD2-CB 4.26Å; G627-C631 PolarHBondContact O-N 3.46Å; G627-C631 VanDerWaalsContact O-N 3.13Å; G627-C631 PolarHBondContact O-SG 2.92Å; G627-C631 VanDerWaalsContact O-SG 3.4Å; K628-C631 PolarHBondContact O-N 2.86Å; C631-E634 PolarHBondContact O-N 3.5Å
632	Q	87.5	Confident	87.4	Confident	3 Å²	3	55.9 Å²	55.9	1%	0.014	32%	0.316	C	S	.	.	H	α-helix	trans	-62.5	-47.4	176.8	-168.8	176.3	50.3	0	0	111.3	C269 H597 K628 L629 D630 E634 S635 L636	C269-Q632 HydrophobicContact CB-CG 4.4Å; C269-Q632 VanDerWaalsContact CB-NE2 3.33Å; C269-Q632 VanDerWaalsContact SG-CB 3.57Å; C269-Q632 VanDerWaalsContact SG-CG 3.56Å; H597-Q632 PolarHBondContact ND1-NE2 3.29Å; H597-Q632 VanDerWaalsContact ND1-NE2 3.15Å; H597-Q632 PolarHBondContact ND1-OE1 3.41Å; K628-Q632 PolarHBondContact O-N 3.49Å; L629-Q632 WeakPolarHBondContact O-CB 3.36Å; L629-Q632 PolarHBondContact O-N 2.62Å; L629-Q632 VanDerWaalsContact O-N 3.16Å; D630-Q632 VanDerWaalsContact C-N 3.29Å; D630-Q632 PolarHBondContact O-N 2.83Å; Q632-E634 PolarHBondContact O-N 3.33Å; Q632-S635 PolarHBondContact O-N 2.99Å; Q632-S635 PolarHBondContact O-OG 3.26Å; Q632-L636 HydrophobicContact CG-CD1 3.95Å; Q632-L636 HydrophobicContact CG-CD2 4.3Å; Q632-L636 HydrophobicContact CG-CG 4Å; Q632-L636 WeakPolarHBondContact O-CG 3.37Å; Q632-L636 PolarHBondContact O-N 2.95Å
633	L	87.8	Confident	87.2	Confident	6 Å²	6	59.4 Å²	59.4	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-62.9	-22.3	-176.4	-71.7	169.5	0	0	0	113.7	L629 D630 S635 L636 K641 T644 K645	L629-L633 HydrophobicContact CD1-CD1 4.22Å; L629-L633 HydrophobicContact CD1-CG 4.13Å; L629-L633 HydrophobicContact CG-CD1 3.89Å; L629-L633 HydrophobicContact CG-CG 4.27Å; L629-L633 WeakPolarHBondContact O-CB 3.24Å; L629-L633 WeakPolarHBondContact O-CG 3.33Å; L629-L633 PolarHBondContact O-N 2.86Å; D630-L633 PolarHBondContact O-N 3.01Å; L633-S635 VanDerWaalsContact C-N 3.3Å; L633-L636 HydrophobicContact CD2-CD1 4.3Å; L633-K641 HydrophobicContact CB-CG 4.34Å; L633-K641 HydrophobicContact CD2-CB 4.33Å; L633-K641 HydrophobicContact CD2-CG 3.95Å; L633-K641 WeakPolarHBondContact O-CD 3.26Å; L633-K641 WeakPolarHBondContact O-CE 3.28Å; L633-K641 PolarHBondContact O-NZ 3.5Å; L633-K641 VanDerWaalsContact O-NZ 3.14Å; L633-T644 HydrophobicContact CD2-CG2 4.05Å; L633-K645 HydrophobicContact CD1-CG 4.02Å; L633-K645 HydrophobicContact CD2-CG 4.38Å
634	E	82.9	Confident	87.2	Confident	132 Å²	132	51.9 Å²	51.9	62%	0.617	29%	0.285	S	S	*	.	H	α-helix	trans	-68.1	-31.3	170.7	-69.7	-176.4	178.2	0	0	112.8	K276 D630 C631 Q632	K276-E634 IonicContact NZ-OE2 3.87Å; D630-E634 PolarHBondContact O-N 2.81Å; C631-E634 PolarHBondContact O-N 3.5Å; Q632-E634 PolarHBondContact O-N 3.33Å
635	S	78	Confident	87.2	Confident	4 Å²	4	52.5 Å²	52.5	3%	0.028	27%	0.271	C	S	.	.	H	α-helix	trans	-97.6	-14.6	-174.2	77.3	0	0	0	0	114	R272 Q632 L633	R272-S635 WeakPolarHBondContact CD-OG 3.36Å; R272-S635 VanDerWaalsContact CZ-O 3.27Å; R272-S635 PolarHBondContact NE-O 3.36Å; R272-S635 PolarHBondContact NE-OG 3.14Å; R272-S635 PolarHBondContact NH2-O 3.47Å; Q632-S635 PolarHBondContact O-N 2.99Å; Q632-S635 PolarHBondContact O-OG 3.26Å; L633-S635 VanDerWaalsContact C-N 3.3Å
636	L	78.6	Confident	87.1	Confident	18 Å²	18	54.8 Å²	54.8	9%	0.094	28%	0.282	C	S	.	.	S	Bend	trans	-79.4	153	-178.2	-68.8	179.2	0	0	0	112.7	H597 Q632 L633 L640 K641	H597-L636 HydrophobicContact CB-CD1 4.2Å; Q632-L636 HydrophobicContact CG-CD1 3.95Å; Q632-L636 HydrophobicContact CG-CD2 4.3Å; Q632-L636 HydrophobicContact CG-CG 4Å; Q632-L636 WeakPolarHBondContact O-CG 3.37Å; Q632-L636 PolarHBondContact O-N 2.95Å; L633-L636 HydrophobicContact CD2-CD1 4.3Å; L636-L640 HydrophobicContact CD1-CD2 4.25Å; L636-L640 HydrophobicContact CD1-CG 4.3Å; L636-L640 HydrophobicContact CD2-CD2 4.11Å; L636-K641 HydrophobicContact CB-CB 4.49Å
637	H	73.8	Confident	87.2	Confident	106 Å²	106	55.6 Å²	55.6	49%	0.491	28%	0.282	S	S	.	.			trans	-60.3	144	170.4	-174.3	-90.2	0	0	0	111.6	S639 L640 K641	H637-S639 VanDerWaalsContact C-N 3.28Å; H637-S639 PolarHBondContact ND1-N 2.9Å; H637-S639 PolarHBondContact ND1-OG 2.8Å; H637-S639 PolarHBondContact O-N 2.83Å; H637-S639 VanDerWaalsContact O-N 3.15Å; H637-L640 PolarHBondContact O-N 3.38Å; H637-K641 WeakPolarHBondContact O-CB 3.24Å; H637-K641 PolarHBondContact O-N 3.27Å
638	D	77.6	Confident	87.4	Confident	85 Å²	85	54.6 Å²	54.6	46%	0.455	27%	0.269	S	S	.	.	H	α-helix	trans	-54.8	-38.9	-171.8	-82.9	-22.8	0	0	0	114	K641 M642	D638-K641 PolarHBondContact O-N 3.3Å; D638-M642 WeakPolarHBondContact O-CB 3.31Å; D638-M642 VanDerWaalsContact O-CG 3.25Å; D638-M642 WeakPolarHBondContact O-CG 3.49Å; D638-M642 PolarHBondContact O-N 3.2Å
639	S	79.5	Confident	87.7	Confident	80 Å²	80	51.9 Å²	51.9	56%	0.559	26%	0.257	S	S	*	.	H	α-helix	trans	-62.1	-46	178.3	60.2	0	0	0	0	112.5	H637 R643	H637-S639 VanDerWaalsContact C-N 3.28Å; H637-S639 PolarHBondContact ND1-N 2.9Å; H637-S639 PolarHBondContact ND1-OG 2.8Å; H637-S639 PolarHBondContact O-N 2.83Å; H637-S639 VanDerWaalsContact O-N 3.15Å; S639-R643 WeakPolarHBondContact O-CB 2.89Å; S639-R643 PolarHBondContact O-N 2.92Å
640	L	83.7	Confident	87.9	Confident	40 Å²	40	52.7 Å²	52.7	21%	0.209	26%	0.261	C	S	.	.	H	α-helix	trans	-72.5	-37.9	178.8	-176	59	0	0	0	111	L636 H637 R643 T644	L636-L640 HydrophobicContact CD1-CD2 4.25Å; L636-L640 HydrophobicContact CD1-CG 4.3Å; L636-L640 HydrophobicContact CD2-CD2 4.11Å; H637-L640 PolarHBondContact O-N 3.38Å; L640-R643 PolarHBondContact O-N 2.99Å; L640-T644 WeakPolarHBondContact O-CB 3.49Å; L640-T644 PolarHBondContact O-N 3.25Å; L640-T644 PolarHBondContact O-OG1 2.96Å
641	K	88.1	Confident	88.2	Confident	50 Å²	50	48 Å²	48	22%	0.217	24%	0.236	C	C	.	.	H	α-helix	trans	-58	-49.9	173.9	-179.5	-178.2	-170.5	158	0	111.7	L633 L636 H637 D638 T644 K645	L633-K641 HydrophobicContact CB-CG 4.34Å; L633-K641 HydrophobicContact CD2-CB 4.33Å; L633-K641 HydrophobicContact CD2-CG 3.95Å; L633-K641 WeakPolarHBondContact O-CD 3.26Å; L633-K641 WeakPolarHBondContact O-CE 3.28Å; L633-K641 PolarHBondContact O-NZ 3.5Å; L633-K641 VanDerWaalsContact O-NZ 3.14Å; L636-K641 HydrophobicContact CB-CB 4.49Å; H637-K641 WeakPolarHBondContact O-CB 3.24Å; H637-K641 PolarHBondContact O-N 3.27Å; D638-K641 PolarHBondContact O-N 3.3Å; K641-T644 PolarHBondContact O-N 3.08Å; K641-K645 WeakPolarHBondContact O-CG 3.09Å; K641-K645 PolarHBondContact O-N 2.91Å
642	M	87.9	Confident	88.7	Confident	92 Å²	92	45.3 Å²	45.3	45%	0.453	22%	0.218	S	C	.	.	H	α-helix	trans	-64.5	-43.6	178.3	-72.4	-58.4	-61.1	0	0	111.6	D638 T644 K645 Q646	D638-M642 WeakPolarHBondContact O-CB 3.31Å; D638-M642 VanDerWaalsContact O-CG 3.25Å; D638-M642 WeakPolarHBondContact O-CG 3.49Å; D638-M642 PolarHBondContact O-N 3.2Å; M642-T644 VanDerWaalsContact C-N 3.33Å; M642-T644 PolarHBondContact O-N 3.12Å; M642-K645 PolarHBondContact O-N 3.37Å; M642-Q646 VanDerWaalsContact O-CB 3.32Å; M642-Q646 WeakPolarHBondContact O-CB 3.39Å; M642-Q646 PolarHBondContact O-N 3.43Å
643	R	91.6	Very high	89.2	Confident	112 Å²	112	45.9 Å²	45.9	42%	0.423	22%	0.22	S	C	.	.	H	α-helix	trans	-58.7	-45	174.8	-178.4	178.6	174.6	172.5	-1.3	111.6	L601 S639 L640 Q646 R647	L601-R643 HydrophobicContact CD2-CG 4.39Å; S639-R643 WeakPolarHBondContact O-CB 2.89Å; S639-R643 PolarHBondContact O-N 2.92Å; L640-R643 PolarHBondContact O-N 2.99Å; R643-Q646 PolarHBondContact O-N 3.36Å; R643-R647 HydrophobicContact CG-CG 4.36Å; R643-R647 WeakPolarHBondContact O-CB 3.05Å; R643-R647 WeakPolarHBondContact O-CG 3.35Å; R643-R647 PolarHBondContact O-N 3.2Å
644	T	93.5	Very high	89.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.7	-45.2	-178.6	-53.6	0	0	0	0	111.3	H597 V600 L629 L633 L640 K641 M642 Q646 R647 L648	H597-T644 HydrophobicContact CB-CG2 3.68Å; V600-T644 HydrophobicContact CB-CG2 4.48Å; V600-T644 HydrophobicContact CG1-CG2 4.45Å; L629-T644 HydrophobicContact CD1-CG2 3.97Å; L633-T644 HydrophobicContact CD2-CG2 4.05Å; L640-T644 WeakPolarHBondContact O-CB 3.49Å; L640-T644 PolarHBondContact O-N 3.25Å; L640-T644 PolarHBondContact O-OG1 2.96Å; K641-T644 PolarHBondContact O-N 3.08Å; M642-T644 VanDerWaalsContact C-N 3.33Å; M642-T644 PolarHBondContact O-N 3.12Å; T644-Q646 VanDerWaalsContact C-N 3.33Å; T644-Q646 PolarHBondContact O-N 2.92Å; T644-R647 PolarHBondContact O-N 2.99Å; T644-L648 WeakPolarHBondContact O-CB 3.33Å; T644-L648 PolarHBondContact O-N 3.16Å
645	K	93.8	Very high	90.4	Very high	72 Å²	72	39.4 Å²	39.4	31%	0.313	19%	0.189	S	C	.	.	H	α-helix	trans	-60.9	-41.6	175.7	-73.5	-172.9	175.6	-164.2	0	112.5	L633 K641 M642 M649 Y671	L633-K645 HydrophobicContact CD1-CG 4.02Å; L633-K645 HydrophobicContact CD2-CG 4.38Å; K641-K645 WeakPolarHBondContact O-CG 3.09Å; K641-K645 PolarHBondContact O-N 2.91Å; M642-K645 PolarHBondContact O-N 3.37Å; K645-M649 PolarHBondContact O-N 2.88Å; K645-M649 VanDerWaalsContact O-N 3.12Å; K645-Y671 HydrophobicContact CB-CE2 4.4Å
646	Q	94.2	Very high	91.3	Very high	58 Å²	58	39.9 Å²	39.9	27%	0.271	19%	0.193	S	C	.	.	H	α-helix	trans	-62	-47.9	176.6	-177.6	67	20.8	0	0	110.9	M642 R643 T644 M649 E650	M642-Q646 VanDerWaalsContact O-CB 3.32Å; M642-Q646 WeakPolarHBondContact O-CB 3.39Å; M642-Q646 PolarHBondContact O-N 3.43Å; R643-Q646 PolarHBondContact O-N 3.36Å; T644-Q646 VanDerWaalsContact C-N 3.33Å; T644-Q646 PolarHBondContact O-N 2.92Å; Q646-M649 WeakPolarHBondContact O-CB 3.21Å; Q646-M649 PolarHBondContact O-N 3.11Å; Q646-E650 WeakPolarHBondContact CG-OE1 3.5Å; Q646-E650 PolarHBondContact NE2-OE1 3.36Å; Q646-E650 WeakPolarHBondContact O-CG 3.15Å; Q646-E650 PolarHBondContact O-N 2.84Å
647	R	96.9	Very high	92.1	Very high	56 Å²	56	39.8 Å²	39.8	21%	0.211	19%	0.192	C	C	.	.	H	α-helix	trans	-69.6	-34.1	-177.7	-64.3	-75.4	177.3	-132.7	9.5	112.5	V600 L601 Y604 R643 T644 E650 L651	V600-R647 HydrophobicContact CG1-CB 4.23Å; L601-R647 HydrophobicContact CD2-CB 4.12Å; L601-R647 HydrophobicContact CD2-CG 3.82Å; Y604-R647 VanDerWaalsContact CE1-CD 3.4Å; Y604-R647 HydrophobicContact CG-CB 4.38Å; Y604-R647 VanDerWaalsContact CZ-NH1 3.34Å; Y604-R647 PolarHBondContact OH-NH1 3.16Å; R643-R647 HydrophobicContact CG-CG 4.36Å; R643-R647 WeakPolarHBondContact O-CB 3.05Å; R643-R647 WeakPolarHBondContact O-CG 3.35Å; R643-R647 PolarHBondContact O-N 3.2Å; T644-R647 PolarHBondContact O-N 2.99Å; R647-E650 WeakPolarHBondContact CD-OE2 3.24Å; R647-E650 IonicContact CZ-OE2 3.39Å; R647-E650 IonicContact NE-OE2 3.99Å; R647-E650 IonicContact NH1-OE1 2.67Å; R647-E650 PolarHBondContact NH1-OE1 3.39Å; R647-E650 IonicContact NH1-OE2 3.61Å; R647-E650 PolarHBondContact NH1-OE2 3.28Å; R647-E650 PolarHBondContact O-N 2.96Å; R647-L651 VanDerWaalsContact O-CB 3.25Å; R647-L651 WeakPolarHBondContact O-CB 3.48Å; R647-L651 PolarHBondContact O-N 3.45Å
648	L	97.6	Very high	93.2	Very high	13 Å²	13	36.3 Å²	36.3	7%	0.068	18%	0.176	C	C	.	.	H	α-helix	trans	-62.4	-44.2	171	-179.8	64.9	0	0	0	111.4	V600 I620 F621 L626 L629 T644 L651 N652	V600-L648 HydrophobicContact CG1-CB 3.88Å; V600-L648 HydrophobicContact CG1-CD1 4.43Å; V600-L648 HydrophobicContact CG2-CD1 4.14Å; I620-L648 HydrophobicContact CG2-CD1 4.11Å; F621-L648 HydrophobicContact CE1-CD1 4.28Å; L626-L648 HydrophobicContact CD2-CD1 4.47Å; L626-L648 HydrophobicContact CD2-CD2 4.19Å; L629-L648 HydrophobicContact CD2-CD2 3.79Å; T644-L648 WeakPolarHBondContact O-CB 3.33Å; T644-L648 PolarHBondContact O-N 3.16Å; L648-L651 PolarHBondContact O-N 3.28Å; L648-N652 WeakPolarHBondContact O-CB 3.19Å; L648-N652 PolarHBondContact O-N 3.36Å
649	M	96.7	Very high	94.1	Very high	5 Å²	5	32.6 Å²	32.6	3%	0.025	16%	0.157	C	C	.	.	H	α-helix	trans	-62.5	-44.6	177.7	176.8	-80	-64.6	0	0	111.6	K645 Q646 L651 N652 R653 W666 H668 Y671	K645-M649 PolarHBondContact O-N 2.88Å; K645-M649 VanDerWaalsContact O-N 3.12Å; Q646-M649 WeakPolarHBondContact O-CB 3.21Å; Q646-M649 PolarHBondContact O-N 3.11Å; M649-L651 VanDerWaalsContact C-N 3.35Å; M649-N652 PolarHBondContact O-N 3.38Å; M649-R653 WeakPolarHBondContact O-CB 3.44Å; M649-R653 PolarHBondContact O-N 3.47Å; M649-R653 PolarHBondContact SD-NH2 3.42Å; M649-W666 HydrophobicContact CG-CH2 3.91Å; M649-W666 HydrophobicContact CG-CZ3 4.42Å; M649-W666 HydrophobicContact SD-CH2 3.92Å; M649-H668 HydrophobicContact CB-CB 4.25Å; M649-H668 HydrophobicContact CG-CB 3.59Å; M649-Y671 HydrophobicContact CB-CD1 4.21Å; M649-Y671 HydrophobicContact CB-CE1 4.16Å; M649-Y671 HydrophobicContact CG-CD1 4.11Å; M649-Y671 HydrophobicContact CG-CE1 4.38Å
650	E	97.1	Very high	94.9	Very high	19 Å²	19	32.9 Å²	32.9	9%	0.089	16%	0.156	C	C	.	.	H	α-helix	trans	-68.4	-35.4	179	-66.5	159.4	166	0	0	112	Y604 Q646 R647 R653 A654	Y604-E650 HydrophobicContact CD2-CB 3.9Å; Y604-E650 HydrophobicContact CE2-CB 3.54Å; Y604-E650 HydrophobicContact CE2-CG 4.39Å; Y604-E650 WeakPolarHBondContact CE2-OE2 3.22Å; Q646-E650 WeakPolarHBondContact CG-OE1 3.5Å; Q646-E650 PolarHBondContact NE2-OE1 3.36Å; Q646-E650 WeakPolarHBondContact O-CG 3.15Å; Q646-E650 PolarHBondContact O-N 2.84Å; R647-E650 WeakPolarHBondContact CD-OE2 3.24Å; R647-E650 IonicContact CZ-OE2 3.39Å; R647-E650 IonicContact NE-OE2 3.99Å; R647-E650 IonicContact NH1-OE1 2.67Å; R647-E650 PolarHBondContact NH1-OE1 3.39Å; R647-E650 IonicContact NH1-OE2 3.61Å; R647-E650 PolarHBondContact NH1-OE2 3.28Å; R647-E650 PolarHBondContact O-N 2.96Å; E650-R653 WeakPolarHBondContact O-CB 3.5Å; E650-R653 PolarHBondContact O-N 2.93Å; E650-A654 PolarHBondContact O-N 2.98Å
651	L	98.2	Very high	95.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.8	-47	171.9	177.3	63.7	0	0	0	111.5	A603 A607 I617 I620 F621 R647 L648 M649 R653 A654 V655	A603-L651 HydrophobicContact CB-CD1 4.01Å; A603-L651 HydrophobicContact CB-CD2 3.52Å; A603-L651 HydrophobicContact CB-CG 4.42Å; A607-L651 HydrophobicContact CB-CD1 4.11Å; I617-L651 HydrophobicContact CD1-CD1 4.22Å; I620-L651 HydrophobicContact CD1-CD2 4.05Å; I620-L651 HydrophobicContact CG2-CD2 4.14Å; F621-L651 HydrophobicContact CE2-CD2 4.41Å; F621-L651 HydrophobicContact CE2-CG 4.28Å; F621-L651 HydrophobicContact CZ-CD2 4.37Å; F621-L651 HydrophobicContact CZ-CG 4.14Å; R647-L651 VanDerWaalsContact O-CB 3.25Å; R647-L651 WeakPolarHBondContact O-CB 3.48Å; R647-L651 PolarHBondContact O-N 3.45Å; L648-L651 PolarHBondContact O-N 3.28Å; M649-L651 VanDerWaalsContact C-N 3.35Å; L651-R653 PolarHBondContact O-N 3.35Å; L651-A654 PolarHBondContact O-N 3.38Å; L651-A654 VanDerWaalsContact O-N 3.13Å; L651-V655 HydrophobicContact CD1-CG2 4.17Å; L651-V655 WeakPolarHBondContact O-CG2 3.44Å; L651-V655 PolarHBondContact O-N 2.81Å
652	N	97.6	Very high	95.7	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.4	-39.8	175.7	-178.3	-132.4	0	0	0	110.8	F621 L648 M649 C656 V664 P665 W666 F667 H668	F621-N652 HydrophobicContact CE1-CB 3.76Å; F621-N652 HydrophobicContact CZ-CB 3.86Å; L648-N652 WeakPolarHBondContact O-CB 3.19Å; L648-N652 PolarHBondContact O-N 3.36Å; M649-N652 PolarHBondContact O-N 3.38Å; N652-C656 WeakPolarHBondContact O-CB 3.34Å; N652-C656 PolarHBondContact O-N 3.28Å; N652-C656 PolarHBondContact O-SG 3.08Å; N652-V664 WeakPolarHBondContact ND2-CG1 3.44Å; N652-P665 PolarHBondContact ND2-O 2.88Å; N652-W666 HydrophobicContact CB-CZ3 4.47Å; N652-F667 PolarHBondContact OD1-N 3.29Å; N652-H668 PolarHBondContact OD1-CD2 3Å
653	R	97.3	Very high	96	Very high	16 Å²	16	39.4 Å²	39.4	6%	0.06	19%	0.185	C	C	.	.	H	α-helix	trans	-60.7	-48.3	173.9	-175.9	-178.3	-52.2	-168.4	-7.5	112.2	M649 E650 L651 C656 L657 W666 Y712 F713 Y714	M649-R653 WeakPolarHBondContact O-CB 3.44Å; M649-R653 PolarHBondContact O-N 3.47Å; M649-R653 PolarHBondContact SD-NH2 3.42Å; E650-R653 WeakPolarHBondContact O-CB 3.5Å; E650-R653 PolarHBondContact O-N 2.93Å; L651-R653 PolarHBondContact O-N 3.35Å; R653-C656 PolarHBondContact O-N 3.41Å; R653-L657 HydrophobicContact CG-CD1 3.98Å; R653-L657 WeakPolarHBondContact O-CG 3.47Å; R653-L657 PolarHBondContact O-N 3.25Å; R653-W666 HydrophobicContact CB-CH2 4.46Å; R653-W666 HydrophobicContact CB-CZ3 3.83Å; R653-Y712 PolarHBondContact NE-O 3.16Å; R653-Y712 PolarHBondContact NH2-O 2.58Å; R653-F713 PolarHBondContact NH1-O 3.41Å; R653-F713 PolarHBondContact NH2-O 3.39Å; R653-Y714 HydrophobicContact CG-CE2 4.18Å
654	A	97.9	Very high	96.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61	-49.5	179.3	0	0	0	0	0	111.3	A607 F612 E650 L651 C656 L657 E658 M789 H793	A607-A654 HydrophobicContact CB-CB 4.06Å; F612-A654 HydrophobicContact CE1-CB 3.97Å; F612-A654 HydrophobicContact CZ-CB 4.16Å; E650-A654 PolarHBondContact O-N 2.98Å; L651-A654 PolarHBondContact O-N 3.38Å; L651-A654 VanDerWaalsContact O-N 3.13Å; A654-C656 PolarHBondContact O-N 3.46Å; A654-L657 PolarHBondContact O-N 2.76Å; A654-L657 VanDerWaalsContact O-N 3.12Å; A654-E658 WeakPolarHBondContact O-CB 3.48Å; A654-E658 PolarHBondContact O-N 2.93Å; A654-M789 HydrophobicContact CB-SD 4.18Å; A654-H793 VanDerWaalsContact CA-CE1 3.44Å; A654-H793 WeakPolarHBondContact CA-CE1 3.33Å
655	V	97.8	Very high	96.2	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	20%	0.2	C	C	.	.	H	α-helix	trans	-60.6	-43.3	179.3	172.6	0	0	0	0	112.3	F612 I617 F621 L651 L657 C659 F662 V664	F612-V655 HydrophobicContact CD1-CG2 4.11Å; F612-V655 HydrophobicContact CE1-CG2 4.23Å; I617-V655 HydrophobicContact CD1-CG2 3.9Å; I617-V655 HydrophobicContact CG1-CG2 4.4Å; I617-V655 HydrophobicContact CG2-CG1 3.9Å; I617-V655 HydrophobicContact CG2-CG2 3.95Å; F621-V655 HydrophobicContact CE2-CB 4.38Å; F621-V655 HydrophobicContact CE2-CG2 3.99Å; L651-V655 HydrophobicContact CD1-CG2 4.17Å; L651-V655 WeakPolarHBondContact O-CG2 3.44Å; L651-V655 PolarHBondContact O-N 2.81Å; V655-L657 PolarHBondContact O-N 3.06Å; V655-C659 CarbonylContact O-C 3.47Å; V655-C659 WeakPolarHBondContact O-CA 3.49Å; V655-C659 PolarHBondContact O-N 3.49Å; V655-F662 HydrophobicContact CG1-CB 4.43Å; V655-F662 HydrophobicContact CG1-CD2 4.14Å; V655-V664 HydrophobicContact CG1-CB 3.88Å; V655-V664 HydrophobicContact CG1-CG1 4.48Å; V655-V664 HydrophobicContact CG1-CG2 3.84Å
656	C	97	Very high	96.2	Very high	15 Å²	15	38.6 Å²	38.6	10%	0.101	20%	0.195	C	C	.	.	H	α-helix	trans	-64.3	-27.2	178.5	-73.1	0	0	0	0	113.8	N652 R653 A654 V664 Y712	N652-C656 WeakPolarHBondContact O-CB 3.34Å; N652-C656 PolarHBondContact O-N 3.28Å; N652-C656 PolarHBondContact O-SG 3.08Å; R653-C656 PolarHBondContact O-N 3.41Å; A654-C656 PolarHBondContact O-N 3.46Å; C656-V664 PolarHBondContact SG-O 3.22Å; C656-Y712 HydrophobicContact CB-CD1 4.25Å; C656-Y712 HydrophobicContact CB-CE1 3.52Å
657	L	96.6	Very high	96.2	Very high	15 Å²	15	40.2 Å²	40.2	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-96.1	-47.8	-176	-69.6	174.7	0	0	0	111.9	R653 A654 V655 Y712 Y714 H793 I796 L797	R653-L657 HydrophobicContact CG-CD1 3.98Å; R653-L657 WeakPolarHBondContact O-CG 3.47Å; R653-L657 PolarHBondContact O-N 3.25Å; A654-L657 PolarHBondContact O-N 2.76Å; A654-L657 VanDerWaalsContact O-N 3.12Å; V655-L657 PolarHBondContact O-N 3.06Å; L657-Y712 HydrophobicContact CD1-CG 4.47Å; L657-Y712 HydrophobicContact CD2-CD2 3.65Å; L657-Y712 HydrophobicContact CD2-CE2 3.6Å; L657-Y712 HydrophobicContact CD2-CG 4.15Å; L657-Y712 HydrophobicContact CG-CD2 4.37Å; L657-Y712 HydrophobicContact CG-CG 4.38Å; L657-Y714 HydrophobicContact CD1-CE2 4.44Å; L657-H793 HydrophobicContact CD1-CB 3.69Å; L657-I796 HydrophobicContact CB-CG2 4.34Å; L657-I796 HydrophobicContact CD2-CG2 4.34Å; L657-L797 HydrophobicContact CD2-CD2 3.77Å; L657-L797 HydrophobicContact CD2-CG 4.02Å
658	E	97.3	Very high	96.1	Very high	33 Å²	33	38.6 Å²	38.6	15%	0.154	20%	0.196	C	C	.	.	H	α-helix	trans	-88	-27.3	-173.9	-51.4	-158.7	-103.1	0	0	112.1	F612 A654 R792 H793 I796	F612-E658 HydrophobicContact CE2-CB 3.94Å; F612-E658 HydrophobicContact CE2-CG 4.49Å; F612-E658 HydrophobicContact CZ-CB 3.9Å; F612-E658 HydrophobicContact CZ-CG 4.21Å; F612-E658 WeakPolarHBondContact CZ-OE1 3.32Å; A654-E658 WeakPolarHBondContact O-CB 3.48Å; A654-E658 PolarHBondContact O-N 2.93Å; E658-R792 IonicContact OE1-CZ 3.19Å; E658-R792 IonicContact OE1-NE 3.29Å; E658-R792 IonicContact OE1-NH2 4Å; E658-R792 PolarHBondContact OE1-NH2 3.37Å; E658-R792 IonicContact OE2-CZ 3.55Å; E658-R792 IonicContact OE2-NE 2.76Å; E658-R792 PolarHBondContact OE2-NE 3.46Å; E658-R792 IonicContact OE2-NH2 3.77Å; E658-R792 PolarHBondContact OE2-NH2 2.86Å; E658-H793 WeakPolarHBondContact CG-NE2 3.36Å; E658-H793 IonicContact OE1-CD2 2.82Å; E658-H793 IonicContact OE1-NE2 3.89Å; E658-H793 PolarHBondContact OE1-NE2 3.24Å; E658-I796 HydrophobicContact CG-CD1 3.83Å
659	C	96.6	Very high	95.7	Very high	8 Å²	8	42.2 Å²	42.2	5%	0.054	21%	0.212	C	C	.	.			trans	-131.9	59.7	-175.8	-50.8	0	0	0	0	113.6	F612 V655 E661 F662	F612-C659 VanDerWaalsContact CD2-SG 3.55Å; F612-C659 WeakPolarHBondContact CG-SG 3.46Å; V655-C659 CarbonylContact O-C 3.47Å; V655-C659 WeakPolarHBondContact O-CA 3.49Å; V655-C659 PolarHBondContact O-N 3.49Å; C659-E661 WeakPolarHBondContact CA-OE2 3.37Å; C659-E661 PolarHBondContact O-N 3.45Å; C659-E661 VanDerWaalsContact O-N 3.1Å; C659-F662 HydrophobicContact CB-CD2 3.4Å; C659-F662 VanDerWaalsContact CB-CD2 3.4Å; C659-F662 HydrophobicContact CB-CE2 3.53Å; C659-F662 HydrophobicContact CB-CG 4.16Å; C659-F662 HydrophobicContact CB-CZ 4.37Å; C659-F662 PolarHBondContact O-N 2.7Å; C659-F662 VanDerWaalsContact O-N 3.12Å
660	P	94.6	Very high	95.3	Very high	85 Å²	85	52.3 Å²	52.3	55%	0.552	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-58.2	-24.3	-179.5	25.7	-35.6	0	0	0	114	F662 Q663	P660-F662 PolarHBondContact O-N 2.93Å; P660-Q663 PolarHBondContact O-N 3.41Å
661	E	94.8	Very high	94.9	Very high	119 Å²	119	53.6 Å²	53.6	56%	0.556	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-60.7	-23.9	176.4	63.4	-85.5	-163.4	0	0	114	C659 Q663	C659-E661 WeakPolarHBondContact CA-OE2 3.37Å; C659-E661 PolarHBondContact O-N 3.45Å; C659-E661 VanDerWaalsContact O-N 3.1Å; E661-Q663 PolarHBondContact O-N 2.96Å
662	F	95.2	Very high	94.5	Very high	27 Å²	27	53.8 Å²	53.8	12%	0.118	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-75.5	-10.3	175.4	-62.5	-26.7	0	0	0	113.3	F612 E614 I617 V655 C659 P660 V664	F612-F662 HydrophobicContact CB-CE2 4.07Å; E614-F662 HydrophobicContact CB-CE1 3.93Å; E614-F662 HydrophobicContact CB-CZ 4.05Å; E614-F662 HydrophobicContact CG-CD1 4.23Å; E614-F662 HydrophobicContact CG-CE1 3.69Å; E614-F662 HydrophobicContact CG-CZ 4.27Å; I617-F662 HydrophobicContact CB-CD2 4.27Å; I617-F662 HydrophobicContact CB-CE2 4.33Å; I617-F662 HydrophobicContact CG1-CD2 4.48Å; I617-F662 HydrophobicContact CG1-CE2 4.19Å; I617-F662 HydrophobicContact CG2-CD2 3.78Å; I617-F662 HydrophobicContact CG2-CE2 4.3Å; I617-F662 HydrophobicContact CG2-CG 4.46Å; V655-F662 HydrophobicContact CG1-CB 4.43Å; V655-F662 HydrophobicContact CG1-CD2 4.14Å; C659-F662 HydrophobicContact CB-CD2 3.4Å; C659-F662 VanDerWaalsContact CB-CD2 3.4Å; C659-F662 HydrophobicContact CB-CE2 3.53Å; C659-F662 HydrophobicContact CB-CG 4.16Å; C659-F662 HydrophobicContact CB-CZ 4.37Å; C659-F662 PolarHBondContact O-N 2.7Å; C659-F662 VanDerWaalsContact O-N 3.12Å; P660-F662 PolarHBondContact O-N 2.93Å; F662-V664 HydrophobicContact CB-CG2 4.17Å; F662-V664 PolarHBondContact O-N 3.44Å; F662-V664 VanDerWaalsContact O-N 3.12Å
663	Q	93.8	Very high	93.9	Very high	173 Å²	173	57.1 Å²	57.1	81%	0.808	27%	0.271	S	S	*	.			trans	56.4	26.9	176.2	-56.2	178.3	10.7	0	0	114	P660 E661	P660-Q663 PolarHBondContact O-N 3.41Å; E661-Q663 PolarHBondContact O-N 2.96Å
664	V	95	Very high	93.3	Very high	24 Å²	24	61.1 Å²	61.1	15%	0.145	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-74.7	124.6	174.3	179.3	0	0	0	0	108.6	I617 F621 N652 V655 C656 F662	I617-V664 HydrophobicContact CG2-CG2 4.41Å; F621-V664 HydrophobicContact CB-CG1 4.07Å; F621-V664 HydrophobicContact CB-CG2 4.07Å; F621-V664 HydrophobicContact CD1-CG1 3.6Å; F621-V664 HydrophobicContact CD2-CG1 3.92Å; F621-V664 HydrophobicContact CD2-CG2 3.93Å; F621-V664 HydrophobicContact CE1-CG1 3.99Å; F621-V664 HydrophobicContact CE2-CG1 4.3Å; F621-V664 HydrophobicContact CG-CB 4.49Å; F621-V664 HydrophobicContact CG-CG1 3.56Å; F621-V664 HydrophobicContact CG-CG2 4.04Å; F621-V664 HydrophobicContact CZ-CG1 4.33Å; N652-V664 WeakPolarHBondContact ND2-CG1 3.44Å; V655-V664 HydrophobicContact CG1-CB 3.88Å; V655-V664 HydrophobicContact CG1-CG1 4.48Å; V655-V664 HydrophobicContact CG1-CG2 3.84Å; C656-V664 PolarHBondContact SG-O 3.22Å; F662-V664 HydrophobicContact CB-CG2 4.17Å; F662-V664 PolarHBondContact O-N 3.44Å; F662-V664 VanDerWaalsContact O-N 3.12Å
665	P	94.1	Very high	92.5	Very high	90 Å²	90	62.8 Å²	62.8	58%	0.584	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-75.9	156.1	178.3	30.5	-34.3	0	0	0	111.6	N652 F667	N652-P665 PolarHBondContact ND2-O 2.88Å; P665-F667 VanDerWaalsContact O-CD1 3.27Å; P665-F667 WeakPolarHBondContact O-CD1 3.31Å
666	W	94.7	Very high	91.5	Very high	54 Å²	54	66 Å²	66	21%	0.205	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-79.1	119.8	165.3	175.2	-111.2	0	0	0	110.3	M649 N652 R653 H668 Y712 F713	M649-W666 HydrophobicContact CG-CH2 3.91Å; M649-W666 HydrophobicContact CG-CZ3 4.42Å; M649-W666 HydrophobicContact SD-CH2 3.92Å; N652-W666 HydrophobicContact CB-CZ3 4.47Å; R653-W666 HydrophobicContact CB-CH2 4.46Å; R653-W666 HydrophobicContact CB-CZ3 3.83Å; W666-H668 HydrophobicContact CH2-CB 3.64Å; W666-H668 HydrophobicContact CZ2-CB 3.8Å; W666-H668 HydrophobicContact CZ3-CB 4.01Å; W666-Y712 HydrophobicContact CB-CD1 4.36Å; W666-Y712 HydrophobicContact CB-CE1 3.95Å; W666-Y712 AromaticContact CD2-CD1 3.91Å; W666-Y712 HydrophobicContact CD2-CD1 3.91Å; W666-Y712 HydrophobicContact CD2-CE1 4.39Å; W666-Y712 AromaticContact CE3-CD1 3.96Å; W666-Y712 HydrophobicContact CE3-CD1 3.96Å; W666-Y712 HydrophobicContact CG-CD1 4.09Å; W666-Y712 HydrophobicContact CG-CE1 4.17Å; W666-F713 AromaticContact CZ2-CD2 3.8Å; W666-F713 HydrophobicContact CZ2-CD2 3.8Å
667	F	93.6	Very high	90.3	Very high	91 Å²	91	73.1 Å²	73.1	40%	0.399	34%	0.343	S	S	.	.			trans	-127.7	10.3	-177.7	58.8	-94	0	0	0	114.6	F621 L626 N652 P665	F621-F667 AromaticContact CD1-CE1 3.81Å; F621-F667 HydrophobicContact CD1-CE1 3.81Å; F621-F667 AromaticContact CD1-CZ 4Å; F621-F667 HydrophobicContact CD1-CZ 4Å; F621-F667 AromaticContact CE1-CE1 3.89Å; F621-F667 HydrophobicContact CE1-CE1 3.89Å; F621-F667 AromaticContact CE1-CZ 3.89Å; F621-F667 HydrophobicContact CE1-CZ 3.89Å; L626-F667 HydrophobicContact CD1-CZ 4.38Å; N652-F667 PolarHBondContact OD1-N 3.29Å; P665-F667 VanDerWaalsContact O-CD1 3.27Å; P665-F667 WeakPolarHBondContact O-CD1 3.31Å
668	H	93.8	Very high	88.8	Confident	22 Å²	22	79 Å²	79	10%	0.102	37%	0.368	C	S	.	.			trans	-101.7	13.5	-176.4	-78.4	-75.6	0	0	0	115.5	M649 N652 W666 R670 Y671 C672	M649-H668 HydrophobicContact CB-CB 4.25Å; M649-H668 HydrophobicContact CG-CB 3.59Å; N652-H668 PolarHBondContact OD1-CD2 3Å; W666-H668 HydrophobicContact CH2-CB 3.64Å; W666-H668 HydrophobicContact CZ2-CB 3.8Å; W666-H668 HydrophobicContact CZ3-CB 4.01Å; H668-R670 PolarHBondContact O-N 3.36Å; H668-Y671 WeakPolarHBondContact O-CB 3.31Å; H668-Y671 PolarHBondContact O-N 3.33Å; H668-C672 PolarHBondContact O-N 3.45Å; H668-C672 PolarHBondContact O-SG 2.71Å
669	E	89.9	Confident	87	Confident	89 Å²	89	82.3 Å²	82.3	42%	0.416	39%	0.39	S	S	.	.	H	α-helix	trans	-54	-54	-179.5	172.7	164.7	-159.6	0	0	113	Y671 C672 Q673 F713	E669-Y671 VanDerWaalsContact C-N 3.28Å; E669-Y671 PolarHBondContact O-N 3.41Å; E669-C672 PolarHBondContact O-N 2.85Å; E669-Q673 WeakPolarHBondContact O-CG 3.48Å; E669-Q673 PolarHBondContact O-N 2.94Å; E669-Q673 PolarHBondContact OE1-NE2 3.13Å; E669-F713 HydrophobicContact CB-CE2 4.04Å; E669-F713 HydrophobicContact CB-CZ 4.36Å; E669-F713 HydrophobicContact CG-CE2 3.85Å; E669-F713 HydrophobicContact CG-CZ 3.73Å
670	R	89.1	Confident	84.9	Confident	218 Å²	218	85.3 Å²	85.3	82%	0.823	41%	0.406	S	S	*	.	H	α-helix	trans	-60.6	-38.6	179.8	-67.3	-177.4	179.9	177.8	0.5	112.4	H668 H674	H668-R670 PolarHBondContact O-N 3.36Å; R670-H674 PolarHBondContact O-N 3.2Å; R670-H674 VanDerWaalsContact O-N 3.12Å
671	Y	89	Confident	83.1	Confident	46 Å²	46	83.2 Å²	83.2	18%	0.18	40%	0.399	C	S	.	.	H	α-helix	trans	-64	-45.4	178	177.3	-104.3	0	0	0	111	K645 M649 H668 E669 H674 L675	K645-Y671 HydrophobicContact CB-CE2 4.4Å; M649-Y671 HydrophobicContact CB-CD1 4.21Å; M649-Y671 HydrophobicContact CB-CE1 4.16Å; M649-Y671 HydrophobicContact CG-CD1 4.11Å; M649-Y671 HydrophobicContact CG-CE1 4.38Å; H668-Y671 WeakPolarHBondContact O-CB 3.31Å; H668-Y671 PolarHBondContact O-N 3.33Å; E669-Y671 VanDerWaalsContact C-N 3.28Å; E669-Y671 PolarHBondContact O-N 3.41Å; Y671-H674 PolarHBondContact O-N 3.5Å; Y671-L675 HydrophobicContact CD1-CD1 3.89Å; Y671-L675 HydrophobicContact CD1-CG 4.48Å; Y671-L675 HydrophobicContact CE1-CD1 3.34Å; Y671-L675 HydrophobicContact CE1-CG 4.11Å; Y671-L675 PolarHBondContact O-N 2.95Å
672	C	88.2	Confident	81.6	Confident	4 Å²	4	81 Å²	81	3%	0.027	40%	0.397	C	S	.	.	H	α-helix	trans	-65.8	-41.8	178.5	-63.9	0	0	0	0	112.4	H668 E669 H674 L675 Q676 F713	H668-C672 PolarHBondContact O-N 3.45Å; H668-C672 PolarHBondContact O-SG 2.71Å; E669-C672 PolarHBondContact O-N 2.85Å; C672-H674 VanDerWaalsContact C-N 3.28Å; C672-H674 PolarHBondContact O-N 2.91Å; C672-L675 PolarHBondContact O-N 3.46Å; C672-Q676 WeakPolarHBondContact O-CG 3.24Å; C672-Q676 PolarHBondContact O-N 2.98Å; C672-F713 HydrophobicContact CB-CB 3.67Å; C672-F713 HydrophobicContact CB-CD1 3.3Å; C672-F713 HydrophobicContact CB-CD2 3.95Å; C672-F713 HydrophobicContact CB-CE1 3.89Å; C672-F713 HydrophobicContact CB-CE2 4.46Å; C672-F713 HydrophobicContact CB-CG 3.34Å; C672-F713 HydrophobicContact CB-CZ 4.44Å
673	Q	85.8	Confident	80.4	Confident	70 Å²	70	80.4 Å²	80.4	33%	0.327	40%	0.396	S	S	.	.	H	α-helix	trans	-58.7	-39.6	174.6	-70.2	171.6	-2.7	0	0	111.9	E669 K677 F713	E669-Q673 WeakPolarHBondContact O-CG 3.48Å; E669-Q673 PolarHBondContact O-N 2.94Å; E669-Q673 PolarHBondContact OE1-NE2 3.13Å; Q673-K677 WeakPolarHBondContact O-CG 3.5Å; Q673-K677 PolarHBondContact O-N 3.14Å; Q673-F713 HydrophobicContact CG-CE1 3.78Å; Q673-F713 HydrophobicContact CG-CZ 3.99Å
674	H	85.2	Confident	79.9	Confident	99 Å²	99	73.9 Å²	73.9	46%	0.458	37%	0.369	S	S	.	.	H	α-helix	trans	-67.8	-40.9	175.3	-174.6	65.2	0	0	0	112.7	R670 Y671 C672 K677 K678	R670-H674 PolarHBondContact O-N 3.2Å; R670-H674 VanDerWaalsContact O-N 3.12Å; Y671-H674 PolarHBondContact O-N 3.5Å; C672-H674 VanDerWaalsContact C-N 3.28Å; C672-H674 PolarHBondContact O-N 2.91Å; H674-K677 PolarHBondContact O-N 3.32Å; H674-K678 WeakPolarHBondContact NE2-CE 3.23Å; H674-K678 PolarHBondContact O-N 3.26Å
675	L	81.2	Confident	79.4	Confident	36 Å²	36	77.6 Å²	77.6	19%	0.188	39%	0.394	C	S	.	.	H	α-helix	trans	-61.5	-44.2	175	-74.3	178.3	0	0	0	111.5	Y671 C672 K677 K678 V679	Y671-L675 HydrophobicContact CD1-CD1 3.89Å; Y671-L675 HydrophobicContact CD1-CG 4.48Å; Y671-L675 HydrophobicContact CE1-CD1 3.34Å; Y671-L675 HydrophobicContact CE1-CG 4.11Å; Y671-L675 PolarHBondContact O-N 2.95Å; C672-L675 PolarHBondContact O-N 3.46Å; L675-K677 VanDerWaalsContact C-N 3.32Å; L675-K677 PolarHBondContact O-N 2.96Å; L675-K678 PolarHBondContact O-N 3.16Å; L675-V679 WeakPolarHBondContact O-CG2 3.33Å; L675-V679 PolarHBondContact O-N 3.38Å
676	Q	76.1	Confident	79	Confident	68 Å²	68	75 Å²	75	32%	0.318	38%	0.376	S	S	.	.	H	α-helix	trans	-61.1	-39	177.7	-73.5	174.8	-22	0	0	112.4	C672 K678 V679	C672-Q676 WeakPolarHBondContact O-CG 3.24Å; C672-Q676 PolarHBondContact O-N 2.98Å; Q676-K678 VanDerWaalsContact C-N 3.3Å; Q676-K678 PolarHBondContact O-N 2.98Å; Q676-V679 PolarHBondContact O-N 2.94Å
677	K	72.4	Confident	78.7	Confident	165 Å²	165	74.1 Å²	74.1	72%	0.717	38%	0.375	S	S	*	.	H	α-helix	trans	-64.7	-31.1	173.6	-71.3	176.6	-177.5	-179.3	0	113.4	Q673 H674 L675	Q673-K677 WeakPolarHBondContact O-CG 3.5Å; Q673-K677 PolarHBondContact O-N 3.14Å; H674-K677 PolarHBondContact O-N 3.32Å; L675-K677 VanDerWaalsContact C-N 3.32Å; L675-K677 PolarHBondContact O-N 2.96Å
678	K	65.2	Low	78.3	Confident	138 Å²	138	73.1 Å²	73.1	60%	0.6	37%	0.371	S	S	*	.	H	α-helix	trans	-80.5	-35.8	176.6	-78.9	-173.4	171.5	-175	0	112.6	H674 L675 Q676 N680	H674-K678 WeakPolarHBondContact NE2-CE 3.23Å; H674-K678 PolarHBondContact O-N 3.26Å; L675-K678 PolarHBondContact O-N 3.16Å; Q676-K678 VanDerWaalsContact C-N 3.3Å; Q676-K678 PolarHBondContact O-N 2.98Å; K678-N680 VanDerWaalsContact C-N 3.29Å; K678-N680 PolarHBondContact O-N 3.23Å
679	V	59.6	Low	78.1	Confident	102 Å²	102	74.9 Å²	74.9	62%	0.618	38%	0.379	S	S	*	.			trans	-78	82	176.5	-179.5	0	0	0	0	108.5	L675 Q676 G681	L675-V679 WeakPolarHBondContact O-CG2 3.33Å; L675-V679 PolarHBondContact O-N 3.38Å; Q676-V679 PolarHBondContact O-N 2.94Å; V679-G681 PolarHBondContact O-N 3.16Å
680	N	52.4	Low	78.1	Confident	72 Å²	72	70.7 Å²	70.7	39%	0.385	36%	0.36	S	S	.	.			trans	-69.9	73.4	167.3	-74.2	-31.7	0	0	0	109.5	K678 S682	K678-N680 VanDerWaalsContact C-N 3.29Å; K678-N680 PolarHBondContact O-N 3.23Å; N680-S682 PolarHBondContact O-N 3.18Å; N680-S682 VanDerWaalsContact O-N 3.11Å
681	G	56.4	Low	78.1	Confident	40 Å²	40	61.1 Å²	61.1	41%	0.412	32%	0.324	S	S	.	.			trans	-67.8	103.1	-177	0	0	0	0	0	111.4	V679 V683 L746	V679-G681 PolarHBondContact O-N 3.16Å; G681-V683 PolarHBondContact O-N 3.34Å; G681-L746 WeakPolarHBondContact O-CD2 3.49Å
682	S	63	Low	78.1	Confident	73 Å²	73	63.1 Å²	63.1	51%	0.51	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-67.8	128.4	165.9	53.2	0	0	0	0	109	N680 S684	N680-S682 PolarHBondContact O-N 3.18Å; N680-S682 VanDerWaalsContact O-N 3.11Å; S682-S684 PolarHBondContact O-N 2.74Å
683	V	70.3	Confident	78.3	Confident	14 Å²	14	64 Å²	64	9%	0.085	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-61.7	126.2	174.4	-171.6	0	0	0	0	109.2	G681 Q687 Q688 L737 V745 W747	G681-V683 PolarHBondContact O-N 3.34Å; V683-Q687 HydrophobicContact CG1-CB 3.88Å; V683-Q688 HydrophobicContact CB-CG 4.36Å; V683-Q688 HydrophobicContact CG1-CG 3.66Å; V683-L737 HydrophobicContact CG2-CD2 4.07Å; V683-V745 PolarHBondContact N-O 3.4Å; V683-W747 HydrophobicContact CG1-CZ2 3.78Å; V683-W747 VanDerWaalsContact CG2-CD1 3.42Å; V683-W747 HydrophobicContact CG2-CD2 4.16Å; V683-W747 HydrophobicContact CG2-CG 3.96Å; V683-W747 HydrophobicContact CG2-CZ2 4.48Å; V683-W747 VanDerWaalsContact CG2-NE1 3.3Å
684	S	82.1	Confident	78.5	Confident	36 Å²	36	60.7 Å²	60.7	25%	0.252	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-69.3	150	177.8	69.1	0	0	0	0	111.3	S682 V686 Q687 Q688	S682-S684 PolarHBondContact O-N 2.74Å; S684-V686 PolarHBondContact O-N 2.7Å; S684-Q687 PolarHBondContact O-N 3.2Å; S684-Q687 VanDerWaalsContact O-N 3.09Å; S684-Q687 WeakPolarHBondContact OG-CB 3.36Å; S684-Q687 VanDerWaalsContact OG-CD 3.29Å; S684-Q687 VanDerWaalsContact OG-CG 3.23Å; S684-Q687 WeakPolarHBondContact OG-CG 3.25Å; S684-Q687 PolarHBondContact OG-N 3Å; S684-Q687 VanDerWaalsContact OG-N 3.12Å; S684-Q687 PolarHBondContact OG-OE1 3.04Å; S684-Q688 PolarHBondContact O-N 3.07Å
685	P	85.5	Confident	78.6	Confident	102 Å²	102	56.4 Å²	56.4	66%	0.662	31%	0.313	S	S	*	.	H	α-helix	trans	-56.3	-34.5	175.2	-25.8	34.4	0	0	0	112.9	Q688 Q689	P685-Q688 PolarHBondContact O-N 3.22Å; P685-Q689 WeakPolarHBondContact O-CB 3.45Å; P685-Q689 PolarHBondContact O-N 3.24Å
686	V	86.6	Confident	78.9	Confident	35 Å²	35	56.4 Å²	56.4	21%	0.212	32%	0.322	C	S	.	.	H	α-helix	trans	-66.7	-43.7	177.3	-178.9	0	0	0	0	111	S684 Q688 Q689 I690 F770	S684-V686 PolarHBondContact O-N 2.7Å; V686-Q688 VanDerWaalsContact C-N 3.34Å; V686-Q688 PolarHBondContact O-N 3.19Å; V686-Q689 WeakPolarHBondContact O-CB 3.39Å; V686-Q689 PolarHBondContact O-N 3.01Å; V686-I690 HydrophobicContact CG1-CD1 3.88Å; V686-I690 HydrophobicContact CG1-CG1 4.4Å; V686-I690 VanDerWaalsContact O-CG1 3.3Å; V686-I690 WeakPolarHBondContact O-CG1 3.37Å; V686-I690 PolarHBondContact O-N 3.14Å; V686-F770 HydrophobicContact CB-CE1 4.48Å; V686-F770 HydrophobicContact CB-CZ 4.39Å; V686-F770 HydrophobicContact CG1-CD2 4.16Å; V686-F770 HydrophobicContact CG1-CE1 4.05Å; V686-F770 HydrophobicContact CG1-CE2 3.66Å; V686-F770 HydrophobicContact CG1-CZ 3.6Å
687	Q	86.9	Confident	79.6	Confident	37 Å²	37	53.8 Å²	53.8	17%	0.173	31%	0.31	C	S	.	.	H	α-helix	trans	-61.2	-41.8	173.7	-77.8	163	-37.8	0	0	111.5	V683 S684 Q689 I690 H691 D717 F718	V683-Q687 HydrophobicContact CG1-CB 3.88Å; S684-Q687 PolarHBondContact O-N 3.2Å; S684-Q687 VanDerWaalsContact O-N 3.09Å; S684-Q687 WeakPolarHBondContact OG-CB 3.36Å; S684-Q687 VanDerWaalsContact OG-CD 3.29Å; S684-Q687 VanDerWaalsContact OG-CG 3.23Å; S684-Q687 WeakPolarHBondContact OG-CG 3.25Å; S684-Q687 PolarHBondContact OG-N 3Å; S684-Q687 VanDerWaalsContact OG-N 3.12Å; S684-Q687 PolarHBondContact OG-OE1 3.04Å; Q687-Q689 VanDerWaalsContact C-N 3.34Å; Q687-Q689 PolarHBondContact O-N 2.86Å; Q687-I690 PolarHBondContact O-N 2.95Å; Q687-H691 WeakPolarHBondContact O-CB 3.4Å; Q687-H691 PolarHBondContact O-N 3.06Å; Q687-D717 PolarHBondContact NE2-OD1 3.44Å; Q687-F718 HydrophobicContact CB-CZ 4.02Å; Q687-F718 HydrophobicContact CG-CZ 4.42Å; Q687-F718 WeakPolarHBondContact O-CZ 3.35Å
688	Q	86.8	Confident	80.3	Confident	69 Å²	69	46.3 Å²	46.3	32%	0.322	28%	0.278	S	S	.	.	H	α-helix	trans	-61.2	-43.8	175.6	-65.7	178.9	3.1	0	0	111.7	V683 S684 P685 V686 H691 T692	V683-Q688 HydrophobicContact CB-CG 4.36Å; V683-Q688 HydrophobicContact CG1-CG 3.66Å; S684-Q688 PolarHBondContact O-N 3.07Å; P685-Q688 PolarHBondContact O-N 3.22Å; V686-Q688 VanDerWaalsContact C-N 3.34Å; V686-Q688 PolarHBondContact O-N 3.19Å; Q688-H691 WeakPolarHBondContact O-CB 3.44Å; Q688-H691 PolarHBondContact O-N 3.29Å; Q688-T692 PolarHBondContact O-N 2.91Å; Q688-T692 PolarHBondContact O-OG1 3.27Å; Q688-T692 VanDerWaalsContact O-OG1 3.06Å
689	Q	88.9	Confident	81.2	Confident	60 Å²	60	42.9 Å²	42.9	28%	0.28	28%	0.282	S	S	.	.	H	α-helix	trans	-62	-47.1	176.8	-176	-173.5	48.3	0	0	111.9	P685 V686 Q687 H691 T692 M693 W809	P685-Q689 WeakPolarHBondContact O-CB 3.45Å; P685-Q689 PolarHBondContact O-N 3.24Å; V686-Q689 WeakPolarHBondContact O-CB 3.39Å; V686-Q689 PolarHBondContact O-N 3.01Å; Q687-Q689 VanDerWaalsContact C-N 3.34Å; Q687-Q689 PolarHBondContact O-N 2.86Å; Q689-H691 VanDerWaalsContact C-N 3.32Å; Q689-H691 PolarHBondContact O-N 3.37Å; Q689-T692 PolarHBondContact O-N 3.39Å; Q689-M693 WeakPolarHBondContact O-CG 3.02Å; Q689-M693 PolarHBondContact O-N 3.04Å; Q689-W809 HydrophobicContact CG-CZ2 4.3Å
690	I	89.9	Confident	82.4	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57.9	-47	176.1	-70	168	0	0	0	109.7	V686 Q687 T692 M693 L694 F718 F770 I804 W809	V686-I690 HydrophobicContact CG1-CD1 3.88Å; V686-I690 HydrophobicContact CG1-CG1 4.4Å; V686-I690 VanDerWaalsContact O-CG1 3.3Å; V686-I690 WeakPolarHBondContact O-CG1 3.37Å; V686-I690 PolarHBondContact O-N 3.14Å; Q687-I690 PolarHBondContact O-N 2.95Å; I690-T692 PolarHBondContact O-N 3.43Å; I690-M693 PolarHBondContact O-N 3.34Å; I690-M693 VanDerWaalsContact O-N 3.13Å; I690-L694 HydrophobicContact CG2-CD1 3.75Å; I690-L694 HydrophobicContact CG2-CG 4.08Å; I690-L694 WeakPolarHBondContact O-CB 2.94Å; I690-L694 VanDerWaalsContact O-CG 3.26Å; I690-L694 WeakPolarHBondContact O-CG 3.28Å; I690-L694 PolarHBondContact O-N 3.22Å; I690-F718 HydrophobicContact CB-CE2 4.05Å; I690-F718 HydrophobicContact CB-CZ 4.47Å; I690-F718 HydrophobicContact CG2-CD2 3.95Å; I690-F718 HydrophobicContact CG2-CE2 3.58Å; I690-F718 HydrophobicContact CG2-CZ 4.34Å; I690-F770 HydrophobicContact CD1-CB 4Å; I690-F770 HydrophobicContact CD1-CD2 3.49Å; I690-F770 VanDerWaalsContact CD1-CD2 3.49Å; I690-F770 HydrophobicContact CD1-CE2 4.23Å; I690-F770 HydrophobicContact CD1-CG 3.9Å; I690-I804 HydrophobicContact CD1-CD1 4.45Å; I690-I804 HydrophobicContact CG2-CD1 4.13Å; I690-W809 HydrophobicContact CB-CZ2 4.4Å; I690-W809 HydrophobicContact CD1-CD2 4.34Å; I690-W809 HydrophobicContact CG1-CD2 4.09Å; I690-W809 HydrophobicContact CG1-CE3 4.42Å; I690-W809 HydrophobicContact CG1-CH2 3.82Å; I690-W809 HydrophobicContact CG1-CZ2 3.43Å; I690-W809 VanDerWaalsContact CG1-CZ2 3.43Å; I690-W809 HydrophobicContact CG1-CZ3 4.3Å
691	H	89	Confident	83.8	Confident	18 Å²	18	38.6 Å²	38.6	8%	0.083	26%	0.261	C	S	.	.	H	α-helix	trans	-56.4	-46.6	177	-175.3	-116.6	0	0	0	112.5	Q687 Q688 Q689 M693 L694 G695 I701 F718 W747	Q687-H691 WeakPolarHBondContact O-CB 3.4Å; Q687-H691 PolarHBondContact O-N 3.06Å; Q688-H691 WeakPolarHBondContact O-CB 3.44Å; Q688-H691 PolarHBondContact O-N 3.29Å; Q689-H691 VanDerWaalsContact C-N 3.32Å; Q689-H691 PolarHBondContact O-N 3.37Å; H691-M693 PolarHBondContact O-N 3.04Å; H691-L694 PolarHBondContact O-N 3.07Å; H691-G695 PolarHBondContact O-N 3.12Å; H691-I701 WeakPolarHBondContact CE1-CD1 3.45Å; H691-I701 WeakPolarHBondContact CE1-CG1 3.29Å; H691-I701 WeakPolarHBondContact NE2-CD1 3.37Å; H691-F718 HydrophobicContact CB-CD1 4.37Å; H691-F718 HydrophobicContact CB-CE1 3.6Å; H691-F718 HydrophobicContact CB-CZ 4.01Å; H691-F718 AromaticContact CD2-CD1 3.87Å; H691-F718 AromaticContact CD2-CE1 3.79Å; H691-W747 HydrophobicContact CB-CH2 4.21Å; H691-W747 HydrophobicContact CB-CZ2 4.43Å; H691-W747 AromaticContact CE1-CH2 3.66Å; H691-W747 AromaticContact CE1-CZ3 3.81Å; H691-W747 AromaticContact CG-CH2 3.69Å; H691-W747 AromaticContact ND1-CH2 3.44Å; H691-W747 WeakPolarHBondContact ND1-CH2 3.4Å
692	T	88.9	Confident	85	Confident	88 Å²	88	40.5 Å²	40.5	54%	0.54	26%	0.261	S	S	.	.	H	α-helix	trans	-61.8	-42.8	175.9	-53.5	0	0	0	0	111.9	Q688 Q689 I690 G695 G696	Q688-T692 PolarHBondContact O-N 2.91Å; Q688-T692 PolarHBondContact O-OG1 3.27Å; Q688-T692 VanDerWaalsContact O-OG1 3.06Å; Q689-T692 PolarHBondContact O-N 3.39Å; I690-T692 PolarHBondContact O-N 3.43Å; T692-G695 PolarHBondContact O-N 3.24Å; T692-G696 PolarHBondContact O-N 3.02Å
693	M	92.3	Very high	86.1	Confident	22 Å²	22	39.1 Å²	39.1	11%	0.108	25%	0.246	C	C	.	.	H	α-helix	trans	-67	-40.4	178.8	-67	-56.2	104.2	0	0	111.6	Q689 I690 H691 G696 V697 W809 P817 W820 K821 L824	Q689-M693 WeakPolarHBondContact O-CG 3.02Å; Q689-M693 PolarHBondContact O-N 3.04Å; I690-M693 PolarHBondContact O-N 3.34Å; I690-M693 VanDerWaalsContact O-N 3.13Å; H691-M693 PolarHBondContact O-N 3.04Å; M693-G696 CarbonylContact O-C 3.58Å; M693-G696 WeakPolarHBondContact O-CA 3.01Å; M693-G696 PolarHBondContact O-N 3.07Å; M693-G696 VanDerWaalsContact O-N 3.09Å; M693-V697 WeakPolarHBondContact O-CG2 3.49Å; M693-V697 PolarHBondContact O-N 2.89Å; M693-W809 HydrophobicContact CB-CH2 4.37Å; M693-W809 HydrophobicContact CG-CH2 4.29Å; M693-P817 HydrophobicContact SD-CB 4.13Å; M693-W820 HydrophobicContact CG-CB 3.97Å; M693-W820 HydrophobicContact CG-CE3 4.3Å; M693-W820 HydrophobicContact SD-CB 4.23Å; M693-W820 HydrophobicContact SD-CE3 4.11Å; M693-K821 HydrophobicContact SD-CG 4.02Å; M693-L824 HydrophobicContact CB-CD1 3.63Å
694	L	90.7	Very high	86.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.9	-44.9	175.8	-73	172.5	0	0	0	111.9	I690 H691 G696 V697 L698 V704 F718 I768 L824 I828	I690-L694 HydrophobicContact CG2-CD1 3.75Å; I690-L694 HydrophobicContact CG2-CG 4.08Å; I690-L694 WeakPolarHBondContact O-CB 2.94Å; I690-L694 VanDerWaalsContact O-CG 3.26Å; I690-L694 WeakPolarHBondContact O-CG 3.28Å; I690-L694 PolarHBondContact O-N 3.22Å; H691-L694 PolarHBondContact O-N 3.07Å; L694-G696 PolarHBondContact O-N 2.92Å; L694-V697 PolarHBondContact O-N 3.36Å; L694-L698 PolarHBondContact O-N 2.98Å; L694-V704 HydrophobicContact CB-CG2 3.86Å; L694-V704 HydrophobicContact CD1-CG1 4.22Å; L694-F718 HydrophobicContact CD1-CB 3.93Å; L694-F718 HydrophobicContact CD1-CD1 4.33Å; L694-F718 HydrophobicContact CD1-CD2 3.86Å; L694-F718 HydrophobicContact CD1-CG 3.75Å; L694-I768 HydrophobicContact CD1-CD1 4.04Å; L694-I768 HydrophobicContact CD2-CD1 3.71Å; L694-L824 HydrophobicContact CD2-CD1 3.95Å; L694-L824 HydrophobicContact CD2-CD2 4.33Å; L694-L824 HydrophobicContact CG-CD1 4.14Å; L694-I828 HydrophobicContact CD2-CD1 3.4Å; L694-I828 VanDerWaalsContact CD2-CD1 3.4Å
695	G	87.2	Confident	87	Confident	10 Å²	10	38.3 Å²	38.3	10%	0.103	24%	0.236	C	C	.	.	H	α-helix	trans	-56.9	-37.5	173.7	0	0	0	0	0	112.5	H691 T692 G699 G700	H691-G695 PolarHBondContact O-N 3.12Å; T692-G695 PolarHBondContact O-N 3.24Å; G695-G699 PolarHBondContact O-N 3.19Å; G695-G700 WeakPolarHBondContact O-CA 2.87Å; G695-G700 PolarHBondContact O-N 3.18Å
696	G	87.4	Confident	86.9	Confident	36 Å²	36	33.7 Å²	33.7	37%	0.371	21%	0.207	S	C	.	.	H	α-helix	trans	-72.9	-26.2	174.2	0	0	0	0	0	115.1	T692 M693 L694	T692-G696 PolarHBondContact O-N 3.02Å; M693-G696 CarbonylContact O-C 3.58Å; M693-G696 WeakPolarHBondContact O-CA 3.01Å; M693-G696 PolarHBondContact O-N 3.07Å; M693-G696 VanDerWaalsContact O-N 3.09Å; L694-G696 PolarHBondContact O-N 2.92Å
697	V	89.9	Confident	86.7	Confident	13 Å²	13	32.9 Å²	32.9	8%	0.079	20%	0.204	C	C	.	.	H	α-helix	trans	-82.5	-41.3	179.1	171.3	0	0	0	0	111.6	M693 L694 K821 L824 R825	M693-V697 WeakPolarHBondContact O-CG2 3.49Å; M693-V697 PolarHBondContact O-N 2.89Å; L694-V697 PolarHBondContact O-N 3.36Å; V697-K821 HydrophobicContact CG2-CB 3.75Å; V697-K821 HydrophobicContact CG2-CG 3.9Å; V697-K821 WeakPolarHBondContact CG2-O 3.37Å; V697-L824 HydrophobicContact CG2-CB 4.08Å; V697-R825 HydrophobicContact CG1-CB 3.92Å; V697-R825 HydrophobicContact CG1-CG 4.42Å
698	L	88.3	Confident	86.6	Confident	8 Å²	8	31.3 Å²	31.3	4%	0.042	20%	0.197	C	C	.	.	H	α-helix	trans	-90.4	-0.8	-174.2	-58.8	175	0	0	0	113.5	L694 F703 V704 C720 P728 I828	L694-L698 PolarHBondContact O-N 2.98Å; L698-F703 HydrophobicContact CB-CB 3.88Å; L698-F703 HydrophobicContact CD1-CB 4.45Å; L698-F703 VanDerWaalsContact O-CD2 3.31Å; L698-F703 WeakPolarHBondContact O-CD2 3.03Å; L698-V704 HydrophobicContact CD1-CG2 3.45Å; L698-V704 VanDerWaalsContact CD1-CG2 3.45Å; L698-C720 HydrophobicContact CD1-CB 3.81Å; L698-P728 HydrophobicContact CB-CB 4.2Å; L698-P728 HydrophobicContact CB-CG 3.95Å; L698-P728 HydrophobicContact CD2-CB 4.4Å; L698-P728 HydrophobicContact CD2-CG 3.72Å; L698-P728 HydrophobicContact CG-CG 4.42Å; L698-I828 HydrophobicContact CD2-CG2 4.48Å
699	G	83.8	Confident	86.6	Confident	66 Å²	66	28.6 Å²	28.6	68%	0.68	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.5	15.9	175.3	0	0	0	0	0	115	G695	G695-G699 PolarHBondContact O-N 3.19Å
700	G	84.1	Confident	86.6	Confident	25 Å²	25	25.9 Å²	25.9	26%	0.258	17%	0.172	S	C	.	.	S	Bend	trans	155	159.1	176.3	0	0	0	0	0	112.7	G695 N702 F703	G695-G700 WeakPolarHBondContact O-CA 2.87Å; G695-G700 PolarHBondContact O-N 3.18Å; G700-N702 PolarHBondContact O-N 3.31Å; G700-F703 WeakPolarHBondContact O-CD2 3.37Å; G700-F703 PolarHBondContact O-N 3.28Å
701	I	81.8	Confident	86.4	Confident	58 Å²	58	29.7 Å²	29.7	30%	0.297	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-73.1	-20.9	178.8	-146	61.6	0	0	0	112.8	H691 F703 V704 P734	H691-I701 WeakPolarHBondContact CE1-CD1 3.45Å; H691-I701 WeakPolarHBondContact CE1-CG1 3.29Å; H691-I701 WeakPolarHBondContact NE2-CD1 3.37Å; I701-F703 PolarHBondContact O-N 3.12Å; I701-F703 VanDerWaalsContact O-N 3.09Å; I701-V704 PolarHBondContact O-N 3.23Å; I701-V704 VanDerWaalsContact O-N 3.12Å; I701-P734 HydrophobicContact CG2-CB 4.22Å
702	N	82.8	Confident	86.5	Confident	80 Å²	80	31.9 Å²	31.9	43%	0.428	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-67.8	-7.3	178	-58	-10.6	0	0	0	113	G700 Y731	G700-N702 PolarHBondContact O-N 3.31Å; N702-Y731 WeakPolarHBondContact O-CD2 3.28Å; N702-Y731 PolarHBondContact O-N 2.84Å
703	F	85.1	Confident	86.5	Confident	44 Å²	44	28.4 Å²	28.4	19%	0.193	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-96.1	-1	176.8	-61.4	-75.9	0	0	0	113.1	L698 G700 I701 C720 P728 L729 P730	L698-F703 HydrophobicContact CB-CB 3.88Å; L698-F703 HydrophobicContact CD1-CB 4.45Å; L698-F703 VanDerWaalsContact O-CD2 3.31Å; L698-F703 WeakPolarHBondContact O-CD2 3.03Å; G700-F703 WeakPolarHBondContact O-CD2 3.37Å; G700-F703 PolarHBondContact O-N 3.28Å; I701-F703 PolarHBondContact O-N 3.12Å; I701-F703 VanDerWaalsContact O-N 3.09Å; F703-C720 VanDerWaalsContact O-CB 3.23Å; F703-C720 WeakPolarHBondContact O-CB 3.46Å; F703-P728 HydrophobicContact CB-CB 4.01Å; F703-P728 HydrophobicContact CD1-CB 3.53Å; F703-P728 HydrophobicContact CE1-CB 4.16Å; F703-P728 WeakPolarHBondContact CE1-O 3.25Å; F703-P728 HydrophobicContact CG-CB 3.85Å; F703-L729 VanDerWaalsContact CD1-C 3.42Å; F703-L729 WeakPolarHBondContact CD1-O 3.4Å; F703-P730 HydrophobicContact CD1-CB 4.18Å; F703-P730 HydrophobicContact CE1-CB 3.82Å; F703-P730 HydrophobicContact CE1-CG 4.3Å; F703-P730 HydrophobicContact CZ-CB 4.41Å
704	V	85.8	Confident	86.4	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.012	18%	0.181	C	C	.	.			trans	-126.5	131.5	-177.2	-174.3	0	0	0	0	109.7	L694 L698 I701 F718 E719	L694-V704 HydrophobicContact CB-CG2 3.86Å; L694-V704 HydrophobicContact CD1-CG1 4.22Å; L698-V704 HydrophobicContact CD1-CG2 3.45Å; L698-V704 VanDerWaalsContact CD1-CG2 3.45Å; I701-V704 PolarHBondContact O-N 3.23Å; I701-V704 VanDerWaalsContact O-N 3.12Å; V704-F718 HydrophobicContact CG1-CB 3.92Å; V704-F718 HydrophobicContact CG1-CD1 4.03Å; V704-F718 HydrophobicContact CG1-CG 4.32Å; V704-E719 WeakPolarHBondContact CA-O 3.3Å
705	R	84.9	Confident	86.3	Confident	32 Å²	32	31.4 Å²	31.4	12%	0.121	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	125.1	171.1	-164.1	177.4	-175.4	-170.7	4.5	110	V708 F718 E719 Y731 S735 S751	R705-V708 HydrophobicContact CB-CG2 3.86Å; R705-V708 HydrophobicContact CG-CG2 3.62Å; R705-F718 CarbonylContact O-C 3.54Å; R705-F718 VanDerWaalsContact O-CA 3.28Å; R705-F718 WeakPolarHBondContact O-CA 3.4Å; R705-E719 HydrophobicContact CB-CB 4.36Å; R705-E719 PolarHBondContact N-O 3.2Å; R705-E719 PolarHBondContact O-N 3.14Å; R705-Y731 HydrophobicContact CB-CD1 4.49Å; R705-Y731 HydrophobicContact CB-CE1 4.11Å; R705-Y731 HydrophobicContact CB-CE2 4.17Å; R705-S735 WeakPolarHBondContact CA-OG 3.13Å; R705-S751 VanDerWaalsContact NH2-CB 3.31Å; R705-S751 PolarHBondContact NH2-O 3.36Å
706	A	84.9	Confident	86.4	Confident	5 Å²	5	30.9 Å²	30.9	4%	0.041	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	153.8	179.6	0	0	0	0	0	111.9	V708 D717 F718 S735 W747	A706-V708 VanDerWaalsContact C-N 3.35Å; A706-V708 PolarHBondContact O-N 3.47Å; A706-D717 CarbonylContact C-O 3.32Å; A706-D717 WeakPolarHBondContact CA-O 3.4Å; A706-F718 HydrophobicContact CB-CD1 3.95Å; A706-F718 HydrophobicContact CB-CE1 4.04Å; A706-S735 PolarHBondContact N-OG 2.7Å; A706-W747 HydrophobicContact CB-CD2 3.47Å; A706-W747 VanDerWaalsContact CB-CD2 3.47Å; A706-W747 HydrophobicContact CB-CE3 3.67Å; A706-W747 HydrophobicContact CB-CG 3.95Å; A706-W747 HydrophobicContact CB-CH2 4.13Å; A706-W747 HydrophobicContact CB-CZ2 3.93Å; A706-W747 HydrophobicContact CB-CZ3 3.99Å
707	A	82.1	Confident	86.5	Confident	18 Å²	18	30.6 Å²	30.6	15%	0.149	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	51.5	46.1	172.7	0	0	0	0	0	114.3	V709 I716 D717 W747	A707-V709 PolarHBondContact O-N 3.27Å; A707-I716 CarbonylContact C-O 3.22Å; A707-I716 WeakPolarHBondContact CA-O 3.33Å; A707-I716 PolarHBondContact N-O 3.17Å; A707-D717 PolarHBondContact N-O 3.48Å; A707-W747 HydrophobicContact CB-CB 3.79Å; A707-W747 HydrophobicContact CB-CG 3.93Å
708	V	84.1	Confident	86.5	Confident	3 Å²	3	30 Å²	30	2%	0.018	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	128.4	-178.2	-179.2	0	0	0	0	110.1	R705 A706 T715 I716 E719	R705-V708 HydrophobicContact CB-CG2 3.86Å; R705-V708 HydrophobicContact CG-CG2 3.62Å; A706-V708 VanDerWaalsContact C-N 3.35Å; A706-V708 PolarHBondContact O-N 3.47Å; V708-T715 CarbonylContact O-C 3.58Å; V708-T715 WeakPolarHBondContact O-CA 3.3Å; V708-I716 HydrophobicContact CB-CB 4.39Å; V708-I716 PolarHBondContact N-O 2.96Å; V708-I716 PolarHBondContact O-N 3.46Å; V708-E719 HydrophobicContact CB-CB 4.36Å; V708-E719 HydrophobicContact CG2-CB 3.67Å
709	V	86.6	Confident	86.7	Confident	13 Å²	13	29.8 Å²	29.8	8%	0.079	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	120.9	174.2	-177.4	0	0	0	0	108.8	A707 F713 Y714	A707-V709 PolarHBondContact O-N 3.27Å; V709-F713 HydrophobicContact CG1-CD1 4.05Å; V709-Y714 WeakPolarHBondContact CA-O 3.44Å
710	T	88.2	Confident	87	Confident	3 Å²	3	26.7 Å²	26.7	2%	0.018	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-76.6	164.6	176	61.3	0	0	0	0	111.7	Y712 F713 Y714 I716 L794 L797 Y799	T710-Y712 PolarHBondContact O-N 3.42Å; T710-Y712 VanDerWaalsContact O-N 3.12Å; T710-F713 PolarHBondContact O-N 2.82Å; T710-Y714 PolarHBondContact N-O 2.95Å; T710-Y714 WeakPolarHBondContact OG1-CA 3.5Å; T710-Y714 WeakPolarHBondContact OG1-CB 3.5Å; T710-Y714 PolarHBondContact OG1-N 2.83Å; T710-Y714 PolarHBondContact OG1-O 3.3Å; T710-I716 HydrophobicContact CG2-CD1 3.59Å; T710-I716 HydrophobicContact CG2-CG1 4.03Å; T710-L794 HydrophobicContact CG2-CD2 4.01Å; T710-L797 HydrophobicContact CG2-CD1 4.25Å; T710-Y799 HydrophobicContact CG2-CE2 4.21Å
711	P	86.6	Confident	87.3	Confident	80 Å²	80	26.4 Å²	26.4	52%	0.519	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-30	178.4	-27.7	36.4	0	0	0	114.7
712	Y	90.3	Very high	87.7	Confident	64 Å²	64	23.9 Å²	23.9	25%	0.251	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	23.2	176.3	-65.5	-94.2	0	0	0	113	R653 C656 L657 W666 T710 Y714 L797	R653-Y712 PolarHBondContact NE-O 3.16Å; R653-Y712 PolarHBondContact NH2-O 2.58Å; C656-Y712 HydrophobicContact CB-CD1 4.25Å; C656-Y712 HydrophobicContact CB-CE1 3.52Å; L657-Y712 HydrophobicContact CD1-CG 4.47Å; L657-Y712 HydrophobicContact CD2-CD2 3.65Å; L657-Y712 HydrophobicContact CD2-CE2 3.6Å; L657-Y712 HydrophobicContact CD2-CG 4.15Å; L657-Y712 HydrophobicContact CG-CD2 4.37Å; L657-Y712 HydrophobicContact CG-CG 4.38Å; W666-Y712 HydrophobicContact CB-CD1 4.36Å; W666-Y712 HydrophobicContact CB-CE1 3.95Å; W666-Y712 AromaticContact CD2-CD1 3.91Å; W666-Y712 HydrophobicContact CD2-CD1 3.91Å; W666-Y712 HydrophobicContact CD2-CE1 4.39Å; W666-Y712 AromaticContact CE3-CD1 3.96Å; W666-Y712 HydrophobicContact CE3-CD1 3.96Å; W666-Y712 HydrophobicContact CG-CD1 4.09Å; W666-Y712 HydrophobicContact CG-CE1 4.17Å; T710-Y712 PolarHBondContact O-N 3.42Å; T710-Y712 VanDerWaalsContact O-N 3.12Å; Y712-Y714 VanDerWaalsContact C-N 3.34Å; Y712-Y714 PolarHBondContact O-N 3.15Å; Y712-L797 HydrophobicContact CD2-CD2 3.9Å; Y712-L797 HydrophobicContact CE2-CD2 4.16Å
713	F	90.2	Very high	88	Confident	15 Å²	15	21.8 Å²	21.8	7%	0.066	12%	0.115	C	C	.	.			trans	60.8	33.7	171.1	-65.6	-96.9	0	0	0	115.2	R653 W666 E669 C672 Q673 V709 T710	R653-F713 PolarHBondContact NH1-O 3.41Å; R653-F713 PolarHBondContact NH2-O 3.39Å; W666-F713 AromaticContact CZ2-CD2 3.8Å; W666-F713 HydrophobicContact CZ2-CD2 3.8Å; E669-F713 HydrophobicContact CB-CE2 4.04Å; E669-F713 HydrophobicContact CB-CZ 4.36Å; E669-F713 HydrophobicContact CG-CE2 3.85Å; E669-F713 HydrophobicContact CG-CZ 3.73Å; C672-F713 HydrophobicContact CB-CB 3.67Å; C672-F713 HydrophobicContact CB-CD1 3.3Å; C672-F713 HydrophobicContact CB-CD2 3.95Å; C672-F713 HydrophobicContact CB-CE1 3.89Å; C672-F713 HydrophobicContact CB-CE2 4.46Å; C672-F713 HydrophobicContact CB-CG 3.34Å; C672-F713 HydrophobicContact CB-CZ 4.44Å; Q673-F713 HydrophobicContact CG-CE1 3.78Å; Q673-F713 HydrophobicContact CG-CZ 3.99Å; V709-F713 HydrophobicContact CG1-CD1 4.05Å; T710-F713 PolarHBondContact O-N 2.82Å
714	Y	90.2	Very high	88.1	Confident	19 Å²	19	26.8 Å²	26.8	8%	0.075	14%	0.137	C	C	.	.			trans	-75.8	134.3	151.3	-77	-67.4	0	0	0	110.1	R653 L657 V709 T710 Y712 R790 H793 L794	R653-Y714 HydrophobicContact CG-CE2 4.18Å; L657-Y714 HydrophobicContact CD1-CE2 4.44Å; V709-Y714 WeakPolarHBondContact CA-O 3.44Å; T710-Y714 PolarHBondContact N-O 2.95Å; T710-Y714 WeakPolarHBondContact OG1-CA 3.5Å; T710-Y714 WeakPolarHBondContact OG1-CB 3.5Å; T710-Y714 PolarHBondContact OG1-N 2.83Å; T710-Y714 PolarHBondContact OG1-O 3.3Å; Y712-Y714 VanDerWaalsContact C-N 3.34Å; Y712-Y714 PolarHBondContact O-N 3.15Å; Y714-R790 HydrophobicContact CD1-CG 4Å; Y714-R790 HydrophobicContact CE1-CB 4.03Å; Y714-R790 HydrophobicContact CE1-CG 3.75Å; Y714-H793 HydrophobicContact CD2-CB 4.41Å; Y714-H793 HydrophobicContact CE2-CB 3.55Å; Y714-H793 AromaticContact CE2-CG 3.94Å; Y714-H793 AromaticContact CE2-ND1 3.49Å; Y714-H793 WeakPolarHBondContact CE2-ND1 3.34Å; Y714-H793 AromaticContact CZ-ND1 3.53Å; Y714-H793 PolarHBondContact OH-ND1 2.95Å; Y714-L794 HydrophobicContact CD2-CD2 4.42Å; Y714-L794 HydrophobicContact CG-CD2 4.43Å
715	T	88.6	Confident	88.1	Confident	65 Å²	65	32.6 Å²	32.6	40%	0.399	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	115.3	166.6	-54	0	0	0	0	108.6	V708 R790	V708-T715 CarbonylContact O-C 3.58Å; V708-T715 WeakPolarHBondContact O-CA 3.3Å; T715-R790 PolarHBondContact O-NH1 3.28Å; T715-R790 PolarHBondContact O-NH2 2.9Å
716	I	89.5	Confident	88	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	135.2	174.1	-57.4	170.4	0	0	0	108.4	A707 V708 T710 F718 A767 L794 Y799	A707-I716 CarbonylContact C-O 3.22Å; A707-I716 WeakPolarHBondContact CA-O 3.33Å; A707-I716 PolarHBondContact N-O 3.17Å; V708-I716 HydrophobicContact CB-CB 4.39Å; V708-I716 PolarHBondContact N-O 2.96Å; V708-I716 PolarHBondContact O-N 3.46Å; T710-I716 HydrophobicContact CG2-CD1 3.59Å; T710-I716 HydrophobicContact CG2-CG1 4.03Å; I716-F718 VanDerWaalsContact CG2-O 3.26Å; I716-F718 WeakPolarHBondContact CG2-O 3.45Å; I716-A767 HydrophobicContact CD1-CB 4.07Å; I716-A767 HydrophobicContact CG1-CB 4.49Å; I716-A767 HydrophobicContact CG2-CB 3.78Å; I716-L794 HydrophobicContact CD1-CD2 3.89Å; I716-L794 HydrophobicContact CG1-CD1 4.44Å; I716-L794 HydrophobicContact CG1-CD2 3.91Å; I716-Y799 HydrophobicContact CD1-CD1 4.16Å; I716-Y799 HydrophobicContact CD1-CD2 4.49Å; I716-Y799 HydrophobicContact CD1-CE1 3.75Å; I716-Y799 HydrophobicContact CD1-CE2 4.13Å
717	D	88.5	Confident	88.1	Confident	30 Å²	30	41.1 Å²	41.1	16%	0.16	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	-51.6	-179.1	-72	-42.3	0	0	0	111.4	Q687 A706 A707 I768 D769 F770	Q687-D717 PolarHBondContact NE2-OD1 3.44Å; A706-D717 CarbonylContact C-O 3.32Å; A706-D717 WeakPolarHBondContact CA-O 3.4Å; A707-D717 PolarHBondContact N-O 3.48Å; D717-I768 WeakPolarHBondContact CB-O 3.23Å; D717-D769 PolarHBondContact N-OD1 3.42Å; D717-F770 PolarHBondContact OD2-N 2.9Å
718	F	91.1	Very high	88.5	Confident	1 Å²	1	41.9 Å²	41.9	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	142.3	174.5	-46.3	-78.4	0	0	0	112.4	Q687 I690 H691 L694 V704 R705 A706 I716 W747 I768	Q687-F718 HydrophobicContact CB-CZ 4.02Å; Q687-F718 HydrophobicContact CG-CZ 4.42Å; Q687-F718 WeakPolarHBondContact O-CZ 3.35Å; I690-F718 HydrophobicContact CB-CE2 4.05Å; I690-F718 HydrophobicContact CB-CZ 4.47Å; I690-F718 HydrophobicContact CG2-CD2 3.95Å; I690-F718 HydrophobicContact CG2-CE2 3.58Å; I690-F718 HydrophobicContact CG2-CZ 4.34Å; H691-F718 HydrophobicContact CB-CD1 4.37Å; H691-F718 HydrophobicContact CB-CE1 3.6Å; H691-F718 HydrophobicContact CB-CZ 4.01Å; H691-F718 AromaticContact CD2-CD1 3.87Å; H691-F718 AromaticContact CD2-CE1 3.79Å; L694-F718 HydrophobicContact CD1-CB 3.93Å; L694-F718 HydrophobicContact CD1-CD1 4.33Å; L694-F718 HydrophobicContact CD1-CD2 3.86Å; L694-F718 HydrophobicContact CD1-CG 3.75Å; V704-F718 HydrophobicContact CG1-CB 3.92Å; V704-F718 HydrophobicContact CG1-CD1 4.03Å; V704-F718 HydrophobicContact CG1-CG 4.32Å; R705-F718 CarbonylContact O-C 3.54Å; R705-F718 VanDerWaalsContact O-CA 3.28Å; R705-F718 WeakPolarHBondContact O-CA 3.4Å; A706-F718 HydrophobicContact CB-CD1 3.95Å; A706-F718 HydrophobicContact CB-CE1 4.04Å; I716-F718 VanDerWaalsContact CG2-O 3.26Å; I716-F718 WeakPolarHBondContact CG2-O 3.45Å; F718-W747 HydrophobicContact CE1-CZ2 4.24Å; F718-I768 HydrophobicContact CB-CB 4.17Å; F718-I768 PolarHBondContact N-O 2.83Å; F718-I768 VanDerWaalsContact N-O 3.07Å; F718-I768 PolarHBondContact O-N 3.05Å
719	E	91.3	Very high	88.6	Confident	3 Å²	3	43.8 Å²	43.8	1%	0.014	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	139.7	173.5	-172.4	-168.3	80.7	0	0	109.4	V704 R705 V708 Y731 V766 Y799	V704-E719 WeakPolarHBondContact CA-O 3.3Å; R705-E719 HydrophobicContact CB-CB 4.36Å; R705-E719 PolarHBondContact N-O 3.2Å; R705-E719 PolarHBondContact O-N 3.14Å; V708-E719 HydrophobicContact CB-CB 4.36Å; V708-E719 HydrophobicContact CG2-CB 3.67Å; E719-Y731 WeakPolarHBondContact CG-OH 3.47Å; E719-Y731 PolarHBondContact O-OH 3.42Å; E719-Y731 WeakPolarHBondContact OE1-CE1 3.5Å; E719-Y731 PolarHBondContact OE1-OH 2.85Å; E719-V766 WeakPolarHBondContact CA-O 3.33Å; E719-Y799 HydrophobicContact CG-CE1 3.92Å; E719-Y799 WeakPolarHBondContact OE2-CE1 3.34Å; E719-Y799 PolarHBondContact OE2-OH 3.09Å
720	C	90.9	Very high	88.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	153.8	164.4	68	0	0	0	0	111.7	L698 F703 V766	L698-C720 HydrophobicContact CD1-CB 3.81Å; F703-C720 VanDerWaalsContact O-CB 3.23Å; F703-C720 WeakPolarHBondContact O-CB 3.46Å; C720-V766 PolarHBondContact N-O 3.38Å; C720-V766 PolarHBondContact O-N 3.44Å
721	K	90.3	Very high	88	Confident	20 Å²	20	48.3 Å²	48.3	9%	0.087	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	128.8	177	-68.3	173.1	-177.5	177.8	0	109	P728 L729 Y731 D757 L759 R765	K721-P728 WeakPolarHBondContact O-CA 3.3Å; K721-L729 HydrophobicContact CB-CB 3.9Å; K721-L729 HydrophobicContact CB-CD1 4.32Å; K721-L729 PolarHBondContact O-N 2.83Å; K721-Y731 HydrophobicContact CD-CE1 4.01Å; K721-Y731 HydrophobicContact CG-CE1 4.33Å; K721-D757 IonicContact NZ-OD2 3.3Å; K721-D757 PolarHBondContact NZ-OD2 3.07Å; K721-L759 HydrophobicContact CD-CD2 3.87Å; K721-L759 HydrophobicContact CG-CD2 3.88Å; K721-R765 HydrophobicContact CG-CG 4.36Å
722	L	90.1	Very high	87.1	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	137.5	175.6	-61.3	-178.4	0	0	0	110.2	L726 K727 P728 A763 H764 V766 I828 L829	L722-L726 HydrophobicContact CD1-CD2 4.21Å; L722-K727 WeakPolarHBondContact CA-O 3.48Å; L722-P728 HydrophobicContact CD2-CB 4.39Å; L722-P728 HydrophobicContact CD2-CG 4.17Å; L722-A763 CarbonylContact O-C 3.59Å; L722-A763 WeakPolarHBondContact O-CA 3.24Å; L722-A763 VanDerWaalsContact O-CB 3.28Å; L722-A763 WeakPolarHBondContact O-CB 3.46Å; L722-H764 PolarHBondContact N-O 2.94Å; L722-H764 PolarHBondContact O-N 2.88Å; L722-V766 HydrophobicContact CD1-CG2 3.68Å; L722-V766 HydrophobicContact CG-CG2 3.99Å; L722-I828 HydrophobicContact CD1-CG2 4.24Å; L722-L829 HydrophobicContact CD1-CD2 3.96Å; L722-L829 HydrophobicContact CD2-CD2 4.08Å
723	D	89.1	Confident	85.8	Confident	36 Å²	36	49.6 Å²	49.6	19%	0.193	27%	0.272	C	S	.	.			trans	-75.9	179.9	172.9	78.6	1.5	0	0	0	112.6	H725 L726 K727 L729	D723-H725 PolarHBondContact O-N 3.45Å; D723-H725 VanDerWaalsContact OD1-CA 3.25Å; D723-H725 WeakPolarHBondContact OD1-CA 3.45Å; D723-H725 WeakPolarHBondContact OD1-CB 3.47Å; D723-H725 PolarHBondContact OD1-N 2.95Å; D723-L726 PolarHBondContact O-N 3.18Å; D723-L726 PolarHBondContact OD1-N 3.23Å; D723-K727 PolarHBondContact N-O 2.85Å; D723-K727 WeakPolarHBondContact OD1-CB 3.26Å; D723-K727 PolarHBondContact OD1-N 2.92Å; D723-L729 HydrophobicContact CB-CD1 4.33Å; D723-L729 HydrophobicContact CB-CD2 4.23Å; D723-L729 HydrophobicContact CB-CG 4.31Å
724	K	86.4	Confident	84.4	Confident	150 Å²	150	52.3 Å²	52.3	65%	0.652	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-14.8	177.5	68.9	-177.4	-179.3	-177.7	0	114.7	G762	K724-G762 WeakPolarHBondContact CA-O 3.36Å; K724-G762 PolarHBondContact N-O 2.76Å
725	H	85.6	Confident	83.1	Confident	124 Å²	124	52.7 Å²	52.7	57%	0.574	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	14.9	178	-59.2	-60.9	0	0	0	112.3	D723 K727	D723-H725 PolarHBondContact O-N 3.45Å; D723-H725 VanDerWaalsContact OD1-CA 3.25Å; D723-H725 WeakPolarHBondContact OD1-CA 3.45Å; D723-H725 WeakPolarHBondContact OD1-CB 3.47Å; D723-H725 PolarHBondContact OD1-N 2.95Å; H725-K727 HydrophobicContact CB-CG 4.44Å; H725-K727 PolarHBondContact O-N 2.83Å
726	L	84.3	Confident	81.7	Confident	83 Å²	83	52.7 Å²	52.7	44%	0.435	30%	0.296	S	S	.	.	S	Bend	trans	61	25.9	-177.3	-55.1	173.3	0	0	0	113.7	L722 D723 L829	L722-L726 HydrophobicContact CD1-CD2 4.21Å; D723-L726 PolarHBondContact O-N 3.18Å; D723-L726 PolarHBondContact OD1-N 3.23Å; L726-L829 HydrophobicContact CB-CD2 4.34Å; L726-L829 WeakPolarHBondContact CD1-O 3.48Å; L726-L829 WeakPolarHBondContact O-CD2 3.48Å
727	K	87	Confident	80.4	Confident	132 Å²	132	56.7 Å²	56.7	57%	0.574	32%	0.317	S	S	*	.			trans	-89	136	173.3	-63.2	-176.1	177.4	179.4	0	110.7	L722 D723 H725	L722-K727 WeakPolarHBondContact CA-O 3.48Å; D723-K727 PolarHBondContact N-O 2.85Å; D723-K727 WeakPolarHBondContact OD1-CB 3.26Å; D723-K727 PolarHBondContact OD1-N 2.92Å; H725-K727 HydrophobicContact CB-CG 4.44Å; H725-K727 PolarHBondContact O-N 2.83Å
728	P	88.7	Confident	79	Confident	35 Å²	35	59.9 Å²	59.9	23%	0.227	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	138.3	178.1	-22.3	34.9	0	0	0	113	L698 F703 K721 L722	L698-P728 HydrophobicContact CB-CB 4.2Å; L698-P728 HydrophobicContact CB-CG 3.95Å; L698-P728 HydrophobicContact CD2-CB 4.4Å; L698-P728 HydrophobicContact CD2-CG 3.72Å; L698-P728 HydrophobicContact CG-CG 4.42Å; F703-P728 HydrophobicContact CB-CB 4.01Å; F703-P728 HydrophobicContact CD1-CB 3.53Å; F703-P728 HydrophobicContact CE1-CB 4.16Å; F703-P728 WeakPolarHBondContact CE1-O 3.25Å; F703-P728 HydrophobicContact CG-CB 3.85Å; K721-P728 WeakPolarHBondContact O-CA 3.3Å; L722-P728 HydrophobicContact CD2-CB 4.39Å; L722-P728 HydrophobicContact CD2-CG 4.17Å
729	L	86.2	Confident	77.4	Confident	43 Å²	43	66.1 Å²	66.1	23%	0.225	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	134.4	175.5	-64.2	173.2	0	0	0	110.5	F703 K721 D723 P760 A763	F703-L729 VanDerWaalsContact CD1-C 3.42Å; F703-L729 WeakPolarHBondContact CD1-O 3.4Å; K721-L729 HydrophobicContact CB-CB 3.9Å; K721-L729 HydrophobicContact CB-CD1 4.32Å; K721-L729 PolarHBondContact O-N 2.83Å; D723-L729 HydrophobicContact CB-CD1 4.33Å; D723-L729 HydrophobicContact CB-CD2 4.23Å; D723-L729 HydrophobicContact CB-CG 4.31Å; L729-P760 HydrophobicContact CD1-CG 4.07Å; L729-A763 HydrophobicContact CD1-CB 3.93Å
730	P	83.3	Confident	75.7	Confident	85 Å²	85	67.8 Å²	67.8	55%	0.552	38%	0.375	S	S	*	.			trans	-76	150.1	-175	31.4	-33.9	0	0	0	112	F703	F703-P730 HydrophobicContact CD1-CB 4.18Å; F703-P730 HydrophobicContact CE1-CB 3.82Å; F703-P730 HydrophobicContact CE1-CG 4.3Å; F703-P730 HydrophobicContact CZ-CB 4.41Å
731	Y	80.5	Confident	73.7	Confident	25 Å²	25	77.6 Å²	77.6	10%	0.098	42%	0.421	C	S	.	.			trans	-92.2	152	168.1	-68.3	-92.2	0	0	0	110.9	N702 R705 E719 K721 G733	N702-Y731 WeakPolarHBondContact O-CD2 3.28Å; N702-Y731 PolarHBondContact O-N 2.84Å; R705-Y731 HydrophobicContact CB-CD1 4.49Å; R705-Y731 HydrophobicContact CB-CE1 4.11Å; R705-Y731 HydrophobicContact CB-CE2 4.17Å; E719-Y731 WeakPolarHBondContact CG-OH 3.47Å; E719-Y731 PolarHBondContact O-OH 3.42Å; E719-Y731 WeakPolarHBondContact OE1-CE1 3.5Å; E719-Y731 PolarHBondContact OE1-OH 2.85Å; K721-Y731 HydrophobicContact CD-CE1 4.01Å; K721-Y731 HydrophobicContact CG-CE1 4.33Å; Y731-G733 PolarHBondContact O-N 3.05Å; Y731-G733 VanDerWaalsContact O-N 3.14Å
732	S	67	Low	71.9	Confident	127 Å²	127	86.3 Å²	86.3	89%	0.888	45%	0.453	S	S	*	.	S	Bend	trans	-66	-12	-177	-46.1	0	0	0	0	114.7
733	G	63.5	Low	70.1	Confident	45 Å²	45	88.9 Å²	88.9	46%	0.464	48%	0.48	S	S	.	.	S	Bend	trans	-159.2	147	174.1	0	0	0	0	0	112.1	Y731	Y731-G733 PolarHBondContact O-N 3.05Å; Y731-G733 VanDerWaalsContact O-N 3.14Å
734	P	60.3	Low	68.4	Low	71 Å²	71	91.7 Å²	91.7	46%	0.461	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-72.5	150.4	-179.8	29.1	-33.6	0	0	0	112	I701 T736	I701-P734 HydrophobicContact CG2-CB 4.22Å; P734-T736 PolarHBondContact O-N 3.39Å
735	S	62.6	Low	67.1	Low	28 Å²	28	87 Å²	87	20%	0.196	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-72	117.4	169.3	-58.3	0	0	0	0	109.6	R705 A706	R705-S735 WeakPolarHBondContact CA-OG 3.13Å; A706-S735 PolarHBondContact N-OG 2.7Å
736	T	60.2	Low	66	Low	65 Å²	65	83.1 Å²	83.1	40%	0.399	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-100.1	144.1	179.5	51.6	0	0	0	0	111.3	P734 D748	P734-T736 PolarHBondContact O-N 3.39Å; T736-D748 PolarHBondContact O-N 2.85Å
737	L	60.9	Low	65.1	Low	83 Å²	83	80.3 Å²	80.3	44%	0.435	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	128.9	170.6	-69.5	168.5	0	0	0	108.6	V683 V745 L746 W747	V683-L737 HydrophobicContact CG2-CD2 4.07Å; L737-V745 HydrophobicContact CB-CG1 3.95Å; L737-V745 HydrophobicContact CD1-CG1 4.26Å; L737-V745 HydrophobicContact CD2-CG1 3.76Å; L737-V745 HydrophobicContact CG-CG1 4.21Å; L737-L746 CarbonylContact C-O 3.4Å; L737-L746 WeakPolarHBondContact CA-O 3.14Å; L737-W747 HydrophobicContact CD1-CH2 4.42Å; L737-W747 HydrophobicContact CD1-CZ3 4.39Å; L737-W747 HydrophobicContact CD2-CD2 3.65Å; L737-W747 HydrophobicContact CD2-CE3 3.35Å; L737-W747 HydrophobicContact CD2-CG 4.5Å; L737-W747 HydrophobicContact CD2-CH2 3.58Å; L737-W747 HydrophobicContact CD2-CZ2 3.87Å; L737-W747 HydrophobicContact CD2-CZ3 3.33Å; L737-W747 HydrophobicContact CG-CE3 3.94Å; L737-W747 HydrophobicContact CG-CH2 4.03Å; L737-W747 HydrophobicContact CG-CZ3 3.58Å
738	Q	60.4	Low	63.8	Low	97 Å²	97	76.5 Å²	76.5	45%	0.453	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	146.7	174.8	-65.3	-174.4	1.5	0	0	110.6	V745 L746 D748	Q738-V745 WeakPolarHBondContact O-CA 3.26Å; Q738-L746 PolarHBondContact N-O 3.35Å; Q738-L746 PolarHBondContact O-N 3.19Å; Q738-D748 HydrophobicContact CG-CB 4.31Å; Q738-D748 PolarHBondContact NE2-OD1 3.07Å; Q738-D748 PolarHBondContact NE2-OD2 3.22Å; Q738-D748 VanDerWaalsContact NE2-OD2 3.14Å
739	I	56.3	Low	62.2	Low	133 Å²	133	78.7 Å²	78.7	68%	0.682	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	115.9	173.4	-57.4	174.2	0	0	0	107.5
740	S	56.2	Low	60.5	Low	37 Å²	37	82.7 Å²	82.7	26%	0.259	47%	0.465	S	S	.	.			trans	-65.5	161.7	174.6	55	0	0	0	0	112.6	R742 G743 K744 L746	S740-R742 PolarHBondContact O-N 2.73Å; S740-G743 PolarHBondContact O-N 2.81Å; S740-K744 PolarHBondContact N-O 2.98Å; S740-K744 WeakPolarHBondContact OG-CB 3.46Å; S740-K744 PolarHBondContact OG-N 2.88Å; S740-K744 PolarHBondContact OG-O 3.09Å; S740-L746 VanDerWaalsContact CB-CD1 3.47Å
741	E	49.9	Very low	59	Low	207 Å²	207	79.1 Å²	79.1	97%	0.967	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-17.6	172.9	-63.7	-179.8	164.2	0	0	114.2
742	R	50.8	Low	57.4	Low	203 Å²	203	82.9 Å²	82.9	77%	0.766	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	15	176	-75.7	-170	-96.2	-143.1	-7.8	114.4	S740 K744	S740-R742 PolarHBondContact O-N 2.73Å; R742-K744 VanDerWaalsContact C-N 3.3Å; R742-K744 PolarHBondContact O-N 3.16Å
743	G	52.1	Low	56.2	Low	57 Å²	57	85 Å²	85	59%	0.588	46%	0.459	S	S	*	.	S	Bend	trans	74.5	11.5	176.9	0	0	0	0	0	115.4	S740	S740-G743 PolarHBondContact O-N 2.81Å
744	K	53.4	Low	55.5	Low	96 Å²	96	86.4 Å²	86.4	42%	0.417	46%	0.456	S	S	.	.			trans	-93	138.1	177.3	-64.1	-174.7	175.8	-170.8	0	111.6	S740 R742	S740-K744 PolarHBondContact N-O 2.98Å; S740-K744 WeakPolarHBondContact OG-CB 3.46Å; S740-K744 PolarHBondContact OG-N 2.88Å; S740-K744 PolarHBondContact OG-O 3.09Å; R742-K744 VanDerWaalsContact C-N 3.3Å; R742-K744 PolarHBondContact O-N 3.16Å
745	V	60	Low	54.9	Low	50 Å²	50	84.2 Å²	84.2	30%	0.303	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	125.1	175.7	-170.8	0	0	0	0	110.3	V683 L737 Q738	V683-V745 PolarHBondContact N-O 3.4Å; L737-V745 HydrophobicContact CB-CG1 3.95Å; L737-V745 HydrophobicContact CD1-CG1 4.26Å; L737-V745 HydrophobicContact CD2-CG1 3.76Å; L737-V745 HydrophobicContact CG-CG1 4.21Å; Q738-V745 WeakPolarHBondContact O-CA 3.26Å
746	L	63.2	Low	54.3	Low	43 Å²	43	93.8 Å²	93.8	23%	0.225	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	157.4	-178.1	-71.7	137.3	0	0	0	110.5	G681 L737 Q738 S740	G681-L746 WeakPolarHBondContact O-CD2 3.49Å; L737-L746 CarbonylContact C-O 3.4Å; L737-L746 WeakPolarHBondContact CA-O 3.14Å; Q738-L746 PolarHBondContact N-O 3.35Å; Q738-L746 PolarHBondContact O-N 3.19Å; S740-L746 VanDerWaalsContact CB-CD1 3.47Å
747	W	64	Low	54.3	Low	24 Å²	24	93.5 Å²	93.5	9%	0.091	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	137.2	167.8	-64.6	115	0	0	0	110.4	V683 H691 A706 A707 F718 L737 S749	V683-W747 HydrophobicContact CG1-CZ2 3.78Å; V683-W747 VanDerWaalsContact CG2-CD1 3.42Å; V683-W747 HydrophobicContact CG2-CD2 4.16Å; V683-W747 HydrophobicContact CG2-CG 3.96Å; V683-W747 HydrophobicContact CG2-CZ2 4.48Å; V683-W747 VanDerWaalsContact CG2-NE1 3.3Å; H691-W747 HydrophobicContact CB-CH2 4.21Å; H691-W747 HydrophobicContact CB-CZ2 4.43Å; H691-W747 AromaticContact CE1-CH2 3.66Å; H691-W747 AromaticContact CE1-CZ3 3.81Å; H691-W747 AromaticContact CG-CH2 3.69Å; H691-W747 AromaticContact ND1-CH2 3.44Å; H691-W747 WeakPolarHBondContact ND1-CH2 3.4Å; A706-W747 HydrophobicContact CB-CD2 3.47Å; A706-W747 VanDerWaalsContact CB-CD2 3.47Å; A706-W747 HydrophobicContact CB-CE3 3.67Å; A706-W747 HydrophobicContact CB-CG 3.95Å; A706-W747 HydrophobicContact CB-CH2 4.13Å; A706-W747 HydrophobicContact CB-CZ2 3.93Å; A706-W747 HydrophobicContact CB-CZ3 3.99Å; A707-W747 HydrophobicContact CB-CB 3.79Å; A707-W747 HydrophobicContact CB-CG 3.93Å; F718-W747 HydrophobicContact CE1-CZ2 4.24Å; L737-W747 HydrophobicContact CD1-CH2 4.42Å; L737-W747 HydrophobicContact CD1-CZ3 4.39Å; L737-W747 HydrophobicContact CD2-CD2 3.65Å; L737-W747 HydrophobicContact CD2-CE3 3.35Å; L737-W747 HydrophobicContact CD2-CG 4.5Å; L737-W747 HydrophobicContact CD2-CH2 3.58Å; L737-W747 HydrophobicContact CD2-CZ2 3.87Å; L737-W747 HydrophobicContact CD2-CZ3 3.33Å; L737-W747 HydrophobicContact CG-CE3 3.94Å; L737-W747 HydrophobicContact CG-CH2 4.03Å; L737-W747 HydrophobicContact CG-CZ3 3.58Å; W747-S749 PolarHBondContact O-N 3.41Å; W747-S749 VanDerWaalsContact O-N 3.13Å; W747-S749 PolarHBondContact O-OG 3.41Å
748	D	60.6	Low	54.6	Low	53 Å²	53	98.6 Å²	98.6	28%	0.283	49%	0.494	S	S	.	.			trans	-59.7	114.8	172.5	-169.5	-2.8	0	0	0	110.2	T736 Q738 N750	T736-D748 PolarHBondContact O-N 2.85Å; Q738-D748 HydrophobicContact CG-CB 4.31Å; Q738-D748 PolarHBondContact NE2-OD1 3.07Å; Q738-D748 PolarHBondContact NE2-OD2 3.22Å; Q738-D748 VanDerWaalsContact NE2-OD2 3.14Å; D748-N750 PolarHBondContact OD1-ND2 3.18Å
749	S	54	Low	55.4	Low	81 Å²	81	96.7 Å²	96.7	57%	0.566	49%	0.486	S	S	*	.			trans	-101.6	30	-170.1	-65.9	0	0	0	0	113.4	W747 S751	W747-S749 PolarHBondContact O-N 3.41Å; W747-S749 VanDerWaalsContact O-N 3.13Å; W747-S749 PolarHBondContact O-OG 3.41Å; S749-S751 PolarHBondContact O-N 3.47Å
750	N	50.8	Low	56.6	Low	127 Å²	127	94 Å²	94	68%	0.679	48%	0.478	S	S	*	.			trans	-67.9	35.4	171.6	-74.6	-27.3	0	0	0	113.2	D748	D748-N750 PolarHBondContact OD1-ND2 3.18Å
751	S	51.6	Low	57.6	Low	10 Å²	10	97.2 Å²	97.2	7%	0.07	51%	0.506	C	S	.	.			trans	-96.8	-11.5	-155.6	60.7	0	0	0	0	116.8	R705 S749 E753	R705-S751 VanDerWaalsContact NH2-CB 3.31Å; R705-S751 PolarHBondContact NH2-O 3.36Å; S749-S751 PolarHBondContact O-N 3.47Å; S751-E753 VanDerWaalsContact C-N 3.28Å; S751-E753 PolarHBondContact O-N 3.49Å
752	L	46.6	Very low	59	Low	103 Å²	103	89.3 Å²	89.3	54%	0.539	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-67	-28.7	-177.3	-140.9	84.1	0	0	0	112.9	N754	L752-N754 PolarHBondContact O-N 2.69Å
753	E	43.3	Very low	60.7	Low	172 Å²	172	80.1 Å²	80.1	80%	0.804	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-73.7	-22.6	-173.7	-69.9	-175.8	160.8	0	0	113.9	S751	S751-E753 VanDerWaalsContact C-N 3.28Å; S751-E753 PolarHBondContact O-N 3.49Å
754	N	48.6	Very low	62.4	Low	74 Å²	74	82.9 Å²	82.9	40%	0.396	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-112	8.9	-171.5	-61	-20	0	0	0	114.8	L752 R756	L752-N754 PolarHBondContact O-N 2.69Å; N754-R756 PolarHBondContact O-N 3.04Å
755	A	46.7	Very low	64.2	Low	26 Å²	26	80 Å²	80	22%	0.215	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-19	175.7	0	0	0	0	0	112.7	R765	A755-R765 PolarHBondContact O-NH1 3.46Å; A755-R765 VanDerWaalsContact O-NH1 3.09Å; A755-R765 PolarHBondContact O-NH2 2.97Å
756	R	50.5	Low	65.7	Low	228 Å²	228	77.7 Å²	77.7	86%	0.86	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	5.6	-176.5	-65.4	-173.9	-180	-171	0.2	115.3	N754 E758	N754-R756 PolarHBondContact O-N 3.04Å; R756-E758 PolarHBondContact O-N 3.16Å
757	D	60.9	Low	67.2	Low	60 Å²	60	75.6 Å²	75.6	32%	0.321	41%	0.407	S	S	.	.			trans	-60.8	113.4	174	-74.5	-13	0	0	0	110	K721 L759 R765	K721-D757 IonicContact NZ-OD2 3.3Å; K721-D757 PolarHBondContact NZ-OD2 3.07Å; D757-L759 PolarHBondContact O-N 3.29Å; D757-R765 PolarHBondContact O-NH2 3.16Å
758	E	65.7	Low	68.7	Low	189 Å²	189	74.5 Å²	74.5	88%	0.883	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-57.5	127.9	171.6	-71.3	-177.5	173.5	0	0	109.2	R756	R756-E758 PolarHBondContact O-N 3.16Å
759	L	78.3	Confident	70.2	Confident	57 Å²	57	72.3 Å²	72.3	30%	0.298	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-75.8	141.9	176.7	-68.9	167.3	0	0	0	109.2	K721 D757 A763 R765	K721-L759 HydrophobicContact CD-CD2 3.87Å; K721-L759 HydrophobicContact CG-CD2 3.88Å; D757-L759 PolarHBondContact O-N 3.29Å; L759-A763 HydrophobicContact CB-CB 4.35Å; L759-R765 HydrophobicContact CD1-CG 3.75Å; L759-R765 HydrophobicContact CD2-CG 3.92Å; L759-R765 HydrophobicContact CG-CG 4.34Å
760	P	81	Confident	72	Confident	78 Å²	78	69.7 Å²	69.7	51%	0.506	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-53.4	147.6	168.4	-24.1	33.4	0	0	0	111.3	L729 G762 A763	L729-P760 HydrophobicContact CD1-CG 4.07Å; P760-G762 PolarHBondContact O-N 3.46Å; P760-A763 HydrophobicContact CB-CB 4.24Å; P760-A763 HydrophobicContact CG-CB 4.47Å; P760-A763 WeakPolarHBondContact O-CB 3.41Å; P760-A763 PolarHBondContact O-N 3.26Å
761	A	77.6	Confident	73.9	Confident	103 Å²	103	63.8 Å²	63.8	85%	0.851	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	122.3	-179.2	0	0	0	0	0	112
762	G	79.1	Confident	75.7	Confident	42 Å²	42	65.7 Å²	65.7	43%	0.433	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	3.9	-177.4	0	0	0	0	0	115.4	K724 P760 H764	K724-G762 WeakPolarHBondContact CA-O 3.36Å; K724-G762 PolarHBondContact N-O 2.76Å; P760-G762 PolarHBondContact O-N 3.46Å; G762-H764 PolarHBondContact O-CE1 3.29Å; G762-H764 PolarHBondContact O-ND1 3.21Å
763	A	85.9	Confident	77.8	Confident	10 Å²	10	64.7 Å²	64.7	8%	0.083	35%	0.349	C	S	.	.			trans	-85.8	149.8	170.6	0	0	0	0	0	111.5	L722 L729 L759 P760	L722-A763 CarbonylContact O-C 3.59Å; L722-A763 WeakPolarHBondContact O-CA 3.24Å; L722-A763 VanDerWaalsContact O-CB 3.28Å; L722-A763 WeakPolarHBondContact O-CB 3.46Å; L729-A763 HydrophobicContact CD1-CB 3.93Å; L759-A763 HydrophobicContact CB-CB 4.35Å; P760-A763 HydrophobicContact CB-CB 4.24Å; P760-A763 HydrophobicContact CG-CB 4.47Å; P760-A763 WeakPolarHBondContact O-CB 3.41Å; P760-A763 PolarHBondContact O-N 3.26Å
764	H	87.8	Confident	80	Confident	115 Å²	115	62.5 Å²	62.5	53%	0.532	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	147.9	-177.9	-53.2	85.7	0	0	0	110.7	L722 G762	L722-H764 PolarHBondContact N-O 2.94Å; L722-H764 PolarHBondContact O-N 2.88Å; G762-H764 PolarHBondContact O-CE1 3.29Å; G762-H764 PolarHBondContact O-ND1 3.21Å
765	R	91.3	Very high	82.1	Confident	34 Å²	34	60.8 Å²	60.8	13%	0.128	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	136.6	172.1	-70.8	169.5	-169.3	-162.9	4.5	109.3	K721 A755 D757 L759 Y799 R800	K721-R765 HydrophobicContact CG-CG 4.36Å; A755-R765 PolarHBondContact O-NH1 3.46Å; A755-R765 VanDerWaalsContact O-NH1 3.09Å; A755-R765 PolarHBondContact O-NH2 2.97Å; D757-R765 PolarHBondContact O-NH2 3.16Å; L759-R765 HydrophobicContact CD1-CG 3.75Å; L759-R765 HydrophobicContact CD2-CG 3.92Å; L759-R765 HydrophobicContact CG-CG 4.34Å; R765-Y799 HydrophobicContact CB-CD1 3.61Å; R765-Y799 HydrophobicContact CB-CE1 3.7Å; R765-Y799 HydrophobicContact CB-CG 4.44Å; R765-Y799 HydrophobicContact CG-CE1 4.35Å; R765-Y799 WeakPolarHBondContact O-CA 3.47Å; R765-R800 PolarHBondContact O-N 3.32Å
766	V	93.1	Very high	84.4	Confident	2 Å²	2	60 Å²	60	1%	0.012	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	119.4	174.7	-175.8	0	0	0	0	108.3	E719 C720 L722 I768 R800 V802	E719-V766 WeakPolarHBondContact CA-O 3.33Å; C720-V766 PolarHBondContact N-O 3.38Å; C720-V766 PolarHBondContact O-N 3.44Å; L722-V766 HydrophobicContact CD1-CG2 3.68Å; L722-V766 HydrophobicContact CG-CG2 3.99Å; V766-I768 HydrophobicContact CG1-CG1 4.05Å; V766-R800 CarbonylContact C-O 3.45Å; V766-R800 VanDerWaalsContact CA-O 3.25Å; V766-R800 WeakPolarHBondContact CA-O 3.3Å; V766-R800 WeakPolarHBondContact CG1-O 3.42Å; V766-R800 HydrophobicContact CG2-CB 4.41Å; V766-V802 HydrophobicContact CG1-CB 4.29Å; V766-V802 HydrophobicContact CG1-CG2 3.62Å
767	A	94.4	Very high	86.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.8	171.2	0	0	0	0	0	108.5	I716 L794 Y799 R800 V801 V802	I716-A767 HydrophobicContact CD1-CB 4.07Å; I716-A767 HydrophobicContact CG1-CB 4.49Å; I716-A767 HydrophobicContact CG2-CB 3.78Å; A767-L794 HydrophobicContact CB-CD1 4.33Å; A767-Y799 HydrophobicContact CB-CD1 3.78Å; A767-Y799 HydrophobicContact CB-CG 4.08Å; A767-R800 PolarHBondContact N-O 2.8Å; A767-V801 HydrophobicContact CB-CG2 4.46Å; A767-V801 CarbonylContact O-C 3.47Å; A767-V801 WeakPolarHBondContact O-CA 3.48Å; A767-V802 PolarHBondContact O-N 2.79Å
768	I	94.3	Very high	87.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	109	-179.9	-55	166.6	0	0	0	107.1	L694 D717 F718 V766 V802 I804 I828	L694-I768 HydrophobicContact CD1-CD1 4.04Å; L694-I768 HydrophobicContact CD2-CD1 3.71Å; D717-I768 WeakPolarHBondContact CB-O 3.23Å; F718-I768 HydrophobicContact CB-CB 4.17Å; F718-I768 PolarHBondContact N-O 2.83Å; F718-I768 VanDerWaalsContact N-O 3.07Å; F718-I768 PolarHBondContact O-N 3.05Å; V766-I768 HydrophobicContact CG1-CG1 4.05Å; I768-V802 CarbonylContact C-O 3.48Å; I768-V802 VanDerWaalsContact CA-O 3.3Å; I768-V802 WeakPolarHBondContact CA-O 3.45Å; I768-V802 HydrophobicContact CG1-CB 4.37Å; I768-I804 HydrophobicContact CG2-CD1 3.51Å; I768-I804 HydrophobicContact CG2-CG1 4.26Å; I768-I828 HydrophobicContact CD1-CD1 3.69Å; I768-I828 HydrophobicContact CD1-CG1 4.21Å
769	D	91.8	Very high	88.7	Confident	8 Å²	8	46.9 Å²	46.9	4%	0.043	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	128.4	-176.4	-86.5	-7.9	0	0	0	110.4	D717 R790 V802 Q803 I804	D717-D769 PolarHBondContact N-OD1 3.42Å; D769-R790 VanDerWaalsContact CG-NH2 3.3Å; D769-R790 IonicContact OD1-NH2 2.79Å; D769-R790 PolarHBondContact OD1-NH2 3Å; D769-R790 IonicContact OD2-CZ 2.75Å; D769-R790 VanDerWaalsContact OD2-CZ 3.29Å; D769-R790 IonicContact OD2-NE 2.83Å; D769-R790 PolarHBondContact OD2-NE 2.88Å; D769-R790 IonicContact OD2-NH2 3.56Å; D769-R790 PolarHBondContact OD2-NH2 3.44Å; D769-V802 PolarHBondContact N-O 2.9Å; D769-Q803 HydrophobicContact CB-CG 4.49Å; D769-Q803 WeakPolarHBondContact O-CA 3.43Å; D769-I804 PolarHBondContact O-N 2.86Å
770	F	91.9	Very high	89.2	Confident	25 Å²	25	46.4 Å²	46.4	11%	0.11	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	117.7	170.8	176.7	-107.9	0	0	0	109.9	V686 I690 D717 D772 I804 H806 W809	V686-F770 HydrophobicContact CB-CE1 4.48Å; V686-F770 HydrophobicContact CB-CZ 4.39Å; V686-F770 HydrophobicContact CG1-CD2 4.16Å; V686-F770 HydrophobicContact CG1-CE1 4.05Å; V686-F770 HydrophobicContact CG1-CE2 3.66Å; V686-F770 HydrophobicContact CG1-CZ 3.6Å; I690-F770 HydrophobicContact CD1-CB 4Å; I690-F770 HydrophobicContact CD1-CD2 3.49Å; I690-F770 VanDerWaalsContact CD1-CD2 3.49Å; I690-F770 HydrophobicContact CD1-CE2 4.23Å; I690-F770 HydrophobicContact CD1-CG 3.9Å; D717-F770 PolarHBondContact OD2-N 2.9Å; F770-D772 HydrophobicContact CE1-CB 4.11Å; F770-D772 PolarHBondContact O-N 3.49Å; F770-I804 HydrophobicContact CD2-CB 4.42Å; F770-I804 HydrophobicContact CD2-CG2 4.16Å; F770-H806 HydrophobicContact CE2-CB 4.16Å; F770-H806 HydrophobicContact CZ-CB 3.78Å; F770-W809 HydrophobicContact CE2-CB 4.22Å; F770-W809 HydrophobicContact CE2-CG 4.39Å
771	M	92.2	Very high	89.8	Confident	4 Å²	4	49 Å²	49	2%	0.02	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	97.9	-178.9	-55.8	-172	69.6	0	0	110.7	F775 F776 M783 A787 Q803 I804 H806	M771-F775 HydrophobicContact CB-CB 4.45Å; M771-F775 HydrophobicContact CB-CD2 4.02Å; M771-F775 HydrophobicContact CE-CB 3.55Å; M771-F775 HydrophobicContact CE-CG 4.1Å; M771-F776 HydrophobicContact CB-CE2 3.6Å; M771-F776 HydrophobicContact CB-CZ 3.86Å; M771-F776 HydrophobicContact CE-CE1 4.21Å; M771-F776 HydrophobicContact CE-CE2 4.13Å; M771-F776 HydrophobicContact CE-CZ 3.71Å; M771-F776 HydrophobicContact SD-CE2 4.47Å; M771-F776 HydrophobicContact SD-CZ 3.84Å; M771-M783 HydrophobicContact CE-CE 3.64Å; M771-M783 HydrophobicContact CE-CG 3.87Å; M771-M783 HydrophobicContact CE-SD 3.75Å; M771-M783 HydrophobicContact SD-CE 3.78Å; M771-A787 HydrophobicContact CE-CB 3.8Å; M771-Q803 HydrophobicContact CG-CB 4Å; M771-Q803 HydrophobicContact CG-CG 3.98Å; M771-Q803 HydrophobicContact SD-CB 3.51Å; M771-Q803 VanDerWaalsContact SD-CB 3.51Å; M771-Q803 HydrophobicContact SD-CG 3.54Å; M771-Q803 VanDerWaalsContact SD-CG 3.54Å; M771-I804 PolarHBondContact N-O 2.84Å; M771-H806 WeakPolarHBondContact O-CB 3.44Å; M771-H806 PolarHBondContact O-N 3.45Å; M771-H806 PolarHBondContact O-ND1 3.18Å
772	D	89.1	Confident	90.6	Very high	49 Å²	49	46.9 Å²	46.9	26%	0.262	25%	0.247	S	C	.	.			trans	-68.2	175	169.7	65.1	-3.8	0	0	0	112.7	F770 K774 F775 F776	F770-D772 HydrophobicContact CE1-CB 4.11Å; F770-D772 PolarHBondContact O-N 3.49Å; D772-K774 VanDerWaalsContact CG-CG 3.45Å; D772-K774 VanDerWaalsContact CG-NZ 3.35Å; D772-K774 PolarHBondContact O-N 3.3Å; D772-K774 VanDerWaalsContact O-N 3.16Å; D772-K774 VanDerWaalsContact OD1-CE 3.28Å; D772-K774 WeakPolarHBondContact OD1-CE 3.47Å; D772-K774 WeakPolarHBondContact OD1-CG 3.31Å; D772-K774 IonicContact OD1-NZ 3.05Å; D772-K774 PolarHBondContact OD1-NZ 2.73Å; D772-K774 WeakPolarHBondContact OD2-CG 3.38Å; D772-K774 IonicContact OD2-NZ 3.13Å; D772-K774 PolarHBondContact OD2-NZ 2.86Å; D772-F775 PolarHBondContact O-N 3.12Å; D772-F775 WeakPolarHBondContact OD1-CD2 3.47Å; D772-F775 WeakPolarHBondContact OD1-CE2 3.49Å; D772-F776 WeakPolarHBondContact O-CD2 3.31Å
773	S	89.8	Confident	91.3	Very high	83 Å²	83	46.7 Å²	46.7	58%	0.58	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-62	-23.9	-173.3	57.7	0	0	0	0	114	F775 F776	S773-F775 PolarHBondContact O-N 3.38Å; S773-F776 PolarHBondContact O-N 3.06Å
774	K	90.8	Very high	91.8	Very high	125 Å²	125	47.9 Å²	47.9	54%	0.543	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-66.9	-21	179.7	57.3	158.6	-165	-91.9	0	113.5	D772 F776 K784	D772-K774 VanDerWaalsContact CG-CG 3.45Å; D772-K774 VanDerWaalsContact CG-NZ 3.35Å; D772-K774 PolarHBondContact O-N 3.3Å; D772-K774 VanDerWaalsContact O-N 3.16Å; D772-K774 VanDerWaalsContact OD1-CE 3.28Å; D772-K774 WeakPolarHBondContact OD1-CE 3.47Å; D772-K774 WeakPolarHBondContact OD1-CG 3.31Å; D772-K774 IonicContact OD1-NZ 3.05Å; D772-K774 PolarHBondContact OD1-NZ 2.73Å; D772-K774 WeakPolarHBondContact OD2-CG 3.38Å; D772-K774 IonicContact OD2-NZ 3.13Å; D772-K774 PolarHBondContact OD2-NZ 2.86Å; K774-F776 VanDerWaalsContact C-N 3.28Å; K774-K784 WeakPolarHBondContact O-CE 3.43Å; K774-K784 PolarHBondContact O-NZ 3.07Å
775	F	92.4	Very high	92.1	Very high	38 Å²	38	42.4 Å²	42.4	17%	0.167	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-81.1	-6.1	177.6	-63.8	-68.5	0	0	0	113.8	M771 D772 S773 K784 A787	M771-F775 HydrophobicContact CB-CB 4.45Å; M771-F775 HydrophobicContact CB-CD2 4.02Å; M771-F775 HydrophobicContact CE-CB 3.55Å; M771-F775 HydrophobicContact CE-CG 4.1Å; D772-F775 PolarHBondContact O-N 3.12Å; D772-F775 WeakPolarHBondContact OD1-CD2 3.47Å; D772-F775 WeakPolarHBondContact OD1-CE2 3.49Å; S773-F775 PolarHBondContact O-N 3.38Å; F775-K784 PolarHBondContact O-N 3.38Å; F775-A787 HydrophobicContact CB-CB 4.03Å; F775-A787 HydrophobicContact CD1-CB 3.73Å; F775-A787 HydrophobicContact CG-CB 4.24Å
776	F	94.8	Very high	92.3	Very high	9 Å²	9	45 Å²	45	4%	0.039	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-119	153.1	-177.8	-58.4	-82.8	0	0	0	112.2	N533 M771 D772 S773 K774 H781 H782 M783 K784 P805 H806 F807	N533-F776 PolarHBondContact ND2-O 2.94Å; M771-F776 HydrophobicContact CB-CE2 3.6Å; M771-F776 HydrophobicContact CB-CZ 3.86Å; M771-F776 HydrophobicContact CE-CE1 4.21Å; M771-F776 HydrophobicContact CE-CE2 4.13Å; M771-F776 HydrophobicContact CE-CZ 3.71Å; M771-F776 HydrophobicContact SD-CE2 4.47Å; M771-F776 HydrophobicContact SD-CZ 3.84Å; D772-F776 WeakPolarHBondContact O-CD2 3.31Å; S773-F776 PolarHBondContact O-N 3.06Å; K774-F776 VanDerWaalsContact C-N 3.28Å; F776-H781 VanDerWaalsContact CD1-O 3.26Å; F776-H781 WeakPolarHBondContact CD1-O 3.33Å; F776-H782 CarbonylContact C-O 3.47Å; F776-H782 VanDerWaalsContact CA-O 3.24Å; F776-H782 WeakPolarHBondContact CA-O 3.43Å; F776-M783 HydrophobicContact CD1-CB 4.44Å; F776-M783 HydrophobicContact CE1-CB 4.38Å; F776-K784 WeakPolarHBondContact O-CE 3.47Å; F776-P805 HydrophobicContact CE2-CB 4.36Å; F776-P805 HydrophobicContact CZ-CB 3.88Å; F776-P805 HydrophobicContact CZ-CG 4.3Å; F776-H806 AromaticContact CD2-CE1 3.97Å; F776-H806 AromaticContact CD2-ND1 3.86Å; F776-H806 AromaticContact CE2-ND1 3.91Å; F776-F807 AromaticContact CD1-CE1 3.97Å; F776-F807 HydrophobicContact CD1-CE1 3.97Å; F776-F807 HydrophobicContact CD2-CE1 4.24Å; F776-F807 AromaticContact CE1-CE1 3.7Å; F776-F807 HydrophobicContact CE1-CE1 3.7Å; F776-F807 HydrophobicContact CE1-CZ 4.15Å; F776-F807 AromaticContact CE2-CE1 3.98Å; F776-F807 HydrophobicContact CE2-CE1 3.98Å; F776-F807 HydrophobicContact CG-CE1 4.24Å; F776-F807 AromaticContact CZ-CE1 3.7Å; F776-F807 HydrophobicContact CZ-CE1 3.7Å; F776-F807 HydrophobicContact CZ-CZ 4.27Å
777	C	93.1	Very high	92.4	Very high	4 Å²	4	45 Å²	45	3%	0.027	23%	0.227	C	C	.	.			trans	-64	146.1	170.4	-66.1	0	0	0	0	110.5	L535 N779 S780 H782	L535-C777 HydrophobicContact CD1-CB 4.25Å; L535-C777 HydrophobicContact CG-CB 4.15Å; C777-N779 PolarHBondContact O-N 2.79Å; C777-S780 PolarHBondContact O-N 2.76Å; C777-H782 HydrophobicContact CB-CB 4.43Å; C777-H782 PolarHBondContact N-O 3.11Å
778	K	88.7	Confident	92.4	Very high	64 Å²	64	47 Å²	47	28%	0.278	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	138.5	176.8	-68.2	-171.1	-172.9	169.1	0	109.9	E499 I532 N533 S780	E499-K778 IonicContact OE1-NZ 2.68Å; E499-K778 PolarHBondContact OE1-NZ 2.86Å; E499-K778 IonicContact OE2-NZ 2.77Å; E499-K778 PolarHBondContact OE2-NZ 2.99Å; I532-K778 VanDerWaalsContact O-CD 3.29Å; I532-K778 WeakPolarHBondContact O-CD 3.48Å; I532-K778 VanDerWaalsContact O-CE 3.29Å; I532-K778 WeakPolarHBondContact O-CE 3.42Å; I532-K778 PolarHBondContact O-NZ 3.15Å; N533-K778 HydrophobicContact CB-CG 4.4Å; N533-K778 WeakPolarHBondContact O-CB 3.41Å; N533-K778 PolarHBondContact O-N 3.02Å; K778-S780 PolarHBondContact O-N 2.76Å
779	N	85.7	Confident	92.5	Very high	135 Å²	135	47.2 Å²	47.2	72%	0.722	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	25.9	-179.4	-56.2	-14.7	0	0	0	113.9	C777	C777-N779 PolarHBondContact O-N 2.79Å
780	S	89.3	Confident	92.6	Very high	46 Å²	46	48.7 Å²	48.7	32%	0.322	24%	0.244	S	C	.	.	S	Bend	trans	-146.8	157.2	179.8	179.7	0	0	0	0	111.3	C777 K778 H782	C777-S780 PolarHBondContact O-N 2.76Å; K778-S780 PolarHBondContact O-N 2.76Å; S780-H782 VanDerWaalsContact C-N 3.27Å; S780-H782 VanDerWaalsContact OG-CB 3.24Å; S780-H782 WeakPolarHBondContact OG-CB 3.27Å; S780-H782 PolarHBondContact OG-N 2.89Å
781	H	93	Very high	92.8	Very high	132 Å²	132	50.8 Å²	50.8	61%	0.611	25%	0.253	S	S	*	.			trans	-90.5	6.7	169.4	-59.3	164.8	0	0	0	112.2	F776 M783 F807	F776-H781 VanDerWaalsContact CD1-O 3.26Å; F776-H781 WeakPolarHBondContact CD1-O 3.33Å; H781-M783 PolarHBondContact O-N 2.79Å; H781-F807 HydrophobicContact CB-CE1 3.87Å; H781-F807 HydrophobicContact CB-CE2 4.2Å; H781-F807 HydrophobicContact CB-CZ 3.63Å; H781-F807 AromaticContact CD2-CD1 3.65Å; H781-F807 AromaticContact CD2-CE1 3.77Å; H781-F807 AromaticContact CD2-CG 3.79Å; H781-F807 AromaticContact CE1-CD2 3.92Å; H781-F807 AromaticContact CG-CE1 3.85Å; H781-F807 AromaticContact CG-CE2 3.82Å; H781-F807 AromaticContact CG-CZ 3.68Å; H781-F807 AromaticContact ND1-CE2 3.85Å; H781-F807 AromaticContact NE2-CD2 3.9Å; H781-F807 AromaticContact NE2-CG 3.8Å
782	H	94.1	Very high	93	Very high	60 Å²	60	53.2 Å²	53.2	28%	0.278	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-70	127.3	179.9	-168.6	83.8	0	0	0	111.6	L535 L569 N570 F776 C777 S780	L535-H782 HydrophobicContact CD1-CB 3.6Å; L569-H782 PolarHBondContact O-CD2 2.9Å; L569-H782 PolarHBondContact O-NE2 2.66Å; N570-H782 PolarHBondContact O-CE1 3.17Å; N570-H782 VanDerWaalsContact O-CE1 3.22Å; N570-H782 PolarHBondContact O-NE2 3.02Å; F776-H782 CarbonylContact C-O 3.47Å; F776-H782 VanDerWaalsContact CA-O 3.24Å; F776-H782 WeakPolarHBondContact CA-O 3.43Å; C777-H782 HydrophobicContact CB-CB 4.43Å; C777-H782 PolarHBondContact N-O 3.11Å; S780-H782 VanDerWaalsContact C-N 3.27Å; S780-H782 VanDerWaalsContact OG-CB 3.24Å; S780-H782 WeakPolarHBondContact OG-CB 3.27Å; S780-H782 PolarHBondContact OG-N 2.89Å
783	M	94.5	Very high	93.4	Very high	38 Å²	38	50.9 Å²	50.9	19%	0.187	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-81.6	140.4	-176.7	-172.6	179	-51.1	0	0	110.9	N570 M771 F776 H781 A787 L788	N570-M783 WeakPolarHBondContact CB-O 3.47Å; M771-M783 HydrophobicContact CE-CE 3.64Å; M771-M783 HydrophobicContact CE-CG 3.87Å; M771-M783 HydrophobicContact CE-SD 3.75Å; M771-M783 HydrophobicContact SD-CE 3.78Å; F776-M783 HydrophobicContact CD1-CB 4.44Å; F776-M783 HydrophobicContact CE1-CB 4.38Å; H781-M783 PolarHBondContact O-N 2.79Å; M783-A787 HydrophobicContact CG-CB 3.58Å; M783-A787 HydrophobicContact SD-CB 3.82Å; M783-L788 HydrophobicContact CG-CD2 4.43Å; M783-L788 HydrophobicContact CG-CG 4.07Å; M783-L788 HydrophobicContact SD-CD2 3.54Å; M783-L788 VanDerWaalsContact SD-CD2 3.54Å; M783-L788 HydrophobicContact SD-CG 3.71Å
784	K	95.6	Very high	93.6	Very high	35 Å²	35	46.9 Å²	46.9	15%	0.152	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-81.1	160.3	178	-63.2	-175.6	-159	-178.4	0	113	N533 V568 K774 F775 F776 E786 A787 L788	N533-K784 VanDerWaalsContact CG-CE 3.43Å; N533-K784 WeakPolarHBondContact ND2-CE 3.49Å; N533-K784 PolarHBondContact ND2-NZ 3.3Å; N533-K784 WeakPolarHBondContact OD1-CE 3.21Å; N533-K784 PolarHBondContact OD1-NZ 3.49Å; V568-K784 WeakPolarHBondContact O-CB 3.34Å; K774-K784 WeakPolarHBondContact O-CE 3.43Å; K774-K784 PolarHBondContact O-NZ 3.07Å; F775-K784 PolarHBondContact O-N 3.38Å; F776-K784 WeakPolarHBondContact O-CE 3.47Å; K784-E786 VanDerWaalsContact C-N 3.29Å; K784-E786 PolarHBondContact O-N 2.85Å; K784-A787 WeakPolarHBondContact O-CB 3.37Å; K784-A787 PolarHBondContact O-N 2.98Å; K784-A787 VanDerWaalsContact O-N 3.12Å; K784-L788 PolarHBondContact O-N 2.77Å
785	G	95.3	Very high	93.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.3	-37.7	-179.4	0	0	0	0	0	113.3	V568 A787 L788 M789	V568-G785 PolarHBondContact O-N 3.27Å; V568-G785 VanDerWaalsContact O-N 3.11Å; G785-A787 VanDerWaalsContact C-N 3.31Å; G785-A787 PolarHBondContact O-N 3.46Å; G785-L788 PolarHBondContact O-N 2.82Å; G785-M789 WeakPolarHBondContact O-CB 3.23Å; G785-M789 PolarHBondContact O-N 3.33Å
786	E	94.7	Very high	94	Very high	89 Å²	89	47.3 Å²	47.3	42%	0.416	23%	0.228	S	C	.	.	H	α-helix	trans	-62.8	-38	179.5	-173.5	179.6	151.2	0	0	112.4	L608 K784 R790	L608-E786 HydrophobicContact CD2-CB 4.16Å; K784-E786 VanDerWaalsContact C-N 3.29Å; K784-E786 PolarHBondContact O-N 2.85Å; E786-R790 WeakPolarHBondContact O-CB 3.33Å; E786-R790 PolarHBondContact O-N 3.4Å; E786-R790 VanDerWaalsContact O-N 3.08Å
787	A	94.4	Very high	93.9	Very high	2 Å²	2	49.1 Å²	49.1	2%	0.017	24%	0.237	C	C	.	.	H	α-helix	trans	-70.7	-35.9	177.6	0	0	0	0	0	111.7	M771 F775 M783 K784 G785 K791	M771-A787 HydrophobicContact CE-CB 3.8Å; F775-A787 HydrophobicContact CB-CB 4.03Å; F775-A787 HydrophobicContact CD1-CB 3.73Å; F775-A787 HydrophobicContact CG-CB 4.24Å; M783-A787 HydrophobicContact CG-CB 3.58Å; M783-A787 HydrophobicContact SD-CB 3.82Å; K784-A787 WeakPolarHBondContact O-CB 3.37Å; K784-A787 PolarHBondContact O-N 2.98Å; K784-A787 VanDerWaalsContact O-N 3.12Å; G785-A787 VanDerWaalsContact C-N 3.31Å; G785-A787 PolarHBondContact O-N 3.46Å; A787-K791 PolarHBondContact O-N 3.3Å; A787-K791 VanDerWaalsContact O-N 3.08Å
788	L	94.4	Very high	93.8	Very high	42 Å²	42	51.3 Å²	51.3	22%	0.22	26%	0.261	C	S	.	.	H	α-helix	trans	-71.3	-47.9	177.4	-74	168.8	0	0	0	112.1	N570 M783 K784 G785 R790 K791 R792	N570-L788 HydrophobicContact CB-CD1 3.99Å; N570-L788 WeakPolarHBondContact ND2-CD1 3.37Å; N570-L788 WeakPolarHBondContact OD1-CD1 3.28Å; M783-L788 HydrophobicContact CG-CD2 4.43Å; M783-L788 HydrophobicContact CG-CG 4.07Å; M783-L788 HydrophobicContact SD-CD2 3.54Å; M783-L788 VanDerWaalsContact SD-CD2 3.54Å; M783-L788 HydrophobicContact SD-CG 3.71Å; K784-L788 PolarHBondContact O-N 2.77Å; G785-L788 PolarHBondContact O-N 2.82Å; L788-R790 VanDerWaalsContact C-N 3.28Å; L788-R790 PolarHBondContact O-N 3.03Å; L788-K791 WeakPolarHBondContact O-CA 3.41Å; L788-K791 WeakPolarHBondContact O-CB 3.28Å; L788-K791 PolarHBondContact O-N 3.44Å; L788-R792 WeakPolarHBondContact O-CG 3.13Å; L788-R792 PolarHBondContact O-N 3.34Å
789	M	96.4	Very high	94	Very high	3 Å²	3	48.9 Å²	48.9	2%	0.015	25%	0.25	C	C	.	.	H	α-helix	trans	-57.3	-43.9	174.6	-177.7	-178.1	74.3	0	0	110.9	Y604 A607 L608 A654 G785 K791 R792 H793	Y604-M789 HydrophobicContact CE2-CE 3.94Å; A607-M789 HydrophobicContact CB-SD 4.45Å; L608-M789 HydrophobicContact CD2-CB 4.31Å; L608-M789 HydrophobicContact CD2-CE 3.87Å; L608-M789 HydrophobicContact CD2-SD 3.97Å; A654-M789 HydrophobicContact CB-SD 4.18Å; G785-M789 WeakPolarHBondContact O-CB 3.23Å; G785-M789 PolarHBondContact O-N 3.33Å; M789-K791 VanDerWaalsContact C-N 3.31Å; M789-K791 PolarHBondContact O-N 2.96Å; M789-R792 PolarHBondContact O-N 3.42Å; M789-H793 VanDerWaalsContact CG-CE1 3.4Å; M789-H793 WeakPolarHBondContact CG-CE1 3.22Å; M789-H793 WeakPolarHBondContact CG-NE2 3.47Å; M789-H793 WeakPolarHBondContact O-CB 3.36Å; M789-H793 PolarHBondContact O-CD2 2.85Å; M789-H793 PolarHBondContact O-N 3.25Å
790	R	95.4	Very high	94.4	Very high	40 Å²	40	47.7 Å²	47.7	15%	0.151	24%	0.235	C	C	.	.	H	α-helix	trans	-56.7	-44	172.8	174.3	-179.7	169.2	105.7	6.2	112.1	Y714 T715 D769 E786 L788 H793 L794	Y714-R790 HydrophobicContact CD1-CG 4Å; Y714-R790 HydrophobicContact CE1-CB 4.03Å; Y714-R790 HydrophobicContact CE1-CG 3.75Å; T715-R790 PolarHBondContact O-NH1 3.28Å; T715-R790 PolarHBondContact O-NH2 2.9Å; D769-R790 VanDerWaalsContact CG-NH2 3.3Å; D769-R790 IonicContact OD1-NH2 2.79Å; D769-R790 PolarHBondContact OD1-NH2 3Å; D769-R790 IonicContact OD2-CZ 2.75Å; D769-R790 VanDerWaalsContact OD2-CZ 3.29Å; D769-R790 IonicContact OD2-NE 2.83Å; D769-R790 PolarHBondContact OD2-NE 2.88Å; D769-R790 IonicContact OD2-NH2 3.56Å; D769-R790 PolarHBondContact OD2-NH2 3.44Å; E786-R790 WeakPolarHBondContact O-CB 3.33Å; E786-R790 PolarHBondContact O-N 3.4Å; E786-R790 VanDerWaalsContact O-N 3.08Å; L788-R790 VanDerWaalsContact C-N 3.28Å; L788-R790 PolarHBondContact O-N 3.03Å; R790-H793 PolarHBondContact O-N 3.45Å; R790-L794 HydrophobicContact CG-CD1 4.26Å; R790-L794 WeakPolarHBondContact O-CG 3.31Å; R790-L794 PolarHBondContact O-N 3.35Å
791	K	95.5	Very high	94.7	Very high	69 Å²	69	46.3 Å²	46.3	30%	0.3	23%	0.225	S	C	.	.	H	α-helix	trans	-61	-50.6	177.4	179.3	-175.5	170.5	-169.5	0	111	A787 L788 M789 H793 L794 E795 V801	A787-K791 PolarHBondContact O-N 3.3Å; A787-K791 VanDerWaalsContact O-N 3.08Å; L788-K791 WeakPolarHBondContact O-CA 3.41Å; L788-K791 WeakPolarHBondContact O-CB 3.28Å; L788-K791 PolarHBondContact O-N 3.44Å; M789-K791 VanDerWaalsContact C-N 3.31Å; M789-K791 PolarHBondContact O-N 2.96Å; K791-H793 VanDerWaalsContact C-N 3.3Å; K791-H793 PolarHBondContact O-N 3.2Å; K791-L794 PolarHBondContact O-N 3.06Å; K791-E795 WeakPolarHBondContact CE-OE1 3.41Å; K791-E795 WeakPolarHBondContact O-CG 3.38Å; K791-E795 PolarHBondContact O-N 2.99Å; K791-V801 HydrophobicContact CG-CB 4.09Å; K791-V801 HydrophobicContact CG-CG1 4.09Å; K791-V801 HydrophobicContact CG-CG2 4.32Å
792	R	95.9	Very high	94.8	Very high	54 Å²	54	40.5 Å²	40.5	20%	0.204	20%	0.198	C	C	.	.	H	α-helix	trans	-54.1	-47.6	176.6	-63.1	-166.6	-50.9	-101.4	1.1	111.3	A607 L608 E658 L788 M789 L794 E795 I796	A607-R792 PolarHBondContact O-NH2 2.91Å; A607-R792 VanDerWaalsContact O-NH2 3.1Å; L608-R792 PolarHBondContact O-NH1 3.44Å; E658-R792 IonicContact OE1-CZ 3.19Å; E658-R792 IonicContact OE1-NE 3.29Å; E658-R792 IonicContact OE1-NH2 4Å; E658-R792 PolarHBondContact OE1-NH2 3.37Å; E658-R792 IonicContact OE2-CZ 3.55Å; E658-R792 IonicContact OE2-NE 2.76Å; E658-R792 PolarHBondContact OE2-NE 3.46Å; E658-R792 IonicContact OE2-NH2 3.77Å; E658-R792 PolarHBondContact OE2-NH2 2.86Å; L788-R792 WeakPolarHBondContact O-CG 3.13Å; L788-R792 PolarHBondContact O-N 3.34Å; M789-R792 PolarHBondContact O-N 3.42Å; R792-L794 PolarHBondContact O-N 3.25Å; R792-E795 WeakPolarHBondContact O-CB 3.2Å; R792-E795 PolarHBondContact O-N 2.92Å; R792-E795 VanDerWaalsContact O-N 3.16Å; R792-I796 WeakPolarHBondContact O-CG1 3.16Å; R792-I796 PolarHBondContact O-N 3.02Å
793	H	96.9	Very high	94.8	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.9	-41.2	179.3	-71.3	-179.8	0	0	0	113.8	A654 L657 E658 Y714 M789 R790 K791 E795 I796 L797	A654-H793 VanDerWaalsContact CA-CE1 3.44Å; A654-H793 WeakPolarHBondContact CA-CE1 3.33Å; L657-H793 HydrophobicContact CD1-CB 3.69Å; E658-H793 WeakPolarHBondContact CG-NE2 3.36Å; E658-H793 IonicContact OE1-CD2 2.82Å; E658-H793 IonicContact OE1-NE2 3.89Å; E658-H793 PolarHBondContact OE1-NE2 3.24Å; Y714-H793 HydrophobicContact CD2-CB 4.41Å; Y714-H793 HydrophobicContact CE2-CB 3.55Å; Y714-H793 AromaticContact CE2-CG 3.94Å; Y714-H793 AromaticContact CE2-ND1 3.49Å; Y714-H793 WeakPolarHBondContact CE2-ND1 3.34Å; Y714-H793 AromaticContact CZ-ND1 3.53Å; Y714-H793 PolarHBondContact OH-ND1 2.95Å; M789-H793 VanDerWaalsContact CG-CE1 3.4Å; M789-H793 WeakPolarHBondContact CG-CE1 3.22Å; M789-H793 WeakPolarHBondContact CG-NE2 3.47Å; M789-H793 WeakPolarHBondContact O-CB 3.36Å; M789-H793 PolarHBondContact O-CD2 2.85Å; M789-H793 PolarHBondContact O-N 3.25Å; R790-H793 PolarHBondContact O-N 3.45Å; K791-H793 VanDerWaalsContact C-N 3.3Å; K791-H793 PolarHBondContact O-N 3.2Å; H793-E795 VanDerWaalsContact C-N 3.32Å; H793-I796 PolarHBondContact O-N 3.3Å; H793-L797 VanDerWaalsContact O-CG 3.3Å; H793-L797 WeakPolarHBondContact O-CG 3.37Å; H793-L797 PolarHBondContact O-N 3.33Å
794	L	95.7	Very high	94.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.7	-37.6	175.7	-70.2	177.5	0	0	0	111.1	T710 Y714 I716 A767 R790 K791 R792 L797 G798 Y799 V801	T710-L794 HydrophobicContact CG2-CD2 4.01Å; Y714-L794 HydrophobicContact CD2-CD2 4.42Å; Y714-L794 HydrophobicContact CG-CD2 4.43Å; I716-L794 HydrophobicContact CD1-CD2 3.89Å; I716-L794 HydrophobicContact CG1-CD1 4.44Å; I716-L794 HydrophobicContact CG1-CD2 3.91Å; A767-L794 HydrophobicContact CB-CD1 4.33Å; R790-L794 HydrophobicContact CG-CD1 4.26Å; R790-L794 WeakPolarHBondContact O-CG 3.31Å; R790-L794 PolarHBondContact O-N 3.35Å; K791-L794 PolarHBondContact O-N 3.06Å; R792-L794 PolarHBondContact O-N 3.25Å; L794-L797 WeakPolarHBondContact O-CB 3.4Å; L794-L797 PolarHBondContact O-N 2.9Å; L794-G798 PolarHBondContact O-N 3.39Å; L794-Y799 VanDerWaalsContact O-CB 3.28Å; L794-Y799 WeakPolarHBondContact O-CB 3.23Å; L794-Y799 WeakPolarHBondContact O-CD2 3.47Å; L794-Y799 PolarHBondContact O-N 3.04Å; L794-V801 HydrophobicContact CB-CG2 3.5Å; L794-V801 VanDerWaalsContact CB-CG2 3.5Å; L794-V801 HydrophobicContact CD1-CG2 4.17Å; L794-V801 HydrophobicContact CG-CG2 4.5Å
795	E	95.7	Very high	94.7	Very high	90 Å²	90	36.2 Å²	36.2	42%	0.421	18%	0.18	S	C	.	.	H	α-helix	trans	-63.8	-43.1	174.8	-69.4	172.5	167.5	0	0	111.9	K791 R792 H793 L797 G798 Y799 V801	K791-E795 WeakPolarHBondContact CE-OE1 3.41Å; K791-E795 WeakPolarHBondContact O-CG 3.38Å; K791-E795 PolarHBondContact O-N 2.99Å; R792-E795 WeakPolarHBondContact O-CB 3.2Å; R792-E795 PolarHBondContact O-N 2.92Å; R792-E795 VanDerWaalsContact O-N 3.16Å; H793-E795 VanDerWaalsContact C-N 3.32Å; E795-L797 VanDerWaalsContact C-N 3.26Å; E795-L797 PolarHBondContact O-N 3.13Å; E795-G798 WeakPolarHBondContact O-CA 3.22Å; E795-G798 PolarHBondContact O-N 2.81Å; E795-Y799 WeakPolarHBondContact CA-O 3.34Å; E795-V801 HydrophobicContact CG-CB 4.48Å; E795-V801 HydrophobicContact CG-CG2 3.83Å
796	I	95.4	Very high	94.5	Very high	82 Å²	82	38.6 Å²	38.6	42%	0.421	19%	0.191	S	C	.	.	H	α-helix	trans	-58.6	-38	172.4	-69.4	165.3	0	0	0	111.5	L657 E658 R792 H793 G798	L657-I796 HydrophobicContact CB-CG2 4.34Å; L657-I796 HydrophobicContact CD2-CG2 4.34Å; E658-I796 HydrophobicContact CG-CD1 3.83Å; R792-I796 WeakPolarHBondContact O-CG1 3.16Å; R792-I796 PolarHBondContact O-N 3.02Å; H793-I796 PolarHBondContact O-N 3.3Å; I796-G798 PolarHBondContact O-N 3.45Å; I796-G798 VanDerWaalsContact O-N 3.14Å
797	L	92.8	Very high	94.3	Very high	47 Å²	47	36.8 Å²	36.8	25%	0.246	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	3.7	175.6	-71.2	170.5	0	0	0	113.9	L657 T710 Y712 H793 L794 E795 Y799	L657-L797 HydrophobicContact CD2-CD2 3.77Å; L657-L797 HydrophobicContact CD2-CG 4.02Å; T710-L797 HydrophobicContact CG2-CD1 4.25Å; Y712-L797 HydrophobicContact CD2-CD2 3.9Å; Y712-L797 HydrophobicContact CE2-CD2 4.16Å; H793-L797 VanDerWaalsContact O-CG 3.3Å; H793-L797 WeakPolarHBondContact O-CG 3.37Å; H793-L797 PolarHBondContact O-N 3.33Å; L794-L797 WeakPolarHBondContact O-CB 3.4Å; L794-L797 PolarHBondContact O-N 2.9Å; E795-L797 VanDerWaalsContact C-N 3.26Å; E795-L797 PolarHBondContact O-N 3.13Å; L797-Y799 HydrophobicContact CB-CD2 3.88Å; L797-Y799 HydrophobicContact CB-CE2 4.1Å
798	G	91.4	Very high	94.2	Very high	50 Å²	50	39.6 Å²	39.6	52%	0.515	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	16.2	176.5	0	0	0	0	0	114.5	L794 E795 I796	L794-G798 PolarHBondContact O-N 3.39Å; E795-G798 WeakPolarHBondContact O-CA 3.22Å; E795-G798 PolarHBondContact O-N 2.81Å; I796-G798 PolarHBondContact O-N 3.45Å; I796-G798 VanDerWaalsContact O-N 3.14Å
799	Y	92.8	Very high	94	Very high	12 Å²	12	37.6 Å²	37.6	5%	0.047	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	139.5	174.8	-67.5	-91.3	0	0	0	111.8	T710 I716 E719 R765 A767 L794 E795 L797	T710-Y799 HydrophobicContact CG2-CE2 4.21Å; I716-Y799 HydrophobicContact CD1-CD1 4.16Å; I716-Y799 HydrophobicContact CD1-CD2 4.49Å; I716-Y799 HydrophobicContact CD1-CE1 3.75Å; I716-Y799 HydrophobicContact CD1-CE2 4.13Å; E719-Y799 HydrophobicContact CG-CE1 3.92Å; E719-Y799 WeakPolarHBondContact OE2-CE1 3.34Å; E719-Y799 PolarHBondContact OE2-OH 3.09Å; R765-Y799 HydrophobicContact CB-CD1 3.61Å; R765-Y799 HydrophobicContact CB-CE1 3.7Å; R765-Y799 HydrophobicContact CB-CG 4.44Å; R765-Y799 HydrophobicContact CG-CE1 4.35Å; R765-Y799 WeakPolarHBondContact O-CA 3.47Å; A767-Y799 HydrophobicContact CB-CD1 3.78Å; A767-Y799 HydrophobicContact CB-CG 4.08Å; L794-Y799 VanDerWaalsContact O-CB 3.28Å; L794-Y799 WeakPolarHBondContact O-CB 3.23Å; L794-Y799 WeakPolarHBondContact O-CD2 3.47Å; L794-Y799 PolarHBondContact O-N 3.04Å; E795-Y799 WeakPolarHBondContact CA-O 3.34Å; L797-Y799 HydrophobicContact CB-CD2 3.88Å; L797-Y799 HydrophobicContact CB-CE2 4.1Å
800	R	93.9	Very high	93.6	Very high	110 Å²	110	42.3 Å²	42.3	42%	0.415	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	115.7	157.4	-179.4	175.9	172.4	-131	-4.9	108.7	R765 V766 A767 I828	R765-R800 PolarHBondContact O-N 3.32Å; V766-R800 CarbonylContact C-O 3.45Å; V766-R800 VanDerWaalsContact CA-O 3.25Å; V766-R800 WeakPolarHBondContact CA-O 3.3Å; V766-R800 WeakPolarHBondContact CG1-O 3.42Å; V766-R800 HydrophobicContact CG2-CB 4.41Å; A767-R800 PolarHBondContact N-O 2.8Å; R800-I828 PolarHBondContact NH1-O 2.84Å
801	V	94.8	Very high	93.3	Very high	18 Å²	18	42 Å²	42	11%	0.109	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	125.5	-175.9	-176.2	0	0	0	0	111	A767 K791 L794 E795 Q803	A767-V801 HydrophobicContact CB-CG2 4.46Å; A767-V801 CarbonylContact O-C 3.47Å; A767-V801 WeakPolarHBondContact O-CA 3.48Å; K791-V801 HydrophobicContact CG-CB 4.09Å; K791-V801 HydrophobicContact CG-CG1 4.09Å; K791-V801 HydrophobicContact CG-CG2 4.32Å; L794-V801 HydrophobicContact CB-CG2 3.5Å; L794-V801 VanDerWaalsContact CB-CG2 3.5Å; L794-V801 HydrophobicContact CD1-CG2 4.17Å; L794-V801 HydrophobicContact CG-CG2 4.5Å; E795-V801 HydrophobicContact CG-CB 4.48Å; E795-V801 HydrophobicContact CG-CG2 3.83Å; V801-Q803 HydrophobicContact CG1-CG 4.05Å
802	V	95	Very high	92.5	Very high	9 Å²	9	47.1 Å²	47.1	6%	0.055	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	109.7	173.4	175.7	0	0	0	0	108.2	V766 A767 I768 D769 K827 I828	V766-V802 HydrophobicContact CG1-CB 4.29Å; V766-V802 HydrophobicContact CG1-CG2 3.62Å; A767-V802 PolarHBondContact O-N 2.79Å; I768-V802 CarbonylContact C-O 3.48Å; I768-V802 VanDerWaalsContact CA-O 3.3Å; I768-V802 WeakPolarHBondContact CA-O 3.45Å; I768-V802 HydrophobicContact CG1-CB 4.37Å; D769-V802 PolarHBondContact N-O 2.9Å; V802-K827 HydrophobicContact CG1-CB 3.86Å; V802-I828 HydrophobicContact CG1-CG1 4.34Å
803	Q	94.1	Very high	91.7	Very high	30 Å²	30	52.7 Å²	52.7	14%	0.14	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	136.3	178.2	-79.5	168.5	-28.5	0	0	111.1	D769 M771 V801 P805	D769-Q803 HydrophobicContact CB-CG 4.49Å; D769-Q803 WeakPolarHBondContact O-CA 3.43Å; M771-Q803 HydrophobicContact CG-CB 4Å; M771-Q803 HydrophobicContact CG-CG 3.98Å; M771-Q803 HydrophobicContact SD-CB 3.51Å; M771-Q803 VanDerWaalsContact SD-CB 3.51Å; M771-Q803 HydrophobicContact SD-CG 3.54Å; M771-Q803 VanDerWaalsContact SD-CG 3.54Å; V801-Q803 HydrophobicContact CG1-CG 4.05Å; Q803-P805 WeakPolarHBondContact O-CD 3.26Å
804	I	93.9	Very high	91.1	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	98.2	176.6	-58.6	168.5	0	0	0	108.1	I690 I768 D769 F770 M771 W809 Y823 L824	I690-I804 HydrophobicContact CD1-CD1 4.45Å; I690-I804 HydrophobicContact CG2-CD1 4.13Å; I768-I804 HydrophobicContact CG2-CD1 3.51Å; I768-I804 HydrophobicContact CG2-CG1 4.26Å; D769-I804 PolarHBondContact O-N 2.86Å; F770-I804 HydrophobicContact CD2-CB 4.42Å; F770-I804 HydrophobicContact CD2-CG2 4.16Å; M771-I804 PolarHBondContact N-O 2.84Å; I804-W809 HydrophobicContact CG2-CB 3.96Å; I804-W809 HydrophobicContact CG2-CD2 4.19Å; I804-W809 HydrophobicContact CG2-CE3 3.75Å; I804-W809 HydrophobicContact CG2-CG 4.3Å; I804-Y823 HydrophobicContact CG2-CE1 4.11Å; I804-L824 HydrophobicContact CD1-CD2 3.5Å; I804-L824 VanDerWaalsContact CD1-CD2 3.5Å; I804-L824 HydrophobicContact CG1-CD2 4.29Å
805	P	93.9	Very high	90.4	Very high	12 Å²	12	57.5 Å²	57.5	8%	0.078	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	138.5	176.6	-21.9	34.6	0	0	0	112.3	F776 Q803 F807 E808 W809	F776-P805 HydrophobicContact CE2-CB 4.36Å; F776-P805 HydrophobicContact CZ-CB 3.88Å; F776-P805 HydrophobicContact CZ-CG 4.3Å; Q803-P805 WeakPolarHBondContact O-CD 3.26Å; P805-F807 VanDerWaalsContact C-N 3.27Å; P805-F807 HydrophobicContact CB-CD1 4.06Å; P805-F807 HydrophobicContact CB-CD2 4.19Å; P805-F807 HydrophobicContact CB-CE1 3.63Å; P805-F807 HydrophobicContact CB-CE2 3.76Å; P805-F807 HydrophobicContact CB-CG 4.32Å; P805-F807 HydrophobicContact CB-CZ 3.45Å; P805-F807 VanDerWaalsContact CB-CZ 3.45Å; P805-F807 HydrophobicContact CG-CE2 4.35Å; P805-F807 HydrophobicContact CG-CZ 4.05Å; P805-F807 PolarHBondContact O-N 3.48Å; P805-E808 HydrophobicContact CB-CB 4.31Å; P805-E808 HydrophobicContact CB-CG 4.17Å; P805-E808 HydrophobicContact CG-CG 4.23Å; P805-E808 PolarHBondContact O-N 2.84Å; P805-E808 VanDerWaalsContact O-N 3.15Å; P805-W809 PolarHBondContact O-N 3.18Å
806	H	92	Very high	90.1	Very high	51 Å²	51	56.4 Å²	56.4	24%	0.236	30%	0.3	C	S	.	.	H	α-helix	trans	-59	-36.4	178.3	74.2	-75.7	0	0	0	113.1	F770 M771 F776 W809 N810	F770-H806 HydrophobicContact CE2-CB 4.16Å; F770-H806 HydrophobicContact CZ-CB 3.78Å; M771-H806 WeakPolarHBondContact O-CB 3.44Å; M771-H806 PolarHBondContact O-N 3.45Å; M771-H806 PolarHBondContact O-ND1 3.18Å; F776-H806 AromaticContact CD2-CE1 3.97Å; F776-H806 AromaticContact CD2-ND1 3.86Å; F776-H806 AromaticContact CE2-ND1 3.91Å; H806-W809 PolarHBondContact O-N 3.04Å; H806-N810 VanDerWaalsContact O-CB 3.26Å; H806-N810 WeakPolarHBondContact O-CB 3.19Å; H806-N810 VanDerWaalsContact O-CG 3.3Å; H806-N810 PolarHBondContact O-N 3Å; H806-N810 PolarHBondContact O-ND2 3.13Å; H806-N810 VanDerWaalsContact O-ND2 3.17Å
807	F	90.6	Very high	89.7	Confident	50 Å²	50	55.6 Å²	55.6	22%	0.219	30%	0.301	C	S	.	.	H	α-helix	trans	-71.5	-29.1	179.2	55.8	-102.2	0	0	0	112.6	F776 H781 P805 S811	F776-F807 AromaticContact CD1-CE1 3.97Å; F776-F807 HydrophobicContact CD1-CE1 3.97Å; F776-F807 HydrophobicContact CD2-CE1 4.24Å; F776-F807 AromaticContact CE1-CE1 3.7Å; F776-F807 HydrophobicContact CE1-CE1 3.7Å; F776-F807 HydrophobicContact CE1-CZ 4.15Å; F776-F807 AromaticContact CE2-CE1 3.98Å; F776-F807 HydrophobicContact CE2-CE1 3.98Å; F776-F807 HydrophobicContact CG-CE1 4.24Å; F776-F807 AromaticContact CZ-CE1 3.7Å; F776-F807 HydrophobicContact CZ-CE1 3.7Å; F776-F807 HydrophobicContact CZ-CZ 4.27Å; H781-F807 HydrophobicContact CB-CE1 3.87Å; H781-F807 HydrophobicContact CB-CE2 4.2Å; H781-F807 HydrophobicContact CB-CZ 3.63Å; H781-F807 AromaticContact CD2-CD1 3.65Å; H781-F807 AromaticContact CD2-CE1 3.77Å; H781-F807 AromaticContact CD2-CG 3.79Å; H781-F807 AromaticContact CE1-CD2 3.92Å; H781-F807 AromaticContact CG-CE1 3.85Å; H781-F807 AromaticContact CG-CE2 3.82Å; H781-F807 AromaticContact CG-CZ 3.68Å; H781-F807 AromaticContact ND1-CE2 3.85Å; H781-F807 AromaticContact NE2-CD2 3.9Å; H781-F807 AromaticContact NE2-CG 3.8Å; P805-F807 VanDerWaalsContact C-N 3.27Å; P805-F807 HydrophobicContact CB-CD1 4.06Å; P805-F807 HydrophobicContact CB-CD2 4.19Å; P805-F807 HydrophobicContact CB-CE1 3.63Å; P805-F807 HydrophobicContact CB-CE2 3.76Å; P805-F807 HydrophobicContact CB-CG 4.32Å; P805-F807 HydrophobicContact CB-CZ 3.45Å; P805-F807 VanDerWaalsContact CB-CZ 3.45Å; P805-F807 HydrophobicContact CG-CE2 4.35Å; P805-F807 HydrophobicContact CG-CZ 4.05Å; P805-F807 PolarHBondContact O-N 3.48Å; F807-S811 WeakPolarHBondContact O-CB 3.43Å; F807-S811 PolarHBondContact O-N 2.81Å
808	E	91.8	Very high	89.5	Confident	62 Å²	62	60.8 Å²	60.8	29%	0.29	32%	0.323	S	S	.	.	H	α-helix	trans	-73.3	-50.2	170.9	-70.4	-179.4	-159.4	0	0	109.8	P805 N810 S811 L814 Y823 K827	P805-E808 HydrophobicContact CB-CB 4.31Å; P805-E808 HydrophobicContact CB-CG 4.17Å; P805-E808 HydrophobicContact CG-CG 4.23Å; P805-E808 PolarHBondContact O-N 2.84Å; P805-E808 VanDerWaalsContact O-N 3.15Å; E808-N810 PolarHBondContact O-N 2.97Å; E808-S811 VanDerWaalsContact O-CB 3.23Å; E808-S811 WeakPolarHBondContact O-CB 3.44Å; E808-S811 PolarHBondContact O-N 3.37Å; E808-S811 VanDerWaalsContact O-N 3.16Å; E808-S811 PolarHBondContact O-OG 3.21Å; E808-L814 VanDerWaalsContact O-CD1 3.31Å; E808-L814 WeakPolarHBondContact O-CD1 3.44Å; E808-Y823 HydrophobicContact CB-CE2 4.44Å; E808-Y823 WeakPolarHBondContact OE2-CE2 3.37Å; E808-Y823 PolarHBondContact OE2-OH 2.87Å; E808-K827 IonicContact OE1-NZ 3.58Å; E808-K827 IonicContact OE2-NZ 2.75Å; E808-K827 PolarHBondContact OE2-NZ 3.42Å
809	W	90.8	Very high	89.4	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61	-41	-176	-171.5	-100.3	0	0	0	113.6	Q689 I690 M693 F770 I804 P805 H806 S811 W820 Y823 L824	Q689-W809 HydrophobicContact CG-CZ2 4.3Å; I690-W809 HydrophobicContact CB-CZ2 4.4Å; I690-W809 HydrophobicContact CD1-CD2 4.34Å; I690-W809 HydrophobicContact CG1-CD2 4.09Å; I690-W809 HydrophobicContact CG1-CE3 4.42Å; I690-W809 HydrophobicContact CG1-CH2 3.82Å; I690-W809 HydrophobicContact CG1-CZ2 3.43Å; I690-W809 VanDerWaalsContact CG1-CZ2 3.43Å; I690-W809 HydrophobicContact CG1-CZ3 4.3Å; M693-W809 HydrophobicContact CB-CH2 4.37Å; M693-W809 HydrophobicContact CG-CH2 4.29Å; F770-W809 HydrophobicContact CE2-CB 4.22Å; F770-W809 HydrophobicContact CE2-CG 4.39Å; I804-W809 HydrophobicContact CG2-CB 3.96Å; I804-W809 HydrophobicContact CG2-CD2 4.19Å; I804-W809 HydrophobicContact CG2-CE3 3.75Å; I804-W809 HydrophobicContact CG2-CG 4.3Å; P805-W809 PolarHBondContact O-N 3.18Å; H806-W809 PolarHBondContact O-N 3.04Å; W809-S811 VanDerWaalsContact C-N 3.31Å; W809-W820 AromaticContact CE2-CD1 3.87Å; W809-W820 AromaticContact CE2-NE1 3.89Å; W809-W820 AromaticContact CE3-CD1 3.95Å; W809-W820 HydrophobicContact CH2-CB 3.76Å; W809-W820 AromaticContact CH2-CD1 3.6Å; W809-W820 HydrophobicContact CH2-CD2 4.49Å; W809-W820 AromaticContact CH2-CG 3.7Å; W809-W820 HydrophobicContact CH2-CG 3.7Å; W809-W820 HydrophobicContact CZ2-CB 4.36Å; W809-W820 AromaticContact CZ2-CD1 3.67Å; W809-W820 HydrophobicContact CZ2-CD2 4.21Å; W809-W820 AromaticContact CZ2-CG 3.85Å; W809-W820 HydrophobicContact CZ2-CG 3.85Å; W809-W820 HydrophobicContact CZ3-CB 4.22Å; W809-W820 AromaticContact CZ3-CD1 3.73Å; W809-W820 HydrophobicContact CZ3-CG 4.19Å; W809-W820 PolarHBondContact O-NE1 3.18Å; W809-Y823 HydrophobicContact CE3-CD1 4.15Å; W809-Y823 HydrophobicContact CE3-CE1 4.11Å; W809-Y823 HydrophobicContact CZ3-CD1 4.08Å; W809-Y823 HydrophobicContact CZ3-CE1 4.37Å; W809-L824 HydrophobicContact CH2-CD1 3.9Å; W809-L824 HydrophobicContact CH2-CD2 4.44Å; W809-L824 HydrophobicContact CH2-CG 4.21Å; W809-L824 HydrophobicContact CZ3-CD1 4.03Å; W809-L824 HydrophobicContact CZ3-CD2 3.8Å; W809-L824 HydrophobicContact CZ3-CG 3.81Å
810	N	87.3	Confident	89.3	Confident	101 Å²	101	60 Å²	60	54%	0.54	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	7.7	-179.1	-60.6	-32.6	0	0	0	113	H806 E808	H806-N810 VanDerWaalsContact O-CB 3.26Å; H806-N810 WeakPolarHBondContact O-CB 3.19Å; H806-N810 VanDerWaalsContact O-CG 3.3Å; H806-N810 PolarHBondContact O-N 3Å; H806-N810 PolarHBondContact O-ND2 3.13Å; H806-N810 VanDerWaalsContact O-ND2 3.17Å; E808-N810 PolarHBondContact O-N 2.97Å
811	S	88.7	Confident	89.1	Confident	34 Å²	34	58 Å²	58	24%	0.238	30%	0.3	C	S	.	.	S	Bend	trans	-66.7	154.6	179.2	67.6	0	0	0	0	112	F807 E808 W809 E813 L814	F807-S811 WeakPolarHBondContact O-CB 3.43Å; F807-S811 PolarHBondContact O-N 2.81Å; E808-S811 VanDerWaalsContact O-CB 3.23Å; E808-S811 WeakPolarHBondContact O-CB 3.44Å; E808-S811 PolarHBondContact O-N 3.37Å; E808-S811 VanDerWaalsContact O-N 3.16Å; E808-S811 PolarHBondContact O-OG 3.21Å; W809-S811 VanDerWaalsContact C-N 3.31Å; S811-E813 PolarHBondContact O-N 3.02Å; S811-L814 CarbonylContact O-C 3.6Å; S811-L814 PolarHBondContact O-N 3.3Å; S811-L814 PolarHBondContact OG-N 3.39Å
812	M	78.9	Confident	88.9	Confident	177 Å²	177	65.7 Å²	65.7	87%	0.872	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-60.8	-28	175	-68.7	-177.2	66.4	0	0	112.8	L814 S815	M812-L814 PolarHBondContact O-N 3.26Å; M812-S815 WeakPolarHBondContact O-CB 3.25Å; M812-S815 PolarHBondContact O-OG 3.23Å
813	E	79.1	Confident	88.8	Confident	170 Å²	170	66.8 Å²	66.8	79%	0.794	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-64.8	-29	176	-61.5	-173.2	173.5	0	0	112.4	S811	S811-E813 PolarHBondContact O-N 3.02Å
814	L	83.7	Confident	88.7	Confident	18 Å²	18	65.3 Å²	65.3	9%	0.094	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-105	59	177	-60.8	-171.1	0	0	0	110.9	E808 S811 M812 A819 W820 Y823	E808-L814 VanDerWaalsContact O-CD1 3.31Å; E808-L814 WeakPolarHBondContact O-CD1 3.44Å; S811-L814 CarbonylContact O-C 3.6Å; S811-L814 PolarHBondContact O-N 3.3Å; S811-L814 PolarHBondContact OG-N 3.39Å; M812-L814 PolarHBondContact O-N 3.26Å; L814-A819 HydrophobicContact CD2-CB 4.04Å; L814-W820 VanDerWaalsContact O-CZ2 3.31Å; L814-W820 WeakPolarHBondContact O-CZ2 3.48Å; L814-W820 PolarHBondContact O-NE1 3.46Å; L814-Y823 HydrophobicContact CD1-CD1 3.88Å; L814-Y823 HydrophobicContact CD1-CD2 3.82Å; L814-Y823 HydrophobicContact CD1-CE1 4.34Å; L814-Y823 HydrophobicContact CD1-CE2 4.27Å; L814-Y823 HydrophobicContact CD1-CG 3.61Å; L814-Y823 HydrophobicContact CD2-CD2 4.47Å; L814-Y823 HydrophobicContact CD2-CG 4.18Å
815	S	82.8	Confident	88.6	Confident	83 Å²	83	71.4 Å²	71.4	58%	0.58	35%	0.347	S	S	*	.			trans	-99.5	-8.9	-179.1	45.6	0	0	0	0	114.4	M812	M812-S815 WeakPolarHBondContact O-CB 3.25Å; M812-S815 PolarHBondContact O-OG 3.23Å
816	T	87.4	Confident	88.5	Confident	67 Å²	67	77.9 Å²	77.9	41%	0.411	37%	0.374	S	S	.	.	S	Bend	trans	-123.8	151.6	-177.9	67.1	0	0	0	0	112.4	H818 A819 W820	T816-H818 PolarHBondContact O-N 3.06Å; T816-A819 WeakPolarHBondContact O-CB 3.23Å; T816-A819 PolarHBondContact O-N 3.19Å; T816-A819 WeakPolarHBondContact OG1-CB 3.49Å; T816-A819 PolarHBondContact OG1-N 3.09Å; T816-W820 PolarHBondContact O-N 2.94Å
817	P	87.1	Confident	88.5	Confident	66 Å²	66	79 Å²	79	43%	0.429	38%	0.378	S	S	.	.	H	α-helix	trans	-55.1	-34.9	174.4	-27.3	35.2	0	0	0	114.1	M693 W820 K821	M693-P817 HydrophobicContact SD-CB 4.13Å; P817-W820 HydrophobicContact CG-CE3 4.5Å; P817-W820 HydrophobicContact CG-CZ3 4.31Å; P817-K821 WeakPolarHBondContact O-CB 3.47Å; P817-K821 VanDerWaalsContact O-CG 3.25Å; P817-K821 WeakPolarHBondContact O-CG 3.42Å; P817-K821 PolarHBondContact O-N 3.45Å
818	H	88.8	Confident	88.4	Confident	156 Å²	156	76.6 Å²	76.6	72%	0.722	37%	0.368	S	S	*	.	H	α-helix	trans	-68.1	-40.7	175.9	-73.8	-70.7	0	0	0	112.2	T816 K821 R822	T816-H818 PolarHBondContact O-N 3.06Å; H818-K821 PolarHBondContact O-N 3.3Å; H818-R822 WeakPolarHBondContact O-CB 3.35Å; H818-R822 PolarHBondContact O-N 2.9Å
819	A	89.4	Confident	88.1	Confident	8 Å²	8	75.8 Å²	75.8	7%	0.066	37%	0.365	C	S	.	.	H	α-helix	trans	-64.1	-46	176.3	0	0	0	0	0	111.5	L814 T816 K821 R822 Y823	L814-A819 HydrophobicContact CD2-CB 4.04Å; T816-A819 WeakPolarHBondContact O-CB 3.23Å; T816-A819 PolarHBondContact O-N 3.19Å; T816-A819 WeakPolarHBondContact OG1-CB 3.49Å; T816-A819 PolarHBondContact OG1-N 3.09Å; A819-K821 PolarHBondContact O-N 2.98Å; A819-R822 PolarHBondContact O-N 3Å; A819-Y823 WeakPolarHBondContact O-CB 3.46Å; A819-Y823 PolarHBondContact O-N 3.48Å
820	W	90.5	Very high	87.2	Confident	38 Å²	38	80.3 Å²	80.3	14%	0.144	41%	0.412	C	S	.	.	H	α-helix	trans	-57.7	-48.2	174.6	-72.9	-43.2	0	0	0	112.2	M693 W809 L814 T816 P817 R822 Y823 L824	M693-W820 HydrophobicContact CG-CB 3.97Å; M693-W820 HydrophobicContact CG-CE3 4.3Å; M693-W820 HydrophobicContact SD-CB 4.23Å; M693-W820 HydrophobicContact SD-CE3 4.11Å; W809-W820 AromaticContact CE2-CD1 3.87Å; W809-W820 AromaticContact CE2-NE1 3.89Å; W809-W820 AromaticContact CE3-CD1 3.95Å; W809-W820 HydrophobicContact CH2-CB 3.76Å; W809-W820 AromaticContact CH2-CD1 3.6Å; W809-W820 HydrophobicContact CH2-CD2 4.49Å; W809-W820 AromaticContact CH2-CG 3.7Å; W809-W820 HydrophobicContact CH2-CG 3.7Å; W809-W820 HydrophobicContact CZ2-CB 4.36Å; W809-W820 AromaticContact CZ2-CD1 3.67Å; W809-W820 HydrophobicContact CZ2-CD2 4.21Å; W809-W820 AromaticContact CZ2-CG 3.85Å; W809-W820 HydrophobicContact CZ2-CG 3.85Å; W809-W820 HydrophobicContact CZ3-CB 4.22Å; W809-W820 AromaticContact CZ3-CD1 3.73Å; W809-W820 HydrophobicContact CZ3-CG 4.19Å; W809-W820 PolarHBondContact O-NE1 3.18Å; L814-W820 VanDerWaalsContact O-CZ2 3.31Å; L814-W820 WeakPolarHBondContact O-CZ2 3.48Å; L814-W820 PolarHBondContact O-NE1 3.46Å; T816-W820 PolarHBondContact O-N 2.94Å; P817-W820 HydrophobicContact CG-CE3 4.5Å; P817-W820 HydrophobicContact CG-CZ3 4.31Å; W820-R822 VanDerWaalsContact C-N 3.33Å; W820-R822 PolarHBondContact O-N 3.26Å; W820-Y823 PolarHBondContact O-N 3.04Å; W820-L824 WeakPolarHBondContact O-CG 3.44Å; W820-L824 PolarHBondContact O-N 3.26Å
821	K	90.6	Very high	87.2	Confident	66 Å²	66	79.3 Å²	79.3	29%	0.287	41%	0.406	S	S	.	.	H	α-helix	trans	-61.6	-41.2	178.4	-72.4	178.2	-176.7	-177.1	0	112.1	M693 V697 P817 H818 A819 R825	M693-K821 HydrophobicContact SD-CG 4.02Å; V697-K821 HydrophobicContact CG2-CB 3.75Å; V697-K821 HydrophobicContact CG2-CG 3.9Å; V697-K821 WeakPolarHBondContact CG2-O 3.37Å; P817-K821 WeakPolarHBondContact O-CB 3.47Å; P817-K821 VanDerWaalsContact O-CG 3.25Å; P817-K821 WeakPolarHBondContact O-CG 3.42Å; P817-K821 PolarHBondContact O-N 3.45Å; H818-K821 PolarHBondContact O-N 3.3Å; A819-K821 PolarHBondContact O-N 2.98Å; K821-R825 VanDerWaalsContact O-CB 3.22Å; K821-R825 WeakPolarHBondContact O-CB 3.35Å; K821-R825 PolarHBondContact O-N 2.99Å
822	R	91.4	Very high	87.1	Confident	180 Å²	180	81.7 Å²	81.7	68%	0.679	41%	0.414	S	S	*	.	H	α-helix	trans	-64.1	-43.8	176.7	-176.5	175.1	63.4	179	0.2	111.5	H818 A819 W820 R825 K826	H818-R822 WeakPolarHBondContact O-CB 3.35Å; H818-R822 PolarHBondContact O-N 2.9Å; A819-R822 PolarHBondContact O-N 3Å; W820-R822 VanDerWaalsContact C-N 3.33Å; W820-R822 PolarHBondContact O-N 3.26Å; R822-R825 PolarHBondContact O-N 3.27Å; R822-K826 WeakPolarHBondContact O-CB 3.31Å; R822-K826 PolarHBondContact O-N 2.82Å
823	Y	92.8	Very high	87.6	Confident	32 Å²	32	76.4 Å²	76.4	13%	0.125	39%	0.389	C	S	.	.	H	α-helix	trans	-61.1	-50.2	176.8	169.1	-94.1	0	0	0	112.1	I804 E808 W809 L814 A819 W820 R825 K826 K827	I804-Y823 HydrophobicContact CG2-CE1 4.11Å; E808-Y823 HydrophobicContact CB-CE2 4.44Å; E808-Y823 WeakPolarHBondContact OE2-CE2 3.37Å; E808-Y823 PolarHBondContact OE2-OH 2.87Å; W809-Y823 HydrophobicContact CE3-CD1 4.15Å; W809-Y823 HydrophobicContact CE3-CE1 4.11Å; W809-Y823 HydrophobicContact CZ3-CD1 4.08Å; W809-Y823 HydrophobicContact CZ3-CE1 4.37Å; L814-Y823 HydrophobicContact CD1-CD1 3.88Å; L814-Y823 HydrophobicContact CD1-CD2 3.82Å; L814-Y823 HydrophobicContact CD1-CE1 4.34Å; L814-Y823 HydrophobicContact CD1-CE2 4.27Å; L814-Y823 HydrophobicContact CD1-CG 3.61Å; L814-Y823 HydrophobicContact CD2-CD2 4.47Å; L814-Y823 HydrophobicContact CD2-CG 4.18Å; A819-Y823 WeakPolarHBondContact O-CB 3.46Å; A819-Y823 PolarHBondContact O-N 3.48Å; W820-Y823 PolarHBondContact O-N 3.04Å; Y823-R825 PolarHBondContact O-N 3.36Å; Y823-K826 PolarHBondContact O-N 3.47Å; Y823-K827 HydrophobicContact CE1-CG 4.2Å; Y823-K827 HydrophobicContact CE2-CD 4.42Å; Y823-K827 VanDerWaalsContact CE2-CE 3.47Å; Y823-K827 HydrophobicContact CE2-CG 4.08Å; Y823-K827 WeakPolarHBondContact O-CG 3.46Å; Y823-K827 PolarHBondContact O-N 3.06Å; Y823-K827 VanDerWaalsContact OH-CE 3.24Å; Y823-K827 WeakPolarHBondContact OH-CE 3.48Å; Y823-K827 PolarHBondContact OH-NZ 2.83Å
824	L	92.2	Very high	88.1	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-62.2	-42.5	177.2	-70.4	176.7	0	0	0	111.8	M693 L694 V697 I804 W809 W820 K826 K827 I828	M693-L824 HydrophobicContact CB-CD1 3.63Å; L694-L824 HydrophobicContact CD2-CD1 3.95Å; L694-L824 HydrophobicContact CD2-CD2 4.33Å; L694-L824 HydrophobicContact CG-CD1 4.14Å; V697-L824 HydrophobicContact CG2-CB 4.08Å; I804-L824 HydrophobicContact CD1-CD2 3.5Å; I804-L824 VanDerWaalsContact CD1-CD2 3.5Å; I804-L824 HydrophobicContact CG1-CD2 4.29Å; W809-L824 HydrophobicContact CH2-CD1 3.9Å; W809-L824 HydrophobicContact CH2-CD2 4.44Å; W809-L824 HydrophobicContact CH2-CG 4.21Å; W809-L824 HydrophobicContact CZ3-CD1 4.03Å; W809-L824 HydrophobicContact CZ3-CD2 3.8Å; W809-L824 HydrophobicContact CZ3-CG 3.81Å; W820-L824 WeakPolarHBondContact O-CG 3.44Å; W820-L824 PolarHBondContact O-N 3.26Å; L824-K826 VanDerWaalsContact C-N 3.34Å; L824-K826 PolarHBondContact O-N 3.09Å; L824-K827 PolarHBondContact O-N 3.12Å; L824-I828 HydrophobicContact CB-CD1 4.3Å; L824-I828 WeakPolarHBondContact O-CB 3.25Å; L824-I828 WeakPolarHBondContact O-CD1 3.46Å; L824-I828 VanDerWaalsContact O-CG1 3.23Å; L824-I828 WeakPolarHBondContact O-CG1 3.41Å; L824-I828 PolarHBondContact O-N 3.35Å
825	R	91.3	Very high	88.3	Confident	128 Å²	128	74.2 Å²	74.2	48%	0.483	38%	0.382	S	S	.	.	H	α-helix	trans	-58.4	-46.4	176.7	-174	175.1	-71	149.5	-2	111.4	V697 K821 R822 Y823 I828 L829	V697-R825 HydrophobicContact CG1-CB 3.92Å; V697-R825 HydrophobicContact CG1-CG 4.42Å; K821-R825 VanDerWaalsContact O-CB 3.22Å; K821-R825 WeakPolarHBondContact O-CB 3.35Å; K821-R825 PolarHBondContact O-N 2.99Å; R822-R825 PolarHBondContact O-N 3.27Å; Y823-R825 PolarHBondContact O-N 3.36Å; R825-I828 PolarHBondContact O-N 2.9Å; R825-L829 HydrophobicContact CG-CD1 4.05Å; R825-L829 WeakPolarHBondContact O-CA 3.4Å; R825-L829 WeakPolarHBondContact O-CB 3.43Å; R825-L829 PolarHBondContact O-N 3.14Å
826	K	91.5	Very high	88.7	Confident	149 Å²	149	73.6 Å²	73.6	65%	0.648	37%	0.369	S	S	*	.	H	α-helix	trans	-60.8	-48.4	176.3	-173.3	-177	178.6	-178	0	111.6	R822 Y823 L824 I828 G830	R822-K826 WeakPolarHBondContact O-CB 3.31Å; R822-K826 PolarHBondContact O-N 2.82Å; Y823-K826 PolarHBondContact O-N 3.47Å; L824-K826 VanDerWaalsContact C-N 3.34Å; L824-K826 PolarHBondContact O-N 3.09Å; K826-I828 PolarHBondContact O-N 3.46Å; K826-G830 WeakPolarHBondContact CA-OXT 3.36Å; K826-G830 WeakPolarHBondContact CG-OXT 3.44Å; K826-G830 CarbonylContact O-C 3.45Å; K826-G830 WeakPolarHBondContact O-CA 3.33Å; K826-G830 PolarHBondContact O-N 3.14Å; K826-G830 VanDerWaalsContact O-OXT 3.08Å
827	K	91.1	Very high	88.8	Confident	73 Å²	73	74.1 Å²	74.1	32%	0.317	37%	0.366	S	S	.	.	H	α-helix	trans	-64.7	-37.8	-179.2	-71.6	-87.2	-177.6	153.4	0	112.8	V802 E808 Y823 L824	V802-K827 HydrophobicContact CG1-CB 3.86Å; E808-K827 IonicContact OE1-NZ 3.58Å; E808-K827 IonicContact OE2-NZ 2.75Å; E808-K827 PolarHBondContact OE2-NZ 3.42Å; Y823-K827 HydrophobicContact CE1-CG 4.2Å; Y823-K827 HydrophobicContact CE2-CD 4.42Å; Y823-K827 VanDerWaalsContact CE2-CE 3.47Å; Y823-K827 HydrophobicContact CE2-CG 4.08Å; Y823-K827 WeakPolarHBondContact O-CG 3.46Å; Y823-K827 PolarHBondContact O-N 3.06Å; Y823-K827 VanDerWaalsContact OH-CE 3.24Å; Y823-K827 WeakPolarHBondContact OH-CE 3.48Å; Y823-K827 PolarHBondContact OH-NZ 2.83Å; L824-K827 PolarHBondContact O-N 3.12Å
828	I	88.9	Confident	88.9	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-88.3	-44.5	-173.9	-61	165.2	0	0	0	111.9	L694 L698 L722 I768 R800 V802 L824 R825 K826	L694-I828 HydrophobicContact CD2-CD1 3.4Å; L694-I828 VanDerWaalsContact CD2-CD1 3.4Å; L698-I828 HydrophobicContact CD2-CG2 4.48Å; L722-I828 HydrophobicContact CD1-CG2 4.24Å; I768-I828 HydrophobicContact CD1-CD1 3.69Å; I768-I828 HydrophobicContact CD1-CG1 4.21Å; R800-I828 PolarHBondContact NH1-O 2.84Å; V802-I828 HydrophobicContact CG1-CG1 4.34Å; L824-I828 HydrophobicContact CB-CD1 4.3Å; L824-I828 WeakPolarHBondContact O-CB 3.25Å; L824-I828 WeakPolarHBondContact O-CD1 3.46Å; L824-I828 VanDerWaalsContact O-CG1 3.23Å; L824-I828 WeakPolarHBondContact O-CG1 3.41Å; L824-I828 PolarHBondContact O-N 3.35Å; R825-I828 PolarHBondContact O-N 2.9Å; K826-I828 PolarHBondContact O-N 3.46Å
829	L	85.7	Confident	88.9	Confident	46 Å²	46	67.9 Å²	67.9	24%	0.241	33%	0.331	C	S	.	.	H	α-helix	trans	-103.9	-10.2	-171.6	-54.7	-178	0	0	0	114.2	L722 L726 R825	L722-L829 HydrophobicContact CD1-CD2 3.96Å; L722-L829 HydrophobicContact CD2-CD2 4.08Å; L726-L829 HydrophobicContact CB-CD2 4.34Å; L726-L829 WeakPolarHBondContact CD1-O 3.48Å; L726-L829 WeakPolarHBondContact O-CD2 3.48Å; R825-L829 HydrophobicContact CG-CD1 4.05Å; R825-L829 WeakPolarHBondContact O-CA 3.4Å; R825-L829 WeakPolarHBondContact O-CB 3.43Å; R825-L829 PolarHBondContact O-N 3.14Å
830	G	71.8	Confident	88.9	Confident	95 Å²	95	73.4 Å²	73.4	98%	0.979	36%	0.355	S	S	*	.			trans	95.3	0	-173.9	0	0	0	0	0	111.8	K826	K826-G830 WeakPolarHBondContact CA-OXT 3.36Å; K826-G830 WeakPolarHBondContact CG-OXT 3.44Å; K826-G830 CarbonylContact O-C 3.45Å; K826-G830 WeakPolarHBondContact O-CA 3.33Å; K826-G830 PolarHBondContact O-N 3.14Å; K826-G830 VanDerWaalsContact O-OXT 3.08Å

Retrieved 830 of 830 residues in 768.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).