A0A077ZFH1_TRITR Loading...

Putative phospholipid binding protein

AlphaFold DB , UniProt , Accession A0A077ZFH1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 579 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	46.7	Very low	227 Å²	227	122.9 Å²	122.9	100%	1.118	69%	0.689	S	S	*	*				0	75.9	0	-70.8	-65.4	174.2	0	0	109.3	L3	M1-L3 PolarHBondContact O-N 3.25Å; M1-L3 VanDerWaalsContact O-N 3.12Å
2	P	37.5	Very low	47.7	Very low	122 Å²	122	119.9 Å²	119.9	79%	0.792	67%	0.67	S	S	*	*			trans	-79.2	101.1	172.8	26.5	-16.2	0	0	0	106.9	F4	P2-F4 PolarHBondContact O-N 2.88Å
3	L	35.7	Very low	48.5	Very low	171 Å²	171	118.5 Å²	118.5	90%	0.895	66%	0.661	S	S	*	*			trans	-39	116.7	159.1	-85.1	140.2	0	0	0	107.3	M1 A5	M1-L3 PolarHBondContact O-N 3.25Å; M1-L3 VanDerWaalsContact O-N 3.12Å; L3-A5 VanDerWaalsContact C-N 3.31Å; L3-A5 PolarHBondContact O-N 2.88Å
4	F	41.1	Very low	48.6	Very low	212 Å²	212	114.4 Å²	114.4	93%	0.93	65%	0.649	S	S	*	*			trans	-46.5	96.5	-178.8	-83.3	-95.2	0	0	0	109.4	P2 A6	P2-F4 PolarHBondContact O-N 2.88Å; F4-A6 PolarHBondContact O-N 3.21Å
5	A	40.2	Very low	48.9	Very low	84 Å²	84	115.6 Å²	115.6	69%	0.694	65%	0.647	S	S	*	*			trans	-67.8	95.6	168.1	0	0	0	0	0	104.1	L3 S7	L3-A5 VanDerWaalsContact C-N 3.31Å; L3-A5 PolarHBondContact O-N 2.88Å; A5-S7 PolarHBondContact O-N 3.42Å
6	A	49.5	Very low	49.5	Very low	48 Å²	48	116 Å²	116	40%	0.397	64%	0.64	S	S	.	*			trans	-48.3	122.9	172.9	0	0	0	0	0	107	F4 A8 A10	F4-A6 PolarHBondContact O-N 3.21Å; A6-A8 PolarHBondContact O-N 3.17Å; A6-A10 HydrophobicContact CB-CB 4.21Å
7	S	58.3	Low	50.3	Low	60 Å²	60	116.5 Å²	116.5	42%	0.42	64%	0.637	S	S	.	*			trans	-42.6	142.6	176.4	162.1	0	0	0	0	108.7	A5 E9 A10 R11	A5-S7 PolarHBondContact O-N 3.42Å; S7-E9 PolarHBondContact O-N 2.78Å; S7-E9 WeakPolarHBondContact OG-CB 3.24Å; S7-E9 PolarHBondContact OG-N 2.99Å; S7-E9 VanDerWaalsContact OG-N 3.15Å; S7-E9 PolarHBondContact OG-OE2 2.82Å; S7-E9 VanDerWaalsContact OG-OE2 3.12Å; S7-A10 WeakPolarHBondContact O-CA 3.35Å; S7-A10 WeakPolarHBondContact O-CB 3.37Å; S7-A10 PolarHBondContact O-N 3.05Å; S7-R11 PolarHBondContact O-N 3.35Å
8	A	58	Low	50.5	Low	80 Å²	80	115.8 Å²	115.8	66%	0.661	63%	0.632	S	S	*	*	H	α-helix	trans	-49.2	-32.2	174.4	0	0	0	0	0	111.5	A6 R11 N12	A6-A8 PolarHBondContact O-N 3.17Å; A8-R11 PolarHBondContact O-N 3.31Å; A8-N12 WeakPolarHBondContact O-CB 3.33Å; A8-N12 PolarHBondContact O-N 3.21Å
9	E	56.9	Low	50.7	Low	147 Å²	147	119.1 Å²	119.1	69%	0.687	64%	0.635	S	S	*	*	H	α-helix	trans	-66.5	-39.1	174.9	-68.6	157.1	147.2	0	0	113.1	S7 N12 N13	S7-E9 PolarHBondContact O-N 2.78Å; S7-E9 WeakPolarHBondContact OG-CB 3.24Å; S7-E9 PolarHBondContact OG-N 2.99Å; S7-E9 VanDerWaalsContact OG-N 3.15Å; S7-E9 PolarHBondContact OG-OE2 2.82Å; S7-E9 VanDerWaalsContact OG-OE2 3.12Å; E9-N12 PolarHBondContact O-N 2.88Å; E9-N13 WeakPolarHBondContact O-CB 3.46Å; E9-N13 PolarHBondContact O-N 3.16Å
10	A	51.5	Low	50.9	Low	50 Å²	50	118.3 Å²	118.3	41%	0.413	63%	0.63	S	S	.	*	H	α-helix	trans	-66.6	-39.6	177.9	0	0	0	0	0	111.6	A6 S7 A14	A6-A10 HydrophobicContact CB-CB 4.21Å; S7-A10 WeakPolarHBondContact O-CA 3.35Å; S7-A10 WeakPolarHBondContact O-CB 3.37Å; S7-A10 PolarHBondContact O-N 3.05Å; A10-A14 WeakPolarHBondContact O-CB 3.22Å; A10-A14 PolarHBondContact O-N 3.25Å
11	R	50.7	Low	51.1	Low	151 Å²	151	117 Å²	117	57%	0.57	62%	0.623	S	S	*	*	H	α-helix	trans	-64.5	-46.2	173	-74.1	-176.4	-134.9	171.8	3.4	111.6	S7 A8 N13 A14 E15	S7-R11 PolarHBondContact O-N 3.35Å; A8-R11 PolarHBondContact O-N 3.31Å; R11-N13 VanDerWaalsContact C-N 3.3Å; R11-N13 PolarHBondContact O-N 3.39Å; R11-A14 PolarHBondContact O-N 3.19Å; R11-A14 VanDerWaalsContact O-N 3.14Å; R11-E15 PolarHBondContact O-N 3.31Å
12	N	59.1	Low	52	Low	87 Å²	87	110.1 Å²	110.1	47%	0.465	59%	0.591	S	S	.	*	H	α-helix	trans	-64.3	-36.8	-179	-152.2	-23.8	0	0	0	111.4	A8 E9 K16	A8-N12 WeakPolarHBondContact O-CB 3.33Å; A8-N12 PolarHBondContact O-N 3.21Å; E9-N12 PolarHBondContact O-N 2.88Å; N12-K16 WeakPolarHBondContact O-CG 3.49Å; N12-K16 PolarHBondContact O-N 3.3Å
13	N	57.4	Low	52.7	Low	102 Å²	102	106.5 Å²	106.5	55%	0.545	57%	0.571	S	S	.	*	H	α-helix	trans	-66.6	-42.6	171.8	-100	-6.5	0	0	0	112.6	E9 R11 E15 K16 Q17	E9-N13 WeakPolarHBondContact O-CB 3.46Å; E9-N13 PolarHBondContact O-N 3.16Å; R11-N13 VanDerWaalsContact C-N 3.3Å; R11-N13 PolarHBondContact O-N 3.39Å; N13-E15 PolarHBondContact O-N 3.4Å; N13-K16 PolarHBondContact O-N 3.04Å; N13-Q17 VanDerWaalsContact O-CG 3.27Å; N13-Q17 WeakPolarHBondContact O-CG 3.46Å; N13-Q17 PolarHBondContact O-N 3.34Å
14	A	49.5	Very low	53.8	Low	61 Å²	61	102.1 Å²	102.1	50%	0.504	55%	0.545	S	S	.	.	H	α-helix	trans	-62.8	-41.6	177.2	0	0	0	0	0	111.9	A10 R11 Q17 L18	A10-A14 WeakPolarHBondContact O-CB 3.22Å; A10-A14 PolarHBondContact O-N 3.25Å; R11-A14 PolarHBondContact O-N 3.19Å; R11-A14 VanDerWaalsContact O-N 3.14Å; A14-Q17 PolarHBondContact O-N 3.17Å; A14-L18 WeakPolarHBondContact O-CB 3.39Å; A14-L18 PolarHBondContact O-N 3.29Å
15	E	54.3	Low	54.4	Low	132 Å²	132	93.4 Å²	93.4	62%	0.617	51%	0.508	S	S	*	.	H	α-helix	trans	-64	-42.4	175.4	-76	179.5	170.8	0	0	112.1	R11 N13 Q17 L18 Y19	R11-E15 PolarHBondContact O-N 3.31Å; N13-E15 PolarHBondContact O-N 3.4Å; E15-Q17 PolarHBondContact O-N 3.23Å; E15-L18 PolarHBondContact O-N 2.95Å; E15-Y19 WeakPolarHBondContact O-CB 3.31Å; E15-Y19 PolarHBondContact O-N 2.97Å
16	K	58.8	Low	54.9	Low	122 Å²	122	94.8 Å²	94.8	53%	0.53	51%	0.508	S	S	.	.	H	α-helix	trans	-61.2	-43.3	173.4	-76.9	178.9	-177	178.2	0	112.1	N12 N13 L18 Y19 L20	N12-K16 WeakPolarHBondContact O-CG 3.49Å; N12-K16 PolarHBondContact O-N 3.3Å; N13-K16 PolarHBondContact O-N 3.04Å; K16-L18 VanDerWaalsContact C-N 3.35Å; K16-Y19 PolarHBondContact O-N 3.15Å; K16-L20 WeakPolarHBondContact O-CB 3.37Å; K16-L20 VanDerWaalsContact O-CG 3.29Å; K16-L20 WeakPolarHBondContact O-CG 3.28Å; K16-L20 PolarHBondContact O-N 3.22Å
17	Q	63	Low	54.7	Low	125 Å²	125	99.6 Å²	99.6	58%	0.584	52%	0.52	S	S	*	.	H	α-helix	trans	-64.1	-40.7	176.5	-70.1	-64.8	-36	0	0	111.4	N13 A14 E15 L20 L21	N13-Q17 VanDerWaalsContact O-CG 3.27Å; N13-Q17 WeakPolarHBondContact O-CG 3.46Å; N13-Q17 PolarHBondContact O-N 3.34Å; A14-Q17 PolarHBondContact O-N 3.17Å; E15-Q17 PolarHBondContact O-N 3.23Å; Q17-L20 PolarHBondContact O-N 3.27Å; Q17-L21 VanDerWaalsContact O-CB 3.29Å; Q17-L21 WeakPolarHBondContact O-CB 3.34Å; Q17-L21 PolarHBondContact O-N 3.16Å
18	L	52.5	Low	54.3	Low	104 Å²	104	102 Å²	102	55%	0.545	52%	0.52	S	S	.	.	H	α-helix	trans	-65.8	-39.8	176.4	-163.5	77.5	0	0	0	111.7	A14 E15 K16 L21 N22	A14-L18 WeakPolarHBondContact O-CB 3.39Å; A14-L18 PolarHBondContact O-N 3.29Å; E15-L18 PolarHBondContact O-N 2.95Å; K16-L18 VanDerWaalsContact C-N 3.35Å; L18-L21 PolarHBondContact O-N 3.16Å; L18-N22 WeakPolarHBondContact O-CB 3.4Å; L18-N22 PolarHBondContact O-N 3.13Å
19	Y	54.4	Low	53.7	Low	178 Å²	178	100.7 Å²	100.7	70%	0.698	51%	0.505	S	S	*	.	H	α-helix	trans	-65.3	-44.9	175.6	-170.8	-91.9	0	0	0	111.5	E15 K16 L21 N22 A23	E15-Y19 WeakPolarHBondContact O-CB 3.31Å; E15-Y19 PolarHBondContact O-N 2.97Å; K16-Y19 PolarHBondContact O-N 3.15Å; Y19-L21 VanDerWaalsContact C-N 3.34Å; Y19-N22 PolarHBondContact O-N 3.5Å; Y19-A23 VanDerWaalsContact O-CB 3.27Å; Y19-A23 WeakPolarHBondContact O-CB 3.14Å; Y19-A23 PolarHBondContact O-N 2.92Å
20	L	55	Low	53.2	Low	102 Å²	102	98.5 Å²	98.5	53%	0.534	50%	0.496	S	S	.	.	H	α-helix	trans	-63.8	-40.3	175.6	-72.5	172.5	0	0	0	111.8	K16 Q17 A23 F24	K16-L20 WeakPolarHBondContact O-CB 3.37Å; K16-L20 VanDerWaalsContact O-CG 3.29Å; K16-L20 WeakPolarHBondContact O-CG 3.28Å; K16-L20 PolarHBondContact O-N 3.22Å; Q17-L20 PolarHBondContact O-N 3.27Å; L20-A23 PolarHBondContact O-N 3.13Å; L20-F24 VanDerWaalsContact O-CB 3.29Å; L20-F24 WeakPolarHBondContact O-CB 3.24Å; L20-F24 PolarHBondContact O-N 3.02Å
21	L	56.4	Low	53.5	Low	91 Å²	91	98 Å²	98	48%	0.476	49%	0.492	S	S	.	.	H	α-helix	trans	-64.1	-49.1	175.1	-174.9	65.4	0	0	0	110.3	Q17 L18 Y19 A23 F24 L25	Q17-L21 VanDerWaalsContact O-CB 3.29Å; Q17-L21 WeakPolarHBondContact O-CB 3.34Å; Q17-L21 PolarHBondContact O-N 3.16Å; L18-L21 PolarHBondContact O-N 3.16Å; Y19-L21 VanDerWaalsContact C-N 3.34Å; L21-A23 VanDerWaalsContact C-N 3.34Å; L21-A23 PolarHBondContact O-N 3.33Å; L21-F24 CarbonylContact O-C 3.56Å; L21-F24 WeakPolarHBondContact O-CB 3.4Å; L21-F24 PolarHBondContact O-N 3.37Å; L21-F24 VanDerWaalsContact O-N 3.13Å; L21-L25 HydrophobicContact CD1-CG 4.38Å; L21-L25 HydrophobicContact CG-CD1 4.13Å; L21-L25 HydrophobicContact CG-CG 4.27Å; L21-L25 WeakPolarHBondContact O-CB 3.43Å; L21-L25 WeakPolarHBondContact O-CG 3.42Å; L21-L25 PolarHBondContact O-N 3.03Å
22	N	52.1	Low	53.6	Low	83 Å²	83	91.1 Å²	91.1	44%	0.444	47%	0.467	S	S	.	.	H	α-helix	trans	-60.5	-42.5	176.5	-82.5	-24.4	0	0	0	112	L18 Y19 F24 L25 V26	L18-N22 WeakPolarHBondContact O-CB 3.4Å; L18-N22 PolarHBondContact O-N 3.13Å; Y19-N22 PolarHBondContact O-N 3.5Å; N22-F24 VanDerWaalsContact C-N 3.32Å; N22-F24 PolarHBondContact O-N 3.26Å; N22-L25 PolarHBondContact O-N 3.23Å; N22-V26 WeakPolarHBondContact O-CB 3.45Å; N22-V26 WeakPolarHBondContact O-CG2 2.74Å; N22-V26 PolarHBondContact O-N 2.96Å
23	A	53.3	Low	53	Low	46 Å²	46	90.7 Å²	90.7	38%	0.38	46%	0.462	S	S	.	.	H	α-helix	trans	-61.5	-41	174.5	0	0	0	0	0	111.7	Y19 L20 L21 K27	Y19-A23 VanDerWaalsContact O-CB 3.27Å; Y19-A23 WeakPolarHBondContact O-CB 3.14Å; Y19-A23 PolarHBondContact O-N 2.92Å; L20-A23 PolarHBondContact O-N 3.13Å; L21-A23 VanDerWaalsContact C-N 3.34Å; L21-A23 PolarHBondContact O-N 3.33Å; A23-K27 WeakPolarHBondContact O-CB 3.22Å; A23-K27 PolarHBondContact O-N 3.15Å
24	F	58.9	Low	52.6	Low	80 Å²	80	95 Å²	95	35%	0.351	47%	0.471	S	S	.	.	H	α-helix	trans	-66.7	-42.2	174.9	-175.8	-91.9	0	0	0	112.1	L20 L21 N22 V26 K27 Y28 A31	L20-F24 VanDerWaalsContact O-CB 3.29Å; L20-F24 WeakPolarHBondContact O-CB 3.24Å; L20-F24 PolarHBondContact O-N 3.02Å; L21-F24 CarbonylContact O-C 3.56Å; L21-F24 WeakPolarHBondContact O-CB 3.4Å; L21-F24 PolarHBondContact O-N 3.37Å; L21-F24 VanDerWaalsContact O-N 3.13Å; N22-F24 VanDerWaalsContact C-N 3.32Å; N22-F24 PolarHBondContact O-N 3.26Å; F24-V26 VanDerWaalsContact C-N 3.35Å; F24-K27 PolarHBondContact O-N 3.1Å; F24-Y28 AromaticContact CD2-CD2 3.46Å; F24-Y28 HydrophobicContact CD2-CD2 3.46Å; F24-Y28 VanDerWaalsContact CD2-CD2 3.46Å; F24-Y28 AromaticContact CD2-CE2 4Å; F24-Y28 HydrophobicContact CD2-CE2 4Å; F24-Y28 HydrophobicContact CD2-CG 4.4Å; F24-Y28 AromaticContact CE2-CD2 3.55Å; F24-Y28 HydrophobicContact CE2-CD2 3.55Å; F24-Y28 HydrophobicContact CE2-CE2 4.14Å; F24-Y28 HydrophobicContact CE2-CG 4.14Å; F24-Y28 HydrophobicContact CG-CD2 4.08Å; F24-Y28 HydrophobicContact CZ-CD2 4.24Å; F24-Y28 HydrophobicContact CZ-CG 4.45Å; F24-Y28 WeakPolarHBondContact O-CA 3.38Å; F24-Y28 WeakPolarHBondContact O-CB 3.42Å; F24-Y28 PolarHBondContact O-N 2.97Å; F24-A31 HydrophobicContact CE1-CB 4.26Å; F24-A31 HydrophobicContact CZ-CB 4.04Å
25	L	53.3	Low	52.8	Low	28 Å²	28	97.7 Å²	97.7	15%	0.147	47%	0.473	C	S	.	.	H	α-helix	trans	-65.6	-37.3	177.5	-68.3	179.9	0	0	0	111.8	L21 N22 P29 A32	L21-L25 HydrophobicContact CD1-CG 4.38Å; L21-L25 HydrophobicContact CG-CD1 4.13Å; L21-L25 HydrophobicContact CG-CG 4.27Å; L21-L25 WeakPolarHBondContact O-CB 3.43Å; L21-L25 WeakPolarHBondContact O-CG 3.42Å; L21-L25 PolarHBondContact O-N 3.03Å; N22-L25 PolarHBondContact O-N 3.23Å; L25-P29 WeakPolarHBondContact O-CA 3.49Å; L25-P29 WeakPolarHBondContact O-CB 3.31Å; L25-P29 WeakPolarHBondContact O-CD 3.47Å; L25-A32 HydrophobicContact CD2-CB 3.17Å
26	V	49.3	Very low	52.5	Low	114 Å²	114	93.4 Å²	93.4	69%	0.691	45%	0.454	S	S	*	.	H	α-helix	trans	-72.4	-41.3	175.9	170.1	0	0	0	0	111.1	N22 F24	N22-V26 WeakPolarHBondContact O-CB 3.45Å; N22-V26 WeakPolarHBondContact O-CG2 2.74Å; N22-V26 PolarHBondContact O-N 2.96Å; F24-V26 VanDerWaalsContact C-N 3.35Å
27	K	46.9	Very low	51.9	Low	149 Å²	149	90.8 Å²	90.8	65%	0.648	45%	0.451	S	S	*	.	H	α-helix	trans	-80.2	-31	-176.7	-166.6	172.4	-178	-178.1	0	113.1	A23 F24 P29	A23-K27 WeakPolarHBondContact O-CB 3.22Å; A23-K27 PolarHBondContact O-N 3.15Å; F24-K27 PolarHBondContact O-N 3.1Å; K27-P29 VanDerWaalsContact C-CD 3.47Å
28	Y	49	Very low	51.1	Low	111 Å²	111	91 Å²	91	44%	0.435	45%	0.452	S	S	.	.			trans	-133.8	56.2	-176.6	-50.9	-78.2	0	0	0	112	F24 M30 A31 A32	F24-Y28 AromaticContact CD2-CD2 3.46Å; F24-Y28 HydrophobicContact CD2-CD2 3.46Å; F24-Y28 VanDerWaalsContact CD2-CD2 3.46Å; F24-Y28 AromaticContact CD2-CE2 4Å; F24-Y28 HydrophobicContact CD2-CE2 4Å; F24-Y28 HydrophobicContact CD2-CG 4.4Å; F24-Y28 AromaticContact CE2-CD2 3.55Å; F24-Y28 HydrophobicContact CE2-CD2 3.55Å; F24-Y28 HydrophobicContact CE2-CE2 4.14Å; F24-Y28 HydrophobicContact CE2-CG 4.14Å; F24-Y28 HydrophobicContact CG-CD2 4.08Å; F24-Y28 HydrophobicContact CZ-CD2 4.24Å; F24-Y28 HydrophobicContact CZ-CG 4.45Å; F24-Y28 WeakPolarHBondContact O-CA 3.38Å; F24-Y28 WeakPolarHBondContact O-CB 3.42Å; F24-Y28 PolarHBondContact O-N 2.97Å; Y28-M30 PolarHBondContact O-N 3.48Å; Y28-A31 PolarHBondContact O-N 3.47Å; Y28-A32 PolarHBondContact O-N 3.42Å; Y28-A32 VanDerWaalsContact O-N 3.09Å
29	P	45.1	Very low	50.7	Low	51 Å²	51	92.3 Å²	92.3	33%	0.331	46%	0.457	S	S	.	.	H	α-helix	trans	-57	-30	-176.9	22.8	-33.4	0	0	0	112.4	L25 K27 A32 Q33	L25-P29 WeakPolarHBondContact O-CA 3.49Å; L25-P29 WeakPolarHBondContact O-CB 3.31Å; L25-P29 WeakPolarHBondContact O-CD 3.47Å; K27-P29 VanDerWaalsContact C-CD 3.47Å; P29-A32 WeakPolarHBondContact O-CB 3.47Å; P29-Q33 WeakPolarHBondContact O-CB 3.37Å; P29-Q33 PolarHBondContact O-N 2.93Å
30	M	47.7	Very low	50	Low	101 Å²	101	87.2 Å²	87.2	50%	0.498	44%	0.441	S	S	.	.	H	α-helix	trans	-79.5	-33.9	179.5	-62.2	-60.7	175.6	0	0	113.9	Y28 A32 Q33 R34	Y28-M30 PolarHBondContact O-N 3.48Å; M30-A32 VanDerWaalsContact C-N 3.28Å; M30-Q33 PolarHBondContact O-N 3.44Å; M30-R34 WeakPolarHBondContact O-CB 3.16Å; M30-R34 PolarHBondContact O-N 3.32Å
31	A	56	Low	49.3	Very low	40 Å²	40	88.6 Å²	88.6	33%	0.331	44%	0.443	S	S	.	.	H	α-helix	trans	-65.6	-40.5	172.4	0	0	0	0	0	109.7	F24 Y28 R34 Q35	F24-A31 HydrophobicContact CE1-CB 4.26Å; F24-A31 HydrophobicContact CZ-CB 4.04Å; Y28-A31 PolarHBondContact O-N 3.47Å; A31-R34 PolarHBondContact O-N 3.01Å; A31-Q35 WeakPolarHBondContact O-CB 3.35Å; A31-Q35 PolarHBondContact O-N 3.02Å
32	A	53	Low	48.3	Very low	6 Å²	6	88 Å²	88	5%	0.05	45%	0.446	C	S	.	.	H	α-helix	trans	-61.6	-47.8	172	0	0	0	0	0	112.2	L25 Y28 P29 M30 R34 Q35 I36	L25-A32 HydrophobicContact CD2-CB 3.17Å; Y28-A32 PolarHBondContact O-N 3.42Å; Y28-A32 VanDerWaalsContact O-N 3.09Å; P29-A32 WeakPolarHBondContact O-CB 3.47Å; M30-A32 VanDerWaalsContact C-N 3.28Å; A32-R34 VanDerWaalsContact C-N 3.34Å; A32-R34 PolarHBondContact O-N 3.43Å; A32-Q35 PolarHBondContact O-N 3.13Å; A32-I36 WeakPolarHBondContact O-CB 3.46Å; A32-I36 WeakPolarHBondContact O-CD1 3.39Å; A32-I36 WeakPolarHBondContact O-CG1 3.38Å; A32-I36 PolarHBondContact O-N 3.1Å
33	Q	48	Very low	47.6	Very low	79 Å²	79	87.2 Å²	87.2	37%	0.369	45%	0.451	S	S	.	.	H	α-helix	trans	-62.7	-39.6	178.8	-166.4	132.1	-11.8	0	0	112.2	P29 M30 I36 S37	P29-Q33 WeakPolarHBondContact O-CB 3.37Å; P29-Q33 PolarHBondContact O-N 2.93Å; M30-Q33 PolarHBondContact O-N 3.44Å; Q33-I36 PolarHBondContact O-N 2.96Å; Q33-S37 PolarHBondContact O-N 3.44Å; Q33-S37 PolarHBondContact O-OG 3.13Å
34	R	49.3	Very low	47.1	Very low	193 Å²	193	88.5 Å²	88.5	73%	0.728	46%	0.457	S	S	*	.	H	α-helix	trans	-64.6	-45.5	173.3	-82.1	-174.9	177.8	175.2	1.4	112.3	M30 A31 A32 I36 S37 Q38	M30-R34 WeakPolarHBondContact O-CB 3.16Å; M30-R34 PolarHBondContact O-N 3.32Å; A31-R34 PolarHBondContact O-N 3.01Å; A32-R34 VanDerWaalsContact C-N 3.34Å; A32-R34 PolarHBondContact O-N 3.43Å; R34-I36 VanDerWaalsContact C-N 3.32Å; R34-I36 PolarHBondContact O-N 3.39Å; R34-S37 PolarHBondContact O-N 3.02Å; R34-Q38 WeakPolarHBondContact O-CG 3.36Å; R34-Q38 PolarHBondContact O-N 2.85Å
35	Q	52.9	Low	46	Very low	117 Å²	117	90.7 Å²	90.7	55%	0.547	47%	0.467	S	S	.	.	H	α-helix	trans	-62.5	-40.5	176.1	-83.7	-171.6	-28.9	0	0	111.5	A31 A32 Q38 M39	A31-Q35 WeakPolarHBondContact O-CB 3.35Å; A31-Q35 PolarHBondContact O-N 3.02Å; A32-Q35 PolarHBondContact O-N 3.13Å; Q35-Q38 PolarHBondContact O-N 3.29Å; Q35-M39 WeakPolarHBondContact O-CG 3.47Å; Q35-M39 PolarHBondContact O-N 2.96Å
36	I	47.8	Very low	45.4	Very low	42 Å²	42	94.7 Å²	94.7	22%	0.215	49%	0.492	C	S	.	.	H	α-helix	trans	-62.4	-48.1	175.5	-68.1	162.1	0	0	0	110.4	A32 Q33 R34 Q38 M39 D40	A32-I36 WeakPolarHBondContact O-CB 3.46Å; A32-I36 WeakPolarHBondContact O-CD1 3.39Å; A32-I36 WeakPolarHBondContact O-CG1 3.38Å; A32-I36 PolarHBondContact O-N 3.1Å; Q33-I36 PolarHBondContact O-N 2.96Å; R34-I36 VanDerWaalsContact C-N 3.32Å; R34-I36 PolarHBondContact O-N 3.39Å; I36-Q38 VanDerWaalsContact C-N 3.28Å; I36-Q38 PolarHBondContact O-N 3.45Å; I36-M39 PolarHBondContact O-N 2.86Å; I36-M39 VanDerWaalsContact O-N 3.12Å; I36-D40 PolarHBondContact O-N 3.4Å
37	S	45.6	Very low	45	Very low	66 Å²	66	91.2 Å²	91.2	46%	0.462	48%	0.479	S	S	.	.	H	α-helix	trans	-63.2	-31.4	175.5	-72.4	0	0	0	0	113.3	Q33 R34 F41	Q33-S37 PolarHBondContact O-N 3.44Å; Q33-S37 PolarHBondContact O-OG 3.13Å; R34-S37 PolarHBondContact O-N 3.02Å; S37-F41 WeakPolarHBondContact O-CB 3.47Å; S37-F41 PolarHBondContact O-N 3.38Å
38	Q	45.9	Very low	44.3	Very low	131 Å²	131	87.4 Å²	87.4	61%	0.612	47%	0.471	S	S	*	.	H	α-helix	trans	-72.3	-36.4	172.2	-78.1	-177.2	4.5	0	0	112.4	R34 Q35 I36 F41 C42	R34-Q38 WeakPolarHBondContact O-CG 3.36Å; R34-Q38 PolarHBondContact O-N 2.85Å; Q35-Q38 PolarHBondContact O-N 3.29Å; I36-Q38 VanDerWaalsContact C-N 3.28Å; I36-Q38 PolarHBondContact O-N 3.45Å; Q38-F41 WeakPolarHBondContact O-CB 3.46Å; Q38-F41 PolarHBondContact O-N 3.4Å; Q38-C42 PolarHBondContact O-N 2.84Å
39	M	44.9	Very low	43.7	Very low	130 Å²	130	89.6 Å²	89.6	64%	0.64	49%	0.485	S	S	*	.	H	α-helix	trans	-65.4	-41.4	173.9	-74.7	-179.2	64.9	0	0	111.2	Q35 I36 F41 C42 A43	Q35-M39 WeakPolarHBondContact O-CG 3.47Å; Q35-M39 PolarHBondContact O-N 2.96Å; I36-M39 PolarHBondContact O-N 2.86Å; I36-M39 VanDerWaalsContact O-N 3.12Å; M39-F41 VanDerWaalsContact C-N 3.3Å; M39-F41 PolarHBondContact O-N 3Å; M39-C42 PolarHBondContact O-N 3.28Å; M39-A43 WeakPolarHBondContact O-CB 3.47Å; M39-A43 PolarHBondContact O-N 3.2Å
40	D	39.1	Very low	43.1	Very low	71 Å²	71	98 Å²	98	38%	0.38	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-38.9	172	-73.1	-22.8	0	0	0	111.4	I36 A43 S44	I36-D40 PolarHBondContact O-N 3.4Å; D40-A43 PolarHBondContact O-N 2.97Å; D40-S44 WeakPolarHBondContact O-CB 3.44Å; D40-S44 PolarHBondContact O-N 3.29Å
41	F	40.1	Very low	42.2	Very low	132 Å²	132	100.2 Å²	100.2	58%	0.579	52%	0.523	S	S	*	.	H	α-helix	trans	-60.3	-46.1	173.2	179.5	-95.6	0	0	0	111.5	S37 Q38 M39 K45	S37-F41 WeakPolarHBondContact O-CB 3.47Å; S37-F41 PolarHBondContact O-N 3.38Å; Q38-F41 WeakPolarHBondContact O-CB 3.46Å; Q38-F41 PolarHBondContact O-N 3.4Å; M39-F41 VanDerWaalsContact C-N 3.3Å; M39-F41 PolarHBondContact O-N 3Å; F41-K45 HydrophobicContact CE1-CD 4.23Å; F41-K45 HydrophobicContact CZ-CD 4.4Å; F41-K45 WeakPolarHBondContact O-CB 3.29Å; F41-K45 PolarHBondContact O-N 3.12Å
42	C	37.2	Very low	41	Very low	77 Å²	77	106.8 Å²	106.8	52%	0.52	54%	0.544	S	S	.	.	H	α-helix	trans	-65.6	-45.2	177.2	-73.1	0	0	0	0	112.2	Q38 M39 K45 V46	Q38-C42 PolarHBondContact O-N 2.84Å; M39-C42 PolarHBondContact O-N 3.28Å; C42-K45 PolarHBondContact O-N 3.44Å; C42-V46 WeakPolarHBondContact O-CG2 3.34Å; C42-V46 PolarHBondContact O-N 2.84Å
43	A	37	Very low	39.9	Very low	68 Å²	68	115 Å²	115	56%	0.562	58%	0.581	S	S	*	*	H	α-helix	trans	-65.8	-40.6	178.7	0	0	0	0	0	112.1	M39 D40 V46 G47	M39-A43 WeakPolarHBondContact O-CB 3.47Å; M39-A43 PolarHBondContact O-N 3.2Å; D40-A43 PolarHBondContact O-N 2.97Å; A43-V46 PolarHBondContact O-N 2.76Å; A43-G47 PolarHBondContact O-N 2.96Å
44	S	41.5	Very low	39	Very low	73 Å²	73	120.2 Å²	120.2	51%	0.51	60%	0.603	S	S	.	*	H	α-helix	trans	-66	-37.6	174.8	175.9	0	0	0	0	111.8	D40 G47 C48	D40-S44 WeakPolarHBondContact O-CB 3.44Å; D40-S44 PolarHBondContact O-N 3.29Å; S44-G47 PolarHBondContact O-N 2.91Å; S44-C48 WeakPolarHBondContact O-CB 3.35Å; S44-C48 PolarHBondContact O-N 2.75Å
45	K	37	Very low	38.1	Very low	126 Å²	126	120.1 Å²	120.1	55%	0.548	61%	0.608	S	S	.	*	H	α-helix	trans	-66.6	-40.7	177.7	-149.6	177.7	-174.5	-169.7	0	111.6	F41 C42 G47 C48 E49	F41-K45 HydrophobicContact CE1-CD 4.23Å; F41-K45 HydrophobicContact CZ-CD 4.4Å; F41-K45 WeakPolarHBondContact O-CB 3.29Å; F41-K45 PolarHBondContact O-N 3.12Å; C42-K45 PolarHBondContact O-N 3.44Å; K45-G47 VanDerWaalsContact C-N 3.35Å; K45-C48 PolarHBondContact O-N 3.28Å; K45-E49 PolarHBondContact O-N 2.86Å
46	V	40.6	Very low	36.9	Very low	112 Å²	112	118.5 Å²	118.5	68%	0.679	62%	0.622	S	S	*	*	H	α-helix	trans	-68.8	-33.3	175	-179.4	0	0	0	0	111.6	C42 A43	C42-V46 WeakPolarHBondContact O-CG2 3.34Å; C42-V46 PolarHBondContact O-N 2.84Å; A43-V46 PolarHBondContact O-N 2.76Å
47	G	39.9	Very low	36.2	Very low	41 Å²	41	123.3 Å²	123.3	42%	0.423	65%	0.653	S	S	.	*	H	α-helix	trans	-72.3	-32	173.5	0	0	0	0	0	114.2	A43 S44 K45 R50	A43-G47 PolarHBondContact O-N 2.96Å; S44-G47 PolarHBondContact O-N 2.91Å; K45-G47 VanDerWaalsContact C-N 3.35Å; G47-R50 PolarHBondContact O-N 3.11Å
48	C	32.7	Very low	35.5	Very low	69 Å²	69	124.3 Å²	124.3	47%	0.466	67%	0.666	S	S	.	*	H	α-helix	trans	-80.9	-23.8	-173.8	-156.3	0	0	0	0	113.1	S44 K45 R50 L51	S44-C48 WeakPolarHBondContact O-CB 3.35Å; S44-C48 PolarHBondContact O-N 2.75Å; K45-C48 PolarHBondContact O-N 3.28Å; C48-R50 PolarHBondContact O-N 3.18Å; C48-L51 PolarHBondContact O-N 2.94Å
49	E	36.1	Very low	34.7	Very low	156 Å²	156	127 Å²	127	73%	0.729	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-17.1	173.2	-74.6	-171.5	176.2	0	0	113.4	K45	K45-E49 PolarHBondContact O-N 2.86Å
50	R	32.1	Very low	34	Very low	229 Å²	229	127.4 Å²	127.4	86%	0.864	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-1.1	175.4	-83.4	-171.3	-167.3	-163	3.5	116	G47 C48	G47-R50 PolarHBondContact O-N 3.11Å; C48-R50 PolarHBondContact O-N 3.18Å
51	L	30	Very low	33.7	Very low	146 Å²	146	131.5 Å²	131.5	76%	0.764	71%	0.705	S	S	*	*			trans	-123.9	14.6	-173.8	-71.4	171.1	0	0	0	114.9	C48 E53	C48-L51 PolarHBondContact O-N 2.94Å; L51-E53 PolarHBondContact O-N 3.38Å
52	K	30.5	Very low	33.4	Very low	179 Å²	179	135.5 Å²	135.5	78%	0.778	72%	0.718	S	S	*	*			trans	-79.5	8.8	177.8	-80.5	-170.5	177.4	-177.2	0	116
53	E	29.4	Very low	33	Very low	177 Å²	177	140.8 Å²	140.8	83%	0.827	74%	0.735	S	S	*	*			trans	-121.5	90.8	172.1	-75.3	-175.2	166.4	0	0	110.8	L51	L51-E53 PolarHBondContact O-N 3.38Å
54	K	30.6	Very low	32.8	Very low	190 Å²	190	146.2 Å²	146.2	83%	0.826	75%	0.749	S	S	*	*	S	Bend	trans	171.8	121.6	131.5	-94.1	160.8	-175.8	176.6	0	112.5
55	K	30.1	Very low	32.3	Very low	191 Å²	191	148.7 Å²	148.7	83%	0.83	76%	0.763	S	S	*	*			trans	69.8	105	143.1	-64.9	-174.6	173.7	-172.7	0	117.8
56	G	26.7	Very low	32.1	Very low	83 Å²	83	150.8 Å²	150.8	86%	0.856	78%	0.779	S	S	*	*			trans	-63	140.1	153	0	0	0	0	0	111.2
57	V	32.9	Very low	31.7	Very low	142 Å²	142	155 Å²	155	86%	0.861	79%	0.791	S	S	*	*			trans	-136.7	137.5	163.9	178.3	0	0	0	0	105.8
58	A	32.3	Very low	31.3	Very low	88 Å²	88	165.1 Å²	165.1	73%	0.727	82%	0.816	S	S	*	*			trans	-64.4	153.8	-160.6	0	0	0	0	0	115.3
59	E	28.8	Very low	31.3	Very low	187 Å²	187	166.1 Å²	166.1	87%	0.874	83%	0.83	S	S	*	*			trans	-65	122.7	165.3	-71.5	177.5	140.2	0	0	109.6
60	D	30.6	Very low	31	Very low	138 Å²	138	164.9 Å²	164.9	74%	0.738	83%	0.832	S	S	*	*			trans	-95.5	113.7	165.2	-88.4	-28.3	0	0	0	108.6	Y62	D60-Y62 HydrophobicContact CB-CD2 4.39Å; D60-Y62 HydrophobicContact CB-CE2 4.19Å; D60-Y62 PolarHBondContact O-N 2.92Å
61	D	31.7	Very low	31	Very low	158 Å²	158	160.1 Å²	160.1	85%	0.845	83%	0.829	S	S	*	*			trans	-63.6	119.4	168	-72.3	-50	0	0	0	110.2
62	Y	32.9	Very low	30.8	Very low	215 Å²	215	164 Å²	164	84%	0.843	83%	0.833	S	S	*	*			trans	-111.9	123.2	168.5	-90.2	-88	0	0	0	111	D60	D60-Y62 HydrophobicContact CB-CD2 4.39Å; D60-Y62 HydrophobicContact CB-CE2 4.19Å; D60-Y62 PolarHBondContact O-N 2.92Å
63	E	30.5	Very low	30.8	Very low	189 Å²	189	166.4 Å²	166.4	88%	0.883	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-65.4	154.7	-169.5	-67.1	-159.7	155.4	0	0	116.5
64	E	31.2	Very low	30.9	Very low	182 Å²	182	163.8 Å²	163.8	85%	0.85	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-72.6	130.4	-178.8	-150.5	175.2	-165.8	0	0	112.6	L66	E64-L66 PolarHBondContact O-N 3.23Å
65	P	32.9	Very low	30.9	Very low	125 Å²	125	162.8 Å²	162.8	81%	0.812	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-73.8	119.8	178.4	-18.3	31.7	0	0	0	113.4
66	L	32.7	Very low	31	Very low	170 Å²	170	161.9 Å²	161.9	89%	0.89	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-52.3	135.4	176.7	-71.4	163.4	0	0	0	115.1	E64 R68	E64-L66 PolarHBondContact O-N 3.23Å; L66-R68 PolarHBondContact O-N 3.42Å
67	H	31.4	Very low	31.1	Very low	200 Å²	200	165 Å²	165	93%	0.926	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-46	116.3	167.2	-86.4	-98.6	0	0	0	113
68	R	31.4	Very low	30.9	Very low	253 Å²	253	161.6 Å²	161.6	96%	0.955	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-98.6	127.3	168	-137.4	176.9	-166.3	127.6	0.1	111	L66	L66-R68 PolarHBondContact O-N 3.42Å
69	A	31.9	Very low	30.7	Very low	90 Å²	90	166.5 Å²	166.5	74%	0.744	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-60.7	144.1	-166.6	0	0	0	0	0	115.4	V71	A69-V71 PolarHBondContact O-N 3.31Å
70	V	30.8	Very low	30.7	Very low	130 Å²	130	163.4 Å²	163.4	79%	0.788	84%	0.838	S	S	*	*			trans	-73	104.8	174.9	176.3	0	0	0	0	109.6	R72	V70-R72 HydrophobicContact CG1-CG 4.29Å; V70-R72 PolarHBondContact O-N 2.91Å
71	V	31.1	Very low	30.6	Very low	129 Å²	129	161 Å²	161	78%	0.782	84%	0.836	S	S	*	*			trans	-84.6	105.3	168	179.1	0	0	0	0	108.5	A69	A69-V71 PolarHBondContact O-N 3.31Å
72	R	26.8	Very low	30.5	Very low	227 Å²	227	159.3 Å²	159.3	86%	0.857	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-71.6	121	171.5	-63.8	-178	-179.2	177.4	0.7	108.6	V70	V70-R72 HydrophobicContact CG1-CG 4.29Å; V70-R72 PolarHBondContact O-N 2.91Å
73	R	29.4	Very low	30.2	Very low	231 Å²	231	155.5 Å²	155.5	87%	0.872	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-87.6	145.2	166	-75.1	-171.9	-176.1	179.1	0.9	110.3
74	P	31.5	Very low	30	Very low	122 Å²	122	153.3 Å²	153.3	79%	0.792	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-74.1	156.9	-173.1	-9.9	28.1	0	0	0	112.5	D76	P74-D76 PolarHBondContact O-N 2.97Å
75	M	31.2	Very low	29.6	Very low	169 Å²	169	149.6 Å²	149.6	83%	0.833	81%	0.806	S	S	*	*			trans	-74.6	111.7	179.5	-59.8	-87.7	-109.9	0	0	109.8	N77	M75-N77 PolarHBondContact O-N 2.85Å
76	D	32.6	Very low	29.2	Very low	172 Å²	172	153.8 Å²	153.8	92%	0.92	81%	0.807	S	S	*	*			trans	-84	105.8	161.3	-93.4	-25.3	0	0	0	108.8	P74	P74-D76 PolarHBondContact O-N 2.97Å
77	N	28.2	Very low	28.7	Very low	149 Å²	149	154.1 Å²	154.1	80%	0.797	80%	0.797	S	S	*	*			trans	-87	127	164.8	-70.2	-35.4	0	0	0	107.9	M75	M75-N77 PolarHBondContact O-N 2.85Å
78	G	28.7	Very low	28.4	Very low	69 Å²	69	155.2 Å²	155.2	71%	0.711	79%	0.793	S	S	*	*			trans	132.6	95.1	163.2	0	0	0	0	0	113.1
79	E	29.5	Very low	28.1	Very low	191 Å²	191	150.2 Å²	150.2	89%	0.893	78%	0.78	S	S	*	*				173.6	113.4	103.5	-91.8	179.8	175.3	0	0	108	A81	E79-A81 VanDerWaalsContact C-N 3.32Å; E79-A81 PolarHBondContact O-N 3.44Å
80	S	27.5	Very low	27.7	Very low	123 Å²	123	151.2 Å²	151.2	86%	0.86	78%	0.782	S	S	*	*			trans	-73.3	85.5	179	-161.9	0	0	0	0	108.2	V82	S80-V82 PolarHBondContact O-N 3.32Å; S80-V82 VanDerWaalsContact O-N 3.1Å
81	A	29.7	Very low	27.5	Very low	86 Å²	86	155.5 Å²	155.5	71%	0.711	79%	0.785	S	S	*	*			trans	-68.8	108.3	170.8	0	0	0	0	0	108.4	E79 V83	E79-A81 VanDerWaalsContact C-N 3.32Å; E79-A81 PolarHBondContact O-N 3.44Å; A81-V83 PolarHBondContact O-N 3.21Å
82	V	29	Very low	27.1	Very low	123 Å²	123	153.6 Å²	153.6	75%	0.745	78%	0.783	S	S	*	*			trans	-55	102	175.3	176.7	0	0	0	0	108.8	S80 Q84	S80-V82 PolarHBondContact O-N 3.32Å; S80-V82 VanDerWaalsContact O-N 3.1Å; V82-Q84 HydrophobicContact CG1-CG 4.47Å; V82-Q84 PolarHBondContact O-N 2.59Å
83	V	26.2	Very low	27	Very low	136 Å²	136	146.8 Å²	146.8	82%	0.824	78%	0.784	S	S	*	*			trans	-71.2	99.7	171.7	177.7	0	0	0	0	107.4	A81 D85	A81-V83 PolarHBondContact O-N 3.21Å; V83-D85 PolarHBondContact O-N 2.54Å
84	Q	25.5	Very low	26.8	Very low	142 Å²	142	138.9 Å²	138.9	66%	0.664	77%	0.774	S	S	*	*			trans	-66.6	109.8	171.3	-77.3	175.1	-29.2	0	0	109	V82 Y86	V82-Q84 HydrophobicContact CG1-CG 4.47Å; V82-Q84 PolarHBondContact O-N 2.59Å; Q84-Y86 HydrophobicContact CB-CE2 4.25Å; Q84-Y86 PolarHBondContact O-N 3.43Å; Q84-Y86 VanDerWaalsContact O-N 3.11Å
85	D	23.2	Very low	26.7	Very low	105 Å²	105	140.7 Å²	140.7	56%	0.561	78%	0.777	S	S	*	*			trans	-75.1	90.1	-176.2	-159.7	3.5	0	0	0	109.9	V83 R87	V83-D85 PolarHBondContact O-N 2.54Å; D85-R87 PolarHBondContact O-N 3.48Å; D85-R87 WeakPolarHBondContact OD1-CG 3.49Å; D85-R87 IonicContact OD1-CZ 3.52Å; D85-R87 IonicContact OD1-NE 2.75Å; D85-R87 IonicContact OD1-NH1 3.75Å; D85-R87 PolarHBondContact OD1-NH1 3.49Å; D85-R87 IonicContact OD2-CZ 3.23Å; D85-R87 IonicContact OD2-NH1 2.69Å; D85-R87 PolarHBondContact OD2-NH1 3.18Å
86	Y	24.5	Very low	26.4	Very low	212 Å²	212	139.6 Å²	139.6	83%	0.831	77%	0.773	S	S	*	*			trans	-75.8	59.3	167.9	-73.1	-87.6	0	0	0	110.5	Q84	Q84-Y86 HydrophobicContact CB-CE2 4.25Å; Q84-Y86 PolarHBondContact O-N 3.43Å; Q84-Y86 VanDerWaalsContact O-N 3.11Å
87	R	23.2	Very low	26.2	Very low	177 Å²	177	139.5 Å²	139.5	67%	0.668	77%	0.767	S	S	*	*			trans	-93.8	106.5	164.4	-90.6	-175.3	-169.6	116.6	-3	109	D85	D85-R87 PolarHBondContact O-N 3.48Å; D85-R87 WeakPolarHBondContact OD1-CG 3.49Å; D85-R87 IonicContact OD1-CZ 3.52Å; D85-R87 IonicContact OD1-NE 2.75Å; D85-R87 IonicContact OD1-NH1 3.75Å; D85-R87 PolarHBondContact OD1-NH1 3.49Å; D85-R87 IonicContact OD2-CZ 3.23Å; D85-R87 IonicContact OD2-NH1 2.69Å; D85-R87 PolarHBondContact OD2-NH1 3.18Å
88	R	24.6	Very low	26.3	Very low	223 Å²	223	141.4 Å²	141.4	84%	0.842	77%	0.768	S	S	*	*			trans	155.6	119.7	160.3	-85.9	153.1	-168.3	-124	5.7	103.1
89	H	25.8	Very low	26.3	Very low	149 Å²	149	144.4 Å²	144.4	69%	0.69	77%	0.766	S	S	*	*				-156.3	128.1	62.6	-70.9	74.1	0	0	0	109.2	Y91	H89-Y91 HydrophobicContact CB-CD2 4.42Å; H89-Y91 HydrophobicContact CB-CE2 4.02Å; H89-Y91 PolarHBondContact O-N 2.9Å
90	S	22	Very low	26.3	Very low	111 Å²	111	142.2 Å²	142.2	78%	0.776	76%	0.759	S	S	*	*			trans	-75.7	112.6	168.2	179.7	0	0	0	0	108.3
91	Y	26.3	Very low	26.6	Very low	219 Å²	219	144.7 Å²	144.7	86%	0.859	76%	0.755	S	S	*	*			trans	-96.6	83.9	162.5	-73.8	-82.2	0	0	0	108.2	H89	H89-Y91 HydrophobicContact CB-CD2 4.42Å; H89-Y91 HydrophobicContact CB-CE2 4.02Å; H89-Y91 PolarHBondContact O-N 2.9Å
92	A	24.7	Very low	26.6	Very low	89 Å²	89	148 Å²	148	74%	0.736	76%	0.755	S	S	*	*			trans	-105.6	113	159.7	0	0	0	0	0	107.4
93	G	24	Very low	27.2	Very low	85 Å²	85	146.3 Å²	146.3	88%	0.876	74%	0.742	S	S	*	*			trans	102.2	106.5	166.3	0	0	0	0	0	114.7
94	G	24.8	Very low	27.9	Very low	64 Å²	64	146.6 Å²	146.6	66%	0.66	75%	0.746	S	S	*	*			trans	176.3	91.1	167.8	0	0	0	0	0	110.3	L96	G94-L96 PolarHBondContact O-N 3.34Å
95	N	28.6	Very low	29.1	Very low	161 Å²	161	145.4 Å²	145.4	86%	0.861	75%	0.745	S	S	*	*			trans	-46.5	97	167.1	-116.5	-38.3	0	0	0	109.5	H97	N95-H97 PolarHBondContact O-N 3.07Å
96	L	26.2	Very low	29.7	Very low	145 Å²	145	142.6 Å²	142.6	76%	0.759	74%	0.741	S	S	*	*			trans	-82.4	38.3	-180	-134.3	109.3	0	0	0	111.4	G94 K98 M99	G94-L96 PolarHBondContact O-N 3.34Å; L96-K98 PolarHBondContact O-N 3.37Å; L96-M99 HydrophobicContact CD2-CE 4.26Å
97	H	27.6	Very low	30.2	Very low	171 Å²	171	138.7 Å²	138.7	79%	0.792	73%	0.73	S	S	*	*			trans	-98.1	67.1	172.4	-124	-72.5	0	0	0	108.1	N95	N95-H97 PolarHBondContact O-N 3.07Å
98	K	31.4	Very low	30.6	Very low	188 Å²	188	135.5 Å²	135.5	82%	0.817	73%	0.732	S	S	*	*			trans	-175	15.5	162.7	-109.1	169.1	-168.8	-172.1	0	117.9	L96 L100	L96-K98 PolarHBondContact O-N 3.37Å; K98-L100 PolarHBondContact O-N 3.41Å
99	M	27.8	Very low	31.1	Very low	133 Å²	133	129.3 Å²	129.3	66%	0.655	72%	0.715	S	S	*	*			trans	-80.8	79.4	164.6	-73	-144.2	-69.5	0	0	109.8	L96 F101	L96-M99 HydrophobicContact CD2-CE 4.26Å; M99-F101 PolarHBondContact O-N 3.2Å
100	L	29.3	Very low	31.5	Very low	145 Å²	145	126 Å²	126	76%	0.759	71%	0.713	S	S	*	*			trans	-66.7	106.3	160.5	-89.9	117.2	0	0	0	107.6	K98 Q102	K98-L100 PolarHBondContact O-N 3.41Å; L100-Q102 PolarHBondContact O-N 3.44Å; L100-Q102 VanDerWaalsContact O-N 3.17Å
101	F	34.1	Very low	32	Very low	175 Å²	175	129.3 Å²	129.3	77%	0.768	71%	0.714	S	S	*	*			trans	-68.3	106.7	168.9	-71	-85.9	0	0	0	108.7	M99	M99-F101 PolarHBondContact O-N 3.2Å
102	Q	30.2	Very low	32.2	Very low	154 Å²	154	127.2 Å²	127.2	72%	0.72	71%	0.712	S	S	*	*			trans	-80	135.7	166.8	-77.3	172.2	-9.1	0	0	108.9	L100	L100-Q102 PolarHBondContact O-N 3.44Å; L100-Q102 VanDerWaalsContact O-N 3.17Å
103	L	42.1	Very low	32.5	Very low	88 Å²	88	128.5 Å²	128.5	46%	0.461	71%	0.713	S	S	.	*			trans	-64.1	154.8	165.3	-76.5	164	0	0	0	109.6	N105 G106 I109	L103-N105 PolarHBondContact O-N 3.46Å; L103-G106 PolarHBondContact O-N 3.17Å; L103-I109 HydrophobicContact CD1-CD1 4.21Å; L103-I109 HydrophobicContact CD1-CG1 3.75Å; L103-I109 HydrophobicContact CG-CD1 4.18Å; L103-I109 HydrophobicContact CG-CG1 4.1Å
104	P	39.5	Very low	32.8	Very low	142 Å²	142	129.7 Å²	129.7	92%	0.922	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.5	-12.1	-174.6	-26.7	34.8	0	0	0	116.3
105	N	51.3	Low	33	Very low	117 Å²	117	135.9 Å²	135.9	63%	0.626	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104	13.8	175.3	63.4	-7.8	0	0	0	114	L103 Q107	L103-N105 PolarHBondContact O-N 3.46Å; N105-Q107 VanDerWaalsContact C-N 3.29Å; N105-Q107 PolarHBondContact O-N 2.91Å
106	G	36.1	Very low	33.1	Very low	46 Å²	46	133.8 Å²	133.8	47%	0.474	71%	0.713	S	S	.	*			trans	75.2	7.1	167.4	0	0	0	0	0	116	L103	L103-G106 PolarHBondContact O-N 3.17Å
107	Q	34.6	Very low	33	Very low	131 Å²	131	132.8 Å²	132.8	61%	0.612	72%	0.717	S	S	*	*			trans	-91.2	137.3	176.1	-67.1	-164.6	-67.3	0	0	112.2	N105	N105-Q107 VanDerWaalsContact C-N 3.29Å; N105-Q107 PolarHBondContact O-N 2.91Å
108	P	31.9	Very low	33.1	Very low	110 Å²	110	131.4 Å²	131.4	71%	0.714	72%	0.715	S	S	*	*			trans	-67.4	141.4	173.1	26.6	-31.7	0	0	0	110.9	A110	P108-A110 PolarHBondContact O-N 3.26Å
109	I	34.8	Very low	33	Very low	92 Å²	92	131.8 Å²	131.8	47%	0.472	72%	0.719	S	S	.	*			trans	-74.9	97.8	177.9	-52.6	176.1	0	0	0	108.4	L103 F111	L103-I109 HydrophobicContact CD1-CD1 4.21Å; L103-I109 HydrophobicContact CD1-CG1 3.75Å; L103-I109 HydrophobicContact CG-CD1 4.18Å; L103-I109 HydrophobicContact CG-CG1 4.1Å; I109-F111 HydrophobicContact CB-CE2 4.44Å; I109-F111 HydrophobicContact CG2-CD2 3.59Å; I109-F111 HydrophobicContact CG2-CE2 3.33Å; I109-F111 HydrophobicContact CG2-CG 4.44Å; I109-F111 HydrophobicContact CG2-CZ 4.01Å; I109-F111 PolarHBondContact O-N 3.44Å
110	A	33.6	Very low	33.2	Very low	80 Å²	80	134 Å²	134	66%	0.661	73%	0.728	S	S	*	*			trans	-83.2	100	169.2	0	0	0	0	0	108.9	P108 H112	P108-A110 PolarHBondContact O-N 3.26Å; A110-H112 PolarHBondContact O-N 2.68Å
111	F	33.5	Very low	33.3	Very low	181 Å²	181	131.5 Å²	131.5	79%	0.794	73%	0.728	S	S	*	*			trans	-76.8	100	166.6	-81.3	-82.4	0	0	0	108.5	I109 P113	I109-F111 HydrophobicContact CB-CE2 4.44Å; I109-F111 HydrophobicContact CG2-CD2 3.59Å; I109-F111 HydrophobicContact CG2-CE2 3.33Å; I109-F111 HydrophobicContact CG2-CG 4.44Å; I109-F111 HydrophobicContact CG2-CZ 4.01Å; I109-F111 PolarHBondContact O-N 3.44Å; F111-P113 WeakPolarHBondContact O-CD 3.49Å
112	H	30.2	Very low	33.1	Very low	174 Å²	174	130.5 Å²	130.5	81%	0.806	73%	0.731	S	S	*	*			trans	-74.7	120.1	163.2	-90.7	-87.3	0	0	0	108.6	A110 S114	A110-H112 PolarHBondContact O-N 2.68Å; H112-S114 PolarHBondContact O-N 3.44Å
113	P	31.7	Very low	32.9	Very low	117 Å²	117	131.2 Å²	131.2	76%	0.76	74%	0.736	S	S	*	*			trans	-70.1	118.1	169	6	7.3	0	0	0	108	F111 E115	F111-P113 WeakPolarHBondContact O-CD 3.49Å; P113-E115 PolarHBondContact O-N 3.08Å
114	S	30.1	Very low	32.3	Very low	109 Å²	109	136 Å²	136	76%	0.762	75%	0.753	S	S	*	*			trans	-67.4	113.9	169.8	49.3	0	0	0	0	109.2	H112 T116	H112-S114 PolarHBondContact O-N 3.44Å; S114-T116 PolarHBondContact O-N 3.39Å; S114-T116 VanDerWaalsContact O-N 3.17Å
115	E	27.7	Very low	31.8	Very low	194 Å²	194	135.5 Å²	135.5	91%	0.907	75%	0.747	S	S	*	*			trans	-61.8	106.5	171.8	-67.1	172.3	162.2	0	0	109.8	P113	P113-E115 PolarHBondContact O-N 3.08Å
116	T	31	Very low	30.7	Very low	118 Å²	118	138.4 Å²	138.4	72%	0.724	76%	0.757	S	S	*	*			trans	-107.4	105.1	157.3	47.5	0	0	0	0	107.8	S114 I118	S114-T116 PolarHBondContact O-N 3.39Å; S114-T116 VanDerWaalsContact O-N 3.17Å; T116-I118 PolarHBondContact O-N 2.9Å
117	S	24.5	Very low	30.3	Very low	123 Å²	123	141 Å²	141	86%	0.86	77%	0.773	S	S	*	*			trans	-57.8	105.1	173.3	35	0	0	0	0	111.2
118	I	31	Very low	30.1	Very low	143 Å²	143	142.1 Å²	142.1	73%	0.733	78%	0.779	S	S	*	*			trans	-125.8	115.9	159.8	-56.3	178.2	0	0	0	106	T116 E120	T116-I118 PolarHBondContact O-N 2.9Å; I118-E120 PolarHBondContact O-N 3.25Å
119	E	29.1	Very low	30.1	Very low	196 Å²	196	141.4 Å²	141.4	92%	0.916	77%	0.774	S	S	*	*			trans	-65.2	87.1	178.9	-68	175.5	143.6	0	0	110.3	A121	E119-A121 PolarHBondContact O-N 3.44Å
120	E	30.4	Very low	30.1	Very low	180 Å²	180	143.6 Å²	143.6	84%	0.841	79%	0.792	S	S	*	*			trans	-81.6	104.3	166.3	-77.6	-170.1	163.1	0	0	109.7	I118 N122	I118-E120 PolarHBondContact O-N 3.25Å; E120-N122 PolarHBondContact O-N 3.14Å
121	A	33	Very low	30.5	Very low	92 Å²	92	145.5 Å²	145.5	76%	0.76	78%	0.783	S	S	*	*			trans	-57.5	96.1	172.6	0	0	0	0	0	111.6	E119 M123	E119-A121 PolarHBondContact O-N 3.44Å; A121-M123 PolarHBondContact O-N 2.99Å
122	N	29.1	Very low	30.8	Very low	154 Å²	154	142.4 Å²	142.4	82%	0.824	78%	0.775	S	S	*	*			trans	25.4	61.1	139.8	-146.5	3.1	0	0	0	116.9	E120	E120-N122 PolarHBondContact O-N 3.14Å
123	M	27.1	Very low	31.1	Very low	168 Å²	168	142.1 Å²	142.1	83%	0.828	77%	0.774	S	S	*	*			trans	-94.7	101.5	167.8	-152.7	161.9	80.5	0	0	107.9	A121 V125	A121-M123 PolarHBondContact O-N 2.99Å; M123-V125 PolarHBondContact O-N 2.91Å
124	K	28.5	Very low	31.3	Very low	189 Å²	189	142.2 Å²	142.2	82%	0.822	77%	0.767	S	S	*	*			trans	-55.2	102.1	173.4	-81.9	177.6	173.3	178.9	0	109.3	E126	K124-E126 PolarHBondContact O-N 2.88Å; K124-E126 VanDerWaalsContact O-N 3.15Å
125	V	29.9	Very low	32	Very low	131 Å²	131	139.3 Å²	139.3	79%	0.794	75%	0.747	S	S	*	*			trans	-75.4	99.1	167.2	-179.2	0	0	0	0	106.5	M123 A127	M123-V125 PolarHBondContact O-N 2.91Å; V125-A127 PolarHBondContact O-N 2.83Å
126	E	26.4	Very low	33.1	Very low	179 Å²	179	134 Å²	134	84%	0.836	73%	0.728	S	S	*	*			trans	-59.5	126	166.6	-72.6	-172.6	157.5	0	0	108.5	K124 E128	K124-E126 PolarHBondContact O-N 2.88Å; K124-E126 VanDerWaalsContact O-N 3.15Å; E126-E128 PolarHBondContact O-N 3.29Å; E126-E128 VanDerWaalsContact O-N 3.12Å
127	A	29.3	Very low	33.7	Very low	99 Å²	99	132.1 Å²	132.1	82%	0.818	72%	0.716	S	S	*	*			trans	-60.2	113	-177.3	0	0	0	0	0	110.8	V125	V125-A127 PolarHBondContact O-N 2.83Å
128	E	29.9	Very low	35	Very low	156 Å²	156	128.1 Å²	128.1	73%	0.729	69%	0.685	S	S	*	*			trans	-59.9	137.2	172.3	-83.7	-97.7	166.3	0	0	110.5	E126	E126-E128 PolarHBondContact O-N 3.29Å; E126-E128 VanDerWaalsContact O-N 3.12Å
129	P	32	Very low	36.1	Very low	95 Å²	95	123.6 Å²	123.6	62%	0.617	66%	0.662	S	S	*	*			trans	-71.9	144.5	-171.8	28.7	-33	0	0	0	112.4	Y131	P129-Y131 PolarHBondContact O-N 3.19Å
130	T	34.9	Very low	37.3	Very low	137 Å²	137	116.6 Å²	116.6	84%	0.84	64%	0.635	S	S	*	*			trans	-54.2	84.9	-177.6	-32.5	0	0	0	0	112.7	D132	T130-D132 VanDerWaalsContact C-N 3.26Å; T130-D132 PolarHBondContact O-N 2.88Å
131	Y	41.6	Very low	38.2	Very low	121 Å²	121	110.9 Å²	110.9	48%	0.475	61%	0.609	S	S	.	*			trans	-81.9	1.6	-175.6	-136.8	-90.4	0	0	0	114	P129 E133 S135 I255	P129-Y131 PolarHBondContact O-N 3.19Å; Y131-E133 PolarHBondContact O-N 3.44Å; Y131-S135 PolarHBondContact O-N 3.49Å; Y131-I255 WeakPolarHBondContact OH-CG1 3.43Å
132	D	38.7	Very low	38.9	Very low	116 Å²	116	106.5 Å²	106.5	62%	0.62	57%	0.573	S	S	*	*	H	α-helix	trans	-65.9	-35.5	-166.4	-82.8	-21.1	0	0	0	113.9	T130 T136	T130-D132 VanDerWaalsContact C-N 3.26Å; T130-D132 PolarHBondContact O-N 2.88Å; D132-T136 VanDerWaalsContact O-CB 3.23Å; D132-T136 WeakPolarHBondContact O-CB 3.41Å; D132-T136 PolarHBondContact O-N 3.15Å; D132-T136 PolarHBondContact O-OG1 3.07Å
133	E	38.2	Very low	40	Very low	168 Å²	168	101.6 Å²	101.6	79%	0.785	55%	0.547	S	S	*	.	H	α-helix	trans	-72.4	-45.5	-172.5	-70.9	-168.6	159.6	0	0	114.1	Y131 S135 T136 T137	Y131-E133 PolarHBondContact O-N 3.44Å; E133-S135 VanDerWaalsContact C-N 3.32Å; E133-T136 PolarHBondContact O-N 3.03Å; E133-T137 WeakPolarHBondContact O-CG2 3.49Å; E133-T137 PolarHBondContact O-N 3.31Å; E133-T137 PolarHBondContact O-OG1 2.77Å
134	L	35.1	Very low	41.3	Very low	119 Å²	119	99.1 Å²	99.1	62%	0.623	53%	0.528	S	S	*	.	H	α-helix	trans	-66.9	-38.2	177.3	-76.6	171.1	0	0	0	110.7	T137 M138	L134-T137 PolarHBondContact O-OG1 3.15Å; L134-T137 VanDerWaalsContact O-OG1 3.06Å; L134-M138 WeakPolarHBondContact O-CB 3.38Å; L134-M138 WeakPolarHBondContact O-CG 3.37Å; L134-M138 PolarHBondContact O-N 3.23Å; L134-M138 VanDerWaalsContact O-N 3.1Å
135	S	45.3	Very low	42.1	Very low	47 Å²	47	90.4 Å²	90.4	33%	0.329	49%	0.491	S	S	.	.	H	α-helix	trans	-63	-48.2	175.3	-151.8	0	0	0	0	111.2	Y131 E133 T137 M138 D139	Y131-S135 PolarHBondContact O-N 3.49Å; E133-S135 VanDerWaalsContact C-N 3.32Å; S135-T137 PolarHBondContact O-N 2.88Å; S135-M138 PolarHBondContact O-N 3.08Å; S135-D139 WeakPolarHBondContact O-CB 3.4Å; S135-D139 PolarHBondContact O-N 3.41Å
136	T	50.5	Low	43	Very low	84 Å²	84	84.3 Å²	84.3	52%	0.515	45%	0.454	S	S	.	.	H	α-helix	trans	-65.3	-39.1	-177.8	-54.9	0	0	0	0	112.4	D132 E133 D139 S140	D132-T136 VanDerWaalsContact O-CB 3.23Å; D132-T136 WeakPolarHBondContact O-CB 3.41Å; D132-T136 PolarHBondContact O-N 3.15Å; D132-T136 PolarHBondContact O-OG1 3.07Å; E133-T136 PolarHBondContact O-N 3.03Å; T136-D139 WeakPolarHBondContact O-CB 3.33Å; T136-D139 PolarHBondContact O-N 2.93Å; T136-S140 PolarHBondContact O-N 3Å
137	T	42.9	Very low	44	Very low	78 Å²	78	78.3 Å²	78.3	48%	0.479	43%	0.432	S	S	.	.	H	α-helix	trans	-68.4	-41.5	176.8	47.6	0	0	0	0	111.7	E133 L134 S135 D139 S140 I141	E133-T137 WeakPolarHBondContact O-CG2 3.49Å; E133-T137 PolarHBondContact O-N 3.31Å; E133-T137 PolarHBondContact O-OG1 2.77Å; L134-T137 PolarHBondContact O-OG1 3.15Å; L134-T137 VanDerWaalsContact O-OG1 3.06Å; S135-T137 PolarHBondContact O-N 2.88Å; T137-D139 VanDerWaalsContact C-N 3.32Å; T137-S140 PolarHBondContact O-N 3.33Å; T137-I141 WeakPolarHBondContact O-CG1 3.49Å; T137-I141 PolarHBondContact O-N 3.43Å; T137-I141 VanDerWaalsContact O-N 3.15Å
138	M	51.8	Low	44.8	Very low	39 Å²	39	75.6 Å²	75.6	19%	0.192	41%	0.407	C	S	.	.	H	α-helix	trans	-63	-38.6	171.6	-74.6	-173.9	66.5	0	0	111.9	L134 S135 I141 A142 M394	L134-M138 WeakPolarHBondContact O-CB 3.38Å; L134-M138 WeakPolarHBondContact O-CG 3.37Å; L134-M138 PolarHBondContact O-N 3.23Å; L134-M138 VanDerWaalsContact O-N 3.1Å; S135-M138 PolarHBondContact O-N 3.08Å; M138-I141 PolarHBondContact O-N 2.98Å; M138-A142 WeakPolarHBondContact O-CB 3.4Å; M138-A142 PolarHBondContact O-N 3.38Å; M138-M394 HydrophobicContact CE-CG 3.96Å
139	D	54.5	Low	45.3	Very low	47 Å²	47	69 Å²	69	25%	0.251	38%	0.377	S	S	.	.	H	α-helix	trans	-59.9	-49.4	174.9	-73.8	-25.5	0	0	0	111.3	S135 T136 T137 I141 A142 D143 K390	S135-D139 WeakPolarHBondContact O-CB 3.4Å; S135-D139 PolarHBondContact O-N 3.41Å; T136-D139 WeakPolarHBondContact O-CB 3.33Å; T136-D139 PolarHBondContact O-N 2.93Å; T137-D139 VanDerWaalsContact C-N 3.32Å; D139-I141 VanDerWaalsContact C-N 3.29Å; D139-I141 PolarHBondContact O-N 2.96Å; D139-A142 PolarHBondContact O-N 3.26Å; D139-A142 VanDerWaalsContact O-N 3.16Å; D139-D143 WeakPolarHBondContact O-CB 3.33Å; D139-D143 PolarHBondContact O-N 2.94Å; D139-K390 WeakPolarHBondContact OD1-CE 3.47Å; D139-K390 IonicContact OD1-NZ 3.7Å; D139-K390 PolarHBondContact OD1-NZ 3.02Å
140	S	55	Low	45.7	Very low	50 Å²	50	65.4 Å²	65.4	35%	0.35	36%	0.355	S	S	.	.	H	α-helix	trans	-62.9	-33.9	178.9	-174.5	0	0	0	0	113.2	T136 T137 R144	T136-S140 PolarHBondContact O-N 3Å; T137-S140 PolarHBondContact O-N 3.33Å; S140-R144 WeakPolarHBondContact O-CB 3.47Å; S140-R144 VanDerWaalsContact O-CG 3.27Å; S140-R144 WeakPolarHBondContact O-CG 3.27Å; S140-R144 PolarHBondContact O-N 3.27Å
141	I	47.8	Very low	45.6	Very low	59 Å²	59	63.6 Å²	63.6	30%	0.303	34%	0.335	S	S	.	.	H	α-helix	trans	-74.1	-42.6	175.2	-61.5	167.9	0	0	0	110.1	T137 M138 D139 D143 R144 V145 L393	T137-I141 WeakPolarHBondContact O-CG1 3.49Å; T137-I141 PolarHBondContact O-N 3.43Å; T137-I141 VanDerWaalsContact O-N 3.15Å; M138-I141 PolarHBondContact O-N 2.98Å; D139-I141 VanDerWaalsContact C-N 3.29Å; D139-I141 PolarHBondContact O-N 2.96Å; I141-D143 VanDerWaalsContact C-N 3.35Å; I141-R144 WeakPolarHBondContact O-CB 3.16Å; I141-R144 PolarHBondContact O-N 3.3Å; I141-V145 WeakPolarHBondContact O-CG2 3.46Å; I141-V145 PolarHBondContact O-N 2.57Å; I141-L393 HydrophobicContact CB-CD1 3.9Å; I141-L393 HydrophobicContact CG2-CD1 3.61Å; I141-L393 HydrophobicContact CG2-CD2 3.79Å; I141-L393 HydrophobicContact CG2-CG 4.28Å
142	A	49.2	Very low	44.9	Very low	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-41.1	177.3	0	0	0	0	0	111.8	M138 D139 R144 V145 A146 Q386 K390	M138-A142 WeakPolarHBondContact O-CB 3.4Å; M138-A142 PolarHBondContact O-N 3.38Å; D139-A142 PolarHBondContact O-N 3.26Å; D139-A142 VanDerWaalsContact O-N 3.16Å; A142-R144 VanDerWaalsContact C-N 3.33Å; A142-R144 PolarHBondContact O-N 2.93Å; A142-V145 PolarHBondContact O-N 3.04Å; A142-A146 VanDerWaalsContact O-CB 3.27Å; A142-A146 WeakPolarHBondContact O-CB 3.26Å; A142-A146 PolarHBondContact O-N 3.22Å; A142-Q386 HydrophobicContact CB-CB 4.27Å; A142-K390 HydrophobicContact CB-CG 3.68Å
143	D	52.3	Low	44.7	Very low	51 Å²	51	59.4 Å²	59.4	27%	0.273	32%	0.323	S	S	.	.	H	α-helix	trans	-57.7	-46.6	171.2	-83.4	-27.6	0	0	0	111.6	D139 I141 V145 A146 S147 Q386	D139-D143 WeakPolarHBondContact O-CB 3.33Å; D139-D143 PolarHBondContact O-N 2.94Å; I141-D143 VanDerWaalsContact C-N 3.35Å; D143-V145 VanDerWaalsContact C-N 3.33Å; D143-V145 PolarHBondContact O-N 3.24Å; D143-A146 WeakPolarHBondContact O-CB 3.39Å; D143-A146 PolarHBondContact O-N 2.85Å; D143-S147 WeakPolarHBondContact O-CB 3.29Å; D143-S147 PolarHBondContact O-N 3.23Å; D143-S147 PolarHBondContact O-OG 2.87Å; D143-S147 VanDerWaalsContact O-OG 3.09Å; D143-Q386 VanDerWaalsContact OD1-CG 3.31Å; D143-Q386 WeakPolarHBondContact OD1-CG 3.45Å; D143-Q386 PolarHBondContact OD1-NE2 3.08Å
144	R	53.5	Low	44.1	Very low	116 Å²	116	54.1 Å²	54.1	44%	0.438	31%	0.305	S	S	.	.	H	α-helix	trans	-62.5	-41.5	177.3	-84.2	176.5	-178.1	160.9	6.5	111.9	S140 I141 A142 S148 W182	S140-R144 WeakPolarHBondContact O-CB 3.47Å; S140-R144 VanDerWaalsContact O-CG 3.27Å; S140-R144 WeakPolarHBondContact O-CG 3.27Å; S140-R144 PolarHBondContact O-N 3.27Å; I141-R144 WeakPolarHBondContact O-CB 3.16Å; I141-R144 PolarHBondContact O-N 3.3Å; A142-R144 VanDerWaalsContact C-N 3.33Å; A142-R144 PolarHBondContact O-N 2.93Å; R144-S148 VanDerWaalsContact O-CB 3.24Å; R144-S148 WeakPolarHBondContact O-CB 3.28Å; R144-S148 PolarHBondContact O-N 3.19Å; R144-S148 PolarHBondContact O-OG 3.21Å; R144-W182 HydrophobicContact CB-CH2 3.75Å; R144-W182 HydrophobicContact CB-CZ2 4.46Å; R144-W182 WeakPolarHBondContact O-CH2 3.41Å
145	V	45.3	Very low	43.8	Very low	7 Å²	7	52.1 Å²	52.1	4%	0.042	31%	0.306	C	S	.	.	H	α-helix	trans	-62.3	-50.1	173.8	173	0	0	0	0	109.6	I141 A142 D143 S147 S148 V149 L183 L424	I141-V145 WeakPolarHBondContact O-CG2 3.46Å; I141-V145 PolarHBondContact O-N 2.57Å; A142-V145 PolarHBondContact O-N 3.04Å; D143-V145 VanDerWaalsContact C-N 3.33Å; D143-V145 PolarHBondContact O-N 3.24Å; V145-S147 PolarHBondContact O-N 3.47Å; V145-S148 WeakPolarHBondContact CA-OG 3.37Å; V145-S148 PolarHBondContact O-N 2.85Å; V145-S148 VanDerWaalsContact O-N 3.13Å; V145-S148 PolarHBondContact O-OG 3.37Å; V145-V149 WeakPolarHBondContact O-CG1 3.43Å; V145-V149 WeakPolarHBondContact O-CG2 3.2Å; V145-V149 PolarHBondContact O-N 3.13Å; V145-L183 HydrophobicContact CG2-CD2 4.03Å; V145-L424 HydrophobicContact CG1-CD1 3.89Å
146	A	48.2	Very low	42.8	Very low	2 Å²	2	57.4 Å²	57.4	2%	0.017	33%	0.325	C	S	.	.	H	α-helix	trans	-56.2	-48.3	177.7	0	0	0	0	0	112.9	A142 D143 S148 V149 S150 V385	A142-A146 VanDerWaalsContact O-CB 3.27Å; A142-A146 WeakPolarHBondContact O-CB 3.26Å; A142-A146 PolarHBondContact O-N 3.22Å; D143-A146 WeakPolarHBondContact O-CB 3.39Å; D143-A146 PolarHBondContact O-N 2.85Å; A146-S148 VanDerWaalsContact C-N 3.33Å; A146-S148 PolarHBondContact O-N 3.17Å; A146-V149 WeakPolarHBondContact O-CG2 3.36Å; A146-V149 PolarHBondContact O-N 3.41Å; A146-S150 WeakPolarHBondContact O-CB 3.49Å; A146-S150 PolarHBondContact O-N 3.04Å; A146-V385 HydrophobicContact CB-CB 4.01Å; A146-V385 HydrophobicContact CB-CG1 3.43Å; A146-V385 VanDerWaalsContact CB-CG1 3.43Å
147	S	48.7	Very low	41.6	Very low	54 Å²	54	64 Å²	64	38%	0.378	34%	0.341	S	S	.	.	H	α-helix	trans	-67.8	-31.2	176.6	-59.7	0	0	0	0	112.6	D143 V145	D143-S147 WeakPolarHBondContact O-CB 3.29Å; D143-S147 PolarHBondContact O-N 3.23Å; D143-S147 PolarHBondContact O-OG 2.87Å; D143-S147 VanDerWaalsContact O-OG 3.09Å; V145-S147 PolarHBondContact O-N 3.47Å
148	S	45.2	Very low	40.7	Very low	42 Å²	42	67.8 Å²	67.8	29%	0.294	36%	0.357	S	S	.	.	H	α-helix	trans	-76.9	-27.7	178.4	71.6	0	0	0	0	113.6	R144 V145 A146	R144-S148 VanDerWaalsContact O-CB 3.24Å; R144-S148 WeakPolarHBondContact O-CB 3.28Å; R144-S148 PolarHBondContact O-N 3.19Å; R144-S148 PolarHBondContact O-OG 3.21Å; V145-S148 WeakPolarHBondContact CA-OG 3.37Å; V145-S148 PolarHBondContact O-N 2.85Å; V145-S148 VanDerWaalsContact O-N 3.13Å; V145-S148 PolarHBondContact O-OG 3.37Å; A146-S148 VanDerWaalsContact C-N 3.33Å; A146-S148 PolarHBondContact O-N 3.17Å
149	V	41	Very low	39.4	Very low	17 Å²	17	72.8 Å²	72.8	10%	0.103	39%	0.385	C	S	.	.	H	α-helix	trans	-100	-5.9	177.6	-57.1	0	0	0	0	112.6	V145 A146 L424 N428	V145-V149 WeakPolarHBondContact O-CG1 3.43Å; V145-V149 WeakPolarHBondContact O-CG2 3.2Å; V145-V149 PolarHBondContact O-N 3.13Å; A146-V149 WeakPolarHBondContact O-CG2 3.36Å; A146-V149 PolarHBondContact O-N 3.41Å; V149-L424 HydrophobicContact CB-CB 4.49Å; V149-L424 HydrophobicContact CG1-CB 4.41Å; V149-L424 HydrophobicContact CG2-CB 4.3Å; V149-L424 HydrophobicContact CG2-CD2 3.83Å; V149-N428 PolarHBondContact O-ND2 2.99Å; V149-N428 PolarHBondContact O-OD1 3.25Å; V149-N428 VanDerWaalsContact O-OD1 3.09Å
150	S	39.1	Very low	37.9	Very low	20 Å²	20	78.2 Å²	78.2	14%	0.14	41%	0.414	C	S	.	.	S	Bend	trans	-94.4	144.4	169.2	-172.7	0	0	0	0	109.1	A146 D152	A146-S150 WeakPolarHBondContact O-CB 3.49Å; A146-S150 PolarHBondContact O-N 3.04Å; S150-D152 VanDerWaalsContact C-N 3.26Å; S150-D152 PolarHBondContact O-N 3.12Å
151	F	34.8	Very low	36.3	Very low	98 Å²	98	87.1 Å²	87.1	43%	0.43	44%	0.44	S	S	.	.			trans	-66.2	91.7	168.1	-150.4	-91.8	0	0	0	107.7	T153	F151-T153 PolarHBondContact O-N 2.85Å; F151-T153 VanDerWaalsContact O-N 3.11Å
152	D	26.4	Very low	35.1	Very low	77 Å²	77	88.8 Å²	88.8	41%	0.412	46%	0.457	S	S	.	.			trans	-68	112.1	-177	-143.7	15.3	0	0	0	108.5	S150 S154	S150-D152 VanDerWaalsContact C-N 3.26Å; S150-D152 PolarHBondContact O-N 3.12Å; D152-S154 PolarHBondContact O-N 2.59Å; D152-S154 WeakPolarHBondContact OD2-CB 3.35Å; D152-S154 PolarHBondContact OD2-OG 3.31Å
153	T	33.2	Very low	33.9	Very low	72 Å²	72	99.1 Å²	99.1	44%	0.442	50%	0.496	S	S	.	.			trans	-67.6	21.5	164.8	26.3	0	0	0	0	112.3	F151 A155 Q156	F151-T153 PolarHBondContact O-N 2.85Å; F151-T153 VanDerWaalsContact O-N 3.11Å; T153-A155 PolarHBondContact O-N 2.72Å; T153-Q156 PolarHBondContact O-N 2.72Å
154	S	27.3	Very low	32.6	Very low	58 Å²	58	107.9 Å²	107.9	41%	0.406	53%	0.526	S	S	.	.	G	3₁₀ helix	trans	-52.9	1.6	166.2	-81	0	0	0	0	114.9	D152 Q156 R157	D152-S154 PolarHBondContact O-N 2.59Å; D152-S154 WeakPolarHBondContact OD2-CB 3.35Å; D152-S154 PolarHBondContact OD2-OG 3.31Å; S154-Q156 PolarHBondContact O-N 3.29Å; S154-R157 PolarHBondContact O-N 3.29Å; S154-R157 VanDerWaalsContact O-N 3.1Å
155	A	27.6	Very low	31.3	Very low	76 Å²	76	105.9 Å²	105.9	63%	0.628	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-51.2	-14.7	158.9	0	0	0	0	0	113.9	T153	T153-A155 PolarHBondContact O-N 2.72Å
156	Q	25.5	Very low	30.3	Very low	159 Å²	159	116.3 Å²	116.3	74%	0.743	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-73.8	-19.1	173.3	-141.7	98.3	-0.2	0	0	114.8	T153 S154	T153-Q156 PolarHBondContact O-N 2.72Å; S154-Q156 PolarHBondContact O-N 3.29Å
157	R	24.2	Very low	29	Very low	223 Å²	223	119.1 Å²	119.1	84%	0.842	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-96.5	8.9	-170.4	-81.4	-161.6	-174	145.1	3.3	117.4	S154	S154-R157 PolarHBondContact O-N 3.29Å; S154-R157 VanDerWaalsContact O-N 3.1Å
158	L	23.7	Very low	27.8	Very low	156 Å²	156	123.1 Å²	123.1	82%	0.817	64%	0.644	S	S	*	*			trans	-127.1	26.6	-178.7	-76.5	174.6	0	0	0	115.7	D160	L158-D160 VanDerWaalsContact C-N 3.27Å; L158-D160 PolarHBondContact O-N 3.02Å
159	N	24.1	Very low	26.7	Very low	144 Å²	144	125.6 Å²	125.6	77%	0.77	66%	0.661	S	S	*	*			trans	-79.8	1	177.5	-139.1	11.8	0	0	0	115.5
160	D	23.7	Very low	26	Very low	161 Å²	161	129.7 Å²	129.7	86%	0.861	69%	0.69	S	S	*	*			trans	-109.4	55.8	177.8	-73.6	-31.4	0	0	0	113.4	L158	L158-D160 VanDerWaalsContact C-N 3.27Å; L158-D160 PolarHBondContact O-N 3.02Å
161	R	21.8	Very low	25.2	Very low	237 Å²	237	140.1 Å²	140.1	89%	0.894	73%	0.727	S	S	*	*			trans	-151	62	159.7	-116.5	167.1	170.8	178.1	-3.3	111.5
162	S	22.5	Very low	24.7	Very low	95 Å²	95	141.3 Å²	141.3	66%	0.664	74%	0.738	S	S	*	*			trans	-70.7	150.4	153.4	69.7	0	0	0	0	109.4
163	R	23.9	Very low	24.6	Very low	217 Å²	217	141.2 Å²	141.2	82%	0.819	74%	0.743	S	S	*	*			trans	79.2	90.7	179	-59.1	-178.9	-89	179.4	-7.2	114.7
164	Y	26.1	Very low	24.2	Very low	234 Å²	234	142.3 Å²	142.3	92%	0.918	75%	0.749	S	S	*	*				164.6	132.6	121.9	-87.6	-71.5	0	0	0	110
165	G	25.6	Very low	24	Very low	74 Å²	74	144.4 Å²	144.4	76%	0.763	75%	0.751	S	S	*	*			trans	92	103.3	150.7	0	0	0	0	0	117.7	G167	G165-G167 PolarHBondContact O-N 2.86Å; G165-G167 VanDerWaalsContact O-N 3.14Å
166	K	23.1	Very low	24	Very low	227 Å²	227	142.6 Å²	142.6	99%	0.987	73%	0.734	S	S	*	*			trans	-56.3	108.9	155	-74.2	173.6	174.5	174.3	0	108.7
167	G	22.6	Very low	24.2	Very low	60 Å²	60	137.5 Å²	137.5	62%	0.619	72%	0.716	S	S	*	*			trans	-150.8	114.5	172.4	0	0	0	0	0	108.8	G165 S169	G165-G167 PolarHBondContact O-N 2.86Å; G165-G167 VanDerWaalsContact O-N 3.14Å; G167-S169 PolarHBondContact O-N 3.41Å
168	S	21.9	Very low	24.3	Very low	138 Å²	138	130.7 Å²	130.7	97%	0.965	70%	0.696	S	S	*	*			trans	-62.7	79	174.4	172.5	0	0	0	0	109.8
169	S	22.8	Very low	24.7	Very low	95 Å²	95	125.3 Å²	125.3	66%	0.664	67%	0.674	S	S	*	*			trans	-111	106	176.8	-157.5	0	0	0	0	108.5	G167 R171	G167-S169 PolarHBondContact O-N 3.41Å; S169-R171 VanDerWaalsContact C-N 3.35Å; S169-R171 PolarHBondContact O-N 3.05Å
170	S	25.7	Very low	25.2	Very low	102 Å²	102	123 Å²	123	71%	0.713	66%	0.658	S	S	*	*			trans	-50	97.9	165.7	-171.1	0	0	0	0	108.3	N172	S170-N172 PolarHBondContact O-N 2.93Å; S170-N172 PolarHBondContact O-OD1 3.29Å
171	R	23.1	Very low	25.6	Very low	240 Å²	240	117.2 Å²	117.2	91%	0.906	64%	0.637	S	S	*	*			trans	-75.8	95.1	177.3	-73.2	-175.3	-169.7	170.2	2.6	107.7	S169 S173	S169-R171 VanDerWaalsContact C-N 3.35Å; S169-R171 PolarHBondContact O-N 3.05Å; R171-S173 PolarHBondContact O-N 2.92Å
172	N	23.1	Very low	26	Very low	123 Å²	123	109.1 Å²	109.1	66%	0.658	61%	0.607	S	S	*	*			trans	-48.9	115.5	174.2	-64.1	-22.2	0	0	0	110.4	S170 V174	S170-N172 PolarHBondContact O-N 2.93Å; S170-N172 PolarHBondContact O-OD1 3.29Å; N172-V174 HydrophobicContact CB-CG2 4.29Å; N172-V174 WeakPolarHBondContact O-CG2 3.47Å; N172-V174 PolarHBondContact O-N 3.28Å; N172-V174 VanDerWaalsContact O-N 3.15Å
173	S	26.1	Very low	26.6	Very low	75 Å²	75	106.6 Å²	106.6	52%	0.524	59%	0.585	S	S	.	*			trans	-77.2	96.2	165.6	67.7	0	0	0	0	107.6	R171 F175	R171-S173 PolarHBondContact O-N 2.92Å; S173-F175 PolarHBondContact O-N 3.19Å
174	V	23.6	Very low	27	Very low	95 Å²	95	104 Å²	104	58%	0.576	58%	0.58	S	S	*	*			trans	-76.4	81	-174.8	-167.6	0	0	0	0	109.6	N172 L178	N172-V174 HydrophobicContact CB-CG2 4.29Å; N172-V174 WeakPolarHBondContact O-CG2 3.47Å; N172-V174 PolarHBondContact O-N 3.28Å; N172-V174 VanDerWaalsContact O-N 3.15Å; V174-L178 HydrophobicContact CG1-CD1 3.45Å; V174-L178 VanDerWaalsContact CG1-CD1 3.45Å; V174-L178 HydrophobicContact CG1-CG 4.19Å
175	F	23	Very low	27.1	Very low	102 Å²	102	97.6 Å²	97.6	45%	0.447	57%	0.569	S	S	.	*			trans	-141.2	25.8	-170.1	-110.2	-77.5	0	0	0	118.6	S173	S173-F175 PolarHBondContact O-N 3.19Å
176	S	28.6	Very low	27.2	Very low	37 Å²	37	99.4 Å²	99.4	26%	0.259	56%	0.556	S	S	.	*	S	Bend	trans	-139.3	-45.6	170.7	173.7	0	0	0	0	113	L178 D453	S176-L178 VanDerWaalsContact C-N 3.26Å; S176-L178 PolarHBondContact O-N 3.43Å; S176-D453 VanDerWaalsContact CB-CG 3.49Å; S176-D453 WeakPolarHBondContact CB-OD1 3.43Å; S176-D453 WeakPolarHBondContact CB-OD2 3.25Å; S176-D453 VanDerWaalsContact OG-CG 3.23Å; S176-D453 PolarHBondContact OG-OD1 3.03Å; S176-D453 VanDerWaalsContact OG-OD1 3.12Å; S176-D453 PolarHBondContact OG-OD2 3.32Å
177	S	28.7	Very low	27.6	Very low	53 Å²	53	92.7 Å²	92.7	37%	0.371	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-17.3	-173.8	-167.8	0	0	0	0	114.5	G181	S177-G181 PolarHBondContact O-N 3.21Å
178	L	27.6	Very low	27.8	Very low	80 Å²	80	99 Å²	99	42%	0.419	54%	0.538	S	S	.	.	H	α-helix	trans	-74.7	-37.5	-174.8	-81.5	166.7	0	0	0	113.1	V174 S176 E180 G181 W182	V174-L178 HydrophobicContact CG1-CD1 3.45Å; V174-L178 VanDerWaalsContact CG1-CD1 3.45Å; V174-L178 HydrophobicContact CG1-CG 4.19Å; S176-L178 VanDerWaalsContact C-N 3.26Å; S176-L178 PolarHBondContact O-N 3.43Å; L178-E180 VanDerWaalsContact C-N 3.28Å; L178-E180 PolarHBondContact O-N 2.91Å; L178-E180 VanDerWaalsContact O-N 3.08Å; L178-G181 PolarHBondContact O-N 2.68Å; L178-W182 HydrophobicContact CB-CB 4Å; L178-W182 HydrophobicContact CD2-CB 3.66Å; L178-W182 HydrophobicContact CD2-CG 3.99Å; L178-W182 HydrophobicContact CG-CB 4.44Å; L178-W182 VanDerWaalsContact O-CA 3.31Å; L178-W182 WeakPolarHBondContact O-CA 3.2Å; L178-W182 WeakPolarHBondContact O-CB 3.35Å; L178-W182 PolarHBondContact O-N 2.93Å
179	A	31.8	Very low	27.8	Very low	43 Å²	43	102.5 Å²	102.5	36%	0.355	53%	0.53	S	S	.	.	H	α-helix	trans	-57.3	-38.7	-171.6	0	0	0	0	0	113.6	L183	A179-L183 WeakPolarHBondContact O-CB 3.38Å; A179-L183 WeakPolarHBondContact O-CD1 3.48Å; A179-L183 VanDerWaalsContact O-CG 3.26Å; A179-L183 WeakPolarHBondContact O-CG 3.34Å
180	E	34.5	Very low	27.8	Very low	95 Å²	95	104.3 Å²	104.3	44%	0.444	54%	0.536	S	S	.	.	H	α-helix	trans	-84.4	-46.3	176.8	-72.4	-178.5	-153.9	0	0	113.5	L178 K184	L178-E180 VanDerWaalsContact C-N 3.28Å; L178-E180 PolarHBondContact O-N 2.91Å; L178-E180 VanDerWaalsContact O-N 3.08Å; E180-K184 PolarHBondContact O-N 3.23Å
181	G	31.3	Very low	27.6	Very low	40 Å²	40	105 Å²	105	41%	0.412	54%	0.537	S	S	.	.	H	α-helix	trans	-73.6	-33.3	-177.7	0	0	0	0	0	113.7	S177 L178 K184 S185	S177-G181 PolarHBondContact O-N 3.21Å; L178-G181 PolarHBondContact O-N 2.68Å; G181-K184 PolarHBondContact O-N 3.34Å; G181-S185 VanDerWaalsContact O-CB 3.27Å; G181-S185 WeakPolarHBondContact O-CB 3.38Å; G181-S185 PolarHBondContact O-N 2.78Å
182	W	30.6	Very low	27.5	Very low	67 Å²	67	101.1 Å²	101.1	25%	0.254	53%	0.532	S	S	.	.	H	α-helix	trans	-76.9	-39.6	-179.5	-173.8	80.2	0	0	0	112.4	R144 L178 K184 S185 K186	R144-W182 HydrophobicContact CB-CH2 3.75Å; R144-W182 HydrophobicContact CB-CZ2 4.46Å; R144-W182 WeakPolarHBondContact O-CH2 3.41Å; L178-W182 HydrophobicContact CB-CB 4Å; L178-W182 HydrophobicContact CD2-CB 3.66Å; L178-W182 HydrophobicContact CD2-CG 3.99Å; L178-W182 HydrophobicContact CG-CB 4.44Å; L178-W182 VanDerWaalsContact O-CA 3.31Å; L178-W182 WeakPolarHBondContact O-CA 3.2Å; L178-W182 WeakPolarHBondContact O-CB 3.35Å; L178-W182 PolarHBondContact O-N 2.93Å; W182-K184 PolarHBondContact O-N 3.49Å; W182-S185 PolarHBondContact O-N 3.28Å; W182-K186 PolarHBondContact O-N 3.43Å
183	L	34.7	Very low	27.4	Very low	41 Å²	41	98.8 Å²	98.8	22%	0.215	54%	0.537	C	S	.	.	H	α-helix	trans	-64.4	-23.5	168.2	-76.3	177.3	0	0	0	111.4	V145 A179 F187	V145-L183 HydrophobicContact CG2-CD2 4.03Å; A179-L183 WeakPolarHBondContact O-CB 3.38Å; A179-L183 WeakPolarHBondContact O-CD1 3.48Å; A179-L183 VanDerWaalsContact O-CG 3.26Å; A179-L183 WeakPolarHBondContact O-CG 3.34Å; L183-F187 HydrophobicContact CB-CE2 4.45Å; L183-F187 HydrophobicContact CD2-CE2 3.72Å; L183-F187 HydrophobicContact CD2-CZ 4.29Å; L183-F187 WeakPolarHBondContact O-CD2 3.39Å; L183-F187 VanDerWaalsContact O-CE2 3.31Å; L183-F187 WeakPolarHBondContact O-CE2 3.3Å; L183-F187 WeakPolarHBondContact O-CG 3.46Å
184	K	31.8	Very low	27.2	Very low	163 Å²	163	107 Å²	107	71%	0.709	56%	0.556	S	S	*	*	H	α-helix	trans	-83.7	-37.1	169.7	-72.5	-179.2	-179.1	176.3	0	112.8	E180 G181 W182 F187	E180-K184 PolarHBondContact O-N 3.23Å; G181-K184 PolarHBondContact O-N 3.34Å; W182-K184 PolarHBondContact O-N 3.49Å; K184-F187 PolarHBondContact O-N 2.92Å
185	S	29.5	Very low	27	Very low	99 Å²	99	107.9 Å²	107.9	69%	0.692	57%	0.567	S	S	*	*	H	α-helix	trans	-69.1	-38.8	-171.7	-168.9	0	0	0	0	113.5	G181 W182	G181-S185 VanDerWaalsContact O-CB 3.27Å; G181-S185 WeakPolarHBondContact O-CB 3.38Å; G181-S185 PolarHBondContact O-N 2.78Å; W182-S185 PolarHBondContact O-N 3.28Å
186	K	26.7	Very low	26.9	Very low	113 Å²	113	113.1 Å²	113.1	49%	0.491	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-85.6	-10.5	179.6	-140.6	-173.1	-75.3	-177.5	0	114.4	W182 K188	W182-K186 PolarHBondContact O-N 3.43Å; K186-K188 VanDerWaalsContact C-N 3.34Å; K186-K188 PolarHBondContact O-N 3.3Å
187	F	33	Very low	26.7	Very low	85 Å²	85	116 Å²	116	37%	0.373	61%	0.61	S	S	.	*	G	3₁₀ helix	trans	-86.2	-0.9	-178	-79.6	-104.2	0	0	0	114.3	L183 K184 L393	L183-F187 HydrophobicContact CB-CE2 4.45Å; L183-F187 HydrophobicContact CD2-CE2 3.72Å; L183-F187 HydrophobicContact CD2-CZ 4.29Å; L183-F187 WeakPolarHBondContact O-CD2 3.39Å; L183-F187 VanDerWaalsContact O-CE2 3.31Å; L183-F187 WeakPolarHBondContact O-CE2 3.3Å; L183-F187 WeakPolarHBondContact O-CG 3.46Å; K184-F187 PolarHBondContact O-N 2.92Å; F187-L393 HydrophobicContact CE1-CD2 4.15Å; F187-L393 HydrophobicContact CZ-CD2 3.63Å
188	K	26.3	Very low	26.5	Very low	194 Å²	194	121 Å²	121	84%	0.843	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-87.1	5.3	-179.1	-122.2	-179.6	-174.5	-179.4	0	115.6	K186	K186-K188 VanDerWaalsContact C-N 3.34Å; K186-K188 PolarHBondContact O-N 3.3Å
189	R	21.3	Very low	26.2	Very low	211 Å²	211	125.7 Å²	125.7	80%	0.796	65%	0.65	S	S	*	*			trans	-154.7	72.7	-178.7	-152.3	176.6	-67.6	170.2	-1.1	114	T191	R189-T191 WeakPolarHBondContact CG-OG1 3.48Å
190	V	22.6	Very low	25.8	Very low	132 Å²	132	128.7 Å²	128.7	80%	0.8	67%	0.668	S	S	*	*			trans	-107.1	71.8	150	-176.5	0	0	0	0	106.3	I192	V190-I192 PolarHBondContact O-N 3.15Å
191	T	21.9	Very low	25.1	Very low	118 Å²	118	129.6 Å²	129.6	72%	0.724	69%	0.685	S	S	*	*			trans	-78.8	109.9	162.4	-0.2	0	0	0	0	106	R189 G193	R189-T191 WeakPolarHBondContact CG-OG1 3.48Å; T191-G193 PolarHBondContact O-N 3.01Å; T191-G193 VanDerWaalsContact O-N 3.11Å
192	I	22.1	Very low	24.8	Very low	158 Å²	158	138.4 Å²	138.4	81%	0.81	71%	0.706	S	S	*	*			trans	-48.1	117.3	172.2	-68.9	163.5	0	0	0	107.9	V190 R194	V190-I192 PolarHBondContact O-N 3.15Å; I192-R194 PolarHBondContact O-N 3.33Å
193	G	20.3	Very low	24.4	Very low	73 Å²	73	142.7 Å²	142.7	75%	0.753	73%	0.729	S	S	*	*			trans	-59.2	108.8	-178.2	0	0	0	0	0	110	T191	T191-G193 PolarHBondContact O-N 3.01Å; T191-G193 VanDerWaalsContact O-N 3.11Å
194	R	20.9	Very low	23.8	Very low	247 Å²	247	151 Å²	151	93%	0.932	76%	0.757	S	S	*	*			trans	-78.5	123.8	165.6	-153	172.2	-175.1	176.8	0.2	107.1	I192	I192-R194 PolarHBondContact O-N 3.33Å
195	S	20.2	Very low	23.4	Very low	114 Å²	114	148.6 Å²	148.6	80%	0.797	76%	0.761	S	S	*	*			trans	-46.6	149.2	-177.9	-86.1	0	0	0	0	114.9	S197	S195-S197 PolarHBondContact O-N 3.38Å
196	K	21.9	Very low	23.1	Very low	213 Å²	213	152.5 Å²	152.5	93%	0.926	77%	0.773	S	S	*	*			trans	-45.1	123.5	174.6	-59.5	167.9	178.8	173	0	112.4
197	S	23.4	Very low	22.9	Very low	98 Å²	98	155.2 Å²	155.2	69%	0.685	79%	0.788	S	S	*	*			trans	-148.7	113.5	153.6	69.1	0	0	0	0	111.6	S195	S195-S197 PolarHBondContact O-N 3.38Å
198	I	25	Very low	22.4	Very low	156 Å²	156	158 Å²	158	80%	0.8	81%	0.806	S	S	*	*			trans	70.5	107.4	136.5	-53.6	165.4	0	0	0	118
199	Q	21.7	Very low	22.4	Very low	179 Å²	179	157.4 Å²	157.4	84%	0.836	81%	0.811	S	S	*	*			trans	1.6	133.6	141.8	-67.5	163.4	-49.8	0	0	118.3
200	S	22.7	Very low	22.4	Very low	106 Å²	106	151.8 Å²	151.8	74%	0.741	81%	0.805	S	S	*	*				159.8	123.2	113.4	-178.9	0	0	0	0	111.7
201	S	20.4	Very low	22.3	Very low	115 Å²	115	150.7 Å²	150.7	80%	0.804	80%	0.803	S	S	*	*			trans	-65.5	121.1	172.5	-55.2	0	0	0	0	112.7
202	R	23.9	Very low	22.3	Very low	225 Å²	225	154.6 Å²	154.6	85%	0.849	81%	0.806	S	S	*	*			trans	-147.2	104	155.3	-72.9	-170.8	179.5	133.1	-1	107.4
203	H	21.9	Very low	22.2	Very low	157 Å²	157	152.3 Å²	152.3	73%	0.727	80%	0.804	S	S	*	*				63.6	116.5	95.4	-94.7	-86.1	0	0	0	116.4
204	R	23.4	Very low	22.5	Very low	214 Å²	214	155.2 Å²	155.2	81%	0.808	80%	0.801	S	S	*	*			trans	75.5	111.1	140.7	-70.3	179.2	178.6	168.8	-0.7	120.7
205	S	22.3	Very low	22.7	Very low	113 Å²	113	150.4 Å²	150.4	79%	0.79	79%	0.794	S	S	*	*				21.6	117.8	129.7	-47	0	0	0	0	119.2
206	L	23.8	Very low	22.7	Very low	181 Å²	181	153.5 Å²	153.5	95%	0.948	80%	0.795	S	S	*	*			trans	-124.7	96.4	149.6	-82.4	169.2	0	0	0	107.6
207	E	22.3	Very low	22.7	Very low	171 Å²	171	149.2 Å²	149.2	80%	0.799	79%	0.787	S	S	*	*			trans	-79	158.9	155.2	-69.9	-170.8	160	0	0	109.3
208	N	23.2	Very low	22.9	Very low	143 Å²	143	150.2 Å²	150.2	77%	0.765	79%	0.788	S	S	*	*			trans	72.5	90.9	166.6	-80.1	-24.8	0	0	0	118.6
209	L	24.7	Very low	22.7	Very low	181 Å²	181	149.1 Å²	149.1	95%	0.948	79%	0.789	S	S	*	*				-111.7	105.9	129.3	-77.3	171.5	0	0	0	108.4
210	S	22.6	Very low	23.1	Very low	94 Å²	94	146.7 Å²	146.7	66%	0.657	79%	0.787	S	S	*	*			trans	-62.8	147.3	175.7	54.1	0	0	0	0	112.5
211	S	19.5	Very low	23.1	Very low	109 Å²	109	147.7 Å²	147.7	76%	0.762	79%	0.788	S	S	*	*			trans	-20.5	127.2	152.8	53.3	0	0	0	0	116.1
212	Y	22.3	Very low	23.7	Very low	200 Å²	200	147.5 Å²	147.5	78%	0.784	79%	0.785	S	S	*	*			trans	-133.7	107.9	156.2	-159.9	-115	0	0	0	108.3	I214	Y212-I214 HydrophobicContact CD1-CD1 3.69Å; Y212-I214 HydrophobicContact CD1-CG1 3.53Å; Y212-I214 HydrophobicContact CE1-CD1 3.28Å; Y212-I214 HydrophobicContact CE1-CG1 3.27Å
213	S	21	Very low	24.1	Very low	110 Å²	110	148.6 Å²	148.6	77%	0.769	79%	0.789	S	S	*	*			trans	-95.2	129.2	170.2	-69.9	0	0	0	0	108.1
214	I	25.7	Very low	24.3	Very low	134 Å²	134	147.5 Å²	147.5	69%	0.687	79%	0.793	S	S	*	*			trans	-120.7	130.4	171	-55.2	176.4	0	0	0	108.3	Y212	Y212-I214 HydrophobicContact CD1-CD1 3.69Å; Y212-I214 HydrophobicContact CD1-CG1 3.53Å; Y212-I214 HydrophobicContact CE1-CD1 3.28Å; Y212-I214 HydrophobicContact CE1-CG1 3.27Å
215	N	24.8	Very low	24.9	Very low	146 Å²	146	143 Å²	143	78%	0.781	79%	0.791	S	S	*	*			trans	-77.1	145.1	-178.8	-63.4	-38.3	0	0	0	113.1
216	E	20.3	Very low	25.2	Very low	178 Å²	178	142.2 Å²	142.2	83%	0.832	79%	0.792	S	S	*	*			trans	21.8	132.7	139.2	-75.6	-172.1	171.7	0	0	123.5
217	V	22.2	Very low	25.6	Very low	123 Å²	123	141.4 Å²	141.4	75%	0.745	79%	0.789	S	S	*	*			trans	82	113.5	134.2	174.5	0	0	0	0	118.5
218	V	27.2	Very low	26	Very low	119 Å²	119	141.2 Å²	141.2	72%	0.721	79%	0.793	S	S	*	*				172.8	126.3	112.9	164.8	0	0	0	0	108.8	T220	V218-T220 HydrophobicContact CG1-CG2 4.45Å
219	T	20.7	Very low	26.4	Very low	133 Å²	133	137.7 Å²	137.7	82%	0.816	79%	0.791	S	S	*	*			trans	-84.7	121.5	171.9	-62.6	0	0	0	0	110.5
220	T	29.5	Very low	26.6	Very low	128 Å²	128	134.7 Å²	134.7	79%	0.785	79%	0.785	S	S	*	*			trans	-148.6	110.3	156	48.5	0	0	0	0	111.4	V218	V218-T220 HydrophobicContact CG1-CG2 4.45Å
221	T	23.7	Very low	27	Very low	127 Å²	127	134.9 Å²	134.9	78%	0.779	79%	0.792	S	S	*	*			trans	-78.6	172.4	153.1	47.3	0	0	0	0	109.5
222	P	33.7	Very low	27.4	Very low	112 Å²	112	137.4 Å²	137.4	73%	0.727	80%	0.796	S	S	*	*			cis	-132.1	166.8	-14.8	36.7	-19.4	0	0	0	113.3
223	R	31.2	Very low	27.8	Very low	248 Å²	248	134.3 Å²	134.3	94%	0.936	80%	0.798	S	S	*	*			trans	-166.8	147.3	143.6	-114	174.3	-106.2	-130.6	2.4	113.2
224	T	27.4	Very low	28.3	Very low	134 Å²	134	134.5 Å²	134.5	82%	0.822	79%	0.794	S	S	*	*			trans	-70.2	174.6	-167.1	25.1	0	0	0	0	116.2
225	P	34.6	Very low	28.4	Very low	118 Å²	118	133 Å²	133	77%	0.766	79%	0.793	S	S	*	*			trans	-104.8	161.4	-145.9	41	-34.5	0	0	0	114
226	A	28.6	Very low	28.7	Very low	97 Å²	97	137.8 Å²	137.8	80%	0.802	80%	0.8	S	S	*	*			trans	159.3	110.1	137.3	0	0	0	0	0	108.4
227	D	32.4	Very low	29.3	Very low	164 Å²	164	138.5 Å²	138.5	88%	0.877	80%	0.801	S	S	*	*			trans	-157.1	132.1	133.2	-136.9	-12.8	0	0	0	112.1
228	N	30	Very low	29.9	Very low	168 Å²	168	137.2 Å²	137.2	90%	0.898	80%	0.804	S	S	*	*			trans	-86.6	111.5	178.7	-71.7	-44.2	0	0	0	107.9
229	G	32	Very low	30.3	Very low	69 Å²	69	137.1 Å²	137.1	71%	0.711	81%	0.808	S	S	*	*			trans	-154.4	93.4	179.9	0	0	0	0	0	113.6
230	S	30	Very low	30.8	Very low	118 Å²	118	136.6 Å²	136.6	83%	0.825	81%	0.808	S	S	*	*			trans	44	81.2	153.7	-66	0	0	0	0	117.9	L232	S230-L232 PolarHBondContact O-N 2.89Å
231	A	30	Very low	31.3	Very low	98 Å²	98	135.3 Å²	135.3	81%	0.81	80%	0.804	S	S	*	*			trans	-67.2	99.6	159.7	0	0	0	0	0	109.5	V233	A231-V233 PolarHBondContact O-N 3Å
232	L	28.4	Very low	32.1	Very low	162 Å²	162	138.1 Å²	138.1	85%	0.848	81%	0.806	S	S	*	*			trans	-55.6	109.7	165.1	-83.1	156.7	0	0	0	108.8	S230 V234	S230-L232 PolarHBondContact O-N 2.89Å; L232-V234 VanDerWaalsContact C-N 3.34Å; L232-V234 PolarHBondContact O-N 3.49Å
233	V	31.4	Very low	32.5	Very low	135 Å²	135	137.5 Å²	137.5	82%	0.818	80%	0.802	S	S	*	*			trans	-67.4	93.3	174.3	178	0	0	0	0	108	A231 P235	A231-V233 PolarHBondContact O-N 3Å; V233-P235 WeakPolarHBondContact O-CD 3.5Å
234	V	30.1	Very low	33.3	Very low	114 Å²	114	135.7 Å²	135.7	69%	0.691	80%	0.795	S	S	*	*			trans	-71.1	119.6	168.3	-178.8	0	0	0	0	107.2	L232 R236	L232-V234 VanDerWaalsContact C-N 3.34Å; L232-V234 PolarHBondContact O-N 3.49Å; V234-R236 PolarHBondContact O-N 3.07Å; V234-R236 VanDerWaalsContact O-N 3.08Å
235	P	28.4	Very low	34.4	Very low	103 Å²	103	133.5 Å²	133.5	67%	0.669	78%	0.777	S	S	*	*			trans	-62.2	117.9	178.7	-15.5	28.6	0	0	0	108.3	V233 F237	V233-P235 WeakPolarHBondContact O-CD 3.5Å; P235-F237 PolarHBondContact O-N 3.04Å
236	R	30.3	Very low	35.3	Very low	246 Å²	246	132.7 Å²	132.7	93%	0.928	76%	0.762	S	S	*	*			trans	-58.6	107.6	169.1	-90.2	-179.4	172.9	145.9	-1.7	107.2	V234 A238	V234-R236 PolarHBondContact O-N 3.07Å; V234-R236 VanDerWaalsContact O-N 3.08Å; R236-A238 PolarHBondContact O-N 2.84Å
237	F	32.4	Very low	36.4	Very low	192 Å²	192	131.3 Å²	131.3	84%	0.842	75%	0.745	S	S	*	*			trans	-46.7	116.4	165.5	-71	-85.4	0	0	0	107.6	P235 S239	P235-F237 PolarHBondContact O-N 3.04Å; F237-S239 PolarHBondContact O-N 3.31Å
238	A	36.1	Very low	37.6	Very low	97 Å²	97	128.2 Å²	128.2	80%	0.802	73%	0.728	S	S	*	*			trans	-49.8	110	175.6	0	0	0	0	0	107.1	R236 C240	R236-A238 PolarHBondContact O-N 2.84Å; A238-C240 PolarHBondContact O-N 3.13Å
239	S	34.8	Very low	39	Very low	116 Å²	116	121.2 Å²	121.2	81%	0.811	69%	0.693	S	S	*	*			trans	-57	113.2	176.7	-154.6	0	0	0	0	105.5	F237 S241	F237-S239 PolarHBondContact O-N 3.31Å; S239-S241 VanDerWaalsContact C-N 3.32Å; S239-S241 PolarHBondContact O-N 2.89Å
240	C	31.4	Very low	40.4	Very low	122 Å²	122	120.8 Å²	120.8	82%	0.824	68%	0.676	S	S	*	*			trans	-53	101.5	179.1	-177.4	0	0	0	0	106.8	A238 K242	A238-C240 PolarHBondContact O-N 3.13Å; C240-K242 PolarHBondContact O-N 2.62Å
241	S	39.9	Very low	42.1	Very low	101 Å²	101	119.5 Å²	119.5	71%	0.706	66%	0.66	S	S	*	*			trans	-60.4	114.8	-176.2	50.3	0	0	0	0	106.1	S239	S239-S241 VanDerWaalsContact C-N 3.32Å; S239-S241 PolarHBondContact O-N 2.89Å
242	K	40.8	Very low	43.9	Very low	186 Å²	186	115.9 Å²	115.9	81%	0.809	63%	0.626	S	S	*	*			trans	-44.5	130.7	164	-74.7	179.4	177.7	175.8	0	106.2	C240 R244	C240-K242 PolarHBondContact O-N 2.62Å; K242-R244 PolarHBondContact O-N 2.83Å; K242-R244 VanDerWaalsContact O-N 3.11Å
243	P	42.7	Very low	45.9	Very low	99 Å²	99	108.5 Å²	108.5	64%	0.643	59%	0.588	S	S	*	*			trans	-47.7	129.1	178.8	19	-30.2	0	0	0	107.3	M245	P243-M245 PolarHBondContact O-N 3.36Å; P243-M245 VanDerWaalsContact O-N 3.11Å
244	R	46.9	Very low	47.7	Very low	211 Å²	211	106.8 Å²	106.8	80%	0.796	57%	0.573	S	S	*	*			trans	-46.2	127.8	176.2	-74.2	-179.8	178	158.1	-0.8	105.6	K242 E246 P247	K242-R244 PolarHBondContact O-N 2.83Å; K242-R244 VanDerWaalsContact O-N 3.11Å; R244-E246 PolarHBondContact O-N 3.45Å; R244-P247 WeakPolarHBondContact O-CD 3.22Å
245	M	51.5	Low	49.9	Very low	88 Å²	88	103.6 Å²	103.6	43%	0.433	55%	0.551	S	S	.	*	H	α-helix	trans	-72.4	-15.2	-173.4	-61.2	-159.1	80.9	0	0	112.2	P243 L248 C249 G401	P243-M245 PolarHBondContact O-N 3.36Å; P243-M245 VanDerWaalsContact O-N 3.11Å; M245-L248 PolarHBondContact O-N 3.06Å; M245-C249 PolarHBondContact O-N 3.46Å; M245-G401 VanDerWaalsContact CE-C 3.41Å; M245-G401 WeakPolarHBondContact CE-O 3.41Å
246	E	52.3	Low	52.3	Low	100 Å²	100	98.9 Å²	98.9	47%	0.467	52%	0.521	S	S	.	.	H	α-helix	trans	-63.4	-46.9	-176.4	-63.6	-178.5	160.2	0	0	114.5	R244 L248 C249 V250 V321 K322	R244-E246 PolarHBondContact O-N 3.45Å; E246-L248 VanDerWaalsContact C-N 3.29Å; E246-L248 PolarHBondContact O-N 2.69Å; E246-C249 PolarHBondContact O-N 3.07Å; E246-V250 PolarHBondContact O-N 3.07Å; E246-V321 HydrophobicContact CB-CG1 4.14Å; E246-V321 VanDerWaalsContact O-CG1 3.32Å; E246-V321 WeakPolarHBondContact O-CG1 3.33Å; E246-K322 WeakPolarHBondContact OE1-CE 3.49Å; E246-K322 IonicContact OE1-NZ 3.85Å
247	P	51.6	Low	54.8	Low	68 Å²	68	87.4 Å²	87.4	44%	0.442	48%	0.478	S	S	.	.	H	α-helix	trans	-58.7	-40.6	175	-19.5	34.2	0	0	0	111.8	R244 C249 V250 D251	R244-P247 WeakPolarHBondContact O-CD 3.22Å; P247-C249 VanDerWaalsContact C-N 3.28Å; P247-C249 PolarHBondContact O-N 2.64Å; P247-V250 PolarHBondContact O-N 3.04Å; P247-D251 VanDerWaalsContact O-CB 3.26Å; P247-D251 WeakPolarHBondContact O-CB 3.43Å; P247-D251 PolarHBondContact O-N 2.63Å
248	L	58.9	Low	57.3	Low	99 Å²	99	83.9 Å²	83.9	52%	0.518	46%	0.462	S	S	.	.	H	α-helix	trans	-60.5	-35.1	-179.5	-70.5	168.2	0	0	0	112.7	M245 E246 M252	M245-L248 PolarHBondContact O-N 3.06Å; E246-L248 VanDerWaalsContact C-N 3.29Å; E246-L248 PolarHBondContact O-N 2.69Å; L248-M252 VanDerWaalsContact O-CB 3.23Å; L248-M252 WeakPolarHBondContact O-CB 3.25Å; L248-M252 PolarHBondContact O-N 3.14Å
249	C	59.8	Low	59.8	Low	22 Å²	22	81.3 Å²	81.3	15%	0.149	44%	0.437	C	S	.	.	H	α-helix	trans	-77.5	-41.4	-177	-154.7	0	0	0	0	112.7	M245 E246 P247 M252 S253 V321	M245-C249 PolarHBondContact O-N 3.46Å; E246-C249 PolarHBondContact O-N 3.07Å; P247-C249 VanDerWaalsContact C-N 3.28Å; P247-C249 PolarHBondContact O-N 2.64Å; C249-M252 PolarHBondContact O-N 3.02Å; C249-S253 PolarHBondContact O-N 2.96Å; C249-V321 HydrophobicContact CB-CG1 4.27Å; C249-V321 PolarHBondContact SG-O 3.43Å
250	V	60	Low	62.6	Low	60 Å²	60	75.8 Å²	75.8	36%	0.364	40%	0.398	S	S	.	.	H	α-helix	trans	-64	-47.4	174	-174.3	0	0	0	0	110.5	E246 P247 M252 S253 M254 V321	E246-V250 PolarHBondContact O-N 3.07Å; P247-V250 PolarHBondContact O-N 3.04Å; V250-M252 PolarHBondContact O-N 3.45Å; V250-S253 PolarHBondContact O-N 2.79Å; V250-M254 PolarHBondContact O-N 3.38Å; V250-M254 VanDerWaalsContact O-N 3.15Å; V250-V321 HydrophobicContact CG2-CB 3.84Å; V250-V321 HydrophobicContact CG2-CG1 3.31Å; V250-V321 HydrophobicContact CG2-CG2 3.34Å
251	D	67.1	Low	65.6	Low	90 Å²	90	76.5 Å²	76.5	48%	0.481	38%	0.383	S	S	.	.	H	α-helix	trans	-57.4	-42.2	177.3	-69.3	-20.4	0	0	0	109.6	P247 S253 M254 I255	P247-D251 VanDerWaalsContact O-CB 3.26Å; P247-D251 WeakPolarHBondContact O-CB 3.43Å; P247-D251 PolarHBondContact O-N 2.63Å; D251-S253 PolarHBondContact O-N 3.1Å; D251-M254 PolarHBondContact O-N 3.35Å; D251-I255 HydrophobicContact CB-CD1 4.43Å; D251-I255 WeakPolarHBondContact O-CB 3.5Å; D251-I255 WeakPolarHBondContact O-CD1 3.28Å; D251-I255 WeakPolarHBondContact O-CG1 3.37Å; D251-I255 PolarHBondContact O-N 3.48Å
252	M	67.7	Low	68.1	Low	22 Å²	22	75.2 Å²	75.2	11%	0.108	37%	0.374	C	S	.	.	H	α-helix	trans	-65.4	-39.8	179.3	-159.4	67.4	-174	0	0	113.3	L248 C249 V250 M254 I255 V256 M394 Q397 L398	L248-M252 VanDerWaalsContact O-CB 3.23Å; L248-M252 WeakPolarHBondContact O-CB 3.25Å; L248-M252 PolarHBondContact O-N 3.14Å; C249-M252 PolarHBondContact O-N 3.02Å; V250-M252 PolarHBondContact O-N 3.45Å; M252-M254 PolarHBondContact O-N 3.07Å; M252-I255 PolarHBondContact O-N 2.85Å; M252-V256 VanDerWaalsContact O-CG2 3.26Å; M252-V256 WeakPolarHBondContact O-CG2 3.38Å; M252-V256 PolarHBondContact O-N 3.43Å; M252-M394 HydrophobicContact CE-CB 3.81Å; M252-M394 HydrophobicContact CE-CG 3.82Å; M252-Q397 HydrophobicContact CE-CB 4.16Å; M252-L398 HydrophobicContact CB-CD2 3.99Å; M252-L398 HydrophobicContact CG-CD2 3.58Å; M252-L398 HydrophobicContact CG-CG 4Å
253	S	69.6	Low	70.8	Confident	8 Å²	8	66.9 Å²	66.9	6%	0.056	34%	0.338	C	S	.	.	H	α-helix	trans	-58.9	-48.6	175	-167.4	0	0	0	0	111.5	C249 V250 D251 I255 V256 S257 C317	C249-S253 PolarHBondContact O-N 2.96Å; V250-S253 PolarHBondContact O-N 2.79Å; D251-S253 PolarHBondContact O-N 3.1Å; S253-I255 VanDerWaalsContact C-N 3.31Å; S253-I255 PolarHBondContact O-N 3.28Å; S253-V256 PolarHBondContact O-N 3.34Å; S253-S257 PolarHBondContact O-N 2.77Å; S253-S257 PolarHBondContact O-OG 3.03Å; S253-C317 PolarHBondContact OG-SG 2.78Å
254	M	69.9	Low	73.4	Confident	99 Å²	99	62.7 Å²	62.7	49%	0.488	31%	0.31	S	S	.	.	H	α-helix	trans	-62.5	-39.9	177.3	-76.2	-64.9	-69.2	0	0	111.4	V250 D251 M252 S257 K258	V250-M254 PolarHBondContact O-N 3.38Å; V250-M254 VanDerWaalsContact O-N 3.15Å; D251-M254 PolarHBondContact O-N 3.35Å; M252-M254 PolarHBondContact O-N 3.07Å; M254-S257 PolarHBondContact O-N 3.15Å; M254-K258 VanDerWaalsContact O-CB 3.29Å; M254-K258 WeakPolarHBondContact O-CB 3.49Å; M254-K258 VanDerWaalsContact O-CG 3.29Å; M254-K258 WeakPolarHBondContact O-CG 3.41Å; M254-K258 PolarHBondContact O-N 3.48Å
255	I	76.3	Confident	75.9	Confident	47 Å²	47	55.3 Å²	55.3	24%	0.241	30%	0.295	C	S	.	.	H	α-helix	trans	-64.4	-45.4	176.2	-69.7	164.6	0	0	0	111.2	Y131 D251 M252 S253 S257 K258 T259	Y131-I255 WeakPolarHBondContact OH-CG1 3.43Å; D251-I255 HydrophobicContact CB-CD1 4.43Å; D251-I255 WeakPolarHBondContact O-CB 3.5Å; D251-I255 WeakPolarHBondContact O-CD1 3.28Å; D251-I255 WeakPolarHBondContact O-CG1 3.37Å; D251-I255 PolarHBondContact O-N 3.48Å; M252-I255 PolarHBondContact O-N 2.85Å; S253-I255 VanDerWaalsContact C-N 3.31Å; S253-I255 PolarHBondContact O-N 3.28Å; I255-S257 VanDerWaalsContact C-N 3.34Å; I255-S257 PolarHBondContact O-N 2.93Å; I255-K258 PolarHBondContact O-N 3.24Å; I255-T259 HydrophobicContact CG2-CG2 4.16Å; I255-T259 WeakPolarHBondContact O-CB 3.41Å; I255-T259 WeakPolarHBondContact O-CG2 3.13Å; I255-T259 PolarHBondContact O-N 3.3Å; I255-T259 PolarHBondContact O-OG1 3.25Å; I255-T259 VanDerWaalsContact O-OG1 3.04Å
256	V	78.3	Confident	78	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.024	28%	0.282	C	S	.	.	H	α-helix	trans	-57.9	-50.5	177.6	169.9	0	0	0	0	109.6	M252 S253 T259 E260 L313 M394	M252-V256 VanDerWaalsContact O-CG2 3.26Å; M252-V256 WeakPolarHBondContact O-CG2 3.38Å; M252-V256 PolarHBondContact O-N 3.43Å; S253-V256 PolarHBondContact O-N 3.34Å; V256-T259 PolarHBondContact O-N 3.47Å; V256-T259 PolarHBondContact O-OG1 3.11Å; V256-E260 VanDerWaalsContact O-CB 3.27Å; V256-E260 WeakPolarHBondContact O-CB 2.88Å; V256-E260 PolarHBondContact O-N 2.85Å; V256-L313 HydrophobicContact CG1-CD1 4.18Å; V256-L313 HydrophobicContact CG1-CD2 4.34Å; V256-M394 HydrophobicContact CG2-SD 4.01Å
257	S	82.3	Confident	80.2	Confident	5 Å²	5	47.6 Å²	47.6	4%	0.035	26%	0.26	C	S	.	.	H	α-helix	trans	-65.5	-41	179.7	-70.5	0	0	0	0	113.4	S253 M254 I255 E260 R261 C317	S253-S257 PolarHBondContact O-N 2.77Å; S253-S257 PolarHBondContact O-OG 3.03Å; M254-S257 PolarHBondContact O-N 3.15Å; I255-S257 VanDerWaalsContact C-N 3.34Å; I255-S257 PolarHBondContact O-N 2.93Å; S257-E260 WeakPolarHBondContact O-CB 3.41Å; S257-E260 PolarHBondContact O-N 3.24Å; S257-R261 WeakPolarHBondContact O-CG 3.31Å; S257-R261 PolarHBondContact O-N 3.28Å; S257-C317 PolarHBondContact OG-SG 2.83Å
258	K	84.8	Confident	82.4	Confident	118 Å²	118	48.4 Å²	48.4	51%	0.513	26%	0.257	S	S	.	.	H	α-helix	trans	-64.7	-46.9	176.1	-78.7	-175.6	175.3	-167.8	0	111.6	M254 I255 E260 R261 S262	M254-K258 VanDerWaalsContact O-CB 3.29Å; M254-K258 WeakPolarHBondContact O-CB 3.49Å; M254-K258 VanDerWaalsContact O-CG 3.29Å; M254-K258 WeakPolarHBondContact O-CG 3.41Å; M254-K258 PolarHBondContact O-N 3.48Å; I255-K258 PolarHBondContact O-N 3.24Å; K258-E260 PolarHBondContact O-N 3.48Å; K258-R261 PolarHBondContact O-N 3.42Å; K258-S262 PolarHBondContact O-N 2.91Å; K258-S262 VanDerWaalsContact O-N 3.13Å
259	T	88.5	Confident	84.3	Confident	42 Å²	42	46.1 Å²	46.1	26%	0.258	24%	0.242	S	C	.	.	H	α-helix	trans	-66.9	-29.4	178.1	65.4	0	0	0	0	111.9	I255 V256 Y263 R387	I255-T259 HydrophobicContact CG2-CG2 4.16Å; I255-T259 WeakPolarHBondContact O-CB 3.41Å; I255-T259 WeakPolarHBondContact O-CG2 3.13Å; I255-T259 PolarHBondContact O-N 3.3Å; I255-T259 PolarHBondContact O-OG1 3.25Å; I255-T259 VanDerWaalsContact O-OG1 3.04Å; V256-T259 PolarHBondContact O-N 3.47Å; V256-T259 PolarHBondContact O-OG1 3.11Å; T259-Y263 WeakPolarHBondContact O-CB 3.49Å; T259-Y263 PolarHBondContact O-N 3.27Å; T259-R387 PolarHBondContact O-NH1 3.45Å; T259-R387 PolarHBondContact OG1-NH1 2.93Å; T259-R387 VanDerWaalsContact OG1-NH1 3.16Å; T259-R387 PolarHBondContact OG1-NH2 3.15Å
260	E	93.5	Very high	86.1	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.7	-48.9	173.4	-174	60.9	-157.8	0	0	111.7	V256 S257 K258 S262 Y263 V264 H305 L310 L313 R387 Y391	V256-E260 VanDerWaalsContact O-CB 3.27Å; V256-E260 WeakPolarHBondContact O-CB 2.88Å; V256-E260 PolarHBondContact O-N 2.85Å; S257-E260 WeakPolarHBondContact O-CB 3.41Å; S257-E260 PolarHBondContact O-N 3.24Å; K258-E260 PolarHBondContact O-N 3.48Å; E260-S262 VanDerWaalsContact C-N 3.28Å; E260-S262 PolarHBondContact O-N 3.29Å; E260-Y263 WeakPolarHBondContact O-CB 3.21Å; E260-Y263 PolarHBondContact O-N 3.19Å; E260-V264 WeakPolarHBondContact O-CG2 3.37Å; E260-V264 PolarHBondContact O-N 2.96Å; E260-H305 IonicContact OE1-CE1 2.89Å; E260-H305 IonicContact OE1-CG 3.76Å; E260-H305 IonicContact OE1-ND1 3.76Å; E260-H305 PolarHBondContact OE1-ND1 2.9Å; E260-L310 HydrophobicContact CB-CD1 3.98Å; E260-L310 HydrophobicContact CG-CB 3.93Å; E260-L310 HydrophobicContact CG-CD1 3.63Å; E260-L310 HydrophobicContact CG-CG 4.31Å; E260-L313 HydrophobicContact CB-CD1 4.4Å; E260-L313 HydrophobicContact CG-CD1 4.05Å; E260-R387 VanDerWaalsContact CA-NH2 3.34Å; E260-R387 IonicContact OE2-CZ 2.76Å; E260-R387 VanDerWaalsContact OE2-CZ 3.28Å; E260-R387 IonicContact OE2-NE 2.75Å; E260-R387 PolarHBondContact OE2-NE 2.69Å; E260-R387 IonicContact OE2-NH2 3.83Å; E260-R387 PolarHBondContact OE2-NH2 2.82Å; E260-Y391 PolarHBondContact OE2-OH 3.25Å
261	R	94.5	Very high	88	Confident	137 Å²	137	43.7 Å²	43.7	52%	0.517	23%	0.225	S	C	.	.	H	α-helix	trans	-55.8	-44.1	175.7	-71.3	178.4	-176.3	-84.4	9.5	112.1	S257 K258 Y263 V264 A265 L310 L314	S257-R261 WeakPolarHBondContact O-CG 3.31Å; S257-R261 PolarHBondContact O-N 3.28Å; K258-R261 PolarHBondContact O-N 3.42Å; R261-Y263 VanDerWaalsContact C-N 3.34Å; R261-Y263 PolarHBondContact O-N 3.34Å; R261-V264 PolarHBondContact O-N 3.01Å; R261-A265 WeakPolarHBondContact O-CB 3.44Å; R261-A265 PolarHBondContact O-N 3.38Å; R261-L310 HydrophobicContact CG-CD1 3.75Å; R261-L310 HydrophobicContact CG-CD2 3.97Å; R261-L314 VanDerWaalsContact NH2-CD2 3.35Å
262	S	93.9	Very high	89.5	Confident	74 Å²	74	44.1 Å²	44.1	52%	0.517	22%	0.224	S	C	.	.	H	α-helix	trans	-62.8	-40.2	176.9	179.6	0	0	0	0	112.2	K258 E260 S266	K258-S262 PolarHBondContact O-N 2.91Å; K258-S262 VanDerWaalsContact O-N 3.13Å; E260-S262 VanDerWaalsContact C-N 3.28Å; E260-S262 PolarHBondContact O-N 3.29Å; S262-S266 WeakPolarHBondContact O-CB 3.25Å; S262-S266 PolarHBondContact O-N 3.28Å; S262-S266 PolarHBondContact O-OG 3.44Å
263	Y	96.3	Very high	90.9	Very high	12 Å²	12	45.4 Å²	45.4	5%	0.047	23%	0.23	C	C	.	.	H	α-helix	trans	-63.5	-48.9	175.2	174.3	-118.4	0	0	0	111.7	T259 E260 R261 A265 S266 L267 Y342 K383 P384 R387	T259-Y263 WeakPolarHBondContact O-CB 3.49Å; T259-Y263 PolarHBondContact O-N 3.27Å; E260-Y263 WeakPolarHBondContact O-CB 3.21Å; E260-Y263 PolarHBondContact O-N 3.19Å; R261-Y263 VanDerWaalsContact C-N 3.34Å; R261-Y263 PolarHBondContact O-N 3.34Å; Y263-A265 VanDerWaalsContact C-N 3.34Å; Y263-A265 PolarHBondContact O-N 3.05Å; Y263-S266 WeakPolarHBondContact O-CB 3.47Å; Y263-S266 PolarHBondContact O-N 2.98Å; Y263-S266 VanDerWaalsContact O-N 3.08Å; Y263-L267 HydrophobicContact CD1-CD1 4.35Å; Y263-L267 HydrophobicContact CD2-CG 4.4Å; Y263-L267 HydrophobicContact CE1-CD1 3.72Å; Y263-L267 HydrophobicContact CE1-CG 4.35Å; Y263-L267 HydrophobicContact CE2-CD1 4.17Å; Y263-L267 HydrophobicContact CE2-CD2 3.79Å; Y263-L267 HydrophobicContact CE2-CG 3.96Å; Y263-L267 WeakPolarHBondContact O-CG 3.4Å; Y263-L267 PolarHBondContact O-N 3.07Å; Y263-Y342 WeakPolarHBondContact CE1-OH 3.44Å; Y263-Y342 WeakPolarHBondContact OH-CE1 3.38Å; Y263-Y342 PolarHBondContact OH-OH 2.88Å; Y263-K383 HydrophobicContact CE2-CB 4.4Å; Y263-P384 WeakPolarHBondContact OH-CA 3.26Å; Y263-R387 HydrophobicContact CD1-CG 3.7Å; Y263-R387 HydrophobicContact CD2-CB 3.98Å; Y263-R387 HydrophobicContact CD2-CG 3.95Å; Y263-R387 HydrophobicContact CE1-CB 4.2Å; Y263-R387 HydrophobicContact CE1-CG 3.65Å; Y263-R387 HydrophobicContact CE2-CB 3.63Å; Y263-R387 HydrophobicContact CE2-CG 3.91Å; Y263-R387 HydrophobicContact CG-CB 4.4Å; Y263-R387 HydrophobicContact CG-CG 3.85Å
264	V	98.3	Very high	92.2	Very high	10 Å²	10	45 Å²	45	6%	0.061	23%	0.227	C	C	.	.	H	α-helix	trans	-59.4	-43.8	177.5	176.3	0	0	0	0	111.7	E260 R261 S266 L267 K268 Y302 H305 V306 L310	E260-V264 WeakPolarHBondContact O-CG2 3.37Å; E260-V264 PolarHBondContact O-N 2.96Å; R261-V264 PolarHBondContact O-N 3.01Å; V264-S266 VanDerWaalsContact C-N 3.31Å; V264-S266 PolarHBondContact O-N 3.18Å; V264-L267 PolarHBondContact O-N 2.77Å; V264-K268 WeakPolarHBondContact O-CB 3.39Å; V264-K268 PolarHBondContact O-N 3.19Å; V264-Y302 HydrophobicContact CG1-CD2 4Å; V264-Y302 HydrophobicContact CG1-CE2 3.64Å; V264-H305 HydrophobicContact CG2-CB 3.75Å; V264-V306 HydrophobicContact CG1-CB 3.85Å; V264-V306 HydrophobicContact CG1-CG2 3.98Å; V264-L310 HydrophobicContact CG2-CD2 4.25Å
265	A	97.8	Very high	93.5	Very high	57 Å²	57	40.5 Å²	40.5	47%	0.471	21%	0.205	S	C	.	.	H	α-helix	trans	-61.3	-39.3	175.1	0	0	0	0	0	112.1	R261 Y263 K268 Y269	R261-A265 WeakPolarHBondContact O-CB 3.44Å; R261-A265 PolarHBondContact O-N 3.38Å; Y263-A265 VanDerWaalsContact C-N 3.34Å; Y263-A265 PolarHBondContact O-N 3.05Å; A265-K268 PolarHBondContact O-N 3.16Å; A265-Y269 WeakPolarHBondContact O-CB 3.41Å; A265-Y269 PolarHBondContact O-N 3.37Å
266	S	96.5	Very high	94.5	Very high	25 Å²	25	40.9 Å²	40.9	18%	0.175	21%	0.21	C	C	.	.	H	α-helix	trans	-65.2	-38.2	176.6	-59.1	0	0	0	0	112.6	S262 Y263 V264 V270	S262-S266 WeakPolarHBondContact O-CB 3.25Å; S262-S266 PolarHBondContact O-N 3.28Å; S262-S266 PolarHBondContact O-OG 3.44Å; Y263-S266 WeakPolarHBondContact O-CB 3.47Å; Y263-S266 PolarHBondContact O-N 2.98Å; Y263-S266 VanDerWaalsContact O-N 3.08Å; V264-S266 VanDerWaalsContact C-N 3.31Å; V264-S266 PolarHBondContact O-N 3.18Å; S266-V270 PolarHBondContact O-N 2.6Å
267	L	98.5	Very high	95.3	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-66.6	-47.1	174.8	-62.7	-179.6	0	0	0	111	Y263 V264 Y269 V270 I271 I298 I301 Y302 P384	Y263-L267 HydrophobicContact CD1-CD1 4.35Å; Y263-L267 HydrophobicContact CD2-CG 4.4Å; Y263-L267 HydrophobicContact CE1-CD1 3.72Å; Y263-L267 HydrophobicContact CE1-CG 4.35Å; Y263-L267 HydrophobicContact CE2-CD1 4.17Å; Y263-L267 HydrophobicContact CE2-CD2 3.79Å; Y263-L267 HydrophobicContact CE2-CG 3.96Å; Y263-L267 WeakPolarHBondContact O-CG 3.4Å; Y263-L267 PolarHBondContact O-N 3.07Å; V264-L267 PolarHBondContact O-N 2.77Å; L267-Y269 VanDerWaalsContact C-N 3.25Å; L267-Y269 PolarHBondContact O-N 2.84Å; L267-V270 PolarHBondContact O-N 3.39Å; L267-I271 WeakPolarHBondContact O-CG1 3.2Å; L267-I271 PolarHBondContact O-N 2.81Å; L267-I298 HydrophobicContact CD2-CD1 3.92Å; L267-I298 HydrophobicContact CD2-CG1 3.83Å; L267-I301 HydrophobicContact CD1-CG2 3.85Å; L267-Y302 HydrophobicContact CB-CD2 3.99Å; L267-Y302 HydrophobicContact CB-CG 4.42Å; L267-P384 HydrophobicContact CD2-CG 3.98Å
268	K	98.6	Very high	95.9	Very high	84 Å²	84	42.2 Å²	42.2	37%	0.365	22%	0.216	S	C	.	.	H	α-helix	trans	-55.1	-44	176.3	-171.3	178.1	171.7	175.2	0	111.3	V264 A265 V270 I271 E272 Y302	V264-K268 WeakPolarHBondContact O-CB 3.39Å; V264-K268 PolarHBondContact O-N 3.19Å; A265-K268 PolarHBondContact O-N 3.16Å; K268-V270 VanDerWaalsContact C-N 3.34Å; K268-V270 PolarHBondContact O-N 2.88Å; K268-I271 WeakPolarHBondContact O-CB 3.43Å; K268-I271 PolarHBondContact O-N 3.39Å; K268-I271 VanDerWaalsContact O-N 3.07Å; K268-E272 WeakPolarHBondContact CE-OE1 3.47Å; K268-E272 WeakPolarHBondContact CE-OE2 3.48Å; K268-E272 HydrophobicContact CG-CG 4.22Å; K268-E272 IonicContact NZ-OE1 2.62Å; K268-E272 PolarHBondContact NZ-OE1 3.02Å; K268-E272 PolarHBondContact O-N 3.37Å; K268-Y302 HydrophobicContact CB-CD2 4.17Å; K268-Y302 HydrophobicContact CB-CE2 3.6Å; K268-Y302 HydrophobicContact CD-CE2 4.44Å; K268-Y302 HydrophobicContact CG-CE2 4.12Å
269	Y	98.2	Very high	96.3	Very high	52 Å²	52	43 Å²	43	20%	0.204	23%	0.225	C	C	.	.	H	α-helix	trans	-55.2	-47.2	178.4	-175.6	-100.9	0	0	0	112.6	A265 L267 I271 E272 H273 Y274 D373 Y380	A265-Y269 WeakPolarHBondContact O-CB 3.41Å; A265-Y269 PolarHBondContact O-N 3.37Å; L267-Y269 VanDerWaalsContact C-N 3.25Å; L267-Y269 PolarHBondContact O-N 2.84Å; Y269-I271 VanDerWaalsContact C-N 3.32Å; Y269-I271 PolarHBondContact O-N 3.35Å; Y269-E272 PolarHBondContact O-N 2.91Å; Y269-H273 AromaticContact CD2-CE1 3.49Å; Y269-H273 VanDerWaalsContact CD2-CE1 3.49Å; Y269-H273 WeakPolarHBondContact CD2-CE1 3.47Å; Y269-H273 AromaticContact CD2-ND1 3.29Å; Y269-H273 VanDerWaalsContact CD2-ND1 3.29Å; Y269-H273 WeakPolarHBondContact CD2-ND1 3.47Å; Y269-H273 AromaticContact CE2-CE1 3.64Å; Y269-H273 AromaticContact CE2-CG 3.89Å; Y269-H273 AromaticContact CE2-ND1 3.47Å; Y269-H273 WeakPolarHBondContact CE2-ND1 3.47Å; Y269-H273 AromaticContact CG-ND1 3.82Å; Y269-H273 WeakPolarHBondContact O-CB 3.49Å; Y269-H273 PolarHBondContact O-N 3.46Å; Y269-H273 PolarHBondContact O-ND1 3.38Å; Y269-Y274 HydrophobicContact CE1-CE2 4.06Å; Y269-D373 WeakPolarHBondContact CE1-OD2 3.29Å; Y269-D373 PolarHBondContact OH-OD1 3.34Å; Y269-D373 PolarHBondContact OH-OD2 3.12Å; Y269-Y380 HydrophobicContact CD1-CD1 4.3Å; Y269-Y380 AromaticContact CD1-CE1 3.8Å; Y269-Y380 HydrophobicContact CD1-CE1 3.8Å; Y269-Y380 HydrophobicContact CE1-CE1 4.12Å; Y269-Y380 HydrophobicContact CE1-CE2 4.44Å; Y269-Y380 AromaticContact CE1-CZ 3.91Å
270	V	98.2	Very high	96.4	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-43.8	176.1	176.5	0	0	0	0	111.2	S266 L267 K268 Y274 I275 F295 I298 L377 Y380 L381	S266-V270 PolarHBondContact O-N 2.6Å; L267-V270 PolarHBondContact O-N 3.39Å; K268-V270 VanDerWaalsContact C-N 3.34Å; K268-V270 PolarHBondContact O-N 2.88Å; V270-Y274 WeakPolarHBondContact O-CB 3.33Å; V270-Y274 PolarHBondContact O-N 3.04Å; V270-I275 PolarHBondContact O-N 3.39Å; V270-F295 HydrophobicContact CG1-CD1 3.9Å; V270-F295 HydrophobicContact CG1-CE1 3.89Å; V270-I298 HydrophobicContact CB-CD1 4.29Å; V270-I298 HydrophobicContact CG1-CD1 4.12Å; V270-L377 HydrophobicContact CG1-CD1 3.98Å; V270-Y380 HydrophobicContact CG2-CD1 4.13Å; V270-Y380 HydrophobicContact CG2-CG 4.09Å; V270-L381 HydrophobicContact CG1-CD2 4.27Å
271	I	98.6	Very high	96.3	Very high	30 Å²	30	51.8 Å²	51.8	15%	0.154	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-39.6	-178.4	-64.1	166	0	0	0	111.6	L267 K268 Y269 I275 P276 I298 E299 Y302	L267-I271 WeakPolarHBondContact O-CG1 3.2Å; L267-I271 PolarHBondContact O-N 2.81Å; K268-I271 WeakPolarHBondContact O-CB 3.43Å; K268-I271 PolarHBondContact O-N 3.39Å; K268-I271 VanDerWaalsContact O-N 3.07Å; Y269-I271 VanDerWaalsContact C-N 3.32Å; Y269-I271 PolarHBondContact O-N 3.35Å; I271-I275 HydrophobicContact CB-CD1 4.21Å; I271-I275 HydrophobicContact CG1-CD1 3.88Å; I271-I275 HydrophobicContact CG2-CD1 4.33Å; I271-I275 WeakPolarHBondContact O-CB 3.46Å; I271-P276 WeakPolarHBondContact O-CD 3.25Å; I271-I298 HydrophobicContact CG1-CG2 4.43Å; I271-E299 HydrophobicContact CD1-CB 4.47Å; I271-E299 HydrophobicContact CD1-CG 4.08Å; I271-E299 HydrophobicContact CG1-CG 4.02Å; I271-E299 HydrophobicContact CG2-CG 4.4Å; I271-Y302 VanDerWaalsContact CD1-CB 3.44Å; I271-Y302 HydrophobicContact CD1-CD1 3.64Å; I271-Y302 HydrophobicContact CD1-CD2 4.42Å; I271-Y302 HydrophobicContact CD1-CG 3.56Å
272	E	98.3	Very high	96.1	Very high	99 Å²	99	50 Å²	50	46%	0.463	28%	0.279	S	S	.	.	H	α-helix	trans	-80.4	-32.1	-178	-71.8	-179.6	150.9	0	0	113	K268 Y269 P276	K268-E272 WeakPolarHBondContact CE-OE1 3.47Å; K268-E272 WeakPolarHBondContact CE-OE2 3.48Å; K268-E272 HydrophobicContact CG-CG 4.22Å; K268-E272 IonicContact NZ-OE1 2.62Å; K268-E272 PolarHBondContact NZ-OE1 3.02Å; K268-E272 PolarHBondContact O-N 3.37Å; Y269-E272 PolarHBondContact O-N 2.91Å; E272-P276 WeakPolarHBondContact O-CG 3.43Å
273	H	97.1	Very high	96	Very high	49 Å²	49	47.5 Å²	47.5	23%	0.227	26%	0.26	C	S	.	.	H	α-helix	trans	-109.6	-24.9	-167.3	-57.6	88.4	0	0	0	115.1	Y269 R367 L371	Y269-H273 AromaticContact CD2-CE1 3.49Å; Y269-H273 VanDerWaalsContact CD2-CE1 3.49Å; Y269-H273 WeakPolarHBondContact CD2-CE1 3.47Å; Y269-H273 AromaticContact CD2-ND1 3.29Å; Y269-H273 VanDerWaalsContact CD2-ND1 3.29Å; Y269-H273 WeakPolarHBondContact CD2-ND1 3.47Å; Y269-H273 AromaticContact CE2-CE1 3.64Å; Y269-H273 AromaticContact CE2-CG 3.89Å; Y269-H273 AromaticContact CE2-ND1 3.47Å; Y269-H273 WeakPolarHBondContact CE2-ND1 3.47Å; Y269-H273 AromaticContact CG-ND1 3.82Å; Y269-H273 WeakPolarHBondContact O-CB 3.49Å; Y269-H273 PolarHBondContact O-N 3.46Å; Y269-H273 PolarHBondContact O-ND1 3.38Å; H273-R367 PolarHBondContact O-NE 2.81Å; H273-L371 HydrophobicContact CB-CD1 3.67Å; H273-L371 HydrophobicContact CB-CD2 4.14Å
274	Y	97.8	Very high	95.9	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-38.7	-176.2	-74.6	-82.9	0	0	0	113.5	Y269 V270 E277 F364 R367 L371 D373 L377	Y269-Y274 HydrophobicContact CE1-CE2 4.06Å; V270-Y274 WeakPolarHBondContact O-CB 3.33Å; V270-Y274 PolarHBondContact O-N 3.04Å; Y274-E277 WeakPolarHBondContact O-CB 3.17Å; Y274-E277 PolarHBondContact O-N 2.87Å; Y274-E277 VanDerWaalsContact O-N 3.16Å; Y274-F364 HydrophobicContact CD1-CB 4.36Å; Y274-F364 AromaticContact CD1-CD1 3.82Å; Y274-F364 HydrophobicContact CD1-CD1 3.82Å; Y274-F364 HydrophobicContact CD1-CE1 4.47Å; Y274-F364 HydrophobicContact CD1-CG 4.31Å; Y274-F364 HydrophobicContact CE1-CB 4.31Å; Y274-R367 HydrophobicContact CD1-CG 4.42Å; Y274-R367 HydrophobicContact CE1-CG 4.35Å; Y274-L371 HydrophobicContact CD2-CD1 4.45Å; Y274-L371 HydrophobicContact CE2-CD1 3.83Å; Y274-D373 WeakPolarHBondContact CE2-OD2 3.17Å; Y274-D373 PolarHBondContact OH-OD2 2.93Å; Y274-L377 HydrophobicContact CD1-CB 4.11Å; Y274-L377 HydrophobicContact CD1-CD1 3.97Å; Y274-L377 HydrophobicContact CD1-CD2 3.77Å; Y274-L377 HydrophobicContact CD1-CG 4.15Å; Y274-L377 HydrophobicContact CD2-CD1 3.88Å; Y274-L377 HydrophobicContact CE1-CB 3.94Å; Y274-L377 HydrophobicContact CE1-CD1 4.43Å; Y274-L377 HydrophobicContact CE1-CD2 4.42Å; Y274-L377 HydrophobicContact CE1-CG 4.48Å; Y274-L377 HydrophobicContact CE2-CD1 4.35Å; Y274-L377 HydrophobicContact CG-CD1 3.65Å; Y274-L377 HydrophobicContact CG-CD2 4.12Å; Y274-L377 HydrophobicContact CG-CG 4.33Å
275	I	97.7	Very high	95.6	Very high	4 Å²	4	53 Å²	53	2%	0.021	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-58.8	-40.5	178	-72.9	-170.6	0	0	0	112.7	V270 I271 E277 M278 F295 I298 E299	V270-I275 PolarHBondContact O-N 3.39Å; I271-I275 HydrophobicContact CB-CD1 4.21Å; I271-I275 HydrophobicContact CG1-CD1 3.88Å; I271-I275 HydrophobicContact CG2-CD1 4.33Å; I271-I275 WeakPolarHBondContact O-CB 3.46Å; I275-E277 PolarHBondContact O-N 2.57Å; I275-M278 WeakPolarHBondContact O-CB 3.43Å; I275-M278 PolarHBondContact O-N 3.16Å; I275-M278 VanDerWaalsContact O-N 3.13Å; I275-F295 HydrophobicContact CD1-CB 4.34Å; I275-F295 HydrophobicContact CD1-CD1 4.22Å; I275-F295 HydrophobicContact CD1-CG 4.17Å; I275-F295 HydrophobicContact CG1-CB 4.48Å; I275-F295 HydrophobicContact CG1-CD1 3.64Å; I275-F295 HydrophobicContact CG1-CD2 4.06Å; I275-F295 HydrophobicContact CG1-CE1 3.77Å; I275-F295 HydrophobicContact CG1-CE2 4.2Å; I275-F295 HydrophobicContact CG1-CG 3.79Å; I275-F295 HydrophobicContact CG1-CZ 4.06Å; I275-I298 HydrophobicContact CD1-CG2 4.13Å; I275-E299 HydrophobicContact CD1-CG 3.72Å
276	P	96.5	Very high	95.4	Very high	55 Å²	55	55.9 Å²	55.9	36%	0.357	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-64.6	-22.9	178.1	-25.8	37.6	0	0	0	114.1	I271 E272 M278 L279	I271-P276 WeakPolarHBondContact O-CD 3.25Å; E272-P276 WeakPolarHBondContact O-CG 3.43Å; P276-M278 PolarHBondContact O-N 3.49Å; P276-M278 VanDerWaalsContact O-N 3.16Å; P276-L279 WeakPolarHBondContact O-CB 3.45Å; P276-L279 PolarHBondContact O-N 2.89Å
277	E	95.5	Very high	95.3	Very high	21 Å²	21	54.7 Å²	54.7	10%	0.098	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-62.9	-22.1	175.6	-59.3	-66.4	121.3	0	0	111.7	Y274 I275 L279 R280 F363 F364 R367	Y274-E277 WeakPolarHBondContact O-CB 3.17Å; Y274-E277 PolarHBondContact O-N 2.87Å; Y274-E277 VanDerWaalsContact O-N 3.16Å; I275-E277 PolarHBondContact O-N 2.57Å; E277-L279 PolarHBondContact O-N 3.22Å; E277-R280 WeakPolarHBondContact O-CB 3.25Å; E277-R280 WeakPolarHBondContact O-CD 3.5Å; E277-R280 VanDerWaalsContact O-CG 3.24Å; E277-R280 WeakPolarHBondContact O-CG 3.26Å; E277-R280 PolarHBondContact O-N 2.99Å; E277-R280 WeakPolarHBondContact OE2-CD 3.28Å; E277-R280 IonicContact OE2-CZ 3.74Å; E277-R280 IonicContact OE2-NE 3.76Å; E277-R280 IonicContact OE2-NH1 2.99Å; E277-R280 PolarHBondContact OE2-NH1 2.97Å; E277-F363 HydrophobicContact CB-CE1 4.21Å; E277-F363 HydrophobicContact CB-CZ 4.5Å; E277-F364 HydrophobicContact CB-CD1 4.26Å; E277-F364 HydrophobicContact CB-CE1 3.93Å; E277-R367 HydrophobicContact CG-CB 4.07Å; E277-R367 HydrophobicContact CG-CG 3.74Å; E277-R367 VanDerWaalsContact OE1-CD 3.31Å; E277-R367 WeakPolarHBondContact OE1-CD 3.42Å; E277-R367 IonicContact OE1-CZ 3.63Å; E277-R367 IonicContact OE1-NE 3.29Å; E277-R367 PolarHBondContact OE1-NE 3.31Å; E277-R367 IonicContact OE1-NH1 3.9Å
278	M	94.6	Very high	95.1	Very high	16 Å²	16	59.7 Å²	59.7	8%	0.079	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-71.4	-4.6	172.7	-61.1	-61.6	-64.8	0	0	113.9	I275 P276 L283 L287 R291 I294 F295 F364	I275-M278 WeakPolarHBondContact O-CB 3.43Å; I275-M278 PolarHBondContact O-N 3.16Å; I275-M278 VanDerWaalsContact O-N 3.13Å; P276-M278 PolarHBondContact O-N 3.49Å; P276-M278 VanDerWaalsContact O-N 3.16Å; M278-L283 HydrophobicContact CE-CD1 4.4Å; M278-L283 HydrophobicContact CE-CD2 4.26Å; M278-L283 WeakPolarHBondContact O-CD2 3.27Å; M278-L283 HydrophobicContact SD-CD1 4.17Å; M278-L287 HydrophobicContact CE-CB 4.26Å; M278-L287 VanDerWaalsContact CE-O 3.22Å; M278-L287 WeakPolarHBondContact CE-O 3.24Å; M278-R291 HydrophobicContact CE-CB 4.32Å; M278-R291 HydrophobicContact CG-CB 4.49Å; M278-I294 HydrophobicContact CE-CD1 3.87Å; M278-I294 HydrophobicContact SD-CD1 3.89Å; M278-F295 HydrophobicContact CG-CD2 4.43Å; M278-F295 HydrophobicContact CG-CE2 3.58Å; M278-F295 HydrophobicContact CG-CZ 4.4Å; M278-F295 HydrophobicContact SD-CE2 4.15Å; M278-F364 HydrophobicContact CG-CZ 4.44Å; M278-F364 HydrophobicContact SD-CE1 4.42Å; M278-F364 HydrophobicContact SD-CZ 3.7Å
279	L	92.6	Very high	94.8	Very high	135 Å²	135	59 Å²	59	71%	0.707	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-103	2	177.3	-57.5	176.5	0	0	0	112.5	P276 E277	P276-L279 WeakPolarHBondContact O-CB 3.45Å; P276-L279 PolarHBondContact O-N 2.89Å; E277-L279 PolarHBondContact O-N 3.22Å
280	R	92	Very high	94.7	Very high	110 Å²	110	59.6 Å²	59.6	42%	0.415	34%	0.342	S	S	.	.			trans	-69.3	147.8	-178.1	-66.2	169.1	57.9	110.1	6.8	112.2	E277 D282 L283	E277-R280 WeakPolarHBondContact O-CB 3.25Å; E277-R280 WeakPolarHBondContact O-CD 3.5Å; E277-R280 VanDerWaalsContact O-CG 3.24Å; E277-R280 WeakPolarHBondContact O-CG 3.26Å; E277-R280 PolarHBondContact O-N 2.99Å; E277-R280 WeakPolarHBondContact OE2-CD 3.28Å; E277-R280 IonicContact OE2-CZ 3.74Å; E277-R280 IonicContact OE2-NE 3.76Å; E277-R280 IonicContact OE2-NH1 2.99Å; E277-R280 PolarHBondContact OE2-NH1 2.97Å; R280-D282 VanDerWaalsContact C-N 3.28Å; R280-D282 VanDerWaalsContact CB-OD1 3.22Å; R280-D282 WeakPolarHBondContact CB-OD1 3.29Å; R280-D282 IonicContact CZ-OD1 3.44Å; R280-D282 IonicContact CZ-OD2 3.72Å; R280-D282 IonicContact NE-OD1 2.82Å; R280-D282 PolarHBondContact NE-OD1 3.25Å; R280-D282 IonicContact NE-OD2 3.79Å; R280-D282 IonicContact NH2-OD1 3.21Å; R280-D282 PolarHBondContact NH2-OD1 3.36Å; R280-D282 IonicContact NH2-OD2 2.78Å; R280-D282 PolarHBondContact NH2-OD2 3.41Å; R280-D282 PolarHBondContact O-N 3.41Å; R280-L283 WeakPolarHBondContact O-CB 3.29Å; R280-L283 PolarHBondContact O-N 3.45Å
281	A	89.9	Confident	94.6	Very high	116 Å²	116	63.3 Å²	63.3	96%	0.959	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-27.2	178.3	0	0	0	0	0	113.2	L283	A281-L283 VanDerWaalsContact C-N 3.3Å
282	D	90.6	Very high	94.5	Very high	99 Å²	99	65.7 Å²	65.7	53%	0.529	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	18.6	178.6	66.2	-21.4	0	0	0	113.3	R280 P284	R280-D282 VanDerWaalsContact C-N 3.28Å; R280-D282 VanDerWaalsContact CB-OD1 3.22Å; R280-D282 WeakPolarHBondContact CB-OD1 3.29Å; R280-D282 IonicContact CZ-OD1 3.44Å; R280-D282 IonicContact CZ-OD2 3.72Å; R280-D282 IonicContact NE-OD1 2.82Å; R280-D282 PolarHBondContact NE-OD1 3.25Å; R280-D282 IonicContact NE-OD2 3.79Å; R280-D282 IonicContact NH2-OD1 3.21Å; R280-D282 PolarHBondContact NH2-OD1 3.36Å; R280-D282 IonicContact NH2-OD2 2.78Å; R280-D282 PolarHBondContact NH2-OD2 3.41Å; R280-D282 PolarHBondContact O-N 3.41Å; D282-P284 WeakPolarHBondContact O-CD 3.44Å
283	L	93.2	Very high	94.4	Very high	22 Å²	22	62.4 Å²	62.4	12%	0.115	36%	0.362	C	S	.	.			trans	-61.9	123.7	179.5	-171.5	70.5	0	0	0	110.7	M278 R280 A281 L287 L288 F363	M278-L283 HydrophobicContact CE-CD1 4.4Å; M278-L283 HydrophobicContact CE-CD2 4.26Å; M278-L283 WeakPolarHBondContact O-CD2 3.27Å; M278-L283 HydrophobicContact SD-CD1 4.17Å; R280-L283 WeakPolarHBondContact O-CB 3.29Å; R280-L283 PolarHBondContact O-N 3.45Å; A281-L283 VanDerWaalsContact C-N 3.3Å; L283-L287 HydrophobicContact CD1-CB 3.84Å; L283-L287 HydrophobicContact CD1-CD1 4.22Å; L283-L287 HydrophobicContact CD2-CB 4.42Å; L283-L287 HydrophobicContact CG-CB 4.03Å; L283-L288 HydrophobicContact CD2-CD2 4.02Å; L283-F363 HydrophobicContact CD1-CD1 4.44Å; L283-F363 HydrophobicContact CD1-CE1 3.66Å; L283-F363 HydrophobicContact CD1-CE2 3.92Å; L283-F363 HydrophobicContact CD1-CZ 3.35Å
284	P	92.6	Very high	94.4	Very high	44 Å²	44	60.1 Å²	60.1	29%	0.286	35%	0.351	S	S	.	.			trans	-56.2	145.1	176.8	-26.7	34.3	0	0	0	112.6	D282 Q286 L287 L288 F363	D282-P284 WeakPolarHBondContact O-CD 3.44Å; P284-Q286 PolarHBondContact O-N 3.06Å; P284-Q286 VanDerWaalsContact O-N 3.16Å; P284-L287 HydrophobicContact CB-CG 4.47Å; P284-L287 HydrophobicContact CG-CD1 4.31Å; P284-L287 PolarHBondContact O-N 3.04Å; P284-L288 PolarHBondContact O-N 2.81Å; P284-F363 VanDerWaalsContact CD-CE2 3.43Å; P284-F363 HydrophobicContact CG-CD2 3.73Å; P284-F363 HydrophobicContact CG-CE2 4.28Å; P284-F363 HydrophobicContact CG-CG 4.42Å
285	S	92.9	Very high	94.4	Very high	92 Å²	92	60.2 Å²	60.2	64%	0.643	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-60.2	-30.8	-176.9	60.1	0	0	0	0	113.2	L287 L288	S285-L287 PolarHBondContact O-N 2.63Å; S285-L288 PolarHBondContact O-N 3.16Å
286	Q	92.5	Very high	94.4	Very high	118 Å²	118	61 Å²	61	55%	0.551	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-64.5	-24.7	174.5	-60.6	88.9	-16.2	0	0	113.2	P284 Q290	P284-Q286 PolarHBondContact O-N 3.06Å; P284-Q286 VanDerWaalsContact O-N 3.16Å; Q286-Q290 VanDerWaalsContact O-CG 3.24Å; Q286-Q290 WeakPolarHBondContact O-CG 3.45Å
287	L	94.6	Very high	94.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-98.6	-10.3	-178.3	-60.7	-176.1	0	0	0	113.1	M278 L283 P284 S285 G289 Q290 I294 L355 C359 F363	M278-L287 HydrophobicContact CE-CB 4.26Å; M278-L287 VanDerWaalsContact CE-O 3.22Å; M278-L287 WeakPolarHBondContact CE-O 3.24Å; L283-L287 HydrophobicContact CD1-CB 3.84Å; L283-L287 HydrophobicContact CD1-CD1 4.22Å; L283-L287 HydrophobicContact CD2-CB 4.42Å; L283-L287 HydrophobicContact CG-CB 4.03Å; P284-L287 HydrophobicContact CB-CG 4.47Å; P284-L287 HydrophobicContact CG-CD1 4.31Å; P284-L287 PolarHBondContact O-N 3.04Å; S285-L287 PolarHBondContact O-N 2.63Å; L287-G289 PolarHBondContact O-N 3.23Å; L287-Q290 WeakPolarHBondContact O-CB 3.42Å; L287-Q290 PolarHBondContact O-N 3.12Å; L287-I294 HydrophobicContact CD2-CD1 3.98Å; L287-L355 HydrophobicContact CD2-CD1 4.07Å; L287-L355 HydrophobicContact CD2-CD2 4.29Å; L287-L355 HydrophobicContact CD2-CG 4.11Å; L287-C359 VanDerWaalsContact CD2-SG 3.54Å; L287-F363 HydrophobicContact CD1-CB 3.61Å; L287-F363 HydrophobicContact CD1-CD1 3.44Å; L287-F363 VanDerWaalsContact CD1-CD1 3.44Å; L287-F363 HydrophobicContact CD1-CD2 4.14Å; L287-F363 HydrophobicContact CD1-CE1 4.15Å; L287-F363 HydrophobicContact CD1-CG 3.43Å; L287-F363 VanDerWaalsContact CD1-CG 3.43Å
288	L	94.8	Very high	94.6	Very high	107 Å²	107	58.6 Å²	58.6	56%	0.56	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	126.1	176.2	-73.7	170	0	0	0	110.9	L283 P284 S285 Q290	L283-L288 HydrophobicContact CD2-CD2 4.02Å; P284-L288 PolarHBondContact O-N 2.81Å; S285-L288 PolarHBondContact O-N 3.16Å; L288-Q290 PolarHBondContact O-N 3.43Å; L288-Q290 VanDerWaalsContact O-N 3.15Å
289	G	93.2	Very high	94.8	Very high	70 Å²	70	61.6 Å²	61.6	72%	0.722	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	-0.2	-178.5	0	0	0	0	0	115.2	L287 R291	L287-G289 PolarHBondContact O-N 3.23Å; G289-R291 VanDerWaalsContact C-N 3.29Å; G289-R291 PolarHBondContact O-N 2.97Å
290	Q	96.3	Very high	95.1	Very high	63 Å²	63	61.3 Å²	61.3	29%	0.294	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	6.3	-176.4	-61.1	-59.4	-34.7	0	0	114.4	Q286 L287 L288 S292 V293 I294 L355	Q286-Q290 VanDerWaalsContact O-CG 3.24Å; Q286-Q290 WeakPolarHBondContact O-CG 3.45Å; L287-Q290 WeakPolarHBondContact O-CB 3.42Å; L287-Q290 PolarHBondContact O-N 3.12Å; L288-Q290 PolarHBondContact O-N 3.43Å; L288-Q290 VanDerWaalsContact O-N 3.15Å; Q290-S292 VanDerWaalsContact C-N 3.28Å; Q290-S292 PolarHBondContact O-N 3.36Å; Q290-V293 WeakPolarHBondContact O-CA 2.87Å; Q290-V293 WeakPolarHBondContact O-CB 3.47Å; Q290-V293 PolarHBondContact O-N 3.01Å; Q290-V293 VanDerWaalsContact OE1-CG2 3.26Å; Q290-I294 HydrophobicContact CB-CD1 4.44Å; Q290-I294 PolarHBondContact O-N 3.3Å; Q290-L355 HydrophobicContact CB-CD2 3.48Å; Q290-L355 VanDerWaalsContact CB-CD2 3.48Å; Q290-L355 HydrophobicContact CG-CD2 3.75Å
291	R	95.8	Very high	95.4	Very high	80 Å²	80	56.1 Å²	56.1	30%	0.302	33%	0.333	S	S	.	.	H	α-helix	trans	-50.2	-47.8	179.9	176.8	-175	170.5	131.1	-6.8	112.2	M278 G289 V293 F295 E299	M278-R291 HydrophobicContact CE-CB 4.32Å; M278-R291 HydrophobicContact CG-CB 4.49Å; G289-R291 VanDerWaalsContact C-N 3.29Å; G289-R291 PolarHBondContact O-N 2.97Å; R291-V293 VanDerWaalsContact C-N 3.26Å; R291-V293 PolarHBondContact O-N 2.95Å; R291-F295 HydrophobicContact CG-CD2 4.21Å; R291-F295 WeakPolarHBondContact O-CD2 3.46Å; R291-F295 PolarHBondContact O-N 3.49Å; R291-E299 IonicContact CZ-OE2 2.57Å; R291-E299 IonicContact NE-OE2 3.28Å; R291-E299 IonicContact NH2-OE1 2.63Å; R291-E299 PolarHBondContact NH2-OE1 2.98Å; R291-E299 IonicContact NH2-OE2 3.52Å; R291-E299 PolarHBondContact NH2-OE2 2.77Å
292	S	95.7	Very high	95.8	Very high	80 Å²	80	53 Å²	53	56%	0.559	30%	0.297	S	S	*	.	H	α-helix	trans	-70.8	-20.9	-179.6	57.5	0	0	0	0	113.4	Q290 G296	Q290-S292 VanDerWaalsContact C-N 3.28Å; Q290-S292 PolarHBondContact O-N 3.36Å; S292-G296 WeakPolarHBondContact O-CA 3.31Å; S292-G296 PolarHBondContact O-N 2.79Å; S292-G296 VanDerWaalsContact O-N 3.15Å
293	V	96.2	Very high	96.2	Very high	30 Å²	30	53.8 Å²	53.8	18%	0.182	30%	0.297	C	S	.	.	H	α-helix	trans	-81.8	-44.5	176	179.2	0	0	0	0	110.7	Q290 R291 N348 K351 S352 L355	Q290-V293 WeakPolarHBondContact O-CA 2.87Å; Q290-V293 WeakPolarHBondContact O-CB 3.47Å; Q290-V293 PolarHBondContact O-N 3.01Å; Q290-V293 VanDerWaalsContact OE1-CG2 3.26Å; R291-V293 VanDerWaalsContact C-N 3.26Å; R291-V293 PolarHBondContact O-N 2.95Å; V293-N348 PolarHBondContact O-ND2 3.06Å; V293-K351 HydrophobicContact CG1-CB 3.78Å; V293-S352 WeakPolarHBondContact O-CA 3.37Å; V293-S352 VanDerWaalsContact O-CB 3.28Å; V293-S352 WeakPolarHBondContact O-CB 3.48Å; V293-L355 HydrophobicContact CB-CD2 4.4Å; V293-L355 HydrophobicContact CG1-CD2 4.15Å
294	I	97.5	Very high	96.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-68.9	-52.7	179.1	-61	172.1	0	0	0	110.8	M278 L287 Q290 S352 L355 M356 F364 L381	M278-I294 HydrophobicContact CE-CD1 3.87Å; M278-I294 HydrophobicContact SD-CD1 3.89Å; L287-I294 HydrophobicContact CD2-CD1 3.98Å; Q290-I294 HydrophobicContact CB-CD1 4.44Å; Q290-I294 PolarHBondContact O-N 3.3Å; I294-S352 PolarHBondContact O-OG 2.77Å; I294-L355 HydrophobicContact CD1-CD2 4.04Å; I294-L355 HydrophobicContact CG1-CD2 3.52Å; I294-L355 HydrophobicContact CG1-CG 4.24Å; I294-M356 HydrophobicContact CG2-CG 4.42Å; I294-M356 HydrophobicContact CG2-SD 3.77Å; I294-F364 HydrophobicContact CD1-CE2 4.14Å; I294-F364 HydrophobicContact CD1-CZ 4.39Å; I294-F364 HydrophobicContact CG2-CE2 4.3Å; I294-L381 HydrophobicContact CG2-CD1 4.08Å
295	F	98.2	Very high	96.7	Very high	3 Å²	3	50.8 Å²	50.8	1%	0.013	28%	0.279	C	S	.	.	S	Bend	trans	-93.1	-7.8	-171.4	-61.1	-79.7	0	0	0	112.8	V270 I275 M278 R291 N297 I298 Y345 F364 L377 L381	V270-F295 HydrophobicContact CG1-CD1 3.9Å; V270-F295 HydrophobicContact CG1-CE1 3.89Å; I275-F295 HydrophobicContact CD1-CB 4.34Å; I275-F295 HydrophobicContact CD1-CD1 4.22Å; I275-F295 HydrophobicContact CD1-CG 4.17Å; I275-F295 HydrophobicContact CG1-CB 4.48Å; I275-F295 HydrophobicContact CG1-CD1 3.64Å; I275-F295 HydrophobicContact CG1-CD2 4.06Å; I275-F295 HydrophobicContact CG1-CE1 3.77Å; I275-F295 HydrophobicContact CG1-CE2 4.2Å; I275-F295 HydrophobicContact CG1-CG 3.79Å; I275-F295 HydrophobicContact CG1-CZ 4.06Å; M278-F295 HydrophobicContact CG-CD2 4.43Å; M278-F295 HydrophobicContact CG-CE2 3.58Å; M278-F295 HydrophobicContact CG-CZ 4.4Å; M278-F295 HydrophobicContact SD-CE2 4.15Å; R291-F295 HydrophobicContact CG-CD2 4.21Å; R291-F295 WeakPolarHBondContact O-CD2 3.46Å; R291-F295 PolarHBondContact O-N 3.49Å; F295-N297 PolarHBondContact O-N 3.25Å; F295-I298 HydrophobicContact CB-CG2 3.91Å; F295-I298 VanDerWaalsContact O-CB 3.27Å; F295-I298 WeakPolarHBondContact O-CB 3.39Å; F295-I298 WeakPolarHBondContact O-CG2 3.27Å; F295-I298 PolarHBondContact O-N 3.16Å; F295-I298 VanDerWaalsContact O-N 3.14Å; F295-Y345 WeakPolarHBondContact O-CE2 3.43Å; F295-F364 HydrophobicContact CE2-CZ 4.11Å; F295-F364 HydrophobicContact CZ-CE1 4.13Å; F295-F364 AromaticContact CZ-CZ 3.76Å; F295-F364 HydrophobicContact CZ-CZ 3.76Å; F295-L377 HydrophobicContact CE1-CD1 4.22Å; F295-L377 HydrophobicContact CE1-CD2 3.98Å; F295-L377 HydrophobicContact CZ-CD2 4.07Å; F295-L381 HydrophobicContact CD1-CD2 3.92Å; F295-L381 HydrophobicContact CE1-CD2 4.45Å
296	G	96.7	Very high	97	Very high	20 Å²	20	48.8 Å²	48.8	21%	0.206	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	-137.7	-175.3	0	0	0	0	0	111.4	S292 N348	S292-G296 WeakPolarHBondContact O-CA 3.31Å; S292-G296 PolarHBondContact O-N 2.79Å; S292-G296 VanDerWaalsContact O-N 3.15Å; G296-N348 WeakPolarHBondContact CA-ND2 3.44Å
297	N	97.7	Very high	97.2	Very high	25 Å²	25	47 Å²	47	13%	0.134	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	32.6	173	62.2	-40.6	0	0	0	112.9	F295 E299 K300 I301 L341 Y345	F295-N297 PolarHBondContact O-N 3.25Å; N297-E299 PolarHBondContact O-N 2.69Å; N297-K300 HydrophobicContact CB-CB 4.44Å; N297-K300 HydrophobicContact CB-CD 4.43Å; N297-K300 PolarHBondContact O-N 3.47Å; N297-K300 VanDerWaalsContact O-N 3.08Å; N297-I301 PolarHBondContact O-N 3.43Å; N297-I301 VanDerWaalsContact O-N 3.12Å; N297-L341 PolarHBondContact ND2-O 3.29Å; N297-Y345 VanDerWaalsContact OD1-CA 3.25Å; N297-Y345 WeakPolarHBondContact OD1-CA 3.42Å; N297-Y345 VanDerWaalsContact OD1-CB 3.28Å; N297-Y345 WeakPolarHBondContact OD1-CB 3.49Å; N297-Y345 WeakPolarHBondContact OD1-CD2 3.2Å; N297-Y345 PolarHBondContact OD1-N 3.3Å
298	I	98.5	Very high	97.3	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-57.1	-36	-177.4	-161.4	170.5	0	0	0	113.1	L267 V270 I271 I275 F295 K300 I301 Y302 Y345 L381	L267-I298 HydrophobicContact CD2-CD1 3.92Å; L267-I298 HydrophobicContact CD2-CG1 3.83Å; V270-I298 HydrophobicContact CB-CD1 4.29Å; V270-I298 HydrophobicContact CG1-CD1 4.12Å; I271-I298 HydrophobicContact CG1-CG2 4.43Å; I275-I298 HydrophobicContact CD1-CG2 4.13Å; F295-I298 HydrophobicContact CB-CG2 3.91Å; F295-I298 VanDerWaalsContact O-CB 3.27Å; F295-I298 WeakPolarHBondContact O-CB 3.39Å; F295-I298 WeakPolarHBondContact O-CG2 3.27Å; F295-I298 PolarHBondContact O-N 3.16Å; F295-I298 VanDerWaalsContact O-N 3.14Å; I298-K300 VanDerWaalsContact C-N 3.34Å; I298-K300 PolarHBondContact O-N 2.85Å; I298-I301 PolarHBondContact O-N 3.25Å; I298-Y302 WeakPolarHBondContact O-CB 3.47Å; I298-Y302 PolarHBondContact O-N 3.35Å; I298-Y345 HydrophobicContact CB-CE2 4.07Å; I298-L381 HydrophobicContact CD1-CD2 4.32Å
299	E	98.6	Very high	97.3	Very high	79 Å²	79	44.7 Å²	44.7	37%	0.369	25%	0.246	S	C	.	.	H	α-helix	trans	-62.4	-40	177.4	-66.5	178.8	109.9	0	0	111.7	I271 I275 R291 N297 Y302 E303	I271-E299 HydrophobicContact CD1-CB 4.47Å; I271-E299 HydrophobicContact CD1-CG 4.08Å; I271-E299 HydrophobicContact CG1-CG 4.02Å; I271-E299 HydrophobicContact CG2-CG 4.4Å; I275-E299 HydrophobicContact CD1-CG 3.72Å; R291-E299 IonicContact CZ-OE2 2.57Å; R291-E299 IonicContact NE-OE2 3.28Å; R291-E299 IonicContact NH2-OE1 2.63Å; R291-E299 PolarHBondContact NH2-OE1 2.98Å; R291-E299 IonicContact NH2-OE2 3.52Å; R291-E299 PolarHBondContact NH2-OE2 2.77Å; N297-E299 PolarHBondContact O-N 2.69Å; E299-Y302 PolarHBondContact O-N 3.47Å; E299-E303 WeakPolarHBondContact O-CB 3.12Å; E299-E303 PolarHBondContact O-N 3.13Å
300	K	98.7	Very high	97.4	Very high	129 Å²	129	42 Å²	42	56%	0.561	22%	0.215	S	C	*	.	H	α-helix	trans	-71	-35.1	176.5	-63.6	-175.6	178.4	-178	0	112.3	N297 I298 F304 L341	N297-K300 HydrophobicContact CB-CB 4.44Å; N297-K300 HydrophobicContact CB-CD 4.43Å; N297-K300 PolarHBondContact O-N 3.47Å; N297-K300 VanDerWaalsContact O-N 3.08Å; I298-K300 VanDerWaalsContact C-N 3.34Å; I298-K300 PolarHBondContact O-N 2.85Å; K300-F304 WeakPolarHBondContact O-CB 3.49Å; K300-F304 PolarHBondContact O-N 2.91Å; K300-L341 HydrophobicContact CB-CD1 4.44Å; K300-L341 HydrophobicContact CB-CD2 4.05Å; K300-L341 HydrophobicContact CD-CD2 4.4Å
301	I	98.8	Very high	97.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.4	-48.2	173.2	-66.1	174.9	0	0	0	108.9	L267 N297 I298 E303 F304 H305 L341 Y342 Y345 P384	L267-I301 HydrophobicContact CD1-CG2 3.85Å; N297-I301 PolarHBondContact O-N 3.43Å; N297-I301 VanDerWaalsContact O-N 3.12Å; I298-I301 PolarHBondContact O-N 3.25Å; I301-E303 PolarHBondContact O-N 3.31Å; I301-F304 PolarHBondContact O-N 3.23Å; I301-H305 PolarHBondContact O-CD2 3.09Å; I301-H305 PolarHBondContact O-N 3.45Å; I301-L341 HydrophobicContact CG1-CB 3.94Å; I301-Y342 HydrophobicContact CD1-CD1 4.35Å; I301-Y342 HydrophobicContact CD1-CE1 4.42Å; I301-Y342 HydrophobicContact CG2-CE1 4.27Å; I301-Y342 HydrophobicContact CG2-CE2 4.23Å; I301-Y345 HydrophobicContact CD1-CD2 3.83Å; I301-Y345 HydrophobicContact CD1-CG 3.92Å; I301-P384 HydrophobicContact CD1-CB 4.34Å
302	Y	98.8	Very high	97	Very high	50 Å²	50	39.9 Å²	39.9	20%	0.196	22%	0.215	C	C	.	.	H	α-helix	trans	-56.2	-50.6	176.2	168.8	-108	0	0	0	112	V264 L267 K268 I271 I298 E299 H305 V306	V264-Y302 HydrophobicContact CG1-CD2 4Å; V264-Y302 HydrophobicContact CG1-CE2 3.64Å; L267-Y302 HydrophobicContact CB-CD2 3.99Å; L267-Y302 HydrophobicContact CB-CG 4.42Å; K268-Y302 HydrophobicContact CB-CD2 4.17Å; K268-Y302 HydrophobicContact CB-CE2 3.6Å; K268-Y302 HydrophobicContact CD-CE2 4.44Å; K268-Y302 HydrophobicContact CG-CE2 4.12Å; I271-Y302 VanDerWaalsContact CD1-CB 3.44Å; I271-Y302 HydrophobicContact CD1-CD1 3.64Å; I271-Y302 HydrophobicContact CD1-CD2 4.42Å; I271-Y302 HydrophobicContact CD1-CG 3.56Å; I298-Y302 WeakPolarHBondContact O-CB 3.47Å; I298-Y302 PolarHBondContact O-N 3.35Å; E299-Y302 PolarHBondContact O-N 3.47Å; Y302-H305 PolarHBondContact O-N 3.15Å; Y302-V306 HydrophobicContact CE1-CG1 4.09Å; Y302-V306 HydrophobicContact CE2-CB 4.04Å; Y302-V306 HydrophobicContact CE2-CG1 4.23Å; Y302-V306 HydrophobicContact CE2-CG2 4.37Å; Y302-V306 WeakPolarHBondContact O-CG1 3.33Å; Y302-V306 PolarHBondContact O-N 3.41Å
303	E	98.7	Very high	96.6	Very high	117 Å²	117	36.5 Å²	36.5	55%	0.547	19%	0.19	S	C	.	.	H	α-helix	trans	-54.2	-55.8	177.9	-175.6	-179.4	-165.5	0	0	110.9	E299 I301 H305 V306 T307	E299-E303 WeakPolarHBondContact O-CB 3.12Å; E299-E303 PolarHBondContact O-N 3.13Å; I301-E303 PolarHBondContact O-N 3.31Å; E303-H305 VanDerWaalsContact C-N 3.28Å; E303-H305 PolarHBondContact O-N 3.04Å; E303-V306 WeakPolarHBondContact O-CG1 3.34Å; E303-V306 PolarHBondContact O-N 3.12Å; E303-T307 HydrophobicContact CG-CG2 4.38Å; E303-T307 WeakPolarHBondContact O-CB 3.39Å; E303-T307 WeakPolarHBondContact O-CG2 3.34Å; E303-T307 PolarHBondContact O-N 3.42Å; E303-T307 PolarHBondContact O-OG1 3.44Å
304	F	98.6	Very high	96.2	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.009	20%	0.195	C	C	.	.	H	α-helix	trans	-51.5	-47.2	176.5	161.5	-120.8	0	0	0	112.4	K300 I301 E308 F309 H335 K338 F339 L341	K300-F304 WeakPolarHBondContact O-CB 3.49Å; K300-F304 PolarHBondContact O-N 2.91Å; I301-F304 PolarHBondContact O-N 3.23Å; F304-E308 HydrophobicContact CD2-CB 4.09Å; F304-E308 HydrophobicContact CE2-CB 4.31Å; F304-E308 WeakPolarHBondContact O-CB 3.45Å; F304-E308 PolarHBondContact O-N 3Å; F304-F309 HydrophobicContact CE1-CB 4.14Å; F304-F309 HydrophobicContact CE1-CG 4.42Å; F304-F309 HydrophobicContact CE2-CB 3.89Å; F304-F309 HydrophobicContact CZ-CB 3.67Å; F304-F309 HydrophobicContact CZ-CD2 4.01Å; F304-F309 AromaticContact CZ-CG 3.96Å; F304-F309 HydrophobicContact CZ-CG 3.96Å; F304-F309 PolarHBondContact O-N 3.36Å; F304-H335 HydrophobicContact CE2-CB 3.9Å; F304-H335 AromaticContact CE2-CG 3.81Å; F304-H335 AromaticContact CE2-ND1 3.69Å; F304-H335 HydrophobicContact CZ-CB 3.83Å; F304-K338 HydrophobicContact CD1-CB 4.34Å; F304-K338 HydrophobicContact CD2-CB 3.58Å; F304-K338 HydrophobicContact CD2-CD 4.17Å; F304-K338 HydrophobicContact CD2-CG 3.86Å; F304-K338 HydrophobicContact CE1-CB 4.22Å; F304-K338 HydrophobicContact CE2-CB 3.45Å; F304-K338 VanDerWaalsContact CE2-CB 3.45Å; F304-K338 HydrophobicContact CE2-CG 3.9Å; F304-K338 HydrophobicContact CG-CB 4.04Å; F304-K338 HydrophobicContact CZ-CB 3.79Å; F304-F339 HydrophobicContact CZ-CE2 4.28Å; F304-L341 HydrophobicContact CB-CD1 3.97Å; F304-L341 HydrophobicContact CG-CD1 4.4Å
305	H	98.4	Very high	95.3	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.219	C	C	.	.	I	π-helix	trans	-70.4	-40.8	-176.3	-82.4	-84	0	0	0	112.8	E260 V264 I301 Y302 E303 F309 L310 Y342 Y391	E260-H305 IonicContact OE1-CE1 2.89Å; E260-H305 IonicContact OE1-CG 3.76Å; E260-H305 IonicContact OE1-ND1 3.76Å; E260-H305 PolarHBondContact OE1-ND1 2.9Å; V264-H305 HydrophobicContact CG2-CB 3.75Å; I301-H305 PolarHBondContact O-CD2 3.09Å; I301-H305 PolarHBondContact O-N 3.45Å; Y302-H305 PolarHBondContact O-N 3.15Å; E303-H305 VanDerWaalsContact C-N 3.28Å; E303-H305 PolarHBondContact O-N 3.04Å; H305-F309 AromaticContact CE1-CD1 3.54Å; H305-F309 AromaticContact ND1-CD1 3.44Å; H305-F309 WeakPolarHBondContact ND1-CD1 3.43Å; H305-L310 WeakPolarHBondContact O-CB 3.3Å; H305-L310 PolarHBondContact O-N 3.38Å; H305-Y342 PolarHBondContact CD2-OH 3.23Å; H305-Y342 PolarHBondContact CE1-OH 3.13Å; H305-Y342 AromaticContact NE2-CE2 3.44Å; H305-Y342 WeakPolarHBondContact NE2-CE2 3.38Å; H305-Y342 AromaticContact NE2-CZ 3.48Å; H305-Y342 PolarHBondContact NE2-OH 3.26Å; H305-Y391 PolarHBondContact CE1-OH 3.41Å
306	V	98	Very high	93.9	Very high	50 Å²	50	43 Å²	43	30%	0.303	23%	0.234	S	C	.	.	I	π-helix	trans	-76.8	-34.8	-177.4	75.2	0	0	0	0	112.8	V264 Y302 E303 P311	V264-V306 HydrophobicContact CG1-CB 3.85Å; V264-V306 HydrophobicContact CG1-CG2 3.98Å; Y302-V306 HydrophobicContact CE1-CG1 4.09Å; Y302-V306 HydrophobicContact CE2-CB 4.04Å; Y302-V306 HydrophobicContact CE2-CG1 4.23Å; Y302-V306 HydrophobicContact CE2-CG2 4.37Å; Y302-V306 WeakPolarHBondContact O-CG1 3.33Å; Y302-V306 PolarHBondContact O-N 3.41Å; E303-V306 WeakPolarHBondContact O-CG1 3.34Å; E303-V306 PolarHBondContact O-N 3.12Å; V306-P311 WeakPolarHBondContact O-CD 3.49Å; V306-P311 WeakPolarHBondContact O-CG 3.37Å
307	T	97.6	Very high	92.2	Very high	82 Å²	82	43.8 Å²	43.8	50%	0.503	24%	0.236	S	C	.	.	I	π-helix	trans	-93.4	-30.6	-174.5	64.2	0	0	0	0	113.8	E303	E303-T307 HydrophobicContact CG-CG2 4.38Å; E303-T307 WeakPolarHBondContact O-CB 3.39Å; E303-T307 WeakPolarHBondContact O-CG2 3.34Å; E303-T307 PolarHBondContact O-N 3.42Å; E303-T307 PolarHBondContact O-OG1 3.44Å
308	E	96.3	Very high	90.4	Very high	57 Å²	57	48.7 Å²	48.7	27%	0.266	27%	0.267	S	S	.	.	I	π-helix	trans	-118.8	-62.6	-172.3	-61.4	172.8	-99.6	0	0	111.3	F304 P311 D312 K338	F304-E308 HydrophobicContact CD2-CB 4.09Å; F304-E308 HydrophobicContact CE2-CB 4.31Å; F304-E308 WeakPolarHBondContact O-CB 3.45Å; F304-E308 PolarHBondContact O-N 3Å; E308-P311 WeakPolarHBondContact O-CD 3.43Å; E308-D312 VanDerWaalsContact O-CB 3.31Å; E308-D312 WeakPolarHBondContact O-CB 3.49Å; E308-D312 VanDerWaalsContact O-CG 3.25Å; E308-D312 PolarHBondContact O-N 3.09Å; E308-K338 IonicContact OE1-NZ 2.84Å; E308-K338 PolarHBondContact OE1-NZ 3.43Å; E308-K338 IonicContact OE2-NZ 3.45Å; E308-K338 PolarHBondContact OE2-NZ 3.44Å
309	F	96.1	Very high	88.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.281	C	S	.	.	I	π-helix	trans	-71	-48.3	-166.2	-167.8	-116.4	0	0	0	114.3	F304 H305 D312 L313 F332 H335 F339 Y391	F304-F309 HydrophobicContact CE1-CB 4.14Å; F304-F309 HydrophobicContact CE1-CG 4.42Å; F304-F309 HydrophobicContact CE2-CB 3.89Å; F304-F309 HydrophobicContact CZ-CB 3.67Å; F304-F309 HydrophobicContact CZ-CD2 4.01Å; F304-F309 AromaticContact CZ-CG 3.96Å; F304-F309 HydrophobicContact CZ-CG 3.96Å; F304-F309 PolarHBondContact O-N 3.36Å; H305-F309 AromaticContact CE1-CD1 3.54Å; H305-F309 AromaticContact ND1-CD1 3.44Å; H305-F309 WeakPolarHBondContact ND1-CD1 3.43Å; F309-D312 PolarHBondContact O-N 2.64Å; F309-L313 HydrophobicContact CD1-CD1 3.79Å; F309-L313 HydrophobicContact CE1-CD1 3.44Å; F309-L313 VanDerWaalsContact CE1-CD1 3.44Å; F309-L313 HydrophobicContact CE1-CG 4.27Å; F309-L313 HydrophobicContact CE2-CD1 4.46Å; F309-L313 HydrophobicContact CE2-CG 4.47Å; F309-L313 HydrophobicContact CG-CD1 4.46Å; F309-L313 HydrophobicContact CZ-CD1 3.8Å; F309-L313 HydrophobicContact CZ-CD2 4.39Å; F309-L313 HydrophobicContact CZ-CG 4.23Å; F309-L313 WeakPolarHBondContact O-CG 3.46Å; F309-L313 PolarHBondContact O-N 3.45Å; F309-F332 HydrophobicContact CE1-CZ 4.42Å; F309-F332 HydrophobicContact CZ-CD1 4.17Å; F309-F332 HydrophobicContact CZ-CD2 4.26Å; F309-F332 AromaticContact CZ-CE1 3.85Å; F309-F332 HydrophobicContact CZ-CE1 3.85Å; F309-F332 AromaticContact CZ-CE2 3.94Å; F309-F332 HydrophobicContact CZ-CE2 3.94Å; F309-F332 HydrophobicContact CZ-CG 4.37Å; F309-F332 AromaticContact CZ-CZ 3.72Å; F309-F332 HydrophobicContact CZ-CZ 3.72Å; F309-H335 HydrophobicContact CD2-CB 4.35Å; F309-H335 AromaticContact CD2-CD2 3.86Å; F309-F339 HydrophobicContact CD2-CE2 4.38Å; F309-F339 HydrophobicContact CD2-CZ 4.31Å; F309-F339 HydrophobicContact CE1-CZ 4.18Å; F309-F339 AromaticContact CE2-CE2 3.95Å; F309-F339 HydrophobicContact CE2-CE2 3.95Å; F309-F339 AromaticContact CE2-CZ 3.78Å; F309-F339 HydrophobicContact CE2-CZ 3.78Å; F309-F339 HydrophobicContact CZ-CE2 4.33Å; F309-F339 AromaticContact CZ-CZ 3.71Å; F309-F339 HydrophobicContact CZ-CZ 3.71Å; F309-Y391 HydrophobicContact CE1-CE1 4.16Å
310	L	94.1	Very high	87.3	Confident	14 Å²	14	53.3 Å²	53.3	7%	0.073	29%	0.292	C	S	.	.	H	α-helix	trans	-64.2	-47.7	178.3	170.4	66	0	0	0	111.7	E260 R261 V264 H305 D312 L313 L314	E260-L310 HydrophobicContact CB-CD1 3.98Å; E260-L310 HydrophobicContact CG-CB 3.93Å; E260-L310 HydrophobicContact CG-CD1 3.63Å; E260-L310 HydrophobicContact CG-CG 4.31Å; R261-L310 HydrophobicContact CG-CD1 3.75Å; R261-L310 HydrophobicContact CG-CD2 3.97Å; V264-L310 HydrophobicContact CG2-CD2 4.25Å; H305-L310 WeakPolarHBondContact O-CB 3.3Å; H305-L310 PolarHBondContact O-N 3.38Å; L310-D312 VanDerWaalsContact C-N 3.32Å; L310-D312 PolarHBondContact O-N 3.41Å; L310-L313 PolarHBondContact O-N 2.99Å; L310-L314 HydrophobicContact CD1-CD1 3.79Å; L310-L314 HydrophobicContact CD1-CD2 4.42Å; L310-L314 HydrophobicContact CD1-CG 3.92Å; L310-L314 HydrophobicContact CG-CD1 3.88Å; L310-L314 HydrophobicContact CG-CG 4.43Å; L310-L314 VanDerWaalsContact O-CG 3.26Å; L310-L314 WeakPolarHBondContact O-CG 3.23Å; L310-L314 PolarHBondContact O-N 3.23Å
311	P	92.9	Very high	85.9	Confident	52 Å²	52	49.4 Å²	49.4	34%	0.338	28%	0.278	S	S	.	.	H	α-helix	trans	-54.7	-44.7	173.2	-29	37.5	0	0	0	113.4	V306 E308 L313 L314 G315	V306-P311 WeakPolarHBondContact O-CD 3.49Å; V306-P311 WeakPolarHBondContact O-CG 3.37Å; E308-P311 WeakPolarHBondContact O-CD 3.43Å; P311-L313 VanDerWaalsContact C-N 3.35Å; P311-L313 PolarHBondContact O-N 3.13Å; P311-L314 PolarHBondContact O-N 2.97Å; P311-G315 PolarHBondContact O-N 3.17Å
312	D	90.9	Very high	84.5	Confident	47 Å²	47	55.7 Å²	55.7	25%	0.251	31%	0.306	S	S	.	.	H	α-helix	trans	-66.8	-34.1	179.4	-78	2.3	0	0	0	112.9	E308 F309 L310 H316 H335	E308-D312 VanDerWaalsContact O-CB 3.31Å; E308-D312 WeakPolarHBondContact O-CB 3.49Å; E308-D312 VanDerWaalsContact O-CG 3.25Å; E308-D312 PolarHBondContact O-N 3.09Å; F309-D312 PolarHBondContact O-N 2.64Å; L310-D312 VanDerWaalsContact C-N 3.32Å; L310-D312 PolarHBondContact O-N 3.41Å; D312-H316 PolarHBondContact O-CD2 3.37Å; D312-H335 IonicContact OD2-CD2 2.7Å; D312-H335 IonicContact OD2-CE1 3.02Å; D312-H335 IonicContact OD2-NE2 3.77Å; D312-H335 PolarHBondContact OD2-NE2 3.28Å
313	L	88.6	Confident	83.6	Confident	8 Å²	8	60.1 Å²	60.1	4%	0.042	32%	0.322	C	S	.	.	H	α-helix	trans	-66.5	-44	172.2	-76.4	174.3	0	0	0	111.4	V256 E260 F309 L310 P311 C317 R331	V256-L313 HydrophobicContact CG1-CD1 4.18Å; V256-L313 HydrophobicContact CG1-CD2 4.34Å; E260-L313 HydrophobicContact CB-CD1 4.4Å; E260-L313 HydrophobicContact CG-CD1 4.05Å; F309-L313 HydrophobicContact CD1-CD1 3.79Å; F309-L313 HydrophobicContact CE1-CD1 3.44Å; F309-L313 VanDerWaalsContact CE1-CD1 3.44Å; F309-L313 HydrophobicContact CE1-CG 4.27Å; F309-L313 HydrophobicContact CE2-CD1 4.46Å; F309-L313 HydrophobicContact CE2-CG 4.47Å; F309-L313 HydrophobicContact CG-CD1 4.46Å; F309-L313 HydrophobicContact CZ-CD1 3.8Å; F309-L313 HydrophobicContact CZ-CD2 4.39Å; F309-L313 HydrophobicContact CZ-CG 4.23Å; F309-L313 WeakPolarHBondContact O-CG 3.46Å; F309-L313 PolarHBondContact O-N 3.45Å; L310-L313 PolarHBondContact O-N 2.99Å; P311-L313 VanDerWaalsContact C-N 3.35Å; P311-L313 PolarHBondContact O-N 3.13Å; L313-C317 PolarHBondContact O-N 3.27Å; L313-C317 PolarHBondContact O-SG 2.85Å; L313-R331 HydrophobicContact CD2-CB 4.4Å
314	L	85.7	Confident	82.8	Confident	53 Å²	53	54.7 Å²	54.7	28%	0.277	30%	0.297	S	S	.	.	H	α-helix	trans	-68.8	-42.1	-178	-68.9	168.1	0	0	0	112.9	R261 L310 P311 H316 C317	R261-L314 VanDerWaalsContact NH2-CD2 3.35Å; L310-L314 HydrophobicContact CD1-CD1 3.79Å; L310-L314 HydrophobicContact CD1-CD2 4.42Å; L310-L314 HydrophobicContact CD1-CG 3.92Å; L310-L314 HydrophobicContact CG-CD1 3.88Å; L310-L314 HydrophobicContact CG-CG 4.43Å; L310-L314 VanDerWaalsContact O-CG 3.26Å; L310-L314 WeakPolarHBondContact O-CG 3.23Å; L310-L314 PolarHBondContact O-N 3.23Å; P311-L314 PolarHBondContact O-N 2.97Å; L314-H316 PolarHBondContact O-N 2.85Å; L314-H316 VanDerWaalsContact O-N 3.09Å; L314-C317 PolarHBondContact O-N 2.88Å
315	G	78.9	Confident	82.2	Confident	50 Å²	50	54.6 Å²	54.6	52%	0.515	30%	0.297	S	S	.	.	H	α-helix	trans	-61.4	-19.5	-177.1	0	0	0	0	0	114.1	P311	P311-G315 PolarHBondContact O-N 3.17Å
316	H	68.8	Low	81.7	Confident	68 Å²	68	55 Å²	55	32%	0.315	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	3.8	-177.2	-68.6	-80.2	0	0	0	114	D312 L314 T318 E319 A327 R331	D312-H316 PolarHBondContact O-CD2 3.37Å; L314-H316 PolarHBondContact O-N 2.85Å; L314-H316 VanDerWaalsContact O-N 3.09Å; H316-T318 PolarHBondContact O-N 3Å; H316-T318 VanDerWaalsContact O-N 3.11Å; H316-E319 HydrophobicContact CB-CG 4.42Å; H316-E319 IonicContact CE1-OE1 2.82Å; H316-E319 IonicContact CG-OE1 3.9Å; H316-E319 IonicContact ND1-OE1 3.28Å; H316-E319 PolarHBondContact ND1-OE1 2.86Å; H316-E319 PolarHBondContact O-N 3.34Å; H316-E319 VanDerWaalsContact O-N 3.15Å; H316-A327 HydrophobicContact CB-CB 4.47Å; H316-R331 PolarHBondContact CD2-NE 3.15Å; H316-R331 PolarHBondContact CD2-NH2 3.17Å; H316-R331 PolarHBondContact CE1-NH2 3.46Å; H316-R331 PolarHBondContact ND1-NH2 2.96Å; H316-R331 VanDerWaalsContact ND1-NH2 3.17Å; H316-R331 PolarHBondContact NE2-NH2 3.09Å
317	C	61.4	Low	81.2	Confident	36 Å²	36	52.8 Å²	52.8	24%	0.243	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-11.6	172.1	-72.4	0	0	0	0	113	S253 S257 L313 L314	S253-C317 PolarHBondContact OG-SG 2.78Å; S257-C317 PolarHBondContact OG-SG 2.83Å; L313-C317 PolarHBondContact O-N 3.27Å; L313-C317 PolarHBondContact O-SG 2.85Å; L314-C317 PolarHBondContact O-N 2.88Å
318	T	60.6	Low	80.8	Confident	128 Å²	128	49.4 Å²	49.4	79%	0.785	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	0.6	177.5	59.2	0	0	0	0	113.7	H316	H316-T318 PolarHBondContact O-N 3Å; H316-T318 VanDerWaalsContact O-N 3.11Å
319	E	65	Low	80.7	Confident	64 Å²	64	46.7 Å²	46.7	30%	0.299	25%	0.253	S	S	.	.	S	Bend	trans	-63.2	157.7	173.6	-72.3	-173.5	-160.9	0	0	111.2	H316 V321 A327 R331	H316-E319 HydrophobicContact CB-CG 4.42Å; H316-E319 IonicContact CE1-OE1 2.82Å; H316-E319 IonicContact CG-OE1 3.9Å; H316-E319 IonicContact ND1-OE1 3.28Å; H316-E319 PolarHBondContact ND1-OE1 2.86Å; H316-E319 PolarHBondContact O-N 3.34Å; H316-E319 VanDerWaalsContact O-N 3.15Å; E319-V321 PolarHBondContact O-N 2.84Å; E319-A327 VanDerWaalsContact OE2-CB 3.23Å; E319-A327 WeakPolarHBondContact OE2-CB 3.29Å; E319-R331 IonicContact OE1-NH2 3.77Å
320	N	66.9	Low	80.5	Confident	112 Å²	112	51 Å²	51	60%	0.599	27%	0.271	S	S	*	.			trans	-51.5	131.1	179.2	-172.5	-31	0	0	0	109.9	K322 R323 V324	N320-K322 PolarHBondContact O-N 3.33Å; N320-K322 PolarHBondContact OD1-N 2.83Å; N320-R323 PolarHBondContact O-N 3.04Å; N320-V324 PolarHBondContact O-N 3.47Å
321	V	68	Low	80.4	Confident	47 Å²	47	52 Å²	52	29%	0.285	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-42.4	-40	-177.9	177.1	0	0	0	0	112.9	E246 C249 V250 E319 R323	E246-V321 HydrophobicContact CB-CG1 4.14Å; E246-V321 VanDerWaalsContact O-CG1 3.32Å; E246-V321 WeakPolarHBondContact O-CG1 3.33Å; C249-V321 HydrophobicContact CB-CG1 4.27Å; C249-V321 PolarHBondContact SG-O 3.43Å; V250-V321 HydrophobicContact CG2-CB 3.84Å; V250-V321 HydrophobicContact CG2-CG1 3.31Å; V250-V321 HydrophobicContact CG2-CG2 3.34Å; E319-V321 PolarHBondContact O-N 2.84Å; V321-R323 VanDerWaalsContact C-N 3.26Å; V321-R323 PolarHBondContact O-N 3.37Å
322	K	71.3	Confident	80.6	Confident	133 Å²	133	49.7 Å²	49.7	58%	0.578	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-69.6	-18.8	-178.1	-63.8	-173.2	179.1	-176.8	0	114.4	E246 N320 Q409	E246-K322 WeakPolarHBondContact OE1-CE 3.49Å; E246-K322 IonicContact OE1-NZ 3.85Å; N320-K322 PolarHBondContact O-N 3.33Å; N320-K322 PolarHBondContact OD1-N 2.83Å; K322-Q409 PolarHBondContact O-OE1 3.17Å
323	R	79.9	Confident	80.8	Confident	142 Å²	142	49 Å²	49	54%	0.536	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-113.8	5	-175.1	-72.2	-168.7	140.6	-171.7	-8.1	114.3	N320 V321 G325 V326 A327 E408	N320-R323 PolarHBondContact O-N 3.04Å; V321-R323 VanDerWaalsContact C-N 3.26Å; V321-R323 PolarHBondContact O-N 3.37Å; R323-G325 PolarHBondContact O-N 2.83Å; R323-V326 WeakPolarHBondContact O-CB 3.31Å; R323-V326 PolarHBondContact O-N 3.38Å; R323-V326 VanDerWaalsContact O-N 3.09Å; R323-A327 PolarHBondContact O-N 2.85Å; R323-E408 IonicContact NH2-OE2 3.52Å
324	V	80.6	Confident	81.2	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.024	28%	0.279	C	S	.	.	H	α-helix	trans	-54.2	-40	177	165.4	0	0	0	0	111.6	N320 V326 A327 V328	N320-V324 PolarHBondContact O-N 3.47Å; V324-V326 PolarHBondContact O-N 3.27Å; V324-A327 WeakPolarHBondContact O-CB 3.37Å; V324-A327 PolarHBondContact O-N 3.43Å; V324-V328 HydrophobicContact CG1-CG2 4.34Å; V324-V328 WeakPolarHBondContact O-CG2 3.49Å; V324-V328 PolarHBondContact O-N 3.48Å
325	G	85.5	Confident	81.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.1	-43.9	177.9	0	0	0	0	0	112.6	R323 A329 L413	R323-G325 PolarHBondContact O-N 2.83Å; G325-A329 VanDerWaalsContact O-CB 3.32Å; G325-A329 WeakPolarHBondContact O-CB 3.06Å; G325-A329 PolarHBondContact O-N 3.43Å; G325-L413 WeakPolarHBondContact O-CD2 3.29Å
326	V	88.6	Confident	82.5	Confident	7 Å²	7	55 Å²	55	4%	0.042	27%	0.268	C	S	.	.	H	α-helix	trans	-60.5	-45.8	173.5	174	0	0	0	0	111	R323 V324 A329 K330 Q409 L412	R323-V326 WeakPolarHBondContact O-CB 3.31Å; R323-V326 PolarHBondContact O-N 3.38Å; R323-V326 VanDerWaalsContact O-N 3.09Å; V324-V326 PolarHBondContact O-N 3.27Å; V326-A329 PolarHBondContact O-N 3Å; V326-K330 HydrophobicContact CG1-CD 3.94Å; V326-K330 HydrophobicContact CG1-CG 4.45Å; V326-K330 WeakPolarHBondContact O-CB 3.43Å; V326-K330 WeakPolarHBondContact O-CG 3.44Å; V326-K330 PolarHBondContact O-N 2.89Å; V326-Q409 HydrophobicContact CG2-CB 3.65Å; V326-Q409 HydrophobicContact CG2-CG 3.79Å; V326-L412 HydrophobicContact CG1-CD1 3.82Å; V326-L412 HydrophobicContact CG2-CD1 4.44Å
327	A	88.1	Confident	83.6	Confident	4 Å²	4	54.9 Å²	54.9	3%	0.033	29%	0.285	C	S	.	.	H	α-helix	trans	-58.4	-52.3	-179.8	0	0	0	0	0	111.1	H316 E319 R323 V324 K330 R331	H316-A327 HydrophobicContact CB-CB 4.47Å; E319-A327 VanDerWaalsContact OE2-CB 3.23Å; E319-A327 WeakPolarHBondContact OE2-CB 3.29Å; R323-A327 PolarHBondContact O-N 2.85Å; V324-A327 WeakPolarHBondContact O-CB 3.37Å; V324-A327 PolarHBondContact O-N 3.43Å; A327-K330 PolarHBondContact O-N 3.06Å; A327-R331 WeakPolarHBondContact O-CG 3.37Å; A327-R331 PolarHBondContact O-N 2.93Å
328	V	89.6	Confident	85.3	Confident	11 Å²	11	57.3 Å²	57.3	7%	0.067	29%	0.291	C	S	.	.	H	α-helix	trans	-59.5	-50.9	178.8	172.7	0	0	0	0	110.5	V324 K330 R331 F332 L395 L398	V324-V328 HydrophobicContact CG1-CG2 4.34Å; V324-V328 WeakPolarHBondContact O-CG2 3.49Å; V324-V328 PolarHBondContact O-N 3.48Å; V328-K330 VanDerWaalsContact C-N 3.31Å; V328-K330 PolarHBondContact O-N 3.43Å; V328-R331 PolarHBondContact O-N 3.11Å; V328-F332 HydrophobicContact CG1-CD2 3.92Å; V328-F332 HydrophobicContact CG1-CE2 3.73Å; V328-F332 WeakPolarHBondContact O-CD2 3.44Å; V328-F332 PolarHBondContact O-N 3.25Å; V328-L395 HydrophobicContact CG1-CD2 4.39Å; V328-L398 HydrophobicContact CB-CD1 4.42Å; V328-L398 HydrophobicContact CG1-CD1 4.07Å
329	A	92.6	Very high	87	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-55.9	-44.7	-179.9	0	0	0	0	0	112.4	G325 V326 R331 F332 L333 L412 L413 A416	G325-A329 VanDerWaalsContact O-CB 3.32Å; G325-A329 WeakPolarHBondContact O-CB 3.06Å; G325-A329 PolarHBondContact O-N 3.43Å; V326-A329 PolarHBondContact O-N 3Å; A329-R331 VanDerWaalsContact C-N 3.28Å; A329-R331 PolarHBondContact O-N 3.23Å; A329-F332 PolarHBondContact O-N 3.09Å; A329-L333 WeakPolarHBondContact O-CG 3.49Å; A329-L333 PolarHBondContact O-N 3.15Å; A329-L412 HydrophobicContact CB-CB 3.83Å; A329-L413 HydrophobicContact CB-CD2 3.95Å; A329-L413 HydrophobicContact CB-CG 4.12Å; A329-A416 HydrophobicContact CB-CB 4.23Å
330	K	93	Very high	88.4	Confident	91 Å²	91	49.1 Å²	49.1	40%	0.396	25%	0.249	S	C	.	.	H	α-helix	trans	-60.3	-35.3	178	-77	177.4	178.7	173	0	112.4	V326 A327 V328 L333 Q334 L412	V326-K330 HydrophobicContact CG1-CD 3.94Å; V326-K330 HydrophobicContact CG1-CG 4.45Å; V326-K330 WeakPolarHBondContact O-CB 3.43Å; V326-K330 WeakPolarHBondContact O-CG 3.44Å; V326-K330 PolarHBondContact O-N 2.89Å; A327-K330 PolarHBondContact O-N 3.06Å; V328-K330 VanDerWaalsContact C-N 3.31Å; V328-K330 PolarHBondContact O-N 3.43Å; K330-L333 PolarHBondContact O-N 3.1Å; K330-Q334 WeakPolarHBondContact O-CB 3.23Å; K330-Q334 PolarHBondContact O-N 3.03Å; K330-L412 HydrophobicContact CG-CD1 4.46Å
331	R	92.3	Very high	89.8	Confident	36 Å²	36	45.2 Å²	45.2	14%	0.136	23%	0.228	C	C	.	.	H	α-helix	trans	-71.6	-39.9	178.2	-54.3	-39.6	161.8	-154.8	-3.1	112.7	L313 H316 E319 A327 V328 A329 L333 Q334 H335	L313-R331 HydrophobicContact CD2-CB 4.4Å; H316-R331 PolarHBondContact CD2-NE 3.15Å; H316-R331 PolarHBondContact CD2-NH2 3.17Å; H316-R331 PolarHBondContact CE1-NH2 3.46Å; H316-R331 PolarHBondContact ND1-NH2 2.96Å; H316-R331 VanDerWaalsContact ND1-NH2 3.17Å; H316-R331 PolarHBondContact NE2-NH2 3.09Å; E319-R331 IonicContact OE1-NH2 3.77Å; A327-R331 WeakPolarHBondContact O-CG 3.37Å; A327-R331 PolarHBondContact O-N 2.93Å; V328-R331 PolarHBondContact O-N 3.11Å; A329-R331 VanDerWaalsContact C-N 3.28Å; A329-R331 PolarHBondContact O-N 3.23Å; R331-L333 VanDerWaalsContact C-N 3.31Å; R331-L333 PolarHBondContact O-N 3.43Å; R331-Q334 PolarHBondContact O-N 3.45Å; R331-H335 PolarHBondContact O-CD2 3.35Å; R331-H335 PolarHBondContact O-N 3.29Å; R331-H335 VanDerWaalsContact O-N 3.12Å
332	F	95.5	Very high	91.2	Very high	3 Å²	3	43 Å²	43	1%	0.013	22%	0.215	C	C	.	.	H	α-helix	trans	-57.5	-47.1	171	-83.6	-88.3	0	0	0	111.2	F309 V328 A329 H335 Q336 F339 Y391 L395 A416 M419 V420	F309-F332 HydrophobicContact CE1-CZ 4.42Å; F309-F332 HydrophobicContact CZ-CD1 4.17Å; F309-F332 HydrophobicContact CZ-CD2 4.26Å; F309-F332 AromaticContact CZ-CE1 3.85Å; F309-F332 HydrophobicContact CZ-CE1 3.85Å; F309-F332 AromaticContact CZ-CE2 3.94Å; F309-F332 HydrophobicContact CZ-CE2 3.94Å; F309-F332 HydrophobicContact CZ-CG 4.37Å; F309-F332 AromaticContact CZ-CZ 3.72Å; F309-F332 HydrophobicContact CZ-CZ 3.72Å; V328-F332 HydrophobicContact CG1-CD2 3.92Å; V328-F332 HydrophobicContact CG1-CE2 3.73Å; V328-F332 WeakPolarHBondContact O-CD2 3.44Å; V328-F332 PolarHBondContact O-N 3.25Å; A329-F332 PolarHBondContact O-N 3.09Å; F332-H335 CarbonylContact O-C 3.6Å; F332-H335 PolarHBondContact O-N 2.84Å; F332-Q336 PolarHBondContact O-N 3.42Å; F332-Q336 VanDerWaalsContact O-N 3.15Å; F332-F339 HydrophobicContact CD1-CE1 4.37Å; F332-F339 AromaticContact CD1-CE2 3.91Å; F332-F339 HydrophobicContact CD1-CE2 3.91Å; F332-F339 AromaticContact CD1-CZ 3.61Å; F332-F339 HydrophobicContact CD1-CZ 3.61Å; F332-F339 HydrophobicContact CE1-CE1 4.26Å; F332-F339 HydrophobicContact CE1-CE2 4.48Å; F332-F339 AromaticContact CE1-CZ 3.73Å; F332-F339 HydrophobicContact CE1-CZ 3.73Å; F332-Y391 AromaticContact CE1-CD1 3.68Å; F332-Y391 HydrophobicContact CE1-CD1 3.68Å; F332-Y391 AromaticContact CE1-CD2 3.98Å; F332-Y391 HydrophobicContact CE1-CD2 3.98Å; F332-Y391 HydrophobicContact CE1-CE1 4.19Å; F332-Y391 HydrophobicContact CE1-CE2 4.47Å; F332-Y391 AromaticContact CE1-CG 3.59Å; F332-Y391 HydrophobicContact CE1-CG 3.59Å; F332-Y391 AromaticContact CZ-CD1 3.41Å; F332-Y391 HydrophobicContact CZ-CD1 3.41Å; F332-Y391 VanDerWaalsContact CZ-CD1 3.41Å; F332-Y391 AromaticContact CZ-CE1 3.89Å; F332-Y391 HydrophobicContact CZ-CE1 3.89Å; F332-Y391 AromaticContact CZ-CG 3.82Å; F332-Y391 HydrophobicContact CZ-CG 3.82Å; F332-L395 HydrophobicContact CD1-CD1 4.37Å; F332-L395 HydrophobicContact CD2-CD2 4.15Å; F332-L395 HydrophobicContact CE1-CD1 4.39Å; F332-L395 HydrophobicContact CE2-CD2 4.2Å; F332-L395 HydrophobicContact CG-CD1 4.47Å; F332-A416 HydrophobicContact CB-CB 3.79Å; F332-A416 HydrophobicContact CG-CB 4.43Å; F332-M419 HydrophobicContact CB-CE 3.94Å; F332-M419 HydrophobicContact CD1-CE 4.06Å; F332-M419 VanDerWaalsContact O-CE 3.31Å; F332-M419 WeakPolarHBondContact O-CE 3.35Å; F332-V420 HydrophobicContact CD1-CG2 3.75Å; F332-V420 HydrophobicContact CE1-CG2 3.97Å
333	L	96.4	Very high	92.2	Very high	33 Å²	33	36.6 Å²	36.6	17%	0.173	19%	0.187	C	C	.	.	H	α-helix	trans	-70.4	-37.6	-178.2	-66.3	173.6	0	0	0	113.1	A329 K330 R331 H335 Q336 L412 Q415 A416 M419	A329-L333 WeakPolarHBondContact O-CG 3.49Å; A329-L333 PolarHBondContact O-N 3.15Å; K330-L333 PolarHBondContact O-N 3.1Å; R331-L333 VanDerWaalsContact C-N 3.31Å; R331-L333 PolarHBondContact O-N 3.43Å; L333-H335 VanDerWaalsContact C-N 3.28Å; L333-H335 PolarHBondContact O-N 3.5Å; L333-Q336 WeakPolarHBondContact O-CB 3.2Å; L333-Q336 WeakPolarHBondContact O-CG 3.34Å; L333-Q336 PolarHBondContact O-N 2.96Å; L333-L412 HydrophobicContact CD1-CD2 4.12Å; L333-Q415 HydrophobicContact CD1-CB 4.13Å; L333-Q415 HydrophobicContact CD2-CB 4.15Å; L333-A416 HydrophobicContact CD2-CB 4.45Å; L333-A416 HydrophobicContact CG-CB 4.25Å; L333-M419 HydrophobicContact CD2-CB 4.39Å
334	Q	96.2	Very high	92.8	Very high	114 Å²	114	34.2 Å²	34.2	53%	0.533	18%	0.184	S	C	.	.	H	α-helix	trans	-59.7	-40.3	174.7	-179.3	176.6	-3.3	0	0	111.3	K330 R331	K330-Q334 WeakPolarHBondContact O-CB 3.23Å; K330-Q334 PolarHBondContact O-N 3.03Å; R331-Q334 PolarHBondContact O-N 3.45Å
335	H	96.9	Very high	93.6	Very high	14 Å²	14	34.1 Å²	34.1	7%	0.065	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	11.2	-179.1	-71.7	-62.7	0	0	0	114.6	F304 F309 D312 R331 F332 L333 G337 K338 F339	F304-H335 HydrophobicContact CE2-CB 3.9Å; F304-H335 AromaticContact CE2-CG 3.81Å; F304-H335 AromaticContact CE2-ND1 3.69Å; F304-H335 HydrophobicContact CZ-CB 3.83Å; F309-H335 HydrophobicContact CD2-CB 4.35Å; F309-H335 AromaticContact CD2-CD2 3.86Å; D312-H335 IonicContact OD2-CD2 2.7Å; D312-H335 IonicContact OD2-CE1 3.02Å; D312-H335 IonicContact OD2-NE2 3.77Å; D312-H335 PolarHBondContact OD2-NE2 3.28Å; R331-H335 PolarHBondContact O-CD2 3.35Å; R331-H335 PolarHBondContact O-N 3.29Å; R331-H335 VanDerWaalsContact O-N 3.12Å; F332-H335 CarbonylContact O-C 3.6Å; F332-H335 PolarHBondContact O-N 2.84Å; L333-H335 VanDerWaalsContact C-N 3.28Å; L333-H335 PolarHBondContact O-N 3.5Å; H335-G337 PolarHBondContact O-N 2.81Å; H335-K338 WeakPolarHBondContact O-CB 3.34Å; H335-K338 PolarHBondContact O-N 3.35Å; H335-F339 HydrophobicContact CB-CD2 4.34Å; H335-F339 HydrophobicContact CB-CE2 4.11Å; H335-F339 WeakPolarHBondContact O-CD2 3.21Å; H335-F339 PolarHBondContact O-N 2.81Å
336	Q	95	Very high	93.9	Very high	109 Å²	109	34.5 Å²	34.5	51%	0.509	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-35.7	-174	66.3	-177.9	-37.3	0	0	114.2	F332 L333 F339 M419 Q423	F332-Q336 PolarHBondContact O-N 3.42Å; F332-Q336 VanDerWaalsContact O-N 3.15Å; L333-Q336 WeakPolarHBondContact O-CB 3.2Å; L333-Q336 WeakPolarHBondContact O-CG 3.34Å; L333-Q336 PolarHBondContact O-N 2.96Å; Q336-F339 PolarHBondContact O-N 3.46Å; Q336-M419 HydrophobicContact CB-CG 3.7Å; Q336-M419 HydrophobicContact CB-SD 4.06Å; Q336-Q423 PolarHBondContact O-NE2 3.05Å
337	G	92.1	Very high	93.9	Very high	65 Å²	65	36.6 Å²	36.6	67%	0.67	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-36.5	178.5	0	0	0	0	0	112.7	H335 G340	H335-G337 PolarHBondContact O-N 2.81Å; G337-G340 PolarHBondContact O-N 3.15Å
338	K	97.3	Very high	94.2	Very high	87 Å²	87	37.9 Å²	37.9	38%	0.378	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-29.9	178.6	-64.9	-79.1	-176.3	135	0	112	F304 E308 H335 G340 L341	F304-K338 HydrophobicContact CD1-CB 4.34Å; F304-K338 HydrophobicContact CD2-CB 3.58Å; F304-K338 HydrophobicContact CD2-CD 4.17Å; F304-K338 HydrophobicContact CD2-CG 3.86Å; F304-K338 HydrophobicContact CE1-CB 4.22Å; F304-K338 HydrophobicContact CE2-CB 3.45Å; F304-K338 VanDerWaalsContact CE2-CB 3.45Å; F304-K338 HydrophobicContact CE2-CG 3.9Å; F304-K338 HydrophobicContact CG-CB 4.04Å; F304-K338 HydrophobicContact CZ-CB 3.79Å; E308-K338 IonicContact OE1-NZ 2.84Å; E308-K338 PolarHBondContact OE1-NZ 3.43Å; E308-K338 IonicContact OE2-NZ 3.45Å; E308-K338 PolarHBondContact OE2-NZ 3.44Å; H335-K338 WeakPolarHBondContact O-CB 3.34Å; H335-K338 PolarHBondContact O-N 3.35Å; K338-G340 PolarHBondContact O-N 2.75Å; K338-G340 VanDerWaalsContact O-N 3.07Å; K338-L341 VanDerWaalsContact O-CB 3.29Å; K338-L341 WeakPolarHBondContact O-CB 3.39Å; K338-L341 WeakPolarHBondContact O-CD1 3.27Å; K338-L341 WeakPolarHBondContact O-CG 3.37Å; K338-L341 PolarHBondContact O-N 3.17Å
339	F	96.9	Very high	94.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-16.7	171.5	-79.3	-80.7	0	0	0	113.5	F304 F309 F332 H335 Q336 L341 Y342 M388 Y391 M419 Q423	F304-F339 HydrophobicContact CZ-CE2 4.28Å; F309-F339 HydrophobicContact CD2-CE2 4.38Å; F309-F339 HydrophobicContact CD2-CZ 4.31Å; F309-F339 HydrophobicContact CE1-CZ 4.18Å; F309-F339 AromaticContact CE2-CE2 3.95Å; F309-F339 HydrophobicContact CE2-CE2 3.95Å; F309-F339 AromaticContact CE2-CZ 3.78Å; F309-F339 HydrophobicContact CE2-CZ 3.78Å; F309-F339 HydrophobicContact CZ-CE2 4.33Å; F309-F339 AromaticContact CZ-CZ 3.71Å; F309-F339 HydrophobicContact CZ-CZ 3.71Å; F332-F339 HydrophobicContact CD1-CE1 4.37Å; F332-F339 AromaticContact CD1-CE2 3.91Å; F332-F339 HydrophobicContact CD1-CE2 3.91Å; F332-F339 AromaticContact CD1-CZ 3.61Å; F332-F339 HydrophobicContact CD1-CZ 3.61Å; F332-F339 HydrophobicContact CE1-CE1 4.26Å; F332-F339 HydrophobicContact CE1-CE2 4.48Å; F332-F339 AromaticContact CE1-CZ 3.73Å; F332-F339 HydrophobicContact CE1-CZ 3.73Å; H335-F339 HydrophobicContact CB-CD2 4.34Å; H335-F339 HydrophobicContact CB-CE2 4.11Å; H335-F339 WeakPolarHBondContact O-CD2 3.21Å; H335-F339 PolarHBondContact O-N 2.81Å; Q336-F339 PolarHBondContact O-N 3.46Å; F339-L341 PolarHBondContact O-N 3.31Å; F339-L341 VanDerWaalsContact O-N 3.14Å; F339-Y342 HydrophobicContact CD1-CD2 4.01Å; F339-Y342 HydrophobicContact CD1-CE2 4.01Å; F339-Y342 HydrophobicContact CE1-CE2 4.34Å; F339-Y342 WeakPolarHBondContact O-CB 3.39Å; F339-Y342 PolarHBondContact O-N 2.89Å; F339-M388 HydrophobicContact CD1-CE 4.13Å; F339-M388 HydrophobicContact CD1-SD 3.83Å; F339-M388 HydrophobicContact CE1-SD 4.19Å; F339-Y391 HydrophobicContact CE1-CD2 4Å; F339-Y391 AromaticContact CE1-CE2 3.73Å; F339-Y391 HydrophobicContact CE1-CE2 3.73Å; F339-Y391 HydrophobicContact CZ-CE2 4.41Å; F339-M419 HydrophobicContact CB-SD 3.99Å; F339-M419 HydrophobicContact CD2-CE 3.7Å; F339-M419 HydrophobicContact CD2-SD 4.08Å; F339-M419 HydrophobicContact CE2-CE 4.01Å; F339-M419 HydrophobicContact CG-CE 4.18Å; F339-M419 HydrophobicContact CG-SD 4.13Å; F339-Q423 HydrophobicContact CB-CG 3.89Å
340	G	93.2	Very high	94.3	Very high	19 Å²	19	39.4 Å²	39.4	20%	0.196	21%	0.209	C	C	.	.	H	α-helix	trans	-56.3	-22.2	167.6	0	0	0	0	0	114.4	G337 K338 Y342 A343 L344	G337-G340 PolarHBondContact O-N 3.15Å; K338-G340 PolarHBondContact O-N 2.75Å; K338-G340 VanDerWaalsContact O-N 3.07Å; G340-Y342 PolarHBondContact O-N 3.42Å; G340-A343 WeakPolarHBondContact O-CB 3.28Å; G340-A343 PolarHBondContact O-N 3.33Å; G340-A343 VanDerWaalsContact O-N 3.15Å; G340-L344 PolarHBondContact O-N 3.06Å
341	L	97.4	Very high	94.2	Very high	30 Å²	30	41.2 Å²	41.2	16%	0.157	22%	0.217	C	C	.	.	H	α-helix	trans	-58.2	-32.8	172.2	-68.1	169.6	0	0	0	112.3	N297 K300 I301 F304 K338 F339 L344 Y345	N297-L341 PolarHBondContact ND2-O 3.29Å; K300-L341 HydrophobicContact CB-CD1 4.44Å; K300-L341 HydrophobicContact CB-CD2 4.05Å; K300-L341 HydrophobicContact CD-CD2 4.4Å; I301-L341 HydrophobicContact CG1-CB 3.94Å; F304-L341 HydrophobicContact CB-CD1 3.97Å; F304-L341 HydrophobicContact CG-CD1 4.4Å; K338-L341 VanDerWaalsContact O-CB 3.29Å; K338-L341 WeakPolarHBondContact O-CB 3.39Å; K338-L341 WeakPolarHBondContact O-CD1 3.27Å; K338-L341 WeakPolarHBondContact O-CG 3.37Å; K338-L341 PolarHBondContact O-N 3.17Å; F339-L341 PolarHBondContact O-N 3.31Å; F339-L341 VanDerWaalsContact O-N 3.14Å; L341-L344 PolarHBondContact O-N 3.18Å; L341-Y345 PolarHBondContact O-N 3.31Å
342	Y	96.7	Very high	94.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-72	-33.8	177.3	-74.3	-90.3	0	0	0	112.6	Y263 I301 H305 F339 G340 L344 Y345 N346 P384 M388	Y263-Y342 WeakPolarHBondContact CE1-OH 3.44Å; Y263-Y342 WeakPolarHBondContact OH-CE1 3.38Å; Y263-Y342 PolarHBondContact OH-OH 2.88Å; I301-Y342 HydrophobicContact CD1-CD1 4.35Å; I301-Y342 HydrophobicContact CD1-CE1 4.42Å; I301-Y342 HydrophobicContact CG2-CE1 4.27Å; I301-Y342 HydrophobicContact CG2-CE2 4.23Å; H305-Y342 PolarHBondContact CD2-OH 3.23Å; H305-Y342 PolarHBondContact CE1-OH 3.13Å; H305-Y342 AromaticContact NE2-CE2 3.44Å; H305-Y342 WeakPolarHBondContact NE2-CE2 3.38Å; H305-Y342 AromaticContact NE2-CZ 3.48Å; H305-Y342 PolarHBondContact NE2-OH 3.26Å; F339-Y342 HydrophobicContact CD1-CD2 4.01Å; F339-Y342 HydrophobicContact CD1-CE2 4.01Å; F339-Y342 HydrophobicContact CE1-CE2 4.34Å; F339-Y342 WeakPolarHBondContact O-CB 3.39Å; F339-Y342 PolarHBondContact O-N 2.89Å; G340-Y342 PolarHBondContact O-N 3.42Å; Y342-L344 VanDerWaalsContact C-N 3.31Å; Y342-L344 PolarHBondContact O-N 3.48Å; Y342-Y345 PolarHBondContact O-N 3.27Å; Y342-N346 WeakPolarHBondContact O-CB 3.41Å; Y342-N346 PolarHBondContact O-N 3.2Å; Y342-N346 PolarHBondContact O-OD1 3.18Å; Y342-P384 HydrophobicContact CD1-CB 4.19Å; Y342-P384 WeakPolarHBondContact CD1-O 3.23Å; Y342-P384 HydrophobicContact CE1-CB 3.86Å; Y342-P384 VanDerWaalsContact CE1-O 3.25Å; Y342-P384 WeakPolarHBondContact CE1-O 3.23Å; Y342-M388 HydrophobicContact CD1-CG 3.25Å; Y342-M388 HydrophobicContact CD1-SD 3.73Å; Y342-M388 HydrophobicContact CD2-CE 4.42Å; Y342-M388 HydrophobicContact CD2-CG 4.25Å; Y342-M388 HydrophobicContact CD2-SD 3.58Å; Y342-M388 VanDerWaalsContact CD2-SD 3.58Å; Y342-M388 HydrophobicContact CE1-CG 3.69Å; Y342-M388 HydrophobicContact CE1-SD 4Å; Y342-M388 HydrophobicContact CE2-SD 3.89Å; Y342-M388 HydrophobicContact CG-CE 4.24Å; Y342-M388 HydrophobicContact CG-CG 3.55Å; Y342-M388 HydrophobicContact CG-SD 3.49Å
343	A	92.1	Very high	94.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63	-41.8	174.1	0	0	0	0	0	111	G340 N346 K347 H426 G427 L430	G340-A343 WeakPolarHBondContact O-CB 3.28Å; G340-A343 PolarHBondContact O-N 3.33Å; G340-A343 VanDerWaalsContact O-N 3.15Å; A343-N346 PolarHBondContact O-N 3.17Å; A343-K347 WeakPolarHBondContact O-CB 3.48Å; A343-K347 PolarHBondContact O-N 3.47Å; A343-H426 HydrophobicContact CB-CB 3.88Å; A343-G427 VanDerWaalsContact O-CA 3.25Å; A343-G427 WeakPolarHBondContact O-CA 3.44Å; A343-L430 HydrophobicContact CB-CD1 4.3Å
344	L	93.8	Very high	94	Very high	91 Å²	91	42.4 Å²	42.4	48%	0.476	23%	0.233	S	C	.	.	H	α-helix	trans	-64.7	-41.2	174.8	-60.9	179.8	0	0	0	112.1	G340 L341 Y342 K347 N348 L430	G340-L344 PolarHBondContact O-N 3.06Å; L341-L344 PolarHBondContact O-N 3.18Å; Y342-L344 VanDerWaalsContact C-N 3.31Å; Y342-L344 PolarHBondContact O-N 3.48Å; L344-K347 PolarHBondContact O-N 3.22Å; L344-N348 PolarHBondContact O-N 3.45Å; L344-L430 HydrophobicContact CD2-CD1 4.12Å
345	Y	96.1	Very high	93.9	Very high	3 Å²	3	38.1 Å²	38.1	1%	0.012	21%	0.214	C	C	.	.	H	α-helix	trans	-61.3	-49.6	176	-167.8	-92.7	0	0	0	111.4	F295 N297 I298 I301 L341 Y342 K347 N348 K349 L381 P384 V385	F295-Y345 WeakPolarHBondContact O-CE2 3.43Å; N297-Y345 VanDerWaalsContact OD1-CA 3.25Å; N297-Y345 WeakPolarHBondContact OD1-CA 3.42Å; N297-Y345 VanDerWaalsContact OD1-CB 3.28Å; N297-Y345 WeakPolarHBondContact OD1-CB 3.49Å; N297-Y345 WeakPolarHBondContact OD1-CD2 3.2Å; N297-Y345 PolarHBondContact OD1-N 3.3Å; I298-Y345 HydrophobicContact CB-CE2 4.07Å; I301-Y345 HydrophobicContact CD1-CD2 3.83Å; I301-Y345 HydrophobicContact CD1-CG 3.92Å; L341-Y345 PolarHBondContact O-N 3.31Å; Y342-Y345 PolarHBondContact O-N 3.27Å; Y345-K347 VanDerWaalsContact C-N 3.33Å; Y345-K347 PolarHBondContact O-N 3.34Å; Y345-N348 PolarHBondContact O-N 2.73Å; Y345-K349 HydrophobicContact CE1-CD 4.28Å; Y345-K349 PolarHBondContact O-N 2.96Å; Y345-L381 PolarHBondContact OH-O 2.98Å; Y345-P384 HydrophobicContact CD1-CB 3.89Å; Y345-P384 HydrophobicContact CD1-CG 4.34Å; Y345-P384 HydrophobicContact CE1-CB 3.8Å; Y345-P384 HydrophobicContact CE1-CG 3.8Å; Y345-P384 HydrophobicContact CE2-CG 4.29Å; Y345-P384 HydrophobicContact CG-CB 4.4Å; Y345-V385 HydrophobicContact CD1-CG2 4.26Å; Y345-V385 HydrophobicContact CE1-CG2 4.17Å
346	N	92	Very high	93.8	Very high	7 Å²	7	37.6 Å²	37.6	4%	0.037	21%	0.211	C	C	.	.	H	α-helix	trans	-62.7	-38.8	179.2	-70.8	-7.5	0	0	0	111.9	Y342 A343 N348 K349 P350 V385	Y342-N346 WeakPolarHBondContact O-CB 3.41Å; Y342-N346 PolarHBondContact O-N 3.2Å; Y342-N346 PolarHBondContact O-OD1 3.18Å; A343-N346 PolarHBondContact O-N 3.17Å; N346-N348 PolarHBondContact O-N 2.83Å; N346-K349 WeakPolarHBondContact O-CB 3.49Å; N346-K349 PolarHBondContact O-N 3.1Å; N346-P350 WeakPolarHBondContact O-CD 3.2Å; N346-V385 WeakPolarHBondContact OD1-CG2 3.42Å
347	K	89.3	Confident	93.7	Very high	52 Å²	52	37 Å²	37	23%	0.226	22%	0.219	C	C	.	.	H	α-helix	trans	-58.6	-37.3	173.1	-174.4	-171.7	-174.1	169.7	0	111.9	A343 L344 Y345 L430 L431 D434	A343-K347 WeakPolarHBondContact O-CB 3.48Å; A343-K347 PolarHBondContact O-N 3.47Å; L344-K347 PolarHBondContact O-N 3.22Å; Y345-K347 VanDerWaalsContact C-N 3.33Å; Y345-K347 PolarHBondContact O-N 3.34Å; K347-L430 HydrophobicContact CD-CB 3.73Å; K347-L430 HydrophobicContact CD-CD1 4.3Å; K347-L430 HydrophobicContact CG-CB 4.21Å; K347-L431 HydrophobicContact CG-CD2 3.79Å; K347-L431 HydrophobicContact CG-CG 3.93Å; K347-D434 WeakPolarHBondContact CE-OD2 3.26Å; K347-D434 IonicContact NZ-OD1 3.71Å; K347-D434 PolarHBondContact NZ-OD1 3.41Å; K347-D434 IonicContact NZ-OD2 3.61Å; K347-D434 PolarHBondContact NZ-OD2 3.48Å
348	N	94.1	Very high	93.6	Very high	30 Å²	30	40 Å²	40	16%	0.16	22%	0.22	C	C	.	.	H	α-helix	trans	-82.4	-25.8	180	-176.2	69	0	0	0	113.5	V293 G296 L344 Y345 N346 P350 K351 S352	V293-N348 PolarHBondContact O-ND2 3.06Å; G296-N348 WeakPolarHBondContact CA-ND2 3.44Å; L344-N348 PolarHBondContact O-N 3.45Å; Y345-N348 PolarHBondContact O-N 2.73Å; N346-N348 PolarHBondContact O-N 2.83Å; N348-P350 VanDerWaalsContact C-CD 3.49Å; N348-K351 WeakPolarHBondContact O-CB 3.24Å; N348-K351 PolarHBondContact O-N 3.29Å; N348-S352 PolarHBondContact O-N 3.35Å; N348-S352 VanDerWaalsContact O-N 3.15Å
349	K	93.7	Very high	93.4	Very high	11 Å²	11	37.3 Å²	37.3	5%	0.048	21%	0.212	C	C	.	.	H	α-helix	trans	-49.8	-42.6	-172.6	-171.6	62	162.6	72.5	0	114.7	Y345 N346 K351 S352 D353 L381 V385	Y345-K349 HydrophobicContact CE1-CD 4.28Å; Y345-K349 PolarHBondContact O-N 2.96Å; N346-K349 WeakPolarHBondContact O-CB 3.49Å; N346-K349 PolarHBondContact O-N 3.1Å; K349-K351 VanDerWaalsContact C-N 3.29Å; K349-K351 PolarHBondContact O-N 3.33Å; K349-S352 WeakPolarHBondContact O-CB 3.31Å; K349-S352 PolarHBondContact O-N 3.28Å; K349-D353 IonicContact NZ-OD1 3.71Å; K349-D353 PolarHBondContact NZ-OD1 2.81Å; K349-D353 IonicContact NZ-OD2 3.51Å; K349-D353 PolarHBondContact NZ-OD2 3.02Å; K349-D353 VanDerWaalsContact O-CG 3.29Å; K349-D353 PolarHBondContact O-N 3.3Å; K349-L381 WeakPolarHBondContact CE-O 2.91Å; K349-V385 HydrophobicContact CG-CG2 4.41Å
350	P	89.6	Confident	93.1	Very high	32 Å²	32	37.3 Å²	37.3	21%	0.208	21%	0.212	C	C	.	.	H	α-helix	trans	-61.2	-34.2	176.8	-25.4	35.4	0	0	0	114.1	N346 N348 A354 L431	N346-P350 WeakPolarHBondContact O-CD 3.2Å; N348-P350 VanDerWaalsContact C-CD 3.49Å; P350-A354 WeakPolarHBondContact O-CB 3.47Å; P350-A354 PolarHBondContact O-N 3.15Å; P350-L431 HydrophobicContact CG-CD1 4.22Å
351	K	91	Very high	93.1	Very high	130 Å²	130	38.7 Å²	38.7	57%	0.565	22%	0.219	S	C	*	.	H	α-helix	trans	-73.5	-41.6	176.9	-60.9	179.8	-178.5	177.2	0	111.3	V293 N348 K349 D353 L355	V293-K351 HydrophobicContact CG1-CB 3.78Å; N348-K351 WeakPolarHBondContact O-CB 3.24Å; N348-K351 PolarHBondContact O-N 3.29Å; K349-K351 VanDerWaalsContact C-N 3.29Å; K349-K351 PolarHBondContact O-N 3.33Å; K351-D353 VanDerWaalsContact C-N 3.32Å; K351-L355 WeakPolarHBondContact O-CB 3.22Å; K351-L355 PolarHBondContact O-N 2.97Å
352	S	95.9	Very high	92.9	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.007	24%	0.243	C	C	.	.	H	α-helix	trans	-54.7	-50.7	171.3	172.3	0	0	0	0	110.5	V293 I294 N348 K349 L355 M356	V293-S352 WeakPolarHBondContact O-CA 3.37Å; V293-S352 VanDerWaalsContact O-CB 3.28Å; V293-S352 WeakPolarHBondContact O-CB 3.48Å; I294-S352 PolarHBondContact O-OG 2.77Å; N348-S352 PolarHBondContact O-N 3.35Å; N348-S352 VanDerWaalsContact O-N 3.15Å; K349-S352 WeakPolarHBondContact O-CB 3.31Å; K349-S352 PolarHBondContact O-N 3.28Å; S352-L355 PolarHBondContact O-N 3.47Å; S352-M356 WeakPolarHBondContact O-CB 3.37Å; S352-M356 VanDerWaalsContact O-CG 3.26Å; S352-M356 WeakPolarHBondContact O-CG 3.44Å; S352-M356 PolarHBondContact O-N 3.01Å
353	D	93	Very high	92.8	Very high	49 Å²	49	44 Å²	44	26%	0.262	25%	0.249	S	C	.	.	H	α-helix	trans	-66.1	-40.8	-175.8	-69.7	-14	0	0	0	112.5	K349 K351 M356 S357	K349-D353 IonicContact NZ-OD1 3.71Å; K349-D353 PolarHBondContact NZ-OD1 2.81Å; K349-D353 IonicContact NZ-OD2 3.51Å; K349-D353 PolarHBondContact NZ-OD2 3.02Å; K349-D353 VanDerWaalsContact O-CG 3.29Å; K349-D353 PolarHBondContact O-N 3.3Å; K351-D353 VanDerWaalsContact C-N 3.32Å; D353-M356 PolarHBondContact O-N 3.14Å; D353-S357 VanDerWaalsContact O-CB 3.29Å; D353-S357 WeakPolarHBondContact O-CB 3.45Å; D353-S357 PolarHBondContact O-N 3Å
354	A	92.3	Very high	93	Very high	47 Å²	47	44.1 Å²	44.1	39%	0.388	25%	0.25	S	C	.	.	H	α-helix	trans	-59.3	-50.3	173.2	0	0	0	0	0	111.1	P350 M356 S357 D358	P350-A354 WeakPolarHBondContact O-CB 3.47Å; P350-A354 PolarHBondContact O-N 3.15Å; A354-M356 PolarHBondContact O-N 2.81Å; A354-S357 PolarHBondContact O-N 2.9Å; A354-D358 WeakPolarHBondContact O-CB 3.3Å; A354-D358 PolarHBondContact O-N 2.77Å
355	L	93.7	Very high	93.1	Very high	23 Å²	23	44.8 Å²	44.8	12%	0.12	25%	0.251	C	S	.	.	H	α-helix	trans	-66.5	-37.6	-179	-174	61.2	0	0	0	112.9	L287 Q290 V293 I294 K351 S352 D358 C359 G360	L287-L355 HydrophobicContact CD2-CD1 4.07Å; L287-L355 HydrophobicContact CD2-CD2 4.29Å; L287-L355 HydrophobicContact CD2-CG 4.11Å; Q290-L355 HydrophobicContact CB-CD2 3.48Å; Q290-L355 VanDerWaalsContact CB-CD2 3.48Å; Q290-L355 HydrophobicContact CG-CD2 3.75Å; V293-L355 HydrophobicContact CB-CD2 4.4Å; V293-L355 HydrophobicContact CG1-CD2 4.15Å; I294-L355 HydrophobicContact CD1-CD2 4.04Å; I294-L355 HydrophobicContact CG1-CD2 3.52Å; I294-L355 HydrophobicContact CG1-CG 4.24Å; K351-L355 WeakPolarHBondContact O-CB 3.22Å; K351-L355 PolarHBondContact O-N 2.97Å; S352-L355 PolarHBondContact O-N 3.47Å; L355-D358 PolarHBondContact O-N 3.06Å; L355-C359 PolarHBondContact O-N 3.2Å; L355-C359 VanDerWaalsContact O-N 3.12Å; L355-G360 PolarHBondContact O-N 3.31Å
356	M	94.6	Very high	93	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.02	28%	0.275	C	S	.	.	I	π-helix	trans	-63.8	-40.2	173.3	-75.2	-59.6	-64.8	0	0	111.6	I294 S352 D353 A354 G360 S361 F364 L377 S378 L381	I294-M356 HydrophobicContact CG2-CG 4.42Å; I294-M356 HydrophobicContact CG2-SD 3.77Å; S352-M356 WeakPolarHBondContact O-CB 3.37Å; S352-M356 VanDerWaalsContact O-CG 3.26Å; S352-M356 WeakPolarHBondContact O-CG 3.44Å; S352-M356 PolarHBondContact O-N 3.01Å; D353-M356 PolarHBondContact O-N 3.14Å; A354-M356 PolarHBondContact O-N 2.81Å; M356-G360 PolarHBondContact O-N 3.23Å; M356-S361 WeakPolarHBondContact O-CB 3.46Å; M356-S361 PolarHBondContact O-N 2.81Å; M356-S361 PolarHBondContact O-OG 2.83Å; M356-F364 HydrophobicContact CE-CD2 4.06Å; M356-F364 HydrophobicContact SD-CD2 4.08Å; M356-F364 HydrophobicContact SD-CE2 4.04Å; M356-L377 HydrophobicContact CE-CB 4.01Å; M356-L377 HydrophobicContact CE-CD2 3.99Å; M356-L377 HydrophobicContact CE-CG 4.08Å; M356-L377 HydrophobicContact SD-CD2 4.38Å; M356-S378 WeakPolarHBondContact CE-OG 3.32Å; M356-L381 HydrophobicContact CG-CD1 4.26Å; M356-L381 HydrophobicContact SD-CD1 4.41Å
357	S	92.7	Very high	93.2	Very high	96 Å²	96	51.3 Å²	51.3	67%	0.671	29%	0.285	S	S	*	.	I	π-helix	trans	-69.9	-38.1	176.3	-174.6	0	0	0	0	112.5	D353 A354	D353-S357 VanDerWaalsContact O-CB 3.29Å; D353-S357 WeakPolarHBondContact O-CB 3.45Å; D353-S357 PolarHBondContact O-N 3Å; A354-S357 PolarHBondContact O-N 2.9Å
358	D	91.1	Very high	93.5	Very high	127 Å²	127	51 Å²	51	68%	0.679	28%	0.284	S	S	*	.	I	π-helix	trans	-74.2	-45.7	-173.8	-72.1	-12.2	0	0	0	112.3	A354 L355	A354-D358 WeakPolarHBondContact O-CB 3.3Å; A354-D358 PolarHBondContact O-N 2.77Å; L355-D358 PolarHBondContact O-N 3.06Å
359	C	91.4	Very high	93.6	Very high	31 Å²	31	55.1 Å²	55.1	21%	0.209	31%	0.306	C	S	.	.	I	π-helix	trans	-149.7	-22.8	-178.2	60.3	0	0	0	0	115	L287 L355 S361 V362 F363	L287-C359 VanDerWaalsContact CD2-SG 3.54Å; L355-C359 PolarHBondContact O-N 3.2Å; L355-C359 VanDerWaalsContact O-N 3.12Å; C359-S361 PolarHBondContact O-N 3.04Å; C359-V362 PolarHBondContact O-N 2.65Å; C359-F363 PolarHBondContact O-N 3.03Å
360	G	91.7	Very high	93.7	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.334	C	S	.	.	I	π-helix	trans	-61.8	-42.2	-175.2	0	0	0	0	0	113.4	L355 M356 V362 F363 F364	L355-G360 PolarHBondContact O-N 3.31Å; M356-G360 PolarHBondContact O-N 3.23Å; G360-V362 VanDerWaalsContact C-N 3.29Å; G360-V362 PolarHBondContact O-N 2.75Å; G360-F363 PolarHBondContact O-N 3.29Å; G360-F363 VanDerWaalsContact O-N 3.13Å; G360-F364 WeakPolarHBondContact O-CD2 3.49Å; G360-F364 PolarHBondContact O-N 3.16Å
361	S	92.4	Very high	94	Very high	49 Å²	49	60 Å²	60	34%	0.343	33%	0.334	S	S	.	.	H	α-helix	trans	-60.1	-39.3	-177.7	-59.6	0	0	0	0	112.3	M356 C359 Q365	M356-S361 WeakPolarHBondContact O-CB 3.46Å; M356-S361 PolarHBondContact O-N 2.81Å; M356-S361 PolarHBondContact O-OG 2.83Å; C359-S361 PolarHBondContact O-N 3.04Å; S361-Q365 WeakPolarHBondContact O-CB 3.29Å; S361-Q365 PolarHBondContact O-N 2.83Å
362	V	93.5	Very high	94.3	Very high	109 Å²	109	61 Å²	61	66%	0.661	35%	0.345	S	S	*	.	H	α-helix	trans	-70.1	-41.7	177.5	-179.3	0	0	0	0	110.7	C359 G360 Q365	C359-V362 PolarHBondContact O-N 2.65Å; G360-V362 VanDerWaalsContact C-N 3.29Å; G360-V362 PolarHBondContact O-N 2.75Å; V362-Q365 PolarHBondContact O-N 3.47Å
363	F	95.4	Very high	94.1	Very high	31 Å²	31	62 Å²	62	14%	0.136	35%	0.35	C	S	.	.	H	α-helix	trans	-65.2	-42	-179.8	173.8	-103.7	0	0	0	113.2	E277 L283 P284 L287 C359 G360 P366	E277-F363 HydrophobicContact CB-CE1 4.21Å; E277-F363 HydrophobicContact CB-CZ 4.5Å; L283-F363 HydrophobicContact CD1-CD1 4.44Å; L283-F363 HydrophobicContact CD1-CE1 3.66Å; L283-F363 HydrophobicContact CD1-CE2 3.92Å; L283-F363 HydrophobicContact CD1-CZ 3.35Å; P284-F363 VanDerWaalsContact CD-CE2 3.43Å; P284-F363 HydrophobicContact CG-CD2 3.73Å; P284-F363 HydrophobicContact CG-CE2 4.28Å; P284-F363 HydrophobicContact CG-CG 4.42Å; L287-F363 HydrophobicContact CD1-CB 3.61Å; L287-F363 HydrophobicContact CD1-CD1 3.44Å; L287-F363 VanDerWaalsContact CD1-CD1 3.44Å; L287-F363 HydrophobicContact CD1-CD2 4.14Å; L287-F363 HydrophobicContact CD1-CE1 4.15Å; L287-F363 HydrophobicContact CD1-CG 3.43Å; L287-F363 VanDerWaalsContact CD1-CG 3.43Å; C359-F363 PolarHBondContact O-N 3.03Å; G360-F363 PolarHBondContact O-N 3.29Å; G360-F363 VanDerWaalsContact O-N 3.13Å; F363-P366 VanDerWaalsContact O-CD 3.28Å; F363-P366 WeakPolarHBondContact O-CD 3.39Å
364	F	96.4	Very high	93.9	Very high	4 Å²	4	69.3 Å²	69.3	2%	0.018	38%	0.379	C	S	.	.	H	α-helix	trans	-83	-11.1	-178.2	-69.3	-70.1	0	0	0	114	Y274 E277 M278 I294 F295 M356 G360 R367 Q368 L377	Y274-F364 HydrophobicContact CD1-CB 4.36Å; Y274-F364 AromaticContact CD1-CD1 3.82Å; Y274-F364 HydrophobicContact CD1-CD1 3.82Å; Y274-F364 HydrophobicContact CD1-CE1 4.47Å; Y274-F364 HydrophobicContact CD1-CG 4.31Å; Y274-F364 HydrophobicContact CE1-CB 4.31Å; E277-F364 HydrophobicContact CB-CD1 4.26Å; E277-F364 HydrophobicContact CB-CE1 3.93Å; M278-F364 HydrophobicContact CG-CZ 4.44Å; M278-F364 HydrophobicContact SD-CE1 4.42Å; M278-F364 HydrophobicContact SD-CZ 3.7Å; I294-F364 HydrophobicContact CD1-CE2 4.14Å; I294-F364 HydrophobicContact CD1-CZ 4.39Å; I294-F364 HydrophobicContact CG2-CE2 4.3Å; F295-F364 HydrophobicContact CE2-CZ 4.11Å; F295-F364 HydrophobicContact CZ-CE1 4.13Å; F295-F364 AromaticContact CZ-CZ 3.76Å; F295-F364 HydrophobicContact CZ-CZ 3.76Å; M356-F364 HydrophobicContact CE-CD2 4.06Å; M356-F364 HydrophobicContact SD-CD2 4.08Å; M356-F364 HydrophobicContact SD-CE2 4.04Å; G360-F364 WeakPolarHBondContact O-CD2 3.49Å; G360-F364 PolarHBondContact O-N 3.16Å; F364-R367 PolarHBondContact O-N 2.93Å; F364-R367 VanDerWaalsContact O-N 3.15Å; F364-Q368 PolarHBondContact O-N 2.89Å; F364-L377 HydrophobicContact CB-CD2 4.32Å; F364-L377 HydrophobicContact CD1-CD2 3.97Å; F364-L377 HydrophobicContact CD2-CD2 3.52Å; F364-L377 HydrophobicContact CE1-CD2 4.08Å; F364-L377 HydrophobicContact CE2-CD2 3.69Å; F364-L377 HydrophobicContact CG-CD2 3.68Å; F364-L377 HydrophobicContact CZ-CD2 3.96Å
365	Q	95.4	Very high	93.8	Very high	105 Å²	105	70.7 Å²	70.7	49%	0.491	38%	0.38	S	S	.	.	H	α-helix	trans	-56.5	-43.9	-178.4	-174.4	-177.9	16.3	0	0	113.9	S361 V362 R367 Q368 L369	S361-Q365 WeakPolarHBondContact O-CB 3.29Å; S361-Q365 PolarHBondContact O-N 2.83Å; V362-Q365 PolarHBondContact O-N 3.47Å; Q365-R367 VanDerWaalsContact C-N 3.31Å; Q365-R367 PolarHBondContact O-N 2.76Å; Q365-Q368 WeakPolarHBondContact O-CB 3.2Å; Q365-Q368 PolarHBondContact O-N 3.48Å; Q365-L369 WeakPolarHBondContact O-CG 3.41Å; Q365-L369 PolarHBondContact O-N 2.96Å
366	P	94.9	Very high	93.7	Very high	81 Å²	81	72.3 Å²	72.3	53%	0.526	39%	0.389	S	S	.	.	H	α-helix	trans	-61.1	-39.5	176.7	-23.5	35.6	0	0	0	112.5	F363 L369 V370	F363-P366 VanDerWaalsContact O-CD 3.28Å; F363-P366 WeakPolarHBondContact O-CD 3.39Å; P366-L369 PolarHBondContact O-N 2.76Å; P366-V370 WeakPolarHBondContact O-CG2 3.44Å; P366-V370 PolarHBondContact O-N 2.82Å
367	R	95.3	Very high	93.8	Very high	66 Å²	66	72.3 Å²	72.3	25%	0.249	39%	0.389	C	S	.	.	H	α-helix	trans	-66.3	-44.3	176.8	-176.5	60.6	169.5	178	2	111.2	H273 Y274 E277 F364 Q365 L369 V370 L371	H273-R367 PolarHBondContact O-NE 2.81Å; Y274-R367 HydrophobicContact CD1-CG 4.42Å; Y274-R367 HydrophobicContact CE1-CG 4.35Å; E277-R367 HydrophobicContact CG-CB 4.07Å; E277-R367 HydrophobicContact CG-CG 3.74Å; E277-R367 VanDerWaalsContact OE1-CD 3.31Å; E277-R367 WeakPolarHBondContact OE1-CD 3.42Å; E277-R367 IonicContact OE1-CZ 3.63Å; E277-R367 IonicContact OE1-NE 3.29Å; E277-R367 PolarHBondContact OE1-NE 3.31Å; E277-R367 IonicContact OE1-NH1 3.9Å; F364-R367 PolarHBondContact O-N 2.93Å; F364-R367 VanDerWaalsContact O-N 3.15Å; Q365-R367 VanDerWaalsContact C-N 3.31Å; Q365-R367 PolarHBondContact O-N 2.76Å; R367-L369 PolarHBondContact O-N 3.05Å; R367-V370 PolarHBondContact O-N 3.48Å; R367-V370 VanDerWaalsContact O-N 3.13Å; R367-L371 HydrophobicContact CG-CD1 3.92Å; R367-L371 HydrophobicContact CG-CG 4.39Å; R367-L371 VanDerWaalsContact O-CG 3.31Å; R367-L371 WeakPolarHBondContact O-CG 3.44Å; R367-L371 PolarHBondContact O-N 3.31Å
368	Q	95.6	Very high	93.9	Very high	44 Å²	44	69.1 Å²	69.1	21%	0.206	37%	0.366	C	S	.	.	H	α-helix	trans	-55.1	-41.7	174.7	-172.2	-170.2	-12.8	0	0	111.6	F364 Q365 L371 L372 D373 L375	F364-Q368 PolarHBondContact O-N 2.89Å; Q365-Q368 WeakPolarHBondContact O-CB 3.2Å; Q365-Q368 PolarHBondContact O-N 3.48Å; Q368-L371 PolarHBondContact O-N 3.15Å; Q368-L372 PolarHBondContact O-N 3.15Å; Q368-L372 VanDerWaalsContact O-N 3.13Å; Q368-D373 HydrophobicContact CG-CB 3.57Å; Q368-D373 PolarHBondContact NE2-O 3.47Å; Q368-D373 PolarHBondContact O-N 3.34Å; Q368-L375 PolarHBondContact NE2-O 2.95Å
369	L	96	Very high	94	Very high	117 Å²	117	65.2 Å²	65.2	61%	0.613	35%	0.349	S	S	*	.	H	α-helix	trans	-65.9	-42.8	176.2	-71.6	171.9	0	0	0	112.5	Q365 P366 R367 L371 L372	Q365-L369 WeakPolarHBondContact O-CG 3.41Å; Q365-L369 PolarHBondContact O-N 2.96Å; P366-L369 PolarHBondContact O-N 2.76Å; R367-L369 PolarHBondContact O-N 3.05Å; L369-L371 VanDerWaalsContact C-N 3.29Å; L369-L371 PolarHBondContact O-N 3.18Å; L369-L372 WeakPolarHBondContact O-CD2 3.22Å; L369-L372 PolarHBondContact O-N 3.06Å; L369-L372 VanDerWaalsContact O-N 3.1Å
370	V	96.4	Very high	94.1	Very high	107 Å²	107	65.2 Å²	65.2	65%	0.648	35%	0.345	S	S	*	.	H	α-helix	trans	-62.6	-37.9	176.9	169.8	0	0	0	0	111.6	P366 R367 L372	P366-V370 WeakPolarHBondContact O-CG2 3.44Å; P366-V370 PolarHBondContact O-N 2.82Å; R367-V370 PolarHBondContact O-N 3.48Å; R367-V370 VanDerWaalsContact O-N 3.13Å; V370-L372 PolarHBondContact O-N 3.32Å
371	L	95.9	Very high	94.4	Very high	38 Å²	38	65.2 Å²	65.2	20%	0.199	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-9.5	177.1	-63.1	171.3	0	0	0	113.2	H273 Y274 R367 Q368 L369 D373	H273-L371 HydrophobicContact CB-CD1 3.67Å; H273-L371 HydrophobicContact CB-CD2 4.14Å; Y274-L371 HydrophobicContact CD2-CD1 4.45Å; Y274-L371 HydrophobicContact CE2-CD1 3.83Å; R367-L371 HydrophobicContact CG-CD1 3.92Å; R367-L371 HydrophobicContact CG-CG 4.39Å; R367-L371 VanDerWaalsContact O-CG 3.31Å; R367-L371 WeakPolarHBondContact O-CG 3.44Å; R367-L371 PolarHBondContact O-N 3.31Å; Q368-L371 PolarHBondContact O-N 3.15Å; L369-L371 VanDerWaalsContact C-N 3.29Å; L369-L371 PolarHBondContact O-N 3.18Å; L371-D373 HydrophobicContact CB-CB 4.46Å; L371-D373 PolarHBondContact O-N 3.26Å
372	L	95.9	Very high	94.5	Very high	151 Å²	151	65.2 Å²	65.2	79%	0.791	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.5	36.4	-171.9	-56.8	173.5	0	0	0	112.4	Q368 L369 V370 K374	Q368-L372 PolarHBondContact O-N 3.15Å; Q368-L372 VanDerWaalsContact O-N 3.13Å; L369-L372 WeakPolarHBondContact O-CD2 3.22Å; L369-L372 PolarHBondContact O-N 3.06Å; L369-L372 VanDerWaalsContact O-N 3.1Å; V370-L372 PolarHBondContact O-N 3.32Å; L372-K374 PolarHBondContact O-N 3.02Å
373	D	93.2	Very high	94.5	Very high	22 Å²	22	62.2 Å²	62.2	12%	0.118	32%	0.319	C	S	.	.			trans	-71.1	126.7	-175.9	-92.3	-14.9	0	0	0	111.7	Y269 Y274 Q368 L371 L375 Y380	Y269-D373 WeakPolarHBondContact CE1-OD2 3.29Å; Y269-D373 PolarHBondContact OH-OD1 3.34Å; Y269-D373 PolarHBondContact OH-OD2 3.12Å; Y274-D373 WeakPolarHBondContact CE2-OD2 3.17Å; Y274-D373 PolarHBondContact OH-OD2 2.93Å; Q368-D373 HydrophobicContact CG-CB 3.57Å; Q368-D373 PolarHBondContact NE2-O 3.47Å; Q368-D373 PolarHBondContact O-N 3.34Å; L371-D373 HydrophobicContact CB-CB 4.46Å; L371-D373 PolarHBondContact O-N 3.26Å; D373-L375 VanDerWaalsContact C-N 3.3Å; D373-L375 PolarHBondContact O-N 2.94Å; D373-Y380 PolarHBondContact OD1-OH 3.22Å
374	K	89.3	Confident	94.5	Very high	203 Å²	203	60.8 Å²	60.8	88%	0.883	31%	0.312	S	S	*	.	S	Bend	trans	-71.8	-24.5	175.9	-62.6	-177.5	-177.8	178.6	0	113.2	L372	L372-K374 PolarHBondContact O-N 3.02Å
375	L	88.9	Confident	94.3	Very high	77 Å²	77	60.8 Å²	60.8	40%	0.403	31%	0.313	S	S	.	.	S	Bend	trans	-115.4	145.6	-178.1	-64.4	176.3	0	0	0	109.3	Q368 D373 Y380	Q368-L375 PolarHBondContact NE2-O 2.95Å; D373-L375 VanDerWaalsContact C-N 3.3Å; D373-L375 PolarHBondContact O-N 2.94Å; L375-Y380 HydrophobicContact CB-CD2 4.27Å; L375-Y380 HydrophobicContact CB-CE2 3.77Å
376	D	91.8	Very high	94	Very high	57 Å²	57	56.9 Å²	56.9	31%	0.305	30%	0.295	S	S	.	.			trans	-74.3	161.6	172.5	70	-13.4	0	0	0	111.5	S378 S379 Y380	D376-S378 PolarHBondContact O-N 3.32Å; D376-S378 WeakPolarHBondContact OD2-CB 3.47Å; D376-S379 WeakPolarHBondContact O-CB 3.45Å; D376-S379 PolarHBondContact O-N 3.32Å; D376-S379 WeakPolarHBondContact OD1-CB 3.31Å; D376-S379 PolarHBondContact OD1-N 2.9Å; D376-S379 PolarHBondContact OD1-OG 3.24Å; D376-Y380 WeakPolarHBondContact O-CD2 3.43Å; D376-Y380 PolarHBondContact O-N 3.35Å
377	L	96.3	Very high	94	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.021	27%	0.271	C	S	.	.	H	α-helix	trans	-56.2	-37.8	178.3	176.5	58.6	0	0	0	111.7	V270 Y274 F295 M356 F364 S379 Y380 L381	V270-L377 HydrophobicContact CG1-CD1 3.98Å; Y274-L377 HydrophobicContact CD1-CB 4.11Å; Y274-L377 HydrophobicContact CD1-CD1 3.97Å; Y274-L377 HydrophobicContact CD1-CD2 3.77Å; Y274-L377 HydrophobicContact CD1-CG 4.15Å; Y274-L377 HydrophobicContact CD2-CD1 3.88Å; Y274-L377 HydrophobicContact CE1-CB 3.94Å; Y274-L377 HydrophobicContact CE1-CD1 4.43Å; Y274-L377 HydrophobicContact CE1-CD2 4.42Å; Y274-L377 HydrophobicContact CE1-CG 4.48Å; Y274-L377 HydrophobicContact CE2-CD1 4.35Å; Y274-L377 HydrophobicContact CG-CD1 3.65Å; Y274-L377 HydrophobicContact CG-CD2 4.12Å; Y274-L377 HydrophobicContact CG-CG 4.33Å; F295-L377 HydrophobicContact CE1-CD1 4.22Å; F295-L377 HydrophobicContact CE1-CD2 3.98Å; F295-L377 HydrophobicContact CZ-CD2 4.07Å; M356-L377 HydrophobicContact CE-CB 4.01Å; M356-L377 HydrophobicContact CE-CD2 3.99Å; M356-L377 HydrophobicContact CE-CG 4.08Å; M356-L377 HydrophobicContact SD-CD2 4.38Å; F364-L377 HydrophobicContact CB-CD2 4.32Å; F364-L377 HydrophobicContact CD1-CD2 3.97Å; F364-L377 HydrophobicContact CD2-CD2 3.52Å; F364-L377 HydrophobicContact CE1-CD2 4.08Å; F364-L377 HydrophobicContact CE2-CD2 3.69Å; F364-L377 HydrophobicContact CG-CD2 3.68Å; F364-L377 HydrophobicContact CZ-CD2 3.96Å; L377-S379 PolarHBondContact O-N 3.34Å; L377-Y380 WeakPolarHBondContact O-CA 3.44Å; L377-Y380 WeakPolarHBondContact O-CB 3.46Å; L377-Y380 PolarHBondContact O-N 2.99Å; L377-L381 HydrophobicContact CD1-CD1 4.38Å; L377-L381 HydrophobicContact CD1-CD2 4.34Å; L377-L381 HydrophobicContact CD1-CG 4.04Å; L377-L381 HydrophobicContact CD2-CD1 4.45Å; L377-L381 HydrophobicContact CG-CD1 3.97Å; L377-L381 HydrophobicContact CG-CG 4.13Å; L377-L381 WeakPolarHBondContact O-CG 3.32Å; L377-L381 PolarHBondContact O-N 3.39Å
378	S	94.7	Very high	93.9	Very high	28 Å²	28	50.2 Å²	50.2	20%	0.196	26%	0.259	C	S	.	.	H	α-helix	trans	-55.6	-39.3	177	-55.5	0	0	0	0	112.2	M356 D376 L381 L382	M356-S378 WeakPolarHBondContact CE-OG 3.32Å; D376-S378 PolarHBondContact O-N 3.32Å; D376-S378 WeakPolarHBondContact OD2-CB 3.47Å; S378-L381 PolarHBondContact O-N 2.98Å; S378-L382 PolarHBondContact O-N 3.35Å
379	S	92.7	Very high	93.5	Very high	45 Å²	45	48.1 Å²	48.1	32%	0.315	25%	0.249	S	C	.	.	H	α-helix	trans	-66.4	-38.8	174.3	-62.7	0	0	0	0	112.6	D376 L377 L382	D376-S379 WeakPolarHBondContact O-CB 3.45Å; D376-S379 PolarHBondContact O-N 3.32Å; D376-S379 WeakPolarHBondContact OD1-CB 3.31Å; D376-S379 PolarHBondContact OD1-N 2.9Å; D376-S379 PolarHBondContact OD1-OG 3.24Å; L377-S379 PolarHBondContact O-N 3.34Å; S379-L382 PolarHBondContact O-N 3.47Å
380	Y	95.1	Very high	93.1	Very high	32 Å²	32	44.4 Å²	44.4	13%	0.125	23%	0.228	C	C	.	.	H	α-helix	trans	-66.2	-38.6	173.8	-74.4	-87	0	0	0	112.3	Y269 V270 D373 L375 D376 L377 L382 K383	Y269-Y380 HydrophobicContact CD1-CD1 4.3Å; Y269-Y380 AromaticContact CD1-CE1 3.8Å; Y269-Y380 HydrophobicContact CD1-CE1 3.8Å; Y269-Y380 HydrophobicContact CE1-CE1 4.12Å; Y269-Y380 HydrophobicContact CE1-CE2 4.44Å; Y269-Y380 AromaticContact CE1-CZ 3.91Å; V270-Y380 HydrophobicContact CG2-CD1 4.13Å; V270-Y380 HydrophobicContact CG2-CG 4.09Å; D373-Y380 PolarHBondContact OD1-OH 3.22Å; L375-Y380 HydrophobicContact CB-CD2 4.27Å; L375-Y380 HydrophobicContact CB-CE2 3.77Å; D376-Y380 WeakPolarHBondContact O-CD2 3.43Å; D376-Y380 PolarHBondContact O-N 3.35Å; L377-Y380 WeakPolarHBondContact O-CA 3.44Å; L377-Y380 WeakPolarHBondContact O-CB 3.46Å; L377-Y380 PolarHBondContact O-N 2.99Å; Y380-L382 PolarHBondContact O-N 2.95Å; Y380-K383 HydrophobicContact CD1-CD 4.12Å; Y380-K383 VanDerWaalsContact CD1-CE 3.46Å; Y380-K383 VanDerWaalsContact O-CB 3.3Å; Y380-K383 WeakPolarHBondContact O-CB 3.41Å; Y380-K383 WeakPolarHBondContact O-CG 3.13Å; Y380-K383 PolarHBondContact O-N 3.44Å; Y380-K383 VanDerWaalsContact O-N 3.13Å
381	L	96.8	Very high	93	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-69.6	-12.5	176.7	-63.4	176	0	0	0	113.2	V270 I294 F295 I298 Y345 K349 M356 L377 S378	V270-L381 HydrophobicContact CG1-CD2 4.27Å; I294-L381 HydrophobicContact CG2-CD1 4.08Å; F295-L381 HydrophobicContact CD1-CD2 3.92Å; F295-L381 HydrophobicContact CE1-CD2 4.45Å; I298-L381 HydrophobicContact CD1-CD2 4.32Å; Y345-L381 PolarHBondContact OH-O 2.98Å; K349-L381 WeakPolarHBondContact CE-O 2.91Å; M356-L381 HydrophobicContact CG-CD1 4.26Å; M356-L381 HydrophobicContact SD-CD1 4.41Å; L377-L381 HydrophobicContact CD1-CD1 4.38Å; L377-L381 HydrophobicContact CD1-CD2 4.34Å; L377-L381 HydrophobicContact CD1-CG 4.04Å; L377-L381 HydrophobicContact CD2-CD1 4.45Å; L377-L381 HydrophobicContact CG-CD1 3.97Å; L377-L381 HydrophobicContact CG-CG 4.13Å; L377-L381 WeakPolarHBondContact O-CG 3.32Å; L377-L381 PolarHBondContact O-N 3.39Å; S378-L381 PolarHBondContact O-N 2.98Å
382	L	94.6	Very high	92.8	Very high	48 Å²	48	37.8 Å²	37.8	25%	0.251	19%	0.19	S	C	.	.	H	α-helix	trans	-81.9	-19.7	172.2	-167.8	60.9	0	0	0	112.8	S378 S379 Y380 V385 Q386	S378-L382 PolarHBondContact O-N 3.35Å; S379-L382 PolarHBondContact O-N 3.47Å; Y380-L382 PolarHBondContact O-N 2.95Å; L382-V385 HydrophobicContact CD1-CB 4.25Å; L382-V385 HydrophobicContact CD1-CG2 4.28Å; L382-V385 PolarHBondContact O-N 2.94Å; L382-Q386 HydrophobicContact CG-CG 4.1Å; L382-Q386 PolarHBondContact O-N 3.5Å
383	K	94.1	Very high	92.4	Very high	47 Å²	47	31.1 Å²	31.1	20%	0.204	16%	0.155	C	C	.	.	H	α-helix	trans	-56.3	-39.9	-173.8	-68	179.3	-178.6	-68.5	0	114.7	Y263 Y380 V385 Q386 R387	Y263-K383 HydrophobicContact CE2-CB 4.4Å; Y380-K383 HydrophobicContact CD1-CD 4.12Å; Y380-K383 VanDerWaalsContact CD1-CE 3.46Å; Y380-K383 VanDerWaalsContact O-CB 3.3Å; Y380-K383 WeakPolarHBondContact O-CB 3.41Å; Y380-K383 WeakPolarHBondContact O-CG 3.13Å; Y380-K383 PolarHBondContact O-N 3.44Å; Y380-K383 VanDerWaalsContact O-N 3.13Å; K383-V385 VanDerWaalsContact C-N 3.34Å; K383-V385 PolarHBondContact O-N 3.38Å; K383-Q386 PolarHBondContact O-N 2.88Å; K383-R387 WeakPolarHBondContact O-CB 3.26Å; K383-R387 PolarHBondContact O-N 3.47Å
384	P	95.6	Very high	92.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.2	-39.7	176.1	-25.1	35.7	0	0	0	113.2	Y263 L267 I301 Y342 Y345 R387 M388	Y263-P384 WeakPolarHBondContact OH-CA 3.26Å; L267-P384 HydrophobicContact CD2-CG 3.98Å; I301-P384 HydrophobicContact CD1-CB 4.34Å; Y342-P384 HydrophobicContact CD1-CB 4.19Å; Y342-P384 WeakPolarHBondContact CD1-O 3.23Å; Y342-P384 HydrophobicContact CE1-CB 3.86Å; Y342-P384 VanDerWaalsContact CE1-O 3.25Å; Y342-P384 WeakPolarHBondContact CE1-O 3.23Å; Y345-P384 HydrophobicContact CD1-CB 3.89Å; Y345-P384 HydrophobicContact CD1-CG 4.34Å; Y345-P384 HydrophobicContact CE1-CB 3.8Å; Y345-P384 HydrophobicContact CE1-CG 3.8Å; Y345-P384 HydrophobicContact CE2-CG 4.29Å; Y345-P384 HydrophobicContact CG-CB 4.4Å; P384-R387 PolarHBondContact O-N 2.73Å; P384-M388 PolarHBondContact O-N 3.25Å
385	V	90.9	Very high	92.2	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.024	11%	0.109	C	C	.	.	H	α-helix	trans	-66.6	-44.2	178	-162	0	0	0	0	110.2	A146 Y345 N346 K349 L382 K383	A146-V385 HydrophobicContact CB-CB 4.01Å; A146-V385 HydrophobicContact CB-CG1 3.43Å; A146-V385 VanDerWaalsContact CB-CG1 3.43Å; Y345-V385 HydrophobicContact CD1-CG2 4.26Å; Y345-V385 HydrophobicContact CE1-CG2 4.17Å; N346-V385 WeakPolarHBondContact OD1-CG2 3.42Å; K349-V385 HydrophobicContact CG-CG2 4.41Å; L382-V385 HydrophobicContact CD1-CB 4.25Å; L382-V385 HydrophobicContact CD1-CG2 4.28Å; L382-V385 PolarHBondContact O-N 2.94Å; K383-V385 VanDerWaalsContact C-N 3.34Å; K383-V385 PolarHBondContact O-N 3.38Å
386	Q	91	Very high	92.2	Very high	24 Å²	24	18.4 Å²	18.4	11%	0.112	10%	0.096	C	C	.	.	H	α-helix	trans	-61.3	-42.8	174.7	-69.2	167.5	-21.8	0	0	112	A142 D143 L382 K383 M388 G389 K390	A142-Q386 HydrophobicContact CB-CB 4.27Å; D143-Q386 VanDerWaalsContact OD1-CG 3.31Å; D143-Q386 WeakPolarHBondContact OD1-CG 3.45Å; D143-Q386 PolarHBondContact OD1-NE2 3.08Å; L382-Q386 HydrophobicContact CG-CG 4.1Å; L382-Q386 PolarHBondContact O-N 3.5Å; K383-Q386 PolarHBondContact O-N 2.88Å; Q386-M388 VanDerWaalsContact C-N 3.28Å; Q386-M388 PolarHBondContact O-N 2.89Å; Q386-G389 WeakPolarHBondContact O-CA 3.36Å; Q386-G389 PolarHBondContact O-N 3.48Å; Q386-K390 PolarHBondContact O-N 3.37Å
387	R	95	Very high	91.9	Very high	7 Å²	7	19.9 Å²	19.9	3%	0.026	10%	0.101	C	C	.	.	H	α-helix	trans	-58.8	-41.6	-176	-174.5	67.9	-180	160.1	5.7	111.5	T259 E260 Y263 K383 P384 G389 K390 Y391	T259-R387 PolarHBondContact O-NH1 3.45Å; T259-R387 PolarHBondContact OG1-NH1 2.93Å; T259-R387 VanDerWaalsContact OG1-NH1 3.16Å; T259-R387 PolarHBondContact OG1-NH2 3.15Å; E260-R387 VanDerWaalsContact CA-NH2 3.34Å; E260-R387 IonicContact OE2-CZ 2.76Å; E260-R387 VanDerWaalsContact OE2-CZ 3.28Å; E260-R387 IonicContact OE2-NE 2.75Å; E260-R387 PolarHBondContact OE2-NE 2.69Å; E260-R387 IonicContact OE2-NH2 3.83Å; E260-R387 PolarHBondContact OE2-NH2 2.82Å; Y263-R387 HydrophobicContact CD1-CG 3.7Å; Y263-R387 HydrophobicContact CD2-CB 3.98Å; Y263-R387 HydrophobicContact CD2-CG 3.95Å; Y263-R387 HydrophobicContact CE1-CB 4.2Å; Y263-R387 HydrophobicContact CE1-CG 3.65Å; Y263-R387 HydrophobicContact CE2-CB 3.63Å; Y263-R387 HydrophobicContact CE2-CG 3.91Å; Y263-R387 HydrophobicContact CG-CB 4.4Å; Y263-R387 HydrophobicContact CG-CG 3.85Å; K383-R387 WeakPolarHBondContact O-CB 3.26Å; K383-R387 PolarHBondContact O-N 3.47Å; P384-R387 PolarHBondContact O-N 2.73Å; R387-G389 VanDerWaalsContact C-N 3.33Å; R387-G389 PolarHBondContact O-N 3.36Å; R387-K390 WeakPolarHBondContact O-CB 3.31Å; R387-K390 PolarHBondContact O-N 3.19Å; R387-K390 VanDerWaalsContact O-N 3.12Å; R387-Y391 HydrophobicContact CG-CD2 4.35Å; R387-Y391 HydrophobicContact CG-CE1 4.28Å; R387-Y391 HydrophobicContact CG-CE2 3.62Å; R387-Y391 WeakPolarHBondContact CG-OH 3.46Å; R387-Y391 VanDerWaalsContact NE-CZ 3.32Å; R387-Y391 PolarHBondContact NE-OH 2.96Å; R387-Y391 WeakPolarHBondContact O-CD2 3.48Å; R387-Y391 PolarHBondContact O-N 2.7Å
388	M	91.5	Very high	91.4	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-60.4	-41.7	174.9	-69.1	-63.3	-75.6	0	0	112.4	F339 Y342 P384 Q386 K390 Y391 V392 V420 Q423 L424	F339-M388 HydrophobicContact CD1-CE 4.13Å; F339-M388 HydrophobicContact CD1-SD 3.83Å; F339-M388 HydrophobicContact CE1-SD 4.19Å; Y342-M388 HydrophobicContact CD1-CG 3.25Å; Y342-M388 HydrophobicContact CD1-SD 3.73Å; Y342-M388 HydrophobicContact CD2-CE 4.42Å; Y342-M388 HydrophobicContact CD2-CG 4.25Å; Y342-M388 HydrophobicContact CD2-SD 3.58Å; Y342-M388 VanDerWaalsContact CD2-SD 3.58Å; Y342-M388 HydrophobicContact CE1-CG 3.69Å; Y342-M388 HydrophobicContact CE1-SD 4Å; Y342-M388 HydrophobicContact CE2-SD 3.89Å; Y342-M388 HydrophobicContact CG-CE 4.24Å; Y342-M388 HydrophobicContact CG-CG 3.55Å; Y342-M388 HydrophobicContact CG-SD 3.49Å; P384-M388 PolarHBondContact O-N 3.25Å; Q386-M388 VanDerWaalsContact C-N 3.28Å; Q386-M388 PolarHBondContact O-N 2.89Å; M388-K390 VanDerWaalsContact C-N 3.34Å; M388-K390 PolarHBondContact O-N 2.74Å; M388-Y391 PolarHBondContact O-N 3.42Å; M388-Y391 HydrophobicContact SD-CD2 3.96Å; M388-Y391 HydrophobicContact SD-CE2 4.26Å; M388-V392 PolarHBondContact O-N 2.8Å; M388-V420 HydrophobicContact CE-CG1 3.75Å; M388-V420 WeakPolarHBondContact O-CG1 3.41Å; M388-V420 HydrophobicContact SD-CG1 4.34Å; M388-Q423 HydrophobicContact CE-CB 3.62Å; M388-L424 HydrophobicContact CB-CD1 4.11Å; M388-L424 HydrophobicContact CB-CD2 3.24Å; M388-L424 HydrophobicContact CB-CG 3.66Å; M388-L424 HydrophobicContact CE-CG 4.41Å; M388-L424 HydrophobicContact CG-CD2 4.05Å
389	G	88.6	Confident	91.2	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.8	-41.9	172.6	0	0	0	0	0	112.6	Q386 R387 Y391 V392 L393	Q386-G389 WeakPolarHBondContact O-CA 3.36Å; Q386-G389 PolarHBondContact O-N 3.48Å; R387-G389 VanDerWaalsContact C-N 3.33Å; R387-G389 PolarHBondContact O-N 3.36Å; G389-Y391 PolarHBondContact O-N 2.86Å; G389-V392 PolarHBondContact O-N 2.85Å; G389-L393 WeakPolarHBondContact O-CG 3.33Å; G389-L393 PolarHBondContact O-N 2.97Å
390	K	87.8	Confident	90.9	Very high	39 Å²	39	24.3 Å²	24.3	17%	0.17	11%	0.113	C	C	.	.	H	α-helix	trans	-62.5	-39.4	176.1	-66.6	-177.2	179.1	-175.5	0	112.5	D139 A142 Q386 R387 M388 V392 L393 M394	D139-K390 WeakPolarHBondContact OD1-CE 3.47Å; D139-K390 IonicContact OD1-NZ 3.7Å; D139-K390 PolarHBondContact OD1-NZ 3.02Å; A142-K390 HydrophobicContact CB-CG 3.68Å; Q386-K390 PolarHBondContact O-N 3.37Å; R387-K390 WeakPolarHBondContact O-CB 3.31Å; R387-K390 PolarHBondContact O-N 3.19Å; R387-K390 VanDerWaalsContact O-N 3.12Å; M388-K390 VanDerWaalsContact C-N 3.34Å; M388-K390 PolarHBondContact O-N 2.74Å; K390-V392 VanDerWaalsContact C-N 3.32Å; K390-V392 PolarHBondContact O-N 2.75Å; K390-L393 PolarHBondContact O-N 3.12Å; K390-M394 WeakPolarHBondContact O-CG 3.26Å; K390-M394 PolarHBondContact O-N 2.8Å
391	Y	93.8	Very high	90.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-58.4	-43.8	175.4	-68.3	-41.6	0	0	0	112.2	E260 H305 F309 F332 F339 R387 M388 G389 L393 M394 L395	E260-Y391 PolarHBondContact OE2-OH 3.25Å; H305-Y391 PolarHBondContact CE1-OH 3.41Å; F309-Y391 HydrophobicContact CE1-CE1 4.16Å; F332-Y391 AromaticContact CE1-CD1 3.68Å; F332-Y391 HydrophobicContact CE1-CD1 3.68Å; F332-Y391 AromaticContact CE1-CD2 3.98Å; F332-Y391 HydrophobicContact CE1-CD2 3.98Å; F332-Y391 HydrophobicContact CE1-CE1 4.19Å; F332-Y391 HydrophobicContact CE1-CE2 4.47Å; F332-Y391 AromaticContact CE1-CG 3.59Å; F332-Y391 HydrophobicContact CE1-CG 3.59Å; F332-Y391 AromaticContact CZ-CD1 3.41Å; F332-Y391 HydrophobicContact CZ-CD1 3.41Å; F332-Y391 VanDerWaalsContact CZ-CD1 3.41Å; F332-Y391 AromaticContact CZ-CE1 3.89Å; F332-Y391 HydrophobicContact CZ-CE1 3.89Å; F332-Y391 AromaticContact CZ-CG 3.82Å; F332-Y391 HydrophobicContact CZ-CG 3.82Å; F339-Y391 HydrophobicContact CE1-CD2 4Å; F339-Y391 AromaticContact CE1-CE2 3.73Å; F339-Y391 HydrophobicContact CE1-CE2 3.73Å; F339-Y391 HydrophobicContact CZ-CE2 4.41Å; R387-Y391 HydrophobicContact CG-CD2 4.35Å; R387-Y391 HydrophobicContact CG-CE1 4.28Å; R387-Y391 HydrophobicContact CG-CE2 3.62Å; R387-Y391 WeakPolarHBondContact CG-OH 3.46Å; R387-Y391 VanDerWaalsContact NE-CZ 3.32Å; R387-Y391 PolarHBondContact NE-OH 2.96Å; R387-Y391 WeakPolarHBondContact O-CD2 3.48Å; R387-Y391 PolarHBondContact O-N 2.7Å; M388-Y391 PolarHBondContact O-N 3.42Å; M388-Y391 HydrophobicContact SD-CD2 3.96Å; M388-Y391 HydrophobicContact SD-CE2 4.26Å; G389-Y391 PolarHBondContact O-N 2.86Å; Y391-L393 VanDerWaalsContact C-N 3.31Å; Y391-L393 PolarHBondContact O-N 3.26Å; Y391-M394 HydrophobicContact CD1-CE 3.39Å; Y391-M394 HydrophobicContact CE1-CE 3.93Å; Y391-M394 HydrophobicContact CG-CE 4.41Å; Y391-M394 PolarHBondContact O-N 3.42Å; Y391-L395 WeakPolarHBondContact O-CB 3.31Å; Y391-L395 VanDerWaalsContact O-CG 3.28Å; Y391-L395 WeakPolarHBondContact O-CG 3.35Å; Y391-L395 PolarHBondContact O-N 2.89Å
392	V	90.3	Very high	89.5	Confident	6 Å²	6	25 Å²	25	4%	0.036	13%	0.128	C	C	.	.	H	α-helix	trans	-59.4	-43.3	176.5	179.4	0	0	0	0	111.2	M388 G389 K390 D396 K417 V420 I421 L424	M388-V392 PolarHBondContact O-N 2.8Å; G389-V392 PolarHBondContact O-N 2.85Å; K390-V392 VanDerWaalsContact C-N 3.32Å; K390-V392 PolarHBondContact O-N 2.75Å; V392-D396 VanDerWaalsContact O-CB 3.28Å; V392-D396 WeakPolarHBondContact O-CB 3.45Å; V392-D396 PolarHBondContact O-N 2.95Å; V392-K417 HydrophobicContact CG1-CG 4.11Å; V392-V420 HydrophobicContact CG2-CB 4.14Å; V392-V420 HydrophobicContact CG2-CG1 3.58Å; V392-I421 HydrophobicContact CG1-CD1 4.01Å; V392-I421 HydrophobicContact CG1-CG1 3.97Å; V392-I421 HydrophobicContact CG2-CG1 3.71Å; V392-L424 HydrophobicContact CG2-CD1 4.15Å
393	L	87.7	Confident	88.7	Confident	11 Å²	11	25 Å²	25	6%	0.058	13%	0.134	C	C	.	.	H	α-helix	trans	-66.5	-43.6	178.7	-61.5	176.3	0	0	0	112.2	I141 F187 G389 K390 Y391 D396 Q397	I141-L393 HydrophobicContact CB-CD1 3.9Å; I141-L393 HydrophobicContact CG2-CD1 3.61Å; I141-L393 HydrophobicContact CG2-CD2 3.79Å; I141-L393 HydrophobicContact CG2-CG 4.28Å; F187-L393 HydrophobicContact CE1-CD2 4.15Å; F187-L393 HydrophobicContact CZ-CD2 3.63Å; G389-L393 WeakPolarHBondContact O-CG 3.33Å; G389-L393 PolarHBondContact O-N 2.97Å; K390-L393 PolarHBondContact O-N 3.12Å; Y391-L393 VanDerWaalsContact C-N 3.31Å; Y391-L393 PolarHBondContact O-N 3.26Å; L393-D396 PolarHBondContact O-N 3.39Å; L393-Q397 WeakPolarHBondContact O-CB 3.32Å; L393-Q397 VanDerWaalsContact O-CG 3.31Å; L393-Q397 WeakPolarHBondContact O-CG 3.28Å; L393-Q397 PolarHBondContact O-N 3.15Å
394	M	88.4	Confident	87.9	Confident	5 Å²	5	27.9 Å²	27.9	3%	0.025	17%	0.167	C	C	.	.	H	α-helix	trans	-65	-43.4	179.4	-70.7	-173.4	-61	0	0	111.4	M138 M252 V256 K390 Y391 Q397 L398	M138-M394 HydrophobicContact CE-CG 3.96Å; M252-M394 HydrophobicContact CE-CB 3.81Å; M252-M394 HydrophobicContact CE-CG 3.82Å; V256-M394 HydrophobicContact CG2-SD 4.01Å; K390-M394 WeakPolarHBondContact O-CG 3.26Å; K390-M394 PolarHBondContact O-N 2.8Å; Y391-M394 HydrophobicContact CD1-CE 3.39Å; Y391-M394 HydrophobicContact CE1-CE 3.93Å; Y391-M394 HydrophobicContact CG-CE 4.41Å; Y391-M394 PolarHBondContact O-N 3.42Å; M394-Q397 PolarHBondContact O-N 3.16Å; M394-L398 WeakPolarHBondContact O-CG 3.46Å; M394-L398 PolarHBondContact O-N 3.19Å
395	L	90.9	Very high	87.2	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-40.2	175.6	-68.4	166	0	0	0	111.2	V328 F332 Y391 Q397 L398 I399 L413 A416 K417 V420	V328-L395 HydrophobicContact CG1-CD2 4.39Å; F332-L395 HydrophobicContact CD1-CD1 4.37Å; F332-L395 HydrophobicContact CD2-CD2 4.15Å; F332-L395 HydrophobicContact CE1-CD1 4.39Å; F332-L395 HydrophobicContact CE2-CD2 4.2Å; F332-L395 HydrophobicContact CG-CD1 4.47Å; Y391-L395 WeakPolarHBondContact O-CB 3.31Å; Y391-L395 VanDerWaalsContact O-CG 3.28Å; Y391-L395 WeakPolarHBondContact O-CG 3.35Å; Y391-L395 PolarHBondContact O-N 2.89Å; L395-Q397 PolarHBondContact O-N 3.35Å; L395-L398 PolarHBondContact O-N 3.32Å; L395-I399 VanDerWaalsContact O-CG1 3.25Å; L395-I399 WeakPolarHBondContact O-CG1 3.36Å; L395-I399 PolarHBondContact O-N 3.41Å; L395-L413 HydrophobicContact CD2-CD2 3.8Å; L395-A416 HydrophobicContact CD1-CB 4.14Å; L395-A416 HydrophobicContact CD2-CB 4.14Å; L395-K417 HydrophobicContact CB-CB 4.04Å; L395-K417 HydrophobicContact CB-CG 4.47Å; L395-K417 HydrophobicContact CD1-CB 4.21Å; L395-V420 HydrophobicContact CD1-CG2 4.11Å
396	D	88	Confident	86.9	Confident	27 Å²	27	36.3 Å²	36.3	14%	0.144	21%	0.212	C	C	.	.	H	α-helix	trans	-64	-38.1	175.2	-169.7	74.7	0	0	0	112.9	V392 L393 I399 K400 K417	V392-D396 VanDerWaalsContact O-CB 3.28Å; V392-D396 WeakPolarHBondContact O-CB 3.45Å; V392-D396 PolarHBondContact O-N 2.95Å; L393-D396 PolarHBondContact O-N 3.39Å; D396-I399 PolarHBondContact O-N 3.24Å; D396-K400 WeakPolarHBondContact O-CG 3.33Å; D396-K400 PolarHBondContact O-N 2.9Å; D396-K400 WeakPolarHBondContact OD2-CE 3.38Å; D396-K400 IonicContact OD2-NZ 3.69Å; D396-K400 PolarHBondContact OD2-NZ 2.87Å; D396-K417 HydrophobicContact CB-CD 4.4Å; D396-K417 IonicContact OD1-NZ 2.93Å; D396-K417 PolarHBondContact OD1-NZ 2.82Å
397	Q	86.2	Confident	86.7	Confident	88 Å²	88	41.2 Å²	41.2	41%	0.411	24%	0.239	S	C	.	.	H	α-helix	trans	-65.3	-42.5	173.4	-76	173.1	-16.8	0	0	111.6	M252 L393 M394 L395 K400 G401	M252-Q397 HydrophobicContact CE-CB 4.16Å; L393-Q397 WeakPolarHBondContact O-CB 3.32Å; L393-Q397 VanDerWaalsContact O-CG 3.31Å; L393-Q397 WeakPolarHBondContact O-CG 3.28Å; L393-Q397 PolarHBondContact O-N 3.15Å; M394-Q397 PolarHBondContact O-N 3.16Å; L395-Q397 PolarHBondContact O-N 3.35Å; Q397-K400 PolarHBondContact O-N 2.78Å; Q397-G401 PolarHBondContact O-N 3.38Å
398	L	86.6	Confident	86.5	Confident	12 Å²	12	45.6 Å²	45.6	6%	0.063	26%	0.26	C	S	.	.	H	α-helix	trans	-60.7	-43.9	174.4	-75.6	169.9	0	0	0	111.5	M252 V328 M394 L395 K400 G401 C402 L413	M252-L398 HydrophobicContact CB-CD2 3.99Å; M252-L398 HydrophobicContact CG-CD2 3.58Å; M252-L398 HydrophobicContact CG-CG 4Å; V328-L398 HydrophobicContact CB-CD1 4.42Å; V328-L398 HydrophobicContact CG1-CD1 4.07Å; M394-L398 WeakPolarHBondContact O-CG 3.46Å; M394-L398 PolarHBondContact O-N 3.19Å; L395-L398 PolarHBondContact O-N 3.32Å; L398-K400 PolarHBondContact O-N 2.74Å; L398-G401 CarbonylContact O-C 3.57Å; L398-G401 WeakPolarHBondContact O-CA 3.34Å; L398-G401 PolarHBondContact O-N 3.3Å; L398-G401 VanDerWaalsContact O-N 3.09Å; L398-C402 PolarHBondContact O-N 3.36Å; L398-C402 VanDerWaalsContact O-N 3.12Å; L398-C402 PolarHBondContact O-SG 3.36Å; L398-L413 HydrophobicContact CB-CD1 3.88Å; L398-L413 HydrophobicContact CB-CD2 3.87Å; L398-L413 HydrophobicContact CD1-CD2 3.89Å
399	I	89.3	Confident	86.3	Confident	30 Å²	30	46 Å²	46	15%	0.154	26%	0.262	C	S	.	.	H	α-helix	trans	-59.3	-46.6	176.6	-67.8	165.2	0	0	0	110.9	L395 D396 G401 C402 V410 L413 Q414 K417	L395-I399 VanDerWaalsContact O-CG1 3.25Å; L395-I399 WeakPolarHBondContact O-CG1 3.36Å; L395-I399 PolarHBondContact O-N 3.41Å; D396-I399 PolarHBondContact O-N 3.24Å; I399-G401 PolarHBondContact O-N 3.41Å; I399-C402 WeakPolarHBondContact O-CB 3.47Å; I399-C402 PolarHBondContact O-N 3.25Å; I399-C402 VanDerWaalsContact O-N 3.13Å; I399-V410 HydrophobicContact CG2-CG1 4.28Å; I399-L413 HydrophobicContact CD1-CB 4.04Å; I399-L413 HydrophobicContact CG1-CB 3.47Å; I399-L413 VanDerWaalsContact CG1-CB 3.47Å; I399-L413 HydrophobicContact CG1-CD1 4.1Å; I399-L413 HydrophobicContact CG1-CG 4.39Å; I399-Q414 HydrophobicContact CD1-CB 4.35Å; I399-K417 HydrophobicContact CD1-CD 4.04Å
400	K	85.9	Confident	86.4	Confident	128 Å²	128	48.2 Å²	48.2	56%	0.557	28%	0.275	S	S	*	.	H	α-helix	trans	-65.8	-25.3	177.3	-73	167.1	175.3	163.3	0	113.2	D396 Q397 L398	D396-K400 WeakPolarHBondContact O-CG 3.33Å; D396-K400 PolarHBondContact O-N 2.9Å; D396-K400 WeakPolarHBondContact OD2-CE 3.38Å; D396-K400 IonicContact OD2-NZ 3.69Å; D396-K400 PolarHBondContact OD2-NZ 2.87Å; Q397-K400 PolarHBondContact O-N 2.78Å; L398-K400 PolarHBondContact O-N 2.74Å
401	G	80.7	Confident	86.7	Confident	33 Å²	33	50.7 Å²	50.7	34%	0.34	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-3.9	175.2	0	0	0	0	0	114.5	M245 Q397 L398 I399	M245-G401 VanDerWaalsContact CE-C 3.41Å; M245-G401 WeakPolarHBondContact CE-O 3.41Å; Q397-G401 PolarHBondContact O-N 3.38Å; L398-G401 CarbonylContact O-C 3.57Å; L398-G401 WeakPolarHBondContact O-CA 3.34Å; L398-G401 PolarHBondContact O-N 3.3Å; L398-G401 VanDerWaalsContact O-N 3.09Å; I399-G401 PolarHBondContact O-N 3.41Å
402	C	82.7	Confident	86.7	Confident	14 Å²	14	52 Å²	52	10%	0.095	30%	0.297	C	S	.	.	S	Bend	trans	-74.3	150.5	177.3	-65	0	0	0	0	111.4	L398 I399 Q409 V410 L413	L398-C402 PolarHBondContact O-N 3.36Å; L398-C402 VanDerWaalsContact O-N 3.12Å; L398-C402 PolarHBondContact O-SG 3.36Å; I399-C402 WeakPolarHBondContact O-CB 3.47Å; I399-C402 PolarHBondContact O-N 3.25Å; I399-C402 VanDerWaalsContact O-N 3.13Å; C402-Q409 PolarHBondContact SG-NE2 3Å; C402-V410 HydrophobicContact CB-CG2 3.55Å; C402-L413 VanDerWaalsContact SG-CD1 3.56Å
403	A	78.8	Confident	86.9	Confident	47 Å²	47	51.8 Å²	51.8	39%	0.388	30%	0.296	S	S	.	.			trans	-65.5	149.4	167.6	0	0	0	0	0	109.9	D405 D406	A403-D405 VanDerWaalsContact CB-OD1 3.24Å; A403-D405 WeakPolarHBondContact CB-OD1 3.3Å; A403-D405 PolarHBondContact O-N 3.34Å; A403-D406 PolarHBondContact O-N 2.78Å
404	A	76.1	Confident	87.2	Confident	109 Å²	109	54.2 Å²	54.2	90%	0.901	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-16.3	-174.4	0	0	0	0	0	113.7
405	D	81	Confident	87.6	Confident	138 Å²	138	57.7 Å²	57.7	74%	0.738	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-0.9	-179.9	59.2	-34.8	0	0	0	113.7	A403 D407	A403-D405 VanDerWaalsContact CB-OD1 3.24Å; A403-D405 WeakPolarHBondContact CB-OD1 3.3Å; A403-D405 PolarHBondContact O-N 3.34Å; D405-D407 PolarHBondContact O-N 3.44Å
406	D	85.1	Confident	87.8	Confident	43 Å²	43	57.6 Å²	57.6	23%	0.23	32%	0.323	C	S	.	.			trans	-93.7	67.5	179.4	-164.3	-13.2	0	0	0	112.1	A403 E408 Q409 V410	A403-D406 PolarHBondContact O-N 2.78Å; D406-E408 VanDerWaalsContact C-N 3.27Å; D406-E408 PolarHBondContact O-N 2.94Å; D406-Q409 HydrophobicContact CB-CB 4.3Å; D406-Q409 PolarHBondContact O-N 3.46Å; D406-Q409 WeakPolarHBondContact OD1-CB 3.31Å; D406-Q409 PolarHBondContact OD1-N 3.4Å; D406-Q409 VanDerWaalsContact OD2-CB 3.29Å; D406-Q409 WeakPolarHBondContact OD2-CB 2.79Å; D406-V410 WeakPolarHBondContact O-CG2 3.49Å; D406-V410 PolarHBondContact O-N 2.95Å; D406-V410 VanDerWaalsContact O-N 3.11Å
407	D	87.5	Confident	88.2	Confident	127 Å²	127	57.8 Å²	57.8	68%	0.679	32%	0.322	S	S	*	.	H	α-helix	trans	-61.3	-33.7	-179	-75	-32.4	0	0	0	112.7	D405 N411	D405-D407 PolarHBondContact O-N 3.44Å; D407-N411 WeakPolarHBondContact O-CB 2.9Å; D407-N411 PolarHBondContact O-N 3.44Å
408	E	88.8	Confident	88.5	Confident	99 Å²	99	58.7 Å²	58.7	46%	0.463	33%	0.326	S	S	.	.	H	α-helix	trans	-63.3	-51.5	178.5	-173.9	-169.9	171.7	0	0	110.5	R323 D406 N411 L412	R323-E408 IonicContact NH2-OE2 3.52Å; D406-E408 VanDerWaalsContact C-N 3.27Å; D406-E408 PolarHBondContact O-N 2.94Å; E408-N411 PolarHBondContact O-N 3.32Å; E408-L412 HydrophobicContact CG-CD1 4.26Å; E408-L412 WeakPolarHBondContact O-CG 3.43Å; E408-L412 PolarHBondContact O-N 3.09Å
409	Q	88.7	Confident	88.9	Confident	8 Å²	8	58.9 Å²	58.9	4%	0.037	33%	0.327	C	S	.	.	H	α-helix	trans	-64.6	-45.5	-178.4	-176.6	165	-71.2	0	0	111.9	K322 V326 C402 D406 N411 L412 L413	K322-Q409 PolarHBondContact O-OE1 3.17Å; V326-Q409 HydrophobicContact CG2-CB 3.65Å; V326-Q409 HydrophobicContact CG2-CG 3.79Å; C402-Q409 PolarHBondContact SG-NE2 3Å; D406-Q409 HydrophobicContact CB-CB 4.3Å; D406-Q409 PolarHBondContact O-N 3.46Å; D406-Q409 WeakPolarHBondContact OD1-CB 3.31Å; D406-Q409 PolarHBondContact OD1-N 3.4Å; D406-Q409 VanDerWaalsContact OD2-CB 3.29Å; D406-Q409 WeakPolarHBondContact OD2-CB 2.79Å; Q409-N411 VanDerWaalsContact C-N 3.32Å; Q409-N411 PolarHBondContact O-N 3.17Å; Q409-L412 PolarHBondContact O-N 3.23Å; Q409-L413 HydrophobicContact CG-CD1 3.79Å; Q409-L413 HydrophobicContact CG-CG 4.44Å; Q409-L413 WeakPolarHBondContact O-CB 3.05Å; Q409-L413 WeakPolarHBondContact O-CG 3.48Å; Q409-L413 PolarHBondContact O-N 3.09Å
410	V	90.8	Very high	89.1	Confident	47 Å²	47	57.5 Å²	57.5	29%	0.285	32%	0.32	S	S	.	.	H	α-helix	trans	-59.9	-45	178.7	171.4	0	0	0	0	110.6	I399 C402 D406 L413 Q414	I399-V410 HydrophobicContact CG2-CG1 4.28Å; C402-V410 HydrophobicContact CB-CG2 3.55Å; D406-V410 WeakPolarHBondContact O-CG2 3.49Å; D406-V410 PolarHBondContact O-N 2.95Å; D406-V410 VanDerWaalsContact O-N 3.11Å; V410-L413 PolarHBondContact O-N 3.48Å; V410-Q414 VanDerWaalsContact O-CB 3.26Å; V410-Q414 WeakPolarHBondContact O-CB 3.47Å; V410-Q414 PolarHBondContact O-N 2.65Å
411	N	93	Very high	89.3	Confident	90 Å²	90	53.3 Å²	53.3	48%	0.481	30%	0.303	S	S	.	.	H	α-helix	trans	-63.3	-45.5	179.2	-177	20.7	0	0	0	112.2	D407 E408 Q409 Q414 Q415	D407-N411 WeakPolarHBondContact O-CB 2.9Å; D407-N411 PolarHBondContact O-N 3.44Å; E408-N411 PolarHBondContact O-N 3.32Å; Q409-N411 VanDerWaalsContact C-N 3.32Å; Q409-N411 PolarHBondContact O-N 3.17Å; N411-Q414 PolarHBondContact O-N 3.12Å; N411-Q415 VanDerWaalsContact CG-NE2 3.34Å; N411-Q415 PolarHBondContact ND2-NE2 3.46Å; N411-Q415 WeakPolarHBondContact O-CG 3.25Å; N411-Q415 PolarHBondContact O-N 3.09Å; N411-Q415 PolarHBondContact O-NE2 3.45Å; N411-Q415 PolarHBondContact OD1-NE2 3.48Å
412	L	94.6	Very high	89.8	Confident	29 Å²	29	53.5 Å²	53.5	15%	0.152	30%	0.295	C	S	.	.	H	α-helix	trans	-64.3	-43.4	178.6	-74.9	173.4	0	0	0	112.3	V326 A329 K330 L333 E408 Q409 Q414 Q415 A416	V326-L412 HydrophobicContact CG1-CD1 3.82Å; V326-L412 HydrophobicContact CG2-CD1 4.44Å; A329-L412 HydrophobicContact CB-CB 3.83Å; K330-L412 HydrophobicContact CG-CD1 4.46Å; L333-L412 HydrophobicContact CD1-CD2 4.12Å; E408-L412 HydrophobicContact CG-CD1 4.26Å; E408-L412 WeakPolarHBondContact O-CG 3.43Å; E408-L412 PolarHBondContact O-N 3.09Å; Q409-L412 PolarHBondContact O-N 3.23Å; L412-Q414 VanDerWaalsContact C-N 3.31Å; L412-Q414 PolarHBondContact O-N 3.29Å; L412-Q415 PolarHBondContact O-N 2.96Å; L412-A416 PolarHBondContact O-N 3.32Å
413	L	93.9	Very high	90.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.8	-38.4	176.3	-75.4	165.8	0	0	0	111.9	G325 A329 L395 L398 I399 C402 Q409 V410 A416 K417	G325-L413 WeakPolarHBondContact O-CD2 3.29Å; A329-L413 HydrophobicContact CB-CD2 3.95Å; A329-L413 HydrophobicContact CB-CG 4.12Å; L395-L413 HydrophobicContact CD2-CD2 3.8Å; L398-L413 HydrophobicContact CB-CD1 3.88Å; L398-L413 HydrophobicContact CB-CD2 3.87Å; L398-L413 HydrophobicContact CD1-CD2 3.89Å; I399-L413 HydrophobicContact CD1-CB 4.04Å; I399-L413 HydrophobicContact CG1-CB 3.47Å; I399-L413 VanDerWaalsContact CG1-CB 3.47Å; I399-L413 HydrophobicContact CG1-CD1 4.1Å; I399-L413 HydrophobicContact CG1-CG 4.39Å; C402-L413 VanDerWaalsContact SG-CD1 3.56Å; Q409-L413 HydrophobicContact CG-CD1 3.79Å; Q409-L413 HydrophobicContact CG-CG 4.44Å; Q409-L413 WeakPolarHBondContact O-CB 3.05Å; Q409-L413 WeakPolarHBondContact O-CG 3.48Å; Q409-L413 PolarHBondContact O-N 3.09Å; V410-L413 PolarHBondContact O-N 3.48Å; L413-A416 PolarHBondContact O-N 3.44Å; L413-K417 WeakPolarHBondContact O-CB 3.04Å; L413-K417 PolarHBondContact O-N 2.67Å
414	Q	94.9	Very high	90.5	Very high	63 Å²	63	51.6 Å²	51.6	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-65.2	-43.5	176.5	-175.4	58.4	38	0	0	111.3	I399 V410 N411 L412 A416 K417 E418	I399-Q414 HydrophobicContact CD1-CB 4.35Å; V410-Q414 VanDerWaalsContact O-CB 3.26Å; V410-Q414 WeakPolarHBondContact O-CB 3.47Å; V410-Q414 PolarHBondContact O-N 2.65Å; N411-Q414 PolarHBondContact O-N 3.12Å; L412-Q414 VanDerWaalsContact C-N 3.31Å; L412-Q414 PolarHBondContact O-N 3.29Å; Q414-A416 PolarHBondContact O-N 2.97Å; Q414-K417 PolarHBondContact O-N 3.22Å; Q414-E418 WeakPolarHBondContact CG-OE1 3.48Å; Q414-E418 PolarHBondContact NE2-OE1 3.06Å; Q414-E418 WeakPolarHBondContact O-CB 3.49Å; Q414-E418 WeakPolarHBondContact O-CG 3.46Å; Q414-E418 PolarHBondContact O-N 3.36Å
415	Q	95.5	Very high	91	Very high	78 Å²	78	49.6 Å²	49.6	36%	0.364	25%	0.246	S	C	.	.	H	α-helix	trans	-60.3	-44.2	173.1	-73.4	172.9	63.5	0	0	112	L333 N411 L412 K417 E418 M419	L333-Q415 HydrophobicContact CD1-CB 4.13Å; L333-Q415 HydrophobicContact CD2-CB 4.15Å; N411-Q415 VanDerWaalsContact CG-NE2 3.34Å; N411-Q415 PolarHBondContact ND2-NE2 3.46Å; N411-Q415 WeakPolarHBondContact O-CG 3.25Å; N411-Q415 PolarHBondContact O-N 3.09Å; N411-Q415 PolarHBondContact O-NE2 3.45Å; N411-Q415 PolarHBondContact OD1-NE2 3.48Å; L412-Q415 PolarHBondContact O-N 2.96Å; Q415-K417 VanDerWaalsContact C-N 3.34Å; Q415-K417 PolarHBondContact O-N 3.25Å; Q415-E418 PolarHBondContact O-N 3.29Å; Q415-M419 WeakPolarHBondContact O-CB 3.38Å; Q415-M419 PolarHBondContact O-N 3.29Å
416	A	96.5	Very high	91.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.3	-43.2	176.1	0	0	0	0	0	111.6	A329 F332 L333 L395 L412 L413 Q414 M419 V420	A329-A416 HydrophobicContact CB-CB 4.23Å; F332-A416 HydrophobicContact CB-CB 3.79Å; F332-A416 HydrophobicContact CG-CB 4.43Å; L333-A416 HydrophobicContact CD2-CB 4.45Å; L333-A416 HydrophobicContact CG-CB 4.25Å; L395-A416 HydrophobicContact CD1-CB 4.14Å; L395-A416 HydrophobicContact CD2-CB 4.14Å; L412-A416 PolarHBondContact O-N 3.32Å; L413-A416 PolarHBondContact O-N 3.44Å; Q414-A416 PolarHBondContact O-N 2.97Å; A416-M419 WeakPolarHBondContact O-CB 2.84Å; A416-M419 PolarHBondContact O-N 3.36Å; A416-V420 WeakPolarHBondContact O-CG2 3.22Å; A416-V420 PolarHBondContact O-N 3.04Å; A416-V420 VanDerWaalsContact O-N 3.1Å
417	K	95.1	Very high	91.3	Very high	30 Å²	30	42.4 Å²	42.4	13%	0.13	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-44.8	177.7	-178.9	-177.2	169.1	-171.2	0	111.3	V392 L395 D396 I399 L413 Q414 Q415 M419 V420 I421	V392-K417 HydrophobicContact CG1-CG 4.11Å; L395-K417 HydrophobicContact CB-CB 4.04Å; L395-K417 HydrophobicContact CB-CG 4.47Å; L395-K417 HydrophobicContact CD1-CB 4.21Å; D396-K417 HydrophobicContact CB-CD 4.4Å; D396-K417 IonicContact OD1-NZ 2.93Å; D396-K417 PolarHBondContact OD1-NZ 2.82Å; I399-K417 HydrophobicContact CD1-CD 4.04Å; L413-K417 WeakPolarHBondContact O-CB 3.04Å; L413-K417 PolarHBondContact O-N 2.67Å; Q414-K417 PolarHBondContact O-N 3.22Å; Q415-K417 VanDerWaalsContact C-N 3.34Å; Q415-K417 PolarHBondContact O-N 3.25Å; K417-M419 VanDerWaalsContact C-N 3.33Å; K417-M419 PolarHBondContact O-N 3.48Å; K417-V420 PolarHBondContact O-N 3.43Å; K417-I421 HydrophobicContact CG-CD1 3.97Å; K417-I421 VanDerWaalsContact O-CG1 3.3Å; K417-I421 WeakPolarHBondContact O-CG1 2.94Å; K417-I421 PolarHBondContact O-N 3.42Å
418	E	92.4	Very high	91.1	Very high	107 Å²	107	37.6 Å²	37.6	50%	0.5	18%	0.181	S	C	.	.	H	α-helix	trans	-62.4	-39.9	176.6	-76.3	171	-164.9	0	0	112	Q414 Q415 I421 F422	Q414-E418 WeakPolarHBondContact CG-OE1 3.48Å; Q414-E418 PolarHBondContact NE2-OE1 3.06Å; Q414-E418 WeakPolarHBondContact O-CB 3.49Å; Q414-E418 WeakPolarHBondContact O-CG 3.46Å; Q414-E418 PolarHBondContact O-N 3.36Å; Q415-E418 PolarHBondContact O-N 3.29Å; E418-I421 PolarHBondContact O-N 2.93Å; E418-F422 VanDerWaalsContact O-CB 3.3Å; E418-F422 WeakPolarHBondContact O-CB 3.32Å; E418-F422 PolarHBondContact O-N 2.81Å
419	M	94.7	Very high	91	Very high	17 Å²	17	33 Å²	33	8%	0.084	16%	0.159	C	C	.	.	H	α-helix	trans	-59.3	-47.1	173.8	-178.5	-76.1	-63.6	0	0	111.6	F332 L333 Q336 F339 Q415 A416 K417 F422 Q423	F332-M419 HydrophobicContact CB-CE 3.94Å; F332-M419 HydrophobicContact CD1-CE 4.06Å; F332-M419 VanDerWaalsContact O-CE 3.31Å; F332-M419 WeakPolarHBondContact O-CE 3.35Å; L333-M419 HydrophobicContact CD2-CB 4.39Å; Q336-M419 HydrophobicContact CB-CG 3.7Å; Q336-M419 HydrophobicContact CB-SD 4.06Å; F339-M419 HydrophobicContact CB-SD 3.99Å; F339-M419 HydrophobicContact CD2-CE 3.7Å; F339-M419 HydrophobicContact CD2-SD 4.08Å; F339-M419 HydrophobicContact CE2-CE 4.01Å; F339-M419 HydrophobicContact CG-CE 4.18Å; F339-M419 HydrophobicContact CG-SD 4.13Å; Q415-M419 WeakPolarHBondContact O-CB 3.38Å; Q415-M419 PolarHBondContact O-N 3.29Å; A416-M419 WeakPolarHBondContact O-CB 2.84Å; A416-M419 PolarHBondContact O-N 3.36Å; K417-M419 VanDerWaalsContact C-N 3.33Å; K417-M419 PolarHBondContact O-N 3.48Å; M419-F422 WeakPolarHBondContact O-CB 3.42Å; M419-F422 PolarHBondContact O-N 3.46Å; M419-Q423 WeakPolarHBondContact O-CG 3.47Å; M419-Q423 PolarHBondContact O-N 2.98Å; M419-Q423 HydrophobicContact SD-CG 3.93Å
420	V	93.5	Very high	90.9	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-64.5	-42.9	177.9	177.5	0	0	0	0	111.5	F332 M388 V392 L395 A416 K417 F422 Q423 L424	F332-V420 HydrophobicContact CD1-CG2 3.75Å; F332-V420 HydrophobicContact CE1-CG2 3.97Å; M388-V420 HydrophobicContact CE-CG1 3.75Å; M388-V420 WeakPolarHBondContact O-CG1 3.41Å; M388-V420 HydrophobicContact SD-CG1 4.34Å; V392-V420 HydrophobicContact CG2-CB 4.14Å; V392-V420 HydrophobicContact CG2-CG1 3.58Å; L395-V420 HydrophobicContact CD1-CG2 4.11Å; A416-V420 WeakPolarHBondContact O-CG2 3.22Å; A416-V420 PolarHBondContact O-N 3.04Å; A416-V420 VanDerWaalsContact O-N 3.1Å; K417-V420 PolarHBondContact O-N 3.43Å; V420-F422 VanDerWaalsContact C-N 3.32Å; V420-F422 PolarHBondContact O-N 2.95Å; V420-Q423 PolarHBondContact O-N 3.32Å; V420-L424 PolarHBondContact O-N 3.48Å
421	I	90.5	Very high	90.6	Very high	41 Å²	41	33.8 Å²	33.8	21%	0.21	16%	0.162	C	C	.	.	H	α-helix	trans	-61.5	-42.3	176.4	-69.8	169.3	0	0	0	110.8	V392 K417 E418 L424 R425	V392-I421 HydrophobicContact CG1-CD1 4.01Å; V392-I421 HydrophobicContact CG1-CG1 3.97Å; V392-I421 HydrophobicContact CG2-CG1 3.71Å; K417-I421 HydrophobicContact CG-CD1 3.97Å; K417-I421 VanDerWaalsContact O-CG1 3.3Å; K417-I421 WeakPolarHBondContact O-CG1 2.94Å; K417-I421 PolarHBondContact O-N 3.42Å; E418-I421 PolarHBondContact O-N 2.93Å; I421-L424 WeakPolarHBondContact O-CB 3.19Å; I421-L424 PolarHBondContact O-N 2.88Å; I421-R425 PolarHBondContact O-N 3.49Å; I421-R425 VanDerWaalsContact O-N 3.15Å
422	F	90.6	Very high	90.3	Very high	36 Å²	36	30 Å²	30	16%	0.158	14%	0.143	C	C	.	.	H	α-helix	trans	-57.8	-50.2	175.2	170.1	-93.4	0	0	0	110.6	E418 M419 V420 L424 R425 H426 N448	E418-F422 VanDerWaalsContact O-CB 3.3Å; E418-F422 WeakPolarHBondContact O-CB 3.32Å; E418-F422 PolarHBondContact O-N 2.81Å; M419-F422 WeakPolarHBondContact O-CB 3.42Å; M419-F422 PolarHBondContact O-N 3.46Å; V420-F422 VanDerWaalsContact C-N 3.32Å; V420-F422 PolarHBondContact O-N 2.95Å; F422-L424 VanDerWaalsContact C-N 3.32Å; F422-L424 PolarHBondContact O-N 3.44Å; F422-R425 PolarHBondContact O-N 3.45Å; F422-R425 VanDerWaalsContact O-N 3.17Å; F422-H426 HydrophobicContact CE1-CB 4.34Å; F422-H426 HydrophobicContact CZ-CB 4.49Å; F422-H426 AromaticContact CZ-ND1 3.91Å; F422-H426 WeakPolarHBondContact O-CB 3.4Å; F422-H426 PolarHBondContact O-N 3.45Å; F422-N448 HydrophobicContact CE2-CB 4.12Å; F422-N448 HydrophobicContact CZ-CB 3.79Å
423	Q	91.5	Very high	90	Very high	17 Å²	17	29.8 Å²	29.8	8%	0.079	14%	0.141	C	C	.	.	H	α-helix	trans	-63.4	-35.4	-179.4	-65.8	-65.7	-5.6	0	0	113.2	Q336 F339 M388 M419 V420 H426	Q336-Q423 PolarHBondContact O-NE2 3.05Å; F339-Q423 HydrophobicContact CB-CG 3.89Å; M388-Q423 HydrophobicContact CE-CB 3.62Å; M419-Q423 WeakPolarHBondContact O-CG 3.47Å; M419-Q423 PolarHBondContact O-N 2.98Å; M419-Q423 HydrophobicContact SD-CG 3.93Å; V420-Q423 PolarHBondContact O-N 3.32Å; Q423-H426 PolarHBondContact O-N 3.42Å
424	L	86	Confident	89.7	Confident	4 Å²	4	33.9 Å²	33.9	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-59.5	-47.4	172.8	-86.1	175.1	0	0	0	112.2	V145 V149 M388 V392 V420 I421 F422	V145-L424 HydrophobicContact CG1-CD1 3.89Å; V149-L424 HydrophobicContact CB-CB 4.49Å; V149-L424 HydrophobicContact CG1-CB 4.41Å; V149-L424 HydrophobicContact CG2-CB 4.3Å; V149-L424 HydrophobicContact CG2-CD2 3.83Å; M388-L424 HydrophobicContact CB-CD1 4.11Å; M388-L424 HydrophobicContact CB-CD2 3.24Å; M388-L424 HydrophobicContact CB-CG 3.66Å; M388-L424 HydrophobicContact CE-CG 4.41Å; M388-L424 HydrophobicContact CG-CD2 4.05Å; V392-L424 HydrophobicContact CG2-CD1 4.15Å; V420-L424 PolarHBondContact O-N 3.48Å; I421-L424 WeakPolarHBondContact O-CB 3.19Å; I421-L424 PolarHBondContact O-N 2.88Å; F422-L424 VanDerWaalsContact C-N 3.32Å; F422-L424 PolarHBondContact O-N 3.44Å
425	R	86.6	Confident	89.5	Confident	68 Å²	68	32 Å²	32	26%	0.257	16%	0.157	S	C	.	.	H	α-helix	trans	-69.9	-34.5	178.3	-175.4	177.2	64.3	-120.2	9.8	111.9	I421 F422 G427 N428 D429 L450	I421-R425 PolarHBondContact O-N 3.49Å; I421-R425 VanDerWaalsContact O-N 3.15Å; F422-R425 PolarHBondContact O-N 3.45Å; F422-R425 VanDerWaalsContact O-N 3.17Å; R425-G427 PolarHBondContact O-N 3.35Å; R425-G427 VanDerWaalsContact O-N 3.13Å; R425-N428 WeakPolarHBondContact O-CB 3.37Å; R425-N428 PolarHBondContact O-N 3.25Å; R425-D429 IonicContact NE-OD2 2.72Å; R425-D429 PolarHBondContact O-N 2.93Å; R425-D429 VanDerWaalsContact O-N 3.17Å; R425-L450 PolarHBondContact NH2-O 2.92Å
426	H	87.8	Confident	89.4	Confident	30 Å²	30	29 Å²	29	14%	0.139	14%	0.144	C	C	.	.	H	α-helix	trans	-59.8	-30.2	-171.4	-166.3	55.2	0	0	0	113.4	A343 F422 Q423 N428 D429 L430	A343-H426 HydrophobicContact CB-CB 3.88Å; F422-H426 HydrophobicContact CE1-CB 4.34Å; F422-H426 HydrophobicContact CZ-CB 4.49Å; F422-H426 AromaticContact CZ-ND1 3.91Å; F422-H426 WeakPolarHBondContact O-CB 3.4Å; F422-H426 PolarHBondContact O-N 3.45Å; Q423-H426 PolarHBondContact O-N 3.42Å; H426-N428 PolarHBondContact O-N 3.39Å; H426-D429 WeakPolarHBondContact O-CB 2.7Å; H426-D429 PolarHBondContact O-N 3.48Å; H426-L430 WeakPolarHBondContact O-CG 3.39Å; H426-L430 PolarHBondContact O-N 3.08Å
427	G	84.6	Confident	89.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60	-42.7	173.4	0	0	0	0	0	113.5	A343 R425 D429 L430 L431	A343-G427 VanDerWaalsContact O-CA 3.25Å; A343-G427 WeakPolarHBondContact O-CA 3.44Å; R425-G427 PolarHBondContact O-N 3.35Å; R425-G427 VanDerWaalsContact O-N 3.13Å; G427-D429 VanDerWaalsContact C-N 3.35Å; G427-L430 PolarHBondContact O-N 3.14Å; G427-L431 PolarHBondContact O-N 3.27Å
428	N	82.8	Confident	89.2	Confident	26 Å²	26	37.4 Å²	37.4	14%	0.139	19%	0.194	C	C	.	.	H	α-helix	trans	-69.9	-35.2	174.9	-73.6	-7.1	0	0	0	112.2	V149 R425 H426 L430 L431 A432	V149-N428 PolarHBondContact O-ND2 2.99Å; V149-N428 PolarHBondContact O-OD1 3.25Å; V149-N428 VanDerWaalsContact O-OD1 3.09Å; R425-N428 WeakPolarHBondContact O-CB 3.37Å; R425-N428 PolarHBondContact O-N 3.25Å; H426-N428 PolarHBondContact O-N 3.39Å; N428-L430 VanDerWaalsContact C-N 3.3Å; N428-L430 PolarHBondContact O-N 2.85Å; N428-L431 WeakPolarHBondContact O-CB 3.48Å; N428-L431 PolarHBondContact O-N 3.37Å; N428-A432 PolarHBondContact O-N 2.91Å
429	D	85.9	Confident	89.3	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-60.2	-43.8	176	-73.1	-22.1	0	0	0	110.9	R425 H426 G427 L431 A432 M433 L449 Q452	R425-D429 IonicContact NE-OD2 2.72Å; R425-D429 PolarHBondContact O-N 2.93Å; R425-D429 VanDerWaalsContact O-N 3.17Å; H426-D429 WeakPolarHBondContact O-CB 2.7Å; H426-D429 PolarHBondContact O-N 3.48Å; G427-D429 VanDerWaalsContact C-N 3.35Å; D429-L431 VanDerWaalsContact C-N 3.34Å; D429-L431 PolarHBondContact O-N 3.5Å; D429-A432 PolarHBondContact O-N 3.49Å; D429-M433 WeakPolarHBondContact O-CB 3.25Å; D429-M433 WeakPolarHBondContact O-CG 3.27Å; D429-M433 PolarHBondContact O-N 2.86Å; D429-L449 HydrophobicContact CB-CB 4.17Å; D429-L449 HydrophobicContact CB-CD2 3.6Å; D429-L449 HydrophobicContact CB-CG 4.23Å; D429-Q452 PolarHBondContact OD1-NE2 3.36Å
430	L	87	Confident	89.1	Confident	28 Å²	28	40.6 Å²	40.6	15%	0.147	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-34.6	174.6	-65	173.1	0	0	0	113.2	A343 L344 K347 H426 G427 N428 M433 D434	A343-L430 HydrophobicContact CB-CD1 4.3Å; L344-L430 HydrophobicContact CD2-CD1 4.12Å; K347-L430 HydrophobicContact CD-CB 3.73Å; K347-L430 HydrophobicContact CD-CD1 4.3Å; K347-L430 HydrophobicContact CG-CB 4.21Å; H426-L430 WeakPolarHBondContact O-CG 3.39Å; H426-L430 PolarHBondContact O-N 3.08Å; G427-L430 PolarHBondContact O-N 3.14Å; N428-L430 VanDerWaalsContact C-N 3.3Å; N428-L430 PolarHBondContact O-N 2.85Å; L430-M433 HydrophobicContact CD2-SD 4.31Å; L430-D434 PolarHBondContact O-N 3.34Å; L430-D434 VanDerWaalsContact O-N 3.15Å
431	L	86.2	Confident	89.1	Confident	42 Å²	42	43.8 Å²	43.8	22%	0.22	23%	0.233	C	C	.	.	H	α-helix	trans	-66.4	-45.9	173.3	-75.4	172.9	0	0	0	111.5	K347 P350 G427 N428 D429 M433 D434 S435	K347-L431 HydrophobicContact CG-CD2 3.79Å; K347-L431 HydrophobicContact CG-CG 3.93Å; P350-L431 HydrophobicContact CG-CD1 4.22Å; G427-L431 PolarHBondContact O-N 3.27Å; N428-L431 WeakPolarHBondContact O-CB 3.48Å; N428-L431 PolarHBondContact O-N 3.37Å; D429-L431 VanDerWaalsContact C-N 3.34Å; D429-L431 PolarHBondContact O-N 3.5Å; L431-M433 VanDerWaalsContact C-N 3.3Å; L431-M433 PolarHBondContact O-N 2.85Å; L431-D434 PolarHBondContact O-N 3.46Å; L431-S435 PolarHBondContact O-N 3.26Å
432	A	85.8	Confident	89.1	Confident	11 Å²	11	45.3 Å²	45.3	9%	0.091	24%	0.242	C	C	.	.	H	α-helix	trans	-65.1	-36.8	179.4	0	0	0	0	0	111.8	N428 D429 S435 Q452 F471 F495	N428-A432 PolarHBondContact O-N 2.91Å; D429-A432 PolarHBondContact O-N 3.49Å; A432-S435 WeakPolarHBondContact O-CB 3.38Å; A432-S435 PolarHBondContact O-N 3Å; A432-Q452 VanDerWaalsContact CB-OE1 3.32Å; A432-F471 HydrophobicContact CB-CE1 3.96Å; A432-F495 HydrophobicContact CB-CE2 4.31Å
433	M	87.8	Confident	89.1	Confident	24 Å²	24	44.6 Å²	44.6	12%	0.118	24%	0.239	C	C	.	.	H	α-helix	trans	-62.1	-44.4	173.7	-73.8	170.2	62.1	0	0	112.3	D429 L430 L431 S435 I436 L443 L449 F473	D429-M433 WeakPolarHBondContact O-CB 3.25Å; D429-M433 WeakPolarHBondContact O-CG 3.27Å; D429-M433 PolarHBondContact O-N 2.86Å; L430-M433 HydrophobicContact CD2-SD 4.31Å; L431-M433 VanDerWaalsContact C-N 3.3Å; L431-M433 PolarHBondContact O-N 2.85Å; M433-S435 PolarHBondContact O-N 3.48Å; M433-I436 WeakPolarHBondContact O-CB 3.47Å; M433-I436 PolarHBondContact O-N 3.47Å; M433-L443 HydrophobicContact CE-CB 3.89Å; M433-L449 HydrophobicContact CG-CD2 4.26Å; M433-L449 HydrophobicContact SD-CB 4.3Å; M433-L449 HydrophobicContact SD-CD2 4.46Å; M433-F473 HydrophobicContact CE-CE1 3.93Å; M433-F473 HydrophobicContact CG-CE1 4.22Å; M433-F473 HydrophobicContact CG-CZ 4.11Å; M433-F473 HydrophobicContact SD-CE1 3.83Å; M433-F473 HydrophobicContact SD-CZ 4.33Å
434	D	88	Confident	88.9	Confident	87 Å²	87	52.5 Å²	52.5	47%	0.465	27%	0.274	S	S	.	.	H	α-helix	trans	-61.5	-24.9	176.4	-77.3	6.9	0	0	0	112.5	K347 L430 L431 I436	K347-D434 WeakPolarHBondContact CE-OD2 3.26Å; K347-D434 IonicContact NZ-OD1 3.71Å; K347-D434 PolarHBondContact NZ-OD1 3.41Å; K347-D434 IonicContact NZ-OD2 3.61Å; K347-D434 PolarHBondContact NZ-OD2 3.48Å; L430-D434 PolarHBondContact O-N 3.34Å; L430-D434 VanDerWaalsContact O-N 3.15Å; L431-D434 PolarHBondContact O-N 3.46Å; D434-I436 VanDerWaalsContact C-N 3.35Å
435	S	90.1	Very high	89.2	Confident	22 Å²	22	58.8 Å²	58.8	15%	0.154	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-5.7	177	-76.9	0	0	0	0	114.5	L431 A432 M433 D493 F495	L431-S435 PolarHBondContact O-N 3.26Å; A432-S435 WeakPolarHBondContact O-CB 3.38Å; A432-S435 PolarHBondContact O-N 3Å; M433-S435 PolarHBondContact O-N 3.48Å; S435-D493 WeakPolarHBondContact CB-O 3.29Å; S435-D493 PolarHBondContact OG-O 3.32Å; S435-F495 PolarHBondContact O-N 3.11Å
436	I	93.3	Very high	89.5	Confident	17 Å²	17	57 Å²	57	9%	0.087	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	129	177.6	-60.9	170	0	0	0	109.9	M433 D434 C439 L443 F471 L478 F495	M433-I436 WeakPolarHBondContact O-CB 3.47Å; M433-I436 PolarHBondContact O-N 3.47Å; D434-I436 VanDerWaalsContact C-N 3.35Å; I436-C439 HydrophobicContact CG2-CB 3.86Å; I436-L443 HydrophobicContact CB-CD1 4.37Å; I436-L443 HydrophobicContact CD1-CD1 3.69Å; I436-L443 HydrophobicContact CG2-CD1 4.48Å; I436-F471 HydrophobicContact CD1-CD1 4.22Å; I436-F471 HydrophobicContact CD1-CD2 4.22Å; I436-F471 HydrophobicContact CD1-CE1 4.01Å; I436-F471 HydrophobicContact CD1-CE2 3.99Å; I436-F471 HydrophobicContact CD1-CG 4.33Å; I436-F471 HydrophobicContact CD1-CZ 3.89Å; I436-F471 HydrophobicContact CG1-CE2 4.27Å; I436-F471 HydrophobicContact CG1-CZ 4.06Å; I436-L478 HydrophobicContact CD1-CD2 4.29Å; I436-F495 CarbonylContact C-O 3.54Å; I436-F495 VanDerWaalsContact CA-O 3.28Å; I436-F495 WeakPolarHBondContact CA-O 3.2Å; I436-F495 HydrophobicContact CG1-CB 4.07Å
437	R	93.6	Very high	89.6	Confident	143 Å²	143	56.7 Å²	56.7	54%	0.54	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	149.1	-178.5	-55.2	-57.9	-169.7	-173.9	2.3	111.4	C439 I494 F495 Y497	R437-C439 VanDerWaalsContact C-N 3.25Å; R437-C439 PolarHBondContact O-N 2.9Å; R437-I494 HydrophobicContact CG-CG2 3.63Å; R437-F495 PolarHBondContact N-O 2.69Å; R437-Y497 VanDerWaalsContact O-CB 3.25Å; R437-Y497 WeakPolarHBondContact O-CB 3.2Å; R437-Y497 PolarHBondContact O-N 2.84Å
438	G	94.3	Very high	89.9	Confident	63 Å²	63	59.9 Å²	59.9	65%	0.649	32%	0.32	S	S	*	.	S	Bend	trans	66.2	25	176.4	0	0	0	0	0	114.2	Y497	G438-Y497 WeakPolarHBondContact O-CB 3.36Å; G438-Y497 VanDerWaalsContact O-CD1 3.24Å; G438-Y497 WeakPolarHBondContact O-CD1 3.17Å
439	C	93.9	Very high	90.3	Very high	26 Å²	26	58.7 Å²	58.7	18%	0.176	31%	0.313	C	S	.	.			trans	-103.3	113.6	173.5	-167.8	0	0	0	0	108.8	I436 R437 L441 Y497	I436-C439 HydrophobicContact CG2-CB 3.86Å; R437-C439 VanDerWaalsContact C-N 3.25Å; R437-C439 PolarHBondContact O-N 2.9Å; C439-L441 PolarHBondContact O-N 3.27Å; C439-Y497 HydrophobicContact CB-CD2 3.97Å; C439-Y497 HydrophobicContact CB-CG 3.87Å
440	D	92.2	Very high	90.5	Very high	164 Å²	164	60 Å²	60	88%	0.877	32%	0.32	S	S	*	.			trans	-83.6	0.7	180	-57	-34.8	0	0	0	112.8
441	L	93	Very high	90.8	Very high	68 Å²	68	59.6 Å²	59.6	36%	0.356	32%	0.317	S	S	.	.	S	Bend	trans	-84.2	139.1	176.9	-59.2	177	0	0	0	110.5	C439 L443 L476 S500	C439-L441 PolarHBondContact O-N 3.27Å; L441-L443 HydrophobicContact CB-CD2 4.48Å; L441-L443 PolarHBondContact O-N 2.91Å; L441-L476 HydrophobicContact CD1-CD1 4.12Å; L441-L476 HydrophobicContact CD1-CD2 3.68Å; L441-S500 WeakPolarHBondContact CD1-OG 3.4Å
442	N	90.9	Very high	91.1	Very high	73 Å²	73	58.3 Å²	58.3	39%	0.39	31%	0.31	S	S	.	.			trans	-73.7	94.5	167.9	-170.5	-3.7	0	0	0	109.8	K444 E445 Q446	N442-K444 PolarHBondContact O-N 3.42Å; N442-K444 VanDerWaalsContact O-N 3.16Å; N442-K444 WeakPolarHBondContact OD1-CB 3.36Å; N442-K444 PolarHBondContact OD1-N 3.34Å; N442-E445 HydrophobicContact CB-CB 4.47Å; N442-E445 HydrophobicContact CB-CG 4.3Å; N442-E445 PolarHBondContact ND2-OE1 3.46Å; N442-E445 PolarHBondContact O-N 3.31Å; N442-Q446 PolarHBondContact O-NE2 2.95Å
443	L	90.7	Very high	91.5	Very high	20 Å²	20	58.3 Å²	58.3	11%	0.105	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-60.8	-24	-177.9	-61.8	-178.3	0	0	0	113.4	M433 I436 L441 E445 Q446 F473 L476 L478	M433-L443 HydrophobicContact CE-CB 3.89Å; I436-L443 HydrophobicContact CB-CD1 4.37Å; I436-L443 HydrophobicContact CD1-CD1 3.69Å; I436-L443 HydrophobicContact CG2-CD1 4.48Å; L441-L443 HydrophobicContact CB-CD2 4.48Å; L441-L443 PolarHBondContact O-N 2.91Å; L443-E445 PolarHBondContact O-N 3.04Å; L443-Q446 PolarHBondContact O-N 3.16Å; L443-F473 HydrophobicContact CB-CZ 4.45Å; L443-F473 HydrophobicContact CD1-CZ 4.41Å; L443-F473 HydrophobicContact CD2-CE2 4.4Å; L443-F473 HydrophobicContact CD2-CZ 4.26Å; L443-L476 HydrophobicContact CD2-CD2 4.23Å; L443-L478 HydrophobicContact CD2-CD1 3.71Å
444	K	86.7	Confident	91.9	Very high	184 Å²	184	60.4 Å²	60.4	80%	0.8	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-68.6	-23.6	176.8	-62	-179.6	-179.2	176.2	0	112.9	N442	N442-K444 PolarHBondContact O-N 3.42Å; N442-K444 VanDerWaalsContact O-N 3.16Å; N442-K444 WeakPolarHBondContact OD1-CB 3.36Å; N442-K444 PolarHBondContact OD1-N 3.34Å
445	E	92.2	Very high	92.3	Very high	135 Å²	135	56.3 Å²	56.3	63%	0.631	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-90	-5.2	178.7	-69	171.4	-164.4	0	0	112.7	N442 L443 G447	N442-E445 HydrophobicContact CB-CB 4.47Å; N442-E445 HydrophobicContact CB-CG 4.3Å; N442-E445 PolarHBondContact ND2-OE1 3.46Å; N442-E445 PolarHBondContact O-N 3.31Å; L443-E445 PolarHBondContact O-N 3.04Å; E445-G447 PolarHBondContact O-N 2.92Å
446	Q	93.3	Very high	92.6	Very high	30 Å²	30	57.1 Å²	57.1	14%	0.14	30%	0.299	C	S	.	.	S	Bend	trans	-84.9	11	-177.4	-50.9	-51.7	-54.9	0	0	113.2	N442 L443 F473 N475 L476	N442-Q446 PolarHBondContact O-NE2 2.95Å; L443-Q446 PolarHBondContact O-N 3.16Å; Q446-F473 HydrophobicContact CB-CB 4.1Å; Q446-F473 HydrophobicContact CB-CD1 4.31Å; Q446-F473 HydrophobicContact CB-CG 4.21Å; Q446-F473 WeakPolarHBondContact O-CB 3.28Å; Q446-N475 VanDerWaalsContact O-CB 3.3Å; Q446-N475 WeakPolarHBondContact O-CB 3.44Å; Q446-N475 PolarHBondContact O-N 2.94Å; Q446-L476 HydrophobicContact CB-CB 3.99Å; Q446-L476 HydrophobicContact CG-CB 4.2Å; Q446-L476 HydrophobicContact CG-CD2 4.04Å
447	G	90.4	Very high	92.7	Very high	25 Å²	25	56.5 Å²	56.5	26%	0.258	30%	0.296	S	S	.	.			trans	74.9	-171.4	-173.8	0	0	0	0	0	112.6	E445 E474	E445-G447 PolarHBondContact O-N 2.92Å; G447-E474 WeakPolarHBondContact CA-OE2 3.35Å
448	N	89.2	Confident	92.6	Very high	66 Å²	66	51.8 Å²	51.8	35%	0.353	28%	0.28	S	S	.	.			trans	-65.3	139.3	-176	-70.9	-43.3	0	0	0	111.9	F422 L450 F473 E474	F422-N448 HydrophobicContact CE2-CB 4.12Å; F422-N448 HydrophobicContact CZ-CB 3.79Å; N448-L450 HydrophobicContact CB-CD2 4.25Å; N448-L450 PolarHBondContact O-N 3.13Å; N448-F473 CarbonylContact O-C 3.59Å; N448-F473 VanDerWaalsContact O-CA 3.29Å; N448-F473 WeakPolarHBondContact O-CA 3.25Å; N448-E474 HydrophobicContact CB-CG 4.25Å; N448-E474 PolarHBondContact N-OE2 3.38Å; N448-E474 PolarHBondContact O-N 3.27Å
449	L	91.6	Very high	92.1	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	109.4	165.3	-175.4	63.6	0	0	0	108	D429 M433 Q452 F471 L472 F473	D429-L449 HydrophobicContact CB-CB 4.17Å; D429-L449 HydrophobicContact CB-CD2 3.6Å; D429-L449 HydrophobicContact CB-CG 4.23Å; M433-L449 HydrophobicContact CG-CD2 4.26Å; M433-L449 HydrophobicContact SD-CB 4.3Å; M433-L449 HydrophobicContact SD-CD2 4.46Å; L449-Q452 HydrophobicContact CD2-CB 4.37Å; L449-Q452 HydrophobicContact CD2-CG 4.12Å; L449-F471 HydrophobicContact CD1-CB 3.81Å; L449-F471 HydrophobicContact CD1-CD1 4.13Å; L449-F471 HydrophobicContact CD2-CD1 3.9Å; L449-L472 WeakPolarHBondContact CD1-O 3.31Å; L449-F473 HydrophobicContact CB-CD1 3.97Å; L449-F473 HydrophobicContact CB-CE1 3.87Å; L449-F473 HydrophobicContact CD1-CD1 3.96Å; L449-F473 HydrophobicContact CD1-CD2 3.95Å; L449-F473 HydrophobicContact CD1-CE1 3.83Å; L449-F473 HydrophobicContact CD1-CE2 3.83Å; L449-F473 HydrophobicContact CD1-CG 4.02Å; L449-F473 HydrophobicContact CD1-CZ 3.77Å; L449-F473 HydrophobicContact CG-CE1 4.34Å
450	L	90.7	Very high	91.1	Very high	32 Å²	32	53 Å²	53	17%	0.168	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-42.7	-177.9	-55.9	-178.8	0	0	0	110.8	R425 N448 L472 E474 L552	R425-L450 PolarHBondContact NH2-O 2.92Å; N448-L450 HydrophobicContact CB-CD2 4.25Å; N448-L450 PolarHBondContact O-N 3.13Å; L450-L472 WeakPolarHBondContact CA-O 3.44Å; L450-L472 HydrophobicContact CB-CD2 4.31Å; L450-L472 HydrophobicContact CB-CG 4.24Å; L450-L472 WeakPolarHBondContact CB-O 3.21Å; L450-L472 HydrophobicContact CD1-CD2 4.46Å; L450-L472 HydrophobicContact CD1-CG 4.35Å; L450-L472 PolarHBondContact N-O 2.89Å; L450-E474 HydrophobicContact CD1-CG 4.19Å; L450-E474 HydrophobicContact CD2-CG 3.88Å; L450-E474 HydrophobicContact CG-CG 4.15Å; L450-L552 HydrophobicContact CD1-CD1 4.2Å; L450-L552 HydrophobicContact CD1-CD2 4.06Å
451	R	92.2	Very high	89.7	Confident	19 Å²	19	57 Å²	57	7%	0.072	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	153.1	-175.8	-158.6	170.8	-64.2	-83.2	4.1	112	L472 W545 D548	R451-L472 HydrophobicContact CB-CB 4.35Å; R451-L472 HydrophobicContact CB-CD2 4.49Å; R451-L472 PolarHBondContact N-O 2.91Å; R451-L472 PolarHBondContact O-N 2.78Å; R451-W545 HydrophobicContact CB-CZ2 4.07Å; R451-W545 HydrophobicContact CG-CZ2 3.91Å; R451-D548 IonicContact CZ-OD1 3.31Å; R451-D548 IonicContact CZ-OD2 3.92Å; R451-D548 IonicContact NE-OD1 2.68Å; R451-D548 IonicContact NE-OD2 2.65Å; R451-D548 PolarHBondContact NE-OD2 3.28Å; R451-D548 IonicContact NH2-OD1 2.72Å; R451-D548 PolarHBondContact NH2-OD1 3.38Å; R451-D548 IonicContact NH2-OD2 3.73Å; R451-D548 PolarHBondContact NH2-OD2 2.87Å
452	Q	93.3	Very high	88.4	Confident	15 Å²	15	60.7 Å²	60.7	7%	0.07	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	138.4	169.3	49.8	158.9	-37.2	0	0	111.5	D429 A432 L449 R469 V470 F471	D429-Q452 PolarHBondContact OD1-NE2 3.36Å; A432-Q452 VanDerWaalsContact CB-OE1 3.32Å; L449-Q452 HydrophobicContact CD2-CB 4.37Å; L449-Q452 HydrophobicContact CD2-CG 4.12Å; Q452-R469 VanDerWaalsContact CD-NH2 3.35Å; Q452-R469 VanDerWaalsContact OE1-NE 3.08Å; Q452-V470 WeakPolarHBondContact CA-O 3.28Å; Q452-F471 HydrophobicContact CB-CD1 3.67Å; Q452-F471 HydrophobicContact CB-CE1 4.03Å; Q452-F471 HydrophobicContact CB-CG 4.25Å; Q452-F471 HydrophobicContact CG-CD1 4.42Å; Q452-F471 VanDerWaalsContact OE1-CE1 3.29Å
453	D	94.4	Very high	87.3	Confident	10 Å²	10	58.1 Å²	58.1	5%	0.053	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	155.2	-174.1	-92.8	-69.3	0	0	0	111.5	S176 F455 R469 V470 Q541 W545	S176-D453 VanDerWaalsContact CB-CG 3.49Å; S176-D453 WeakPolarHBondContact CB-OD1 3.43Å; S176-D453 WeakPolarHBondContact CB-OD2 3.25Å; S176-D453 VanDerWaalsContact OG-CG 3.23Å; S176-D453 PolarHBondContact OG-OD1 3.03Å; S176-D453 VanDerWaalsContact OG-OD1 3.12Å; S176-D453 PolarHBondContact OG-OD2 3.32Å; D453-F455 HydrophobicContact CB-CD2 4.11Å; D453-F455 HydrophobicContact CB-CE2 3.39Å; D453-F455 HydrophobicContact CB-CZ 3.69Å; D453-R469 CarbonylContact O-C 3.5Å; D453-R469 WeakPolarHBondContact O-CA 3.41Å; D453-V470 PolarHBondContact N-O 2.77Å; D453-V470 PolarHBondContact O-N 3Å; D453-Q541 PolarHBondContact OD1-NE2 3.3Å; D453-W545 HydrophobicContact CB-CZ2 3.78Å; D453-W545 PolarHBondContact OD2-NE1 3.41Å
454	E	95.1	Very high	86.8	Confident	68 Å²	68	65.5 Å²	65.5	32%	0.318	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.7	171.5	-172.9	174.8	95.8	0	0	110.6	V467 R468 N537	E454-V467 VanDerWaalsContact CD-CG1 3.44Å; E454-V467 HydrophobicContact CG-CG1 3.57Å; E454-R468 WeakPolarHBondContact CA-O 3.28Å; E454-N537 PolarHBondContact O-ND2 3.2Å
455	F	97.8	Very high	87	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.009	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	158.8	-179.7	-66.1	-77.6	0	0	0	111.6	D453 V457 V467 R468 V470 F519 I534 Q535 A536 Q541 W545	D453-F455 HydrophobicContact CB-CD2 4.11Å; D453-F455 HydrophobicContact CB-CE2 3.39Å; D453-F455 HydrophobicContact CB-CZ 3.69Å; F455-V457 HydrophobicContact CB-CG2 4.08Å; F455-V467 WeakPolarHBondContact O-CA 3.21Å; F455-R468 PolarHBondContact N-O 2.91Å; F455-R468 PolarHBondContact O-N 3.04Å; F455-V470 HydrophobicContact CD2-CB 3.93Å; F455-V470 HydrophobicContact CD2-CG2 3.74Å; F455-V470 HydrophobicContact CE2-CB 4.26Å; F455-F519 HydrophobicContact CE1-CE1 4.23Å; F455-I534 HydrophobicContact CB-CG2 3.65Å; F455-I534 HydrophobicContact CD1-CG2 3.47Å; F455-I534 VanDerWaalsContact CD1-CG2 3.47Å; F455-I534 HydrophobicContact CD2-CG2 3.96Å; F455-I534 HydrophobicContact CE1-CG2 4.06Å; F455-I534 HydrophobicContact CE2-CG2 4.45Å; F455-I534 HydrophobicContact CG-CG2 3.42Å; F455-I534 VanDerWaalsContact CG-CG2 3.42Å; F455-Q535 WeakPolarHBondContact CD1-O 3.42Å; F455-A536 HydrophobicContact CD1-CB 4.27Å; F455-A536 HydrophobicContact CE1-CB 3.84Å; F455-Q541 HydrophobicContact CE1-CG 4.04Å; F455-Q541 HydrophobicContact CZ-CG 4.08Å; F455-W545 AromaticContact CE2-CD2 3.8Å; F455-W545 HydrophobicContact CE2-CD2 3.8Å; F455-W545 AromaticContact CE2-CE2 3.44Å; F455-W545 VanDerWaalsContact CE2-CE2 3.44Å; F455-W545 HydrophobicContact CE2-CE3 4.25Å; F455-W545 HydrophobicContact CE2-CG 4.35Å; F455-W545 HydrophobicContact CE2-CH2 4.13Å; F455-W545 AromaticContact CE2-CZ2 3.64Å; F455-W545 HydrophobicContact CE2-CZ2 3.64Å; F455-W545 HydrophobicContact CE2-CZ3 4.39Å; F455-W545 AromaticContact CE2-NE1 3.74Å; F455-W545 AromaticContact CZ-CD1 3.58Å; F455-W545 AromaticContact CZ-CD2 3.69Å; F455-W545 HydrophobicContact CZ-CD2 3.69Å; F455-W545 AromaticContact CZ-CE2 3.55Å; F455-W545 HydrophobicContact CZ-CE3 4.43Å; F455-W545 AromaticContact CZ-CG 3.74Å; F455-W545 HydrophobicContact CZ-CG 3.74Å; F455-W545 HydrophobicContact CZ-CZ2 4.23Å; F455-W545 AromaticContact CZ-NE1 3.42Å
456	V	96.7	Very high	87	Confident	38 Å²	38	59.6 Å²	59.6	23%	0.23	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	121.3	157.6	-178.5	0	0	0	0	108	F458 K465 Q535	V456-F458 HydrophobicContact CG1-CE2 3.8Å; V456-F458 HydrophobicContact CG1-CZ 3.92Å; V456-K465 HydrophobicContact CG1-CB 4.13Å; V456-Q535 HydrophobicContact CB-CB 4.28Å; V456-Q535 PolarHBondContact N-O 2.82Å; V456-Q535 PolarHBondContact O-N 3.47Å
457	V	95.2	Very high	87.1	Confident	4 Å²	4	61.4 Å²	61.4	2%	0.024	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	131.9	-177.1	-177.6	0	0	0	0	109.9	F455 C466 R468 V470 F479 F532 V533 I534	F455-V457 HydrophobicContact CB-CG2 4.08Å; V457-C466 PolarHBondContact N-O 2.93Å; V457-C466 PolarHBondContact O-N 3.2Å; V457-C466 PolarHBondContact O-SG 3.11Å; V457-R468 HydrophobicContact CB-CG 4.22Å; V457-R468 HydrophobicContact CG2-CB 3.87Å; V457-R468 HydrophobicContact CG2-CG 4.09Å; V457-V470 HydrophobicContact CG2-CG2 4.3Å; V457-F479 HydrophobicContact CG1-CD1 4.44Å; V457-F479 HydrophobicContact CG1-CE1 4.28Å; V457-F479 HydrophobicContact CG2-CD1 4.35Å; V457-F479 HydrophobicContact CG2-CE1 4.42Å; V457-F532 HydrophobicContact CG1-CB 4.33Å; V457-F532 HydrophobicContact CG1-CD1 4.14Å; V457-V533 WeakPolarHBondContact CA-O 3.48Å; V457-I534 HydrophobicContact CG2-CG1 4.38Å
458	F	91.9	Very high	87.3	Confident	44 Å²	44	62.6 Å²	62.6	19%	0.193	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	122	173.2	-50.9	-106	0	0	0	108.1	V456 K465 F532 V533 Q535	V456-F458 HydrophobicContact CG1-CE2 3.8Å; V456-F458 HydrophobicContact CG1-CZ 3.92Å; F458-K465 HydrophobicContact CD1-CB 3.82Å; F458-K465 HydrophobicContact CE1-CB 3.53Å; F458-K465 HydrophobicContact CZ-CB 4.11Å; F458-F532 WeakPolarHBondContact O-CA 3.49Å; F458-V533 HydrophobicContact CB-CB 4.16Å; F458-V533 HydrophobicContact CD2-CB 4.34Å; F458-V533 WeakPolarHBondContact CD2-O 3.42Å; F458-V533 PolarHBondContact N-O 2.9Å; F458-V533 PolarHBondContact O-N 3.02Å; F458-Q535 HydrophobicContact CE2-CB 4.2Å
459	K	83.3	Confident	87.6	Confident	94 Å²	94	61.1 Å²	61.1	41%	0.409	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	104.8	178.6	-179.6	175.1	-177.1	171.5	0	110.2	G463 D530 F532	K459-G463 WeakPolarHBondContact O-CA 3.39Å; K459-D530 WeakPolarHBondContact CE-OD1 3.43Å; K459-D530 WeakPolarHBondContact CE-OD2 3.49Å; K459-D530 IonicContact NZ-OD2 2.59Å; K459-D530 PolarHBondContact NZ-OD2 2.82Å; K459-F532 HydrophobicContact CB-CD1 4.23Å; K459-F532 HydrophobicContact CB-CE1 4.02Å; K459-F532 HydrophobicContact CD-CE1 3.84Å; K459-F532 HydrophobicContact CD-CZ 4.44Å; K459-F532 HydrophobicContact CG-CD1 4.22Å; K459-F532 HydrophobicContact CG-CE1 3.6Å; K459-F532 HydrophobicContact CG-CZ 4.4Å
460	G	72.8	Confident	87.9	Confident	20 Å²	20	61 Å²	61	21%	0.206	30%	0.297	C	S	.	.	S	Bend	trans	84.9	169.7	-175.9	0	0	0	0	0	113.5	V462 G463 V531	G460-V462 VanDerWaalsContact C-N 3.31Å; G460-V462 PolarHBondContact O-N 3.49Å; G460-G463 PolarHBondContact O-N 3.19Å; G460-G463 VanDerWaalsContact O-N 3.08Å; G460-V531 PolarHBondContact N-O 3.01Å
461	R	63.2	Low	88.1	Confident	248 Å²	248	59.5 Å²	59.5	94%	0.936	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-33.3	-174.9	-64.1	-173.5	-174.3	124.3	0.7	113.7
462	V	64.7	Low	88.3	Confident	147 Å²	147	58.7 Å²	58.7	89%	0.891	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	18.5	177.3	-161.1	0	0	0	0	110.5	G460	G460-V462 VanDerWaalsContact C-N 3.31Å; G460-V462 PolarHBondContact O-N 3.49Å
463	G	67.7	Low	88.4	Confident	18 Å²	18	58 Å²	58	19%	0.186	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-63.8	140.4	-170	0	0	0	0	0	114.8	K459 G460 K465	K459-G463 WeakPolarHBondContact O-CA 3.39Å; G460-G463 PolarHBondContact O-N 3.19Å; G460-G463 VanDerWaalsContact O-N 3.08Å; G463-K465 PolarHBondContact O-N 3.16Å
464	H	81.4	Confident	88.4	Confident	175 Å²	175	59.5 Å²	59.5	81%	0.81	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-60.6	129.4	168.4	-69	-77	0	0	0	110.8
465	K	89.5	Confident	88.4	Confident	163 Å²	163	59.7 Å²	59.7	71%	0.709	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.9	133.1	172.7	70.4	-176.2	-179.8	-177.8	0	110.1	V456 F458 G463	V456-K465 HydrophobicContact CG1-CB 4.13Å; F458-K465 HydrophobicContact CD1-CB 3.82Å; F458-K465 HydrophobicContact CE1-CB 3.53Å; F458-K465 HydrophobicContact CZ-CB 4.11Å; G463-K465 PolarHBondContact O-N 3.16Å
466	C	93.3	Very high	88.3	Confident	32 Å²	32	59.8 Å²	59.8	22%	0.216	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	145.9	176.2	67.1	0	0	0	0	111.2	V457	V457-C466 PolarHBondContact N-O 2.93Å; V457-C466 PolarHBondContact O-N 3.2Å; V457-C466 PolarHBondContact O-SG 3.11Å
467	V	94.6	Very high	88.3	Confident	68 Å²	68	58 Å²	58	41%	0.412	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	130.3	174.1	-179.1	0	0	0	0	108.7	E454 F455 P482	E454-V467 VanDerWaalsContact CD-CG1 3.44Å; E454-V467 HydrophobicContact CG-CG1 3.57Å; F455-V467 WeakPolarHBondContact O-CA 3.21Å; V467-P482 HydrophobicContact CG1-CG 4.14Å
468	R	95.6	Very high	88.3	Confident	50 Å²	50	57.8 Å²	57.8	19%	0.189	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	138.2	177.7	-65.7	-67.1	-179.1	-91.2	-2.1	110.4	E454 F455 V457 V470 A480	E454-R468 WeakPolarHBondContact CA-O 3.28Å; F455-R468 PolarHBondContact N-O 2.91Å; F455-R468 PolarHBondContact O-N 3.04Å; V457-R468 HydrophobicContact CB-CG 4.22Å; V457-R468 HydrophobicContact CG2-CB 3.87Å; V457-R468 HydrophobicContact CG2-CG 4.09Å; R468-V470 HydrophobicContact CB-CG2 4.23Å; R468-A480 CarbonylContact C-O 3.51Å; R468-A480 VanDerWaalsContact CA-O 3.23Å; R468-A480 WeakPolarHBondContact CA-O 2.99Å; R468-A480 VanDerWaalsContact CD-O 3.29Å; R468-A480 WeakPolarHBondContact CD-O 3.47Å
469	R	95.3	Very high	88.5	Confident	35 Å²	35	55.8 Å²	55.8	13%	0.132	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	118.7	156.8	-170.8	74.3	170.5	-170.5	-2.3	106.8	Q452 D453 F471 A480 F495	Q452-R469 VanDerWaalsContact CD-NH2 3.35Å; Q452-R469 VanDerWaalsContact OE1-NE 3.08Å; D453-R469 CarbonylContact O-C 3.5Å; D453-R469 WeakPolarHBondContact O-CA 3.41Å; R469-F471 HydrophobicContact CB-CE2 3.88Å; R469-F471 HydrophobicContact CB-CZ 4.38Å; R469-F471 HydrophobicContact CG-CD2 4.14Å; R469-F471 HydrophobicContact CG-CE1 4.32Å; R469-F471 HydrophobicContact CG-CE2 3.37Å; R469-F471 HydrophobicContact CG-CZ 3.48Å; R469-F471 VanDerWaalsContact CG-CZ 3.48Å; R469-A480 PolarHBondContact N-O 3.35Å; R469-A480 PolarHBondContact O-N 3.08Å; R469-F495 HydrophobicContact CB-CD1 3.72Å; R469-F495 HydrophobicContact CB-CE1 3.81Å; R469-F495 HydrophobicContact CG-CD1 3.91Å; R469-F495 HydrophobicContact CG-CE1 3.69Å; R469-F495 HydrophobicContact CG-CZ 4.17Å
470	V	96.7	Very high	89.1	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.8	178	-172.5	0	0	0	0	108.1	Q452 D453 F455 V457 R468 V477 L478 F479 W545	Q452-V470 WeakPolarHBondContact CA-O 3.28Å; D453-V470 PolarHBondContact N-O 2.77Å; D453-V470 PolarHBondContact O-N 3Å; F455-V470 HydrophobicContact CD2-CB 3.93Å; F455-V470 HydrophobicContact CD2-CG2 3.74Å; F455-V470 HydrophobicContact CE2-CB 4.26Å; V457-V470 HydrophobicContact CG2-CG2 4.3Å; R468-V470 HydrophobicContact CB-CG2 4.23Å; V470-V477 HydrophobicContact CG1-CG1 3.83Å; V470-L478 CarbonylContact C-O 3.57Å; V470-L478 VanDerWaalsContact CA-O 3.31Å; V470-L478 WeakPolarHBondContact CA-O 3.05Å; V470-F479 HydrophobicContact CG1-CD1 4.25Å; V470-F479 HydrophobicContact CG1-CE1 4.13Å; V470-F479 HydrophobicContact CG1-CZ 4.48Å; V470-F479 HydrophobicContact CG2-CD1 3.64Å; V470-F479 HydrophobicContact CG2-CE1 3.91Å; V470-W545 HydrophobicContact CB-CH2 3.86Å; V470-W545 HydrophobicContact CB-CZ3 4.28Å; V470-W545 HydrophobicContact CG1-CH2 3.69Å; V470-W545 HydrophobicContact CG1-CZ3 3.72Å; V470-W545 WeakPolarHBondContact O-CH2 3.27Å
471	F	95.9	Very high	90.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	119.5	179.8	-62.7	-99.2	0	0	0	108.4	A432 I436 L449 Q452 R469 F473 V477 L478 A480 F495	A432-F471 HydrophobicContact CB-CE1 3.96Å; I436-F471 HydrophobicContact CD1-CD1 4.22Å; I436-F471 HydrophobicContact CD1-CD2 4.22Å; I436-F471 HydrophobicContact CD1-CE1 4.01Å; I436-F471 HydrophobicContact CD1-CE2 3.99Å; I436-F471 HydrophobicContact CD1-CG 4.33Å; I436-F471 HydrophobicContact CD1-CZ 3.89Å; I436-F471 HydrophobicContact CG1-CE2 4.27Å; I436-F471 HydrophobicContact CG1-CZ 4.06Å; L449-F471 HydrophobicContact CD1-CB 3.81Å; L449-F471 HydrophobicContact CD1-CD1 4.13Å; L449-F471 HydrophobicContact CD2-CD1 3.9Å; Q452-F471 HydrophobicContact CB-CD1 3.67Å; Q452-F471 HydrophobicContact CB-CE1 4.03Å; Q452-F471 HydrophobicContact CB-CG 4.25Å; Q452-F471 HydrophobicContact CG-CD1 4.42Å; Q452-F471 VanDerWaalsContact OE1-CE1 3.29Å; R469-F471 HydrophobicContact CB-CE2 3.88Å; R469-F471 HydrophobicContact CB-CZ 4.38Å; R469-F471 HydrophobicContact CG-CD2 4.14Å; R469-F471 HydrophobicContact CG-CE1 4.32Å; R469-F471 HydrophobicContact CG-CE2 3.37Å; R469-F471 HydrophobicContact CG-CZ 3.48Å; R469-F471 VanDerWaalsContact CG-CZ 3.48Å; F471-F473 HydrophobicContact CB-CD2 4.19Å; F471-F473 HydrophobicContact CB-CE2 3.57Å; F471-F473 HydrophobicContact CB-CZ 4.32Å; F471-F473 HydrophobicContact CG-CE2 4.47Å; F471-V477 CarbonylContact O-C 3.43Å; F471-V477 WeakPolarHBondContact O-CA 3.3Å; F471-L478 HydrophobicContact CB-CB 4.24Å; F471-L478 HydrophobicContact CB-CD2 4.44Å; F471-L478 HydrophobicContact CD2-CD2 3.6Å; F471-L478 HydrophobicContact CE2-CD2 4.22Å; F471-L478 HydrophobicContact CG-CD2 4.32Å; F471-L478 PolarHBondContact N-O 2.81Å; F471-L478 PolarHBondContact O-N 3.25Å; F471-A480 HydrophobicContact CE2-CB 4.03Å; F471-F495 HydrophobicContact CE2-CB 4.48Å; F471-F495 HydrophobicContact CE2-CG 4.35Å; F471-F495 HydrophobicContact CZ-CB 4.48Å; F471-F495 AromaticContact CZ-CD2 3.84Å; F471-F495 HydrophobicContact CZ-CD2 3.84Å; F471-F495 HydrophobicContact CZ-CE2 4.18Å; F471-F495 HydrophobicContact CZ-CG 4.03Å
472	L	96.2	Very high	91.6	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	102.6	177.1	175	64	0	0	0	109.2	L449 L450 R451 V477 T503 W545 D548 I549 L552	L449-L472 WeakPolarHBondContact CD1-O 3.31Å; L450-L472 WeakPolarHBondContact CA-O 3.44Å; L450-L472 HydrophobicContact CB-CD2 4.31Å; L450-L472 HydrophobicContact CB-CG 4.24Å; L450-L472 WeakPolarHBondContact CB-O 3.21Å; L450-L472 HydrophobicContact CD1-CD2 4.46Å; L450-L472 HydrophobicContact CD1-CG 4.35Å; L450-L472 PolarHBondContact N-O 2.89Å; R451-L472 HydrophobicContact CB-CB 4.35Å; R451-L472 HydrophobicContact CB-CD2 4.49Å; R451-L472 PolarHBondContact N-O 2.91Å; R451-L472 PolarHBondContact O-N 2.78Å; L472-V477 HydrophobicContact CD1-CG2 3.8Å; L472-T503 HydrophobicContact CD1-CG2 4.45Å; L472-W545 HydrophobicContact CB-CH2 3.84Å; L472-W545 HydrophobicContact CB-CZ3 3.76Å; L472-D548 HydrophobicContact CD2-CB 3.9Å; L472-I549 HydrophobicContact CD1-CG1 4.03Å; L472-I549 HydrophobicContact CD2-CG1 3.65Å; L472-I549 HydrophobicContact CG-CG1 4.49Å; L472-L552 HydrophobicContact CD1-CD2 4.07Å
473	F	95	Very high	92.7	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	164.1	167.7	-58.2	-97.6	0	0	0	110.2	M433 L443 Q446 N448 L449 F471 N475 L476 L478 T503	M433-F473 HydrophobicContact CE-CE1 3.93Å; M433-F473 HydrophobicContact CG-CE1 4.22Å; M433-F473 HydrophobicContact CG-CZ 4.11Å; M433-F473 HydrophobicContact SD-CE1 3.83Å; M433-F473 HydrophobicContact SD-CZ 4.33Å; L443-F473 HydrophobicContact CB-CZ 4.45Å; L443-F473 HydrophobicContact CD1-CZ 4.41Å; L443-F473 HydrophobicContact CD2-CE2 4.4Å; L443-F473 HydrophobicContact CD2-CZ 4.26Å; Q446-F473 HydrophobicContact CB-CB 4.1Å; Q446-F473 HydrophobicContact CB-CD1 4.31Å; Q446-F473 HydrophobicContact CB-CG 4.21Å; Q446-F473 WeakPolarHBondContact O-CB 3.28Å; N448-F473 CarbonylContact O-C 3.59Å; N448-F473 VanDerWaalsContact O-CA 3.29Å; N448-F473 WeakPolarHBondContact O-CA 3.25Å; L449-F473 HydrophobicContact CB-CD1 3.97Å; L449-F473 HydrophobicContact CB-CE1 3.87Å; L449-F473 HydrophobicContact CD1-CD1 3.96Å; L449-F473 HydrophobicContact CD1-CD2 3.95Å; L449-F473 HydrophobicContact CD1-CE1 3.83Å; L449-F473 HydrophobicContact CD1-CE2 3.83Å; L449-F473 HydrophobicContact CD1-CG 4.02Å; L449-F473 HydrophobicContact CD1-CZ 3.77Å; L449-F473 HydrophobicContact CG-CE1 4.34Å; F471-F473 HydrophobicContact CB-CD2 4.19Å; F471-F473 HydrophobicContact CB-CE2 3.57Å; F471-F473 HydrophobicContact CB-CZ 4.32Å; F471-F473 HydrophobicContact CG-CE2 4.47Å; F473-N475 PolarHBondContact O-N 2.93Å; F473-L476 WeakPolarHBondContact CA-O 3.35Å; F473-L476 HydrophobicContact CB-CB 4.14Å; F473-L476 VanDerWaalsContact CB-O 3.32Å; F473-L476 WeakPolarHBondContact CB-O 3.45Å; F473-L476 HydrophobicContact CD2-CB 4.27Å; F473-L476 PolarHBondContact N-O 3.5Å; F473-L478 HydrophobicContact CE2-CB 4.3Å; F473-T503 WeakPolarHBondContact O-CG2 3.35Å
474	E	93.7	Very high	93	Very high	43 Å²	43	52.1 Å²	52.1	20%	0.201	24%	0.24	C	C	.	.	S	Bend	trans	-57.3	-36.5	174.2	-67.9	179.7	124.8	0	0	112.8	G447 N448 L450 T503 L552 K555 Q556	G447-E474 WeakPolarHBondContact CA-OE2 3.35Å; N448-E474 HydrophobicContact CB-CG 4.25Å; N448-E474 PolarHBondContact N-OE2 3.38Å; N448-E474 PolarHBondContact O-N 3.27Å; L450-E474 HydrophobicContact CD1-CG 4.19Å; L450-E474 HydrophobicContact CD2-CG 3.88Å; L450-E474 HydrophobicContact CG-CG 4.15Å; E474-T503 WeakPolarHBondContact O-CB 3.41Å; E474-T503 PolarHBondContact O-OG1 3.27Å; E474-L552 HydrophobicContact CB-CD1 4.3Å; E474-L552 HydrophobicContact CG-CD1 4.48Å; E474-K555 IonicContact OE1-NZ 2.69Å; E474-Q556 PolarHBondContact O-NE2 2.92Å; E474-Q556 VanDerWaalsContact O-NE2 3.16Å
475	N	95.6	Very high	92.2	Very high	72 Å²	72	45.1 Å²	45.1	39%	0.385	21%	0.213	S	C	.	.	S	Bend	trans	-109.2	-4.9	-176.8	-58.7	-36.7	0	0	0	114.2	Q446 F473 K502 T503	Q446-N475 VanDerWaalsContact O-CB 3.3Å; Q446-N475 WeakPolarHBondContact O-CB 3.44Å; Q446-N475 PolarHBondContact O-N 2.94Å; F473-N475 PolarHBondContact O-N 2.93Å; N475-K502 WeakPolarHBondContact O-CA 2.99Å; N475-T503 VanDerWaalsContact C-OG1 3.27Å; N475-T503 WeakPolarHBondContact CA-OG1 3.41Å; N475-T503 PolarHBondContact O-N 3.12Å; N475-T503 PolarHBondContact O-OG1 3.5Å
476	L	95.7	Very high	91	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.016	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	134.6	-171.5	-165	75.3	0	0	0	112.9	L441 L443 Q446 F473 L478 I501	L441-L476 HydrophobicContact CD1-CD1 4.12Å; L441-L476 HydrophobicContact CD1-CD2 3.68Å; L443-L476 HydrophobicContact CD2-CD2 4.23Å; Q446-L476 HydrophobicContact CB-CB 3.99Å; Q446-L476 HydrophobicContact CG-CB 4.2Å; Q446-L476 HydrophobicContact CG-CD2 4.04Å; F473-L476 WeakPolarHBondContact CA-O 3.35Å; F473-L476 HydrophobicContact CB-CB 4.14Å; F473-L476 VanDerWaalsContact CB-O 3.32Å; F473-L476 WeakPolarHBondContact CB-O 3.45Å; F473-L476 HydrophobicContact CD2-CB 4.27Å; F473-L476 PolarHBondContact N-O 3.5Å; L476-L478 HydrophobicContact CD2-CB 4.12Å; L476-L478 HydrophobicContact CD2-CD1 4.18Å; L476-I501 CarbonylContact C-O 3.55Å
477	V	96.2	Very high	89.3	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	114	161.6	-174.8	0	0	0	0	108	V470 F471 L472 F479 S500 I501 T503 V506 L521	V470-V477 HydrophobicContact CG1-CG1 3.83Å; F471-V477 CarbonylContact O-C 3.43Å; F471-V477 WeakPolarHBondContact O-CA 3.3Å; L472-V477 HydrophobicContact CD1-CG2 3.8Å; V477-F479 HydrophobicContact CG1-CE2 3.81Å; V477-F479 HydrophobicContact CG1-CZ 3.98Å; V477-S500 CarbonylContact O-C 3.48Å; V477-S500 WeakPolarHBondContact O-CA 3.47Å; V477-S500 WeakPolarHBondContact O-CB 3.27Å; V477-I501 PolarHBondContact N-O 3.39Å; V477-I501 PolarHBondContact O-N 2.96Å; V477-T503 HydrophobicContact CG2-CG2 3.98Å; V477-V506 HydrophobicContact CG2-CG2 4.04Å; V477-L521 HydrophobicContact CG1-CD1 4.01Å
478	L	96.7	Very high	87.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.6	-176.2	179.7	156.2	0	0	0	110.9	I436 L443 V470 F471 F473 L476 A480 Y497	I436-L478 HydrophobicContact CD1-CD2 4.29Å; L443-L478 HydrophobicContact CD2-CD1 3.71Å; V470-L478 CarbonylContact C-O 3.57Å; V470-L478 VanDerWaalsContact CA-O 3.31Å; V470-L478 WeakPolarHBondContact CA-O 3.05Å; F471-L478 HydrophobicContact CB-CB 4.24Å; F471-L478 HydrophobicContact CB-CD2 4.44Å; F471-L478 HydrophobicContact CD2-CD2 3.6Å; F471-L478 HydrophobicContact CE2-CD2 4.22Å; F471-L478 HydrophobicContact CG-CD2 4.32Å; F471-L478 PolarHBondContact N-O 2.81Å; F471-L478 PolarHBondContact O-N 3.25Å; F473-L478 HydrophobicContact CE2-CB 4.3Å; L476-L478 HydrophobicContact CD2-CB 4.12Å; L476-L478 HydrophobicContact CD2-CD1 4.18Å; L478-A480 HydrophobicContact CD2-CB 3.96Å; L478-Y497 HydrophobicContact CD1-CD2 3.77Å; L478-Y497 HydrophobicContact CD1-CE2 3.96Å; L478-Y497 HydrophobicContact CD2-CD2 4.27Å; L478-Y497 HydrophobicContact CG-CD2 3.85Å; L478-Y497 HydrophobicContact CG-CE2 3.97Å
479	F	96.1	Very high	85.4	Confident	1 Å²	1	57.3 Å²	57.3	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.3	176.8	-57	-103.8	0	0	0	109.4	V457 V470 V477 K498 Q499 I501 L521 F532 I534	V457-F479 HydrophobicContact CG1-CD1 4.44Å; V457-F479 HydrophobicContact CG1-CE1 4.28Å; V457-F479 HydrophobicContact CG2-CD1 4.35Å; V457-F479 HydrophobicContact CG2-CE1 4.42Å; V470-F479 HydrophobicContact CG1-CD1 4.25Å; V470-F479 HydrophobicContact CG1-CE1 4.13Å; V470-F479 HydrophobicContact CG1-CZ 4.48Å; V470-F479 HydrophobicContact CG2-CD1 3.64Å; V470-F479 HydrophobicContact CG2-CE1 3.91Å; V477-F479 HydrophobicContact CG1-CE2 3.81Å; V477-F479 HydrophobicContact CG1-CZ 3.98Å; F479-K498 WeakPolarHBondContact O-CB 3.37Å; F479-K498 PolarHBondContact O-N 2.78Å; F479-Q499 HydrophobicContact CB-CG 3.85Å; F479-Q499 HydrophobicContact CD2-CG 4.01Å; F479-Q499 HydrophobicContact CG-CG 4.17Å; F479-Q499 PolarHBondContact N-O 2.92Å; F479-Q499 PolarHBondContact O-N 2.81Å; F479-I501 HydrophobicContact CE2-CD1 3.92Å; F479-I501 HydrophobicContact CE2-CG1 4.16Å; F479-I501 HydrophobicContact CZ-CD1 4.38Å; F479-L521 HydrophobicContact CZ-CD1 4.29Å; F479-F532 HydrophobicContact CZ-CB 4.44Å; F479-F532 HydrophobicContact CZ-CD2 4.38Å; F479-F532 HydrophobicContact CZ-CG 4.24Å; F479-I534 HydrophobicContact CE1-CD1 3.99Å; F479-I534 HydrophobicContact CZ-CD1 4.33Å
480	A	96.2	Very high	83.3	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	151.3	177.6	0	0	0	0	0	111.6	R468 R469 F471 L478 F495 D496	R468-A480 CarbonylContact C-O 3.51Å; R468-A480 VanDerWaalsContact CA-O 3.23Å; R468-A480 WeakPolarHBondContact CA-O 2.99Å; R468-A480 VanDerWaalsContact CD-O 3.29Å; R468-A480 WeakPolarHBondContact CD-O 3.47Å; R469-A480 PolarHBondContact N-O 3.35Å; R469-A480 PolarHBondContact O-N 3.08Å; F471-A480 HydrophobicContact CE2-CB 4.03Å; L478-A480 HydrophobicContact CD2-CB 3.96Å; A480-F495 HydrophobicContact CB-CB 3.82Å; A480-D496 CarbonylContact C-O 3.59Å; A480-D496 VanDerWaalsContact CA-O 3.31Å; A480-D496 WeakPolarHBondContact CA-O 2.98Å
481	K	94.9	Very high	81.3	Confident	107 Å²	107	65.3 Å²	65.3	47%	0.465	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	120.8	174.6	-179.7	-177.1	177.6	-178.3	0	108.8	D496 K498	K481-D496 HydrophobicContact CB-CB 4.44Å; K481-D496 PolarHBondContact N-O 3.11Å; K481-D496 PolarHBondContact O-N 3.02Å; K481-K498 HydrophobicContact CB-CD 4.37Å; K481-K498 HydrophobicContact CB-CG 4.12Å
482	P	91.7	Very high	79.7	Confident	35 Å²	35	68.4 Å²	68.4	23%	0.227	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	136.7	173.9	28.4	-33.4	0	0	0	110.5	V467 F495	V467-P482 HydrophobicContact CG1-CG 4.14Å; P482-F495 HydrophobicContact CB-CD1 4.23Å; P482-F495 HydrophobicContact CB-CE1 4.22Å
483	R	87.8	Confident	78.8	Confident	127 Å²	127	71.4 Å²	71.4	48%	0.479	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	125.5	177	-175.9	173	-175.3	-96.5	4.3	109	A485 I494	R483-A485 PolarHBondContact O-N 3.03Å; R483-I494 HydrophobicContact CB-CB 4.42Å; R483-I494 PolarHBondContact N-O 3.38Å; R483-I494 PolarHBondContact O-N 3.05Å
484	K	74.6	Confident	78.5	Confident	182 Å²	182	73 Å²	73	79%	0.791	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	124.2	170.4	-61.4	-173.2	179.5	-174.5	0	108.8	K486	K484-K486 PolarHBondContact O-N 3.3Å
485	A	65.7	Low	78.5	Confident	28 Å²	28	71.4 Å²	71.4	23%	0.231	37%	0.365	C	S	.	.			trans	-60.6	127.2	168.4	0	0	0	0	0	109	R483 I494	R483-A485 PolarHBondContact O-N 3.03Å; A485-I494 HydrophobicContact CB-CD1 4.17Å
486	K	64.5	Low	78.5	Confident	194 Å²	194	70.1 Å²	70.1	84%	0.843	36%	0.358	S	S	*	.	S	Bend	trans	-79.5	-19.1	179	-72.6	-174.5	176.8	-176.6	0	113.2	K484	K484-K486 PolarHBondContact O-N 3.3Å
487	N	56.2	Low	78.5	Confident	158 Å²	158	72.8 Å²	72.8	85%	0.845	37%	0.368	S	S	*	.	S	Bend	trans	-127.3	6.1	-156.9	-119.2	34.1	0	0	0	116.3
488	N	54	Low	78.5	Confident	107 Å²	107	77.3 Å²	77.3	57%	0.572	39%	0.388	S	S	*	.			trans	-104.8	138.6	175.3	-89.1	16.8	0	0	0	110.2	F490	N488-F490 WeakPolarHBondContact CB-O 3.36Å; N488-F490 PolarHBondContact O-N 3.11Å
489	S	54.5	Low	78.3	Confident	109 Å²	109	79.6 Å²	79.6	76%	0.762	40%	0.399	S	S	*	.	S	Bend	trans	-51.3	-20	164.9	45.3	0	0	0	0	112.8
490	F	50.6	Low	78.2	Confident	110 Å²	110	81 Å²	81	48%	0.482	41%	0.409	S	S	.	.	S	Bend	trans	-117.6	123.7	174.5	-56.8	-79.3	0	0	0	110.9	N488 V492	N488-F490 WeakPolarHBondContact CB-O 3.36Å; N488-F490 PolarHBondContact O-N 3.11Å; F490-V492 PolarHBondContact O-N 3.43Å
491	P	55.5	Low	78	Confident	93 Å²	93	81.2 Å²	81.2	60%	0.604	41%	0.41	S	S	*	.			trans	-68.4	96.2	173.7	27.4	-31.5	0	0	0	109.2
492	V	63	Low	77.9	Confident	65 Å²	65	82.3 Å²	82.3	39%	0.394	41%	0.414	S	S	.	.			trans	-89.1	123.9	166.5	-177.5	0	0	0	0	107.5	F490 I494	F490-V492 PolarHBondContact O-N 3.43Å; V492-I494 PolarHBondContact O-N 3.13Å
493	D	76.9	Confident	77.9	Confident	64 Å²	64	80.8 Å²	80.8	34%	0.342	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	121.1	171.2	-71.2	-37.8	0	0	0	109.1	S435 F495	S435-D493 WeakPolarHBondContact CB-O 3.29Å; S435-D493 PolarHBondContact OG-O 3.32Å; D493-F495 HydrophobicContact CB-CE1 4.2Å; D493-F495 HydrophobicContact CB-CE2 4.15Å; D493-F495 HydrophobicContact CB-CZ 3.68Å
494	I	89	Confident	78	Confident	33 Å²	33	78.7 Å²	78.7	17%	0.169	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137.7	173.9	-62.3	173.5	0	0	0	107.7	R437 R483 A485 V492	R437-I494 HydrophobicContact CG-CG2 3.63Å; R483-I494 HydrophobicContact CB-CB 4.42Å; R483-I494 PolarHBondContact N-O 3.38Å; R483-I494 PolarHBondContact O-N 3.05Å; A485-I494 HydrophobicContact CB-CD1 4.17Å; V492-I494 PolarHBondContact O-N 3.13Å
495	F	93.1	Very high	78.7	Confident	11 Å²	11	71.8 Å²	71.8	5%	0.048	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	106.7	-178.2	-57.7	-66.5	0	0	0	110.6	A432 S435 I436 R437 R469 F471 A480 P482 D493 Y497	A432-F495 HydrophobicContact CB-CE2 4.31Å; S435-F495 PolarHBondContact O-N 3.11Å; I436-F495 CarbonylContact C-O 3.54Å; I436-F495 VanDerWaalsContact CA-O 3.28Å; I436-F495 WeakPolarHBondContact CA-O 3.2Å; I436-F495 HydrophobicContact CG1-CB 4.07Å; R437-F495 PolarHBondContact N-O 2.69Å; R469-F495 HydrophobicContact CB-CD1 3.72Å; R469-F495 HydrophobicContact CB-CE1 3.81Å; R469-F495 HydrophobicContact CG-CD1 3.91Å; R469-F495 HydrophobicContact CG-CE1 3.69Å; R469-F495 HydrophobicContact CG-CZ 4.17Å; F471-F495 HydrophobicContact CE2-CB 4.48Å; F471-F495 HydrophobicContact CE2-CG 4.35Å; F471-F495 HydrophobicContact CZ-CB 4.48Å; F471-F495 AromaticContact CZ-CD2 3.84Å; F471-F495 HydrophobicContact CZ-CD2 3.84Å; F471-F495 HydrophobicContact CZ-CE2 4.18Å; F471-F495 HydrophobicContact CZ-CG 4.03Å; A480-F495 HydrophobicContact CB-CB 3.82Å; P482-F495 HydrophobicContact CB-CD1 4.23Å; P482-F495 HydrophobicContact CB-CE1 4.22Å; D493-F495 HydrophobicContact CB-CE1 4.2Å; D493-F495 HydrophobicContact CB-CE2 4.15Å; D493-F495 HydrophobicContact CB-CZ 3.68Å; F495-Y497 PolarHBondContact O-N 3.35Å
496	D	95.2	Very high	79.8	Confident	44 Å²	44	70.6 Å²	70.6	24%	0.235	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	116.1	176.8	-61.6	-38.1	0	0	0	109.5	A480 K481	A480-D496 CarbonylContact C-O 3.59Å; A480-D496 VanDerWaalsContact CA-O 3.31Å; A480-D496 WeakPolarHBondContact CA-O 2.98Å; K481-D496 HydrophobicContact CB-CB 4.44Å; K481-D496 PolarHBondContact N-O 3.11Å; K481-D496 PolarHBondContact O-N 3.02Å
497	Y	96.9	Very high	81.1	Confident	59 Å²	59	61.4 Å²	61.4	23%	0.231	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.8	144.2	174.4	175.5	-101.8	0	0	0	111.6	R437 G438 C439 L478 F495 S500	R437-Y497 VanDerWaalsContact O-CB 3.25Å; R437-Y497 WeakPolarHBondContact O-CB 3.2Å; R437-Y497 PolarHBondContact O-N 2.84Å; G438-Y497 WeakPolarHBondContact O-CB 3.36Å; G438-Y497 VanDerWaalsContact O-CD1 3.24Å; G438-Y497 WeakPolarHBondContact O-CD1 3.17Å; C439-Y497 HydrophobicContact CB-CD2 3.97Å; C439-Y497 HydrophobicContact CB-CG 3.87Å; L478-Y497 HydrophobicContact CD1-CD2 3.77Å; L478-Y497 HydrophobicContact CD1-CE2 3.96Å; L478-Y497 HydrophobicContact CD2-CD2 4.27Å; L478-Y497 HydrophobicContact CG-CD2 3.85Å; L478-Y497 HydrophobicContact CG-CE2 3.97Å; F495-Y497 PolarHBondContact O-N 3.35Å; Y497-S500 PolarHBondContact OH-N 3.08Å; Y497-S500 PolarHBondContact OH-OG 2.91Å
498	K	94.5	Very high	82.7	Confident	97 Å²	97	55.4 Å²	55.4	42%	0.422	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	-49.9	175.7	-61.4	-65.4	154.1	-141.1	0	112.3	F479 K481	F479-K498 WeakPolarHBondContact O-CB 3.37Å; F479-K498 PolarHBondContact O-N 2.78Å; K481-K498 HydrophobicContact CB-CD 4.37Å; K481-K498 HydrophobicContact CB-CG 4.12Å
499	Q	92.8	Very high	84.5	Confident	47 Å²	47	52.7 Å²	52.7	22%	0.22	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	165.9	-176.8	54.4	171.8	56.5	0	0	109.7	F479	F479-Q499 HydrophobicContact CB-CG 3.85Å; F479-Q499 HydrophobicContact CD2-CG 4.01Å; F479-Q499 HydrophobicContact CG-CG 4.17Å; F479-Q499 PolarHBondContact N-O 2.92Å; F479-Q499 PolarHBondContact O-N 2.81Å
500	S	94.1	Very high	86.2	Confident	31 Å²	31	51.2 Å²	51.2	22%	0.217	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	163.1	173.7	57.1	0	0	0	0	111.2	L441 V477 Y497	L441-S500 WeakPolarHBondContact CD1-OG 3.4Å; V477-S500 CarbonylContact O-C 3.48Å; V477-S500 WeakPolarHBondContact O-CA 3.47Å; V477-S500 WeakPolarHBondContact O-CB 3.27Å; Y497-S500 PolarHBondContact OH-N 3.08Å; Y497-S500 PolarHBondContact OH-OG 2.91Å
501	I	92	Very high	88.1	Confident	5 Å²	5	53 Å²	53	3%	0.026	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	129	177.9	-47.8	173.1	0	0	0	107.1	L476 V477 F479 T503 V506 F523 F532	L476-I501 CarbonylContact C-O 3.55Å; V477-I501 PolarHBondContact N-O 3.39Å; V477-I501 PolarHBondContact O-N 2.96Å; F479-I501 HydrophobicContact CE2-CD1 3.92Å; F479-I501 HydrophobicContact CE2-CG1 4.16Å; F479-I501 HydrophobicContact CZ-CD1 4.38Å; I501-T503 PolarHBondContact O-N 3.2Å; I501-V506 HydrophobicContact CB-CG2 3.98Å; I501-V506 HydrophobicContact CG2-CG2 3.48Å; I501-V506 VanDerWaalsContact CG2-CG2 3.48Å; I501-F523 HydrophobicContact CB-CE1 4.43Å; I501-F523 HydrophobicContact CB-CZ 4.43Å; I501-F523 HydrophobicContact CD1-CE2 4.14Å; I501-F523 HydrophobicContact CD1-CZ 4.1Å; I501-F523 HydrophobicContact CG1-CE1 4.29Å; I501-F523 HydrophobicContact CG1-CE2 4.34Å; I501-F523 HydrophobicContact CG1-CZ 3.8Å; I501-F523 HydrophobicContact CG2-CD1 4Å; I501-F523 HydrophobicContact CG2-CE1 3.56Å; I501-F523 HydrophobicContact CG2-CZ 3.94Å; I501-F532 HydrophobicContact CD1-CD2 3.6Å; I501-F532 HydrophobicContact CD1-CE2 3.47Å; I501-F532 VanDerWaalsContact CD1-CE2 3.47Å; I501-F532 HydrophobicContact CG1-CE2 4.31Å
502	K	92.6	Very high	89.5	Confident	129 Å²	129	50.2 Å²	50.2	56%	0.561	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.9	134.5	172.8	-69.7	-175.4	177	-178.5	0	109.2	N475 T504 D505 V506	N475-K502 WeakPolarHBondContact O-CA 2.99Å; K502-T504 PolarHBondContact O-N 3.25Å; K502-T504 VanDerWaalsContact O-N 3.16Å; K502-D505 PolarHBondContact O-N 3.05Å; K502-V506 WeakPolarHBondContact O-CG2 3.36Å; K502-V506 PolarHBondContact O-N 3.21Å
503	T	92.6	Very high	90.6	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.018	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-63.2	-25.6	-176.7	53.2	0	0	0	0	112.1	L472 F473 E474 N475 V477 I501 D505 V506 L552 Q556	L472-T503 HydrophobicContact CD1-CG2 4.45Å; F473-T503 WeakPolarHBondContact O-CG2 3.35Å; E474-T503 WeakPolarHBondContact O-CB 3.41Å; E474-T503 PolarHBondContact O-OG1 3.27Å; N475-T503 VanDerWaalsContact C-OG1 3.27Å; N475-T503 WeakPolarHBondContact CA-OG1 3.41Å; N475-T503 PolarHBondContact O-N 3.12Å; N475-T503 PolarHBondContact O-OG1 3.5Å; V477-T503 HydrophobicContact CG2-CG2 3.98Å; I501-T503 PolarHBondContact O-N 3.2Å; T503-D505 PolarHBondContact O-N 3.34Å; T503-V506 PolarHBondContact O-N 2.86Å; T503-V506 VanDerWaalsContact O-N 3.15Å; T503-L552 HydrophobicContact CG2-CD2 3.74Å; T503-Q556 PolarHBondContact OG1-NE2 3.11Å
504	T	89.2	Confident	91.2	Very high	84 Å²	84	58 Å²	58	52%	0.515	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-58.3	-24.4	170.3	54.3	0	0	0	0	114.3	K502	K502-T504 PolarHBondContact O-N 3.25Å; K502-T504 VanDerWaalsContact O-N 3.16Å
505	D	89	Confident	91.2	Very high	36 Å²	36	57.3 Å²	57.3	19%	0.193	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-107.4	1.6	-179.1	-58.2	-46.2	0	0	0	112.4	K502 T503 F523 R524 R525	K502-D505 PolarHBondContact O-N 3.05Å; T503-D505 PolarHBondContact O-N 3.34Å; D505-F523 HydrophobicContact CB-CD1 4.48Å; D505-F523 CarbonylContact O-C 3.51Å; D505-F523 WeakPolarHBondContact O-CA 3.05Å; D505-R524 PolarHBondContact O-N 3.26Å; D505-R525 IonicContact OD1-NE 2.67Å
506	V	90.4	Very high	91.3	Very high	3 Å²	3	61.3 Å²	61.3	2%	0.018	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	131.6	-178.8	172.9	0	0	0	0	111	V477 I501 K502 T503 L521 L553	V477-V506 HydrophobicContact CG2-CG2 4.04Å; I501-V506 HydrophobicContact CB-CG2 3.98Å; I501-V506 HydrophobicContact CG2-CG2 3.48Å; I501-V506 VanDerWaalsContact CG2-CG2 3.48Å; K502-V506 WeakPolarHBondContact O-CG2 3.36Å; K502-V506 PolarHBondContact O-N 3.21Å; T503-V506 PolarHBondContact O-N 2.86Å; T503-V506 VanDerWaalsContact O-N 3.15Å; V506-L521 HydrophobicContact CG1-CD2 4.09Å; V506-L553 WeakPolarHBondContact O-CD2 3.35Å
507	G	90.3	Very high	91.3	Very high	2 Å²	2	61.9 Å²	61.9	2%	0.021	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	155.7	158.5	0	0	0	0	0	110.4	L521 W522	G507-L521 WeakPolarHBondContact O-CA 3.43Å; G507-W522 PolarHBondContact N-O 2.88Å; G507-W522 PolarHBondContact O-N 3.04Å
508	I	91	Very high	91.2	Very high	32 Å²	32	61.7 Å²	61.7	16%	0.164	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	139.3	-179.7	-173.6	167.7	0	0	0	111.4	F519 E520 L521 V546 I549 L553	I508-F519 HydrophobicContact CD1-CD2 4.26Å; I508-E520 WeakPolarHBondContact CA-O 3.4Å; I508-L521 HydrophobicContact CB-CD2 4.14Å; I508-L521 HydrophobicContact CD1-CD2 4.22Å; I508-L521 HydrophobicContact CG1-CD2 4.02Å; I508-V546 HydrophobicContact CD1-CB 4.44Å; I508-V546 HydrophobicContact CD1-CG1 4.48Å; I508-V546 HydrophobicContact CD1-CG2 4.18Å; I508-I549 HydrophobicContact CB-CG2 4.17Å; I508-I549 HydrophobicContact CD1-CB 3.94Å; I508-I549 HydrophobicContact CD1-CD1 4.17Å; I508-I549 HydrophobicContact CD1-CG2 3.8Å; I508-I549 HydrophobicContact CG2-CG2 4.27Å; I508-L553 HydrophobicContact CG2-CD1 3.86Å
509	T	91.4	Very high	91.2	Very high	49 Å²	49	57 Å²	57	30%	0.301	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	108.2	164.2	-51.8	0	0	0	0	108.2	E511 F519 E520 W522	T509-E511 WeakPolarHBondContact CG2-O 3.25Å; T509-F519 WeakPolarHBondContact O-CA 3.24Å; T509-F519 WeakPolarHBondContact O-CB 3.21Å; T509-E520 PolarHBondContact N-O 3.41Å; T509-E520 PolarHBondContact O-N 3.13Å; T509-W522 PolarHBondContact OG1-NE1 3.38Å
510	Q	91.4	Very high	91.2	Very high	78 Å²	78	57.2 Å²	57.2	36%	0.364	31%	0.311	S	S	.	.			trans	-68.8	-35.9	-175.6	166.9	173.5	-10	0	0	113.3	K542 V546	Q510-K542 WeakPolarHBondContact O-CE 3.5Å; Q510-K542 PolarHBondContact O-NZ 3.49Å; Q510-V546 HydrophobicContact CB-CG1 3.78Å; Q510-V546 HydrophobicContact CB-CG2 4.37Å; Q510-V546 VanDerWaalsContact CD-CG1 3.41Å; Q510-V546 HydrophobicContact CG-CB 4.42Å; Q510-V546 HydrophobicContact CG-CG1 3.52Å; Q510-V546 HydrophobicContact CG-CG2 4.13Å
511	E	88.4	Confident	91.1	Very high	147 Å²	147	55.8 Å²	55.8	69%	0.687	30%	0.3	S	S	*	.			trans	-117.3	124.7	-173.5	-60.1	-166.6	165.9	0	0	110.6	T509	T509-E511 WeakPolarHBondContact CG2-O 3.25Å
512	V	86.7	Confident	90.9	Very high	35 Å²	35	59.1 Å²	59.1	21%	0.212	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-110.1	127.6	172.1	-178.3	0	0	0	0	106.8	E514 A515 K518 E520	V512-E514 PolarHBondContact O-N 3.39Å; V512-A515 HydrophobicContact CB-CB 4.18Å; V512-A515 HydrophobicContact CG1-CB 4.05Å; V512-A515 PolarHBondContact O-N 2.95Å; V512-A515 VanDerWaalsContact O-N 3.13Å; V512-K518 HydrophobicContact CB-CB 4.15Å; V512-K518 HydrophobicContact CG2-CB 4.08Å; V512-E520 HydrophobicContact CG2-CG 3.68Å
513	A	86.1	Confident	90.5	Very high	90 Å²	90	55 Å²	55	74%	0.744	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	135.1	-179.9	0	0	0	0	0	110.6	A515	A513-A515 PolarHBondContact O-N 3.37Å
514	E	87.8	Confident	89.7	Confident	203 Å²	203	61.1 Å²	61.1	95%	0.949	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	9.9	178.3	-55.3	177.1	-178	0	0	115.4	V512	V512-E514 PolarHBondContact O-N 3.39Å
515	A	90.8	Very high	88.8	Confident	18 Å²	18	65 Å²	65	15%	0.149	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-133.3	77.1	-177.9	0	0	0	0	0	111.4	V512 A513 L517 K518	V512-A515 HydrophobicContact CB-CB 4.18Å; V512-A515 HydrophobicContact CG1-CB 4.05Å; V512-A515 PolarHBondContact O-N 2.95Å; V512-A515 VanDerWaalsContact O-N 3.13Å; A513-A515 PolarHBondContact O-N 3.37Å; A515-L517 PolarHBondContact O-N 2.82Å; A515-L517 VanDerWaalsContact O-N 3.08Å; A515-K518 HydrophobicContact CB-CB 3.88Å; A515-K518 HydrophobicContact CB-CD 3.75Å; A515-K518 HydrophobicContact CB-CG 3.87Å; A515-K518 PolarHBondContact O-N 3.26Å
516	P	93.6	Very high	87.6	Confident	95 Å²	95	74.9 Å²	74.9	62%	0.617	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-24.1	-170.6	24.6	-34.8	0	0	0	113.8	K542	P516-K542 WeakPolarHBondContact O-CD 3.45Å; P516-K542 WeakPolarHBondContact O-CE 3.36Å; P516-K542 PolarHBondContact O-NZ 3.31Å
517	L	96.1	Very high	86.2	Confident	56 Å²	56	80.2 Å²	80.2	29%	0.293	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-4.7	178.2	-61	-178.4	0	0	0	114.1	A515 A536 L539	A515-L517 PolarHBondContact O-N 2.82Å; A515-L517 VanDerWaalsContact O-N 3.08Å; L517-A536 WeakPolarHBondContact O-CB 3.37Å; L517-A536 PolarHBondContact O-N 3.48Å; L517-L539 HydrophobicContact CD2-CB 4.2Å
518	K	94.8	Very high	85	Confident	55 Å²	55	81.8 Å²	81.8	24%	0.239	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	145.9	180	-62.6	-173.4	-174.3	177.7	0	111.4	V512 A515 V533 I534 Q535 K542	V512-K518 HydrophobicContact CB-CB 4.15Å; V512-K518 HydrophobicContact CG2-CB 4.08Å; A515-K518 HydrophobicContact CB-CB 3.88Å; A515-K518 HydrophobicContact CB-CD 3.75Å; A515-K518 HydrophobicContact CB-CG 3.87Å; A515-K518 PolarHBondContact O-N 3.26Å; K518-V533 HydrophobicContact CB-CG1 4.13Å; K518-V533 HydrophobicContact CD-CG1 3.78Å; K518-V533 HydrophobicContact CG-CG1 4.33Å; K518-I534 VanDerWaalsContact CA-O 3.27Å; K518-I534 WeakPolarHBondContact CA-O 3.47Å; K518-Q535 HydrophobicContact CG-CB 3.94Å; K518-Q535 HydrophobicContact CG-CG 4.11Å; K518-K542 WeakPolarHBondContact O-CE 3.33Å; K518-K542 PolarHBondContact O-NZ 3.35Å
519	F	95	Very high	83.7	Confident	0 Å²	0	85.9 Å²	85.9	0%	0	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	162.6	166.2	65.6	-82.6	0	0	0	108.1	F455 I508 T509 L521 I534 K542 W545 V546 I549	F455-F519 HydrophobicContact CE1-CE1 4.23Å; I508-F519 HydrophobicContact CD1-CD2 4.26Å; T509-F519 WeakPolarHBondContact O-CA 3.24Å; T509-F519 WeakPolarHBondContact O-CB 3.21Å; F519-L521 HydrophobicContact CD2-CD2 4.35Å; F519-L521 HydrophobicContact CE2-CD2 4.22Å; F519-L521 HydrophobicContact CE2-CG 4.29Å; F519-I534 HydrophobicContact CD1-CB 4.3Å; F519-I534 HydrophobicContact CD1-CG2 4.47Å; F519-I534 HydrophobicContact CD2-CB 4.43Å; F519-I534 HydrophobicContact CE1-CB 3.87Å; F519-I534 HydrophobicContact CE1-CG2 3.64Å; F519-I534 HydrophobicContact CE2-CB 4.02Å; F519-I534 HydrophobicContact CE2-CD1 3.87Å; F519-I534 HydrophobicContact CE2-CG1 4.41Å; F519-I534 HydrophobicContact CE2-CG2 4.3Å; F519-I534 HydrophobicContact CZ-CB 3.73Å; F519-I534 HydrophobicContact CZ-CD1 4.03Å; F519-I534 HydrophobicContact CZ-CG1 4.45Å; F519-I534 HydrophobicContact CZ-CG2 3.54Å; F519-I534 PolarHBondContact N-O 2.89Å; F519-I534 PolarHBondContact O-N 3.2Å; F519-K542 HydrophobicContact CD1-CG 4.02Å; F519-W545 HydrophobicContact CE1-CB 4.42Å; F519-W545 HydrophobicContact CZ-CB 4.08Å; F519-W545 HydrophobicContact CZ-CE3 4.41Å; F519-V546 HydrophobicContact CB-CG2 4.14Å; F519-V546 HydrophobicContact CG-CG2 4.18Å; F519-I549 HydrophobicContact CE2-CD1 4.34Å
520	E	92.7	Very high	82.9	Confident	51 Å²	51	85.8 Å²	85.8	24%	0.238	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	139.3	-175.9	-51.7	179.7	146.4	0	0	111.2	I508 T509 V512 V531 F532 V533	I508-E520 WeakPolarHBondContact CA-O 3.4Å; T509-E520 PolarHBondContact N-O 3.41Å; T509-E520 PolarHBondContact O-N 3.13Å; V512-E520 HydrophobicContact CG2-CG 3.68Å; E520-V531 HydrophobicContact CB-CG1 3.96Å; E520-V531 HydrophobicContact CG-CG1 4.33Å; E520-F532 CarbonylContact C-O 3.58Å; E520-F532 VanDerWaalsContact CA-O 3.3Å; E520-F532 WeakPolarHBondContact CA-O 3.38Å; E520-V533 HydrophobicContact CG-CG1 4.45Å; E520-V533 HydrophobicContact CG-CG2 4.21Å
521	L	91.8	Very high	82.7	Confident	0 Å²	0	83.8 Å²	83.8	0%	0	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	130.5	164.1	-57.2	-176.6	0	0	0	109	V477 F479 V506 G507 I508 F519 F532 I534 I549	V477-L521 HydrophobicContact CG1-CD1 4.01Å; F479-L521 HydrophobicContact CZ-CD1 4.29Å; V506-L521 HydrophobicContact CG1-CD2 4.09Å; G507-L521 WeakPolarHBondContact O-CA 3.43Å; I508-L521 HydrophobicContact CB-CD2 4.14Å; I508-L521 HydrophobicContact CD1-CD2 4.22Å; I508-L521 HydrophobicContact CG1-CD2 4.02Å; F519-L521 HydrophobicContact CD2-CD2 4.35Å; F519-L521 HydrophobicContact CE2-CD2 4.22Å; F519-L521 HydrophobicContact CE2-CG 4.29Å; L521-F532 HydrophobicContact CB-CB 4.43Å; L521-F532 PolarHBondContact N-O 3.45Å; L521-F532 PolarHBondContact O-N 2.89Å; L521-I534 HydrophobicContact CD1-CD1 3.59Å; L521-I534 HydrophobicContact CG-CD1 3.83Å; L521-I549 HydrophobicContact CD2-CD1 3.96Å
522	W	87.5	Confident	82.8	Confident	75 Å²	75	76.9 Å²	76.9	28%	0.284	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	159.5	-178.7	46.7	-92.3	0	0	0	109.9	G507 T509 R524 V531	G507-W522 PolarHBondContact N-O 2.88Å; G507-W522 PolarHBondContact O-N 3.04Å; T509-W522 PolarHBondContact OG1-NE1 3.38Å; W522-R524 HydrophobicContact CZ3-CB 4.36Å; W522-R524 HydrophobicContact CZ3-CG 4.4Å; W522-R524 PolarHBondContact O-N 3.45Å; W522-V531 HydrophobicContact CB-CG1 4.5Å; W522-V531 HydrophobicContact CB-CG2 4.12Å
523	F	84.3	Confident	83.1	Confident	44 Å²	44	76.2 Å²	76.2	19%	0.193	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.8	177.6	-71.4	-101.7	0	0	0	110.3	I501 D505 R525 S528 D530 F532	I501-F523 HydrophobicContact CB-CE1 4.43Å; I501-F523 HydrophobicContact CB-CZ 4.43Å; I501-F523 HydrophobicContact CD1-CE2 4.14Å; I501-F523 HydrophobicContact CD1-CZ 4.1Å; I501-F523 HydrophobicContact CG1-CE1 4.29Å; I501-F523 HydrophobicContact CG1-CE2 4.34Å; I501-F523 HydrophobicContact CG1-CZ 3.8Å; I501-F523 HydrophobicContact CG2-CD1 4Å; I501-F523 HydrophobicContact CG2-CE1 3.56Å; I501-F523 HydrophobicContact CG2-CZ 3.94Å; D505-F523 HydrophobicContact CB-CD1 4.48Å; D505-F523 CarbonylContact O-C 3.51Å; D505-F523 WeakPolarHBondContact O-CA 3.05Å; F523-R525 VanDerWaalsContact C-N 3.29Å; F523-R525 CarbonylContact C-O 3.55Å; F523-R525 WeakPolarHBondContact CB-O 3.49Å; F523-R525 PolarHBondContact O-N 2.91Å; F523-S528 WeakPolarHBondContact CD2-OG 3.19Å; F523-S528 WeakPolarHBondContact CE2-OG 3.19Å; F523-S528 WeakPolarHBondContact CG-OG 3.43Å; F523-D530 HydrophobicContact CD2-CB 4.25Å; F523-D530 HydrophobicContact CE2-CB 3.95Å; F523-F532 AromaticContact CE2-CE2 3.83Å; F523-F532 HydrophobicContact CE2-CE2 3.83Å
524	R	75.2	Confident	83.5	Confident	130 Å²	130	71.9 Å²	71.9	49%	0.491	35%	0.351	S	S	.	.	S	Bend	trans	-59	-43.7	-179	-168.6	-174.2	-171.8	95.8	3.9	111.6	D505 W522	D505-R524 PolarHBondContact O-N 3.26Å; W522-R524 HydrophobicContact CZ3-CB 4.36Å; W522-R524 HydrophobicContact CZ3-CG 4.4Å; W522-R524 PolarHBondContact O-N 3.45Å
525	R	71.1	Confident	83.9	Confident	165 Å²	165	65.4 Å²	65.4	62%	0.623	32%	0.321	S	S	*	.	S	Bend	trans	-83.7	134.8	170.9	-57.4	-176.4	-166.1	-176.2	3.8	107.2	D505 F523 T527	D505-R525 IonicContact OD1-NE 2.67Å; F523-R525 VanDerWaalsContact C-N 3.29Å; F523-R525 CarbonylContact C-O 3.55Å; F523-R525 WeakPolarHBondContact CB-O 3.49Å; F523-R525 PolarHBondContact O-N 2.91Å; R525-T527 HydrophobicContact CB-CG2 3.99Å; R525-T527 PolarHBondContact O-N 3.12Å; R525-T527 PolarHBondContact O-OG1 2.9Å
526	R	63.3	Low	84.2	Confident	244 Å²	244	64.6 Å²	64.6	92%	0.921	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	26.5	176.9	-72.4	-177.7	137.6	163.1	-3.4	113.7	S528	R526-S528 PolarHBondContact O-N 3.33Å
527	T	61	Low	84.4	Confident	115 Å²	115	65.2 Å²	65.2	71%	0.706	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-25.1	175.7	50.7	0	0	0	0	111.7	R525	R525-T527 HydrophobicContact CB-CG2 3.99Å; R525-T527 PolarHBondContact O-N 3.12Å; R525-T527 PolarHBondContact O-OG1 2.9Å
528	S	64.1	Low	84.4	Confident	35 Å²	35	64 Å²	64	25%	0.245	31%	0.309	C	S	.	.			trans	-142.2	138.8	171.5	58.7	0	0	0	0	110.8	F523 R526 D530	F523-S528 WeakPolarHBondContact CD2-OG 3.19Å; F523-S528 WeakPolarHBondContact CE2-OG 3.19Å; F523-S528 WeakPolarHBondContact CG-OG 3.43Å; R526-S528 PolarHBondContact O-N 3.33Å; S528-D530 PolarHBondContact O-N 3.49Å
529	S	63.8	Low	84.4	Confident	118 Å²	118	65 Å²	65	83%	0.825	32%	0.316	S	S	*	.			trans	-76.3	3.7	169.7	54.5	0	0	0	0	113.1	V531	S529-V531 PolarHBondContact O-N 3.35Å
530	D	75.7	Confident	84.4	Confident	48 Å²	48	70.3 Å²	70.3	26%	0.257	34%	0.341	S	S	.	.			trans	-64.7	116.5	180	-81.9	-8.2	0	0	0	110.9	K459 F523 S528 F532	K459-D530 WeakPolarHBondContact CE-OD1 3.43Å; K459-D530 WeakPolarHBondContact CE-OD2 3.49Å; K459-D530 IonicContact NZ-OD2 2.59Å; K459-D530 PolarHBondContact NZ-OD2 2.82Å; F523-D530 HydrophobicContact CD2-CB 4.25Å; F523-D530 HydrophobicContact CE2-CB 3.95Å; S528-D530 PolarHBondContact O-N 3.49Å; D530-F532 HydrophobicContact CB-CE2 4.31Å; D530-F532 HydrophobicContact CB-CZ 4.21Å
531	V	86.5	Confident	84.6	Confident	35 Å²	35	68.3 Å²	68.3	21%	0.212	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.8	169	-179	0	0	0	0	107.6	G460 E520 W522 S529	G460-V531 PolarHBondContact N-O 3.01Å; E520-V531 HydrophobicContact CB-CG1 3.96Å; E520-V531 HydrophobicContact CG-CG1 4.33Å; W522-V531 HydrophobicContact CB-CG1 4.5Å; W522-V531 HydrophobicContact CB-CG2 4.12Å; S529-V531 PolarHBondContact O-N 3.35Å
532	F	90.6	Very high	84.8	Confident	3 Å²	3	69 Å²	69	1%	0.013	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	106.9	173.3	-59.9	-74.2	0	0	0	109	V457 F458 K459 F479 I501 E520 L521 F523 D530 I534	V457-F532 HydrophobicContact CG1-CB 4.33Å; V457-F532 HydrophobicContact CG1-CD1 4.14Å; F458-F532 WeakPolarHBondContact O-CA 3.49Å; K459-F532 HydrophobicContact CB-CD1 4.23Å; K459-F532 HydrophobicContact CB-CE1 4.02Å; K459-F532 HydrophobicContact CD-CE1 3.84Å; K459-F532 HydrophobicContact CD-CZ 4.44Å; K459-F532 HydrophobicContact CG-CD1 4.22Å; K459-F532 HydrophobicContact CG-CE1 3.6Å; K459-F532 HydrophobicContact CG-CZ 4.4Å; F479-F532 HydrophobicContact CZ-CB 4.44Å; F479-F532 HydrophobicContact CZ-CD2 4.38Å; F479-F532 HydrophobicContact CZ-CG 4.24Å; I501-F532 HydrophobicContact CD1-CD2 3.6Å; I501-F532 HydrophobicContact CD1-CE2 3.47Å; I501-F532 VanDerWaalsContact CD1-CE2 3.47Å; I501-F532 HydrophobicContact CG1-CE2 4.31Å; E520-F532 CarbonylContact C-O 3.58Å; E520-F532 VanDerWaalsContact CA-O 3.3Å; E520-F532 WeakPolarHBondContact CA-O 3.38Å; L521-F532 HydrophobicContact CB-CB 4.43Å; L521-F532 PolarHBondContact N-O 3.45Å; L521-F532 PolarHBondContact O-N 2.89Å; F523-F532 AromaticContact CE2-CE2 3.83Å; F523-F532 HydrophobicContact CE2-CE2 3.83Å; D530-F532 HydrophobicContact CB-CE2 4.31Å; D530-F532 HydrophobicContact CB-CZ 4.21Å; F532-I534 HydrophobicContact CB-CG1 4.39Å; F532-I534 PolarHBondContact O-N 2.93Å
533	V	92.6	Very high	85.2	Confident	20 Å²	20	70.4 Å²	70.4	12%	0.121	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	117.7	169.3	-170.3	0	0	0	0	107.2	V457 F458 K518 E520	V457-V533 WeakPolarHBondContact CA-O 3.48Å; F458-V533 HydrophobicContact CB-CB 4.16Å; F458-V533 HydrophobicContact CD2-CB 4.34Å; F458-V533 WeakPolarHBondContact CD2-O 3.42Å; F458-V533 PolarHBondContact N-O 2.9Å; F458-V533 PolarHBondContact O-N 3.02Å; K518-V533 HydrophobicContact CB-CG1 4.13Å; K518-V533 HydrophobicContact CD-CG1 3.78Å; K518-V533 HydrophobicContact CG-CG1 4.33Å; E520-V533 HydrophobicContact CG-CG1 4.45Å; E520-V533 HydrophobicContact CG-CG2 4.21Å
534	I	95.4	Very high	85.5	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.6	-176.2	-57.4	-177.7	0	0	0	108.3	F455 V457 F479 K518 F519 L521 F532	F455-I534 HydrophobicContact CB-CG2 3.65Å; F455-I534 HydrophobicContact CD1-CG2 3.47Å; F455-I534 VanDerWaalsContact CD1-CG2 3.47Å; F455-I534 HydrophobicContact CD2-CG2 3.96Å; F455-I534 HydrophobicContact CE1-CG2 4.06Å; F455-I534 HydrophobicContact CE2-CG2 4.45Å; F455-I534 HydrophobicContact CG-CG2 3.42Å; F455-I534 VanDerWaalsContact CG-CG2 3.42Å; V457-I534 HydrophobicContact CG2-CG1 4.38Å; F479-I534 HydrophobicContact CE1-CD1 3.99Å; F479-I534 HydrophobicContact CZ-CD1 4.33Å; K518-I534 VanDerWaalsContact CA-O 3.27Å; K518-I534 WeakPolarHBondContact CA-O 3.47Å; F519-I534 HydrophobicContact CD1-CB 4.3Å; F519-I534 HydrophobicContact CD1-CG2 4.47Å; F519-I534 HydrophobicContact CD2-CB 4.43Å; F519-I534 HydrophobicContact CE1-CB 3.87Å; F519-I534 HydrophobicContact CE1-CG2 3.64Å; F519-I534 HydrophobicContact CE2-CB 4.02Å; F519-I534 HydrophobicContact CE2-CD1 3.87Å; F519-I534 HydrophobicContact CE2-CG1 4.41Å; F519-I534 HydrophobicContact CE2-CG2 4.3Å; F519-I534 HydrophobicContact CZ-CB 3.73Å; F519-I534 HydrophobicContact CZ-CD1 4.03Å; F519-I534 HydrophobicContact CZ-CG1 4.45Å; F519-I534 HydrophobicContact CZ-CG2 3.54Å; F519-I534 PolarHBondContact N-O 2.89Å; F519-I534 PolarHBondContact O-N 3.2Å; L521-I534 HydrophobicContact CD1-CD1 3.59Å; L521-I534 HydrophobicContact CG-CD1 3.83Å; F532-I534 HydrophobicContact CB-CG1 4.39Å; F532-I534 PolarHBondContact O-N 2.93Å
535	Q	95.9	Very high	86.5	Confident	66 Å²	66	62.9 Å²	62.9	31%	0.308	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	114	178.4	-179.6	176.7	-29.9	0	0	110.5	F455 V456 F458 K518	F455-Q535 WeakPolarHBondContact CD1-O 3.42Å; V456-Q535 HydrophobicContact CB-CB 4.28Å; V456-Q535 PolarHBondContact N-O 2.82Å; V456-Q535 PolarHBondContact O-N 3.47Å; F458-Q535 HydrophobicContact CE2-CB 4.2Å; K518-Q535 HydrophobicContact CG-CB 3.94Å; K518-Q535 HydrophobicContact CG-CG 4.11Å
536	A	97.6	Very high	87.7	Confident	2 Å²	2	55.2 Å²	55.2	2%	0.017	29%	0.289	C	S	.	.			trans	-72.8	155.6	174.2	0	0	0	0	0	112.6	F455 L517 S538 Q541 K542	F455-A536 HydrophobicContact CD1-CB 4.27Å; F455-A536 HydrophobicContact CE1-CB 3.84Å; L517-A536 WeakPolarHBondContact O-CB 3.37Å; L517-A536 PolarHBondContact O-N 3.48Å; A536-S538 WeakPolarHBondContact CB-O 3.44Å; A536-Q541 HydrophobicContact CB-CB 4.4Å; A536-K542 HydrophobicContact CB-CB 3.72Å
537	N	96.6	Very high	89.1	Confident	107 Å²	107	47.4 Å²	47.4	57%	0.572	27%	0.265	S	S	*	.	S	Bend	trans	-80.8	-18.9	174.8	-60.4	-44.2	0	0	0	112.5	E454	E454-N537 PolarHBondContact O-ND2 3.2Å
538	S	96.8	Very high	90.6	Very high	31 Å²	31	42.9 Å²	42.9	22%	0.217	24%	0.236	C	C	.	.	S	Bend	trans	-152.9	158.8	-179.7	61.2	0	0	0	0	110.9	A536 E540 Q541 K542	A536-S538 WeakPolarHBondContact CB-O 3.44Å; S538-E540 VanDerWaalsContact C-N 3.28Å; S538-E540 WeakPolarHBondContact CB-OE2 3.38Å; S538-E540 PolarHBondContact O-N 2.85Å; S538-Q541 PolarHBondContact O-N 3.03Å; S538-Q541 VanDerWaalsContact OG-CB 3.28Å; S538-Q541 WeakPolarHBondContact OG-CB 3.14Å; S538-Q541 PolarHBondContact OG-N 3.25Å; S538-K542 PolarHBondContact O-N 3.35Å; S538-K542 VanDerWaalsContact O-N 3.14Å
539	L	95.9	Very high	92	Very high	75 Å²	75	41.4 Å²	41.4	39%	0.393	23%	0.225	S	C	.	.	H	α-helix	trans	-66.1	-37	178.8	-178.4	63.4	0	0	0	110.6	L517 Q541 K542 Q543	L517-L539 HydrophobicContact CD2-CB 4.2Å; L539-Q541 PolarHBondContact O-N 2.96Å; L539-K542 PolarHBondContact O-N 2.87Å; L539-Q543 HydrophobicContact CD1-CG 4.34Å; L539-Q543 HydrophobicContact CG-CG 4.3Å; L539-Q543 WeakPolarHBondContact O-CB 3.21Å; L539-Q543 VanDerWaalsContact O-CG 3.27Å; L539-Q543 WeakPolarHBondContact O-CG 3.41Å; L539-Q543 PolarHBondContact O-N 3.28Å
540	E	94.5	Very high	93.4	Very high	112 Å²	112	37.3 Å²	37.3	52%	0.523	20%	0.197	S	C	.	.	H	α-helix	trans	-61.3	-44.9	177.5	-61.7	73.4	-162.5	0	0	110.8	S538 Q543 A544	S538-E540 VanDerWaalsContact C-N 3.28Å; S538-E540 WeakPolarHBondContact CB-OE2 3.38Å; S538-E540 PolarHBondContact O-N 2.85Å; E540-Q543 PolarHBondContact O-N 3.46Å; E540-A544 WeakPolarHBondContact O-CB 3.37Å; E540-A544 PolarHBondContact O-N 3.37Å
541	Q	96.2	Very high	94	Very high	10 Å²	10	40.6 Å²	40.6	5%	0.047	21%	0.21	C	C	.	.	H	α-helix	trans	-62.5	-46	176	-173.7	-167.5	45.7	0	0	110.9	D453 F455 A536 S538 L539 Q543 A544 W545	D453-Q541 PolarHBondContact OD1-NE2 3.3Å; F455-Q541 HydrophobicContact CE1-CG 4.04Å; F455-Q541 HydrophobicContact CZ-CG 4.08Å; A536-Q541 HydrophobicContact CB-CB 4.4Å; S538-Q541 PolarHBondContact O-N 3.03Å; S538-Q541 VanDerWaalsContact OG-CB 3.28Å; S538-Q541 WeakPolarHBondContact OG-CB 3.14Å; S538-Q541 PolarHBondContact OG-N 3.25Å; L539-Q541 PolarHBondContact O-N 2.96Å; Q541-Q543 PolarHBondContact O-N 3.45Å; Q541-A544 PolarHBondContact O-N 2.81Å; Q541-W545 VanDerWaalsContact O-CD1 3.24Å; Q541-W545 PolarHBondContact O-N 2.94Å; Q541-W545 VanDerWaalsContact O-N 3.08Å
542	K	97	Very high	94.2	Very high	14 Å²	14	39.5 Å²	39.5	6%	0.061	20%	0.203	C	C	.	.	H	α-helix	trans	-57.9	-50.2	175.5	171.7	179.8	166	174.2	0	111.1	Q510 P516 K518 F519 A536 S538 L539 A544 W545 V546	Q510-K542 WeakPolarHBondContact O-CE 3.5Å; Q510-K542 PolarHBondContact O-NZ 3.49Å; P516-K542 WeakPolarHBondContact O-CD 3.45Å; P516-K542 WeakPolarHBondContact O-CE 3.36Å; P516-K542 PolarHBondContact O-NZ 3.31Å; K518-K542 WeakPolarHBondContact O-CE 3.33Å; K518-K542 PolarHBondContact O-NZ 3.35Å; F519-K542 HydrophobicContact CD1-CG 4.02Å; A536-K542 HydrophobicContact CB-CB 3.72Å; S538-K542 PolarHBondContact O-N 3.35Å; S538-K542 VanDerWaalsContact O-N 3.14Å; L539-K542 PolarHBondContact O-N 2.87Å; K542-A544 VanDerWaalsContact C-N 3.34Å; K542-A544 PolarHBondContact O-N 3.45Å; K542-W545 PolarHBondContact O-N 2.9Å; K542-V546 HydrophobicContact CG-CG2 4.11Å; K542-V546 WeakPolarHBondContact O-CB 3.39Å; K542-V546 VanDerWaalsContact O-CG2 3.28Å; K542-V546 WeakPolarHBondContact O-CG2 3.12Å; K542-V546 PolarHBondContact O-N 3.45Å
543	Q	95.3	Very high	94.1	Very high	104 Å²	104	41 Å²	41	49%	0.486	21%	0.211	S	C	.	.	H	α-helix	trans	-60.4	-44.3	-177.1	-76.2	173.5	-17.2	0	0	111.4	L539 E540 Q541 W545 V546 M547	L539-Q543 HydrophobicContact CD1-CG 4.34Å; L539-Q543 HydrophobicContact CG-CG 4.3Å; L539-Q543 WeakPolarHBondContact O-CB 3.21Å; L539-Q543 VanDerWaalsContact O-CG 3.27Å; L539-Q543 WeakPolarHBondContact O-CG 3.41Å; L539-Q543 PolarHBondContact O-N 3.28Å; E540-Q543 PolarHBondContact O-N 3.46Å; Q541-Q543 PolarHBondContact O-N 3.45Å; Q543-W545 PolarHBondContact O-N 2.77Å; Q543-V546 PolarHBondContact O-N 2.95Å; Q543-M547 WeakPolarHBondContact O-CB 3.41Å; Q543-M547 PolarHBondContact O-N 3Å
544	A	91.1	Very high	93.8	Very high	16 Å²	16	44.9 Å²	44.9	13%	0.132	22%	0.224	C	C	.	.	H	α-helix	trans	-60.9	-44.8	177.1	0	0	0	0	0	112.1	E540 Q541 K542 M547 D548	E540-A544 WeakPolarHBondContact O-CB 3.37Å; E540-A544 PolarHBondContact O-N 3.37Å; Q541-A544 PolarHBondContact O-N 2.81Å; K542-A544 VanDerWaalsContact C-N 3.34Å; K542-A544 PolarHBondContact O-N 3.45Å; A544-M547 PolarHBondContact O-N 2.83Å; A544-D548 PolarHBondContact O-N 3.13Å
545	W	96.3	Very high	93.3	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65	-46.3	177.1	-87.9	73.7	0	0	0	113.2	R451 D453 F455 V470 L472 F519 Q541 K542 Q543 M547 D548 I549	R451-W545 HydrophobicContact CB-CZ2 4.07Å; R451-W545 HydrophobicContact CG-CZ2 3.91Å; D453-W545 HydrophobicContact CB-CZ2 3.78Å; D453-W545 PolarHBondContact OD2-NE1 3.41Å; F455-W545 AromaticContact CE2-CD2 3.8Å; F455-W545 HydrophobicContact CE2-CD2 3.8Å; F455-W545 AromaticContact CE2-CE2 3.44Å; F455-W545 VanDerWaalsContact CE2-CE2 3.44Å; F455-W545 HydrophobicContact CE2-CE3 4.25Å; F455-W545 HydrophobicContact CE2-CG 4.35Å; F455-W545 HydrophobicContact CE2-CH2 4.13Å; F455-W545 AromaticContact CE2-CZ2 3.64Å; F455-W545 HydrophobicContact CE2-CZ2 3.64Å; F455-W545 HydrophobicContact CE2-CZ3 4.39Å; F455-W545 AromaticContact CE2-NE1 3.74Å; F455-W545 AromaticContact CZ-CD1 3.58Å; F455-W545 AromaticContact CZ-CD2 3.69Å; F455-W545 HydrophobicContact CZ-CD2 3.69Å; F455-W545 AromaticContact CZ-CE2 3.55Å; F455-W545 HydrophobicContact CZ-CE3 4.43Å; F455-W545 AromaticContact CZ-CG 3.74Å; F455-W545 HydrophobicContact CZ-CG 3.74Å; F455-W545 HydrophobicContact CZ-CZ2 4.23Å; F455-W545 AromaticContact CZ-NE1 3.42Å; V470-W545 HydrophobicContact CB-CH2 3.86Å; V470-W545 HydrophobicContact CB-CZ3 4.28Å; V470-W545 HydrophobicContact CG1-CH2 3.69Å; V470-W545 HydrophobicContact CG1-CZ3 3.72Å; V470-W545 WeakPolarHBondContact O-CH2 3.27Å; L472-W545 HydrophobicContact CB-CH2 3.84Å; L472-W545 HydrophobicContact CB-CZ3 3.76Å; F519-W545 HydrophobicContact CE1-CB 4.42Å; F519-W545 HydrophobicContact CZ-CB 4.08Å; F519-W545 HydrophobicContact CZ-CE3 4.41Å; Q541-W545 VanDerWaalsContact O-CD1 3.24Å; Q541-W545 PolarHBondContact O-N 2.94Å; Q541-W545 VanDerWaalsContact O-N 3.08Å; K542-W545 PolarHBondContact O-N 2.9Å; Q543-W545 PolarHBondContact O-N 2.77Å; W545-M547 VanDerWaalsContact C-N 3.32Å; W545-M547 PolarHBondContact O-N 3.29Å; W545-D548 PolarHBondContact O-N 3.4Å; W545-I549 HydrophobicContact CE3-CD1 3.99Å; W545-I549 WeakPolarHBondContact O-CB 3.27Å; W545-I549 VanDerWaalsContact O-CG1 3.25Å; W545-I549 WeakPolarHBondContact O-CG1 3.1Å; W545-I549 PolarHBondContact O-N 3.48Å
546	V	95.8	Very high	92.9	Very high	4 Å²	4	49.4 Å²	49.4	2%	0.024	24%	0.243	C	C	.	.	H	α-helix	trans	-61.3	-44	177.8	166.2	0	0	0	0	110.7	I508 Q510 F519 K542 Q543 S550	I508-V546 HydrophobicContact CD1-CB 4.44Å; I508-V546 HydrophobicContact CD1-CG1 4.48Å; I508-V546 HydrophobicContact CD1-CG2 4.18Å; Q510-V546 HydrophobicContact CB-CG1 3.78Å; Q510-V546 HydrophobicContact CB-CG2 4.37Å; Q510-V546 VanDerWaalsContact CD-CG1 3.41Å; Q510-V546 HydrophobicContact CG-CB 4.42Å; Q510-V546 HydrophobicContact CG-CG1 3.52Å; Q510-V546 HydrophobicContact CG-CG2 4.13Å; F519-V546 HydrophobicContact CB-CG2 4.14Å; F519-V546 HydrophobicContact CG-CG2 4.18Å; K542-V546 HydrophobicContact CG-CG2 4.11Å; K542-V546 WeakPolarHBondContact O-CB 3.39Å; K542-V546 VanDerWaalsContact O-CG2 3.28Å; K542-V546 WeakPolarHBondContact O-CG2 3.12Å; K542-V546 PolarHBondContact O-N 3.45Å; Q543-V546 PolarHBondContact O-N 2.95Å; V546-S550 WeakPolarHBondContact O-CB 3.35Å; V546-S550 PolarHBondContact O-N 2.85Å; V546-S550 PolarHBondContact O-OG 3.41Å
547	M	92.7	Very high	92.1	Very high	81 Å²	81	51.1 Å²	51.1	40%	0.399	26%	0.258	S	S	.	.	H	α-helix	trans	-60.3	-52.3	179.2	180	-176.4	73.8	0	0	110.7	Q543 A544 W545 I549 S550 Q551	Q543-M547 WeakPolarHBondContact O-CB 3.41Å; Q543-M547 PolarHBondContact O-N 3Å; A544-M547 PolarHBondContact O-N 2.83Å; W545-M547 VanDerWaalsContact C-N 3.32Å; W545-M547 PolarHBondContact O-N 3.29Å; M547-I549 PolarHBondContact O-N 2.74Å; M547-S550 PolarHBondContact O-N 3.32Å; M547-Q551 HydrophobicContact CG-CG 4.49Å; M547-Q551 WeakPolarHBondContact O-CB 3.49Å; M547-Q551 VanDerWaalsContact O-CG 3.31Å; M547-Q551 WeakPolarHBondContact O-CG 3.29Å; M547-Q551 PolarHBondContact O-N 3.44Å
548	D	91.5	Very high	91.4	Very high	19 Å²	19	50.5 Å²	50.5	10%	0.102	25%	0.253	C	S	.	.	H	α-helix	trans	-61	-46.5	-179.9	-79.6	19.6	0	0	0	112.8	R451 L472 A544 W545 S550 Q551 L552	R451-D548 IonicContact CZ-OD1 3.31Å; R451-D548 IonicContact CZ-OD2 3.92Å; R451-D548 IonicContact NE-OD1 2.68Å; R451-D548 IonicContact NE-OD2 2.65Å; R451-D548 PolarHBondContact NE-OD2 3.28Å; R451-D548 IonicContact NH2-OD1 2.72Å; R451-D548 PolarHBondContact NH2-OD1 3.38Å; R451-D548 IonicContact NH2-OD2 3.73Å; R451-D548 PolarHBondContact NH2-OD2 2.87Å; L472-D548 HydrophobicContact CD2-CB 3.9Å; A544-D548 PolarHBondContact O-N 3.13Å; W545-D548 PolarHBondContact O-N 3.4Å; D548-S550 VanDerWaalsContact C-N 3.31Å; D548-S550 PolarHBondContact O-N 2.84Å; D548-Q551 PolarHBondContact O-N 2.84Å; D548-L552 VanDerWaalsContact O-CB 3.25Å; D548-L552 WeakPolarHBondContact O-CB 3.39Å; D548-L552 PolarHBondContact O-N 3.09Å
549	I	94.1	Very high	90.5	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-63.1	-43.4	178.9	-67	169.7	0	0	0	109.5	L472 I508 F519 L521 W545 M547 L552 L553	L472-I549 HydrophobicContact CD1-CG1 4.03Å; L472-I549 HydrophobicContact CD2-CG1 3.65Å; L472-I549 HydrophobicContact CG-CG1 4.49Å; I508-I549 HydrophobicContact CB-CG2 4.17Å; I508-I549 HydrophobicContact CD1-CB 3.94Å; I508-I549 HydrophobicContact CD1-CD1 4.17Å; I508-I549 HydrophobicContact CD1-CG2 3.8Å; I508-I549 HydrophobicContact CG2-CG2 4.27Å; F519-I549 HydrophobicContact CE2-CD1 4.34Å; L521-I549 HydrophobicContact CD2-CD1 3.96Å; W545-I549 HydrophobicContact CE3-CD1 3.99Å; W545-I549 WeakPolarHBondContact O-CB 3.27Å; W545-I549 VanDerWaalsContact O-CG1 3.25Å; W545-I549 WeakPolarHBondContact O-CG1 3.1Å; W545-I549 PolarHBondContact O-N 3.48Å; M547-I549 PolarHBondContact O-N 2.74Å; I549-L552 PolarHBondContact O-N 3.07Å; I549-L553 HydrophobicContact CG2-CD1 3.81Å; I549-L553 HydrophobicContact CG2-CG 4.19Å; I549-L553 WeakPolarHBondContact O-CB 3.45Å; I549-L553 WeakPolarHBondContact O-CG 3.45Å; I549-L553 PolarHBondContact O-N 2.9Å
550	S	92.7	Very high	89.5	Confident	33 Å²	33	56.6 Å²	56.6	23%	0.231	28%	0.278	C	S	.	.	H	α-helix	trans	-63.4	-43.7	178.5	-58.7	0	0	0	0	111.9	V546 M547 D548 L553 W554	V546-S550 WeakPolarHBondContact O-CB 3.35Å; V546-S550 PolarHBondContact O-N 2.85Å; V546-S550 PolarHBondContact O-OG 3.41Å; M547-S550 PolarHBondContact O-N 3.32Å; D548-S550 VanDerWaalsContact C-N 3.31Å; D548-S550 PolarHBondContact O-N 2.84Å; S550-L553 PolarHBondContact O-N 3.06Å; S550-W554 VanDerWaalsContact O-CB 3.28Å; S550-W554 WeakPolarHBondContact O-CB 3.29Å; S550-W554 PolarHBondContact O-N 2.71Å
551	Q	89	Confident	88.1	Confident	116 Å²	116	56.3 Å²	56.3	54%	0.542	27%	0.272	S	S	.	.	H	α-helix	trans	-63.3	-42.4	176	-74.3	177.4	6.3	0	0	111.8	M547 D548 W554 K555	M547-Q551 HydrophobicContact CG-CG 4.49Å; M547-Q551 WeakPolarHBondContact O-CB 3.49Å; M547-Q551 VanDerWaalsContact O-CG 3.31Å; M547-Q551 WeakPolarHBondContact O-CG 3.29Å; M547-Q551 PolarHBondContact O-N 3.44Å; D548-Q551 PolarHBondContact O-N 2.84Å; Q551-W554 PolarHBondContact O-N 3.36Å; Q551-K555 WeakPolarHBondContact O-CB 3.46Å; Q551-K555 PolarHBondContact O-N 2.76Å
552	L	90.4	Very high	86.3	Confident	12 Å²	12	57.9 Å²	57.9	6%	0.063	29%	0.291	C	S	.	.	H	α-helix	trans	-61.4	-49.7	176.7	179.2	63.5	0	0	0	111.4	L450 L472 E474 T503 D548 I549 W554 K555 Q556	L450-L552 HydrophobicContact CD1-CD1 4.2Å; L450-L552 HydrophobicContact CD1-CD2 4.06Å; L472-L552 HydrophobicContact CD1-CD2 4.07Å; E474-L552 HydrophobicContact CB-CD1 4.3Å; E474-L552 HydrophobicContact CG-CD1 4.48Å; T503-L552 HydrophobicContact CG2-CD2 3.74Å; D548-L552 VanDerWaalsContact O-CB 3.25Å; D548-L552 WeakPolarHBondContact O-CB 3.39Å; D548-L552 PolarHBondContact O-N 3.09Å; I549-L552 PolarHBondContact O-N 3.07Å; L552-W554 VanDerWaalsContact C-N 3.3Å; L552-W554 PolarHBondContact O-N 2.82Å; L552-K555 PolarHBondContact O-N 3.24Å; L552-Q556 VanDerWaalsContact O-CG 3.29Å; L552-Q556 WeakPolarHBondContact O-CG 3.38Å; L552-Q556 PolarHBondContact O-N 2.9Å
553	L	89.3	Confident	84.1	Confident	34 Å²	34	60.8 Å²	60.8	18%	0.178	31%	0.307	C	S	.	.	H	α-helix	trans	-63.1	-37.3	178.3	-68	176.4	0	0	0	111.6	V506 I508 I549 S550 A557	V506-L553 WeakPolarHBondContact O-CD2 3.35Å; I508-L553 HydrophobicContact CG2-CD1 3.86Å; I549-L553 HydrophobicContact CG2-CD1 3.81Å; I549-L553 HydrophobicContact CG2-CG 4.19Å; I549-L553 WeakPolarHBondContact O-CB 3.45Å; I549-L553 WeakPolarHBondContact O-CG 3.45Å; I549-L553 PolarHBondContact O-N 2.9Å; S550-L553 PolarHBondContact O-N 3.06Å; L553-A557 WeakPolarHBondContact O-CB 3.29Å; L553-A557 PolarHBondContact O-N 3.01Å
554	W	86.5	Confident	82	Confident	102 Å²	102	58.1 Å²	58.1	39%	0.386	30%	0.303	S	S	.	.	H	α-helix	trans	-67.1	-45.6	175.6	-174.3	-104.9	0	0	0	112.4	S550 Q551 L552 Q556 A557 I558	S550-W554 VanDerWaalsContact O-CB 3.28Å; S550-W554 WeakPolarHBondContact O-CB 3.29Å; S550-W554 PolarHBondContact O-N 2.71Å; Q551-W554 PolarHBondContact O-N 3.36Å; L552-W554 VanDerWaalsContact C-N 3.3Å; L552-W554 PolarHBondContact O-N 2.82Å; W554-Q556 VanDerWaalsContact C-N 3.28Å; W554-Q556 PolarHBondContact O-N 3.12Å; W554-A557 WeakPolarHBondContact O-CB 3.34Å; W554-A557 PolarHBondContact O-N 2.88Å; W554-A557 VanDerWaalsContact O-N 3.13Å; W554-I558 HydrophobicContact CG-CD1 4.45Å; W554-I558 VanDerWaalsContact NE1-CD1 3.27Å; W554-I558 PolarHBondContact O-N 3.41Å
555	K	85.3	Confident	79.7	Confident	127 Å²	127	62.9 Å²	62.9	55%	0.552	33%	0.326	S	S	*	.	H	α-helix	trans	-56.3	-44.9	175	-178.9	-177.5	176.2	-173.7	0	110.8	E474 Q551 L552 I558 F559	E474-K555 IonicContact OE1-NZ 2.69Å; Q551-K555 WeakPolarHBondContact O-CB 3.46Å; Q551-K555 PolarHBondContact O-N 2.76Å; L552-K555 PolarHBondContact O-N 3.24Å; K555-I558 PolarHBondContact O-N 2.9Å; K555-F559 WeakPolarHBondContact O-CB 3.41Å; K555-F559 PolarHBondContact O-N 3.01Å
556	Q	85.7	Confident	76.9	Confident	34 Å²	34	71.8 Å²	71.8	16%	0.159	37%	0.365	C	S	.	.	H	α-helix	trans	-64.8	-41.2	176	-70.9	172.6	-2.5	0	0	112.3	E474 T503 L552 W554 F559 N560	E474-Q556 PolarHBondContact O-NE2 2.92Å; E474-Q556 VanDerWaalsContact O-NE2 3.16Å; T503-Q556 PolarHBondContact OG1-NE2 3.11Å; L552-Q556 VanDerWaalsContact O-CG 3.29Å; L552-Q556 WeakPolarHBondContact O-CG 3.38Å; L552-Q556 PolarHBondContact O-N 2.9Å; W554-Q556 VanDerWaalsContact C-N 3.28Å; W554-Q556 PolarHBondContact O-N 3.12Å; Q556-F559 PolarHBondContact O-N 3.5Å; Q556-N560 WeakPolarHBondContact O-CB 3.34Å; Q556-N560 VanDerWaalsContact O-CG 3.22Å; Q556-N560 PolarHBondContact O-N 2.95Å; Q556-N560 PolarHBondContact O-ND2 3.06Å
557	A	82.2	Confident	73.9	Confident	39 Å²	39	77 Å²	77	32%	0.322	40%	0.4	S	S	.	.	H	α-helix	trans	-63.1	-41.9	177.1	0	0	0	0	0	112.3	L553 W554 R561	L553-A557 WeakPolarHBondContact O-CB 3.29Å; L553-A557 PolarHBondContact O-N 3.01Å; W554-A557 WeakPolarHBondContact O-CB 3.34Å; W554-A557 PolarHBondContact O-N 2.88Å; W554-A557 VanDerWaalsContact O-N 3.13Å; A557-R561 WeakPolarHBondContact O-CG 3.27Å; A557-R561 PolarHBondContact O-N 2.99Å; A557-R561 VanDerWaalsContact O-N 3.11Å
558	I	80.3	Confident	70.8	Confident	94 Å²	94	77.7 Å²	77.7	48%	0.482	41%	0.405	S	S	.	.	H	α-helix	trans	-62.3	-47.1	174.1	-68.7	170.6	0	0	0	110.5	W554 K555 N560 R561 G562	W554-I558 HydrophobicContact CG-CD1 4.45Å; W554-I558 VanDerWaalsContact NE1-CD1 3.27Å; W554-I558 PolarHBondContact O-N 3.41Å; K555-I558 PolarHBondContact O-N 2.9Å; I558-N560 VanDerWaalsContact C-N 3.33Å; I558-N560 PolarHBondContact O-N 3.48Å; I558-R561 WeakPolarHBondContact O-CB 3.44Å; I558-R561 PolarHBondContact O-N 3.22Å; I558-R561 VanDerWaalsContact O-N 3.16Å; I558-G562 PolarHBondContact O-N 3.39Å
559	F	78.6	Confident	67.7	Low	131 Å²	131	84.6 Å²	84.6	58%	0.575	44%	0.438	S	S	*	.	H	α-helix	trans	-60.6	-42.8	-179.9	-175.8	-102.7	0	0	0	112.1	K555 Q556 R561 G562 N563	K555-F559 WeakPolarHBondContact O-CB 3.41Å; K555-F559 PolarHBondContact O-N 3.01Å; Q556-F559 PolarHBondContact O-N 3.5Å; F559-R561 VanDerWaalsContact C-N 3.31Å; F559-R561 PolarHBondContact O-N 2.9Å; F559-G562 PolarHBondContact O-N 3.49Å; F559-N563 WeakPolarHBondContact CE1-ND2 3.48Å; F559-N563 WeakPolarHBondContact CZ-ND2 3.44Å; F559-N563 PolarHBondContact O-N 3.14Å
560	N	75.5	Confident	64.4	Low	102 Å²	102	90.1 Å²	90.1	55%	0.545	48%	0.475	S	S	.	.	H	α-helix	trans	-65.2	-33.6	177.1	-69.6	-17.3	0	0	0	112.4	Q556 I558 A564	Q556-N560 WeakPolarHBondContact O-CB 3.34Å; Q556-N560 VanDerWaalsContact O-CG 3.22Å; Q556-N560 PolarHBondContact O-N 2.95Å; Q556-N560 PolarHBondContact O-ND2 3.06Å; I558-N560 VanDerWaalsContact C-N 3.33Å; I558-N560 PolarHBondContact O-N 3.48Å; N560-A564 VanDerWaalsContact O-CB 3.25Å; N560-A564 WeakPolarHBondContact O-CB 3.49Å; N560-A564 PolarHBondContact O-N 2.93Å
561	R	65.1	Low	61.4	Low	106 Å²	106	95.2 Å²	95.2	40%	0.4	50%	0.499	S	S	.	.	H	α-helix	trans	-68.8	-44.5	171.7	-70.7	174.8	-177.4	-173.2	1.6	112.2	A557 I558 F559 N563 A564 N565	A557-R561 WeakPolarHBondContact O-CG 3.27Å; A557-R561 PolarHBondContact O-N 2.99Å; A557-R561 VanDerWaalsContact O-N 3.11Å; I558-R561 WeakPolarHBondContact O-CB 3.44Å; I558-R561 PolarHBondContact O-N 3.22Å; I558-R561 VanDerWaalsContact O-N 3.16Å; F559-R561 VanDerWaalsContact C-N 3.31Å; F559-R561 PolarHBondContact O-N 2.9Å; R561-N563 VanDerWaalsContact C-N 3.29Å; R561-N563 PolarHBondContact O-N 2.87Å; R561-A564 PolarHBondContact O-N 3.34Å; R561-N565 PolarHBondContact O-N 2.85Å; R561-N565 VanDerWaalsContact O-N 3.16Å
562	G	56.9	Low	58.9	Low	43 Å²	43	96.7 Å²	96.7	44%	0.443	51%	0.51	S	S	.	.	H	α-helix	trans	-61.2	-36.9	177.7	0	0	0	0	0	112.8	I558 F559	I558-G562 PolarHBondContact O-N 3.39Å; F559-G562 PolarHBondContact O-N 3.49Å
563	N	52.2	Low	56	Low	76 Å²	76	99.7 Å²	99.7	41%	0.406	54%	0.544	S	S	.	.	H	α-helix	trans	-76.7	-34.7	173.5	-75.5	-14.8	0	0	0	113.1	F559 R561 N565 K566	F559-N563 WeakPolarHBondContact CE1-ND2 3.48Å; F559-N563 WeakPolarHBondContact CZ-ND2 3.44Å; F559-N563 PolarHBondContact O-N 3.14Å; R561-N563 VanDerWaalsContact C-N 3.29Å; R561-N563 PolarHBondContact O-N 2.87Å; N563-N565 PolarHBondContact O-N 3.03Å; N563-K566 WeakPolarHBondContact O-CB 3.42Å; N563-K566 PolarHBondContact O-N 3.37Å
564	A	50.3	Low	53	Low	48 Å²	48	105.8 Å²	105.8	40%	0.397	57%	0.571	S	S	.	*	H	α-helix	trans	-62.6	-26.2	175.7	0	0	0	0	0	112.7	N560 R561 K566 C567 L568	N560-A564 VanDerWaalsContact O-CB 3.25Å; N560-A564 WeakPolarHBondContact O-CB 3.49Å; N560-A564 PolarHBondContact O-N 2.93Å; R561-A564 PolarHBondContact O-N 3.34Å; A564-K566 PolarHBondContact O-N 3.06Å; A564-C567 PolarHBondContact O-N 2.82Å; A564-L568 PolarHBondContact O-N 3.08Å
565	N	43.7	Very low	50.2	Low	116 Å²	116	110.7 Å²	110.7	62%	0.62	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-17.5	171.2	-74.1	-14.4	0	0	0	113.9	R561 N563 L568	R561-N565 PolarHBondContact O-N 2.85Å; R561-N565 VanDerWaalsContact O-N 3.16Å; N563-N565 PolarHBondContact O-N 3.03Å; N565-L568 VanDerWaalsContact OD1-CD1 3.25Å; N565-L568 WeakPolarHBondContact OD1-CD1 3.42Å
566	K	37.4	Very low	47.4	Very low	187 Å²	187	108.8 Å²	108.8	81%	0.813	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-13.3	169.9	-69.3	-172.4	178.1	179.8	0	113.8	N563 A564	N563-K566 WeakPolarHBondContact O-CB 3.42Å; N563-K566 PolarHBondContact O-N 3.37Å; A564-K566 PolarHBondContact O-N 3.06Å
567	C	31.7	Very low	44.7	Very low	112 Å²	112	114 Å²	114	76%	0.757	63%	0.628	S	S	*	*	S	Bend	trans	-110.8	6.3	178.7	-71.8	0	0	0	0	113.8	A564 M569	A564-C567 PolarHBondContact O-N 2.82Å; C567-M569 VanDerWaalsContact C-N 3.3Å; C567-M569 PolarHBondContact O-N 2.92Å
568	L	28.6	Very low	42.1	Very low	97 Å²	97	122.2 Å²	122.2	51%	0.508	66%	0.656	S	S	.	*			trans	-75.7	82.6	175.6	-96.8	150.5	0	0	0	110	A564 N565 Y575	A564-L568 PolarHBondContact O-N 3.08Å; N565-L568 VanDerWaalsContact OD1-CD1 3.25Å; N565-L568 WeakPolarHBondContact OD1-CD1 3.42Å; L568-Y575 HydrophobicContact CD2-CD1 4.06Å; L568-Y575 HydrophobicContact CD2-CE1 4.38Å
569	M	25.5	Very low	39.8	Very low	164 Å²	164	125.2 Å²	125.2	81%	0.808	67%	0.666	S	S	*	*			trans	-74.7	133.8	161.2	-68.7	-147.3	-119.2	0	0	109.5	C567 L571	C567-M569 VanDerWaalsContact C-N 3.3Å; C567-M569 PolarHBondContact O-N 2.92Å; M569-L571 PolarHBondContact O-N 3.12Å; M569-L571 VanDerWaalsContact O-N 3.12Å
570	P	26.5	Very low	37.8	Very low	120 Å²	120	124.9 Å²	124.9	78%	0.779	67%	0.67	S	S	*	*			trans	-72.2	106.3	-175.5	28.2	-33.5	0	0	0	110.5
571	L	29.1	Very low	35.9	Very low	140 Å²	140	126.1 Å²	126.1	73%	0.733	68%	0.677	S	S	*	*			trans	-100.2	106	165.8	-82.7	159.8	0	0	0	109	M569 G573	M569-L571 PolarHBondContact O-N 3.12Å; M569-L571 VanDerWaalsContact O-N 3.12Å; L571-G573 PolarHBondContact O-N 3.01Å
572	N	36.4	Very low	34.2	Very low	147 Å²	147	127.2 Å²	127.2	79%	0.786	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	46.7	51.8	158.4	-66.1	-16.8	0	0	0	117.4	H574	N572-H574 PolarHBondContact O-N 2.91Å; N572-H574 PolarHBondContact O-ND1 3.15Å
573	G	28.5	Very low	32.9	Very low	75 Å²	75	132.2 Å²	132.2	77%	0.773	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	69.7	5.8	159.5	0	0	0	0	0	116.4	L571	L571-G573 PolarHBondContact O-N 3.01Å
574	H	26.7	Very low	31.7	Very low	161 Å²	161	135.7 Å²	135.7	75%	0.745	73%	0.725	S	S	*	*			trans	-126.9	105.9	179.6	-65.7	81.3	0	0	0	109.2	N572 A576	N572-H574 PolarHBondContact O-N 2.91Å; N572-H574 PolarHBondContact O-ND1 3.15Å; H574-A576 PolarHBondContact O-N 3.07Å
575	Y	27.5	Very low	30.5	Very low	205 Å²	205	141.5 Å²	141.5	80%	0.804	75%	0.747	S	S	*	*			trans	-72.1	81.2	167.5	-62	-81.1	0	0	0	108.5	L568	L568-Y575 HydrophobicContact CD2-CD1 4.06Å; L568-Y575 HydrophobicContact CD2-CE1 4.38Å
576	A	27.2	Very low	29.5	Very low	88 Å²	88	143.4 Å²	143.4	73%	0.727	76%	0.756	S	S	*	*			trans	-87.3	118.6	170.4	0	0	0	0	0	109	H574 K578	H574-A576 PolarHBondContact O-N 3.07Å; A576-K578 PolarHBondContact O-N 3.02Å
577	L	28.4	Very low	28.9	Very low	144 Å²	144	140 Å²	140	75%	0.754	75%	0.752	S	S	*	*			trans	-57.6	114.6	174.7	-71.4	154.8	0	0	0	109.7	F579	L577-F579 HydrophobicContact CB-CD2 4.08Å; L577-F579 HydrophobicContact CB-CE2 3.97Å; L577-F579 HydrophobicContact CD1-CE2 4.1Å; L577-F579 HydrophobicContact CD2-CE2 3.91Å; L577-F579 HydrophobicContact CD2-CZ 4.15Å; L577-F579 HydrophobicContact CG-CE2 4.21Å
578	K	28.2	Very low	28.7	Very low	210 Å²	210	142.3 Å²	142.3	91%	0.913	75%	0.752	S	S	*	*			trans	-98.5	100.7	162.9	-141.1	-179.8	-173.8	-178.1	0	106.4	A576	A576-K578 PolarHBondContact O-N 3.02Å
579	F	31.6	Very low	28.7	Very low	157 Å²	157	146.5 Å²	146.5	69%	0.689	77%	0.774	S	S	*	*			trans	-82.9	0	171.5	-83.7	-74.4	0	0	0	111.1	L577	L577-F579 HydrophobicContact CB-CD2 4.08Å; L577-F579 HydrophobicContact CB-CE2 3.97Å; L577-F579 HydrophobicContact CD1-CE2 4.1Å; L577-F579 HydrophobicContact CD2-CE2 3.91Å; L577-F579 HydrophobicContact CD2-CZ 4.15Å; L577-F579 HydrophobicContact CG-CE2 4.21Å

Retrieved 579 of 579 residues in 147.1 ms (Link to these results)

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