A0A3Q0KQY5_SCHMA Loading...

DUF4203 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KQY5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 886 aa.

						>A0A3Q0KQY5_SCHMA|A0A3Q0KQY5
MGGMLWFQLAPYLLLTSVHIQECFAHTIITIEHGSFTNISVNGLLYVRVLKIPPGSKFIVYQVHSPFNPLLVSTSASFTYDTSQYSAHCGLAGFTENKTLSTFYVYSSYSVPLTVWVKAVAYGSEFPLPGGCGRSSRSDFINTAINTDIMTKNIDLSSPKRIEFLSYWTSALQFSAASIPVGPGGFACSHRITTSKPSGSLVYHIYGAPLITAGGSYGAFVNPSPNEVASVLKNMANFGHSSFVGAYIQSFHQSEFTPNDGFINIIVSRRPATAYIITVVVEYSVSGDTWQVPYTPVILYGCPAQIPTSFYRTVYNQPTLNASLEVNCGTLPKDAPVILFPVAILLLAGFLYATSCNMWIWPRCAVSAMIMGSVIGLIIFYRFSDEPNESYVILIASALLPAFFALFVFVILWWRYVRPTLYYQRMFGQGPLVKVENSTTVLVNEPWNSDVLDNSYQNVDAPFGSSSQTEHTPINNVSVLAPVSEEEASITALQLCNDIVYRPSSAHSGAYVSNEQGASNDNQDYTCVRICGIQLYRRFRSSQKSSKTLAPPLKPFTLRPRRFARLLPVLPTVFILIGYLSISLDRSLKLDKSSVSFFAFCIIMSGLLLGLLSVFKNFAFGISTALVGFYVTLCCTSFFLIPSCLLPHIVIEYFLMLTCFDIRLRTLRIQFYGQYDVIVVVIWFVSSICFGSLALCLIRLQDARELSEAQNYHTSHSKHSYTNTNAHTTSNSLLLLGEIRPDSQASCYVPRMFPVPSLSSNANSASSLHNLLSSPKIYSKIDSEGSVNYPVPVDHCHPSNPSSSRVSTEKQPLLQGSFYNKYGGLMSTGTGHPSLLPLSRVQLAAASQSLPFSSSSSVNTTGKSSQFDAEENEVKTNSSINSTQCK
					

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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	44.2	Very low	52.5	Low	230 Å²	230	118.9 Å²	118.9	100%	1.133	64%	0.635	S	S	*	*				0	-37	0	-93.5	172.7	149.1	0	0	114	G3	M1-G3 PolarHBondContact O-N 3.3Å
2	G	47.4	Very low	52.5	Low	62 Å²	62	123 Å²	123	64%	0.639	64%	0.637	S	S	*	*	H	α-helix	trans	-65	-27.4	-178.1	0	0	0	0	0	117
3	G	45.7	Very low	52.6	Low	54 Å²	54	122 Å²	122	56%	0.557	63%	0.632	S	S	*	*	H	α-helix	trans	-73.3	-28.9	-177.9	0	0	0	0	0	115.3	M1	M1-G3 PolarHBondContact O-N 3.3Å
4	M	49.4	Very low	52.6	Low	152 Å²	152	121.4 Å²	121.4	75%	0.749	63%	0.63	S	S	*	*	H	α-helix	trans	-75.1	-29.5	179.9	-91	171.6	83.6	0	0	112.7	W6 Q8	M4-W6 VanDerWaalsContact C-N 3.34Å; M4-W6 PolarHBondContact O-N 3.5Å; M4-Q8 PolarHBondContact O-N 3.3Å
5	L	52	Low	52.4	Low	111 Å²	111	120.4 Å²	120.4	58%	0.581	63%	0.625	S	S	*	*	H	α-helix	trans	-68.6	-36.1	-179.1	-144.1	94.8	0	0	0	111.6	Q8 L9	L5-Q8 PolarHBondContact O-N 3.49Å; L5-L9 HydrophobicContact CD2-CD1 3.78Å; L5-L9 HydrophobicContact CG-CD1 4.09Å; L5-L9 WeakPolarHBondContact O-CB 3.5Å; L5-L9 PolarHBondContact O-N 3.42Å
6	W	52.8	Low	52.2	Low	197 Å²	197	117.1 Å²	117.1	75%	0.746	61%	0.612	S	S	*	*	H	α-helix	trans	-69.4	-38.4	-178.3	-118.6	84.9	0	0	0	112.7	M4 Q8 L9 A10	M4-W6 VanDerWaalsContact C-N 3.34Å; M4-W6 PolarHBondContact O-N 3.5Å; W6-Q8 VanDerWaalsContact C-N 3.32Å; W6-Q8 PolarHBondContact O-N 3.28Å; W6-L9 PolarHBondContact O-N 2.9Å; W6-A10 VanDerWaalsContact O-CB 3.31Å; W6-A10 WeakPolarHBondContact O-CB 3.24Å; W6-A10 PolarHBondContact O-N 3.18Å
7	F	61.2	Low	51.9	Low	179 Å²	179	113.3 Å²	113.3	79%	0.785	60%	0.597	S	S	*	*	H	α-helix	trans	-70.1	-27.4	176.4	-90.5	-79.5	0	0	0	113.4	P11	F7-P11 WeakPolarHBondContact O-CD 3.46Å
8	Q	59.8	Low	51.5	Low	138 Å²	138	110.8 Å²	110.8	65%	0.645	59%	0.587	S	S	*	*	H	α-helix	trans	-79.8	-35.3	172.7	-79.1	-176.5	-26.7	0	0	112.5	M4 L5 W6 P11 Y12	M4-Q8 PolarHBondContact O-N 3.3Å; L5-Q8 PolarHBondContact O-N 3.49Å; W6-Q8 VanDerWaalsContact C-N 3.32Å; W6-Q8 PolarHBondContact O-N 3.28Å; Q8-P11 WeakPolarHBondContact O-CD 3.39Å; Q8-P11 WeakPolarHBondContact O-CG 3.08Å; Q8-Y12 WeakPolarHBondContact O-CD2 3.43Å
9	L	54.7	Low	50.9	Low	87 Å²	87	111 Å²	111	46%	0.455	58%	0.584	S	S	.	*	H	α-helix	trans	-79.3	-33.2	-179.1	-89	153.6	0	0	0	113.9	L5 W6 Y12 L13	L5-L9 HydrophobicContact CD2-CD1 3.78Å; L5-L9 HydrophobicContact CG-CD1 4.09Å; L5-L9 WeakPolarHBondContact O-CB 3.5Å; L5-L9 PolarHBondContact O-N 3.42Å; W6-L9 PolarHBondContact O-N 2.9Å; L9-Y12 PolarHBondContact O-N 3.12Å; L9-Y12 VanDerWaalsContact O-N 3.11Å; L9-L13 PolarHBondContact O-N 2.96Å
10	A	55.7	Low	50.6	Low	34 Å²	34	110.1 Å²	110.1	28%	0.281	58%	0.579	S	S	.	*	H	α-helix	trans	-55.4	-46.7	-178.9	0	0	0	0	0	114.2	W6 Y12 L13 L14	W6-A10 VanDerWaalsContact O-CB 3.31Å; W6-A10 WeakPolarHBondContact O-CB 3.24Å; W6-A10 PolarHBondContact O-N 3.18Å; A10-Y12 VanDerWaalsContact C-N 3.35Å; A10-Y12 PolarHBondContact O-N 3.33Å; A10-L13 PolarHBondContact O-N 2.85Å; A10-L14 WeakPolarHBondContact O-CB 3.41Å; A10-L14 PolarHBondContact O-N 3.23Å
11	P	55.1	Low	49.8	Very low	64 Å²	64	111.9 Å²	111.9	42%	0.416	58%	0.584	S	S	.	*	H	α-helix	trans	-67.5	-33.7	175.9	23.1	-30.9	0	0	0	112.5	F7 Q8 L14 L15	F7-P11 WeakPolarHBondContact O-CD 3.46Å; Q8-P11 WeakPolarHBondContact O-CD 3.39Å; Q8-P11 WeakPolarHBondContact O-CG 3.08Å; P11-L14 PolarHBondContact O-N 2.98Å; P11-L15 WeakPolarHBondContact O-CB 3.36Å; P11-L15 WeakPolarHBondContact O-CD1 3.29Å; P11-L15 PolarHBondContact O-N 2.92Å
12	Y	51.7	Low	49.5	Very low	168 Å²	168	107.2 Å²	107.2	66%	0.659	56%	0.56	S	S	*	*	H	α-helix	trans	-65.8	-40.8	173	-86.5	-85	0	0	0	111.8	Q8 L9 A10 L15 T16	Q8-Y12 WeakPolarHBondContact O-CD2 3.43Å; L9-Y12 PolarHBondContact O-N 3.12Å; L9-Y12 VanDerWaalsContact O-N 3.11Å; A10-Y12 VanDerWaalsContact C-N 3.35Å; A10-Y12 PolarHBondContact O-N 3.33Å; Y12-L15 PolarHBondContact O-N 3.17Å; Y12-T16 WeakPolarHBondContact O-CB 3.37Å; Y12-T16 WeakPolarHBondContact O-CG2 3.39Å; Y12-T16 PolarHBondContact O-N 3.18Å; Y12-T16 PolarHBondContact O-OG1 2.83Å; Y12-T16 VanDerWaalsContact O-OG1 3.11Å
13	L	54.3	Low	49.5	Very low	110 Å²	110	109.3 Å²	109.3	58%	0.576	56%	0.563	S	S	*	*	H	α-helix	trans	-64.1	-42.4	175	-92.1	159.9	0	0	0	111.6	L9 A10 T16 S17	L9-L13 PolarHBondContact O-N 2.96Å; A10-L13 PolarHBondContact O-N 2.85Å; L13-T16 WeakPolarHBondContact CA-OG1 3.49Å; L13-T16 PolarHBondContact O-N 3.31Å; L13-T16 PolarHBondContact O-OG1 3.48Å; L13-S17 WeakPolarHBondContact O-CB 3.47Å; L13-S17 PolarHBondContact O-N 3.26Å
14	L	53	Low	49.5	Very low	114 Å²	114	112.3 Å²	112.3	60%	0.597	56%	0.561	S	S	*	*	H	α-helix	trans	-67.1	-40.3	175.9	-111.9	138.9	0	0	0	112.5	A10 P11 S17 V18	A10-L14 WeakPolarHBondContact O-CB 3.41Å; A10-L14 PolarHBondContact O-N 3.23Å; P11-L14 PolarHBondContact O-N 2.98Å; L14-S17 PolarHBondContact O-N 3.35Å; L14-S17 PolarHBondContact O-OG 3Å; L14-V18 WeakPolarHBondContact O-CB 3.44Å; L14-V18 VanDerWaalsContact O-CG2 3.28Å; L14-V18 WeakPolarHBondContact O-CG2 3.44Å; L14-V18 PolarHBondContact O-N 3.19Å
15	L	49.4	Very low	49.4	Very low	106 Å²	106	108.6 Å²	108.6	56%	0.555	56%	0.555	S	S	*	*	H	α-helix	trans	-65.4	-40.2	173.2	-98.1	137.1	0	0	0	111.6	P11 Y12 H19	P11-L15 WeakPolarHBondContact O-CB 3.36Å; P11-L15 WeakPolarHBondContact O-CD1 3.29Å; P11-L15 PolarHBondContact O-N 2.92Å; Y12-L15 PolarHBondContact O-N 3.17Å; L15-H19 WeakPolarHBondContact O-CB 3.28Å; L15-H19 PolarHBondContact O-N 3.12Å
16	T	49.7	Very low	49.9	Very low	67 Å²	67	107.2 Å²	107.2	41%	0.411	55%	0.545	S	S	.	.	H	α-helix	trans	-68.2	-36.1	174.2	59.8	0	0	0	0	111.5	Y12 L13 H19 I20	Y12-T16 WeakPolarHBondContact O-CB 3.37Å; Y12-T16 WeakPolarHBondContact O-CG2 3.39Å; Y12-T16 PolarHBondContact O-N 3.18Å; Y12-T16 PolarHBondContact O-OG1 2.83Å; Y12-T16 VanDerWaalsContact O-OG1 3.11Å; L13-T16 WeakPolarHBondContact CA-OG1 3.49Å; L13-T16 PolarHBondContact O-N 3.31Å; L13-T16 PolarHBondContact O-OG1 3.48Å; T16-H19 PolarHBondContact O-N 2.97Å; T16-I20 WeakPolarHBondContact O-CB 3.46Å; T16-I20 VanDerWaalsContact O-CD1 3.3Å; T16-I20 WeakPolarHBondContact O-CD1 3.3Å; T16-I20 WeakPolarHBondContact O-CG1 3.25Å; T16-I20 PolarHBondContact O-N 2.78Å
17	S	47	Very low	50.8	Low	53 Å²	53	101.7 Å²	101.7	37%	0.371	53%	0.533	S	S	.	.	H	α-helix	trans	-70.5	-38.9	177.5	72.3	0	0	0	0	111.8	L13 L14 I20 Q21	L13-S17 WeakPolarHBondContact O-CB 3.47Å; L13-S17 PolarHBondContact O-N 3.26Å; L14-S17 PolarHBondContact O-N 3.35Å; L14-S17 PolarHBondContact O-OG 3Å; S17-I20 PolarHBondContact O-N 3.42Å; S17-Q21 WeakPolarHBondContact O-CB 3.12Å; S17-Q21 PolarHBondContact O-N 3.18Å
18	V	44.1	Very low	51.7	Low	69 Å²	69	97.8 Å²	97.8	42%	0.418	52%	0.519	S	S	.	.	H	α-helix	trans	-67.4	-43.4	174.8	174.2	0	0	0	0	110.4	L14 I20 Q21 E22	L14-V18 WeakPolarHBondContact O-CB 3.44Å; L14-V18 VanDerWaalsContact O-CG2 3.28Å; L14-V18 WeakPolarHBondContact O-CG2 3.44Å; L14-V18 PolarHBondContact O-N 3.19Å; V18-I20 PolarHBondContact O-N 3.14Å; V18-Q21 PolarHBondContact O-N 2.87Å; V18-E22 WeakPolarHBondContact O-CB 3.36Å; V18-E22 PolarHBondContact O-N 2.75Å
19	H	40	Very low	52.9	Low	114 Å²	114	93.3 Å²	93.3	53%	0.528	50%	0.499	S	S	.	.	H	α-helix	trans	-65.3	-36.9	173.9	-92.4	-40.9	0	0	0	113	L15 T16 C23	L15-H19 WeakPolarHBondContact O-CB 3.28Å; L15-H19 PolarHBondContact O-N 3.12Å; T16-H19 PolarHBondContact O-N 2.97Å; H19-C23 VanDerWaalsContact O-CB 3.25Å; H19-C23 WeakPolarHBondContact O-CB 3.38Å; H19-C23 PolarHBondContact O-N 3.29Å; H19-C23 PolarHBondContact O-SG 3.18Å
20	I	44	Very low	54.5	Low	92 Å²	92	93.2 Å²	93.2	47%	0.472	50%	0.503	S	S	.	.	H	α-helix	trans	-66.9	-41.5	174.4	-72.5	164.6	0	0	0	109.9	T16 S17 V18 C23 F24	T16-I20 WeakPolarHBondContact O-CB 3.46Å; T16-I20 VanDerWaalsContact O-CD1 3.3Å; T16-I20 WeakPolarHBondContact O-CD1 3.3Å; T16-I20 WeakPolarHBondContact O-CG1 3.25Å; T16-I20 PolarHBondContact O-N 2.78Å; S17-I20 PolarHBondContact O-N 3.42Å; V18-I20 PolarHBondContact O-N 3.14Å; I20-C23 WeakPolarHBondContact O-CB 3.37Å; I20-C23 PolarHBondContact O-N 2.94Å; I20-F24 HydrophobicContact CG2-CD2 3.65Å; I20-F24 HydrophobicContact CG2-CE2 3.67Å; I20-F24 WeakPolarHBondContact O-CD2 3.45Å; I20-F24 PolarHBondContact O-N 2.86Å
21	Q	35.6	Very low	56.1	Low	149 Å²	149	91.8 Å²	91.8	70%	0.696	49%	0.49	S	S	*	.	H	α-helix	trans	-71.1	-34.6	-179.2	-160.6	168.2	5.6	0	0	112.2	S17 V18 F24 A25	S17-Q21 WeakPolarHBondContact O-CB 3.12Å; S17-Q21 PolarHBondContact O-N 3.18Å; V18-Q21 PolarHBondContact O-N 2.87Å; Q21-F24 CarbonylContact O-C 3.59Å; Q21-F24 PolarHBondContact O-N 3.42Å; Q21-A25 PolarHBondContact O-N 2.86Å
22	E	37.2	Very low	57.7	Low	132 Å²	132	93.3 Å²	93.3	62%	0.617	49%	0.492	S	S	*	.	H	α-helix	trans	-70.1	-35.6	168.3	-75.9	-170.7	161.9	0	0	112.3	V18 F24 A25	V18-E22 WeakPolarHBondContact O-CB 3.36Å; V18-E22 PolarHBondContact O-N 2.75Å; E22-F24 PolarHBondContact O-N 2.88Å; E22-A25 PolarHBondContact O-N 3.39Å
23	C	47.5	Very low	59.4	Low	106 Å²	106	87.8 Å²	87.8	72%	0.716	47%	0.472	S	S	*	.	H	α-helix	trans	-63.8	-21.7	171.3	-77.9	0	0	0	0	112.9	H19 I20	H19-C23 VanDerWaalsContact O-CB 3.25Å; H19-C23 WeakPolarHBondContact O-CB 3.38Å; H19-C23 PolarHBondContact O-N 3.29Å; H19-C23 PolarHBondContact O-SG 3.18Å; I20-C23 WeakPolarHBondContact O-CB 3.37Å; I20-C23 PolarHBondContact O-N 2.94Å
24	F	45.1	Very low	60.9	Low	116 Å²	116	84 Å²	84	51%	0.509	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	28.9	177	-71.1	-61.7	0	0	0	112.9	I20 Q21 E22 H26	I20-F24 HydrophobicContact CG2-CD2 3.65Å; I20-F24 HydrophobicContact CG2-CE2 3.67Å; I20-F24 WeakPolarHBondContact O-CD2 3.45Å; I20-F24 PolarHBondContact O-N 2.86Å; Q21-F24 CarbonylContact O-C 3.59Å; Q21-F24 PolarHBondContact O-N 3.42Å; E22-F24 PolarHBondContact O-N 2.88Å; F24-H26 AromaticContact CD1-NE2 3.4Å; F24-H26 WeakPolarHBondContact CD1-NE2 3.31Å; F24-H26 AromaticContact CG-NE2 3.94Å; F24-H26 PolarHBondContact O-CE1 3.31Å; F24-H26 VanDerWaalsContact O-CE1 3.3Å; F24-H26 VanDerWaalsContact O-CG 3.31Å; F24-H26 PolarHBondContact O-N 3.1Å; F24-H26 PolarHBondContact O-ND1 2.94Å
25	A	47.8	Very low	62.5	Low	74 Å²	74	80.1 Å²	80.1	61%	0.612	44%	0.442	S	S	*	.			trans	-65.4	79.1	162.6	0	0	0	0	0	109.3	Q21 E22 T27	Q21-A25 PolarHBondContact O-N 2.86Å; E22-A25 PolarHBondContact O-N 3.39Å; A25-T27 PolarHBondContact O-N 2.82Å
26	H	62.1	Low	64.4	Low	82 Å²	82	76.4 Å²	76.4	38%	0.38	42%	0.421	S	S	.	.			trans	-63.5	108.8	-177.1	-59.1	114.6	0	0	0	109.2	F24 I28 Y46	F24-H26 AromaticContact CD1-NE2 3.4Å; F24-H26 WeakPolarHBondContact CD1-NE2 3.31Å; F24-H26 AromaticContact CG-NE2 3.94Å; F24-H26 PolarHBondContact O-CE1 3.31Å; F24-H26 VanDerWaalsContact O-CE1 3.3Å; F24-H26 VanDerWaalsContact O-CG 3.31Å; F24-H26 PolarHBondContact O-N 3.1Å; F24-H26 PolarHBondContact O-ND1 2.94Å; H26-I28 PolarHBondContact O-N 2.88Å; H26-Y46 HydrophobicContact CB-CD2 3.73Å; H26-Y46 HydrophobicContact CB-CE2 3.61Å; H26-Y46 HydrophobicContact CB-CG 4.45Å; H26-Y46 AromaticContact CD2-CE2 3.08Å; H26-Y46 WeakPolarHBondContact CD2-CE2 3.48Å; H26-Y46 AromaticContact CD2-CZ 3.18Å; H26-Y46 PolarHBondContact CD2-OH 3.04Å; H26-Y46 AromaticContact CG-CE2 3.55Å; H26-Y46 AromaticContact CG-CZ 3.66Å; H26-Y46 AromaticContact NE2-CZ 3.75Å; H26-Y46 PolarHBondContact NE2-OH 3.15Å; H26-Y46 VanDerWaalsContact NE2-OH 3.07Å
27	T	73	Confident	66.3	Low	82 Å²	82	75 Å²	75	50%	0.503	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	117.8	174.8	-51.4	0	0	0	0	107.3	A25 L45 Y46	A25-T27 PolarHBondContact O-N 2.82Å; T27-L45 HydrophobicContact CG2-CD1 3.81Å; T27-L45 VanDerWaalsContact O-CD1 3.24Å; T27-L45 WeakPolarHBondContact O-CD1 3.22Å; T27-Y46 PolarHBondContact O-N 3.08Å
28	I	79.7	Confident	68.4	Low	96 Å²	96	77.8 Å²	77.8	49%	0.492	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.6	178.4	-57.8	172.2	0	0	0	107.9	H26 Y46	H26-I28 PolarHBondContact O-N 2.88Å; I28-Y46 WeakPolarHBondContact CA-O 3.33Å
29	I	85.3	Confident	70.5	Confident	44 Å²	44	75 Å²	75	23%	0.226	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	139.1	173.1	-68	176.1	0	0	0	108.8	I31 I39 L45 Y46 V47 R48	I29-I31 HydrophobicContact CG2-CG2 4.43Å; I29-I39 HydrophobicContact CD1-CB 4.19Å; I29-I39 HydrophobicContact CD1-CG2 4.36Å; I29-I39 HydrophobicContact CG2-CG2 3.84Å; I29-L45 HydrophobicContact CB-CD1 4.42Å; I29-L45 HydrophobicContact CD1-CD1 3.57Å; I29-L45 HydrophobicContact CD1-CD2 3.82Å; I29-L45 HydrophobicContact CD1-CG 4.28Å; I29-L45 HydrophobicContact CG1-CD1 3.82Å; I29-Y46 PolarHBondContact N-O 3.47Å; I29-V47 WeakPolarHBondContact O-CA 3.42Å; I29-R48 PolarHBondContact O-N 2.9Å
30	T	87.2	Confident	72.7	Confident	85 Å²	85	73 Å²	73	52%	0.521	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	138	176.4	53.6	0	0	0	0	110	R48 L50	T30-R48 CarbonylContact C-O 3.55Å; T30-R48 VanDerWaalsContact CA-O 3.31Å; T30-R48 WeakPolarHBondContact CA-O 3.48Å; T30-R48 HydrophobicContact CG2-CB 4.19Å; T30-L50 HydrophobicContact CG2-CD1 4.03Å
31	I	90.2	Very high	74.6	Confident	5 Å²	5	68.6 Å²	68.6	3%	0.026	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	150.2	174.8	66.5	171.7	0	0	0	109.8	I29 T37 V47 R48 V49 L50 F103 V117 A119	I29-I31 HydrophobicContact CG2-CG2 4.43Å; I31-T37 WeakPolarHBondContact CG2-OG1 3.31Å; I31-V47 HydrophobicContact CD1-CG1 3.73Å; I31-V47 HydrophobicContact CG1-CG1 3.84Å; I31-V47 HydrophobicContact CG2-CG1 3.99Å; I31-R48 PolarHBondContact N-O 3.36Å; I31-V49 HydrophobicContact CD1-CG2 4.02Å; I31-V49 HydrophobicContact CG1-CB 4.39Å; I31-V49 HydrophobicContact CG1-CG1 4.44Å; I31-V49 HydrophobicContact CG1-CG2 3.97Å; I31-V49 WeakPolarHBondContact O-CA 3.35Å; I31-L50 PolarHBondContact O-N 3Å; I31-F103 HydrophobicContact CD1-CE1 4.35Å; I31-V117 HydrophobicContact CD1-CG1 3.52Å; I31-A119 HydrophobicContact CD1-CB 4.21Å
32	E	88.1	Confident	76.9	Confident	96 Å²	96	66.6 Å²	66.6	45%	0.449	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	142	175	-59.5	-162.9	149	0	0	111	G34 S35 K51	E32-G34 PolarHBondContact O-N 2.75Å; E32-S35 PolarHBondContact N-OG 2.92Å; E32-S35 WeakPolarHBondContact O-CB 3.45Å; E32-S35 PolarHBondContact O-N 3.02Å; E32-S35 VanDerWaalsContact O-N 3.16Å; E32-S35 PolarHBondContact O-OG 3.37Å; E32-K51 WeakPolarHBondContact OE1-CE 3.31Å; E32-K51 IonicContact OE1-NZ 2.68Å; E32-K51 PolarHBondContact OE1-NZ 2.99Å; E32-K51 IonicContact OE2-NZ 3.78Å
33	H	88.1	Confident	79	Confident	51 Å²	51	61.2 Å²	61.2	24%	0.236	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50	133.8	170.4	167.7	-93.2	0	0	0	111.8	S35 V49 L50 K51 A121	H33-S35 PolarHBondContact O-N 3.48Å; H33-S35 VanDerWaalsContact O-N 3.16Å; H33-V49 HydrophobicContact CB-CG1 4.44Å; H33-L50 WeakPolarHBondContact CB-O 3.49Å; H33-L50 PolarHBondContact N-O 2.88Å; H33-K51 WeakPolarHBondContact CB-O 3.47Å; H33-A121 PolarHBondContact CD2-N 3.25Å; H33-A121 VanDerWaalsContact CD2-N 3.34Å; H33-A121 PolarHBondContact NE2-N 3Å
34	G	85.3	Confident	80.8	Confident	31 Å²	31	58.5 Å²	58.5	32%	0.32	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	-14.9	179	0	0	0	0	0	115.2	E32 K118 A119	E32-G34 PolarHBondContact O-N 2.75Å; G34-K118 WeakPolarHBondContact O-CE 3.46Å; G34-A119 PolarHBondContact N-O 3.44Å
35	S	87.1	Confident	82.7	Confident	32 Å²	32	53.2 Å²	53.2	22%	0.224	31%	0.312	C	S	.	.			trans	-77.8	140.1	179.2	72.4	0	0	0	0	111.8	E32 H33 T37	E32-S35 PolarHBondContact N-OG 2.92Å; E32-S35 WeakPolarHBondContact O-CB 3.45Å; E32-S35 PolarHBondContact O-N 3.02Å; E32-S35 VanDerWaalsContact O-N 3.16Å; E32-S35 PolarHBondContact O-OG 3.37Å; H33-S35 PolarHBondContact O-N 3.48Å; H33-S35 VanDerWaalsContact O-N 3.16Å; S35-T37 WeakPolarHBondContact OG-CG2 3.41Å
36	F	88.2	Confident	84.6	Confident	28 Å²	28	52.2 Å²	52.2	12%	0.123	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	101.4	172.4	-167.9	-87.8	0	0	0	108	H64 W116 V117 K118 L232 K233 A236	F36-H64 AromaticContact CE2-CD2 3.96Å; F36-W116 HydrophobicContact CD1-CB 4.36Å; F36-W116 HydrophobicContact CE1-CB 3.49Å; F36-W116 VanDerWaalsContact CE1-CB 3.49Å; F36-W116 AromaticContact CE1-CD1 3.53Å; F36-W116 AromaticContact CE1-CG 3.7Å; F36-W116 HydrophobicContact CE1-CG 3.7Å; F36-W116 HydrophobicContact CE2-CB 4.41Å; F36-W116 HydrophobicContact CZ-CB 3.51Å; F36-W116 HydrophobicContact CZ-CG 4.13Å; F36-V117 WeakPolarHBondContact CA-O 3.28Å; F36-K118 HydrophobicContact CD2-CB 3.81Å; F36-K118 HydrophobicContact CD2-CD 4.14Å; F36-K118 HydrophobicContact CD2-CG 4.48Å; F36-L232 HydrophobicContact CZ-CB 4.26Å; F36-K233 HydrophobicContact CB-CD 4.34Å; F36-K233 HydrophobicContact CB-CG 3.95Å; F36-K233 HydrophobicContact CD1-CB 3.7Å; F36-K233 HydrophobicContact CD1-CD 4.12Å; F36-K233 HydrophobicContact CD1-CG 3.88Å; F36-K233 HydrophobicContact CD2-CB 4.38Å; F36-K233 HydrophobicContact CE1-CB 3.83Å; F36-K233 HydrophobicContact CG-CB 3.99Å; F36-K233 HydrophobicContact CG-CD 4.45Å; F36-K233 HydrophobicContact CG-CG 3.9Å; F36-K233 HydrophobicContact CZ-CB 4.26Å; F36-A236 HydrophobicContact CD2-CB 4.32Å; F36-A236 HydrophobicContact CE2-CB 4.33Å
37	T	89.6	Confident	85.8	Confident	38 Å²	38	48.3 Å²	48.3	23%	0.233	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	151	-171.4	55.1	0	0	0	0	111.2	I31 S35 W116 V117	I31-T37 WeakPolarHBondContact CG2-OG1 3.31Å; S35-T37 WeakPolarHBondContact OG-CG2 3.41Å; T37-W116 CarbonylContact O-C 3.56Å; T37-W116 WeakPolarHBondContact O-CA 3.18Å; T37-V117 PolarHBondContact N-O 3.28Å; T37-V117 PolarHBondContact O-N 2.79Å
38	N	90.3	Very high	86.6	Confident	112 Å²	112	49.3 Å²	49.3	60%	0.599	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	137.8	170.7	59.1	-26.4	0	0	0	110.1	T114 V115	N38-T114 HydrophobicContact CB-CG2 4.21Å; N38-V115 CarbonylContact C-O 3.5Å; N38-V115 WeakPolarHBondContact CA-O 3.45Å
39	I	89	Confident	87.1	Confident	10 Å²	10	44.8 Å²	44.8	5%	0.051	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	146.2	178.1	63	-178.6	0	0	0	108.7	I29 V41 L45 V47 V115 V117	I29-I39 HydrophobicContact CD1-CB 4.19Å; I29-I39 HydrophobicContact CD1-CG2 4.36Å; I29-I39 HydrophobicContact CG2-CG2 3.84Å; I39-V41 HydrophobicContact CD1-CG2 4.18Å; I39-V41 HydrophobicContact CG1-CG2 4.05Å; I39-L45 HydrophobicContact CB-CD2 4.41Å; I39-L45 HydrophobicContact CD1-CD2 3.64Å; I39-L45 HydrophobicContact CG1-CD2 4.27Å; I39-V47 HydrophobicContact CD1-CG2 4Å; I39-V115 HydrophobicContact CG1-CB 3.94Å; I39-V115 WeakPolarHBondContact CG1-O 3.41Å; I39-V115 PolarHBondContact N-O 2.89Å; I39-V115 PolarHBondContact O-N 3.13Å; I39-V117 HydrophobicContact CD1-CB 4.33Å; I39-V117 HydrophobicContact CD1-CG2 3.38Å; I39-V117 HydrophobicContact CG1-CG2 4.05Å
40	S	86.5	Confident	87.3	Confident	71 Å²	71	45.7 Å²	45.7	50%	0.497	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122.8	173.2	-175.4	0	0	0	0	108.8	P112 L113	S40-P112 WeakPolarHBondContact OG-CB 3.5Å; S40-L113 WeakPolarHBondContact CA-O 3.36Å
41	V	83.8	Confident	87.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	117.5	-177.5	-173.5	0	0	0	0	109.4	I39 L45 V105 P112 L113 V115	I39-V41 HydrophobicContact CD1-CG2 4.18Å; I39-V41 HydrophobicContact CG1-CG2 4.05Å; V41-L45 HydrophobicContact CG1-CB 4.32Å; V41-L45 HydrophobicContact CG2-CD2 3.87Å; V41-V105 HydrophobicContact CG1-CG1 4.15Å; V41-V105 HydrophobicContact CG2-CG1 4.15Å; V41-P112 WeakPolarHBondContact O-CA 3.19Å; V41-L113 PolarHBondContact N-O 2.92Å; V41-L113 PolarHBondContact O-N 2.88Å; V41-V115 HydrophobicContact CB-CG2 4.02Å; V41-V115 HydrophobicContact CG2-CB 3.94Å; V41-V115 HydrophobicContact CG2-CG2 3.47Å; V41-V115 VanDerWaalsContact CG2-CG2 3.47Å
42	N	82.7	Confident	87.2	Confident	107 Å²	107	48.5 Å²	48.5	57%	0.572	26%	0.256	S	S	*	.	S	Bend	trans	-130.2	97.5	172.5	-172.1	13	0	0	0	108.5	P112	N42-P112 HydrophobicContact CB-CB 4.19Å
43	G	82.4	Confident	87.1	Confident	20 Å²	20	46.5 Å²	46.5	21%	0.206	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80.4	-137.2	-170.3	0	0	0	0	0	113.3	Y106 S107	G43-Y106 WeakPolarHBondContact O-CA 3.44Å; G43-S107 WeakPolarHBondContact CA-O 3.12Å; G43-S107 PolarHBondContact N-O 3.21Å; G43-S107 PolarHBondContact O-N 3.44Å
44	L	84.3	Confident	86.8	Confident	49 Å²	49	50.3 Å²	50.3	26%	0.257	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	124.2	-175.2	-179.2	63.4	0	0	0	112.1	Y46 F78 Y106	L44-Y46 HydrophobicContact CD2-CE2 3.68Å; L44-Y46 WeakPolarHBondContact CD2-OH 3.4Å; L44-Y46 HydrophobicContact CG-CD2 4.47Å; L44-Y46 HydrophobicContact CG-CE2 3.7Å; L44-F78 HydrophobicContact CD1-CE2 3.37Å; L44-F78 HydrophobicContact CD1-CZ 3.42Å; L44-F78 VanDerWaalsContact CD1-CZ 3.42Å; L44-Y106 HydrophobicContact CB-CD2 4.13Å
45	L	86.5	Confident	86.7	Confident	5 Å²	5	51.1 Å²	51.1	3%	0.026	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	138.8	-178.8	-175.9	75.3	0	0	0	112.1	T27 I29 I39 V41 V47 V105	T27-L45 HydrophobicContact CG2-CD1 3.81Å; T27-L45 VanDerWaalsContact O-CD1 3.24Å; T27-L45 WeakPolarHBondContact O-CD1 3.22Å; I29-L45 HydrophobicContact CB-CD1 4.42Å; I29-L45 HydrophobicContact CD1-CD1 3.57Å; I29-L45 HydrophobicContact CD1-CD2 3.82Å; I29-L45 HydrophobicContact CD1-CG 4.28Å; I29-L45 HydrophobicContact CG1-CD1 3.82Å; I39-L45 HydrophobicContact CB-CD2 4.41Å; I39-L45 HydrophobicContact CD1-CD2 3.64Å; I39-L45 HydrophobicContact CG1-CD2 4.27Å; V41-L45 HydrophobicContact CG1-CB 4.32Å; V41-L45 HydrophobicContact CG2-CD2 3.87Å; L45-V47 HydrophobicContact CD2-CG2 3.96Å; L45-V47 HydrophobicContact CG-CG2 4.27Å; L45-V105 PolarHBondContact N-O 2.85Å; L45-V105 PolarHBondContact O-N 3.24Å
46	Y	86.1	Confident	86.7	Confident	52 Å²	52	49.9 Å²	49.9	20%	0.204	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	115.9	179.8	-67.1	-118	0	0	0	108.4	H26 T27 I28 I29 L44 Y104	H26-Y46 HydrophobicContact CB-CD2 3.73Å; H26-Y46 HydrophobicContact CB-CE2 3.61Å; H26-Y46 HydrophobicContact CB-CG 4.45Å; H26-Y46 AromaticContact CD2-CE2 3.08Å; H26-Y46 WeakPolarHBondContact CD2-CE2 3.48Å; H26-Y46 AromaticContact CD2-CZ 3.18Å; H26-Y46 PolarHBondContact CD2-OH 3.04Å; H26-Y46 AromaticContact CG-CE2 3.55Å; H26-Y46 AromaticContact CG-CZ 3.66Å; H26-Y46 AromaticContact NE2-CZ 3.75Å; H26-Y46 PolarHBondContact NE2-OH 3.15Å; H26-Y46 VanDerWaalsContact NE2-OH 3.07Å; T27-Y46 PolarHBondContact O-N 3.08Å; I28-Y46 WeakPolarHBondContact CA-O 3.33Å; I29-Y46 PolarHBondContact N-O 3.47Å; L44-Y46 HydrophobicContact CD2-CE2 3.68Å; L44-Y46 WeakPolarHBondContact CD2-OH 3.4Å; L44-Y46 HydrophobicContact CG-CD2 4.47Å; L44-Y46 HydrophobicContact CG-CE2 3.7Å; Y46-Y104 AromaticContact CD1-CD1 3.8Å; Y46-Y104 HydrophobicContact CD1-CD1 3.8Å; Y46-Y104 AromaticContact CD1-CE1 3.42Å; Y46-Y104 HydrophobicContact CD1-CE1 3.42Å; Y46-Y104 VanDerWaalsContact CD1-CE1 3.42Å; Y46-Y104 AromaticContact CE1-CD1 3.78Å; Y46-Y104 HydrophobicContact CE1-CD1 3.78Å; Y46-Y104 AromaticContact CE1-CE1 3.28Å; Y46-Y104 HydrophobicContact CE1-CE1 3.28Å; Y46-Y104 HydrophobicContact CE2-CD1 4.48Å; Y46-Y104 HydrophobicContact CG-CD1 4.25Å; Y46-Y104 HydrophobicContact CG-CE1 4.3Å; Y46-Y104 AromaticContact CZ-CE1 3.93Å
47	V	87.9	Confident	86.6	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	119.5	-179.2	-174.2	0	0	0	0	109.5	I29 I31 I39 L45 T102 F103 V105	I29-V47 WeakPolarHBondContact O-CA 3.42Å; I31-V47 HydrophobicContact CD1-CG1 3.73Å; I31-V47 HydrophobicContact CG1-CG1 3.84Å; I31-V47 HydrophobicContact CG2-CG1 3.99Å; I39-V47 HydrophobicContact CD1-CG2 4Å; L45-V47 HydrophobicContact CD2-CG2 3.96Å; L45-V47 HydrophobicContact CG-CG2 4.27Å; V47-T102 WeakPolarHBondContact O-CA 3.35Å; V47-F103 HydrophobicContact CB-CD1 4.05Å; V47-F103 HydrophobicContact CB-CE1 3.51Å; V47-F103 HydrophobicContact CB-CE2 4.08Å; V47-F103 HydrophobicContact CB-CZ 3.51Å; V47-F103 HydrophobicContact CG1-CD1 4.31Å; V47-F103 HydrophobicContact CG1-CE1 3.41Å; V47-F103 VanDerWaalsContact CG1-CE1 3.41Å; V47-F103 HydrophobicContact CG1-CZ 3.57Å; V47-F103 HydrophobicContact CG2-CE1 4.38Å; V47-F103 HydrophobicContact CG2-CE2 4.17Å; V47-F103 HydrophobicContact CG2-CZ 3.88Å; V47-F103 PolarHBondContact N-O 3.41Å; V47-F103 PolarHBondContact O-N 2.84Å; V47-F103 VanDerWaalsContact O-N 3.07Å; V47-V105 HydrophobicContact CG2-CG2 4.25Å
48	R	90	Very high	86.5	Confident	103 Å²	103	49.8 Å²	49.8	39%	0.389	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	119.4	-179.7	-179.2	-176.4	-68.7	-175.4	2.4	110	I29 T30 I31 L100 T102	I29-R48 PolarHBondContact O-N 2.9Å; T30-R48 CarbonylContact C-O 3.55Å; T30-R48 VanDerWaalsContact CA-O 3.31Å; T30-R48 WeakPolarHBondContact CA-O 3.48Å; T30-R48 HydrophobicContact CG2-CB 4.19Å; I31-R48 PolarHBondContact N-O 3.36Å; R48-L100 HydrophobicContact CG-CD1 3.58Å; R48-L100 HydrophobicContact CG-CD2 3.89Å; R48-L100 HydrophobicContact CG-CG 3.84Å; R48-T102 HydrophobicContact CB-CG2 4.16Å; R48-T102 HydrophobicContact CG-CG2 4.13Å
49	V	89.9	Confident	86.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	123.9	178.6	-169	0	0	0	0	109.9	I31 H33 I52 I59 Y61 L100 S101 F103 A119	I31-V49 HydrophobicContact CD1-CG2 4.02Å; I31-V49 HydrophobicContact CG1-CB 4.39Å; I31-V49 HydrophobicContact CG1-CG1 4.44Å; I31-V49 HydrophobicContact CG1-CG2 3.97Å; I31-V49 WeakPolarHBondContact O-CA 3.35Å; H33-V49 HydrophobicContact CB-CG1 4.44Å; V49-I52 HydrophobicContact CG1-CG1 4.28Å; V49-I59 HydrophobicContact CB-CD1 4.36Å; V49-I59 HydrophobicContact CG1-CD1 4Å; V49-I59 HydrophobicContact CG2-CD1 4.4Å; V49-Y61 HydrophobicContact CG2-CD1 4.44Å; V49-Y61 HydrophobicContact CG2-CE1 4.1Å; V49-L100 WeakPolarHBondContact O-CD1 3.32Å; V49-S101 PolarHBondContact N-O 3.21Å; V49-S101 PolarHBondContact O-N 2.92Å; V49-F103 HydrophobicContact CG2-CD1 4.42Å; V49-F103 HydrophobicContact CG2-CE1 4.28Å; V49-A119 HydrophobicContact CB-CB 4.46Å; V49-A119 HydrophobicContact CG1-CB 3.88Å; V49-A119 HydrophobicContact CG2-CB 3.71Å
50	L	89.9	Confident	86.7	Confident	64 Å²	64	44 Å²	44	34%	0.335	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	163.8	179.5	-64.4	169.2	0	0	0	111.6	T30 I31 H33 I52 L100	T30-L50 HydrophobicContact CG2-CD1 4.03Å; I31-L50 PolarHBondContact O-N 3Å; H33-L50 WeakPolarHBondContact CB-O 3.49Å; H33-L50 PolarHBondContact N-O 2.88Å; L50-I52 PolarHBondContact O-N 3.07Å; L50-L100 HydrophobicContact CD2-CD1 3.35Å; L50-L100 HydrophobicContact CG-CD1 4.35Å
51	K	87.6	Confident	87	Confident	143 Å²	143	41 Å²	41	62%	0.622	22%	0.223	S	C	*	.			trans	60.1	37.7	174.3	-59.3	176.6	175.3	170.3	0	114	E32 H33 P53	E32-K51 WeakPolarHBondContact OE1-CE 3.31Å; E32-K51 IonicContact OE1-NZ 2.68Å; E32-K51 PolarHBondContact OE1-NZ 2.99Å; E32-K51 IonicContact OE2-NZ 3.78Å; H33-K51 WeakPolarHBondContact CB-O 3.47Å; K51-P53 WeakPolarHBondContact O-CD 3.23Å
52	I	87.4	Confident	87.4	Confident	6 Å²	6	41 Å²	41	3%	0.031	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-65.6	127.4	174.3	-61.5	176.6	0	0	0	108.9	V49 L50 S56 I59 T95 T99 A121	V49-I52 HydrophobicContact CG1-CG1 4.28Å; L50-I52 PolarHBondContact O-N 3.07Å; I52-S56 WeakPolarHBondContact CG2-OG 3.03Å; I52-I59 HydrophobicContact CD1-CD1 4.05Å; I52-I59 HydrophobicContact CG1-CD1 4.39Å; I52-T95 HydrophobicContact CD1-CG2 4.46Å; I52-T99 PolarHBondContact N-O 3.11Å; I52-A121 HydrophobicContact CG2-CB 3.86Å
53	P	86.9	Confident	87.9	Confident	54 Å²	54	36 Å²	36	35%	0.351	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-57.6	138	178.9	-25.2	33.7	0	0	0	112.6	K51 S56	K51-P53 WeakPolarHBondContact O-CD 3.23Å; P53-S56 WeakPolarHBondContact O-CB 3.46Å; P53-S56 PolarHBondContact O-N 3.41Å; P53-S56 PolarHBondContact O-OG 3.49Å
54	P	82.1	Confident	88.3	Confident	131 Å²	131	35 Å²	35	85%	0.851	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	137.8	173.9	27.3	-33.1	0	0	0	110.2
55	G	81.7	Confident	88.4	Confident	47 Å²	47	32.8 Å²	32.8	49%	0.485	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.8	-6.6	-176.7	0	0	0	0	0	115.1
56	S	87.5	Confident	88	Confident	6 Å²	6	32.7 Å²	32.7	4%	0.042	18%	0.175	C	C	.	.			trans	-63.3	137.2	171	55.5	0	0	0	0	111.9	I52 P53 T95 Y122	I52-S56 WeakPolarHBondContact CG2-OG 3.03Å; P53-S56 WeakPolarHBondContact O-CB 3.46Å; P53-S56 PolarHBondContact O-N 3.41Å; P53-S56 PolarHBondContact O-OG 3.49Å; S56-T95 PolarHBondContact O-OG1 3.33Å; S56-Y122 CarbonylContact C-O 3.52Å; S56-Y122 WeakPolarHBondContact CA-O 3.19Å
57	K	85.9	Confident	87.3	Confident	64 Å²	64	31.2 Å²	31.2	28%	0.278	17%	0.17	S	C	.	.			trans	-102.5	-34.7	179.3	-71.7	-60	-172.7	178.9	0	113.4	F94 T95 Y122	K57-F94 WeakPolarHBondContact O-CA 3.47Å; K57-T95 PolarHBondContact O-N 3.24Å; K57-T95 PolarHBondContact O-OG1 2.89Å; K57-Y122 PolarHBondContact N-O 3.41Å
58	F	88.7	Confident	86.9	Confident	1 Å²	1	32.5 Å²	32.5	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	160.1	178.9	66.1	-88.7	0	0	0	110.7	V60 G93 F94 A121 Y122 G123 F126 L128 F186	F58-V60 HydrophobicContact CD2-CG2 4.16Å; F58-V60 HydrophobicContact CE2-CG2 4.04Å; F58-G93 CarbonylContact C-O 3.57Å; F58-G93 VanDerWaalsContact CA-O 3.3Å; F58-G93 WeakPolarHBondContact CA-O 3.45Å; F58-F94 HydrophobicContact CB-CD1 4.23Å; F58-A121 CarbonylContact O-C 3.59Å; F58-A121 WeakPolarHBondContact O-CA 3.27Å; F58-Y122 HydrophobicContact CD2-CD2 4.25Å; F58-Y122 AromaticContact CE2-CD2 3.66Å; F58-Y122 HydrophobicContact CE2-CD2 3.66Å; F58-Y122 AromaticContact CE2-CG 3.91Å; F58-Y122 HydrophobicContact CE2-CG 3.91Å; F58-Y122 VanDerWaalsContact CZ-CB 3.4Å; F58-Y122 HydrophobicContact CZ-CD2 4.23Å; F58-Y122 HydrophobicContact CZ-CG 4.01Å; F58-Y122 PolarHBondContact N-O 3.44Å; F58-Y122 PolarHBondContact O-N 3.36Å; F58-G123 WeakPolarHBondContact CE1-O 3.14Å; F58-F126 HydrophobicContact CE1-CB 4.28Å; F58-F126 HydrophobicContact CZ-CB 4.06Å; F58-L128 HydrophobicContact CB-CD1 4.21Å; F58-L128 HydrophobicContact CD1-CD1 4.16Å; F58-L128 HydrophobicContact CD2-CD1 3.49Å; F58-L128 VanDerWaalsContact CD2-CD1 3.49Å; F58-L128 HydrophobicContact CE1-CD1 4.38Å; F58-L128 HydrophobicContact CE2-CD1 3.75Å; F58-L128 HydrophobicContact CG-CD1 3.7Å; F58-L128 HydrophobicContact CZ-CB 4.45Å; F58-L128 HydrophobicContact CZ-CD1 4.17Å; F58-F186 HydrophobicContact CD1-CE1 4.32Å; F58-F186 HydrophobicContact CD1-CE2 4.46Å; F58-F186 AromaticContact CD1-CZ 3.7Å; F58-F186 HydrophobicContact CD1-CZ 3.7Å; F58-F186 HydrophobicContact CE1-CE1 4.06Å; F58-F186 AromaticContact CE1-CZ 3.85Å; F58-F186 HydrophobicContact CE1-CZ 3.85Å
59	I	90.3	Very high	86.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	134.6	178	-172.7	166.9	0	0	0	109.3	V49 I52 Y61 A92 G93 T95 A119 V120 A121	V49-I59 HydrophobicContact CB-CD1 4.36Å; V49-I59 HydrophobicContact CG1-CD1 4Å; V49-I59 HydrophobicContact CG2-CD1 4.4Å; I52-I59 HydrophobicContact CD1-CD1 4.05Å; I52-I59 HydrophobicContact CG1-CD1 4.39Å; I59-Y61 HydrophobicContact CD1-CE1 4Å; I59-Y61 HydrophobicContact CG1-CD1 4.46Å; I59-Y61 HydrophobicContact CG1-CE1 4.13Å; I59-Y61 HydrophobicContact CG2-CE1 3.79Å; I59-Y61 HydrophobicContact CG2-CE2 3.75Å; I59-Y61 WeakPolarHBondContact CG2-OH 3.46Å; I59-A92 WeakPolarHBondContact O-CA 3.49Å; I59-G93 PolarHBondContact N-O 2.96Å; I59-G93 PolarHBondContact O-N 3.28Å; I59-T95 HydrophobicContact CB-CG2 3.7Å; I59-T95 HydrophobicContact CG2-CG2 3.56Å; I59-A119 HydrophobicContact CD1-CB 3.9Å; I59-A119 HydrophobicContact CG1-CB 4.25Å; I59-V120 WeakPolarHBondContact CA-O 3.43Å; I59-A121 HydrophobicContact CB-CB 4.35Å; I59-A121 HydrophobicContact CG1-CB 4.32Å
60	V	92	Very high	86.3	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	117.3	174.9	-178.1	0	0	0	0	107.9	F58 Q62 L91 A92 A119 V120 Y122 P129 T143	F58-V60 HydrophobicContact CD2-CG2 4.16Å; F58-V60 HydrophobicContact CE2-CG2 4.04Å; V60-Q62 HydrophobicContact CG1-CG 4.37Å; V60-L91 CarbonylContact C-O 3.46Å; V60-L91 WeakPolarHBondContact CA-O 3.13Å; V60-A92 HydrophobicContact CG2-CB 4.27Å; V60-A119 WeakPolarHBondContact O-CA 3.39Å; V60-V120 PolarHBondContact N-O 2.95Å; V60-V120 PolarHBondContact O-N 3.32Å; V60-Y122 HydrophobicContact CB-CE2 4.24Å; V60-Y122 HydrophobicContact CG2-CD2 4.02Å; V60-Y122 HydrophobicContact CG2-CE2 3.84Å; V60-P129 HydrophobicContact CG2-CG 4.07Å; V60-T143 HydrophobicContact CG1-CG2 4.3Å
61	Y	92.7	Very high	86.1	Confident	6 Å²	6	28.3 Å²	28.3	2%	0.024	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	132.4	173.2	-45.7	-80.9	0	0	0	110	V49 I59 T74 G90 L91 S101 F103 A119	V49-Y61 HydrophobicContact CG2-CD1 4.44Å; V49-Y61 HydrophobicContact CG2-CE1 4.1Å; I59-Y61 HydrophobicContact CD1-CE1 4Å; I59-Y61 HydrophobicContact CG1-CD1 4.46Å; I59-Y61 HydrophobicContact CG1-CE1 4.13Å; I59-Y61 HydrophobicContact CG2-CE1 3.79Å; I59-Y61 HydrophobicContact CG2-CE2 3.75Å; I59-Y61 WeakPolarHBondContact CG2-OH 3.46Å; Y61-T74 HydrophobicContact CE2-CG2 4.24Å; Y61-G90 WeakPolarHBondContact O-CA 3.44Å; Y61-L91 HydrophobicContact CD2-CB 4.13Å; Y61-L91 PolarHBondContact N-O 3.12Å; Y61-L91 PolarHBondContact O-N 2.69Å; Y61-S101 PolarHBondContact OH-OG 2.73Å; Y61-F103 HydrophobicContact CD1-CB 4.47Å; Y61-F103 AromaticContact CD1-CD1 3.42Å; Y61-F103 HydrophobicContact CD1-CD1 3.42Å; Y61-F103 VanDerWaalsContact CD1-CD1 3.42Å; Y61-F103 AromaticContact CD1-CE1 3.84Å; Y61-F103 HydrophobicContact CD1-CE1 3.84Å; Y61-F103 HydrophobicContact CD1-CG 4.05Å; Y61-F103 HydrophobicContact CE1-CB 4.41Å; Y61-F103 AromaticContact CE1-CD1 3.68Å; Y61-F103 HydrophobicContact CE1-CD1 3.68Å; Y61-F103 HydrophobicContact CE1-CE1 4.41Å; Y61-F103 HydrophobicContact CE1-CG 4.35Å; Y61-F103 HydrophobicContact CG-CD1 4.1Å; Y61-F103 HydrophobicContact CG-CG 4.32Å; Y61-A119 HydrophobicContact CD1-CB 3.98Å
62	Q	93.5	Very high	86.1	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	126.9	177.1	-53.8	-177.6	0.5	0	0	107.7	V60 V117 K118 T295	V60-Q62 HydrophobicContact CG1-CG 4.37Å; Q62-V117 VanDerWaalsContact O-CA 3.32Å; Q62-V117 WeakPolarHBondContact O-CA 3.23Å; Q62-K118 HydrophobicContact CB-CB 4.35Å; Q62-K118 PolarHBondContact N-O 3.17Å; Q62-K118 PolarHBondContact O-N 3.38Å; Q62-T295 HydrophobicContact CB-CG2 4.12Å; Q62-T295 HydrophobicContact CG-CG2 4.2Å
63	V	92	Very high	86.1	Confident	3 Å²	3	21.2 Å²	21.2	2%	0.018	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	121.4	178.3	-176.6	0	0	0	0	107.8	L70 V72 C89 F103 V105 V115 V117	V63-L70 HydrophobicContact CG1-CD1 4.39Å; V63-V72 HydrophobicContact CB-CG2 3.95Å; V63-V72 HydrophobicContact CG1-CG2 3.91Å; V63-V72 HydrophobicContact CG2-CG1 3.89Å; V63-V72 HydrophobicContact CG2-CG2 4.05Å; V63-C89 HydrophobicContact CB-CB 4.32Å; V63-C89 PolarHBondContact N-O 3.23Å; V63-C89 PolarHBondContact O-N 3.41Å; V63-F103 HydrophobicContact CG2-CE2 3.68Å; V63-F103 HydrophobicContact CG2-CZ 4.22Å; V63-V105 HydrophobicContact CG2-CG2 4.46Å; V63-V115 HydrophobicContact CG1-CG1 3.41Å; V63-V115 VanDerWaalsContact CG1-CG1 3.41Å; V63-V117 HydrophobicContact CG1-CG2 4.18Å; V63-V117 HydrophobicContact CG2-CG2 4.18Å
64	H	91.3	Very high	86	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	123.8	-178.4	-54.3	-82.6	0	0	0	109.9	F36 H88 W116 L232 T295 P296	F36-H64 AromaticContact CE2-CD2 3.96Å; H64-H88 AromaticContact CG-ND1 3.93Å; H64-H88 AromaticContact ND1-CG 3.92Å; H64-H88 AromaticContact ND1-ND1 3.27Å; H64-H88 PolarHBondContact ND1-ND1 3.13Å; H64-W116 PolarHBondContact N-O 2.9Å; H64-W116 PolarHBondContact O-N 2.98Å; H64-L232 HydrophobicContact CB-CD1 3.97Å; H64-T295 VanDerWaalsContact CE1-CG2 3.41Å; H64-T295 WeakPolarHBondContact CE1-CG2 3.46Å; H64-P296 PolarHBondContact CE1-O 3.35Å
65	S	87.2	Confident	85.9	Confident	2 Å²	2	15.1 Å²	15.1	1%	0.014	9%	0.093	C	C	.	.			trans	-127.1	94	163.9	-172.9	0	0	0	0	107.3	F67 N68 A87	S65-F67 PolarHBondContact O-N 3.45Å; S65-N68 WeakPolarHBondContact CB-O 3.41Å; S65-N68 PolarHBondContact O-N 3.33Å; S65-N68 PolarHBondContact OG-O 3.41Å; S65-A87 PolarHBondContact N-O 3.23Å; S65-A87 WeakPolarHBondContact O-CB 3.47Å
66	P	76.5	Confident	85.6	Confident	3 Å²	3	15.6 Å²	15.6	2%	0.019	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	129.6	176.1	-25.2	35.2	0	0	0	110.3	N68 W116 V228 L232	P66-N68 PolarHBondContact O-N 3.15Å; P66-N68 VanDerWaalsContact O-N 3.15Å; P66-W116 VanDerWaalsContact CD-CZ3 3.4Å; P66-W116 HydrophobicContact CG-CE3 4.28Å; P66-W116 HydrophobicContact CG-CZ3 3.98Å; P66-V228 HydrophobicContact CB-CB 4.22Å; P66-V228 HydrophobicContact CB-CG1 3.99Å; P66-V228 HydrophobicContact CG-CB 4.06Å; P66-V228 HydrophobicContact CG-CG1 3.83Å; P66-L232 HydrophobicContact CG-CD1 4.39Å
67	F	73.3	Confident	85	Confident	21 Å²	21	19 Å²	19	9%	0.092	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.2	-14.3	176.9	-40.5	-69.8	0	0	0	117.6	S65 P225 V228 Y300	S65-F67 PolarHBondContact O-N 3.45Å; F67-P225 HydrophobicContact CD2-CG 4.34Å; F67-P225 HydrophobicContact CE2-CG 4.28Å; F67-V228 HydrophobicContact CE2-CG2 4.23Å; F67-V228 HydrophobicContact CZ-CG2 4.06Å; F67-Y300 WeakPolarHBondContact CD1-OH 3.3Å; F67-Y300 HydrophobicContact CE1-CE1 4.16Å
68	N	78.6	Confident	84.5	Confident	27 Å²	27	18.1 Å²	18.1	14%	0.144	11%	0.113	C	C	.	.	S	Bend	trans	-124.2	115.3	-177	-66	-45.8	0	0	0	111.5	S65 P66 Y109 L113	S65-N68 WeakPolarHBondContact CB-O 3.41Å; S65-N68 PolarHBondContact O-N 3.33Å; S65-N68 PolarHBondContact OG-O 3.41Å; P66-N68 PolarHBondContact O-N 3.15Å; P66-N68 VanDerWaalsContact O-N 3.15Å; N68-Y109 HydrophobicContact CB-CE2 4.31Å; N68-L113 HydrophobicContact CB-CD1 3.83Å; N68-L113 HydrophobicContact CB-CD2 4.44Å; N68-L113 WeakPolarHBondContact ND2-CD2 3.28Å
69	P	82.5	Confident	83.9	Confident	36 Å²	36	21 Å²	21	23%	0.234	13%	0.131	C	C	.	.			trans	-66.6	141	176.6	27.1	-37.5	0	0	0	113.1	Y85 Y109	P69-Y85 HydrophobicContact CB-CD1 4.45Å; P69-Y85 HydrophobicContact CB-CE1 3.84Å; P69-Y85 HydrophobicContact CB-CE2 3.99Å; P69-Y85 HydrophobicContact CG-CE1 4.16Å; P69-Y85 HydrophobicContact CG-CE2 4.45Å; P69-Y85 VanDerWaalsContact CG-OH 3.28Å; P69-Y85 WeakPolarHBondContact CG-OH 3.47Å; P69-Y109 VanDerWaalsContact CD-OH 3.25Å; P69-Y109 WeakPolarHBondContact CD-OH 3.42Å; P69-Y109 WeakPolarHBondContact O-CE2 3.46Å
70	L	84.4	Confident	82.9	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.01	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	156.7	178	-66	171.8	0	0	0	110.7	V63 Y85 S86 V105 L113 V115	V63-L70 HydrophobicContact CG1-CD1 4.39Å; L70-Y85 WeakPolarHBondContact O-CA 3.39Å; L70-S86 PolarHBondContact N-O 3.22Å; L70-S86 PolarHBondContact O-N 2.93Å; L70-S86 VanDerWaalsContact O-N 3.09Å; L70-V105 HydrophobicContact CD1-CG1 4.33Å; L70-L113 HydrophobicContact CD2-CD1 3.89Å; L70-V115 HydrophobicContact CD1-CB 4.21Å; L70-V115 HydrophobicContact CD1-CG1 3.66Å; L70-V115 HydrophobicContact CD1-CG2 3.44Å; L70-V115 VanDerWaalsContact CD1-CG2 3.44Å
71	L	85.4	Confident	81.9	Confident	41 Å²	41	34.4 Å²	34.4	22%	0.215	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	121.9	172.1	-172.8	69.8	0	0	0	109.4	F78 Q84 Y85 Y106	L71-F78 HydrophobicContact CD2-CB 4.07Å; L71-F78 HydrophobicContact CD2-CD1 3.42Å; L71-F78 VanDerWaalsContact CD2-CD1 3.42Å; L71-F78 HydrophobicContact CD2-CE1 4.08Å; L71-F78 HydrophobicContact CD2-CG 3.97Å; L71-F78 HydrophobicContact CG-CD1 3.61Å; L71-F78 HydrophobicContact CG-CE1 4.03Å; L71-Q84 WeakPolarHBondContact CA-O 3.4Å; L71-Y85 HydrophobicContact CB-CD2 4.23Å; L71-Y85 HydrophobicContact CD1-CD2 4.43Å; L71-Y106 HydrophobicContact CB-CD1 4.25Å; L71-Y106 HydrophobicContact CD2-CD1 4.27Å; L71-Y106 PolarHBondContact N-O 3.28Å; L71-Y106 VanDerWaalsContact N-O 3.09Å; L71-Y106 PolarHBondContact O-N 2.9Å
72	V	87.9	Confident	81.1	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	135.7	-179.3	-172.8	0	0	0	0	109.1	V63 S83 Q84 C89 L91 F103 Y104 V105	V63-V72 HydrophobicContact CB-CG2 3.95Å; V63-V72 HydrophobicContact CG1-CG2 3.91Å; V63-V72 HydrophobicContact CG2-CG1 3.89Å; V63-V72 HydrophobicContact CG2-CG2 4.05Å; V72-S83 CarbonylContact O-C 3.57Å; V72-S83 WeakPolarHBondContact O-CA 3.25Å; V72-S83 WeakPolarHBondContact O-CB 3.38Å; V72-Q84 PolarHBondContact N-O 2.89Å; V72-Q84 PolarHBondContact O-N 3.41Å; V72-C89 HydrophobicContact CB-CB 4.01Å; V72-C89 HydrophobicContact CG2-CB 3.73Å; V72-L91 HydrophobicContact CB-CD1 4.12Å; V72-L91 HydrophobicContact CG1-CD1 3.59Å; V72-L91 HydrophobicContact CG1-CG 4.5Å; V72-F103 HydrophobicContact CG1-CD2 3.88Å; V72-F103 HydrophobicContact CG1-CE2 4.23Å; V72-Y104 CarbonylContact C-O 3.53Å; V72-Y104 WeakPolarHBondContact CA-O 2.94Å; V72-V105 HydrophobicContact CG1-CG2 4.41Å; V72-V105 HydrophobicContact CG2-CG1 4.41Å; V72-V105 HydrophobicContact CG2-CG2 4.46Å
73	S	87.6	Confident	80.5	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	146.9	-177.6	-176.9	0	0	0	0	111.8	S75 F78 T82 Y104	S73-S75 VanDerWaalsContact C-N 3.34Å; S73-S75 VanDerWaalsContact CB-O 3.25Å; S73-S75 WeakPolarHBondContact CB-O 3.32Å; S73-S75 PolarHBondContact OG-N 3.41Å; S73-S75 VanDerWaalsContact OG-N 3.14Å; S73-S75 PolarHBondContact OG-O 2.84Å; S73-S75 PolarHBondContact OG-OG 3.23Å; S73-F78 VanDerWaalsContact CB-CD1 3.43Å; S73-T82 VanDerWaalsContact CA-O 3.29Å; S73-T82 WeakPolarHBondContact CA-O 3.37Å; S73-T82 PolarHBondContact OG-O 3.16Å; S73-T82 VanDerWaalsContact OG-O 3.08Å; S73-T82 PolarHBondContact OG-OG1 3.22Å; S73-Y104 PolarHBondContact N-O 2.95Å; S73-Y104 PolarHBondContact O-N 3.23Å
74	T	84.2	Confident	80.1	Confident	25 Å²	25	36.7 Å²	36.7	15%	0.153	20%	0.202	C	C	.	.	S	Bend	trans	-80.2	-19.7	169.1	55.9	0	0	0	0	112.1	Y61 T82 L91 Y104 D139 F140	Y61-T74 HydrophobicContact CE2-CG2 4.24Å; T74-T82 PolarHBondContact N-O 3.28Å; T74-L91 HydrophobicContact CG2-CB 4.35Å; T74-L91 HydrophobicContact CG2-CD1 4.23Å; T74-Y104 WeakPolarHBondContact O-CE2 3.1Å; T74-D139 PolarHBondContact OG1-O 3.38Å; T74-F140 HydrophobicContact CG2-CD2 4.34Å
75	S	81.5	Confident	79.6	Confident	31 Å²	31	43.1 Å²	43.1	22%	0.217	23%	0.227	C	C	.	.	S	Bend	trans	-115.2	155.4	177.9	74.8	0	0	0	0	112.2	S73 S77 T82 Y104	S73-S75 VanDerWaalsContact C-N 3.34Å; S73-S75 VanDerWaalsContact CB-O 3.25Å; S73-S75 WeakPolarHBondContact CB-O 3.32Å; S73-S75 PolarHBondContact OG-N 3.41Å; S73-S75 VanDerWaalsContact OG-N 3.14Å; S73-S75 PolarHBondContact OG-O 2.84Å; S73-S75 PolarHBondContact OG-OG 3.23Å; S75-S77 PolarHBondContact O-N 3.01Å; S75-S77 PolarHBondContact OG-OG 3.49Å; S75-T82 WeakPolarHBondContact OG-CB 3.23Å; S75-T82 PolarHBondContact OG-OG1 3.46Å; S75-Y104 WeakPolarHBondContact O-CD2 3.32Å
76	A	75.7	Confident	79.4	Confident	58 Å²	58	44.4 Å²	44.4	48%	0.479	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-13.9	177.3	0	0	0	0	0	113.8	F78 Y104	A76-F78 WeakPolarHBondContact O-CD2 3.45Å; A76-Y104 HydrophobicContact CB-CD1 4.48Å; A76-Y104 HydrophobicContact CB-CE1 3.86Å; A76-Y104 HydrophobicContact CB-CE2 4.28Å; A76-Y104 VanDerWaalsContact N-CE2 3.35Å
77	S	74.4	Confident	79.7	Confident	78 Å²	78	45.3 Å²	45.3	55%	0.545	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-9.3	-174.2	58.6	0	0	0	0	114.5	S75 T79	S75-S77 PolarHBondContact O-N 3.01Å; S75-S77 PolarHBondContact OG-OG 3.49Å; S77-T79 PolarHBondContact O-N 3.03Å
78	F	75.3	Confident	80.3	Confident	44 Å²	44	44.6 Å²	44.6	19%	0.193	24%	0.241	C	C	.	.			trans	43.7	38	-177.5	-70.7	-84.2	0	0	0	114.2	L44 L71 S73 A76 S83	L44-F78 HydrophobicContact CD1-CE2 3.37Å; L44-F78 HydrophobicContact CD1-CZ 3.42Å; L44-F78 VanDerWaalsContact CD1-CZ 3.42Å; L71-F78 HydrophobicContact CD2-CB 4.07Å; L71-F78 HydrophobicContact CD2-CD1 3.42Å; L71-F78 VanDerWaalsContact CD2-CD1 3.42Å; L71-F78 HydrophobicContact CD2-CE1 4.08Å; L71-F78 HydrophobicContact CD2-CG 3.97Å; L71-F78 HydrophobicContact CG-CD1 3.61Å; L71-F78 HydrophobicContact CG-CE1 4.03Å; S73-F78 VanDerWaalsContact CB-CD1 3.43Å; A76-F78 WeakPolarHBondContact O-CD2 3.45Å; F78-S83 PolarHBondContact O-OG 2.84Å
79	T	76.6	Confident	80.8	Confident	62 Å²	62	43.4 Å²	43.4	38%	0.38	23%	0.234	S	C	.	.			trans	-70.7	153.4	177.8	46.5	0	0	0	0	110.9	S77 D81 T82 S83	S77-T79 PolarHBondContact O-N 3.03Å; T79-D81 PolarHBondContact O-N 2.96Å; T79-T82 PolarHBondContact N-OG1 2.84Å; T79-T82 PolarHBondContact O-N 3.18Å; T79-T82 PolarHBondContact O-OG1 3.3Å; T79-T82 PolarHBondContact OG1-OG1 2.85Å; T79-S83 WeakPolarHBondContact O-CB 3.4Å; T79-S83 PolarHBondContact O-N 2.98Å; T79-S83 PolarHBondContact O-OG 2.85Å
80	Y	69.2	Low	81.2	Confident	218 Å²	218	41.7 Å²	41.7	86%	0.855	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-28.5	176.5	-77.6	-77.8	0	0	0	113.3
81	D	70.8	Confident	81.5	Confident	65 Å²	65	41.6 Å²	41.6	35%	0.348	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-11.8	-179.9	-68.7	-14.5	0	0	0	113.9	T79 R137 F140	T79-D81 PolarHBondContact O-N 2.96Å; D81-R137 IonicContact OD2-CZ 3.65Å; D81-R137 IonicContact OD2-NH1 2.77Å; D81-R137 PolarHBondContact OD2-NH1 3.26Å; D81-R137 IonicContact OD2-NH2 2.74Å; D81-R137 PolarHBondContact OD2-NH2 2.95Å; D81-F140 WeakPolarHBondContact O-CD1 2.93Å; D81-F140 VanDerWaalsContact O-CG 3.29Å; D81-F140 WeakPolarHBondContact O-CG 3.3Å
82	T	75.4	Confident	81.7	Confident	22 Å²	22	39.7 Å²	39.7	14%	0.135	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.9	-0	-173.8	61.9	0	0	0	0	113.8	S73 T74 S75 T79 F140	S73-T82 VanDerWaalsContact CA-O 3.29Å; S73-T82 WeakPolarHBondContact CA-O 3.37Å; S73-T82 PolarHBondContact OG-O 3.16Å; S73-T82 VanDerWaalsContact OG-O 3.08Å; S73-T82 PolarHBondContact OG-OG1 3.22Å; T74-T82 PolarHBondContact N-O 3.28Å; S75-T82 WeakPolarHBondContact OG-CB 3.23Å; S75-T82 PolarHBondContact OG-OG1 3.46Å; T79-T82 PolarHBondContact N-OG1 2.84Å; T79-T82 PolarHBondContact O-N 3.18Å; T79-T82 PolarHBondContact O-OG1 3.3Å; T79-T82 PolarHBondContact OG1-OG1 2.85Å; T82-F140 VanDerWaalsContact CA-CD2 3.46Å; T82-F140 WeakPolarHBondContact O-CD2 3.46Å; T82-F140 WeakPolarHBondContact O-CE2 3.23Å
83	S	81	Confident	81.6	Confident	18 Å²	18	39.9 Å²	39.9	13%	0.126	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	156.1	-173.3	66.7	0	0	0	0	112.6	V72 F78 T79	V72-S83 CarbonylContact O-C 3.57Å; V72-S83 WeakPolarHBondContact O-CA 3.25Å; V72-S83 WeakPolarHBondContact O-CB 3.38Å; F78-S83 PolarHBondContact O-OG 2.84Å; T79-S83 WeakPolarHBondContact O-CB 3.4Å; T79-S83 PolarHBondContact O-N 2.98Å; T79-S83 PolarHBondContact O-OG 2.85Å
84	Q	83.3	Confident	81.5	Confident	16 Å²	16	43.6 Å²	43.6	8%	0.075	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	135.6	177.1	-179.9	169	47.5	0	0	110.1	L71 V72 C89 G90 L91 N142	L71-Q84 WeakPolarHBondContact CA-O 3.4Å; V72-Q84 PolarHBondContact N-O 2.89Å; V72-Q84 PolarHBondContact O-N 3.41Å; Q84-C89 HydrophobicContact CG-CB 4.37Å; Q84-C89 VanDerWaalsContact OE1-CA 3.31Å; Q84-G90 PolarHBondContact OE1-O 3.06Å; Q84-L91 HydrophobicContact CB-CD2 3.88Å; Q84-N142 PolarHBondContact NE2-OD1 3.07Å
85	Y	81.9	Confident	81.3	Confident	136 Å²	136	42.5 Å²	42.5	53%	0.533	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	108.4	174.8	-174.8	-107.5	0	0	0	110.3	P69 L70 L71	P69-Y85 HydrophobicContact CB-CD1 4.45Å; P69-Y85 HydrophobicContact CB-CE1 3.84Å; P69-Y85 HydrophobicContact CB-CE2 3.99Å; P69-Y85 HydrophobicContact CG-CE1 4.16Å; P69-Y85 HydrophobicContact CG-CE2 4.45Å; P69-Y85 VanDerWaalsContact CG-OH 3.28Å; P69-Y85 WeakPolarHBondContact CG-OH 3.47Å; L70-Y85 WeakPolarHBondContact O-CA 3.39Å; L71-Y85 HydrophobicContact CB-CD2 4.23Å; L71-Y85 HydrophobicContact CD1-CD2 4.43Å
86	S	82.4	Confident	81	Confident	28 Å²	28	48 Å²	48	20%	0.196	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165	161	-178.8	178.4	0	0	0	0	110.9	L70 H88 C89	L70-S86 PolarHBondContact N-O 3.22Å; L70-S86 PolarHBondContact O-N 2.93Å; L70-S86 VanDerWaalsContact O-N 3.09Å; S86-H88 WeakPolarHBondContact CB-O 3.32Å; S86-H88 PolarHBondContact OG-N 3.47Å; S86-H88 VanDerWaalsContact OG-N 3.09Å; S86-H88 PolarHBondContact OG-O 3.12Å; S86-C89 PolarHBondContact O-SG 3.15Å
87	A	81.8	Confident	80.7	Confident	22 Å²	22	50.1 Å²	50.1	18%	0.182	25%	0.25	C	S	.	.	S	Bend	trans	-69.9	-24.2	167.7	0	0	0	0	0	111.9	S65	S65-A87 PolarHBondContact N-O 3.23Å; S65-A87 WeakPolarHBondContact O-CB 3.47Å
88	H	87.8	Confident	81	Confident	7 Å²	7	51.9 Å²	51.9	3%	0.032	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	103.3	175.3	-55.2	-58.7	0	0	0	108.5	H64 S86 V297 I298	H64-H88 AromaticContact CG-ND1 3.93Å; H64-H88 AromaticContact ND1-CG 3.92Å; H64-H88 AromaticContact ND1-ND1 3.27Å; H64-H88 PolarHBondContact ND1-ND1 3.13Å; S86-H88 WeakPolarHBondContact CB-O 3.32Å; S86-H88 PolarHBondContact OG-N 3.47Å; S86-H88 VanDerWaalsContact OG-N 3.09Å; S86-H88 PolarHBondContact OG-O 3.12Å; H88-V297 HydrophobicContact CB-CG2 4.28Å; H88-I298 VanDerWaalsContact NE2-CD1 3.26Å; H88-I298 WeakPolarHBondContact NE2-CD1 3.04Å; H88-I298 VanDerWaalsContact NE2-CG1 3.31Å; H88-I298 WeakPolarHBondContact NE2-CG1 3.26Å
89	C	88.3	Confident	81.3	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.007	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	138.3	-179.6	-62.5	0	0	0	0	110.4	V63 V72 Q84 S86 T295	V63-C89 HydrophobicContact CB-CB 4.32Å; V63-C89 PolarHBondContact N-O 3.23Å; V63-C89 PolarHBondContact O-N 3.41Å; V72-C89 HydrophobicContact CB-CB 4.01Å; V72-C89 HydrophobicContact CG2-CB 3.73Å; Q84-C89 HydrophobicContact CG-CB 4.37Å; Q84-C89 VanDerWaalsContact OE1-CA 3.31Å; S86-C89 PolarHBondContact O-SG 3.15Å; C89-T295 WeakPolarHBondContact O-CG2 3.23Å
90	G	90	Very high	81.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	114	-179.7	0	0	0	0	0	109.8	Y61 Q84 N142 T143 A144 T295	Y61-G90 WeakPolarHBondContact O-CA 3.44Å; Q84-G90 PolarHBondContact OE1-O 3.06Å; G90-N142 PolarHBondContact O-OD1 2.9Å; G90-T143 VanDerWaalsContact CA-OG1 3.28Å; G90-T143 WeakPolarHBondContact CA-OG1 3.01Å; G90-T143 PolarHBondContact O-N 3.43Å; G90-T143 PolarHBondContact O-OG1 3.18Å; G90-A144 PolarHBondContact O-N 2.88Å; G90-T295 WeakPolarHBondContact CA-OG1 3.38Å
91	L	90.8	Very high	82.4	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	148.6	-178.1	-55.5	-179.5	0	0	0	109.5	V60 Y61 V72 T74 Q84 F140 I141 T143	V60-L91 CarbonylContact C-O 3.46Å; V60-L91 WeakPolarHBondContact CA-O 3.13Å; Y61-L91 HydrophobicContact CD2-CB 4.13Å; Y61-L91 PolarHBondContact N-O 3.12Å; Y61-L91 PolarHBondContact O-N 2.69Å; V72-L91 HydrophobicContact CB-CD1 4.12Å; V72-L91 HydrophobicContact CG1-CD1 3.59Å; V72-L91 HydrophobicContact CG1-CG 4.5Å; T74-L91 HydrophobicContact CG2-CB 4.35Å; T74-L91 HydrophobicContact CG2-CD1 4.23Å; Q84-L91 HydrophobicContact CB-CD2 3.88Å; L91-F140 HydrophobicContact CD1-CE2 4.24Å; L91-F140 HydrophobicContact CD2-CD2 4.2Å; L91-F140 HydrophobicContact CD2-CE2 3.23Å; L91-F140 HydrophobicContact CD2-CZ 3.63Å; L91-F140 HydrophobicContact CG-CE2 4.26Å; L91-I141 CarbonylContact C-O 3.6Å; L91-I141 WeakPolarHBondContact CA-O 3.3Å; L91-T143 PolarHBondContact N-OG1 3.17Å
92	A	89.5	Confident	83.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143.3	165.2	0	0	0	0	0	111	I59 V60 L128 I141 T143	I59-A92 WeakPolarHBondContact O-CA 3.49Å; V60-A92 HydrophobicContact CG2-CB 4.27Å; A92-L128 HydrophobicContact CB-CD1 4.15Å; A92-I141 HydrophobicContact CB-CB 4.03Å; A92-I141 HydrophobicContact CB-CG2 4.31Å; A92-I141 PolarHBondContact N-O 3.34Å; A92-I141 PolarHBondContact O-N 3.18Å; A92-I141 VanDerWaalsContact O-N 3.11Å; A92-T143 HydrophobicContact CB-CG2 3.58Å
93	G	86.8	Confident	83.9	Confident	5 Å²	5	43.8 Å²	43.8	5%	0.052	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	153.2	175.6	0	0	0	0	0	110.9	F58 I59	F58-G93 CarbonylContact C-O 3.57Å; F58-G93 VanDerWaalsContact CA-O 3.3Å; F58-G93 WeakPolarHBondContact CA-O 3.45Å; I59-G93 PolarHBondContact N-O 2.96Å; I59-G93 PolarHBondContact O-N 3.28Å
94	F	85.3	Confident	84.3	Confident	78 Å²	78	44.7 Å²	44.7	34%	0.342	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	141.3	178.3	-62.2	-86	0	0	0	110.9	K57 F58 L128 S138 I141 F186	K57-F94 WeakPolarHBondContact O-CA 3.47Å; F58-F94 HydrophobicContact CB-CD1 4.23Å; F94-L128 HydrophobicContact CE1-CD2 3.97Å; F94-L128 HydrophobicContact CZ-CD2 3.78Å; F94-S138 WeakPolarHBondContact CD2-O 3.24Å; F94-S138 WeakPolarHBondContact CE2-O 3.47Å; F94-I141 HydrophobicContact CE2-CD1 3.8Å; F94-I141 HydrophobicContact CZ-CD1 3.78Å; F94-F186 HydrophobicContact CD1-CE2 4.36Å; F94-F186 AromaticContact CE1-CD2 3.71Å; F94-F186 HydrophobicContact CE1-CD2 3.71Å; F94-F186 AromaticContact CE1-CE2 3.63Å; F94-F186 HydrophobicContact CE1-CE2 3.63Å; F94-F186 HydrophobicContact CZ-CD2 4.31Å
95	T	79.1	Confident	84.5	Confident	3 Å²	3	44 Å²	44	2%	0.018	22%	0.223	C	C	.	.			trans	-96.2	-8	-172.9	47.6	0	0	0	0	113.9	I52 S56 K57 I59 N97 K98	I52-T95 HydrophobicContact CD1-CG2 4.46Å; S56-T95 PolarHBondContact O-OG1 3.33Å; K57-T95 PolarHBondContact O-N 3.24Å; K57-T95 PolarHBondContact O-OG1 2.89Å; I59-T95 HydrophobicContact CB-CG2 3.7Å; I59-T95 HydrophobicContact CG2-CG2 3.56Å; T95-N97 PolarHBondContact O-N 3.44Å; T95-K98 VanDerWaalsContact O-CB 3.3Å; T95-K98 WeakPolarHBondContact O-CB 3.33Å; T95-K98 PolarHBondContact O-N 3.23Å
96	E	75.6	Confident	84.7	Confident	146 Å²	146	42 Å²	42	68%	0.682	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	41.2	35.2	-178.9	-65.2	-174.2	157.3	0	0	114.2	K98	E96-K98 PolarHBondContact O-N 2.81Å; E96-K98 WeakPolarHBondContact OE2-CE 3.47Å; E96-K98 IonicContact OE2-NZ 2.74Å; E96-K98 PolarHBondContact OE2-NZ 3.29Å
97	N	70.3	Confident	84.7	Confident	103 Å²	103	40.8 Å²	40.8	55%	0.551	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	18.7	-172.6	-66.5	-5.7	0	0	0	116	T95	T95-N97 PolarHBondContact O-N 3.44Å
98	K	79.9	Confident	84.6	Confident	115 Å²	115	41.5 Å²	41.5	50%	0.5	21%	0.21	S	C	.	.			trans	-73.8	137.4	172.2	-62.7	170.7	-172.7	155.6	0	109.4	T95 E96 L100	T95-K98 VanDerWaalsContact O-CB 3.3Å; T95-K98 WeakPolarHBondContact O-CB 3.33Å; T95-K98 PolarHBondContact O-N 3.23Å; E96-K98 PolarHBondContact O-N 2.81Å; E96-K98 WeakPolarHBondContact OE2-CE 3.47Å; E96-K98 IonicContact OE2-NZ 2.74Å; E96-K98 PolarHBondContact OE2-NZ 3.29Å; K98-L100 WeakPolarHBondContact CB-O 3.31Å; K98-L100 PolarHBondContact O-N 3.37Å
99	T	81.5	Confident	84.1	Confident	100 Å²	100	42.3 Å²	42.3	61%	0.613	21%	0.213	S	C	*	.	S	Bend	trans	-77.4	-3.6	172.9	54.5	0	0	0	0	112.9	I52	I52-T99 PolarHBondContact N-O 3.11Å
100	L	84.1	Confident	83.4	Confident	62 Å²	62	46.1 Å²	46.1	33%	0.325	24%	0.24	S	C	.	.			trans	-129.3	139.2	-178.6	-160.3	85.4	0	0	0	110.2	R48 V49 L50 K98	R48-L100 HydrophobicContact CG-CD1 3.58Å; R48-L100 HydrophobicContact CG-CD2 3.89Å; R48-L100 HydrophobicContact CG-CG 3.84Å; V49-L100 WeakPolarHBondContact O-CD1 3.32Å; L50-L100 HydrophobicContact CD2-CD1 3.35Å; L50-L100 HydrophobicContact CG-CD1 4.35Å; K98-L100 WeakPolarHBondContact CB-O 3.31Å; K98-L100 PolarHBondContact O-N 3.37Å
101	S	86	Confident	82.8	Confident	19 Å²	19	49.8 Å²	49.8	13%	0.133	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	155.3	168.1	-166.3	0	0	0	0	111.1	V49 Y61	V49-S101 PolarHBondContact N-O 3.21Å; V49-S101 PolarHBondContact O-N 2.92Å; Y61-S101 PolarHBondContact OH-OG 2.73Å
102	T	86.5	Confident	82.3	Confident	59 Å²	59	52.9 Å²	52.9	36%	0.362	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	144	-174	52.7	0	0	0	0	111.3	V47 R48	V47-T102 WeakPolarHBondContact O-CA 3.35Å; R48-T102 HydrophobicContact CB-CG2 4.16Å; R48-T102 HydrophobicContact CG-CG2 4.13Å
103	F	89.2	Confident	81.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	167.9	170.3	73.2	-83.4	0	0	0	110.1	I31 V47 V49 Y61 V63 V72 V105 V117	I31-F103 HydrophobicContact CD1-CE1 4.35Å; V47-F103 HydrophobicContact CB-CD1 4.05Å; V47-F103 HydrophobicContact CB-CE1 3.51Å; V47-F103 HydrophobicContact CB-CE2 4.08Å; V47-F103 HydrophobicContact CB-CZ 3.51Å; V47-F103 HydrophobicContact CG1-CD1 4.31Å; V47-F103 HydrophobicContact CG1-CE1 3.41Å; V47-F103 VanDerWaalsContact CG1-CE1 3.41Å; V47-F103 HydrophobicContact CG1-CZ 3.57Å; V47-F103 HydrophobicContact CG2-CE1 4.38Å; V47-F103 HydrophobicContact CG2-CE2 4.17Å; V47-F103 HydrophobicContact CG2-CZ 3.88Å; V47-F103 PolarHBondContact N-O 3.41Å; V47-F103 PolarHBondContact O-N 2.84Å; V47-F103 VanDerWaalsContact O-N 3.07Å; V49-F103 HydrophobicContact CG2-CD1 4.42Å; V49-F103 HydrophobicContact CG2-CE1 4.28Å; Y61-F103 HydrophobicContact CD1-CB 4.47Å; Y61-F103 AromaticContact CD1-CD1 3.42Å; Y61-F103 HydrophobicContact CD1-CD1 3.42Å; Y61-F103 VanDerWaalsContact CD1-CD1 3.42Å; Y61-F103 AromaticContact CD1-CE1 3.84Å; Y61-F103 HydrophobicContact CD1-CE1 3.84Å; Y61-F103 HydrophobicContact CD1-CG 4.05Å; Y61-F103 HydrophobicContact CE1-CB 4.41Å; Y61-F103 AromaticContact CE1-CD1 3.68Å; Y61-F103 HydrophobicContact CE1-CD1 3.68Å; Y61-F103 HydrophobicContact CE1-CE1 4.41Å; Y61-F103 HydrophobicContact CE1-CG 4.35Å; Y61-F103 HydrophobicContact CG-CD1 4.1Å; Y61-F103 HydrophobicContact CG-CG 4.32Å; V63-F103 HydrophobicContact CG2-CE2 3.68Å; V63-F103 HydrophobicContact CG2-CZ 4.22Å; V72-F103 HydrophobicContact CG1-CD2 3.88Å; V72-F103 HydrophobicContact CG1-CE2 4.23Å; F103-V105 HydrophobicContact CD2-CG2 3.98Å; F103-V105 HydrophobicContact CE2-CG2 3.42Å; F103-V105 VanDerWaalsContact CE2-CG2 3.42Å; F103-V105 HydrophobicContact CZ-CG2 4.4Å; F103-V117 HydrophobicContact CE1-CG1 4.16Å; F103-V117 HydrophobicContact CZ-CG1 3.52Å
104	Y	89.3	Confident	81.8	Confident	38 Å²	38	56.6 Å²	56.6	15%	0.149	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	136	-169.5	-52.8	-95.1	0	0	0	110.3	Y46 V72 S73 T74 S75 A76	Y46-Y104 AromaticContact CD1-CD1 3.8Å; Y46-Y104 HydrophobicContact CD1-CD1 3.8Å; Y46-Y104 AromaticContact CD1-CE1 3.42Å; Y46-Y104 HydrophobicContact CD1-CE1 3.42Å; Y46-Y104 VanDerWaalsContact CD1-CE1 3.42Å; Y46-Y104 AromaticContact CE1-CD1 3.78Å; Y46-Y104 HydrophobicContact CE1-CD1 3.78Å; Y46-Y104 AromaticContact CE1-CE1 3.28Å; Y46-Y104 HydrophobicContact CE1-CE1 3.28Å; Y46-Y104 HydrophobicContact CE2-CD1 4.48Å; Y46-Y104 HydrophobicContact CG-CD1 4.25Å; Y46-Y104 HydrophobicContact CG-CE1 4.3Å; Y46-Y104 AromaticContact CZ-CE1 3.93Å; V72-Y104 CarbonylContact C-O 3.53Å; V72-Y104 WeakPolarHBondContact CA-O 2.94Å; S73-Y104 PolarHBondContact N-O 2.95Å; S73-Y104 PolarHBondContact O-N 3.23Å; T74-Y104 WeakPolarHBondContact O-CE2 3.1Å; S75-Y104 WeakPolarHBondContact O-CD2 3.32Å; A76-Y104 HydrophobicContact CB-CD1 4.48Å; A76-Y104 HydrophobicContact CB-CE1 3.86Å; A76-Y104 HydrophobicContact CB-CE2 4.28Å; A76-Y104 VanDerWaalsContact N-CE2 3.35Å
105	V	89.2	Confident	82	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.5	175.3	-174.6	0	0	0	0	108.4	V41 L45 V47 V63 L70 V72 F103	V41-V105 HydrophobicContact CG1-CG1 4.15Å; V41-V105 HydrophobicContact CG2-CG1 4.15Å; L45-V105 PolarHBondContact N-O 2.85Å; L45-V105 PolarHBondContact O-N 3.24Å; V47-V105 HydrophobicContact CG2-CG2 4.25Å; V63-V105 HydrophobicContact CG2-CG2 4.46Å; L70-V105 HydrophobicContact CD1-CG1 4.33Å; V72-V105 HydrophobicContact CG1-CG2 4.41Å; V72-V105 HydrophobicContact CG2-CG1 4.41Å; V72-V105 HydrophobicContact CG2-CG2 4.46Å; F103-V105 HydrophobicContact CD2-CG2 3.98Å; F103-V105 HydrophobicContact CE2-CG2 3.42Å; F103-V105 VanDerWaalsContact CE2-CG2 3.42Å; F103-V105 HydrophobicContact CZ-CG2 4.4Å
106	Y	85.4	Confident	82.7	Confident	96 Å²	96	53.7 Å²	53.7	38%	0.376	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	130.3	177.7	176.4	-101.8	0	0	0	110.8	G43 L44 L71	G43-Y106 WeakPolarHBondContact O-CA 3.44Å; L44-Y106 HydrophobicContact CB-CD2 4.13Å; L71-Y106 HydrophobicContact CB-CD1 4.25Å; L71-Y106 HydrophobicContact CD2-CD1 4.27Å; L71-Y106 PolarHBondContact N-O 3.28Å; L71-Y106 VanDerWaalsContact N-O 3.09Å; L71-Y106 PolarHBondContact O-N 2.9Å
107	S	83.2	Confident	83.5	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.014	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	127.5	171.2	176.4	0	0	0	0	109.4	G43 Y109	G43-S107 WeakPolarHBondContact CA-O 3.12Å; G43-S107 PolarHBondContact N-O 3.21Å; G43-S107 PolarHBondContact O-N 3.44Å; S107-Y109 VanDerWaalsContact C-N 3.32Å; S107-Y109 WeakPolarHBondContact OG-CD2 3.26Å; S107-Y109 PolarHBondContact OG-N 2.94Å
108	S	77.9	Confident	84.6	Confident	36 Å²	36	42.2 Å²	42.2	25%	0.252	23%	0.233	S	C	.	.			trans	-87.8	1.1	173.4	60.5	0	0	0	0	113.3	Q317	S108-Q317 WeakPolarHBondContact O-CG 3.35Å; S108-Q317 PolarHBondContact O-NE2 3.15Å
109	Y	78.2	Confident	85.2	Confident	24 Å²	24	36.8 Å²	36.8	9%	0.094	21%	0.209	C	C	.	.			trans	-82.2	145.2	-175.9	-64	-91.5	0	0	0	111.2	N68 P69 S107 V111 L113 P318	N68-Y109 HydrophobicContact CB-CE2 4.31Å; P69-Y109 VanDerWaalsContact CD-OH 3.25Å; P69-Y109 WeakPolarHBondContact CD-OH 3.42Å; P69-Y109 WeakPolarHBondContact O-CE2 3.46Å; S107-Y109 VanDerWaalsContact C-N 3.32Å; S107-Y109 WeakPolarHBondContact OG-CD2 3.26Å; S107-Y109 PolarHBondContact OG-N 2.94Å; Y109-V111 VanDerWaalsContact C-N 3.28Å; Y109-V111 PolarHBondContact O-N 2.96Å; Y109-L113 HydrophobicContact CD2-CD1 3.35Å; Y109-L113 HydrophobicContact CD2-CG 4.34Å; Y109-L113 HydrophobicContact CE2-CD1 3.81Å; Y109-L113 HydrophobicContact CG-CD1 3.89Å; Y109-L113 HydrophobicContact CG-CG 4.47Å; Y109-P318 WeakPolarHBondContact CD1-O 3.26Å; Y109-P318 HydrophobicContact CE1-CB 4Å; Y109-P318 HydrophobicContact CE1-CG 3.68Å; Y109-P318 WeakPolarHBondContact CE1-O 3.11Å
110	S	73.2	Confident	85.7	Confident	81 Å²	81	33 Å²	33	57%	0.566	19%	0.186	S	C	*	.	S	Bend	trans	-72.4	-20.9	178.4	54.4	0	0	0	0	113.7
111	V	77.2	Confident	86	Confident	77 Å²	77	30.8 Å²	30.8	47%	0.467	18%	0.176	S	C	.	.	S	Bend	trans	-101.5	136.4	178.7	-177.1	0	0	0	0	108.8	Y109 L113	Y109-V111 VanDerWaalsContact C-N 3.28Å; Y109-V111 PolarHBondContact O-N 2.96Å; V111-L113 PolarHBondContact O-N 3.21Å
112	P	80.2	Confident	86.2	Confident	67 Å²	67	31.2 Å²	31.2	44%	0.435	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-57.5	126	174.2	22.3	-33	0	0	0	110.8	S40 V41 N42	S40-P112 WeakPolarHBondContact OG-CB 3.5Å; V41-P112 WeakPolarHBondContact O-CA 3.19Å; N42-P112 HydrophobicContact CB-CB 4.19Å
113	L	81.9	Confident	86.3	Confident	14 Å²	14	28.9 Å²	28.9	7%	0.073	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	134.1	177.4	-69.2	-178.9	0	0	0	110.6	S40 V41 N68 L70 Y109 V111 V115	S40-L113 WeakPolarHBondContact CA-O 3.36Å; V41-L113 PolarHBondContact N-O 2.92Å; V41-L113 PolarHBondContact O-N 2.88Å; N68-L113 HydrophobicContact CB-CD1 3.83Å; N68-L113 HydrophobicContact CB-CD2 4.44Å; N68-L113 WeakPolarHBondContact ND2-CD2 3.28Å; L70-L113 HydrophobicContact CD2-CD1 3.89Å; Y109-L113 HydrophobicContact CD2-CD1 3.35Å; Y109-L113 HydrophobicContact CD2-CG 4.34Å; Y109-L113 HydrophobicContact CE2-CD1 3.81Å; Y109-L113 HydrophobicContact CG-CD1 3.89Å; Y109-L113 HydrophobicContact CG-CG 4.47Å; V111-L113 PolarHBondContact O-N 3.21Å; L113-V115 HydrophobicContact CB-CG2 4.29Å; L113-V115 PolarHBondContact O-N 3.33Å
114	T	85.3	Confident	86.1	Confident	68 Å²	68	30.6 Å²	30.6	42%	0.417	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	122.3	166.3	-53.6	0	0	0	0	108.9	N38 W116	N38-T114 HydrophobicContact CB-CG2 4.21Å; T114-W116 HydrophobicContact CG2-CH2 3.88Å; T114-W116 HydrophobicContact CG2-CZ2 3.81Å; T114-W116 HydrophobicContact CG2-CZ3 4.3Å; T114-W116 WeakPolarHBondContact O-CZ3 3.47Å
115	V	89.5	Confident	85.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	140.3	-177.8	-174.5	0	0	0	0	108.3	N38 I39 V41 V63 L70 L113 V117	N38-V115 CarbonylContact C-O 3.5Å; N38-V115 WeakPolarHBondContact CA-O 3.45Å; I39-V115 HydrophobicContact CG1-CB 3.94Å; I39-V115 WeakPolarHBondContact CG1-O 3.41Å; I39-V115 PolarHBondContact N-O 2.89Å; I39-V115 PolarHBondContact O-N 3.13Å; V41-V115 HydrophobicContact CB-CG2 4.02Å; V41-V115 HydrophobicContact CG2-CB 3.94Å; V41-V115 HydrophobicContact CG2-CG2 3.47Å; V41-V115 VanDerWaalsContact CG2-CG2 3.47Å; V63-V115 HydrophobicContact CG1-CG1 3.41Å; V63-V115 VanDerWaalsContact CG1-CG1 3.41Å; L70-V115 HydrophobicContact CD1-CB 4.21Å; L70-V115 HydrophobicContact CD1-CG1 3.66Å; L70-V115 HydrophobicContact CD1-CG2 3.44Å; L70-V115 VanDerWaalsContact CD1-CG2 3.44Å; L113-V115 HydrophobicContact CB-CG2 4.29Å; L113-V115 PolarHBondContact O-N 3.33Å; V115-V117 HydrophobicContact CG1-CG2 4.22Å
116	W	92.8	Very high	85.9	Confident	20 Å²	20	34.2 Å²	34.2	8%	0.076	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	132.8	176.4	-65.6	-92.5	0	0	0	110.4	F36 T37 H64 P66 T114 P225 N226 A229	F36-W116 HydrophobicContact CD1-CB 4.36Å; F36-W116 HydrophobicContact CE1-CB 3.49Å; F36-W116 VanDerWaalsContact CE1-CB 3.49Å; F36-W116 AromaticContact CE1-CD1 3.53Å; F36-W116 AromaticContact CE1-CG 3.7Å; F36-W116 HydrophobicContact CE1-CG 3.7Å; F36-W116 HydrophobicContact CE2-CB 4.41Å; F36-W116 HydrophobicContact CZ-CB 3.51Å; F36-W116 HydrophobicContact CZ-CG 4.13Å; T37-W116 CarbonylContact O-C 3.56Å; T37-W116 WeakPolarHBondContact O-CA 3.18Å; H64-W116 PolarHBondContact N-O 2.9Å; H64-W116 PolarHBondContact O-N 2.98Å; P66-W116 VanDerWaalsContact CD-CZ3 3.4Å; P66-W116 HydrophobicContact CG-CE3 4.28Å; P66-W116 HydrophobicContact CG-CZ3 3.98Å; T114-W116 HydrophobicContact CG2-CH2 3.88Å; T114-W116 HydrophobicContact CG2-CZ2 3.81Å; T114-W116 HydrophobicContact CG2-CZ3 4.3Å; T114-W116 WeakPolarHBondContact O-CZ3 3.47Å; W116-P225 HydrophobicContact CH2-CB 3.75Å; W116-P225 HydrophobicContact CZ3-CB 4.27Å; W116-N226 WeakPolarHBondContact CZ2-OD1 3.25Å; W116-A229 HydrophobicContact CD2-CB 3.43Å; W116-A229 VanDerWaalsContact CD2-CB 3.43Å; W116-A229 HydrophobicContact CE3-CB 4.02Å; W116-A229 HydrophobicContact CG-CB 3.82Å; W116-A229 HydrophobicContact CH2-CB 4.14Å; W116-A229 HydrophobicContact CZ2-CB 3.55Å; W116-A229 HydrophobicContact CZ3-CB 4.37Å
117	V	92.9	Very high	86.1	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	141.8	-173	174.7	0	0	0	0	110.4	I31 F36 T37 I39 Q62 V63 F103 V115	I31-V117 HydrophobicContact CD1-CG1 3.52Å; F36-V117 WeakPolarHBondContact CA-O 3.28Å; T37-V117 PolarHBondContact N-O 3.28Å; T37-V117 PolarHBondContact O-N 2.79Å; I39-V117 HydrophobicContact CD1-CB 4.33Å; I39-V117 HydrophobicContact CD1-CG2 3.38Å; I39-V117 HydrophobicContact CG1-CG2 4.05Å; Q62-V117 VanDerWaalsContact O-CA 3.32Å; Q62-V117 WeakPolarHBondContact O-CA 3.23Å; V63-V117 HydrophobicContact CG1-CG2 4.18Å; V63-V117 HydrophobicContact CG2-CG2 4.18Å; F103-V117 HydrophobicContact CE1-CG1 4.16Å; F103-V117 HydrophobicContact CZ-CG1 3.52Å; V115-V117 HydrophobicContact CG1-CG2 4.22Å
118	K	93	Very high	86.4	Confident	9 Å²	9	29.7 Å²	29.7	4%	0.039	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.3	169.8	-174.5	178.7	-177.4	-177.2	0	109.9	G34 F36 Q62 V120 A236 N237	G34-K118 WeakPolarHBondContact O-CE 3.46Å; F36-K118 HydrophobicContact CD2-CB 3.81Å; F36-K118 HydrophobicContact CD2-CD 4.14Å; F36-K118 HydrophobicContact CD2-CG 4.48Å; Q62-K118 HydrophobicContact CB-CB 4.35Å; Q62-K118 PolarHBondContact N-O 3.17Å; Q62-K118 PolarHBondContact O-N 3.38Å; K118-V120 HydrophobicContact CD-CG2 4.11Å; K118-V120 VanDerWaalsContact CE-CG2 3.41Å; K118-V120 HydrophobicContact CG-CG2 4.01Å; K118-A236 HydrophobicContact CD-CB 4.02Å; K118-A236 PolarHBondContact NZ-O 3.34Å; K118-N237 PolarHBondContact NZ-OD1 3.16Å
119	A	92.3	Very high	86.9	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	124	173.8	0	0	0	0	0	109.8	I31 G34 V49 I59 V60 Y61	I31-A119 HydrophobicContact CD1-CB 4.21Å; G34-A119 PolarHBondContact N-O 3.44Å; V49-A119 HydrophobicContact CB-CB 4.46Å; V49-A119 HydrophobicContact CG1-CB 3.88Å; V49-A119 HydrophobicContact CG2-CB 3.71Å; I59-A119 HydrophobicContact CD1-CB 3.9Å; I59-A119 HydrophobicContact CG1-CB 4.25Å; V60-A119 WeakPolarHBondContact O-CA 3.39Å; Y61-A119 HydrophobicContact CD1-CB 3.98Å
120	V	91.4	Very high	87.3	Confident	22 Å²	22	26.9 Å²	26.9	13%	0.133	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.7	-177.6	-170.7	0	0	0	0	109.6	I59 V60 K118 Y122	I59-V120 WeakPolarHBondContact CA-O 3.43Å; V60-V120 PolarHBondContact N-O 2.95Å; V60-V120 PolarHBondContact O-N 3.32Å; K118-V120 HydrophobicContact CD-CG2 4.11Å; K118-V120 VanDerWaalsContact CE-CG2 3.41Å; K118-V120 HydrophobicContact CG-CG2 4.01Å; V120-Y122 HydrophobicContact CB-CE2 3.87Å; V120-Y122 HydrophobicContact CG1-CD2 4.49Å; V120-Y122 HydrophobicContact CG1-CE1 4.28Å; V120-Y122 HydrophobicContact CG1-CE2 3.74Å; V120-Y122 WeakPolarHBondContact O-CE2 3.46Å
121	A	91.3	Very high	87.7	Confident	14 Å²	14	23.6 Å²	23.6	12%	0.116	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	144.5	-179.4	0	0	0	0	0	111	H33 I52 F58 I59	H33-A121 PolarHBondContact CD2-N 3.25Å; H33-A121 VanDerWaalsContact CD2-N 3.34Å; H33-A121 PolarHBondContact NE2-N 3Å; I52-A121 HydrophobicContact CG2-CB 3.86Å; F58-A121 CarbonylContact O-C 3.59Å; F58-A121 WeakPolarHBondContact O-CA 3.27Å; I59-A121 HydrophobicContact CB-CB 4.35Å; I59-A121 HydrophobicContact CG1-CB 4.32Å
122	Y	90.2	Very high	87.9	Confident	29 Å²	29	20.4 Å²	20.4	11%	0.114	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	152.4	-175.8	-63.9	-86.5	0	0	0	110.8	S56 K57 F58 V60 V120 F126 V292 P293	S56-Y122 CarbonylContact C-O 3.52Å; S56-Y122 WeakPolarHBondContact CA-O 3.19Å; K57-Y122 PolarHBondContact N-O 3.41Å; F58-Y122 HydrophobicContact CD2-CD2 4.25Å; F58-Y122 AromaticContact CE2-CD2 3.66Å; F58-Y122 HydrophobicContact CE2-CD2 3.66Å; F58-Y122 AromaticContact CE2-CG 3.91Å; F58-Y122 HydrophobicContact CE2-CG 3.91Å; F58-Y122 VanDerWaalsContact CZ-CB 3.4Å; F58-Y122 HydrophobicContact CZ-CD2 4.23Å; F58-Y122 HydrophobicContact CZ-CG 4.01Å; F58-Y122 PolarHBondContact N-O 3.44Å; F58-Y122 PolarHBondContact O-N 3.36Å; V60-Y122 HydrophobicContact CB-CE2 4.24Å; V60-Y122 HydrophobicContact CG2-CD2 4.02Å; V60-Y122 HydrophobicContact CG2-CE2 3.84Å; V120-Y122 HydrophobicContact CB-CE2 3.87Å; V120-Y122 HydrophobicContact CG1-CD2 4.49Å; V120-Y122 HydrophobicContact CG1-CE1 4.28Å; V120-Y122 HydrophobicContact CG1-CE2 3.74Å; V120-Y122 WeakPolarHBondContact O-CE2 3.46Å; Y122-F126 AromaticContact CD1-CD1 3.9Å; Y122-F126 HydrophobicContact CD1-CD1 3.9Å; Y122-F126 HydrophobicContact CD1-CD2 4.47Å; Y122-F126 HydrophobicContact CD1-CE1 4.18Å; Y122-F126 HydrophobicContact CD1-CG 4.05Å; Y122-V292 HydrophobicContact CD1-CG1 4.5Å; Y122-V292 HydrophobicContact CD1-CG2 3.85Å; Y122-V292 HydrophobicContact CD2-CG1 4.28Å; Y122-V292 HydrophobicContact CE1-CB 4.49Å; Y122-V292 HydrophobicContact CE1-CG1 4.14Å; Y122-V292 HydrophobicContact CE1-CG2 3.97Å; Y122-V292 HydrophobicContact CE2-CG1 3.9Å; Y122-V292 HydrophobicContact CG-CG2 4.29Å; Y122-P293 WeakPolarHBondContact OH-CD 3.46Å
123	G	88.3	Confident	87.7	Confident	10 Å²	10	17.3 Å²	17.3	10%	0.103	10%	0.099	C	C	.	.			trans	-77.8	-178.8	176.6	0	0	0	0	0	113.7	F58 E125	F58-G123 WeakPolarHBondContact CE1-O 3.14Å; G123-E125 VanDerWaalsContact C-N 3.29Å; G123-E125 WeakPolarHBondContact CA-OE1 3.43Å; G123-E125 PolarHBondContact O-N 3.42Å
124	S	85.1	Confident	87.1	Confident	36 Å²	36	25.2 Å²	25.2	25%	0.252	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-25.2	179.4	34.5	0	0	0	0	114.5	F126 P180	S124-F126 VanDerWaalsContact C-N 3.29Å; S124-P180 WeakPolarHBondContact O-CB 3.19Å
125	E	85.5	Confident	86.1	Confident	74 Å²	74	24 Å²	24	35%	0.346	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-16.7	-175.1	56.3	-75.7	171.8	0	0	112.8	G123 W290	G123-E125 VanDerWaalsContact C-N 3.29Å; G123-E125 WeakPolarHBondContact CA-OE1 3.43Å; G123-E125 PolarHBondContact O-N 3.42Å; E125-W290 HydrophobicContact CB-CD2 4.21Å; E125-W290 HydrophobicContact CB-CZ2 4.24Å; E125-W290 HydrophobicContact CG-CD2 3.87Å; E125-W290 HydrophobicContact CG-CE3 3.83Å; E125-W290 HydrophobicContact CG-CH2 3.86Å; E125-W290 HydrophobicContact CG-CZ2 3.91Å; E125-W290 HydrophobicContact CG-CZ3 3.81Å
126	F	88.7	Confident	84.8	Confident	40 Å²	40	26 Å²	26	18%	0.175	14%	0.136	C	C	.	.	S	Bend	trans	-83.9	144.9	-178.9	-69.2	-92.8	0	0	0	112	F58 Y122 S124 W290 V292	F58-F126 HydrophobicContact CE1-CB 4.28Å; F58-F126 HydrophobicContact CZ-CB 4.06Å; Y122-F126 AromaticContact CD1-CD1 3.9Å; Y122-F126 HydrophobicContact CD1-CD1 3.9Å; Y122-F126 HydrophobicContact CD1-CD2 4.47Å; Y122-F126 HydrophobicContact CD1-CE1 4.18Å; Y122-F126 HydrophobicContact CD1-CG 4.05Å; S124-F126 VanDerWaalsContact C-N 3.29Å; F126-W290 HydrophobicContact CD1-CB 4.02Å; F126-W290 HydrophobicContact CD1-CE3 4.21Å; F126-W290 HydrophobicContact CD2-CE3 4.34Å; F126-W290 HydrophobicContact CE1-CB 4.43Å; F126-W290 AromaticContact CE1-CE3 3.69Å; F126-W290 HydrophobicContact CE1-CE3 3.69Å; F126-W290 HydrophobicContact CE1-CZ3 4.43Å; F126-W290 AromaticContact CE2-CE3 3.82Å; F126-W290 HydrophobicContact CE2-CE3 3.82Å; F126-W290 HydrophobicContact CE2-CZ3 4.03Å; F126-W290 HydrophobicContact CG-CB 4.47Å; F126-W290 AromaticContact CZ-CE3 3.47Å; F126-W290 HydrophobicContact CZ-CE3 3.47Å; F126-W290 VanDerWaalsContact CZ-CE3 3.47Å; F126-W290 AromaticContact CZ-CZ3 3.79Å; F126-W290 HydrophobicContact CZ-CZ3 3.79Å; F126-V292 HydrophobicContact CB-CG2 3.72Å; F126-V292 HydrophobicContact CD1-CG2 3.71Å; F126-V292 HydrophobicContact CG-CG2 4.13Å
127	P	89.8	Confident	83.4	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.161	C	C	.	.			trans	-66.2	143.4	169.9	28.6	-34	0	0	0	110.9	P129 L201 V281 V292	P127-P129 VanDerWaalsContact O-CD 3.32Å; P127-P129 WeakPolarHBondContact O-CD 3.22Å; P127-L201 HydrophobicContact CB-CD2 3.89Å; P127-V281 HydrophobicContact CB-CG1 4.23Å; P127-V281 HydrophobicContact CB-CG2 4.19Å; P127-V281 HydrophobicContact CG-CG1 3.94Å; P127-V281 HydrophobicContact CG-CG2 4.21Å; P127-V292 HydrophobicContact CG-CG2 4.21Å; P127-V292 WeakPolarHBondContact O-CG2 3.35Å
128	L	89.1	Confident	82	Confident	3 Å²	3	36.6 Å²	36.6	2%	0.016	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-95.9	108.1	-179	175.1	62.5	0	0	0	109.8	F58 A92 F94 G130 G131 I141 A177 S178 F186	F58-L128 HydrophobicContact CB-CD1 4.21Å; F58-L128 HydrophobicContact CD1-CD1 4.16Å; F58-L128 HydrophobicContact CD2-CD1 3.49Å; F58-L128 VanDerWaalsContact CD2-CD1 3.49Å; F58-L128 HydrophobicContact CE1-CD1 4.38Å; F58-L128 HydrophobicContact CE2-CD1 3.75Å; F58-L128 HydrophobicContact CG-CD1 3.7Å; F58-L128 HydrophobicContact CZ-CB 4.45Å; F58-L128 HydrophobicContact CZ-CD1 4.17Å; A92-L128 HydrophobicContact CB-CD1 4.15Å; F94-L128 HydrophobicContact CE1-CD2 3.97Å; F94-L128 HydrophobicContact CZ-CD2 3.78Å; L128-G130 PolarHBondContact O-N 3.34Å; L128-G131 PolarHBondContact O-N 3.11Å; L128-I141 HydrophobicContact CD1-CD1 3.91Å; L128-I141 HydrophobicContact CD2-CD1 3.32Å; L128-I141 HydrophobicContact CG-CD1 3.8Å; L128-A177 VanDerWaalsContact O-CA 3.29Å; L128-A177 WeakPolarHBondContact O-CA 3.49Å; L128-A177 WeakPolarHBondContact O-CB 3.15Å; L128-S178 WeakPolarHBondContact CB-OG 3.42Å; L128-S178 PolarHBondContact N-O 3.27Å; L128-S178 VanDerWaalsContact N-O 3.15Å; L128-S178 PolarHBondContact O-N 3.47Å; L128-F186 HydrophobicContact CB-CD1 3.65Å; L128-F186 HydrophobicContact CB-CE1 3.79Å; L128-F186 HydrophobicContact CB-CG 4.27Å; L128-F186 HydrophobicContact CD2-CB 4.24Å; L128-F186 HydrophobicContact CD2-CD1 4.03Å; L128-F186 HydrophobicContact CD2-CD2 3.97Å; L128-F186 HydrophobicContact CD2-CE1 4.39Å; L128-F186 HydrophobicContact CD2-CE2 4.34Å; L128-F186 HydrophobicContact CD2-CG 3.8Å
129	P	89.3	Confident	80.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	136.3	-179.9	24.7	-34.2	0	0	0	110.3	V60 P127 G131 I141 T143 V292 Y294	V60-P129 HydrophobicContact CG2-CG 4.07Å; P127-P129 VanDerWaalsContact O-CD 3.32Å; P127-P129 WeakPolarHBondContact O-CD 3.22Å; P129-G131 PolarHBondContact O-N 3.16Å; P129-G131 VanDerWaalsContact O-N 3.12Å; P129-I141 WeakPolarHBondContact O-CG2 3.33Å; P129-T143 HydrophobicContact CB-CG2 4.09Å; P129-T143 HydrophobicContact CG-CG2 3.79Å; P129-T143 WeakPolarHBondContact O-CG2 3.49Å; P129-V292 HydrophobicContact CG-CG1 3.83Å; P129-Y294 WeakPolarHBondContact CA-OH 3.14Å; P129-Y294 HydrophobicContact CB-CD1 4Å; P129-Y294 HydrophobicContact CB-CD2 3.92Å; P129-Y294 HydrophobicContact CB-CE1 3.69Å; P129-Y294 HydrophobicContact CB-CE2 3.62Å; P129-Y294 HydrophobicContact CB-CG 4.09Å; P129-Y294 VanDerWaalsContact CB-CZ 3.48Å
130	G	85.4	Confident	80.2	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.01	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	1.5	179.9	0	0	0	0	0	117	L128 C132 G133 I141 N142 A176 Y294	L128-G130 PolarHBondContact O-N 3.34Å; G130-C132 PolarHBondContact O-N 3.04Å; G130-G133 PolarHBondContact O-N 2.93Å; G130-I141 WeakPolarHBondContact O-CG2 3.48Å; G130-N142 WeakPolarHBondContact CA-O 3.27Å; G130-A176 CarbonylContact C-O 3.51Å; G130-A176 WeakPolarHBondContact CA-O 3.48Å; G130-Y294 PolarHBondContact N-OH 2.99Å
131	G	83.5	Confident	79.9	Confident	11 Å²	11	41 Å²	41	11%	0.113	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-4.5	-175.3	0	0	0	0	0	116	L128 P129 S136 A176	L128-G131 PolarHBondContact O-N 3.11Å; P129-G131 PolarHBondContact O-N 3.16Å; P129-G131 VanDerWaalsContact O-N 3.12Å; G131-S136 PolarHBondContact O-OG 3.26Å; G131-A176 PolarHBondContact N-O 2.73Å
132	C	80.9	Confident	79.7	Confident	10 Å²	10	41.2 Å²	41.2	7%	0.068	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.4	8.5	175.1	-65.2	0	0	0	0	114.6	G130 A176 A177 C188	G130-C132 PolarHBondContact O-N 3.04Å; C132-A176 HydrophobicContact CB-CB 4.02Å; C132-A176 WeakPolarHBondContact CB-O 3.27Å; C132-A176 PolarHBondContact N-O 3.02Å; C132-A177 PolarHBondContact SG-O 3.05Å; C132-C188 WeakPolarHBondContact CA-SG 3.43Å; C132-C188 HydrophobicContact CB-CB 4.01Å; C132-C188 WeakPolarHBondContact CB-SG 3.38Å; C132-C188 WeakPolarHBondContact SG-CA 3.09Å; C132-C188 WeakPolarHBondContact SG-CB 3.06Å; C132-C188 CovalentContact SG-SG 2.03Å; C132-C188 PolarHBondContact SG-SG 3.19Å
133	G	75.5	Confident	79.5	Confident	3 Å²	3	39.9 Å²	39.9	3%	0.031	21%	0.206	C	C	.	.	S	Bend	trans	-64.3	151.7	176.4	0	0	0	0	0	112.1	G130 S135 S136	G130-G133 PolarHBondContact O-N 2.93Å; G133-S135 PolarHBondContact O-N 3.42Å; G133-S135 VanDerWaalsContact O-N 3.13Å; G133-S136 VanDerWaalsContact O-CB 3.32Å; G133-S136 WeakPolarHBondContact O-CB 3.45Å; G133-S136 PolarHBondContact O-N 3.3Å; G133-S136 PolarHBondContact O-OG 2.92Å
134	R	68.7	Low	79.4	Confident	179 Å²	179	39.4 Å²	39.4	68%	0.675	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-29.3	177.4	-72.3	-175.3	176.4	169.2	2.4	113.5	D260 F262	R134-D260 IonicContact CZ-OD1 2.85Å; R134-D260 PolarHBondContact NE-O 2.99Å; R134-D260 IonicContact NH2-OD1 2.74Å; R134-D260 PolarHBondContact NH2-OD1 3.39Å; R134-F262 HydrophobicContact CG-CE2 4.38Å
135	S	64.3	Low	79.4	Confident	42 Å²	42	37.9 Å²	37.9	29%	0.294	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	3.3	177.1	53.1	0	0	0	0	114.2	G133 R137	G133-S135 PolarHBondContact O-N 3.42Å; G133-S135 VanDerWaalsContact O-N 3.13Å; S135-R137 PolarHBondContact O-N 3.05Å
136	S	62.9	Low	79.1	Confident	42 Å²	42	37.7 Å²	37.7	29%	0.294	19%	0.192	S	C	.	.			trans	-67.8	104.9	176	60.9	0	0	0	0	109.9	G131 G133 F140	G131-S136 PolarHBondContact O-OG 3.26Å; G133-S136 VanDerWaalsContact O-CB 3.32Å; G133-S136 WeakPolarHBondContact O-CB 3.45Å; G133-S136 PolarHBondContact O-N 3.3Å; G133-S136 PolarHBondContact O-OG 2.92Å; S136-F140 WeakPolarHBondContact CA-O 3.21Å
137	R	63.3	Low	78.3	Confident	158 Å²	158	38.4 Å²	38.4	60%	0.596	20%	0.199	S	C	*	.	B	Isolated β-bridge	trans	-112.3	173.2	170.1	-71.1	-165.9	-178.7	154.6	14.6	109.1	D81 S135 D139 F140	D81-R137 IonicContact OD2-CZ 3.65Å; D81-R137 IonicContact OD2-NH1 2.77Å; D81-R137 PolarHBondContact OD2-NH1 3.26Å; D81-R137 IonicContact OD2-NH2 2.74Å; D81-R137 PolarHBondContact OD2-NH2 2.95Å; S135-R137 PolarHBondContact O-N 3.05Å; R137-D139 PolarHBondContact O-N 3.34Å; R137-F140 PolarHBondContact N-O 2.92Å; R137-F140 VanDerWaalsContact N-O 3.08Å; R137-F140 PolarHBondContact O-N 2.97Å
138	S	64.7	Low	77.1	Confident	86 Å²	86	41.1 Å²	41.1	60%	0.601	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-23.4	-177.5	59.2	0	0	0	0	114.3	F94	F94-S138 WeakPolarHBondContact CD2-O 3.24Å; F94-S138 WeakPolarHBondContact CE2-O 3.47Å
139	D	69.3	Low	75.7	Confident	110 Å²	110	43 Å²	43	59%	0.588	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.1	-6.4	-171.5	-55.6	-3.9	0	0	0	113.2	T74 R137	T74-D139 PolarHBondContact OG1-O 3.38Å; R137-D139 PolarHBondContact O-N 3.34Å
140	F	78	Confident	73.9	Confident	8 Å²	8	43.2 Å²	43.2	4%	0.035	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-145.6	127	-173.7	178.4	-95.1	0	0	0	112.1	T74 D81 T82 L91 S136 R137 N142	T74-F140 HydrophobicContact CG2-CD2 4.34Å; D81-F140 WeakPolarHBondContact O-CD1 2.93Å; D81-F140 VanDerWaalsContact O-CG 3.29Å; D81-F140 WeakPolarHBondContact O-CG 3.3Å; T82-F140 VanDerWaalsContact CA-CD2 3.46Å; T82-F140 WeakPolarHBondContact O-CD2 3.46Å; T82-F140 WeakPolarHBondContact O-CE2 3.23Å; L91-F140 HydrophobicContact CD1-CE2 4.24Å; L91-F140 HydrophobicContact CD2-CD2 4.2Å; L91-F140 HydrophobicContact CD2-CE2 3.23Å; L91-F140 HydrophobicContact CD2-CZ 3.63Å; L91-F140 HydrophobicContact CG-CE2 4.26Å; S136-F140 WeakPolarHBondContact CA-O 3.21Å; R137-F140 PolarHBondContact N-O 2.92Å; R137-F140 VanDerWaalsContact N-O 3.08Å; R137-F140 PolarHBondContact O-N 2.97Å; F140-N142 HydrophobicContact CE1-CB 4.31Å
141	I	85.1	Confident	71.9	Confident	5 Å²	5	48 Å²	48	3%	0.026	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	131	176.1	-61.9	170.6	0	0	0	108.6	L91 A92 F94 L128 P129 G130 T143	L91-I141 CarbonylContact C-O 3.6Å; L91-I141 WeakPolarHBondContact CA-O 3.3Å; A92-I141 HydrophobicContact CB-CB 4.03Å; A92-I141 HydrophobicContact CB-CG2 4.31Å; A92-I141 PolarHBondContact N-O 3.34Å; A92-I141 PolarHBondContact O-N 3.18Å; A92-I141 VanDerWaalsContact O-N 3.11Å; F94-I141 HydrophobicContact CE2-CD1 3.8Å; F94-I141 HydrophobicContact CZ-CD1 3.78Å; L128-I141 HydrophobicContact CD1-CD1 3.91Å; L128-I141 HydrophobicContact CD2-CD1 3.32Å; L128-I141 HydrophobicContact CG-CD1 3.8Å; P129-I141 WeakPolarHBondContact O-CG2 3.33Å; G130-I141 WeakPolarHBondContact O-CG2 3.48Å; I141-T143 HydrophobicContact CG2-CG2 4.43Å
142	N	85.7	Confident	69.8	Low	19 Å²	19	54.1 Å²	54.1	10%	0.102	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	114	178.1	178.6	11.4	0	0	0	110.7	Q84 G90 G130 F140 A144	Q84-N142 PolarHBondContact NE2-OD1 3.07Å; G90-N142 PolarHBondContact O-OD1 2.9Å; G130-N142 WeakPolarHBondContact CA-O 3.27Å; F140-N142 HydrophobicContact CE1-CB 4.31Å; N142-A144 WeakPolarHBondContact OD1-CB 3.49Å; N142-A144 PolarHBondContact OD1-N 2.88Å
143	T	86.4	Confident	67.8	Low	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.302	C	S	.	.			trans	-106.8	10.1	177.2	72.6	0	0	0	0	112.9	V60 G90 L91 A92 P129 I141 Y294 T295	V60-T143 HydrophobicContact CG1-CG2 4.3Å; G90-T143 VanDerWaalsContact CA-OG1 3.28Å; G90-T143 WeakPolarHBondContact CA-OG1 3.01Å; G90-T143 PolarHBondContact O-N 3.43Å; G90-T143 PolarHBondContact O-OG1 3.18Å; L91-T143 PolarHBondContact N-OG1 3.17Å; A92-T143 HydrophobicContact CB-CG2 3.58Å; P129-T143 HydrophobicContact CB-CG2 4.09Å; P129-T143 HydrophobicContact CG-CG2 3.79Å; P129-T143 WeakPolarHBondContact O-CG2 3.49Å; I141-T143 HydrophobicContact CG2-CG2 4.43Å; T143-Y294 VanDerWaalsContact O-CD1 3.3Å; T143-Y294 WeakPolarHBondContact O-CD1 3.32Å; T143-T295 PolarHBondContact O-N 3.34Å; T143-T295 VanDerWaalsContact O-N 3.12Å; T143-T295 PolarHBondContact OG1-OG1 3.35Å
144	A	86.2	Confident	66.2	Low	1 Å²	1	61 Å²	61	1%	0.008	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-80.6	152	176	0	0	0	0	0	111.7	G90 N142	G90-A144 PolarHBondContact O-N 2.88Å; N142-A144 WeakPolarHBondContact OD1-CB 3.49Å; N142-A144 PolarHBondContact OD1-N 2.88Å
145	I	84.9	Confident	64.9	Low	3 Å²	3	60.6 Å²	60.6	2%	0.015	32%	0.323	C	S	.	.			trans	-97.3	114.7	169.1	-56.8	162.9	0	0	0	106.5	L172 F174 V279 T295 V297	I145-L172 HydrophobicContact CG2-CB 4.29Å; I145-L172 HydrophobicContact CG2-CD2 4.07Å; I145-F174 HydrophobicContact CG1-CB 4.34Å; I145-V279 HydrophobicContact CD1-CB 4.09Å; I145-V279 HydrophobicContact CD1-CG2 3.74Å; I145-V279 HydrophobicContact CG1-CG2 4.42Å; I145-T295 WeakPolarHBondContact CD1-O 3.41Å; I145-V297 HydrophobicContact CB-CB 4.27Å; I145-V297 HydrophobicContact CB-CG1 3.77Å; I145-V297 HydrophobicContact CD1-CG1 4.34Å; I145-V297 HydrophobicContact CG2-CG1 3.81Å; I145-V297 WeakPolarHBondContact O-CG2 3.08Å
146	N	79.6	Confident	63.9	Low	71 Å²	71	60.4 Å²	60.4	38%	0.38	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	130.1	172.3	-72.2	-5.3	0	0	0	108.7	Q173	N146-Q173 HydrophobicContact CB-CB 4.41Å; N146-Q173 PolarHBondContact N-O 3.36Å; N146-Q173 PolarHBondContact O-N 3.34Å
147	T	72.7	Confident	63.2	Low	54 Å²	54	64.9 Å²	64.9	33%	0.331	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	115.2	170.1	59.1	0	0	0	0	107.2	L172 V297 L299	T147-L172 HydrophobicContact CG2-CD2 3.74Å; T147-V297 HydrophobicContact CG2-CG1 3.84Å; T147-V297 HydrophobicContact CG2-CG2 3.97Å; T147-L299 HydrophobicContact CG2-CD1 3.89Å
148	D	64.2	Low	62.5	Low	58 Å²	58	58.9 Å²	58.9	31%	0.31	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	142.7	174.5	-159.4	0.6	0	0	0	109.5	S170 A171	D148-S170 WeakPolarHBondContact O-CA 3.5Å; D148-A171 PolarHBondContact N-O 2.94Å; D148-A171 PolarHBondContact O-N 3.19Å
149	I	58.7	Low	61.7	Low	41 Å²	41	58.2 Å²	58.2	21%	0.21	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	138	165	-60.7	169.2	0	0	0	105.1	T151 P303	I149-T151 HydrophobicContact CB-CG2 4.31Å; I149-T151 HydrophobicContact CG2-CG2 4.02Å; I149-T151 PolarHBondContact O-N 3.29Å; I149-T151 PolarHBondContact O-OG1 3.49Å; I149-P303 HydrophobicContact CD1-CB 3.61Å
150	M	51.4	Low	60.7	Low	5 Å²	5	57.7 Å²	57.7	3%	0.025	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	68.6	174.3	-77	-179.7	84.1	0	0	110.5	I154 I162 S166 T169 A171 I266	M150-I154 HydrophobicContact CE-CD1 3.52Å; M150-I154 HydrophobicContact CG-CD1 4.44Å; M150-I162 HydrophobicContact CB-CG2 4.44Å; M150-I162 HydrophobicContact CE-CG2 4.05Å; M150-S166 WeakPolarHBondContact O-CB 3.29Å; M150-T169 WeakPolarHBondContact SD-CB 3.32Å; M150-T169 HydrophobicContact SD-CG2 4.35Å; M150-T169 PolarHBondContact SD-OG1 2.87Å; M150-A171 HydrophobicContact CG-CB 4.43Å; M150-I266 HydrophobicContact CE-CD1 3.9Å; M150-I266 HydrophobicContact CE-CG1 4.28Å; M150-I266 HydrophobicContact CE-CG2 4.24Å; M150-I266 HydrophobicContact SD-CG1 4.38Å; M150-I266 HydrophobicContact SD-CG2 3.48Å; M150-I266 WeakPolarHBondContact SD-CG2 3.4Å
151	T	43.5	Very low	59.4	Low	103 Å²	103	62.8 Å²	62.8	63%	0.632	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-25.3	164.1	56.4	0	0	0	0	109.8	I149	I149-T151 HydrophobicContact CB-CG2 4.31Å; I149-T151 HydrophobicContact CG2-CG2 4.02Å; I149-T151 PolarHBondContact O-N 3.29Å; I149-T151 PolarHBondContact O-OG1 3.49Å
152	K	40	Very low	57.7	Low	139 Å²	139	62.8 Å²	62.8	60%	0.604	34%	0.337	S	S	*	.	S	Bend	trans	-79.5	124.4	-178.5	-141.9	172.6	-174.8	178.5	0	110.1	I154	K152-I154 VanDerWaalsContact C-N 3.29Å; K152-I154 PolarHBondContact O-N 2.84Å
153	N	38.4	Very low	56	Low	110 Å²	110	69.2 Å²	69.2	59%	0.588	37%	0.367	S	S	*	.			trans	-54.6	91.7	168.2	-66	-21.4	0	0	0	108.8
154	I	41.6	Very low	54.5	Low	47 Å²	47	73.1 Å²	73.1	24%	0.241	38%	0.384	C	S	.	.			trans	-67	135.4	158.6	-69.7	157.4	0	0	0	104.8	M150 K152 L156 I162 I266	M150-I154 HydrophobicContact CE-CD1 3.52Å; M150-I154 HydrophobicContact CG-CD1 4.44Å; K152-I154 VanDerWaalsContact C-N 3.29Å; K152-I154 PolarHBondContact O-N 2.84Å; I154-L156 HydrophobicContact CB-CD1 3.97Å; I154-L156 HydrophobicContact CG2-CD1 3.61Å; I154-L156 HydrophobicContact CG2-CG 4.05Å; I154-L156 PolarHBondContact O-N 3.25Å; I154-I162 WeakPolarHBondContact O-CD1 3.26Å; I154-I266 HydrophobicContact CD1-CD1 4.34Å; I154-I266 HydrophobicContact CD1-CG1 4.38Å
155	D	41.9	Very low	53.3	Low	170 Å²	170	73.2 Å²	73.2	91%	0.909	38%	0.384	S	S	*	.	S	Bend	trans	-64.6	53.8	176.8	-81.6	-28.3	0	0	0	112.1
156	L	43.2	Very low	52.1	Low	38 Å²	38	74.2 Å²	74.2	20%	0.199	39%	0.392	C	S	.	.	S	Bend	trans	-80.9	136.1	157.7	-70.7	136.8	0	0	0	105.4	I154 S158 I162 I662	I154-L156 HydrophobicContact CB-CD1 3.97Å; I154-L156 HydrophobicContact CG2-CD1 3.61Å; I154-L156 HydrophobicContact CG2-CG 4.05Å; I154-L156 PolarHBondContact O-N 3.25Å; L156-S158 CarbonylContact O-C 3.49Å; L156-S158 PolarHBondContact O-N 3.31Å; L156-I162 HydrophobicContact CB-CD1 4.25Å; L156-I162 HydrophobicContact CD1-CD1 4.31Å; L156-I662 HydrophobicContact CD2-CG1 4.28Å
157	S	49.3	Very low	51.3	Low	137 Å²	137	75.8 Å²	75.8	96%	0.958	39%	0.393	S	S	*	.	S	Bend	trans	-40.1	-12.3	-172.7	58.3	0	0	0	0	118.9
158	S	47.6	Very low	51	Low	32 Å²	32	75.3 Å²	75.3	22%	0.224	39%	0.385	C	S	.	.			trans	-137.9	112.8	172.2	178.1	0	0	0	0	110.8	L156 K160	L156-S158 CarbonylContact O-C 3.49Å; L156-S158 PolarHBondContact O-N 3.31Å; S158-K160 PolarHBondContact O-N 3.18Å
159	P	48.1	Very low	51.3	Low	71 Å²	71	72.6 Å²	72.6	46%	0.461	37%	0.371	S	S	.	.	H	α-helix	trans	-63.6	-28.4	175.5	24	-32.4	0	0	0	112.4	I162	P159-I162 WeakPolarHBondContact O-CB 3.4Å; P159-I162 PolarHBondContact O-N 3.13Å
160	K	49.1	Very low	52.1	Low	99 Å²	99	70.8 Å²	70.8	43%	0.43	36%	0.362	S	S	.	.	H	α-helix	trans	-72.7	-32.9	-174.2	-62.8	-170.9	-179.7	-169.9	0	114	S158 I162 E386	S158-K160 PolarHBondContact O-N 3.18Å; K160-I162 PolarHBondContact O-N 2.69Å; K160-E386 HydrophobicContact CD-CG 4.05Å; K160-E386 WeakPolarHBondContact CD-OE1 3.5Å; K160-E386 WeakPolarHBondContact CE-OE1 3.37Å; K160-E386 IonicContact NZ-OE1 3.05Å; K160-E386 PolarHBondContact NZ-OE1 3.03Å; K160-E386 IonicContact NZ-OE2 3.1Å; K160-E386 PolarHBondContact NZ-OE2 2.92Å
161	R	49.6	Very low	53.3	Low	116 Å²	116	70.6 Å²	70.6	44%	0.438	36%	0.361	S	S	.	.	H	α-helix	trans	-67.5	-22.1	175.9	-72.3	-171.9	-163.1	177.2	7.5	113
162	I	49.5	Very low	55	Low	4 Å²	4	65.7 Å²	65.7	2%	0.021	33%	0.331	C	S	.	.	H	α-helix	trans	-73.9	-38.7	-175	-56.3	174	0	0	0	110.6	M150 I154 L156 P159 K160 F164 L165 S166	M150-I162 HydrophobicContact CB-CG2 4.44Å; M150-I162 HydrophobicContact CE-CG2 4.05Å; I154-I162 WeakPolarHBondContact O-CD1 3.26Å; L156-I162 HydrophobicContact CB-CD1 4.25Å; L156-I162 HydrophobicContact CD1-CD1 4.31Å; P159-I162 WeakPolarHBondContact O-CB 3.4Å; P159-I162 PolarHBondContact O-N 3.13Å; K160-I162 PolarHBondContact O-N 2.69Å; I162-F164 VanDerWaalsContact C-N 3.27Å; I162-F164 PolarHBondContact O-N 3.35Å; I162-L165 CarbonylContact O-C 3.48Å; I162-L165 PolarHBondContact O-N 3.22Å; I162-L165 VanDerWaalsContact O-N 3.12Å; I162-S166 PolarHBondContact O-N 3.18Å
163	E	50.8	Low	57.1	Low	155 Å²	155	61.1 Å²	61.1	72%	0.724	31%	0.312	S	S	*	.	H	α-helix	trans	-60.7	-37.4	-178.1	-166.9	173.8	-172.4	0	0	112	S166	E163-S166 WeakPolarHBondContact O-CB 3.33Å; E163-S166 PolarHBondContact O-N 2.99Å; E163-S166 PolarHBondContact O-OG 3.21Å
164	F	54.8	Low	59.4	Low	82 Å²	82	56 Å²	56	36%	0.36	28%	0.284	S	S	.	.	H	α-helix	trans	-69.5	-38.8	175.4	-73.5	-75.9	0	0	0	113.8	I162 P387	I162-F164 VanDerWaalsContact C-N 3.27Å; I162-F164 PolarHBondContact O-N 3.35Å; F164-P387 HydrophobicContact CE1-CB 4.07Å; F164-P387 HydrophobicContact CE1-CG 3.62Å; F164-P387 HydrophobicContact CE2-CG 4.41Å; F164-P387 HydrophobicContact CZ-CB 3.85Å; F164-P387 VanDerWaalsContact CZ-CD 3.41Å; F164-P387 HydrophobicContact CZ-CG 3.34Å
165	L	60.6	Low	61.5	Low	2 Å²	2	53.8 Å²	53.8	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-74.8	-20.2	177.3	-73.6	170.2	0	0	0	111.9	I162 Y167 W168 T169 L655 C659 I662	I162-L165 CarbonylContact O-C 3.48Å; I162-L165 PolarHBondContact O-N 3.22Å; I162-L165 VanDerWaalsContact O-N 3.12Å; L165-Y167 PolarHBondContact O-N 2.94Å; L165-W168 CarbonylContact O-C 3.57Å; L165-W168 WeakPolarHBondContact O-CA 3.07Å; L165-W168 PolarHBondContact O-N 2.74Å; L165-T169 HydrophobicContact CB-CG2 4.42Å; L165-T169 PolarHBondContact O-N 3.25Å; L165-T169 PolarHBondContact O-OG1 3.02Å; L165-L655 HydrophobicContact CD2-CD2 4.08Å; L165-C659 HydrophobicContact CD1-CB 4.16Å; L165-C659 HydrophobicContact CD2-CB 4.28Å; L165-I662 HydrophobicContact CD1-CB 3.93Å; L165-I662 HydrophobicContact CD1-CD1 3.55Å; L165-I662 HydrophobicContact CD1-CG1 4.32Å; L165-I662 HydrophobicContact CD1-CG2 3.8Å
166	S	60.7	Low	63.6	Low	25 Å²	25	46 Å²	46	18%	0.175	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-49.2	-37.6	-177.2	75	0	0	0	0	112.6	M150 I162 E163 W168 R269	M150-S166 WeakPolarHBondContact O-CB 3.29Å; I162-S166 PolarHBondContact O-N 3.18Å; E163-S166 WeakPolarHBondContact O-CB 3.33Å; E163-S166 PolarHBondContact O-N 2.99Å; E163-S166 PolarHBondContact O-OG 3.21Å; S166-W168 VanDerWaalsContact C-N 3.32Å; S166-W168 PolarHBondContact O-N 3.24Å; S166-R269 PolarHBondContact O-NH2 2.91Å
167	Y	61.7	Low	65.7	Low	103 Å²	103	44.2 Å²	44.2	40%	0.404	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-67.3	-30.3	178.9	-168.2	-96	0	0	0	113.3	L165 R269 P271 P303	L165-Y167 PolarHBondContact O-N 2.94Å; Y167-R269 PolarHBondContact O-NH2 3.4Å; Y167-P271 HydrophobicContact CE1-CG 3.97Å; Y167-P303 HydrophobicContact CE2-CG 4.34Å
168	W	66.5	Low	67.5	Low	45 Å²	45	37.8 Å²	37.8	17%	0.17	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-106.5	-1	-173.9	-58.3	101.1	0	0	0	113.9	L165 S166 R269 P271 I651 L655 R663	L165-W168 CarbonylContact O-C 3.57Å; L165-W168 WeakPolarHBondContact O-CA 3.07Å; L165-W168 PolarHBondContact O-N 2.74Å; S166-W168 VanDerWaalsContact C-N 3.32Å; S166-W168 PolarHBondContact O-N 3.24Å; W168-R269 PolarHBondContact O-N 3.3Å; W168-P271 HydrophobicContact CE3-CG 4.25Å; W168-P271 HydrophobicContact CH2-CG 4.04Å; W168-P271 VanDerWaalsContact CZ3-CD 3.46Å; W168-P271 HydrophobicContact CZ3-CG 3.6Å; W168-I651 HydrophobicContact CH2-CD1 4.23Å; W168-I651 HydrophobicContact CH2-CG2 4.06Å; W168-I651 HydrophobicContact CZ2-CG2 4.1Å; W168-I651 HydrophobicContact CZ3-CG2 4.34Å; W168-L655 HydrophobicContact CB-CD1 4.18Å; W168-L655 HydrophobicContact CD2-CD1 4.25Å; W168-L655 HydrophobicContact CG-CD1 3.95Å; W168-R663 PolarHBondContact O-NH1 3.26Å; W168-R663 VanDerWaalsContact O-NH1 3.07Å
169	T	71.6	Confident	69.3	Low	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	146.8	-179.1	56.4	0	0	0	0	111.5	M150 L165 I266 V267 R269 R663 T666	M150-T169 WeakPolarHBondContact SD-CB 3.32Å; M150-T169 HydrophobicContact SD-CG2 4.35Å; M150-T169 PolarHBondContact SD-OG1 2.87Å; L165-T169 HydrophobicContact CB-CG2 4.42Å; L165-T169 PolarHBondContact O-N 3.25Å; L165-T169 PolarHBondContact O-OG1 3.02Å; T169-I266 HydrophobicContact CG2-CG2 4.37Å; T169-V267 CarbonylContact C-O 3.45Å; T169-V267 WeakPolarHBondContact CA-O 3.29Å; T169-R269 PolarHBondContact O-NE 3.13Å; T169-R269 PolarHBondContact O-NH2 3.46Å; T169-R663 VanDerWaalsContact CG2-NH1 3.35Å; T169-T666 HydrophobicContact CG2-CG2 4.06Å
170	S	74	Confident	71	Confident	3 Å²	3	34 Å²	34	2%	0.021	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	160	171.8	46	0	0	0	0	109.3	D148 I266 V267 R269	D148-S170 WeakPolarHBondContact O-CA 3.5Å; S170-I266 CarbonylContact O-C 3.59Å; S170-I266 WeakPolarHBondContact O-CA 3.29Å; S170-V267 PolarHBondContact N-O 3.26Å; S170-V267 PolarHBondContact O-N 3.32Å; S170-V267 PolarHBondContact OG-O 3.43Å; S170-R269 VanDerWaalsContact OG-CG 3.28Å; S170-R269 WeakPolarHBondContact OG-CG 3.47Å
171	A	76.2	Confident	72.3	Confident	2 Å²	2	32.6 Å²	32.6	2%	0.017	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.8	173.1	0	0	0	0	0	109.2	D148 M150 Q173 N264 I265	D148-A171 PolarHBondContact N-O 2.94Å; D148-A171 PolarHBondContact O-N 3.19Å; M150-A171 HydrophobicContact CG-CB 4.43Å; A171-Q173 HydrophobicContact CB-CG 4.19Å; A171-N264 WeakPolarHBondContact CB-OD1 3.34Å; A171-I265 WeakPolarHBondContact CA-O 3.5Å
172	L	80.8	Confident	73.2	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	113.1	161.3	-62.4	178.9	0	0	0	107.3	I145 T147 N264 I265 V267 I277 L299	I145-L172 HydrophobicContact CG2-CB 4.29Å; I145-L172 HydrophobicContact CG2-CD2 4.07Å; T147-L172 HydrophobicContact CG2-CD2 3.74Å; L172-N264 WeakPolarHBondContact O-CA 3.33Å; L172-I265 HydrophobicContact CB-CB 4.39Å; L172-I265 PolarHBondContact N-O 3.2Å; L172-I265 PolarHBondContact O-N 3.23Å; L172-V267 HydrophobicContact CD1-CG2 3.6Å; L172-V267 HydrophobicContact CG-CG2 3.62Å; L172-I277 HydrophobicContact CD1-CD1 4.12Å; L172-I277 HydrophobicContact CD1-CG2 4.09Å; L172-I277 HydrophobicContact CD2-CD1 4.26Å; L172-L299 HydrophobicContact CD2-CD1 4.37Å
173	Q	83.2	Confident	73.7	Confident	42 Å²	42	35.9 Å²	35.9	20%	0.196	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124	178.6	-65.3	178.7	25.8	0	0	109.3	N146 A171 I263 N264	N146-Q173 HydrophobicContact CB-CB 4.41Å; N146-Q173 PolarHBondContact N-O 3.36Å; N146-Q173 PolarHBondContact O-N 3.34Å; A171-Q173 HydrophobicContact CB-CG 4.19Å; Q173-I263 WeakPolarHBondContact CA-O 3.17Å; Q173-N264 HydrophobicContact CG-CB 4.31Å
174	F	86.3	Confident	74.3	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.009	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	149.8	174.3	55.8	-84.9	0	0	0	110.2	I145 Y203 F262 I263 I265 V279 Y294	I145-F174 HydrophobicContact CG1-CB 4.34Å; F174-Y203 AromaticContact CE2-CD1 3.8Å; F174-Y203 HydrophobicContact CE2-CD1 3.8Å; F174-Y203 AromaticContact CE2-CE1 3.94Å; F174-Y203 HydrophobicContact CE2-CE1 3.94Å; F174-Y203 HydrophobicContact CE2-CG 4.35Å; F174-Y203 HydrophobicContact CZ-CD1 4.31Å; F174-Y203 HydrophobicContact CZ-CG 4.49Å; F174-F262 CarbonylContact O-C 3.59Å; F174-F262 WeakPolarHBondContact O-CA 3.19Å; F174-I263 HydrophobicContact CD2-CB 4.29Å; F174-I263 HydrophobicContact CE1-CB 4.24Å; F174-I263 HydrophobicContact CE1-CG2 3.99Å; F174-I263 HydrophobicContact CE2-CB 3.82Å; F174-I263 HydrophobicContact CE2-CD1 3.73Å; F174-I263 HydrophobicContact CE2-CG1 4.32Å; F174-I263 HydrophobicContact CE2-CG2 4.09Å; F174-I263 HydrophobicContact CZ-CB 3.79Å; F174-I263 HydrophobicContact CZ-CD1 4.22Å; F174-I263 HydrophobicContact CZ-CG2 3.56Å; F174-I263 PolarHBondContact N-O 3.13Å; F174-I263 VanDerWaalsContact N-O 3.11Å; F174-I263 PolarHBondContact O-N 2.92Å; F174-I265 HydrophobicContact CE1-CD1 3.82Å; F174-I265 HydrophobicContact CE1-CG1 4.3Å; F174-I265 HydrophobicContact CZ-CD1 4.05Å; F174-V279 HydrophobicContact CD1-CG2 4.46Å; F174-V279 HydrophobicContact CE1-CG1 4.49Å; F174-V279 HydrophobicContact CE1-CG2 4.14Å; F174-V279 HydrophobicContact CE2-CG1 4.15Å; F174-V279 HydrophobicContact CZ-CG1 4Å; F174-V279 HydrophobicContact CZ-CG2 4.45Å; F174-Y294 HydrophobicContact CB-CD1 4.41Å; F174-Y294 HydrophobicContact CB-CE1 4.32Å; F174-Y294 HydrophobicContact CD2-CE1 4.05Å; F174-Y294 HydrophobicContact CD2-CE2 4.47Å
175	S	86.2	Confident	75.2	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.007	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	139.4	176	-63.6	0	0	0	0	109.9	F262 Y294	S175-F262 VanDerWaalsContact OG-CE1 3.29Å; S175-F262 WeakPolarHBondContact OG-CE1 3.44Å; S175-Y294 PolarHBondContact O-OH 2.87Å
176	A	86.1	Confident	76.1	Confident	7 Å²	7	30.4 Å²	30.4	6%	0.058	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-64.1	149.1	177.8	0	0	0	0	0	111.6	G130 G131 C132 G261 I263	G130-A176 CarbonylContact C-O 3.51Å; G130-A176 WeakPolarHBondContact CA-O 3.48Å; G131-A176 PolarHBondContact N-O 2.73Å; C132-A176 HydrophobicContact CB-CB 4.02Å; C132-A176 WeakPolarHBondContact CB-O 3.27Å; C132-A176 PolarHBondContact N-O 3.02Å; A176-G261 PolarHBondContact N-O 2.91Å; A176-I263 HydrophobicContact CB-CD1 4.09Å; A176-I263 HydrophobicContact CB-CG1 4.24Å
177	A	88.3	Confident	76.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-78.1	149.7	176	0	0	0	0	0	111.5	L128 C132 L201 Y203 V281 Y294	L128-A177 VanDerWaalsContact O-CA 3.29Å; L128-A177 WeakPolarHBondContact O-CA 3.49Å; L128-A177 WeakPolarHBondContact O-CB 3.15Å; C132-A177 PolarHBondContact SG-O 3.05Å; A177-L201 HydrophobicContact CB-CD1 4.27Å; A177-Y203 HydrophobicContact CB-CE1 4.15Å; A177-Y203 PolarHBondContact N-OH 2.82Å; A177-V281 HydrophobicContact CB-CB 4.3Å; A177-V281 HydrophobicContact CB-CG1 4.17Å; A177-V281 HydrophobicContact CB-CG2 3.8Å; A177-Y294 PolarHBondContact N-OH 3.16Å
178	S	86.3	Confident	77.7	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.014	18%	0.182	C	C	.	.	B	Isolated β-bridge	trans	-97	151.4	169.9	54.9	0	0	0	0	111.7	L128	L128-S178 WeakPolarHBondContact CB-OG 3.42Å; L128-S178 PolarHBondContact N-O 3.27Å; L128-S178 VanDerWaalsContact N-O 3.15Å; L128-S178 PolarHBondContact O-N 3.47Å
179	I	85.2	Confident	77.7	Confident	4 Å²	4	25.6 Å²	25.6	2%	0.021	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	139.3	-179.8	-61.9	176.9	0	0	0	108.6	V181 F186 A187 P197 L201 Y283	I179-V181 PolarHBondContact O-N 3.21Å; I179-F186 CarbonylContact O-C 3.58Å; I179-F186 WeakPolarHBondContact O-CA 3.45Å; I179-A187 PolarHBondContact N-O 2.85Å; I179-A187 PolarHBondContact O-N 3.35Å; I179-P197 HydrophobicContact CD1-CB 3.88Å; I179-L201 HydrophobicContact CD1-CD1 4.14Å; I179-L201 HydrophobicContact CD1-CG 4.25Å; I179-L201 HydrophobicContact CG1-CD1 3.49Å; I179-L201 VanDerWaalsContact CG1-CD1 3.49Å; I179-L201 HydrophobicContact CG1-CD2 4.3Å; I179-L201 HydrophobicContact CG1-CG 3.79Å; I179-Y283 HydrophobicContact CG1-CE2 4.41Å; I179-Y283 HydrophobicContact CG2-CD2 4.34Å; I179-Y283 HydrophobicContact CG2-CE1 4.21Å; I179-Y283 HydrophobicContact CG2-CE2 3.54Å; I179-Y283 VanDerWaalsContact CG2-CZ 3.45Å; I179-Y283 WeakPolarHBondContact CG2-OH 3.4Å
180	P	83.2	Confident	77.4	Confident	20 Å²	20	29.4 Å²	29.4	13%	0.13	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	128.8	171.9	30.5	-36.6	0	0	0	111.1	S124 F186 Y283	S124-P180 WeakPolarHBondContact O-CB 3.19Å; P180-F186 HydrophobicContact CB-CE1 4.4Å; P180-Y283 HydrophobicContact CG-CD1 3.68Å; P180-Y283 HydrophobicContact CG-CE1 3.39Å
181	V	77.7	Confident	76.7	Confident	70 Å²	70	38.3 Å²	38.3	42%	0.424	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	111.1	179.5	-179	0	0	0	0	109.3	I179 G185 A187	I179-V181 PolarHBondContact O-N 3.21Å; V181-G185 PolarHBondContact N-O 3.06Å; V181-G185 CarbonylContact O-C 3.38Å; V181-G185 VanDerWaalsContact O-CA 3.3Å; V181-G185 WeakPolarHBondContact O-CA 3.03Å; V181-G185 PolarHBondContact O-N 3.37Å; V181-A187 HydrophobicContact CB-CB 4.44Å; V181-A187 HydrophobicContact CG2-CB 3.46Å; V181-A187 VanDerWaalsContact CG2-CB 3.46Å
182	G	67.4	Low	75.9	Confident	57 Å²	57	40 Å²	40	59%	0.588	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	-166.8	179.5	0	0	0	0	0	113.4	G184	G182-G184 PolarHBondContact O-N 2.71Å
183	P	59.8	Low	74.6	Confident	131 Å²	131	46.3 Å²	46.3	85%	0.851	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	18.8	-170.5	26.2	-32.5	0	0	0	115.9
184	G	62.9	Low	73.1	Confident	42 Å²	42	50.8 Å²	50.8	43%	0.433	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	167.8	4.8	175.5	0	0	0	0	0	117.4	G182	G182-G184 PolarHBondContact O-N 2.71Å
185	G	74.1	Confident	71.5	Confident	34 Å²	34	54 Å²	54	35%	0.351	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	152.1	175.3	0	0	0	0	0	111.7	V181	V181-G185 PolarHBondContact N-O 3.06Å; V181-G185 CarbonylContact O-C 3.38Å; V181-G185 VanDerWaalsContact O-CA 3.3Å; V181-G185 WeakPolarHBondContact O-CA 3.03Å; V181-G185 PolarHBondContact O-N 3.37Å
186	F	80.7	Confident	70	Confident	48 Å²	48	63.4 Å²	63.4	21%	0.211	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	133.8	166.7	-63.8	-86.5	0	0	0	108.5	F58 F94 L128 I179 P180	F58-F186 HydrophobicContact CD1-CE1 4.32Å; F58-F186 HydrophobicContact CD1-CE2 4.46Å; F58-F186 AromaticContact CD1-CZ 3.7Å; F58-F186 HydrophobicContact CD1-CZ 3.7Å; F58-F186 HydrophobicContact CE1-CE1 4.06Å; F58-F186 AromaticContact CE1-CZ 3.85Å; F58-F186 HydrophobicContact CE1-CZ 3.85Å; F94-F186 HydrophobicContact CD1-CE2 4.36Å; F94-F186 AromaticContact CE1-CD2 3.71Å; F94-F186 HydrophobicContact CE1-CD2 3.71Å; F94-F186 AromaticContact CE1-CE2 3.63Å; F94-F186 HydrophobicContact CE1-CE2 3.63Å; F94-F186 HydrophobicContact CZ-CD2 4.31Å; L128-F186 HydrophobicContact CB-CD1 3.65Å; L128-F186 HydrophobicContact CB-CE1 3.79Å; L128-F186 HydrophobicContact CB-CG 4.27Å; L128-F186 HydrophobicContact CD2-CB 4.24Å; L128-F186 HydrophobicContact CD2-CD1 4.03Å; L128-F186 HydrophobicContact CD2-CD2 3.97Å; L128-F186 HydrophobicContact CD2-CE1 4.39Å; L128-F186 HydrophobicContact CD2-CE2 4.34Å; L128-F186 HydrophobicContact CD2-CG 3.8Å; I179-F186 CarbonylContact O-C 3.58Å; I179-F186 WeakPolarHBondContact O-CA 3.45Å; P180-F186 HydrophobicContact CB-CE1 4.4Å
187	A	77.5	Confident	68.7	Low	28 Å²	28	65.7 Å²	65.7	23%	0.231	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	149	178.9	0	0	0	0	0	111.8	I179 V181 I192	I179-A187 PolarHBondContact N-O 2.85Å; I179-A187 PolarHBondContact O-N 3.35Å; V181-A187 HydrophobicContact CB-CB 4.44Å; V181-A187 HydrophobicContact CG2-CB 3.46Å; V181-A187 VanDerWaalsContact CG2-CB 3.46Å; A187-I192 HydrophobicContact CB-CD1 4.12Å; A187-I192 HydrophobicContact CB-CG1 4.04Å
188	C	77.4	Confident	67.2	Low	14 Å²	14	70.7 Å²	70.7	10%	0.095	43%	0.425	C	S	.	.			trans	-84.8	126.9	174.2	-63.4	0	0	0	0	110.1	C132 H190 R191 I192	C132-C188 WeakPolarHBondContact CA-SG 3.43Å; C132-C188 HydrophobicContact CB-CB 4.01Å; C132-C188 WeakPolarHBondContact CB-SG 3.38Å; C132-C188 WeakPolarHBondContact SG-CA 3.09Å; C132-C188 WeakPolarHBondContact SG-CB 3.06Å; C132-C188 CovalentContact SG-SG 2.03Å; C132-C188 PolarHBondContact SG-SG 3.19Å; C188-H190 VanDerWaalsContact CB-CE1 3.47Å; C188-H190 WeakPolarHBondContact CB-CE1 3.1Å; C188-H190 PolarHBondContact O-N 3.24Å; C188-R191 HydrophobicContact CB-CG 4.29Å; C188-R191 PolarHBondContact O-N 3.42Å; C188-I192 WeakPolarHBondContact O-CG1 3.17Å; C188-I192 PolarHBondContact O-N 3.34Å
189	S	67.1	Low	66.3	Low	30 Å²	30	71.1 Å²	71.1	21%	0.21	43%	0.43	C	S	.	.	G	3₁₀ helix	trans	-46.3	-41.9	-178.8	52.3	0	0	0	0	113.6	R191 I192 Q253	S189-R191 VanDerWaalsContact C-N 3.3Å; S189-R191 PolarHBondContact O-N 3.47Å; S189-I192 PolarHBondContact O-N 2.88Å; S189-Q253 PolarHBondContact OG-NE2 3.3Å; S189-Q253 PolarHBondContact OG-OE1 3.15Å
190	H	65	Low	66.1	Low	81 Å²	81	73.6 Å²	73.6	38%	0.375	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-68.9	-20	179.2	72.4	-90.7	0	0	0	115.1	C188 P258	C188-H190 VanDerWaalsContact CB-CE1 3.47Å; C188-H190 WeakPolarHBondContact CB-CE1 3.1Å; C188-H190 PolarHBondContact O-N 3.24Å; H190-P258 HydrophobicContact CB-CB 4.16Å; H190-P258 HydrophobicContact CB-CG 3.59Å
191	R	59.7	Low	66.2	Low	190 Å²	190	72.8 Å²	72.8	72%	0.717	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-94.4	-8.5	177.2	-62.5	-168.6	180	-179.9	-2.4	113	C188 S189 T193	C188-R191 HydrophobicContact CB-CG 4.29Å; C188-R191 PolarHBondContact O-N 3.42Å; S189-R191 VanDerWaalsContact C-N 3.3Å; S189-R191 PolarHBondContact O-N 3.47Å; R191-T193 PolarHBondContact O-N 3Å; R191-T193 VanDerWaalsContact O-N 3.08Å
192	I	59.3	Low	66.7	Low	38 Å²	38	70.1 Å²	70.1	20%	0.195	43%	0.426	C	S	.	.			trans	-79.5	97.1	-178.9	-51.2	174.7	0	0	0	108.1	A187 C188 S189 S195 P197	A187-I192 HydrophobicContact CB-CD1 4.12Å; A187-I192 HydrophobicContact CB-CG1 4.04Å; C188-I192 WeakPolarHBondContact O-CG1 3.17Å; C188-I192 PolarHBondContact O-N 3.34Å; S189-I192 PolarHBondContact O-N 2.88Å; I192-S195 WeakPolarHBondContact CG2-O 3.42Å; I192-S195 WeakPolarHBondContact CG2-OG 3.29Å; I192-P197 HydrophobicContact CD1-CB 4.32Å
193	T	53	Low	67.8	Low	132 Å²	132	67.4 Å²	67.4	81%	0.81	40%	0.398	S	S	*	.			trans	-87.9	-22.8	-177.9	46.3	0	0	0	0	113.8	R191	R191-T193 PolarHBondContact O-N 3Å; R191-T193 VanDerWaalsContact O-N 3.08Å
194	T	52.2	Low	69.2	Low	135 Å²	135	62.2 Å²	62.2	83%	0.828	36%	0.362	S	S	*	.	S	Bend	trans	-112.1	-18.8	-165	45.6	0	0	0	0	115.4
195	S	53.5	Low	70.5	Confident	70 Å²	70	60.2 Å²	60.2	49%	0.49	34%	0.342	S	S	.	.	S	Bend	trans	-136.4	124.8	179.3	57.2	0	0	0	0	109.8	I192 P197	I192-S195 WeakPolarHBondContact CG2-O 3.42Å; I192-S195 WeakPolarHBondContact CG2-OG 3.29Å; S195-P197 VanDerWaalsContact O-N 3.16Å
196	K	54.4	Low	71.3	Confident	198 Å²	198	60.4 Å²	60.4	86%	0.861	33%	0.332	S	S	*	.			trans	-53.4	127	167.7	-80.9	-178.4	178	177.5	0	107.6	S198	K196-S198 PolarHBondContact O-N 3.26Å
197	P	57.9	Low	71.6	Confident	55 Å²	55	58.1 Å²	58.1	36%	0.357	32%	0.322	S	S	.	.			trans	-56.2	129	174	22.5	-30.8	0	0	0	108.1	I179 I192 S195 G199	I179-P197 HydrophobicContact CD1-CB 3.88Å; I192-P197 HydrophobicContact CD1-CB 4.32Å; S195-P197 VanDerWaalsContact O-N 3.16Å; P197-G199 PolarHBondContact O-N 3.48Å; P197-G199 VanDerWaalsContact O-N 3.1Å
198	S	56.6	Low	72	Confident	106 Å²	106	56.9 Å²	56.9	74%	0.741	31%	0.312	S	S	*	.	S	Bend	trans	-64.7	-12.8	-177.5	-52.4	0	0	0	0	113.1	K196	K196-S198 PolarHBondContact O-N 3.26Å
199	G	68.7	Low	72.2	Confident	11 Å²	11	57.4 Å²	57.4	11%	0.113	32%	0.315	C	S	.	.	S	Bend	trans	-137.3	168.9	-178.2	0	0	0	0	0	113.4	P197 S284	P197-G199 PolarHBondContact O-N 3.48Å; P197-G199 VanDerWaalsContact O-N 3.1Å; G199-S284 WeakPolarHBondContact CA-O 3.31Å
200	S	79.6	Confident	72.6	Confident	55 Å²	55	56.1 Å²	56.1	39%	0.385	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	140.9	178.6	62.2	0	0	0	0	111	S284	S200-S284 PolarHBondContact N-O 2.9Å; S200-S284 PolarHBondContact O-N 3.37Å; S200-S284 PolarHBondContact OG-OG 2.87Å
201	L	85	Confident	73	Confident	4 Å²	4	52.7 Å²	52.7	2%	0.021	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	128.4	170.5	-69.7	174.8	0	0	0	110.4	P127 A177 I179 Q253 V281 E282 Y283	P127-L201 HydrophobicContact CB-CD2 3.89Å; A177-L201 HydrophobicContact CB-CD1 4.27Å; I179-L201 HydrophobicContact CD1-CD1 4.14Å; I179-L201 HydrophobicContact CD1-CG 4.25Å; I179-L201 HydrophobicContact CG1-CD1 3.49Å; I179-L201 VanDerWaalsContact CG1-CD1 3.49Å; I179-L201 HydrophobicContact CG1-CD2 4.3Å; I179-L201 HydrophobicContact CG1-CG 3.79Å; L201-Q253 HydrophobicContact CB-CB 4.08Å; L201-Q253 PolarHBondContact O-N 3.41Å; L201-Q253 VanDerWaalsContact O-N 3.09Å; L201-V281 HydrophobicContact CD2-CG2 3.74Å; L201-E282 WeakPolarHBondContact CA-O 3.43Å; L201-Y283 HydrophobicContact CD2-CD2 3.82Å; L201-Y283 HydrophobicContact CD2-CG 4.17Å; L201-Y283 HydrophobicContact CG-CD2 4.38Å
202	V	88.4	Confident	73.5	Confident	13 Å²	13	44 Å²	44	8%	0.079	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.7	175.1	-173.5	0	0	0	0	108.6	F251 E282	V202-F251 WeakPolarHBondContact CA-O 3.43Å; V202-E282 HydrophobicContact CB-CB 4.45Å; V202-E282 PolarHBondContact N-O 2.88Å; V202-E282 PolarHBondContact O-N 3.35Å
203	Y	90.4	Very high	73.7	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	120	176.9	-62.3	-81.6	0	0	0	109.5	F174 A177 S250 F251 Q253 I263 V279 V281 Y294	F174-Y203 AromaticContact CE2-CD1 3.8Å; F174-Y203 HydrophobicContact CE2-CD1 3.8Å; F174-Y203 AromaticContact CE2-CE1 3.94Å; F174-Y203 HydrophobicContact CE2-CE1 3.94Å; F174-Y203 HydrophobicContact CE2-CG 4.35Å; F174-Y203 HydrophobicContact CZ-CD1 4.31Å; F174-Y203 HydrophobicContact CZ-CG 4.49Å; A177-Y203 HydrophobicContact CB-CE1 4.15Å; A177-Y203 PolarHBondContact N-OH 2.82Å; Y203-S250 CarbonylContact O-C 3.57Å; Y203-S250 WeakPolarHBondContact O-CA 3.37Å; Y203-F251 PolarHBondContact N-O 3.27Å; Y203-F251 PolarHBondContact O-N 3.48Å; Y203-Q253 HydrophobicContact CE2-CB 3.93Å; Y203-Q253 HydrophobicContact CE2-CG 4.15Å; Y203-I263 HydrophobicContact CD2-CD1 3.9Å; Y203-I263 HydrophobicContact CE1-CD1 4.03Å; Y203-I263 HydrophobicContact CE2-CD1 3.28Å; Y203-I263 HydrophobicContact CG-CD1 4.48Å; Y203-V279 HydrophobicContact CD1-CG1 4.06Å; Y203-V281 HydrophobicContact CD1-CB 4Å; Y203-V281 HydrophobicContact CD1-CG2 4.19Å; Y203-V281 HydrophobicContact CE1-CB 3.91Å; Y203-V281 HydrophobicContact CE1-CG2 3.82Å; Y203-Y294 HydrophobicContact CE1-CE2 4.3Å
204	H	90.8	Very high	73.8	Confident	23 Å²	23	36.3 Å²	36.3	11%	0.106	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126.9	176.3	-58.1	-75.4	0	0	0	110	Y206 Y247 S250 V279 V280 E282	H204-Y206 HydrophobicContact CB-CD2 4.38Å; H204-Y206 HydrophobicContact CB-CE2 3.65Å; H204-Y247 HydrophobicContact CB-CE2 4.28Å; H204-Y247 AromaticContact ND1-CE2 3.76Å; H204-S250 WeakPolarHBondContact ND1-CB 3.27Å; H204-V279 CarbonylContact O-C 3.26Å; H204-V279 WeakPolarHBondContact O-CA 3.26Å; H204-V280 HydrophobicContact CB-CB 4.46Å; H204-V280 PolarHBondContact N-O 2.7Å; H204-V280 PolarHBondContact O-N 3.34Å; H204-E282 IonicContact CD2-OE2 3.56Å; H204-E282 IonicContact CE1-OE2 3.46Å; H204-E282 IonicContact NE2-OE2 3.86Å; H204-E282 PolarHBondContact NE2-OE2 3.21Å
205	I	89.6	Confident	74	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	126.7	177	-52.3	-171.6	0	0	0	109	I248 Q249 F251 I265 I277 V279 L667	I205-I248 HydrophobicContact CB-CB 4.4Å; I205-I248 HydrophobicContact CG2-CB 4.43Å; I205-I248 HydrophobicContact CG2-CD1 4.05Å; I205-I248 WeakPolarHBondContact O-CB 3.46Å; I205-I248 PolarHBondContact O-N 2.98Å; I205-Q249 PolarHBondContact N-O 3.38Å; I205-F251 HydrophobicContact CD1-CD2 4.19Å; I205-F251 HydrophobicContact CD1-CE2 3.49Å; I205-F251 VanDerWaalsContact CD1-CE2 3.49Å; I205-F251 HydrophobicContact CD1-CZ 4.41Å; I205-F251 HydrophobicContact CG1-CD2 4.36Å; I205-F251 HydrophobicContact CG1-CE2 3.97Å; I205-I265 HydrophobicContact CD1-CD1 3.73Å; I205-I265 HydrophobicContact CD1-CG2 4.46Å; I205-I277 HydrophobicContact CG2-CG2 3.74Å; I205-V279 HydrophobicContact CG1-CG2 4.33Å; I205-L667 HydrophobicContact CD1-CD2 3.86Å
206	Y	89.7	Confident	74.1	Confident	37 Å²	37	31.8 Å²	31.8	15%	0.145	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	145.4	171.1	-62.3	-93.7	0	0	0	109.9	H204 F238 F243 A246 Y247 I277 T278 V280	H204-Y206 HydrophobicContact CB-CD2 4.38Å; H204-Y206 HydrophobicContact CB-CE2 3.65Å; Y206-F238 HydrophobicContact CD2-CE2 4.36Å; Y206-F238 AromaticContact CE2-CE2 3.82Å; Y206-F238 HydrophobicContact CE2-CE2 3.82Å; Y206-F238 HydrophobicContact CE2-CZ 4.43Å; Y206-F243 AromaticContact CD1-CE1 3.72Å; Y206-F243 HydrophobicContact CD1-CE1 3.72Å; Y206-F243 AromaticContact CD1-CZ 3.88Å; Y206-F243 HydrophobicContact CD1-CZ 3.88Å; Y206-F243 HydrophobicContact CD2-CZ 4.33Å; Y206-F243 HydrophobicContact CE1-CE1 4.14Å; Y206-F243 HydrophobicContact CG-CE1 4.09Å; Y206-F243 AromaticContact CG-CZ 3.75Å; Y206-F243 HydrophobicContact CG-CZ 3.75Å; Y206-A246 CarbonylContact C-O 3.51Å; Y206-A246 VanDerWaalsContact CA-O 3.29Å; Y206-A246 WeakPolarHBondContact CA-O 3.43Å; Y206-Y247 AromaticContact CE1-CD2 3.94Å; Y206-Y247 HydrophobicContact CE1-CD2 3.94Å; Y206-Y247 HydrophobicContact CE1-CG 4.38Å; Y206-I277 WeakPolarHBondContact O-CA 3.39Å; Y206-T278 PolarHBondContact N-O 3.45Å; Y206-T278 PolarHBondContact O-N 2.93Å; Y206-T278 VanDerWaalsContact O-O 3.11Å; Y206-V280 HydrophobicContact CD2-CB 4.37Å; Y206-V280 HydrophobicContact CD2-CG2 3.75Å; Y206-V280 HydrophobicContact CE2-CB 4.06Å; Y206-V280 HydrophobicContact CE2-CG2 3.79Å
207	G	87.8	Confident	74.2	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	155.4	175.6	0	0	0	0	0	112.9	A246 I276 F671	G207-A246 PolarHBondContact N-O 3.42Å; G207-A246 PolarHBondContact O-N 3.15Å; G207-I276 CarbonylContact C-O 3.58Å; G207-I276 WeakPolarHBondContact CA-O 3.41Å; G207-F671 VanDerWaalsContact O-CZ 3.31Å; G207-F671 WeakPolarHBondContact O-CZ 3.5Å
208	A	85.1	Confident	74.2	Confident	3 Å²	3	30.4 Å²	30.4	3%	0.025	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140.8	170.4	0	0	0	0	0	109.7	V231 M235 Y275 I276	A208-V231 HydrophobicContact CB-CG1 4.14Å; A208-M235 HydrophobicContact CB-CE 4.37Å; A208-M235 HydrophobicContact CB-CG 4.14Å; A208-M235 HydrophobicContact CB-SD 3.78Å; A208-Y275 WeakPolarHBondContact O-CA 3.24Å; A208-I276 PolarHBondContact N-O 3.26Å; A208-I276 PolarHBondContact O-N 3.46Å
209	P	81.6	Confident	74.7	Confident	25 Å²	25	25.9 Å²	25.9	16%	0.162	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	137.4	175.2	28.9	-31.7	0	0	0	110.8	T212 A219 F671	P209-T212 HydrophobicContact CB-CG2 3.72Å; P209-A219 HydrophobicContact CB-CB 4.13Å; P209-A219 HydrophobicContact CG-CB 4.44Å; P209-F671 HydrophobicContact CB-CB 3.77Å; P209-F671 HydrophobicContact CB-CD1 4.2Å; P209-F671 HydrophobicContact CB-CD2 4.32Å; P209-F671 HydrophobicContact CB-CG 3.84Å; P209-F671 HydrophobicContact CG-CB 4.39Å; P209-F671 HydrophobicContact CG-CD1 4.08Å; P209-F671 HydrophobicContact CG-CG 4.24Å
210	L	77	Confident	74.7	Confident	2 Å²	2	27.7 Å²	27.7	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	-45.4	173.4	-177.2	67.3	0	0	0	111.5	A219 F220 P223 V228 V231 A274 I276 I298	L210-A219 CarbonylContact O-C 3.59Å; L210-A219 VanDerWaalsContact O-CA 3.32Å; L210-A219 WeakPolarHBondContact O-CA 3.42Å; L210-F220 HydrophobicContact CD1-CD2 4.24Å; L210-F220 PolarHBondContact O-N 3.46Å; L210-P223 HydrophobicContact CD1-CB 4.4Å; L210-P223 HydrophobicContact CD1-CG 4.38Å; L210-P223 HydrophobicContact CD2-CG 4.5Å; L210-P223 HydrophobicContact CG-CG 4.21Å; L210-V228 HydrophobicContact CD1-CB 4.48Å; L210-V228 HydrophobicContact CD1-CG1 4.45Å; L210-V228 HydrophobicContact CD1-CG2 4.17Å; L210-V228 HydrophobicContact CD2-CG1 4.17Å; L210-V228 HydrophobicContact CD2-CG2 4.2Å; L210-V231 HydrophobicContact CD1-CG2 4.44Å; L210-A274 WeakPolarHBondContact CA-O 3.49Å; L210-A274 HydrophobicContact CB-CB 4.37Å; L210-A274 WeakPolarHBondContact CB-O 3.25Å; L210-A274 HydrophobicContact CD2-CB 4.33Å; L210-A274 PolarHBondContact N-O 2.58Å; L210-I276 HydrophobicContact CB-CG1 4.46Å; L210-I276 HydrophobicContact CD1-CD1 4.12Å; L210-I276 HydrophobicContact CD2-CD1 4.49Å; L210-I276 HydrophobicContact CD2-CG1 4.44Å; L210-I298 HydrophobicContact CD2-CD1 4.22Å; L210-I298 HydrophobicContact CD2-CG1 4.41Å; L210-I298 HydrophobicContact CD2-CG2 4.02Å
211	I	73.2	Confident	73.9	Confident	10 Å²	10	30.4 Å²	30.4	5%	0.051	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	122.5	175.1	-58.6	176.5	0	0	0	108.8	F220 P223 T273 A274 V326	I211-F220 VanDerWaalsContact CA-O 3.29Å; I211-F220 WeakPolarHBondContact CA-O 3.43Å; I211-F220 WeakPolarHBondContact CG2-O 3.49Å; I211-P223 HydrophobicContact CD1-CG 3.92Å; I211-P223 HydrophobicContact CG1-CG 3.89Å; I211-T273 WeakPolarHBondContact O-CA 3.26Å; I211-T273 WeakPolarHBondContact O-CB 3.29Å; I211-A274 HydrophobicContact CB-CB 4.08Å; I211-A274 HydrophobicContact CD1-CB 4.1Å; I211-A274 HydrophobicContact CG1-CB 4.09Å; I211-A274 PolarHBondContact N-O 2.84Å; I211-A274 PolarHBondContact O-N 2.83Å; I211-V326 HydrophobicContact CD1-CB 3.97Å; I211-V326 HydrophobicContact CD1-CG2 3.68Å
212	T	69.8	Low	73	Confident	7 Å²	7	34.8 Å²	34.8	4%	0.043	20%	0.201	C	C	.	.			trans	-137.6	170.8	177.3	68	0	0	0	0	110.2	P209 G214 A219 F671	P209-T212 HydrophobicContact CB-CG2 3.72Å; T212-G214 PolarHBondContact O-N 3.43Å; T212-G214 PolarHBondContact OG1-N 3.25Å; T212-G214 PolarHBondContact OG1-O 2.95Å; T212-A219 HydrophobicContact CG2-CB 3.95Å; T212-A219 WeakPolarHBondContact OG1-CB 3.26Å; T212-F671 HydrophobicContact CG2-CB 4.44Å
213	A	63.3	Low	72.2	Confident	7 Å²	7	34.4 Å²	34.4	6%	0.058	20%	0.198	C	C	.	.	S	Bend	trans	-63.7	-6	177.1	0	0	0	0	0	114.1	I641 Y675 D676	A213-I641 HydrophobicContact CB-CG2 4.25Å; A213-Y675 WeakPolarHBondContact O-CB 3.47Å; A213-Y675 WeakPolarHBondContact O-CD2 3.02Å; A213-D676 WeakPolarHBondContact CB-OD1 3.49Å
214	G	56.4	Low	71.5	Confident	2 Å²	2	36.6 Å²	36.6	2%	0.021	21%	0.214	C	C	.	.	S	Bend	trans	-170.7	128.3	177.2	0	0	0	0	0	114.9	T212 G673 Q674	T212-G214 PolarHBondContact O-N 3.43Å; T212-G214 PolarHBondContact OG1-N 3.25Å; T212-G214 PolarHBondContact OG1-O 2.95Å; G214-G673 WeakPolarHBondContact O-CA 3.32Å; G214-Q674 PolarHBondContact O-N 3.23Å
215	G	55.5	Low	70.9	Confident	42 Å²	42	38.3 Å²	38.3	43%	0.433	23%	0.227	S	C	.	.			trans	-90.5	118.5	-170.7	0	0	0	0	0	114.4	A219	G215-A219 WeakPolarHBondContact CA-O 3.07Å
216	S	54.5	Low	70.5	Confident	68 Å²	68	43.6 Å²	43.6	48%	0.476	26%	0.255	S	S	.	.	S	Bend	trans	-139.3	-13	164.6	73.6	0	0	0	0	114.4
217	Y	57.7	Low	70.1	Confident	188 Å²	188	45.2 Å²	45.2	74%	0.737	26%	0.264	S	S	*	.	S	Bend	trans	-138.1	70.8	-175.8	-73.6	-77.9	0	0	0	112.6	A219	Y217-A219 PolarHBondContact O-N 2.95Å
218	G	56.8	Low	69.9	Low	36 Å²	36	45.2 Å²	45.2	37%	0.371	26%	0.264	S	S	.	.	S	Bend	trans	63.3	15.6	-178.5	0	0	0	0	0	114.2	F220	G218-F220 VanDerWaalsContact O-CD2 3.25Å; G218-F220 WeakPolarHBondContact O-CD2 3.07Å; G218-F220 WeakPolarHBondContact O-CE2 3.34Å
219	A	68.6	Low	70	Confident	11 Å²	11	45.2 Å²	45.2	9%	0.091	26%	0.264	C	S	.	.			trans	-102.5	128.3	175.3	0	0	0	0	0	109.5	P209 L210 T212 G215 Y217	P209-A219 HydrophobicContact CB-CB 4.13Å; P209-A219 HydrophobicContact CG-CB 4.44Å; L210-A219 CarbonylContact O-C 3.59Å; L210-A219 VanDerWaalsContact O-CA 3.32Å; L210-A219 WeakPolarHBondContact O-CA 3.42Å; T212-A219 HydrophobicContact CG2-CB 3.95Å; T212-A219 WeakPolarHBondContact OG1-CB 3.26Å; G215-A219 WeakPolarHBondContact CA-O 3.07Å; Y217-A219 PolarHBondContact O-N 2.95Å
220	F	67.3	Low	70.1	Confident	48 Å²	48	46.7 Å²	46.7	21%	0.211	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-119.7	155.4	-172.2	-55.7	-87.8	0	0	0	110.1	L210 I211 G218 P223 E227 V231	L210-F220 HydrophobicContact CD1-CD2 4.24Å; L210-F220 PolarHBondContact O-N 3.46Å; I211-F220 VanDerWaalsContact CA-O 3.29Å; I211-F220 WeakPolarHBondContact CA-O 3.43Å; I211-F220 WeakPolarHBondContact CG2-O 3.49Å; G218-F220 VanDerWaalsContact O-CD2 3.25Å; G218-F220 WeakPolarHBondContact O-CD2 3.07Å; G218-F220 WeakPolarHBondContact O-CE2 3.34Å; F220-P223 HydrophobicContact CB-CB 3.7Å; F220-P223 HydrophobicContact CB-CG 4.24Å; F220-P223 HydrophobicContact CD2-CB 3.8Å; F220-P223 HydrophobicContact CG-CB 3.84Å; F220-E227 HydrophobicContact CD1-CB 4.42Å; F220-E227 HydrophobicContact CD1-CG 4.35Å; F220-E227 HydrophobicContact CD2-CB 4.44Å; F220-E227 HydrophobicContact CE1-CB 3.95Å; F220-E227 HydrophobicContact CE1-CG 3.75Å; F220-E227 HydrophobicContact CE2-CB 3.95Å; F220-E227 HydrophobicContact CZ-CB 3.7Å; F220-E227 HydrophobicContact CZ-CG 3.92Å; F220-V231 HydrophobicContact CE2-CG2 4.12Å
221	V	64	Low	70.6	Confident	112 Å²	112	47 Å²	47	68%	0.679	28%	0.277	S	S	*	.	S	Bend	trans	-79.4	-39.8	171.9	-179.3	0	0	0	0	110.3
222	N	65.6	Low	71.3	Confident	96 Å²	96	46.5 Å²	46.5	51%	0.513	28%	0.275	S	S	.	.	S	Bend	trans	-144.5	94.3	171.3	-167.4	7.8	0	0	0	109
223	P	72.4	Confident	72.2	Confident	5 Å²	5	50.8 Å²	50.8	3%	0.032	29%	0.292	C	S	.	.			trans	-76.4	132.1	-174.9	28	-31.2	0	0	0	111.6	L210 I211 F220 E227 V228	L210-P223 HydrophobicContact CD1-CB 4.4Å; L210-P223 HydrophobicContact CD1-CG 4.38Å; L210-P223 HydrophobicContact CD2-CG 4.5Å; L210-P223 HydrophobicContact CG-CG 4.21Å; I211-P223 HydrophobicContact CD1-CG 3.92Å; I211-P223 HydrophobicContact CG1-CG 3.89Å; F220-P223 HydrophobicContact CB-CB 3.7Å; F220-P223 HydrophobicContact CB-CG 4.24Å; F220-P223 HydrophobicContact CD2-CB 3.8Å; F220-P223 HydrophobicContact CG-CB 3.84Å; P223-E227 WeakPolarHBondContact CA-OE2 3.31Å; P223-E227 HydrophobicContact CB-CB 4.36Å; P223-V228 HydrophobicContact CB-CG2 3.76Å; P223-V228 HydrophobicContact CG-CG2 3.95Å
224	S	74.7	Confident	73.4	Confident	46 Å²	46	52.9 Å²	52.9	32%	0.322	30%	0.303	S	S	.	.			trans	-66.5	155.4	166.2	65.4	0	0	0	0	111.3	N226 E227 V228	S224-N226 PolarHBondContact O-N 3.04Å; S224-N226 VanDerWaalsContact O-N 3.11Å; S224-E227 PolarHBondContact N-OE2 3.35Å; S224-E227 WeakPolarHBondContact O-CB 3.44Å; S224-E227 PolarHBondContact O-N 3.49Å; S224-E227 VanDerWaalsContact OG-CD 3.28Å; S224-E227 VanDerWaalsContact OG-CG 3.28Å; S224-E227 WeakPolarHBondContact OG-CG 3.27Å; S224-E227 PolarHBondContact OG-N 3.44Å; S224-E227 PolarHBondContact OG-OE2 3.22Å; S224-V228 WeakPolarHBondContact O-CG2 3.33Å; S224-V228 PolarHBondContact O-N 3.45Å
225	P	78.6	Confident	74.8	Confident	59 Å²	59	52.8 Å²	52.8	38%	0.383	30%	0.302	S	S	.	.	H	α-helix	trans	-53.5	-34.4	176.8	-28.1	35.6	0	0	0	113.9	F67 W116 V228 A229	F67-P225 HydrophobicContact CD2-CG 4.34Å; F67-P225 HydrophobicContact CE2-CG 4.28Å; W116-P225 HydrophobicContact CH2-CB 3.75Å; W116-P225 HydrophobicContact CZ3-CB 4.27Å; P225-V228 PolarHBondContact O-N 3.12Å; P225-A229 VanDerWaalsContact O-CB 3.3Å; P225-A229 WeakPolarHBondContact O-CB 3.47Å; P225-A229 PolarHBondContact O-N 3.21Å
226	N	81.3	Confident	76.3	Confident	111 Å²	111	50.9 Å²	50.9	59%	0.594	28%	0.282	S	S	*	.	H	α-helix	trans	-67.3	-40.8	176.7	-68.9	-24.1	0	0	0	112.4	W116 S224 A229 S230	W116-N226 WeakPolarHBondContact CZ2-OD1 3.25Å; S224-N226 PolarHBondContact O-N 3.04Å; S224-N226 VanDerWaalsContact O-N 3.11Å; N226-A229 PolarHBondContact O-N 3.4Å; N226-S230 PolarHBondContact O-N 3.41Å
227	E	82.1	Confident	77.7	Confident	71 Å²	71	48.6 Å²	48.6	33%	0.332	27%	0.265	S	S	.	.	H	α-helix	trans	-66.1	-44.6	175.8	-74	164.9	153.6	0	0	110.7	F220 P223 S224 A229 S230 V231	F220-E227 HydrophobicContact CD1-CB 4.42Å; F220-E227 HydrophobicContact CD1-CG 4.35Å; F220-E227 HydrophobicContact CD2-CB 4.44Å; F220-E227 HydrophobicContact CE1-CB 3.95Å; F220-E227 HydrophobicContact CE1-CG 3.75Å; F220-E227 HydrophobicContact CE2-CB 3.95Å; F220-E227 HydrophobicContact CZ-CB 3.7Å; F220-E227 HydrophobicContact CZ-CG 3.92Å; P223-E227 WeakPolarHBondContact CA-OE2 3.31Å; P223-E227 HydrophobicContact CB-CB 4.36Å; S224-E227 PolarHBondContact N-OE2 3.35Å; S224-E227 WeakPolarHBondContact O-CB 3.44Å; S224-E227 PolarHBondContact O-N 3.49Å; S224-E227 VanDerWaalsContact OG-CD 3.28Å; S224-E227 VanDerWaalsContact OG-CG 3.28Å; S224-E227 WeakPolarHBondContact OG-CG 3.27Å; S224-E227 PolarHBondContact OG-N 3.44Å; S224-E227 PolarHBondContact OG-OE2 3.22Å; E227-A229 VanDerWaalsContact C-N 3.29Å; E227-A229 PolarHBondContact O-N 3.11Å; E227-S230 WeakPolarHBondContact O-CB 3.37Å; E227-S230 PolarHBondContact O-N 2.85Å; E227-S230 VanDerWaalsContact O-N 3.13Å; E227-S230 PolarHBondContact O-OG 2.87Å; E227-V231 PolarHBondContact O-N 3.07Å
228	V	83.1	Confident	78.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-57.1	-46.2	173.7	-177.6	0	0	0	0	110.7	P66 F67 L210 P223 S224 P225 S230 V231 L232 I298	P66-V228 HydrophobicContact CB-CB 4.22Å; P66-V228 HydrophobicContact CB-CG1 3.99Å; P66-V228 HydrophobicContact CG-CB 4.06Å; P66-V228 HydrophobicContact CG-CG1 3.83Å; F67-V228 HydrophobicContact CE2-CG2 4.23Å; F67-V228 HydrophobicContact CZ-CG2 4.06Å; L210-V228 HydrophobicContact CD1-CB 4.48Å; L210-V228 HydrophobicContact CD1-CG1 4.45Å; L210-V228 HydrophobicContact CD1-CG2 4.17Å; L210-V228 HydrophobicContact CD2-CG1 4.17Å; L210-V228 HydrophobicContact CD2-CG2 4.2Å; P223-V228 HydrophobicContact CB-CG2 3.76Å; P223-V228 HydrophobicContact CG-CG2 3.95Å; S224-V228 WeakPolarHBondContact O-CG2 3.33Å; S224-V228 PolarHBondContact O-N 3.45Å; P225-V228 PolarHBondContact O-N 3.12Å; V228-S230 VanDerWaalsContact C-N 3.28Å; V228-S230 PolarHBondContact O-N 3.34Å; V228-V231 PolarHBondContact O-N 3.04Å; V228-L232 HydrophobicContact CG1-CD1 3.95Å; V228-L232 HydrophobicContact CG1-CG 4.35Å; V228-L232 WeakPolarHBondContact O-CG 3.24Å; V228-L232 PolarHBondContact O-N 3.38Å; V228-I298 HydrophobicContact CG1-CD1 3.46Å; V228-I298 VanDerWaalsContact CG1-CD1 3.46Å; V228-I298 HydrophobicContact CG1-CG1 4.45Å
229	A	86	Confident	79.6	Confident	4 Å²	4	43.4 Å²	43.4	3%	0.033	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-33.1	178.8	0	0	0	0	0	113	W116 P225 N226 E227 L232 K233	W116-A229 HydrophobicContact CD2-CB 3.43Å; W116-A229 VanDerWaalsContact CD2-CB 3.43Å; W116-A229 HydrophobicContact CE3-CB 4.02Å; W116-A229 HydrophobicContact CG-CB 3.82Å; W116-A229 HydrophobicContact CH2-CB 4.14Å; W116-A229 HydrophobicContact CZ2-CB 3.55Å; W116-A229 HydrophobicContact CZ3-CB 4.37Å; P225-A229 VanDerWaalsContact O-CB 3.3Å; P225-A229 WeakPolarHBondContact O-CB 3.47Å; P225-A229 PolarHBondContact O-N 3.21Å; N226-A229 PolarHBondContact O-N 3.4Å; E227-A229 VanDerWaalsContact C-N 3.29Å; E227-A229 PolarHBondContact O-N 3.11Å; A229-L232 PolarHBondContact O-N 2.74Å; A229-K233 VanDerWaalsContact O-CB 3.31Å; A229-K233 WeakPolarHBondContact O-CB 3.31Å; A229-K233 PolarHBondContact O-N 3.1Å
230	S	85.3	Confident	79.8	Confident	55 Å²	55	48.5 Å²	48.5	39%	0.385	28%	0.278	S	S	.	.	H	α-helix	trans	-64.1	-41.2	175.9	78.5	0	0	0	0	112.1	N226 E227 V228 N234	N226-S230 PolarHBondContact O-N 3.41Å; E227-S230 WeakPolarHBondContact O-CB 3.37Å; E227-S230 PolarHBondContact O-N 2.85Å; E227-S230 VanDerWaalsContact O-N 3.13Å; E227-S230 PolarHBondContact O-OG 2.87Å; V228-S230 VanDerWaalsContact C-N 3.28Å; V228-S230 PolarHBondContact O-N 3.34Å; S230-N234 PolarHBondContact O-N 2.81Å; S230-N234 PolarHBondContact O-ND2 3.14Å
231	V	85.7	Confident	79.9	Confident	9 Å²	9	52.7 Å²	52.7	6%	0.055	31%	0.313	C	S	.	.	H	α-helix	trans	-72.5	-39.9	176.7	-172.6	0	0	0	0	110.5	A208 L210 F220 E227 V228 K233 N234 M235 I276	A208-V231 HydrophobicContact CB-CG1 4.14Å; L210-V231 HydrophobicContact CD1-CG2 4.44Å; F220-V231 HydrophobicContact CE2-CG2 4.12Å; E227-V231 PolarHBondContact O-N 3.07Å; V228-V231 PolarHBondContact O-N 3.04Å; V231-K233 VanDerWaalsContact C-N 3.35Å; V231-K233 PolarHBondContact O-N 2.75Å; V231-N234 PolarHBondContact O-N 2.91Å; V231-M235 WeakPolarHBondContact O-CG 3.36Å; V231-M235 PolarHBondContact O-N 2.82Å; V231-I276 HydrophobicContact CB-CD1 3.65Å; V231-I276 HydrophobicContact CG1-CD1 3.49Å; V231-I276 VanDerWaalsContact CG1-CD1 3.49Å
232	L	88.6	Confident	80.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-60.5	-42.1	174	-76	171.2	0	0	0	112.1	F36 H64 P66 V228 A229 N234 M235 A236 I276 P296	F36-L232 HydrophobicContact CZ-CB 4.26Å; H64-L232 HydrophobicContact CB-CD1 3.97Å; P66-L232 HydrophobicContact CG-CD1 4.39Å; V228-L232 HydrophobicContact CG1-CD1 3.95Å; V228-L232 HydrophobicContact CG1-CG 4.35Å; V228-L232 WeakPolarHBondContact O-CG 3.24Å; V228-L232 PolarHBondContact O-N 3.38Å; A229-L232 PolarHBondContact O-N 2.74Å; L232-N234 VanDerWaalsContact C-N 3.31Å; L232-N234 PolarHBondContact O-N 2.98Å; L232-M235 CarbonylContact O-C 3.6Å; L232-M235 PolarHBondContact O-N 3.33Å; L232-A236 VanDerWaalsContact O-CB 3.23Å; L232-A236 WeakPolarHBondContact O-CB 3.39Å; L232-A236 PolarHBondContact O-N 2.95Å; L232-I276 HydrophobicContact CD2-CD1 4.04Å; L232-I276 HydrophobicContact CD2-CG1 4.18Å; L232-I276 HydrophobicContact CD2-CG2 3.83Å; L232-I276 HydrophobicContact CG-CD1 3.99Å; L232-P296 HydrophobicContact CD2-CB 4.13Å; L232-P296 HydrophobicContact CD2-CG 4.21Å
233	K	88.9	Confident	81.1	Confident	96 Å²	96	47 Å²	47	42%	0.417	28%	0.28	S	S	.	.	H	α-helix	trans	-56.6	-46.5	175.5	177.9	177.9	177	-179.7	0	111.2	F36 A229 V231 A236 N237	F36-K233 HydrophobicContact CB-CD 4.34Å; F36-K233 HydrophobicContact CB-CG 3.95Å; F36-K233 HydrophobicContact CD1-CB 3.7Å; F36-K233 HydrophobicContact CD1-CD 4.12Å; F36-K233 HydrophobicContact CD1-CG 3.88Å; F36-K233 HydrophobicContact CD2-CB 4.38Å; F36-K233 HydrophobicContact CE1-CB 3.83Å; F36-K233 HydrophobicContact CG-CB 3.99Å; F36-K233 HydrophobicContact CG-CD 4.45Å; F36-K233 HydrophobicContact CG-CG 3.9Å; F36-K233 HydrophobicContact CZ-CB 4.26Å; A229-K233 VanDerWaalsContact O-CB 3.31Å; A229-K233 WeakPolarHBondContact O-CB 3.31Å; A229-K233 PolarHBondContact O-N 3.1Å; V231-K233 VanDerWaalsContact C-N 3.35Å; V231-K233 PolarHBondContact O-N 2.75Å; K233-A236 PolarHBondContact O-N 3.36Å; K233-N237 WeakPolarHBondContact O-CB 3.47Å; K233-N237 PolarHBondContact O-N 3.17Å; K233-N237 VanDerWaalsContact O-N 3.14Å; K233-N237 PolarHBondContact O-ND2 2.94Å
234	N	87.8	Confident	81.2	Confident	51 Å²	51	50.6 Å²	50.6	27%	0.273	30%	0.302	S	S	.	.	H	α-helix	trans	-65.2	-41.9	178.3	-68	-13.2	0	0	0	111.4	S230 V231 L232 N237 S242 F243 V244	S230-N234 PolarHBondContact O-N 2.81Å; S230-N234 PolarHBondContact O-ND2 3.14Å; V231-N234 PolarHBondContact O-N 2.91Å; L232-N234 VanDerWaalsContact C-N 3.31Å; L232-N234 PolarHBondContact O-N 2.98Å; N234-N237 PolarHBondContact O-N 2.87Å; N234-S242 WeakPolarHBondContact CB-O 3.35Å; N234-F243 WeakPolarHBondContact O-CA 3.36Å; N234-V244 HydrophobicContact CB-CB 4.23Å; N234-V244 HydrophobicContact CB-CG2 3.89Å
235	M	87	Confident	81.3	Confident	0 Å²	0	49 Å²	49	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-69.1	-30.8	176.8	-72.8	-68	-75.9	0	0	113.4	A208 V231 L232 N237 F243 G245 I276 T278 P296	A208-M235 HydrophobicContact CB-CE 4.37Å; A208-M235 HydrophobicContact CB-CG 4.14Å; A208-M235 HydrophobicContact CB-SD 3.78Å; V231-M235 WeakPolarHBondContact O-CG 3.36Å; V231-M235 PolarHBondContact O-N 2.82Å; L232-M235 CarbonylContact O-C 3.6Å; L232-M235 PolarHBondContact O-N 3.33Å; M235-N237 VanDerWaalsContact C-N 3.33Å; M235-F243 HydrophobicContact SD-CE2 4.14Å; M235-F243 HydrophobicContact SD-CZ 4.46Å; M235-G245 WeakPolarHBondContact SD-CA 3.41Å; M235-I276 HydrophobicContact CB-CG2 4.04Å; M235-I276 HydrophobicContact CE-CG2 4.13Å; M235-I276 HydrophobicContact CG-CB 4.48Å; M235-I276 HydrophobicContact CG-CG2 3.77Å; M235-T278 HydrophobicContact CE-CG2 3.62Å; M235-P296 HydrophobicContact CB-CB 4.36Å
236	A	86.8	Confident	81.6	Confident	3 Å²	3	48.4 Å²	48.4	3%	0.025	29%	0.293	C	S	.	.	H	α-helix	trans	-76.8	-20.3	176.7	0	0	0	0	0	112.6	F36 K118 L232 K233 F238 P296	F36-A236 HydrophobicContact CD2-CB 4.32Å; F36-A236 HydrophobicContact CE2-CB 4.33Å; K118-A236 HydrophobicContact CD-CB 4.02Å; K118-A236 PolarHBondContact NZ-O 3.34Å; L232-A236 VanDerWaalsContact O-CB 3.23Å; L232-A236 WeakPolarHBondContact O-CB 3.39Å; L232-A236 PolarHBondContact O-N 2.95Å; K233-A236 PolarHBondContact O-N 3.36Å; A236-F238 PolarHBondContact O-N 3.01Å; A236-P296 HydrophobicContact CB-CG 4.29Å
237	N	84.3	Confident	81.7	Confident	20 Å²	20	48.5 Å²	48.5	11%	0.107	29%	0.286	C	S	.	.			trans	-87.2	48.3	179.2	-72.1	-13.6	0	0	0	112.4	K118 K233 N234 M235 G239 H240 S242	K118-N237 PolarHBondContact NZ-OD1 3.16Å; K233-N237 WeakPolarHBondContact O-CB 3.47Å; K233-N237 PolarHBondContact O-N 3.17Å; K233-N237 VanDerWaalsContact O-N 3.14Å; K233-N237 PolarHBondContact O-ND2 2.94Å; N234-N237 PolarHBondContact O-N 2.87Å; M235-N237 VanDerWaalsContact C-N 3.33Å; N237-G239 PolarHBondContact O-N 3.3Å; N237-H240 HydrophobicContact CB-CB 4.25Å; N237-H240 WeakPolarHBondContact O-CB 3.21Å; N237-H240 PolarHBondContact O-N 3.14Å; N237-H240 VanDerWaalsContact O-N 3.14Å; N237-S242 PolarHBondContact ND2-OG 3.07Å
238	F	78.7	Confident	81.7	Confident	41 Å²	41	46 Å²	46	18%	0.18	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	137.5	175.8	-172.2	-98.5	0	0	0	111.4	Y206 A236 H240 F243 V280 Q291 P293	Y206-F238 HydrophobicContact CD2-CE2 4.36Å; Y206-F238 AromaticContact CE2-CE2 3.82Å; Y206-F238 HydrophobicContact CE2-CE2 3.82Å; Y206-F238 HydrophobicContact CE2-CZ 4.43Å; A236-F238 PolarHBondContact O-N 3.01Å; F238-H240 VanDerWaalsContact C-N 3.28Å; F238-H240 PolarHBondContact O-N 3.1Å; F238-F243 HydrophobicContact CB-CD2 4.42Å; F238-F243 HydrophobicContact CB-CE2 4.48Å; F238-F243 HydrophobicContact CD2-CD2 4.15Å; F238-F243 HydrophobicContact CD2-CE1 4.17Å; F238-F243 AromaticContact CD2-CE2 3.79Å; F238-F243 HydrophobicContact CD2-CE2 3.79Å; F238-F243 HydrophobicContact CD2-CG 4.49Å; F238-F243 AromaticContact CD2-CZ 3.79Å; F238-F243 HydrophobicContact CD2-CZ 3.79Å; F238-F243 HydrophobicContact CE2-CE1 4.33Å; F238-F243 HydrophobicContact CE2-CZ 4.24Å; F238-V280 HydrophobicContact CD1-CG1 4.25Å; F238-V280 HydrophobicContact CD1-CG2 4.44Å; F238-V280 HydrophobicContact CD2-CG2 3.71Å; F238-V280 HydrophobicContact CE1-CG1 3.73Å; F238-V280 HydrophobicContact CE1-CG2 4.39Å; F238-V280 HydrophobicContact CE2-CB 4.43Å; F238-V280 HydrophobicContact CE2-CG1 4.27Å; F238-V280 HydrophobicContact CE2-CG2 3.66Å; F238-V280 HydrophobicContact CG-CG2 4.12Å; F238-V280 HydrophobicContact CZ-CB 4.35Å; F238-V280 HydrophobicContact CZ-CG1 3.74Å; F238-V280 HydrophobicContact CZ-CG2 4.01Å; F238-Q291 HydrophobicContact CE1-CB 3.95Å; F238-Q291 VanDerWaalsContact CZ-OE1 3.28Å; F238-P293 HydrophobicContact CB-CB 4.14Å; F238-P293 HydrophobicContact CB-CG 4Å
239	G	75.3	Confident	81.8	Confident	73 Å²	73	49 Å²	49	75%	0.753	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	-9.5	-175.6	0	0	0	0	0	115.3	N237	N237-G239 PolarHBondContact O-N 3.3Å
240	H	71.8	Confident	81.8	Confident	119 Å²	119	50.7 Å²	50.7	55%	0.551	30%	0.3	S	S	*	.	S	Bend	trans	-93.4	156.2	172.5	-67.3	-84.7	0	0	0	111.6	N237 F238 S242 F243	N237-H240 HydrophobicContact CB-CB 4.25Å; N237-H240 WeakPolarHBondContact O-CB 3.21Å; N237-H240 PolarHBondContact O-N 3.14Å; N237-H240 VanDerWaalsContact O-N 3.14Å; F238-H240 VanDerWaalsContact C-N 3.28Å; F238-H240 PolarHBondContact O-N 3.1Å; H240-S242 PolarHBondContact O-N 2.71Å; H240-F243 WeakPolarHBondContact O-CB 3.39Å; H240-F243 PolarHBondContact O-N 3.1Å
241	S	70.1	Confident	81.7	Confident	136 Å²	136	49 Å²	49	95%	0.951	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-15.6	173.3	55.7	0	0	0	0	114.3	F243	S241-F243 VanDerWaalsContact C-N 3.33Å
242	S	75	Confident	81.5	Confident	42 Å²	42	52.6 Å²	52.6	29%	0.294	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	0.8	176.3	56	0	0	0	0	114.2	N234 N237 H240 V244	N234-S242 WeakPolarHBondContact CB-O 3.35Å; N237-S242 PolarHBondContact ND2-OG 3.07Å; H240-S242 PolarHBondContact O-N 2.71Å; S242-V244 PolarHBondContact O-N 3.01Å
243	F	78.6	Confident	81	Confident	45 Å²	45	53.8 Å²	53.8	20%	0.197	31%	0.308	C	S	.	.			trans	-70.8	122.7	178.1	-176.3	-106.9	0	0	0	111.5	Y206 N234 M235 F238 H240 S241 G245 T278	Y206-F243 AromaticContact CD1-CE1 3.72Å; Y206-F243 HydrophobicContact CD1-CE1 3.72Å; Y206-F243 AromaticContact CD1-CZ 3.88Å; Y206-F243 HydrophobicContact CD1-CZ 3.88Å; Y206-F243 HydrophobicContact CD2-CZ 4.33Å; Y206-F243 HydrophobicContact CE1-CE1 4.14Å; Y206-F243 HydrophobicContact CG-CE1 4.09Å; Y206-F243 AromaticContact CG-CZ 3.75Å; Y206-F243 HydrophobicContact CG-CZ 3.75Å; N234-F243 WeakPolarHBondContact O-CA 3.36Å; M235-F243 HydrophobicContact SD-CE2 4.14Å; M235-F243 HydrophobicContact SD-CZ 4.46Å; F238-F243 HydrophobicContact CB-CD2 4.42Å; F238-F243 HydrophobicContact CB-CE2 4.48Å; F238-F243 HydrophobicContact CD2-CD2 4.15Å; F238-F243 HydrophobicContact CD2-CE1 4.17Å; F238-F243 AromaticContact CD2-CE2 3.79Å; F238-F243 HydrophobicContact CD2-CE2 3.79Å; F238-F243 HydrophobicContact CD2-CG 4.49Å; F238-F243 AromaticContact CD2-CZ 3.79Å; F238-F243 HydrophobicContact CD2-CZ 3.79Å; F238-F243 HydrophobicContact CE2-CE1 4.33Å; F238-F243 HydrophobicContact CE2-CZ 4.24Å; H240-F243 WeakPolarHBondContact O-CB 3.39Å; H240-F243 PolarHBondContact O-N 3.1Å; S241-F243 VanDerWaalsContact C-N 3.33Å; F243-G245 VanDerWaalsContact CE1-O 3.28Å; F243-G245 WeakPolarHBondContact CE1-O 3.4Å; F243-T278 HydrophobicContact CE2-CG2 4.35Å; F243-T278 HydrophobicContact CZ-CG2 4.44Å
244	V	75.3	Confident	80	Confident	81 Å²	81	54.6 Å²	54.6	49%	0.491	33%	0.325	S	S	.	.			trans	-107.7	8.7	-176.6	-177.7	0	0	0	0	112.2	N234 S242 A246	N234-V244 HydrophobicContact CB-CB 4.23Å; N234-V244 HydrophobicContact CB-CG2 3.89Å; S242-V244 PolarHBondContact O-N 3.01Å; V244-A246 PolarHBondContact O-N 3.34Å
245	G	77.9	Confident	79.1	Confident	14 Å²	14	57.5 Å²	57.5	14%	0.144	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-74.5	122.5	-178.2	0	0	0	0	0	113	M235 F243	M235-G245 WeakPolarHBondContact SD-CA 3.41Å; F243-G245 VanDerWaalsContact CE1-O 3.28Å; F243-G245 WeakPolarHBondContact CE1-O 3.4Å
246	A	83	Confident	78.2	Confident	46 Å²	46	59.9 Å²	59.9	38%	0.38	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	132.3	168.6	0	0	0	0	0	109.7	Y206 G207 V244 F671	Y206-A246 CarbonylContact C-O 3.51Å; Y206-A246 VanDerWaalsContact CA-O 3.29Å; Y206-A246 WeakPolarHBondContact CA-O 3.43Å; G207-A246 PolarHBondContact N-O 3.42Å; G207-A246 PolarHBondContact O-N 3.15Å; V244-A246 PolarHBondContact O-N 3.34Å; A246-F671 HydrophobicContact CB-CE1 4.12Å
247	Y	84	Confident	76.8	Confident	113 Å²	113	65.7 Å²	65.7	44%	0.443	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	133	174.2	175.9	-99	0	0	0	110.7	H204 Y206 S250	H204-Y247 HydrophobicContact CB-CE2 4.28Å; H204-Y247 AromaticContact ND1-CE2 3.76Å; Y206-Y247 AromaticContact CE1-CD2 3.94Å; Y206-Y247 HydrophobicContact CE1-CD2 3.94Å; Y206-Y247 HydrophobicContact CE1-CG 4.38Å; Y247-S250 WeakPolarHBondContact OH-CB 3.48Å; Y247-S250 PolarHBondContact OH-N 3.49Å; Y247-S250 VanDerWaalsContact OH-N 3.12Å; Y247-S250 PolarHBondContact OH-OG 2.89Å; Y247-S250 VanDerWaalsContact OH-OG 3.08Å
248	I	81.9	Confident	75.2	Confident	18 Å²	18	67 Å²	67	9%	0.092	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-64.5	-178.5	-62.6	167.5	0	0	0	110.4	I205 L667 I669	I205-I248 HydrophobicContact CB-CB 4.4Å; I205-I248 HydrophobicContact CG2-CB 4.43Å; I205-I248 HydrophobicContact CG2-CD1 4.05Å; I205-I248 WeakPolarHBondContact O-CB 3.46Å; I205-I248 PolarHBondContact O-N 2.98Å; I248-L667 HydrophobicContact CG2-CD1 3.86Å; I248-L667 HydrophobicContact CG2-CD2 4.18Å; I248-L667 HydrophobicContact CG2-CG 4.25Å; I248-I669 HydrophobicContact CD1-CD1 4.01Å; I248-I669 HydrophobicContact CD1-CG1 4.03Å; I248-I669 HydrophobicContact CD1-CG2 3.93Å; I248-I669 HydrophobicContact CG2-CG1 4.36Å
249	Q	84.9	Confident	74.1	Confident	62 Å²	62	72 Å²	72	29%	0.29	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	156.4	-175.6	-175.6	162.9	3.7	0	0	110.4	I205 F251 L667	I205-Q249 PolarHBondContact N-O 3.38Å; Q249-F251 HydrophobicContact CB-CE2 4.01Å; Q249-F251 HydrophobicContact CB-CZ 4.06Å; Q249-F251 HydrophobicContact CG-CD2 4.5Å; Q249-F251 HydrophobicContact CG-CE1 4.04Å; Q249-F251 HydrophobicContact CG-CE2 3.8Å; Q249-F251 HydrophobicContact CG-CZ 3.56Å; Q249-L667 HydrophobicContact CB-CD1 3.78Å; Q249-L667 HydrophobicContact CG-CD1 4.39Å
250	S	86.8	Confident	73.2	Confident	40 Å²	40	73 Å²	73	28%	0.28	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	151.8	171	64.6	0	0	0	0	111.9	Y203 H204 Y247	Y203-S250 CarbonylContact O-C 3.57Å; Y203-S250 WeakPolarHBondContact O-CA 3.37Å; H204-S250 WeakPolarHBondContact ND1-CB 3.27Å; Y247-S250 WeakPolarHBondContact OH-CB 3.48Å; Y247-S250 PolarHBondContact OH-N 3.49Å; Y247-S250 VanDerWaalsContact OH-N 3.12Å; Y247-S250 PolarHBondContact OH-OG 2.89Å; Y247-S250 VanDerWaalsContact OH-OG 3.08Å
251	F	83.8	Confident	73.1	Confident	19 Å²	19	67.6 Å²	67.6	8%	0.083	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	137.6	179.7	-54	-89.8	0	0	0	110.1	V202 Y203 I205 Q249 F256 I265 L667	V202-F251 WeakPolarHBondContact CA-O 3.43Å; Y203-F251 PolarHBondContact N-O 3.27Å; Y203-F251 PolarHBondContact O-N 3.48Å; I205-F251 HydrophobicContact CD1-CD2 4.19Å; I205-F251 HydrophobicContact CD1-CE2 3.49Å; I205-F251 VanDerWaalsContact CD1-CE2 3.49Å; I205-F251 HydrophobicContact CD1-CZ 4.41Å; I205-F251 HydrophobicContact CG1-CD2 4.36Å; I205-F251 HydrophobicContact CG1-CE2 3.97Å; Q249-F251 HydrophobicContact CB-CE2 4.01Å; Q249-F251 HydrophobicContact CB-CZ 4.06Å; Q249-F251 HydrophobicContact CG-CD2 4.5Å; Q249-F251 HydrophobicContact CG-CE1 4.04Å; Q249-F251 HydrophobicContact CG-CE2 3.8Å; Q249-F251 HydrophobicContact CG-CZ 3.56Å; F251-F256 HydrophobicContact CB-CE2 3.83Å; F251-F256 HydrophobicContact CB-CZ 4.41Å; F251-F256 HydrophobicContact CD1-CZ 4.32Å; F251-F256 HydrophobicContact CG-CE2 4.3Å; F251-F256 HydrophobicContact CG-CZ 4.39Å; F251-I265 HydrophobicContact CD2-CD1 4.06Å; F251-I265 HydrophobicContact CE2-CD1 4.05Å; F251-I265 HydrophobicContact CZ-CG2 4.34Å; F251-L667 HydrophobicContact CZ-CD1 4.13Å
252	H	81.8	Confident	73.3	Confident	85 Å²	85	64.9 Å²	64.9	39%	0.394	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	142.8	170.4	-69.6	-84.6	0	0	0	110.5	S254 E255	H252-S254 PolarHBondContact O-N 3.45Å; H252-S254 VanDerWaalsContact O-N 3.1Å; H252-E255 HydrophobicContact CB-CG 4.37Å; H252-E255 IonicContact CD2-OE1 3.54Å; H252-E255 PolarHBondContact N-OE1 3.47Å; H252-E255 VanDerWaalsContact N-OE1 3.09Å; H252-E255 WeakPolarHBondContact O-CB 3.46Å; H252-E255 PolarHBondContact O-N 3.18Å
253	Q	76.5	Confident	73.6	Confident	26 Å²	26	63.1 Å²	63.1	12%	0.121	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-56.3	-30	175.8	-170.7	178	39.9	0	0	112.7	S189 L201 Y203 E255 F256	S189-Q253 PolarHBondContact OG-NE2 3.3Å; S189-Q253 PolarHBondContact OG-OE1 3.15Å; L201-Q253 HydrophobicContact CB-CB 4.08Å; L201-Q253 PolarHBondContact O-N 3.41Å; L201-Q253 VanDerWaalsContact O-N 3.09Å; Y203-Q253 HydrophobicContact CE2-CB 3.93Å; Y203-Q253 HydrophobicContact CE2-CG 4.15Å; Q253-E255 PolarHBondContact O-N 3.3Å; Q253-F256 PolarHBondContact O-N 3.31Å
254	S	69.2	Low	73.6	Confident	112 Å²	112	63.4 Å²	63.4	78%	0.783	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-63.2	-16.8	177.9	53.6	0	0	0	0	114.6	H252 F256	H252-S254 PolarHBondContact O-N 3.45Å; H252-S254 VanDerWaalsContact O-N 3.1Å; S254-F256 VanDerWaalsContact C-N 3.28Å
255	E	68	Low	73.8	Confident	113 Å²	113	60 Å²	60	53%	0.528	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-76.9	-15.9	178.9	-65.6	170.2	-145.7	0	0	112.7	H252 Q253	H252-E255 HydrophobicContact CB-CG 4.37Å; H252-E255 IonicContact CD2-OE1 3.54Å; H252-E255 PolarHBondContact N-OE1 3.47Å; H252-E255 VanDerWaalsContact N-OE1 3.09Å; H252-E255 WeakPolarHBondContact O-CB 3.46Å; H252-E255 PolarHBondContact O-N 3.18Å; Q253-E255 PolarHBondContact O-N 3.3Å
256	F	67.5	Low	73.8	Confident	50 Å²	50	60.5 Å²	60.5	22%	0.219	33%	0.327	C	S	.	.	S	Bend	trans	-109.9	133.3	-177.3	-61.9	-81.8	0	0	0	111.4	F251 Q253 S254 P258 I263 I265	F251-F256 HydrophobicContact CB-CE2 3.83Å; F251-F256 HydrophobicContact CB-CZ 4.41Å; F251-F256 HydrophobicContact CD1-CZ 4.32Å; F251-F256 HydrophobicContact CG-CE2 4.3Å; F251-F256 HydrophobicContact CG-CZ 4.39Å; Q253-F256 PolarHBondContact O-N 3.31Å; S254-F256 VanDerWaalsContact C-N 3.28Å; F256-P258 WeakPolarHBondContact O-CD 3.47Å; F256-I263 HydrophobicContact CD1-CG2 3.92Å; F256-I263 HydrophobicContact CD2-CG1 4.49Å; F256-I263 HydrophobicContact CD2-CG2 3.88Å; F256-I263 HydrophobicContact CE1-CG2 3.81Å; F256-I263 HydrophobicContact CE2-CG2 3.77Å; F256-I263 HydrophobicContact CG-CG1 4.43Å; F256-I263 HydrophobicContact CG-CG2 3.95Å; F256-I263 HydrophobicContact CZ-CG2 3.75Å; F256-I265 HydrophobicContact CE1-CG1 4.27Å; F256-I265 HydrophobicContact CZ-CD1 4.33Å; F256-I265 HydrophobicContact CZ-CG1 3.96Å
257	T	57.9	Low	73.6	Confident	124 Å²	124	58.3 Å²	58.3	76%	0.761	31%	0.308	S	S	*	.			trans	-78	113.4	173.3	49.5	0	0	0	0	109.8	N259	T257-N259 VanDerWaalsContact C-N 3.28Å; T257-N259 PolarHBondContact O-N 3.35Å; T257-N259 VanDerWaalsContact O-N 3.17Å
258	P	50.7	Low	73.3	Confident	49 Å²	49	53.2 Å²	53.2	32%	0.318	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-85.1	14.3	-164.3	33.3	-34.6	0	0	0	114.6	H190 F256 D260 G261	H190-P258 HydrophobicContact CB-CB 4.16Å; H190-P258 HydrophobicContact CB-CG 3.59Å; F256-P258 WeakPolarHBondContact O-CD 3.47Å; P258-D260 PolarHBondContact O-N 3.25Å; P258-G261 PolarHBondContact O-N 3.25Å
259	N	55.1	Low	72.7	Confident	144 Å²	144	52.7 Å²	52.7	77%	0.77	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-55.3	-27.4	-175.5	-72.7	-3.7	0	0	0	113	T257	T257-N259 VanDerWaalsContact C-N 3.28Å; T257-N259 PolarHBondContact O-N 3.35Å; T257-N259 VanDerWaalsContact O-N 3.17Å
260	D	56.7	Low	72.1	Confident	94 Å²	94	50.7 Å²	50.7	50%	0.503	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-95.1	-11.9	178	-69.8	-36.3	0	0	0	115	R134 P258 F262	R134-D260 IonicContact CZ-OD1 2.85Å; R134-D260 PolarHBondContact NE-O 2.99Å; R134-D260 IonicContact NH2-OD1 2.74Å; R134-D260 PolarHBondContact NH2-OD1 3.39Å; P258-D260 PolarHBondContact O-N 3.25Å; D260-F262 HydrophobicContact CB-CD2 4.35Å; D260-F262 WeakPolarHBondContact O-CD2 3.09Å; D260-F262 WeakPolarHBondContact O-CE2 3.33Å; D260-F262 PolarHBondContact O-N 3.35Å
261	G	69.4	Low	71.2	Confident	7 Å²	7	48.9 Å²	48.9	7%	0.072	26%	0.263	C	S	.	.	S	Bend	trans	71.5	0.5	-174.5	0	0	0	0	0	114.7	A176 P258	A176-G261 PolarHBondContact N-O 2.91Å; P258-G261 PolarHBondContact O-N 3.25Å
262	F	76.1	Confident	70.3	Confident	78 Å²	78	48.2 Å²	48.2	34%	0.342	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	145.5	176	-59.7	-80.5	0	0	0	110.5	R134 F174 S175 D260	R134-F262 HydrophobicContact CG-CE2 4.38Å; F174-F262 CarbonylContact O-C 3.59Å; F174-F262 WeakPolarHBondContact O-CA 3.19Å; S175-F262 VanDerWaalsContact OG-CE1 3.29Å; S175-F262 WeakPolarHBondContact OG-CE1 3.44Å; D260-F262 HydrophobicContact CB-CD2 4.35Å; D260-F262 WeakPolarHBondContact O-CD2 3.09Å; D260-F262 WeakPolarHBondContact O-CE2 3.33Å; D260-F262 PolarHBondContact O-N 3.35Å
263	I	79.7	Confident	69.9	Low	6 Å²	6	44.2 Å²	44.2	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	126.2	169.3	-64.2	169.9	0	0	0	106.6	Q173 F174 A176 Y203 F256 I265	Q173-I263 WeakPolarHBondContact CA-O 3.17Å; F174-I263 HydrophobicContact CD2-CB 4.29Å; F174-I263 HydrophobicContact CE1-CB 4.24Å; F174-I263 HydrophobicContact CE1-CG2 3.99Å; F174-I263 HydrophobicContact CE2-CB 3.82Å; F174-I263 HydrophobicContact CE2-CD1 3.73Å; F174-I263 HydrophobicContact CE2-CG1 4.32Å; F174-I263 HydrophobicContact CE2-CG2 4.09Å; F174-I263 HydrophobicContact CZ-CB 3.79Å; F174-I263 HydrophobicContact CZ-CD1 4.22Å; F174-I263 HydrophobicContact CZ-CG2 3.56Å; F174-I263 PolarHBondContact N-O 3.13Å; F174-I263 VanDerWaalsContact N-O 3.11Å; F174-I263 PolarHBondContact O-N 2.92Å; A176-I263 HydrophobicContact CB-CD1 4.09Å; A176-I263 HydrophobicContact CB-CG1 4.24Å; Y203-I263 HydrophobicContact CD2-CD1 3.9Å; Y203-I263 HydrophobicContact CE1-CD1 4.03Å; Y203-I263 HydrophobicContact CE2-CD1 3.28Å; Y203-I263 HydrophobicContact CG-CD1 4.48Å; F256-I263 HydrophobicContact CD1-CG2 3.92Å; F256-I263 HydrophobicContact CD2-CG1 4.49Å; F256-I263 HydrophobicContact CD2-CG2 3.88Å; F256-I263 HydrophobicContact CE1-CG2 3.81Å; F256-I263 HydrophobicContact CE2-CG2 3.77Å; F256-I263 HydrophobicContact CG-CG1 4.43Å; F256-I263 HydrophobicContact CG-CG2 3.95Å; F256-I263 HydrophobicContact CZ-CG2 3.75Å; I263-I265 HydrophobicContact CG2-CD1 4.22Å; I263-I265 HydrophobicContact CG2-CG1 3.97Å
264	N	79	Confident	70	Confident	51 Å²	51	43 Å²	43	27%	0.273	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	117	179.8	-173.6	4.4	0	0	0	109.5	A171 L172 Q173	A171-N264 WeakPolarHBondContact CB-OD1 3.34Å; L172-N264 WeakPolarHBondContact O-CA 3.33Å; Q173-N264 HydrophobicContact CG-CB 4.31Å
265	I	79.1	Confident	70.7	Confident	9 Å²	9	37.8 Å²	37.8	5%	0.046	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.7	-179.8	-53.8	-179.5	0	0	0	108.1	A171 L172 F174 I205 F251 F256 I263 V267 L667	A171-I265 WeakPolarHBondContact CA-O 3.5Å; L172-I265 HydrophobicContact CB-CB 4.39Å; L172-I265 PolarHBondContact N-O 3.2Å; L172-I265 PolarHBondContact O-N 3.23Å; F174-I265 HydrophobicContact CE1-CD1 3.82Å; F174-I265 HydrophobicContact CE1-CG1 4.3Å; F174-I265 HydrophobicContact CZ-CD1 4.05Å; I205-I265 HydrophobicContact CD1-CD1 3.73Å; I205-I265 HydrophobicContact CD1-CG2 4.46Å; F251-I265 HydrophobicContact CD2-CD1 4.06Å; F251-I265 HydrophobicContact CE2-CD1 4.05Å; F251-I265 HydrophobicContact CZ-CG2 4.34Å; F256-I265 HydrophobicContact CE1-CG1 4.27Å; F256-I265 HydrophobicContact CZ-CD1 4.33Å; F256-I265 HydrophobicContact CZ-CG1 3.96Å; I263-I265 HydrophobicContact CG2-CD1 4.22Å; I263-I265 HydrophobicContact CG2-CG1 3.97Å; I265-V267 HydrophobicContact CG2-CG2 4.43Å; I265-L667 HydrophobicContact CG2-CB 4.26Å; I265-L667 HydrophobicContact CG2-CD2 4.47Å
266	I	78.3	Confident	71.5	Confident	25 Å²	25	32.4 Å²	32.4	13%	0.128	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	129	177.8	-52.6	171.1	0	0	0	108.5	M150 I154 T169 S170 T666 L667	M150-I266 HydrophobicContact CE-CD1 3.9Å; M150-I266 HydrophobicContact CE-CG1 4.28Å; M150-I266 HydrophobicContact CE-CG2 4.24Å; M150-I266 HydrophobicContact SD-CG1 4.38Å; M150-I266 HydrophobicContact SD-CG2 3.48Å; M150-I266 WeakPolarHBondContact SD-CG2 3.4Å; I154-I266 HydrophobicContact CD1-CD1 4.34Å; I154-I266 HydrophobicContact CD1-CG1 4.38Å; T169-I266 HydrophobicContact CG2-CG2 4.37Å; S170-I266 CarbonylContact O-C 3.59Å; S170-I266 WeakPolarHBondContact O-CA 3.29Å; I266-T666 HydrophobicContact CB-CG2 4.02Å; I266-T666 HydrophobicContact CG2-CG2 3.32Å; I266-T666 CarbonylContact O-C 3.59Å; I266-T666 WeakPolarHBondContact O-CA 3.44Å; I266-L667 WeakPolarHBondContact O-CB 3.34Å; I266-L667 PolarHBondContact O-N 2.9Å
267	V	79.2	Confident	72.5	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	139.6	-177.6	-176.8	0	0	0	0	110.3	T169 S170 L172 I265 L299 L667 I669	T169-V267 CarbonylContact C-O 3.45Å; T169-V267 WeakPolarHBondContact CA-O 3.29Å; S170-V267 PolarHBondContact N-O 3.26Å; S170-V267 PolarHBondContact O-N 3.32Å; S170-V267 PolarHBondContact OG-O 3.43Å; L172-V267 HydrophobicContact CD1-CG2 3.6Å; L172-V267 HydrophobicContact CG-CG2 3.62Å; I265-V267 HydrophobicContact CG2-CG2 4.43Å; V267-L299 HydrophobicContact CG1-CD2 3.86Å; V267-L667 CarbonylContact C-O 3.51Å; V267-L667 WeakPolarHBondContact CA-O 3.45Å; V267-L667 HydrophobicContact CG2-CB 4.22Å; V267-L667 HydrophobicContact CG2-CD2 4.02Å; V267-I669 HydrophobicContact CG1-CB 4.42Å; V267-I669 HydrophobicContact CG1-CD1 3.64Å; V267-I669 HydrophobicContact CG1-CG1 3.81Å
268	S	76.8	Confident	74.1	Confident	6 Å²	6	24.2 Å²	24.2	4%	0.042	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	135.2	172.3	65.7	0	0	0	0	111.6	L667 R668	S268-L667 PolarHBondContact N-O 3.41Å; S268-L667 PolarHBondContact OG-O 2.85Å; S268-R668 WeakPolarHBondContact OG-CA 3.45Å
269	R	71.2	Confident	76.1	Confident	7 Å²	7	21.9 Å²	21.9	3%	0.026	11%	0.114	C	C	.	.			trans	-104.5	141.7	173.4	-67.8	-165	-74	165.7	4.2	112.1	S166 Y167 W168 T169 S170	S166-R269 PolarHBondContact O-NH2 2.91Å; Y167-R269 PolarHBondContact O-NH2 3.4Å; W168-R269 PolarHBondContact O-N 3.3Å; T169-R269 PolarHBondContact O-NE 3.13Å; T169-R269 PolarHBondContact O-NH2 3.46Å; S170-R269 VanDerWaalsContact OG-CG 3.28Å; S170-R269 WeakPolarHBondContact OG-CG 3.47Å
270	R	72.3	Confident	77.8	Confident	19 Å²	19	15 Å²	15	7%	0.072	8%	0.077	C	C	.	.			trans	-112.3	118.2	167.5	178.4	176.2	172.1	-170.5	0.1	108.3	T273 G301 S643 C644 D676	R270-T273 HydrophobicContact CB-CG2 4.43Å; R270-T273 WeakPolarHBondContact CB-OG1 3.17Å; R270-T273 HydrophobicContact CG-CG2 3.9Å; R270-T273 PolarHBondContact O-N 3.19Å; R270-T273 PolarHBondContact O-OG1 3.36Å; R270-G301 VanDerWaalsContact O-CA 3.27Å; R270-G301 WeakPolarHBondContact O-CA 3.44Å; R270-S643 PolarHBondContact NE-O 3.49Å; R270-S643 PolarHBondContact NH2-O 3.48Å; R270-C644 VanDerWaalsContact NH2-C 3.28Å; R270-D676 IonicContact CZ-OD2 3.84Å; R270-D676 IonicContact NH1-OD2 3.09Å; R270-D676 PolarHBondContact NH1-OD2 2.91Å; R270-D676 VanDerWaalsContact NH1-OD2 3.17Å; R270-D676 IonicContact NH2-OD1 2.66Å; R270-D676 PolarHBondContact NH2-OD1 3.07Å; R270-D676 VanDerWaalsContact NH2-OD1 3.1Å; R270-D676 IonicContact NH2-OD2 2.75Å; R270-D676 PolarHBondContact NH2-OD2 2.86Å
271	P	66.1	Low	79.5	Confident	3 Å²	3	10.5 Å²	10.5	2%	0.019	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	151.5	175	-26.5	33.8	0	0	0	112	Y167 W168 T273 T330	Y167-P271 HydrophobicContact CE1-CG 3.97Å; W168-P271 HydrophobicContact CE3-CG 4.25Å; W168-P271 HydrophobicContact CH2-CG 4.04Å; W168-P271 VanDerWaalsContact CZ3-CD 3.46Å; W168-P271 HydrophobicContact CZ3-CG 3.6Å; P271-T273 PolarHBondContact O-N 2.98Å; P271-T330 HydrophobicContact CB-CG2 4.37Å
272	A	65.9	Low	80.5	Confident	5 Å²	5	11.7 Å²	11.7	4%	0.041	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	18.3	177.8	0	0	0	0	0	116	C328 S643	A272-C328 WeakPolarHBondContact CA-O 3.24Å; A272-C328 WeakPolarHBondContact CB-O 3.47Å; A272-C328 PolarHBondContact N-O 2.88Å; A272-S643 WeakPolarHBondContact CB-OG 3.21Å; A272-S643 PolarHBondContact O-OG 2.97Å
273	T	73.9	Confident	81.1	Confident	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.043	C	C	.	.			trans	-126.9	161.3	175.2	64.4	0	0	0	0	110.9	I211 R270 P271 Y275 G301	I211-T273 WeakPolarHBondContact O-CA 3.26Å; I211-T273 WeakPolarHBondContact O-CB 3.29Å; R270-T273 HydrophobicContact CB-CG2 4.43Å; R270-T273 WeakPolarHBondContact CB-OG1 3.17Å; R270-T273 HydrophobicContact CG-CG2 3.9Å; R270-T273 PolarHBondContact O-N 3.19Å; R270-T273 PolarHBondContact O-OG1 3.36Å; P271-T273 PolarHBondContact O-N 2.98Å; T273-Y275 PolarHBondContact OG1-OH 3.49Å; T273-G301 VanDerWaalsContact O-CA 3.28Å; T273-G301 WeakPolarHBondContact O-CA 3.06Å; T273-G301 PolarHBondContact O-N 2.85Å
274	A	77.9	Confident	81.2	Confident	0 Å²	0	10 Å²	10	0%	0	5%	0.053	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	145.2	175.5	0	0	0	0	0	110.2	L210 I211 I298 L299 Y300	L210-A274 WeakPolarHBondContact CA-O 3.49Å; L210-A274 HydrophobicContact CB-CB 4.37Å; L210-A274 WeakPolarHBondContact CB-O 3.25Å; L210-A274 HydrophobicContact CD2-CB 4.33Å; L210-A274 PolarHBondContact N-O 2.58Å; I211-A274 HydrophobicContact CB-CB 4.08Å; I211-A274 HydrophobicContact CD1-CB 4.1Å; I211-A274 HydrophobicContact CG1-CB 4.09Å; I211-A274 PolarHBondContact N-O 2.84Å; I211-A274 PolarHBondContact O-N 2.83Å; A274-I298 HydrophobicContact CB-CG2 4.37Å; A274-L299 WeakPolarHBondContact CA-O 3.44Å; A274-Y300 HydrophobicContact CB-CD1 4.27Å
275	Y	82.9	Confident	81.4	Confident	4 Å²	4	9.2 Å²	9.2	2%	0.016	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	140.4	-176.2	-46.4	-64.6	0	0	0	109.6	A208 T273 L299 I669 F671	A208-Y275 WeakPolarHBondContact O-CA 3.24Å; T273-Y275 PolarHBondContact OG1-OH 3.49Å; Y275-L299 PolarHBondContact N-O 3.4Å; Y275-L299 PolarHBondContact O-N 2.76Å; Y275-I669 HydrophobicContact CD2-CG2 4.45Å; Y275-I669 HydrophobicContact CG-CG2 4.43Å; Y275-F671 HydrophobicContact CD1-CB 4.36Å; Y275-F671 AromaticContact CD1-CD2 3.32Å; Y275-F671 HydrophobicContact CD1-CD2 3.32Å; Y275-F671 HydrophobicContact CD1-CE2 4.01Å; Y275-F671 HydrophobicContact CD1-CG 4.23Å; Y275-F671 HydrophobicContact CE1-CB 3.97Å; Y275-F671 AromaticContact CE1-CD2 3.65Å; Y275-F671 HydrophobicContact CE1-CD2 3.65Å; Y275-F671 HydrophobicContact CE1-CG 4.29Å; Y275-F671 HydrophobicContact CG-CD2 4.01Å; Y275-F671 HydrophobicContact CG-CE2 4.31Å
276	I	86.4	Confident	81.1	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	129	168.2	-68.5	162.1	0	0	0	107.5	G207 A208 L210 V231 L232 M235 P296 V297 I298	G207-I276 CarbonylContact C-O 3.58Å; G207-I276 WeakPolarHBondContact CA-O 3.41Å; A208-I276 PolarHBondContact N-O 3.26Å; A208-I276 PolarHBondContact O-N 3.46Å; L210-I276 HydrophobicContact CB-CG1 4.46Å; L210-I276 HydrophobicContact CD1-CD1 4.12Å; L210-I276 HydrophobicContact CD2-CD1 4.49Å; L210-I276 HydrophobicContact CD2-CG1 4.44Å; V231-I276 HydrophobicContact CB-CD1 3.65Å; V231-I276 HydrophobicContact CG1-CD1 3.49Å; V231-I276 VanDerWaalsContact CG1-CD1 3.49Å; L232-I276 HydrophobicContact CD2-CD1 4.04Å; L232-I276 HydrophobicContact CD2-CG1 4.18Å; L232-I276 HydrophobicContact CD2-CG2 3.83Å; L232-I276 HydrophobicContact CG-CD1 3.99Å; M235-I276 HydrophobicContact CB-CG2 4.04Å; M235-I276 HydrophobicContact CE-CG2 4.13Å; M235-I276 HydrophobicContact CG-CB 4.48Å; M235-I276 HydrophobicContact CG-CG2 3.77Å; I276-P296 HydrophobicContact CG2-CB 4.11Å; I276-V297 WeakPolarHBondContact CA-O 3.29Å; I276-I298 HydrophobicContact CG1-CG1 3.98Å
277	I	88.7	Confident	80.9	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	138	-179	-58.4	174	0	0	0	108.5	L172 I205 Y206 P296 V297 L299 I669	L172-I277 HydrophobicContact CD1-CD1 4.12Å; L172-I277 HydrophobicContact CD1-CG2 4.09Å; L172-I277 HydrophobicContact CD2-CD1 4.26Å; I205-I277 HydrophobicContact CG2-CG2 3.74Å; Y206-I277 WeakPolarHBondContact O-CA 3.39Å; I277-P296 CarbonylContact O-C 3.6Å; I277-P296 VanDerWaalsContact O-CA 3.31Å; I277-P296 WeakPolarHBondContact O-CA 3.31Å; I277-V297 PolarHBondContact N-O 2.78Å; I277-V297 PolarHBondContact O-N 3.38Å; I277-L299 HydrophobicContact CD1-CB 3.6Å; I277-L299 HydrophobicContact CD1-CD2 3.51Å; I277-L299 HydrophobicContact CD1-CG 4.15Å; I277-L299 HydrophobicContact CG1-CB 4.3Å; I277-I669 HydrophobicContact CD1-CD1 3.35Å; I277-I669 HydrophobicContact CG1-CD1 4.1Å
278	T	91.2	Very high	81	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.006	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	148.1	166.6	-170.5	0	0	0	0	109.9	Y206 M235 F243 Y294	Y206-T278 PolarHBondContact N-O 3.45Å; Y206-T278 PolarHBondContact O-N 2.93Å; Y206-T278 VanDerWaalsContact O-O 3.11Å; M235-T278 HydrophobicContact CE-CG2 3.62Å; F243-T278 HydrophobicContact CE2-CG2 4.35Å; F243-T278 HydrophobicContact CZ-CG2 4.44Å; T278-Y294 PolarHBondContact OG1-O 3.43Å
279	V	91.5	Very high	81.5	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	130	174.5	178.2	0	0	0	0	106.9	I145 F174 Y203 H204 I205 Y294	I145-V279 HydrophobicContact CD1-CB 4.09Å; I145-V279 HydrophobicContact CD1-CG2 3.74Å; I145-V279 HydrophobicContact CG1-CG2 4.42Å; F174-V279 HydrophobicContact CD1-CG2 4.46Å; F174-V279 HydrophobicContact CE1-CG1 4.49Å; F174-V279 HydrophobicContact CE1-CG2 4.14Å; F174-V279 HydrophobicContact CE2-CG1 4.15Å; F174-V279 HydrophobicContact CZ-CG1 4Å; F174-V279 HydrophobicContact CZ-CG2 4.45Å; Y203-V279 HydrophobicContact CD1-CG1 4.06Å; H204-V279 CarbonylContact O-C 3.26Å; H204-V279 WeakPolarHBondContact O-CA 3.26Å; I205-V279 HydrophobicContact CG1-CG2 4.33Å; V279-Y294 HydrophobicContact CB-CD2 4.18Å; V279-Y294 HydrophobicContact CB-CG 4.45Å; V279-Y294 HydrophobicContact CG1-CD2 4.16Å; V279-Y294 WeakPolarHBondContact O-CB 3.32Å; V279-Y294 WeakPolarHBondContact O-CD2 3.38Å; V279-Y294 PolarHBondContact O-N 2.77Å
280	V	91.8	Very high	82.3	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123	176.3	-179.3	0	0	0	0	107.6	H204 Y206 F238 Q291 P293	H204-V280 HydrophobicContact CB-CB 4.46Å; H204-V280 PolarHBondContact N-O 2.7Å; H204-V280 PolarHBondContact O-N 3.34Å; Y206-V280 HydrophobicContact CD2-CB 4.37Å; Y206-V280 HydrophobicContact CD2-CG2 3.75Å; Y206-V280 HydrophobicContact CE2-CB 4.06Å; Y206-V280 HydrophobicContact CE2-CG2 3.79Å; F238-V280 HydrophobicContact CD1-CG1 4.25Å; F238-V280 HydrophobicContact CD1-CG2 4.44Å; F238-V280 HydrophobicContact CD2-CG2 3.71Å; F238-V280 HydrophobicContact CE1-CG1 3.73Å; F238-V280 HydrophobicContact CE1-CG2 4.39Å; F238-V280 HydrophobicContact CE2-CB 4.43Å; F238-V280 HydrophobicContact CE2-CG1 4.27Å; F238-V280 HydrophobicContact CE2-CG2 3.66Å; F238-V280 HydrophobicContact CG-CG2 4.12Å; F238-V280 HydrophobicContact CZ-CB 4.35Å; F238-V280 HydrophobicContact CZ-CG1 3.74Å; F238-V280 HydrophobicContact CZ-CG2 4.01Å; V280-Q291 HydrophobicContact CG1-CB 3.95Å; V280-Q291 HydrophobicContact CG1-CG 4.43Å; V280-P293 HydrophobicContact CG2-CB 4.15Å
281	V	91.4	Very high	83.2	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	126.9	171.8	56.2	0	0	0	0	109.2	P127 A177 L201 Y203 Q291 V292 Y294	P127-V281 HydrophobicContact CB-CG1 4.23Å; P127-V281 HydrophobicContact CB-CG2 4.19Å; P127-V281 HydrophobicContact CG-CG1 3.94Å; P127-V281 HydrophobicContact CG-CG2 4.21Å; A177-V281 HydrophobicContact CB-CB 4.3Å; A177-V281 HydrophobicContact CB-CG1 4.17Å; A177-V281 HydrophobicContact CB-CG2 3.8Å; L201-V281 HydrophobicContact CD2-CG2 3.74Å; Y203-V281 HydrophobicContact CD1-CB 4Å; Y203-V281 HydrophobicContact CD1-CG2 4.19Å; Y203-V281 HydrophobicContact CE1-CB 3.91Å; Y203-V281 HydrophobicContact CE1-CG2 3.82Å; V281-Q291 CarbonylContact O-C 3.6Å; V281-Q291 VanDerWaalsContact O-CA 3.3Å; V281-Q291 WeakPolarHBondContact O-CA 3.32Å; V281-V292 HydrophobicContact CG1-CB 4.22Å; V281-V292 VanDerWaalsContact CG1-O 3.31Å; V281-V292 WeakPolarHBondContact CG1-O 3.46Å; V281-V292 PolarHBondContact N-O 3.44Å; V281-V292 PolarHBondContact O-N 3.5Å; V281-Y294 HydrophobicContact CB-CE2 4.14Å; V281-Y294 HydrophobicContact CG1-CE2 3.95Å
282	E	90.5	Very high	84.4	Confident	32 Å²	32	30.6 Å²	30.6	15%	0.15	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	135.3	171.6	-176.6	179	142.2	0	0	109.7	L201 V202 H204 T289 W290 Q291	L201-E282 WeakPolarHBondContact CA-O 3.43Å; V202-E282 HydrophobicContact CB-CB 4.45Å; V202-E282 PolarHBondContact N-O 2.88Å; V202-E282 PolarHBondContact O-N 3.35Å; H204-E282 IonicContact CD2-OE2 3.56Å; H204-E282 IonicContact CE1-OE2 3.46Å; H204-E282 IonicContact NE2-OE2 3.86Å; H204-E282 PolarHBondContact NE2-OE2 3.21Å; E282-T289 WeakPolarHBondContact OE1-CG2 3.17Å; E282-W290 CarbonylContact C-O 3.56Å; E282-W290 WeakPolarHBondContact CA-O 3.39Å; E282-Q291 HydrophobicContact CB-CG 3.87Å; E282-Q291 HydrophobicContact CG-CG 3.79Å; E282-Q291 PolarHBondContact OE2-NE2 2.83Å
283	Y	88.7	Confident	85.6	Confident	15 Å²	15	30.6 Å²	30.6	6%	0.059	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	119.6	169.5	-178.9	-126.7	0	0	0	109.3	I179 P180 L201 V285 T289 W290	I179-Y283 HydrophobicContact CG1-CE2 4.41Å; I179-Y283 HydrophobicContact CG2-CD2 4.34Å; I179-Y283 HydrophobicContact CG2-CE1 4.21Å; I179-Y283 HydrophobicContact CG2-CE2 3.54Å; I179-Y283 VanDerWaalsContact CG2-CZ 3.45Å; I179-Y283 WeakPolarHBondContact CG2-OH 3.4Å; P180-Y283 HydrophobicContact CG-CD1 3.68Å; P180-Y283 HydrophobicContact CG-CE1 3.39Å; L201-Y283 HydrophobicContact CD2-CD2 3.82Å; L201-Y283 HydrophobicContact CD2-CG 4.17Å; L201-Y283 HydrophobicContact CG-CD2 4.38Å; Y283-V285 HydrophobicContact CD1-CG2 3.76Å; Y283-V285 HydrophobicContact CD2-CG2 4.4Å; Y283-V285 HydrophobicContact CE1-CB 4.44Å; Y283-V285 HydrophobicContact CE1-CG2 3.05Å; Y283-V285 HydrophobicContact CE2-CG2 3.78Å; Y283-V285 HydrophobicContact CG-CG2 4.39Å; Y283-V285 WeakPolarHBondContact OH-CG2 3.37Å; Y283-T289 WeakPolarHBondContact O-CA 3.4Å; Y283-W290 PolarHBondContact N-O 2.86Å; Y283-W290 PolarHBondContact O-N 3.33Å
284	S	83.3	Confident	86.5	Confident	34 Å²	34	30.6 Å²	30.6	24%	0.238	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.6	179.7	55.7	0	0	0	0	111	G199 S200 D288	G199-S284 WeakPolarHBondContact CA-O 3.31Å; S200-S284 PolarHBondContact N-O 2.9Å; S200-S284 PolarHBondContact O-N 3.37Å; S200-S284 PolarHBondContact OG-OG 2.87Å; S284-D288 CarbonylContact C-O 3.59Å; S284-D288 WeakPolarHBondContact CA-O 3.36Å
285	V	81.8	Confident	87.2	Confident	34 Å²	34	30.6 Å²	30.6	21%	0.206	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	125	176.8	-175.1	0	0	0	0	109.4	Y283 G287 D288	Y283-V285 HydrophobicContact CD1-CG2 3.76Å; Y283-V285 HydrophobicContact CD2-CG2 4.4Å; Y283-V285 HydrophobicContact CE1-CB 4.44Å; Y283-V285 HydrophobicContact CE1-CG2 3.05Å; Y283-V285 HydrophobicContact CE2-CG2 3.78Å; Y283-V285 HydrophobicContact CG-CG2 4.39Å; Y283-V285 WeakPolarHBondContact OH-CG2 3.37Å; V285-G287 PolarHBondContact O-N 3.26Å; V285-D288 PolarHBondContact N-O 3.32Å; V285-D288 PolarHBondContact O-N 3.3Å
286	S	73.7	Confident	87.6	Confident	117 Å²	117	30.5 Å²	30.5	82%	0.818	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.6	29.8	172.8	53.8	0	0	0	0	115.4
287	G	74	Confident	87.7	Confident	73 Å²	73	30.8 Å²	30.8	75%	0.753	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	101.1	-21.2	-179.3	0	0	0	0	0	115.2	V285	V285-G287 PolarHBondContact O-N 3.26Å
288	D	81.3	Confident	87.4	Confident	101 Å²	101	30.9 Å²	30.9	54%	0.54	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	137.9	176.5	-66.7	-30.8	0	0	0	110.8	S284 V285	S284-D288 CarbonylContact C-O 3.59Å; S284-D288 WeakPolarHBondContact CA-O 3.36Å; V285-D288 PolarHBondContact N-O 3.32Å; V285-D288 PolarHBondContact O-N 3.3Å
289	T	86.5	Confident	86.8	Confident	78 Å²	78	31 Å²	31	48%	0.479	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	122.3	-178.9	58.8	0	0	0	0	110.9	E282 Y283	E282-T289 WeakPolarHBondContact OE1-CG2 3.17Å; Y283-T289 WeakPolarHBondContact O-CA 3.4Å
290	W	88.8	Confident	86	Confident	85 Å²	85	33.3 Å²	33.3	32%	0.322	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.2	178.4	-55.8	97.7	0	0	0	109.7	E125 F126 E282 Y283	E125-W290 HydrophobicContact CB-CD2 4.21Å; E125-W290 HydrophobicContact CB-CZ2 4.24Å; E125-W290 HydrophobicContact CG-CD2 3.87Å; E125-W290 HydrophobicContact CG-CE3 3.83Å; E125-W290 HydrophobicContact CG-CH2 3.86Å; E125-W290 HydrophobicContact CG-CZ2 3.91Å; E125-W290 HydrophobicContact CG-CZ3 3.81Å; F126-W290 HydrophobicContact CD1-CB 4.02Å; F126-W290 HydrophobicContact CD1-CE3 4.21Å; F126-W290 HydrophobicContact CD2-CE3 4.34Å; F126-W290 HydrophobicContact CE1-CB 4.43Å; F126-W290 AromaticContact CE1-CE3 3.69Å; F126-W290 HydrophobicContact CE1-CE3 3.69Å; F126-W290 HydrophobicContact CE1-CZ3 4.43Å; F126-W290 AromaticContact CE2-CE3 3.82Å; F126-W290 HydrophobicContact CE2-CE3 3.82Å; F126-W290 HydrophobicContact CE2-CZ3 4.03Å; F126-W290 HydrophobicContact CG-CB 4.47Å; F126-W290 AromaticContact CZ-CE3 3.47Å; F126-W290 HydrophobicContact CZ-CE3 3.47Å; F126-W290 VanDerWaalsContact CZ-CE3 3.47Å; F126-W290 AromaticContact CZ-CZ3 3.79Å; F126-W290 HydrophobicContact CZ-CZ3 3.79Å; E282-W290 CarbonylContact C-O 3.56Å; E282-W290 WeakPolarHBondContact CA-O 3.39Å; Y283-W290 PolarHBondContact N-O 2.86Å; Y283-W290 PolarHBondContact O-N 3.33Å
291	Q	90.7	Very high	84.7	Confident	63 Å²	63	33.5 Å²	33.5	29%	0.294	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.8	-173.1	-69	178.4	-9.9	0	0	111.6	F238 V280 V281 E282	F238-Q291 HydrophobicContact CE1-CB 3.95Å; F238-Q291 VanDerWaalsContact CZ-OE1 3.28Å; V280-Q291 HydrophobicContact CG1-CB 3.95Å; V280-Q291 HydrophobicContact CG1-CG 4.43Å; V281-Q291 CarbonylContact O-C 3.6Å; V281-Q291 VanDerWaalsContact O-CA 3.3Å; V281-Q291 WeakPolarHBondContact O-CA 3.32Å; E282-Q291 HydrophobicContact CB-CG 3.87Å; E282-Q291 HydrophobicContact CG-CG 3.79Å; E282-Q291 PolarHBondContact OE2-NE2 2.83Å
292	V	90.7	Very high	83.2	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	125.2	175.8	-176.5	0	0	0	0	110.3	Y122 F126 P127 P129 V281	Y122-V292 HydrophobicContact CD1-CG1 4.5Å; Y122-V292 HydrophobicContact CD1-CG2 3.85Å; Y122-V292 HydrophobicContact CD2-CG1 4.28Å; Y122-V292 HydrophobicContact CE1-CB 4.49Å; Y122-V292 HydrophobicContact CE1-CG1 4.14Å; Y122-V292 HydrophobicContact CE1-CG2 3.97Å; Y122-V292 HydrophobicContact CE2-CG1 3.9Å; Y122-V292 HydrophobicContact CG-CG2 4.29Å; F126-V292 HydrophobicContact CB-CG2 3.72Å; F126-V292 HydrophobicContact CD1-CG2 3.71Å; F126-V292 HydrophobicContact CG-CG2 4.13Å; P127-V292 HydrophobicContact CG-CG2 4.21Å; P127-V292 WeakPolarHBondContact O-CG2 3.35Å; P129-V292 HydrophobicContact CG-CG1 3.83Å; V281-V292 HydrophobicContact CG1-CB 4.22Å; V281-V292 VanDerWaalsContact CG1-O 3.31Å; V281-V292 WeakPolarHBondContact CG1-O 3.46Å; V281-V292 PolarHBondContact N-O 3.44Å; V281-V292 PolarHBondContact O-N 3.5Å
293	P	92.3	Very high	81.4	Confident	5 Å²	5	34.3 Å²	34.3	3%	0.032	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	139.6	174	32.2	-35.2	0	0	0	112	Y122 F238 V280	Y122-P293 WeakPolarHBondContact OH-CD 3.46Å; F238-P293 HydrophobicContact CB-CB 4.14Å; F238-P293 HydrophobicContact CB-CG 4Å; V280-P293 HydrophobicContact CG2-CB 4.15Å
294	Y	92.9	Very high	79.5	Confident	0 Å²	0	36 Å²	36	0%	0	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-69.9	166.8	158.5	-76.9	-105.5	0	0	0	109.9	P129 G130 T143 F174 S175 A177 Y203 T278 V279 V281	P129-Y294 WeakPolarHBondContact CA-OH 3.14Å; P129-Y294 HydrophobicContact CB-CD1 4Å; P129-Y294 HydrophobicContact CB-CD2 3.92Å; P129-Y294 HydrophobicContact CB-CE1 3.69Å; P129-Y294 HydrophobicContact CB-CE2 3.62Å; P129-Y294 HydrophobicContact CB-CG 4.09Å; P129-Y294 VanDerWaalsContact CB-CZ 3.48Å; G130-Y294 PolarHBondContact N-OH 2.99Å; T143-Y294 VanDerWaalsContact O-CD1 3.3Å; T143-Y294 WeakPolarHBondContact O-CD1 3.32Å; F174-Y294 HydrophobicContact CB-CD1 4.41Å; F174-Y294 HydrophobicContact CB-CE1 4.32Å; F174-Y294 HydrophobicContact CD2-CE1 4.05Å; F174-Y294 HydrophobicContact CD2-CE2 4.47Å; S175-Y294 PolarHBondContact O-OH 2.87Å; A177-Y294 PolarHBondContact N-OH 3.16Å; Y203-Y294 HydrophobicContact CE1-CE2 4.3Å; T278-Y294 PolarHBondContact OG1-O 3.43Å; V279-Y294 HydrophobicContact CB-CD2 4.18Å; V279-Y294 HydrophobicContact CB-CG 4.45Å; V279-Y294 HydrophobicContact CG1-CD2 4.16Å; V279-Y294 WeakPolarHBondContact O-CB 3.32Å; V279-Y294 WeakPolarHBondContact O-CD2 3.38Å; V279-Y294 PolarHBondContact O-N 2.77Å; V281-Y294 HydrophobicContact CB-CE2 4.14Å; V281-Y294 HydrophobicContact CG1-CE2 3.95Å
295	T	91.8	Very high	77.5	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.006	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-67.5	126.7	177.4	-60	0	0	0	0	110.2	Q62 H64 C89 G90 T143 I145	Q62-T295 HydrophobicContact CB-CG2 4.12Å; Q62-T295 HydrophobicContact CG-CG2 4.2Å; H64-T295 VanDerWaalsContact CE1-CG2 3.41Å; H64-T295 WeakPolarHBondContact CE1-CG2 3.46Å; C89-T295 WeakPolarHBondContact O-CG2 3.23Å; G90-T295 WeakPolarHBondContact CA-OG1 3.38Å; T143-T295 PolarHBondContact O-N 3.34Å; T143-T295 VanDerWaalsContact O-N 3.12Å; T143-T295 PolarHBondContact OG1-OG1 3.35Å; I145-T295 WeakPolarHBondContact CD1-O 3.41Å
296	P	91.3	Very high	75.4	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-65.1	142.2	178.9	23.7	-30.1	0	0	0	111.2	H64 L232 M235 A236 I276 I277	H64-P296 PolarHBondContact CE1-O 3.35Å; L232-P296 HydrophobicContact CD2-CB 4.13Å; L232-P296 HydrophobicContact CD2-CG 4.21Å; M235-P296 HydrophobicContact CB-CB 4.36Å; A236-P296 HydrophobicContact CB-CG 4.29Å; I276-P296 HydrophobicContact CG2-CB 4.11Å; I277-P296 CarbonylContact O-C 3.6Å; I277-P296 VanDerWaalsContact O-CA 3.31Å; I277-P296 WeakPolarHBondContact O-CA 3.31Å
297	V	88.1	Confident	73.4	Confident	7 Å²	7	43.3 Å²	43.3	4%	0.042	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	150.9	-179.2	70.6	0	0	0	0	110.5	H88 I145 T147 I276 I277	H88-V297 HydrophobicContact CB-CG2 4.28Å; I145-V297 HydrophobicContact CB-CB 4.27Å; I145-V297 HydrophobicContact CB-CG1 3.77Å; I145-V297 HydrophobicContact CD1-CG1 4.34Å; I145-V297 HydrophobicContact CG2-CG1 3.81Å; I145-V297 WeakPolarHBondContact O-CG2 3.08Å; T147-V297 HydrophobicContact CG2-CG1 3.84Å; T147-V297 HydrophobicContact CG2-CG2 3.97Å; I276-V297 WeakPolarHBondContact CA-O 3.29Å; I277-V297 PolarHBondContact N-O 2.78Å; I277-V297 PolarHBondContact O-N 3.38Å
298	I	83.2	Confident	71.4	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.3	170	-57.1	169	0	0	0	108.8	H88 L210 V228 A274 I276 Y300	H88-I298 VanDerWaalsContact NE2-CD1 3.26Å; H88-I298 WeakPolarHBondContact NE2-CD1 3.04Å; H88-I298 VanDerWaalsContact NE2-CG1 3.31Å; H88-I298 WeakPolarHBondContact NE2-CG1 3.26Å; L210-I298 HydrophobicContact CD2-CD1 4.22Å; L210-I298 HydrophobicContact CD2-CG1 4.41Å; L210-I298 HydrophobicContact CD2-CG2 4.02Å; V228-I298 HydrophobicContact CG1-CD1 3.46Å; V228-I298 VanDerWaalsContact CG1-CD1 3.46Å; V228-I298 HydrophobicContact CG1-CG1 4.45Å; A274-I298 HydrophobicContact CB-CG2 4.37Å; I276-I298 HydrophobicContact CG1-CG1 3.98Å; I298-Y300 HydrophobicContact CB-CE2 3.99Å; I298-Y300 HydrophobicContact CG2-CD1 4.04Å; I298-Y300 HydrophobicContact CG2-CD2 4.12Å; I298-Y300 HydrophobicContact CG2-CE1 3.69Å; I298-Y300 HydrophobicContact CG2-CE2 3.77Å; I298-Y300 HydrophobicContact CG2-CG 4.26Å
299	L	78.8	Confident	69	Low	5 Å²	5	45 Å²	45	3%	0.026	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	109.4	167	-176.7	68	0	0	0	109.1	T147 L172 V267 A274 Y275 I277	T147-L299 HydrophobicContact CG2-CD1 3.89Å; L172-L299 HydrophobicContact CD2-CD1 4.37Å; V267-L299 HydrophobicContact CG1-CD2 3.86Å; A274-L299 WeakPolarHBondContact CA-O 3.44Å; Y275-L299 PolarHBondContact N-O 3.4Å; Y275-L299 PolarHBondContact O-N 2.76Å; I277-L299 HydrophobicContact CD1-CB 3.6Å; I277-L299 HydrophobicContact CD1-CD2 3.51Å; I277-L299 HydrophobicContact CD1-CG 4.15Å; I277-L299 HydrophobicContact CG1-CB 4.3Å
300	Y	73.7	Confident	66.4	Low	47 Å²	47	45.8 Å²	45.8	18%	0.184	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	132.7	173.9	-62.7	-80.1	0	0	0	110.6	F67 A274 I298 C302 V326	F67-Y300 WeakPolarHBondContact CD1-OH 3.3Å; F67-Y300 HydrophobicContact CE1-CE1 4.16Å; A274-Y300 HydrophobicContact CB-CD1 4.27Å; I298-Y300 HydrophobicContact CB-CE2 3.99Å; I298-Y300 HydrophobicContact CG2-CD1 4.04Å; I298-Y300 HydrophobicContact CG2-CD2 4.12Å; I298-Y300 HydrophobicContact CG2-CE1 3.69Å; I298-Y300 HydrophobicContact CG2-CE2 3.77Å; I298-Y300 HydrophobicContact CG2-CG 4.26Å; Y300-C302 PolarHBondContact O-N 2.8Å; Y300-V326 HydrophobicContact CD1-CG2 3.75Å; Y300-V326 HydrophobicContact CE1-CG2 3.97Å
301	G	64.4	Low	63.8	Low	4 Å²	4	51.6 Å²	51.6	4%	0.041	27%	0.272	C	S	.	.	S	Bend	trans	-72.1	-16.6	174.4	0	0	0	0	0	113.6	R270 T273	R270-G301 VanDerWaalsContact O-CA 3.27Å; R270-G301 WeakPolarHBondContact O-CA 3.44Å; T273-G301 VanDerWaalsContact O-CA 3.28Å; T273-G301 WeakPolarHBondContact O-CA 3.06Å; T273-G301 PolarHBondContact O-N 2.85Å
302	C	60.3	Low	61	Low	11 Å²	11	59.5 Å²	59.5	7%	0.074	30%	0.299	C	S	.	.	S	Bend	trans	-94.5	151	174.7	-73.2	0	0	0	0	112.5	Y300 A304 C328	Y300-C302 PolarHBondContact O-N 2.8Å; C302-A304 PolarHBondContact O-N 3.46Å; C302-C328 HydrophobicContact CB-CB 4.18Å; C302-C328 WeakPolarHBondContact CB-SG 3.48Å; C302-C328 WeakPolarHBondContact SG-CB 3.29Å; C302-C328 CovalentContact SG-SG 2.02Å; C302-C328 PolarHBondContact SG-SG 3.41Å
303	P	53.5	Low	58	Low	39 Å²	39	64 Å²	64	25%	0.253	33%	0.327	S	S	.	.			trans	-63.5	121.1	161.5	28.7	-31.5	0	0	0	108.9	I149 Y167 Q305	I149-P303 HydrophobicContact CD1-CB 3.61Å; Y167-P303 HydrophobicContact CE2-CG 4.34Å; P303-Q305 VanDerWaalsContact C-N 3.27Å; P303-Q305 PolarHBondContact O-N 3.22Å
304	A	49.2	Very low	55	Low	50 Å²	50	69.5 Å²	69.5	41%	0.413	36%	0.36	S	S	.	.			trans	-65.4	97.7	160.8	0	0	0	0	0	105.9	C302 I306	C302-A304 PolarHBondContact O-N 3.46Å; A304-I306 PolarHBondContact O-N 3.47Å
305	Q	40	Very low	52	Low	163 Å²	163	80.3 Å²	80.3	76%	0.762	40%	0.403	S	S	*	.			trans	-64.6	92	163.8	-76	-174.4	0.7	0	0	105.7	P303 P307	P303-Q305 VanDerWaalsContact C-N 3.27Å; P303-Q305 PolarHBondContact O-N 3.22Å; Q305-P307 WeakPolarHBondContact O-CD 3.31Å
306	I	38.5	Very low	49	Very low	105 Å²	105	85.8 Å²	85.8	54%	0.538	43%	0.432	S	S	.	.			trans	-65.1	113.2	155.6	-55.9	170.1	0	0	0	102.8	A304 T308 F310	A304-I306 PolarHBondContact O-N 3.47Å; I306-T308 PolarHBondContact O-N 2.82Å; I306-F310 HydrophobicContact CG2-CB 4.28Å
307	P	30.5	Very low	46	Very low	70 Å²	70	90.4 Å²	90.4	46%	0.455	45%	0.453	S	S	.	.			trans	-53.4	122.4	178.3	-21.4	32.1	0	0	0	107.4	Q305 S309 F310	Q305-P307 WeakPolarHBondContact O-CD 3.31Å; P307-S309 PolarHBondContact O-N 2.71Å; P307-F310 WeakPolarHBondContact O-CB 3.11Å; P307-F310 PolarHBondContact O-N 3.29Å
308	T	32.5	Very low	43.4	Very low	132 Å²	132	91.8 Å²	91.8	81%	0.81	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-58.8	-16.4	-177.4	42.1	0	0	0	0	112.8	I306 F310	I306-T308 PolarHBondContact O-N 2.82Å; T308-F310 PolarHBondContact O-N 2.86Å
309	S	32.1	Very low	40.9	Very low	78 Å²	78	97 Å²	97	55%	0.545	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-62.2	-17.3	169.6	54.9	0	0	0	0	114.3	P307 Y311	P307-S309 PolarHBondContact O-N 2.71Å; S309-Y311 VanDerWaalsContact C-N 3.33Å; S309-Y311 PolarHBondContact O-N 3.49Å
310	F	32.1	Very low	38.6	Very low	95 Å²	95	103.3 Å²	103.3	42%	0.417	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-68.2	-28.2	-178.9	-114.6	-85.4	0	0	0	114	I306 P307 T308 P318	I306-F310 HydrophobicContact CG2-CB 4.28Å; P307-F310 WeakPolarHBondContact O-CB 3.11Å; P307-F310 PolarHBondContact O-N 3.29Å; T308-F310 PolarHBondContact O-N 2.86Å; F310-P318 HydrophobicContact CE1-CG 4.19Å; F310-P318 HydrophobicContact CE2-CB 4.49Å; F310-P318 HydrophobicContact CZ-CB 3.85Å; F310-P318 HydrophobicContact CZ-CG 3.72Å
311	Y	32.6	Very low	36.6	Very low	206 Å²	206	107.2 Å²	107.2	81%	0.808	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-86.8	-14.9	-174.6	-81.9	-76	0	0	0	114.5	S309	S309-Y311 VanDerWaalsContact C-N 3.33Å; S309-Y311 PolarHBondContact O-N 3.49Å
312	R	31.6	Very low	35.1	Very low	229 Å²	229	110.3 Å²	110.3	86%	0.864	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	-15.9	-166.5	-157.7	172.7	-92	-154.5	-2.2	115.8
313	T	29	Very low	34.1	Very low	95 Å²	95	112 Å²	112	58%	0.583	59%	0.588	S	S	*	*	S	Bend	trans	-144.4	94.8	-175.2	47.1	0	0	0	0	112.6
314	V	28.7	Very low	33.5	Very low	121 Å²	121	114.3 Å²	114.3	73%	0.733	60%	0.598	S	S	*	*			trans	66.4	141.9	161.4	-171.6	0	0	0	0	113.2	N316	V314-N316 PolarHBondContact O-N 3.19Å
315	Y	30.5	Very low	33.4	Very low	227 Å²	227	117 Å²	117	89%	0.89	60%	0.603	S	S	*	*			trans	-65.1	56.3	175	-72.5	-92.4	0	0	0	112.1	Q317	Y315-Q317 PolarHBondContact O-N 3.12Å
316	N	27.7	Very low	33.9	Very low	116 Å²	116	110.8 Å²	110.8	62%	0.62	58%	0.575	S	S	*	*			trans	-74.8	99.5	170	-77.9	-9.2	0	0	0	106.8	V314	V314-N316 PolarHBondContact O-N 3.19Å
317	Q	29.6	Very low	34.5	Very low	98 Å²	98	110 Å²	110	46%	0.458	57%	0.572	S	S	.	*			trans	-37.1	137.2	172.2	-68.5	164	-34.1	0	0	110.5	S108 Y315 T319	S108-Q317 WeakPolarHBondContact O-CG 3.35Å; S108-Q317 PolarHBondContact O-NE2 3.15Å; Y315-Q317 PolarHBondContact O-N 3.12Å; Q317-T319 HydrophobicContact CB-CG2 4.47Å; Q317-T319 PolarHBondContact O-N 3.31Å
318	P	33.1	Very low	35.5	Very low	36 Å²	36	108.5 Å²	108.5	23%	0.234	56%	0.563	C	S	.	*			trans	-67	88.4	169.5	4.1	9	0	0	0	108	Y109 F310 L320	Y109-P318 WeakPolarHBondContact CD1-O 3.26Å; Y109-P318 HydrophobicContact CE1-CB 4Å; Y109-P318 HydrophobicContact CE1-CG 3.68Å; Y109-P318 WeakPolarHBondContact CE1-O 3.11Å; F310-P318 HydrophobicContact CE1-CG 4.19Å; F310-P318 HydrophobicContact CE2-CB 4.49Å; F310-P318 HydrophobicContact CZ-CB 3.85Å; F310-P318 HydrophobicContact CZ-CG 3.72Å; P318-L320 PolarHBondContact O-N 3.39Å
319	T	29.5	Very low	36.4	Very low	109 Å²	109	103.7 Å²	103.7	67%	0.669	54%	0.54	S	S	*	.			trans	-86.6	22.5	166.5	45.8	0	0	0	0	111.5	Q317	Q317-T319 HydrophobicContact CB-CG2 4.47Å; Q317-T319 PolarHBondContact O-N 3.31Å
320	L	31.5	Very low	37.5	Very low	139 Å²	139	102.7 Å²	102.7	73%	0.728	53%	0.53	S	S	*	.			trans	-96.5	98.6	160.5	-91.2	137.7	0	0	0	107.4	P318 A322	P318-L320 PolarHBondContact O-N 3.39Å; L320-A322 HydrophobicContact CB-CB 4.38Å; L320-A322 HydrophobicContact CD2-CB 4.4Å; L320-A322 PolarHBondContact O-N 3.49Å
321	N	31.8	Very low	38.5	Very low	129 Å²	129	99.8 Å²	99.8	69%	0.69	52%	0.519	S	S	*	.			trans	-59.8	19.8	159.9	-123	11.2	0	0	0	112.5	S323	N321-S323 PolarHBondContact O-N 2.78Å
322	A	33	Very low	39.6	Very low	68 Å²	68	93.6 Å²	93.6	56%	0.562	50%	0.504	S	S	*	.			trans	-70.2	80.4	155.2	0	0	0	0	0	105.4	L320 L324	L320-A322 HydrophobicContact CB-CB 4.38Å; L320-A322 HydrophobicContact CD2-CB 4.4Å; L320-A322 PolarHBondContact O-N 3.49Å; A322-L324 PolarHBondContact O-N 3.49Å
323	S	38.2	Very low	40.7	Very low	46 Å²	46	89.9 Å²	89.9	32%	0.322	49%	0.494	S	S	.	.			trans	-35.6	123.5	146	49	0	0	0	0	105.2	N321 E325	N321-S323 PolarHBondContact O-N 2.78Å; S323-E325 PolarHBondContact O-N 3.42Å
324	L	42.7	Very low	41.9	Very low	89 Å²	89	92.5 Å²	92.5	47%	0.466	50%	0.504	S	S	.	.			trans	-55.7	80.5	177.2	-80.8	140.9	0	0	0	107.8	A322 V326	A322-L324 PolarHBondContact O-N 3.49Å; L324-V326 PolarHBondContact O-N 3.48Å
325	E	46.1	Very low	43.5	Very low	107 Å²	107	87.8 Å²	87.8	50%	0.5	48%	0.478	S	S	.	.			trans	-56.9	130.7	169.6	-74.1	-169.2	151.4	0	0	102.7	S323 N327	S323-E325 PolarHBondContact O-N 3.42Å; E325-N327 HydrophobicContact CB-CB 4.1Å; E325-N327 PolarHBondContact O-N 2.89Å
326	V	51.6	Low	45	Very low	31 Å²	31	81.4 Å²	81.4	19%	0.188	47%	0.465	C	S	.	.			trans	-72	60.1	175.9	-171.5	0	0	0	0	107.2	I211 Y300 L324 C328	I211-V326 HydrophobicContact CD1-CB 3.97Å; I211-V326 HydrophobicContact CD1-CG2 3.68Å; Y300-V326 HydrophobicContact CD1-CG2 3.75Å; Y300-V326 HydrophobicContact CE1-CG2 3.97Å; L324-V326 PolarHBondContact O-N 3.48Å; V326-C328 PolarHBondContact O-N 3.44Å
327	N	49.5	Very low	46.8	Very low	88 Å²	88	81.8 Å²	81.8	47%	0.471	47%	0.471	S	S	.	.			trans	-92.9	32.4	-170.4	-158.7	14.5	0	0	0	110.9	E325 K333	E325-N327 HydrophobicContact CB-CB 4.1Å; E325-N327 PolarHBondContact O-N 2.89Å; N327-K333 WeakPolarHBondContact OD1-CE 3.23Å; N327-K333 PolarHBondContact OD1-NZ 2.99Å
328	C	52.5	Low	48.7	Very low	39 Å²	39	80.3 Å²	80.3	26%	0.264	47%	0.465	S	S	.	.			trans	-105.2	85.6	169.4	4.5	0	0	0	0	107.5	A272 C302 V326	A272-C328 WeakPolarHBondContact CA-O 3.24Å; A272-C328 WeakPolarHBondContact CB-O 3.47Å; A272-C328 PolarHBondContact N-O 2.88Å; C302-C328 HydrophobicContact CB-CB 4.18Å; C302-C328 WeakPolarHBondContact CB-SG 3.48Å; C302-C328 WeakPolarHBondContact SG-CB 3.29Å; C302-C328 CovalentContact SG-SG 2.02Å; C302-C328 PolarHBondContact SG-SG 3.41Å; V326-C328 PolarHBondContact O-N 3.44Å
329	G	51.6	Low	50.4	Low	31 Å²	31	81.6 Å²	81.6	32%	0.32	47%	0.47	S	S	.	.			trans	-61.1	157	155.9	0	0	0	0	0	109.7	L331	G329-L331 PolarHBondContact O-N 3.26Å; G329-L331 VanDerWaalsContact O-N 3.15Å
330	T	53.8	Low	52.6	Low	58 Å²	58	83.2 Å²	83.2	36%	0.356	47%	0.468	S	S	.	.	S	Bend	trans	-57.9	-24.3	171	47.7	0	0	0	0	112.3	P271 F638	P271-T330 HydrophobicContact CB-CG2 4.37Å; T330-F638 WeakPolarHBondContact OG1-CD1 3.42Å; T330-F638 WeakPolarHBondContact OG1-CE1 3.35Å
331	L	54.3	Low	54.9	Low	33 Å²	33	79.4 Å²	79.4	17%	0.173	45%	0.452	C	S	.	.	S	Bend	trans	-116.1	135.5	174.2	-75	149	0	0	0	108.9	G329 K333 I338 F638	G329-L331 PolarHBondContact O-N 3.26Å; G329-L331 VanDerWaalsContact O-N 3.15Å; L331-K333 PolarHBondContact O-N 3.49Å; L331-I338 HydrophobicContact CD2-CB 3.92Å; L331-I338 HydrophobicContact CD2-CD1 4.33Å; L331-I338 HydrophobicContact CD2-CG2 3.17Å; L331-F638 HydrophobicContact CD1-CB 3.53Å; L331-F638 HydrophobicContact CD1-CD1 3.5Å; L331-F638 HydrophobicContact CD1-CD2 4.5Å; L331-F638 HydrophobicContact CD1-CE1 4.33Å; L331-F638 HydrophobicContact CD1-CG 3.61Å; L331-F638 HydrophobicContact CG-CD1 4.46Å
332	P	55.6	Low	57	Low	76 Å²	76	74.1 Å²	74.1	49%	0.494	42%	0.424	S	S	.	.			trans	-58.5	131.3	168.4	23.1	-29.9	0	0	0	109.2	D334 A335 I338	P332-D334 PolarHBondContact O-N 2.81Å; P332-A335 HydrophobicContact CB-CB 4.38Å; P332-A335 HydrophobicContact CG-CB 3.74Å; P332-I338 HydrophobicContact CG-CD1 3.74Å
333	K	53.4	Low	59.2	Low	152 Å²	152	73.1 Å²	73.1	66%	0.661	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	134.3	168.9	-67.8	175.7	176.8	170.7	0	107.1	N327 L331	N327-K333 WeakPolarHBondContact OD1-CE 3.23Å; N327-K333 PolarHBondContact OD1-NZ 2.99Å; L331-K333 PolarHBondContact O-N 3.49Å
334	D	55.2	Low	61.4	Low	149 Å²	149	75.1 Å²	75.1	80%	0.797	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	30.5	174.2	-43.6	-42	0	0	0	117.1	P332 P336	P332-D334 PolarHBondContact O-N 2.81Å; D334-P336 WeakPolarHBondContact O-CD 3.29Å
335	A	62	Low	63.3	Low	22 Å²	22	75.4 Å²	75.4	18%	0.182	42%	0.423	C	S	.	.			trans	-101	87.8	169.2	0	0	0	0	0	112	P332 V337 I338 L339	P332-A335 HydrophobicContact CB-CB 4.38Å; P332-A335 HydrophobicContact CG-CB 3.74Å; A335-V337 PolarHBondContact O-N 3.27Å; A335-V337 VanDerWaalsContact O-N 3.09Å; A335-I338 HydrophobicContact CB-CD1 4.03Å; A335-I338 HydrophobicContact CB-CG1 4.09Å; A335-I338 PolarHBondContact O-N 2.97Å; A335-L339 WeakPolarHBondContact O-CG 3.46Å; A335-L339 PolarHBondContact O-N 3.43Å; A335-L339 VanDerWaalsContact O-N 3.12Å
336	P	61.5	Low	65.1	Low	93 Å²	93	72.9 Å²	72.9	60%	0.604	41%	0.413	S	S	*	.	H	α-helix	trans	-57.6	-29	179.4	23.5	-33.9	0	0	0	112.6	D334 I338 L339 F340	D334-P336 WeakPolarHBondContact O-CD 3.29Å; P336-I338 PolarHBondContact O-N 3.17Å; P336-L339 PolarHBondContact O-N 3.31Å; P336-F340 WeakPolarHBondContact O-CB 3.22Å; P336-F340 PolarHBondContact O-N 3.36Å
337	V	67.3	Low	66.7	Low	125 Å²	125	76.4 Å²	76.4	76%	0.758	43%	0.43	S	S	*	.	H	α-helix	trans	-57	-30.8	176.2	-176.9	0	0	0	0	112.3	A335 P341	A335-V337 PolarHBondContact O-N 3.27Å; A335-V337 VanDerWaalsContact O-N 3.09Å; V337-P341 WeakPolarHBondContact O-CD 3.44Å; V337-P341 VanDerWaalsContact O-CG 3.32Å; V337-P341 WeakPolarHBondContact O-CG 3.07Å
338	I	68.7	Low	68.2	Low	66 Å²	66	74.6 Å²	74.6	34%	0.338	43%	0.428	S	S	.	.	H	α-helix	trans	-100.3	-35.6	-179.8	-43.6	175.5	0	0	0	111.2	L331 P332 A335 P336 F340 P341 V342	L331-I338 HydrophobicContact CD2-CB 3.92Å; L331-I338 HydrophobicContact CD2-CD1 4.33Å; L331-I338 HydrophobicContact CD2-CG2 3.17Å; P332-I338 HydrophobicContact CG-CD1 3.74Å; A335-I338 HydrophobicContact CB-CD1 4.03Å; A335-I338 HydrophobicContact CB-CG1 4.09Å; A335-I338 PolarHBondContact O-N 2.97Å; P336-I338 PolarHBondContact O-N 3.17Å; I338-F340 VanDerWaalsContact C-N 3.31Å; I338-F340 PolarHBondContact O-N 2.86Å; I338-P341 WeakPolarHBondContact O-CD 3.49Å; I338-V342 HydrophobicContact CG2-CG2 4.44Å; I338-V342 VanDerWaalsContact O-CG2 3.27Å; I338-V342 WeakPolarHBondContact O-CG2 3.01Å; I338-V342 PolarHBondContact O-N 2.97Å
339	L	69.1	Low	69.7	Low	64 Å²	64	73 Å²	73	34%	0.335	42%	0.418	S	S	.	.	H	α-helix	trans	-61.9	-37.6	178.8	-65.8	165.6	0	0	0	111.9	A335 P336 V342 A343 F639	A335-L339 WeakPolarHBondContact O-CG 3.46Å; A335-L339 PolarHBondContact O-N 3.43Å; A335-L339 VanDerWaalsContact O-N 3.12Å; P336-L339 PolarHBondContact O-N 3.31Å; L339-V342 PolarHBondContact O-N 3.27Å; L339-A343 WeakPolarHBondContact O-CB 3.38Å; L339-A343 PolarHBondContact O-N 2.88Å; L339-F639 HydrophobicContact CB-CE1 4.12Å; L339-F639 HydrophobicContact CD2-CD1 3.73Å; L339-F639 HydrophobicContact CD2-CE1 3.41Å; L339-F639 VanDerWaalsContact CD2-CE1 3.41Å; L339-F639 HydrophobicContact CG-CE1 4.37Å
340	F	76.1	Confident	71	Confident	143 Å²	143	76.2 Å²	76.2	63%	0.627	42%	0.423	S	S	*	.	H	α-helix	trans	-65.4	-51.1	-179.9	177.8	-100.1	0	0	0	113.4	P336 I338 V342 A343 I344	P336-F340 WeakPolarHBondContact O-CB 3.22Å; P336-F340 PolarHBondContact O-N 3.36Å; I338-F340 VanDerWaalsContact C-N 3.31Å; I338-F340 PolarHBondContact O-N 2.86Å; F340-V342 VanDerWaalsContact C-N 3.29Å; F340-V342 PolarHBondContact O-N 2.99Å; F340-A343 WeakPolarHBondContact O-CB 3.36Å; F340-A343 PolarHBondContact O-N 3.37Å; F340-A343 VanDerWaalsContact O-N 3.16Å; F340-I344 HydrophobicContact CD1-CD1 3.77Å; F340-I344 HydrophobicContact CE1-CD1 3.27Å; F340-I344 HydrophobicContact CE1-CG1 4.33Å; F340-I344 HydrophobicContact CE2-CD1 4.28Å; F340-I344 HydrophobicContact CG-CD1 4.47Å; F340-I344 HydrophobicContact CZ-CD1 3.57Å; F340-I344 HydrophobicContact CZ-CG1 4.31Å; F340-I344 PolarHBondContact O-N 2.95Å
341	P	78.3	Confident	72.2	Confident	59 Å²	59	77.4 Å²	77.4	38%	0.383	43%	0.427	S	S	.	.	H	α-helix	trans	-55.8	-39.7	171.4	-27.5	33.5	0	0	0	114	V337 I338 A343 I344 L345	V337-P341 WeakPolarHBondContact O-CD 3.44Å; V337-P341 VanDerWaalsContact O-CG 3.32Å; V337-P341 WeakPolarHBondContact O-CG 3.07Å; I338-P341 WeakPolarHBondContact O-CD 3.49Å; P341-A343 VanDerWaalsContact C-N 3.34Å; P341-I344 PolarHBondContact O-N 3.42Å; P341-L345 WeakPolarHBondContact O-CG 3.27Å; P341-L345 PolarHBondContact O-N 2.96Å
342	V	77.4	Confident	73.4	Confident	18 Å²	18	76.9 Å²	76.9	11%	0.109	42%	0.423	C	S	.	.	H	α-helix	trans	-66.5	-37.5	178.1	179.6	0	0	0	0	111	I338 L339 F340 L345 L346 C635 F638 F639	I338-V342 HydrophobicContact CG2-CG2 4.44Å; I338-V342 VanDerWaalsContact O-CG2 3.27Å; I338-V342 WeakPolarHBondContact O-CG2 3.01Å; I338-V342 PolarHBondContact O-N 2.97Å; L339-V342 PolarHBondContact O-N 3.27Å; F340-V342 VanDerWaalsContact C-N 3.29Å; F340-V342 PolarHBondContact O-N 2.99Å; V342-L345 PolarHBondContact O-N 2.84Å; V342-L346 WeakPolarHBondContact O-CB 3.47Å; V342-L346 PolarHBondContact O-N 3.35Å; V342-C635 HydrophobicContact CG1-CB 3.95Å; V342-F638 HydrophobicContact CG1-CB 4.41Å; V342-F639 HydrophobicContact CB-CE2 4.19Å; V342-F639 HydrophobicContact CB-CZ 3.76Å; V342-F639 HydrophobicContact CG1-CD2 4.34Å; V342-F639 HydrophobicContact CG1-CE1 4.44Å; V342-F639 HydrophobicContact CG1-CE2 3.5Å; V342-F639 HydrophobicContact CG1-CZ 3.56Å
343	A	79	Confident	74.3	Confident	46 Å²	46	73.6 Å²	73.6	38%	0.38	40%	0.402	S	S	.	.	H	α-helix	trans	-66	-39.3	174.3	0	0	0	0	0	112.1	L339 F340 P341 L346 L347 F639	L339-A343 WeakPolarHBondContact O-CB 3.38Å; L339-A343 PolarHBondContact O-N 2.88Å; F340-A343 WeakPolarHBondContact O-CB 3.36Å; F340-A343 PolarHBondContact O-N 3.37Å; F340-A343 VanDerWaalsContact O-N 3.16Å; P341-A343 VanDerWaalsContact C-N 3.34Å; A343-L346 WeakPolarHBondContact O-CB 3.3Å; A343-L346 PolarHBondContact O-N 2.8Å; A343-L347 PolarHBondContact O-N 3.38Å; A343-F639 HydrophobicContact CB-CZ 4.14Å
344	I	82.9	Confident	75.3	Confident	88 Å²	88	68.2 Å²	68.2	45%	0.451	38%	0.382	S	S	.	.	H	α-helix	trans	-62.5	-44.5	172.9	-67.9	169	0	0	0	110.6	F340 P341 L346 L347 A348	F340-I344 HydrophobicContact CD1-CD1 3.77Å; F340-I344 HydrophobicContact CE1-CD1 3.27Å; F340-I344 HydrophobicContact CE1-CG1 4.33Å; F340-I344 HydrophobicContact CE2-CD1 4.28Å; F340-I344 HydrophobicContact CG-CD1 4.47Å; F340-I344 HydrophobicContact CZ-CD1 3.57Å; F340-I344 HydrophobicContact CZ-CG1 4.31Å; F340-I344 PolarHBondContact O-N 2.95Å; P341-I344 PolarHBondContact O-N 3.42Å; I344-L346 VanDerWaalsContact C-N 3.29Å; I344-L346 PolarHBondContact O-N 3.24Å; I344-L347 PolarHBondContact O-N 2.63Å; I344-A348 VanDerWaalsContact O-CB 3.29Å; I344-A348 WeakPolarHBondContact O-CB 3.45Å; I344-A348 PolarHBondContact O-N 2.97Å
345	L	83.8	Confident	75.8	Confident	95 Å²	95	62.3 Å²	62.3	50%	0.497	35%	0.353	S	S	.	.	H	α-helix	trans	-63.5	-35.4	177.1	-74.9	171.1	0	0	0	112.2	P341 V342 A348 G349	P341-L345 WeakPolarHBondContact O-CG 3.27Å; P341-L345 PolarHBondContact O-N 2.96Å; V342-L345 PolarHBondContact O-N 2.84Å; L345-A348 PolarHBondContact O-N 3.2Å; L345-G349 PolarHBondContact O-N 3.19Å
346	L	84.2	Confident	76	Confident	54 Å²	54	62.8 Å²	62.8	28%	0.283	35%	0.354	S	S	.	.	H	α-helix	trans	-61.8	-49.4	173.3	-176.8	146.8	0	0	0	111	V342 A343 I344 G349 F350 C635 T636 F639	V342-L346 WeakPolarHBondContact O-CB 3.47Å; V342-L346 PolarHBondContact O-N 3.35Å; A343-L346 WeakPolarHBondContact O-CB 3.3Å; A343-L346 PolarHBondContact O-N 2.8Å; I344-L346 VanDerWaalsContact C-N 3.29Å; I344-L346 PolarHBondContact O-N 3.24Å; L346-G349 PolarHBondContact O-N 3.14Å; L346-F350 WeakPolarHBondContact O-CB 3.49Å; L346-F350 PolarHBondContact O-N 3.5Å; L346-C635 HydrophobicContact CB-CB 3.7Å; L346-C635 HydrophobicContact CD1-CB 3.95Å; L346-C635 HydrophobicContact CG-CB 4.19Å; L346-T636 HydrophobicContact CD1-CG2 3.63Å; L346-F639 HydrophobicContact CD1-CD2 4.35Å; L346-F639 HydrophobicContact CD1-CE2 4.3Å
347	L	83.7	Confident	76	Confident	106 Å²	106	59.5 Å²	59.5	56%	0.555	33%	0.331	S	S	*	.	H	α-helix	trans	-64	-44.8	178.1	-175.9	65.5	0	0	0	111.1	A343 I344 F350 L351	A343-L347 PolarHBondContact O-N 3.38Å; I344-L347 PolarHBondContact O-N 2.63Å; L347-F350 PolarHBondContact O-N 3.02Å; L347-L351 HydrophobicContact CD1-CD1 4.49Å; L347-L351 HydrophobicContact CG-CD1 4.11Å; L347-L351 WeakPolarHBondContact O-CB 3.44Å; L347-L351 VanDerWaalsContact O-CG 3.26Å; L347-L351 WeakPolarHBondContact O-CG 3.23Å; L347-L351 PolarHBondContact O-N 3.13Å
348	A	83	Confident	75.7	Confident	50 Å²	50	61.5 Å²	61.5	41%	0.413	34%	0.335	S	S	.	.	H	α-helix	trans	-64	-41.8	178.7	0	0	0	0	0	112.2	I344 L345 L351 Y352	I344-A348 VanDerWaalsContact O-CB 3.29Å; I344-A348 WeakPolarHBondContact O-CB 3.45Å; I344-A348 PolarHBondContact O-N 2.97Å; L345-A348 PolarHBondContact O-N 3.2Å; A348-L351 PolarHBondContact O-N 3.41Å; A348-Y352 VanDerWaalsContact O-CB 3.27Å; A348-Y352 WeakPolarHBondContact O-CB 3.3Å; A348-Y352 PolarHBondContact O-N 3.02Å
349	G	82.2	Confident	75.7	Confident	6 Å²	6	65.6 Å²	65.6	6%	0.062	35%	0.346	C	S	.	.	H	α-helix	trans	-64.6	-40.7	175.5	0	0	0	0	0	112.1	L345 L346 Y352 A353 T632	L345-G349 PolarHBondContact O-N 3.19Å; L346-G349 PolarHBondContact O-N 3.14Å; G349-Y352 WeakPolarHBondContact O-CB 3.3Å; G349-Y352 PolarHBondContact O-N 2.99Å; G349-A353 PolarHBondContact O-N 3.23Å; G349-T632 VanDerWaalsContact C-CG2 3.44Å
350	F	79.7	Confident	75.6	Confident	97 Å²	97	63.3 Å²	63.3	43%	0.425	33%	0.334	S	S	.	.	H	α-helix	trans	-66.8	-44.1	176.6	-176.8	-99.5	0	0	0	111.3	L346 L347 Y352 A353 T354 T632	L346-F350 WeakPolarHBondContact O-CB 3.49Å; L346-F350 PolarHBondContact O-N 3.5Å; L347-F350 PolarHBondContact O-N 3.02Å; F350-Y352 VanDerWaalsContact C-N 3.3Å; F350-Y352 PolarHBondContact O-N 2.94Å; F350-A353 PolarHBondContact O-N 3.04Å; F350-T354 HydrophobicContact CD1-CG2 4.23Å; F350-T354 HydrophobicContact CD2-CG2 4.15Å; F350-T354 HydrophobicContact CE1-CG2 3.82Å; F350-T354 HydrophobicContact CE2-CG2 3.74Å; F350-T354 HydrophobicContact CG-CG2 4.39Å; F350-T354 HydrophobicContact CZ-CG2 3.57Å; F350-T354 WeakPolarHBondContact O-CB 3.18Å; F350-T354 WeakPolarHBondContact O-CG2 3.41Å; F350-T354 PolarHBondContact O-N 2.98Å; F350-T354 PolarHBondContact O-OG1 3.14Å; F350-T632 VanDerWaalsContact CA-CG2 3.47Å; F350-T632 HydrophobicContact CB-CG2 3.74Å
351	L	79.7	Confident	75.4	Confident	83 Å²	83	59.4 Å²	59.4	44%	0.435	32%	0.315	S	S	.	.	H	α-helix	trans	-62.6	-38.6	172.8	-71	172.9	0	0	0	111	L347 A348 A353 T354 S355	L347-L351 HydrophobicContact CD1-CD1 4.49Å; L347-L351 HydrophobicContact CG-CD1 4.11Å; L347-L351 WeakPolarHBondContact O-CB 3.44Å; L347-L351 VanDerWaalsContact O-CG 3.26Å; L347-L351 WeakPolarHBondContact O-CG 3.23Å; L347-L351 PolarHBondContact O-N 3.13Å; A348-L351 PolarHBondContact O-N 3.41Å; L351-A353 VanDerWaalsContact C-N 3.33Å; L351-A353 PolarHBondContact O-N 2.99Å; L351-T354 PolarHBondContact O-N 3.11Å; L351-S355 WeakPolarHBondContact O-CA 3.3Å; L351-S355 WeakPolarHBondContact O-CB 3.29Å; L351-S355 PolarHBondContact O-N 3.4Å; L351-S355 PolarHBondContact O-OG 2.99Å
352	Y	79.1	Confident	75.2	Confident	22 Å²	22	59.8 Å²	59.8	9%	0.086	32%	0.317	C	S	.	.	H	α-helix	trans	-63.3	-37.9	175.8	-177.1	-91.2	0	0	0	112.1	A348 G349 F350 R363 V366 T624 V627	A348-Y352 VanDerWaalsContact O-CB 3.27Å; A348-Y352 WeakPolarHBondContact O-CB 3.3Å; A348-Y352 PolarHBondContact O-N 3.02Å; G349-Y352 WeakPolarHBondContact O-CB 3.3Å; G349-Y352 PolarHBondContact O-N 2.99Å; F350-Y352 VanDerWaalsContact C-N 3.3Å; F350-Y352 PolarHBondContact O-N 2.94Å; Y352-R363 HydrophobicContact CD2-CB 4.38Å; Y352-R363 HydrophobicContact CD2-CG 3.95Å; Y352-R363 HydrophobicContact CE2-CB 3.8Å; Y352-R363 HydrophobicContact CE2-CG 3.86Å; Y352-R363 PolarHBondContact O-NE 3.26Å; Y352-R363 PolarHBondContact O-NH2 2.72Å; Y352-V366 HydrophobicContact CD2-CG1 4.18Å; Y352-V366 HydrophobicContact CE2-CB 4.24Å; Y352-V366 HydrophobicContact CE2-CG1 4.08Å; Y352-T624 HydrophobicContact CE1-CG2 4.39Å; Y352-V627 HydrophobicContact CE1-CB 4.04Å; Y352-V627 HydrophobicContact CE1-CG1 3.99Å
353	A	75.2	Confident	75.1	Confident	8 Å²	8	59.2 Å²	59.2	7%	0.066	31%	0.313	C	S	.	.	H	α-helix	trans	-68.7	-50.8	172.6	0	0	0	0	0	111.6	G349 F350 L351 R363 F629	G349-A353 PolarHBondContact O-N 3.23Å; F350-A353 PolarHBondContact O-N 3.04Å; L351-A353 VanDerWaalsContact C-N 3.33Å; L351-A353 PolarHBondContact O-N 2.99Å; A353-R363 PolarHBondContact O-NH2 2.85Å; A353-R363 VanDerWaalsContact O-NH2 3.07Å; A353-F629 HydrophobicContact CB-CD2 4.17Å; A353-F629 HydrophobicContact CB-CE2 3.92Å; A353-F629 HydrophobicContact CB-CZ 4.37Å
354	T	73.5	Confident	74.9	Confident	39 Å²	39	57 Å²	57	24%	0.239	30%	0.295	C	S	.	.	H	α-helix	trans	-92.3	-17.9	-164.5	58.8	0	0	0	0	116.1	F350 L351 C356 F690	F350-T354 HydrophobicContact CD1-CG2 4.23Å; F350-T354 HydrophobicContact CD2-CG2 4.15Å; F350-T354 HydrophobicContact CE1-CG2 3.82Å; F350-T354 HydrophobicContact CE2-CG2 3.74Å; F350-T354 HydrophobicContact CG-CG2 4.39Å; F350-T354 HydrophobicContact CZ-CG2 3.57Å; F350-T354 WeakPolarHBondContact O-CB 3.18Å; F350-T354 WeakPolarHBondContact O-CG2 3.41Å; F350-T354 PolarHBondContact O-N 2.98Å; F350-T354 PolarHBondContact O-OG1 3.14Å; L351-T354 PolarHBondContact O-N 3.11Å; T354-C356 PolarHBondContact O-N 3.03Å; T354-C356 PolarHBondContact O-SG 3.37Å; T354-F690 HydrophobicContact CG2-CE1 4.4Å
355	S	66.8	Low	74.7	Confident	25 Å²	25	53.6 Å²	53.6	18%	0.175	28%	0.28	C	S	.	.			trans	-61.4	7.4	-177.7	51.6	0	0	0	0	117	L351 N357 M358 R363	L351-S355 WeakPolarHBondContact O-CA 3.3Å; L351-S355 WeakPolarHBondContact O-CB 3.29Å; L351-S355 PolarHBondContact O-N 3.4Å; L351-S355 PolarHBondContact O-OG 2.99Å; S355-N357 PolarHBondContact O-N 2.92Å; S355-M358 PolarHBondContact O-N 3.1Å; S355-R363 PolarHBondContact OG-NE 3.47Å; S355-R363 PolarHBondContact OG-NH2 3.25Å
356	C	64.3	Low	74.5	Confident	32 Å²	32	52 Å²	52	22%	0.216	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	35.1	-132.8	175.3	-63.4	0	0	0	0	113.9	T354 L697	T354-C356 PolarHBondContact O-N 3.03Å; T354-C356 PolarHBondContact O-SG 3.37Å; C356-L697 HydrophobicContact CB-CD1 3.97Å; C356-L697 WeakPolarHBondContact SG-CD1 3.48Å
357	N	61.5	Low	74.4	Confident	23 Å²	23	49.4 Å²	49.4	12%	0.123	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-20.6	-172.9	-158.8	-11.7	0	0	0	113.4	S355 W359 I360 Q701	S355-N357 PolarHBondContact O-N 2.92Å; N357-W359 PolarHBondContact O-N 3.26Å; N357-W359 VanDerWaalsContact O-N 3.11Å; N357-I360 WeakPolarHBondContact OD1-CD1 3.36Å; N357-Q701 PolarHBondContact ND2-NE2 3.4Å; N357-Q701 PolarHBondContact ND2-OE1 2.88Å
358	M	61.9	Low	74.3	Confident	168 Å²	168	44.9 Å²	44.9	83%	0.828	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-35.2	-171.5	-66.2	-94	-80.3	0	0	111.1	S355	S355-M358 PolarHBondContact O-N 3.1Å
359	W	67.8	Low	74.3	Confident	151 Å²	151	45.3 Å²	45.3	57%	0.572	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.6	43.4	-166.7	-64.9	20.9	0	0	0	113.2	N357 W361 P362 R363	N357-W359 PolarHBondContact O-N 3.26Å; N357-W359 VanDerWaalsContact O-N 3.11Å; W359-W361 PolarHBondContact O-N 2.63Å; W359-P362 HydrophobicContact CB-CB 4.43Å; W359-P362 HydrophobicContact CB-CG 4.17Å; W359-P362 WeakPolarHBondContact O-CD 3.38Å; W359-R363 VanDerWaalsContact O-CG 3.32Å; W359-R363 WeakPolarHBondContact O-CG 3.29Å; W359-R363 PolarHBondContact O-N 3.38Å
360	I	68.1	Low	74.4	Confident	17 Å²	17	48 Å²	48	9%	0.087	25%	0.245	C	C	.	.	H	α-helix	trans	-56.3	-47.9	179.5	-68.7	172.8	0	0	0	112.7	N357 R363 C364 F620	N357-I360 WeakPolarHBondContact OD1-CD1 3.36Å; I360-R363 PolarHBondContact O-N 2.93Å; I360-C364 PolarHBondContact O-N 3.13Å; I360-C364 VanDerWaalsContact O-N 3.12Å; I360-C364 PolarHBondContact O-SG 3.3Å; I360-F620 HydrophobicContact CB-CZ 4.32Å; I360-F620 HydrophobicContact CG1-CE1 4.2Å; I360-F620 HydrophobicContact CG1-CZ 3.98Å; I360-F620 HydrophobicContact CG2-CE2 4.25Å; I360-F620 HydrophobicContact CG2-CZ 3.96Å
361	W	71.5	Confident	74.5	Confident	61 Å²	61	44.8 Å²	44.8	23%	0.231	23%	0.232	C	C	.	.	H	α-helix	trans	-69.1	-45.4	-174.6	-61	110.9	0	0	0	113.1	W359 R363 C364 A365 F409 W413 V417 R561 A564	W359-W361 PolarHBondContact O-N 2.63Å; W361-R363 VanDerWaalsContact C-N 3.27Å; W361-R363 PolarHBondContact O-N 3.32Å; W361-C364 PolarHBondContact O-N 3.01Å; W361-A365 PolarHBondContact O-N 3.36Å; W361-F409 HydrophobicContact CE3-CZ 4.03Å; W361-W413 AromaticContact CD2-CD1 3.8Å; W361-W413 AromaticContact CD2-NE1 3.65Å; W361-W413 AromaticContact CE2-NE1 3.91Å; W361-W413 AromaticContact CE3-CD1 3.58Å; W361-W413 AromaticContact CE3-NE1 3.94Å; W361-W413 AromaticContact CG-NE1 3.9Å; W361-W413 AromaticContact CZ3-CD1 3.88Å; W361-V417 HydrophobicContact CH2-CB 4.15Å; W361-V417 HydrophobicContact CH2-CG1 3.39Å; W361-V417 HydrophobicContact CH2-CG2 3.66Å; W361-V417 HydrophobicContact CZ2-CG1 3.34Å; W361-V417 HydrophobicContact CZ2-CG2 4.48Å; W361-V417 HydrophobicContact CZ3-CG1 4.19Å; W361-V417 HydrophobicContact CZ3-CG2 3.97Å; W361-R561 HydrophobicContact CH2-CG 4.4Å; W361-R561 HydrophobicContact CZ2-CG 4.38Å; W361-A564 HydrophobicContact CH2-CB 4.15Å; W361-A564 HydrophobicContact CZ3-CB 3.77Å
362	P	73.8	Confident	74.6	Confident	66 Å²	66	41.4 Å²	41.4	43%	0.429	22%	0.217	S	C	.	.	H	α-helix	trans	-53.4	-42.1	169.7	-28.5	34.7	0	0	0	113.2	W359 C364 A365 V366	W359-P362 HydrophobicContact CB-CB 4.43Å; W359-P362 HydrophobicContact CB-CG 4.17Å; W359-P362 WeakPolarHBondContact O-CD 3.38Å; P362-C364 PolarHBondContact O-N 3.41Å; P362-A365 WeakPolarHBondContact O-CB 3.4Å; P362-A365 PolarHBondContact O-N 3.34Å; P362-V366 VanDerWaalsContact O-CG2 3.32Å; P362-V366 WeakPolarHBondContact O-CG2 3.44Å; P362-V366 PolarHBondContact O-N 3.28Å
363	R	74.6	Confident	74.9	Confident	6 Å²	6	41.7 Å²	41.7	2%	0.023	22%	0.222	C	C	.	.	H	α-helix	trans	-61.8	-42.9	177.6	-71.5	171.5	175.3	-145.9	-6.9	112.6	Y352 A353 S355 W359 I360 W361 A365 V366 S367 T624	Y352-R363 HydrophobicContact CD2-CB 4.38Å; Y352-R363 HydrophobicContact CD2-CG 3.95Å; Y352-R363 HydrophobicContact CE2-CB 3.8Å; Y352-R363 HydrophobicContact CE2-CG 3.86Å; Y352-R363 PolarHBondContact O-NE 3.26Å; Y352-R363 PolarHBondContact O-NH2 2.72Å; A353-R363 PolarHBondContact O-NH2 2.85Å; A353-R363 VanDerWaalsContact O-NH2 3.07Å; S355-R363 PolarHBondContact OG-NE 3.47Å; S355-R363 PolarHBondContact OG-NH2 3.25Å; W359-R363 VanDerWaalsContact O-CG 3.32Å; W359-R363 WeakPolarHBondContact O-CG 3.29Å; W359-R363 PolarHBondContact O-N 3.38Å; I360-R363 PolarHBondContact O-N 2.93Å; W361-R363 VanDerWaalsContact C-N 3.27Å; W361-R363 PolarHBondContact O-N 3.32Å; R363-A365 VanDerWaalsContact C-N 3.33Å; R363-V366 PolarHBondContact O-N 2.94Å; R363-S367 WeakPolarHBondContact O-CB 3.45Å; R363-S367 PolarHBondContact O-N 3.45Å; R363-S367 PolarHBondContact O-OG 3.31Å; R363-T624 PolarHBondContact NH1-OG1 2.93Å
364	C	76.3	Confident	75.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-65.3	-39	176.8	-61	0	0	0	0	111.3	I360 W361 P362 S367 A368 F409	I360-C364 PolarHBondContact O-N 3.13Å; I360-C364 VanDerWaalsContact O-N 3.12Å; I360-C364 PolarHBondContact O-SG 3.3Å; W361-C364 PolarHBondContact O-N 3.01Å; P362-C364 PolarHBondContact O-N 3.41Å; C364-S367 PolarHBondContact O-N 2.78Å; C364-S367 PolarHBondContact O-OG 3.38Å; C364-A368 WeakPolarHBondContact O-CB 3.14Å; C364-A368 PolarHBondContact O-N 3.12Å; C364-F409 HydrophobicContact CB-CE2 3.67Å; C364-F409 HydrophobicContact CB-CZ 3.56Å
365	A	77.2	Confident	75.7	Confident	16 Å²	16	45 Å²	45	13%	0.132	24%	0.237	C	C	.	.	H	α-helix	trans	-62.7	-46.3	174.4	0	0	0	0	0	111.3	W361 P362 R363 S367 A368 M369 F409	W361-A365 PolarHBondContact O-N 3.36Å; P362-A365 WeakPolarHBondContact O-CB 3.4Å; P362-A365 PolarHBondContact O-N 3.34Å; R363-A365 VanDerWaalsContact C-N 3.33Å; A365-S367 PolarHBondContact O-N 2.89Å; A365-A368 WeakPolarHBondContact O-CB 3.38Å; A365-A368 PolarHBondContact O-N 3.24Å; A365-M369 WeakPolarHBondContact O-CG 3.19Å; A365-M369 PolarHBondContact O-N 3.39Å; A365-F409 HydrophobicContact CB-CD1 3.8Å; A365-F409 HydrophobicContact CB-CE1 3.73Å
366	V	80.4	Confident	76.3	Confident	61 Å²	61	44 Å²	44	37%	0.37	23%	0.231	S	C	.	.	H	α-helix	trans	-62.3	-42.9	176.9	171.7	0	0	0	0	111.3	Y352 P362 R363 A368 M369 I370	Y352-V366 HydrophobicContact CD2-CG1 4.18Å; Y352-V366 HydrophobicContact CE2-CB 4.24Å; Y352-V366 HydrophobicContact CE2-CG1 4.08Å; P362-V366 VanDerWaalsContact O-CG2 3.32Å; P362-V366 WeakPolarHBondContact O-CG2 3.44Å; P362-V366 PolarHBondContact O-N 3.28Å; R363-V366 PolarHBondContact O-N 2.94Å; V366-A368 VanDerWaalsContact C-N 3.32Å; V366-A368 PolarHBondContact O-N 3.38Å; V366-M369 WeakPolarHBondContact O-CB 2.94Å; V366-M369 PolarHBondContact O-N 3.06Å; V366-I370 HydrophobicContact CG1-CD1 3.84Å; V366-I370 HydrophobicContact CG1-CG1 4.39Å; V366-I370 VanDerWaalsContact O-CG1 3.31Å; V366-I370 WeakPolarHBondContact O-CG1 2.98Å; V366-I370 PolarHBondContact O-N 3.2Å
367	S	82.6	Confident	77.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.3	-36.6	177.2	73.3	0	0	0	0	112.1	R363 C364 A365 M371	R363-S367 WeakPolarHBondContact O-CB 3.45Å; R363-S367 PolarHBondContact O-N 3.45Å; R363-S367 PolarHBondContact O-OG 3.31Å; C364-S367 PolarHBondContact O-N 2.78Å; C364-S367 PolarHBondContact O-OG 3.38Å; A365-S367 PolarHBondContact O-N 2.89Å; S367-M371 WeakPolarHBondContact O-CG 3.41Å; S367-M371 PolarHBondContact O-N 3.05Å
368	A	82.2	Confident	77.9	Confident	12 Å²	12	45.4 Å²	45.4	10%	0.099	24%	0.236	C	C	.	.	H	α-helix	trans	-62.2	-44.8	172.6	0	0	0	0	0	111.5	C364 A365 V366 M371 G372 L567	C364-A368 WeakPolarHBondContact O-CB 3.14Å; C364-A368 PolarHBondContact O-N 3.12Å; A365-A368 WeakPolarHBondContact O-CB 3.38Å; A365-A368 PolarHBondContact O-N 3.24Å; V366-A368 VanDerWaalsContact C-N 3.32Å; V366-A368 PolarHBondContact O-N 3.38Å; A368-M371 PolarHBondContact O-N 2.93Å; A368-G372 PolarHBondContact O-N 3.1Å; A368-L567 HydrophobicContact CB-CD2 3.69Å
369	M	82.9	Confident	78.5	Confident	58 Å²	58	41.5 Å²	41.5	29%	0.286	22%	0.217	S	C	.	.	H	α-helix	trans	-62	-46	177.1	-72.9	178	70.1	0	0	112	A365 V366 M371 G372 S373 A402 L406	A365-M369 WeakPolarHBondContact O-CG 3.19Å; A365-M369 PolarHBondContact O-N 3.39Å; V366-M369 WeakPolarHBondContact O-CB 2.94Å; V366-M369 PolarHBondContact O-N 3.06Å; M369-M371 VanDerWaalsContact C-N 3.35Å; M369-M371 PolarHBondContact O-N 2.97Å; M369-G372 PolarHBondContact O-N 3.27Å; M369-S373 WeakPolarHBondContact O-CB 3.3Å; M369-S373 PolarHBondContact O-N 3.25Å; M369-A402 HydrophobicContact CB-CB 4.24Å; M369-A402 HydrophobicContact CE-CB 4.32Å; M369-L406 HydrophobicContact CG-CB 3.93Å; M369-L406 HydrophobicContact CG-CD1 4.05Å; M369-L406 HydrophobicContact SD-CB 4.41Å; M369-L406 HydrophobicContact SD-CD1 3.45Å; M369-L406 WeakPolarHBondContact SD-CD1 3.4Å
370	I	82.6	Confident	78.8	Confident	63 Å²	63	38.5 Å²	38.5	32%	0.323	21%	0.209	S	C	.	.	H	α-helix	trans	-59	-49	178.2	-68.7	166.6	0	0	0	109.6	V366 S373 V374 P571	V366-I370 HydrophobicContact CG1-CD1 3.84Å; V366-I370 HydrophobicContact CG1-CG1 4.39Å; V366-I370 VanDerWaalsContact O-CG1 3.31Å; V366-I370 WeakPolarHBondContact O-CG1 2.98Å; V366-I370 PolarHBondContact O-N 3.2Å; I370-S373 PolarHBondContact O-N 3.04Å; I370-V374 HydrophobicContact CG2-CG2 4.47Å; I370-V374 VanDerWaalsContact O-CG2 3.3Å; I370-V374 WeakPolarHBondContact O-CG2 3.47Å; I370-V374 PolarHBondContact O-N 3.33Å; I370-P571 HydrophobicContact CG2-CB 4.35Å
371	M	82.5	Confident	78.7	Confident	29 Å²	29	41.1 Å²	41.1	14%	0.143	22%	0.218	C	C	.	.	H	α-helix	trans	-66.7	-40.2	179.3	-70.7	-56.3	-57.3	0	0	112.6	S367 A368 M369 S373 V374 I375 L570 P571	S367-M371 WeakPolarHBondContact O-CG 3.41Å; S367-M371 PolarHBondContact O-N 3.05Å; A368-M371 PolarHBondContact O-N 2.93Å; M369-M371 VanDerWaalsContact C-N 3.35Å; M369-M371 PolarHBondContact O-N 2.97Å; M371-S373 VanDerWaalsContact C-N 3.34Å; M371-S373 PolarHBondContact O-N 3Å; M371-V374 PolarHBondContact O-N 3.09Å; M371-I375 WeakPolarHBondContact O-CB 3.45Å; M371-I375 WeakPolarHBondContact O-CD1 3.38Å; M371-I375 WeakPolarHBondContact O-CG1 3.21Å; M371-I375 PolarHBondContact O-N 2.87Å; M371-L570 HydrophobicContact CE-CB 4.24Å; M371-L570 HydrophobicContact CG-CB 3.86Å; M371-L570 HydrophobicContact SD-CB 4.09Å; M371-P571 HydrophobicContact CG-CB 4.42Å; M371-P571 VanDerWaalsContact SD-CA 3.59Å; M371-P571 HydrophobicContact SD-CB 4Å
372	G	82.8	Confident	78.4	Confident	13 Å²	13	43.1 Å²	43.1	13%	0.134	23%	0.225	C	C	.	.	H	α-helix	trans	-59.2	-45.4	174.8	0	0	0	0	0	111.8	A368 M369 G376 P401	A368-G372 PolarHBondContact O-N 3.1Å; M369-G372 PolarHBondContact O-N 3.27Å; G372-G376 PolarHBondContact O-N 3.46Å; G372-P401 VanDerWaalsContact O-CB 3.25Å; G372-P401 WeakPolarHBondContact O-CB 3.4Å
373	S	85.2	Confident	77.9	Confident	28 Å²	28	46.9 Å²	46.9	20%	0.196	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-47.1	175.2	178.7	0	0	0	0	112.2	M369 I370 M371 I375 G376 L377 A398	M369-S373 WeakPolarHBondContact O-CB 3.3Å; M369-S373 PolarHBondContact O-N 3.25Å; I370-S373 PolarHBondContact O-N 3.04Å; M371-S373 VanDerWaalsContact C-N 3.34Å; M371-S373 PolarHBondContact O-N 3Å; S373-I375 PolarHBondContact O-N 3.44Å; S373-G376 PolarHBondContact O-N 3.27Å; S373-L377 WeakPolarHBondContact O-CB 3.44Å; S373-L377 VanDerWaalsContact O-CG 3.3Å; S373-L377 WeakPolarHBondContact O-CG 3.5Å; S373-L377 PolarHBondContact O-N 3.49Å; S373-A398 WeakPolarHBondContact OG-CB 3.42Å
374	V	82.9	Confident	77.1	Confident	27 Å²	27	48.9 Å²	48.9	16%	0.164	25%	0.25	C	S	.	.	H	α-helix	trans	-62.7	-44.9	178.7	169.7	0	0	0	0	111.3	I370 M371 L377 I378 F574	I370-V374 HydrophobicContact CG2-CG2 4.47Å; I370-V374 VanDerWaalsContact O-CG2 3.3Å; I370-V374 WeakPolarHBondContact O-CG2 3.47Å; I370-V374 PolarHBondContact O-N 3.33Å; M371-V374 PolarHBondContact O-N 3.09Å; V374-L377 PolarHBondContact O-N 3.49Å; V374-I378 HydrophobicContact CG1-CD1 3.75Å; V374-I378 HydrophobicContact CG1-CG1 4.48Å; V374-I378 WeakPolarHBondContact O-CD1 3.33Å; V374-I378 WeakPolarHBondContact O-CG1 3.36Å; V374-I378 PolarHBondContact O-N 2.87Å; V374-F574 HydrophobicContact CG1-CD2 4.32Å; V374-F574 HydrophobicContact CG1-CE1 4.11Å; V374-F574 HydrophobicContact CG1-CE2 3.7Å; V374-F574 HydrophobicContact CG1-CZ 3.59Å
375	I	82.2	Confident	76.1	Confident	88 Å²	88	54.8 Å²	54.8	45%	0.451	28%	0.281	S	S	.	.	H	α-helix	trans	-63.9	-45.3	177.7	-68.1	164.8	0	0	0	110.3	M371 S373 I378 I379	M371-I375 WeakPolarHBondContact O-CB 3.45Å; M371-I375 WeakPolarHBondContact O-CD1 3.38Å; M371-I375 WeakPolarHBondContact O-CG1 3.21Å; M371-I375 PolarHBondContact O-N 2.87Å; S373-I375 PolarHBondContact O-N 3.44Å; I375-I378 PolarHBondContact O-N 2.84Å; I375-I379 HydrophobicContact CG2-CD1 3.78Å; I375-I379 WeakPolarHBondContact O-CG1 3.49Å; I375-I379 PolarHBondContact O-N 2.91Å
376	G	79.8	Confident	74.9	Confident	4 Å²	4	58.5 Å²	58.5	4%	0.041	30%	0.296	C	S	.	.	H	α-helix	trans	-57.9	-48.7	175.5	0	0	0	0	0	112	G372 S373 I378 I379 F380 S397	G372-G376 PolarHBondContact O-N 3.46Å; S373-G376 PolarHBondContact O-N 3.27Å; G376-I378 PolarHBondContact O-N 3.35Å; G376-I379 PolarHBondContact O-N 2.86Å; G376-F380 WeakPolarHBondContact O-CB 3.42Å; G376-F380 VanDerWaalsContact O-CD2 3.32Å; G376-F380 WeakPolarHBondContact O-CD2 3.31Å; G376-F380 PolarHBondContact O-N 3.47Å; G376-S397 CarbonylContact C-O 3.18Å; G376-S397 VanDerWaalsContact CA-O 3.23Å; G376-S397 WeakPolarHBondContact CA-O 3.41Å
377	L	79.9	Confident	73.6	Confident	47 Å²	47	58.3 Å²	58.3	25%	0.246	30%	0.296	C	S	.	.	H	α-helix	trans	-58.8	-44.4	175.6	-77.8	165.4	0	0	0	111.7	S373 V374 I379 Y381 S397 A398 F654	S373-L377 WeakPolarHBondContact O-CB 3.44Å; S373-L377 VanDerWaalsContact O-CG 3.3Å; S373-L377 WeakPolarHBondContact O-CG 3.5Å; S373-L377 PolarHBondContact O-N 3.49Å; V374-L377 PolarHBondContact O-N 3.49Å; L377-I379 VanDerWaalsContact C-N 3.33Å; L377-I379 PolarHBondContact O-N 3.39Å; L377-Y381 WeakPolarHBondContact O-CA 3.35Å; L377-Y381 WeakPolarHBondContact O-CB 3.39Å; L377-Y381 PolarHBondContact O-N 3.41Å; L377-S397 VanDerWaalsContact CD2-OG 3.23Å; L377-S397 WeakPolarHBondContact CD2-OG 3.2Å; L377-S397 PolarHBondContact N-O 2.87Å; L377-S397 VanDerWaalsContact N-O 3.1Å; L377-A398 HydrophobicContact CD1-CB 4.25Å; L377-A398 HydrophobicContact CD2-CB 4.26Å; L377-A398 HydrophobicContact CG-CB 4.12Å; L377-F654 HydrophobicContact CB-CE2 3.71Å; L377-F654 HydrophobicContact CB-CZ 4.08Å
378	I	78.4	Confident	72.2	Confident	39 Å²	39	65.8 Å²	65.8	20%	0.2	34%	0.336	C	S	.	.	H	α-helix	trans	-62.2	-42.3	179.1	-69.8	162.6	0	0	0	111.2	V374 I375 G376 R382 F574 F654 L657 T658	V374-I378 HydrophobicContact CG1-CD1 3.75Å; V374-I378 HydrophobicContact CG1-CG1 4.48Å; V374-I378 WeakPolarHBondContact O-CD1 3.33Å; V374-I378 WeakPolarHBondContact O-CG1 3.36Å; V374-I378 PolarHBondContact O-N 2.87Å; I375-I378 PolarHBondContact O-N 2.84Å; G376-I378 PolarHBondContact O-N 3.35Å; I378-R382 VanDerWaalsContact O-CB 3.22Å; I378-R382 WeakPolarHBondContact O-CB 3.28Å; I378-R382 PolarHBondContact O-N 3.33Å; I378-F574 HydrophobicContact CD1-CE2 4.2Å; I378-F654 HydrophobicContact CG1-CD2 4.02Å; I378-F654 HydrophobicContact CG1-CE2 3.92Å; I378-L657 HydrophobicContact CD1-CD1 3.94Å; I378-T658 HydrophobicContact CG1-CG2 4.46Å; I378-T658 HydrophobicContact CG2-CG2 4.49Å
379	I	75.7	Confident	71	Confident	85 Å²	85	69.7 Å²	69.7	44%	0.436	35%	0.352	S	S	.	.	H	α-helix	trans	-69.5	-57.3	-179.8	-65.9	168.1	0	0	0	110	I375 G376 L377 Y381 R382 F383	I375-I379 HydrophobicContact CG2-CD1 3.78Å; I375-I379 WeakPolarHBondContact O-CG1 3.49Å; I375-I379 PolarHBondContact O-N 2.91Å; G376-I379 PolarHBondContact O-N 2.86Å; L377-I379 VanDerWaalsContact C-N 3.33Å; L377-I379 PolarHBondContact O-N 3.39Å; I379-Y381 PolarHBondContact O-N 2.88Å; I379-R382 PolarHBondContact O-N 2.85Å; I379-F383 HydrophobicContact CG2-CD2 3.96Å; I379-F383 HydrophobicContact CG2-CE2 4.26Å; I379-F383 WeakPolarHBondContact O-CD2 3.28Å; I379-F383 PolarHBondContact O-N 3.44Å; I379-F383 VanDerWaalsContact O-N 3.15Å
380	F	72.5	Confident	70.2	Confident	89 Å²	89	71.3 Å²	71.3	39%	0.39	37%	0.369	S	S	.	.	H	α-helix	trans	-66.4	-40.3	-175.7	-80.8	-81.4	0	0	0	112.1	G376 R382 F383 S384 A396	G376-F380 WeakPolarHBondContact O-CB 3.42Å; G376-F380 VanDerWaalsContact O-CD2 3.32Å; G376-F380 WeakPolarHBondContact O-CD2 3.31Å; G376-F380 PolarHBondContact O-N 3.47Å; F380-R382 PolarHBondContact O-N 3.25Å; F380-F383 PolarHBondContact O-N 2.93Å; F380-S384 WeakPolarHBondContact O-CA 3.28Å; F380-S384 WeakPolarHBondContact O-CB 3.44Å; F380-S384 PolarHBondContact O-N 3.39Å; F380-A396 WeakPolarHBondContact CE2-O 3.36Å
381	Y	67.6	Low	69.5	Low	72 Å²	72	74.3 Å²	74.3	28%	0.282	38%	0.378	S	S	.	.	H	α-helix	trans	-66.1	-25.7	177.7	-164.6	-87.5	0	0	0	112.4	L377 I379 F654 T658	L377-Y381 WeakPolarHBondContact O-CA 3.35Å; L377-Y381 WeakPolarHBondContact O-CB 3.39Å; L377-Y381 PolarHBondContact O-N 3.41Å; I379-Y381 PolarHBondContact O-N 2.88Å; Y381-F654 HydrophobicContact CD1-CE1 4.06Å; Y381-F654 HydrophobicContact CD1-CZ 4.2Å; Y381-F654 HydrophobicContact CD2-CE1 4.17Å; Y381-F654 HydrophobicContact CD2-CZ 4.2Å; Y381-F654 HydrophobicContact CE1-CE1 4.3Å; Y381-F654 HydrophobicContact CE2-CE1 4.44Å; Y381-F654 AromaticContact CG-CE1 3.98Å; Y381-F654 HydrophobicContact CG-CE1 3.98Å; Y381-F654 AromaticContact CG-CZ 3.81Å; Y381-F654 HydrophobicContact CG-CZ 3.81Å; Y381-T658 HydrophobicContact CD1-CG2 3.81Å; Y381-T658 HydrophobicContact CG-CG2 4.33Å
382	R	65.5	Low	68.9	Low	103 Å²	103	75.9 Å²	75.9	39%	0.389	39%	0.389	S	S	.	.	H	α-helix	trans	-77.1	-33.1	174.8	-178.2	175.4	179	166.6	1.3	113.2	I378 I379 F380	I378-R382 VanDerWaalsContact O-CB 3.22Å; I378-R382 WeakPolarHBondContact O-CB 3.28Å; I378-R382 PolarHBondContact O-N 3.33Å; I379-R382 PolarHBondContact O-N 2.85Å; F380-R382 PolarHBondContact O-N 3.25Å
383	F	61.6	Low	68.2	Low	145 Å²	145	77.4 Å²	77.4	64%	0.636	39%	0.393	S	S	*	.	H	α-helix	trans	-110.9	-9.3	-171.7	-64.4	-66.4	0	0	0	114.8	I379 F380 D385	I379-F383 HydrophobicContact CG2-CD2 3.96Å; I379-F383 HydrophobicContact CG2-CE2 4.26Å; I379-F383 WeakPolarHBondContact O-CD2 3.28Å; I379-F383 PolarHBondContact O-N 3.44Å; I379-F383 VanDerWaalsContact O-N 3.15Å; F380-F383 PolarHBondContact O-N 2.93Å; F383-D385 PolarHBondContact O-N 3.28Å
384	S	59.3	Low	67.6	Low	48 Å²	48	81 Å²	81	34%	0.336	41%	0.409	S	S	.	.			trans	-78.3	117.4	-179.2	-168.2	0	0	0	0	110	F380	F380-S384 WeakPolarHBondContact O-CA 3.28Å; F380-S384 WeakPolarHBondContact O-CB 3.44Å; F380-S384 PolarHBondContact O-N 3.39Å
385	D	53.9	Low	67.3	Low	123 Å²	123	83.8 Å²	83.8	66%	0.658	42%	0.423	S	S	*	.			trans	-89	118.1	166.9	-66.9	-42	0	0	0	108.5	F383	F383-D385 PolarHBondContact O-N 3.28Å
386	E	53.5	Low	67.1	Low	95 Å²	95	81 Å²	81	44%	0.444	41%	0.413	S	S	.	.			trans	68.3	137.4	171.8	-78.6	166.5	160.3	0	0	119.8	K160	K160-E386 HydrophobicContact CD-CG 4.05Å; K160-E386 WeakPolarHBondContact CD-OE1 3.5Å; K160-E386 WeakPolarHBondContact CE-OE1 3.37Å; K160-E386 IonicContact NZ-OE1 3.05Å; K160-E386 PolarHBondContact NZ-OE1 3.03Å; K160-E386 IonicContact NZ-OE2 3.1Å; K160-E386 PolarHBondContact NZ-OE2 2.92Å
387	P	52	Low	67	Low	56 Å²	56	81 Å²	81	36%	0.364	41%	0.412	S	S	.	.			trans	-106.7	62.2	178.8	43.9	-31.1	0	0	0	110.7	F164 E389 I393	F164-P387 HydrophobicContact CE1-CB 4.07Å; F164-P387 HydrophobicContact CE1-CG 3.62Å; F164-P387 HydrophobicContact CE2-CG 4.41Å; F164-P387 HydrophobicContact CZ-CB 3.85Å; F164-P387 VanDerWaalsContact CZ-CD 3.41Å; F164-P387 HydrophobicContact CZ-CG 3.34Å; P387-E389 PolarHBondContact O-N 2.91Å; P387-I393 HydrophobicContact CB-CD1 3.83Å
388	N	53.4	Low	67	Low	158 Å²	158	79.3 Å²	79.3	85%	0.845	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.9	169.5	-84	-6.5	0	0	0	111.4
389	E	57.9	Low	67.2	Low	94 Å²	94	81.1 Å²	81.1	44%	0.439	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.7	81.6	176.6	-63	-166.6	140.1	0	0	110.9	P387 Y391 V392 I393	P387-E389 PolarHBondContact O-N 2.91Å; E389-Y391 HydrophobicContact CB-CD1 3.87Å; E389-Y391 HydrophobicContact CB-CE1 3.45Å; E389-Y391 VanDerWaalsContact CB-CE1 3.45Å; E389-Y391 HydrophobicContact CG-CD1 4.46Å; E389-Y391 HydrophobicContact CG-CE1 3.62Å; E389-Y391 PolarHBondContact O-N 2.83Å; E389-Y391 VanDerWaalsContact O-N 3.07Å; E389-Y391 PolarHBondContact OE1-OH 3.37Å; E389-Y391 PolarHBondContact OE2-OH 2.9Å; E389-V392 HydrophobicContact CB-CB 3.92Å; E389-V392 HydrophobicContact CB-CG2 3.75Å; E389-V392 PolarHBondContact O-N 3.23Å; E389-V392 WeakPolarHBondContact OE2-CG2 3.2Å; E389-I393 PolarHBondContact O-N 3.24Å; E389-I393 VanDerWaalsContact O-N 3.14Å
390	S	65	Low	67.6	Low	91 Å²	91	82.3 Å²	82.3	64%	0.636	42%	0.421	S	S	*	.	H	α-helix	trans	-51.9	-31.3	177.6	55.5	0	0	0	0	113.2	L394	S390-L394 WeakPolarHBondContact O-CB 3.18Å; S390-L394 PolarHBondContact O-N 2.94Å
391	Y	68.9	Low	68.2	Low	127 Å²	127	79.1 Å²	79.1	50%	0.498	41%	0.409	S	S	.	.	H	α-helix	trans	-68	-41.6	175.1	73.4	-87.6	0	0	0	112.7	E389 L394 I395	E389-Y391 HydrophobicContact CB-CD1 3.87Å; E389-Y391 HydrophobicContact CB-CE1 3.45Å; E389-Y391 VanDerWaalsContact CB-CE1 3.45Å; E389-Y391 HydrophobicContact CG-CD1 4.46Å; E389-Y391 HydrophobicContact CG-CE1 3.62Å; E389-Y391 PolarHBondContact O-N 2.83Å; E389-Y391 VanDerWaalsContact O-N 3.07Å; E389-Y391 PolarHBondContact OE1-OH 3.37Å; E389-Y391 PolarHBondContact OE2-OH 2.9Å; Y391-L394 PolarHBondContact O-N 3.2Å; Y391-I395 HydrophobicContact CD2-CD1 4.25Å; Y391-I395 WeakPolarHBondContact O-CD1 3.27Å; Y391-I395 VanDerWaalsContact O-CG1 3.23Å; Y391-I395 WeakPolarHBondContact O-CG1 3.28Å; Y391-I395 PolarHBondContact O-N 3.34Å
392	V	68.6	Low	68.9	Low	62 Å²	62	76 Å²	76	38%	0.376	40%	0.399	S	S	.	.	H	α-helix	trans	-66	-42.4	177.3	174.8	0	0	0	0	110.2	E389 L394 I395 A396	E389-V392 HydrophobicContact CB-CB 3.92Å; E389-V392 HydrophobicContact CB-CG2 3.75Å; E389-V392 PolarHBondContact O-N 3.23Å; E389-V392 WeakPolarHBondContact OE2-CG2 3.2Å; V392-L394 PolarHBondContact O-N 3.48Å; V392-I395 PolarHBondContact O-N 3.26Å; V392-A396 VanDerWaalsContact O-CB 3.27Å; V392-A396 WeakPolarHBondContact O-CB 3.47Å; V392-A396 PolarHBondContact O-N 2.98Å
393	I	68.9	Low	69.9	Low	45 Å²	45	77.1 Å²	77.1	23%	0.231	41%	0.406	C	S	.	.	H	α-helix	trans	-60.2	-49.1	175.7	-64.5	175.9	0	0	0	109.6	P387 E389 I395 A396 S397	P387-I393 HydrophobicContact CB-CD1 3.83Å; E389-I393 PolarHBondContact O-N 3.24Å; E389-I393 VanDerWaalsContact O-N 3.14Å; I393-I395 VanDerWaalsContact C-N 3.31Å; I393-I395 PolarHBondContact O-N 3.48Å; I393-A396 PolarHBondContact O-N 2.89Å; I393-S397 WeakPolarHBondContact O-CA 3.1Å; I393-S397 WeakPolarHBondContact O-CB 3.38Å; I393-S397 PolarHBondContact O-N 3.41Å; I393-S397 PolarHBondContact O-OG 3.26Å
394	L	72.2	Confident	71.1	Confident	102 Å²	102	76.6 Å²	76.6	53%	0.534	40%	0.404	S	S	.	.	H	α-helix	trans	-57.3	-44	178.4	-173.7	75.5	0	0	0	112.2	S390 Y391 V392 A398 L399	S390-L394 WeakPolarHBondContact O-CB 3.18Å; S390-L394 PolarHBondContact O-N 2.94Å; Y391-L394 PolarHBondContact O-N 3.2Å; V392-L394 PolarHBondContact O-N 3.48Å; L394-A398 HydrophobicContact CD1-CB 4.43Å; L394-A398 WeakPolarHBondContact O-CB 3.35Å; L394-A398 PolarHBondContact O-N 3.47Å; L394-L399 PolarHBondContact O-N 2.75Å
395	I	76.4	Confident	72.2	Confident	87 Å²	87	75.4 Å²	75.4	45%	0.446	40%	0.397	S	S	.	.	I	π-helix	trans	-65	-48.2	179	-67.5	163.2	0	0	0	110.5	Y391 V392 I393 L399 L400	Y391-I395 HydrophobicContact CD2-CD1 4.25Å; Y391-I395 WeakPolarHBondContact O-CD1 3.27Å; Y391-I395 VanDerWaalsContact O-CG1 3.23Å; Y391-I395 WeakPolarHBondContact O-CG1 3.28Å; Y391-I395 PolarHBondContact O-N 3.34Å; V392-I395 PolarHBondContact O-N 3.26Å; I393-I395 VanDerWaalsContact C-N 3.31Å; I393-I395 PolarHBondContact O-N 3.48Å; I395-L399 HydrophobicContact CG1-CD1 3.99Å; I395-L399 PolarHBondContact O-N 3.49Å; I395-L400 WeakPolarHBondContact O-CB 3.38Å; I395-L400 PolarHBondContact O-N 2.9Å
396	A	77.5	Confident	73.7	Confident	29 Å²	29	72.2 Å²	72.2	24%	0.24	38%	0.38	C	S	.	.	I	π-helix	trans	-70.7	-35.9	-177.7	0	0	0	0	0	112.9	F380 V392 I393 P401	F380-A396 WeakPolarHBondContact CE2-O 3.36Å; V392-A396 VanDerWaalsContact O-CB 3.27Å; V392-A396 WeakPolarHBondContact O-CB 3.47Å; V392-A396 PolarHBondContact O-N 2.98Å; I393-A396 PolarHBondContact O-N 2.89Å; A396-P401 VanDerWaalsContact O-CD 3.23Å; A396-P401 WeakPolarHBondContact O-CD 3.05Å
397	S	77.5	Confident	75.2	Confident	4 Å²	4	73.5 Å²	73.5	3%	0.028	38%	0.384	C	S	.	.	I	π-helix	trans	-89.4	-35.6	-173.2	74	0	0	0	0	113.7	G376 L377 I393 P401	G376-S397 CarbonylContact C-O 3.18Å; G376-S397 VanDerWaalsContact CA-O 3.23Å; G376-S397 WeakPolarHBondContact CA-O 3.41Å; L377-S397 VanDerWaalsContact CD2-OG 3.23Å; L377-S397 WeakPolarHBondContact CD2-OG 3.2Å; L377-S397 PolarHBondContact N-O 2.87Å; L377-S397 VanDerWaalsContact N-O 3.1Å; I393-S397 WeakPolarHBondContact O-CA 3.1Å; I393-S397 WeakPolarHBondContact O-CB 3.38Å; I393-S397 PolarHBondContact O-N 3.41Å; I393-S397 PolarHBondContact O-OG 3.26Å; S397-P401 WeakPolarHBondContact O-CG 3.46Å
398	A	80.4	Confident	76.6	Confident	11 Å²	11	73.6 Å²	73.6	9%	0.091	38%	0.383	C	S	.	.	I	π-helix	trans	-110.7	-53.2	-174.3	0	0	0	0	0	112	S373 L377 L394 A402	S373-A398 WeakPolarHBondContact OG-CB 3.42Å; L377-A398 HydrophobicContact CD1-CB 4.25Å; L377-A398 HydrophobicContact CD2-CB 4.26Å; L377-A398 HydrophobicContact CG-CB 4.12Å; L394-A398 HydrophobicContact CD1-CB 4.43Å; L394-A398 WeakPolarHBondContact O-CB 3.35Å; L394-A398 PolarHBondContact O-N 3.47Å; A398-A402 VanDerWaalsContact O-CB 3.24Å; A398-A402 WeakPolarHBondContact O-CB 2.83Å; A398-A402 PolarHBondContact O-N 2.85Å; A398-A402 VanDerWaalsContact O-N 3.17Å
399	L	83.3	Confident	77.8	Confident	78 Å²	78	67.2 Å²	67.2	41%	0.408	35%	0.348	S	S	.	.	I	π-helix	trans	-72.6	-49.2	-171.8	-68.7	173.6	0	0	0	112.4	L394 I395 A402 F403	L394-L399 PolarHBondContact O-N 2.75Å; I395-L399 HydrophobicContact CG1-CD1 3.99Å; I395-L399 PolarHBondContact O-N 3.49Å; L399-A402 WeakPolarHBondContact O-CB 3.2Å; L399-A402 PolarHBondContact O-N 3.45Å; L399-F403 HydrophobicContact CB-CD2 4.29Å; L399-F403 HydrophobicContact CB-CE2 4.08Å; L399-F403 HydrophobicContact CD2-CE2 4.38Å; L399-F403 WeakPolarHBondContact O-CD2 3.34Å; L399-F403 PolarHBondContact O-N 3.24Å
400	L	84.2	Confident	78.8	Confident	110 Å²	110	65.8 Å²	65.8	58%	0.576	35%	0.346	S	S	*	.	H	α-helix	trans	-62.2	-45.3	-177.9	-174.4	151.3	0	0	0	112.3	I395 A402 F403 F404	I395-L400 WeakPolarHBondContact O-CB 3.38Å; I395-L400 PolarHBondContact O-N 2.9Å; L400-A402 VanDerWaalsContact C-N 3.33Å; L400-A402 PolarHBondContact O-N 3.21Å; L400-F403 PolarHBondContact O-N 3.39Å; L400-F404 WeakPolarHBondContact O-CB 3.41Å; L400-F404 PolarHBondContact O-N 2.87Å
401	P	84.6	Confident	79.4	Confident	21 Å²	21	64.2 Å²	64.2	14%	0.136	33%	0.33	C	S	.	.	H	α-helix	trans	-63.5	-35.3	173.1	-28.3	40.4	0	0	0	113.3	G372 A396 S397 A405	G372-P401 VanDerWaalsContact O-CB 3.25Å; G372-P401 WeakPolarHBondContact O-CB 3.4Å; A396-P401 VanDerWaalsContact O-CD 3.23Å; A396-P401 WeakPolarHBondContact O-CD 3.05Å; S397-P401 WeakPolarHBondContact O-CG 3.46Å; P401-A405 VanDerWaalsContact O-CB 3.31Å; P401-A405 WeakPolarHBondContact O-CB 3.33Å; P401-A405 PolarHBondContact O-N 3.04Å
402	A	83.1	Confident	79.7	Confident	8 Å²	8	62.1 Å²	62.1	7%	0.066	33%	0.327	C	S	.	.	H	α-helix	trans	-65.5	-45.8	174.9	0	0	0	0	0	112.1	M369 A398 L399 L400 A405 L406	M369-A402 HydrophobicContact CB-CB 4.24Å; M369-A402 HydrophobicContact CE-CB 4.32Å; A398-A402 VanDerWaalsContact O-CB 3.24Å; A398-A402 WeakPolarHBondContact O-CB 2.83Å; A398-A402 PolarHBondContact O-N 2.85Å; A398-A402 VanDerWaalsContact O-N 3.17Å; L399-A402 WeakPolarHBondContact O-CB 3.2Å; L399-A402 PolarHBondContact O-N 3.45Å; L400-A402 VanDerWaalsContact C-N 3.33Å; L400-A402 PolarHBondContact O-N 3.21Å; A402-A405 PolarHBondContact O-N 3.08Å; A402-L406 WeakPolarHBondContact O-CB 3.33Å; A402-L406 PolarHBondContact O-N 3.33Å
403	F	86.5	Confident	79.8	Confident	125 Å²	125	63.3 Å²	63.3	55%	0.548	33%	0.325	S	S	.	.	H	α-helix	trans	-65.1	-39.8	176.7	-74.3	-60.3	0	0	0	111.9	L399 L400 L406 F407	L399-F403 HydrophobicContact CB-CD2 4.29Å; L399-F403 HydrophobicContact CB-CE2 4.08Å; L399-F403 HydrophobicContact CD2-CE2 4.38Å; L399-F403 WeakPolarHBondContact O-CD2 3.34Å; L399-F403 PolarHBondContact O-N 3.24Å; L400-F403 PolarHBondContact O-N 3.39Å; F403-L406 PolarHBondContact O-N 2.88Å; F403-F407 WeakPolarHBondContact O-CB 3.45Å; F403-F407 PolarHBondContact O-N 3.43Å
404	F	85.2	Confident	80.1	Confident	135 Å²	135	69 Å²	69	59%	0.592	34%	0.343	S	S	*	.	H	α-helix	trans	-63.3	-45.4	175.1	-175.2	-100	0	0	0	111.7	L400 L406 F407 V408	L400-F404 WeakPolarHBondContact O-CB 3.41Å; L400-F404 PolarHBondContact O-N 2.87Å; F404-L406 VanDerWaalsContact C-N 3.31Å; F404-L406 PolarHBondContact O-N 3.34Å; F404-F407 PolarHBondContact O-N 3.31Å; F404-V408 HydrophobicContact CD1-CG2 4.16Å; F404-V408 HydrophobicContact CE1-CG2 3.77Å; F404-V408 HydrophobicContact CE2-CG2 4.39Å; F404-V408 HydrophobicContact CZ-CG2 3.9Å; F404-V408 WeakPolarHBondContact O-CG2 3.34Å; F404-V408 PolarHBondContact O-N 2.87Å
405	A	84.1	Confident	79.9	Confident	22 Å²	22	72.8 Å²	72.8	18%	0.182	35%	0.35	C	S	.	.	H	α-helix	trans	-60.8	-40.8	175.8	0	0	0	0	0	111.9	P401 A402 F409	P401-A405 VanDerWaalsContact O-CB 3.31Å; P401-A405 WeakPolarHBondContact O-CB 3.33Å; P401-A405 PolarHBondContact O-N 3.04Å; A402-A405 PolarHBondContact O-N 3.08Å; A405-F409 WeakPolarHBondContact O-CB 3.47Å; A405-F409 PolarHBondContact O-N 3.23Å
406	L	84.5	Confident	79.4	Confident	57 Å²	57	75.1 Å²	75.1	30%	0.298	36%	0.355	S	S	.	.	H	α-helix	trans	-64	-44.6	174.2	-178.5	144.3	0	0	0	111.7	M369 A402 F403 F404 F409 V410	M369-L406 HydrophobicContact CG-CB 3.93Å; M369-L406 HydrophobicContact CG-CD1 4.05Å; M369-L406 HydrophobicContact SD-CB 4.41Å; M369-L406 HydrophobicContact SD-CD1 3.45Å; M369-L406 WeakPolarHBondContact SD-CD1 3.4Å; A402-L406 WeakPolarHBondContact O-CB 3.33Å; A402-L406 PolarHBondContact O-N 3.33Å; F403-L406 PolarHBondContact O-N 2.88Å; F404-L406 VanDerWaalsContact C-N 3.31Å; F404-L406 PolarHBondContact O-N 3.34Å; L406-F409 WeakPolarHBondContact O-CB 3.09Å; L406-F409 PolarHBondContact O-N 2.91Å; L406-V410 HydrophobicContact CD2-CG2 4.05Å; L406-V410 HydrophobicContact CG-CG2 4.48Å; L406-V410 VanDerWaalsContact O-CG2 3.31Å; L406-V410 WeakPolarHBondContact O-CG2 3.35Å; L406-V410 PolarHBondContact O-N 2.65Å
407	F	84.4	Confident	78.5	Confident	122 Å²	122	74.2 Å²	74.2	54%	0.535	35%	0.346	S	S	.	.	H	α-helix	trans	-61.5	-46.3	178.8	179.9	-106.4	0	0	0	111.8	F403 F404 F409 V410 I411	F403-F407 WeakPolarHBondContact O-CB 3.45Å; F403-F407 PolarHBondContact O-N 3.43Å; F404-F407 PolarHBondContact O-N 3.31Å; F407-F409 VanDerWaalsContact C-N 3.32Å; F407-F409 PolarHBondContact O-N 2.98Å; F407-V410 PolarHBondContact O-N 2.82Å; F407-I411 HydrophobicContact CD1-CD1 3.73Å; F407-I411 HydrophobicContact CE1-CD1 3.24Å; F407-I411 HydrophobicContact CE1-CG1 4.35Å; F407-I411 HydrophobicContact CE2-CD1 4.17Å; F407-I411 HydrophobicContact CG-CD1 4.39Å; F407-I411 HydrophobicContact CZ-CD1 3.5Å; F407-I411 HydrophobicContact CZ-CG1 4.33Å; F407-I411 WeakPolarHBondContact O-CG1 3.45Å; F407-I411 PolarHBondContact O-N 3.31Å
408	V	81.5	Confident	77.5	Confident	57 Å²	57	80.6 Å²	80.6	35%	0.345	37%	0.37	S	S	.	.	H	α-helix	trans	-59.6	-44.7	173.9	172.6	0	0	0	0	110.5	F404 V410 I411 L412	F404-V408 HydrophobicContact CD1-CG2 4.16Å; F404-V408 HydrophobicContact CE1-CG2 3.77Å; F404-V408 HydrophobicContact CE2-CG2 4.39Å; F404-V408 HydrophobicContact CZ-CG2 3.9Å; F404-V408 WeakPolarHBondContact O-CG2 3.34Å; F404-V408 PolarHBondContact O-N 2.87Å; V408-V410 PolarHBondContact O-N 3.5Å; V408-I411 PolarHBondContact O-N 2.98Å; V408-L412 HydrophobicContact CG1-CD1 3.96Å; V408-L412 HydrophobicContact CG1-CG 4.28Å; V408-L412 WeakPolarHBondContact O-CB 3.46Å; V408-L412 VanDerWaalsContact O-CG 3.28Å; V408-L412 WeakPolarHBondContact O-CG 3.38Å; V408-L412 PolarHBondContact O-N 3.39Å
409	F	79.8	Confident	76	Confident	24 Å²	24	82.4 Å²	82.4	11%	0.105	38%	0.38	C	S	.	.	H	α-helix	trans	-60.3	-43.4	176.9	179.7	-95	0	0	0	112.3	W361 C364 A365 A405 L406 F407 L412 W413 L567	W361-F409 HydrophobicContact CE3-CZ 4.03Å; C364-F409 HydrophobicContact CB-CE2 3.67Å; C364-F409 HydrophobicContact CB-CZ 3.56Å; A365-F409 HydrophobicContact CB-CD1 3.8Å; A365-F409 HydrophobicContact CB-CE1 3.73Å; A405-F409 WeakPolarHBondContact O-CB 3.47Å; A405-F409 PolarHBondContact O-N 3.23Å; L406-F409 WeakPolarHBondContact O-CB 3.09Å; L406-F409 PolarHBondContact O-N 2.91Å; F407-F409 VanDerWaalsContact C-N 3.32Å; F407-F409 PolarHBondContact O-N 2.98Å; F409-L412 PolarHBondContact O-N 3.1Å; F409-W413 VanDerWaalsContact O-CB 3.25Å; F409-W413 WeakPolarHBondContact O-CB 3.29Å; F409-W413 PolarHBondContact O-N 3Å; F409-L567 HydrophobicContact CD2-CD2 3.89Å; F409-L567 HydrophobicContact CE2-CD2 4.06Å
410	V	79.2	Confident	74.4	Confident	65 Å²	65	81 Å²	81	39%	0.394	38%	0.375	S	S	.	.	H	α-helix	trans	-63.7	-42	177.3	171	0	0	0	0	111.2	L406 F407 V408 W413 W414	L406-V410 HydrophobicContact CD2-CG2 4.05Å; L406-V410 HydrophobicContact CG-CG2 4.48Å; L406-V410 VanDerWaalsContact O-CG2 3.31Å; L406-V410 WeakPolarHBondContact O-CG2 3.35Å; L406-V410 PolarHBondContact O-N 2.65Å; F407-V410 PolarHBondContact O-N 2.82Å; V408-V410 PolarHBondContact O-N 3.5Å; V410-W413 PolarHBondContact O-N 2.66Å; V410-W414 WeakPolarHBondContact O-CB 3.46Å; V410-W414 PolarHBondContact O-N 2.88Å
411	I	77.8	Confident	72.5	Confident	58 Å²	58	79 Å²	79	30%	0.297	36%	0.364	S	S	.	.	H	α-helix	trans	-62.5	-47	175	-70.2	171.8	0	0	0	110.8	F407 V408 W413 W414 R415	F407-I411 HydrophobicContact CD1-CD1 3.73Å; F407-I411 HydrophobicContact CE1-CD1 3.24Å; F407-I411 HydrophobicContact CE1-CG1 4.35Å; F407-I411 HydrophobicContact CE2-CD1 4.17Å; F407-I411 HydrophobicContact CG-CD1 4.39Å; F407-I411 HydrophobicContact CZ-CD1 3.5Å; F407-I411 HydrophobicContact CZ-CG1 4.33Å; F407-I411 WeakPolarHBondContact O-CG1 3.45Å; F407-I411 PolarHBondContact O-N 3.31Å; V408-I411 PolarHBondContact O-N 2.98Å; I411-W413 VanDerWaalsContact C-N 3.3Å; I411-W413 PolarHBondContact O-N 2.86Å; I411-W414 PolarHBondContact O-N 2.89Å; I411-R415 WeakPolarHBondContact O-CB 3.45Å; I411-R415 PolarHBondContact O-N 3.32Å
412	L	73.4	Confident	70.2	Confident	83 Å²	83	85.1 Å²	85.1	44%	0.435	39%	0.386	S	S	.	.	H	α-helix	trans	-62.5	-40.7	178.4	-70.5	177.1	0	0	0	111.2	V408 F409 Y416	V408-L412 HydrophobicContact CG1-CD1 3.96Å; V408-L412 HydrophobicContact CG1-CG 4.28Å; V408-L412 WeakPolarHBondContact O-CB 3.46Å; V408-L412 VanDerWaalsContact O-CG 3.28Å; V408-L412 WeakPolarHBondContact O-CG 3.38Å; V408-L412 PolarHBondContact O-N 3.39Å; F409-L412 PolarHBondContact O-N 3.1Å; L412-Y416 HydrophobicContact CB-CD2 4.39Å; L412-Y416 HydrophobicContact CD2-CD2 3.76Å; L412-Y416 HydrophobicContact CD2-CE2 3.51Å; L412-Y416 WeakPolarHBondContact O-CB 3.29Å; L412-Y416 WeakPolarHBondContact O-CD2 3.49Å; L412-Y416 PolarHBondContact O-N 2.8Å
413	W	71.4	Confident	67.7	Low	87 Å²	87	91.9 Å²	91.9	33%	0.33	41%	0.411	S	S	.	.	I	π-helix	trans	-63.6	-45.1	175.7	-179.3	80.2	0	0	0	111.5	W361 F409 V410 I411 V417 R418	W361-W413 AromaticContact CD2-CD1 3.8Å; W361-W413 AromaticContact CD2-NE1 3.65Å; W361-W413 AromaticContact CE2-NE1 3.91Å; W361-W413 AromaticContact CE3-CD1 3.58Å; W361-W413 AromaticContact CE3-NE1 3.94Å; W361-W413 AromaticContact CG-NE1 3.9Å; W361-W413 AromaticContact CZ3-CD1 3.88Å; F409-W413 VanDerWaalsContact O-CB 3.25Å; F409-W413 WeakPolarHBondContact O-CB 3.29Å; F409-W413 PolarHBondContact O-N 3Å; V410-W413 PolarHBondContact O-N 2.66Å; I411-W413 VanDerWaalsContact C-N 3.3Å; I411-W413 PolarHBondContact O-N 2.86Å; W413-V417 HydrophobicContact CG-CB 4.35Å; W413-V417 WeakPolarHBondContact O-CA 3.48Å; W413-V417 VanDerWaalsContact O-CB 3.3Å; W413-V417 WeakPolarHBondContact O-CB 3.42Å; W413-V417 PolarHBondContact O-N 3.24Å; W413-R418 PolarHBondContact O-N 3.4Å
414	W	74.6	Confident	65.3	Low	165 Å²	165	89.3 Å²	89.3	63%	0.625	40%	0.401	S	S	*	.	I	π-helix	trans	-66.9	-42.3	178	-170.1	4.3	0	0	0	112.1	V410 I411 P419	V410-W414 WeakPolarHBondContact O-CB 3.46Å; V410-W414 PolarHBondContact O-N 2.88Å; I411-W414 PolarHBondContact O-N 2.89Å; W414-P419 VanDerWaalsContact O-CD 3.29Å; W414-P419 WeakPolarHBondContact O-CD 3.25Å
415	R	69.5	Low	63	Low	180 Å²	180	93.9 Å²	93.9	68%	0.679	41%	0.414	S	S	*	.	I	π-helix	trans	-74.5	-43.4	-178.6	-81.5	-169.7	155.8	150.5	-2.9	114.1	I411 P419	I411-R415 WeakPolarHBondContact O-CB 3.45Å; I411-R415 PolarHBondContact O-N 3.32Å; R415-P419 WeakPolarHBondContact O-CG 3.42Å
416	Y	65	Low	60.5	Low	137 Å²	137	98.2 Å²	98.2	54%	0.537	43%	0.432	S	S	.	.	I	π-helix	trans	-107.1	-27.4	-167.5	-62.3	-71.7	0	0	0	113.9	L412 T420	L412-Y416 HydrophobicContact CB-CD2 4.39Å; L412-Y416 HydrophobicContact CD2-CD2 3.76Å; L412-Y416 HydrophobicContact CD2-CE2 3.51Å; L412-Y416 WeakPolarHBondContact O-CB 3.29Å; L412-Y416 WeakPolarHBondContact O-CD2 3.49Å; L412-Y416 PolarHBondContact O-N 2.8Å; Y416-T420 WeakPolarHBondContact O-CG2 3.12Å
417	V	59.4	Low	58	Low	10 Å²	10	103 Å²	103	6%	0.061	45%	0.451	C	S	.	.	I	π-helix	trans	-98.9	-49.8	-173.9	-178.8	0	0	0	0	111	W361 W413 T420 L421	W361-V417 HydrophobicContact CH2-CB 4.15Å; W361-V417 HydrophobicContact CH2-CG1 3.39Å; W361-V417 HydrophobicContact CH2-CG2 3.66Å; W361-V417 HydrophobicContact CZ2-CG1 3.34Å; W361-V417 HydrophobicContact CZ2-CG2 4.48Å; W361-V417 HydrophobicContact CZ3-CG1 4.19Å; W361-V417 HydrophobicContact CZ3-CG2 3.97Å; W413-V417 HydrophobicContact CG-CB 4.35Å; W413-V417 WeakPolarHBondContact O-CA 3.48Å; W413-V417 VanDerWaalsContact O-CB 3.3Å; W413-V417 WeakPolarHBondContact O-CB 3.42Å; W413-V417 PolarHBondContact O-N 3.24Å; V417-T420 PolarHBondContact O-N 3.41Å; V417-T420 PolarHBondContact O-OG1 3.03Å; V417-L421 HydrophobicContact CG1-CD1 4.37Å; V417-L421 PolarHBondContact O-N 2.86Å
418	R	56.2	Low	55.6	Low	138 Å²	138	99.4 Å²	99.4	52%	0.521	45%	0.447	S	S	.	.	H	α-helix	trans	-59.3	-43.5	-175.6	-166.2	179.9	-177.1	-171.4	1.2	113.9	W413 T420 L421 Y422	W413-R418 PolarHBondContact O-N 3.4Å; R418-T420 VanDerWaalsContact C-N 3.31Å; R418-T420 PolarHBondContact O-N 2.9Å; R418-L421 PolarHBondContact O-N 3.37Å; R418-Y422 PolarHBondContact O-N 3.03Å
419	P	47.8	Very low	53.4	Low	48 Å²	48	103.1 Å²	103.1	31%	0.312	46%	0.461	S	S	.	.	H	α-helix	trans	-63.9	-40.7	179.8	-21.7	35	0	0	0	110.6	W414 R415 L421 Y422 Y423	W414-P419 VanDerWaalsContact O-CD 3.29Å; W414-P419 WeakPolarHBondContact O-CD 3.25Å; R415-P419 WeakPolarHBondContact O-CG 3.42Å; P419-L421 PolarHBondContact O-N 2.68Å; P419-Y422 PolarHBondContact O-N 2.87Å; P419-Y423 HydrophobicContact CB-CD2 4.16Å; P419-Y423 HydrophobicContact CB-CE2 4.1Å; P419-Y423 WeakPolarHBondContact O-CD2 3.47Å; P419-Y423 PolarHBondContact O-N 3.25Å
420	T	50.9	Low	51.1	Low	49 Å²	49	104.3 Å²	104.3	30%	0.301	48%	0.48	S	S	.	.	H	α-helix	trans	-61.2	-32.2	179	65.5	0	0	0	0	113	Y416 V417 R418 Q424	Y416-T420 WeakPolarHBondContact O-CG2 3.12Å; V417-T420 PolarHBondContact O-N 3.41Å; V417-T420 PolarHBondContact O-OG1 3.03Å; R418-T420 VanDerWaalsContact C-N 3.31Å; R418-T420 PolarHBondContact O-N 2.9Å; T420-Q424 WeakPolarHBondContact O-CB 3.22Å; T420-Q424 PolarHBondContact O-N 2.98Å
421	L	44	Very low	49	Very low	67 Å²	67	106.6 Å²	106.6	35%	0.351	50%	0.496	S	S	.	.	H	α-helix	trans	-70.4	-38.5	173.2	-71.2	169.3	0	0	0	112.3	V417 R418 P419 R425	V417-L421 HydrophobicContact CG1-CD1 4.37Å; V417-L421 PolarHBondContact O-N 2.86Å; R418-L421 PolarHBondContact O-N 3.37Å; P419-L421 PolarHBondContact O-N 2.68Å; L421-R425 PolarHBondContact O-N 2.87Å; L421-R425 VanDerWaalsContact O-N 3.16Å
422	Y	35.5	Very low	46.8	Very low	150 Å²	150	111.9 Å²	111.9	59%	0.588	52%	0.524	S	S	*	.	H	α-helix	trans	-69.5	-43	177.3	-161.6	-93.1	0	0	0	111.3	R418 P419 Q424 R425 M426	R418-Y422 PolarHBondContact O-N 3.03Å; P419-Y422 PolarHBondContact O-N 2.87Å; Y422-Q424 PolarHBondContact O-N 3.21Å; Y422-R425 PolarHBondContact O-N 2.98Å; Y422-M426 HydrophobicContact CD1-CG 4.05Å; Y422-M426 HydrophobicContact CE1-CE 4.01Å; Y422-M426 HydrophobicContact CE1-CG 3.71Å; Y422-M426 WeakPolarHBondContact O-CB 3.41Å; Y422-M426 PolarHBondContact O-N 2.8Å; Y422-M426 VanDerWaalsContact OH-CE 3.24Å; Y422-M426 WeakPolarHBondContact OH-CE 3.14Å
423	Y	31.5	Very low	44.6	Very low	150 Å²	150	113.8 Å²	113.8	59%	0.588	54%	0.539	S	S	*	.	H	α-helix	trans	-64.9	-37.7	176.3	-77.2	-70.5	0	0	0	112.6	P419 M426 F427	P419-Y423 HydrophobicContact CB-CD2 4.16Å; P419-Y423 HydrophobicContact CB-CE2 4.1Å; P419-Y423 WeakPolarHBondContact O-CD2 3.47Å; P419-Y423 PolarHBondContact O-N 3.25Å; Y423-M426 PolarHBondContact O-N 3.12Å; Y423-F427 HydrophobicContact CD1-CD2 4.14Å; Y423-F427 HydrophobicContact CD1-CE2 4.35Å; Y423-F427 PolarHBondContact O-N 3.4Å
424	Q	35.6	Very low	42.6	Very low	72 Å²	72	116.8 Å²	116.8	34%	0.336	55%	0.554	S	S	.	*	H	α-helix	trans	-65.8	-37.5	173.5	-103.9	-173.5	-31	0	0	113	T420 Y422 G428	T420-Q424 WeakPolarHBondContact O-CB 3.22Å; T420-Q424 PolarHBondContact O-N 2.98Å; Y422-Q424 PolarHBondContact O-N 3.21Å; Q424-G428 PolarHBondContact O-N 3.15Å
425	R	36.8	Very low	40.5	Very low	231 Å²	231	114.3 Å²	114.3	87%	0.872	56%	0.557	S	S	*	*	H	α-helix	trans	-71.1	-35	176.3	-93.3	-175	-178.5	168.7	0.8	112.9	L421 Y422	L421-R425 PolarHBondContact O-N 2.87Å; L421-R425 VanDerWaalsContact O-N 3.16Å; Y422-R425 PolarHBondContact O-N 2.98Å
426	M	32.4	Very low	38.5	Very low	112 Å²	112	114.1 Å²	114.1	55%	0.552	56%	0.564	S	S	*	*	H	α-helix	trans	-83.8	-35.6	-176.8	-78.8	-65.2	-170.1	0	0	113.9	Y422 Y423	Y422-M426 HydrophobicContact CD1-CG 4.05Å; Y422-M426 HydrophobicContact CE1-CE 4.01Å; Y422-M426 HydrophobicContact CE1-CG 3.71Å; Y422-M426 WeakPolarHBondContact O-CB 3.41Å; Y422-M426 PolarHBondContact O-N 2.8Å; Y422-M426 VanDerWaalsContact OH-CE 3.24Å; Y422-M426 WeakPolarHBondContact OH-CE 3.14Å; Y423-M426 PolarHBondContact O-N 3.12Å
427	F	31	Very low	36.9	Very low	159 Å²	159	114.2 Å²	114.2	70%	0.697	57%	0.574	S	S	*	*	H	α-helix	trans	-114.5	2.7	-170.1	-71.1	-74.4	0	0	0	115.5	Y423	Y423-F427 HydrophobicContact CD1-CD2 4.14Å; Y423-F427 HydrophobicContact CD1-CE2 4.35Å; Y423-F427 PolarHBondContact O-N 3.4Å
428	G	34.1	Very low	35.6	Very low	45 Å²	45	118.5 Å²	118.5	46%	0.464	60%	0.604	S	S	.	*			trans	64.3	159.8	-179.7	0	0	0	0	0	112.2	Q424 G430	Q424-G428 PolarHBondContact O-N 3.15Å; G428-G430 VanDerWaalsContact C-N 3.31Å; G428-G430 PolarHBondContact O-N 3.33Å
429	Q	34.7	Very low	34.4	Very low	135 Å²	135	117.6 Å²	117.6	63%	0.631	61%	0.614	S	S	*	*	S	Bend	trans	-77.1	82.1	179.5	-67.2	-176.2	2.9	0	0	110.2
430	G	32.3	Very low	33.5	Very low	49 Å²	49	122.1 Å²	122.1	51%	0.505	64%	0.641	S	S	.	*	S	Bend	trans	-138	136.2	170.5	0	0	0	0	0	110.5	G428 L432	G428-G430 VanDerWaalsContact C-N 3.31Å; G428-G430 PolarHBondContact O-N 3.33Å; G430-L432 PolarHBondContact O-N 2.8Å
431	P	35.5	Very low	32.5	Very low	114 Å²	114	125.3 Å²	125.3	74%	0.74	66%	0.66	S	S	*	*			trans	-58.5	125.8	166.4	27.6	-30.2	0	0	0	106.6	V433	P431-V433 VanDerWaalsContact C-N 3.35Å; P431-V433 PolarHBondContact O-N 2.59Å
432	L	31.3	Very low	31.9	Very low	169 Å²	169	129.3 Å²	129.3	89%	0.885	68%	0.681	S	S	*	*			trans	-40.5	90.8	-176.2	-68.8	149.4	0	0	0	111.9	G430 K434	G430-L432 PolarHBondContact O-N 2.8Å; L432-K434 PolarHBondContact O-N 3.24Å
433	V	27.9	Very low	31.6	Very low	123 Å²	123	126.8 Å²	126.8	75%	0.745	68%	0.681	S	S	*	*			trans	-86.6	98.4	162.2	-179.5	0	0	0	0	104	P431 V435	P431-V433 VanDerWaalsContact C-N 3.35Å; P431-V433 PolarHBondContact O-N 2.59Å; V433-V435 PolarHBondContact O-N 3.4Å
434	K	28.2	Very low	31.3	Very low	150 Å²	150	126 Å²	126	65%	0.652	69%	0.687	S	S	*	*			trans	-61.5	108.8	168.7	-167.5	175.4	-176.7	176.3	0	106.2	L432 E436	L432-K434 PolarHBondContact O-N 3.24Å; K434-E436 PolarHBondContact O-N 3.31Å
435	V	30.5	Very low	31	Very low	112 Å²	112	129.5 Å²	129.5	68%	0.679	70%	0.704	S	S	*	*			trans	-65.9	100.6	170.8	180	0	0	0	0	105.7	V433 N437	V433-V435 PolarHBondContact O-N 3.4Å; V435-N437 PolarHBondContact O-N 3.01Å
436	E	27.2	Very low	30.8	Very low	176 Å²	176	123.6 Å²	123.6	82%	0.822	70%	0.695	S	S	*	*			trans	-65.7	86.7	168.3	-81.3	-173.7	146.8	0	0	108	K434 S438	K434-E436 PolarHBondContact O-N 3.31Å; E436-S438 PolarHBondContact O-N 3.31Å
437	N	32.8	Very low	30.7	Very low	139 Å²	139	128.8 Å²	128.8	74%	0.743	71%	0.709	S	S	*	*			trans	-69.4	111.3	154.4	-82.9	-3.3	0	0	0	106.4	V435	V435-N437 PolarHBondContact O-N 3.01Å
438	S	32.5	Very low	30.5	Very low	101 Å²	101	126.8 Å²	126.8	71%	0.706	71%	0.705	S	S	*	*	S	Bend	trans	-22	138.9	166.3	44.6	0	0	0	0	114.1	E436	E436-S438 PolarHBondContact O-N 3.31Å
439	T	29.5	Very low	30.3	Very low	119 Å²	119	129.5 Å²	129.5	73%	0.73	72%	0.717	S	S	*	*	S	Bend	trans	95.4	72.1	174.2	73	0	0	0	0	116.6	V441	T439-V441 PolarHBondContact O-N 3.15Å
440	T	29.9	Very low	29.9	Very low	143 Å²	143	129.2 Å²	129.2	88%	0.877	72%	0.72	S	S	*	*			trans	45.4	67.1	136.2	61.6	0	0	0	0	117.4
441	V	28.9	Very low	29.7	Very low	115 Å²	115	133.4 Å²	133.4	70%	0.697	74%	0.735	S	S	*	*			trans	-137.1	87.2	155.2	-171.4	0	0	0	0	107.9	T439 V443	T439-V441 PolarHBondContact O-N 3.15Å; V441-V443 HydrophobicContact CG1-CG2 3.76Å; V441-V443 PolarHBondContact O-N 2.98Å
442	L	31.8	Very low	29.3	Very low	151 Å²	151	135.3 Å²	135.3	79%	0.791	74%	0.739	S	S	*	*			trans	-71.6	88.9	167.1	-145.6	94.8	0	0	0	106.7	N444	L442-N444 PolarHBondContact O-N 3.43Å
443	V	29.1	Very low	29	Very low	97 Å²	97	134.2 Å²	134.2	59%	0.588	73%	0.734	S	S	*	*			trans	-66.9	97.9	169.9	179.8	0	0	0	0	106.6	V441 E445	V441-V443 HydrophobicContact CG1-CG2 3.76Å; V441-V443 PolarHBondContact O-N 2.98Å; V443-E445 PolarHBondContact O-N 3.23Å; V443-E445 VanDerWaalsContact O-N 3.14Å
444	N	26.3	Very low	28.9	Very low	133 Å²	133	134.5 Å²	134.5	71%	0.711	73%	0.731	S	S	*	*			trans	-64.7	108.2	168.7	-79.2	-13.9	0	0	0	108	L442	L442-N444 PolarHBondContact O-N 3.43Å
445	E	28.8	Very low	28.6	Very low	147 Å²	147	132.3 Å²	132.3	69%	0.687	73%	0.734	S	S	*	*			trans	-64.6	129.3	172.9	-68.3	176.8	175.4	0	0	109.5	V443 W447	V443-E445 PolarHBondContact O-N 3.23Å; V443-E445 VanDerWaalsContact O-N 3.14Å; E445-W447 PolarHBondContact O-N 3.47Å
446	P	32.1	Very low	28.4	Very low	107 Å²	107	138 Å²	138	70%	0.695	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	25.9	-168.5	29.2	-33.4	0	0	0	115.2
447	W	31	Very low	28.2	Very low	221 Å²	221	138.5 Å²	138.5	84%	0.837	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138	18.8	179.3	-21.7	88.7	0	0	0	113.4	E445 S449	E445-W447 PolarHBondContact O-N 3.47Å; W447-S449 PolarHBondContact O-N 3.44Å; W447-S449 VanDerWaalsContact O-N 3.15Å
448	N	25.5	Very low	27.7	Very low	117 Å²	117	138.6 Å²	138.6	63%	0.626	75%	0.748	S	S	*	*			trans	-80.7	96.2	175.3	-159.5	4.5	0	0	0	109.7	D450	N448-D450 PolarHBondContact O-N 2.75Å
449	S	30.5	Very low	27.3	Very low	101 Å²	101	140.8 Å²	140.8	71%	0.706	76%	0.757	S	S	*	*			trans	-80	12.8	-179.4	46.5	0	0	0	0	114.4	W447 V451	W447-S449 PolarHBondContact O-N 3.44Å; W447-S449 VanDerWaalsContact O-N 3.15Å; S449-V451 PolarHBondContact O-N 3.45Å
450	D	27.2	Very low	27	Very low	129 Å²	129	142 Å²	142	69%	0.69	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	22.1	-171.6	-64.7	-5.9	0	0	0	114	N448 L452	N448-D450 PolarHBondContact O-N 2.75Å; D450-L452 VanDerWaalsContact C-N 3.25Å; D450-L452 PolarHBondContact O-N 3.26Å
451	V	27.8	Very low	26.8	Very low	138 Å²	138	139.8 Å²	139.8	84%	0.836	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-0.4	174.8	-178	0	0	0	0	112.7	S449	S449-V451 PolarHBondContact O-N 3.45Å
452	L	26	Very low	27	Very low	154 Å²	154	140 Å²	140	81%	0.806	76%	0.759	S	S	*	*			trans	-114.3	81.8	175.2	-80.2	145.6	0	0	0	109.5	D450	D450-L452 VanDerWaalsContact C-N 3.25Å; D450-L452 PolarHBondContact O-N 3.26Å
453	D	25.7	Very low	26.6	Very low	146 Å²	146	143.3 Å²	143.3	78%	0.781	77%	0.767	S	S	*	*			trans	-175.9	93	138.3	-91.9	-25.5	0	0	0	112.4
454	N	25	Very low	26.2	Very low	128 Å²	128	142.4 Å²	142.4	68%	0.684	78%	0.778	S	S	*	*			trans	44.6	111.8	131.5	-69.4	-25.9	0	0	0	121	Y456	N454-Y456 PolarHBondContact O-N 2.73Å
455	S	23.4	Very low	26.1	Very low	104 Å²	104	142.1 Å²	142.1	73%	0.727	79%	0.786	S	S	*	*			trans	7.7	102.3	130.6	62.6	0	0	0	0	117
456	Y	24.8	Very low	25.8	Very low	231 Å²	231	141 Å²	141	91%	0.906	80%	0.795	S	S	*	*			trans	-134.1	119.9	151.8	-95.8	-85.9	0	0	0	109.5	N454	N454-Y456 PolarHBondContact O-N 2.73Å
457	Q	24	Very low	25.4	Very low	188 Å²	188	141.6 Å²	141.6	88%	0.879	80%	0.802	S	S	*	*			trans	-72.6	139.6	-178.9	-74.4	172.1	-32.8	0	0	111.7
458	N	21.8	Very low	25	Very low	141 Å²	141	140.7 Å²	140.7	75%	0.754	81%	0.807	S	S	*	*			trans	-5	131.3	152.5	-63.7	-12.6	0	0	0	118.4
459	V	24.5	Very low	24.9	Very low	147 Å²	147	142.1 Å²	142.1	89%	0.891	82%	0.82	S	S	*	*			trans	-144.1	119.9	132.1	-176.4	0	0	0	0	109.2
460	D	22.9	Very low	24.6	Very low	143 Å²	143	145.7 Å²	145.7	77%	0.765	83%	0.825	S	S	*	*			trans	-77.7	151.2	176.1	-64.4	-62.6	0	0	0	113.4
461	A	24.9	Very low	24.4	Very low	98 Å²	98	148.7 Å²	148.7	81%	0.81	84%	0.835	S	S	*	*				174.8	144.8	124.1	0	0	0	0	0	113.3
462	P	33.4	Very low	24.2	Very low	119 Å²	119	148.6 Å²	148.6	77%	0.773	83%	0.834	S	S	*	*			trans	-109.4	157.5	-165.5	39.4	-28.9	0	0	0	114.8
463	F	23	Very low	24.2	Very low	220 Å²	220	146.9 Å²	146.9	97%	0.965	83%	0.833	S	S	*	*			trans	-137.3	129.6	167.8	-106.1	-89.1	0	0	0	112.3
464	G	22.1	Very low	24	Very low	78 Å²	78	146.5 Å²	146.5	80%	0.804	83%	0.829	S	S	*	*			trans	-95	164.1	-171.3	0	0	0	0	0	115.7
465	S	23.4	Very low	24.1	Very low	127 Å²	127	148 Å²	148	89%	0.888	84%	0.837	S	S	*	*			trans	-90.8	154.4	-172.8	50.4	0	0	0	0	114.8
466	S	21.9	Very low	24.1	Very low	124 Å²	124	150.3 Å²	150.3	87%	0.867	84%	0.841	S	S	*	*			trans	-145.5	133.9	157.6	60.1	0	0	0	0	112.2
467	S	24.4	Very low	24.1	Very low	120 Å²	120	145.7 Å²	145.7	84%	0.839	84%	0.837	S	S	*	*			trans	-85.5	150.5	-174.7	48.3	0	0	0	0	114.6
468	Q	22.2	Very low	24.2	Very low	202 Å²	202	142.1 Å²	142.1	94%	0.944	83%	0.833	S	S	*	*			trans	-134.2	145.8	163.6	-92.3	-174.2	-4.8	0	0	111.2
469	T	23.9	Very low	24.3	Very low	146 Å²	146	141 Å²	141	90%	0.896	83%	0.831	S	S	*	*			trans	-103.3	149.2	-154.7	-4.7	0	0	0	0	114
470	E	23.7	Very low	24.3	Very low	177 Å²	177	141.7 Å²	141.7	83%	0.827	83%	0.829	S	S	*	*			trans	-82.3	151.5	-178.9	-111.3	172	153.5	0	0	114.2
471	H	23.4	Very low	24.5	Very low	191 Å²	191	139.2 Å²	139.2	88%	0.884	83%	0.828	S	S	*	*			trans	-122.9	131.2	168.5	-87.4	-60.1	0	0	0	111.9
472	T	24.1	Very low	24.6	Very low	136 Å²	136	140.5 Å²	140.5	83%	0.834	83%	0.828	S	S	*	*			trans	-95.4	144	-176.2	41.3	0	0	0	0	114.2
473	P	25	Very low	24.2	Very low	119 Å²	119	141.4 Å²	141.4	77%	0.773	83%	0.831	S	S	*	*			trans	-117.1	153.4	163.4	33.3	-19	0	0	0	114.8
474	I	22.4	Very low	24.4	Very low	138 Å²	138	135.9 Å²	135.9	71%	0.708	82%	0.82	S	S	*	*			trans	-101.5	139.9	-171.1	-65.2	159.8	0	0	0	109.6
475	N	25.9	Very low	24.7	Very low	159 Å²	159	141.2 Å²	141.2	85%	0.85	82%	0.824	S	S	*	*			trans	-170	137.8	144.4	-98.4	-17.4	0	0	0	113.1
476	N	23.9	Very low	24.8	Very low	152 Å²	152	144 Å²	144	81%	0.813	82%	0.823	S	S	*	*			trans	-91.8	135.1	-171.5	-67.3	-29.2	0	0	0	111.8
477	V	25.8	Very low	25	Very low	135 Å²	135	147.4 Å²	147.4	82%	0.818	83%	0.825	S	S	*	*			trans	-139.1	129.6	158.3	179.5	0	0	0	0	108.9
478	S	24.6	Very low	25.1	Very low	112 Å²	112	145.7 Å²	145.7	78%	0.783	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-63.5	120.5	-176.5	50	0	0	0	0	113.3
479	V	25.8	Very low	25.3	Very low	118 Å²	118	140.7 Å²	140.7	72%	0.715	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-98.7	122.9	175.9	177.7	0	0	0	0	108.8
480	L	24.1	Very low	25.5	Very low	162 Å²	162	140.3 Å²	140.3	85%	0.848	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-65.6	141.9	170.6	-100.8	77.2	0	0	0	110.7
481	A	26.4	Very low	25.8	Very low	91 Å²	91	137.2 Å²	137.2	75%	0.752	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-70	137.6	-171.1	0	0	0	0	0	113.7
482	P	27.1	Very low	26.2	Very low	125 Å²	125	131.9 Å²	131.9	81%	0.812	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-74.6	136.2	176.4	29.3	-32.1	0	0	0	111.9
483	V	26	Very low	26.5	Very low	138 Å²	138	132.3 Å²	132.3	84%	0.836	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-70.6	126.9	173.3	175.9	0	0	0	0	108.9	E485	V483-E485 PolarHBondContact O-N 3.43Å
484	S	26.5	Very low	26.9	Very low	103 Å²	103	133 Å²	133	72%	0.72	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-65.2	120.7	-178.6	49.5	0	0	0	0	111.8	E486	S484-E486 PolarHBondContact O-N 3.44Å
485	E	27.3	Very low	27.4	Very low	191 Å²	191	133.1 Å²	133.1	89%	0.893	77%	0.769	S	S	*	*			trans	-66.1	112	167.7	-64.8	179.6	164.1	0	0	108.8	V483 E487	V483-E485 PolarHBondContact O-N 3.43Å; E485-E487 PolarHBondContact O-N 3.21Å
486	E	26.3	Very low	27.6	Very low	185 Å²	185	130.7 Å²	130.7	86%	0.864	76%	0.764	S	S	*	*			trans	-69.2	111.5	170.4	-85.2	-177.9	151.3	0	0	109.5	S484 A488	S484-E486 PolarHBondContact O-N 3.44Å; E486-A488 PolarHBondContact O-N 3.24Å
487	E	26.6	Very low	28	Very low	195 Å²	195	129.7 Å²	129.7	91%	0.911	76%	0.759	S	S	*	*			trans	-63.5	76.3	169.5	-70.6	178.9	141.6	0	0	111	E485	E485-E487 PolarHBondContact O-N 3.21Å
488	A	25.4	Very low	28.2	Very low	84 Å²	84	130 Å²	130	69%	0.694	76%	0.755	S	S	*	*			trans	-98.2	121.9	168.2	0	0	0	0	0	109.9	E486	E486-A488 PolarHBondContact O-N 3.24Å
489	S	27.1	Very low	28.4	Very low	98 Å²	98	131.9 Å²	131.9	69%	0.685	76%	0.755	S	S	*	*	S	Bend	trans	110.1	33.2	164.3	79.1	0	0	0	0	119.6
490	I	29.1	Very low	28.5	Very low	138 Å²	138	131.7 Å²	131.7	71%	0.708	75%	0.754	S	S	*	*	S	Bend	trans	-91.3	-15.2	152.8	-64	176.3	0	0	0	111.5	A492 L493	I490-A492 PolarHBondContact O-N 2.76Å; I490-L493 PolarHBondContact O-N 3.24Å
491	T	30.2	Very low	28.7	Very low	111 Å²	111	134.6 Å²	134.6	68%	0.681	76%	0.755	S	S	*	*	H	α-helix	trans	-76.2	-15.1	-178.6	32.7	0	0	0	0	115.6	L493	T491-L493 VanDerWaalsContact C-N 3.31Å; T491-L493 PolarHBondContact O-N 3.4Å
492	A	31.5	Very low	28.7	Very low	80 Å²	80	141.8 Å²	141.8	66%	0.661	76%	0.763	S	S	*	*	H	α-helix	trans	-75.3	-20.8	176.1	0	0	0	0	0	113.2	I490	I490-A492 PolarHBondContact O-N 2.76Å
493	L	30.5	Very low	29	Very low	145 Å²	145	140.5 Å²	140.5	76%	0.759	76%	0.755	S	S	*	*	H	α-helix	trans	-91.1	-16.7	-175.4	-131.7	137.8	0	0	0	113	I490 T491	I490-L493 PolarHBondContact O-N 3.24Å; T491-L493 VanDerWaalsContact C-N 3.31Å; T491-L493 PolarHBondContact O-N 3.4Å
494	Q	33.2	Very low	28.8	Very low	133 Å²	133	138.9 Å²	138.9	62%	0.621	75%	0.75	S	S	*	*	H	α-helix	trans	-88.2	-22.9	179.7	-127.6	159.8	-12	0	0	113	C496	Q494-C496 VanDerWaalsContact C-N 3.33Å; Q494-C496 PolarHBondContact O-N 3.42Å
495	L	31.8	Very low	28.7	Very low	140 Å²	140	139.3 Å²	139.3	73%	0.733	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-20.4	-179.7	-152	81	0	0	0	113.8
496	C	30.6	Very low	28.6	Very low	108 Å²	108	134.9 Å²	134.9	73%	0.73	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-14.9	-179	-84.4	0	0	0	0	114.7	Q494	Q494-C496 VanDerWaalsContact C-N 3.33Å; Q494-C496 PolarHBondContact O-N 3.42Å
497	N	32	Very low	28.3	Very low	132 Å²	132	134.4 Å²	134.4	71%	0.706	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.3	-17.6	-175.2	-80.4	-11.5	0	0	0	114.7
498	D	30.2	Very low	28.1	Very low	140 Å²	140	130.9 Å²	130.9	75%	0.749	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	9.4	-170.6	-78.2	-15.6	0	0	0	115.8
499	I	28.4	Very low	28	Very low	152 Å²	152	130.3 Å²	130.3	78%	0.779	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-3.4	179.2	-61.8	178.6	0	0	0	113.5
500	V	28.3	Very low	27.7	Very low	114 Å²	114	129.9 Å²	129.9	69%	0.691	75%	0.747	S	S	*	*	S	Bend	trans	-108.3	-1.1	-167.6	-176.7	0	0	0	0	116.7
501	Y	29.1	Very low	27.4	Very low	224 Å²	224	133.9 Å²	133.9	88%	0.878	76%	0.755	S	S	*	*	S	Bend	trans	-124.9	78.9	179.6	-87.5	-87.1	0	0	0	115
502	R	26	Very low	27	Very low	242 Å²	242	134 Å²	134	91%	0.913	76%	0.755	S	S	*	*			trans	41.1	163.9	143.7	-105.6	-155.2	168.7	162.6	0.1	122.3
503	P	33	Very low	26.6	Very low	98 Å²	98	134.5 Å²	134.5	64%	0.636	75%	0.754	S	S	*	*			trans	-114.4	167.9	-132.5	33.3	-11.9	0	0	0	115.5
504	S	22.6	Very low	26.2	Very low	104 Å²	104	133.6 Å²	133.6	73%	0.727	75%	0.75	S	S	*	*			trans	54.8	103.4	147.6	57.8	0	0	0	0	119.8
505	S	23.1	Very low	25.8	Very low	112 Å²	112	134.9 Å²	134.9	78%	0.783	76%	0.756	S	S	*	*			trans	-7.2	125.7	143.3	57.3	0	0	0	0	119.6
506	A	25.1	Very low	25.3	Very low	97 Å²	97	136.6 Å²	136.6	80%	0.802	76%	0.76	S	S	*	*			trans	-152.5	92.8	145.6	0	0	0	0	0	107
507	H	21.7	Very low	24.9	Very low	176 Å²	176	134.7 Å²	134.7	82%	0.815	76%	0.758	S	S	*	*				60.7	106.4	97.1	-84.5	3.9	0	0	0	116.3
508	S	22.4	Very low	24.6	Very low	121 Å²	121	133.3 Å²	133.3	85%	0.846	77%	0.765	S	S	*	*				75.6	132.9	129.1	69.3	0	0	0	0	121.5
509	G	22.9	Very low	24.2	Very low	71 Å²	71	131.1 Å²	131.1	73%	0.732	76%	0.761	S	S	*	*			trans	108	85.2	158.5	0	0	0	0	0	111.9
510	A	20.7	Very low	24	Very low	89 Å²	89	130.1 Å²	130.1	74%	0.736	76%	0.757	S	S	*	*				56.8	129.2	67.2	0	0	0	0	0	113.8
511	Y	22.2	Very low	24	Very low	222 Å²	222	130.5 Å²	130.5	87%	0.871	76%	0.756	S	S	*	*			trans	88.6	137	172.8	-73.6	-98.2	0	0	0	118
512	V	22.4	Very low	23.9	Very low	113 Å²	113	127.4 Å²	127.4	69%	0.685	75%	0.754	S	S	*	*			cis	176.7	146.4	-28.2	132.8	0	0	0	0	104.6
513	S	22.1	Very low	24	Very low	91 Å²	91	122.8 Å²	122.8	64%	0.636	74%	0.743	S	S	*	*			trans	74.9	116.9	155	-76.5	0	0	0	0	122.7
514	N	22.7	Very low	23.6	Very low	126 Å²	126	124.8 Å²	124.8	67%	0.674	75%	0.748	S	S	*	*				96.5	133.6	113.3	-76.5	17.3	0	0	0	120.7
515	E	23.9	Very low	23.9	Very low	160 Å²	160	129 Å²	129	75%	0.748	75%	0.75	S	S	*	*			trans	76.1	144.1	145.4	-75	170.8	-150.5	0	0	116.8
516	Q	22.7	Very low	24	Very low	177 Å²	177	130 Å²	130	83%	0.827	75%	0.751	S	S	*	*			cis	177.8	148.3	-8.8	-168.6	86.2	-14.9	0	0	104.2
517	G	22.2	Very low	24	Very low	67 Å²	67	131.2 Å²	131.2	69%	0.691	75%	0.753	S	S	*	*			trans	89.3	115.2	155.4	0	0	0	0	0	115.8
518	A	24	Very low	24.2	Very low	103 Å²	103	129 Å²	129	85%	0.851	75%	0.751	S	S	*	*				85.8	138.1	89	0	0	0	0	0	110.7
519	S	22.4	Very low	24.2	Very low	95 Å²	95	134.9 Å²	134.9	66%	0.664	76%	0.755	S	S	*	*			cis	-175.6	156.1	-9	62.8	0	0	0	0	104.6
520	N	24.7	Very low	24.4	Very low	131 Å²	131	138.8 Å²	138.8	70%	0.701	76%	0.757	S	S	*	*			trans	81.9	118.2	150.7	-64.7	1.4	0	0	0	120.5
521	D	27.4	Very low	24.7	Very low	122 Å²	122	140.9 Å²	140.9	65%	0.652	77%	0.765	S	S	*	*				68	87.7	125.7	-57.2	-22.6	0	0	0	118.9
522	N	27.2	Very low	24.9	Very low	158 Å²	158	133.4 Å²	133.4	85%	0.845	76%	0.755	S	S	*	*			trans	-129.9	92.1	141.4	-99.4	-12.3	0	0	0	109.4	D524	N522-D524 PolarHBondContact O-N 2.84Å
523	Q	27.8	Very low	25.1	Very low	145 Å²	145	135 Å²	135	68%	0.678	76%	0.758	S	S	*	*			trans	-77.4	90.9	164	-77.2	177.4	-7.4	0	0	108.7	Y525	Q523-Y525 HydrophobicContact CB-CE2 4.24Å
524	D	26.3	Very low	25.2	Very low	140 Å²	140	139.2 Å²	139.2	75%	0.749	77%	0.768	S	S	*	*			trans	-102.9	110.9	162.5	-88.1	-32.3	0	0	0	110.3	N522 T526	N522-D524 PolarHBondContact O-N 2.84Å; D524-T526 PolarHBondContact O-N 3.42Å
525	Y	27.1	Very low	25.4	Very low	193 Å²	193	140.5 Å²	140.5	76%	0.757	77%	0.774	S	S	*	*			trans	-67.5	108.2	-176.8	-71.6	-99.2	0	0	0	111.2	Q523 C527	Q523-Y525 HydrophobicContact CB-CE2 4.24Å; Y525-C527 PolarHBondContact O-N 2.91Å
526	T	25.7	Very low	25.5	Very low	134 Å²	134	143 Å²	143	82%	0.822	78%	0.778	S	S	*	*			trans	-93.9	86.7	168.6	41.7	0	0	0	0	110.4	D524 V528	D524-T526 PolarHBondContact O-N 3.42Å; T526-V528 PolarHBondContact O-N 2.85Å
527	C	25.6	Very low	25.6	Very low	122 Å²	122	145.2 Å²	145.2	82%	0.824	78%	0.779	S	S	*	*			trans	-73.9	103.3	168.9	-87.1	0	0	0	0	110.2	Y525 R529	Y525-C527 PolarHBondContact O-N 2.91Å; C527-R529 PolarHBondContact O-N 3.18Å
528	V	26.6	Very low	25.6	Very low	128 Å²	128	153.5 Å²	153.5	78%	0.776	79%	0.789	S	S	*	*			trans	-83.4	113.8	169.4	178.3	0	0	0	0	109.2	T526 I530	T526-V528 PolarHBondContact O-N 2.85Å; V528-I530 HydrophobicContact CG1-CG1 4.45Å; V528-I530 PolarHBondContact O-N 3.4Å
529	R	22	Very low	25.6	Very low	246 Å²	246	157.3 Å²	157.3	93%	0.928	79%	0.787	S	S	*	*			trans	-86.6	103.6	-178	-162.9	-175.8	-145	-178.9	6.1	109.4	C527	C527-R529 PolarHBondContact O-N 3.18Å
530	I	26.7	Very low	25.7	Very low	153 Å²	153	164.5 Å²	164.5	79%	0.785	80%	0.799	S	S	*	*			trans	-121.4	129.6	159.7	-58.8	176.8	0	0	0	106.8	V528 G532	V528-I530 HydrophobicContact CG1-CG1 4.45Å; V528-I530 PolarHBondContact O-N 3.4Å; I530-G532 PolarHBondContact O-N 3.08Å
531	C	27.5	Very low	25.7	Very low	133 Å²	133	163.7 Å²	163.7	90%	0.899	80%	0.804	S	S	*	*	S	Bend	trans	-34.4	107.7	-167.6	-66.1	0	0	0	0	116.3
532	G	26.4	Very low	25.6	Very low	64 Å²	64	163.1 Å²	163.1	66%	0.66	81%	0.809	S	S	*	*	S	Bend		81.5	65.1	127.9	0	0	0	0	0	118.6	I530	I530-G532 PolarHBondContact O-N 3.08Å
533	I	26.1	Very low	25.6	Very low	148 Å²	148	164.6 Å²	164.6	76%	0.759	81%	0.811	S	S	*	*			trans	-155.8	110.2	140	-80.7	124.4	0	0	0	106.8	L535	I533-L535 HydrophobicContact CG2-CB 4.45Å; I533-L535 HydrophobicContact CG2-CD1 3.48Å; I533-L535 VanDerWaalsContact CG2-CD1 3.48Å; I533-L535 HydrophobicContact CG2-CG 3.58Å; I533-L535 PolarHBondContact O-N 3.09Å
534	Q	25.2	Very low	25.5	Very low	178 Å²	178	167.5 Å²	167.5	83%	0.832	82%	0.821	S	S	*	*			trans	-83.1	94.4	172.2	-77.3	179.8	-16	0	0	109
535	L	26.3	Very low	25.5	Very low	153 Å²	153	166.5 Å²	166.5	80%	0.801	83%	0.825	S	S	*	*			trans	-93.8	102.7	172.3	-84.7	155.9	0	0	0	109.7	I533 R537	I533-L535 HydrophobicContact CG2-CB 4.45Å; I533-L535 HydrophobicContact CG2-CD1 3.48Å; I533-L535 VanDerWaalsContact CG2-CD1 3.48Å; I533-L535 HydrophobicContact CG2-CG 3.58Å; I533-L535 PolarHBondContact O-N 3.09Å; L535-R537 PolarHBondContact O-N 3.37Å
536	Y	24.9	Very low	25.4	Very low	213 Å²	213	162.2 Å²	162.2	84%	0.835	82%	0.824	S	S	*	*			trans	-58	113.1	171.9	-89.1	-95.4	0	0	0	110.4	R538	Y536-R538 PolarHBondContact O-N 3.34Å; Y536-R538 VanDerWaalsContact O-N 3.12Å
537	R	24.7	Very low	25.5	Very low	223 Å²	223	165.1 Å²	165.1	84%	0.842	83%	0.825	S	S	*	*			trans	-76.8	92.2	-179.2	-162.2	-176	-146.1	174.1	6.3	110	L535	L535-R537 PolarHBondContact O-N 3.37Å
538	R	23.2	Very low	25.4	Very low	241 Å²	241	166.2 Å²	166.2	91%	0.909	83%	0.828	S	S	*	*			trans	-95.9	109	167.1	-142.9	178	-159.9	179.2	5.4	109	Y536 R540	Y536-R538 PolarHBondContact O-N 3.34Å; Y536-R538 VanDerWaalsContact O-N 3.12Å; R538-R540 PolarHBondContact O-N 3.12Å
539	F	23.5	Very low	25.4	Very low	184 Å²	184	168 Å²	168	81%	0.807	83%	0.832	S	S	*	*			trans	-58.2	116.2	175.3	-88.9	-97	0	0	0	110.2
540	R	25.5	Very low	25.6	Very low	246 Å²	246	160.2 Å²	160.2	93%	0.928	82%	0.821	S	S	*	*			trans	-107	125.1	161	-94.8	-174.4	175.9	175	-0.6	108.7	R538	R538-R540 PolarHBondContact O-N 3.12Å
541	S	24.2	Very low	25.5	Very low	113 Å²	113	158.3 Å²	158.3	79%	0.79	82%	0.819	S	S	*	*			trans	-62.4	134.6	-176.2	55.1	0	0	0	0	112.2	Q543	S541-Q543 PolarHBondContact O-N 2.96Å
542	S	25.2	Very low	25.6	Very low	110 Å²	110	157.9 Å²	157.9	77%	0.769	81%	0.814	S	S	*	*			trans	-51.2	108.2	171.8	173	0	0	0	0	112.1
543	Q	26.8	Very low	25.6	Very low	190 Å²	190	162.9 Å²	162.9	89%	0.888	83%	0.825	S	S	*	*			trans	-100	110.8	158.4	-103.9	-178.7	-10.9	0	0	108.2	S541 S545	S541-Q543 PolarHBondContact O-N 2.96Å; Q543-S545 PolarHBondContact O-N 3.41Å
544	K	25.3	Very low	25.7	Very low	205 Å²	205	164.2 Å²	164.2	89%	0.891	83%	0.825	S	S	*	*			trans	-59.7	107.6	172.6	-72.3	172.6	175.1	175.4	0	109.2
545	S	26.7	Very low	26	Very low	119 Å²	119	161.2 Å²	161.2	83%	0.832	82%	0.821	S	S	*	*			trans	-108.3	115.4	166.9	-174.7	0	0	0	0	109.2	Q543	Q543-S545 PolarHBondContact O-N 3.41Å
546	S	25.6	Very low	26.2	Very low	104 Å²	104	160.4 Å²	160.4	73%	0.727	81%	0.811	S	S	*	*			trans	-83.1	116.8	-175.9	48.8	0	0	0	0	111.5
547	K	26.8	Very low	26.7	Very low	195 Å²	195	155.4 Å²	155.4	85%	0.848	80%	0.803	S	S	*	*			trans	40.8	102.8	138	-63.6	-179.3	178.3	179.6	0	117.2
548	T	25.1	Very low	27.3	Very low	144 Å²	144	149.4 Å²	149.4	88%	0.883	79%	0.787	S	S	*	*			trans	-131.2	110.2	137.4	-32.9	0	0	0	0	106.9	A550	T548-A550 PolarHBondContact O-N 2.93Å; T548-A550 VanDerWaalsContact O-N 3.08Å
549	L	26.5	Very low	28.3	Very low	165 Å²	165	145.2 Å²	145.2	86%	0.864	77%	0.772	S	S	*	*			trans	-66.5	103.7	-174.9	-139.2	89.3	0	0	0	108.2
550	A	25.3	Very low	29.2	Very low	84 Å²	84	139.2 Å²	139.2	69%	0.694	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-57.8	136	170.3	0	0	0	0	0	109.2	T548	T548-A550 PolarHBondContact O-N 2.93Å; T548-A550 VanDerWaalsContact O-N 3.08Å
551	P	25	Very low	30.3	Very low	113 Å²	113	131.1 Å²	131.1	73%	0.734	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-61.6	138.6	-176.2	24.1	-31.3	0	0	0	110.4	L553	P551-L553 PolarHBondContact O-N 3.44Å
552	P	30.1	Very low	31.8	Very low	124 Å²	124	133.1 Å²	133.1	81%	0.805	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-65.9	129.4	-165.1	25.4	-33.1	0	0	0	111.5	K554	P552-K554 PolarHBondContact O-N 3.01Å
553	L	26.5	Very low	33.3	Very low	169 Å²	169	134.5 Å²	134.5	89%	0.885	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-50.7	130.5	178.5	-76.9	95.7	0	0	0	111.6	P551	P551-L553 PolarHBondContact O-N 3.44Å
554	K	26.3	Very low	34.9	Very low	176 Å²	176	126.6 Å²	126.6	77%	0.765	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-55.5	128.8	179.3	-80.9	172	176.4	166.1	0	111.1	P552 F556	P552-K554 PolarHBondContact O-N 3.01Å; K554-F556 HydrophobicContact CB-CD2 4.29Å; K554-F556 HydrophobicContact CB-CE2 4.13Å; K554-F556 WeakPolarHBondContact O-CD2 3.18Å; K554-F556 PolarHBondContact O-N 3.31Å; K554-F556 VanDerWaalsContact O-N 3.07Å
555	P	32.2	Very low	36.7	Very low	115 Å²	115	118.8 Å²	118.8	75%	0.747	64%	0.635	S	S	*	*			trans	-73.8	103.1	-179.6	29	-32.5	0	0	0	110.8
556	F	30.6	Very low	38.8	Very low	135 Å²	135	115.8 Å²	115.8	59%	0.592	61%	0.609	S	S	*	*			trans	-97.9	78.8	170.2	-81.4	-92.1	0	0	0	110.7	K554	K554-F556 HydrophobicContact CB-CD2 4.29Å; K554-F556 HydrophobicContact CB-CE2 4.13Å; K554-F556 WeakPolarHBondContact O-CD2 3.18Å; K554-F556 PolarHBondContact O-N 3.31Å; K554-F556 VanDerWaalsContact O-N 3.07Å
557	T	35.4	Very low	41.1	Very low	108 Å²	108	113.3 Å²	113.3	66%	0.663	59%	0.588	S	S	*	*			trans	-139.2	0.8	174.6	54.4	0	0	0	0	117.1
558	L	38.4	Very low	43.6	Very low	97 Å²	97	104 Å²	104	51%	0.508	55%	0.547	S	S	.	.	S	Bend	trans	-118	6.6	-179.5	-76.8	159.2	0	0	0	115.6	R562	L558-R562 WeakPolarHBondContact O-CG 3.45Å
559	R	42.7	Very low	46	Very low	154 Å²	154	97.1 Å²	97.1	58%	0.581	51%	0.505	S	S	*	.	H	α-helix	trans	-70.4	-45.4	-177.5	-71.9	-174	-176.9	-172	2.4	115.4	R561 R562 F563	R559-R561 PolarHBondContact O-N 3.29Å; R559-R562 WeakPolarHBondContact O-CB 3.31Å; R559-R562 PolarHBondContact O-N 3.45Å; R559-R562 VanDerWaalsContact O-N 3.16Å; R559-F563 HydrophobicContact CB-CE2 4.44Å; R559-F563 VanDerWaalsContact O-CD2 3.31Å; R559-F563 WeakPolarHBondContact O-CD2 3.31Å; R559-F563 PolarHBondContact O-N 3.07Å
560	P	43.9	Very low	48.6	Very low	58 Å²	58	92.5 Å²	92.5	38%	0.377	48%	0.481	S	S	.	.	H	α-helix	trans	-68.8	-37.6	-168.7	21.8	-29.7	0	0	0	113.7	R562 F563 A564	P560-R562 PolarHBondContact O-N 3.02Å; P560-F563 PolarHBondContact O-N 3.26Å; P560-A564 PolarHBondContact O-N 2.98Å; P560-A564 VanDerWaalsContact O-N 3.16Å
561	R	48.7	Very low	51.4	Low	76 Å²	76	88.7 Å²	88.7	29%	0.287	45%	0.449	S	S	.	.	H	α-helix	trans	-61.2	-31.7	175.1	-168	174.4	179.6	-174.3	-4.7	112.2	W361 R559	W361-R561 HydrophobicContact CH2-CG 4.4Å; W361-R561 HydrophobicContact CZ2-CG 4.38Å; R559-R561 PolarHBondContact O-N 3.29Å
562	R	54.9	Low	54.2	Low	155 Å²	155	83.4 Å²	83.4	59%	0.585	42%	0.415	S	S	*	.	H	α-helix	trans	-75	-32.8	178.3	-66.3	178.9	179.7	-174.5	0.1	112.4	L558 R559 P560	L558-R562 WeakPolarHBondContact O-CG 3.45Å; R559-R562 WeakPolarHBondContact O-CB 3.31Å; R559-R562 PolarHBondContact O-N 3.45Å; R559-R562 VanDerWaalsContact O-N 3.16Å; P560-R562 PolarHBondContact O-N 3.02Å
563	F	56.6	Low	56.7	Low	138 Å²	138	77.7 Å²	77.7	61%	0.605	38%	0.378	S	S	*	.	H	α-helix	trans	-73.7	-36.9	176.4	-81.5	-74.7	0	0	0	112.6	R559 P560 R565 L566	R559-F563 HydrophobicContact CB-CE2 4.44Å; R559-F563 VanDerWaalsContact O-CD2 3.31Å; R559-F563 WeakPolarHBondContact O-CD2 3.31Å; R559-F563 PolarHBondContact O-N 3.07Å; P560-F563 PolarHBondContact O-N 3.26Å; F563-R565 PolarHBondContact O-N 3.4Å; F563-L566 VanDerWaalsContact O-CB 3.28Å; F563-L566 WeakPolarHBondContact O-CB 3.32Å; F563-L566 PolarHBondContact O-N 3.35Å
564	A	59.6	Low	59.4	Low	24 Å²	24	71 Å²	71	20%	0.198	34%	0.341	C	S	.	.	H	α-helix	trans	-60.8	-31.6	178.7	0	0	0	0	0	113.2	W361 P560 L566 L567	W361-A564 HydrophobicContact CH2-CB 4.15Å; W361-A564 HydrophobicContact CZ3-CB 3.77Å; P560-A564 PolarHBondContact O-N 2.98Å; P560-A564 VanDerWaalsContact O-N 3.16Å; A564-L566 PolarHBondContact O-N 2.75Å; A564-L567 PolarHBondContact O-N 3.07Å
565	R	64.7	Low	62.2	Low	41 Å²	41	63.3 Å²	63.3	16%	0.155	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-10.4	175.3	-68.7	-177.5	178.6	178.8	-1.6	113.9	F563 L567 N617 F620	F563-R565 PolarHBondContact O-N 3.4Å; R565-L567 VanDerWaalsContact C-N 3.35Å; R565-N617 PolarHBondContact NH1-OD1 2.85Å; R565-F620 HydrophobicContact CB-CD2 4.27Å; R565-F620 WeakPolarHBondContact O-CD2 3.48Å
566	L	69.3	Low	64.6	Low	56 Å²	56	59 Å²	59	29%	0.293	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-15	177.1	-156.9	77.1	0	0	0	112.2	F563 A564 V569	F563-L566 VanDerWaalsContact O-CB 3.28Å; F563-L566 WeakPolarHBondContact O-CB 3.32Å; F563-L566 PolarHBondContact O-N 3.35Å; A564-L566 PolarHBondContact O-N 2.75Å; L566-V569 HydrophobicContact CD1-CG2 4.14Å; L566-V569 HydrophobicContact CG-CG2 4.41Å; L566-V569 WeakPolarHBondContact O-CB 3.36Å; L566-V569 WeakPolarHBondContact O-CG2 3.43Å; L566-V569 PolarHBondContact O-N 2.66Å
567	L	75.6	Confident	67.2	Low	52 Å²	52	52.9 Å²	52.9	27%	0.272	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-37.8	-172.7	-148.9	67.1	0	0	0	114.2	A368 F409 A564 R565 V569 L570 P571	A368-L567 HydrophobicContact CB-CD2 3.69Å; F409-L567 HydrophobicContact CD2-CD2 3.89Å; F409-L567 HydrophobicContact CE2-CD2 4.06Å; A564-L567 PolarHBondContact O-N 3.07Å; R565-L567 VanDerWaalsContact C-N 3.35Å; L567-V569 PolarHBondContact O-N 3.46Å; L567-L570 HydrophobicContact CD1-CD1 4.04Å; L567-L570 PolarHBondContact O-N 3.33Å; L567-P571 WeakPolarHBondContact O-CD 3.31Å
568	P	77.3	Confident	69.4	Low	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-15.7	173.9	-25.4	38.5	0	0	0	114.8	L570 P571 T572 F620 S623 T624	P568-L570 VanDerWaalsContact C-N 3.29Å; P568-L570 PolarHBondContact O-N 3.26Å; P568-P571 VanDerWaalsContact O-CD 3.25Å; P568-P571 WeakPolarHBondContact O-CD 3.32Å; P568-P571 VanDerWaalsContact O-CG 3.28Å; P568-P571 WeakPolarHBondContact O-CG 3.49Å; P568-T572 PolarHBondContact O-OG1 3.09Å; P568-F620 HydrophobicContact CB-CD2 4.49Å; P568-F620 HydrophobicContact CG-CD2 3.94Å; P568-F620 HydrophobicContact CG-CE2 3.74Å; P568-S623 WeakPolarHBondContact O-CB 3.5Å; P568-T624 HydrophobicContact CB-CG2 3.84Å; P568-T624 HydrophobicContact CG-CG2 4.29Å
569	V	77.3	Confident	71.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-67.9	-32.3	176.9	177.4	0	0	0	0	111.2	L566 L567 T572 V573 L609 L612 A619	L566-V569 HydrophobicContact CD1-CG2 4.14Å; L566-V569 HydrophobicContact CG-CG2 4.41Å; L566-V569 WeakPolarHBondContact O-CB 3.36Å; L566-V569 WeakPolarHBondContact O-CG2 3.43Å; L566-V569 PolarHBondContact O-N 2.66Å; L567-V569 PolarHBondContact O-N 3.46Å; V569-T572 WeakPolarHBondContact O-CB 3.12Å; V569-T572 PolarHBondContact O-N 3.02Å; V569-V573 HydrophobicContact CG1-CG2 3.74Å; V569-V573 VanDerWaalsContact O-CG2 3.29Å; V569-V573 WeakPolarHBondContact O-CG2 3.45Å; V569-V573 PolarHBondContact O-N 3.34Å; V569-L609 HydrophobicContact CG1-CD2 4.03Å; V569-L612 HydrophobicContact CG1-CB 3.87Å; V569-L612 HydrophobicContact CG1-CD1 3.45Å; V569-L612 VanDerWaalsContact CG1-CD1 3.45Å; V569-L612 HydrophobicContact CG1-CG 4.25Å; V569-A619 HydrophobicContact CG2-CB 4.11Å
570	L	81.1	Confident	73.5	Confident	67 Å²	67	40.5 Å²	40.5	35%	0.351	19%	0.19	S	C	.	.	H	α-helix	trans	-58.3	-53.4	-177.8	-63.7	176.7	0	0	0	113.7	M371 L567 P568 T572 V573 F574 L609	M371-L570 HydrophobicContact CE-CB 4.24Å; M371-L570 HydrophobicContact CG-CB 3.86Å; M371-L570 HydrophobicContact SD-CB 4.09Å; L567-L570 HydrophobicContact CD1-CD1 4.04Å; L567-L570 PolarHBondContact O-N 3.33Å; P568-L570 VanDerWaalsContact C-N 3.29Å; P568-L570 PolarHBondContact O-N 3.26Å; L570-T572 VanDerWaalsContact C-N 3.27Å; L570-T572 PolarHBondContact O-N 3.37Å; L570-V573 PolarHBondContact O-N 2.9Å; L570-F574 PolarHBondContact O-N 3.06Å; L570-L609 HydrophobicContact CD2-CD2 4.19Å
571	P	82.4	Confident	75.2	Confident	4 Å²	4	37.8 Å²	37.8	3%	0.026	17%	0.173	C	C	.	.	H	α-helix	trans	-63.6	-33.1	177.4	23.8	-34.3	0	0	0	112.4	I370 M371 L567 P568 F574 I575 V627	I370-P571 HydrophobicContact CG2-CB 4.35Å; M371-P571 HydrophobicContact CG-CB 4.42Å; M371-P571 VanDerWaalsContact SD-CA 3.59Å; M371-P571 HydrophobicContact SD-CB 4Å; L567-P571 WeakPolarHBondContact O-CD 3.31Å; P568-P571 VanDerWaalsContact O-CD 3.25Å; P568-P571 WeakPolarHBondContact O-CD 3.32Å; P568-P571 VanDerWaalsContact O-CG 3.28Å; P568-P571 WeakPolarHBondContact O-CG 3.49Å; P571-F574 WeakPolarHBondContact O-CB 3.4Å; P571-F574 PolarHBondContact O-N 2.84Å; P571-I575 VanDerWaalsContact O-CG1 3.31Å; P571-I575 WeakPolarHBondContact O-CG1 3.34Å; P571-I575 PolarHBondContact O-N 2.9Å; P571-V627 HydrophobicContact CB-CG2 4.02Å; P571-V627 HydrophobicContact CG-CG2 4.09Å
572	T	83.6	Confident	76.4	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.018	16%	0.162	C	C	.	.	H	α-helix	trans	-64.1	-46.7	175.1	-52	0	0	0	0	112	P568 V569 L570 F574 I575 L576 S623 L626 V627	P568-T572 PolarHBondContact O-OG1 3.09Å; V569-T572 WeakPolarHBondContact O-CB 3.12Å; V569-T572 PolarHBondContact O-N 3.02Å; L570-T572 VanDerWaalsContact C-N 3.27Å; L570-T572 PolarHBondContact O-N 3.37Å; T572-F574 VanDerWaalsContact C-N 3.26Å; T572-F574 PolarHBondContact O-N 3.42Å; T572-I575 PolarHBondContact O-N 2.79Å; T572-L576 HydrophobicContact CG2-CD1 3.96Å; T572-L576 HydrophobicContact CG2-CG 4.33Å; T572-L576 WeakPolarHBondContact O-CB 3.28Å; T572-L576 WeakPolarHBondContact O-CG 3.25Å; T572-L576 PolarHBondContact O-N 3.47Å; T572-S623 VanDerWaalsContact OG1-C 3.3Å; T572-S623 WeakPolarHBondContact OG1-CA 3.41Å; T572-S623 WeakPolarHBondContact OG1-CB 3.26Å; T572-S623 PolarHBondContact OG1-O 3Å; T572-L626 HydrophobicContact CG2-CB 3.77Å; T572-L626 HydrophobicContact CG2-CD1 3.36Å; T572-L626 HydrophobicContact CG2-CG 4.21Å; T572-V627 VanDerWaalsContact OG1-CG2 3.26Å; T572-V627 WeakPolarHBondContact OG1-CG2 3.46Å
573	V	83.9	Confident	77.5	Confident	4 Å²	4	29.8 Å²	29.8	2%	0.024	15%	0.151	C	C	.	.	H	α-helix	trans	-60.6	-41.6	177.4	171.3	0	0	0	0	109.7	V569 L570 L576 I577 L608 L609 L612	V569-V573 HydrophobicContact CG1-CG2 3.74Å; V569-V573 VanDerWaalsContact O-CG2 3.29Å; V569-V573 WeakPolarHBondContact O-CG2 3.45Å; V569-V573 PolarHBondContact O-N 3.34Å; L570-V573 PolarHBondContact O-N 2.9Å; V573-L576 PolarHBondContact O-N 3.21Å; V573-I577 HydrophobicContact CG1-CD1 3.52Å; V573-I577 HydrophobicContact CG1-CG1 4.22Å; V573-I577 WeakPolarHBondContact O-CB 3.33Å; V573-I577 WeakPolarHBondContact O-CD1 3.47Å; V573-I577 WeakPolarHBondContact O-CG1 3.39Å; V573-I577 PolarHBondContact O-N 2.84Å; V573-L608 HydrophobicContact CG1-CB 4.29Å; V573-L608 HydrophobicContact CG1-CD1 4.29Å; V573-L608 HydrophobicContact CG2-CB 4.01Å; V573-L609 HydrophobicContact CG2-CD2 4.15Å; V573-L609 HydrophobicContact CG2-CG 4.28Å; V573-L612 HydrophobicContact CG2-CD1 3.93Å
574	F	82.8	Confident	78.5	Confident	28 Å²	28	25.8 Å²	25.8	12%	0.123	14%	0.136	C	C	.	.	H	α-helix	trans	-59	-48.5	175.4	-174	-89.6	0	0	0	112.4	V374 I378 L570 P571 T572 I577 G578 Y653 L657	V374-F574 HydrophobicContact CG1-CD2 4.32Å; V374-F574 HydrophobicContact CG1-CE1 4.11Å; V374-F574 HydrophobicContact CG1-CE2 3.7Å; V374-F574 HydrophobicContact CG1-CZ 3.59Å; I378-F574 HydrophobicContact CD1-CE2 4.2Å; L570-F574 PolarHBondContact O-N 3.06Å; P571-F574 WeakPolarHBondContact O-CB 3.4Å; P571-F574 PolarHBondContact O-N 2.84Å; T572-F574 VanDerWaalsContact C-N 3.26Å; T572-F574 PolarHBondContact O-N 3.42Å; F574-I577 PolarHBondContact O-N 3.02Å; F574-G578 PolarHBondContact O-N 3.47Å; F574-Y653 HydrophobicContact CD1-CD1 4.14Å; F574-Y653 HydrophobicContact CD1-CE1 4.09Å; F574-Y653 HydrophobicContact CD2-CD1 4.39Å; F574-Y653 AromaticContact CD2-CE1 3.64Å; F574-Y653 HydrophobicContact CD2-CE1 3.64Å; F574-Y653 AromaticContact CE1-CD1 3.59Å; F574-Y653 HydrophobicContact CE1-CD1 3.59Å; F574-Y653 AromaticContact CE1-CE1 3.83Å; F574-Y653 HydrophobicContact CE1-CE1 3.83Å; F574-Y653 AromaticContact CE2-CD1 3.88Å; F574-Y653 HydrophobicContact CE2-CD1 3.88Å; F574-Y653 AromaticContact CE2-CE1 3.34Å; F574-Y653 HydrophobicContact CE2-CE1 3.34Å; F574-Y653 AromaticContact CG-CE1 4Å; F574-Y653 HydrophobicContact CG-CE1 4Å; F574-Y653 AromaticContact CZ-CD1 3.44Å; F574-Y653 HydrophobicContact CZ-CD1 3.44Å; F574-Y653 VanDerWaalsContact CZ-CD1 3.44Å; F574-Y653 AromaticContact CZ-CE1 3.44Å; F574-Y653 HydrophobicContact CZ-CE1 3.44Å; F574-Y653 VanDerWaalsContact CZ-CE1 3.44Å; F574-L657 HydrophobicContact CE2-CD1 3.74Å; F574-L657 HydrophobicContact CZ-CD1 4.03Å
575	I	84.2	Confident	79	Confident	15 Å²	15	25.6 Å²	25.6	8%	0.077	13%	0.131	C	C	.	.	H	α-helix	trans	-65.4	-43.1	179.2	-65.9	167.6	0	0	0	111.3	P571 T572 G578 Y579 V627 Y630 V650 W683	P571-I575 VanDerWaalsContact O-CG1 3.31Å; P571-I575 WeakPolarHBondContact O-CG1 3.34Å; P571-I575 PolarHBondContact O-N 2.9Å; T572-I575 PolarHBondContact O-N 2.79Å; I575-G578 PolarHBondContact O-N 3.01Å; I575-Y579 PolarHBondContact O-N 3.27Å; I575-V627 HydrophobicContact CD1-CB 4.48Å; I575-V627 HydrophobicContact CD1-CG1 4.48Å; I575-V627 HydrophobicContact CD1-CG2 4Å; I575-Y630 HydrophobicContact CD1-CD1 3.86Å; I575-Y630 HydrophobicContact CD1-CE1 4.45Å; I575-Y630 HydrophobicContact CD1-CG 4.15Å; I575-Y630 HydrophobicContact CG2-CD2 3.97Å; I575-Y630 HydrophobicContact CG2-CE2 4.22Å; I575-Y630 HydrophobicContact CG2-CG 4.17Å; I575-V650 HydrophobicContact CG1-CG2 4.43Å; I575-W683 HydrophobicContact CG2-CH2 3.67Å; I575-W683 HydrophobicContact CG2-CZ2 3.65Å
576	L	84.7	Confident	79.2	Confident	24 Å²	24	30.8 Å²	30.8	13%	0.126	15%	0.151	C	C	.	.	H	α-helix	trans	-65.4	-41.6	179.2	-75.5	176.2	0	0	0	112	T572 V573 G578 Y579 L580 L608 L626 W683 F684	T572-L576 HydrophobicContact CG2-CD1 3.96Å; T572-L576 HydrophobicContact CG2-CG 4.33Å; T572-L576 WeakPolarHBondContact O-CB 3.28Å; T572-L576 WeakPolarHBondContact O-CG 3.25Å; T572-L576 PolarHBondContact O-N 3.47Å; V573-L576 PolarHBondContact O-N 3.21Å; L576-G578 VanDerWaalsContact C-N 3.31Å; L576-Y579 PolarHBondContact O-N 2.69Å; L576-L580 VanDerWaalsContact O-CB 3.3Å; L576-L580 WeakPolarHBondContact O-CB 3.46Å; L576-L580 WeakPolarHBondContact O-CD1 2.98Å; L576-L580 VanDerWaalsContact O-CG 3.23Å; L576-L580 WeakPolarHBondContact O-CG 3.46Å; L576-L580 PolarHBondContact O-N 3.15Å; L576-L608 HydrophobicContact CB-CD1 4.1Å; L576-L608 HydrophobicContact CD1-CD2 4.3Å; L576-L626 HydrophobicContact CD1-CD1 4.22Å; L576-W683 HydrophobicContact CD2-CH2 4.48Å; L576-F684 HydrophobicContact CD2-CE1 3.96Å; L576-F684 HydrophobicContact CD2-CZ 4.36Å
577	I	84.2	Confident	79.2	Confident	6 Å²	6	32.7 Å²	32.7	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-63.7	-41.7	173.7	-66.4	166.2	0	0	0	109.8	V573 F574 Y579 L580 S581 M604 L608 Y653	V573-I577 HydrophobicContact CG1-CD1 3.52Å; V573-I577 HydrophobicContact CG1-CG1 4.22Å; V573-I577 WeakPolarHBondContact O-CB 3.33Å; V573-I577 WeakPolarHBondContact O-CD1 3.47Å; V573-I577 WeakPolarHBondContact O-CG1 3.39Å; V573-I577 PolarHBondContact O-N 2.84Å; F574-I577 PolarHBondContact O-N 3.02Å; I577-Y579 PolarHBondContact O-N 3.48Å; I577-L580 PolarHBondContact O-N 2.63Å; I577-S581 WeakPolarHBondContact O-CB 3.41Å; I577-S581 PolarHBondContact O-N 2.59Å; I577-S581 PolarHBondContact O-OG 3.34Å; I577-M604 HydrophobicContact CG1-CB 4.32Å; I577-L608 HydrophobicContact CG1-CD1 4Å; I577-Y653 HydrophobicContact CG2-CE2 3.91Å; I577-Y653 WeakPolarHBondContact CG2-OH 3.39Å
578	G	81.6	Confident	78.9	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-55	-52.7	174.2	0	0	0	0	0	112	F574 I575 L576 S581 I582 Y653	F574-G578 PolarHBondContact O-N 3.47Å; I575-G578 PolarHBondContact O-N 3.01Å; L576-G578 VanDerWaalsContact C-N 3.31Å; G578-S581 PolarHBondContact O-N 3.39Å; G578-S581 PolarHBondContact O-OG 2.96Å; G578-I582 WeakPolarHBondContact O-CG1 3.42Å; G578-I582 PolarHBondContact O-N 3.26Å; G578-Y653 VanDerWaalsContact CA-CG 3.46Å
579	Y	83.9	Confident	78.6	Confident	58 Å²	58	40.1 Å²	40.1	23%	0.227	20%	0.203	C	C	.	.	H	α-helix	trans	-58.5	-51.1	175.6	176.8	-104.6	0	0	0	112.5	I575 L576 I577 S581 I582 S583 I649 V680 W683 F684	I575-Y579 PolarHBondContact O-N 3.27Å; L576-Y579 PolarHBondContact O-N 2.69Å; I577-Y579 PolarHBondContact O-N 3.48Å; Y579-S581 VanDerWaalsContact C-N 3.33Å; Y579-S581 PolarHBondContact O-N 3.25Å; Y579-I582 PolarHBondContact O-N 3.23Å; Y579-S583 PolarHBondContact O-N 3.24Å; Y579-S583 PolarHBondContact O-OG 2.83Å; Y579-I649 HydrophobicContact CD2-CD1 4.09Å; Y579-V680 HydrophobicContact CE2-CG1 3.83Å; Y579-W683 HydrophobicContact CD2-CZ3 4.43Å; Y579-W683 HydrophobicContact CG-CZ3 4.37Å; Y579-F684 HydrophobicContact CD1-CE2 4.2Å; Y579-F684 AromaticContact CD1-CZ 3.83Å; Y579-F684 HydrophobicContact CD1-CZ 3.83Å; Y579-F684 AromaticContact CE1-CE2 3.74Å; Y579-F684 HydrophobicContact CE1-CE2 3.74Å; Y579-F684 AromaticContact CE1-CZ 3.73Å; Y579-F684 HydrophobicContact CE1-CZ 3.73Å; Y579-F684 HydrophobicContact CE2-CE2 4.45Å; Y579-F684 HydrophobicContact CG-CZ 4.49Å; Y579-F684 AromaticContact CZ-CE2 3.88Å
580	L	82.7	Confident	78	Confident	41 Å²	41	40.3 Å²	40.3	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-63.7	-37.4	-178.7	-73.8	167.4	0	0	0	112.6	L576 I577 I582 S583 L584 F600 M604	L576-L580 VanDerWaalsContact O-CB 3.3Å; L576-L580 WeakPolarHBondContact O-CB 3.46Å; L576-L580 WeakPolarHBondContact O-CD1 2.98Å; L576-L580 VanDerWaalsContact O-CG 3.23Å; L576-L580 WeakPolarHBondContact O-CG 3.46Å; L576-L580 PolarHBondContact O-N 3.15Å; I577-L580 PolarHBondContact O-N 2.63Å; L580-I582 VanDerWaalsContact C-N 3.27Å; L580-I582 PolarHBondContact O-N 3.35Å; L580-S583 PolarHBondContact O-N 3.35Å; L580-L584 HydrophobicContact CB-CD1 4.47Å; L580-L584 HydrophobicContact CD2-CD1 4.05Å; L580-L584 WeakPolarHBondContact O-CB 3.39Å; L580-L584 WeakPolarHBondContact O-CG 2.92Å; L580-L584 PolarHBondContact O-N 3.03Å; L580-F600 HydrophobicContact CB-CZ 4.23Å; L580-M604 HydrophobicContact CD1-CE 3.72Å
581	S	79.7	Confident	77.4	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-36.7	177.9	71.4	0	0	0	0	111.6	I577 G578 Y579 D585	I577-S581 WeakPolarHBondContact O-CB 3.41Å; I577-S581 PolarHBondContact O-N 2.59Å; I577-S581 PolarHBondContact O-OG 3.34Å; G578-S581 PolarHBondContact O-N 3.39Å; G578-S581 PolarHBondContact O-OG 2.96Å; Y579-S581 VanDerWaalsContact C-N 3.33Å; Y579-S581 PolarHBondContact O-N 3.25Å; S581-D585 VanDerWaalsContact O-CB 3.3Å; S581-D585 WeakPolarHBondContact O-CB 3.4Å; S581-D585 PolarHBondContact O-N 2.88Å
582	I	75.3	Confident	76.7	Confident	13 Å²	13	47.6 Å²	47.6	7%	0.067	24%	0.236	C	C	.	.	H	α-helix	trans	-76.4	-45.9	177.2	-65.4	173.6	0	0	0	110.3	G578 Y579 L580 I649 E652 M656	G578-I582 WeakPolarHBondContact O-CG1 3.42Å; G578-I582 PolarHBondContact O-N 3.26Å; Y579-I582 PolarHBondContact O-N 3.23Å; L580-I582 VanDerWaalsContact C-N 3.27Å; L580-I582 PolarHBondContact O-N 3.35Å; I582-I649 HydrophobicContact CD1-CB 4.1Å; I582-I649 HydrophobicContact CD1-CG1 4.15Å; I582-I649 HydrophobicContact CD1-CG2 3.91Å; I582-E652 HydrophobicContact CD1-CB 3.79Å; I582-E652 HydrophobicContact CD1-CG 4.47Å; I582-M656 HydrophobicContact CG1-CE 3.83Å
583	S	77.1	Confident	76.1	Confident	50 Å²	50	49.8 Å²	49.8	35%	0.35	25%	0.251	S	S	.	.	H	α-helix	trans	-69.9	-33.6	-177.3	-61.2	0	0	0	0	113.6	Y579 L580	Y579-S583 PolarHBondContact O-N 3.24Å; Y579-S583 PolarHBondContact O-OG 2.83Å; L580-S583 PolarHBondContact O-N 3.35Å
584	L	76.9	Confident	75.7	Confident	55 Å²	55	51.6 Å²	51.6	29%	0.288	26%	0.264	S	S	.	.	S	Bend	trans	-99.9	1.2	-177.3	-60.7	174.7	0	0	0	113.6	L580 R586 S587 L588 F600	L580-L584 HydrophobicContact CB-CD1 4.47Å; L580-L584 HydrophobicContact CD2-CD1 4.05Å; L580-L584 WeakPolarHBondContact O-CB 3.39Å; L580-L584 WeakPolarHBondContact O-CG 2.92Å; L580-L584 PolarHBondContact O-N 3.03Å; L584-R586 VanDerWaalsContact C-N 3.32Å; L584-R586 PolarHBondContact O-N 3.27Å; L584-S587 PolarHBondContact O-N 2.98Å; L584-S587 VanDerWaalsContact O-N 3.11Å; L584-L588 HydrophobicContact CB-CD1 3.86Å; L584-L588 HydrophobicContact CB-CG 4.21Å; L584-L588 HydrophobicContact CD1-CD1 4.19Å; L584-L588 WeakPolarHBondContact O-CB 3.31Å; L584-L588 PolarHBondContact O-N 3.28Å; L584-F600 HydrophobicContact CD1-CE2 4.37Å; L584-F600 HydrophobicContact CD1-CZ 4.3Å
585	D	71.7	Confident	75.4	Confident	20 Å²	20	55.3 Å²	55.3	11%	0.107	29%	0.289	C	S	.	.	H	α-helix	trans	-48.3	-52.6	-178.2	-161.1	31.6	0	0	0	112.2	S581 K589 L590 R668	S581-D585 VanDerWaalsContact O-CB 3.3Å; S581-D585 WeakPolarHBondContact O-CB 3.4Å; S581-D585 PolarHBondContact O-N 2.88Å; D585-K589 WeakPolarHBondContact O-CA 3.42Å; D585-K589 PolarHBondContact O-N 3.47Å; D585-L590 PolarHBondContact O-N 3.46Å; D585-R668 IonicContact OD1-NH1 2.89Å; D585-R668 PolarHBondContact OD1-NH1 2.88Å; D585-R668 IonicContact OD2-CZ 3.17Å; D585-R668 IonicContact OD2-NE 2.82Å; D585-R668 IonicContact OD2-NH1 3.69Å; D585-R668 PolarHBondContact OD2-NH1 3.11Å
586	R	67.2	Low	75.2	Confident	150 Å²	150	56.4 Å²	56.4	57%	0.566	30%	0.297	S	S	*	.	H	α-helix	trans	-69.2	-40.4	179.9	-68.9	-173.4	178.2	-179.2	-0.4	112.8	L584	L584-R586 VanDerWaalsContact C-N 3.32Å; L584-R586 PolarHBondContact O-N 3.27Å
587	S	70.6	Confident	74.9	Confident	96 Å²	96	55.3 Å²	55.3	67%	0.671	29%	0.292	S	S	*	.	H	α-helix	trans	-68.7	-37.1	-176.8	-57	0	0	0	0	111.9	L584	L584-S587 PolarHBondContact O-N 2.98Å; L584-S587 VanDerWaalsContact O-N 3.11Å
588	L	68.7	Low	74.8	Confident	90 Å²	90	58.4 Å²	58.4	47%	0.471	31%	0.305	S	S	.	.	H	α-helix	trans	-98.9	-4	-176.7	-65.7	177.2	0	0	0	113.6	L584 L590 F600	L584-L588 HydrophobicContact CB-CD1 3.86Å; L584-L588 HydrophobicContact CB-CG 4.21Å; L584-L588 HydrophobicContact CD1-CD1 4.19Å; L584-L588 WeakPolarHBondContact O-CB 3.31Å; L584-L588 PolarHBondContact O-N 3.28Å; L588-L590 VanDerWaalsContact C-N 3.26Å; L588-L590 HydrophobicContact CB-CD1 4.48Å; L588-L590 HydrophobicContact CB-CD2 4.23Å; L588-L590 HydrophobicContact CB-CG 3.93Å; L588-L590 PolarHBondContact O-N 2.76Å; L588-F600 HydrophobicContact CD1-CD2 3.62Å; L588-F600 HydrophobicContact CD1-CE2 3.35Å; L588-F600 HydrophobicContact CD1-CZ 4.25Å
589	K	71.3	Confident	74.8	Confident	117 Å²	117	60.2 Å²	60.2	51%	0.509	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	48.3	-176.8	-56.9	-174.7	-177.5	-179.1	0	111.5	D585 D591 K592	D585-K589 WeakPolarHBondContact O-CA 3.42Å; D585-K589 PolarHBondContact O-N 3.47Å; K589-D591 VanDerWaalsContact CA-OD1 3.3Å; K589-D591 WeakPolarHBondContact CA-OD1 2.94Å; K589-D591 PolarHBondContact O-N 2.74Å; K589-K592 HydrophobicContact CB-CD 4.07Å; K589-K592 HydrophobicContact CB-CG 4.18Å; K589-K592 HydrophobicContact CD-CD 4.38Å; K589-K592 PolarHBondContact O-N 2.75Å
590	L	64.4	Low	74.8	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-65.4	-18.8	-177.7	-68.3	170.3	0	0	0	112.1	D585 L588 K592 F597 F600	D585-L590 PolarHBondContact O-N 3.46Å; L588-L590 VanDerWaalsContact C-N 3.26Å; L588-L590 HydrophobicContact CB-CD1 4.48Å; L588-L590 HydrophobicContact CB-CD2 4.23Å; L588-L590 HydrophobicContact CB-CG 3.93Å; L588-L590 PolarHBondContact O-N 2.76Å; L590-K592 VanDerWaalsContact C-N 3.3Å; L590-K592 PolarHBondContact O-N 3.41Å; L590-F597 HydrophobicContact CB-CD2 4.48Å; L590-F600 HydrophobicContact CD1-CD1 4.02Å; L590-F600 HydrophobicContact CD1-CE1 4.19Å; L590-F600 HydrophobicContact CD1-CG 4.25Å; L590-F600 HydrophobicContact CD2-CB 3.58Å; L590-F600 HydrophobicContact CD2-CD1 4.23Å; L590-F600 HydrophobicContact CD2-CD2 4.26Å; L590-F600 HydrophobicContact CD2-CG 3.77Å
591	D	67.7	Low	74.9	Confident	70 Å²	70	57.2 Å²	57.2	37%	0.374	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-64.6	-24.8	175	61.1	-19	0	0	0	114.4	K589 S593	K589-D591 VanDerWaalsContact CA-OD1 3.3Å; K589-D591 WeakPolarHBondContact CA-OD1 2.94Å; K589-D591 PolarHBondContact O-N 2.74Å; D591-S593 PolarHBondContact O-N 3.31Å
592	K	69.1	Low	75.1	Confident	155 Å²	155	63 Å²	63	67%	0.674	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-66.4	-37	-174	-76.2	-172.9	167.9	-170.4	0	114.9	K589 L590	K589-K592 HydrophobicContact CB-CD 4.07Å; K589-K592 HydrophobicContact CB-CG 4.18Å; K589-K592 HydrophobicContact CD-CD 4.38Å; K589-K592 PolarHBondContact O-N 2.75Å; L590-K592 VanDerWaalsContact C-N 3.3Å; L590-K592 PolarHBondContact O-N 3.41Å
593	S	70.6	Confident	75.7	Confident	49 Å²	49	67.4 Å²	67.4	34%	0.343	36%	0.36	S	S	.	.			trans	-151.2	142.4	-177.3	75.7	0	0	0	0	112.3	D591 V595 S596 F597	D591-S593 PolarHBondContact O-N 3.31Å; S593-V595 PolarHBondContact O-N 2.87Å; S593-S596 PolarHBondContact N-OG 3.39Å; S593-S596 PolarHBondContact O-N 2.93Å; S593-S596 PolarHBondContact O-OG 3.13Å; S593-S596 VanDerWaalsContact OG-CB 3.27Å; S593-S596 WeakPolarHBondContact OG-CB 3.36Å; S593-S596 PolarHBondContact OG-N 3.21Å; S593-S596 PolarHBondContact OG-OG 2.71Å; S593-F597 PolarHBondContact O-N 3.43Å
594	S	74.9	Confident	76	Confident	42 Å²	42	67 Å²	67	29%	0.294	35%	0.353	S	S	.	.	H	α-helix	trans	-59.5	-36.5	172.2	54.4	0	0	0	0	111.4	S596 F597 F598	S594-S596 PolarHBondContact O-N 3.28Å; S594-F597 PolarHBondContact O-N 2.83Å; S594-F598 WeakPolarHBondContact O-CD2 3.46Å; S594-F598 PolarHBondContact O-N 3.45Å
595	V	77.9	Confident	76.4	Confident	106 Å²	106	66 Å²	66	64%	0.642	35%	0.351	S	S	*	.	H	α-helix	trans	-62	-42.3	177.5	-177	0	0	0	0	111.5	S593 F597 F598 A599	S593-V595 PolarHBondContact O-N 2.87Å; V595-F597 VanDerWaalsContact C-N 3.35Å; V595-F597 PolarHBondContact O-N 2.75Å; V595-F598 PolarHBondContact O-N 3.42Å; V595-A599 WeakPolarHBondContact O-CB 3.33Å; V595-A599 PolarHBondContact O-N 2.87Å
596	S	79.1	Confident	76.9	Confident	37 Å²	37	67.2 Å²	67.2	26%	0.259	37%	0.369	S	S	.	.	H	α-helix	trans	-64.4	-39.3	176.2	50.2	0	0	0	0	112.2	S593 S594 F600	S593-S596 PolarHBondContact N-OG 3.39Å; S593-S596 PolarHBondContact O-N 2.93Å; S593-S596 PolarHBondContact O-OG 3.13Å; S593-S596 VanDerWaalsContact OG-CB 3.27Å; S593-S596 WeakPolarHBondContact OG-CB 3.36Å; S593-S596 PolarHBondContact OG-N 3.21Å; S593-S596 PolarHBondContact OG-OG 2.71Å; S594-S596 PolarHBondContact O-N 3.28Å; S596-F600 VanDerWaalsContact O-CB 3.3Å; S596-F600 WeakPolarHBondContact O-CB 3.39Å; S596-F600 PolarHBondContact O-N 2.85Å
597	F	78.7	Confident	77.7	Confident	1 Å²	1	64.8 Å²	64.8	0%	0.004	37%	0.366	C	S	.	.	H	α-helix	trans	-64.5	-48.1	175.9	-179.7	-101.5	0	0	0	111.9	L590 S593 S594 V595 A599 F600 C601 Y653 M656 L657 L664	L590-F597 HydrophobicContact CB-CD2 4.48Å; S593-F597 PolarHBondContact O-N 3.43Å; S594-F597 PolarHBondContact O-N 2.83Å; V595-F597 VanDerWaalsContact C-N 3.35Å; V595-F597 PolarHBondContact O-N 2.75Å; F597-A599 PolarHBondContact O-N 3.44Å; F597-F600 WeakPolarHBondContact O-CB 3.32Å; F597-F600 PolarHBondContact O-N 3.04Å; F597-C601 PolarHBondContact O-N 2.95Å; F597-C601 PolarHBondContact O-SG 3.17Å; F597-C601 VanDerWaalsContact O-SG 3.39Å; F597-Y653 HydrophobicContact CZ-CD2 4.27Å; F597-Y653 AromaticContact CZ-CE2 3.94Å; F597-Y653 HydrophobicContact CZ-CE2 3.94Å; F597-M656 HydrophobicContact CE1-CB 4.3Å; F597-M656 HydrophobicContact CE2-CB 4.44Å; F597-M656 HydrophobicContact CE2-SD 3.88Å; F597-M656 HydrophobicContact CZ-CB 3.82Å; F597-M656 HydrophobicContact CZ-SD 4.12Å; F597-L657 HydrophobicContact CE1-CD2 4.07Å; F597-L664 HydrophobicContact CB-CD2 4.43Å
598	F	80.9	Confident	78.3	Confident	71 Å²	71	61.7 Å²	61.7	31%	0.311	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-41.6	177.1	-75.5	-63.1	0	0	0	112.4	S594 V595 F600 C601 I602 F660	S594-F598 WeakPolarHBondContact O-CD2 3.46Å; S594-F598 PolarHBondContact O-N 3.45Å; V595-F598 PolarHBondContact O-N 3.42Å; F598-F600 VanDerWaalsContact C-N 3.32Å; F598-F600 PolarHBondContact O-N 2.71Å; F598-C601 PolarHBondContact O-N 3.1Å; F598-I602 WeakPolarHBondContact O-CB 3.28Å; F598-I602 VanDerWaalsContact O-CG1 3.27Å; F598-I602 WeakPolarHBondContact O-CG1 3.38Å; F598-I602 PolarHBondContact O-N 3.46Å; F598-F660 HydrophobicContact CE2-CG 4.47Å; F598-F660 HydrophobicContact CZ-CD1 4.39Å
599	A	83.1	Confident	78.8	Confident	40 Å²	40	59.7 Å²	59.7	33%	0.331	33%	0.332	S	S	.	.	H	α-helix	trans	-60	-44	175.1	0	0	0	0	0	111	V595 F597 I602 I603	V595-A599 WeakPolarHBondContact O-CB 3.33Å; V595-A599 PolarHBondContact O-N 2.87Å; F597-A599 PolarHBondContact O-N 3.44Å; A599-I602 PolarHBondContact O-N 2.9Å; A599-I603 WeakPolarHBondContact O-CB 3.5Å; A599-I603 WeakPolarHBondContact O-CD1 3.41Å; A599-I603 WeakPolarHBondContact O-CG1 3.29Å; A599-I603 PolarHBondContact O-N 2.85Å
600	F	84	Confident	79	Confident	22 Å²	22	55.6 Å²	55.6	10%	0.096	32%	0.322	C	S	.	.	H	α-helix	trans	-59.3	-49.7	174.2	174.2	-98	0	0	0	111.9	L580 L584 L588 L590 S596 F597 F598 I602 I603 M604	L580-F600 HydrophobicContact CB-CZ 4.23Å; L584-F600 HydrophobicContact CD1-CE2 4.37Å; L584-F600 HydrophobicContact CD1-CZ 4.3Å; L588-F600 HydrophobicContact CD1-CD2 3.62Å; L588-F600 HydrophobicContact CD1-CE2 3.35Å; L588-F600 HydrophobicContact CD1-CZ 4.25Å; L590-F600 HydrophobicContact CD1-CD1 4.02Å; L590-F600 HydrophobicContact CD1-CE1 4.19Å; L590-F600 HydrophobicContact CD1-CG 4.25Å; L590-F600 HydrophobicContact CD2-CB 3.58Å; L590-F600 HydrophobicContact CD2-CD1 4.23Å; L590-F600 HydrophobicContact CD2-CD2 4.26Å; L590-F600 HydrophobicContact CD2-CG 3.77Å; S596-F600 VanDerWaalsContact O-CB 3.3Å; S596-F600 WeakPolarHBondContact O-CB 3.39Å; S596-F600 PolarHBondContact O-N 2.85Å; F597-F600 WeakPolarHBondContact O-CB 3.32Å; F597-F600 PolarHBondContact O-N 3.04Å; F598-F600 VanDerWaalsContact C-N 3.32Å; F598-F600 PolarHBondContact O-N 2.71Å; F600-I602 VanDerWaalsContact C-N 3.32Å; F600-I602 PolarHBondContact O-N 3.47Å; F600-I603 PolarHBondContact O-N 3.42Å; F600-M604 HydrophobicContact CD1-CG 4.38Å; F600-M604 HydrophobicContact CD2-CG 3.74Å; F600-M604 HydrophobicContact CE1-CG 4.12Å; F600-M604 HydrophobicContact CE2-CE 4.21Å; F600-M604 HydrophobicContact CE2-CG 3.45Å; F600-M604 VanDerWaalsContact CE2-CG 3.45Å; F600-M604 HydrophobicContact CE2-SD 4.06Å; F600-M604 HydrophobicContact CG-CG 4.21Å; F600-M604 HydrophobicContact CZ-CE 4.3Å; F600-M604 HydrophobicContact CZ-CG 3.67Å; F600-M604 VanDerWaalsContact O-CB 3.29Å; F600-M604 WeakPolarHBondContact O-CB 3.44Å; F600-M604 VanDerWaalsContact O-CG 3.24Å; F600-M604 WeakPolarHBondContact O-CG 3.29Å; F600-M604 PolarHBondContact O-N 3.47Å
601	C	83.8	Confident	79.6	Confident	14 Å²	14	60.9 Å²	60.9	10%	0.095	35%	0.35	C	S	.	.	H	α-helix	trans	-57.9	-43.6	177.4	-71.3	0	0	0	0	112.1	F597 F598 S605	F597-C601 PolarHBondContact O-N 2.95Å; F597-C601 PolarHBondContact O-SG 3.17Å; F597-C601 VanDerWaalsContact O-SG 3.39Å; F598-C601 PolarHBondContact O-N 3.1Å; C601-S605 WeakPolarHBondContact O-CB 3.17Å; C601-S605 PolarHBondContact O-N 2.6Å
602	I	84.8	Confident	79.7	Confident	122 Å²	122	58.8 Å²	58.8	63%	0.626	34%	0.338	S	S	*	.	H	α-helix	trans	-68	-47.8	179.9	-67.9	166.9	0	0	0	111.1	F598 A599 F600 S605 G606	F598-I602 WeakPolarHBondContact O-CB 3.28Å; F598-I602 VanDerWaalsContact O-CG1 3.27Å; F598-I602 WeakPolarHBondContact O-CG1 3.38Å; F598-I602 PolarHBondContact O-N 3.46Å; A599-I602 PolarHBondContact O-N 2.9Å; F600-I602 VanDerWaalsContact C-N 3.32Å; F600-I602 PolarHBondContact O-N 3.47Å; I602-S605 PolarHBondContact O-N 3.14Å; I602-G606 PolarHBondContact O-N 2.79Å
603	I	86.4	Confident	79.7	Confident	105 Å²	105	53.6 Å²	53.6	54%	0.538	32%	0.322	S	S	.	.	H	α-helix	trans	-63.6	-48.6	-179.1	-68.5	165.7	0	0	0	110	A599 F600 S605 G606 L607	A599-I603 WeakPolarHBondContact O-CB 3.5Å; A599-I603 WeakPolarHBondContact O-CD1 3.41Å; A599-I603 WeakPolarHBondContact O-CG1 3.29Å; A599-I603 PolarHBondContact O-N 2.85Å; F600-I603 PolarHBondContact O-N 3.42Å; I603-S605 VanDerWaalsContact C-N 3.34Å; I603-S605 PolarHBondContact O-N 2.78Å; I603-G606 PolarHBondContact O-N 3.4Å; I603-L607 HydrophobicContact CG2-CD1 3.96Å; I603-L607 HydrophobicContact CG2-CG 4.4Å; I603-L607 WeakPolarHBondContact O-CB 3.41Å; I603-L607 WeakPolarHBondContact O-CG 3.35Å; I603-L607 PolarHBondContact O-N 3.38Å
604	M	84.9	Confident	79.6	Confident	41 Å²	41	56.1 Å²	56.1	20%	0.202	34%	0.335	C	S	.	.	H	α-helix	trans	-67	-36.7	179.5	-64.4	-58.9	-86.8	0	0	111.8	I577 L580 F600 L607 L608	I577-M604 HydrophobicContact CG1-CB 4.32Å; L580-M604 HydrophobicContact CD1-CE 3.72Å; F600-M604 HydrophobicContact CD1-CG 4.38Å; F600-M604 HydrophobicContact CD2-CG 3.74Å; F600-M604 HydrophobicContact CE1-CG 4.12Å; F600-M604 HydrophobicContact CE2-CE 4.21Å; F600-M604 HydrophobicContact CE2-CG 3.45Å; F600-M604 VanDerWaalsContact CE2-CG 3.45Å; F600-M604 HydrophobicContact CE2-SD 4.06Å; F600-M604 HydrophobicContact CG-CG 4.21Å; F600-M604 HydrophobicContact CZ-CE 4.3Å; F600-M604 HydrophobicContact CZ-CG 3.67Å; F600-M604 VanDerWaalsContact O-CB 3.29Å; F600-M604 WeakPolarHBondContact O-CB 3.44Å; F600-M604 VanDerWaalsContact O-CG 3.24Å; F600-M604 WeakPolarHBondContact O-CG 3.29Å; F600-M604 PolarHBondContact O-N 3.47Å; M604-L607 PolarHBondContact O-N 2.82Å; M604-L607 HydrophobicContact SD-CD1 4.15Å; M604-L608 VanDerWaalsContact O-CB 3.29Å; M604-L608 WeakPolarHBondContact O-CB 3.49Å; M604-L608 VanDerWaalsContact O-CG 3.26Å; M604-L608 WeakPolarHBondContact O-CG 3.29Å; M604-L608 PolarHBondContact O-N 3.24Å
605	S	83.7	Confident	79.2	Confident	34 Å²	34	60.4 Å²	60.4	24%	0.238	35%	0.349	C	S	.	.	H	α-helix	trans	-61.1	-47.1	171.6	-173	0	0	0	0	111.2	C601 I602 I603 L607 L608 L609	C601-S605 WeakPolarHBondContact O-CB 3.17Å; C601-S605 PolarHBondContact O-N 2.6Å; I602-S605 PolarHBondContact O-N 3.14Å; I603-S605 VanDerWaalsContact C-N 3.34Å; I603-S605 PolarHBondContact O-N 2.78Å; S605-L607 PolarHBondContact O-N 3.18Å; S605-L608 PolarHBondContact O-N 3.37Å; S605-L609 WeakPolarHBondContact O-CB 3.28Å; S605-L609 WeakPolarHBondContact O-CD1 3.45Å; S605-L609 WeakPolarHBondContact O-CG 3.35Å; S605-L609 PolarHBondContact O-N 2.84Å; S605-L609 WeakPolarHBondContact OG-CD1 3.02Å
606	G	83.1	Confident	78.7	Confident	46 Å²	46	60.4 Å²	60.4	47%	0.474	34%	0.34	S	S	.	.	H	α-helix	trans	-61	-42.6	176.7	0	0	0	0	0	113.1	I602 I603 G610	I602-G606 PolarHBondContact O-N 2.79Å; I603-G606 PolarHBondContact O-N 3.4Å; G606-G610 WeakPolarHBondContact O-CA 3.3Å; G606-G610 PolarHBondContact O-N 3.36Å
607	L	84.4	Confident	78.1	Confident	98 Å²	98	61.5 Å²	61.5	51%	0.513	34%	0.343	S	S	.	.	H	α-helix	trans	-66.4	-49	177.2	-72.3	173.3	0	0	0	111.9	I603 M604 S605 G610 L611	I603-L607 HydrophobicContact CG2-CD1 3.96Å; I603-L607 HydrophobicContact CG2-CG 4.4Å; I603-L607 WeakPolarHBondContact O-CB 3.41Å; I603-L607 WeakPolarHBondContact O-CG 3.35Å; I603-L607 PolarHBondContact O-N 3.38Å; M604-L607 PolarHBondContact O-N 2.82Å; M604-L607 HydrophobicContact SD-CD1 4.15Å; S605-L607 PolarHBondContact O-N 3.18Å; L607-G610 PolarHBondContact O-N 3.26Å; L607-L611 WeakPolarHBondContact O-CB 3.48Å; L607-L611 VanDerWaalsContact O-CG 3.29Å; L607-L611 WeakPolarHBondContact O-CG 3.41Å; L607-L611 PolarHBondContact O-N 3.18Å
608	L	82.4	Confident	77.7	Confident	31 Å²	31	66.2 Å²	66.2	16%	0.162	36%	0.363	C	S	.	.	H	α-helix	trans	-65.7	-45	179.7	-71.5	168.8	0	0	0	111	V573 L576 I577 M604 S605 G610 L611 L612	V573-L608 HydrophobicContact CG1-CB 4.29Å; V573-L608 HydrophobicContact CG1-CD1 4.29Å; V573-L608 HydrophobicContact CG2-CB 4.01Å; L576-L608 HydrophobicContact CB-CD1 4.1Å; L576-L608 HydrophobicContact CD1-CD2 4.3Å; I577-L608 HydrophobicContact CG1-CD1 4Å; M604-L608 VanDerWaalsContact O-CB 3.29Å; M604-L608 WeakPolarHBondContact O-CB 3.49Å; M604-L608 VanDerWaalsContact O-CG 3.26Å; M604-L608 WeakPolarHBondContact O-CG 3.29Å; M604-L608 PolarHBondContact O-N 3.24Å; S605-L608 PolarHBondContact O-N 3.37Å; L608-G610 VanDerWaalsContact C-N 3.32Å; L608-G610 PolarHBondContact O-N 2.66Å; L608-L611 PolarHBondContact O-N 3.02Å; L608-L612 WeakPolarHBondContact O-CB 3.08Å; L608-L612 WeakPolarHBondContact O-CD1 3.06Å; L608-L612 WeakPolarHBondContact O-CG 3.43Å; L608-L612 PolarHBondContact O-N 3.09Å
609	L	80.1	Confident	77.3	Confident	49 Å²	49	62.8 Å²	62.8	26%	0.257	35%	0.349	S	S	.	.	H	α-helix	trans	-62.7	-41	174.4	-73.5	167.2	0	0	0	111.3	V569 L570 V573 S605 L612 S613	V569-L609 HydrophobicContact CG1-CD2 4.03Å; L570-L609 HydrophobicContact CD2-CD2 4.19Å; V573-L609 HydrophobicContact CG2-CD2 4.15Å; V573-L609 HydrophobicContact CG2-CG 4.28Å; S605-L609 WeakPolarHBondContact O-CB 3.28Å; S605-L609 WeakPolarHBondContact O-CD1 3.45Å; S605-L609 WeakPolarHBondContact O-CG 3.35Å; S605-L609 PolarHBondContact O-N 2.84Å; S605-L609 WeakPolarHBondContact OG-CD1 3.02Å; L609-L612 PolarHBondContact O-N 2.92Å; L609-S613 WeakPolarHBondContact O-CB 3.25Å; L609-S613 PolarHBondContact O-N 2.02Å; L609-S613 PolarHBondContact O-OG 2.92Å
610	G	75.7	Confident	76.8	Confident	30 Å²	30	61.1 Å²	61.1	31%	0.309	33%	0.334	S	S	.	.	H	α-helix	trans	-57.9	-57	175.4	0	0	0	0	0	111.4	G606 L607 L608 L612 S613 V614	G606-G610 WeakPolarHBondContact O-CA 3.3Å; G606-G610 PolarHBondContact O-N 3.36Å; L607-G610 PolarHBondContact O-N 3.26Å; L608-G610 VanDerWaalsContact C-N 3.32Å; L608-G610 PolarHBondContact O-N 2.66Å; G610-L612 VanDerWaalsContact C-N 3.34Å; G610-L612 PolarHBondContact O-N 2.76Å; G610-S613 PolarHBondContact O-N 2.67Å; G610-S613 VanDerWaalsContact O-N 3.12Å; G610-S613 PolarHBondContact O-OG 2.99Å; G610-V614 WeakPolarHBondContact O-CG2 3.39Å; G610-V614 PolarHBondContact O-N 3.23Å
611	L	75.5	Confident	76.3	Confident	116 Å²	116	60.1 Å²	60.1	61%	0.607	33%	0.33	S	S	*	.	H	α-helix	trans	-58.1	-44.2	178.4	-72.3	168	0	0	0	112.2	L607 L608 S613 V614	L607-L611 WeakPolarHBondContact O-CB 3.48Å; L607-L611 VanDerWaalsContact O-CG 3.29Å; L607-L611 WeakPolarHBondContact O-CG 3.41Å; L607-L611 PolarHBondContact O-N 3.18Å; L608-L611 PolarHBondContact O-N 3.02Å; L611-S613 VanDerWaalsContact C-N 3.33Å; L611-S613 PolarHBondContact O-N 3.17Å; L611-V614 PolarHBondContact O-N 3.26Å
612	L	71.1	Confident	76.2	Confident	25 Å²	25	60.6 Å²	60.6	13%	0.131	33%	0.331	C	S	.	.	H	α-helix	trans	-71.8	-27.7	179.5	-67.1	169.6	0	0	0	111.9	V569 V573 L608 L609 G610 F615 A619	V569-L612 HydrophobicContact CG1-CB 3.87Å; V569-L612 HydrophobicContact CG1-CD1 3.45Å; V569-L612 VanDerWaalsContact CG1-CD1 3.45Å; V569-L612 HydrophobicContact CG1-CG 4.25Å; V573-L612 HydrophobicContact CG2-CD1 3.93Å; L608-L612 WeakPolarHBondContact O-CB 3.08Å; L608-L612 WeakPolarHBondContact O-CD1 3.06Å; L608-L612 WeakPolarHBondContact O-CG 3.43Å; L608-L612 PolarHBondContact O-N 3.09Å; L609-L612 PolarHBondContact O-N 2.92Å; G610-L612 VanDerWaalsContact C-N 3.34Å; G610-L612 PolarHBondContact O-N 2.76Å; L612-F615 CarbonylContact O-C 3.07Å; L612-A619 HydrophobicContact CB-CB 3.66Å; L612-A619 HydrophobicContact CD2-CB 3.65Å; L612-A619 HydrophobicContact CG-CB 4.25Å; L612-A619 WeakPolarHBondContact O-CB 3.42Å
613	S	69.1	Low	76	Confident	47 Å²	47	54.8 Å²	54.8	33%	0.329	30%	0.301	S	S	.	.	H	α-helix	trans	-74.1	-26.8	176.4	76.5	0	0	0	0	113.6	L609 G610 L611 K616	L609-S613 WeakPolarHBondContact O-CB 3.25Å; L609-S613 PolarHBondContact O-N 2.02Å; L609-S613 PolarHBondContact O-OG 2.92Å; G610-S613 PolarHBondContact O-N 2.67Å; G610-S613 VanDerWaalsContact O-N 3.12Å; G610-S613 PolarHBondContact O-OG 2.99Å; L611-S613 VanDerWaalsContact C-N 3.33Å; L611-S613 PolarHBondContact O-N 3.17Å; S613-K616 VanDerWaalsContact O-CE 3.26Å; S613-K616 WeakPolarHBondContact O-CE 3.18Å; S613-K616 WeakPolarHBondContact O-CG 3.17Å
614	V	68.7	Low	75.6	Confident	102 Å²	102	49.9 Å²	49.9	62%	0.618	28%	0.276	S	S	*	.	H	α-helix	trans	-66.4	-48.7	176.2	173.6	0	0	0	0	109.6	G610 L611 K616	G610-V614 WeakPolarHBondContact O-CG2 3.39Å; G610-V614 PolarHBondContact O-N 3.23Å; L611-V614 PolarHBondContact O-N 3.26Å; V614-K616 PolarHBondContact O-N 3.46Å
615	F	66.9	Low	75.5	Confident	132 Å²	132	48 Å²	48	58%	0.579	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	66.9	-179.1	-58.6	-77	0	0	0	112.1	L612 N617 F618 A619	L612-F615 CarbonylContact O-C 3.07Å; F615-N617 PolarHBondContact O-N 2.82Å; F615-N617 VanDerWaalsContact O-N 3.15Å; F615-F618 HydrophobicContact CB-CB 3.52Å; F615-F618 HydrophobicContact CB-CD1 4.19Å; F615-F618 HydrophobicContact CB-CG 4.18Å; F615-F618 CarbonylContact O-C 3.6Å; F615-F618 WeakPolarHBondContact O-CA 3.29Å; F615-F618 VanDerWaalsContact O-CB 3.31Å; F615-F618 WeakPolarHBondContact O-CB 3.43Å; F615-F618 PolarHBondContact O-N 3.02Å; F615-A619 WeakPolarHBondContact O-CB 3.45Å; F615-A619 PolarHBondContact O-N 3.47Å
616	K	67.3	Low	75.5	Confident	106 Å²	106	47 Å²	47	46%	0.461	26%	0.259	S	S	.	.	H	α-helix	trans	-50.9	-43.8	-170.1	-60.9	-178.3	-179.5	175.6	0	115.5	S613 V614 F620	S613-K616 VanDerWaalsContact O-CE 3.26Å; S613-K616 WeakPolarHBondContact O-CE 3.18Å; S613-K616 WeakPolarHBondContact O-CG 3.17Å; V614-K616 PolarHBondContact O-N 3.46Å; K616-F620 PolarHBondContact O-N 3.11Å
617	N	66.6	Low	75.6	Confident	59 Å²	59	45.1 Å²	45.1	32%	0.316	24%	0.238	S	C	.	.	H	α-helix	trans	-73.6	-42.2	177.7	-73.6	-8.7	0	0	0	111.1	R565 F615 A619 F620 G621 L695	R565-N617 PolarHBondContact NH1-OD1 2.85Å; F615-N617 PolarHBondContact O-N 2.82Å; F615-N617 VanDerWaalsContact O-N 3.15Å; N617-A619 PolarHBondContact O-N 3.28Å; N617-F620 PolarHBondContact O-N 2.8Å; N617-G621 PolarHBondContact O-N 2.9Å; N617-G621 VanDerWaalsContact O-N 3.17Å; N617-L695 VanDerWaalsContact C-CD2 3.41Å; N617-L695 HydrophobicContact CB-CD2 4.34Å; N617-L695 VanDerWaalsContact O-CD2 3.26Å; N617-L695 WeakPolarHBondContact O-CD2 3.16Å
618	F	68.7	Low	75.5	Confident	100 Å²	100	40.5 Å²	40.5	44%	0.439	21%	0.214	S	C	.	.	H	α-helix	trans	-56.4	-48.9	176.2	-173.4	-101.1	0	0	0	112.1	F615 F620 G621 I622 L695	F615-F618 HydrophobicContact CB-CB 3.52Å; F615-F618 HydrophobicContact CB-CD1 4.19Å; F615-F618 HydrophobicContact CB-CG 4.18Å; F615-F618 CarbonylContact O-C 3.6Å; F615-F618 WeakPolarHBondContact O-CA 3.29Å; F615-F618 VanDerWaalsContact O-CB 3.31Å; F615-F618 WeakPolarHBondContact O-CB 3.43Å; F615-F618 PolarHBondContact O-N 3.02Å; F618-F620 VanDerWaalsContact C-N 3.33Å; F618-F620 PolarHBondContact O-N 2.85Å; F618-G621 PolarHBondContact O-N 3.41Å; F618-I622 HydrophobicContact CD1-CD1 3.54Å; F618-I622 HydrophobicContact CD2-CD1 3.9Å; F618-I622 HydrophobicContact CE1-CD1 3.09Å; F618-I622 HydrophobicContact CE2-CD1 3.42Å; F618-I622 VanDerWaalsContact CE2-CD1 3.42Å; F618-I622 HydrophobicContact CG-CD1 3.91Å; F618-I622 HydrophobicContact CZ-CD1 3Å; F618-I622 HydrophobicContact CZ-CG1 4.47Å; F618-I622 PolarHBondContact O-N 3.28Å; F618-L695 HydrophobicContact CB-CD1 4.16Å; F618-L695 HydrophobicContact CB-CD2 4.25Å; F618-L695 HydrophobicContact CD2-CD1 3.13Å; F618-L695 HydrophobicContact CD2-CG 4.45Å; F618-L695 HydrophobicContact CE2-CD1 3.73Å; F618-L695 HydrophobicContact CG-CD1 3.93Å
619	A	72.9	Confident	75.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-40.4	178.6	0	0	0	0	0	112.4	V569 L612 F615 N617 S623	V569-A619 HydrophobicContact CG2-CB 4.11Å; L612-A619 HydrophobicContact CB-CB 3.66Å; L612-A619 HydrophobicContact CD2-CB 3.65Å; L612-A619 HydrophobicContact CG-CB 4.25Å; L612-A619 WeakPolarHBondContact O-CB 3.42Å; F615-A619 WeakPolarHBondContact O-CB 3.45Å; F615-A619 PolarHBondContact O-N 3.47Å; N617-A619 PolarHBondContact O-N 3.28Å; A619-S623 WeakPolarHBondContact O-CB 3.34Å; A619-S623 PolarHBondContact O-N 3.45Å; A619-S623 PolarHBondContact O-OG 2.76Å
620	F	73	Confident	76	Confident	5 Å²	5	38.2 Å²	38.2	2%	0.022	20%	0.201	C	C	.	.	H	α-helix	trans	-63.3	-47.1	175.9	177.5	-94.8	0	0	0	112.1	I360 R565 P568 K616 N617 F618 S623 T624 I698	I360-F620 HydrophobicContact CB-CZ 4.32Å; I360-F620 HydrophobicContact CG1-CE1 4.2Å; I360-F620 HydrophobicContact CG1-CZ 3.98Å; I360-F620 HydrophobicContact CG2-CE2 4.25Å; I360-F620 HydrophobicContact CG2-CZ 3.96Å; R565-F620 HydrophobicContact CB-CD2 4.27Å; R565-F620 WeakPolarHBondContact O-CD2 3.48Å; P568-F620 HydrophobicContact CB-CD2 4.49Å; P568-F620 HydrophobicContact CG-CD2 3.94Å; P568-F620 HydrophobicContact CG-CE2 3.74Å; K616-F620 PolarHBondContact O-N 3.11Å; N617-F620 PolarHBondContact O-N 2.8Å; F618-F620 VanDerWaalsContact C-N 3.33Å; F618-F620 PolarHBondContact O-N 2.85Å; F620-S623 WeakPolarHBondContact CA-OG 3.28Å; F620-S623 PolarHBondContact O-OG 2.94Å; F620-T624 HydrophobicContact CD2-CG2 4.48Å; F620-T624 HydrophobicContact CE2-CG2 4.22Å; F620-T624 HydrophobicContact CZ-CG2 4.22Å; F620-T624 WeakPolarHBondContact O-CG2 3.47Å; F620-T624 PolarHBondContact O-N 3Å; F620-T624 PolarHBondContact O-OG1 3.2Å; F620-I698 HydrophobicContact CD1-CD1 4Å; F620-I698 HydrophobicContact CE1-CD1 4.38Å
621	G	73.9	Confident	76.4	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-60.4	-49.3	178.2	0	0	0	0	0	112.4	N617 F618 T624 A625	N617-G621 PolarHBondContact O-N 2.9Å; N617-G621 VanDerWaalsContact O-N 3.17Å; F618-G621 PolarHBondContact O-N 3.41Å; G621-T624 PolarHBondContact O-OG1 3.05Å; G621-A625 WeakPolarHBondContact O-CB 3.41Å; G621-A625 PolarHBondContact O-N 3.33Å; G621-A625 VanDerWaalsContact O-N 3.13Å
622	I	80.3	Confident	76.8	Confident	24 Å²	24	33.9 Å²	33.9	12%	0.123	17%	0.173	C	C	.	.	H	α-helix	trans	-72.1	-37	-178	-75.1	162.6	0	0	0	112.7	F618 A625 L626	F618-I622 HydrophobicContact CD1-CD1 3.54Å; F618-I622 HydrophobicContact CD2-CD1 3.9Å; F618-I622 HydrophobicContact CE1-CD1 3.09Å; F618-I622 HydrophobicContact CE2-CD1 3.42Å; F618-I622 VanDerWaalsContact CE2-CD1 3.42Å; F618-I622 HydrophobicContact CG-CD1 3.91Å; F618-I622 HydrophobicContact CZ-CD1 3Å; F618-I622 HydrophobicContact CZ-CG1 4.47Å; F618-I622 PolarHBondContact O-N 3.28Å; I622-A625 PolarHBondContact O-N 2.98Å; I622-L626 HydrophobicContact CG2-CD1 3.55Å; I622-L626 HydrophobicContact CG2-CG 4.1Å; I622-L626 VanDerWaalsContact O-CB 3.31Å; I622-L626 WeakPolarHBondContact O-CB 3.47Å; I622-L626 WeakPolarHBondContact O-CG 3.43Å; I622-L626 PolarHBondContact O-N 3.42Å
623	S	82.1	Confident	77.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-62.5	-46.5	178.2	53.7	0	0	0	0	112.2	P568 T572 A619 F620 L626 V627	P568-S623 WeakPolarHBondContact O-CB 3.5Å; T572-S623 VanDerWaalsContact OG1-C 3.3Å; T572-S623 WeakPolarHBondContact OG1-CA 3.41Å; T572-S623 WeakPolarHBondContact OG1-CB 3.26Å; T572-S623 PolarHBondContact OG1-O 3Å; A619-S623 WeakPolarHBondContact O-CB 3.34Å; A619-S623 PolarHBondContact O-N 3.45Å; A619-S623 PolarHBondContact O-OG 2.76Å; F620-S623 WeakPolarHBondContact CA-OG 3.28Å; F620-S623 PolarHBondContact O-OG 2.94Å; S623-L626 PolarHBondContact O-N 2.99Å; S623-V627 WeakPolarHBondContact O-CG2 3.4Å; S623-V627 PolarHBondContact O-N 3.28Å
624	T	78	Confident	78.2	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-65.1	-40.7	177.6	56.5	0	0	0	0	111.8	Y352 R363 P568 F620 G621 G628	Y352-T624 HydrophobicContact CE1-CG2 4.39Å; R363-T624 PolarHBondContact NH1-OG1 2.93Å; P568-T624 HydrophobicContact CB-CG2 3.84Å; P568-T624 HydrophobicContact CG-CG2 4.29Å; F620-T624 HydrophobicContact CD2-CG2 4.48Å; F620-T624 HydrophobicContact CE2-CG2 4.22Å; F620-T624 HydrophobicContact CZ-CG2 4.22Å; F620-T624 WeakPolarHBondContact O-CG2 3.47Å; F620-T624 PolarHBondContact O-N 3Å; F620-T624 PolarHBondContact O-OG1 3.2Å; G621-T624 PolarHBondContact O-OG1 3.05Å; T624-G628 PolarHBondContact O-N 2.92Å
625	A	81.6	Confident	78.8	Confident	2 Å²	2	27.6 Å²	27.6	2%	0.017	13%	0.134	C	C	.	.	H	α-helix	trans	-62.9	-50	174	0	0	0	0	0	111.7	G621 I622 V627 G628 F629 F690	G621-A625 WeakPolarHBondContact O-CB 3.41Å; G621-A625 PolarHBondContact O-N 3.33Å; G621-A625 VanDerWaalsContact O-N 3.13Å; I622-A625 PolarHBondContact O-N 2.98Å; A625-V627 PolarHBondContact O-N 2.54Å; A625-G628 PolarHBondContact O-N 3.22Å; A625-F629 HydrophobicContact CB-CD2 4.31Å; A625-F629 WeakPolarHBondContact O-CB 3.49Å; A625-F629 VanDerWaalsContact O-CD2 3.26Å; A625-F629 WeakPolarHBondContact O-CD2 3.42Å; A625-F629 PolarHBondContact O-N 3.02Å; A625-F690 HydrophobicContact CB-CB 4.32Å
626	L	85	Confident	79.4	Confident	14 Å²	14	23.5 Å²	23.5	7%	0.073	12%	0.12	C	C	.	.	H	α-helix	trans	-57.3	-46.9	-179.6	-81.8	167.6	0	0	0	112.4	T572 L576 I622 S623 Y630 W683 S687	T572-L626 HydrophobicContact CG2-CB 3.77Å; T572-L626 HydrophobicContact CG2-CD1 3.36Å; T572-L626 HydrophobicContact CG2-CG 4.21Å; L576-L626 HydrophobicContact CD1-CD1 4.22Å; I622-L626 HydrophobicContact CG2-CD1 3.55Å; I622-L626 HydrophobicContact CG2-CG 4.1Å; I622-L626 VanDerWaalsContact O-CB 3.31Å; I622-L626 WeakPolarHBondContact O-CB 3.47Å; I622-L626 WeakPolarHBondContact O-CG 3.43Å; I622-L626 PolarHBondContact O-N 3.42Å; S623-L626 PolarHBondContact O-N 2.99Å; L626-Y630 WeakPolarHBondContact O-CB 3.38Å; L626-Y630 PolarHBondContact O-N 3.06Å; L626-W683 HydrophobicContact CD2-CZ2 4.16Å; L626-W683 PolarHBondContact O-NE1 3.01Å; L626-S687 WeakPolarHBondContact CA-OG 3.34Å
627	V	84.9	Confident	79.9	Confident	5 Å²	5	18.6 Å²	18.6	3%	0.03	10%	0.098	C	C	.	.	H	α-helix	trans	-70.2	-45.2	180	174.1	0	0	0	0	110.6	Y352 P571 T572 I575 S623 A625 Y630 V631	Y352-V627 HydrophobicContact CE1-CB 4.04Å; Y352-V627 HydrophobicContact CE1-CG1 3.99Å; P571-V627 HydrophobicContact CB-CG2 4.02Å; P571-V627 HydrophobicContact CG-CG2 4.09Å; T572-V627 VanDerWaalsContact OG1-CG2 3.26Å; T572-V627 WeakPolarHBondContact OG1-CG2 3.46Å; I575-V627 HydrophobicContact CD1-CB 4.48Å; I575-V627 HydrophobicContact CD1-CG1 4.48Å; I575-V627 HydrophobicContact CD1-CG2 4Å; S623-V627 WeakPolarHBondContact O-CG2 3.4Å; S623-V627 PolarHBondContact O-N 3.28Å; A625-V627 PolarHBondContact O-N 2.54Å; V627-Y630 PolarHBondContact O-N 2.89Å; V627-V631 WeakPolarHBondContact O-CG2 3.38Å; V627-V631 PolarHBondContact O-N 2.82Å
628	G	82.9	Confident	80.2	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.01	10%	0.098	C	C	.	.	H	α-helix	trans	-63.1	-48.5	-179.7	0	0	0	0	0	112.4	T624 A625 Y630 V631 T632	T624-G628 PolarHBondContact O-N 2.92Å; A625-G628 PolarHBondContact O-N 3.22Å; G628-Y630 VanDerWaalsContact C-N 3.33Å; G628-Y630 PolarHBondContact O-N 3.05Å; G628-V631 PolarHBondContact O-N 2.75Å; G628-T632 WeakPolarHBondContact O-CG2 3Å; G628-T632 PolarHBondContact O-N 3.44Å; G628-T632 PolarHBondContact O-OG1 3.2Å
629	F	84.8	Confident	80.2	Confident	16 Å²	16	18.2 Å²	18.2	7%	0.07	9%	0.094	C	C	.	.	H	α-helix	trans	-66.8	-32.9	176.4	-80.6	-71.3	0	0	0	113.1	A353 A625 T632 L633 F690	A353-F629 HydrophobicContact CB-CD2 4.17Å; A353-F629 HydrophobicContact CB-CE2 3.92Å; A353-F629 HydrophobicContact CB-CZ 4.37Å; A625-F629 HydrophobicContact CB-CD2 4.31Å; A625-F629 WeakPolarHBondContact O-CB 3.49Å; A625-F629 VanDerWaalsContact O-CD2 3.26Å; A625-F629 WeakPolarHBondContact O-CD2 3.42Å; A625-F629 PolarHBondContact O-N 3.02Å; F629-T632 VanDerWaalsContact CA-OG1 3.29Å; F629-T632 WeakPolarHBondContact CA-OG1 3.36Å; F629-T632 PolarHBondContact O-OG1 3.39Å; F629-L633 VanDerWaalsContact O-CB 3.23Å; F629-L633 WeakPolarHBondContact O-CB 3.19Å; F629-L633 VanDerWaalsContact O-CG 3.26Å; F629-L633 WeakPolarHBondContact O-CG 3.34Å; F629-L633 PolarHBondContact O-N 3.1Å; F629-F690 HydrophobicContact CD2-CB 4.41Å; F629-F690 HydrophobicContact CD2-CD2 4.49Å; F629-F690 HydrophobicContact CE1-CD2 4.1Å; F629-F690 HydrophobicContact CE1-CE2 4.08Å; F629-F690 HydrophobicContact CE2-CB 3.45Å; F629-F690 VanDerWaalsContact CE2-CB 3.45Å; F629-F690 HydrophobicContact CE2-CD1 4.18Å; F629-F690 AromaticContact CE2-CD2 3.38Å; F629-F690 HydrophobicContact CE2-CD2 3.38Å; F629-F690 HydrophobicContact CE2-CE2 4.12Å; F629-F690 AromaticContact CE2-CG 3.4Å; F629-F690 HydrophobicContact CE2-CG 3.4Å; F629-F690 HydrophobicContact CZ-CB 4.08Å; F629-F690 HydrophobicContact CZ-CD1 4.02Å; F629-F690 AromaticContact CZ-CD2 3.12Å; F629-F690 HydrophobicContact CZ-CD2 3.12Å; F629-F690 HydrophobicContact CZ-CE1 4.23Å; F629-F690 AromaticContact CZ-CE2 3.38Å; F629-F690 HydrophobicContact CZ-CE2 3.38Å; F629-F690 AromaticContact CZ-CG 3.47Å; F629-F690 HydrophobicContact CZ-CG 3.47Å; F629-F690 VanDerWaalsContact CZ-CG 3.47Å; F629-F690 AromaticContact CZ-CZ 3.93Å; F629-F690 HydrophobicContact CZ-CZ 3.93Å
630	Y	86.4	Confident	80.1	Confident	16 Å²	16	24.8 Å²	24.8	6%	0.063	13%	0.128	C	C	.	.	H	α-helix	trans	-60.6	-49.2	172.2	179.3	-97	0	0	0	110.7	I575 L626 V627 G628 L633 C634 L646 V650 W683	I575-Y630 HydrophobicContact CD1-CD1 3.86Å; I575-Y630 HydrophobicContact CD1-CE1 4.45Å; I575-Y630 HydrophobicContact CD1-CG 4.15Å; I575-Y630 HydrophobicContact CG2-CD2 3.97Å; I575-Y630 HydrophobicContact CG2-CE2 4.22Å; I575-Y630 HydrophobicContact CG2-CG 4.17Å; L626-Y630 WeakPolarHBondContact O-CB 3.38Å; L626-Y630 PolarHBondContact O-N 3.06Å; V627-Y630 PolarHBondContact O-N 2.89Å; G628-Y630 VanDerWaalsContact C-N 3.33Å; G628-Y630 PolarHBondContact O-N 3.05Å; Y630-L633 PolarHBondContact O-N 3.09Å; Y630-C634 WeakPolarHBondContact O-CB 3.47Å; Y630-C634 PolarHBondContact O-N 2.83Å; Y630-C634 PolarHBondContact O-SG 2.86Å; Y630-L646 HydrophobicContact CD2-CD1 3.83Å; Y630-L646 HydrophobicContact CD2-CD2 4.18Å; Y630-L646 HydrophobicContact CD2-CG 3.91Å; Y630-L646 HydrophobicContact CE2-CD1 3.64Å; Y630-L646 HydrophobicContact CE2-CD2 4.29Å; Y630-L646 HydrophobicContact CE2-CG 3.57Å; Y630-L646 PolarHBondContact OH-O 3.08Å; Y630-V650 HydrophobicContact CE1-CG2 3.7Å; Y630-V650 WeakPolarHBondContact OH-CG2 3.31Å; Y630-W683 HydrophobicContact CD2-CD2 4.42Å; Y630-W683 AromaticContact CD2-CE2 3.98Å; Y630-W683 HydrophobicContact CD2-CH2 4.34Å; Y630-W683 AromaticContact CD2-CZ2 3.94Å; Y630-W683 HydrophobicContact CD2-CZ2 3.94Å; Y630-W683 HydrophobicContact CG-CZ2 4.45Å
631	V	84.4	Confident	79.8	Confident	44 Å²	44	26.5 Å²	26.5	27%	0.267	14%	0.137	S	C	.	.	H	α-helix	trans	-63.9	-44.1	179.4	174.2	0	0	0	0	111.3	V627 G628 C634 C635	V627-V631 WeakPolarHBondContact O-CG2 3.38Å; V627-V631 PolarHBondContact O-N 2.82Å; G628-V631 PolarHBondContact O-N 2.75Å; V631-C634 PolarHBondContact O-N 2.73Å; V631-C635 PolarHBondContact O-N 2.94Å; V631-C635 PolarHBondContact O-SG 3.12Å
632	T	84.2	Confident	79.2	Confident	12 Å²	12	30.6 Å²	30.6	7%	0.074	16%	0.164	C	C	.	.	H	α-helix	trans	-63.8	-44.7	178.4	57.1	0	0	0	0	111.5	G349 F350 G628 F629 C635 T636	G349-T632 VanDerWaalsContact C-CG2 3.44Å; F350-T632 VanDerWaalsContact CA-CG2 3.47Å; F350-T632 HydrophobicContact CB-CG2 3.74Å; G628-T632 WeakPolarHBondContact O-CG2 3Å; G628-T632 PolarHBondContact O-N 3.44Å; G628-T632 PolarHBondContact O-OG1 3.2Å; F629-T632 VanDerWaalsContact CA-OG1 3.29Å; F629-T632 WeakPolarHBondContact CA-OG1 3.36Å; F629-T632 PolarHBondContact O-OG1 3.39Å; T632-C635 PolarHBondContact O-N 2.92Å; T632-T636 WeakPolarHBondContact O-CG2 3.38Å; T632-T636 PolarHBondContact O-N 2.82Å; T632-T636 PolarHBondContact O-OG1 2.83Å
633	L	84.9	Confident	78.4	Confident	24 Å²	24	30.1 Å²	30.1	13%	0.126	16%	0.163	C	C	.	.	H	α-helix	trans	-68.2	-34.7	179.3	-72.2	171.4	0	0	0	112.4	F629 Y630 T636 S637 L646 I682 W683	F629-L633 VanDerWaalsContact O-CB 3.23Å; F629-L633 WeakPolarHBondContact O-CB 3.19Å; F629-L633 VanDerWaalsContact O-CG 3.26Å; F629-L633 WeakPolarHBondContact O-CG 3.34Å; F629-L633 PolarHBondContact O-N 3.1Å; Y630-L633 PolarHBondContact O-N 3.09Å; L633-T636 VanDerWaalsContact CA-OG1 3.29Å; L633-T636 WeakPolarHBondContact CA-OG1 3.3Å; L633-T636 PolarHBondContact O-OG1 3.06Å; L633-S637 WeakPolarHBondContact O-CB 3.42Å; L633-S637 PolarHBondContact O-N 3.34Å; L633-S637 PolarHBondContact O-OG 2.86Å; L633-L646 HydrophobicContact CB-CD2 3.4Å; L633-L646 VanDerWaalsContact CB-CD2 3.4Å; L633-I682 HydrophobicContact CD1-CG2 4.31Å; L633-I682 HydrophobicContact CD2-CG2 4.28Å; L633-W683 VanDerWaalsContact CD1-CA 3.42Å; L633-W683 HydrophobicContact CD1-CB 3.45Å; L633-W683 VanDerWaalsContact CD1-CB 3.45Å; L633-W683 HydrophobicContact CD1-CG 4.16Å
634	C	83.8	Confident	77.9	Confident	11 Å²	11	30.3 Å²	30.3	7%	0.074	16%	0.164	C	C	.	.	H	α-helix	trans	-60.7	-47.6	170.6	-76.9	0	0	0	0	110.4	Y630 V631 S637 F638	Y630-C634 WeakPolarHBondContact O-CB 3.47Å; Y630-C634 PolarHBondContact O-N 2.83Å; Y630-C634 PolarHBondContact O-SG 2.86Å; V631-C634 PolarHBondContact O-N 2.73Å; C634-S637 PolarHBondContact O-N 2.83Å; C634-S637 PolarHBondContact O-OG 2.86Å; C634-F638 WeakPolarHBondContact O-CD2 3.31Å; C634-F638 WeakPolarHBondContact O-CG 3.37Å; C634-F638 PolarHBondContact O-N 2.87Å
635	C	82.3	Confident	77.6	Confident	7 Å²	7	31.1 Å²	31.1	5%	0.047	17%	0.168	C	C	.	.	H	α-helix	trans	-64.8	-45	178.3	-61.8	0	0	0	0	112.3	V342 L346 V631 T632 S637 F638 F639	V342-C635 HydrophobicContact CG1-CB 3.95Å; L346-C635 HydrophobicContact CB-CB 3.7Å; L346-C635 HydrophobicContact CD1-CB 3.95Å; L346-C635 HydrophobicContact CG-CB 4.19Å; V631-C635 PolarHBondContact O-N 2.94Å; V631-C635 PolarHBondContact O-SG 3.12Å; T632-C635 PolarHBondContact O-N 2.92Å; C635-S637 VanDerWaalsContact C-N 3.27Å; C635-S637 PolarHBondContact O-N 2.94Å; C635-F638 WeakPolarHBondContact O-CB 3.32Å; C635-F638 PolarHBondContact O-N 2.9Å; C635-F639 WeakPolarHBondContact O-CD2 3.39Å; C635-F639 PolarHBondContact O-N 2.64Å
636	T	80.2	Confident	77.3	Confident	46 Å²	46	31.1 Å²	31.1	28%	0.282	17%	0.168	S	C	.	.	H	α-helix	trans	-63.3	-37.6	176.4	58.2	0	0	0	0	111.1	L346 T632 L633 F638 F639 L640	L346-T636 HydrophobicContact CD1-CG2 3.63Å; T632-T636 WeakPolarHBondContact O-CG2 3.38Å; T632-T636 PolarHBondContact O-N 2.82Å; T632-T636 PolarHBondContact O-OG1 2.83Å; L633-T636 VanDerWaalsContact CA-OG1 3.29Å; L633-T636 WeakPolarHBondContact CA-OG1 3.3Å; L633-T636 PolarHBondContact O-OG1 3.06Å; T636-F638 VanDerWaalsContact C-N 3.33Å; T636-F638 PolarHBondContact O-N 2.88Å; T636-F639 PolarHBondContact O-N 2.92Å; T636-F639 VanDerWaalsContact O-N 3.15Å; T636-L640 WeakPolarHBondContact O-CB 3.48Å; T636-L640 PolarHBondContact O-N 3.13Å
637	S	76.3	Confident	76.7	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.014	17%	0.168	C	C	.	.	H	α-helix	trans	-63.5	-40	177	76.2	0	0	0	0	111.8	L633 C634 C635 F639 I641 C644	L633-S637 WeakPolarHBondContact O-CB 3.42Å; L633-S637 PolarHBondContact O-N 3.34Å; L633-S637 PolarHBondContact O-OG 2.86Å; C634-S637 PolarHBondContact O-N 2.83Å; C634-S637 PolarHBondContact O-OG 2.86Å; C635-S637 VanDerWaalsContact C-N 3.27Å; C635-S637 PolarHBondContact O-N 2.94Å; S637-F639 PolarHBondContact O-N 3.01Å; S637-I641 CarbonylContact O-C 3.59Å; S637-I641 VanDerWaalsContact O-C 3.26Å; S637-I641 PolarHBondContact O-N 2.9Å; S637-C644 VanDerWaalsContact CB-CB 3.48Å
638	F	73.1	Confident	76.1	Confident	70 Å²	70	31.2 Å²	31.2	31%	0.307	17%	0.169	S	C	.	.	H	α-helix	trans	-60.5	-30.1	174.3	-77	-51.2	0	0	0	113.7	T330 L331 V342 C634 C635 T636 P647	T330-F638 WeakPolarHBondContact OG1-CD1 3.42Å; T330-F638 WeakPolarHBondContact OG1-CE1 3.35Å; L331-F638 HydrophobicContact CD1-CB 3.53Å; L331-F638 HydrophobicContact CD1-CD1 3.5Å; L331-F638 HydrophobicContact CD1-CD2 4.5Å; L331-F638 HydrophobicContact CD1-CE1 4.33Å; L331-F638 HydrophobicContact CD1-CG 3.61Å; L331-F638 HydrophobicContact CG-CD1 4.46Å; V342-F638 HydrophobicContact CG1-CB 4.41Å; C634-F638 WeakPolarHBondContact O-CD2 3.31Å; C634-F638 WeakPolarHBondContact O-CG 3.37Å; C634-F638 PolarHBondContact O-N 2.87Å; C635-F638 WeakPolarHBondContact O-CB 3.32Å; C635-F638 PolarHBondContact O-N 2.9Å; T636-F638 VanDerWaalsContact C-N 3.33Å; T636-F638 PolarHBondContact O-N 2.88Å; F638-P647 HydrophobicContact CE1-CB 3.99Å; F638-P647 HydrophobicContact CE1-CG 3.93Å; F638-P647 HydrophobicContact CE2-CB 3.92Å; F638-P647 HydrophobicContact CE2-CG 4.41Å; F638-P647 HydrophobicContact CZ-CB 3.39Å; F638-P647 HydrophobicContact CZ-CG 3.83Å
639	F	70.3	Confident	75.8	Confident	81 Å²	81	31.3 Å²	31.3	36%	0.355	17%	0.169	S	C	.	.	H	α-helix	trans	-89.5	-41.5	178.3	-66.6	-64.9	0	0	0	113.9	L339 V342 A343 L346 C635 T636 S637	L339-F639 HydrophobicContact CB-CE1 4.12Å; L339-F639 HydrophobicContact CD2-CD1 3.73Å; L339-F639 HydrophobicContact CD2-CE1 3.41Å; L339-F639 VanDerWaalsContact CD2-CE1 3.41Å; L339-F639 HydrophobicContact CG-CE1 4.37Å; V342-F639 HydrophobicContact CB-CE2 4.19Å; V342-F639 HydrophobicContact CB-CZ 3.76Å; V342-F639 HydrophobicContact CG1-CD2 4.34Å; V342-F639 HydrophobicContact CG1-CE1 4.44Å; V342-F639 HydrophobicContact CG1-CE2 3.5Å; V342-F639 HydrophobicContact CG1-CZ 3.56Å; A343-F639 HydrophobicContact CB-CZ 4.14Å; L346-F639 HydrophobicContact CD1-CD2 4.35Å; L346-F639 HydrophobicContact CD1-CE2 4.3Å; C635-F639 WeakPolarHBondContact O-CD2 3.39Å; C635-F639 PolarHBondContact O-N 2.64Å; T636-F639 PolarHBondContact O-N 2.92Å; T636-F639 VanDerWaalsContact O-N 3.15Å; S637-F639 PolarHBondContact O-N 3.01Å
640	L	70	Confident	75.3	Confident	138 Å²	138	32.6 Å²	32.6	72%	0.723	18%	0.178	S	C	*	.	H	α-helix	trans	-106.1	-33.3	-165	-63.7	174.9	0	0	0	113.8	T636	T636-L640 WeakPolarHBondContact O-CB 3.48Å; T636-L640 PolarHBondContact O-N 3.13Å
641	I	66.2	Low	74.7	Confident	42 Å²	42	34.6 Å²	34.6	22%	0.215	19%	0.189	C	C	.	.	S	Bend	trans	-125.3	89.9	-171.8	-54.3	174.9	0	0	0	108	A213 S637 S643 C644 V679	A213-I641 HydrophobicContact CB-CG2 4.25Å; S637-I641 CarbonylContact O-C 3.59Å; S637-I641 VanDerWaalsContact O-C 3.26Å; S637-I641 PolarHBondContact O-N 2.9Å; I641-S643 PolarHBondContact O-N 2.89Å; I641-C644 HydrophobicContact CB-CB 4.36Å; I641-C644 HydrophobicContact CG2-CB 4.17Å; I641-C644 PolarHBondContact O-N 2.78Å; I641-V679 HydrophobicContact CD1-CG2 3.82Å
642	P	61.5	Low	74.2	Confident	86 Å²	86	33.1 Å²	33.1	56%	0.558	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	141	174.6	24.6	-32.5	0	0	0	109.3	C644	P642-C644 PolarHBondContact O-N 2.85Å
643	S	63.6	Low	74	Confident	15 Å²	15	33.1 Å²	33.1	11%	0.105	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	10.9	176.3	-37.5	0	0	0	0	116.5	R270 A272 I641	R270-S643 PolarHBondContact NE-O 3.49Å; R270-S643 PolarHBondContact NH2-O 3.48Å; A272-S643 WeakPolarHBondContact CB-OG 3.21Å; A272-S643 PolarHBondContact O-OG 2.97Å; I641-S643 PolarHBondContact O-N 2.89Å
644	C	70.9	Confident	73.6	Confident	4 Å²	4	33.8 Å²	33.8	3%	0.027	18%	0.18	C	C	.	.			trans	-57.4	142.8	-179.6	-171.3	0	0	0	0	114.4	R270 S637 I641 P642 L646 P647 H648 D676	R270-C644 VanDerWaalsContact NH2-C 3.28Å; S637-C644 VanDerWaalsContact CB-CB 3.48Å; I641-C644 HydrophobicContact CB-CB 4.36Å; I641-C644 HydrophobicContact CG2-CB 4.17Å; I641-C644 PolarHBondContact O-N 2.78Å; P642-C644 PolarHBondContact O-N 2.85Å; C644-L646 VanDerWaalsContact C-N 3.35Å; C644-L646 PolarHBondContact O-N 2.94Å; C644-P647 WeakPolarHBondContact O-CD 3.23Å; C644-H648 PolarHBondContact O-CD2 2.9Å; C644-H648 VanDerWaalsContact O-CD2 3.27Å; C644-D676 WeakPolarHBondContact CA-OD1 3.3Å
645	L	72.2	Confident	73.1	Confident	18 Å²	18	33.5 Å²	33.5	9%	0.094	18%	0.178	C	C	.	.	S	Bend	trans	-69.8	-32	-174.3	-178.3	74.8	0	0	0	112.7	H648 I649 Y672 D676	L645-H648 WeakPolarHBondContact O-CA 3.21Å; L645-H648 WeakPolarHBondContact O-CB 3.4Å; L645-H648 PolarHBondContact O-N 3.05Å; L645-I649 HydrophobicContact CD2-CD1 4.35Å; L645-I649 HydrophobicContact CG-CD1 4.36Å; L645-I649 HydrophobicContact CG-CG1 4.19Å; L645-I649 PolarHBondContact O-N 3.09Å; L645-Y672 HydrophobicContact CD1-CD1 4.35Å; L645-Y672 HydrophobicContact CD1-CE1 4.17Å; L645-Y672 HydrophobicContact CD2-CD1 3.6Å; L645-Y672 HydrophobicContact CD2-CE1 3.6Å; L645-D676 HydrophobicContact CB-CB 3.94Å; L645-D676 VanDerWaalsContact CB-CG 3.5Å; L645-D676 WeakPolarHBondContact CB-OD1 3.32Å; L645-D676 PolarHBondContact N-OD1 3.24Å
646	L	75.3	Confident	72.7	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-52.4	-49.9	-167.8	-164.5	74.7	0	0	0	113.6	Y630 L633 C644 H648 I649 V679 V680 W683	Y630-L646 HydrophobicContact CD2-CD1 3.83Å; Y630-L646 HydrophobicContact CD2-CD2 4.18Å; Y630-L646 HydrophobicContact CD2-CG 3.91Å; Y630-L646 HydrophobicContact CE2-CD1 3.64Å; Y630-L646 HydrophobicContact CE2-CD2 4.29Å; Y630-L646 HydrophobicContact CE2-CG 3.57Å; Y630-L646 PolarHBondContact OH-O 3.08Å; L633-L646 HydrophobicContact CB-CD2 3.4Å; L633-L646 VanDerWaalsContact CB-CD2 3.4Å; C644-L646 VanDerWaalsContact C-N 3.35Å; C644-L646 PolarHBondContact O-N 2.94Å; L646-H648 VanDerWaalsContact C-N 3.29Å; L646-H648 PolarHBondContact O-N 3.09Å; L646-I649 HydrophobicContact CD1-CD1 4.26Å; L646-I649 PolarHBondContact O-N 3.48Å; L646-V679 HydrophobicContact CB-CG1 4.3Å; L646-V679 HydrophobicContact CD2-CG1 4.06Å; L646-V680 HydrophobicContact CD1-CG2 4.47Å; L646-W683 HydrophobicContact CD1-CD2 4.44Å; L646-W683 HydrophobicContact CD1-CE3 4.14Å
647	P	72.7	Confident	72.4	Confident	14 Å²	14	32.1 Å²	32.1	9%	0.091	17%	0.168	C	C	.	.	H	α-helix	trans	-65.6	-28.3	176.3	22.5	-33	0	0	0	113.9	F638 C644 I649	F638-P647 HydrophobicContact CE1-CB 3.99Å; F638-P647 HydrophobicContact CE1-CG 3.93Å; F638-P647 HydrophobicContact CE2-CB 3.92Å; F638-P647 HydrophobicContact CE2-CG 4.41Å; F638-P647 HydrophobicContact CZ-CB 3.39Å; F638-P647 HydrophobicContact CZ-CG 3.83Å; C644-P647 WeakPolarHBondContact O-CD 3.23Å; P647-I649 VanDerWaalsContact C-N 3.32Å; P647-I649 PolarHBondContact O-N 3.28Å
648	H	73	Confident	72.1	Confident	7 Å²	7	32.3 Å²	32.3	3%	0.032	17%	0.169	C	C	.	.	H	α-helix	trans	-71.5	-24.8	178.9	-65.7	-69	0	0	0	113	C644 L645 L646 V650 I651 E652	C644-H648 PolarHBondContact O-CD2 2.9Å; C644-H648 VanDerWaalsContact O-CD2 3.27Å; L645-H648 WeakPolarHBondContact O-CA 3.21Å; L645-H648 WeakPolarHBondContact O-CB 3.4Å; L645-H648 PolarHBondContact O-N 3.05Å; L646-H648 VanDerWaalsContact C-N 3.29Å; L646-H648 PolarHBondContact O-N 3.09Å; H648-V650 PolarHBondContact O-N 3.15Å; H648-I651 PolarHBondContact O-N 3.24Å; H648-E652 WeakPolarHBondContact O-CB 3.32Å; H648-E652 VanDerWaalsContact O-CG 3.29Å; H648-E652 WeakPolarHBondContact O-CG 3.3Å; H648-E652 PolarHBondContact O-N 2.78Å
649	I	75.6	Confident	71.9	Confident	3 Å²	3	29.8 Å²	29.8	2%	0.015	16%	0.16	C	C	.	.	H	α-helix	trans	-58.3	-47.4	-179.3	-69.2	165	0	0	0	111.6	Y579 I582 L645 L646 P647 Y653	Y579-I649 HydrophobicContact CD2-CD1 4.09Å; I582-I649 HydrophobicContact CD1-CB 4.1Å; I582-I649 HydrophobicContact CD1-CG1 4.15Å; I582-I649 HydrophobicContact CD1-CG2 3.91Å; L645-I649 HydrophobicContact CD2-CD1 4.35Å; L645-I649 HydrophobicContact CG-CD1 4.36Å; L645-I649 HydrophobicContact CG-CG1 4.19Å; L645-I649 PolarHBondContact O-N 3.09Å; L646-I649 HydrophobicContact CD1-CD1 4.26Å; L646-I649 PolarHBondContact O-N 3.48Å; P647-I649 VanDerWaalsContact C-N 3.32Å; P647-I649 PolarHBondContact O-N 3.28Å; I649-Y653 WeakPolarHBondContact O-CB 3.25Å; I649-Y653 PolarHBondContact O-N 3.08Å
650	V	74	Confident	71.9	Confident	44 Å²	44	27.3 Å²	27.3	27%	0.267	15%	0.149	S	C	.	.	H	α-helix	trans	-70.4	-36.6	-179.7	167	0	0	0	0	111.1	I575 Y630 H648 Y653 F654	I575-V650 HydrophobicContact CG1-CG2 4.43Å; Y630-V650 HydrophobicContact CE1-CG2 3.7Å; Y630-V650 WeakPolarHBondContact OH-CG2 3.31Å; H648-V650 PolarHBondContact O-N 3.15Å; V650-Y653 PolarHBondContact O-N 3.41Å; V650-F654 WeakPolarHBondContact O-CB 3.33Å; V650-F654 PolarHBondContact O-N 3.29Å
651	I	73.8	Confident	71.6	Confident	58 Å²	58	24.7 Å²	24.7	30%	0.297	14%	0.136	S	C	.	.	H	α-helix	trans	-64.9	-46.1	176.6	-61.7	171	0	0	0	110.4	W168 H648 F654 L655	W168-I651 HydrophobicContact CH2-CD1 4.23Å; W168-I651 HydrophobicContact CH2-CG2 4.06Å; W168-I651 HydrophobicContact CZ2-CG2 4.1Å; W168-I651 HydrophobicContact CZ3-CG2 4.34Å; H648-I651 PolarHBondContact O-N 3.24Å; I651-F654 WeakPolarHBondContact O-CB 3.45Å; I651-F654 PolarHBondContact O-N 3.35Å; I651-L655 HydrophobicContact CG2-CD1 4.06Å; I651-L655 HydrophobicContact CG2-CG 4.46Å; I651-L655 WeakPolarHBondContact O-CB 3.34Å; I651-L655 VanDerWaalsContact O-CG 3.31Å; I651-L655 WeakPolarHBondContact O-CG 3.37Å; I651-L655 PolarHBondContact O-N 3.27Å
652	E	74.4	Confident	71.7	Confident	13 Å²	13	23.5 Å²	23.5	6%	0.061	13%	0.13	C	C	.	.	H	α-helix	trans	-60.6	-48	176.8	-76.8	-60.4	155.9	0	0	111.4	I582 H648 F654 L655 M656 R663	I582-E652 HydrophobicContact CD1-CB 3.79Å; I582-E652 HydrophobicContact CD1-CG 4.47Å; H648-E652 WeakPolarHBondContact O-CB 3.32Å; H648-E652 VanDerWaalsContact O-CG 3.29Å; H648-E652 WeakPolarHBondContact O-CG 3.3Å; H648-E652 PolarHBondContact O-N 2.78Å; E652-F654 VanDerWaalsContact C-N 3.31Å; E652-F654 PolarHBondContact O-N 3.39Å; E652-L655 PolarHBondContact O-N 3.32Å; E652-M656 HydrophobicContact CB-CE 4.14Å; E652-M656 VanDerWaalsContact O-CG 3.32Å; E652-M656 WeakPolarHBondContact O-CG 3.37Å; E652-M656 PolarHBondContact O-N 3.31Å; E652-R663 IonicContact OE1-CZ 3.88Å; E652-R663 IonicContact OE1-NH2 2.7Å; E652-R663 PolarHBondContact OE1-NH2 3.12Å; E652-R663 IonicContact OE2-CZ 3.9Å; E652-R663 VanDerWaalsContact OE2-CZ 3.32Å; E652-R663 IonicContact OE2-NE 3.32Å; E652-R663 PolarHBondContact OE2-NE 2.94Å; E652-R663 VanDerWaalsContact OE2-NE 3.09Å; E652-R663 IonicContact OE2-NH2 2.87Å; E652-R663 PolarHBondContact OE2-NH2 3.29Å
653	Y	79.5	Confident	72.1	Confident	11 Å²	11	19.4 Å²	19.4	4%	0.043	10%	0.103	C	C	.	.	H	α-helix	trans	-63.5	-39	178.3	-176.8	-123.6	0	0	0	112	F574 I577 G578 F597 I649 V650 M656 L657	F574-Y653 HydrophobicContact CD1-CD1 4.14Å; F574-Y653 HydrophobicContact CD1-CE1 4.09Å; F574-Y653 HydrophobicContact CD2-CD1 4.39Å; F574-Y653 AromaticContact CD2-CE1 3.64Å; F574-Y653 HydrophobicContact CD2-CE1 3.64Å; F574-Y653 AromaticContact CE1-CD1 3.59Å; F574-Y653 HydrophobicContact CE1-CD1 3.59Å; F574-Y653 AromaticContact CE1-CE1 3.83Å; F574-Y653 HydrophobicContact CE1-CE1 3.83Å; F574-Y653 AromaticContact CE2-CD1 3.88Å; F574-Y653 HydrophobicContact CE2-CD1 3.88Å; F574-Y653 AromaticContact CE2-CE1 3.34Å; F574-Y653 HydrophobicContact CE2-CE1 3.34Å; F574-Y653 AromaticContact CG-CE1 4Å; F574-Y653 HydrophobicContact CG-CE1 4Å; F574-Y653 AromaticContact CZ-CD1 3.44Å; F574-Y653 HydrophobicContact CZ-CD1 3.44Å; F574-Y653 VanDerWaalsContact CZ-CD1 3.44Å; F574-Y653 AromaticContact CZ-CE1 3.44Å; F574-Y653 HydrophobicContact CZ-CE1 3.44Å; F574-Y653 VanDerWaalsContact CZ-CE1 3.44Å; I577-Y653 HydrophobicContact CG2-CE2 3.91Å; I577-Y653 WeakPolarHBondContact CG2-OH 3.39Å; G578-Y653 VanDerWaalsContact CA-CG 3.46Å; F597-Y653 HydrophobicContact CZ-CD2 4.27Å; F597-Y653 AromaticContact CZ-CE2 3.94Å; F597-Y653 HydrophobicContact CZ-CE2 3.94Å; I649-Y653 WeakPolarHBondContact O-CB 3.25Å; I649-Y653 PolarHBondContact O-N 3.08Å; V650-Y653 PolarHBondContact O-N 3.41Å; Y653-M656 PolarHBondContact O-N 3.38Å; Y653-L657 HydrophobicContact CD1-CD1 4.1Å; Y653-L657 HydrophobicContact CE1-CD1 3.68Å; Y653-L657 HydrophobicContact CE2-CD1 4.22Å; Y653-L657 HydrophobicContact CE2-CG 4.26Å; Y653-L657 WeakPolarHBondContact O-CG 3.48Å; Y653-L657 PolarHBondContact O-N 2.77Å; Y653-L657 VanDerWaalsContact O-N 3.08Å
654	F	77	Confident	72.2	Confident	39 Å²	39	19.6 Å²	19.6	17%	0.171	10%	0.103	C	C	.	.	H	α-helix	trans	-60.1	-47.8	172.7	176.2	-99.8	0	0	0	111.8	L377 I378 Y381 V650 I651 E652 M656 L657 T658	L377-F654 HydrophobicContact CB-CE2 3.71Å; L377-F654 HydrophobicContact CB-CZ 4.08Å; I378-F654 HydrophobicContact CG1-CD2 4.02Å; I378-F654 HydrophobicContact CG1-CE2 3.92Å; Y381-F654 HydrophobicContact CD1-CE1 4.06Å; Y381-F654 HydrophobicContact CD1-CZ 4.2Å; Y381-F654 HydrophobicContact CD2-CE1 4.17Å; Y381-F654 HydrophobicContact CD2-CZ 4.2Å; Y381-F654 HydrophobicContact CE1-CE1 4.3Å; Y381-F654 HydrophobicContact CE2-CE1 4.44Å; Y381-F654 AromaticContact CG-CE1 3.98Å; Y381-F654 HydrophobicContact CG-CE1 3.98Å; Y381-F654 AromaticContact CG-CZ 3.81Å; Y381-F654 HydrophobicContact CG-CZ 3.81Å; V650-F654 WeakPolarHBondContact O-CB 3.33Å; V650-F654 PolarHBondContact O-N 3.29Å; I651-F654 WeakPolarHBondContact O-CB 3.45Å; I651-F654 PolarHBondContact O-N 3.35Å; E652-F654 VanDerWaalsContact C-N 3.31Å; E652-F654 PolarHBondContact O-N 3.39Å; F654-M656 VanDerWaalsContact C-N 3.3Å; F654-M656 PolarHBondContact O-N 2.93Å; F654-L657 PolarHBondContact O-N 2.74Å; F654-L657 VanDerWaalsContact O-N 3.14Å; F654-T658 HydrophobicContact CD1-CG2 4.46Å; F654-T658 HydrophobicContact CD2-CG2 4.2Å; F654-T658 HydrophobicContact CE1-CG2 4.03Å; F654-T658 HydrophobicContact CE2-CG2 3.73Å; F654-T658 HydrophobicContact CZ-CG2 3.65Å; F654-T658 PolarHBondContact O-N 2.82Å; F654-T658 PolarHBondContact O-OG1 3.45Å; F654-T658 VanDerWaalsContact O-OG1 3.04Å
655	L	73	Confident	72	Confident	4 Å²	4	28.4 Å²	28.4	2%	0.021	14%	0.136	C	C	.	.	H	α-helix	trans	-63.6	-34.1	177.4	-71.9	172.4	0	0	0	112.6	L165 W168 I651 E652 C659 R663	L165-L655 HydrophobicContact CD2-CD2 4.08Å; W168-L655 HydrophobicContact CB-CD1 4.18Å; W168-L655 HydrophobicContact CD2-CD1 4.25Å; W168-L655 HydrophobicContact CG-CD1 3.95Å; I651-L655 HydrophobicContact CG2-CD1 4.06Å; I651-L655 HydrophobicContact CG2-CG 4.46Å; I651-L655 WeakPolarHBondContact O-CB 3.34Å; I651-L655 VanDerWaalsContact O-CG 3.31Å; I651-L655 WeakPolarHBondContact O-CG 3.37Å; I651-L655 PolarHBondContact O-N 3.27Å; E652-L655 PolarHBondContact O-N 3.32Å; L655-C659 WeakPolarHBondContact O-CA 3.4Å; L655-C659 WeakPolarHBondContact O-CB 3.47Å; L655-C659 PolarHBondContact O-N 3.05Å; L655-R663 HydrophobicContact CB-CG 4.46Å
656	M	73.3	Confident	72	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-64.6	-40.2	173.1	-72	-176.9	-139.3	0	0	112.1	I582 F597 E652 Y653 F654 F660 R663 R668	I582-M656 HydrophobicContact CG1-CE 3.83Å; F597-M656 HydrophobicContact CE1-CB 4.3Å; F597-M656 HydrophobicContact CE2-CB 4.44Å; F597-M656 HydrophobicContact CE2-SD 3.88Å; F597-M656 HydrophobicContact CZ-CB 3.82Å; F597-M656 HydrophobicContact CZ-SD 4.12Å; E652-M656 HydrophobicContact CB-CE 4.14Å; E652-M656 VanDerWaalsContact O-CG 3.32Å; E652-M656 WeakPolarHBondContact O-CG 3.37Å; E652-M656 PolarHBondContact O-N 3.31Å; Y653-M656 PolarHBondContact O-N 3.38Å; F654-M656 VanDerWaalsContact C-N 3.3Å; F654-M656 PolarHBondContact O-N 2.93Å; M656-F660 VanDerWaalsContact O-CA 3.31Å; M656-F660 WeakPolarHBondContact O-CA 3.09Å; M656-F660 VanDerWaalsContact O-CB 3.29Å; M656-F660 WeakPolarHBondContact O-CB 3.45Å; M656-F660 PolarHBondContact O-N 2.79Å; M656-R663 HydrophobicContact CG-CG 4.03Å; M656-R668 VanDerWaalsContact CE-NH2 3.31Å; M656-R668 VanDerWaalsContact SD-CZ 3.57Å; M656-R668 PolarHBondContact SD-NH1 3.23Å; M656-R668 VanDerWaalsContact SD-NH1 3.41Å; M656-R668 PolarHBondContact SD-NH2 3.06Å
657	L	74.7	Confident	71.8	Confident	24 Å²	24	28.2 Å²	28.2	13%	0.126	14%	0.135	C	C	.	.	H	α-helix	trans	-73.2	-38.8	-179.7	-72.5	170.4	0	0	0	112.6	I378 F574 F597 Y653 F654	I378-L657 HydrophobicContact CD1-CD1 3.94Å; F574-L657 HydrophobicContact CE2-CD1 3.74Å; F574-L657 HydrophobicContact CZ-CD1 4.03Å; F597-L657 HydrophobicContact CE1-CD2 4.07Å; Y653-L657 HydrophobicContact CD1-CD1 4.1Å; Y653-L657 HydrophobicContact CE1-CD1 3.68Å; Y653-L657 HydrophobicContact CE2-CD1 4.22Å; Y653-L657 HydrophobicContact CE2-CG 4.26Å; Y653-L657 WeakPolarHBondContact O-CG 3.48Å; Y653-L657 PolarHBondContact O-N 2.77Å; Y653-L657 VanDerWaalsContact O-N 3.08Å; F654-L657 PolarHBondContact O-N 2.74Å; F654-L657 VanDerWaalsContact O-N 3.14Å
658	T	70.2	Confident	71.7	Confident	5 Å²	5	28.6 Å²	28.6	3%	0.031	13%	0.134	C	C	.	.	H	α-helix	trans	-84	-37.7	-176.2	55.5	0	0	0	0	113.2	I378 Y381 F654	I378-T658 HydrophobicContact CG1-CG2 4.46Å; I378-T658 HydrophobicContact CG2-CG2 4.49Å; Y381-T658 HydrophobicContact CD1-CG2 3.81Å; Y381-T658 HydrophobicContact CG-CG2 4.33Å; F654-T658 HydrophobicContact CD1-CG2 4.46Å; F654-T658 HydrophobicContact CD2-CG2 4.2Å; F654-T658 HydrophobicContact CE1-CG2 4.03Å; F654-T658 HydrophobicContact CE2-CG2 3.73Å; F654-T658 HydrophobicContact CZ-CG2 3.65Å; F654-T658 PolarHBondContact O-N 2.82Å; F654-T658 PolarHBondContact O-OG1 3.45Å; F654-T658 VanDerWaalsContact O-OG1 3.04Å
659	C	68.1	Low	71.3	Confident	17 Å²	17	28.5 Å²	28.5	12%	0.115	13%	0.134	C	C	.	.	S	Bend	trans	-122.7	44.5	-173.5	-68.4	0	0	0	0	112.4	L165 L655 D661 I662 R663	L165-C659 HydrophobicContact CD1-CB 4.16Å; L165-C659 HydrophobicContact CD2-CB 4.28Å; L655-C659 WeakPolarHBondContact O-CA 3.4Å; L655-C659 WeakPolarHBondContact O-CB 3.47Å; L655-C659 PolarHBondContact O-N 3.05Å; C659-D661 VanDerWaalsContact C-N 3.3Å; C659-D661 PolarHBondContact O-N 3.03Å; C659-I662 PolarHBondContact O-N 2.94Å; C659-R663 VanDerWaalsContact O-CB 3.32Å; C659-R663 WeakPolarHBondContact O-CB 3.47Å; C659-R663 PolarHBondContact O-N 2.79Å
660	F	70	Confident	70.9	Confident	29 Å²	29	30.1 Å²	30.1	13%	0.127	14%	0.141	C	C	.	.	H	α-helix	trans	-54.8	-40.6	-174.4	68.4	-89	0	0	0	113.7	F598 M656 I662 R663 L664	F598-F660 HydrophobicContact CE2-CG 4.47Å; F598-F660 HydrophobicContact CZ-CD1 4.39Å; M656-F660 VanDerWaalsContact O-CA 3.31Å; M656-F660 WeakPolarHBondContact O-CA 3.09Å; M656-F660 VanDerWaalsContact O-CB 3.29Å; M656-F660 WeakPolarHBondContact O-CB 3.45Å; M656-F660 PolarHBondContact O-N 2.79Å; F660-I662 VanDerWaalsContact C-N 3.27Å; F660-I662 PolarHBondContact O-N 2.78Å; F660-R663 PolarHBondContact O-N 2.03Å; F660-L664 HydrophobicContact CB-CD1 4.08Å; F660-L664 VanDerWaalsContact O-CB 3.24Å; F660-L664 WeakPolarHBondContact O-CB 3.25Å; F660-L664 WeakPolarHBondContact O-CD1 3.03Å; F660-L664 VanDerWaalsContact O-CG 3.25Å; F660-L664 WeakPolarHBondContact O-CG 3.3Å; F660-L664 PolarHBondContact O-N 3.28Å
661	D	65.7	Low	70.6	Confident	83 Å²	83	29.5 Å²	29.5	44%	0.444	14%	0.135	S	C	.	.	H	α-helix	trans	-58	-39.3	-177.9	-68.8	-48.3	0	0	0	113	C659 R665	C659-D661 VanDerWaalsContact C-N 3.3Å; C659-D661 PolarHBondContact O-N 3.03Å; D661-R665 WeakPolarHBondContact O-CD 3.2Å; D661-R665 WeakPolarHBondContact O-CG 3.34Å
662	I	66.5	Low	70.4	Confident	17 Å²	17	31.8 Å²	31.8	9%	0.087	14%	0.141	C	C	.	.	H	α-helix	trans	-90.2	-46.3	-178.2	-57.7	169.5	0	0	0	109.2	L156 L165 C659 F660 L664 R665 T666	L156-I662 HydrophobicContact CD2-CG1 4.28Å; L165-I662 HydrophobicContact CD1-CB 3.93Å; L165-I662 HydrophobicContact CD1-CD1 3.55Å; L165-I662 HydrophobicContact CD1-CG1 4.32Å; L165-I662 HydrophobicContact CD1-CG2 3.8Å; C659-I662 PolarHBondContact O-N 2.94Å; F660-I662 VanDerWaalsContact C-N 3.27Å; F660-I662 PolarHBondContact O-N 2.78Å; I662-L664 VanDerWaalsContact C-N 3.34Å; I662-L664 PolarHBondContact O-N 3.28Å; I662-R665 PolarHBondContact O-N 2.93Å; I662-R665 VanDerWaalsContact O-N 3.09Å; I662-T666 HydrophobicContact CG2-CG2 4.2Å; I662-T666 WeakPolarHBondContact O-CG2 3.18Å; I662-T666 PolarHBondContact O-N 2.91Å; I662-T666 VanDerWaalsContact O-N 3.08Å
663	R	71.4	Confident	70.1	Confident	1 Å²	1	31.3 Å²	31.3	0%	0.004	14%	0.139	C	C	.	.	H	α-helix	trans	-72.6	-20.8	-172.3	-160.1	62.8	175.5	-177.9	-2.8	114.5	W168 T169 E652 L655 M656 C659 F660 T666 R668	W168-R663 PolarHBondContact O-NH1 3.26Å; W168-R663 VanDerWaalsContact O-NH1 3.07Å; T169-R663 VanDerWaalsContact CG2-NH1 3.35Å; E652-R663 IonicContact OE1-CZ 3.88Å; E652-R663 IonicContact OE1-NH2 2.7Å; E652-R663 PolarHBondContact OE1-NH2 3.12Å; E652-R663 IonicContact OE2-CZ 3.9Å; E652-R663 VanDerWaalsContact OE2-CZ 3.32Å; E652-R663 IonicContact OE2-NE 3.32Å; E652-R663 PolarHBondContact OE2-NE 2.94Å; E652-R663 VanDerWaalsContact OE2-NE 3.09Å; E652-R663 IonicContact OE2-NH2 2.87Å; E652-R663 PolarHBondContact OE2-NH2 3.29Å; L655-R663 HydrophobicContact CB-CG 4.46Å; M656-R663 HydrophobicContact CG-CG 4.03Å; C659-R663 VanDerWaalsContact O-CB 3.32Å; C659-R663 WeakPolarHBondContact O-CB 3.47Å; C659-R663 PolarHBondContact O-N 2.79Å; F660-R663 PolarHBondContact O-N 2.03Å; R663-T666 PolarHBondContact O-OG1 2.75Å; R663-R668 PolarHBondContact O-NH2 3.02Å
664	L	65.3	Low	69.7	Low	18 Å²	18	35.4 Å²	35.4	9%	0.094	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-27.2	170.1	-68.8	169.5	0	0	0	112	F597 F660 I662	F597-L664 HydrophobicContact CB-CD2 4.43Å; F660-L664 HydrophobicContact CB-CD1 4.08Å; F660-L664 VanDerWaalsContact O-CB 3.24Å; F660-L664 WeakPolarHBondContact O-CB 3.25Å; F660-L664 WeakPolarHBondContact O-CD1 3.03Å; F660-L664 VanDerWaalsContact O-CG 3.25Å; F660-L664 WeakPolarHBondContact O-CG 3.3Å; F660-L664 PolarHBondContact O-N 3.28Å; I662-L664 VanDerWaalsContact C-N 3.34Å; I662-L664 PolarHBondContact O-N 3.28Å
665	R	66.6	Low	69.6	Low	190 Å²	190	39.6 Å²	39.6	72%	0.717	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-16.8	175.7	-65.2	-178.7	-176.9	-175.4	1.9	113.2	D661 I662	D661-R665 WeakPolarHBondContact O-CD 3.2Å; D661-R665 WeakPolarHBondContact O-CG 3.34Å; I662-R665 PolarHBondContact O-N 2.93Å; I662-R665 VanDerWaalsContact O-N 3.09Å
666	T	72.2	Confident	69.7	Low	6 Å²	6	39.5 Å²	39.5	4%	0.037	17%	0.174	C	C	.	.	S	Bend	trans	-76.8	125.7	178.3	61.4	0	0	0	0	111.3	T169 I266 I662 R663 R668	T169-T666 HydrophobicContact CG2-CG2 4.06Å; I266-T666 HydrophobicContact CB-CG2 4.02Å; I266-T666 HydrophobicContact CG2-CG2 3.32Å; I266-T666 CarbonylContact O-C 3.59Å; I266-T666 WeakPolarHBondContact O-CA 3.44Å; I662-T666 HydrophobicContact CG2-CG2 4.2Å; I662-T666 WeakPolarHBondContact O-CG2 3.18Å; I662-T666 PolarHBondContact O-N 2.91Å; I662-T666 VanDerWaalsContact O-N 3.08Å; R663-T666 PolarHBondContact O-OG1 2.75Å; T666-R668 PolarHBondContact O-N 3.12Å
667	L	70.6	Confident	70	Confident	8 Å²	8	43.3 Å²	43.3	4%	0.042	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-60.8	127.4	171.9	-179.1	79.2	0	0	0	110.7	I205 I248 Q249 F251 I265 I266 V267 S268 I669	I205-L667 HydrophobicContact CD1-CD2 3.86Å; I248-L667 HydrophobicContact CG2-CD1 3.86Å; I248-L667 HydrophobicContact CG2-CD2 4.18Å; I248-L667 HydrophobicContact CG2-CG 4.25Å; Q249-L667 HydrophobicContact CB-CD1 3.78Å; Q249-L667 HydrophobicContact CG-CD1 4.39Å; F251-L667 HydrophobicContact CZ-CD1 4.13Å; I265-L667 HydrophobicContact CG2-CB 4.26Å; I265-L667 HydrophobicContact CG2-CD2 4.47Å; I266-L667 WeakPolarHBondContact O-CB 3.34Å; I266-L667 PolarHBondContact O-N 2.9Å; V267-L667 CarbonylContact C-O 3.51Å; V267-L667 WeakPolarHBondContact CA-O 3.45Å; V267-L667 HydrophobicContact CG2-CB 4.22Å; V267-L667 HydrophobicContact CG2-CD2 4.02Å; S268-L667 PolarHBondContact N-O 3.41Å; S268-L667 PolarHBondContact OG-O 2.85Å; L667-I669 HydrophobicContact CD2-CD1 3.86Å; L667-I669 HydrophobicContact CD2-CG1 3.78Å; L667-I669 HydrophobicContact CG-CG1 4.15Å
668	R	71.6	Confident	70.4	Confident	23 Å²	23	45.4 Å²	45.4	9%	0.087	21%	0.207	C	C	.	.			trans	-98.7	108.6	176	-64.9	-179.9	-166.8	159.1	2.9	112	S268 D585 M656 R663 T666	S268-R668 WeakPolarHBondContact OG-CA 3.45Å; D585-R668 IonicContact OD1-NH1 2.89Å; D585-R668 PolarHBondContact OD1-NH1 2.88Å; D585-R668 IonicContact OD2-CZ 3.17Å; D585-R668 IonicContact OD2-NE 2.82Å; D585-R668 IonicContact OD2-NH1 3.69Å; D585-R668 PolarHBondContact OD2-NH1 3.11Å; M656-R668 VanDerWaalsContact CE-NH2 3.31Å; M656-R668 VanDerWaalsContact SD-CZ 3.57Å; M656-R668 PolarHBondContact SD-NH1 3.23Å; M656-R668 VanDerWaalsContact SD-NH1 3.41Å; M656-R668 PolarHBondContact SD-NH2 3.06Å; R663-R668 PolarHBondContact O-NH2 3.02Å; T666-R668 PolarHBondContact O-N 3.12Å
669	I	63.8	Low	71	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.021	21%	0.209	C	C	.	.			trans	-98.7	89.3	171.8	-53.4	-177.7	0	0	0	107.4	I248 V267 Y275 I277 L667 F671	I248-I669 HydrophobicContact CD1-CD1 4.01Å; I248-I669 HydrophobicContact CD1-CG1 4.03Å; I248-I669 HydrophobicContact CD1-CG2 3.93Å; I248-I669 HydrophobicContact CG2-CG1 4.36Å; V267-I669 HydrophobicContact CG1-CB 4.42Å; V267-I669 HydrophobicContact CG1-CD1 3.64Å; V267-I669 HydrophobicContact CG1-CG1 3.81Å; Y275-I669 HydrophobicContact CD2-CG2 4.45Å; Y275-I669 HydrophobicContact CG-CG2 4.43Å; I277-I669 HydrophobicContact CD1-CD1 3.35Å; I277-I669 HydrophobicContact CG1-CD1 4.1Å; L667-I669 HydrophobicContact CD2-CD1 3.86Å; L667-I669 HydrophobicContact CD2-CG1 3.78Å; L667-I669 HydrophobicContact CG-CG1 4.15Å; I669-F671 HydrophobicContact CG2-CD2 3.82Å; I669-F671 HydrophobicContact CG2-CE2 3.33Å; I669-F671 HydrophobicContact CG2-CZ 4.23Å
670	Q	67.8	Low	71.8	Confident	37 Å²	37	45.5 Å²	45.5	17%	0.173	21%	0.207	C	C	.	.			trans	-107.2	111.1	176.8	-64.6	-175	8.1	0	0	109.3	Y672	Q670-Y672 HydrophobicContact CB-CE1 4.09Å; Q670-Y672 PolarHBondContact OE1-OH 3.08Å
671	F	66.9	Low	72.5	Confident	31 Å²	31	47.9 Å²	47.9	14%	0.136	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-102.5	130.1	163.3	-64.4	-80.7	0	0	0	108.7	G207 P209 T212 A246 Y275 I669	G207-F671 VanDerWaalsContact O-CZ 3.31Å; G207-F671 WeakPolarHBondContact O-CZ 3.5Å; P209-F671 HydrophobicContact CB-CB 3.77Å; P209-F671 HydrophobicContact CB-CD1 4.2Å; P209-F671 HydrophobicContact CB-CD2 4.32Å; P209-F671 HydrophobicContact CB-CG 3.84Å; P209-F671 HydrophobicContact CG-CB 4.39Å; P209-F671 HydrophobicContact CG-CD1 4.08Å; P209-F671 HydrophobicContact CG-CG 4.24Å; T212-F671 HydrophobicContact CG2-CB 4.44Å; A246-F671 HydrophobicContact CB-CE1 4.12Å; Y275-F671 HydrophobicContact CD1-CB 4.36Å; Y275-F671 AromaticContact CD1-CD2 3.32Å; Y275-F671 HydrophobicContact CD1-CD2 3.32Å; Y275-F671 HydrophobicContact CD1-CE2 4.01Å; Y275-F671 HydrophobicContact CD1-CG 4.23Å; Y275-F671 HydrophobicContact CE1-CB 3.97Å; Y275-F671 AromaticContact CE1-CD2 3.65Å; Y275-F671 HydrophobicContact CE1-CD2 3.65Å; Y275-F671 HydrophobicContact CE1-CG 4.29Å; Y275-F671 HydrophobicContact CG-CD2 4.01Å; Y275-F671 HydrophobicContact CG-CE2 4.31Å; I669-F671 HydrophobicContact CG2-CD2 3.82Å; I669-F671 HydrophobicContact CG2-CE2 3.33Å; I669-F671 HydrophobicContact CG2-CZ 4.23Å
672	Y	69.9	Low	73.6	Confident	107 Å²	107	47.6 Å²	47.6	42%	0.42	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-95.4	125.5	179.5	-54.5	-59.3	0	0	0	109.3	L645 Q670	L645-Y672 HydrophobicContact CD1-CD1 4.35Å; L645-Y672 HydrophobicContact CD1-CE1 4.17Å; L645-Y672 HydrophobicContact CD2-CD1 3.6Å; L645-Y672 HydrophobicContact CD2-CE1 3.6Å; Q670-Y672 HydrophobicContact CB-CE1 4.09Å; Q670-Y672 PolarHBondContact OE1-OH 3.08Å
673	G	67.8	Low	74.6	Confident	2 Å²	2	46.9 Å²	46.9	2%	0.021	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-75.2	161.9	171.1	0	0	0	0	0	111.3	G214 Y675 D676 V677	G214-G673 WeakPolarHBondContact O-CA 3.32Å; G673-Y675 VanDerWaalsContact C-N 3.28Å; G673-Y675 PolarHBondContact O-N 2.8Å; G673-D676 PolarHBondContact N-OD2 3.35Å; G673-D676 VanDerWaalsContact N-OD2 3.14Å; G673-D676 WeakPolarHBondContact O-CB 3.1Å; G673-D676 PolarHBondContact O-N 2.94Å; G673-V677 PolarHBondContact O-N 2.81Å
674	Q	72	Confident	75.4	Confident	98 Å²	98	49.6 Å²	49.6	46%	0.458	23%	0.23	S	C	.	.	H	α-helix	trans	-58.4	-41.5	177.2	-175.1	179	-4.7	0	0	112	G214 D676 V677 I678	G214-Q674 PolarHBondContact O-N 3.23Å; Q674-D676 VanDerWaalsContact C-N 3.31Å; Q674-D676 PolarHBondContact O-N 3.28Å; Q674-V677 PolarHBondContact O-N 3.35Å; Q674-I678 HydrophobicContact CG-CD1 3.92Å; Q674-I678 WeakPolarHBondContact O-CG1 3.03Å; Q674-I678 PolarHBondContact O-N 3.2Å
675	Y	74	Confident	76.4	Confident	126 Å²	126	52.5 Å²	52.5	49%	0.494	25%	0.249	S	C	.	.	H	α-helix	trans	-67.3	-29.8	176.3	-67.3	-64.7	0	0	0	112.7	A213 G673 V677 I678 V679	A213-Y675 WeakPolarHBondContact O-CB 3.47Å; A213-Y675 WeakPolarHBondContact O-CD2 3.02Å; G673-Y675 VanDerWaalsContact C-N 3.28Å; G673-Y675 PolarHBondContact O-N 2.8Å; Y675-V677 VanDerWaalsContact C-N 3.32Å; Y675-V677 PolarHBondContact O-N 3.28Å; Y675-I678 HydrophobicContact CD1-CD1 4.4Å; Y675-I678 PolarHBondContact O-N 2.95Å; Y675-V679 WeakPolarHBondContact O-CB 3.4Å; Y675-V679 WeakPolarHBondContact O-CG2 3.45Å; Y675-V679 PolarHBondContact O-N 3.05Å
676	D	76.1	Confident	77.3	Confident	2 Å²	2	45 Å²	45	1%	0.011	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-45	174.1	-69.8	-31	0	0	0	110.2	A213 R270 C644 L645 G673 Q674 V680	A213-D676 WeakPolarHBondContact CB-OD1 3.49Å; R270-D676 IonicContact CZ-OD2 3.84Å; R270-D676 IonicContact NH1-OD2 3.09Å; R270-D676 PolarHBondContact NH1-OD2 2.91Å; R270-D676 VanDerWaalsContact NH1-OD2 3.17Å; R270-D676 IonicContact NH2-OD1 2.66Å; R270-D676 PolarHBondContact NH2-OD1 3.07Å; R270-D676 VanDerWaalsContact NH2-OD1 3.1Å; R270-D676 IonicContact NH2-OD2 2.75Å; R270-D676 PolarHBondContact NH2-OD2 2.86Å; C644-D676 WeakPolarHBondContact CA-OD1 3.3Å; L645-D676 HydrophobicContact CB-CB 3.94Å; L645-D676 VanDerWaalsContact CB-CG 3.5Å; L645-D676 WeakPolarHBondContact CB-OD1 3.32Å; L645-D676 PolarHBondContact N-OD1 3.24Å; G673-D676 PolarHBondContact N-OD2 3.35Å; G673-D676 VanDerWaalsContact N-OD2 3.14Å; G673-D676 WeakPolarHBondContact O-CB 3.1Å; G673-D676 PolarHBondContact O-N 2.94Å; Q674-D676 VanDerWaalsContact C-N 3.31Å; Q674-D676 PolarHBondContact O-N 3.28Å; D676-V680 VanDerWaalsContact O-CG2 3.28Å; D676-V680 WeakPolarHBondContact O-CG2 3.3Å; D676-V680 PolarHBondContact O-N 2.82Å; D676-V680 VanDerWaalsContact O-N 3.13Å
677	V	79.3	Confident	78	Confident	81 Å²	81	44.7 Å²	44.7	49%	0.491	22%	0.223	S	C	.	.	H	α-helix	trans	-65.8	-46.6	178.2	-178.5	0	0	0	0	110.9	G673 Q674 Y675 V679 V680 V681	G673-V677 PolarHBondContact O-N 2.81Å; Q674-V677 PolarHBondContact O-N 3.35Å; Y675-V677 VanDerWaalsContact C-N 3.32Å; Y675-V677 PolarHBondContact O-N 3.28Å; V677-V679 PolarHBondContact O-N 3.24Å; V677-V680 PolarHBondContact O-N 3.31Å; V677-V681 HydrophobicContact CG1-CG2 4.42Å; V677-V681 WeakPolarHBondContact O-CG2 3.42Å; V677-V681 PolarHBondContact O-N 3.27Å
678	I	81.8	Confident	78.7	Confident	68 Å²	68	49.4 Å²	49.4	35%	0.349	25%	0.248	S	C	.	.	H	α-helix	trans	-60.3	-45.6	179.5	-68	167	0	0	0	110.9	Q674 Y675 V680 V681 I682	Q674-I678 HydrophobicContact CG-CD1 3.92Å; Q674-I678 WeakPolarHBondContact O-CG1 3.03Å; Q674-I678 PolarHBondContact O-N 3.2Å; Y675-I678 HydrophobicContact CD1-CD1 4.4Å; Y675-I678 PolarHBondContact O-N 2.95Å; I678-V680 VanDerWaalsContact C-N 3.33Å; I678-V680 PolarHBondContact O-N 2.93Å; I678-V681 PolarHBondContact O-N 2.85Å; I678-I682 HydrophobicContact CG2-CD1 3.65Å; I678-I682 HydrophobicContact CG2-CG1 4.26Å; I678-I682 VanDerWaalsContact O-CG1 3.28Å; I678-I682 WeakPolarHBondContact O-CG1 3.14Å; I678-I682 PolarHBondContact O-N 3.38Å
679	V	83.9	Confident	79.3	Confident	11 Å²	11	51.7 Å²	51.7	7%	0.067	27%	0.266	C	S	.	.	H	α-helix	trans	-62.8	-40.5	179.7	170.3	0	0	0	0	111.2	I641 L646 Y675 V677 I682 W683	I641-V679 HydrophobicContact CD1-CG2 3.82Å; L646-V679 HydrophobicContact CB-CG1 4.3Å; L646-V679 HydrophobicContact CD2-CG1 4.06Å; Y675-V679 WeakPolarHBondContact O-CB 3.4Å; Y675-V679 WeakPolarHBondContact O-CG2 3.45Å; Y675-V679 PolarHBondContact O-N 3.05Å; V677-V679 PolarHBondContact O-N 3.24Å; V679-I682 PolarHBondContact O-N 3.08Å; V679-W683 WeakPolarHBondContact O-CB 3.38Å; V679-W683 PolarHBondContact O-N 3.36Å
680	V	84.1	Confident	80.1	Confident	13 Å²	13	55.1 Å²	55.1	8%	0.079	28%	0.281	C	S	.	.	H	α-helix	trans	-64.9	-41.7	175.3	171.3	0	0	0	0	111.4	Y579 L646 D676 V677 I678 W683 F684	Y579-V680 HydrophobicContact CE2-CG1 3.83Å; L646-V680 HydrophobicContact CD1-CG2 4.47Å; D676-V680 VanDerWaalsContact O-CG2 3.28Å; D676-V680 WeakPolarHBondContact O-CG2 3.3Å; D676-V680 PolarHBondContact O-N 2.82Å; D676-V680 VanDerWaalsContact O-N 3.13Å; V677-V680 PolarHBondContact O-N 3.31Å; I678-V680 VanDerWaalsContact C-N 3.33Å; I678-V680 PolarHBondContact O-N 2.93Å; V680-W683 WeakPolarHBondContact O-CB 2.92Å; V680-W683 PolarHBondContact O-N 2.85Å; V680-F684 HydrophobicContact CG1-CD2 3.82Å; V680-F684 HydrophobicContact CG1-CE2 3.72Å; V680-F684 VanDerWaalsContact O-CD2 3.29Å; V680-F684 WeakPolarHBondContact O-CD2 3.35Å; V680-F684 PolarHBondContact O-N 3.13Å
681	V	86.2	Confident	80.7	Confident	80 Å²	80	53.4 Å²	53.4	49%	0.485	27%	0.273	S	S	.	.	H	α-helix	trans	-63.8	-46.4	176.5	171.7	0	0	0	0	111	V677 I678 W683 F684 V685	V677-V681 HydrophobicContact CG1-CG2 4.42Å; V677-V681 WeakPolarHBondContact O-CG2 3.42Å; V677-V681 PolarHBondContact O-N 3.27Å; I678-V681 PolarHBondContact O-N 2.85Å; V681-W683 VanDerWaalsContact C-N 3.28Å; V681-W683 PolarHBondContact O-N 3.38Å; V681-F684 PolarHBondContact O-N 2.63Å; V681-V685 HydrophobicContact CG1-CG2 4.15Å; V681-V685 WeakPolarHBondContact O-CB 3.35Å; V681-V685 VanDerWaalsContact O-CG2 3.31Å; V681-V685 WeakPolarHBondContact O-CG2 3.5Å; V681-V685 PolarHBondContact O-N 2.76Å
682	I	87.6	Confident	81.3	Confident	77 Å²	77	54.5 Å²	54.5	40%	0.395	29%	0.285	S	S	.	.	H	α-helix	trans	-57.6	-44.9	175.5	-69.3	169	0	0	0	109.9	L633 I678 V679 F684 V685 S686	L633-I682 HydrophobicContact CD1-CG2 4.31Å; L633-I682 HydrophobicContact CD2-CG2 4.28Å; I678-I682 HydrophobicContact CG2-CD1 3.65Å; I678-I682 HydrophobicContact CG2-CG1 4.26Å; I678-I682 VanDerWaalsContact O-CG1 3.28Å; I678-I682 WeakPolarHBondContact O-CG1 3.14Å; I678-I682 PolarHBondContact O-N 3.38Å; V679-I682 PolarHBondContact O-N 3.08Å; I682-F684 PolarHBondContact O-N 3Å; I682-V685 PolarHBondContact O-N 2.81Å; I682-S686 WeakPolarHBondContact O-CB 3.49Å; I682-S686 PolarHBondContact O-N 2.88Å; I682-S686 PolarHBondContact O-OG 2.92Å
683	W	88.4	Confident	81.7	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-56	-51.7	177.5	174.1	42.8	0	0	0	112.5	I575 L576 Y579 L626 Y630 L633 L646 V679 V680 V681 S687	I575-W683 HydrophobicContact CG2-CH2 3.67Å; I575-W683 HydrophobicContact CG2-CZ2 3.65Å; L576-W683 HydrophobicContact CD2-CH2 4.48Å; Y579-W683 HydrophobicContact CD2-CZ3 4.43Å; Y579-W683 HydrophobicContact CG-CZ3 4.37Å; L626-W683 HydrophobicContact CD2-CZ2 4.16Å; L626-W683 PolarHBondContact O-NE1 3.01Å; Y630-W683 HydrophobicContact CD2-CD2 4.42Å; Y630-W683 AromaticContact CD2-CE2 3.98Å; Y630-W683 HydrophobicContact CD2-CH2 4.34Å; Y630-W683 AromaticContact CD2-CZ2 3.94Å; Y630-W683 HydrophobicContact CD2-CZ2 3.94Å; Y630-W683 HydrophobicContact CG-CZ2 4.45Å; L633-W683 VanDerWaalsContact CD1-CA 3.42Å; L633-W683 HydrophobicContact CD1-CB 3.45Å; L633-W683 VanDerWaalsContact CD1-CB 3.45Å; L633-W683 HydrophobicContact CD1-CG 4.16Å; L646-W683 HydrophobicContact CD1-CD2 4.44Å; L646-W683 HydrophobicContact CD1-CE3 4.14Å; V679-W683 WeakPolarHBondContact O-CB 3.38Å; V679-W683 PolarHBondContact O-N 3.36Å; V680-W683 WeakPolarHBondContact O-CB 2.92Å; V680-W683 PolarHBondContact O-N 2.85Å; V681-W683 VanDerWaalsContact C-N 3.28Å; V681-W683 PolarHBondContact O-N 3.38Å; W683-S687 VanDerWaalsContact O-CB 3.23Å; W683-S687 WeakPolarHBondContact O-CB 3.45Å; W683-S687 PolarHBondContact O-N 3.5Å; W683-S687 PolarHBondContact O-OG 2.72Å
684	F	87	Confident	82	Confident	57 Å²	57	53.7 Å²	53.7	25%	0.25	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-47.7	179.9	-81.2	-69	0	0	0	112.3	L576 Y579 V680 V681 I682 S687 I688	L576-F684 HydrophobicContact CD2-CE1 3.96Å; L576-F684 HydrophobicContact CD2-CZ 4.36Å; Y579-F684 HydrophobicContact CD1-CE2 4.2Å; Y579-F684 AromaticContact CD1-CZ 3.83Å; Y579-F684 HydrophobicContact CD1-CZ 3.83Å; Y579-F684 AromaticContact CE1-CE2 3.74Å; Y579-F684 HydrophobicContact CE1-CE2 3.74Å; Y579-F684 AromaticContact CE1-CZ 3.73Å; Y579-F684 HydrophobicContact CE1-CZ 3.73Å; Y579-F684 HydrophobicContact CE2-CE2 4.45Å; Y579-F684 HydrophobicContact CG-CZ 4.49Å; Y579-F684 AromaticContact CZ-CE2 3.88Å; V680-F684 HydrophobicContact CG1-CD2 3.82Å; V680-F684 HydrophobicContact CG1-CE2 3.72Å; V680-F684 VanDerWaalsContact O-CD2 3.29Å; V680-F684 WeakPolarHBondContact O-CD2 3.35Å; V680-F684 PolarHBondContact O-N 3.13Å; V681-F684 PolarHBondContact O-N 2.63Å; I682-F684 PolarHBondContact O-N 3Å; F684-S687 PolarHBondContact O-N 3.36Å; F684-I688 VanDerWaalsContact O-CG1 3.3Å; F684-I688 WeakPolarHBondContact O-CG1 3.45Å; F684-I688 PolarHBondContact O-N 2.94Å
685	V	87.7	Confident	82	Confident	80 Å²	80	50 Å²	50	49%	0.485	27%	0.271	S	S	.	.	H	α-helix	trans	-64.5	-47.7	-177.6	174.2	0	0	0	0	111.1	V681 I682 S687 I688 C689	V681-V685 HydrophobicContact CG1-CG2 4.15Å; V681-V685 WeakPolarHBondContact O-CB 3.35Å; V681-V685 VanDerWaalsContact O-CG2 3.31Å; V681-V685 WeakPolarHBondContact O-CG2 3.5Å; V681-V685 PolarHBondContact O-N 2.76Å; I682-V685 PolarHBondContact O-N 2.81Å; V685-S687 VanDerWaalsContact C-N 3.3Å; V685-S687 PolarHBondContact O-N 3.01Å; V685-I688 PolarHBondContact O-N 3.45Å; V685-C689 PolarHBondContact O-N 2.84Å; V685-C689 PolarHBondContact O-SG 3.35Å; V685-C689 VanDerWaalsContact O-SG 3.35Å
686	S	84.8	Confident	82.1	Confident	31 Å²	31	47.6 Å²	47.6	22%	0.217	27%	0.272	C	S	.	.	H	α-helix	trans	-60.7	-41.8	176.4	-63.5	0	0	0	0	111.2	I682 I688 C689 F690	I682-S686 WeakPolarHBondContact O-CB 3.49Å; I682-S686 PolarHBondContact O-N 2.88Å; I682-S686 PolarHBondContact O-OG 2.92Å; S686-I688 VanDerWaalsContact C-N 3.33Å; S686-I688 PolarHBondContact O-N 3.44Å; S686-C689 PolarHBondContact O-N 3.27Å; S686-F690 WeakPolarHBondContact O-CB 3.08Å; S686-F690 VanDerWaalsContact O-CD2 3.3Å; S686-F690 WeakPolarHBondContact O-CD2 3.48Å; S686-F690 PolarHBondContact O-N 3.11Å
687	S	86.8	Confident	81.9	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.007	29%	0.289	C	S	.	.	H	α-helix	trans	-64.5	-36.6	179.2	-59.2	0	0	0	0	113	L626 W683 F684 V685 G691	L626-S687 WeakPolarHBondContact CA-OG 3.34Å; W683-S687 VanDerWaalsContact O-CB 3.23Å; W683-S687 WeakPolarHBondContact O-CB 3.45Å; W683-S687 PolarHBondContact O-N 3.5Å; W683-S687 PolarHBondContact O-OG 2.72Å; F684-S687 PolarHBondContact O-N 3.36Å; V685-S687 VanDerWaalsContact C-N 3.3Å; V685-S687 PolarHBondContact O-N 3.01Å; S687-G691 WeakPolarHBondContact O-CA 3.44Å; S687-G691 PolarHBondContact O-N 3.32Å
688	I	85.5	Confident	81.4	Confident	107 Å²	107	47.5 Å²	47.5	55%	0.549	27%	0.268	S	S	.	.	H	α-helix	trans	-68.6	-47.1	175.2	-67.6	164.9	0	0	0	110.7	F684 V685 S686 G691 S692	F684-I688 VanDerWaalsContact O-CG1 3.3Å; F684-I688 WeakPolarHBondContact O-CG1 3.45Å; F684-I688 PolarHBondContact O-N 2.94Å; V685-I688 PolarHBondContact O-N 3.45Å; S686-I688 VanDerWaalsContact C-N 3.33Å; S686-I688 PolarHBondContact O-N 3.44Å; I688-G691 PolarHBondContact O-N 2.9Å; I688-S692 WeakPolarHBondContact O-CB 3.43Å; I688-S692 PolarHBondContact O-N 2.79Å; I688-S692 PolarHBondContact O-OG 3.09Å
689	C	84.6	Confident	80.9	Confident	70 Å²	70	53.2 Å²	53.2	47%	0.473	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-46.3	-179.7	-70.2	0	0	0	0	112.5	V685 S686 S692 L693	V685-C689 PolarHBondContact O-N 2.84Å; V685-C689 PolarHBondContact O-SG 3.35Å; V685-C689 VanDerWaalsContact O-SG 3.35Å; S686-C689 PolarHBondContact O-N 3.27Å; C689-S692 PolarHBondContact O-OG 3.46Å; C689-L693 WeakPolarHBondContact O-CB 3.24Å; C689-L693 PolarHBondContact O-N 3.5Å
690	F	80.4	Confident	80.1	Confident	77 Å²	77	58.3 Å²	58.3	34%	0.338	31%	0.312	S	S	.	.	H	α-helix	trans	-76.5	-32.3	178.6	-80.2	-86.8	0	0	0	112.4	T354 A625 F629 S686 S692 L693 A694	T354-F690 HydrophobicContact CG2-CE1 4.4Å; A625-F690 HydrophobicContact CB-CB 4.32Å; F629-F690 HydrophobicContact CD2-CB 4.41Å; F629-F690 HydrophobicContact CD2-CD2 4.49Å; F629-F690 HydrophobicContact CE1-CD2 4.1Å; F629-F690 HydrophobicContact CE1-CE2 4.08Å; F629-F690 HydrophobicContact CE2-CB 3.45Å; F629-F690 VanDerWaalsContact CE2-CB 3.45Å; F629-F690 HydrophobicContact CE2-CD1 4.18Å; F629-F690 AromaticContact CE2-CD2 3.38Å; F629-F690 HydrophobicContact CE2-CD2 3.38Å; F629-F690 HydrophobicContact CE2-CE2 4.12Å; F629-F690 AromaticContact CE2-CG 3.4Å; F629-F690 HydrophobicContact CE2-CG 3.4Å; F629-F690 HydrophobicContact CZ-CB 4.08Å; F629-F690 HydrophobicContact CZ-CD1 4.02Å; F629-F690 AromaticContact CZ-CD2 3.12Å; F629-F690 HydrophobicContact CZ-CD2 3.12Å; F629-F690 HydrophobicContact CZ-CE1 4.23Å; F629-F690 AromaticContact CZ-CE2 3.38Å; F629-F690 HydrophobicContact CZ-CE2 3.38Å; F629-F690 AromaticContact CZ-CG 3.47Å; F629-F690 HydrophobicContact CZ-CG 3.47Å; F629-F690 VanDerWaalsContact CZ-CG 3.47Å; F629-F690 AromaticContact CZ-CZ 3.93Å; F629-F690 HydrophobicContact CZ-CZ 3.93Å; S686-F690 WeakPolarHBondContact O-CB 3.08Å; S686-F690 VanDerWaalsContact O-CD2 3.3Å; S686-F690 WeakPolarHBondContact O-CD2 3.48Å; S686-F690 PolarHBondContact O-N 3.11Å; F690-S692 VanDerWaalsContact C-N 3.33Å; F690-L693 PolarHBondContact O-N 3.26Å; F690-A694 WeakPolarHBondContact O-CB 3.46Å; F690-A694 PolarHBondContact O-N 3.1Å
691	G	79.9	Confident	79.4	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-61	-42.1	171.4	0	0	0	0	0	112	S687 I688 L695	S687-G691 WeakPolarHBondContact O-CA 3.44Å; S687-G691 PolarHBondContact O-N 3.32Å; I688-G691 PolarHBondContact O-N 2.9Å; G691-L695 WeakPolarHBondContact O-CD1 3.48Å; G691-L695 VanDerWaalsContact O-CG 3.27Å; G691-L695 WeakPolarHBondContact O-CG 3.28Å; G691-L695 PolarHBondContact O-N 2.86Å
692	S	79.1	Confident	78.4	Confident	55 Å²	55	59.5 Å²	59.5	39%	0.385	31%	0.313	S	S	.	.	H	α-helix	trans	-69.1	-39.6	175.4	70.7	0	0	0	0	112.7	I688 C689 F690 L695 C696	I688-S692 WeakPolarHBondContact O-CB 3.43Å; I688-S692 PolarHBondContact O-N 2.79Å; I688-S692 PolarHBondContact O-OG 3.09Å; C689-S692 PolarHBondContact O-OG 3.46Å; F690-S692 VanDerWaalsContact C-N 3.33Å; S692-L695 WeakPolarHBondContact O-CB 3.49Å; S692-L695 PolarHBondContact O-N 2.82Å; S692-L695 VanDerWaalsContact O-N 3.14Å; S692-C696 PolarHBondContact O-N 3.11Å; S692-C696 PolarHBondContact O-SG 3Å
693	L	79.2	Confident	77.3	Confident	84 Å²	84	58.6 Å²	58.6	44%	0.44	32%	0.317	S	S	.	.	H	α-helix	trans	-62.2	-46	174.5	-168.2	159.4	0	0	0	111.5	C689 F690 L695 C696 L697	C689-L693 WeakPolarHBondContact O-CB 3.24Å; C689-L693 PolarHBondContact O-N 3.5Å; F690-L693 PolarHBondContact O-N 3.26Å; L693-L695 PolarHBondContact O-N 2.88Å; L693-C696 WeakPolarHBondContact O-CB 3.21Å; L693-C696 PolarHBondContact O-N 2.95Å; L693-C696 VanDerWaalsContact O-N 3.11Å; L693-L697 HydrophobicContact CD2-CD1 3.43Å; L693-L697 VanDerWaalsContact CD2-CD1 3.43Å; L693-L697 HydrophobicContact CD2-CG 3.95Å; L693-L697 PolarHBondContact O-N 3.21Å
694	A	73.8	Confident	75.9	Confident	8 Å²	8	66.5 Å²	66.5	7%	0.066	35%	0.346	C	S	.	.	H	α-helix	trans	-56.8	-34.1	175.7	0	0	0	0	0	111.5	F690 L697 I698	F690-A694 WeakPolarHBondContact O-CB 3.46Å; F690-A694 PolarHBondContact O-N 3.1Å; A694-L697 PolarHBondContact O-N 3.47Å; A694-I698 WeakPolarHBondContact O-CB 3.31Å; A694-I698 WeakPolarHBondContact O-CD1 3.39Å; A694-I698 WeakPolarHBondContact O-CG1 3.46Å; A694-I698 PolarHBondContact O-N 3.23Å
695	L	72.9	Confident	74.5	Confident	19 Å²	19	67.8 Å²	67.8	10%	0.099	35%	0.353	C	S	.	.	H	α-helix	trans	-71.1	-43	175.7	-69.4	163.1	0	0	0	113.8	N617 F618 G691 S692 L693 L697 I698 R699	N617-L695 VanDerWaalsContact C-CD2 3.41Å; N617-L695 HydrophobicContact CB-CD2 4.34Å; N617-L695 VanDerWaalsContact O-CD2 3.26Å; N617-L695 WeakPolarHBondContact O-CD2 3.16Å; F618-L695 HydrophobicContact CB-CD1 4.16Å; F618-L695 HydrophobicContact CB-CD2 4.25Å; F618-L695 HydrophobicContact CD2-CD1 3.13Å; F618-L695 HydrophobicContact CD2-CG 4.45Å; F618-L695 HydrophobicContact CE2-CD1 3.73Å; F618-L695 HydrophobicContact CG-CD1 3.93Å; G691-L695 WeakPolarHBondContact O-CD1 3.48Å; G691-L695 VanDerWaalsContact O-CG 3.27Å; G691-L695 WeakPolarHBondContact O-CG 3.28Å; G691-L695 PolarHBondContact O-N 2.86Å; S692-L695 WeakPolarHBondContact O-CB 3.49Å; S692-L695 PolarHBondContact O-N 2.82Å; S692-L695 VanDerWaalsContact O-N 3.14Å; L693-L695 PolarHBondContact O-N 2.88Å; L695-L697 PolarHBondContact O-N 3.23Å; L695-I698 PolarHBondContact O-N 2.88Å; L695-R699 WeakPolarHBondContact O-CB 3.43Å; L695-R699 WeakPolarHBondContact O-CG 3.41Å; L695-R699 PolarHBondContact O-N 3.47Å
696	C	74.9	Confident	72.9	Confident	77 Å²	77	68.9 Å²	68.9	52%	0.52	36%	0.356	S	S	.	.	H	α-helix	trans	-56.5	-44.5	173.7	-68.6	0	0	0	0	110	S692 L693 R699 L700	S692-C696 PolarHBondContact O-N 3.11Å; S692-C696 PolarHBondContact O-SG 3Å; L693-C696 WeakPolarHBondContact O-CB 3.21Å; L693-C696 PolarHBondContact O-N 2.95Å; L693-C696 VanDerWaalsContact O-N 3.11Å; C696-R699 PolarHBondContact O-N 3.15Å; C696-L700 WeakPolarHBondContact O-CB 3.3Å; C696-L700 VanDerWaalsContact O-CG 3.24Å; C696-L700 WeakPolarHBondContact O-CG 3.49Å; C696-L700 PolarHBondContact O-N 3.4Å
697	L	71.6	Confident	71.4	Confident	70 Å²	70	69.8 Å²	69.8	37%	0.366	36%	0.362	S	S	.	.	H	α-helix	trans	-68.4	-41	178.7	-67.6	178.2	0	0	0	113.5	C356 L693 A694 L695 R699 L700 Q701	C356-L697 HydrophobicContact CB-CD1 3.97Å; C356-L697 WeakPolarHBondContact SG-CD1 3.48Å; L693-L697 HydrophobicContact CD2-CD1 3.43Å; L693-L697 VanDerWaalsContact CD2-CD1 3.43Å; L693-L697 HydrophobicContact CD2-CG 3.95Å; L693-L697 PolarHBondContact O-N 3.21Å; A694-L697 PolarHBondContact O-N 3.47Å; L695-L697 PolarHBondContact O-N 3.23Å; L697-R699 VanDerWaalsContact C-N 3.33Å; L697-R699 PolarHBondContact O-N 2.9Å; L697-L700 HydrophobicContact CD2-CD1 4.49Å; L697-L700 PolarHBondContact O-N 3.38Å; L697-Q701 PolarHBondContact O-N 2.77Å
698	I	69.4	Low	69.7	Low	10 Å²	10	73.8 Å²	73.8	5%	0.051	38%	0.381	C	S	.	.	H	α-helix	trans	-62.3	-43.1	174.9	-70.8	163.8	0	0	0	110.1	F620 A694 L695 Q701 D702	F620-I698 HydrophobicContact CD1-CD1 4Å; F620-I698 HydrophobicContact CE1-CD1 4.38Å; A694-I698 WeakPolarHBondContact O-CB 3.31Å; A694-I698 WeakPolarHBondContact O-CD1 3.39Å; A694-I698 WeakPolarHBondContact O-CG1 3.46Å; A694-I698 PolarHBondContact O-N 3.23Å; L695-I698 PolarHBondContact O-N 2.88Å; I698-Q701 PolarHBondContact O-N 3.21Å; I698-D702 WeakPolarHBondContact O-CB 3.49Å; I698-D702 PolarHBondContact O-N 2.95Å
699	R	70.6	Confident	67.9	Low	189 Å²	189	70.1 Å²	70.1	71%	0.713	37%	0.366	S	S	*	.	H	α-helix	trans	-65.6	-40.7	177.7	-76.1	-173.9	177.1	-170.8	0.9	112.6	L695 C696 L697 Q701 D702 A703	L695-R699 WeakPolarHBondContact O-CB 3.43Å; L695-R699 WeakPolarHBondContact O-CG 3.41Å; L695-R699 PolarHBondContact O-N 3.47Å; C696-R699 PolarHBondContact O-N 3.15Å; L697-R699 VanDerWaalsContact C-N 3.33Å; L697-R699 PolarHBondContact O-N 2.9Å; R699-Q701 VanDerWaalsContact C-N 3.31Å; R699-D702 PolarHBondContact O-N 3.33Å; R699-A703 WeakPolarHBondContact O-CB 3.45Å; R699-A703 PolarHBondContact O-N 3.44Å
700	L	67.8	Low	66.4	Low	118 Å²	118	72.3 Å²	72.3	62%	0.618	37%	0.37	S	S	*	.	H	α-helix	trans	-63.5	-39.2	176.3	-75	169.6	0	0	0	111.4	C696 L697 A703 R704	C696-L700 WeakPolarHBondContact O-CB 3.3Å; C696-L700 VanDerWaalsContact O-CG 3.24Å; C696-L700 WeakPolarHBondContact O-CG 3.49Å; C696-L700 PolarHBondContact O-N 3.4Å; L697-L700 HydrophobicContact CD2-CD1 4.49Å; L697-L700 PolarHBondContact O-N 3.38Å; L700-A703 PolarHBondContact O-N 3.28Å; L700-R704 PolarHBondContact O-N 3.19Å
701	Q	69	Low	64.6	Low	69 Å²	69	73.9 Å²	73.9	32%	0.322	38%	0.381	S	S	.	.	H	α-helix	trans	-71.7	-43.1	176.2	-175.8	168	-25.2	0	0	112.4	N357 L697 I698 R699 A703 R704 E705	N357-Q701 PolarHBondContact ND2-NE2 3.4Å; N357-Q701 PolarHBondContact ND2-OE1 2.88Å; L697-Q701 PolarHBondContact O-N 2.77Å; I698-Q701 PolarHBondContact O-N 3.21Å; R699-Q701 VanDerWaalsContact C-N 3.31Å; Q701-A703 PolarHBondContact O-N 2.94Å; Q701-R704 PolarHBondContact O-N 2.72Å; Q701-E705 HydrophobicContact CG-CG 4.32Å; Q701-E705 PolarHBondContact NE2-OE1 2.83Å; Q701-E705 PolarHBondContact O-N 2.79Å
702	D	65.8	Low	62.8	Low	49 Å²	49	81.7 Å²	81.7	26%	0.262	41%	0.412	S	S	.	.	H	α-helix	trans	-57.3	-38	175.2	-75.2	-14.8	0	0	0	110.2	I698 R699 L706	I698-D702 WeakPolarHBondContact O-CB 3.49Å; I698-D702 PolarHBondContact O-N 2.95Å; R699-D702 PolarHBondContact O-N 3.33Å; D702-L706 WeakPolarHBondContact O-CB 3.45Å; D702-L706 PolarHBondContact O-N 3.5Å; D702-L706 VanDerWaalsContact O-N 3.13Å
703	A	64.6	Low	60.7	Low	58 Å²	58	85.3 Å²	85.3	48%	0.479	42%	0.423	S	S	.	.	H	α-helix	trans	-66.8	-41.5	174.3	0	0	0	0	0	112.8	R699 L700 Q701 L706 S707	R699-A703 WeakPolarHBondContact O-CB 3.45Å; R699-A703 PolarHBondContact O-N 3.44Å; L700-A703 PolarHBondContact O-N 3.28Å; Q701-A703 PolarHBondContact O-N 2.94Å; A703-L706 PolarHBondContact O-N 3.47Å; A703-S707 PolarHBondContact O-N 3.41Å; A703-S707 PolarHBondContact O-OG 3.11Å
704	R	58.5	Low	58.9	Low	167 Å²	167	85.4 Å²	85.4	63%	0.63	43%	0.427	S	S	*	.	H	α-helix	trans	-63.9	-47.4	177	-176.4	179.3	176.6	163.8	6.6	112	L700 Q701 L706 S707 E708	L700-R704 PolarHBondContact O-N 3.19Å; Q701-R704 PolarHBondContact O-N 2.72Å; R704-L706 PolarHBondContact O-N 3.41Å; R704-S707 WeakPolarHBondContact CA-OG 3.39Å; R704-S707 PolarHBondContact O-N 2.93Å; R704-S707 PolarHBondContact O-OG 2.95Å; R704-E708 IonicContact CZ-OE1 3.58Å; R704-E708 IonicContact NE-OE1 2.71Å; R704-E708 PolarHBondContact NE-OE1 3.27Å; R704-E708 IonicContact NH2-OE1 2.95Å; R704-E708 WeakPolarHBondContact O-CG 3.32Å; R704-E708 PolarHBondContact O-N 3.24Å
705	E	57.5	Low	57.4	Low	85 Å²	85	88.1 Å²	88.1	40%	0.397	45%	0.445	S	S	.	.	H	α-helix	trans	-60.3	-37.4	177.3	-71.7	-178.1	-165.2	0	0	111.1	Q701 A709	Q701-E705 HydrophobicContact CG-CG 4.32Å; Q701-E705 PolarHBondContact NE2-OE1 2.83Å; Q701-E705 PolarHBondContact O-N 2.79Å; E705-A709 WeakPolarHBondContact O-CB 3.45Å; E705-A709 PolarHBondContact O-N 2.95Å
706	L	54.3	Low	55.5	Low	102 Å²	102	93.7 Å²	93.7	53%	0.534	47%	0.47	S	S	.	.	H	α-helix	trans	-68.9	-41.5	176	-158	108.4	0	0	0	112.3	D702 A703 R704 E708 A709 Q710	D702-L706 WeakPolarHBondContact O-CB 3.45Å; D702-L706 PolarHBondContact O-N 3.5Å; D702-L706 VanDerWaalsContact O-N 3.13Å; A703-L706 PolarHBondContact O-N 3.47Å; R704-L706 PolarHBondContact O-N 3.41Å; L706-E708 VanDerWaalsContact C-N 3.35Å; L706-A709 PolarHBondContact O-N 3.25Å; L706-Q710 WeakPolarHBondContact O-CG 3.47Å; L706-Q710 PolarHBondContact O-N 3.29Å
707	S	54.1	Low	53.8	Low	50 Å²	50	94.6 Å²	94.6	35%	0.35	48%	0.477	S	S	.	.	H	α-helix	trans	-65	-38.6	176.2	63.5	0	0	0	0	112.4	A703 R704 Q710 N711	A703-S707 PolarHBondContact O-N 3.41Å; A703-S707 PolarHBondContact O-OG 3.11Å; R704-S707 WeakPolarHBondContact CA-OG 3.39Å; R704-S707 PolarHBondContact O-N 2.93Å; R704-S707 PolarHBondContact O-OG 2.95Å; S707-Q710 PolarHBondContact O-N 2.8Å; S707-N711 PolarHBondContact O-N 2.64Å
708	E	50.9	Low	51.9	Low	86 Å²	86	99.8 Å²	99.8	40%	0.402	50%	0.497	S	S	.	.	H	α-helix	trans	-64.7	-43.4	175.5	-72.8	175.5	-167.2	0	0	109.9	R704 L706 Q710 N711 Y712	R704-E708 IonicContact CZ-OE1 3.58Å; R704-E708 IonicContact NE-OE1 2.71Å; R704-E708 PolarHBondContact NE-OE1 3.27Å; R704-E708 IonicContact NH2-OE1 2.95Å; R704-E708 WeakPolarHBondContact O-CG 3.32Å; R704-E708 PolarHBondContact O-N 3.24Å; L706-E708 VanDerWaalsContact C-N 3.35Å; E708-Q710 PolarHBondContact O-N 2.97Å; E708-N711 PolarHBondContact O-N 3.25Å; E708-Y712 WeakPolarHBondContact O-CD2 3.31Å; E708-Y712 PolarHBondContact O-N 3.14Å; E708-Y712 VanDerWaalsContact O-N 3.12Å
709	A	48	Very low	50.1	Low	29 Å²	29	106.3 Å²	106.3	24%	0.24	53%	0.527	C	S	.	.	H	α-helix	trans	-61.9	-38.7	175.4	0	0	0	0	0	113.3	E705 L706 Y712 H713	E705-A709 WeakPolarHBondContact O-CB 3.45Å; E705-A709 PolarHBondContact O-N 2.95Å; L706-A709 PolarHBondContact O-N 3.25Å; A709-Y712 PolarHBondContact O-N 2.85Å; A709-H713 PolarHBondContact O-N 2.98Å
710	Q	51.3	Low	48.1	Very low	117 Å²	117	102.3 Å²	102.3	55%	0.547	53%	0.528	S	S	.	.	H	α-helix	trans	-66	-40.2	175.3	-75.3	179.4	-25.9	0	0	112.2	L706 S707 E708 Y712 H713 T714	L706-Q710 WeakPolarHBondContact O-CG 3.47Å; L706-Q710 PolarHBondContact O-N 3.29Å; S707-Q710 PolarHBondContact O-N 2.8Å; E708-Q710 PolarHBondContact O-N 2.97Å; Q710-Y712 VanDerWaalsContact C-N 3.3Å; Q710-Y712 PolarHBondContact O-N 3.02Å; Q710-H713 WeakPolarHBondContact O-CB 3.06Å; Q710-H713 PolarHBondContact O-N 2.92Å; Q710-H713 VanDerWaalsContact O-N 3.12Å; Q710-T714 PolarHBondContact O-N 2.78Å; Q710-T714 VanDerWaalsContact O-N 3.15Å; Q710-T714 PolarHBondContact O-OG1 3.41Å
711	N	44	Very low	46.3	Very low	109 Å²	109	107.7 Å²	107.7	58%	0.583	54%	0.542	S	S	*	.	H	α-helix	trans	-65.7	-30.7	176.8	-72.8	-14.7	0	0	0	112.9	S707 E708 T714 S715	S707-N711 PolarHBondContact O-N 2.64Å; E708-N711 PolarHBondContact O-N 3.25Å; N711-T714 PolarHBondContact O-OG1 3.49Å; N711-T714 VanDerWaalsContact O-OG1 3.11Å; N711-S715 PolarHBondContact O-N 2.82Å; N711-S715 PolarHBondContact O-OG 2.82Å
712	Y	41.3	Very low	44.4	Very low	165 Å²	165	110.3 Å²	110.3	65%	0.647	56%	0.563	S	S	*	*	H	α-helix	trans	-71.3	-32.2	171.5	-79.1	-73.1	0	0	0	112.8	E708 A709 Q710 S715 H716	E708-Y712 WeakPolarHBondContact O-CD2 3.31Å; E708-Y712 PolarHBondContact O-N 3.14Å; E708-Y712 VanDerWaalsContact O-N 3.12Å; A709-Y712 PolarHBondContact O-N 2.85Å; Q710-Y712 VanDerWaalsContact C-N 3.3Å; Q710-Y712 PolarHBondContact O-N 3.02Å; Y712-S715 PolarHBondContact O-OG 2.84Å; Y712-S715 VanDerWaalsContact O-OG 3.13Å; Y712-H716 PolarHBondContact O-N 2.85Å
713	H	35.5	Very low	42.4	Very low	131 Å²	131	114.8 Å²	114.8	61%	0.606	59%	0.587	S	S	*	*	H	α-helix	trans	-67.3	-40.3	175.2	-101.2	-74.3	0	0	0	112.4	A709 Q710 S717	A709-H713 PolarHBondContact O-N 2.98Å; Q710-H713 WeakPolarHBondContact O-CB 3.06Å; Q710-H713 PolarHBondContact O-N 2.92Å; Q710-H713 VanDerWaalsContact O-N 3.12Å; H713-S717 PolarHBondContact O-N 2.77Å; H713-S717 VanDerWaalsContact O-N 3.15Å; H713-S717 PolarHBondContact O-OG 3.47Å
714	T	42.2	Very low	40.8	Very low	86 Å²	86	118.1 Å²	118.1	53%	0.528	60%	0.601	S	S	.	*	H	α-helix	trans	-74.7	-30.6	-179.5	51.8	0	0	0	0	113.1	Q710 N711 S717	Q710-T714 PolarHBondContact O-N 2.78Å; Q710-T714 VanDerWaalsContact O-N 3.15Å; Q710-T714 PolarHBondContact O-OG1 3.41Å; N711-T714 PolarHBondContact O-OG1 3.49Å; N711-T714 VanDerWaalsContact O-OG1 3.11Å; T714-S717 PolarHBondContact O-OG 3.43Å
715	S	41.4	Very low	39.2	Very low	65 Å²	65	116.2 Å²	116.2	46%	0.455	60%	0.603	S	S	.	*	H	α-helix	trans	-72	-37.5	175.6	63	0	0	0	0	112.4	N711 Y712	N711-S715 PolarHBondContact O-N 2.82Å; N711-S715 PolarHBondContact O-OG 2.82Å; Y712-S715 PolarHBondContact O-OG 2.84Å; Y712-S715 VanDerWaalsContact O-OG 3.13Å
716	H	33.9	Very low	37.7	Very low	136 Å²	136	116.4 Å²	116.4	63%	0.63	62%	0.619	S	S	*	*	H	α-helix	trans	-78.4	-24.9	177.2	-95.6	-68.6	0	0	0	114.5	Y712 K718 H719	Y712-H716 PolarHBondContact O-N 2.85Å; H716-K718 PolarHBondContact O-N 2.85Å; H716-H719 PolarHBondContact O-N 3.5Å
717	S	37.3	Very low	36.3	Very low	95 Å²	95	119.3 Å²	119.3	66%	0.664	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-12.5	174.7	68.1	0	0	0	0	113.7	H713 T714	H713-S717 PolarHBondContact O-N 2.77Å; H713-S717 VanDerWaalsContact O-N 3.15Å; H713-S717 PolarHBondContact O-OG 3.47Å; T714-S717 PolarHBondContact O-OG 3.43Å
718	K	33	Very low	34.9	Very low	179 Å²	179	123.1 Å²	123.1	78%	0.778	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-2.2	176	-101.2	-174.6	178.1	-175.8	0	114.2	H716 S720	H716-K718 PolarHBondContact O-N 2.85Å; K718-S720 VanDerWaalsContact C-N 3.28Å; K718-S720 PolarHBondContact O-N 3.11Å; K718-S720 VanDerWaalsContact O-N 3.11Å
719	H	30.8	Very low	33.7	Very low	148 Å²	148	124.8 Å²	124.8	69%	0.685	67%	0.668	S	S	*	*	S	Bend	trans	-82.9	85.1	162.9	-75.1	5.8	0	0	0	108	H716 Y721	H716-H719 PolarHBondContact O-N 3.5Å; H719-Y721 PolarHBondContact O-N 3.17Å; H719-Y721 VanDerWaalsContact O-N 3.07Å
720	S	28.4	Very low	32.6	Very low	105 Å²	105	128.1 Å²	128.1	73%	0.734	69%	0.689	S	S	*	*			trans	-43.6	118.6	159.8	-75.2	0	0	0	0	107.3	K718 T722	K718-S720 VanDerWaalsContact C-N 3.28Å; K718-S720 PolarHBondContact O-N 3.11Å; K718-S720 VanDerWaalsContact O-N 3.11Å; S720-T722 PolarHBondContact O-N 2.81Å
721	Y	30.8	Very low	31.4	Very low	230 Å²	230	130 Å²	130	90%	0.902	70%	0.703	S	S	*	*			trans	-51.5	96.8	163	-82.8	-99.8	0	0	0	106.5	H719 N723	H719-Y721 PolarHBondContact O-N 3.17Å; H719-Y721 VanDerWaalsContact O-N 3.07Å; Y721-N723 PolarHBondContact O-N 2.82Å
722	T	28.3	Very low	30.5	Very low	124 Å²	124	130.1 Å²	130.1	76%	0.761	71%	0.712	S	S	*	*			trans	-61.1	102.5	163.8	6.2	0	0	0	0	104	S720 T724	S720-T722 PolarHBondContact O-N 2.81Å; T722-T724 PolarHBondContact O-N 3.36Å
723	N	25.3	Very low	29.8	Very low	144 Å²	144	130.7 Å²	130.7	77%	0.77	73%	0.726	S	S	*	*			trans	-60.4	87.3	175.1	-144.6	10.1	0	0	0	105.8	Y721 N725	Y721-N723 PolarHBondContact O-N 2.82Å; N723-N725 PolarHBondContact O-N 3.43Å
724	T	29.3	Very low	29.3	Very low	127 Å²	127	131.2 Å²	131.2	78%	0.779	73%	0.732	S	S	*	*			trans	-69.5	92	171.9	36.7	0	0	0	0	105.3	T722 A726	T722-T724 PolarHBondContact O-N 3.36Å; T724-A726 VanDerWaalsContact C-N 3.34Å; T724-A726 PolarHBondContact O-N 2.88Å
725	N	25.7	Very low	28.6	Very low	127 Å²	127	133.9 Å²	133.9	68%	0.679	74%	0.743	S	S	*	*			trans	-49.1	103.7	169	-72.6	-23.6	0	0	0	107.3	N723 H727	N723-N725 PolarHBondContact O-N 3.43Å; N725-H727 PolarHBondContact O-N 3.31Å
726	A	26.2	Very low	27.8	Very low	89 Å²	89	139.9 Å²	139.9	74%	0.736	77%	0.768	S	S	*	*			trans	-68.6	75.8	174.5	0	0	0	0	0	108.2	T724 T728	T724-A726 VanDerWaalsContact C-N 3.34Å; T724-A726 PolarHBondContact O-N 2.88Å; A726-T728 PolarHBondContact O-N 2.83Å
727	H	25.4	Very low	27.3	Very low	163 Å²	163	135.6 Å²	135.6	76%	0.755	76%	0.761	S	S	*	*			trans	-71.3	92.6	159.3	-95.1	-64.8	0	0	0	107.2	N725 T729	N725-H727 PolarHBondContact O-N 3.31Å; H727-T729 PolarHBondContact O-N 2.95Å
728	T	24.6	Very low	26.6	Very low	131 Å²	131	139.1 Å²	139.1	80%	0.804	77%	0.767	S	S	*	*			trans	-63.4	84	163.7	29.5	0	0	0	0	108.2	A726	A726-T728 PolarHBondContact O-N 2.83Å
729	T	24.9	Very low	26.3	Very low	120 Å²	120	138.7 Å²	138.7	74%	0.736	77%	0.772	S	S	*	*			trans	-114.8	96.6	162.1	28.7	0	0	0	0	108.3	H727	H727-T729 PolarHBondContact O-N 2.95Å
730	S	25.4	Very low	25.9	Very low	100 Å²	100	140.5 Å²	140.5	70%	0.699	77%	0.773	S	S	*	*			trans	-34.5	130.2	160.3	49.5	0	0	0	0	113
731	N	25.5	Very low	25.9	Very low	156 Å²	156	141.3 Å²	141.3	83%	0.834	78%	0.775	S	S	*	*			trans	141.3	74.9	143	-70.6	-12.1	0	0	0	111.7
732	S	26.3	Very low	25.6	Very low	111 Å²	111	137.1 Å²	137.1	78%	0.776	77%	0.769	S	S	*	*			trans	-150.8	64.8	151.9	56.4	0	0	0	0	109.1	L734	S732-L734 PolarHBondContact O-N 3.11Å
733	L	25.3	Very low	25.4	Very low	177 Å²	177	136.2 Å²	136.2	93%	0.927	77%	0.767	S	S	*	*			trans	-73.6	75.1	162.7	-146.6	162.6	0	0	0	106.8
734	L	25.2	Very low	25.4	Very low	142 Å²	142	138 Å²	138	74%	0.743	77%	0.771	S	S	*	*			trans	-135.9	106.1	171.6	-95.8	166.3	0	0	0	108.9	S732	S732-L734 PolarHBondContact O-N 3.11Å
735	L	26.9	Very low	25.1	Very low	143 Å²	143	136.9 Å²	136.9	75%	0.749	77%	0.774	S	S	*	*			trans	56.5	89.9	156.5	-86.8	86.2	0	0	0	117.1	G737	L735-G737 PolarHBondContact O-N 3.49Å
736	L	25.3	Very low	25.1	Very low	190 Å²	190	135.3 Å²	135.3	100%	0.995	77%	0.773	S	S	*	*			trans	-61	74.7	134.4	-165.2	75.5	0	0	0	108.7
737	G	23.6	Very low	24.9	Very low	47 Å²	47	136.5 Å²	136.5	49%	0.485	78%	0.775	S	S	.	*			trans	-119.8	102.8	177.4	0	0	0	0	0	109.6	L735	L735-G737 PolarHBondContact O-N 3.49Å
738	E	23.1	Very low	24.9	Very low	169 Å²	169	139.5 Å²	139.5	79%	0.79	78%	0.781	S	S	*	*			trans	54.3	82.1	158.3	-63.3	-175.7	156.4	0	0	116.7	R740	E738-R740 PolarHBondContact O-N 3.36Å
739	I	25.8	Very low	24.8	Very low	170 Å²	170	138.8 Å²	138.8	87%	0.872	78%	0.777	S	S	*	*			trans	-66	87.3	149.4	-59.8	171.2	0	0	0	106.5
740	R	22.3	Very low	24.8	Very low	186 Å²	186	138.4 Å²	138.4	70%	0.702	78%	0.776	S	S	*	*			trans	-59.3	128.1	164.2	-139.1	179.8	-174	108.9	-2.9	106.9	E738 D742	E738-R740 PolarHBondContact O-N 3.36Å; R740-D742 VanDerWaalsContact C-N 3.28Å; R740-D742 PolarHBondContact O-N 3.47Å
741	P	28.8	Very low	24.7	Very low	121 Å²	121	144.9 Å²	144.9	79%	0.786	79%	0.785	S	S	*	*			trans	-81.3	79.5	-174.3	33.5	-32.4	0	0	0	108.9	S743	P741-S743 PolarHBondContact O-N 3.4Å; P741-S743 VanDerWaalsContact O-N 3.12Å
742	D	24	Very low	24.5	Very low	143 Å²	143	146 Å²	146	77%	0.765	79%	0.788	S	S	*	*			trans	-77.9	102.3	170.3	-78.7	-15.9	0	0	0	109	R740 Q744	R740-D742 VanDerWaalsContact C-N 3.28Å; R740-D742 PolarHBondContact O-N 3.47Å; D742-Q744 PolarHBondContact O-N 3.49Å
743	S	24.2	Very low	24.5	Very low	105 Å²	105	149.8 Å²	149.8	73%	0.734	79%	0.79	S	S	*	*			trans	-28.5	118	163	54.2	0	0	0	0	114	P741	P741-S743 PolarHBondContact O-N 3.4Å; P741-S743 VanDerWaalsContact O-N 3.12Å
744	Q	25.3	Very low	24.5	Very low	182 Å²	182	147 Å²	147	85%	0.85	78%	0.783	S	S	*	*			trans	-161.8	80.4	136	-106.6	171.2	46.1	0	0	107.9	D742 S746	D742-Q744 PolarHBondContact O-N 3.49Å; Q744-S746 PolarHBondContact O-N 3.39Å
745	A	24.3	Very low	24.5	Very low	102 Å²	102	146.5 Å²	146.5	84%	0.843	79%	0.786	S	S	*	*			trans	-64.1	86.6	156.9	0	0	0	0	0	106.9	C747	A745-C747 VanDerWaalsContact C-N 3.3Å; A745-C747 PolarHBondContact O-N 3.01Å
746	S	24.2	Very low	24.5	Very low	94 Å²	94	145 Å²	145	66%	0.657	79%	0.785	S	S	*	*			trans	-66.3	94.9	172.4	56.8	0	0	0	0	107.7	Q744 Y748	Q744-S746 PolarHBondContact O-N 3.39Å; S746-Y748 PolarHBondContact O-N 3.41Å
747	C	22.9	Very low	24.5	Very low	115 Å²	115	141.2 Å²	141.2	78%	0.777	77%	0.774	S	S	*	*			trans	-46.4	111.4	163.6	-86.4	0	0	0	0	108.8	A745 V749	A745-C747 VanDerWaalsContact C-N 3.3Å; A745-C747 PolarHBondContact O-N 3.01Å; C747-V749 VanDerWaalsContact C-N 3.34Å; C747-V749 PolarHBondContact O-N 2.92Å
748	Y	24.6	Very low	24.6	Very low	225 Å²	225	147.1 Å²	147.1	88%	0.882	79%	0.794	S	S	*	*			trans	-61.9	95.7	166.9	-102.5	-97.7	0	0	0	108.5	S746	S746-Y748 PolarHBondContact O-N 3.41Å
749	V	23	Very low	24.8	Very low	117 Å²	117	144.2 Å²	144.2	71%	0.709	79%	0.792	S	S	*	*			trans	-77.7	120.4	165.7	179.2	0	0	0	0	106.9	C747 R751	C747-V749 VanDerWaalsContact C-N 3.34Å; C747-V749 PolarHBondContact O-N 2.92Å; V749-R751 PolarHBondContact O-N 2.89Å
750	P	24.6	Very low	24.8	Very low	112 Å²	112	141.8 Å²	141.8	73%	0.727	79%	0.79	S	S	*	*			trans	-64.9	123.3	177.9	-5.5	19	0	0	0	108.6	M752	P750-M752 PolarHBondContact O-N 2.91Å
751	R	23.9	Very low	25	Very low	236 Å²	236	139.9 Å²	139.9	89%	0.891	79%	0.794	S	S	*	*			trans	-53.2	96.8	172.1	-76.3	177.9	175.9	162.7	-2.4	109.9	V749	V749-R751 PolarHBondContact O-N 2.89Å
752	M	22	Very low	25	Very low	180 Å²	180	138.2 Å²	138.2	89%	0.887	79%	0.79	S	S	*	*			trans	-73.9	116.4	150.6	-86.4	-179.2	172.2	0	0	106.1	P750 P754	P750-M752 PolarHBondContact O-N 2.91Å; M752-P754 WeakPolarHBondContact O-CD 3.5Å; M752-P754 VanDerWaalsContact O-N 3.13Å
753	F	24.6	Very low	25.1	Very low	189 Å²	189	138.9 Å²	138.9	83%	0.829	79%	0.794	S	S	*	*			trans	-53.3	113.9	169.5	-73	-92.4	0	0	0	108.5	V755	F753-V755 PolarHBondContact O-N 3.5Å; F753-V755 VanDerWaalsContact O-N 3.15Å
754	P	25.3	Very low	25.2	Very low	120 Å²	120	138.6 Å²	138.6	78%	0.779	79%	0.792	S	S	*	*			trans	-70.5	113.7	170.7	28	-27.7	0	0	0	106.9	M752	M752-P754 WeakPolarHBondContact O-CD 3.5Å; M752-P754 VanDerWaalsContact O-N 3.13Å
755	V	26.1	Very low	25.3	Very low	131 Å²	131	135.3 Å²	135.3	79%	0.794	80%	0.796	S	S	*	*			trans	-56.2	127.6	167.5	178.6	0	0	0	0	106.8	F753 S757	F753-V755 PolarHBondContact O-N 3.5Å; F753-V755 VanDerWaalsContact O-N 3.15Å; V755-S757 PolarHBondContact O-N 2.76Å
756	P	27.6	Very low	25.6	Very low	112 Å²	112	135.8 Å²	135.8	73%	0.727	79%	0.793	S	S	*	*			trans	-61.1	111.2	-174.5	-16.9	28.4	0	0	0	109.3	L758	P756-L758 PolarHBondContact O-N 3.02Å; P756-L758 VanDerWaalsContact O-N 3.13Å
757	S	24.9	Very low	25.7	Very low	110 Å²	110	135.7 Å²	135.7	77%	0.769	79%	0.792	S	S	*	*			trans	-64	111	166.2	50.4	0	0	0	0	107.3	V755 S759	V755-S757 PolarHBondContact O-N 2.76Å; S757-S759 PolarHBondContact O-N 3.43Å
758	L	25.9	Very low	26	Very low	171 Å²	171	138.2 Å²	138.2	90%	0.895	80%	0.797	S	S	*	*			trans	-53.2	100.9	166.8	-95.9	78.9	0	0	0	107.9	P756 S760	P756-L758 PolarHBondContact O-N 3.02Å; P756-L758 VanDerWaalsContact O-N 3.13Å; L758-S760 PolarHBondContact O-N 3.48Å
759	S	25.8	Very low	26.2	Very low	108 Å²	108	135.9 Å²	135.9	76%	0.755	79%	0.794	S	S	*	*			trans	-71.1	115.1	171.1	71.1	0	0	0	0	107.7	S757 N761	S757-S759 PolarHBondContact O-N 3.43Å; S759-N761 VanDerWaalsContact C-N 3.35Å; S759-N761 PolarHBondContact O-N 3.14Å
760	S	26.4	Very low	26.5	Very low	119 Å²	119	136.8 Å²	136.8	83%	0.832	80%	0.795	S	S	*	*			trans	-60.4	92.3	169.5	54.7	0	0	0	0	109.9	L758	L758-S760 PolarHBondContact O-N 3.48Å
761	N	26.9	Very low	26.6	Very low	145 Å²	145	139.2 Å²	139.2	78%	0.775	80%	0.801	S	S	*	*			trans	-141.4	76.8	158.7	-129.6	-1.2	0	0	0	108.7	S759 N763	S759-N761 VanDerWaalsContact C-N 3.35Å; S759-N761 PolarHBondContact O-N 3.14Å; N761-N763 PolarHBondContact O-N 3.03Å; N761-N763 VanDerWaalsContact O-N 3.13Å
762	A	27.6	Very low	26.7	Very low	86 Å²	86	136.7 Å²	136.7	71%	0.711	80%	0.804	S	S	*	*			trans	-62.1	105.5	160.7	0	0	0	0	0	107.2
763	N	26.7	Very low	26.8	Very low	158 Å²	158	132.3 Å²	132.3	85%	0.845	79%	0.791	S	S	*	*	S	Bend	trans	157.2	70.7	151	-75.8	-16	0	0	0	110	N761	N761-N763 PolarHBondContact O-N 3.03Å; N761-N763 VanDerWaalsContact O-N 3.13Å
764	S	26.2	Very low	26.8	Very low	99 Å²	99	128.3 Å²	128.3	69%	0.692	79%	0.787	S	S	*	*			trans	-174.3	46.6	157.5	37.1	0	0	0	0	111.4	S766	S764-S766 VanDerWaalsContact C-N 3.27Å; S764-S766 PolarHBondContact O-N 3.02Å
765	A	28	Very low	26.8	Very low	113 Å²	113	128.9 Å²	128.9	93%	0.934	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	30.9	176.4	0	0	0	0	0	113.5
766	S	29.6	Very low	26.6	Very low	112 Å²	112	131.4 Å²	131.4	78%	0.783	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.6	7.4	-176.1	61.1	0	0	0	0	117	S764	S764-S766 VanDerWaalsContact C-N 3.27Å; S764-S766 PolarHBondContact O-N 3.02Å
767	S	28	Very low	26.4	Very low	91 Å²	91	132.9 Å²	132.9	64%	0.636	79%	0.791	S	S	*	*	S	Bend	trans	-111.4	-5.2	177.9	64.8	0	0	0	0	115.9	H769	S767-H769 VanDerWaalsContact C-N 3.35Å
768	L	28.4	Very low	26.3	Very low	169 Å²	169	137.8 Å²	137.8	89%	0.885	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-2.1	-178.9	-131.6	138.2	0	0	0	114.1
769	H	29.1	Very low	26.2	Very low	176 Å²	176	134.6 Å²	134.6	82%	0.815	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-2.6	-178.5	-121	-58.1	0	0	0	115.6	S767	S767-H769 VanDerWaalsContact C-N 3.35Å
770	N	29.4	Very low	26.1	Very low	136 Å²	136	138.3 Å²	138.3	73%	0.727	79%	0.789	S	S	*	*	S	Bend	trans	-115	17.1	-173.5	-80.9	-9.3	0	0	0	115.8
771	L	26.6	Very low	26.1	Very low	163 Å²	163	138.6 Å²	138.6	85%	0.853	78%	0.779	S	S	*	*	S	Bend	trans	-112.7	17.6	179.9	-95.3	161.5	0	0	0	115.2
772	L	26.4	Very low	25.9	Very low	183 Å²	183	138.6 Å²	138.6	96%	0.958	78%	0.78	S	S	*	*	S	Bend	trans	-106.3	12.1	173.4	-93.5	156	0	0	0	114.2
773	S	24.4	Very low	25.9	Very low	88 Å²	88	140.4 Å²	140.4	62%	0.615	79%	0.787	S	S	*	*	S	Bend	trans	-128	100.3	175.3	48.3	0	0	0	0	110.8
774	S	23	Very low	25.6	Very low	105 Å²	105	142.5 Å²	142.5	73%	0.734	79%	0.792	S	S	*	*			trans	57.8	106.1	156.7	66.5	0	0	0	0	118.7
775	P	26.3	Very low	25.6	Very low	132 Å²	132	141.2 Å²	141.2	86%	0.857	79%	0.794	S	S	*	*			trans	-92.3	96.7	145	28.7	-14.3	0	0	0	108.4
776	K	21	Very low	25.3	Very low	184 Å²	184	141.2 Å²	141.2	80%	0.8	79%	0.787	S	S	*	*			trans	-54.4	163.7	140.6	-92	174.3	173.1	173.5	0	108.5
777	I	22.8	Very low	25.1	Very low	142 Å²	142	141.7 Å²	141.7	73%	0.728	79%	0.785	S	S	*	*			trans	116.8	124.2	167.4	-64.6	160.8	0	0	0	109.5
778	Y	23.7	Very low	24.8	Very low	213 Å²	213	144.4 Å²	144.4	84%	0.835	79%	0.792	S	S	*	*			cis	-147	145.2	21.5	-107.2	-61.4	0	0	0	110.6
779	S	23.5	Very low	24.6	Very low	105 Å²	105	146 Å²	146	73%	0.734	79%	0.788	S	S	*	*			trans	-68	140.3	160.3	43.8	0	0	0	0	112.3
780	K	24.9	Very low	24.4	Very low	186 Å²	186	143.6 Å²	143.6	81%	0.809	79%	0.788	S	S	*	*			trans	-169.2	109.1	140.8	-143.6	162.4	178.4	179.1	0	114.5
781	I	25.6	Very low	24.3	Very low	124 Å²	124	143 Å²	143	64%	0.636	79%	0.789	S	S	*	*			trans	68	100	134.8	-57.4	173.7	0	0	0	119
782	D	23.1	Very low	24.2	Very low	146 Å²	146	140.8 Å²	140.8	78%	0.781	78%	0.784	S	S	*	*				26.5	114.9	119.5	-46.5	-30.9	0	0	0	118.6
783	S	26.3	Very low	24.2	Very low	124 Å²	124	137.8 Å²	137.8	87%	0.867	77%	0.773	S	S	*	*			trans	-165	118.8	133	5.1	0	0	0	0	110.4
784	E	22.2	Very low	24.1	Very low	202 Å²	202	140.6 Å²	140.6	94%	0.944	78%	0.781	S	S	*	*			trans	-56.2	154	168	-62	167.2	132.5	0	0	112.1
785	G	25.2	Very low	24.1	Very low	71 Å²	71	144 Å²	144	73%	0.732	79%	0.785	S	S	*	*			trans	153.8	68.9	164.5	0	0	0	0	0	114.3	V787	G785-V787 PolarHBondContact O-N 2.86Å
786	S	21.9	Very low	23.9	Very low	114 Å²	114	143.6 Å²	143.6	80%	0.797	78%	0.784	S	S	*	*			trans	-58.1	118	165.4	61.6	0	0	0	0	110.7
787	V	26.1	Very low	24	Very low	122 Å²	122	143.1 Å²	143.1	74%	0.739	78%	0.784	S	S	*	*			trans	-133.9	102.9	156.3	-179.1	0	0	0	0	108	G785 Y789	G785-V787 PolarHBondContact O-N 2.86Å; V787-Y789 HydrophobicContact CG1-CD2 4.03Å; V787-Y789 HydrophobicContact CG1-CE2 4.2Å; V787-Y789 PolarHBondContact O-N 2.88Å
788	N	21.4	Very low	24	Very low	147 Å²	147	141.8 Å²	141.8	79%	0.786	79%	0.785	S	S	*	*			trans	-64.7	119.9	168.8	-73.4	-42.4	0	0	0	110.2
789	Y	24.6	Very low	24.1	Very low	204 Å²	204	136.9 Å²	136.9	80%	0.8	78%	0.782	S	S	*	*			trans	-138.2	113.4	147.3	-88.2	-78.9	0	0	0	108.4	V787 V791	V787-Y789 HydrophobicContact CG1-CD2 4.03Å; V787-Y789 HydrophobicContact CG1-CE2 4.2Å; V787-Y789 PolarHBondContact O-N 2.88Å; Y789-V791 PolarHBondContact O-N 2.82Å
790	P	24.6	Very low	24	Very low	124 Å²	124	139.1 Å²	139.1	81%	0.805	79%	0.785	S	S	*	*			trans	-81.5	113.5	179.7	31.8	-28.6	0	0	0	108.8
791	V	27	Very low	24.1	Very low	124 Å²	124	135.8 Å²	135.8	75%	0.752	78%	0.783	S	S	*	*			trans	-89.1	132.9	165.7	178.8	0	0	0	0	107.2	Y789 V793	Y789-V791 PolarHBondContact O-N 2.82Å; V791-V793 PolarHBondContact O-N 2.76Å
792	P	24.3	Very low	24.1	Very low	116 Å²	116	135.3 Å²	135.3	75%	0.753	79%	0.791	S	S	*	*			trans	-70.8	116.3	-165.6	4.1	10.4	0	0	0	109.8	D794	P792-D794 PolarHBondContact O-N 3.17Å
793	V	25.6	Very low	24.1	Very low	120 Å²	120	133.6 Å²	133.6	73%	0.727	79%	0.79	S	S	*	*			trans	-76.7	107.3	167.2	179.9	0	0	0	0	106.6	V791 H795	V791-V793 PolarHBondContact O-N 2.76Å; V793-H795 PolarHBondContact O-N 2.71Å; V793-H795 VanDerWaalsContact O-N 3.1Å; V793-H795 PolarHBondContact O-ND1 3.37Å
794	D	23.5	Very low	24.1	Very low	147 Å²	147	132.9 Å²	132.9	79%	0.786	79%	0.785	S	S	*	*			trans	-49.1	118.4	169	-84.1	-36.4	0	0	0	109.1	P792 C796	P792-D794 PolarHBondContact O-N 3.17Å; D794-C796 VanDerWaalsContact C-N 3.25Å; D794-C796 PolarHBondContact O-N 3.43Å
795	H	22.7	Very low	24.1	Very low	178 Å²	178	133 Å²	133	82%	0.824	78%	0.777	S	S	*	*			trans	-69.1	81	-178	-74.8	33.1	0	0	0	109.8	V793 H797	V793-H795 PolarHBondContact O-N 2.71Å; V793-H795 VanDerWaalsContact O-N 3.1Å; V793-H795 PolarHBondContact O-ND1 3.37Å; H795-H797 VanDerWaalsContact C-N 3.29Å; H795-H797 PolarHBondContact O-N 3.14Å
796	C	22.5	Very low	24.2	Very low	122 Å²	122	134.8 Å²	134.8	82%	0.824	77%	0.773	S	S	*	*			trans	-69.3	96	153.8	-83.4	0	0	0	0	107.3	D794	D794-C796 VanDerWaalsContact C-N 3.25Å; D794-C796 PolarHBondContact O-N 3.43Å
797	H	21.8	Very low	24.4	Very low	174 Å²	174	133.8 Å²	133.8	81%	0.806	77%	0.766	S	S	*	*			trans	-44.8	122.9	168.9	-108.2	-60.2	0	0	0	109.4	H795 S799	H795-H797 VanDerWaalsContact C-N 3.29Å; H795-H797 PolarHBondContact O-N 3.14Å; H797-S799 PolarHBondContact O-N 3.01Å
798	P	24.3	Very low	24.4	Very low	115 Å²	115	133 Å²	133	75%	0.747	76%	0.761	S	S	*	*			trans	-66.8	103.4	174.4	26.1	-29.9	0	0	0	107.1	N800	P798-N800 PolarHBondContact O-N 2.99Å
799	S	24.3	Very low	24.7	Very low	109 Å²	109	135.6 Å²	135.6	76%	0.762	77%	0.769	S	S	*	*			trans	-56.4	107.7	163.2	48.9	0	0	0	0	106.9	H797	H797-S799 PolarHBondContact O-N 3.01Å
800	N	22.9	Very low	24.8	Very low	152 Å²	152	135.1 Å²	135.1	81%	0.813	77%	0.771	S	S	*	*			trans	-37.8	127	172.1	-109	-25	0	0	0	109.3	P798 S802	P798-N800 PolarHBondContact O-N 2.99Å; N800-S802 PolarHBondContact O-N 2.6Å
801	P	26.8	Very low	24.8	Very low	116 Å²	116	135.7 Å²	135.7	75%	0.753	76%	0.763	S	S	*	*			trans	-56.8	111.5	-179.6	22.5	-31.1	0	0	0	107.6	S803	P801-S803 PolarHBondContact O-N 2.95Å
802	S	24.3	Very low	24.8	Very low	115 Å²	115	135.4 Å²	135.4	80%	0.804	76%	0.764	S	S	*	*			trans	-52.3	108.4	173.6	48	0	0	0	0	107	N800 S804	N800-S802 PolarHBondContact O-N 2.6Å; S802-S804 PolarHBondContact O-N 3.07Å
803	S	23.9	Very low	24.9	Very low	110 Å²	110	137.1 Å²	137.1	77%	0.769	77%	0.766	S	S	*	*			trans	-51.8	107.3	175	50.8	0	0	0	0	107.5	P801 R805	P801-S803 PolarHBondContact O-N 2.95Å; S803-R805 PolarHBondContact O-N 2.95Å
804	S	26.3	Very low	25.1	Very low	108 Å²	108	137.9 Å²	137.9	76%	0.755	77%	0.765	S	S	*	*			trans	-64.2	94.7	173.2	57.3	0	0	0	0	106.7	S802 V806	S802-S804 PolarHBondContact O-N 3.07Å; S804-V806 PolarHBondContact O-N 2.97Å
805	R	22.8	Very low	25.2	Very low	205 Å²	205	140 Å²	140	77%	0.774	77%	0.77	S	S	*	*			trans	-60.2	107.5	177.6	-145.3	177.5	-169.6	-179.4	1.6	106.9	S803 S807	S803-R805 PolarHBondContact O-N 2.95Å; R805-S807 PolarHBondContact O-N 3.07Å
806	V	25.8	Very low	25.4	Very low	108 Å²	108	135.2 Å²	135.2	66%	0.655	77%	0.769	S	S	*	*			trans	-62.7	119.9	178.2	177	0	0	0	0	108.2	S804 T808	S804-V806 PolarHBondContact O-N 2.97Å; V806-T808 PolarHBondContact O-N 2.89Å; V806-T808 VanDerWaalsContact O-N 3.1Å
807	S	26.5	Very low	25.5	Very low	93 Å²	93	133.1 Å²	133.1	65%	0.65	76%	0.756	S	S	*	*			trans	-58.2	108.2	-177.3	-47.3	0	0	0	0	110.9	R805	R805-S807 PolarHBondContact O-N 3.07Å
808	T	25.9	Very low	25.8	Very low	105 Å²	105	134.1 Å²	134.1	64%	0.644	76%	0.758	S	S	*	*			trans	-82.5	155.3	172.5	52.7	0	0	0	0	110.4	V806 K810 Q811	V806-T808 PolarHBondContact O-N 2.89Å; V806-T808 VanDerWaalsContact O-N 3.1Å; T808-K810 PolarHBondContact O-N 3Å; T808-Q811 PolarHBondContact O-N 3.3Å
809	E	28.3	Very low	25.9	Very low	202 Å²	202	139.6 Å²	139.6	94%	0.944	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52	1.7	-172.2	-157.5	177.1	-177.3	0	0	116.7
810	K	26.7	Very low	26	Very low	194 Å²	194	141.4 Å²	141.4	84%	0.843	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	14.6	-175.7	-69.4	-171.3	177.8	180	0	115.7	T808	T808-K810 PolarHBondContact O-N 3Å
811	Q	24.5	Very low	26.2	Very low	137 Å²	137	144.1 Å²	144.1	64%	0.64	77%	0.771	S	S	*	*	S	Bend	trans	-109	120.8	166.7	-80.9	-175	-26.9	0	0	111.7	T808 L813	T808-Q811 PolarHBondContact O-N 3.3Å; Q811-L813 PolarHBondContact O-N 3.03Å; Q811-L813 VanDerWaalsContact O-N 3.14Å
812	P	26.2	Very low	26.3	Very low	118 Å²	118	149.1 Å²	149.1	77%	0.766	78%	0.776	S	S	*	*			trans	-64.1	116.3	176.3	26	-31.2	0	0	0	108.9	L814	P812-L814 PolarHBondContact O-N 2.98Å; P812-L814 VanDerWaalsContact O-N 3.1Å
813	L	27	Very low	26.6	Very low	151 Å²	151	146.3 Å²	146.3	79%	0.791	77%	0.766	S	S	*	*	S	Bend	trans	-58.9	115.6	169.8	-74.4	160.7	0	0	0	107.9	Q811	Q811-L813 PolarHBondContact O-N 3.03Å; Q811-L813 VanDerWaalsContact O-N 3.14Å
814	L	30.3	Very low	26.8	Very low	136 Å²	136	145.3 Å²	145.3	71%	0.712	77%	0.773	S	S	*	*			trans	85.1	85.7	175.1	-61.1	137.2	0	0	0	116.3	P812 G816	P812-L814 PolarHBondContact O-N 2.98Å; P812-L814 VanDerWaalsContact O-N 3.1Å; L814-G816 PolarHBondContact O-N 2.73Å
815	Q	24.9	Very low	26.8	Very low	193 Å²	193	148.3 Å²	148.3	90%	0.902	78%	0.78	S	S	*	*	S	Bend	trans	-65.4	105.6	149.8	-156.5	173.4	22.1	0	0	107.6
816	G	27.4	Very low	27	Very low	77 Å²	77	146.5 Å²	146.5	79%	0.794	78%	0.782	S	S	*	*	S	Bend	trans	97.1	59.4	169.4	0	0	0	0	0	116.3	L814	L814-G816 PolarHBondContact O-N 2.73Å
817	S	25.7	Very low	27	Very low	78 Å²	78	146.5 Å²	146.5	55%	0.545	79%	0.786	S	S	.	*	S	Bend	trans	-144.8	134.7	147.7	71.9	0	0	0	0	111.2	Y819	S817-Y819 PolarHBondContact O-N 3.3Å
818	F	26.9	Very low	27	Very low	195 Å²	195	147.8 Å²	147.8	86%	0.855	79%	0.791	S	S	*	*			trans	-35.3	117.3	-170.9	-67.7	-96.6	0	0	0	114.9	N820	F818-N820 PolarHBondContact O-N 3.24Å
819	Y	25.7	Very low	27.2	Very low	229 Å²	229	145.1 Å²	145.1	90%	0.898	78%	0.784	S	S	*	*			trans	-57.9	82.3	162.6	-87.6	-91.6	0	0	0	110	S817 K821	S817-Y819 PolarHBondContact O-N 3.3Å; Y819-K821 PolarHBondContact O-N 3.01Å
820	N	28.2	Very low	27.2	Very low	147 Å²	147	143.1 Å²	143.1	79%	0.786	79%	0.786	S	S	*	*			trans	-72.8	98.3	168.2	-93.3	-24.3	0	0	0	108.1	F818 Y822	F818-N820 PolarHBondContact O-N 3.24Å; N820-Y822 PolarHBondContact O-N 3.35Å
821	K	26.3	Very low	27.2	Very low	209 Å²	209	136.7 Å²	136.7	91%	0.909	77%	0.774	S	S	*	*			trans	-44.8	98.5	177.5	-65.1	174.8	179	179.3	0	111.5	Y819	Y819-K821 PolarHBondContact O-N 3.01Å
822	Y	27.7	Very low	27.2	Very low	221 Å²	221	139 Å²	139	87%	0.867	79%	0.785	S	S	*	*			trans	-89.9	115.6	170.9	-141.7	-98	0	0	0	108.9	N820	N820-Y822 PolarHBondContact O-N 3.35Å
823	G	31.7	Very low	27.2	Very low	56 Å²	56	138.9 Å²	138.9	58%	0.577	78%	0.784	S	S	*	*	S	Bend	trans	65.8	75.3	159.4	0	0	0	0	0	117.6	L825	G823-L825 PolarHBondContact O-N 3.23Å
824	G	28.2	Very low	27.2	Very low	89 Å²	89	137.1 Å²	137.1	92%	0.918	79%	0.785	S	S	*	*	S	Bend	trans	61.3	1.5	136.3	0	0	0	0	0	120.9	M826	G824-M826 PolarHBondContact O-N 3.22Å
825	L	25.8	Very low	27.2	Very low	172 Å²	172	138.7 Å²	138.7	90%	0.901	79%	0.793	S	S	*	*			trans	-94.9	80.6	176.2	-76.4	154.8	0	0	0	109.6	G823 S827	G823-L825 PolarHBondContact O-N 3.23Å; L825-S827 PolarHBondContact O-N 2.82Å
826	M	26.9	Very low	27.2	Very low	166 Å²	166	137.2 Å²	137.2	82%	0.818	79%	0.79	S	S	*	*			trans	-70.5	105.5	160	-96.1	177.4	81.6	0	0	107.7	G824 T828	G824-M826 PolarHBondContact O-N 3.22Å; M826-T828 HydrophobicContact CE-CG2 3.46Å; M826-T828 VanDerWaalsContact CE-CG2 3.46Å
827	S	26.5	Very low	27.4	Very low	108 Å²	108	139 Å²	139	76%	0.755	79%	0.788	S	S	*	*			trans	-92.9	101.8	149.3	-177.9	0	0	0	0	106.6	L825 G829	L825-S827 PolarHBondContact O-N 2.82Å; S827-G829 PolarHBondContact O-N 2.85Å; S827-G829 VanDerWaalsContact O-N 3.1Å
828	T	27.4	Very low	27.7	Very low	120 Å²	120	141.2 Å²	141.2	74%	0.736	79%	0.793	S	S	*	*			trans	-70.3	93.1	167.7	45.2	0	0	0	0	108	M826	M826-T828 HydrophobicContact CE-CG2 3.46Å; M826-T828 VanDerWaalsContact CE-CG2 3.46Å
829	G	28.2	Very low	28	Very low	50 Å²	50	135.3 Å²	135.3	52%	0.515	78%	0.776	S	S	.	*	S	Bend	trans	164.2	117.5	175.1	0	0	0	0	0	111	S827 G831	S827-G829 PolarHBondContact O-N 2.85Å; S827-G829 VanDerWaalsContact O-N 3.1Å; G829-G831 PolarHBondContact O-N 3.26Å
830	T	29.2	Very low	28.4	Very low	160 Å²	160	135.2 Å²	135.2	98%	0.982	77%	0.774	S	S	*	*	S	Bend	trans	-50.2	92.8	172.5	47.4	0	0	0	0	111.2
831	G	25.8	Very low	29	Very low	58 Å²	58	133.6 Å²	133.6	60%	0.598	77%	0.769	S	S	*	*	S	Bend	trans	-173.2	124.7	177.5	0	0	0	0	0	109.5	G829	G829-G831 PolarHBondContact O-N 3.26Å
832	H	26.3	Very low	29.5	Very low	186 Å²	186	128.7 Å²	128.7	86%	0.861	75%	0.749	S	S	*	*			trans	-44.6	128.8	-172	-69.4	-79.2	0	0	0	113.3	S834	H832-S834 PolarHBondContact O-N 2.9Å
833	P	26.4	Very low	29.9	Very low	116 Å²	116	124 Å²	124	75%	0.753	74%	0.738	S	S	*	*			trans	-67	122.5	176.7	27.3	-31.1	0	0	0	109	L835	P833-L835 PolarHBondContact O-N 2.97Å
834	S	26.4	Very low	30	Very low	114 Å²	114	123.1 Å²	123.1	80%	0.797	73%	0.726	S	S	*	*			trans	-59.6	108.3	170.9	42.2	0	0	0	0	109.2	H832 L836	H832-S834 PolarHBondContact O-N 2.9Å; S834-L836 PolarHBondContact O-N 3.32Å
835	L	29.2	Very low	30.3	Very low	169 Å²	169	122.5 Å²	122.5	89%	0.885	71%	0.712	S	S	*	*			trans	-56.8	104.1	167.6	-80.2	147.5	0	0	0	108.2	P833 P837	P833-L835 PolarHBondContact O-N 2.97Å; L835-P837 WeakPolarHBondContact O-CD 3.38Å
836	L	26.5	Very low	30.8	Very low	161 Å²	161	118 Å²	118	84%	0.843	70%	0.699	S	S	*	*			trans	-68.9	115.6	165.7	-111.5	148.2	0	0	0	107.1	S834 L838	S834-L836 PolarHBondContact O-N 3.32Å; L836-L838 PolarHBondContact O-N 2.8Å
837	P	31.2	Very low	31.1	Very low	114 Å²	114	113.7 Å²	113.7	74%	0.74	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-68.3	125.9	-175.6	27.5	-32.2	0	0	0	109.3	L835 S839	L835-P837 WeakPolarHBondContact O-CD 3.38Å; P837-S839 PolarHBondContact O-N 2.83Å
838	L	30.9	Very low	31.2	Very low	125 Å²	125	115.3 Å²	115.3	65%	0.654	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-52.9	132.9	172.5	-68	155.8	0	0	0	109	L836	L836-L838 PolarHBondContact O-N 2.8Å
839	S	33.8	Very low	31.2	Very low	72 Å²	72	114.4 Å²	114.4	50%	0.503	68%	0.681	S	S	.	*	P	Polyproline II helix	trans	-65.9	143.7	-178.7	66.7	0	0	0	0	110.1	P837 V841 Q842	P837-S839 PolarHBondContact O-N 2.83Å; S839-V841 PolarHBondContact O-N 3.42Å; S839-Q842 PolarHBondContact O-N 2.93Å
840	R	34.3	Very low	31.3	Very low	227 Å²	227	118.1 Å²	118.1	86%	0.857	69%	0.688	S	S	*	*	H	α-helix	trans	-48.4	-22.1	-177.6	-77.8	-177.4	174.6	177.3	-2.4	114.7	Q842 L843 A844	R840-Q842 VanDerWaalsContact C-N 3.34Å; R840-L843 PolarHBondContact O-N 2.85Å; R840-A844 PolarHBondContact O-N 3.39Å
841	V	40	Very low	31.2	Very low	112 Å²	112	116.5 Å²	116.5	68%	0.679	68%	0.68	S	S	*	*	H	α-helix	trans	-65.6	-34.8	175.9	-175.1	0	0	0	0	112	S839 A844 A845	S839-V841 PolarHBondContact O-N 3.42Å; V841-A844 PolarHBondContact O-N 2.83Å; V841-A845 PolarHBondContact O-N 2.93Å
842	Q	37.4	Very low	31.2	Very low	107 Å²	107	122.8 Å²	122.8	50%	0.5	69%	0.691	S	S	.	*	H	α-helix	trans	-74	-32	176.8	-72.5	174.5	-46.2	0	0	112.3	S839 R840 A846	S839-Q842 PolarHBondContact O-N 2.93Å; R840-Q842 VanDerWaalsContact C-N 3.34Å; Q842-A846 PolarHBondContact O-N 2.94Å
843	L	35.6	Very low	31.2	Very low	121 Å²	121	119.3 Å²	119.3	63%	0.634	69%	0.688	S	S	*	*	H	α-helix	trans	-69.6	-37.9	170.8	-92.3	152.1	0	0	0	111.9	R840 A846 S847	R840-L843 PolarHBondContact O-N 2.85Å; L843-A846 PolarHBondContact O-N 3.34Å; L843-S847 PolarHBondContact O-N 2.76Å; L843-S847 PolarHBondContact O-OG 3.45Å
844	A	34.3	Very low	31.1	Very low	38 Å²	38	118.8 Å²	118.8	31%	0.314	69%	0.687	S	S	.	*	H	α-helix	trans	-68.6	-36.9	175.9	0	0	0	0	0	112.8	R840 V841 A846 S847 Q848	R840-A844 PolarHBondContact O-N 3.39Å; V841-A844 PolarHBondContact O-N 2.83Å; A844-A846 VanDerWaalsContact C-N 3.3Å; A844-A846 PolarHBondContact O-N 2.74Å; A844-S847 PolarHBondContact O-N 2.82Å; A844-S847 PolarHBondContact O-OG 3.21Å; A844-Q848 WeakPolarHBondContact O-CB 3.46Å; A844-Q848 WeakPolarHBondContact O-CG 3.46Å; A844-Q848 PolarHBondContact O-N 2.92Å; A844-Q848 VanDerWaalsContact O-N 3.13Å
845	A	35.2	Very low	31.1	Very low	77 Å²	77	118.9 Å²	118.9	64%	0.636	69%	0.687	S	S	*	*	H	α-helix	trans	-67.8	-30.2	176.5	0	0	0	0	0	112.7	V841	V841-A845 PolarHBondContact O-N 2.93Å
846	A	34.6	Very low	31	Very low	76 Å²	76	115.8 Å²	115.8	63%	0.628	68%	0.68	S	S	*	*	H	α-helix	trans	-77	-27	174.7	0	0	0	0	0	113	Q842 L843 A844	Q842-A846 PolarHBondContact O-N 2.94Å; L843-A846 PolarHBondContact O-N 3.34Å; A844-A846 VanDerWaalsContact C-N 3.3Å; A844-A846 PolarHBondContact O-N 2.74Å
847	S	33.9	Very low	30.9	Very low	77 Å²	77	113.5 Å²	113.5	54%	0.538	68%	0.678	S	S	.	*	H	α-helix	trans	-91.4	-16.7	-178.8	64.5	0	0	0	0	114.8	L843 A844 S849	L843-S847 PolarHBondContact O-N 2.76Å; L843-S847 PolarHBondContact O-OG 3.45Å; A844-S847 PolarHBondContact O-N 2.82Å; A844-S847 PolarHBondContact O-OG 3.21Å; S847-S849 VanDerWaalsContact C-N 3.31Å; S847-S849 PolarHBondContact O-N 2.97Å
848	Q	29.4	Very low	30.7	Very low	141 Å²	141	113.8 Å²	113.8	66%	0.659	68%	0.677	S	S	*	*			trans	-85.2	10.9	-176.7	-75.4	-176.2	3.9	0	0	115.4	A844 L850	A844-Q848 WeakPolarHBondContact O-CB 3.46Å; A844-Q848 WeakPolarHBondContact O-CG 3.46Å; A844-Q848 PolarHBondContact O-N 2.92Å; A844-Q848 VanDerWaalsContact O-N 3.13Å; Q848-L850 PolarHBondContact O-N 3.16Å
849	S	27.3	Very low	30.4	Very low	102 Å²	102	114.7 Å²	114.7	71%	0.713	68%	0.683	S	S	*	*			trans	-81.8	54.5	165.7	67.7	0	0	0	0	111.6	S847	S847-S849 VanDerWaalsContact C-N 3.31Å; S847-S849 PolarHBondContact O-N 2.97Å
850	L	29.1	Very low	30	Very low	127 Å²	127	117.9 Å²	117.9	67%	0.665	70%	0.699	S	S	*	*	S	Bend	trans	-143.1	127.4	164.3	-88.7	124.2	0	0	0	107.8	Q848 F852	Q848-L850 PolarHBondContact O-N 3.16Å; L850-F852 PolarHBondContact O-N 3.16Å
851	P	28.3	Very low	29.4	Very low	127 Å²	127	113.6 Å²	113.6	83%	0.825	70%	0.698	S	S	*	*			trans	-69.8	108.8	-174.5	27.2	-30.6	0	0	0	109.7	S853	P851-S853 PolarHBondContact O-N 3.41Å
852	F	25.4	Very low	28.6	Very low	190 Å²	190	111.7 Å²	111.7	83%	0.833	70%	0.702	S	S	*	*			trans	-67	99.4	170.2	-88.3	-91.2	0	0	0	109.6	L850	L850-F852 PolarHBondContact O-N 3.16Å
853	S	26.3	Very low	28.2	Very low	113 Å²	113	116.4 Å²	116.4	79%	0.79	72%	0.721	S	S	*	*			trans	-78.5	127.8	154.2	51.3	0	0	0	0	109	P851	P851-S853 PolarHBondContact O-N 3.41Å
854	S	24.6	Very low	27.5	Very low	105 Å²	105	116.4 Å²	116.4	73%	0.734	73%	0.731	S	S	*	*			trans	-60.1	144.5	-172.3	48.9	0	0	0	0	115.9
855	S	25.3	Very low	27.2	Very low	115 Å²	115	120 Å²	120	80%	0.804	75%	0.754	S	S	*	*			trans	52.1	98.9	143.2	64.3	0	0	0	0	118.2
856	S	26.9	Very low	26.7	Very low	104 Å²	104	123.9 Å²	123.9	73%	0.727	76%	0.758	S	S	*	*			trans	-131	109.8	146.7	63.9	0	0	0	0	108.8	V858	S856-V858 PolarHBondContact O-N 2.8Å; S856-V858 VanDerWaalsContact O-N 3.13Å
857	S	24.9	Very low	26.4	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	77%	0.772	S	S	*	*			trans	-51.5	107.4	167.5	49.1	0	0	0	0	110.4	N859	S857-N859 PolarHBondContact O-N 3.36Å
858	V	26.6	Very low	26	Very low	119 Å²	119	133 Å²	133	72%	0.721	78%	0.781	S	S	*	*			trans	-88.1	103.9	168.7	177.6	0	0	0	0	107.6	S856 T860	S856-V858 PolarHBondContact O-N 2.8Å; S856-V858 VanDerWaalsContact O-N 3.13Å; V858-T860 PolarHBondContact O-N 2.65Å; V858-T860 VanDerWaalsContact O-N 3.1Å
859	N	24.4	Very low	26	Very low	145 Å²	145	130.9 Å²	130.9	78%	0.775	79%	0.787	S	S	*	*			trans	-53.7	105.3	163.5	-84.9	-25.2	0	0	0	109.6	S857 T861	S857-N859 PolarHBondContact O-N 3.36Å; N859-T861 PolarHBondContact O-N 2.89Å
860	T	25.5	Very low	26.1	Very low	138 Å²	138	135 Å²	135	85%	0.847	80%	0.795	S	S	*	*			trans	-85.4	82.7	165.3	43.2	0	0	0	0	109.3	V858	V858-T860 PolarHBondContact O-N 2.65Å; V858-T860 VanDerWaalsContact O-N 3.1Å
861	T	22.2	Very low	25.8	Very low	137 Å²	137	136.9 Å²	136.9	84%	0.84	80%	0.801	S	S	*	*			trans	-99.7	109.7	157.4	22.4	0	0	0	0	107.6	N859	N859-T861 PolarHBondContact O-N 2.89Å
862	G	24.6	Very low	25.9	Very low	73 Å²	73	138.2 Å²	138.2	75%	0.753	80%	0.801	S	S	*	*			trans	167.8	76.2	174.1	0	0	0	0	0	117.2
863	K	27	Very low	25.9	Very low	206 Å²	206	135.5 Å²	135.5	90%	0.896	79%	0.791	S	S	*	*			trans	78.4	110.3	147.4	-66.4	178.7	176.2	177.8	0	118.6
864	S	22.8	Very low	26.1	Very low	121 Å²	121	136 Å²	136	85%	0.846	79%	0.789	S	S	*	*			trans	-38.6	126.9	154.4	58.2	0	0	0	0	114.2
865	S	27.9	Very low	26.2	Very low	114 Å²	114	138.2 Å²	138.2	80%	0.797	79%	0.786	S	S	*	*			trans	-135.7	99.1	143.3	57.5	0	0	0	0	107.1	F867	S865-F867 PolarHBondContact O-N 3.44Å
866	Q	23.7	Very low	26.4	Very low	158 Å²	158	138.4 Å²	138.4	74%	0.738	78%	0.782	S	S	*	*			trans	-47.4	120.4	169.7	-172.4	175.2	5.4	0	0	110.9
867	F	28.5	Very low	26.4	Very low	208 Å²	208	140.8 Å²	140.8	91%	0.912	79%	0.786	S	S	*	*			trans	-143.5	97.4	155	-109.6	-81.4	0	0	0	107.3	S865	S865-F867 PolarHBondContact O-N 3.44Å
868	D	25.2	Very low	26.7	Very low	136 Å²	136	140.1 Å²	140.1	73%	0.727	78%	0.782	S	S	*	*			trans	-63.7	127.4	169	-63.3	-56.3	0	0	0	109.5
869	A	29	Very low	26.7	Very low	96 Å²	96	139.2 Å²	139.2	79%	0.793	78%	0.781	S	S	*	*			trans	-160.2	90.5	159.3	0	0	0	0	0	109.9
870	E	28.9	Very low	27.1	Very low	188 Å²	188	139.7 Å²	139.7	88%	0.879	78%	0.782	S	S	*	*			trans	30.8	101.4	149.5	-75.5	176.5	137.7	0	0	120.1
871	E	24.4	Very low	27.3	Very low	168 Å²	168	139.6 Å²	139.6	79%	0.785	78%	0.776	S	S	*	*			trans	-16.7	122.7	132.6	-159.2	170.2	-148.4	0	0	116
872	N	29.2	Very low	27.8	Very low	155 Å²	155	138.8 Å²	138.8	83%	0.829	78%	0.776	S	S	*	*			trans	-144	86.5	150	-96.2	-42.1	0	0	0	108.7	V874	N872-V874 PolarHBondContact O-N 2.87Å
873	E	25.8	Very low	28.3	Very low	132 Å²	132	141.1 Å²	141.1	62%	0.617	78%	0.776	S	S	*	*			trans	-60.3	119.1	161.2	-82.3	-165.2	140	0	0	109.6	K875	E873-K875 IonicContact OE1-NZ 3.73Å; E873-K875 PolarHBondContact OE1-NZ 2.91Å; E873-K875 IonicContact OE2-NZ 3.13Å; E873-K875 PolarHBondContact OE2-NZ 3.31Å
874	V	30.8	Very low	28.4	Very low	124 Å²	124	140.6 Å²	140.6	75%	0.752	78%	0.777	S	S	*	*			trans	-113.2	89	157.4	-178.8	0	0	0	0	107.7	N872 T876	N872-V874 PolarHBondContact O-N 2.87Å; V874-T876 HydrophobicContact CG1-CG2 4.15Å; V874-T876 PolarHBondContact O-N 2.92Å
875	K	26.2	Very low	28.8	Very low	152 Å²	152	141.1 Å²	141.1	66%	0.661	78%	0.779	S	S	*	*			trans	-68	99	164.3	-78.5	178.2	176.4	109.5	0	109	E873 N877	E873-K875 IonicContact OE1-NZ 3.73Å; E873-K875 PolarHBondContact OE1-NZ 2.91Å; E873-K875 IonicContact OE2-NZ 3.13Å; E873-K875 PolarHBondContact OE2-NZ 3.31Å; K875-N877 PolarHBondContact O-N 2.84Å
876	T	29.7	Very low	29.1	Very low	118 Å²	118	149.1 Å²	149.1	72%	0.724	80%	0.799	S	S	*	*			trans	-89.1	89.5	162.6	45.2	0	0	0	0	110.1	V874 S878	V874-T876 HydrophobicContact CG1-CG2 4.15Å; V874-T876 PolarHBondContact O-N 2.92Å; T876-S878 PolarHBondContact O-N 3.35Å
877	N	27.4	Very low	29.4	Very low	154 Å²	154	148.7 Å²	148.7	82%	0.824	80%	0.802	S	S	*	*			trans	-61.8	113.5	155.3	-80.1	-21.1	0	0	0	108.3	K875	K875-N877 PolarHBondContact O-N 2.84Å
878	S	30.7	Very low	29.4	Very low	100 Å²	100	145.6 Å²	145.6	70%	0.699	80%	0.797	S	S	*	*			trans	-115	77.9	167.8	52.5	0	0	0	0	109.9	T876 I880	T876-S878 PolarHBondContact O-N 3.35Å; S878-I880 PolarHBondContact O-N 3.18Å
879	S	27.7	Very low	29.7	Very low	101 Å²	101	146.1 Å²	146.1	71%	0.706	80%	0.801	S	S	*	*			trans	-70.1	97.9	153.8	54	0	0	0	0	108.1	N881	S879-N881 PolarHBondContact O-N 3.35Å
880	I	31.6	Very low	29.7	Very low	154 Å²	154	149.1 Å²	149.1	79%	0.79	80%	0.801	S	S	*	*			trans	-85.2	95.6	172.5	-64.5	175.4	0	0	0	107.5	S878 S882	S878-I880 PolarHBondContact O-N 3.18Å; I880-S882 PolarHBondContact O-N 3.44Å
881	N	30.8	Very low	29.7	Very low	136 Å²	136	146.6 Å²	146.6	73%	0.727	80%	0.796	S	S	*	*			trans	-57.6	110.5	160.8	-80.4	-26.4	0	0	0	108.8	S879 T883	S879-N881 PolarHBondContact O-N 3.35Å; N881-T883 VanDerWaalsContact C-N 3.33Å; N881-T883 PolarHBondContact O-N 3.47Å; N881-T883 VanDerWaalsContact O-N 3.11Å
882	S	32.6	Very low	30.1	Very low	120 Å²	120	145.2 Å²	145.2	84%	0.839	80%	0.797	S	S	*	*			trans	-76.4	90.9	162.2	57.7	0	0	0	0	108.1	I880	I880-S882 PolarHBondContact O-N 3.44Å
883	T	33.4	Very low	30.2	Very low	123 Å²	123	144.5 Å²	144.5	76%	0.755	80%	0.795	S	S	*	*			trans	-66.6	138.3	174.3	17.6	0	0	0	0	111.6	N881 C885	N881-T883 VanDerWaalsContact C-N 3.33Å; N881-T883 PolarHBondContact O-N 3.47Å; N881-T883 VanDerWaalsContact O-N 3.11Å; T883-C885 PolarHBondContact O-N 2.68Å
884	Q	29.2	Very low	30.5	Very low	194 Å²	194	145.5 Å²	145.5	91%	0.907	81%	0.808	S	S	*	*			trans	-42.5	129.7	162.5	-76.4	165.2	-47	0	0	111.9
885	C	31.1	Very low	30.5	Very low	133 Å²	133	147.3 Å²	147.3	90%	0.899	81%	0.813	S	S	*	*			trans	-93.5	131.8	154.9	-79.9	0	0	0	0	108.1	T883	T883-C885 PolarHBondContact O-N 2.68Å
886	K	35.3	Very low	30.9	Very low	282 Å²	282	146.8 Å²	146.8	100%	1.226	83%	0.827	S	S	*	*			trans	-47.9	0	-172.8	-81	175.1	171.8	175.8	0	115.2

Retrieved 886 of 886 residues in 930.1 ms (Link to these results)

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