A0A3Q0KPG5_SCHMA Loading...

Putative fimbrin/plastin AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KPG5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 967 aa.

						>A0A3Q0KPG5_SCHMA|A0A3Q0KPG5
MVETVNDREARITRYSELLEAFASFDANNTGSLSVKYIIPALRKLGCKSTDPEILEAVKAAEVDQNAEKISFYDFKRIYQEACKGNPMVSSIGNAGSKSNLYHYGTYGDRVDDDTLHSVSEEEQVGFSSWIERNLLDDPECKRYLPFKSDGSDLYDKCTDGILLCKIINCSIPKTIDHRAINRHLPLTTYQMHENITLALNSARAIGCNVVNIGAGDIWNGTKHLLLGLLWQIIKIGLLKQINVVAHAELATLLEGEETINDFAKLSPEEILIRWVNYHLKGTDSGTRMENFSFDVRNSEVYAYLVEKIAPQEKKQYMHSARAILDAVDLVQRAEMVLQNAEQLNCRVFVRPEDIVSGSQKLNLAFLANLFHGYPALEKQPEVEEKVAEIEETREEKTYRNWINSLGYPNNVNYLFYDLIDGLILLRLFDSIQPHIVNWTIVHEPICDTPAKANFQCLENCNYVIKLGRQFGFSLVGVGGADLHDGKRTMTLALLWQLMRAYTLSLLTQLTEAEIAISGKSTNLNHGTSYPIEEMKIIEWANKKLINAGKFTKISTSSGFTDPNLKTSHAVIDLIEAIRPNTVDYNLVLPGNTKTEQLTNAEYAITLARRIGATVYAMPEDLIELKHKMIMTIFACLMAVDLKQNRKTVNSWKQVEKIEIVENRSFHSPTHSSRESLETKSYLYVGTNCKDNLEVNEDNNDADDIVEDNDDRKPCSKPTLLKDTPRPPPEKTFVKSFRVNLSSCRKSPITSLDDARQSYSQLGDCAEVDSLDGLVTANLVKVTNIRTIPSPKRSQSPIIHHHPGMNYHYMKSSSRSWSPVDLSINTSNKTYSKYVNQLSKSTNSVNHVGLNHPQKSFSPTLTNNNKQNSRSATQSPHENKRNTTDNHDLPFTTEKEYIEEKTTHSTLYTLVYPKEHFIDLKPSTYTNGLNNTIKTTSVTTTTTATKNRPHGGGRLFLATGARKDLII
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	39	Very low	239 Å²	239	98.6 Å²	98.6	100%	1.177	51%	0.51	S	S	*	.				0	142.2	0	-59.9	175.4	-168.5	0	0	106	E3	M1-E3 PolarHBondContact O-N 3.46Å
2	V	36.6	Very low	39.8	Very low	139 Å²	139	98.3 Å²	98.3	84%	0.842	51%	0.508	S	S	*	.			trans	-79	105.4	-178.1	-176.3	0	0	0	0	108.9	T4	V2-T4 PolarHBondContact O-N 2.83Å
3	E	32.2	Very low	40.7	Very low	103 Å²	103	95.1 Å²	95.1	48%	0.481	50%	0.496	S	S	.	.			trans	-72.2	106.2	167.4	-72.7	-170.2	-178.7	0	0	108.5	M1 R11	M1-E3 PolarHBondContact O-N 3.46Å; E3-R11 VanDerWaalsContact CD-CZ 3.45Å; E3-R11 IonicContact OE1-CZ 3.04Å; E3-R11 IonicContact OE1-NH1 3.69Å; E3-R11 PolarHBondContact OE1-NH1 3.36Å; E3-R11 IonicContact OE1-NH2 3.79Å; E3-R11 PolarHBondContact OE1-NH2 3.14Å; E3-R11 IonicContact OE2-CZ 2.64Å; E3-R11 VanDerWaalsContact OE2-CZ 3.27Å; E3-R11 IonicContact OE2-NH1 3.14Å; E3-R11 PolarHBondContact OE2-NH1 2.82Å; E3-R11 IonicContact OE2-NH2 3.48Å; E3-R11 PolarHBondContact OE2-NH2 3.43Å
4	T	37.7	Very low	42.6	Very low	85 Å²	85	91.6 Å²	91.6	52%	0.521	47%	0.473	S	S	.	.			trans	-66.2	153.8	171.8	56.1	0	0	0	0	110.3	V2 N6 D7	V2-T4 PolarHBondContact O-N 2.83Å; T4-N6 PolarHBondContact O-N 3.39Å; T4-N6 VanDerWaalsContact O-N 3.08Å; T4-D7 PolarHBondContact O-N 3.27Å
5	V	42.6	Very low	44.8	Very low	69 Å²	69	92.7 Å²	92.7	42%	0.418	47%	0.469	S	S	.	.	H	α-helix	trans	-46	-44.2	178.7	177.5	0	0	0	0	111.8	D7 R8 E9 E675	V5-D7 PolarHBondContact O-N 2.99Å; V5-R8 WeakPolarHBondContact O-CB 3.18Å; V5-R8 PolarHBondContact O-N 3.05Å; V5-E9 HydrophobicContact CG1-CG 4.19Å; V5-E9 WeakPolarHBondContact O-CG 3.43Å; V5-E9 PolarHBondContact O-N 3.3Å; V5-E675 WeakPolarHBondContact CG1-OE1 3.46Å; V5-E675 WeakPolarHBondContact CG2-OE1 3.32Å
6	N	39.4	Very low	46.6	Very low	112 Å²	112	90.9 Å²	90.9	60%	0.599	47%	0.468	S	S	*	.	H	α-helix	trans	-50.2	-31.4	176.4	-64.5	4	0	0	0	114.7	T4 A10	T4-N6 PolarHBondContact O-N 3.39Å; T4-N6 VanDerWaalsContact O-N 3.08Å; N6-A10 WeakPolarHBondContact O-CB 3.21Å; N6-A10 PolarHBondContact O-N 3.42Å
7	D	40.5	Very low	48.6	Very low	55 Å²	55	90.6 Å²	90.6	29%	0.294	46%	0.464	S	S	.	.	H	α-helix	trans	-80.7	-35.3	-179.8	-152.1	78	0	0	0	112.2	T4 V5 E9 A10 R11	T4-D7 PolarHBondContact O-N 3.27Å; V5-D7 PolarHBondContact O-N 2.99Å; D7-E9 VanDerWaalsContact C-N 3.33Å; D7-A10 PolarHBondContact O-N 3.04Å; D7-R11 WeakPolarHBondContact O-CD 3.49Å; D7-R11 WeakPolarHBondContact O-CG 3.48Å; D7-R11 PolarHBondContact O-N 2.93Å; D7-R11 VanDerWaalsContact O-N 3.1Å; D7-R11 IonicContact OD2-CZ 3.77Å; D7-R11 IonicContact OD2-NE 2.7Å; D7-R11 PolarHBondContact OD2-NE 3.42Å; D7-R11 IonicContact OD2-NH2 3.62Å; D7-R11 PolarHBondContact OD2-NH2 3.1Å
8	R	40.6	Very low	50.6	Low	120 Å²	120	85.7 Å²	85.7	45%	0.453	44%	0.439	S	S	.	.	H	α-helix	trans	-61.3	-43.4	166.7	-82.2	-174.2	172.4	-174.1	-0.7	110.9	V5 R11 I12	V5-R8 WeakPolarHBondContact O-CB 3.18Å; V5-R8 PolarHBondContact O-N 3.05Å; R8-R11 PolarHBondContact O-N 3.11Å; R8-I12 WeakPolarHBondContact O-CG1 3.47Å; R8-I12 PolarHBondContact O-N 2.87Å
9	E	37.9	Very low	52.3	Low	48 Å²	48	85.2 Å²	85.2	22%	0.224	44%	0.437	C	S	.	.	H	α-helix	trans	-59.7	-45.6	175.9	-66.6	-173	152.1	0	0	112.8	V5 D7 R11 I12 T13 R674	V5-E9 HydrophobicContact CG1-CG 4.19Å; V5-E9 WeakPolarHBondContact O-CG 3.43Å; V5-E9 PolarHBondContact O-N 3.3Å; D7-E9 VanDerWaalsContact C-N 3.33Å; E9-R11 VanDerWaalsContact C-N 3.33Å; E9-R11 PolarHBondContact O-N 3.46Å; E9-I12 PolarHBondContact O-N 2.92Å; E9-T13 PolarHBondContact O-N 2.78Å; E9-T13 PolarHBondContact O-OG1 3.08Å; E9-R674 WeakPolarHBondContact OE1-CD 3.36Å; E9-R674 IonicContact OE1-CZ 2.65Å; E9-R674 VanDerWaalsContact OE1-CZ 3.31Å; E9-R674 IonicContact OE1-NE 2.66Å; E9-R674 PolarHBondContact OE1-NE 3.33Å; E9-R674 IonicContact OE1-NH1 3.94Å; E9-R674 PolarHBondContact OE1-NH1 2.99Å; E9-R674 IonicContact OE2-CZ 3.16Å; E9-R674 IonicContact OE2-NH1 3.86Å; E9-R674 PolarHBondContact OE2-NH1 2.9Å; E9-R674 IonicContact OE2-NH2 2.89Å
10	A	41.1	Very low	53.8	Low	37 Å²	37	86.6 Å²	86.6	31%	0.306	44%	0.441	S	S	.	.	H	α-helix	trans	-63.1	-37.3	178.9	0	0	0	0	0	112.4	N6 D7 R14	N6-A10 WeakPolarHBondContact O-CB 3.21Å; N6-A10 PolarHBondContact O-N 3.42Å; D7-A10 PolarHBondContact O-N 3.04Å; A10-R14 WeakPolarHBondContact O-CB 3.42Å; A10-R14 PolarHBondContact O-N 2.78Å; A10-R14 VanDerWaalsContact O-N 3.1Å
11	R	45.7	Very low	55.3	Low	78 Å²	78	82.5 Å²	82.5	29%	0.294	42%	0.421	S	S	.	.	H	α-helix	trans	-64	-43.7	176	-69.4	163.5	-163.4	-153.5	-5.9	112.3	E3 D7 R8 E9 Y15	E3-R11 VanDerWaalsContact CD-CZ 3.45Å; E3-R11 IonicContact OE1-CZ 3.04Å; E3-R11 IonicContact OE1-NH1 3.69Å; E3-R11 PolarHBondContact OE1-NH1 3.36Å; E3-R11 IonicContact OE1-NH2 3.79Å; E3-R11 PolarHBondContact OE1-NH2 3.14Å; E3-R11 IonicContact OE2-CZ 2.64Å; E3-R11 VanDerWaalsContact OE2-CZ 3.27Å; E3-R11 IonicContact OE2-NH1 3.14Å; E3-R11 PolarHBondContact OE2-NH1 2.82Å; E3-R11 IonicContact OE2-NH2 3.48Å; E3-R11 PolarHBondContact OE2-NH2 3.43Å; D7-R11 WeakPolarHBondContact O-CD 3.49Å; D7-R11 WeakPolarHBondContact O-CG 3.48Å; D7-R11 PolarHBondContact O-N 2.93Å; D7-R11 VanDerWaalsContact O-N 3.1Å; D7-R11 IonicContact OD2-CZ 3.77Å; D7-R11 IonicContact OD2-NE 2.7Å; D7-R11 PolarHBondContact OD2-NE 3.42Å; D7-R11 IonicContact OD2-NH2 3.62Å; D7-R11 PolarHBondContact OD2-NH2 3.1Å; R8-R11 PolarHBondContact O-N 3.11Å; E9-R11 VanDerWaalsContact C-N 3.33Å; E9-R11 PolarHBondContact O-N 3.46Å; R11-Y15 PolarHBondContact O-N 3.26Å; R11-Y15 VanDerWaalsContact O-N 3.16Å
12	I	48.2	Very low	57.7	Low	95 Å²	95	71.7 Å²	71.7	49%	0.487	37%	0.367	S	S	.	.	H	α-helix	trans	-65.3	-48.3	178.5	-66.2	168.5	0	0	0	110.4	R8 E9 R14 Y15 S16 L677	R8-I12 WeakPolarHBondContact O-CG1 3.47Å; R8-I12 PolarHBondContact O-N 2.87Å; E9-I12 PolarHBondContact O-N 2.92Å; I12-R14 VanDerWaalsContact C-N 3.28Å; I12-R14 PolarHBondContact O-N 3.34Å; I12-Y15 PolarHBondContact O-N 3.16Å; I12-Y15 VanDerWaalsContact O-N 3.07Å; I12-S16 PolarHBondContact O-N 2.92Å; I12-S16 PolarHBondContact O-OG 3.26Å; I12-L677 HydrophobicContact CD1-CD1 3.68Å
13	T	50.9	Low	59.9	Low	56 Å²	56	67.4 Å²	67.4	34%	0.344	35%	0.346	S	S	.	.	H	α-helix	trans	-55	-44.7	179.2	-52.4	0	0	0	0	111.2	E9 Y15 S16 E17	E9-T13 PolarHBondContact O-N 2.78Å; E9-T13 PolarHBondContact O-OG1 3.08Å; T13-Y15 PolarHBondContact O-N 3.29Å; T13-S16 PolarHBondContact O-N 2.84Å; T13-S16 PolarHBondContact O-OG 3.35Å; T13-E17 WeakPolarHBondContact O-CG 3.33Å; T13-E17 PolarHBondContact O-N 2.85Å
14	R	68.5	Low	62.3	Low	47 Å²	47	65.1 Å²	65.1	18%	0.177	34%	0.342	C	S	.	.	H	α-helix	trans	-68.8	-29	177.4	-83.1	172.7	166	177.5	-3.4	115.5	A10 I12 E17 L18 M88	A10-R14 WeakPolarHBondContact O-CB 3.42Å; A10-R14 PolarHBondContact O-N 2.78Å; A10-R14 VanDerWaalsContact O-N 3.1Å; I12-R14 VanDerWaalsContact C-N 3.28Å; I12-R14 PolarHBondContact O-N 3.34Å; R14-E17 VanDerWaalsContact CG-OE2 3.25Å; R14-E17 WeakPolarHBondContact CG-OE2 3.45Å; R14-E17 PolarHBondContact O-N 2.86Å; R14-L18 WeakPolarHBondContact O-CB 3.48Å; R14-L18 PolarHBondContact O-N 3.03Å; R14-M88 PolarHBondContact NH1-O 3.18Å; R14-M88 PolarHBondContact NH2-SD 2.92Å
15	Y	74.5	Confident	64.6	Low	107 Å²	107	63.9 Å²	63.9	42%	0.42	33%	0.33	S	S	.	.	H	α-helix	trans	-70.3	-36.7	174	-168.5	-103.7	0	0	0	111.3	R11 I12 T13 L19 F72	R11-Y15 PolarHBondContact O-N 3.26Å; R11-Y15 VanDerWaalsContact O-N 3.16Å; I12-Y15 PolarHBondContact O-N 3.16Å; I12-Y15 VanDerWaalsContact O-N 3.07Å; T13-Y15 PolarHBondContact O-N 3.29Å; Y15-L19 HydrophobicContact CD1-CD1 3.89Å; Y15-L19 HydrophobicContact CE1-CD1 3.58Å; Y15-L19 HydrophobicContact CE1-CG 4.3Å; Y15-L19 PolarHBondContact O-N 3.14Å; Y15-L19 VanDerWaalsContact O-N 3.1Å; Y15-F72 AromaticContact CE2-CE1 3.8Å; Y15-F72 HydrophobicContact CE2-CE1 3.8Å; Y15-F72 HydrophobicContact CE2-CZ 4.02Å; Y15-F72 AromaticContact CZ-CE1 3.86Å
16	S	73.9	Confident	66.4	Low	65 Å²	65	61.1 Å²	61.1	46%	0.455	31%	0.312	S	S	.	.	H	α-helix	trans	-65.8	-41.3	169	36	0	0	0	0	112.9	I12 T13 L18 L19 E20	I12-S16 PolarHBondContact O-N 2.92Å; I12-S16 PolarHBondContact O-OG 3.26Å; T13-S16 PolarHBondContact O-N 2.84Å; T13-S16 PolarHBondContact O-OG 3.35Å; S16-L18 PolarHBondContact O-N 2.93Å; S16-L19 PolarHBondContact O-N 2.71Å; S16-E20 WeakPolarHBondContact O-CB 3.34Å; S16-E20 PolarHBondContact O-N 3.14Å
17	E	81.3	Confident	67.8	Low	85 Å²	85	60 Å²	60	40%	0.397	32%	0.319	S	S	.	.	H	α-helix	trans	-59.2	-46.8	174.4	-70	166.1	178.9	0	0	111.6	T13 R14 L19 E20 A21 L45	T13-E17 WeakPolarHBondContact O-CG 3.33Å; T13-E17 PolarHBondContact O-N 2.85Å; R14-E17 VanDerWaalsContact CG-OE2 3.25Å; R14-E17 WeakPolarHBondContact CG-OE2 3.45Å; R14-E17 PolarHBondContact O-N 2.86Å; E17-L19 PolarHBondContact O-N 3.41Å; E17-E20 PolarHBondContact O-N 3.44Å; E17-A21 WeakPolarHBondContact O-CB 3.37Å; E17-A21 PolarHBondContact O-N 3.2Å; E17-L45 HydrophobicContact CB-CD2 3.93Å; E17-L45 WeakPolarHBondContact O-CD2 3.33Å
18	L	84.2	Confident	69.4	Low	3 Å²	3	64 Å²	64	2%	0.016	34%	0.34	C	S	.	.	H	α-helix	trans	-56.3	-45.8	175.6	-91.2	158.7	0	0	0	112.3	R14 S16 F22 L45 F72 F75 Y79 I92	R14-L18 WeakPolarHBondContact O-CB 3.48Å; R14-L18 PolarHBondContact O-N 3.03Å; S16-L18 PolarHBondContact O-N 2.93Å; L18-F22 WeakPolarHBondContact O-CB 3.49Å; L18-F22 PolarHBondContact O-N 2.91Å; L18-L45 HydrophobicContact CD2-CD1 3.65Å; L18-L45 HydrophobicContact CG-CD1 4.22Å; L18-F72 HydrophobicContact CB-CE2 4.26Å; L18-F72 HydrophobicContact CB-CZ 4.2Å; L18-F75 HydrophobicContact CD2-CD1 4.31Å; L18-F75 HydrophobicContact CD2-CE1 3.97Å; L18-Y79 HydrophobicContact CD1-CD1 4.09Å; L18-Y79 HydrophobicContact CD1-CE1 4.26Å; L18-Y79 HydrophobicContact CD2-CD1 3.81Å; L18-Y79 HydrophobicContact CD2-CE1 4.42Å; L18-Y79 HydrophobicContact CD2-CG 3.89Å; L18-Y79 HydrophobicContact CG-CD1 4.29Å; L18-Y79 HydrophobicContact CG-CE1 4.47Å; L18-I92 HydrophobicContact CD1-CD1 4.31Å
19	L	83.3	Confident	70.6	Confident	75 Å²	75	61 Å²	61	39%	0.393	33%	0.333	S	S	.	.	H	α-helix	trans	-65.3	-45	176.1	-80.2	168.5	0	0	0	112	Y15 S16 E17 A21 F22 A23 F72	Y15-L19 HydrophobicContact CD1-CD1 3.89Å; Y15-L19 HydrophobicContact CE1-CD1 3.58Å; Y15-L19 HydrophobicContact CE1-CG 4.3Å; Y15-L19 PolarHBondContact O-N 3.14Å; Y15-L19 VanDerWaalsContact O-N 3.1Å; S16-L19 PolarHBondContact O-N 2.71Å; E17-L19 PolarHBondContact O-N 3.41Å; L19-A21 VanDerWaalsContact C-N 3.32Å; L19-A21 PolarHBondContact O-N 2.9Å; L19-F22 PolarHBondContact O-N 2.84Å; L19-A23 VanDerWaalsContact O-CB 3.23Å; L19-A23 WeakPolarHBondContact O-CB 3.42Å; L19-A23 PolarHBondContact O-N 3.24Å; L19-F72 HydrophobicContact CD2-CD1 4.34Å; L19-F72 HydrophobicContact CD2-CD2 4.11Å; L19-F72 HydrophobicContact CD2-CE1 3.96Å; L19-F72 HydrophobicContact CD2-CE2 3.72Å; L19-F72 HydrophobicContact CD2-CG 4.41Å; L19-F72 HydrophobicContact CD2-CZ 3.63Å; L19-F72 HydrophobicContact CG-CE1 4.38Å; L19-F72 HydrophobicContact CG-CE2 4.02Å; L19-F72 HydrophobicContact CG-CZ 3.74Å
20	E	82.8	Confident	72.5	Confident	113 Å²	113	62.3 Å²	62.3	53%	0.528	34%	0.344	S	S	.	.	H	α-helix	trans	-69	-31.1	-179.6	-157.9	-138	113.8	0	0	112.2	S16 E17 S24 K44	S16-E20 WeakPolarHBondContact O-CB 3.34Å; S16-E20 PolarHBondContact O-N 3.14Å; E17-E20 PolarHBondContact O-N 3.44Å; E20-S24 VanDerWaalsContact O-CB 3.22Å; E20-S24 WeakPolarHBondContact O-CB 3.48Å; E20-S24 PolarHBondContact O-N 3.03Å; E20-S24 VanDerWaalsContact O-N 3.13Å; E20-S24 PolarHBondContact O-OG 3.29Å; E20-K44 PolarHBondContact O-NZ 2.91Å; E20-K44 WeakPolarHBondContact OE1-CE 3.45Å; E20-K44 IonicContact OE1-NZ 2.88Å; E20-K44 PolarHBondContact OE1-NZ 2.62Å
21	A	84.1	Confident	74.1	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.008	35%	0.349	C	S	.	.	H	α-helix	trans	-65.7	-54.1	170.7	0	0	0	0	0	110.9	E17 L19 A23 S24 F25 K44 L45	E17-A21 WeakPolarHBondContact O-CB 3.37Å; E17-A21 PolarHBondContact O-N 3.2Å; L19-A21 VanDerWaalsContact C-N 3.32Å; L19-A21 PolarHBondContact O-N 2.9Å; A21-A23 PolarHBondContact O-N 3.27Å; A21-S24 PolarHBondContact O-N 3.35Å; A21-S24 PolarHBondContact O-OG 2.96Å; A21-F25 WeakPolarHBondContact O-CD2 3.49Å; A21-K44 HydrophobicContact CB-CD 4.43Å; A21-L45 HydrophobicContact CB-CD1 4Å; A21-L45 HydrophobicContact CB-CD2 3.59Å; A21-L45 HydrophobicContact CB-CG 3.58Å
22	F	85.8	Confident	75.9	Confident	12 Å²	12	60 Å²	60	5%	0.053	34%	0.344	C	S	.	.	H	α-helix	trans	-58	-51	178.9	-174.2	-87.6	0	0	0	112.2	L18 L19 S24 F25 D26 L33 F72 F75	L18-F22 WeakPolarHBondContact O-CB 3.49Å; L18-F22 PolarHBondContact O-N 2.91Å; L19-F22 PolarHBondContact O-N 2.84Å; F22-S24 VanDerWaalsContact C-N 3.27Å; F22-S24 PolarHBondContact O-N 3.41Å; F22-F25 PolarHBondContact O-N 3.29Å; F22-D26 HydrophobicContact CD1-CB 4.38Å; F22-D26 HydrophobicContact CE1-CB 4.16Å; F22-D26 PolarHBondContact O-N 3.17Å; F22-L33 HydrophobicContact CD2-CB 3.99Å; F22-L33 HydrophobicContact CD2-CD2 4.46Å; F22-L33 HydrophobicContact CE2-CB 3.47Å; F22-L33 VanDerWaalsContact CE2-CB 3.47Å; F22-L33 HydrophobicContact CZ-CB 3.95Å; F22-F72 HydrophobicContact CB-CD2 3.79Å; F22-F72 HydrophobicContact CB-CE2 4.16Å; F22-F72 HydrophobicContact CD1-CB 4.41Å; F22-F72 HydrophobicContact CD1-CD2 4.15Å; F22-F72 HydrophobicContact CD2-CB 4.3Å; F22-F72 AromaticContact CD2-CD2 3.91Å; F22-F72 HydrophobicContact CD2-CD2 3.91Å; F22-F72 HydrophobicContact CE1-CB 4.19Å; F22-F72 VanDerWaalsContact CE2-CA 3.47Å; F22-F72 HydrophobicContact CE2-CB 4.04Å; F22-F72 HydrophobicContact CE2-CD2 4.49Å; F22-F72 HydrophobicContact CG-CB 4.47Å; F22-F72 AromaticContact CG-CD2 3.7Å; F22-F72 HydrophobicContact CG-CD2 3.7Å; F22-F72 HydrophobicContact CZ-CB 3.98Å; F22-F75 HydrophobicContact CB-CD1 4.04Å; F22-F75 HydrophobicContact CB-CE1 4.17Å; F22-F75 HydrophobicContact CD2-CB 3.74Å; F22-F75 AromaticContact CD2-CD1 3.72Å; F22-F75 HydrophobicContact CD2-CD1 3.72Å; F22-F75 AromaticContact CD2-CG 3.78Å; F22-F75 HydrophobicContact CD2-CG 3.78Å; F22-F75 HydrophobicContact CE2-CB 3.95Å; F22-F75 HydrophobicContact CE2-CG 4.45Å; F22-F75 HydrophobicContact CG-CD1 4.37Å
23	A	82.2	Confident	77.6	Confident	49 Å²	49	55.4 Å²	55.4	41%	0.405	32%	0.32	S	S	.	.	H	α-helix	trans	-61.5	-33.1	180	0	0	0	0	0	112.8	L19 A21 F25 D26	L19-A23 VanDerWaalsContact O-CB 3.23Å; L19-A23 WeakPolarHBondContact O-CB 3.42Å; L19-A23 PolarHBondContact O-N 3.24Å; A21-A23 PolarHBondContact O-N 3.27Å; A23-F25 PolarHBondContact O-N 2.66Å; A23-D26 PolarHBondContact O-N 3.08Å
24	S	84.1	Confident	79.1	Confident	56 Å²	56	54.6 Å²	54.6	39%	0.392	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-8.2	176.7	67.3	0	0	0	0	115.2	E20 A21 F22 K44	E20-S24 VanDerWaalsContact O-CB 3.22Å; E20-S24 WeakPolarHBondContact O-CB 3.48Å; E20-S24 PolarHBondContact O-N 3.03Å; E20-S24 VanDerWaalsContact O-N 3.13Å; E20-S24 PolarHBondContact O-OG 3.29Å; A21-S24 PolarHBondContact O-N 3.35Å; A21-S24 PolarHBondContact O-OG 2.96Å; F22-S24 VanDerWaalsContact C-N 3.27Å; F22-S24 PolarHBondContact O-N 3.41Å; S24-K44 VanDerWaalsContact CB-NZ 3.31Å; S24-K44 WeakPolarHBondContact OG-CD 3.41Å; S24-K44 PolarHBondContact OG-NZ 2.92Å
25	F	84.5	Confident	79.9	Confident	59 Å²	59	55.6 Å²	55.6	26%	0.259	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-18.9	173.4	-70.5	-80	0	0	0	113.7	A21 F22 A23 A27 L33 Y37 P40 A41 K44	A21-F25 WeakPolarHBondContact O-CD2 3.49Å; F22-F25 PolarHBondContact O-N 3.29Å; A23-F25 PolarHBondContact O-N 2.66Å; F25-A27 PolarHBondContact O-N 3.48Å; F25-L33 HydrophobicContact CB-CD1 3.36Å; F25-L33 HydrophobicContact CG-CD1 4.47Å; F25-Y37 HydrophobicContact CB-CD2 4.45Å; F25-Y37 HydrophobicContact CB-CG 4.19Å; F25-Y37 AromaticContact CD1-CD1 3.81Å; F25-Y37 HydrophobicContact CD1-CD1 3.81Å; F25-Y37 HydrophobicContact CD1-CE1 4.5Å; F25-Y37 AromaticContact CD1-CG 3.99Å; F25-Y37 HydrophobicContact CD1-CG 3.99Å; F25-Y37 HydrophobicContact CE1-CD1 4.42Å; F25-Y37 HydrophobicContact CG-CG 4.44Å; F25-P40 HydrophobicContact CD1-CB 4.29Å; F25-P40 HydrophobicContact CE1-CB 3.53Å; F25-P40 HydrophobicContact CE2-CB 4.19Å; F25-P40 HydrophobicContact CZ-CB 3.47Å; F25-P40 VanDerWaalsContact CZ-CB 3.47Å; F25-A41 HydrophobicContact CD2-CB 3.64Å; F25-A41 HydrophobicContact CE2-CB 4.01Å; F25-A41 HydrophobicContact CG-CB 4.42Å; F25-K44 HydrophobicContact CE2-CB 4.44Å; F25-K44 HydrophobicContact CE2-CD 4.43Å
26	D	82.1	Confident	80.3	Confident	11 Å²	11	57.3 Å²	57.3	6%	0.059	34%	0.338	C	S	.	.			trans	-85.4	61	163.5	-174.2	13.1	0	0	0	110.8	F22 A23 N28 N29 T30 G31 S32	F22-D26 HydrophobicContact CD1-CB 4.38Å; F22-D26 HydrophobicContact CE1-CB 4.16Å; F22-D26 PolarHBondContact O-N 3.17Å; A23-D26 PolarHBondContact O-N 3.08Å; D26-N28 PolarHBondContact O-N 3.4Å; D26-N29 PolarHBondContact O-N 2.98Å; D26-N29 PolarHBondContact OD1-N 3.27Å; D26-T30 VanDerWaalsContact CG-N 3.29Å; D26-T30 WeakPolarHBondContact OD1-CB 3.38Å; D26-T30 PolarHBondContact OD1-N 2.95Å; D26-T30 PolarHBondContact OD1-OG1 3.26Å; D26-T30 PolarHBondContact OD2-N 3.46Å; D26-T30 PolarHBondContact OD2-OG1 3.04Å; D26-G31 WeakPolarHBondContact OD2-CA 3.02Å; D26-G31 PolarHBondContact OD2-N 3.02Å; D26-S32 PolarHBondContact OD2-N 3.42Å; D26-S32 VanDerWaalsContact OD2-N 3.08Å
27	A	68.9	Low	81	Confident	88 Å²	88	58.3 Å²	58.3	73%	0.727	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-10.7	-175.9	0	0	0	0	0	114.8	F25	F25-A27 PolarHBondContact O-N 3.48Å
28	N	73.4	Confident	81.3	Confident	139 Å²	139	54.6 Å²	54.6	74%	0.743	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	5.8	177.3	-70.1	8.6	0	0	0	112.7	D26 T30	D26-N28 PolarHBondContact O-N 3.4Å; N28-T30 HydrophobicContact CB-CG2 3.77Å; N28-T30 PolarHBondContact O-N 3.18Å
29	N	66.2	Low	81.4	Confident	57 Å²	57	56.9 Å²	56.9	31%	0.305	33%	0.327	S	S	.	.			trans	51.7	38.6	-179.1	-78.4	-8.5	0	0	0	113.9	D26 G31 F737	D26-N29 PolarHBondContact O-N 2.98Å; D26-N29 PolarHBondContact OD1-N 3.27Å; N29-G31 VanDerWaalsContact C-N 3.29Å; N29-G31 PolarHBondContact O-N 3.01Å; N29-F737 HydrophobicContact CB-CB 3.76Å; N29-F737 WeakPolarHBondContact CB-O 3.19Å; N29-F737 PolarHBondContact ND2-O 3.29Å
30	T	76.6	Confident	81.6	Confident	75 Å²	75	55.6 Å²	55.6	46%	0.46	32%	0.323	S	S	.	.			trans	-76.9	-12.9	-176.3	62.3	0	0	0	0	114	D26 N28 S32	D26-T30 VanDerWaalsContact CG-N 3.29Å; D26-T30 WeakPolarHBondContact OD1-CB 3.38Å; D26-T30 PolarHBondContact OD1-N 2.95Å; D26-T30 PolarHBondContact OD1-OG1 3.26Å; D26-T30 PolarHBondContact OD2-N 3.46Å; D26-T30 PolarHBondContact OD2-OG1 3.04Å; N28-T30 HydrophobicContact CB-CG2 3.77Å; N28-T30 PolarHBondContact O-N 3.18Å; T30-S32 PolarHBondContact OG1-N 3.07Å; T30-S32 PolarHBondContact OG1-O 3.11Å; T30-S32 VanDerWaalsContact OG1-O 3.05Å; T30-S32 PolarHBondContact OG1-OG 3.04Å
31	G	75.6	Confident	81.8	Confident	39 Å²	39	50.2 Å²	50.2	40%	0.402	30%	0.298	S	S	.	.	S	Bend	trans	73.6	15.7	-166.1	0	0	0	0	0	112.9	D26 N29	D26-G31 WeakPolarHBondContact OD2-CA 3.02Å; D26-G31 PolarHBondContact OD2-N 3.02Å; N29-G31 VanDerWaalsContact C-N 3.29Å; N29-G31 PolarHBondContact O-N 3.01Å
32	S	82.2	Confident	81.9	Confident	27 Å²	27	50.2 Å²	50.2	19%	0.189	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	131.1	-171.2	72.9	0	0	0	0	113.3	D26 T30 I70	D26-S32 PolarHBondContact OD2-N 3.42Å; D26-S32 VanDerWaalsContact OD2-N 3.08Å; T30-S32 PolarHBondContact OG1-N 3.07Å; T30-S32 PolarHBondContact OG1-O 3.11Å; T30-S32 VanDerWaalsContact OG1-O 3.05Å; T30-S32 PolarHBondContact OG1-OG 3.04Å; S32-I70 CarbonylContact C-O 3.53Å; S32-I70 VanDerWaalsContact CA-O 3.31Å; S32-I70 WeakPolarHBondContact CA-O 3.4Å
33	L	84	Confident	81.9	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	125.6	-179.7	-175.1	81.7	0	0	0	109.4	F22 F25 I38 A41 K69 I70 F75	F22-L33 HydrophobicContact CD2-CB 3.99Å; F22-L33 HydrophobicContact CD2-CD2 4.46Å; F22-L33 HydrophobicContact CE2-CB 3.47Å; F22-L33 VanDerWaalsContact CE2-CB 3.47Å; F22-L33 HydrophobicContact CZ-CB 3.95Å; F25-L33 HydrophobicContact CB-CD1 3.36Å; F25-L33 HydrophobicContact CG-CD1 4.47Å; L33-I38 HydrophobicContact CD2-CG1 4.03Å; L33-A41 HydrophobicContact CD2-CB 4.35Å; L33-K69 CarbonylContact O-C 3.45Å; L33-K69 VanDerWaalsContact O-CA 3.31Å; L33-K69 WeakPolarHBondContact O-CA 3.38Å; L33-I70 HydrophobicContact CB-CG1 3.95Å; L33-I70 HydrophobicContact CD2-CD1 4.19Å; L33-I70 HydrophobicContact CD2-CG1 4.35Å; L33-I70 PolarHBondContact N-O 2.83Å; L33-I70 WeakPolarHBondContact O-CG1 3.39Å; L33-I70 PolarHBondContact O-N 2.67Å; L33-F75 HydrophobicContact CD2-CD2 3.78Å; L33-F75 HydrophobicContact CD2-CE2 4.19Å; L33-F75 HydrophobicContact CD2-CG 4.4Å
34	S	83.8	Confident	82	Confident	38 Å²	38	56 Å²	56	27%	0.266	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	139.6	172.6	-176.3	0	0	0	0	110.9	K36 Y37 E68	S34-K36 PolarHBondContact O-N 3.25Å; S34-Y37 PolarHBondContact O-N 3.21Å; S34-E68 VanDerWaalsContact CA-O 3.29Å; S34-E68 WeakPolarHBondContact CA-O 3.31Å; S34-E68 PolarHBondContact OG-O 2.84Å; S34-E68 VanDerWaalsContact OG-O 3.13Å
35	V	83.6	Confident	81.9	Confident	69 Å²	69	54.5 Å²	54.5	42%	0.418	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-49.3	-37.8	-172.5	168.8	0	0	0	0	113.6	Y37 I38 A67 E68 I70	V35-Y37 PolarHBondContact O-N 3.43Å; V35-I38 HydrophobicContact CB-CD1 4.2Å; V35-I38 HydrophobicContact CG1-CD1 4.05Å; V35-I38 HydrophobicContact CG2-CD1 4.22Å; V35-I38 WeakPolarHBondContact O-CB 3.24Å; V35-I38 VanDerWaalsContact O-CG1 3.31Å; V35-I38 WeakPolarHBondContact O-CG1 3.46Å; V35-I38 PolarHBondContact O-N 2.93Å; V35-A67 WeakPolarHBondContact CG2-O 3.3Å; V35-E68 PolarHBondContact N-O 2.88Å; V35-E68 VanDerWaalsContact N-O 3.14Å; V35-I70 HydrophobicContact CG2-CG2 4.13Å
36	K	84.9	Confident	81.7	Confident	143 Å²	143	54.2 Å²	54.2	62%	0.622	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-57.3	-18.4	176.1	63.5	-178.7	174	175.9	0	115.3	S34	S34-K36 PolarHBondContact O-N 3.25Å
37	Y	87.8	Confident	81.5	Confident	86 Å²	86	54.1 Å²	54.1	34%	0.337	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-99.9	-2.1	178.6	-58.7	-50.8	0	0	0	114	F25 S34 V35 A41	F25-Y37 HydrophobicContact CB-CD2 4.45Å; F25-Y37 HydrophobicContact CB-CG 4.19Å; F25-Y37 AromaticContact CD1-CD1 3.81Å; F25-Y37 HydrophobicContact CD1-CD1 3.81Å; F25-Y37 HydrophobicContact CD1-CE1 4.5Å; F25-Y37 AromaticContact CD1-CG 3.99Å; F25-Y37 HydrophobicContact CD1-CG 3.99Å; F25-Y37 HydrophobicContact CE1-CD1 4.42Å; F25-Y37 HydrophobicContact CG-CG 4.44Å; S34-Y37 PolarHBondContact O-N 3.21Å; V35-Y37 PolarHBondContact O-N 3.43Å; Y37-A41 VanDerWaalsContact O-CB 3.25Å; Y37-A41 WeakPolarHBondContact O-CB 3.42Å; Y37-A41 PolarHBondContact O-N 2.96Å
38	I	86.5	Confident	82	Confident	7 Å²	7	59.4 Å²	59.4	4%	0.036	32%	0.319	C	S	.	.	H	α-helix	trans	-57.7	-55.9	177.5	-66.7	169.5	0	0	0	110.5	L33 V35 A41 L42 I54 V58 I70 I78	L33-I38 HydrophobicContact CD2-CG1 4.03Å; V35-I38 HydrophobicContact CB-CD1 4.2Å; V35-I38 HydrophobicContact CG1-CD1 4.05Å; V35-I38 HydrophobicContact CG2-CD1 4.22Å; V35-I38 WeakPolarHBondContact O-CB 3.24Å; V35-I38 VanDerWaalsContact O-CG1 3.31Å; V35-I38 WeakPolarHBondContact O-CG1 3.46Å; V35-I38 PolarHBondContact O-N 2.93Å; I38-A41 PolarHBondContact O-N 3.17Å; I38-L42 HydrophobicContact CG2-CD1 3.66Å; I38-L42 HydrophobicContact CG2-CG 4.33Å; I38-L42 VanDerWaalsContact O-CG 3.24Å; I38-L42 WeakPolarHBondContact O-CG 3.43Å; I38-L42 PolarHBondContact O-N 2.87Å; I38-I54 HydrophobicContact CG2-CG2 4.29Å; I38-V58 HydrophobicContact CD1-CG2 4.34Å; I38-V58 HydrophobicContact CG2-CG2 4.23Å; I38-I70 HydrophobicContact CD1-CD1 3.79Å; I38-I70 HydrophobicContact CD1-CG1 4.45Å; I38-I70 HydrophobicContact CD1-CG2 4.29Å; I38-I70 HydrophobicContact CG1-CD1 3.7Å; I38-I70 HydrophobicContact CG1-CG1 4.43Å; I38-I78 HydrophobicContact CD1-CD1 4.09Å; I38-I78 HydrophobicContact CG2-CD1 4.47Å; I38-I78 HydrophobicContact CG2-CG2 4Å
39	I	87.1	Confident	82.3	Confident	50 Å²	50	53.8 Å²	53.8	26%	0.256	29%	0.291	S	S	.	.	H	α-helix	trans	-59.5	-51.6	179.4	-65.5	165	0	0	0	110.9	A41 L42 R43 D51 I54	I39-A41 PolarHBondContact O-N 3.47Å; I39-L42 PolarHBondContact O-N 2.9Å; I39-R43 HydrophobicContact CG2-CG 4.1Å; I39-R43 WeakPolarHBondContact O-CB 3.47Å; I39-R43 WeakPolarHBondContact O-CG 3.45Å; I39-R43 PolarHBondContact O-N 3.39Å; I39-D51 HydrophobicContact CD1-CB 4.34Å; I39-I54 HydrophobicContact CG1-CB 4.34Å; I39-I54 HydrophobicContact CG1-CD1 4.25Å; I39-I54 HydrophobicContact CG1-CG2 3.73Å; I39-I54 HydrophobicContact CG2-CD1 4.34Å
40	P	87.2	Confident	83.2	Confident	49 Å²	49	54.1 Å²	54.1	32%	0.318	29%	0.294	S	S	.	.	H	α-helix	trans	-51.7	-43.8	172.9	-31.2	35.5	0	0	0	115.6	F25 R43 K44	F25-P40 HydrophobicContact CD1-CB 4.29Å; F25-P40 HydrophobicContact CE1-CB 3.53Å; F25-P40 HydrophobicContact CE2-CB 4.19Å; F25-P40 HydrophobicContact CZ-CB 3.47Å; F25-P40 VanDerWaalsContact CZ-CB 3.47Å; P40-R43 PolarHBondContact O-N 3.2Å; P40-K44 PolarHBondContact O-N 3.04Å
41	A	87	Confident	83.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-70.8	-40.2	-179.2	0	0	0	0	0	112.3	F25 L33 Y37 I38 I39 K44 L45 F75	F25-A41 HydrophobicContact CD2-CB 3.64Å; F25-A41 HydrophobicContact CE2-CB 4.01Å; F25-A41 HydrophobicContact CG-CB 4.42Å; L33-A41 HydrophobicContact CD2-CB 4.35Å; Y37-A41 VanDerWaalsContact O-CB 3.25Å; Y37-A41 WeakPolarHBondContact O-CB 3.42Å; Y37-A41 PolarHBondContact O-N 2.96Å; I38-A41 PolarHBondContact O-N 3.17Å; I39-A41 PolarHBondContact O-N 3.47Å; A41-K44 PolarHBondContact O-N 3.18Å; A41-L45 PolarHBondContact O-N 2.83Å; A41-F75 HydrophobicContact CB-CE2 3.5Å; A41-F75 HydrophobicContact CB-CZ 3.49Å; A41-F75 VanDerWaalsContact CB-CZ 3.49Å
42	L	86.6	Confident	84	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-38.8	172.6	-64.4	169.5	0	0	0	111.7	I38 I39 K44 L45 C47 I54 F75 I78 Y79	I38-L42 HydrophobicContact CG2-CD1 3.66Å; I38-L42 HydrophobicContact CG2-CG 4.33Å; I38-L42 VanDerWaalsContact O-CG 3.24Å; I38-L42 WeakPolarHBondContact O-CG 3.43Å; I38-L42 PolarHBondContact O-N 2.87Å; I39-L42 PolarHBondContact O-N 2.9Å; L42-K44 VanDerWaalsContact C-N 3.34Å; L42-K44 PolarHBondContact O-N 3.37Å; L42-L45 WeakPolarHBondContact O-CB 3.39Å; L42-L45 PolarHBondContact O-N 3.42Å; L42-L45 VanDerWaalsContact O-N 3.14Å; L42-C47 HydrophobicContact CB-CB 3.99Å; L42-C47 WeakPolarHBondContact O-CB 3.21Å; L42-C47 PolarHBondContact O-N 3Å; L42-C47 VanDerWaalsContact O-N 3.07Å; L42-I54 HydrophobicContact CD1-CB 4.45Å; L42-I54 HydrophobicContact CD1-CD1 4.22Å; L42-I54 HydrophobicContact CD1-CG1 4.19Å; L42-I54 HydrophobicContact CD1-CG2 3.46Å; L42-I54 VanDerWaalsContact CD1-CG2 3.46Å; L42-F75 HydrophobicContact CD2-CE2 3.83Å; L42-F75 HydrophobicContact CD2-CZ 4.16Å; L42-F75 HydrophobicContact CG-CE2 3.95Å; L42-I78 HydrophobicContact CD1-CG2 3.96Å; L42-Y79 HydrophobicContact CD2-CD2 3.7Å; L42-Y79 HydrophobicContact CD2-CG 4.18Å
43	R	85.2	Confident	84.1	Confident	89 Å²	89	59.8 Å²	59.8	34%	0.336	31%	0.312	S	S	.	.	H	α-helix	trans	-64	-37.5	175.1	-67.9	-79.4	176.8	-120.1	-5.5	111.6	I39 P40 L45 G46 C47 S49 D51	I39-R43 HydrophobicContact CG2-CG 4.1Å; I39-R43 WeakPolarHBondContact O-CB 3.47Å; I39-R43 WeakPolarHBondContact O-CG 3.45Å; I39-R43 PolarHBondContact O-N 3.39Å; P40-R43 PolarHBondContact O-N 3.2Å; R43-L45 VanDerWaalsContact C-N 3.26Å; R43-L45 PolarHBondContact O-N 3.13Å; R43-G46 PolarHBondContact O-N 3.12Å; R43-C47 PolarHBondContact NH1-O 3.43Å; R43-S49 VanDerWaalsContact CZ-O 3.22Å; R43-S49 PolarHBondContact NH1-O 3.17Å; R43-S49 PolarHBondContact NH2-O 2.9Å; R43-D51 IonicContact CZ-OD1 2.88Å; R43-D51 IonicContact NE-OD1 2.77Å; R43-D51 IonicContact NH2-OD1 3.46Å; R43-D51 PolarHBondContact NH2-OD1 3.26Å
44	K	83.9	Confident	84.1	Confident	94 Å²	94	59.9 Å²	59.9	41%	0.409	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-32.1	172.6	-173.2	-178.2	166.7	-164.8	0	112.4	E20 A21 S24 F25 P40 A41 L42 G46	E20-K44 PolarHBondContact O-NZ 2.91Å; E20-K44 WeakPolarHBondContact OE1-CE 3.45Å; E20-K44 IonicContact OE1-NZ 2.88Å; E20-K44 PolarHBondContact OE1-NZ 2.62Å; A21-K44 HydrophobicContact CB-CD 4.43Å; S24-K44 VanDerWaalsContact CB-NZ 3.31Å; S24-K44 WeakPolarHBondContact OG-CD 3.41Å; S24-K44 PolarHBondContact OG-NZ 2.92Å; F25-K44 HydrophobicContact CE2-CB 4.44Å; F25-K44 HydrophobicContact CE2-CD 4.43Å; P40-K44 PolarHBondContact O-N 3.04Å; A41-K44 PolarHBondContact O-N 3.18Å; L42-K44 VanDerWaalsContact C-N 3.34Å; L42-K44 PolarHBondContact O-N 3.37Å; K44-G46 PolarHBondContact O-N 2.97Å
45	L	82.6	Confident	84.1	Confident	25 Å²	25	63 Å²	63	13%	0.131	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	7.3	172.7	-64.4	169.1	0	0	0	114	E17 L18 A21 A41 L42 R43 C47 F75 Y79	E17-L45 HydrophobicContact CB-CD2 3.93Å; E17-L45 WeakPolarHBondContact O-CD2 3.33Å; L18-L45 HydrophobicContact CD2-CD1 3.65Å; L18-L45 HydrophobicContact CG-CD1 4.22Å; A21-L45 HydrophobicContact CB-CD1 4Å; A21-L45 HydrophobicContact CB-CD2 3.59Å; A21-L45 HydrophobicContact CB-CG 3.58Å; A41-L45 PolarHBondContact O-N 2.83Å; L42-L45 WeakPolarHBondContact O-CB 3.39Å; L42-L45 PolarHBondContact O-N 3.42Å; L42-L45 VanDerWaalsContact O-N 3.14Å; R43-L45 VanDerWaalsContact C-N 3.26Å; R43-L45 PolarHBondContact O-N 3.13Å; L45-C47 PolarHBondContact O-N 3.42Å; L45-F75 HydrophobicContact CD1-CE1 3.94Å; L45-F75 HydrophobicContact CD1-CZ 3.79Å; L45-Y79 HydrophobicContact CB-CD2 4.28Å; L45-Y79 HydrophobicContact CB-CE2 3.72Å; L45-Y79 HydrophobicContact CD1-CD2 3.64Å; L45-Y79 HydrophobicContact CD1-CE2 3.82Å; L45-Y79 HydrophobicContact CD1-CG 4.19Å; L45-Y79 HydrophobicContact CG-CE2 4.37Å
46	G	80.2	Confident	84.1	Confident	53 Å²	53	64.8 Å²	64.8	55%	0.546	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	70	16.8	-177.6	0	0	0	0	0	114.2	R43 K44 K48	R43-G46 PolarHBondContact O-N 3.12Å; K44-G46 PolarHBondContact O-N 2.97Å; G46-K48 PolarHBondContact O-N 2.78Å
47	C	79.3	Confident	84.1	Confident	8 Å²	8	58.3 Å²	58.3	5%	0.054	30%	0.303	C	S	.	.			trans	-60.3	120.2	174.2	-173.1	0	0	0	0	109.7	L42 R43 L45 S49	L42-C47 HydrophobicContact CB-CB 3.99Å; L42-C47 WeakPolarHBondContact O-CB 3.21Å; L42-C47 PolarHBondContact O-N 3Å; L42-C47 VanDerWaalsContact O-N 3.07Å; R43-C47 PolarHBondContact NH1-O 3.43Å; L45-C47 PolarHBondContact O-N 3.42Å; C47-S49 PolarHBondContact SG-OG 3.11Å
48	K	77.7	Confident	83.9	Confident	200 Å²	200	55.3 Å²	55.3	87%	0.87	29%	0.293	S	S	*	.			trans	-91.9	-14.7	-176.2	-64.7	-173.3	179	-179.6	0	113.9	G46	G46-K48 PolarHBondContact O-N 2.78Å
49	S	80.8	Confident	83.8	Confident	21 Å²	21	59.7 Å²	59.7	15%	0.147	31%	0.312	C	S	.	.	S	Bend	trans	-57.8	141.3	-176.1	-37.6	0	0	0	0	111.3	R43 C47 E53 A82	R43-S49 VanDerWaalsContact CZ-O 3.22Å; R43-S49 PolarHBondContact NH1-O 3.17Å; R43-S49 PolarHBondContact NH2-O 2.9Å; C47-S49 PolarHBondContact SG-OG 3.11Å; S49-E53 WeakPolarHBondContact CA-OE2 3.4Å; S49-E53 VanDerWaalsContact CB-OE2 3.3Å; S49-E53 WeakPolarHBondContact CB-OE2 3.49Å; S49-A82 WeakPolarHBondContact CB-O 3.38Å; S49-A82 PolarHBondContact OG-O 2.96Å
50	T	84.8	Confident	83.7	Confident	63 Å²	63	59.8 Å²	59.8	39%	0.387	32%	0.32	S	S	.	.			trans	-67.3	158.7	-174.2	67.4	0	0	0	0	112.1	P52 E53 I54	T50-P52 VanDerWaalsContact C-N 3.35Å; T50-P52 WeakPolarHBondContact OG1-CG 3.4Å; T50-E53 WeakPolarHBondContact CB-OE1 3.41Å; T50-E53 VanDerWaalsContact CG2-OE1 3.24Å; T50-E53 WeakPolarHBondContact CG2-OE1 3.38Å; T50-E53 VanDerWaalsContact N-CD 3.29Å; T50-E53 PolarHBondContact N-OE2 2.99Å; T50-E53 WeakPolarHBondContact O-CA 3.41Å; T50-E53 WeakPolarHBondContact O-CB 3.23Å; T50-E53 PolarHBondContact O-N 3.45Å; T50-E53 WeakPolarHBondContact OG1-CG 3.49Å; T50-E53 PolarHBondContact OG1-OE1 3.45Å; T50-I54 PolarHBondContact O-N 2.88Å
51	D	84.1	Confident	83.4	Confident	77 Å²	77	57.7 Å²	57.7	41%	0.412	31%	0.307	S	S	.	.	H	α-helix	trans	-53.7	-40.6	178.4	-71.5	8.1	0	0	0	113.8	I39 R43 I54 L55	I39-D51 HydrophobicContact CD1-CB 4.34Å; R43-D51 IonicContact CZ-OD1 2.88Å; R43-D51 IonicContact NE-OD1 2.77Å; R43-D51 IonicContact NH2-OD1 3.46Å; R43-D51 PolarHBondContact NH2-OD1 3.26Å; D51-I54 PolarHBondContact O-N 3Å; D51-L55 WeakPolarHBondContact O-CG 3.49Å; D51-L55 PolarHBondContact O-N 3.33Å
52	P	84.9	Confident	83.2	Confident	86 Å²	86	65.6 Å²	65.6	56%	0.558	34%	0.344	S	S	*	.	H	α-helix	trans	-68.1	-32.4	171.2	24.6	-33.3	0	0	0	114.1	T50 I54 L55 E56	T50-P52 VanDerWaalsContact C-N 3.35Å; T50-P52 WeakPolarHBondContact OG1-CG 3.4Å; P52-I54 VanDerWaalsContact C-N 3.32Å; P52-L55 PolarHBondContact O-N 2.76Å; P52-E56 PolarHBondContact O-N 2.95Å
53	E	84.4	Confident	82.7	Confident	98 Å²	98	66.3 Å²	66.3	46%	0.458	35%	0.348	S	S	.	.	H	α-helix	trans	-64.7	-37.3	171.6	-71.5	150.9	-134.9	0	0	111.6	S49 T50 E56 A57	S49-E53 WeakPolarHBondContact CA-OE2 3.4Å; S49-E53 VanDerWaalsContact CB-OE2 3.3Å; S49-E53 WeakPolarHBondContact CB-OE2 3.49Å; T50-E53 WeakPolarHBondContact CB-OE1 3.41Å; T50-E53 VanDerWaalsContact CG2-OE1 3.24Å; T50-E53 WeakPolarHBondContact CG2-OE1 3.38Å; T50-E53 VanDerWaalsContact N-CD 3.29Å; T50-E53 PolarHBondContact N-OE2 2.99Å; T50-E53 WeakPolarHBondContact O-CA 3.41Å; T50-E53 WeakPolarHBondContact O-CB 3.23Å; T50-E53 PolarHBondContact O-N 3.45Å; T50-E53 WeakPolarHBondContact OG1-CG 3.49Å; T50-E53 PolarHBondContact OG1-OE1 3.45Å; E53-E56 PolarHBondContact O-N 3.33Å; E53-A57 WeakPolarHBondContact O-CB 3.27Å; E53-A57 PolarHBondContact O-N 2.88Å
54	I	83.6	Confident	82	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-65.7	-40.2	174.1	-66.1	169.6	0	0	0	110.6	I38 I39 L42 T50 D51 P52 E56 A57 V58 A82	I38-I54 HydrophobicContact CG2-CG2 4.29Å; I39-I54 HydrophobicContact CG1-CB 4.34Å; I39-I54 HydrophobicContact CG1-CD1 4.25Å; I39-I54 HydrophobicContact CG1-CG2 3.73Å; I39-I54 HydrophobicContact CG2-CD1 4.34Å; L42-I54 HydrophobicContact CD1-CB 4.45Å; L42-I54 HydrophobicContact CD1-CD1 4.22Å; L42-I54 HydrophobicContact CD1-CG1 4.19Å; L42-I54 HydrophobicContact CD1-CG2 3.46Å; L42-I54 VanDerWaalsContact CD1-CG2 3.46Å; T50-I54 PolarHBondContact O-N 2.88Å; D51-I54 PolarHBondContact O-N 3Å; P52-I54 VanDerWaalsContact C-N 3.32Å; I54-E56 VanDerWaalsContact C-N 3.35Å; I54-A57 WeakPolarHBondContact O-CB 3.33Å; I54-A57 PolarHBondContact O-N 2.87Å; I54-V58 WeakPolarHBondContact O-CG2 3.35Å; I54-V58 PolarHBondContact O-N 3.4Å; I54-A82 HydrophobicContact CG1-CB 4.45Å
55	L	83.1	Confident	81.2	Confident	104 Å²	104	69.5 Å²	69.5	55%	0.545	37%	0.372	S	S	.	.	H	α-helix	trans	-65.2	-36.8	175	-72.4	167.7	0	0	0	112.4	D51 P52 V58 K59	D51-L55 WeakPolarHBondContact O-CG 3.49Å; D51-L55 PolarHBondContact O-N 3.33Å; P52-L55 PolarHBondContact O-N 2.76Å; L55-V58 PolarHBondContact O-N 3.33Å; L55-K59 PolarHBondContact O-N 2.63Å
56	E	84.6	Confident	80.5	Confident	107 Å²	107	75.1 Å²	75.1	50%	0.5	40%	0.402	S	S	.	.	H	α-helix	trans	-69.6	-37.8	173.6	-144.4	63.4	-147.9	0	0	111.7	P52 E53 I54 V58 K59 A60	P52-E56 PolarHBondContact O-N 2.95Å; E53-E56 PolarHBondContact O-N 3.33Å; I54-E56 VanDerWaalsContact C-N 3.35Å; E56-V58 VanDerWaalsContact C-N 3.31Å; E56-V58 PolarHBondContact O-N 2.73Å; E56-K59 WeakPolarHBondContact O-CB 3.49Å; E56-K59 PolarHBondContact O-N 2.95Å; E56-K59 VanDerWaalsContact OE1-CD 3.27Å; E56-K59 WeakPolarHBondContact OE1-CD 3.38Å; E56-K59 IonicContact OE1-NZ 3.31Å; E56-K59 PolarHBondContact OE1-NZ 3.44Å; E56-K59 IonicContact OE2-NZ 3.52Å; E56-K59 PolarHBondContact OE2-NZ 3.05Å; E56-A60 WeakPolarHBondContact O-CB 3.17Å; E56-A60 PolarHBondContact O-N 2.79Å
57	A	84	Confident	80.2	Confident	6 Å²	6	74.1 Å²	74.1	5%	0.05	39%	0.388	C	S	.	.	H	α-helix	trans	-63	-33.5	172.7	0	0	0	0	0	113.2	E53 I54 A60 A61 E81 A82	E53-A57 WeakPolarHBondContact O-CB 3.27Å; E53-A57 PolarHBondContact O-N 2.88Å; I54-A57 WeakPolarHBondContact O-CB 3.33Å; I54-A57 PolarHBondContact O-N 2.87Å; A57-A60 PolarHBondContact O-N 2.98Å; A57-A61 VanDerWaalsContact O-CB 3.26Å; A57-A61 WeakPolarHBondContact O-CB 3.22Å; A57-A61 PolarHBondContact O-N 3.14Å; A57-E81 HydrophobicContact CB-CB 3.71Å; A57-A82 HydrophobicContact CB-CB 3.73Å
58	V	85.1	Confident	80.2	Confident	24 Å²	24	81.1 Å²	81.1	15%	0.145	42%	0.42	C	S	.	.	H	α-helix	trans	-64.2	-40.7	172.6	170.3	0	0	0	0	111.6	I38 I54 L55 E56 I78	I38-V58 HydrophobicContact CD1-CG2 4.34Å; I38-V58 HydrophobicContact CG2-CG2 4.23Å; I54-V58 WeakPolarHBondContact O-CG2 3.35Å; I54-V58 PolarHBondContact O-N 3.4Å; L55-V58 PolarHBondContact O-N 3.33Å; E56-V58 VanDerWaalsContact C-N 3.31Å; E56-V58 PolarHBondContact O-N 2.73Å; V58-I78 HydrophobicContact CG2-CD1 4.02Å; V58-I78 HydrophobicContact CG2-CG1 4.09Å; V58-I78 HydrophobicContact CG2-CG2 3.71Å
59	K	84.4	Confident	80.5	Confident	99 Å²	99	77.4 Å²	77.4	43%	0.43	40%	0.404	S	S	.	.	H	α-helix	trans	-65.6	-45.3	173.2	-59.1	166.6	-175.8	165.7	0	111.5	L55 E56 A61 E62	L55-K59 PolarHBondContact O-N 2.63Å; E56-K59 WeakPolarHBondContact O-CB 3.49Å; E56-K59 PolarHBondContact O-N 2.95Å; E56-K59 VanDerWaalsContact OE1-CD 3.27Å; E56-K59 WeakPolarHBondContact OE1-CD 3.38Å; E56-K59 IonicContact OE1-NZ 3.31Å; E56-K59 PolarHBondContact OE1-NZ 3.44Å; E56-K59 IonicContact OE2-NZ 3.52Å; E56-K59 PolarHBondContact OE2-NZ 3.05Å; K59-A61 PolarHBondContact O-N 3.25Å; K59-E62 PolarHBondContact O-N 3.45Å
60	A	84.6	Confident	80.7	Confident	52 Å²	52	76.7 Å²	76.7	43%	0.43	40%	0.398	S	S	.	.	H	α-helix	trans	-68	-22.2	-177.7	0	0	0	0	0	113.5	E56 A57 E62 E81	E56-A60 WeakPolarHBondContact O-CB 3.17Å; E56-A60 PolarHBondContact O-N 2.79Å; A57-A60 PolarHBondContact O-N 2.98Å; A60-E62 PolarHBondContact O-N 3.2Å; A60-E81 HydrophobicContact CB-CG 4.17Å; A60-E81 VanDerWaalsContact CB-OE2 3.27Å; A60-E81 WeakPolarHBondContact CB-OE2 3.29Å
61	A	81.6	Confident	80.8	Confident	4 Å²	4	75.4 Å²	75.4	3%	0.033	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	2.5	175.2	0	0	0	0	0	114.3	A57 K59 V63 R77 I78 E81	A57-A61 VanDerWaalsContact O-CB 3.26Å; A57-A61 WeakPolarHBondContact O-CB 3.22Å; A57-A61 PolarHBondContact O-N 3.14Å; K59-A61 PolarHBondContact O-N 3.25Å; A61-V63 HydrophobicContact CB-CG2 3.87Å; A61-V63 PolarHBondContact O-N 3.5Å; A61-R77 HydrophobicContact CB-CB 3.98Å; A61-I78 HydrophobicContact CB-CB 4.46Å; A61-I78 HydrophobicContact CB-CG1 3.71Å; A61-E81 HydrophobicContact CB-CG 3.96Å
62	E	81.7	Confident	80.9	Confident	166 Å²	166	72.9 Å²	72.9	78%	0.776	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	31.2	-177.3	-57.2	-174.8	145.4	0	0	114	K59 A60	K59-E62 PolarHBondContact O-N 3.45Å; A60-E62 PolarHBondContact O-N 3.2Å
63	V	75.8	Confident	80.9	Confident	15 Å²	15	73.6 Å²	73.6	9%	0.091	37%	0.37	C	S	.	.			trans	-85.6	132	178.1	-175.8	0	0	0	0	109.6	A61 Q65 I70 D74 I78	A61-V63 HydrophobicContact CB-CG2 3.87Å; A61-V63 PolarHBondContact O-N 3.5Å; V63-Q65 PolarHBondContact O-N 2.83Å; V63-Q65 VanDerWaalsContact O-N 3.17Å; V63-I70 HydrophobicContact CG1-CB 4.48Å; V63-I70 HydrophobicContact CG1-CG2 3.66Å; V63-D74 HydrophobicContact CG2-CB 3.89Å; V63-I78 HydrophobicContact CG2-CD1 4.05Å; V63-I78 HydrophobicContact CG2-CG1 4.07Å
64	D	71.9	Confident	81	Confident	101 Å²	101	70.4 Å²	70.4	54%	0.54	36%	0.356	S	S	.	.			trans	-59.2	119	178.7	179.3	5.5	0	0	0	110.7	N66 A67	D64-N66 PolarHBondContact O-N 2.86Å; D64-N66 PolarHBondContact OD1-N 3.31Å; D64-N66 PolarHBondContact OD1-ND2 3.13Å; D64-A67 HydrophobicContact CB-CB 4.14Å; D64-A67 WeakPolarHBondContact O-CB 3.44Å; D64-A67 PolarHBondContact O-N 3.3Å; D64-A67 VanDerWaalsContact O-N 3.09Å
65	Q	66	Low	81.2	Confident	150 Å²	150	70.3 Å²	70.3	70%	0.701	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-16.8	-177.1	-61.6	176.8	25.6	0	0	112.7	V63	V63-Q65 PolarHBondContact O-N 2.83Å; V63-Q65 VanDerWaalsContact O-N 3.17Å
66	N	68.8	Low	81.4	Confident	143 Å²	143	66.8 Å²	66.8	77%	0.765	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-6.8	176.3	-57.9	-58	0	0	0	113.5	D64 E68	D64-N66 PolarHBondContact O-N 2.86Å; D64-N66 PolarHBondContact OD1-N 3.31Å; D64-N66 PolarHBondContact OD1-ND2 3.13Å; N66-E68 PolarHBondContact O-N 3.34Å
67	A	72.6	Confident	81.3	Confident	31 Å²	31	66 Å²	66	26%	0.256	33%	0.328	S	S	.	.			trans	-76.5	112.5	-177.8	0	0	0	0	0	111.2	V35 D64 K69	V35-A67 WeakPolarHBondContact CG2-O 3.3Å; D64-A67 HydrophobicContact CB-CB 4.14Å; D64-A67 WeakPolarHBondContact O-CB 3.44Å; D64-A67 PolarHBondContact O-N 3.3Å; D64-A67 VanDerWaalsContact O-N 3.09Å; A67-K69 PolarHBondContact O-N 3.42Å
68	E	79.5	Confident	81.4	Confident	156 Å²	156	65.7 Å²	65.7	73%	0.729	33%	0.326	S	S	*	.	S	Bend	trans	-58.6	-19.3	176.7	-63	-168.7	144.7	0	0	114.1	S34 V35 N66	S34-E68 VanDerWaalsContact CA-O 3.29Å; S34-E68 WeakPolarHBondContact CA-O 3.31Å; S34-E68 PolarHBondContact OG-O 2.84Å; S34-E68 VanDerWaalsContact OG-O 3.13Å; V35-E68 PolarHBondContact N-O 2.88Å; V35-E68 VanDerWaalsContact N-O 3.14Å; N66-E68 PolarHBondContact O-N 3.34Å
69	K	83.1	Confident	81.5	Confident	122 Å²	122	65.1 Å²	65.1	53%	0.53	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	139.5	-173.9	-56.7	178.8	-177.9	-177.4	0	110.8	L33 A67	L33-K69 CarbonylContact O-C 3.45Å; L33-K69 VanDerWaalsContact O-CA 3.31Å; L33-K69 WeakPolarHBondContact O-CA 3.38Å; A67-K69 PolarHBondContact O-N 3.42Å
70	I	85.8	Confident	81.4	Confident	5 Å²	5	61.5 Å²	61.5	3%	0.026	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	154.4	177.5	70	162.3	0	0	0	110.6	S32 L33 V35 I38 V63 D74 F75 I78	S32-I70 CarbonylContact C-O 3.53Å; S32-I70 VanDerWaalsContact CA-O 3.31Å; S32-I70 WeakPolarHBondContact CA-O 3.4Å; L33-I70 HydrophobicContact CB-CG1 3.95Å; L33-I70 HydrophobicContact CD2-CD1 4.19Å; L33-I70 HydrophobicContact CD2-CG1 4.35Å; L33-I70 PolarHBondContact N-O 2.83Å; L33-I70 WeakPolarHBondContact O-CG1 3.39Å; L33-I70 PolarHBondContact O-N 2.67Å; V35-I70 HydrophobicContact CG2-CG2 4.13Å; I38-I70 HydrophobicContact CD1-CD1 3.79Å; I38-I70 HydrophobicContact CD1-CG1 4.45Å; I38-I70 HydrophobicContact CD1-CG2 4.29Å; I38-I70 HydrophobicContact CG1-CD1 3.7Å; I38-I70 HydrophobicContact CG1-CG1 4.43Å; V63-I70 HydrophobicContact CG1-CB 4.48Å; V63-I70 HydrophobicContact CG1-CG2 3.66Å; I70-D74 HydrophobicContact CB-CB 4.03Å; I70-F75 HydrophobicContact CD1-CB 3.81Å; I70-F75 HydrophobicContact CD1-CD2 4.37Å; I70-I78 HydrophobicContact CD1-CD1 3.52Å
71	S	86.8	Confident	81.3	Confident	37 Å²	37	61.1 Å²	61.1	26%	0.259	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	170.1	174	79.7	0	0	0	0	112.3	Y73 D74 F75	S71-Y73 VanDerWaalsContact C-N 3.26Å; S71-Y73 PolarHBondContact O-N 2.93Å; S71-Y73 PolarHBondContact OG-N 2.96Å; S71-D74 WeakPolarHBondContact CA-OD2 3.39Å; S71-D74 WeakPolarHBondContact CB-OD2 3.48Å; S71-D74 PolarHBondContact N-OD2 2.9Å; S71-D74 PolarHBondContact O-N 3.2Å; S71-D74 PolarHBondContact OG-N 2.82Å; S71-D74 PolarHBondContact OG-OD2 3Å; S71-F75 PolarHBondContact O-N 3.14Å
72	F	86.6	Confident	81.4	Confident	23 Å²	23	61.5 Å²	61.5	10%	0.101	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-34.6	172	177.3	-104.7	0	0	0	113.1	Y15 L18 L19 F22 D74 F75 K76	Y15-F72 AromaticContact CE2-CE1 3.8Å; Y15-F72 HydrophobicContact CE2-CE1 3.8Å; Y15-F72 HydrophobicContact CE2-CZ 4.02Å; Y15-F72 AromaticContact CZ-CE1 3.86Å; L18-F72 HydrophobicContact CB-CE2 4.26Å; L18-F72 HydrophobicContact CB-CZ 4.2Å; L19-F72 HydrophobicContact CD2-CD1 4.34Å; L19-F72 HydrophobicContact CD2-CD2 4.11Å; L19-F72 HydrophobicContact CD2-CE1 3.96Å; L19-F72 HydrophobicContact CD2-CE2 3.72Å; L19-F72 HydrophobicContact CD2-CG 4.41Å; L19-F72 HydrophobicContact CD2-CZ 3.63Å; L19-F72 HydrophobicContact CG-CE1 4.38Å; L19-F72 HydrophobicContact CG-CE2 4.02Å; L19-F72 HydrophobicContact CG-CZ 3.74Å; F22-F72 HydrophobicContact CB-CD2 3.79Å; F22-F72 HydrophobicContact CB-CE2 4.16Å; F22-F72 HydrophobicContact CD1-CB 4.41Å; F22-F72 HydrophobicContact CD1-CD2 4.15Å; F22-F72 HydrophobicContact CD2-CB 4.3Å; F22-F72 AromaticContact CD2-CD2 3.91Å; F22-F72 HydrophobicContact CD2-CD2 3.91Å; F22-F72 HydrophobicContact CE1-CB 4.19Å; F22-F72 VanDerWaalsContact CE2-CA 3.47Å; F22-F72 HydrophobicContact CE2-CB 4.04Å; F22-F72 HydrophobicContact CE2-CD2 4.49Å; F22-F72 HydrophobicContact CG-CB 4.47Å; F22-F72 AromaticContact CG-CD2 3.7Å; F22-F72 HydrophobicContact CG-CD2 3.7Å; F22-F72 HydrophobicContact CZ-CB 3.98Å; F72-D74 VanDerWaalsContact C-N 3.31Å; F72-D74 PolarHBondContact O-N 3.3Å; F72-F75 PolarHBondContact O-N 2.92Å; F72-K76 WeakPolarHBondContact O-CB 3.35Å; F72-K76 PolarHBondContact O-N 2.88Å
73	Y	84.3	Confident	81.2	Confident	101 Å²	101	53.9 Å²	53.9	40%	0.396	26%	0.263	S	S	.	.	H	α-helix	trans	-68.5	-33.4	177.1	-64.8	-85.2	0	0	0	112	S71 R77	S71-Y73 VanDerWaalsContact C-N 3.26Å; S71-Y73 PolarHBondContact O-N 2.93Å; S71-Y73 PolarHBondContact OG-N 2.96Å; Y73-R77 WeakPolarHBondContact O-CG 3.29Å; Y73-R77 PolarHBondContact O-N 3.48Å
74	D	86.7	Confident	81	Confident	31 Å²	31	60.1 Å²	60.1	17%	0.166	29%	0.289	C	S	.	.	H	α-helix	trans	-73.9	-42.9	176.4	-51.8	-42.9	0	0	0	110.2	V63 I70 S71 F72 K76 R77 I78	V63-D74 HydrophobicContact CG2-CB 3.89Å; I70-D74 HydrophobicContact CB-CB 4.03Å; S71-D74 WeakPolarHBondContact CA-OD2 3.39Å; S71-D74 WeakPolarHBondContact CB-OD2 3.48Å; S71-D74 PolarHBondContact N-OD2 2.9Å; S71-D74 PolarHBondContact O-N 3.2Å; S71-D74 PolarHBondContact OG-N 2.82Å; S71-D74 PolarHBondContact OG-OD2 3Å; F72-D74 VanDerWaalsContact C-N 3.31Å; F72-D74 PolarHBondContact O-N 3.3Å; D74-K76 VanDerWaalsContact C-N 3.32Å; D74-K76 PolarHBondContact O-N 3.26Å; D74-R77 PolarHBondContact O-N 3.2Å; D74-R77 VanDerWaalsContact O-N 3.15Å; D74-R77 IonicContact OD1-CZ 2.91Å; D74-R77 IonicContact OD1-NE 2.84Å; D74-R77 IonicContact OD1-NH2 3.64Å; D74-R77 PolarHBondContact OD1-NH2 2.89Å; D74-I78 WeakPolarHBondContact O-CD1 3.32Å; D74-I78 VanDerWaalsContact O-CG1 3.23Å; D74-I78 WeakPolarHBondContact O-CG1 3.41Å; D74-I78 PolarHBondContact O-N 3.5Å
75	F	88.7	Confident	80.4	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-42.1	172.2	179.4	-110.6	0	0	0	112.1	L18 F22 L33 A41 L42 L45 I70 S71 F72 I78 Y79	L18-F75 HydrophobicContact CD2-CD1 4.31Å; L18-F75 HydrophobicContact CD2-CE1 3.97Å; F22-F75 HydrophobicContact CB-CD1 4.04Å; F22-F75 HydrophobicContact CB-CE1 4.17Å; F22-F75 HydrophobicContact CD2-CB 3.74Å; F22-F75 AromaticContact CD2-CD1 3.72Å; F22-F75 HydrophobicContact CD2-CD1 3.72Å; F22-F75 AromaticContact CD2-CG 3.78Å; F22-F75 HydrophobicContact CD2-CG 3.78Å; F22-F75 HydrophobicContact CE2-CB 3.95Å; F22-F75 HydrophobicContact CE2-CG 4.45Å; F22-F75 HydrophobicContact CG-CD1 4.37Å; L33-F75 HydrophobicContact CD2-CD2 3.78Å; L33-F75 HydrophobicContact CD2-CE2 4.19Å; L33-F75 HydrophobicContact CD2-CG 4.4Å; A41-F75 HydrophobicContact CB-CE2 3.5Å; A41-F75 HydrophobicContact CB-CZ 3.49Å; A41-F75 VanDerWaalsContact CB-CZ 3.49Å; L42-F75 HydrophobicContact CD2-CE2 3.83Å; L42-F75 HydrophobicContact CD2-CZ 4.16Å; L42-F75 HydrophobicContact CG-CE2 3.95Å; L45-F75 HydrophobicContact CD1-CE1 3.94Å; L45-F75 HydrophobicContact CD1-CZ 3.79Å; I70-F75 HydrophobicContact CD1-CB 3.81Å; I70-F75 HydrophobicContact CD1-CD2 4.37Å; S71-F75 PolarHBondContact O-N 3.14Å; F72-F75 PolarHBondContact O-N 2.92Å; F75-I78 PolarHBondContact O-N 3.48Å; F75-Y79 WeakPolarHBondContact O-CB 3.44Å; F75-Y79 PolarHBondContact O-N 2.8Å
76	K	86	Confident	80	Confident	30 Å²	30	55.8 Å²	55.8	13%	0.13	29%	0.29	C	S	.	.	H	α-helix	trans	-59.8	-46.7	173	-172.4	-163	166	-170.7	0	111.1	F72 D74 Y79 Q80 I92	F72-K76 WeakPolarHBondContact O-CB 3.35Å; F72-K76 PolarHBondContact O-N 2.88Å; D74-K76 VanDerWaalsContact C-N 3.32Å; D74-K76 PolarHBondContact O-N 3.26Å; K76-Y79 PolarHBondContact O-N 3.42Å; K76-Q80 WeakPolarHBondContact O-CG 3.19Å; K76-Q80 PolarHBondContact O-N 3.23Å; K76-Q80 PolarHBondContact O-OE1 2.92Å; K76-I92 VanDerWaalsContact CE-CG2 3.4Å
77	R	83.7	Confident	78.8	Confident	90 Å²	90	54.5 Å²	54.5	34%	0.34	29%	0.289	S	S	.	.	H	α-helix	trans	-60.5	-46.6	176.5	-77.2	-172.2	-77.2	177.7	-0.7	111.8	A61 Y73 D74 Y79 Q80 E81	A61-R77 HydrophobicContact CB-CB 3.98Å; Y73-R77 WeakPolarHBondContact O-CG 3.29Å; Y73-R77 PolarHBondContact O-N 3.48Å; D74-R77 PolarHBondContact O-N 3.2Å; D74-R77 VanDerWaalsContact O-N 3.15Å; D74-R77 IonicContact OD1-CZ 2.91Å; D74-R77 IonicContact OD1-NE 2.84Å; D74-R77 IonicContact OD1-NH2 3.64Å; D74-R77 PolarHBondContact OD1-NH2 2.89Å; R77-Y79 VanDerWaalsContact C-N 3.3Å; R77-Y79 PolarHBondContact O-N 3.25Å; R77-Q80 WeakPolarHBondContact O-CB 3.27Å; R77-Q80 PolarHBondContact O-N 3.22Å; R77-Q80 VanDerWaalsContact O-N 3.15Å; R77-E81 WeakPolarHBondContact O-CB 3.48Å; R77-E81 WeakPolarHBondContact O-CG 3.3Å; R77-E81 PolarHBondContact O-N 2.97Å
78	I	86.2	Confident	77.5	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-59.5	-40	175.7	-61.9	158.5	0	0	0	111.1	I38 L42 V58 A61 V63 I70 D74 F75 E81 A82	I38-I78 HydrophobicContact CD1-CD1 4.09Å; I38-I78 HydrophobicContact CG2-CD1 4.47Å; I38-I78 HydrophobicContact CG2-CG2 4Å; L42-I78 HydrophobicContact CD1-CG2 3.96Å; V58-I78 HydrophobicContact CG2-CD1 4.02Å; V58-I78 HydrophobicContact CG2-CG1 4.09Å; V58-I78 HydrophobicContact CG2-CG2 3.71Å; A61-I78 HydrophobicContact CB-CB 4.46Å; A61-I78 HydrophobicContact CB-CG1 3.71Å; V63-I78 HydrophobicContact CG2-CD1 4.05Å; V63-I78 HydrophobicContact CG2-CG1 4.07Å; I70-I78 HydrophobicContact CD1-CD1 3.52Å; D74-I78 WeakPolarHBondContact O-CD1 3.32Å; D74-I78 VanDerWaalsContact O-CG1 3.23Å; D74-I78 WeakPolarHBondContact O-CG1 3.41Å; D74-I78 PolarHBondContact O-N 3.5Å; F75-I78 PolarHBondContact O-N 3.48Å; I78-E81 PolarHBondContact O-N 3.21Å; I78-A82 WeakPolarHBondContact O-CB 3.39Å; I78-A82 PolarHBondContact O-N 2.86Å
79	Y	86.5	Confident	76.1	Confident	12 Å²	12	51.6 Å²	51.6	5%	0.047	27%	0.272	C	S	.	.	H	α-helix	trans	-66.7	-40.1	175.3	177.9	-102.2	0	0	0	112.8	L18 L42 L45 F75 K76 R77 C83 V89 I92	L18-Y79 HydrophobicContact CD1-CD1 4.09Å; L18-Y79 HydrophobicContact CD1-CE1 4.26Å; L18-Y79 HydrophobicContact CD2-CD1 3.81Å; L18-Y79 HydrophobicContact CD2-CE1 4.42Å; L18-Y79 HydrophobicContact CD2-CG 3.89Å; L18-Y79 HydrophobicContact CG-CD1 4.29Å; L18-Y79 HydrophobicContact CG-CE1 4.47Å; L42-Y79 HydrophobicContact CD2-CD2 3.7Å; L42-Y79 HydrophobicContact CD2-CG 4.18Å; L45-Y79 HydrophobicContact CB-CD2 4.28Å; L45-Y79 HydrophobicContact CB-CE2 3.72Å; L45-Y79 HydrophobicContact CD1-CD2 3.64Å; L45-Y79 HydrophobicContact CD1-CE2 3.82Å; L45-Y79 HydrophobicContact CD1-CG 4.19Å; L45-Y79 HydrophobicContact CG-CE2 4.37Å; F75-Y79 WeakPolarHBondContact O-CB 3.44Å; F75-Y79 PolarHBondContact O-N 2.8Å; K76-Y79 PolarHBondContact O-N 3.42Å; R77-Y79 VanDerWaalsContact C-N 3.3Å; R77-Y79 PolarHBondContact O-N 3.25Å; Y79-C83 VanDerWaalsContact O-CB 3.27Å; Y79-C83 WeakPolarHBondContact O-CB 3.22Å; Y79-C83 PolarHBondContact O-N 3.16Å; Y79-C83 VanDerWaalsContact O-N 3.13Å; Y79-C83 PolarHBondContact O-SG 3.11Å; Y79-V89 HydrophobicContact CE1-CG1 4.29Å; Y79-I92 HydrophobicContact CE1-CD1 4.1Å
80	Q	82.7	Confident	74	Confident	23 Å²	23	50.7 Å²	50.7	11%	0.107	28%	0.281	C	S	.	.	H	α-helix	trans	-61.9	-47.1	173.8	-69.9	165.5	-83.5	0	0	110.7	K76 R77 C83 K84 I92 N94	K76-Q80 WeakPolarHBondContact O-CG 3.19Å; K76-Q80 PolarHBondContact O-N 3.23Å; K76-Q80 PolarHBondContact O-OE1 2.92Å; R77-Q80 WeakPolarHBondContact O-CB 3.27Å; R77-Q80 PolarHBondContact O-N 3.22Å; R77-Q80 VanDerWaalsContact O-N 3.15Å; Q80-C83 PolarHBondContact O-N 2.85Å; Q80-K84 PolarHBondContact O-N 2.9Å; Q80-I92 HydrophobicContact CG-CB 4.42Å; Q80-I92 HydrophobicContact CG-CG2 4.1Å; Q80-I92 PolarHBondContact NE2-O 2.9Å; Q80-N94 PolarHBondContact NE2-OD1 3.1Å
81	E	83.2	Confident	72.1	Confident	44 Å²	44	52.2 Å²	52.2	21%	0.206	29%	0.293	C	S	.	.	H	α-helix	trans	-61.6	-53.1	176.7	-71.6	-59.1	131.5	0	0	112.3	A57 A60 A61 R77 I78 C83 K84	A57-E81 HydrophobicContact CB-CB 3.71Å; A60-E81 HydrophobicContact CB-CG 4.17Å; A60-E81 VanDerWaalsContact CB-OE2 3.27Å; A60-E81 WeakPolarHBondContact CB-OE2 3.29Å; A61-E81 HydrophobicContact CB-CG 3.96Å; R77-E81 WeakPolarHBondContact O-CB 3.48Å; R77-E81 WeakPolarHBondContact O-CG 3.3Å; R77-E81 PolarHBondContact O-N 2.97Å; I78-E81 PolarHBondContact O-N 3.21Å; E81-C83 PolarHBondContact O-N 3.14Å; E81-C83 VanDerWaalsContact O-N 3.14Å; E81-K84 VanDerWaalsContact CD-CE 3.43Å; E81-K84 WeakPolarHBondContact O-CB 3.42Å; E81-K84 PolarHBondContact O-N 2.93Å; E81-K84 VanDerWaalsContact O-N 3.07Å; E81-K84 WeakPolarHBondContact OE1-CE 3.28Å; E81-K84 IonicContact OE1-NZ 2.69Å; E81-K84 PolarHBondContact OE1-NZ 2.91Å; E81-K84 WeakPolarHBondContact OE2-CD 3.49Å; E81-K84 WeakPolarHBondContact OE2-CE 3.18Å; E81-K84 IonicContact OE2-NZ 2.9Å; E81-K84 PolarHBondContact OE2-NZ 3.43Å
82	A	82.1	Confident	69.9	Low	11 Å²	11	52 Å²	52	9%	0.091	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-25.3	-178.1	0	0	0	0	0	112.7	S49 I54 A57 I78	S49-A82 WeakPolarHBondContact CB-O 3.38Å; S49-A82 PolarHBondContact OG-O 2.96Å; I54-A82 HydrophobicContact CG1-CB 4.45Å; A57-A82 HydrophobicContact CB-CB 3.73Å; I78-A82 WeakPolarHBondContact O-CB 3.39Å; I78-A82 PolarHBondContact O-N 2.86Å
83	C	79.2	Confident	67.3	Low	6 Å²	6	53.4 Å²	53.4	4%	0.041	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	10.6	178.2	-66.8	0	0	0	0	114.3	Y79 Q80 E81 G85 N86 V89	Y79-C83 VanDerWaalsContact O-CB 3.27Å; Y79-C83 WeakPolarHBondContact O-CB 3.22Å; Y79-C83 PolarHBondContact O-N 3.16Å; Y79-C83 VanDerWaalsContact O-N 3.13Å; Y79-C83 PolarHBondContact O-SG 3.11Å; Q80-C83 PolarHBondContact O-N 2.85Å; E81-C83 PolarHBondContact O-N 3.14Å; E81-C83 VanDerWaalsContact O-N 3.14Å; C83-G85 PolarHBondContact O-N 3.21Å; C83-G85 VanDerWaalsContact O-N 3.09Å; C83-N86 HydrophobicContact CB-CB 4.49Å; C83-N86 WeakPolarHBondContact O-CB 3.18Å; C83-N86 PolarHBondContact O-N 3.15Å; C83-V89 HydrophobicContact CB-CB 3.91Å; C83-V89 HydrophobicContact CB-CG1 3.78Å; C83-V89 HydrophobicContact CB-CG2 3.78Å
84	K	69.8	Low	64.6	Low	146 Å²	146	54.6 Å²	54.6	64%	0.635	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-33.3	-179.4	-92.6	179.8	172.9	166.7	0	114.7	Q80 E81 N86	Q80-K84 PolarHBondContact O-N 2.9Å; E81-K84 VanDerWaalsContact CD-CE 3.43Å; E81-K84 WeakPolarHBondContact O-CB 3.42Å; E81-K84 PolarHBondContact O-N 2.93Å; E81-K84 VanDerWaalsContact O-N 3.07Å; E81-K84 WeakPolarHBondContact OE1-CE 3.28Å; E81-K84 IonicContact OE1-NZ 2.69Å; E81-K84 PolarHBondContact OE1-NZ 2.91Å; E81-K84 WeakPolarHBondContact OE2-CD 3.49Å; E81-K84 WeakPolarHBondContact OE2-CE 3.18Å; E81-K84 IonicContact OE2-NZ 2.9Å; E81-K84 PolarHBondContact OE2-NZ 3.43Å; K84-N86 VanDerWaalsContact C-N 3.3Å; K84-N86 PolarHBondContact O-N 3.2Å
85	G	60.4	Low	62.1	Low	81 Å²	81	54.9 Å²	54.9	84%	0.835	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-5.3	177.4	0	0	0	0	0	115.1	C83	C83-G85 PolarHBondContact O-N 3.21Å; C83-G85 VanDerWaalsContact O-N 3.09Å
86	N	57.8	Low	59.1	Low	79 Å²	79	57.6 Å²	57.6	42%	0.422	36%	0.357	S	S	.	.			trans	-99.5	110.5	-176.8	-168.7	-7.9	0	0	0	109.6	C83 K84 M88 V89	C83-N86 HydrophobicContact CB-CB 4.49Å; C83-N86 WeakPolarHBondContact O-CB 3.18Å; C83-N86 PolarHBondContact O-N 3.15Å; K84-N86 VanDerWaalsContact C-N 3.3Å; K84-N86 PolarHBondContact O-N 3.2Å; N86-M88 PolarHBondContact O-N 3.07Å; N86-V89 HydrophobicContact CB-CG2 4.49Å; N86-V89 PolarHBondContact O-N 3.5Å
87	P	44.2	Very low	56.7	Low	117 Å²	117	57.9 Å²	57.9	76%	0.76	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-5.9	-171.4	27.1	-36.3	0	0	0	114.2	S90	P87-S90 PolarHBondContact O-OG 3.1Å
88	M	44.7	Very low	54.4	Low	117 Å²	117	61.9 Å²	61.9	58%	0.576	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-11.5	175	-139.1	177.7	176.9	0	0	113.8	R14 N86	R14-M88 PolarHBondContact NH1-O 3.18Å; R14-M88 PolarHBondContact NH2-SD 2.92Å; N86-M88 PolarHBondContact O-N 3.07Å
89	V	49.3	Very low	52	Low	9 Å²	9	65.2 Å²	65.2	6%	0.055	41%	0.406	C	S	.	.	S	Bend	trans	-107.2	-10.8	-171.2	-180	0	0	0	0	113.9	Y79 C83 N86 S91 I92	Y79-V89 HydrophobicContact CE1-CG1 4.29Å; C83-V89 HydrophobicContact CB-CB 3.91Å; C83-V89 HydrophobicContact CB-CG1 3.78Å; C83-V89 HydrophobicContact CB-CG2 3.78Å; N86-V89 HydrophobicContact CB-CG2 4.49Å; N86-V89 PolarHBondContact O-N 3.5Å; V89-S91 PolarHBondContact O-N 3.33Å; V89-S91 VanDerWaalsContact O-N 3.08Å; V89-I92 HydrophobicContact CG1-CD1 4.23Å; V89-I92 PolarHBondContact O-N 3.39Å; V89-I92 VanDerWaalsContact O-N 3.08Å
90	S	40.3	Very low	50	Low	102 Å²	102	68.1 Å²	68.1	71%	0.713	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-24	172.8	44.5	0	0	0	0	114.2	P87 I92	P87-S90 PolarHBondContact O-OG 3.1Å; S90-I92 PolarHBondContact O-N 3.2Å
91	S	44.1	Very low	48.3	Very low	38 Å²	38	70.6 Å²	70.6	27%	0.266	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-7.5	176.1	-44.7	0	0	0	0	114.9	V89 G93	V89-S91 PolarHBondContact O-N 3.33Å; V89-S91 VanDerWaalsContact O-N 3.08Å; S91-G93 PolarHBondContact O-N 3.41Å
92	I	41.4	Very low	46.6	Very low	31 Å²	31	73 Å²	73	16%	0.159	44%	0.444	C	S	.	.	S	Bend	trans	-94.4	80.7	177.8	-52	-175.4	0	0	0	109.8	L18 K76 Y79 Q80 V89 S90	L18-I92 HydrophobicContact CD1-CD1 4.31Å; K76-I92 VanDerWaalsContact CE-CG2 3.4Å; Y79-I92 HydrophobicContact CE1-CD1 4.1Å; Q80-I92 HydrophobicContact CG-CB 4.42Å; Q80-I92 HydrophobicContact CG-CG2 4.1Å; Q80-I92 PolarHBondContact NE2-O 2.9Å; V89-I92 HydrophobicContact CG1-CD1 4.23Å; V89-I92 PolarHBondContact O-N 3.39Å; V89-I92 VanDerWaalsContact O-N 3.08Å; S90-I92 PolarHBondContact O-N 3.2Å
93	G	32.3	Very low	44.8	Very low	53 Å²	53	77.9 Å²	77.9	55%	0.546	46%	0.464	S	S	.	.			trans	-61.1	149.3	178.6	0	0	0	0	0	114.5	S91 A95	S91-G93 PolarHBondContact O-N 3.41Å; G93-A95 PolarHBondContact O-N 3.3Å
94	N	28	Very low	43.1	Very low	127 Å²	127	80.9 Å²	80.9	68%	0.679	48%	0.476	S	S	*	.			trans	-76.2	99.9	173.3	-89.7	-5.9	0	0	0	111	Q80	Q80-N94 PolarHBondContact NE2-OD1 3.1Å
95	A	33.1	Very low	41.3	Very low	37 Å²	37	75.9 Å²	75.9	31%	0.306	47%	0.465	S	S	.	.			trans	-135.1	79.6	163	0	0	0	0	0	108.5	G93 S97 R297	G93-A95 PolarHBondContact O-N 3.3Å; A95-S97 VanDerWaalsContact C-N 3.25Å; A95-S97 PolarHBondContact O-N 3.12Å; A95-R297 VanDerWaalsContact CB-NH1 3.31Å
96	G	27.2	Very low	40.3	Very low	56 Å²	56	75.9 Å²	75.9	58%	0.577	45%	0.449	S	S	*	.			trans	-89	29.7	176.3	0	0	0	0	0	113.3	K98	G96-K98 PolarHBondContact O-N 3.16Å
97	S	35.2	Very low	39.2	Very low	37 Å²	37	83.6 Å²	83.6	26%	0.259	47%	0.474	S	S	.	.			trans	-61.6	131.6	176.2	-59.3	0	0	0	0	109.9	A95 S99	A95-S97 VanDerWaalsContact C-N 3.25Å; A95-S97 PolarHBondContact O-N 3.12Å; S97-S99 PolarHBondContact O-N 3.48Å
98	K	34.2	Very low	38.7	Very low	173 Å²	173	80.7 Å²	80.7	75%	0.752	47%	0.466	S	S	*	.			trans	-73.1	93.3	177.6	-63.5	169.8	-175.3	167.8	0	108.7	G96 N100	G96-K98 PolarHBondContact O-N 3.16Å; K98-N100 PolarHBondContact O-N 3.41Å
99	S	37.1	Very low	38	Very low	71 Å²	71	83.7 Å²	83.7	50%	0.497	48%	0.484	S	S	.	.			trans	-65.8	99.9	168.1	44	0	0	0	0	108.9	S97 L101	S97-S99 PolarHBondContact O-N 3.48Å; S99-L101 PolarHBondContact O-N 3.28Å
100	N	44.1	Very low	37.2	Very low	72 Å²	72	93.7 Å²	93.7	39%	0.385	52%	0.521	S	S	.	.			trans	-71.3	72.4	174.3	-81	5.5	0	0	0	109.5	K98 Y102 E121	K98-N100 PolarHBondContact O-N 3.41Å; N100-Y102 HydrophobicContact CB-CE2 4.38Å; N100-Y102 PolarHBondContact O-N 2.81Å; N100-E121 HydrophobicContact CB-CB 3.81Å; N100-E121 WeakPolarHBondContact CB-OE2 3.35Å; N100-E121 PolarHBondContact ND2-OE2 3.18Å; N100-E121 PolarHBondContact O-N 2.98Å
101	L	45.9	Very low	37	Very low	75 Å²	75	95.4 Å²	95.4	39%	0.393	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	93.9	-176.9	-164.9	69.9	0	0	0	109	S99 H103 V119	S99-L101 PolarHBondContact O-N 3.28Å; L101-H103 PolarHBondContact O-CE1 2.88Å; L101-H103 PolarHBondContact O-N 3.47Å; L101-H103 PolarHBondContact O-ND1 3.5Å; L101-V119 WeakPolarHBondContact CA-O 3.34Å
102	Y	48.7	Very low	36.8	Very low	94 Å²	94	101.2 Å²	101.2	37%	0.369	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.1	122.5	177	-65.3	-82.2	0	0	0	109.5	N100 Y104 S118 V119 E121	N100-Y102 HydrophobicContact CB-CE2 4.38Å; N100-Y102 PolarHBondContact O-N 2.81Å; Y102-Y104 HydrophobicContact CG-CE2 4.41Å; Y102-S118 CarbonylContact O-C 3.53Å; Y102-S118 WeakPolarHBondContact O-CA 3.4Å; Y102-V119 PolarHBondContact N-O 3.27Å; Y102-V119 PolarHBondContact O-N 3.13Å; Y102-E121 HydrophobicContact CD2-CB 4.48Å; Y102-E121 HydrophobicContact CE2-CB 3.87Å; Y102-E121 HydrophobicContact CE2-CG 3.93Å; Y102-E121 VanDerWaalsContact CE2-OE2 3.27Å; Y102-E121 WeakPolarHBondContact CE2-OE2 3.39Å; Y102-E121 PolarHBondContact OH-OE2 3.08Å
103	H	44.3	Very low	36.6	Very low	114 Å²	114	103.4 Å²	103.4	53%	0.528	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94	129.4	173.8	-65.1	59.7	0	0	0	108.4	L101 L116 H117	L101-H103 PolarHBondContact O-CE1 2.88Å; L101-H103 PolarHBondContact O-N 3.47Å; L101-H103 PolarHBondContact O-ND1 3.5Å; H103-L116 HydrophobicContact CB-CD2 4.35Å; H103-H117 CarbonylContact C-O 3.58Å; H103-H117 WeakPolarHBondContact CA-O 3.4Å
104	Y	43	Very low	36.8	Very low	70 Å²	70	106.4 Å²	106.4	28%	0.275	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124	121.7	177.6	-63.7	-84.5	0	0	0	108.8	Y102 H117 V119 K223	Y102-Y104 HydrophobicContact CG-CE2 4.41Å; Y104-H117 PolarHBondContact N-O 3.13Å; Y104-H117 PolarHBondContact O-N 3.33Å; Y104-V119 HydrophobicContact CD2-CB 4.26Å; Y104-V119 HydrophobicContact CD2-CG2 3.69Å; Y104-V119 HydrophobicContact CE2-CB 3.9Å; Y104-V119 HydrophobicContact CE2-CG2 3.72Å; Y104-K223 HydrophobicContact CD2-CD 4.39Å; Y104-K223 HydrophobicContact CE1-CD 3.96Å; Y104-K223 HydrophobicContact CE2-CD 3.77Å; Y104-K223 PolarHBondContact OH-NZ 3.36Å
105	G	32.7	Very low	37.7	Very low	41 Å²	41	102.9 Å²	102.9	42%	0.423	55%	0.553	S	S	.	*			trans	-78.1	159.4	165.2	0	0	0	0	0	111.3	Y107	G105-Y107 PolarHBondContact O-N 2.85Å
106	T	38.3	Very low	38.2	Very low	81 Å²	81	106.3 Å²	106.3	50%	0.497	57%	0.566	S	S	.	*			trans	-67.5	123.6	179.7	-26.7	0	0	0	0	110.5	G108 D113	T106-G108 PolarHBondContact O-N 3.49Å; T106-D113 PolarHBondContact OG1-O 3.07Å
107	Y	35	Very low	39.8	Very low	241 Å²	241	105 Å²	105	95%	0.945	55%	0.545	S	S	*	.			trans	-76.8	85.5	176.1	-94.4	-94.2	0	0	0	110.8	G105	G105-Y107 PolarHBondContact O-N 2.85Å
108	G	34.6	Very low	41.3	Very low	56 Å²	56	104.8 Å²	104.8	58%	0.577	54%	0.543	S	S	*	.	S	Bend	trans	-145.4	143.8	171.5	0	0	0	0	0	110.7	T106 R110	T106-G108 PolarHBondContact O-N 3.49Å; G108-R110 PolarHBondContact O-N 3.03Å
109	D	29.5	Very low	43.4	Very low	180 Å²	180	96.6 Å²	96.6	96%	0.963	51%	0.507	S	S	*	.	S	Bend	trans	-80.7	47.1	-173.8	-150.8	18	0	0	0	112
110	R	33.4	Very low	45.7	Very low	219 Å²	219	94 Å²	94	83%	0.826	49%	0.49	S	S	*	.			trans	-140.7	122.1	-178.4	-79	-175.5	164.1	150.5	-2.6	109.2	G108 D112	G108-R110 PolarHBondContact O-N 3.03Å; R110-D112 VanDerWaalsContact C-N 3.28Å; R110-D112 PolarHBondContact O-N 3.48Å
111	V	35.7	Very low	47.8	Very low	138 Å²	138	92.1 Å²	92.1	84%	0.836	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-9.4	-162.3	-177.8	0	0	0	0	113.8
112	D	40.1	Very low	49.8	Very low	159 Å²	159	89.6 Å²	89.6	85%	0.85	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	5.9	-163.7	-54.2	-57.2	0	0	0	115.9	R110	R110-D112 VanDerWaalsContact C-N 3.28Å; R110-D112 PolarHBondContact O-N 3.48Å
113	D	36	Very low	51.9	Low	77 Å²	77	86.2 Å²	86.2	41%	0.412	45%	0.452	S	S	.	.			trans	-110.6	58.6	-179.7	-162	-3.5	0	0	0	112.3	T106 T115	T106-D113 PolarHBondContact OG1-O 3.07Å; D113-T115 PolarHBondContact O-N 2.92Å; D113-T115 PolarHBondContact OD1-OG1 2.74Å
114	D	36.1	Very low	54.2	Low	117 Å²	117	81.1 Å²	81.1	63%	0.626	43%	0.428	S	S	*	.			trans	-78.5	48.2	-171.9	-158.9	15.9	0	0	0	113.1	L116	D114-L116 PolarHBondContact O-N 3.27Å
115	T	47.9	Very low	56.6	Low	52 Å²	52	78.7 Å²	78.7	32%	0.319	42%	0.421	S	S	.	.			trans	-79.3	101.7	179	-57.8	0	0	0	0	110.4	D113 H117	D113-T115 PolarHBondContact O-N 2.92Å; D113-T115 PolarHBondContact OD1-OG1 2.74Å; T115-H117 WeakPolarHBondContact CG2-NE2 3.46Å; T115-H117 PolarHBondContact O-CD2 3.34Å; T115-H117 PolarHBondContact O-N 2.72Å; T115-H117 VanDerWaalsContact O-N 3.16Å
116	L	44.3	Very low	59.4	Low	110 Å²	110	76.9 Å²	76.9	58%	0.576	40%	0.402	S	S	*	.			trans	-73.3	102.4	-178	-76	166.7	0	0	0	112.8	H103 D114	H103-L116 HydrophobicContact CB-CD2 4.35Å; D114-L116 PolarHBondContact O-N 3.27Å
117	H	59.1	Low	62	Low	29 Å²	29	73 Å²	73	13%	0.134	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	134.7	175.7	-64.7	-82	0	0	0	112.6	H103 Y104 T115 H224	H103-H117 CarbonylContact C-O 3.58Å; H103-H117 WeakPolarHBondContact CA-O 3.4Å; Y104-H117 PolarHBondContact N-O 3.13Å; Y104-H117 PolarHBondContact O-N 3.33Å; T115-H117 WeakPolarHBondContact CG2-NE2 3.46Å; T115-H117 PolarHBondContact O-CD2 3.34Å; T115-H117 PolarHBondContact O-N 2.72Å; T115-H117 VanDerWaalsContact O-N 3.16Å; H117-H224 HydrophobicContact CB-CB 4.29Å; H117-H224 VanDerWaalsContact CB-ND1 3.33Å; H117-H224 WeakPolarHBondContact CB-ND1 3.41Å; H117-H224 AromaticContact CD2-CE1 3.56Å; H117-H224 AromaticContact CE1-CE1 3.6Å; H117-H224 AromaticContact CE1-NE2 3.37Å; H117-H224 PolarHBondContact CE1-NE2 3.17Å; H117-H224 AromaticContact CG-CE1 3.24Å; H117-H224 AromaticContact CG-CG 3.96Å; H117-H224 AromaticContact CG-ND1 3.48Å; H117-H224 AromaticContact CG-NE2 3.61Å; H117-H224 AromaticContact ND1-CD2 3.53Å; H117-H224 AromaticContact ND1-CE1 3.29Å; H117-H224 PolarHBondContact ND1-CE1 3.42Å; H117-H224 VanDerWaalsContact ND1-CE1 3.29Å; H117-H224 AromaticContact ND1-CG 3.91Å; H117-H224 AromaticContact ND1-ND1 3.78Å; H117-H224 AromaticContact ND1-NE2 3.12Å; H117-H224 PolarHBondContact ND1-NE2 3.42Å; H117-H224 VanDerWaalsContact ND1-NE2 3.12Å; H117-H224 AromaticContact NE2-CE1 3.75Å; H117-H224 AromaticContact NE2-NE2 3.95Å
118	S	68.4	Low	64.8	Low	31 Å²	31	61.7 Å²	61.7	22%	0.217	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	140.1	-173.8	60.8	0	0	0	0	113.7	Y102 Y682	Y102-S118 CarbonylContact O-C 3.53Å; Y102-S118 WeakPolarHBondContact O-CA 3.4Å; S118-Y682 PolarHBondContact O-OH 3.01Å; S118-Y682 PolarHBondContact OG-OH 2.91Å
119	V	78.2	Confident	67.5	Low	1 Å²	1	62 Å²	62	1%	0.006	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	128.7	179.1	-179.1	0	0	0	0	109.6	L101 Y102 Y104 Y155 K223 H224 L227	L101-V119 WeakPolarHBondContact CA-O 3.34Å; Y102-V119 PolarHBondContact N-O 3.27Å; Y102-V119 PolarHBondContact O-N 3.13Å; Y104-V119 HydrophobicContact CD2-CB 4.26Å; Y104-V119 HydrophobicContact CD2-CG2 3.69Å; Y104-V119 HydrophobicContact CE2-CB 3.9Å; Y104-V119 HydrophobicContact CE2-CG2 3.72Å; V119-Y155 WeakPolarHBondContact CG1-OH 3.46Å; V119-K223 HydrophobicContact CG2-CB 3.87Å; V119-H224 HydrophobicContact CG2-CB 4.02Å; V119-L227 HydrophobicContact CG1-CD2 3.83Å
120	S	85.6	Confident	70.5	Confident	18 Å²	18	53.5 Å²	53.5	13%	0.126	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	127.4	176.5	177.5	0	0	0	0	111.2	E122 E123 Q124	S120-E122 VanDerWaalsContact C-N 3.29Å; S120-E122 PolarHBondContact OG-N 3.18Å; S120-E123 PolarHBondContact O-N 2.87Å; S120-Q124 WeakPolarHBondContact O-CB 3.25Å; S120-Q124 PolarHBondContact O-N 3.4Å; S120-Q124 VanDerWaalsContact O-N 3.12Å
121	E	87	Confident	73.4	Confident	31 Å²	31	43 Å²	43	15%	0.145	24%	0.243	C	C	.	.	H	α-helix	trans	-62	-38.2	171.4	-157	-178.4	120.7	0	0	112.2	N100 Y102 E123 Q124 V125	N100-E121 HydrophobicContact CB-CB 3.81Å; N100-E121 WeakPolarHBondContact CB-OE2 3.35Å; N100-E121 PolarHBondContact ND2-OE2 3.18Å; N100-E121 PolarHBondContact O-N 2.98Å; Y102-E121 HydrophobicContact CD2-CB 4.48Å; Y102-E121 HydrophobicContact CE2-CB 3.87Å; Y102-E121 HydrophobicContact CE2-CG 3.93Å; Y102-E121 VanDerWaalsContact CE2-OE2 3.27Å; Y102-E121 WeakPolarHBondContact CE2-OE2 3.39Å; Y102-E121 PolarHBondContact OH-OE2 3.08Å; E121-E123 VanDerWaalsContact C-N 3.34Å; E121-E123 PolarHBondContact O-N 3.45Å; E121-Q124 PolarHBondContact O-N 3.03Å; E121-V125 WeakPolarHBondContact O-CG2 3.2Å; E121-V125 PolarHBondContact O-N 3.5Å
122	E	88.2	Confident	76.1	Confident	22 Å²	22	39.2 Å²	39.2	10%	0.103	22%	0.215	C	C	.	.	H	α-helix	trans	-57.4	-48.9	179.2	-51.2	174.6	-165.7	0	0	109.6	S120 G126 D354 S357 S359 L362	S120-E122 VanDerWaalsContact C-N 3.29Å; S120-E122 PolarHBondContact OG-N 3.18Å; E122-G126 PolarHBondContact O-N 3.34Å; E122-D354 WeakPolarHBondContact CG-OD1 3.45Å; E122-S357 PolarHBondContact OE2-OG 3.38Å; E122-S359 WeakPolarHBondContact OE2-CB 3.45Å; E122-S359 PolarHBondContact OE2-OG 2.94Å; E122-L362 HydrophobicContact CB-CD1 3.73Å
123	E	91.6	Very high	78.5	Confident	24 Å²	24	36.8 Å²	36.8	11%	0.112	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-43.4	177.1	-68.5	-177.7	-140.2	0	0	112.6	S120 E121 V125 G126 F127 L227 K361	S120-E123 PolarHBondContact O-N 2.87Å; E121-E123 VanDerWaalsContact C-N 3.34Å; E121-E123 PolarHBondContact O-N 3.45Å; E123-V125 VanDerWaalsContact C-N 3.3Å; E123-V125 PolarHBondContact O-N 2.92Å; E123-G126 PolarHBondContact O-N 2.96Å; E123-F127 HydrophobicContact CB-CE2 4.06Å; E123-F127 HydrophobicContact CB-CZ 4.01Å; E123-F127 HydrophobicContact CG-CZ 4.2Å; E123-F127 WeakPolarHBondContact O-CB 3.43Å; E123-F127 WeakPolarHBondContact O-CD2 3.28Å; E123-F127 WeakPolarHBondContact O-CG 3.47Å; E123-F127 PolarHBondContact O-N 2.96Å; E123-L227 HydrophobicContact CB-CD1 4.23Å; E123-L227 HydrophobicContact CB-CD2 3.85Å; E123-L227 HydrophobicContact CB-CG 4.35Å; E123-K361 HydrophobicContact CG-CD 4.25Å; E123-K361 WeakPolarHBondContact OE1-CD 3.35Å; E123-K361 IonicContact OE1-NZ 2.81Å; E123-K361 PolarHBondContact OE1-NZ 3.14Å; E123-K361 WeakPolarHBondContact OE2-CD 3.43Å; E123-K361 IonicContact OE2-NZ 2.97Å; E123-K361 PolarHBondContact OE2-NZ 3.02Å
124	Q	93.4	Very high	81.1	Confident	6 Å²	6	34.8 Å²	34.8	3%	0.028	18%	0.184	C	C	.	.	H	α-helix	trans	-57.4	-43.2	179.5	-174.2	-175.8	-83	0	0	111.3	S120 E121 S128 D150 G151 Y155	S120-Q124 WeakPolarHBondContact O-CB 3.25Å; S120-Q124 PolarHBondContact O-N 3.4Å; S120-Q124 VanDerWaalsContact O-N 3.12Å; E121-Q124 PolarHBondContact O-N 3.03Å; Q124-S128 WeakPolarHBondContact O-CB 3.25Å; Q124-S128 PolarHBondContact O-N 3.49Å; Q124-S128 PolarHBondContact O-OG 2.83Å; Q124-D150 PolarHBondContact NE2-O 3.02Å; Q124-G151 WeakPolarHBondContact CG-O 3.4Å; Q124-Y155 HydrophobicContact CG-CE2 4.18Å; Q124-Y155 VanDerWaalsContact OE1-CE2 3.28Å; Q124-Y155 PolarHBondContact OE1-OH 2.96Å; Q124-Y155 VanDerWaalsContact OE1-OH 3.06Å
125	V	92.9	Very high	83.8	Confident	20 Å²	20	29.6 Å²	29.6	12%	0.121	16%	0.156	C	C	.	.	H	α-helix	trans	-74.4	-49.2	176.6	177.7	0	0	0	0	111.5	E121 E123 F127 S128 S129 D150	E121-V125 WeakPolarHBondContact O-CG2 3.2Å; E121-V125 PolarHBondContact O-N 3.5Å; E123-V125 VanDerWaalsContact C-N 3.3Å; E123-V125 PolarHBondContact O-N 2.92Å; V125-F127 VanDerWaalsContact C-N 3.25Å; V125-F127 PolarHBondContact O-N 3.4Å; V125-S128 PolarHBondContact O-N 3.17Å; V125-S128 VanDerWaalsContact O-N 3.11Å; V125-S129 WeakPolarHBondContact O-CB 3.24Å; V125-S129 PolarHBondContact O-N 3.21Å; V125-D150 VanDerWaalsContact CG2-O 3.3Å; V125-D150 WeakPolarHBondContact CG2-O 3.44Å
126	G	91.6	Very high	85.8	Confident	2 Å²	2	31.9 Å²	31.9	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-57.7	-38.4	-176.8	0	0	0	0	0	112.6	E122 E123 W130 F349	E122-G126 PolarHBondContact O-N 3.34Å; E123-G126 PolarHBondContact O-N 2.96Å; G126-W130 PolarHBondContact O-N 2.54Å; G126-F349 VanDerWaalsContact CA-O 3.28Å; G126-F349 WeakPolarHBondContact CA-O 3.44Å
127	F	94.4	Very high	88	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-75.2	-42.5	174.8	-56.7	-12.2	0	0	0	111.8	E123 V125 S129 W130 I131 L227 L230 W231 I234 L362	E123-F127 HydrophobicContact CB-CE2 4.06Å; E123-F127 HydrophobicContact CB-CZ 4.01Å; E123-F127 HydrophobicContact CG-CZ 4.2Å; E123-F127 WeakPolarHBondContact O-CB 3.43Å; E123-F127 WeakPolarHBondContact O-CD2 3.28Å; E123-F127 WeakPolarHBondContact O-CG 3.47Å; E123-F127 PolarHBondContact O-N 2.96Å; V125-F127 VanDerWaalsContact C-N 3.25Å; V125-F127 PolarHBondContact O-N 3.4Å; F127-S129 VanDerWaalsContact C-N 3.32Å; F127-S129 PolarHBondContact O-N 2.83Å; F127-W130 PolarHBondContact O-N 2.81Å; F127-W130 VanDerWaalsContact O-N 3.17Å; F127-I131 VanDerWaalsContact O-CG1 3.22Å; F127-I131 WeakPolarHBondContact O-CG1 3.41Å; F127-I131 PolarHBondContact O-N 3.36Å; F127-L227 HydrophobicContact CD2-CD1 3.52Å; F127-L227 HydrophobicContact CD2-CG 4.3Å; F127-L227 HydrophobicContact CE2-CD1 3.73Å; F127-L227 HydrophobicContact CE2-CG 4.01Å; F127-L230 HydrophobicContact CD2-CB 4.18Å; F127-W231 AromaticContact CE1-CE3 3.69Å; F127-W231 HydrophobicContact CE1-CE3 3.69Å; F127-W231 HydrophobicContact CE1-CZ3 4.29Å; F127-W231 HydrophobicContact CE2-CB 3.78Å; F127-W231 HydrophobicContact CZ-CB 3.74Å; F127-W231 HydrophobicContact CZ-CD2 4.12Å; F127-W231 AromaticContact CZ-CE3 3.58Å; F127-W231 HydrophobicContact CZ-CE3 3.58Å; F127-W231 HydrophobicContact CZ-CG 4.21Å; F127-I234 HydrophobicContact CB-CD1 3.83Å; F127-I234 HydrophobicContact CD1-CD1 3.78Å; F127-I234 HydrophobicContact CD2-CD1 4.25Å; F127-I234 HydrophobicContact CE1-CD1 4.5Å; F127-I234 HydrophobicContact CG-CD1 3.67Å; F127-L362 HydrophobicContact CD1-CD2 4.46Å; F127-L362 HydrophobicContact CE1-CD2 4.01Å
128	S	93.9	Very high	89.5	Confident	4 Å²	4	33.1 Å²	33.1	3%	0.028	17%	0.174	C	C	.	.	H	α-helix	trans	-57.3	-44.7	176.2	-60.6	0	0	0	0	112	Q124 V125 I131 E132 F147 G151	Q124-S128 WeakPolarHBondContact O-CB 3.25Å; Q124-S128 PolarHBondContact O-N 3.49Å; Q124-S128 PolarHBondContact O-OG 2.83Å; V125-S128 PolarHBondContact O-N 3.17Å; V125-S128 VanDerWaalsContact O-N 3.11Å; S128-I131 PolarHBondContact O-N 3.44Å; S128-E132 WeakPolarHBondContact O-CB 3.48Å; S128-E132 PolarHBondContact O-N 3.25Å; S128-F147 WeakPolarHBondContact O-CD2 3.4Å; S128-G151 WeakPolarHBondContact OG-CA 3.48Å
129	S	91.3	Very high	90.5	Very high	61 Å²	61	36.6 Å²	36.6	43%	0.427	20%	0.196	S	C	.	.	H	α-helix	trans	-61.8	-41.7	175.7	179.9	0	0	0	0	112.6	V125 F127 R133	V125-S129 WeakPolarHBondContact O-CB 3.24Å; V125-S129 PolarHBondContact O-N 3.21Å; F127-S129 VanDerWaalsContact C-N 3.32Å; F127-S129 PolarHBondContact O-N 2.83Å; S129-R133 PolarHBondContact O-N 3.34Å
130	W	92.5	Very high	91	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.008	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-44	174.2	175.3	90.8	0	0	0	112.2	G126 F127 E132 R133 N134 I167 C170 I234 V348 F349 F956	G126-W130 PolarHBondContact O-N 2.54Å; F127-W130 PolarHBondContact O-N 2.81Å; F127-W130 VanDerWaalsContact O-N 3.17Å; W130-E132 VanDerWaalsContact C-N 3.3Å; W130-E132 PolarHBondContact O-N 3.24Å; W130-R133 PolarHBondContact O-N 2.84Å; W130-N134 PolarHBondContact NE1-ND2 3.32Å; W130-N134 VanDerWaalsContact NE1-ND2 3.14Å; W130-N134 PolarHBondContact O-N 3.4Å; W130-N134 PolarHBondContact O-ND2 3.21Å; W130-I167 HydrophobicContact CH2-CG2 4.43Å; W130-I167 HydrophobicContact CZ3-CG2 4.05Å; W130-C170 HydrophobicContact CH2-CB 4.1Å; W130-I234 HydrophobicContact CD2-CD1 4.34Å; W130-I234 HydrophobicContact CD2-CG1 4.24Å; W130-I234 HydrophobicContact CE3-CD1 3.74Å; W130-I234 HydrophobicContact CE3-CG1 3.73Å; W130-I234 HydrophobicContact CH2-CG1 3.89Å; W130-I234 HydrophobicContact CZ2-CG1 4.34Å; W130-I234 HydrophobicContact CZ3-CD1 4Å; W130-I234 HydrophobicContact CZ3-CG1 3.57Å; W130-V348 HydrophobicContact CB-CG1 4.3Å; W130-F349 HydrophobicContact CB-CD1 4.03Å; W130-F349 HydrophobicContact CB-CE1 3.53Å; W130-F349 HydrophobicContact CB-CZ 4.13Å; W130-F349 AromaticContact CD1-CE1 3.36Å; W130-F349 AromaticContact CD1-CE2 3.89Å; W130-F349 AromaticContact CD1-CZ 3.03Å; W130-F349 HydrophobicContact CD2-CE1 4.3Å; W130-F349 HydrophobicContact CD2-CZ 4.48Å; W130-F349 HydrophobicContact CG-CD1 4.4Å; W130-F349 AromaticContact CG-CE1 3.45Å; W130-F349 HydrophobicContact CG-CE1 3.45Å; W130-F349 VanDerWaalsContact CG-CE1 3.45Å; W130-F349 AromaticContact CG-CZ 3.65Å; W130-F349 HydrophobicContact CG-CZ 3.65Å; W130-F349 AromaticContact NE1-CZ 3.55Å; W130-F956 HydrophobicContact CZ2-CZ 4.15Å
131	I	93.7	Very high	91.3	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.2	-47.3	177.5	-65.2	162.9	0	0	0	109.3	F127 S128 N134 L135 F147 L154 L163 I167 L230	F127-I131 VanDerWaalsContact O-CG1 3.22Å; F127-I131 WeakPolarHBondContact O-CG1 3.41Å; F127-I131 PolarHBondContact O-N 3.36Å; S128-I131 PolarHBondContact O-N 3.44Å; I131-N134 PolarHBondContact O-N 2.81Å; I131-L135 HydrophobicContact CG2-CD1 3.94Å; I131-L135 WeakPolarHBondContact O-CB 3.3Å; I131-L135 PolarHBondContact O-N 3.13Å; I131-F147 HydrophobicContact CB-CE2 3.93Å; I131-F147 HydrophobicContact CB-CZ 4.33Å; I131-F147 HydrophobicContact CG2-CE2 3.7Å; I131-F147 HydrophobicContact CG2-CZ 3.84Å; I131-L154 HydrophobicContact CD1-CD1 3.48Å; I131-L154 VanDerWaalsContact CD1-CD1 3.48Å; I131-L163 HydrophobicContact CG2-CD1 4.03Å; I131-I167 HydrophobicContact CD1-CD1 3.62Å; I131-I167 HydrophobicContact CG1-CD1 3.77Å; I131-I167 HydrophobicContact CG1-CG1 4.13Å; I131-I167 HydrophobicContact CG2-CD1 3.97Å; I131-I167 HydrophobicContact CG2-CG1 4.12Å; I131-L230 HydrophobicContact CD1-CD2 4.47Å
132	E	92.5	Very high	91.4	Very high	57 Å²	57	42.5 Å²	42.5	27%	0.266	22%	0.219	S	C	.	.	H	α-helix	trans	-59.5	-50.4	177.5	-170.9	155.8	156.7	0	0	112	S128 W130 N134 L135 L136 L145 P146 F147	S128-E132 WeakPolarHBondContact O-CB 3.48Å; S128-E132 PolarHBondContact O-N 3.25Å; W130-E132 VanDerWaalsContact C-N 3.3Å; W130-E132 PolarHBondContact O-N 3.24Å; E132-N134 VanDerWaalsContact C-N 3.28Å; E132-N134 PolarHBondContact O-N 2.85Å; E132-L135 PolarHBondContact O-N 3.18Å; E132-L136 WeakPolarHBondContact O-CB 3.18Å; E132-L136 PolarHBondContact O-N 3.46Å; E132-L145 HydrophobicContact CB-CD2 3.98Å; E132-L145 HydrophobicContact CG-CD1 4.4Å; E132-L145 HydrophobicContact CG-CD2 3.95Å; E132-P146 VanDerWaalsContact OE1-CB 3.32Å; E132-P146 WeakPolarHBondContact OE1-CB 3.46Å; E132-P146 VanDerWaalsContact OE2-CA 3.28Å; E132-P146 WeakPolarHBondContact OE2-CA 3.26Å; E132-F147 HydrophobicContact CB-CD2 4.16Å; E132-F147 HydrophobicContact CB-CE2 4.47Å; E132-F147 PolarHBondContact OE2-N 3.42Å
133	R	90	Very high	91.5	Very high	108 Å²	108	46.1 Å²	46.1	41%	0.408	23%	0.232	S	C	.	.	H	α-helix	trans	-57.1	-39.5	178.1	-169.7	-172.7	74.2	159.7	-5.7	112.9	S129 W130 N369	S129-R133 PolarHBondContact O-N 3.34Å; W130-R133 PolarHBondContact O-N 2.84Å; R133-N369 PolarHBondContact NH1-OD1 3.28Å; R133-N369 PolarHBondContact NH2-OD1 2.97Å
134	N	90.5	Very high	91.5	Very high	36 Å²	36	45.5 Å²	45.5	19%	0.193	23%	0.229	C	C	.	.	H	α-helix	trans	-88.5	-16.6	-173.1	-69.4	-98.3	0	0	0	113.7	W130 I131 E132	W130-N134 PolarHBondContact NE1-ND2 3.32Å; W130-N134 VanDerWaalsContact NE1-ND2 3.14Å; W130-N134 PolarHBondContact O-N 3.4Å; W130-N134 PolarHBondContact O-ND2 3.21Å; I131-N134 PolarHBondContact O-N 2.81Å; E132-N134 VanDerWaalsContact C-N 3.28Å; E132-N134 PolarHBondContact O-N 2.85Å
135	L	92.8	Very high	91.5	Very high	8 Å²	8	46.4 Å²	46.4	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-117	1.5	-178.9	-68.5	178.2	0	0	0	114.8	I131 E132 D137 D138 C141 L145 L163 K166 I167 C170	I131-L135 HydrophobicContact CG2-CD1 3.94Å; I131-L135 WeakPolarHBondContact O-CB 3.3Å; I131-L135 PolarHBondContact O-N 3.13Å; E132-L135 PolarHBondContact O-N 3.18Å; L135-D137 PolarHBondContact O-N 3.36Å; L135-D138 HydrophobicContact CD2-CB 4.3Å; L135-D138 PolarHBondContact O-N 2.99Å; L135-C141 HydrophobicContact CB-CB 3.91Å; L135-L145 HydrophobicContact CB-CD1 4.36Å; L135-L163 HydrophobicContact CD1-CD1 3.79Å; L135-K166 HydrophobicContact CD1-CB 3.96Å; L135-K166 HydrophobicContact CD2-CB 4.13Å; L135-I167 HydrophobicContact CD1-CG1 4.12Å; L135-C170 WeakPolarHBondContact CD2-SG 3.28Å
136	L	90.4	Very high	91.5	Very high	99 Å²	99	49.9 Å²	49.9	52%	0.518	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-37.9	178.8	-169	65	0	0	0	113.7	E132 L145	E132-L136 WeakPolarHBondContact O-CB 3.18Å; E132-L136 PolarHBondContact O-N 3.46Å; L136-L145 HydrophobicContact CD1-CD1 4.44Å
137	D	89.7	Confident	91.5	Very high	132 Å²	132	50.6 Å²	50.6	71%	0.706	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-18.5	-179.6	-72	-31.4	0	0	0	113.5	L135 P139	L135-D137 PolarHBondContact O-N 3.36Å; D137-P139 WeakPolarHBondContact O-CD 3.37Å
138	D	91.3	Very high	91.4	Very high	34 Å²	34	55.5 Å²	55.5	18%	0.182	28%	0.28	C	S	.	.			trans	-73.9	120	-176.2	-177.2	-74.3	0	0	0	111.1	L135 E140 C141 K166	L135-D138 HydrophobicContact CD2-CB 4.3Å; L135-D138 PolarHBondContact O-N 2.99Å; D138-E140 VanDerWaalsContact C-N 3.26Å; D138-E140 PolarHBondContact O-N 2.9Å; D138-E140 WeakPolarHBondContact OD1-CB 3.48Å; D138-E140 PolarHBondContact OD1-N 3.45Å; D138-C141 HydrophobicContact CB-CB 3.94Å; D138-C141 VanDerWaalsContact CG-SG 3.51Å; D138-C141 PolarHBondContact O-N 3.09Å; D138-C141 VanDerWaalsContact O-N 3.11Å; D138-C141 PolarHBondContact OD1-N 2.9Å; D138-C141 VanDerWaalsContact OD1-N 3.08Å; D138-C141 PolarHBondContact OD1-SG 3.44Å; D138-K166 VanDerWaalsContact CG-NZ 3.3Å; D138-K166 IonicContact OD1-NZ 3.32Å; D138-K166 PolarHBondContact OD1-NZ 3.14Å; D138-K166 VanDerWaalsContact OD1-NZ 3.14Å; D138-K166 IonicContact OD2-NZ 2.97Å; D138-K166 PolarHBondContact OD2-NZ 2.96Å
139	P	90.2	Very high	91.2	Very high	104 Å²	104	60.7 Å²	60.7	68%	0.675	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-26.5	-173.7	-26	35.8	0	0	0	115.3	D137	D137-P139 WeakPolarHBondContact O-CD 3.37Å
140	E	87.5	Confident	91.1	Very high	41 Å²	41	61 Å²	61	19%	0.192	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-33.3	177.5	-61.4	173.1	-113.1	0	0	111.3	D138 K142 R143 K166 R183	D138-E140 VanDerWaalsContact C-N 3.26Å; D138-E140 PolarHBondContact O-N 2.9Å; D138-E140 WeakPolarHBondContact OD1-CB 3.48Å; D138-E140 PolarHBondContact OD1-N 3.45Å; E140-K142 PolarHBondContact O-N 2.95Å; E140-R143 WeakPolarHBondContact O-CG 3.32Å; E140-K166 WeakPolarHBondContact OE1-CE 3.5Å; E140-K166 IonicContact OE1-NZ 2.63Å; E140-K166 PolarHBondContact OE1-NZ 3.3Å; E140-R183 IonicContact OE1-CZ 2.75Å; E140-R183 IonicContact OE1-NE 3.92Å; E140-R183 PolarHBondContact OE1-NE 3.17Å; E140-R183 IonicContact OE1-NH2 3.26Å; E140-R183 PolarHBondContact OE1-NH2 3.26Å; E140-R183 IonicContact OE2-CZ 3.76Å; E140-R183 IonicContact OE2-NE 2.73Å; E140-R183 PolarHBondContact OE2-NE 3.17Å; E140-R183 IonicContact OE2-NH2 3.43Å; E140-R183 PolarHBondContact OE2-NH2 3.24Å
141	C	91.1	Very high	91	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.007	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-71.8	-16.7	-175.4	-61.2	0	0	0	0	113.1	L135 D138 R143 Y144 L145	L135-C141 HydrophobicContact CB-CB 3.91Å; D138-C141 HydrophobicContact CB-CB 3.94Å; D138-C141 VanDerWaalsContact CG-SG 3.51Å; D138-C141 PolarHBondContact O-N 3.09Å; D138-C141 VanDerWaalsContact O-N 3.11Å; D138-C141 PolarHBondContact OD1-N 2.9Å; D138-C141 VanDerWaalsContact OD1-N 3.08Å; D138-C141 PolarHBondContact OD1-SG 3.44Å; C141-R143 PolarHBondContact O-N 3.48Å; C141-Y144 HydrophobicContact CB-CD2 4.48Å; C141-Y144 PolarHBondContact O-N 2.97Å; C141-L145 PolarHBondContact O-N 3.36Å
142	K	90	Very high	90.8	Very high	132 Å²	132	62.3 Å²	62.3	57%	0.574	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-55.3	-16.7	175.5	-65.5	-178.6	-177.9	-177	0	115.1	E140	E140-K142 PolarHBondContact O-N 2.95Å
143	R	90.5	Very high	90.9	Very high	97 Å²	97	60.3 Å²	60.3	37%	0.366	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-82.2	-15.5	172.6	75.3	-170.1	177.6	-154.7	-2.6	114.5	E140 C141 D160	E140-R143 WeakPolarHBondContact O-CG 3.32Å; C141-R143 PolarHBondContact O-N 3.48Å; R143-D160 IonicContact NH2-OD2 3.71Å
144	Y	92.3	Very high	91.1	Very high	12 Å²	12	55.2 Å²	55.2	5%	0.047	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-8.3	176.4	-46.9	-75.2	0	0	0	113	C141 K157 D160 L163	C141-Y144 HydrophobicContact CB-CD2 4.48Å; C141-Y144 PolarHBondContact O-N 2.97Å; Y144-K157 HydrophobicContact CD1-CB 3.95Å; Y144-K157 HydrophobicContact CD1-CG 4.18Å; Y144-K157 WeakPolarHBondContact CE1-O 3.28Å; Y144-K157 WeakPolarHBondContact O-CD 3.47Å; Y144-K157 WeakPolarHBondContact O-CE 3.25Å; Y144-K157 PolarHBondContact O-NZ 2.75Å; Y144-D160 WeakPolarHBondContact CE1-OD2 3.45Å; Y144-D160 PolarHBondContact OH-OD1 3.37Å; Y144-D160 VanDerWaalsContact OH-OD1 3.08Å; Y144-D160 PolarHBondContact OH-OD2 3.25Å; Y144-L163 HydrophobicContact CD1-CD2 4.37Å; Y144-L163 HydrophobicContact CD2-CB 4.26Å; Y144-L163 HydrophobicContact CD2-CD1 4.06Å; Y144-L163 HydrophobicContact CE1-CB 4.36Å; Y144-L163 HydrophobicContact CE2-CB 4.08Å; Y144-L163 HydrophobicContact CG-CD1 4.41Å; Y144-L163 HydrophobicContact CG-CD2 4.21Å
145	L	91.6	Very high	91.2	Very high	25 Å²	25	53.6 Å²	53.6	13%	0.131	29%	0.287	C	S	.	.			trans	-112.6	143.1	-174.2	-57.7	-178.5	0	0	0	110.9	E132 L135 L136 C141 F147	E132-L145 HydrophobicContact CB-CD2 3.98Å; E132-L145 HydrophobicContact CG-CD1 4.4Å; E132-L145 HydrophobicContact CG-CD2 3.95Å; L135-L145 HydrophobicContact CB-CD1 4.36Å; L136-L145 HydrophobicContact CD1-CD1 4.44Å; C141-L145 PolarHBondContact O-N 3.36Å; L145-F147 HydrophobicContact CD2-CD2 3.76Å; L145-F147 HydrophobicContact CD2-CE2 3.4Å; L145-F147 HydrophobicContact CD2-CZ 4.19Å
146	P	92.9	Very high	91.2	Very high	92 Å²	92	58.1 Å²	58.1	60%	0.597	31%	0.31	S	S	*	.	S	Bend	cis	-73.9	163.3	-3.1	33.5	-37.4	0	0	0	112.6	E132 K157	E132-P146 VanDerWaalsContact OE1-CB 3.32Å; E132-P146 WeakPolarHBondContact OE1-CB 3.46Å; E132-P146 VanDerWaalsContact OE2-CA 3.28Å; E132-P146 WeakPolarHBondContact OE2-CA 3.26Å; P146-K157 PolarHBondContact O-NZ 3.05Å
147	F	92.8	Very high	91.4	Very high	17 Å²	17	55.2 Å²	55.2	8%	0.075	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-75.9	164.7	161.4	-67.5	-82.2	0	0	0	111.2	S128 I131 E132 L145 L154 K157 L163	S128-F147 WeakPolarHBondContact O-CD2 3.4Å; I131-F147 HydrophobicContact CB-CE2 3.93Å; I131-F147 HydrophobicContact CB-CZ 4.33Å; I131-F147 HydrophobicContact CG2-CE2 3.7Å; I131-F147 HydrophobicContact CG2-CZ 3.84Å; E132-F147 HydrophobicContact CB-CD2 4.16Å; E132-F147 HydrophobicContact CB-CE2 4.47Å; E132-F147 PolarHBondContact OE2-N 3.42Å; L145-F147 HydrophobicContact CD2-CD2 3.76Å; L145-F147 HydrophobicContact CD2-CE2 3.4Å; L145-F147 HydrophobicContact CD2-CZ 4.19Å; F147-L154 HydrophobicContact CE1-CB 4.44Å; F147-L154 HydrophobicContact CE1-CD1 3.9Å; F147-L154 HydrophobicContact CZ-CD1 4.15Å; F147-K157 HydrophobicContact CD1-CD 3.73Å; F147-K157 HydrophobicContact CE1-CB 4.29Å; F147-K157 HydrophobicContact CE1-CD 3.58Å; F147-L163 HydrophobicContact CE1-CD2 4.42Å; F147-L163 HydrophobicContact CZ-CD2 4.07Å
148	K	92.8	Very high	91.7	Very high	103 Å²	103	49 Å²	49	45%	0.448	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-66	153.3	165.8	-65.8	164.4	-173.8	163	0	109.8	D150 G151 S152 D153	K148-D150 WeakPolarHBondContact CB-OD1 3.41Å; K148-D150 PolarHBondContact O-N 3.03Å; K148-D150 VanDerWaalsContact O-N 3.08Å; K148-G151 PolarHBondContact O-N 3.05Å; K148-S152 WeakPolarHBondContact CD-OG 3.48Å; K148-S152 PolarHBondContact NZ-OG 3.34Å; K148-D153 WeakPolarHBondContact CB-OD1 3.29Å; K148-D153 HydrophobicContact CD-CB 3.87Å; K148-D153 HydrophobicContact CG-CB 4.33Å; K148-D153 PolarHBondContact N-OD1 2.96Å; K148-D153 PolarHBondContact N-OD2 3.44Å
149	S	88.3	Confident	91.8	Very high	114 Å²	114	49.1 Å²	49.1	80%	0.797	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-14.2	178.9	-45.6	0	0	0	0	114.6	R351	S149-R351 PolarHBondContact O-NH2 3.17Å
150	D	89.4	Confident	91.9	Very high	67 Å²	67	45 Å²	45	36%	0.358	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-9.2	171.3	66.8	-1.8	0	0	0	113.3	Q124 V125 K148 S152	Q124-D150 PolarHBondContact NE2-O 3.02Å; V125-D150 VanDerWaalsContact CG2-O 3.3Å; V125-D150 WeakPolarHBondContact CG2-O 3.44Å; K148-D150 WeakPolarHBondContact CB-OD1 3.41Å; K148-D150 PolarHBondContact O-N 3.03Å; K148-D150 VanDerWaalsContact O-N 3.08Å; D150-S152 PolarHBondContact O-N 2.85Å; D150-S152 VanDerWaalsContact OD1-CB 3.26Å; D150-S152 WeakPolarHBondContact OD1-CB 3.5Å; D150-S152 PolarHBondContact OD1-N 3.25Å; D150-S152 PolarHBondContact OD1-OG 2.84Å; D150-S152 WeakPolarHBondContact OD2-CB 3.1Å; D150-S152 PolarHBondContact OD2-OG 3.46Å
151	G	89.9	Confident	92.3	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.226	C	C	.	.			trans	67.4	12.1	-173.4	0	0	0	0	0	114.8	Q124 S128 K148 D153 L154	Q124-G151 WeakPolarHBondContact CG-O 3.4Å; S128-G151 WeakPolarHBondContact OG-CA 3.48Å; K148-G151 PolarHBondContact O-N 3.05Å; G151-D153 PolarHBondContact O-N 3.29Å; G151-L154 WeakPolarHBondContact O-CB 3.49Å; G151-L154 PolarHBondContact O-N 3.46Å; G151-L154 VanDerWaalsContact O-N 3.11Å
152	S	90.6	Very high	92.5	Very high	30 Å²	30	43 Å²	43	21%	0.21	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-19.4	-170.9	61.4	0	0	0	0	114.6	K148 D150	K148-S152 WeakPolarHBondContact CD-OG 3.48Å; K148-S152 PolarHBondContact NZ-OG 3.34Å; D150-S152 PolarHBondContact O-N 2.85Å; D150-S152 VanDerWaalsContact OD1-CB 3.26Å; D150-S152 WeakPolarHBondContact OD1-CB 3.5Å; D150-S152 PolarHBondContact OD1-N 3.25Å; D150-S152 PolarHBondContact OD1-OG 2.84Å; D150-S152 WeakPolarHBondContact OD2-CB 3.1Å; D150-S152 PolarHBondContact OD2-OG 3.46Å
153	D	93.7	Very high	92.8	Very high	15 Å²	15	36.7 Å²	36.7	8%	0.08	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-1.1	176	57.1	-25.5	0	0	0	114.5	K148 G151 Y155 D156 K157	K148-D153 WeakPolarHBondContact CB-OD1 3.29Å; K148-D153 HydrophobicContact CD-CB 3.87Å; K148-D153 HydrophobicContact CG-CB 4.33Å; K148-D153 PolarHBondContact N-OD1 2.96Å; K148-D153 PolarHBondContact N-OD2 3.44Å; G151-D153 PolarHBondContact O-N 3.29Å; D153-Y155 PolarHBondContact O-N 2.72Å; D153-D156 PolarHBondContact O-N 3.43Å; D153-K157 HydrophobicContact CB-CD 4.29Å; D153-K157 WeakPolarHBondContact O-CB 3.4Å; D153-K157 WeakPolarHBondContact O-CG 3.42Å; D153-K157 PolarHBondContact O-N 2.92Å; D153-K157 VanDerWaalsContact O-N 3.07Å; D153-K157 WeakPolarHBondContact OD2-CE 3.39Å; D153-K157 IonicContact OD2-NZ 2.67Å; D153-K157 PolarHBondContact OD2-NZ 3.22Å
154	L	93.9	Very high	93.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-55	-38	176.2	175.9	60.5	0	0	0	112.8	I131 F147 G151 C158 L230	I131-L154 HydrophobicContact CD1-CD1 3.48Å; I131-L154 VanDerWaalsContact CD1-CD1 3.48Å; F147-L154 HydrophobicContact CE1-CB 4.44Å; F147-L154 HydrophobicContact CE1-CD1 3.9Å; F147-L154 HydrophobicContact CZ-CD1 4.15Å; G151-L154 WeakPolarHBondContact O-CB 3.49Å; G151-L154 PolarHBondContact O-N 3.46Å; G151-L154 VanDerWaalsContact O-N 3.11Å; L154-C158 PolarHBondContact O-N 3.08Å; L154-C158 PolarHBondContact O-SG 2.72Å; L154-L230 HydrophobicContact CD1-CD1 4.1Å; L154-L230 HydrophobicContact CD2-CD1 3.83Å; L154-L230 HydrophobicContact CG-CD1 4.13Å
155	Y	94.1	Very high	93.3	Very high	3 Å²	3	31.6 Å²	31.6	1%	0.012	18%	0.179	C	C	.	.	H	α-helix	trans	-70	-53.5	-178.5	-50.6	-71.6	0	0	0	111.2	V119 Q124 D153 K157 C158 T159 K223 L226	V119-Y155 WeakPolarHBondContact CG1-OH 3.46Å; Q124-Y155 HydrophobicContact CG-CE2 4.18Å; Q124-Y155 VanDerWaalsContact OE1-CE2 3.28Å; Q124-Y155 PolarHBondContact OE1-OH 2.96Å; Q124-Y155 VanDerWaalsContact OE1-OH 3.06Å; D153-Y155 PolarHBondContact O-N 2.72Å; Y155-K157 VanDerWaalsContact C-N 3.26Å; Y155-K157 PolarHBondContact O-N 3.13Å; Y155-C158 PolarHBondContact O-N 3.31Å; Y155-T159 PolarHBondContact O-N 3.42Å; Y155-K223 HydrophobicContact CD1-CB 3.94Å; Y155-K223 HydrophobicContact CD1-CG 3.78Å; Y155-K223 HydrophobicContact CD2-CD 3.85Å; Y155-K223 HydrophobicContact CD2-CG 3.88Å; Y155-K223 HydrophobicContact CE1-CB 3.56Å; Y155-K223 HydrophobicContact CE1-CD 4.44Å; Y155-K223 HydrophobicContact CE1-CG 3.83Å; Y155-K223 WeakPolarHBondContact CE1-O 3.29Å; Y155-K223 HydrophobicContact CE2-CB 4.27Å; Y155-K223 HydrophobicContact CE2-CD 3.65Å; Y155-K223 HydrophobicContact CE2-CG 3.9Å; Y155-K223 HydrophobicContact CG-CB 4.46Å; Y155-K223 HydrophobicContact CG-CD 4.31Å; Y155-K223 HydrophobicContact CG-CG 3.82Å; Y155-L226 HydrophobicContact CD1-CB 4.38Å; Y155-L226 HydrophobicContact CD1-CD2 3.85Å; Y155-L226 HydrophobicContact CD1-CG 4.2Å
156	D	93	Very high	93.5	Very high	102 Å²	102	30.8 Å²	30.8	55%	0.545	17%	0.174	S	C	.	.	H	α-helix	trans	-55.3	-43.3	178.8	-52	-27.2	0	0	0	111	D153 C158 T159	D153-D156 PolarHBondContact O-N 3.43Å; D156-C158 VanDerWaalsContact C-N 3.28Å; D156-C158 PolarHBondContact O-N 2.75Å; D156-T159 WeakPolarHBondContact O-CB 3.4Å; D156-T159 WeakPolarHBondContact O-CG2 3.32Å; D156-T159 PolarHBondContact O-N 3.14Å; D156-T159 PolarHBondContact O-OG1 3.34Å
157	K	94.3	Very high	93.7	Very high	39 Å²	39	26.4 Å²	26.4	17%	0.17	15%	0.146	C	C	.	.	H	α-helix	trans	-70.3	-16.7	179.8	-73.1	171	167.7	177.8	0	114.4	Y144 P146 F147 D153 Y155 L163	Y144-K157 HydrophobicContact CD1-CB 3.95Å; Y144-K157 HydrophobicContact CD1-CG 4.18Å; Y144-K157 WeakPolarHBondContact CE1-O 3.28Å; Y144-K157 WeakPolarHBondContact O-CD 3.47Å; Y144-K157 WeakPolarHBondContact O-CE 3.25Å; Y144-K157 PolarHBondContact O-NZ 2.75Å; P146-K157 PolarHBondContact O-NZ 3.05Å; F147-K157 HydrophobicContact CD1-CD 3.73Å; F147-K157 HydrophobicContact CE1-CB 4.29Å; F147-K157 HydrophobicContact CE1-CD 3.58Å; D153-K157 HydrophobicContact CB-CD 4.29Å; D153-K157 WeakPolarHBondContact O-CB 3.4Å; D153-K157 WeakPolarHBondContact O-CG 3.42Å; D153-K157 PolarHBondContact O-N 2.92Å; D153-K157 VanDerWaalsContact O-N 3.07Å; D153-K157 WeakPolarHBondContact OD2-CE 3.39Å; D153-K157 IonicContact OD2-NZ 2.67Å; D153-K157 PolarHBondContact OD2-NZ 3.22Å; Y155-K157 VanDerWaalsContact C-N 3.26Å; Y155-K157 PolarHBondContact O-N 3.13Å; K157-L163 HydrophobicContact CB-CD2 3.96Å
158	C	94.7	Very high	93.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-89.6	-12	174.5	-74.5	0	0	0	0	113.9	L154 Y155 D156 D160 G161 L164 L226	L154-C158 PolarHBondContact O-N 3.08Å; L154-C158 PolarHBondContact O-SG 2.72Å; Y155-C158 PolarHBondContact O-N 3.31Å; D156-C158 VanDerWaalsContact C-N 3.28Å; D156-C158 PolarHBondContact O-N 2.75Å; C158-D160 PolarHBondContact O-N 2.7Å; C158-D160 VanDerWaalsContact O-N 3.13Å; C158-G161 PolarHBondContact O-N 3.34Å; C158-L164 HydrophobicContact CB-CD1 4.18Å; C158-L164 HydrophobicContact CB-CG 4.15Å; C158-L226 HydrophobicContact CB-CD1 4.22Å; C158-L226 HydrophobicContact CB-CD2 3.6Å
159	T	93.8	Very high	94	Very high	37 Å²	37	21.6 Å²	21.6	23%	0.227	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-19.7	-171.9	58.6	0	0	0	0	115.2	Y155 D156 M192 I196	Y155-T159 PolarHBondContact O-N 3.42Å; D156-T159 WeakPolarHBondContact O-CB 3.4Å; D156-T159 WeakPolarHBondContact O-CG2 3.32Å; D156-T159 PolarHBondContact O-N 3.14Å; D156-T159 PolarHBondContact O-OG1 3.34Å; T159-M192 VanDerWaalsContact O-CE 3.22Å; T159-M192 WeakPolarHBondContact O-CE 3.36Å; T159-I196 WeakPolarHBondContact O-CD1 3.15Å
160	D	93.3	Very high	94.3	Very high	18 Å²	18	16.4 Å²	16.4	10%	0.096	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-5	176.2	75.4	13.9	0	0	0	114.6	R143 Y144 C158 I162 L187 M192 N195	R143-D160 IonicContact NH2-OD2 3.71Å; Y144-D160 WeakPolarHBondContact CE1-OD2 3.45Å; Y144-D160 PolarHBondContact OH-OD1 3.37Å; Y144-D160 VanDerWaalsContact OH-OD1 3.08Å; Y144-D160 PolarHBondContact OH-OD2 3.25Å; C158-D160 PolarHBondContact O-N 2.7Å; C158-D160 VanDerWaalsContact O-N 3.13Å; D160-I162 PolarHBondContact O-N 3.38Å; D160-I162 VanDerWaalsContact O-N 3.13Å; D160-I162 WeakPolarHBondContact OD1-CB 3.36Å; D160-I162 PolarHBondContact OD1-N 3.12Å; D160-L187 HydrophobicContact CB-CD1 3.94Å; D160-M192 HydrophobicContact CB-CE 4.27Å; D160-M192 HydrophobicContact CB-CG 4.31Å; D160-N195 WeakPolarHBondContact O-CB 3.5Å; D160-N195 PolarHBondContact O-ND2 3.19Å
161	G	95.1	Very high	94.4	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.073	C	C	.	.	S	Bend	trans	71.8	-13.6	-178.7	0	0	0	0	0	116.1	C158 L164 C165	C158-G161 PolarHBondContact O-N 3.34Å; G161-L164 PolarHBondContact O-N 3.31Å; G161-C165 PolarHBondContact O-N 3.4Å; G161-C165 PolarHBondContact O-SG 3.05Å; G161-C165 VanDerWaalsContact O-SG 3.33Å
162	I	95.9	Very high	94.6	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-72.2	-43	-173.6	-60.8	172.1	0	0	0	110.5	D160 L164 C165 K166 I181 N182 R183 L187 N195	D160-I162 PolarHBondContact O-N 3.38Å; D160-I162 VanDerWaalsContact O-N 3.13Å; D160-I162 WeakPolarHBondContact OD1-CB 3.36Å; D160-I162 PolarHBondContact OD1-N 3.12Å; I162-L164 VanDerWaalsContact C-N 3.26Å; I162-L164 PolarHBondContact O-N 2.94Å; I162-C165 PolarHBondContact O-N 3.41Å; I162-K166 WeakPolarHBondContact O-CG 3.28Å; I162-K166 PolarHBondContact O-N 3.32Å; I162-I181 HydrophobicContact CB-CG2 4.41Å; I162-I181 HydrophobicContact CG1-CG2 3.77Å; I162-I181 HydrophobicContact CG2-CG2 4.36Å; I162-N182 WeakPolarHBondContact CD1-O 3.47Å; I162-R183 HydrophobicContact CD1-CG 4.47Å; I162-L187 HydrophobicContact CD1-CD1 3.67Å; I162-N195 VanDerWaalsContact CG1-ND2 3.28Å; I162-N195 WeakPolarHBondContact CG1-ND2 3.21Å
163	L	95.7	Very high	94.7	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58.5	-39.8	174.3	-180	59.1	0	0	0	111.2	I131 L135 Y144 F147 K157 K166 I167	I131-L163 HydrophobicContact CG2-CD1 4.03Å; L135-L163 HydrophobicContact CD1-CD1 3.79Å; Y144-L163 HydrophobicContact CD1-CD2 4.37Å; Y144-L163 HydrophobicContact CD2-CB 4.26Å; Y144-L163 HydrophobicContact CD2-CD1 4.06Å; Y144-L163 HydrophobicContact CE1-CB 4.36Å; Y144-L163 HydrophobicContact CE2-CB 4.08Å; Y144-L163 HydrophobicContact CG-CD1 4.41Å; Y144-L163 HydrophobicContact CG-CD2 4.21Å; F147-L163 HydrophobicContact CE1-CD2 4.42Å; F147-L163 HydrophobicContact CZ-CD2 4.07Å; K157-L163 HydrophobicContact CB-CD2 3.96Å; L163-K166 PolarHBondContact O-N 2.93Å; L163-I167 HydrophobicContact CD1-CD1 4.16Å; L163-I167 HydrophobicContact CD1-CG1 4.45Å; L163-I167 HydrophobicContact CG-CD1 3.92Å; L163-I167 WeakPolarHBondContact O-CD1 3.33Å; L163-I167 VanDerWaalsContact O-CG1 3.26Å; L163-I167 WeakPolarHBondContact O-CG1 3.42Å; L163-I167 PolarHBondContact O-N 2.88Å
164	L	96.3	Very high	94.7	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-66	-42.7	175.3	-72.2	171.2	0	0	0	112.5	C158 G161 I162 K166 I167 I168 A199 I218 L226 L230	C158-L164 HydrophobicContact CB-CD1 4.18Å; C158-L164 HydrophobicContact CB-CG 4.15Å; G161-L164 PolarHBondContact O-N 3.31Å; I162-L164 VanDerWaalsContact C-N 3.26Å; I162-L164 PolarHBondContact O-N 2.94Å; L164-K166 VanDerWaalsContact C-N 3.28Å; L164-K166 PolarHBondContact O-N 3.2Å; L164-I167 PolarHBondContact O-N 3.46Å; L164-I168 WeakPolarHBondContact O-CG1 3.23Å; L164-I168 PolarHBondContact O-N 3.16Å; L164-A199 HydrophobicContact CB-CB 3.86Å; L164-I218 HydrophobicContact CD1-CG2 3.55Å; L164-L226 HydrophobicContact CD1-CD1 4.22Å; L164-L226 HydrophobicContact CD2-CD1 3.82Å; L164-L230 HydrophobicContact CD2-CD2 3.8Å; L164-L230 HydrophobicContact CD2-CG 4.48Å
165	C	97.3	Very high	94.7	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61	-36.9	173.5	-65.8	0	0	0	0	112.5	G161 I162 N169 I176 I181	G161-C165 PolarHBondContact O-N 3.4Å; G161-C165 PolarHBondContact O-SG 3.05Å; G161-C165 VanDerWaalsContact O-SG 3.33Å; I162-C165 PolarHBondContact O-N 3.41Å; C165-N169 PolarHBondContact O-N 2.77Å; C165-I176 HydrophobicContact CB-CD1 3.78Å; C165-I176 HydrophobicContact CB-CG2 4.38Å; C165-I181 HydrophobicContact CB-CD1 3.59Å; C165-I181 HydrophobicContact CB-CG1 4.19Å
166	K	96.2	Very high	94.9	Very high	8 Å²	8	21.8 Å²	21.8	4%	0.035	11%	0.113	C	C	.	.	H	α-helix	trans	-66.7	-45.7	174.7	-68.3	-86.1	-178.1	174.4	0	111.4	L135 D138 E140 I162 L163 L164 I168 N169 C170	L135-K166 HydrophobicContact CD1-CB 3.96Å; L135-K166 HydrophobicContact CD2-CB 4.13Å; D138-K166 VanDerWaalsContact CG-NZ 3.3Å; D138-K166 IonicContact OD1-NZ 3.32Å; D138-K166 PolarHBondContact OD1-NZ 3.14Å; D138-K166 VanDerWaalsContact OD1-NZ 3.14Å; D138-K166 IonicContact OD2-NZ 2.97Å; D138-K166 PolarHBondContact OD2-NZ 2.96Å; E140-K166 WeakPolarHBondContact OE1-CE 3.5Å; E140-K166 IonicContact OE1-NZ 2.63Å; E140-K166 PolarHBondContact OE1-NZ 3.3Å; I162-K166 WeakPolarHBondContact O-CG 3.28Å; I162-K166 PolarHBondContact O-N 3.32Å; L163-K166 PolarHBondContact O-N 2.93Å; L164-K166 VanDerWaalsContact C-N 3.28Å; L164-K166 PolarHBondContact O-N 3.2Å; K166-I168 PolarHBondContact O-N 3.14Å; K166-N169 CarbonylContact O-C 3.59Å; K166-N169 PolarHBondContact O-N 3.07Å; K166-N169 VanDerWaalsContact O-N 3.11Å; K166-C170 PolarHBondContact O-N 3.36Å
167	I	96.1	Very high	95	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-60.1	-41.1	177.3	-71.5	163.6	0	0	0	112.1	W130 I131 L135 L163 L164 N169 C170 S171 L230 I233	W130-I167 HydrophobicContact CH2-CG2 4.43Å; W130-I167 HydrophobicContact CZ3-CG2 4.05Å; I131-I167 HydrophobicContact CD1-CD1 3.62Å; I131-I167 HydrophobicContact CG1-CD1 3.77Å; I131-I167 HydrophobicContact CG1-CG1 4.13Å; I131-I167 HydrophobicContact CG2-CD1 3.97Å; I131-I167 HydrophobicContact CG2-CG1 4.12Å; L135-I167 HydrophobicContact CD1-CG1 4.12Å; L163-I167 HydrophobicContact CD1-CD1 4.16Å; L163-I167 HydrophobicContact CD1-CG1 4.45Å; L163-I167 HydrophobicContact CG-CD1 3.92Å; L163-I167 WeakPolarHBondContact O-CD1 3.33Å; L163-I167 VanDerWaalsContact O-CG1 3.26Å; L163-I167 WeakPolarHBondContact O-CG1 3.42Å; L163-I167 PolarHBondContact O-N 2.88Å; L164-I167 PolarHBondContact O-N 3.46Å; I167-N169 VanDerWaalsContact C-N 3.33Å; I167-N169 PolarHBondContact O-N 3.3Å; I167-C170 WeakPolarHBondContact O-CB 3.33Å; I167-C170 PolarHBondContact O-N 3.18Å; I167-S171 PolarHBondContact O-N 2.78Å; I167-S171 VanDerWaalsContact O-N 3.17Å; I167-L230 HydrophobicContact CD1-CD2 3.8Å; I167-L230 HydrophobicContact CG2-CD2 4.06Å; I167-I233 HydrophobicContact CG2-CG2 3.94Å
168	I	96.9	Very high	95	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-61.8	-42.2	174.6	-69.4	166	0	0	0	111	L164 K166 C170 S171 I172 T175 I176 A199 A203 I233	L164-I168 WeakPolarHBondContact O-CG1 3.23Å; L164-I168 PolarHBondContact O-N 3.16Å; K166-I168 PolarHBondContact O-N 3.14Å; I168-C170 VanDerWaalsContact C-N 3.32Å; I168-C170 PolarHBondContact O-N 3.04Å; I168-S171 PolarHBondContact O-N 2.92Å; I168-I172 PolarHBondContact O-N 3.27Å; I168-T175 HydrophobicContact CG2-CG2 3.7Å; I168-I176 HydrophobicContact CB-CD1 4.04Å; I168-I176 HydrophobicContact CD1-CD1 4.06Å; I168-I176 HydrophobicContact CG2-CD1 3.93Å; I168-I176 HydrophobicContact CG2-CG1 4.31Å; I168-A199 HydrophobicContact CD1-CB 3.91Å; I168-A199 WeakPolarHBondContact CD1-O 3.47Å; I168-A203 HydrophobicContact CD1-CB 4.26Å; I168-I233 HydrophobicContact CD1-CD1 4.28Å; I168-I233 HydrophobicContact CG1-CD1 3.8Å; I168-I233 HydrophobicContact CG1-CG1 4.3Å; I168-I233 HydrophobicContact CG1-CG2 4.1Å
169	N	95.8	Very high	95	Very high	17 Å²	17	22.2 Å²	22.2	9%	0.091	11%	0.11	C	C	.	.	H	α-helix	trans	-71.9	-19.1	176.1	-90.8	5.3	0	0	0	114.4	C165 K166 I167 I172 P173 T175 I176 H178	C165-N169 PolarHBondContact O-N 2.77Å; K166-N169 CarbonylContact O-C 3.59Å; K166-N169 PolarHBondContact O-N 3.07Å; K166-N169 VanDerWaalsContact O-N 3.11Å; I167-N169 VanDerWaalsContact C-N 3.33Å; I167-N169 PolarHBondContact O-N 3.3Å; N169-I172 CarbonylContact O-C 3.23Å; N169-P173 VanDerWaalsContact O-CA 3.3Å; N169-P173 WeakPolarHBondContact O-CA 3.42Å; N169-T175 PolarHBondContact OD1-N 3.06Å; N169-I176 PolarHBondContact ND2-O 2.85Å; N169-I176 PolarHBondContact OD1-N 2.97Å; N169-I176 PolarHBondContact OD1-O 3.36Å; N169-H178 PolarHBondContact ND2-CE1 2.69Å; N169-H178 PolarHBondContact ND2-NE2 2.67Å
170	C	93.4	Very high	95	Very high	5 Å²	5	20.5 Å²	20.5	3%	0.034	10%	0.099	C	C	.	.	H	α-helix	trans	-65.6	-64.1	163.2	-66.4	0	0	0	0	109.3	W130 L135 K166 I167 I168 I172 F956	W130-C170 HydrophobicContact CH2-CB 4.1Å; L135-C170 WeakPolarHBondContact CD2-SG 3.28Å; K166-C170 PolarHBondContact O-N 3.36Å; I167-C170 WeakPolarHBondContact O-CB 3.33Å; I167-C170 PolarHBondContact O-N 3.18Å; I168-C170 VanDerWaalsContact C-N 3.32Å; I168-C170 PolarHBondContact O-N 3.04Å; C170-I172 VanDerWaalsContact C-N 3.34Å; C170-I172 PolarHBondContact O-N 3.49Å; C170-F956 HydrophobicContact CB-CD2 4.48Å; C170-F956 HydrophobicContact CB-CE2 3.9Å; C170-F956 WeakPolarHBondContact O-CD1 3.35Å; C170-F956 WeakPolarHBondContact O-CD2 3.44Å; C170-F956 VanDerWaalsContact O-CE2 3.28Å; C170-F956 WeakPolarHBondContact O-CE2 3.33Å; C170-F956 WeakPolarHBondContact O-CG 3.11Å
171	S	93.1	Very high	95.1	Very high	2 Å²	2	20 Å²	20	1%	0.014	10%	0.096	C	C	.	.	H	α-helix	trans	-58.5	-40.4	-174	-70.9	0	0	0	0	113.9	I167 I168 I233	I167-S171 PolarHBondContact O-N 2.78Å; I167-S171 VanDerWaalsContact O-N 3.17Å; I168-S171 PolarHBondContact O-N 2.92Å; S171-I233 WeakPolarHBondContact CB-O 3.39Å; S171-I233 PolarHBondContact OG-O 3.13Å
172	I	92.8	Very high	95.1	Very high	19 Å²	19	21.1 Å²	21.1	10%	0.097	10%	0.102	C	C	.	.	S	Bend	trans	-135.9	103.7	168.9	-58.8	-168.6	0	0	0	109.4	I168 N169 C170 T175 I206 I236 K240	I168-I172 PolarHBondContact O-N 3.27Å; N169-I172 CarbonylContact O-C 3.23Å; C170-I172 VanDerWaalsContact C-N 3.34Å; C170-I172 PolarHBondContact O-N 3.49Å; I172-T175 WeakPolarHBondContact CB-OG1 3.29Å; I172-T175 VanDerWaalsContact CG2-OG1 3.25Å; I172-T175 WeakPolarHBondContact CG2-OG1 3.31Å; I172-T175 WeakPolarHBondContact O-CB 3.49Å; I172-T175 PolarHBondContact O-N 2.85Å; I172-T175 PolarHBondContact O-OG1 3.13Å; I172-I206 HydrophobicContact CB-CG2 4.35Å; I172-I206 HydrophobicContact CD1-CB 3.88Å; I172-I206 HydrophobicContact CD1-CG2 3.82Å; I172-I206 HydrophobicContact CG1-CG2 4.43Å; I172-I236 HydrophobicContact CD1-CG2 3.97Å; I172-I236 HydrophobicContact CG1-CG2 4.42Å; I172-K240 HydrophobicContact CD1-CD 3.77Å; I172-K240 HydrophobicContact CG1-CD 3.92Å
173	P	93.1	Very high	94.9	Very high	52 Å²	52	25.7 Å²	25.7	34%	0.338	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	149.4	173.3	-28.1	35.9	0	0	0	113	N169 T175 F956	N169-P173 VanDerWaalsContact O-CA 3.3Å; N169-P173 WeakPolarHBondContact O-CA 3.42Å; P173-T175 PolarHBondContact O-N 3.03Å; P173-F956 HydrophobicContact CG-CB 3.78Å
174	K	93.1	Very high	94.5	Very high	138 Å²	138	33.5 Å²	33.5	60%	0.6	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	63	11.1	-177.3	-62.9	177.9	153.2	-117.9	0	116.2	I176 E602	K174-I176 VanDerWaalsContact C-N 3.3Å; K174-I176 PolarHBondContact O-N 3.32Å; K174-E602 IonicContact NZ-OE1 3.27Å; K174-E602 PolarHBondContact NZ-OE1 3.48Å; K174-E602 IonicContact NZ-OE2 3.13Å
175	T	95.7	Very high	94.1	Very high	14 Å²	14	38.9 Å²	38.9	9%	0.086	18%	0.184	C	C	.	.	S	Bend	trans	-66.4	-35.3	174.8	-56.2	0	0	0	0	112.1	I168 N169 I172 P173 I206 R609	I168-T175 HydrophobicContact CG2-CG2 3.7Å; N169-T175 PolarHBondContact OD1-N 3.06Å; I172-T175 WeakPolarHBondContact CB-OG1 3.29Å; I172-T175 VanDerWaalsContact CG2-OG1 3.25Å; I172-T175 WeakPolarHBondContact CG2-OG1 3.31Å; I172-T175 WeakPolarHBondContact O-CB 3.49Å; I172-T175 PolarHBondContact O-N 2.85Å; I172-T175 PolarHBondContact O-OG1 3.13Å; P173-T175 PolarHBondContact O-N 3.03Å; T175-I206 HydrophobicContact CG2-CG2 3.53Å; T175-R609 PolarHBondContact O-NH1 2.74Å
176	I	97.2	Very high	93.7	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.021	22%	0.222	C	C	.	.	S	Bend	trans	-125.4	134.3	179.8	-60.3	173.4	0	0	0	109.1	C165 I168 N169 K174 I181 L198 S202	C165-I176 HydrophobicContact CB-CD1 3.78Å; C165-I176 HydrophobicContact CB-CG2 4.38Å; I168-I176 HydrophobicContact CB-CD1 4.04Å; I168-I176 HydrophobicContact CD1-CD1 4.06Å; I168-I176 HydrophobicContact CG2-CD1 3.93Å; I168-I176 HydrophobicContact CG2-CG1 4.31Å; N169-I176 PolarHBondContact ND2-O 2.85Å; N169-I176 PolarHBondContact OD1-N 2.97Å; N169-I176 PolarHBondContact OD1-O 3.36Å; K174-I176 VanDerWaalsContact C-N 3.3Å; K174-I176 PolarHBondContact O-N 3.32Å; I176-I181 HydrophobicContact CG2-CD1 4.02Å; I176-I181 HydrophobicContact CG2-CG1 3.89Å; I176-L198 HydrophobicContact CG2-CD1 4.31Å; I176-L198 HydrophobicContact CG2-CD2 3.93Å; I176-L198 HydrophobicContact CG2-CG 4.2Å; I176-S202 WeakPolarHBondContact CG1-OG 3.48Å
177	D	96.4	Very high	93.4	Very high	23 Å²	23	45.8 Å²	45.8	12%	0.123	23%	0.228	C	C	.	.			trans	-82.5	125.4	170.1	-172.3	-20.5	0	0	0	109.3	R179 A180 T606	D177-R179 PolarHBondContact O-N 3Å; D177-R179 VanDerWaalsContact O-N 3.15Å; D177-R179 VanDerWaalsContact OD1-CB 3.27Å; D177-R179 WeakPolarHBondContact OD1-CB 3.37Å; D177-R179 WeakPolarHBondContact OD1-CG 3.5Å; D177-R179 PolarHBondContact OD1-N 3.08Å; D177-R179 IonicContact OD1-NE 2.67Å; D177-R179 PolarHBondContact OD1-NE 2.97Å; D177-R179 IonicContact OD2-CZ 2.65Å; D177-R179 IonicContact OD2-NE 3.49Å; D177-R179 PolarHBondContact OD2-NE 3.09Å; D177-R179 IonicContact OD2-NH2 3.52Å; D177-R179 PolarHBondContact OD2-NH2 3.34Å; D177-A180 HydrophobicContact CB-CB 4.43Å; D177-A180 WeakPolarHBondContact O-CB 3.37Å; D177-A180 PolarHBondContact O-N 3.05Å; D177-T606 HydrophobicContact CB-CG2 4.37Å; D177-T606 WeakPolarHBondContact CB-OG1 3.43Å
178	H	93.5	Very high	93.3	Very high	61 Å²	61	49.1 Å²	49.1	28%	0.282	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-14.6	177.9	-66	-60.5	0	0	0	113.8	N169 I181 R183	N169-H178 PolarHBondContact ND2-CE1 2.69Å; N169-H178 PolarHBondContact ND2-NE2 2.67Å; H178-I181 WeakPolarHBondContact ND1-CD1 3.33Å; H178-R183 VanDerWaalsContact O-CD 3.22Å; H178-R183 WeakPolarHBondContact O-CD 3.34Å; H178-R183 PolarHBondContact O-NH1 3.31Å
179	R	94.3	Very high	93.1	Very high	66 Å²	66	52.9 Å²	52.9	25%	0.249	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-28.5	168.9	-64.7	-179.5	-64.3	165.1	-2.7	113.1	D177 L587 T599 Y603	D177-R179 PolarHBondContact O-N 3Å; D177-R179 VanDerWaalsContact O-N 3.15Å; D177-R179 VanDerWaalsContact OD1-CB 3.27Å; D177-R179 WeakPolarHBondContact OD1-CB 3.37Å; D177-R179 WeakPolarHBondContact OD1-CG 3.5Å; D177-R179 PolarHBondContact OD1-N 3.08Å; D177-R179 IonicContact OD1-NE 2.67Å; D177-R179 PolarHBondContact OD1-NE 2.97Å; D177-R179 IonicContact OD2-CZ 2.65Å; D177-R179 IonicContact OD2-NE 3.49Å; D177-R179 PolarHBondContact OD2-NE 3.09Å; D177-R179 IonicContact OD2-NH2 3.52Å; D177-R179 PolarHBondContact OD2-NH2 3.34Å; R179-L587 HydrophobicContact CB-CD1 3.93Å; R179-L587 HydrophobicContact CG-CD1 4.18Å; R179-L587 PolarHBondContact NH1-O 3.34Å; R179-T599 VanDerWaalsContact NH2-CG2 3.32Å; R179-T599 PolarHBondContact NH2-O 2.98Å; R179-Y603 HydrophobicContact CB-CD2 4.05Å; R179-Y603 HydrophobicContact CB-CE2 3.98Å
180	A	94.6	Very high	92.9	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.302	C	S	.	.	S	Bend	trans	-82.8	-11.3	-179.1	0	0	0	0	0	113.5	D177 Y603 T606 L607 R610	D177-A180 HydrophobicContact CB-CB 4.43Å; D177-A180 WeakPolarHBondContact O-CB 3.37Å; D177-A180 PolarHBondContact O-N 3.05Å; A180-Y603 HydrophobicContact CB-CD2 4.23Å; A180-Y603 HydrophobicContact CB-CE2 4.4Å; A180-T606 WeakPolarHBondContact CB-OG1 3.28Å; A180-L607 HydrophobicContact CB-CD2 3.97Å; A180-L607 HydrophobicContact CB-CG 4.3Å; A180-R610 WeakPolarHBondContact O-CD 3.45Å; A180-R610 PolarHBondContact O-NH1 3.26Å
181	I	95.8	Very high	93	Very high	8 Å²	8	63.5 Å²	63.5	4%	0.041	31%	0.313	C	S	.	.	S	Bend	trans	-83.9	130.6	-179.1	-50.7	171	0	0	0	109.8	I162 C165 I176 H178 R183 N195 L198	I162-I181 HydrophobicContact CB-CG2 4.41Å; I162-I181 HydrophobicContact CG1-CG2 3.77Å; I162-I181 HydrophobicContact CG2-CG2 4.36Å; C165-I181 HydrophobicContact CB-CD1 3.59Å; C165-I181 HydrophobicContact CB-CG1 4.19Å; I176-I181 HydrophobicContact CG2-CD1 4.02Å; I176-I181 HydrophobicContact CG2-CG1 3.89Å; H178-I181 WeakPolarHBondContact ND1-CD1 3.33Å; I181-R183 HydrophobicContact CB-CG 3.98Å; I181-R183 HydrophobicContact CG2-CG 3.89Å; I181-R183 WeakPolarHBondContact O-CD 3.37Å; I181-R183 WeakPolarHBondContact O-CG 3.43Å; I181-R183 PolarHBondContact O-N 2.88Å; I181-R183 VanDerWaalsContact O-N 3.07Å; I181-N195 WeakPolarHBondContact CG2-OD1 3.45Å; I181-L198 HydrophobicContact CG1-CD2 3.98Å
182	N	94.6	Very high	93	Very high	23 Å²	23	65 Å²	65	12%	0.123	32%	0.32	C	S	.	.			trans	-68.7	104.5	172.6	-64.9	-46.4	0	0	0	108.8	I162 L187 Q191 E194 N195	I162-N182 WeakPolarHBondContact CD1-O 3.47Å; N182-L187 HydrophobicContact CB-CD2 4.08Å; N182-L187 VanDerWaalsContact O-CD2 3.25Å; N182-L187 WeakPolarHBondContact O-CD2 3.41Å; N182-Q191 HydrophobicContact CB-CB 3.85Å; N182-Q191 HydrophobicContact CB-CG 4.07Å; N182-Q191 PolarHBondContact ND2-O 3.22Å; N182-E194 WeakPolarHBondContact ND2-CB 3.33Å; N182-E194 PolarHBondContact ND2-OE2 3.19Å; N182-N195 WeakPolarHBondContact CB-OD1 3.47Å; N182-N195 PolarHBondContact N-OD1 2.56Å; N182-N195 PolarHBondContact O-ND2 3.28Å
183	R	92	Very high	93.1	Very high	97 Å²	97	68.4 Å²	68.4	37%	0.366	34%	0.336	S	S	.	.			trans	-113.8	-14.3	-168.8	-72.8	154.4	72.7	-146.1	8.3	115.7	E140 I162 H178 I181 L185	E140-R183 IonicContact OE1-CZ 2.75Å; E140-R183 IonicContact OE1-NE 3.92Å; E140-R183 PolarHBondContact OE1-NE 3.17Å; E140-R183 IonicContact OE1-NH2 3.26Å; E140-R183 PolarHBondContact OE1-NH2 3.26Å; E140-R183 IonicContact OE2-CZ 3.76Å; E140-R183 IonicContact OE2-NE 2.73Å; E140-R183 PolarHBondContact OE2-NE 3.17Å; E140-R183 IonicContact OE2-NH2 3.43Å; E140-R183 PolarHBondContact OE2-NH2 3.24Å; I162-R183 HydrophobicContact CD1-CG 4.47Å; H178-R183 VanDerWaalsContact O-CD 3.22Å; H178-R183 WeakPolarHBondContact O-CD 3.34Å; H178-R183 PolarHBondContact O-NH1 3.31Å; I181-R183 HydrophobicContact CB-CG 3.98Å; I181-R183 HydrophobicContact CG2-CG 3.89Å; I181-R183 WeakPolarHBondContact O-CD 3.37Å; I181-R183 WeakPolarHBondContact O-CG 3.43Å; I181-R183 PolarHBondContact O-N 2.88Å; I181-R183 VanDerWaalsContact O-N 3.07Å; R183-L185 PolarHBondContact O-N 3.32Å
184	H	87	Confident	93.2	Very high	164 Å²	164	67.2 Å²	67.2	76%	0.759	33%	0.326	S	S	*	.	S	Bend	trans	-72.6	125.3	-178	-61.8	-76.3	0	0	0	111.1	L187	H184-L187 VanDerWaalsContact O-CD2 3.24Å; H184-L187 WeakPolarHBondContact O-CD2 3.4Å
185	L	87.4	Confident	93.4	Very high	114 Å²	114	60.6 Å²	60.6	60%	0.597	30%	0.297	S	S	*	.	S	Bend	trans	-92.8	147.7	178.3	-67.3	178	0	0	0	111.5	R183 L187	R183-L185 PolarHBondContact O-N 3.32Å; L185-L187 HydrophobicContact CD2-CD1 4.25Å; L185-L187 HydrophobicContact CD2-CG 4.21Å
186	P	88.5	Confident	93.5	Very high	124 Å²	124	60 Å²	60	81%	0.805	29%	0.293	S	S	*	.	S	Bend	cis	-73.3	143.6	-9.5	31.8	-34.6	0	0	0	111.4
187	L	91.1	Very high	93.5	Very high	29 Å²	29	60.9 Å²	60.9	15%	0.152	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-80.1	143	176.8	-65.9	160.2	0	0	0	110.5	D160 I162 N182 H184 L185 Q191 M192	D160-L187 HydrophobicContact CB-CD1 3.94Å; I162-L187 HydrophobicContact CD1-CD1 3.67Å; N182-L187 HydrophobicContact CB-CD2 4.08Å; N182-L187 VanDerWaalsContact O-CD2 3.25Å; N182-L187 WeakPolarHBondContact O-CD2 3.41Å; H184-L187 VanDerWaalsContact O-CD2 3.24Å; H184-L187 WeakPolarHBondContact O-CD2 3.4Å; L185-L187 HydrophobicContact CD2-CD1 4.25Å; L185-L187 HydrophobicContact CD2-CG 4.21Å; L187-Q191 HydrophobicContact CB-CB 4.43Å; L187-Q191 HydrophobicContact CD2-CB 4.02Å; L187-M192 HydrophobicContact CB-CG 3.85Å; L187-M192 HydrophobicContact CD1-CG 4.37Å
188	T	93.4	Very high	93.5	Very high	71 Å²	71	59.8 Å²	59.8	44%	0.436	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-74.8	156.3	165.5	60.9	0	0	0	0	110.9	Y190 Q191 M192	T188-Y190 PolarHBondContact O-N 3.31Å; T188-Q191 PolarHBondContact O-N 2.89Å; T188-Q191 VanDerWaalsContact OG1-CD 3.3Å; T188-Q191 VanDerWaalsContact OG1-CG 3.3Å; T188-Q191 WeakPolarHBondContact OG1-CG 3.22Å; T188-Q191 PolarHBondContact OG1-N 3.03Å; T188-Q191 PolarHBondContact OG1-OE1 3.43Å; T188-M192 WeakPolarHBondContact O-CG 3.23Å; T188-M192 PolarHBondContact O-N 3.13Å
189	T	92.6	Very high	93.7	Very high	79 Å²	79	57 Å²	57	49%	0.485	28%	0.281	S	S	.	.	H	α-helix	trans	-54	-38.4	173.8	48	0	0	0	0	112.4	M192 H193 W219	T189-M192 PolarHBondContact O-N 2.99Å; T189-H193 WeakPolarHBondContact O-CB 3.33Å; T189-H193 PolarHBondContact O-N 2.75Å; T189-W219 HydrophobicContact CG2-CZ2 4.15Å
190	Y	91.9	Very high	93.9	Very high	186 Å²	186	54.2 Å²	54.2	73%	0.729	27%	0.271	S	S	*	.	H	α-helix	trans	-61.4	-45.6	173.5	-64.2	-73.7	0	0	0	112.4	T188 H193 E194	T188-Y190 PolarHBondContact O-N 3.31Å; Y190-H193 PolarHBondContact O-N 3.43Å; Y190-E194 WeakPolarHBondContact O-CG 3.48Å; Y190-E194 PolarHBondContact O-N 2.98Å
191	Q	93.9	Very high	94	Very high	59 Å²	59	54.8 Å²	54.8	28%	0.276	27%	0.274	S	S	.	.	H	α-helix	trans	-66.6	-36.7	178.4	-74.7	163.5	-47.1	0	0	112.8	N182 L187 T188 E194 N195	N182-Q191 HydrophobicContact CB-CB 3.85Å; N182-Q191 HydrophobicContact CB-CG 4.07Å; N182-Q191 PolarHBondContact ND2-O 3.22Å; L187-Q191 HydrophobicContact CB-CB 4.43Å; L187-Q191 HydrophobicContact CD2-CB 4.02Å; T188-Q191 PolarHBondContact O-N 2.89Å; T188-Q191 VanDerWaalsContact OG1-CD 3.3Å; T188-Q191 VanDerWaalsContact OG1-CG 3.3Å; T188-Q191 WeakPolarHBondContact OG1-CG 3.22Å; T188-Q191 PolarHBondContact OG1-N 3.03Å; T188-Q191 PolarHBondContact OG1-OE1 3.43Å; Q191-E194 PolarHBondContact O-N 3.13Å; Q191-N195 VanDerWaalsContact O-CG 3.31Å; Q191-N195 PolarHBondContact O-N 2.87Å
192	M	94.7	Very high	94.1	Very high	33 Å²	33	54.4 Å²	54.4	16%	0.163	27%	0.272	C	S	.	.	H	α-helix	trans	-62.8	-48.4	172.3	-63.4	169.5	71.3	0	0	110.7	T159 D160 L187 T188 T189 E194 N195 I196	T159-M192 VanDerWaalsContact O-CE 3.22Å; T159-M192 WeakPolarHBondContact O-CE 3.36Å; D160-M192 HydrophobicContact CB-CE 4.27Å; D160-M192 HydrophobicContact CB-CG 4.31Å; L187-M192 HydrophobicContact CB-CG 3.85Å; L187-M192 HydrophobicContact CD1-CG 4.37Å; T188-M192 WeakPolarHBondContact O-CG 3.23Å; T188-M192 PolarHBondContact O-N 3.13Å; T189-M192 PolarHBondContact O-N 2.99Å; M192-E194 VanDerWaalsContact C-N 3.32Å; M192-E194 PolarHBondContact O-N 3.33Å; M192-N195 PolarHBondContact O-N 3.38Å; M192-I196 WeakPolarHBondContact O-CG1 3.14Å; M192-I196 PolarHBondContact O-N 3.08Å
193	H	94.6	Very high	94.2	Very high	91 Å²	91	53.3 Å²	53.3	42%	0.421	27%	0.266	S	S	.	.	H	α-helix	trans	-62.1	-37.2	176.9	-172.5	-65.3	0	0	0	112.2	T189 Y190 T197	T189-H193 WeakPolarHBondContact O-CB 3.33Å; T189-H193 PolarHBondContact O-N 2.75Å; Y190-H193 PolarHBondContact O-N 3.43Å; H193-T197 PolarHBondContact ND1-OG1 3.17Å; H193-T197 WeakPolarHBondContact O-CB 3.28Å; H193-T197 PolarHBondContact O-N 3.2Å; H193-T197 PolarHBondContact O-OG1 3.41Å
194	E	95.2	Very high	94.3	Very high	27 Å²	27	51 Å²	51	13%	0.126	26%	0.257	C	S	.	.	H	α-helix	trans	-64.7	-42.9	172	-79.4	-157.5	154.5	0	0	112.8	N182 Y190 Q191 M192 I196 T197 L198 R579 R610	N182-E194 WeakPolarHBondContact ND2-CB 3.33Å; N182-E194 PolarHBondContact ND2-OE2 3.19Å; Y190-E194 WeakPolarHBondContact O-CG 3.48Å; Y190-E194 PolarHBondContact O-N 2.98Å; Q191-E194 PolarHBondContact O-N 3.13Å; M192-E194 VanDerWaalsContact C-N 3.32Å; M192-E194 PolarHBondContact O-N 3.33Å; E194-I196 PolarHBondContact O-N 2.85Å; E194-T197 WeakPolarHBondContact O-CB 3.44Å; E194-T197 PolarHBondContact O-N 2.74Å; E194-L198 WeakPolarHBondContact O-CB 3.43Å; E194-L198 PolarHBondContact O-N 3.33Å; E194-R579 WeakPolarHBondContact OE1-CD 3.43Å; E194-R579 IonicContact OE1-CZ 3.32Å; E194-R579 IonicContact OE1-NE 2.89Å; E194-R579 IonicContact OE1-NH1 2.64Å; E194-R579 PolarHBondContact OE1-NH1 2.97Å; E194-R610 HydrophobicContact CB-CG 3.89Å; E194-R610 HydrophobicContact CG-CG 4.44Å; E194-R610 IonicContact OE2-CZ 3.09Å; E194-R610 IonicContact OE2-NE 2.98Å; E194-R610 PolarHBondContact OE2-NE 3.27Å; E194-R610 IonicContact OE2-NH2 3.24Å
195	N	97.2	Very high	94.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.5	-42.3	176	-73.5	-19	0	0	0	111.6	D160 I162 I181 N182 Q191 M192 L198 A199	D160-N195 WeakPolarHBondContact O-CB 3.5Å; D160-N195 PolarHBondContact O-ND2 3.19Å; I162-N195 VanDerWaalsContact CG1-ND2 3.28Å; I162-N195 WeakPolarHBondContact CG1-ND2 3.21Å; I181-N195 WeakPolarHBondContact CG2-OD1 3.45Å; N182-N195 WeakPolarHBondContact CB-OD1 3.47Å; N182-N195 PolarHBondContact N-OD1 2.56Å; N182-N195 PolarHBondContact O-ND2 3.28Å; Q191-N195 VanDerWaalsContact O-CG 3.31Å; Q191-N195 PolarHBondContact O-N 2.87Å; M192-N195 PolarHBondContact O-N 3.38Å; N195-L198 WeakPolarHBondContact O-CB 3.25Å; N195-L198 PolarHBondContact O-N 3.42Å; N195-A199 PolarHBondContact O-N 3.07Å
196	I	97.3	Very high	95	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.1	-40.7	174.1	-63.7	167.5	0	0	0	110.7	T159 M192 E194 L198 A199 L200 A215 I218 W219	T159-I196 WeakPolarHBondContact O-CD1 3.15Å; M192-I196 WeakPolarHBondContact O-CG1 3.14Å; M192-I196 PolarHBondContact O-N 3.08Å; E194-I196 PolarHBondContact O-N 2.85Å; I196-L198 VanDerWaalsContact C-N 3.34Å; I196-L198 PolarHBondContact O-N 2.96Å; I196-A199 WeakPolarHBondContact O-CB 3.21Å; I196-A199 PolarHBondContact O-N 3.2Å; I196-L200 HydrophobicContact CG2-CD1 3.88Å; I196-L200 HydrophobicContact CG2-CG 4.23Å; I196-L200 WeakPolarHBondContact O-CG 3.4Å; I196-L200 PolarHBondContact O-N 3.38Å; I196-A215 HydrophobicContact CB-CB 4.09Å; I196-A215 HydrophobicContact CG2-CB 3.63Å; I196-I218 HydrophobicContact CD1-CB 4.25Å; I196-I218 HydrophobicContact CD1-CG2 4.04Å; I196-I218 HydrophobicContact CG1-CG2 4.16Å; I196-I218 HydrophobicContact CG2-CB 3.74Å; I196-I218 HydrophobicContact CG2-CG1 4.05Å; I196-I218 HydrophobicContact CG2-CG2 3.97Å; I196-W219 HydrophobicContact CD1-CB 3.83Å
197	T	97	Very high	95.2	Very high	24 Å²	24	33.2 Å²	33.2	15%	0.147	16%	0.164	C	C	.	.	H	α-helix	trans	-62	-42.1	176.7	-58.2	0	0	0	0	111.3	H193 E194 N201	H193-T197 PolarHBondContact ND1-OG1 3.17Å; H193-T197 WeakPolarHBondContact O-CB 3.28Å; H193-T197 PolarHBondContact O-N 3.2Å; H193-T197 PolarHBondContact O-OG1 3.41Å; E194-T197 WeakPolarHBondContact O-CB 3.44Å; E194-T197 PolarHBondContact O-N 2.74Å; T197-N201 WeakPolarHBondContact O-CB 3.49Å; T197-N201 PolarHBondContact O-N 2.95Å; T197-N201 PolarHBondContact O-ND2 3Å
198	L	97.8	Very high	95.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.4	-46.6	171.4	173.2	56.5	0	0	0	111.5	I176 I181 E194 N195 I196 S202 T606 R609 R610	I176-L198 HydrophobicContact CG2-CD1 4.31Å; I176-L198 HydrophobicContact CG2-CD2 3.93Å; I176-L198 HydrophobicContact CG2-CG 4.2Å; I181-L198 HydrophobicContact CG1-CD2 3.98Å; E194-L198 WeakPolarHBondContact O-CB 3.43Å; E194-L198 PolarHBondContact O-N 3.33Å; N195-L198 WeakPolarHBondContact O-CB 3.25Å; N195-L198 PolarHBondContact O-N 3.42Å; I196-L198 VanDerWaalsContact C-N 3.34Å; I196-L198 PolarHBondContact O-N 2.96Å; L198-S202 WeakPolarHBondContact O-CB 3.34Å; L198-S202 PolarHBondContact O-N 3.33Å; L198-S202 PolarHBondContact O-OG 3.1Å; L198-T606 VanDerWaalsContact CD1-O 3.27Å; L198-T606 WeakPolarHBondContact CD1-O 3.13Å; L198-R609 HydrophobicContact CD1-CB 3.91Å; L198-R610 HydrophobicContact CB-CB 4.05Å; L198-R610 HydrophobicContact CB-CG 4.19Å; L198-R610 HydrophobicContact CD1-CB 4.34Å; L198-R610 HydrophobicContact CD2-CB 4.42Å
199	A	97.7	Very high	95.3	Very high	2 Å²	2	30.4 Å²	30.4	2%	0.017	15%	0.147	C	C	.	.	H	α-helix	trans	-61.3	-50.9	177.2	0	0	0	0	0	111.9	L164 I168 N195 I196 N201 S202 A203	L164-A199 HydrophobicContact CB-CB 3.86Å; I168-A199 HydrophobicContact CD1-CB 3.91Å; I168-A199 WeakPolarHBondContact CD1-O 3.47Å; N195-A199 PolarHBondContact O-N 3.07Å; I196-A199 WeakPolarHBondContact O-CB 3.21Å; I196-A199 PolarHBondContact O-N 3.2Å; A199-N201 PolarHBondContact O-N 2.73Å; A199-S202 PolarHBondContact O-N 3.11Å; A199-A203 WeakPolarHBondContact O-CB 3.33Å; A199-A203 PolarHBondContact O-N 3.22Å
200	L	97.3	Very high	95.2	Very high	8 Å²	8	26.8 Å²	26.8	4%	0.042	13%	0.125	C	C	.	.	H	α-helix	trans	-62.5	-43.5	-179.7	-69.6	170.9	0	0	0	112.6	I196 S202 A203 R204 V210 I213 A215 I218 L229	I196-L200 HydrophobicContact CG2-CD1 3.88Å; I196-L200 HydrophobicContact CG2-CG 4.23Å; I196-L200 WeakPolarHBondContact O-CG 3.4Å; I196-L200 PolarHBondContact O-N 3.38Å; L200-S202 VanDerWaalsContact C-N 3.28Å; L200-S202 PolarHBondContact O-N 3.32Å; L200-A203 PolarHBondContact O-N 3.33Å; L200-R204 PolarHBondContact O-N 3.12Å; L200-V210 HydrophobicContact CD2-CG1 4.36Å; L200-I213 HydrophobicContact CD2-CB 4.3Å; L200-I213 HydrophobicContact CD2-CG2 3.65Å; L200-A215 HydrophobicContact CD1-CB 4.15Å; L200-I218 HydrophobicContact CD2-CG1 4.49Å; L200-L229 HydrophobicContact CD2-CD2 3.65Å
201	N	96.9	Very high	94.7	Very high	12 Å²	12	20.9 Å²	20.9	6%	0.064	11%	0.108	C	C	.	.	H	α-helix	trans	-68.9	-28	177.2	-74.1	-24.7	0	0	0	112.7	T197 A199 R204 A205 R609 G612	T197-N201 WeakPolarHBondContact O-CB 3.49Å; T197-N201 PolarHBondContact O-N 2.95Å; T197-N201 PolarHBondContact O-ND2 3Å; A199-N201 PolarHBondContact O-N 2.73Å; N201-R204 PolarHBondContact OD1-NH1 2.71Å; N201-A205 PolarHBondContact O-N 3.33Å; N201-R609 HydrophobicContact CB-CB 3.84Å; N201-R609 HydrophobicContact CB-CG 4.07Å; N201-R609 PolarHBondContact ND2-O 2.94Å; N201-G612 VanDerWaalsContact ND2-C 3.32Å; N201-G612 WeakPolarHBondContact ND2-CA 3.37Å; N201-G612 PolarHBondContact ND2-O 3.01Å
202	S	97.5	Very high	94.2	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-79.5	-37.2	174.9	-58.5	0	0	0	0	112.4	I176 L198 A199 L200 R204 A205 I206	I176-S202 WeakPolarHBondContact CG1-OG 3.48Å; L198-S202 WeakPolarHBondContact O-CB 3.34Å; L198-S202 PolarHBondContact O-N 3.33Å; L198-S202 PolarHBondContact O-OG 3.1Å; A199-S202 PolarHBondContact O-N 3.11Å; L200-S202 VanDerWaalsContact C-N 3.28Å; L200-S202 PolarHBondContact O-N 3.32Å; S202-R204 VanDerWaalsContact C-N 3.33Å; S202-A205 PolarHBondContact O-N 2.97Å; S202-I206 PolarHBondContact O-N 3.06Å; S202-I206 VanDerWaalsContact O-N 3.11Å
203	A	96.9	Very high	94	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58.8	-45.1	169.1	0	0	0	0	0	110.7	I168 A199 L200 A205 I206 G207 C208 V210 L229 I233	I168-A203 HydrophobicContact CD1-CB 4.26Å; A199-A203 WeakPolarHBondContact O-CB 3.33Å; A199-A203 PolarHBondContact O-N 3.22Å; L200-A203 PolarHBondContact O-N 3.33Å; A203-A205 VanDerWaalsContact C-N 3.33Å; A203-A205 PolarHBondContact O-N 3.29Å; A203-I206 WeakPolarHBondContact O-CG1 3.45Å; A203-I206 PolarHBondContact O-N 2.82Å; A203-G207 PolarHBondContact O-N 2.86Å; A203-C208 HydrophobicContact CB-CB 4.01Å; A203-C208 VanDerWaalsContact O-CB 3.31Å; A203-C208 WeakPolarHBondContact O-CB 3.4Å; A203-C208 PolarHBondContact O-N 3.3Å; A203-V210 HydrophobicContact CB-CG1 4.06Å; A203-L229 HydrophobicContact CB-CD1 3.99Å; A203-I233 HydrophobicContact CB-CD1 4.37Å; A203-I233 HydrophobicContact CB-CG1 4.42Å
204	R	95	Very high	93.8	Very high	47 Å²	47	18.4 Å²	18.4	18%	0.177	11%	0.107	C	C	.	.	H	α-helix	trans	-57.3	-45.3	173.3	-154.6	-176.5	-70.1	95	-2.8	111.8	L200 N201 S202 I206 G207 V210 S405 Y616	L200-R204 PolarHBondContact O-N 3.12Å; N201-R204 PolarHBondContact OD1-NH1 2.71Å; S202-R204 VanDerWaalsContact C-N 3.33Å; R204-I206 VanDerWaalsContact C-N 3.29Å; R204-I206 PolarHBondContact O-N 2.91Å; R204-G207 PolarHBondContact O-N 3.37Å; R204-V210 HydrophobicContact CB-CG2 3.72Å; R204-V210 HydrophobicContact CG-CG2 3.8Å; R204-V210 VanDerWaalsContact CZ-CG2 3.41Å; R204-V210 VanDerWaalsContact NE-CG2 3.3Å; R204-S405 VanDerWaalsContact CG-CB 3.42Å; R204-S405 WeakPolarHBondContact CG-OG 3.4Å; R204-S405 WeakPolarHBondContact O-CB 3.35Å; R204-Y616 WeakPolarHBondContact CD-OH 3.5Å; R204-Y616 HydrophobicContact CG-CE1 4.13Å
205	A	94.6	Very high	93.7	Very high	13 Å²	13	17.6 Å²	17.6	11%	0.107	11%	0.105	C	C	.	.	H	α-helix	trans	-66.6	-23.9	-179.6	0	0	0	0	0	114.6	N201 S202 A203 N401	N201-A205 PolarHBondContact O-N 3.33Å; S202-A205 PolarHBondContact O-N 2.97Å; A203-A205 VanDerWaalsContact C-N 3.33Å; A203-A205 PolarHBondContact O-N 3.29Å; A205-N401 PolarHBondContact O-ND2 2.67Å
206	I	94	Very high	93.4	Very high	11 Å²	11	19 Å²	19	6%	0.056	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-2.3	172.6	65.7	167.2	0	0	0	113.9	I172 T175 S202 A203 R204 I236 N401	I172-I206 HydrophobicContact CB-CG2 4.35Å; I172-I206 HydrophobicContact CD1-CB 3.88Å; I172-I206 HydrophobicContact CD1-CG2 3.82Å; I172-I206 HydrophobicContact CG1-CG2 4.43Å; T175-I206 HydrophobicContact CG2-CG2 3.53Å; S202-I206 PolarHBondContact O-N 3.06Å; S202-I206 VanDerWaalsContact O-N 3.11Å; A203-I206 WeakPolarHBondContact O-CG1 3.45Å; A203-I206 PolarHBondContact O-N 2.82Å; R204-I206 VanDerWaalsContact C-N 3.29Å; R204-I206 PolarHBondContact O-N 2.91Å; I206-I236 HydrophobicContact CD1-CG2 4.45Å; I206-I236 HydrophobicContact CG1-CD1 4.47Å; I206-N401 WeakPolarHBondContact CA-ND2 3.35Å; I206-N401 PolarHBondContact O-ND2 2.92Å
207	G	92.8	Very high	93.2	Very high	5 Å²	5	21.6 Å²	21.6	5%	0.052	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	101	10.5	178.2	0	0	0	0	0	115.6	A203 R204	A203-G207 PolarHBondContact O-N 2.86Å; R204-G207 PolarHBondContact O-N 3.37Å
208	C	94.7	Very high	93	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	13%	0.127	C	C	.	.			trans	-70.8	136	170.4	-56.3	0	0	0	0	110.8	A203 V210 Q232 S405	A203-C208 HydrophobicContact CB-CB 4.01Å; A203-C208 VanDerWaalsContact O-CB 3.31Å; A203-C208 WeakPolarHBondContact O-CB 3.4Å; A203-C208 PolarHBondContact O-N 3.3Å; C208-V210 HydrophobicContact CB-CG1 4.21Å; C208-V210 PolarHBondContact O-N 3.48Å; C208-Q232 HydrophobicContact CB-CB 4.23Å; C208-S405 WeakPolarHBondContact O-CA 3.22Å; C208-S405 WeakPolarHBondContact O-CB 3.46Å
209	N	92.8	Very high	92.6	Very high	41 Å²	41	25.7 Å²	25.7	22%	0.219	15%	0.146	C	C	.	.			trans	-68.2	117	161.5	178.7	3.9	0	0	0	109.1	V211 Q232 G407	N209-V211 WeakPolarHBondContact OD1-CB 3.36Å; N209-V211 WeakPolarHBondContact OD1-CG2 3.17Å; N209-V211 PolarHBondContact OD1-N 2.67Å; N209-Q232 PolarHBondContact O-NE2 2.8Å; N209-Q232 PolarHBondContact O-OE1 3.19Å; N209-G407 VanDerWaalsContact CG-CA 3.46Å; N209-G407 WeakPolarHBondContact ND2-CA 3.41Å
210	V	89.3	Confident	92.2	Very high	3 Å²	3	31 Å²	31	2%	0.018	18%	0.175	C	C	.	.			trans	-124.8	22.1	174.3	-59.6	0	0	0	0	111.7	L200 A203 R204 C208 I213 L229	L200-V210 HydrophobicContact CD2-CG1 4.36Å; A203-V210 HydrophobicContact CB-CG1 4.06Å; R204-V210 HydrophobicContact CB-CG2 3.72Å; R204-V210 HydrophobicContact CG-CG2 3.8Å; R204-V210 VanDerWaalsContact CZ-CG2 3.41Å; R204-V210 VanDerWaalsContact NE-CG2 3.3Å; C208-V210 HydrophobicContact CB-CG1 4.21Å; C208-V210 PolarHBondContact O-N 3.48Å; V210-I213 PolarHBondContact O-N 3Å; V210-L229 HydrophobicContact CG1-CD1 3.82Å
211	V	82.4	Confident	91.6	Very high	62 Å²	62	31.4 Å²	31.4	38%	0.376	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	141.1	166.7	-177.3	0	0	0	0	107.9	N209 I213	N209-V211 WeakPolarHBondContact OD1-CB 3.36Å; N209-V211 WeakPolarHBondContact OD1-CG2 3.17Å; N209-V211 PolarHBondContact OD1-N 2.67Å; V211-I213 PolarHBondContact O-N 3.42Å
212	N	83	Confident	91.2	Very high	80 Å²	80	32.6 Å²	32.6	43%	0.428	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	22.3	-172.3	-53.9	-42.7	0	0	0	115.5	N663	N212-N663 PolarHBondContact OD1-OD1 3.49Å
213	I	89.5	Confident	91	Very high	21 Å²	21	35.3 Å²	35.3	11%	0.108	20%	0.2	C	C	.	.			trans	-121.9	102	170.6	-49.7	-176	0	0	0	110	L200 V210 V211 I218 L225 L229	L200-I213 HydrophobicContact CD2-CB 4.3Å; L200-I213 HydrophobicContact CD2-CG2 3.65Å; V210-I213 PolarHBondContact O-N 3Å; V211-I213 PolarHBondContact O-N 3.42Å; I213-I218 HydrophobicContact CG2-CD1 3.89Å; I213-I218 HydrophobicContact CG2-CG1 4.11Å; I213-L225 HydrophobicContact CD1-CB 4.46Å; I213-L225 HydrophobicContact CG1-CB 4.38Å; I213-L225 HydrophobicContact CG1-CD2 4.31Å; I213-L229 HydrophobicContact CD1-CB 4.23Å
214	G	90.4	Very high	90.6	Very high	30 Å²	30	36.3 Å²	36.3	31%	0.309	20%	0.204	S	C	.	.			trans	-87.6	163.4	172.2	0	0	0	0	0	112.8	G216 D217	G214-G216 VanDerWaalsContact C-N 3.25Å; G214-G216 PolarHBondContact O-N 2.95Å; G214-D217 WeakPolarHBondContact CA-OD2 3.41Å; G214-D217 PolarHBondContact N-OD2 3.21Å; G214-D217 PolarHBondContact O-N 3.31Å
215	A	93.1	Very high	90.4	Very high	11 Å²	11	35.4 Å²	35.4	9%	0.091	20%	0.203	C	C	.	.	H	α-helix	trans	-68.4	-27.3	175.1	0	0	0	0	0	112.6	I196 L200 W219	I196-A215 HydrophobicContact CB-CB 4.09Å; I196-A215 HydrophobicContact CG2-CB 3.63Å; L200-A215 HydrophobicContact CD1-CB 4.15Å; A215-W219 WeakPolarHBondContact O-CB 3.43Å; A215-W219 PolarHBondContact O-N 3.22Å; A215-W219 VanDerWaalsContact O-N 3.13Å
216	G	92.1	Very high	90.4	Very high	29 Å²	29	34.8 Å²	34.8	30%	0.299	20%	0.198	S	C	.	.	H	α-helix	trans	-64.4	-36.2	172.6	0	0	0	0	0	113.2	G214 W219 N220	G214-G216 VanDerWaalsContact C-N 3.25Å; G214-G216 PolarHBondContact O-N 2.95Å; G216-W219 PolarHBondContact O-N 2.75Å; G216-N220 VanDerWaalsContact O-CB 3.3Å; G216-N220 WeakPolarHBondContact O-CB 3.49Å; G216-N220 PolarHBondContact O-N 3.01Å; G216-N220 PolarHBondContact O-ND2 3.42Å
217	D	92.1	Very high	90.4	Very high	55 Å²	55	34.5 Å²	34.5	29%	0.294	20%	0.196	S	C	.	.	H	α-helix	trans	-67.5	-42.2	-178.9	-54.8	-69.2	0	0	0	112.1	G214 N220 G221 T222 L225	G214-D217 WeakPolarHBondContact CA-OD2 3.41Å; G214-D217 PolarHBondContact N-OD2 3.21Å; G214-D217 PolarHBondContact O-N 3.31Å; D217-N220 PolarHBondContact O-N 3.09Å; D217-G221 PolarHBondContact O-N 2.92Å; D217-T222 VanDerWaalsContact O-CB 3.29Å; D217-T222 WeakPolarHBondContact O-CB 3.46Å; D217-T222 PolarHBondContact O-N 3.18Å; D217-T222 PolarHBondContact O-OG1 3.15Å; D217-L225 HydrophobicContact CB-CD1 3.89Å
218	I	93	Very high	90.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.5	-39	175.2	-55.6	-57.2	0	0	0	110.7	L164 I196 L200 I213 G221 L226 L229	L164-I218 HydrophobicContact CD1-CG2 3.55Å; I196-I218 HydrophobicContact CD1-CB 4.25Å; I196-I218 HydrophobicContact CD1-CG2 4.04Å; I196-I218 HydrophobicContact CG1-CG2 4.16Å; I196-I218 HydrophobicContact CG2-CB 3.74Å; I196-I218 HydrophobicContact CG2-CG1 4.05Å; I196-I218 HydrophobicContact CG2-CG2 3.97Å; L200-I218 HydrophobicContact CD2-CG1 4.49Å; I213-I218 HydrophobicContact CG2-CD1 3.89Å; I213-I218 HydrophobicContact CG2-CG1 4.11Å; I218-G221 PolarHBondContact O-N 3.36Å; I218-G221 VanDerWaalsContact O-N 3.14Å; I218-L226 HydrophobicContact CD1-CB 3.9Å; I218-L226 HydrophobicContact CD1-CD1 4.25Å; I218-L229 HydrophobicContact CD1-CD2 4.15Å
219	W	90.4	Very high	90.4	Very high	110 Å²	110	35.5 Å²	35.5	42%	0.417	21%	0.206	S	C	.	.	H	α-helix	trans	-67.6	-37.4	177	-175.7	76.3	0	0	0	112.8	T189 I196 A215 G216 G221	T189-W219 HydrophobicContact CG2-CZ2 4.15Å; I196-W219 HydrophobicContact CD1-CB 3.83Å; A215-W219 WeakPolarHBondContact O-CB 3.43Å; A215-W219 PolarHBondContact O-N 3.22Å; A215-W219 VanDerWaalsContact O-N 3.13Å; G216-W219 PolarHBondContact O-N 2.75Å; W219-G221 PolarHBondContact O-N 3.29Å
220	N	88.6	Confident	90.5	Very high	114 Å²	114	33.6 Å²	33.6	61%	0.61	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-5.8	171.8	-71.5	-23.8	0	0	0	113.3	G216 D217	G216-N220 VanDerWaalsContact O-CB 3.3Å; G216-N220 WeakPolarHBondContact O-CB 3.49Å; G216-N220 PolarHBondContact O-N 3.01Å; G216-N220 PolarHBondContact O-ND2 3.42Å; D217-N220 PolarHBondContact O-N 3.09Å
221	G	83.7	Confident	90.8	Very high	15 Å²	15	35 Å²	35	16%	0.155	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	29.3	-179.2	0	0	0	0	0	114.4	D217 I218 W219 K223	D217-G221 PolarHBondContact O-N 2.92Å; I218-G221 PolarHBondContact O-N 3.36Å; I218-G221 VanDerWaalsContact O-N 3.14Å; W219-G221 PolarHBondContact O-N 3.29Å; G221-K223 VanDerWaalsContact O-CG 3.29Å; G221-K223 WeakPolarHBondContact O-CG 3.45Å; G221-K223 PolarHBondContact O-N 2.95Å
222	T	89.3	Confident	91.3	Very high	38 Å²	38	34.4 Å²	34.4	23%	0.233	19%	0.194	C	C	.	.			trans	-60.4	93.9	-179.8	-59.8	0	0	0	0	111.2	D217 H224 L225 L226	D217-T222 VanDerWaalsContact O-CB 3.29Å; D217-T222 WeakPolarHBondContact O-CB 3.46Å; D217-T222 PolarHBondContact O-N 3.18Å; D217-T222 PolarHBondContact O-OG1 3.15Å; T222-H224 PolarHBondContact O-N 3.43Å; T222-L225 HydrophobicContact CG2-CB 4.28Å; T222-L225 HydrophobicContact CG2-CD1 3.84Å; T222-L225 HydrophobicContact CG2-CG 3.88Å; T222-L225 PolarHBondContact O-N 2.77Å; T222-L226 PolarHBondContact O-N 2.87Å; T222-L226 VanDerWaalsContact O-N 3.13Å
223	K	92.3	Very high	92	Very high	56 Å²	56	30.6 Å²	30.6	24%	0.243	17%	0.174	C	C	.	.	H	α-helix	trans	-58.9	-41.3	-160	-61.8	-169.9	177.2	-168.3	0	114.9	Y104 V119 Y155 G221 L227	Y104-K223 HydrophobicContact CD2-CD 4.39Å; Y104-K223 HydrophobicContact CE1-CD 3.96Å; Y104-K223 HydrophobicContact CE2-CD 3.77Å; Y104-K223 PolarHBondContact OH-NZ 3.36Å; V119-K223 HydrophobicContact CG2-CB 3.87Å; Y155-K223 HydrophobicContact CD1-CB 3.94Å; Y155-K223 HydrophobicContact CD1-CG 3.78Å; Y155-K223 HydrophobicContact CD2-CD 3.85Å; Y155-K223 HydrophobicContact CD2-CG 3.88Å; Y155-K223 HydrophobicContact CE1-CB 3.56Å; Y155-K223 HydrophobicContact CE1-CD 4.44Å; Y155-K223 HydrophobicContact CE1-CG 3.83Å; Y155-K223 WeakPolarHBondContact CE1-O 3.29Å; Y155-K223 HydrophobicContact CE2-CB 4.27Å; Y155-K223 HydrophobicContact CE2-CD 3.65Å; Y155-K223 HydrophobicContact CE2-CG 3.9Å; Y155-K223 HydrophobicContact CG-CB 4.46Å; Y155-K223 HydrophobicContact CG-CD 4.31Å; Y155-K223 HydrophobicContact CG-CG 3.82Å; G221-K223 VanDerWaalsContact O-CG 3.29Å; G221-K223 WeakPolarHBondContact O-CG 3.45Å; G221-K223 PolarHBondContact O-N 2.95Å; K223-L227 WeakPolarHBondContact O-CB 3.41Å; K223-L227 PolarHBondContact O-N 2.86Å
224	H	88.8	Confident	92.2	Very high	21 Å²	21	29.6 Å²	29.6	10%	0.097	17%	0.168	C	C	.	.	H	α-helix	trans	-72.3	-37.2	-175.7	68.8	-91.6	0	0	0	112.1	H117 V119 T222 G228	H117-H224 HydrophobicContact CB-CB 4.29Å; H117-H224 VanDerWaalsContact CB-ND1 3.33Å; H117-H224 WeakPolarHBondContact CB-ND1 3.41Å; H117-H224 AromaticContact CD2-CE1 3.56Å; H117-H224 AromaticContact CE1-CE1 3.6Å; H117-H224 AromaticContact CE1-NE2 3.37Å; H117-H224 PolarHBondContact CE1-NE2 3.17Å; H117-H224 AromaticContact CG-CE1 3.24Å; H117-H224 AromaticContact CG-CG 3.96Å; H117-H224 AromaticContact CG-ND1 3.48Å; H117-H224 AromaticContact CG-NE2 3.61Å; H117-H224 AromaticContact ND1-CD2 3.53Å; H117-H224 AromaticContact ND1-CE1 3.29Å; H117-H224 PolarHBondContact ND1-CE1 3.42Å; H117-H224 VanDerWaalsContact ND1-CE1 3.29Å; H117-H224 AromaticContact ND1-CG 3.91Å; H117-H224 AromaticContact ND1-ND1 3.78Å; H117-H224 AromaticContact ND1-NE2 3.12Å; H117-H224 PolarHBondContact ND1-NE2 3.42Å; H117-H224 VanDerWaalsContact ND1-NE2 3.12Å; H117-H224 AromaticContact NE2-CE1 3.75Å; H117-H224 AromaticContact NE2-NE2 3.95Å; V119-H224 HydrophobicContact CG2-CB 4.02Å; T222-H224 PolarHBondContact O-N 3.43Å; H224-G228 PolarHBondContact O-N 2.95Å
225	L	92.1	Very high	92.4	Very high	28 Å²	28	31.4 Å²	31.4	15%	0.147	17%	0.168	C	C	.	.	H	α-helix	trans	-69.1	-45.4	175.2	-61.1	-178.2	0	0	0	111.1	I213 D217 T222 G228 L229	I213-L225 HydrophobicContact CD1-CB 4.46Å; I213-L225 HydrophobicContact CG1-CB 4.38Å; I213-L225 HydrophobicContact CG1-CD2 4.31Å; D217-L225 HydrophobicContact CB-CD1 3.89Å; T222-L225 HydrophobicContact CG2-CB 4.28Å; T222-L225 HydrophobicContact CG2-CD1 3.84Å; T222-L225 HydrophobicContact CG2-CG 3.88Å; T222-L225 PolarHBondContact O-N 2.77Å; L225-G228 PolarHBondContact O-N 3.04Å; L225-L229 VanDerWaalsContact O-CB 3.3Å; L225-L229 WeakPolarHBondContact O-CB 3.27Å; L225-L229 PolarHBondContact O-N 2.92Å
226	L	93.8	Very high	92.4	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.1	-43.1	177	175.3	49.2	0	0	0	111.7	Y155 C158 L164 I218 T222 L229 L230	Y155-L226 HydrophobicContact CD1-CB 4.38Å; Y155-L226 HydrophobicContact CD1-CD2 3.85Å; Y155-L226 HydrophobicContact CD1-CG 4.2Å; C158-L226 HydrophobicContact CB-CD1 4.22Å; C158-L226 HydrophobicContact CB-CD2 3.6Å; L164-L226 HydrophobicContact CD1-CD1 4.22Å; L164-L226 HydrophobicContact CD2-CD1 3.82Å; I218-L226 HydrophobicContact CD1-CB 3.9Å; I218-L226 HydrophobicContact CD1-CD1 4.25Å; T222-L226 PolarHBondContact O-N 2.87Å; T222-L226 VanDerWaalsContact O-N 3.13Å; L226-L229 PolarHBondContact O-N 2.99Å; L226-L230 HydrophobicContact CD1-CD1 3.97Å; L226-L230 HydrophobicContact CD1-CG 4Å; L226-L230 HydrophobicContact CG-CD1 4.28Å; L226-L230 WeakPolarHBondContact O-CB 3.37Å; L226-L230 VanDerWaalsContact O-CG 3.31Å; L226-L230 WeakPolarHBondContact O-CG 3.41Å; L226-L230 PolarHBondContact O-N 2.87Å
227	L	93.5	Very high	92.4	Very high	6 Å²	6	31.7 Å²	31.7	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-64.7	-40.6	175.7	-168.9	74.8	0	0	0	112	V119 E123 F127 K223 L230 W231	V119-L227 HydrophobicContact CG1-CD2 3.83Å; E123-L227 HydrophobicContact CB-CD1 4.23Å; E123-L227 HydrophobicContact CB-CD2 3.85Å; E123-L227 HydrophobicContact CB-CG 4.35Å; F127-L227 HydrophobicContact CD2-CD1 3.52Å; F127-L227 HydrophobicContact CD2-CG 4.3Å; F127-L227 HydrophobicContact CE2-CD1 3.73Å; F127-L227 HydrophobicContact CE2-CG 4.01Å; K223-L227 WeakPolarHBondContact O-CB 3.41Å; K223-L227 PolarHBondContact O-N 2.86Å; L227-L230 PolarHBondContact O-N 3.14Å; L227-W231 PolarHBondContact O-N 2.9Å
228	G	92.7	Very high	92.4	Very high	23 Å²	23	29.4 Å²	29.4	24%	0.237	15%	0.149	C	C	.	.	H	α-helix	trans	-65.2	-38.3	175.1	0	0	0	0	0	113.5	H224 L225 Q232	H224-G228 PolarHBondContact O-N 2.95Å; L225-G228 PolarHBondContact O-N 3.04Å; G228-Q232 WeakPolarHBondContact O-CG 3.21Å; G228-Q232 PolarHBondContact O-N 3.31Å
229	L	94.6	Very high	92.4	Very high	3 Å²	3	30 Å²	30	2%	0.016	15%	0.152	C	C	.	.	H	α-helix	trans	-65.1	-46.7	173.4	177.4	60.7	0	0	0	111.5	L200 A203 V210 I213 I218 L225 L226 W231 Q232 I233	L200-L229 HydrophobicContact CD2-CD2 3.65Å; A203-L229 HydrophobicContact CB-CD1 3.99Å; V210-L229 HydrophobicContact CG1-CD1 3.82Å; I213-L229 HydrophobicContact CD1-CB 4.23Å; I218-L229 HydrophobicContact CD1-CD2 4.15Å; L225-L229 VanDerWaalsContact O-CB 3.3Å; L225-L229 WeakPolarHBondContact O-CB 3.27Å; L225-L229 PolarHBondContact O-N 2.92Å; L226-L229 PolarHBondContact O-N 2.99Å; L229-W231 PolarHBondContact O-N 3.45Å; L229-Q232 PolarHBondContact O-N 3.11Å; L229-I233 HydrophobicContact CD1-CD1 3.88Å; L229-I233 HydrophobicContact CD1-CG1 4.33Å; L229-I233 HydrophobicContact CG-CD1 3.84Å; L229-I233 WeakPolarHBondContact O-CG1 3.39Å; L229-I233 PolarHBondContact O-N 3.2Å
230	L	95.9	Very high	92.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.1	-44	176.3	-74.1	171.6	0	0	0	111.5	F127 I131 L154 L164 I167 L226 L227 Q232 I233 I234	F127-L230 HydrophobicContact CD2-CB 4.18Å; I131-L230 HydrophobicContact CD1-CD2 4.47Å; L154-L230 HydrophobicContact CD1-CD1 4.1Å; L154-L230 HydrophobicContact CD2-CD1 3.83Å; L154-L230 HydrophobicContact CG-CD1 4.13Å; L164-L230 HydrophobicContact CD2-CD2 3.8Å; L164-L230 HydrophobicContact CD2-CG 4.48Å; I167-L230 HydrophobicContact CD1-CD2 3.8Å; I167-L230 HydrophobicContact CG2-CD2 4.06Å; L226-L230 HydrophobicContact CD1-CD1 3.97Å; L226-L230 HydrophobicContact CD1-CG 4Å; L226-L230 HydrophobicContact CG-CD1 4.28Å; L226-L230 WeakPolarHBondContact O-CB 3.37Å; L226-L230 VanDerWaalsContact O-CG 3.31Å; L226-L230 WeakPolarHBondContact O-CG 3.41Å; L226-L230 PolarHBondContact O-N 2.87Å; L227-L230 PolarHBondContact O-N 3.14Å; L230-Q232 VanDerWaalsContact C-N 3.34Å; L230-Q232 PolarHBondContact O-N 3.05Å; L230-I233 PolarHBondContact O-N 2.88Å; L230-I234 WeakPolarHBondContact O-CB 3.38Å; L230-I234 WeakPolarHBondContact O-CG1 3.19Å; L230-I234 PolarHBondContact O-N 2.83Å
231	W	94.6	Very high	92	Very high	32 Å²	32	25.6 Å²	25.6	12%	0.121	13%	0.131	C	C	.	.	H	α-helix	trans	-56.7	-45.9	174.7	172.8	-121	0	0	0	112.2	F127 L227 L229 I234 K235 K361 L364 A365	F127-W231 AromaticContact CE1-CE3 3.69Å; F127-W231 HydrophobicContact CE1-CE3 3.69Å; F127-W231 HydrophobicContact CE1-CZ3 4.29Å; F127-W231 HydrophobicContact CE2-CB 3.78Å; F127-W231 HydrophobicContact CZ-CB 3.74Å; F127-W231 HydrophobicContact CZ-CD2 4.12Å; F127-W231 AromaticContact CZ-CE3 3.58Å; F127-W231 HydrophobicContact CZ-CE3 3.58Å; F127-W231 HydrophobicContact CZ-CG 4.21Å; L227-W231 PolarHBondContact O-N 2.9Å; L229-W231 PolarHBondContact O-N 3.45Å; W231-I234 PolarHBondContact O-N 3.33Å; W231-K235 HydrophobicContact CD2-CB 4.42Å; W231-K235 HydrophobicContact CH2-CB 4.29Å; W231-K235 HydrophobicContact CH2-CG 4.47Å; W231-K235 HydrophobicContact CZ2-CB 4.08Å; W231-K235 HydrophobicContact CZ2-CD 3.95Å; W231-K235 HydrophobicContact CZ2-CG 4.11Å; W231-K235 VanDerWaalsContact O-CB 3.23Å; W231-K235 WeakPolarHBondContact O-CB 3.31Å; W231-K235 PolarHBondContact O-N 2.87Å; W231-K361 HydrophobicContact CD2-CB 4.21Å; W231-K361 HydrophobicContact CD2-CD 3.86Å; W231-K361 HydrophobicContact CD2-CG 4.04Å; W231-K361 HydrophobicContact CE3-CB 4.12Å; W231-K361 HydrophobicContact CE3-CD 4.41Å; W231-K361 HydrophobicContact CE3-CG 4.46Å; W231-K361 HydrophobicContact CG-CD 4.01Å; W231-K361 HydrophobicContact CH2-CB 3.69Å; W231-K361 HydrophobicContact CH2-CG 4.17Å; W231-K361 VanDerWaalsContact CH2-O 3.29Å; W231-K361 WeakPolarHBondContact CH2-O 3.45Å; W231-K361 HydrophobicContact CZ2-CB 3.77Å; W231-K361 HydrophobicContact CZ2-CD 4.44Å; W231-K361 HydrophobicContact CZ2-CG 3.69Å; W231-K361 HydrophobicContact CZ3-CB 3.87Å; W231-L364 HydrophobicContact CH2-CD2 4.21Å; W231-L364 HydrophobicContact CZ2-CD2 4.23Å; W231-A365 HydrophobicContact CZ3-CB 4.27Å
232	Q	94.6	Very high	92.4	Very high	51 Å²	51	24.9 Å²	24.9	24%	0.238	12%	0.124	C	C	.	.	H	α-helix	trans	-63.1	-45.2	178.9	-71.3	-178.8	82.7	0	0	112.5	C208 N209 G228 L229 L230 I234 K235 I236	C208-Q232 HydrophobicContact CB-CB 4.23Å; N209-Q232 PolarHBondContact O-NE2 2.8Å; N209-Q232 PolarHBondContact O-OE1 3.19Å; G228-Q232 WeakPolarHBondContact O-CG 3.21Å; G228-Q232 PolarHBondContact O-N 3.31Å; L229-Q232 PolarHBondContact O-N 3.11Å; L230-Q232 VanDerWaalsContact C-N 3.34Å; L230-Q232 PolarHBondContact O-N 3.05Å; Q232-I234 VanDerWaalsContact C-N 3.35Å; Q232-I234 PolarHBondContact O-N 3.31Å; Q232-K235 PolarHBondContact O-N 2.91Å; Q232-I236 WeakPolarHBondContact O-CG1 3.18Å; Q232-I236 PolarHBondContact O-N 3.41Å
233	I	96.1	Very high	92.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.7	-42.6	178.7	-63	161	0	0	0	110.3	I167 I168 S171 A203 L229 L230 G237	I167-I233 HydrophobicContact CG2-CG2 3.94Å; I168-I233 HydrophobicContact CD1-CD1 4.28Å; I168-I233 HydrophobicContact CG1-CD1 3.8Å; I168-I233 HydrophobicContact CG1-CG1 4.3Å; I168-I233 HydrophobicContact CG1-CG2 4.1Å; S171-I233 WeakPolarHBondContact CB-O 3.39Å; S171-I233 PolarHBondContact OG-O 3.13Å; A203-I233 HydrophobicContact CB-CD1 4.37Å; A203-I233 HydrophobicContact CB-CG1 4.42Å; L229-I233 HydrophobicContact CD1-CD1 3.88Å; L229-I233 HydrophobicContact CD1-CG1 4.33Å; L229-I233 HydrophobicContact CG-CD1 3.84Å; L229-I233 WeakPolarHBondContact O-CG1 3.39Å; L229-I233 PolarHBondContact O-N 3.2Å; L230-I233 PolarHBondContact O-N 2.88Å; I233-G237 PolarHBondContact O-N 2.7Å; I233-G237 VanDerWaalsContact O-N 3.11Å
234	I	94.7	Very high	91.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-64.7	-49.2	176.8	-70.2	168.3	0	0	0	110.7	F127 W130 L230 W231 Q232 I236 G237 L238 F349	F127-I234 HydrophobicContact CB-CD1 3.83Å; F127-I234 HydrophobicContact CD1-CD1 3.78Å; F127-I234 HydrophobicContact CD2-CD1 4.25Å; F127-I234 HydrophobicContact CE1-CD1 4.5Å; F127-I234 HydrophobicContact CG-CD1 3.67Å; W130-I234 HydrophobicContact CD2-CD1 4.34Å; W130-I234 HydrophobicContact CD2-CG1 4.24Å; W130-I234 HydrophobicContact CE3-CD1 3.74Å; W130-I234 HydrophobicContact CE3-CG1 3.73Å; W130-I234 HydrophobicContact CH2-CG1 3.89Å; W130-I234 HydrophobicContact CZ2-CG1 4.34Å; W130-I234 HydrophobicContact CZ3-CD1 4Å; W130-I234 HydrophobicContact CZ3-CG1 3.57Å; L230-I234 WeakPolarHBondContact O-CB 3.38Å; L230-I234 WeakPolarHBondContact O-CG1 3.19Å; L230-I234 PolarHBondContact O-N 2.83Å; W231-I234 PolarHBondContact O-N 3.33Å; Q232-I234 VanDerWaalsContact C-N 3.35Å; Q232-I234 PolarHBondContact O-N 3.31Å; I234-I236 PolarHBondContact O-N 3.44Å; I234-G237 PolarHBondContact O-N 3.06Å; I234-G237 VanDerWaalsContact O-N 3.1Å; I234-L238 HydrophobicContact CG2-CD1 3.65Å; I234-L238 HydrophobicContact CG2-CG 4.22Å; I234-L238 WeakPolarHBondContact O-CG 3.27Å; I234-L238 PolarHBondContact O-N 3.4Å; I234-F349 HydrophobicContact CG2-CE1 3.86Å; I234-F349 HydrophobicContact CG2-CZ 4.23Å
235	K	94.1	Very high	91.6	Very high	68 Å²	68	25.2 Å²	25.2	30%	0.296	13%	0.129	S	C	.	.	H	α-helix	trans	-56.4	-47.5	179.3	-175.5	-177.5	177.2	-177.6	0	111.4	W231 Q232 G237 L238 L239 E269	W231-K235 HydrophobicContact CD2-CB 4.42Å; W231-K235 HydrophobicContact CH2-CB 4.29Å; W231-K235 HydrophobicContact CH2-CG 4.47Å; W231-K235 HydrophobicContact CZ2-CB 4.08Å; W231-K235 HydrophobicContact CZ2-CD 3.95Å; W231-K235 HydrophobicContact CZ2-CG 4.11Å; W231-K235 VanDerWaalsContact O-CB 3.23Å; W231-K235 WeakPolarHBondContact O-CB 3.31Å; W231-K235 PolarHBondContact O-N 2.87Å; Q232-K235 PolarHBondContact O-N 2.91Å; K235-G237 VanDerWaalsContact C-N 3.34Å; K235-G237 PolarHBondContact O-N 3.15Å; K235-L238 PolarHBondContact O-N 3.07Å; K235-L239 HydrophobicContact CD-CD1 4.17Å; K235-L239 HydrophobicContact CG-CD1 3.6Å; K235-L239 HydrophobicContact CG-CG 4.2Å; K235-L239 WeakPolarHBondContact O-CB 3.41Å; K235-L239 WeakPolarHBondContact O-CG 3.46Å; K235-L239 PolarHBondContact O-N 2.64Å; K235-E269 WeakPolarHBondContact CE-OE1 3.39Å; K235-E269 IonicContact NZ-OE1 2.68Å; K235-E269 PolarHBondContact NZ-OE1 3.02Å
236	I	92.7	Very high	91.2	Very high	43 Å²	43	26.5 Å²	26.5	22%	0.221	14%	0.144	C	C	.	.	H	α-helix	trans	-61.3	-43.4	176.7	-69	170.3	0	0	0	110.8	I172 I206 Q232 I234 L238 K240	I172-I236 HydrophobicContact CD1-CG2 3.97Å; I172-I236 HydrophobicContact CG1-CG2 4.42Å; I206-I236 HydrophobicContact CD1-CG2 4.45Å; I206-I236 HydrophobicContact CG1-CD1 4.47Å; Q232-I236 WeakPolarHBondContact O-CG1 3.18Å; Q232-I236 PolarHBondContact O-N 3.41Å; I234-I236 PolarHBondContact O-N 3.44Å; I236-L238 VanDerWaalsContact C-N 3.32Å; I236-L238 PolarHBondContact O-N 2.99Å; I236-K240 WeakPolarHBondContact O-CB 3.07Å; I236-K240 PolarHBondContact O-N 2.88Å; I236-K240 VanDerWaalsContact O-N 3.13Å
237	G	91.8	Very high	90.8	Very high	2 Å²	2	27.6 Å²	27.6	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-62.7	-35.6	176.9	0	0	0	0	0	114.2	I233 I234 K235	I233-G237 PolarHBondContact O-N 2.7Å; I233-G237 VanDerWaalsContact O-N 3.11Å; I234-G237 PolarHBondContact O-N 3.06Å; I234-G237 VanDerWaalsContact O-N 3.1Å; K235-G237 VanDerWaalsContact C-N 3.34Å; K235-G237 PolarHBondContact O-N 3.15Å
238	L	92.4	Very high	90.4	Very high	8 Å²	8	28 Å²	28	4%	0.042	15%	0.153	C	C	.	.	H	α-helix	trans	-81.6	-35.1	-179.4	-69.6	174	0	0	0	114	I234 K235 I236 F349 A365 A368 H372	I234-L238 HydrophobicContact CG2-CD1 3.65Å; I234-L238 HydrophobicContact CG2-CG 4.22Å; I234-L238 WeakPolarHBondContact O-CG 3.27Å; I234-L238 PolarHBondContact O-N 3.4Å; K235-L238 PolarHBondContact O-N 3.07Å; I236-L238 VanDerWaalsContact C-N 3.32Å; I236-L238 PolarHBondContact O-N 2.99Å; L238-F349 HydrophobicContact CD1-CE1 4.21Å; L238-F349 HydrophobicContact CD1-CE2 3.96Å; L238-F349 HydrophobicContact CD1-CZ 3.52Å; L238-F349 HydrophobicContact CD2-CE2 4.13Å; L238-F349 HydrophobicContact CD2-CZ 3.95Å; L238-F349 HydrophobicContact CG-CZ 4.24Å; L238-A365 HydrophobicContact CD1-CB 3.59Å; L238-A368 HydrophobicContact CB-CB 4.13Å; L238-H372 PolarHBondContact O-CE1 3.31Å; L238-H372 PolarHBondContact O-NE2 2.91Å
239	L	92.9	Very high	90.2	Very high	12 Å²	12	28.7 Å²	28.7	6%	0.063	15%	0.15	C	C	.	.	H	α-helix	trans	-96.9	-22.4	-171.7	-62.4	-174.5	0	0	0	113.4	K235 Q241 I242 P268 E269 L272 L364 A368	K235-L239 HydrophobicContact CD-CD1 4.17Å; K235-L239 HydrophobicContact CG-CD1 3.6Å; K235-L239 HydrophobicContact CG-CG 4.2Å; K235-L239 WeakPolarHBondContact O-CB 3.41Å; K235-L239 WeakPolarHBondContact O-CG 3.46Å; K235-L239 PolarHBondContact O-N 2.64Å; L239-Q241 PolarHBondContact O-N 3.24Å; L239-Q241 VanDerWaalsContact O-N 3.1Å; L239-I242 HydrophobicContact CD2-CD1 4.03Å; L239-I242 PolarHBondContact O-N 2.85Å; L239-P268 HydrophobicContact CB-CB 3.71Å; L239-P268 HydrophobicContact CB-CG 4.01Å; L239-P268 HydrophobicContact CD1-CB 4.24Å; L239-P268 HydrophobicContact CD2-CB 4.09Å; L239-P268 HydrophobicContact CG-CB 4.22Å; L239-E269 HydrophobicContact CD1-CG 4.35Å; L239-L272 HydrophobicContact CD2-CD1 4Å; L239-L364 HydrophobicContact CD1-CD2 4.41Å; L239-L364 HydrophobicContact CD2-CD1 4.22Å; L239-A368 HydrophobicContact CD2-CB 4.2Å
240	K	86.9	Confident	89.9	Confident	87 Å²	87	28.6 Å²	28.6	38%	0.378	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.8	-178.4	169.7	-175.7	166.6	-156.9	0	114.9	I172 I236 N243	I172-K240 HydrophobicContact CD1-CD 3.77Å; I172-K240 HydrophobicContact CG1-CD 3.92Å; I236-K240 WeakPolarHBondContact O-CB 3.07Å; I236-K240 PolarHBondContact O-N 2.88Å; I236-K240 VanDerWaalsContact O-N 3.13Å; K240-N243 PolarHBondContact O-ND2 3.15Å
241	Q	85.2	Confident	89.5	Confident	44 Å²	44	28.7 Å²	28.7	21%	0.206	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-8.6	178.5	-66	-176	19.8	0	0	112.9	L239 N243 A246 H247 A958	L239-Q241 PolarHBondContact O-N 3.24Å; L239-Q241 VanDerWaalsContact O-N 3.1Å; Q241-N243 VanDerWaalsContact C-N 3.35Å; Q241-N243 PolarHBondContact O-N 3.03Å; Q241-A246 WeakPolarHBondContact O-CB 3.41Å; Q241-H247 PolarHBondContact O-CD2 3.04Å; Q241-H247 VanDerWaalsContact O-CD2 3.27Å; Q241-A958 VanDerWaalsContact OE1-CB 3.3Å
242	I	90.8	Very high	89.1	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.005	15%	0.153	C	C	.	.			trans	-89.6	75.4	-176.2	-49	-175.2	0	0	0	109.3	L239 P268 I271 L272 A368 F371	L239-I242 HydrophobicContact CD2-CD1 4.03Å; L239-I242 PolarHBondContact O-N 2.85Å; I242-P268 HydrophobicContact CB-CB 4.26Å; I242-I271 HydrophobicContact CG2-CB 4.39Å; I242-I271 HydrophobicContact CG2-CG2 3.84Å; I242-L272 HydrophobicContact CD1-CD1 3.86Å; I242-L272 HydrophobicContact CD1-CD2 3.98Å; I242-L272 HydrophobicContact CD1-CG 3.97Å; I242-L272 HydrophobicContact CG2-CG 4.29Å; I242-A368 HydrophobicContact CD1-CB 3.91Å; I242-F371 HydrophobicContact CB-CE1 4.31Å; I242-F371 HydrophobicContact CD1-CD1 3.89Å; I242-F371 HydrophobicContact CD1-CG 4.5Å; I242-F371 HydrophobicContact CG1-CD1 3.79Å; I242-F371 HydrophobicContact CG1-CE1 3.95Å; I242-F371 HydrophobicContact CG2-CD1 4.22Å; I242-F371 HydrophobicContact CG2-CE1 3.97Å; I242-F371 HydrophobicContact CG2-CZ 4.34Å
243	N	88.1	Confident	88.9	Confident	56 Å²	56	26.2 Å²	26.2	30%	0.299	14%	0.142	S	C	.	.	S	Bend	trans	-154.1	163.7	176.3	63.8	69.6	0	0	0	111.1	K240 Q241 V245 A246 H247 L250	K240-N243 PolarHBondContact O-ND2 3.15Å; Q241-N243 VanDerWaalsContact C-N 3.35Å; Q241-N243 PolarHBondContact O-N 3.03Å; N243-V245 PolarHBondContact O-N 3.02Å; N243-V245 WeakPolarHBondContact OD1-CB 3.5Å; N243-V245 PolarHBondContact OD1-N 3.31Å; N243-A246 PolarHBondContact O-N 3.03Å; N243-A246 PolarHBondContact OD1-N 3.07Å; N243-H247 PolarHBondContact O-N 2.7Å; N243-L250 VanDerWaalsContact C-CD1 3.49Å
244	V	84.4	Confident	88.5	Confident	4 Å²	4	29 Å²	29	2%	0.024	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.3	-175	-64.3	0	0	0	0	114.5	H247 A248 L250 I260 F263 A264 V387 I390	V244-H247 CarbonylContact O-C 3.59Å; V244-A248 WeakPolarHBondContact O-CA 3.43Å; V244-A248 PolarHBondContact O-N 3.47Å; V244-L250 HydrophobicContact CG1-CB 4.15Å; V244-I260 HydrophobicContact CB-CD1 4.17Å; V244-I260 HydrophobicContact CG1-CD1 3.78Å; V244-I260 HydrophobicContact CG2-CD1 4.49Å; V244-F263 HydrophobicContact CG1-CD1 3.42Å; V244-F263 VanDerWaalsContact CG1-CD1 3.42Å; V244-F263 HydrophobicContact CG1-CE1 3.67Å; V244-A264 HydrophobicContact CG2-CB 4.16Å; V244-V387 HydrophobicContact CB-CG2 4.39Å; V244-V387 VanDerWaalsContact O-CG1 3.25Å; V244-V387 WeakPolarHBondContact O-CG1 3.3Å; V244-I390 HydrophobicContact CG2-CD1 4.34Å; V244-I390 HydrophobicContact CG2-CG2 4.34Å
245	V	82.1	Confident	88.1	Confident	61 Å²	61	33.5 Å²	33.5	37%	0.37	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-35.6	179.7	-174.1	0	0	0	0	111.2	N243 V387 I390 E391	N243-V245 PolarHBondContact O-N 3.02Å; N243-V245 WeakPolarHBondContact OD1-CB 3.5Å; N243-V245 PolarHBondContact OD1-N 3.31Å; V245-V387 HydrophobicContact CB-CG1 4.41Å; V245-V387 HydrophobicContact CG2-CG1 4.35Å; V245-I390 HydrophobicContact CG2-CB 4.26Å; V245-I390 HydrophobicContact CG2-CG2 4.07Å; V245-E391 HydrophobicContact CG1-CG 4.48Å
246	A	83.8	Confident	87.7	Confident	55 Å²	55	34.4 Å²	34.4	46%	0.455	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-36	172.4	0	0	0	0	0	112.9	Q241 N243	Q241-A246 WeakPolarHBondContact O-CB 3.41Å; N243-A246 PolarHBondContact O-N 3.03Å; N243-A246 PolarHBondContact OD1-N 3.07Å
247	H	85.8	Confident	87.3	Confident	23 Å²	23	41.8 Å²	41.8	11%	0.106	24%	0.24	C	C	.	.			trans	-129.9	85.1	-176.9	-70.1	-82.4	0	0	0	111.1	Q241 N243 V244 E249 L250 F371	Q241-H247 PolarHBondContact O-CD2 3.04Å; Q241-H247 VanDerWaalsContact O-CD2 3.27Å; N243-H247 PolarHBondContact O-N 2.7Å; V244-H247 CarbonylContact O-C 3.59Å; H247-E249 WeakPolarHBondContact CA-OE2 3.44Å; H247-E249 HydrophobicContact CB-CG 4.36Å; H247-E249 IonicContact CE1-OE1 3.61Å; H247-E249 IonicContact CG-OE1 2.74Å; H247-E249 IonicContact ND1-OE1 2.61Å; H247-E249 PolarHBondContact ND1-OE1 3.32Å; H247-E249 PolarHBondContact O-N 2.71Å; H247-E249 VanDerWaalsContact O-N 3.16Å; H247-L250 HydrophobicContact CB-CD1 3.75Å; H247-L250 HydrophobicContact CB-CG 3.78Å; H247-L250 VanDerWaalsContact O-CB 3.26Å; H247-L250 WeakPolarHBondContact O-CB 3.34Å; H247-L250 WeakPolarHBondContact O-CG 3.22Å; H247-L250 PolarHBondContact O-N 2.89Å; H247-F371 HydrophobicContact CB-CZ 4.41Å; H247-F371 AromaticContact CD2-CE1 3.69Å; H247-F371 AromaticContact CD2-CZ 3.91Å; H247-F371 AromaticContact CG-CZ 3.98Å; H247-F371 AromaticContact NE2-CE1 3.67Å
248	A	84.7	Confident	87	Confident	14 Å²	14	43.7 Å²	43.7	12%	0.116	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-61.8	-22.1	178.4	0	0	0	0	0	113.2	V244 L250 A251	V244-A248 WeakPolarHBondContact O-CA 3.43Å; V244-A248 PolarHBondContact O-N 3.47Å; A248-L250 PolarHBondContact O-N 3.26Å; A248-A251 WeakPolarHBondContact O-CB 3.39Å; A248-A251 PolarHBondContact O-N 3.37Å
249	E	87.2	Confident	86.7	Confident	39 Å²	39	46.5 Å²	46.5	18%	0.182	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-62.9	-20	171.8	63.1	-89.1	-154	0	0	114	H247 A251 T252 L377 K379	H247-E249 WeakPolarHBondContact CA-OE2 3.44Å; H247-E249 HydrophobicContact CB-CG 4.36Å; H247-E249 IonicContact CE1-OE1 3.61Å; H247-E249 IonicContact CG-OE1 2.74Å; H247-E249 IonicContact ND1-OE1 2.61Å; H247-E249 PolarHBondContact ND1-OE1 3.32Å; H247-E249 PolarHBondContact O-N 2.71Å; H247-E249 VanDerWaalsContact O-N 3.16Å; E249-A251 PolarHBondContact O-N 3.31Å; E249-A251 VanDerWaalsContact O-N 3.13Å; E249-T252 PolarHBondContact O-N 2.88Å; E249-T252 VanDerWaalsContact O-N 3.16Å; E249-T252 PolarHBondContact O-OG1 2.83Å; E249-L377 HydrophobicContact CB-CB 3.92Å; E249-L377 HydrophobicContact CG-CB 3.99Å; E249-L377 HydrophobicContact CG-CD1 4.47Å; E249-K379 HydrophobicContact CB-CB 4.46Å
250	L	89.7	Confident	86.3	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-61.1	-18.1	173.5	-71.3	171.3	0	0	0	113.3	N243 V244 H247 A248 T252 L253 F263 I271 F371 L377	N243-L250 VanDerWaalsContact C-CD1 3.49Å; V244-L250 HydrophobicContact CG1-CB 4.15Å; H247-L250 HydrophobicContact CB-CD1 3.75Å; H247-L250 HydrophobicContact CB-CG 3.78Å; H247-L250 VanDerWaalsContact O-CB 3.26Å; H247-L250 WeakPolarHBondContact O-CB 3.34Å; H247-L250 WeakPolarHBondContact O-CG 3.22Å; H247-L250 PolarHBondContact O-N 2.89Å; A248-L250 PolarHBondContact O-N 3.26Å; L250-T252 PolarHBondContact O-N 3.37Å; L250-T252 VanDerWaalsContact O-N 3.12Å; L250-L253 HydrophobicContact CD2-CD1 3.57Å; L250-L253 VanDerWaalsContact O-CB 3.23Å; L250-L253 WeakPolarHBondContact O-CB 3.31Å; L250-L253 WeakPolarHBondContact O-CG 3.2Å; L250-L253 PolarHBondContact O-N 3.46Å; L250-F263 HydrophobicContact CB-CE1 4.13Å; L250-F263 HydrophobicContact CB-CZ 4.39Å; L250-I271 HydrophobicContact CD1-CG2 3.94Å; L250-I271 HydrophobicContact CD2-CG2 3.8Å; L250-I271 HydrophobicContact CG-CG2 4.48Å; L250-F371 HydrophobicContact CD1-CZ 4.43Å; L250-F371 HydrophobicContact CD2-CE2 3.78Å; L250-F371 HydrophobicContact CD2-CZ 3.84Å; L250-F371 HydrophobicContact CG-CZ 4.34Å; L250-L377 HydrophobicContact CD2-CD1 4Å
251	A	86.3	Confident	86.1	Confident	3 Å²	3	46.3 Å²	46.3	3%	0.025	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-62.1	-16.2	174.5	0	0	0	0	0	113.9	A248 E249 L253 L254 I260 V383	A248-A251 WeakPolarHBondContact O-CB 3.39Å; A248-A251 PolarHBondContact O-N 3.37Å; E249-A251 PolarHBondContact O-N 3.31Å; E249-A251 VanDerWaalsContact O-N 3.13Å; A251-L253 PolarHBondContact O-N 2.86Å; A251-L254 HydrophobicContact CB-CD1 4.42Å; A251-L254 WeakPolarHBondContact O-CD1 3.48Å; A251-L254 WeakPolarHBondContact O-CG 3.38Å; A251-L254 PolarHBondContact O-N 3.07Å; A251-I260 HydrophobicContact CB-CD1 3.97Å; A251-V383 HydrophobicContact CB-CB 4.35Å; A251-V383 HydrophobicContact CB-CG1 3.69Å; A251-V383 HydrophobicContact CB-CG2 4.05Å
252	T	87.4	Confident	86.1	Confident	26 Å²	26	47 Å²	47	16%	0.16	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-67.8	-9.4	168.5	55.9	0	0	0	0	114.1	E249 L250 E378 Q380	E249-T252 PolarHBondContact O-N 2.88Å; E249-T252 VanDerWaalsContact O-N 3.16Å; E249-T252 PolarHBondContact O-OG1 2.83Å; L250-T252 PolarHBondContact O-N 3.37Å; L250-T252 VanDerWaalsContact O-N 3.12Å; T252-E378 WeakPolarHBondContact CG2-O 3.48Å; T252-Q380 HydrophobicContact CG2-CG 4.05Å
253	L	89.7	Confident	86	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.021	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-98.6	7.3	178.7	-50.6	179.6	0	0	0	113.6	L250 A251 F263 R274 W275 Y278 L377	L250-L253 HydrophobicContact CD2-CD1 3.57Å; L250-L253 VanDerWaalsContact O-CB 3.23Å; L250-L253 WeakPolarHBondContact O-CB 3.31Å; L250-L253 WeakPolarHBondContact O-CG 3.2Å; L250-L253 PolarHBondContact O-N 3.46Å; A251-L253 PolarHBondContact O-N 2.86Å; L253-F263 HydrophobicContact CB-CE2 3.64Å; L253-F263 HydrophobicContact CB-CZ 3.83Å; L253-F263 HydrophobicContact CD1-CZ 4.21Å; L253-F263 WeakPolarHBondContact O-CE2 3.48Å; L253-R274 HydrophobicContact CB-CB 4.48Å; L253-R274 PolarHBondContact O-NH1 3.28Å; L253-W275 HydrophobicContact CD1-CB 3.85Å; L253-Y278 VanDerWaalsContact CD2-CB 3.41Å; L253-Y278 HydrophobicContact CD2-CD1 4.23Å; L253-Y278 HydrophobicContact CD2-CD2 3.65Å; L253-Y278 HydrophobicContact CD2-CE2 4.46Å; L253-Y278 HydrophobicContact CD2-CG 3.51Å; L253-L377 HydrophobicContact CD1-CD1 4.09Å; L253-L377 HydrophobicContact CD2-CD1 4.19Å; L253-L377 HydrophobicContact CD2-CD2 4.07Å; L253-L377 HydrophobicContact CG-CD1 4.02Å
254	L	87.7	Confident	85.8	Confident	58 Å²	58	45.2 Å²	45.2	30%	0.304	27%	0.268	S	S	.	.			trans	-63.5	136.6	171.5	-71.8	169.5	0	0	0	110.6	A251 E258 F263	A251-L254 HydrophobicContact CB-CD1 4.42Å; A251-L254 WeakPolarHBondContact O-CD1 3.48Å; A251-L254 WeakPolarHBondContact O-CG 3.38Å; A251-L254 PolarHBondContact O-N 3.07Å; L254-E258 WeakPolarHBondContact CA-OE2 3.44Å; L254-E258 HydrophobicContact CD2-CB 4.41Å; L254-E258 HydrophobicContact CD2-CG 4Å; L254-F263 HydrophobicContact CD2-CB 3.6Å; L254-F263 HydrophobicContact CD2-CD2 3.99Å; L254-F263 HydrophobicContact CD2-CG 4.06Å
255	E	86.6	Confident	85.9	Confident	96 Å²	96	48 Å²	48	45%	0.449	28%	0.279	S	S	.	.			trans	-118.3	120.8	-177.2	-57.7	-151.1	128.2	0	0	112.8	E257 E258 K281	E255-E257 PolarHBondContact O-N 3.26Å; E255-E258 PolarHBondContact N-OE2 3.49Å; E255-E258 VanDerWaalsContact O-CB 3.27Å; E255-E258 WeakPolarHBondContact O-CB 3.49Å; E255-E258 PolarHBondContact O-N 3.3Å; E255-K281 IonicContact OE1-NZ 3.37Å; E255-K281 PolarHBondContact OE1-NZ 3.1Å
256	G	85.6	Confident	86.2	Confident	87 Å²	87	46.5 Å²	46.5	90%	0.897	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	-119.2	176.9	0	0	0	0	0	113.4
257	E	83.6	Confident	86.5	Confident	197 Å²	197	44.6 Å²	44.6	92%	0.921	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	9.6	-179.9	-60.3	-175.4	166.3	0	0	112.6	E255	E255-E257 PolarHBondContact O-N 3.26Å
258	E	87.5	Confident	86.8	Confident	43 Å²	43	44.6 Å²	44.6	20%	0.201	25%	0.254	C	S	.	.			trans	-59.3	137.2	179.9	-177.1	-176.1	-131.4	0	0	112.8	L254 E255 D262 R274	L254-E258 WeakPolarHBondContact CA-OE2 3.44Å; L254-E258 HydrophobicContact CD2-CB 4.41Å; L254-E258 HydrophobicContact CD2-CG 4Å; E255-E258 PolarHBondContact N-OE2 3.49Å; E255-E258 VanDerWaalsContact O-CB 3.27Å; E255-E258 WeakPolarHBondContact O-CB 3.49Å; E255-E258 PolarHBondContact O-N 3.3Å; E258-D262 HydrophobicContact CG-CB 3.83Å; E258-R274 VanDerWaalsContact CD-NH1 3.26Å; E258-R274 IonicContact OE1-CZ 2.61Å; E258-R274 VanDerWaalsContact OE1-CZ 3.29Å; E258-R274 IonicContact OE1-NH1 2.68Å; E258-R274 PolarHBondContact OE1-NH1 3.43Å; E258-R274 IonicContact OE1-NH2 2.73Å; E258-R274 PolarHBondContact OE1-NH2 3.32Å; E258-R274 IonicContact OE2-CZ 3.7Å; E258-R274 IonicContact OE2-NH1 3.51Å; E258-R274 PolarHBondContact OE2-NH1 3.28Å; E258-R274 IonicContact OE2-NH2 2.78Å
259	T	85.7	Confident	87.3	Confident	66 Å²	66	45.3 Å²	45.3	41%	0.405	26%	0.256	S	S	.	.			trans	-91.4	158.7	175.5	80.5	0	0	0	0	112.2	N261 D262 F263	T259-N261 PolarHBondContact O-N 3.26Å; T259-N261 VanDerWaalsContact O-N 3.13Å; T259-N261 PolarHBondContact OG1-N 2.86Å; T259-D262 VanDerWaalsContact CB-OD2 3.3Å; T259-D262 WeakPolarHBondContact CB-OD2 3.44Å; T259-D262 WeakPolarHBondContact CG2-OD2 3.29Å; T259-D262 PolarHBondContact N-OD2 3.27Å; T259-D262 VanDerWaalsContact N-OD2 3.12Å; T259-D262 WeakPolarHBondContact O-CA 3.48Å; T259-D262 WeakPolarHBondContact O-CB 3.25Å; T259-D262 PolarHBondContact O-N 3.36Å; T259-D262 PolarHBondContact OG1-N 3.41Å; T259-D262 PolarHBondContact OG1-OD2 3.46Å; T259-F263 PolarHBondContact O-N 2.88Å
260	I	84.4	Confident	87.5	Confident	17 Å²	17	47.7 Å²	47.7	9%	0.087	27%	0.267	C	S	.	.	H	α-helix	trans	-56.9	-27.1	172.4	-167.2	65.5	0	0	0	112.9	V244 A251 A264 V383 K386 V387 I390	V244-I260 HydrophobicContact CB-CD1 4.17Å; V244-I260 HydrophobicContact CG1-CD1 3.78Å; V244-I260 HydrophobicContact CG2-CD1 4.49Å; A251-I260 HydrophobicContact CB-CD1 3.97Å; I260-A264 VanDerWaalsContact O-CB 3.28Å; I260-A264 WeakPolarHBondContact O-CB 3.42Å; I260-A264 PolarHBondContact O-N 2.92Å; I260-V383 HydrophobicContact CD1-CG1 4.33Å; I260-V383 HydrophobicContact CG1-CG1 4.48Å; I260-K386 HydrophobicContact CG2-CB 4.12Å; I260-K386 HydrophobicContact CG2-CD 4.48Å; I260-V387 HydrophobicContact CD1-CG2 4.45Å; I260-V387 HydrophobicContact CG1-CG2 4.19Å; I260-I390 HydrophobicContact CG1-CD1 3.9Å; I260-I390 HydrophobicContact CG2-CD1 4.16Å
261	N	82.8	Confident	87.7	Confident	79 Å²	79	48 Å²	48	42%	0.422	27%	0.268	S	S	.	.	H	α-helix	trans	-76.7	-22.8	174.7	-73.3	-29.8	0	0	0	113.1	T259 K265 I390	T259-N261 PolarHBondContact O-N 3.26Å; T259-N261 VanDerWaalsContact O-N 3.13Å; T259-N261 PolarHBondContact OG1-N 2.86Å; N261-K265 VanDerWaalsContact O-CE 3.26Å; N261-K265 WeakPolarHBondContact O-CE 3.1Å; N261-K265 WeakPolarHBondContact O-CG 3.49Å; N261-I390 WeakPolarHBondContact OD1-CD1 3.48Å; N261-I390 WeakPolarHBondContact OD1-CG1 3.2Å
262	D	85	Confident	88.2	Confident	57 Å²	57	47.9 Å²	47.9	31%	0.305	27%	0.267	S	S	.	.	H	α-helix	trans	-80.8	-45.3	173	-58.5	-57.9	0	0	0	110.3	E258 T259 A264 K265	E258-D262 HydrophobicContact CG-CB 3.83Å; T259-D262 VanDerWaalsContact CB-OD2 3.3Å; T259-D262 WeakPolarHBondContact CB-OD2 3.44Å; T259-D262 WeakPolarHBondContact CG2-OD2 3.29Å; T259-D262 PolarHBondContact N-OD2 3.27Å; T259-D262 VanDerWaalsContact N-OD2 3.12Å; T259-D262 WeakPolarHBondContact O-CA 3.48Å; T259-D262 WeakPolarHBondContact O-CB 3.25Å; T259-D262 PolarHBondContact O-N 3.36Å; T259-D262 PolarHBondContact OG1-N 3.41Å; T259-D262 PolarHBondContact OG1-OD2 3.46Å; D262-A264 PolarHBondContact O-N 2.97Å; D262-K265 WeakPolarHBondContact O-CB 3.31Å; D262-K265 PolarHBondContact O-N 3.32Å; D262-K265 IonicContact OD1-NZ 2.79Å; D262-K265 PolarHBondContact OD1-NZ 3.5Å
263	F	87.3	Confident	88.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.6	-34.6	172.9	-167.3	-79.8	0	0	0	112.7	V244 L250 L253 L254 T259 K265 L266 I271	V244-F263 HydrophobicContact CG1-CD1 3.42Å; V244-F263 VanDerWaalsContact CG1-CD1 3.42Å; V244-F263 HydrophobicContact CG1-CE1 3.67Å; L250-F263 HydrophobicContact CB-CE1 4.13Å; L250-F263 HydrophobicContact CB-CZ 4.39Å; L253-F263 HydrophobicContact CB-CE2 3.64Å; L253-F263 HydrophobicContact CB-CZ 3.83Å; L253-F263 HydrophobicContact CD1-CZ 4.21Å; L253-F263 WeakPolarHBondContact O-CE2 3.48Å; L254-F263 HydrophobicContact CD2-CB 3.6Å; L254-F263 HydrophobicContact CD2-CD2 3.99Å; L254-F263 HydrophobicContact CD2-CG 4.06Å; T259-F263 PolarHBondContact O-N 2.88Å; F263-K265 PolarHBondContact O-N 3Å; F263-L266 HydrophobicContact CB-CD1 4.39Å; F263-L266 HydrophobicContact CD1-CD1 4.36Å; F263-L266 HydrophobicContact CD2-CD1 3.7Å; F263-L266 HydrophobicContact CE2-CD1 3.98Å; F263-L266 HydrophobicContact CG-CD1 3.91Å; F263-L266 HydrophobicContact CZ-CD1 4.43Å; F263-L266 WeakPolarHBondContact O-CB 3.39Å; F263-L266 VanDerWaalsContact O-CG 3.31Å; F263-L266 WeakPolarHBondContact O-CG 3.47Å; F263-L266 PolarHBondContact O-N 3.26Å; F263-I271 HydrophobicContact CE1-CD1 4Å; F263-I271 HydrophobicContact CE1-CG1 3.83Å; F263-I271 HydrophobicContact CE1-CG2 4.24Å; F263-I271 HydrophobicContact CZ-CG1 4.03Å; F263-I271 HydrophobicContact CZ-CG2 4.14Å
264	A	85.2	Confident	88.8	Confident	21 Å²	21	50.2 Å²	50.2	17%	0.174	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-10.8	176.2	0	0	0	0	0	115	V244 I260 D262 I390	V244-A264 HydrophobicContact CG2-CB 4.16Å; I260-A264 VanDerWaalsContact O-CB 3.28Å; I260-A264 WeakPolarHBondContact O-CB 3.42Å; I260-A264 PolarHBondContact O-N 2.92Å; D262-A264 PolarHBondContact O-N 2.97Å; A264-I390 HydrophobicContact CB-CD1 4.2Å; A264-I390 HydrophobicContact CB-CG2 3.69Å
265	K	86.4	Confident	89.1	Confident	61 Å²	61	47.5 Å²	47.5	27%	0.265	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-20.5	173.7	-58.8	160.9	-170.9	166.3	0	112.5	N261 D262 F263 Y414 Y417	N261-K265 VanDerWaalsContact O-CE 3.26Å; N261-K265 WeakPolarHBondContact O-CE 3.1Å; N261-K265 WeakPolarHBondContact O-CG 3.49Å; D262-K265 WeakPolarHBondContact O-CB 3.31Å; D262-K265 PolarHBondContact O-N 3.32Å; D262-K265 IonicContact OD1-NZ 2.79Å; D262-K265 PolarHBondContact OD1-NZ 3.5Å; F263-K265 PolarHBondContact O-N 3Å; K265-Y414 HydrophobicContact CB-CD1 4.49Å; K265-Y414 HydrophobicContact CG-CD1 3.91Å; K265-Y414 HydrophobicContact CG-CE1 4.1Å; K265-Y417 HydrophobicContact CB-CD1 4.15Å; K265-Y417 HydrophobicContact CB-CG 4.23Å; K265-Y417 HydrophobicContact CD-CD2 3.97Å; K265-Y417 HydrophobicContact CD-CE2 4.44Å; K265-Y417 HydrophobicContact CD-CG 4.11Å; K265-Y417 HydrophobicContact CG-CG 4.24Å
266	L	88.5	Confident	89.6	Confident	30 Å²	30	42.9 Å²	42.9	16%	0.157	24%	0.239	C	C	.	.	S	Bend	trans	-63.6	147	-174.8	-60	172.9	0	0	0	111.5	F263 E270 I271	F263-L266 HydrophobicContact CB-CD1 4.39Å; F263-L266 HydrophobicContact CD1-CD1 4.36Å; F263-L266 HydrophobicContact CD2-CD1 3.7Å; F263-L266 HydrophobicContact CE2-CD1 3.98Å; F263-L266 HydrophobicContact CG-CD1 3.91Å; F263-L266 HydrophobicContact CZ-CD1 4.43Å; F263-L266 WeakPolarHBondContact O-CB 3.39Å; F263-L266 VanDerWaalsContact O-CG 3.31Å; F263-L266 WeakPolarHBondContact O-CG 3.47Å; F263-L266 PolarHBondContact O-N 3.26Å; L266-E270 HydrophobicContact CB-CB 4.24Å; L266-E270 HydrophobicContact CD2-CB 4.47Å; L266-I271 HydrophobicContact CB-CD1 4.32Å; L266-I271 HydrophobicContact CB-CG1 3.9Å; L266-I271 HydrophobicContact CD1-CG1 4.33Å
267	S	90	Very high	90	Very high	16 Å²	16	40 Å²	40	11%	0.112	20%	0.203	C	C	.	.			trans	-65	150.9	167.9	63.8	0	0	0	0	111.4	E269 E270 I271	S267-E269 PolarHBondContact O-N 3.37Å; S267-E269 VanDerWaalsContact O-N 3.14Å; S267-E270 VanDerWaalsContact CB-OE2 3.28Å; S267-E270 WeakPolarHBondContact CB-OE2 3.23Å; S267-E270 PolarHBondContact N-OE2 2.92Å; S267-E270 PolarHBondContact O-N 3.23Å; S267-E270 VanDerWaalsContact OG-CG 3.29Å; S267-E270 WeakPolarHBondContact OG-CG 3.5Å; S267-E270 PolarHBondContact OG-N 3Å; S267-E270 VanDerWaalsContact OG-N 3.14Å; S267-E270 PolarHBondContact OG-OE2 3.29Å; S267-I271 WeakPolarHBondContact O-CG1 3.4Å; S267-I271 PolarHBondContact O-N 3.41Å
268	P	92.3	Very high	90.5	Very high	22 Å²	22	34.5 Å²	34.5	14%	0.143	17%	0.174	C	C	.	.	H	α-helix	trans	-52.7	-31.3	169.9	-30	38.7	0	0	0	113.6	L239 I242 L272	L239-P268 HydrophobicContact CB-CB 3.71Å; L239-P268 HydrophobicContact CB-CG 4.01Å; L239-P268 HydrophobicContact CD1-CB 4.24Å; L239-P268 HydrophobicContact CD2-CB 4.09Å; L239-P268 HydrophobicContact CG-CB 4.22Å; I242-P268 HydrophobicContact CB-CB 4.26Å; P268-L272 WeakPolarHBondContact O-CB 3.31Å; P268-L272 WeakPolarHBondContact O-CG 3.4Å; P268-L272 PolarHBondContact O-N 2.94Å
269	E	93.7	Very high	90.8	Very high	30 Å²	30	33.3 Å²	33.3	14%	0.14	17%	0.169	C	C	.	.	H	α-helix	trans	-64.1	-47.9	173.4	-69.2	92.7	144.8	0	0	112.9	K235 L239 S267 I271 L272 I273 F292 L364	K235-E269 WeakPolarHBondContact CE-OE1 3.39Å; K235-E269 IonicContact NZ-OE1 2.68Å; K235-E269 PolarHBondContact NZ-OE1 3.02Å; L239-E269 HydrophobicContact CD1-CG 4.35Å; S267-E269 PolarHBondContact O-N 3.37Å; S267-E269 VanDerWaalsContact O-N 3.14Å; E269-I271 VanDerWaalsContact C-N 3.34Å; E269-L272 WeakPolarHBondContact O-CB 3.13Å; E269-L272 PolarHBondContact O-N 3Å; E269-I273 WeakPolarHBondContact O-CG1 3.36Å; E269-I273 PolarHBondContact O-N 3.27Å; E269-F292 HydrophobicContact CB-CE2 3.94Å; E269-F292 HydrophobicContact CB-CZ 3.91Å; E269-F292 HydrophobicContact CG-CE2 4.18Å; E269-F292 HydrophobicContact CG-CZ 4.25Å; E269-L364 HydrophobicContact CG-CD1 3.98Å; E269-L364 HydrophobicContact CG-CD2 4.09Å
270	E	92.8	Very high	91.2	Very high	89 Å²	89	30.2 Å²	30.2	42%	0.416	15%	0.15	S	C	.	.	H	α-helix	trans	-65	-39.1	175.5	-71.6	161	109.6	0	0	111.7	L266 S267 L272 I273 R274	L266-E270 HydrophobicContact CB-CB 4.24Å; L266-E270 HydrophobicContact CD2-CB 4.47Å; S267-E270 VanDerWaalsContact CB-OE2 3.28Å; S267-E270 WeakPolarHBondContact CB-OE2 3.23Å; S267-E270 PolarHBondContact N-OE2 2.92Å; S267-E270 PolarHBondContact O-N 3.23Å; S267-E270 VanDerWaalsContact OG-CG 3.29Å; S267-E270 WeakPolarHBondContact OG-CG 3.5Å; S267-E270 PolarHBondContact OG-N 3Å; S267-E270 VanDerWaalsContact OG-N 3.14Å; S267-E270 PolarHBondContact OG-OE2 3.29Å; E270-L272 VanDerWaalsContact C-N 3.33Å; E270-L272 PolarHBondContact O-N 2.89Å; E270-I273 PolarHBondContact O-N 3.23Å; E270-R274 WeakPolarHBondContact O-CG 3.42Å; E270-R274 PolarHBondContact O-N 2.89Å
271	I	93.8	Very high	91.4	Very high	5 Å²	5	34.3 Å²	34.3	3%	0.026	17%	0.167	C	C	.	.	H	α-helix	trans	-60.7	-43.5	174.4	-65.8	172.5	0	0	0	110.4	I242 L250 F263 L266 S267 E269 R274 W275	I242-I271 HydrophobicContact CG2-CB 4.39Å; I242-I271 HydrophobicContact CG2-CG2 3.84Å; L250-I271 HydrophobicContact CD1-CG2 3.94Å; L250-I271 HydrophobicContact CD2-CG2 3.8Å; L250-I271 HydrophobicContact CG-CG2 4.48Å; F263-I271 HydrophobicContact CE1-CD1 4Å; F263-I271 HydrophobicContact CE1-CG1 3.83Å; F263-I271 HydrophobicContact CE1-CG2 4.24Å; F263-I271 HydrophobicContact CZ-CG1 4.03Å; F263-I271 HydrophobicContact CZ-CG2 4.14Å; L266-I271 HydrophobicContact CB-CD1 4.32Å; L266-I271 HydrophobicContact CB-CG1 3.9Å; L266-I271 HydrophobicContact CD1-CG1 4.33Å; S267-I271 WeakPolarHBondContact O-CG1 3.4Å; S267-I271 PolarHBondContact O-N 3.41Å; E269-I271 VanDerWaalsContact C-N 3.34Å; I271-R274 PolarHBondContact O-N 3.02Å; I271-W275 WeakPolarHBondContact O-CB 3.43Å; I271-W275 PolarHBondContact O-N 2.87Å
272	L	95.4	Very high	91.3	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-63.6	-41.4	174.2	-84	175	0	0	0	112.8	L239 I242 P268 E269 E270 W275 V276 F292 L364 L367 A368 F371	L239-L272 HydrophobicContact CD2-CD1 4Å; I242-L272 HydrophobicContact CD1-CD1 3.86Å; I242-L272 HydrophobicContact CD1-CD2 3.98Å; I242-L272 HydrophobicContact CD1-CG 3.97Å; I242-L272 HydrophobicContact CG2-CG 4.29Å; P268-L272 WeakPolarHBondContact O-CB 3.31Å; P268-L272 WeakPolarHBondContact O-CG 3.4Å; P268-L272 PolarHBondContact O-N 2.94Å; E269-L272 WeakPolarHBondContact O-CB 3.13Å; E269-L272 PolarHBondContact O-N 3Å; E270-L272 VanDerWaalsContact C-N 3.33Å; E270-L272 PolarHBondContact O-N 2.89Å; L272-W275 HydrophobicContact CD2-CE3 4.02Å; L272-W275 HydrophobicContact CD2-CZ3 4.45Å; L272-W275 WeakPolarHBondContact O-CB 3.31Å; L272-W275 PolarHBondContact O-N 2.96Å; L272-V276 WeakPolarHBondContact O-CG2 3.32Å; L272-V276 PolarHBondContact O-N 3.49Å; L272-F292 HydrophobicContact CB-CE1 4.35Å; L272-F292 HydrophobicContact CB-CZ 4.49Å; L272-L364 HydrophobicContact CD1-CD1 3.77Å; L272-L367 HydrophobicContact CB-CD2 3.92Å; L272-L367 HydrophobicContact CD1-CD2 4.37Å; L272-L367 HydrophobicContact CD2-CD2 4.14Å; L272-L367 HydrophobicContact CD2-CG 4.22Å; L272-L367 HydrophobicContact CG-CD2 4.38Å; L272-A368 HydrophobicContact CD1-CB 4.17Å; L272-F371 HydrophobicContact CD2-CB 3.77Å; L272-F371 HydrophobicContact CD2-CD2 4.44Å; L272-F371 HydrophobicContact CD2-CG 4.08Å
273	I	95.4	Very high	91.4	Very high	32 Å²	32	32.2 Å²	32.2	16%	0.164	17%	0.173	C	C	.	.	H	α-helix	trans	-62.5	-45.6	176.2	-75.1	166	0	0	0	110.7	E269 E270 W275 V276 N277 M289 F292	E269-I273 WeakPolarHBondContact O-CG1 3.36Å; E269-I273 PolarHBondContact O-N 3.27Å; E270-I273 PolarHBondContact O-N 3.23Å; I273-W275 PolarHBondContact O-N 2.91Å; I273-V276 PolarHBondContact O-N 3.09Å; I273-N277 WeakPolarHBondContact O-CB 3.25Å; I273-N277 PolarHBondContact O-N 3.4Å; I273-N277 PolarHBondContact O-ND2 2.91Å; I273-M289 VanDerWaalsContact CG2-O 3.3Å; I273-M289 WeakPolarHBondContact CG2-O 3.3Å; I273-F292 HydrophobicContact CD1-CE2 3.77Å; I273-F292 HydrophobicContact CD1-CZ 3.87Å; I273-F292 HydrophobicContact CG1-CE1 4.32Å; I273-F292 HydrophobicContact CG1-CE2 4.13Å; I273-F292 HydrophobicContact CG1-CZ 3.73Å
274	R	94.7	Very high	90.9	Very high	48 Å²	48	39.1 Å²	39.1	18%	0.181	21%	0.21	C	C	.	.	H	α-helix	trans	-62.2	-41	174.9	-72.9	-179.6	177.3	-147.2	16.1	112.3	L253 E258 E270 I271 N277 Y278	L253-R274 HydrophobicContact CB-CB 4.48Å; L253-R274 PolarHBondContact O-NH1 3.28Å; E258-R274 VanDerWaalsContact CD-NH1 3.26Å; E258-R274 IonicContact OE1-CZ 2.61Å; E258-R274 VanDerWaalsContact OE1-CZ 3.29Å; E258-R274 IonicContact OE1-NH1 2.68Å; E258-R274 PolarHBondContact OE1-NH1 3.43Å; E258-R274 IonicContact OE1-NH2 2.73Å; E258-R274 PolarHBondContact OE1-NH2 3.32Å; E258-R274 IonicContact OE2-CZ 3.7Å; E258-R274 IonicContact OE2-NH1 3.51Å; E258-R274 PolarHBondContact OE2-NH1 3.28Å; E258-R274 IonicContact OE2-NH2 2.78Å; E270-R274 WeakPolarHBondContact O-CG 3.42Å; E270-R274 PolarHBondContact O-N 2.89Å; I271-R274 PolarHBondContact O-N 3.02Å; R274-N277 PolarHBondContact O-N 3.35Å; R274-Y278 WeakPolarHBondContact O-CB 3.32Å; R274-Y278 PolarHBondContact O-N 2.77Å
275	W	95.5	Very high	90.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.5	-44.9	176	172.8	71.5	0	0	0	112.5	L253 I271 L272 I273 Y278 H279 L305 I309 L367 L370 F371 Y374 P375	L253-W275 HydrophobicContact CD1-CB 3.85Å; I271-W275 WeakPolarHBondContact O-CB 3.43Å; I271-W275 PolarHBondContact O-N 2.87Å; L272-W275 HydrophobicContact CD2-CE3 4.02Å; L272-W275 HydrophobicContact CD2-CZ3 4.45Å; L272-W275 WeakPolarHBondContact O-CB 3.31Å; L272-W275 PolarHBondContact O-N 2.96Å; I273-W275 PolarHBondContact O-N 2.91Å; W275-Y278 WeakPolarHBondContact O-CB 3.36Å; W275-Y278 PolarHBondContact O-N 3.43Å; W275-H279 AromaticContact CD1-CD2 3.86Å; W275-H279 AromaticContact CD1-NE2 3.94Å; W275-H279 AromaticContact CE2-CD2 3.83Å; W275-H279 AromaticContact NE1-CD2 3.47Å; W275-H279 PolarHBondContact NE1-CD2 2.86Å; W275-H279 AromaticContact NE1-NE2 3.38Å; W275-H279 PolarHBondContact NE1-NE2 2.97Å; W275-H279 PolarHBondContact O-CD2 3.42Å; W275-H279 PolarHBondContact O-N 2.65Å; W275-L305 HydrophobicContact CH2-CD1 4.11Å; W275-L305 HydrophobicContact CH2-CD2 4.18Å; W275-L305 HydrophobicContact CH2-CG 4.44Å; W275-L305 HydrophobicContact CZ2-CD1 4.39Å; W275-L305 HydrophobicContact CZ3-CD1 4.22Å; W275-L305 HydrophobicContact CZ3-CD2 3.97Å; W275-I309 HydrophobicContact CH2-CD1 4.03Å; W275-I309 HydrophobicContact CH2-CG2 4.47Å; W275-I309 HydrophobicContact CZ2-CD1 4.24Å; W275-I309 HydrophobicContact CZ2-CG2 3.88Å; W275-L367 HydrophobicContact CE3-CD1 4.46Å; W275-L367 HydrophobicContact CE3-CG 4.47Å; W275-L367 HydrophobicContact CZ3-CD1 3.8Å; W275-L367 HydrophobicContact CZ3-CG 4.02Å; W275-L370 HydrophobicContact CH2-CB 4.23Å; W275-F371 AromaticContact CD1-CD2 4Å; W275-F371 AromaticContact CD2-CD2 3.73Å; W275-F371 HydrophobicContact CD2-CD2 3.73Å; W275-F371 AromaticContact CE2-CD2 3.69Å; W275-F371 HydrophobicContact CE3-CB 4.3Å; W275-F371 HydrophobicContact CE3-CD2 4.23Å; W275-F371 AromaticContact CG-CD2 3.95Å; W275-F371 HydrophobicContact CG-CD2 3.95Å; W275-F371 HydrophobicContact CG-CE2 4.31Å; W275-F371 HydrophobicContact CH2-CB 4.05Å; W275-F371 HydrophobicContact CZ2-CB 4.32Å; W275-F371 HydrophobicContact CZ2-CD2 4.16Å; W275-F371 HydrophobicContact CZ3-CB 4.02Å; W275-F371 AromaticContact NE1-CD2 3.82Å; W275-Y374 WeakPolarHBondContact CZ2-O 2.92Å; W275-P375 PolarHBondContact NE1-O 3.06Å
276	V	95.8	Very high	90.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-62.9	-50.5	173.8	173.1	0	0	0	0	110.9	L272 I273 Y278 H279 L280 M289 V301 L305 L367	L272-V276 WeakPolarHBondContact O-CG2 3.32Å; L272-V276 PolarHBondContact O-N 3.49Å; I273-V276 PolarHBondContact O-N 3.09Å; V276-Y278 PolarHBondContact O-N 3.03Å; V276-H279 PolarHBondContact O-N 2.71Å; V276-H279 VanDerWaalsContact O-N 3.07Å; V276-L280 HydrophobicContact CG1-CD1 3.84Å; V276-L280 HydrophobicContact CG1-CG 4.23Å; V276-L280 WeakPolarHBondContact O-CG 3.39Å; V276-L280 PolarHBondContact O-N 3.07Å; V276-M289 HydrophobicContact CB-SD 4.08Å; V276-M289 HydrophobicContact CG1-CB 4.02Å; V276-M289 HydrophobicContact CG1-SD 3.9Å; V276-M289 HydrophobicContact CG2-SD 3.99Å; V276-V301 HydrophobicContact CG1-CG1 3.58Å; V276-L305 HydrophobicContact CG2-CD1 4.35Å; V276-L305 HydrophobicContact CG2-CD2 3.96Å; V276-L367 HydrophobicContact CG2-CD1 3.56Å; V276-L367 HydrophobicContact CG2-CD2 3.75Å; V276-L367 HydrophobicContact CG2-CG 4.17Å
277	N	95	Very high	89.9	Confident	27 Å²	27	39.8 Å²	39.8	14%	0.144	23%	0.233	C	C	.	.	H	α-helix	trans	-63.9	-27.1	-178.8	-75.4	-33	0	0	0	113	I273 R274 K281 R288 M289	I273-N277 WeakPolarHBondContact O-CB 3.25Å; I273-N277 PolarHBondContact O-N 3.4Å; I273-N277 PolarHBondContact O-ND2 2.91Å; R274-N277 PolarHBondContact O-N 3.35Å; N277-K281 WeakPolarHBondContact O-CG 3.34Å; N277-K281 PolarHBondContact O-N 3.01Å; N277-R288 WeakPolarHBondContact OD1-CA 3.49Å; N277-R288 WeakPolarHBondContact OD1-CB 3.39Å; N277-R288 WeakPolarHBondContact OD1-CD 3.3Å; N277-M289 PolarHBondContact ND2-O 2.67Å; N277-M289 PolarHBondContact OD1-N 2.85Å
278	Y	94	Very high	89.9	Confident	80 Å²	80	43.2 Å²	43.2	31%	0.314	24%	0.244	S	C	.	.	H	α-helix	trans	-63.5	-51.3	168.9	175.7	-84.1	0	0	0	111.6	L253 R274 W275 V276 L280 K281 L377	L253-Y278 VanDerWaalsContact CD2-CB 3.41Å; L253-Y278 HydrophobicContact CD2-CD1 4.23Å; L253-Y278 HydrophobicContact CD2-CD2 3.65Å; L253-Y278 HydrophobicContact CD2-CE2 4.46Å; L253-Y278 HydrophobicContact CD2-CG 3.51Å; R274-Y278 WeakPolarHBondContact O-CB 3.32Å; R274-Y278 PolarHBondContact O-N 2.77Å; W275-Y278 WeakPolarHBondContact O-CB 3.36Å; W275-Y278 PolarHBondContact O-N 3.43Å; V276-Y278 PolarHBondContact O-N 3.03Å; Y278-L280 VanDerWaalsContact C-N 3.25Å; Y278-L280 PolarHBondContact O-N 3.28Å; Y278-K281 WeakPolarHBondContact O-CB 3.37Å; Y278-K281 PolarHBondContact O-N 3.11Å; Y278-L377 HydrophobicContact CD1-CD2 3.66Å; Y278-L377 HydrophobicContact CE1-CD2 3.5Å; Y278-L377 HydrophobicContact CG-CD2 4.36Å
279	H	93.4	Very high	89.8	Confident	18 Å²	18	42.2 Å²	42.2	8%	0.083	24%	0.237	C	C	.	.	H	α-helix	trans	-67.8	-22.9	179.1	-77.3	-63.7	0	0	0	113.8	W275 V276 L305 K308 P375 A376	W275-H279 AromaticContact CD1-CD2 3.86Å; W275-H279 AromaticContact CD1-NE2 3.94Å; W275-H279 AromaticContact CE2-CD2 3.83Å; W275-H279 AromaticContact NE1-CD2 3.47Å; W275-H279 PolarHBondContact NE1-CD2 2.86Å; W275-H279 AromaticContact NE1-NE2 3.38Å; W275-H279 PolarHBondContact NE1-NE2 2.97Å; W275-H279 PolarHBondContact O-CD2 3.42Å; W275-H279 PolarHBondContact O-N 2.65Å; V276-H279 PolarHBondContact O-N 2.71Å; V276-H279 VanDerWaalsContact O-N 3.07Å; H279-L305 HydrophobicContact CB-CD1 3.8Å; H279-K308 HydrophobicContact CB-CB 4.29Å; H279-P375 PolarHBondContact NE2-O 2.98Å; H279-A376 PolarHBondContact CE1-O 3.26Å; H279-A376 VanDerWaalsContact CE1-O 3.3Å
280	L	92.9	Very high	89.8	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-9.5	170.3	-61.6	179	0	0	0	114.1	V276 Y278 G282 T283 R288 V301 Y304	V276-L280 HydrophobicContact CG1-CD1 3.84Å; V276-L280 HydrophobicContact CG1-CG 4.23Å; V276-L280 WeakPolarHBondContact O-CG 3.39Å; V276-L280 PolarHBondContact O-N 3.07Å; Y278-L280 VanDerWaalsContact C-N 3.25Å; Y278-L280 PolarHBondContact O-N 3.28Å; L280-G282 PolarHBondContact O-N 3.08Å; L280-T283 HydrophobicContact CD2-CG2 4.33Å; L280-T283 PolarHBondContact O-N 2.95Å; L280-T283 PolarHBondContact O-OG1 3.18Å; L280-R288 PolarHBondContact O-NH1 2.88Å; L280-R288 PolarHBondContact O-NH2 2.85Å; L280-R288 VanDerWaalsContact O-NH2 3.11Å; L280-V301 HydrophobicContact CD1-CG1 4.36Å; L280-V301 HydrophobicContact CD1-CG2 4.36Å; L280-Y304 HydrophobicContact CD2-CG 4.46Å
281	K	89.3	Confident	89.7	Confident	103 Å²	103	44.4 Å²	44.4	45%	0.448	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	122	170.9	-74.5	161.7	-166.6	176.3	0	108.2	E255 N277 Y278	E255-K281 IonicContact OE1-NZ 3.37Å; E255-K281 PolarHBondContact OE1-NZ 3.1Å; N277-K281 WeakPolarHBondContact O-CG 3.34Å; N277-K281 PolarHBondContact O-N 3.01Å; Y278-K281 WeakPolarHBondContact O-CB 3.37Å; Y278-K281 PolarHBondContact O-N 3.11Å
282	G	81.1	Confident	89.6	Confident	70 Å²	70	44.5 Å²	44.5	72%	0.722	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	76	28.3	-176.4	0	0	0	0	0	115.4	L280	L280-G282 PolarHBondContact O-N 3.08Å
283	T	86.1	Confident	89.4	Confident	21 Å²	21	45.4 Å²	45.4	13%	0.129	25%	0.254	C	S	.	.	S	Bend	trans	-90.3	159.4	156.6	55.1	0	0	0	0	110.7	L280 S285 Y304	L280-T283 HydrophobicContact CD2-CG2 4.33Å; L280-T283 PolarHBondContact O-N 2.95Å; L280-T283 PolarHBondContact O-OG1 3.18Å; T283-S285 PolarHBondContact O-N 3.41Å; T283-S285 VanDerWaalsContact O-N 3.14Å; T283-S285 PolarHBondContact OG1-O 2.77Å; T283-Y304 HydrophobicContact CG2-CD1 3.74Å; T283-Y304 HydrophobicContact CG2-CE1 4.4Å; T283-Y304 HydrophobicContact CG2-CG 3.94Å
284	D	78.7	Confident	89.1	Confident	145 Å²	145	50.3 Å²	50.3	78%	0.775	28%	0.275	S	S	*	.	S	Bend	trans	-58.1	-24.1	171.4	-61.2	-29.6	0	0	0	112.7
285	S	76	Confident	88.9	Confident	11 Å²	11	49.8 Å²	49.8	8%	0.077	28%	0.276	C	S	.	.			trans	-80.8	130.7	177.4	-176	0	0	0	0	113.6	T283 T287 R288 E300 Y304	T283-S285 PolarHBondContact O-N 3.41Å; T283-S285 VanDerWaalsContact O-N 3.14Å; T283-S285 PolarHBondContact OG1-O 2.77Å; S285-T287 VanDerWaalsContact C-N 3.3Å; S285-T287 WeakPolarHBondContact OG-CB 3.38Å; S285-T287 PolarHBondContact OG-N 3.28Å; S285-T287 PolarHBondContact OG-OG1 2.78Å; S285-R288 PolarHBondContact O-NH1 3.08Å; S285-E300 WeakPolarHBondContact CB-OE1 3.31Å; S285-E300 PolarHBondContact OG-OE1 3.44Å; S285-Y304 VanDerWaalsContact CB-CE2 3.49Å
286	G	79.7	Confident	88.7	Confident	72 Å²	72	49.8 Å²	49.8	74%	0.742	28%	0.276	S	S	*	.			trans	-80.7	-4.7	165.4	0	0	0	0	0	114.2
287	T	82.5	Confident	88.5	Confident	44 Å²	44	52 Å²	52	27%	0.27	28%	0.284	S	S	.	.			trans	-63.6	133.8	177.3	-59.5	0	0	0	0	110	S285 E300 V301	S285-T287 VanDerWaalsContact C-N 3.3Å; S285-T287 WeakPolarHBondContact OG-CB 3.38Å; S285-T287 PolarHBondContact OG-N 3.28Å; S285-T287 PolarHBondContact OG-OG1 2.78Å; T287-E300 PolarHBondContact OG1-OE1 2.77Å; T287-E300 PolarHBondContact OG1-OE2 3.46Å; T287-V301 HydrophobicContact CG2-CG2 4.01Å
288	R	89.3	Confident	88.3	Confident	88 Å²	88	53.1 Å²	53.1	33%	0.332	29%	0.29	S	S	.	.			trans	-125.4	153.6	172.4	-65.6	-62.5	175.2	-93.1	2.5	108.9	N277 L280 S285	N277-R288 WeakPolarHBondContact OD1-CA 3.49Å; N277-R288 WeakPolarHBondContact OD1-CB 3.39Å; N277-R288 WeakPolarHBondContact OD1-CD 3.3Å; L280-R288 PolarHBondContact O-NH1 2.88Å; L280-R288 PolarHBondContact O-NH2 2.85Å; L280-R288 VanDerWaalsContact O-NH2 3.11Å; S285-R288 PolarHBondContact O-NH1 3.08Å
289	M	91.6	Very high	88.3	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.275	C	S	.	.			trans	-92.3	126.2	178.5	-172.8	176.2	-176.9	0	0	108.9	I273 V276 N277 F292 V296 V301 L367	I273-M289 VanDerWaalsContact CG2-O 3.3Å; I273-M289 WeakPolarHBondContact CG2-O 3.3Å; V276-M289 HydrophobicContact CB-SD 4.08Å; V276-M289 HydrophobicContact CG1-CB 4.02Å; V276-M289 HydrophobicContact CG1-SD 3.9Å; V276-M289 HydrophobicContact CG2-SD 3.99Å; N277-M289 PolarHBondContact ND2-O 2.67Å; N277-M289 PolarHBondContact OD1-N 2.85Å; M289-F292 HydrophobicContact CE-CB 4.12Å; M289-F292 HydrophobicContact CE-CD1 3.33Å; M289-F292 HydrophobicContact CE-CE1 3.81Å; M289-F292 HydrophobicContact CE-CG 3.81Å; M289-V296 HydrophobicContact CE-CG1 3.94Å; M289-V296 HydrophobicContact SD-CG1 4.34Å; M289-V301 HydrophobicContact SD-CG1 4.24Å; M289-L367 HydrophobicContact CE-CD2 4.26Å; M289-L367 HydrophobicContact SD-CD2 4.4Å
290	E	91.9	Very high	88.3	Confident	150 Å²	150	49.9 Å²	49.9	70%	0.701	28%	0.278	S	S	*	.	S	Bend	trans	-120	-17.9	172	-65.5	176.5	-170.4	0	0	110.7	D295	E290-D295 PolarHBondContact N-OD2 2.65Å
291	N	91	Very high	88.4	Confident	15 Å²	15	49.8 Å²	49.8	8%	0.08	28%	0.277	C	S	.	.			trans	-151.8	157.6	175.9	67.2	92	0	0	0	113.4	S293 F294 D295	N291-S293 PolarHBondContact O-N 3.22Å; N291-S293 WeakPolarHBondContact OD1-CA 3.3Å; N291-S293 PolarHBondContact OD1-N 2.84Å; N291-S293 PolarHBondContact OD1-OG 3.15Å; N291-F294 PolarHBondContact OD1-N 3.32Å; N291-D295 PolarHBondContact N-OD2 2.89Å; N291-D295 PolarHBondContact ND2-OD1 2.74Å; N291-D295 PolarHBondContact ND2-OD2 2.89Å
292	F	91.7	Very high	88.7	Confident	7 Å²	7	44.9 Å²	44.9	3%	0.031	26%	0.256	C	S	.	.	S	Bend	trans	-81.2	15.3	-179.7	-46.9	-95.9	0	0	0	114.3	E269 L272 I273 M289 Q360 N363 L364 L367	E269-F292 HydrophobicContact CB-CE2 3.94Å; E269-F292 HydrophobicContact CB-CZ 3.91Å; E269-F292 HydrophobicContact CG-CE2 4.18Å; E269-F292 HydrophobicContact CG-CZ 4.25Å; L272-F292 HydrophobicContact CB-CE1 4.35Å; L272-F292 HydrophobicContact CB-CZ 4.49Å; I273-F292 HydrophobicContact CD1-CE2 3.77Å; I273-F292 HydrophobicContact CD1-CZ 3.87Å; I273-F292 HydrophobicContact CG1-CE1 4.32Å; I273-F292 HydrophobicContact CG1-CE2 4.13Å; I273-F292 HydrophobicContact CG1-CZ 3.73Å; M289-F292 HydrophobicContact CE-CB 4.12Å; M289-F292 HydrophobicContact CE-CD1 3.33Å; M289-F292 HydrophobicContact CE-CE1 3.81Å; M289-F292 HydrophobicContact CE-CG 3.81Å; F292-Q360 HydrophobicContact CB-CG 3.93Å; F292-N363 HydrophobicContact CB-CB 4.33Å; F292-N363 VanDerWaalsContact O-CB 3.23Å; F292-N363 WeakPolarHBondContact O-CB 3.47Å; F292-N363 PolarHBondContact O-ND2 3.14Å; F292-N363 VanDerWaalsContact O-ND2 3.11Å; F292-L364 HydrophobicContact CB-CB 4.47Å; F292-L364 HydrophobicContact CD1-CB 4.01Å; F292-L364 HydrophobicContact CD1-CD1 3.9Å; F292-L364 HydrophobicContact CE1-CB 4.49Å; F292-L364 HydrophobicContact CE1-CD1 3.5Å; F292-L364 HydrophobicContact CE2-CD1 4.26Å; F292-L364 HydrophobicContact CG-CB 4.16Å; F292-L364 HydrophobicContact CG-CD1 4.45Å; F292-L364 HydrophobicContact CZ-CD1 3.72Å; F292-L367 HydrophobicContact CD1-CD2 4.16Å; F292-L367 HydrophobicContact CE1-CD2 3.75Å
293	S	91.1	Very high	89.3	Confident	20 Å²	20	41.6 Å²	41.6	14%	0.14	22%	0.222	C	C	.	.	S	Bend	trans	-124.6	-53.2	-166.1	77.9	0	0	0	0	115.8	N291 R297 G358	N291-S293 PolarHBondContact O-N 3.22Å; N291-S293 WeakPolarHBondContact OD1-CA 3.3Å; N291-S293 PolarHBondContact OD1-N 2.84Å; N291-S293 PolarHBondContact OD1-OG 3.15Å; S293-R297 WeakPolarHBondContact O-CG 3.4Å; S293-R297 PolarHBondContact O-NE 3.2Å; S293-G358 WeakPolarHBondContact CA-O 3.22Å; S293-G358 WeakPolarHBondContact O-CA 3.35Å
294	F	89	Confident	89.7	Confident	136 Å²	136	42.2 Å²	42.2	60%	0.596	22%	0.222	S	C	*	.	S	Bend	trans	-96	-44.6	-178.7	-73.9	-82.9	0	0	0	111.8	N291 V296 R297	N291-F294 PolarHBondContact OD1-N 3.32Å; F294-V296 PolarHBondContact O-N 2.89Å; F294-V296 VanDerWaalsContact O-N 3.1Å; F294-R297 WeakPolarHBondContact O-CG 3.41Å; F294-R297 PolarHBondContact O-N 2.83Å; F294-R297 VanDerWaalsContact O-N 3.09Å
295	D	90.5	Very high	90.5	Very high	36 Å²	36	35.3 Å²	35.3	19%	0.193	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-20.7	-170.5	-40.4	-10.8	0	0	0	113	E290 N291 V301	E290-D295 PolarHBondContact N-OD2 2.65Å; N291-D295 PolarHBondContact N-OD2 2.89Å; N291-D295 PolarHBondContact ND2-OD1 2.74Å; N291-D295 PolarHBondContact ND2-OD2 2.89Å; D295-V301 WeakPolarHBondContact O-CG2 3.39Å
296	V	92.2	Very high	91.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-12.5	-179.5	-64.1	0	0	0	0	114.1	M289 F294 N298 S299 V301 Y302 I355 N363	M289-V296 HydrophobicContact CE-CG1 3.94Å; M289-V296 HydrophobicContact SD-CG1 4.34Å; F294-V296 PolarHBondContact O-N 2.89Å; F294-V296 VanDerWaalsContact O-N 3.1Å; V296-N298 VanDerWaalsContact C-N 3.3Å; V296-N298 PolarHBondContact O-N 2.92Å; V296-S299 WeakPolarHBondContact O-CA 3.4Å; V296-S299 PolarHBondContact O-N 3.28Å; V296-V301 HydrophobicContact CG1-CB 4.33Å; V296-V301 HydrophobicContact CG1-CG1 4.23Å; V296-Y302 HydrophobicContact CB-CD2 4.22Å; V296-Y302 HydrophobicContact CB-CE2 3.67Å; V296-Y302 HydrophobicContact CG1-CE2 4.01Å; V296-Y302 HydrophobicContact CG2-CE2 4.31Å; V296-I355 WeakPolarHBondContact O-CG2 3.23Å; V296-N363 HydrophobicContact CG2-CB 4.27Å; V296-N363 VanDerWaalsContact CG2-ND2 3.34Å; V296-N363 WeakPolarHBondContact CG2-ND2 3.33Å
297	R	91.3	Very high	92	Very high	47 Å²	47	35 Å²	35	18%	0.177	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-33	-172.5	-63	-178.7	-171.4	-141.1	-6.1	113.8	A95 S293 F294 S299 I355 S357	A95-R297 VanDerWaalsContact CB-NH1 3.31Å; S293-R297 WeakPolarHBondContact O-CG 3.4Å; S293-R297 PolarHBondContact O-NE 3.2Å; F294-R297 WeakPolarHBondContact O-CG 3.41Å; F294-R297 PolarHBondContact O-N 2.83Å; F294-R297 VanDerWaalsContact O-N 3.09Å; R297-S299 PolarHBondContact O-N 3.29Å; R297-I355 WeakPolarHBondContact CA-O 3.38Å; R297-S357 PolarHBondContact NH1-O 3.03Å; R297-S357 VanDerWaalsContact NH1-O 3.09Å; R297-S357 PolarHBondContact NH2-O 2.92Å; R297-S357 VanDerWaalsContact NH2-O 3.11Å
298	N	90.7	Very high	92.5	Very high	50 Å²	50	37 Å²	37	27%	0.267	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	1.9	178	76.6	-11.6	0	0	0	112.6	V296 E300 R333	V296-N298 VanDerWaalsContact C-N 3.3Å; V296-N298 PolarHBondContact O-N 2.92Å; N298-E300 WeakPolarHBondContact ND2-CB 3.27Å; N298-E300 PolarHBondContact ND2-OE2 2.92Å; N298-E300 PolarHBondContact O-N 2.68Å; N298-E300 WeakPolarHBondContact OD1-CB 3.43Å; N298-E300 PolarHBondContact OD1-N 2.99Å; N298-R333 WeakPolarHBondContact O-CD 3.32Å; N298-R333 PolarHBondContact O-NH1 3.23Å
299	S	93.8	Very high	92.7	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	56.6	7.3	-174.9	-64.4	0	0	0	0	116.2	V296 R297 Y302 A303 A334	V296-S299 WeakPolarHBondContact O-CA 3.4Å; V296-S299 PolarHBondContact O-N 3.28Å; R297-S299 PolarHBondContact O-N 3.29Å; S299-Y302 PolarHBondContact O-N 3.39Å; S299-A303 VanDerWaalsContact O-CB 3.3Å; S299-A303 WeakPolarHBondContact O-CB 3.49Å; S299-A303 PolarHBondContact O-N 3.23Å; S299-A334 WeakPolarHBondContact OG-CA 3.2Å; S299-A334 WeakPolarHBondContact OG-CB 3.42Å
300	E	94	Very high	92.8	Very high	30 Å²	30	33.3 Å²	33.3	14%	0.14	16%	0.156	C	C	.	.	H	α-helix	trans	-66.9	-48.5	-176.4	179.1	-176.2	-164.6	0	0	112.1	S285 T287 N298 Y302 A303 Y304 L325	S285-E300 WeakPolarHBondContact CB-OE1 3.31Å; S285-E300 PolarHBondContact OG-OE1 3.44Å; T287-E300 PolarHBondContact OG1-OE1 2.77Å; T287-E300 PolarHBondContact OG1-OE2 3.46Å; N298-E300 WeakPolarHBondContact ND2-CB 3.27Å; N298-E300 PolarHBondContact ND2-OE2 2.92Å; N298-E300 PolarHBondContact O-N 2.68Å; N298-E300 WeakPolarHBondContact OD1-CB 3.43Å; N298-E300 PolarHBondContact OD1-N 2.99Å; E300-Y302 VanDerWaalsContact C-N 3.3Å; E300-Y302 PolarHBondContact O-N 3.4Å; E300-A303 PolarHBondContact O-N 3.39Å; E300-Y304 HydrophobicContact CG-CD2 4.02Å; E300-Y304 HydrophobicContact CG-CE2 3.93Å; E300-Y304 WeakPolarHBondContact O-CD2 3.48Å; E300-Y304 PolarHBondContact O-N 2.81Å; E300-Y304 VanDerWaalsContact O-N 3.14Å; E300-L325 HydrophobicContact CB-CD2 3.88Å; E300-L325 HydrophobicContact CG-CD1 4.45Å; E300-L325 HydrophobicContact CG-CD2 3.95Å
301	V	94.4	Very high	92.8	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-54	-48.3	175.8	169.4	0	0	0	0	110.5	V276 L280 T287 M289 D295 V296 L305	V276-V301 HydrophobicContact CG1-CG1 3.58Å; L280-V301 HydrophobicContact CD1-CG1 4.36Å; L280-V301 HydrophobicContact CD1-CG2 4.36Å; T287-V301 HydrophobicContact CG2-CG2 4.01Å; M289-V301 HydrophobicContact SD-CG1 4.24Å; D295-V301 WeakPolarHBondContact O-CG2 3.39Å; V296-V301 HydrophobicContact CG1-CB 4.33Å; V296-V301 HydrophobicContact CG1-CG1 4.23Å; V301-L305 WeakPolarHBondContact O-CB 3.11Å; V301-L305 PolarHBondContact O-N 3.37Å
302	Y	95.5	Very high	92.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-71.3	-35.8	179.6	-67.2	-51.9	0	0	0	113.3	V296 S299 E300 L305 V306 V337 I355 N363 F366 L367 L370	V296-Y302 HydrophobicContact CB-CD2 4.22Å; V296-Y302 HydrophobicContact CB-CE2 3.67Å; V296-Y302 HydrophobicContact CG1-CE2 4.01Å; V296-Y302 HydrophobicContact CG2-CE2 4.31Å; S299-Y302 PolarHBondContact O-N 3.39Å; E300-Y302 VanDerWaalsContact C-N 3.3Å; E300-Y302 PolarHBondContact O-N 3.4Å; Y302-L305 HydrophobicContact CD1-CD2 4.39Å; Y302-L305 PolarHBondContact O-N 3.23Å; Y302-V306 VanDerWaalsContact O-CB 3.29Å; Y302-V306 WeakPolarHBondContact O-CB 3.26Å; Y302-V306 VanDerWaalsContact O-CG2 3.24Å; Y302-V306 WeakPolarHBondContact O-CG2 3.5Å; Y302-V306 PolarHBondContact O-N 3.13Å; Y302-V337 HydrophobicContact CG-CG1 4.34Å; Y302-I355 HydrophobicContact CD2-CD1 4.39Å; Y302-I355 HydrophobicContact CD2-CG2 4.18Å; Y302-I355 HydrophobicContact CE2-CD1 4.44Å; Y302-I355 HydrophobicContact CE2-CG1 4.39Å; Y302-I355 HydrophobicContact CE2-CG2 4.14Å; Y302-N363 WeakPolarHBondContact OH-CA 3.29Å; Y302-N363 VanDerWaalsContact OH-CB 3.31Å; Y302-N363 WeakPolarHBondContact OH-CB 3.28Å; Y302-N363 PolarHBondContact OH-O 3.43Å; Y302-N363 VanDerWaalsContact OH-O 3.12Å; Y302-F366 HydrophobicContact CD1-CD1 4.29Å; Y302-F366 AromaticContact CD1-CE1 3.92Å; Y302-F366 HydrophobicContact CD1-CE1 3.92Å; Y302-F366 HydrophobicContact CD2-CE1 4.35Å; Y302-F366 AromaticContact CE1-CD1 3.75Å; Y302-F366 HydrophobicContact CE1-CD1 3.75Å; Y302-F366 AromaticContact CE1-CE1 3.87Å; Y302-F366 HydrophobicContact CE1-CE1 3.87Å; Y302-F366 HydrophobicContact CE2-CD1 4.2Å; Y302-F366 HydrophobicContact CE2-CE1 4.29Å; Y302-F366 HydrophobicContact CG-CE1 4.17Å; Y302-F366 AromaticContact CZ-CD1 3.71Å; Y302-L367 HydrophobicContact CD1-CD1 4.49Å; Y302-L367 HydrophobicContact CE1-CD1 3.86Å; Y302-L370 HydrophobicContact CD1-CD1 4.41Å
303	A	94.8	Very high	92.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-58.5	-50.4	177.5	0	0	0	0	0	111.4	S299 E300 E307 A321 I324 V337	S299-A303 VanDerWaalsContact O-CB 3.3Å; S299-A303 WeakPolarHBondContact O-CB 3.49Å; S299-A303 PolarHBondContact O-N 3.23Å; E300-A303 PolarHBondContact O-N 3.39Å; A303-E307 PolarHBondContact O-N 3.01Å; A303-A321 HydrophobicContact CB-CB 4.15Å; A303-I324 HydrophobicContact CB-CB 4.1Å; A303-I324 HydrophobicContact CB-CD1 4.12Å; A303-I324 HydrophobicContact CB-CG2 3.69Å; A303-V337 HydrophobicContact CB-CG2 4.21Å
304	Y	94.8	Very high	92.6	Very high	35 Å²	35	43.1 Å²	43.1	14%	0.137	20%	0.202	C	C	.	.	H	α-helix	trans	-69.2	-44.7	176.4	-75.2	-66.3	0	0	0	112.8	L280 T283 S285 E300 V306 E307 K308 A321 L325	L280-Y304 HydrophobicContact CD2-CG 4.46Å; T283-Y304 HydrophobicContact CG2-CD1 3.74Å; T283-Y304 HydrophobicContact CG2-CE1 4.4Å; T283-Y304 HydrophobicContact CG2-CG 3.94Å; S285-Y304 VanDerWaalsContact CB-CE2 3.49Å; E300-Y304 HydrophobicContact CG-CD2 4.02Å; E300-Y304 HydrophobicContact CG-CE2 3.93Å; E300-Y304 WeakPolarHBondContact O-CD2 3.48Å; E300-Y304 PolarHBondContact O-N 2.81Å; E300-Y304 VanDerWaalsContact O-N 3.14Å; Y304-V306 PolarHBondContact O-N 3.46Å; Y304-E307 PolarHBondContact O-N 3.37Å; Y304-K308 WeakPolarHBondContact O-CB 3.36Å; Y304-K308 WeakPolarHBondContact O-CG 3.39Å; Y304-K308 PolarHBondContact O-N 3.4Å; Y304-A321 HydrophobicContact CD1-CB 3.63Å; Y304-A321 HydrophobicContact CE1-CB 3.89Å; Y304-A321 HydrophobicContact CG-CB 4.12Å; Y304-L325 HydrophobicContact CD2-CD1 4.35Å; Y304-L325 HydrophobicContact CE2-CD1 3.5Å
305	L	95	Very high	92.5	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-58.5	-50	-179.5	178.9	69.8	0	0	0	111.7	W275 V276 H279 V301 Y302 E307 K308 I309 L367 L370	W275-L305 HydrophobicContact CH2-CD1 4.11Å; W275-L305 HydrophobicContact CH2-CD2 4.18Å; W275-L305 HydrophobicContact CH2-CG 4.44Å; W275-L305 HydrophobicContact CZ2-CD1 4.39Å; W275-L305 HydrophobicContact CZ3-CD1 4.22Å; W275-L305 HydrophobicContact CZ3-CD2 3.97Å; V276-L305 HydrophobicContact CG2-CD1 4.35Å; V276-L305 HydrophobicContact CG2-CD2 3.96Å; H279-L305 HydrophobicContact CB-CD1 3.8Å; V301-L305 WeakPolarHBondContact O-CB 3.11Å; V301-L305 PolarHBondContact O-N 3.37Å; Y302-L305 HydrophobicContact CD1-CD2 4.39Å; Y302-L305 PolarHBondContact O-N 3.23Å; L305-E307 VanDerWaalsContact C-N 3.33Å; L305-E307 PolarHBondContact O-N 3.34Å; L305-K308 PolarHBondContact O-N 2.97Å; L305-K308 VanDerWaalsContact O-N 3.13Å; L305-I309 HydrophobicContact CD1-CG2 3.97Å; L305-I309 HydrophobicContact CG-CD1 4.44Å; L305-I309 HydrophobicContact CG-CG2 4.49Å; L305-I309 WeakPolarHBondContact O-CG1 3.39Å; L305-I309 WeakPolarHBondContact O-CG2 3.27Å; L305-I309 PolarHBondContact O-N 2.83Å; L305-L367 HydrophobicContact CD2-CD1 3.47Å; L305-L367 VanDerWaalsContact CD2-CD1 3.47Å; L305-L370 HydrophobicContact CD2-CD1 4.38Å
306	V	94.7	Very high	92.5	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-68.7	-32.2	-176.3	177.8	0	0	0	0	111.4	Y302 Y304 A310 M318 N340 L344 L370	Y302-V306 VanDerWaalsContact O-CB 3.29Å; Y302-V306 WeakPolarHBondContact O-CB 3.26Å; Y302-V306 VanDerWaalsContact O-CG2 3.24Å; Y302-V306 WeakPolarHBondContact O-CG2 3.5Å; Y302-V306 PolarHBondContact O-N 3.13Å; Y304-V306 PolarHBondContact O-N 3.46Å; V306-A310 VanDerWaalsContact O-CB 3.31Å; V306-A310 WeakPolarHBondContact O-CB 3.49Å; V306-A310 PolarHBondContact O-N 2.83Å; V306-M318 HydrophobicContact CG1-CE 3.71Å; V306-N340 HydrophobicContact CG1-CB 3.71Å; V306-L344 HydrophobicContact CG1-CD1 3.94Å; V306-L370 HydrophobicContact CG2-CD1 4.07Å; V306-L370 HydrophobicContact CG2-CD2 4.2Å
307	E	93.2	Very high	92.4	Very high	75 Å²	75	51.9 Å²	51.9	35%	0.35	24%	0.237	S	C	.	.	H	α-helix	trans	-67.3	-40.7	169.6	-169.2	-173.1	136.4	0	0	112	A303 Y304 L305 K315 A321	A303-E307 PolarHBondContact O-N 3.01Å; Y304-E307 PolarHBondContact O-N 3.37Å; L305-E307 VanDerWaalsContact C-N 3.33Å; L305-E307 PolarHBondContact O-N 3.34Å; E307-K315 VanDerWaalsContact O-CE 3.22Å; E307-K315 WeakPolarHBondContact O-CE 3.47Å; E307-K315 PolarHBondContact O-NZ 3.45Å; E307-A321 HydrophobicContact CB-CB 4.5Å; E307-A321 WeakPolarHBondContact OE2-CB 3.3Å; E307-A321 PolarHBondContact OE2-N 2.93Å
308	K	92.6	Very high	92.4	Very high	85 Å²	85	50.9 Å²	50.9	37%	0.37	24%	0.235	S	C	.	.	H	α-helix	trans	-65.1	-54.3	-178.5	-72.3	-85.5	-176.2	164.6	0	111.9	H279 Y304 L305 A310 K315	H279-K308 HydrophobicContact CB-CB 4.29Å; Y304-K308 WeakPolarHBondContact O-CB 3.36Å; Y304-K308 WeakPolarHBondContact O-CG 3.39Å; Y304-K308 PolarHBondContact O-N 3.4Å; L305-K308 PolarHBondContact O-N 2.97Å; L305-K308 VanDerWaalsContact O-N 3.13Å; K308-A310 VanDerWaalsContact C-N 3.32Å; K308-A310 PolarHBondContact O-N 3.26Å; K308-K315 PolarHBondContact O-NZ 2.9Å
309	I	94	Very high	92.5	Very high	5 Å²	5	51.8 Å²	51.8	3%	0.026	24%	0.237	C	C	.	.	H	α-helix	trans	-74.6	-16.9	-172.7	72.5	-175.7	0	0	0	114.3	W275 L305 L344 L370 A376	W275-I309 HydrophobicContact CH2-CD1 4.03Å; W275-I309 HydrophobicContact CH2-CG2 4.47Å; W275-I309 HydrophobicContact CZ2-CD1 4.24Å; W275-I309 HydrophobicContact CZ2-CG2 3.88Å; L305-I309 HydrophobicContact CD1-CG2 3.97Å; L305-I309 HydrophobicContact CG-CD1 4.44Å; L305-I309 HydrophobicContact CG-CG2 4.49Å; L305-I309 WeakPolarHBondContact O-CG1 3.39Å; L305-I309 WeakPolarHBondContact O-CG2 3.27Å; L305-I309 PolarHBondContact O-N 2.83Å; I309-L344 HydrophobicContact CG1-CD1 4.47Å; I309-L370 HydrophobicContact CD1-CB 4.29Å; I309-L370 HydrophobicContact CD1-CD2 4.35Å; I309-A376 HydrophobicContact CB-CB 3.98Å; I309-A376 HydrophobicContact CG2-CB 4.11Å
310	A	93.1	Very high	92.4	Very high	6 Å²	6	54.4 Å²	54.4	5%	0.05	26%	0.255	C	S	.	.	S	Bend	trans	-64.7	140	-178.8	0	0	0	0	0	112.5	V306 K308 K315 M318 L344	V306-A310 VanDerWaalsContact O-CB 3.31Å; V306-A310 WeakPolarHBondContact O-CB 3.49Å; V306-A310 PolarHBondContact O-N 2.83Å; K308-A310 VanDerWaalsContact C-N 3.32Å; K308-A310 PolarHBondContact O-N 3.26Å; A310-K315 HydrophobicContact CB-CG 4.06Å; A310-K315 WeakPolarHBondContact O-CE 3.41Å; A310-K315 PolarHBondContact O-NZ 3.25Å; A310-M318 HydrophobicContact CB-CE 3.8Å; A310-M318 HydrophobicContact CB-SD 3.72Å; A310-L344 HydrophobicContact CB-CD2 4.13Å
311	P	91.7	Very high	92.3	Very high	42 Å²	42	53 Å²	53	27%	0.273	25%	0.249	S	C	.	.			trans	-60.9	140.7	168.5	-22.7	33.4	0	0	0	111.5	E313 K314 K315 Y374	P311-E313 PolarHBondContact O-N 3.48Å; P311-E313 VanDerWaalsContact O-N 3.1Å; P311-K314 PolarHBondContact O-N 3.12Å; P311-K315 PolarHBondContact O-N 3.47Å; P311-Y374 HydrophobicContact CG-CD1 3.91Å; P311-Y374 HydrophobicContact CG-CE1 3.37Å
312	Q	89.3	Confident	92.2	Very high	149 Å²	149	61.1 Å²	61.1	70%	0.696	28%	0.28	S	S	*	.	H	α-helix	trans	-54.7	-34.8	-176.7	-166.6	66	6.7	0	0	113.2	K314 K315	Q312-K314 PolarHBondContact O-N 2.95Å; Q312-K315 PolarHBondContact O-N 3.24Å
313	E	90	Very high	92.1	Very high	156 Å²	156	63.1 Å²	63.1	73%	0.729	30%	0.296	S	S	*	.	H	α-helix	trans	-57.7	-31.5	174.9	-62.2	167.2	-166.4	0	0	113.9	P311 Q316	P311-E313 PolarHBondContact O-N 3.48Å; P311-E313 VanDerWaalsContact O-N 3.1Å; E313-Q316 PolarHBondContact O-NE2 3.31Å
314	K	89.3	Confident	92	Very high	52 Å²	52	63.1 Å²	63.1	23%	0.226	30%	0.296	C	S	.	.	H	α-helix	trans	-90.5	-27.5	-178.2	-68.8	-170	172.8	-172.2	0	113.1	P311 Q312 Q316 Y317 M318 Q343 L344 Y374	P311-K314 PolarHBondContact O-N 3.12Å; Q312-K314 PolarHBondContact O-N 2.95Å; K314-Q316 PolarHBondContact O-N 3.38Å; K314-Y317 PolarHBondContact O-N 3.04Å; K314-M318 HydrophobicContact CB-SD 4.07Å; K314-M318 WeakPolarHBondContact O-CG 3.45Å; K314-Q343 WeakPolarHBondContact CD-O 3.47Å; K314-Q343 WeakPolarHBondContact CE-O 3.42Å; K314-Q343 PolarHBondContact NZ-O 3.44Å; K314-L344 HydrophobicContact CD-CD2 3.7Å; K314-Y374 PolarHBondContact NZ-OH 3.43Å
315	K	88.3	Confident	91.9	Very high	60 Å²	60	63.2 Å²	63.2	26%	0.261	30%	0.299	S	S	.	.	H	α-helix	trans	-57.1	-28.5	-174.7	-58.1	-164.2	-167.3	-160.1	0	113.7	E307 K308 A310 P311 Q312 Y317 M318	E307-K315 VanDerWaalsContact O-CE 3.22Å; E307-K315 WeakPolarHBondContact O-CE 3.47Å; E307-K315 PolarHBondContact O-NZ 3.45Å; K308-K315 PolarHBondContact O-NZ 2.9Å; A310-K315 HydrophobicContact CB-CG 4.06Å; A310-K315 WeakPolarHBondContact O-CE 3.41Å; A310-K315 PolarHBondContact O-NZ 3.25Å; P311-K315 PolarHBondContact O-N 3.47Å; Q312-K315 PolarHBondContact O-N 3.24Å; K315-Y317 PolarHBondContact O-N 3.27Å; K315-M318 PolarHBondContact O-N 3.26Å
316	Q	88.9	Confident	91.7	Very high	138 Å²	138	68.7 Å²	68.7	65%	0.645	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-16	174.9	70.8	-173.3	-44.4	0	0	114.7	E313 K314	E313-Q316 PolarHBondContact O-NE2 3.31Å; K314-Q316 PolarHBondContact O-N 3.38Å
317	Y	90	Very high	91.6	Very high	157 Å²	157	69.2 Å²	69.2	62%	0.616	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	13.2	178.3	-52	-64.6	0	0	0	112.6	K314 K315	K314-Y317 PolarHBondContact O-N 3.04Å; K315-Y317 PolarHBondContact O-N 3.27Å
318	M	91.9	Very high	91.4	Very high	27 Å²	27	72.1 Å²	72.1	13%	0.133	36%	0.355	C	S	.	.	S	Bend	trans	-121.7	146.4	-172.7	-65	173.4	72.6	0	0	110.2	V306 A310 K314 K315 N340 Q343 L344	V306-M318 HydrophobicContact CG1-CE 3.71Å; A310-M318 HydrophobicContact CB-CE 3.8Å; A310-M318 HydrophobicContact CB-SD 3.72Å; K314-M318 HydrophobicContact CB-SD 4.07Å; K314-M318 WeakPolarHBondContact O-CG 3.45Å; K315-M318 PolarHBondContact O-N 3.26Å; M318-N340 VanDerWaalsContact CA-OD1 3.31Å; M318-N340 WeakPolarHBondContact CA-OD1 3.48Å; M318-N340 WeakPolarHBondContact CB-OD1 3.42Å; M318-N340 HydrophobicContact CE-CB 3.7Å; M318-Q343 HydrophobicContact CG-CB 4.17Å; M318-Q343 HydrophobicContact CG-CG 4.11Å; M318-L344 HydrophobicContact CE-CD1 4.42Å; M318-L344 HydrophobicContact CE-CD2 4.44Å; M318-L344 HydrophobicContact CE-CG 4.29Å; M318-L344 HydrophobicContact SD-CD2 4.44Å
319	H	92.5	Very high	91.4	Very high	68 Å²	68	71.8 Å²	71.8	32%	0.315	36%	0.357	S	S	.	.			trans	-66.3	135.4	169.3	-54.4	-72.6	0	0	0	108.9	I324 M336 Q339 N340	H319-I324 HydrophobicContact CB-CD1 4.05Å; H319-I324 HydrophobicContact CB-CG1 3.73Å; H319-M336 HydrophobicContact CB-CE 4.06Å; H319-Q339 PolarHBondContact NE2-OE1 3.49Å; H319-N340 PolarHBondContact N-OD1 2.94Å; H319-N340 PolarHBondContact O-ND2 3.07Å
320	S	93.4	Very high	91.4	Very high	55 Å²	55	74.2 Å²	74.2	39%	0.385	37%	0.37	S	S	.	.			trans	-70.2	153.3	171.3	63.9	0	0	0	0	110.7	R322 A323 I324	S320-R322 PolarHBondContact O-N 3.25Å; S320-R322 VanDerWaalsContact O-N 3.13Å; S320-A323 PolarHBondContact O-N 3.18Å; S320-A323 PolarHBondContact OG-N 3.17Å; S320-I324 WeakPolarHBondContact O-CG1 3.36Å; S320-I324 PolarHBondContact O-N 3.02Å
321	A	91.9	Very high	91.4	Very high	1 Å²	1	76.3 Å²	76.3	1%	0.008	38%	0.382	C	S	.	.	H	α-helix	trans	-54.6	-34.5	177	0	0	0	0	0	111.6	A303 Y304 E307 I324 L325	A303-A321 HydrophobicContact CB-CB 4.15Å; Y304-A321 HydrophobicContact CD1-CB 3.63Å; Y304-A321 HydrophobicContact CE1-CB 3.89Å; Y304-A321 HydrophobicContact CG-CB 4.12Å; E307-A321 HydrophobicContact CB-CB 4.5Å; E307-A321 WeakPolarHBondContact OE2-CB 3.3Å; E307-A321 PolarHBondContact OE2-N 2.93Å; A321-I324 PolarHBondContact O-N 2.94Å; A321-L325 WeakPolarHBondContact O-CB 3.48Å; A321-L325 WeakPolarHBondContact O-CD1 3.4Å; A321-L325 WeakPolarHBondContact O-CG 3.26Å; A321-L325 PolarHBondContact O-N 2.71Å
322	R	91.8	Very high	91.6	Very high	171 Å²	171	79.6 Å²	79.6	65%	0.645	39%	0.394	S	S	*	.	H	α-helix	trans	-64.9	-49.9	173.8	-167.4	172.6	-170	124.8	4.4	112.5	S320 I324 L325 D326	S320-R322 PolarHBondContact O-N 3.25Å; S320-R322 VanDerWaalsContact O-N 3.13Å; R322-I324 PolarHBondContact O-N 2.66Å; R322-L325 PolarHBondContact O-N 3.4Å; R322-D326 PolarHBondContact O-N 3.17Å
323	A	92.8	Very high	91.9	Very high	42 Å²	42	74.1 Å²	74.1	35%	0.347	37%	0.367	S	S	.	.	H	α-helix	trans	-62.4	-30.9	177.9	0	0	0	0	0	112.7	S320 M336	S320-A323 PolarHBondContact O-N 3.18Å; S320-A323 PolarHBondContact OG-N 3.17Å; A323-M336 WeakPolarHBondContact O-CE 3.42Å
324	I	93.2	Very high	92.1	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-67.2	-49.2	170.5	-65.6	170.1	0	0	0	110.3	A303 H319 S320 A321 R322 D326 A327 R333 M336 V337	A303-I324 HydrophobicContact CB-CB 4.1Å; A303-I324 HydrophobicContact CB-CD1 4.12Å; A303-I324 HydrophobicContact CB-CG2 3.69Å; H319-I324 HydrophobicContact CB-CD1 4.05Å; H319-I324 HydrophobicContact CB-CG1 3.73Å; S320-I324 WeakPolarHBondContact O-CG1 3.36Å; S320-I324 PolarHBondContact O-N 3.02Å; A321-I324 PolarHBondContact O-N 2.94Å; R322-I324 PolarHBondContact O-N 2.66Å; I324-D326 VanDerWaalsContact C-N 3.32Å; I324-D326 PolarHBondContact O-N 3.23Å; I324-A327 VanDerWaalsContact O-CB 3.28Å; I324-A327 WeakPolarHBondContact O-CB 3.36Å; I324-A327 PolarHBondContact O-N 2.95Å; I324-A327 VanDerWaalsContact O-N 3.12Å; I324-R333 HydrophobicContact CG2-CG 3.43Å; I324-R333 VanDerWaalsContact CG2-CG 3.43Å; I324-R333 WeakPolarHBondContact O-CG 3.45Å; I324-M336 HydrophobicContact CG1-CB 3.97Å; I324-M336 HydrophobicContact CG1-CE 4.12Å; I324-V337 HydrophobicContact CD1-CG2 4.2Å; I324-V337 HydrophobicContact CG2-CG2 3.93Å
325	L	92.1	Very high	92.4	Very high	38 Å²	38	66.5 Å²	66.5	20%	0.199	33%	0.332	C	S	.	.	H	α-helix	trans	-68.8	-27	-177.4	-73	166.6	0	0	0	114	E300 Y304 A321 R322 A327 R333	E300-L325 HydrophobicContact CB-CD2 3.88Å; E300-L325 HydrophobicContact CG-CD1 4.45Å; E300-L325 HydrophobicContact CG-CD2 3.95Å; Y304-L325 HydrophobicContact CD2-CD1 4.35Å; Y304-L325 HydrophobicContact CE2-CD1 3.5Å; A321-L325 WeakPolarHBondContact O-CB 3.48Å; A321-L325 WeakPolarHBondContact O-CD1 3.4Å; A321-L325 WeakPolarHBondContact O-CG 3.26Å; A321-L325 PolarHBondContact O-N 2.71Å; R322-L325 PolarHBondContact O-N 3.4Å; L325-A327 PolarHBondContact O-N 3.47Å; L325-R333 PolarHBondContact O-NH2 3.22Å
326	D	92.2	Very high	92.8	Very high	115 Å²	115	64.9 Å²	64.9	62%	0.615	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-17.9	172.6	-67.2	-32.6	0	0	0	112.3	R322 I324	R322-D326 PolarHBondContact O-N 3.17Å; I324-D326 VanDerWaalsContact C-N 3.32Å; I324-D326 PolarHBondContact O-N 3.23Å
327	A	91.2	Very high	93.2	Very high	11 Å²	11	58.3 Å²	58.3	9%	0.091	30%	0.295	C	S	.	.			trans	-72.6	126	173.3	0	0	0	0	0	111.4	I324 L325 R333 M336	I324-A327 VanDerWaalsContact O-CB 3.28Å; I324-A327 WeakPolarHBondContact O-CB 3.36Å; I324-A327 PolarHBondContact O-N 2.95Å; I324-A327 VanDerWaalsContact O-N 3.12Å; L325-A327 PolarHBondContact O-N 3.47Å; A327-R333 HydrophobicContact CB-CB 4.38Å; A327-R333 PolarHBondContact O-NE 2.89Å; A327-R333 VanDerWaalsContact O-NE 3.14Å; A327-R333 PolarHBondContact O-NH2 3.32Å; A327-M336 HydrophobicContact CB-SD 4.14Å
328	V	89.6	Confident	93.5	Very high	136 Å²	136	50.9 Å²	50.9	82%	0.824	27%	0.266	S	S	*	.	S	Bend	trans	-78.3	-38.5	-174.8	-179.8	0	0	0	0	112.6
329	D	92.6	Very high	93.7	Very high	79 Å²	79	52.8 Å²	52.8	42%	0.422	27%	0.274	S	S	.	.			trans	-77.5	130.3	175.8	170.5	37.7	0	0	0	111.1	V331 Q332 R333	D329-V331 VanDerWaalsContact C-N 3.34Å; D329-V331 PolarHBondContact OD1-N 3.43Å; D329-V331 WeakPolarHBondContact OD2-CB 3.43Å; D329-V331 PolarHBondContact OD2-N 3.03Å; D329-Q332 HydrophobicContact CB-CB 4.02Å; D329-Q332 WeakPolarHBondContact OD2-CB 3.27Å; D329-Q332 PolarHBondContact OD2-N 2.97Å; D329-R333 VanDerWaalsContact O-CB 3.25Å; D329-R333 WeakPolarHBondContact O-CB 3.21Å; D329-R333 PolarHBondContact O-N 3.32Å
330	L	93.4	Very high	93.8	Very high	56 Å²	56	49.7 Å²	49.7	29%	0.293	26%	0.26	S	S	.	.	H	α-helix	trans	-70.8	-28.9	179.1	-58.5	-174.1	0	0	0	112.4	A334 V356	L330-A334 VanDerWaalsContact O-CB 3.31Å; L330-A334 WeakPolarHBondContact O-CB 3.48Å; L330-A334 PolarHBondContact O-N 3.17Å; L330-V356 HydrophobicContact CB-CG1 4.2Å; L330-V356 HydrophobicContact CB-CG2 3.84Å; L330-V356 HydrophobicContact CD1-CG1 4.49Å; L330-V356 WeakPolarHBondContact O-CG2 3.5Å
331	V	94.2	Very high	93.9	Very high	49 Å²	49	47 Å²	47	30%	0.297	24%	0.242	S	C	.	.	H	α-helix	trans	-72.9	-48	178.1	-176.4	0	0	0	0	109.9	D329 R333 A334 E335 P352 V356	D329-V331 VanDerWaalsContact C-N 3.34Å; D329-V331 PolarHBondContact OD1-N 3.43Å; D329-V331 WeakPolarHBondContact OD2-CB 3.43Å; D329-V331 PolarHBondContact OD2-N 3.03Å; V331-R333 VanDerWaalsContact C-N 3.29Å; V331-R333 PolarHBondContact O-N 3.35Å; V331-A334 PolarHBondContact O-N 3.23Å; V331-E335 PolarHBondContact O-N 3.4Å; V331-P352 HydrophobicContact CG1-CB 3.85Å; V331-V356 HydrophobicContact CG2-CG2 4.34Å
332	Q	94.4	Very high	94	Very high	111 Å²	111	51.7 Å²	51.7	52%	0.519	26%	0.263	S	S	.	.	H	α-helix	trans	-55.8	-43.5	170.3	-175.7	177.3	35.1	0	0	112	D329 E335 M336	D329-Q332 HydrophobicContact CB-CB 4.02Å; D329-Q332 WeakPolarHBondContact OD2-CB 3.27Å; D329-Q332 PolarHBondContact OD2-N 2.97Å; Q332-E335 PolarHBondContact O-N 2.86Å; Q332-M336 HydrophobicContact CG-SD 4.5Å; Q332-M336 WeakPolarHBondContact O-CG 3.19Å; Q332-M336 PolarHBondContact O-N 3.11Å
333	R	95.3	Very high	94	Very high	34 Å²	34	47.7 Å²	47.7	13%	0.128	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-44	177.3	-171.3	-174.1	-69.6	-175.3	-2.6	112.4	N298 I324 L325 A327 D329 V331 E335 M336 V337	N298-R333 WeakPolarHBondContact O-CD 3.32Å; N298-R333 PolarHBondContact O-NH1 3.23Å; I324-R333 HydrophobicContact CG2-CG 3.43Å; I324-R333 VanDerWaalsContact CG2-CG 3.43Å; I324-R333 WeakPolarHBondContact O-CG 3.45Å; L325-R333 PolarHBondContact O-NH2 3.22Å; A327-R333 HydrophobicContact CB-CB 4.38Å; A327-R333 PolarHBondContact O-NE 2.89Å; A327-R333 VanDerWaalsContact O-NE 3.14Å; A327-R333 PolarHBondContact O-NH2 3.32Å; D329-R333 VanDerWaalsContact O-CB 3.25Å; D329-R333 WeakPolarHBondContact O-CB 3.21Å; D329-R333 PolarHBondContact O-N 3.32Å; V331-R333 VanDerWaalsContact C-N 3.29Å; V331-R333 PolarHBondContact O-N 3.35Å; R333-E335 VanDerWaalsContact C-N 3.35Å; R333-M336 PolarHBondContact O-N 3.08Å; R333-V337 PolarHBondContact O-N 2.58Å; R333-V337 VanDerWaalsContact O-N 3.09Å
334	A	95.1	Very high	94	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.6	-37.8	175.2	0	0	0	0	0	111.9	S299 L330 V331 V337 L338 P352 I355 V356	S299-A334 WeakPolarHBondContact OG-CA 3.2Å; S299-A334 WeakPolarHBondContact OG-CB 3.42Å; L330-A334 VanDerWaalsContact O-CB 3.31Å; L330-A334 WeakPolarHBondContact O-CB 3.48Å; L330-A334 PolarHBondContact O-N 3.17Å; V331-A334 PolarHBondContact O-N 3.23Å; A334-V337 WeakPolarHBondContact O-CB 3.45Å; A334-V337 PolarHBondContact O-N 3.36Å; A334-L338 WeakPolarHBondContact O-CG 3.44Å; A334-L338 PolarHBondContact O-N 3Å; A334-P352 HydrophobicContact CB-CB 3.95Å; A334-I355 HydrophobicContact CB-CB 4.19Å; A334-I355 HydrophobicContact CB-CD1 4.23Å; A334-I355 HydrophobicContact CB-CG2 4.32Å; A334-V356 HydrophobicContact CB-CG2 4.24Å
335	E	96.6	Very high	93.9	Very high	48 Å²	48	52.1 Å²	52.1	22%	0.224	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-41.9	172.6	175.5	56.3	-149.6	0	0	112.1	V331 Q332 R333 V337 L338 Q339 R347 P352	V331-E335 PolarHBondContact O-N 3.4Å; Q332-E335 PolarHBondContact O-N 2.86Å; R333-E335 VanDerWaalsContact C-N 3.35Å; E335-V337 VanDerWaalsContact C-N 3.34Å; E335-V337 PolarHBondContact O-N 3.35Å; E335-L338 CarbonylContact O-C 3.29Å; E335-L338 PolarHBondContact O-N 3.31Å; E335-L338 VanDerWaalsContact O-N 3.11Å; E335-Q339 WeakPolarHBondContact O-CG 3.29Å; E335-Q339 PolarHBondContact O-N 3.29Å; E335-Q339 VanDerWaalsContact OE1-CG 3.32Å; E335-Q339 WeakPolarHBondContact OE1-CG 3.48Å; E335-Q339 PolarHBondContact OE1-NE2 2.9Å; E335-R347 IonicContact OE1-CZ 3.69Å; E335-R347 IonicContact OE1-NH1 2.7Å; E335-R347 PolarHBondContact OE1-NH1 3.32Å; E335-R347 IonicContact OE1-NH2 2.71Å; E335-R347 PolarHBondContact OE1-NH2 2.91Å; E335-R347 IonicContact OE2-CZ 3.58Å; E335-R347 IonicContact OE2-NH1 3.29Å; E335-R347 IonicContact OE2-NH2 2.88Å; E335-R347 PolarHBondContact OE2-NH2 3.41Å; E335-P352 HydrophobicContact CB-CB 4.32Å; E335-P352 HydrophobicContact CB-CG 3.85Å; E335-P352 VanDerWaalsContact OE2-CG 3.24Å; E335-P352 WeakPolarHBondContact OE2-CG 3.26Å
336	M	96	Very high	93.8	Very high	27 Å²	27	50.5 Å²	50.5	13%	0.133	26%	0.262	C	S	.	.	H	α-helix	trans	-64.4	-37.2	175.7	-66.4	171.8	69.2	0	0	112.4	H319 A323 I324 A327 Q332 R333 L338 N340	H319-M336 HydrophobicContact CB-CE 4.06Å; A323-M336 WeakPolarHBondContact O-CE 3.42Å; I324-M336 HydrophobicContact CG1-CB 3.97Å; I324-M336 HydrophobicContact CG1-CE 4.12Å; A327-M336 HydrophobicContact CB-SD 4.14Å; Q332-M336 HydrophobicContact CG-SD 4.5Å; Q332-M336 WeakPolarHBondContact O-CG 3.19Å; Q332-M336 PolarHBondContact O-N 3.11Å; R333-M336 PolarHBondContact O-N 3.08Å; M336-L338 VanDerWaalsContact C-N 3.34Å; M336-N340 PolarHBondContact O-N 3.3Å; M336-N340 VanDerWaalsContact O-N 3.13Å
337	V	96.5	Very high	93.8	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-42.5	169.6	164.5	0	0	0	0	111.3	Y302 A303 I324 R333 A334 E335 N340 A341	Y302-V337 HydrophobicContact CG-CG1 4.34Å; A303-V337 HydrophobicContact CB-CG2 4.21Å; I324-V337 HydrophobicContact CD1-CG2 4.2Å; I324-V337 HydrophobicContact CG2-CG2 3.93Å; R333-V337 PolarHBondContact O-N 2.58Å; R333-V337 VanDerWaalsContact O-N 3.09Å; A334-V337 WeakPolarHBondContact O-CB 3.45Å; A334-V337 PolarHBondContact O-N 3.36Å; E335-V337 VanDerWaalsContact C-N 3.34Å; E335-V337 PolarHBondContact O-N 3.35Å; V337-N340 WeakPolarHBondContact O-CB 3.28Å; V337-N340 PolarHBondContact O-N 3.36Å; V337-A341 PolarHBondContact O-N 2.8Å
338	L	95.9	Very high	93.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-73.1	-31.5	-179	-71.1	173.4	0	0	0	113.1	A334 E335 M336 A341 E342 R347 V350 P352 I355 F366	A334-L338 WeakPolarHBondContact O-CG 3.44Å; A334-L338 PolarHBondContact O-N 3Å; E335-L338 CarbonylContact O-C 3.29Å; E335-L338 PolarHBondContact O-N 3.31Å; E335-L338 VanDerWaalsContact O-N 3.11Å; M336-L338 VanDerWaalsContact C-N 3.34Å; L338-A341 CarbonylContact O-C 3.6Å; L338-A341 PolarHBondContact O-N 3Å; L338-E342 WeakPolarHBondContact O-CB 3.5Å; L338-E342 PolarHBondContact O-N 3.48Å; L338-R347 HydrophobicContact CB-CG 4.19Å; L338-R347 HydrophobicContact CD2-CG 4.32Å; L338-V350 HydrophobicContact CD1-CG2 4.42Å; L338-V350 HydrophobicContact CD2-CG2 3.62Å; L338-P352 HydrophobicContact CD1-CG 4.01Å; L338-I355 HydrophobicContact CD1-CD1 4.05Å; L338-I355 HydrophobicContact CD2-CD1 4.17Å; L338-I355 HydrophobicContact CG-CD1 4.05Å; L338-F366 HydrophobicContact CD2-CD2 4.5Å; L338-F366 HydrophobicContact CD2-CE1 4.36Å; L338-F366 HydrophobicContact CD2-CE2 3.77Å; L338-F366 HydrophobicContact CD2-CZ 3.69Å
339	Q	96	Very high	93.4	Very high	68 Å²	68	42.4 Å²	42.4	32%	0.318	21%	0.207	S	C	.	.	H	α-helix	trans	-63.1	-41.1	168.6	-72.1	169.6	11.5	0	0	111.8	H319 E335 E342 Q343	H319-Q339 PolarHBondContact NE2-OE1 3.49Å; E335-Q339 WeakPolarHBondContact O-CG 3.29Å; E335-Q339 PolarHBondContact O-N 3.29Å; E335-Q339 VanDerWaalsContact OE1-CG 3.32Å; E335-Q339 WeakPolarHBondContact OE1-CG 3.48Å; E335-Q339 PolarHBondContact OE1-NE2 2.9Å; Q339-E342 VanDerWaalsContact O-CB 3.28Å; Q339-E342 WeakPolarHBondContact O-CB 3.5Å; Q339-E342 PolarHBondContact O-N 2.84Å; Q339-Q343 PolarHBondContact O-N 3.18Å
340	N	95.6	Very high	93.4	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.011	19%	0.19	C	C	.	.	H	α-helix	trans	-62.4	-44.6	171.5	-83.8	9.1	0	0	0	111.6	V306 M318 H319 M336 V337 E342 Q343 L344	V306-N340 HydrophobicContact CG1-CB 3.71Å; M318-N340 VanDerWaalsContact CA-OD1 3.31Å; M318-N340 WeakPolarHBondContact CA-OD1 3.48Å; M318-N340 WeakPolarHBondContact CB-OD1 3.42Å; M318-N340 HydrophobicContact CE-CB 3.7Å; H319-N340 PolarHBondContact N-OD1 2.94Å; H319-N340 PolarHBondContact O-ND2 3.07Å; M336-N340 PolarHBondContact O-N 3.3Å; M336-N340 VanDerWaalsContact O-N 3.13Å; V337-N340 WeakPolarHBondContact O-CB 3.28Å; V337-N340 PolarHBondContact O-N 3.36Å; N340-E342 PolarHBondContact O-N 3.15Å; N340-Q343 PolarHBondContact O-N 3.39Å; N340-L344 PolarHBondContact O-N 2.93Å
341	A	94.8	Very high	93.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.2	-27.5	174.4	0	0	0	0	0	112.6	V337 L338 L344 N345 C346 R347 F366 L370	V337-A341 PolarHBondContact O-N 2.8Å; L338-A341 CarbonylContact O-C 3.6Å; L338-A341 PolarHBondContact O-N 3Å; A341-L344 CarbonylContact O-C 3.46Å; A341-L344 WeakPolarHBondContact O-CA 3.43Å; A341-L344 WeakPolarHBondContact O-CB 3.39Å; A341-L344 PolarHBondContact O-N 2.79Å; A341-L344 VanDerWaalsContact O-N 3.12Å; A341-N345 PolarHBondContact O-N 3.23Å; A341-C346 HydrophobicContact CB-CB 4.35Å; A341-C346 WeakPolarHBondContact O-CA 3.36Å; A341-C346 PolarHBondContact O-N 3.23Å; A341-R347 HydrophobicContact CB-CB 4.43Å; A341-R347 PolarHBondContact O-N 3.26Å; A341-F366 HydrophobicContact CB-CE2 3.85Å; A341-F366 HydrophobicContact CB-CZ 3.86Å; A341-L370 HydrophobicContact CB-CD2 4.45Å
342	E	93.9	Very high	93.3	Very high	99 Å²	99	38.8 Å²	38.8	46%	0.463	18%	0.181	S	C	.	.	H	α-helix	trans	-66.9	-41.4	174.9	-153.2	173	143.9	0	0	111.6	L338 Q339 N340 L344 N345 R347	L338-E342 WeakPolarHBondContact O-CB 3.5Å; L338-E342 PolarHBondContact O-N 3.48Å; Q339-E342 VanDerWaalsContact O-CB 3.28Å; Q339-E342 WeakPolarHBondContact O-CB 3.5Å; Q339-E342 PolarHBondContact O-N 2.84Å; N340-E342 PolarHBondContact O-N 3.15Å; E342-L344 PolarHBondContact O-N 3.42Å; E342-L344 VanDerWaalsContact O-N 3.15Å; E342-N345 PolarHBondContact O-N 2.87Å; E342-R347 HydrophobicContact CB-CB 4.07Å; E342-R347 HydrophobicContact CG-CB 4.28Å; E342-R347 WeakPolarHBondContact OE2-CD 3.46Å; E342-R347 IonicContact OE2-CZ 2.65Å; E342-R347 IonicContact OE2-NE 2.66Å; E342-R347 IonicContact OE2-NH1 2.76Å; E342-R347 PolarHBondContact OE2-NH1 2.92Å
343	Q	92.9	Very high	93.1	Very high	87 Å²	87	38.3 Å²	38.3	41%	0.407	18%	0.178	S	C	.	.	H	α-helix	trans	-60.4	-24.1	170.5	-55.7	-49.3	-45.4	0	0	112.5	K314 M318 Q339 N340	K314-Q343 WeakPolarHBondContact CD-O 3.47Å; K314-Q343 WeakPolarHBondContact CE-O 3.42Å; K314-Q343 PolarHBondContact NZ-O 3.44Å; M318-Q343 HydrophobicContact CG-CB 4.17Å; M318-Q343 HydrophobicContact CG-CG 4.11Å; Q339-Q343 PolarHBondContact O-N 3.18Å; N340-Q343 PolarHBondContact O-N 3.39Å
344	L	92.1	Very high	93	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-1.9	174.4	-59.3	-171.7	0	0	0	113.8	V306 I309 A310 K314 M318 N340 A341 E342 C346 Y374	V306-L344 HydrophobicContact CG1-CD1 3.94Å; I309-L344 HydrophobicContact CG1-CD1 4.47Å; A310-L344 HydrophobicContact CB-CD2 4.13Å; K314-L344 HydrophobicContact CD-CD2 3.7Å; M318-L344 HydrophobicContact CE-CD1 4.42Å; M318-L344 HydrophobicContact CE-CD2 4.44Å; M318-L344 HydrophobicContact CE-CG 4.29Å; M318-L344 HydrophobicContact SD-CD2 4.44Å; N340-L344 PolarHBondContact O-N 2.93Å; A341-L344 CarbonylContact O-C 3.46Å; A341-L344 WeakPolarHBondContact O-CA 3.43Å; A341-L344 WeakPolarHBondContact O-CB 3.39Å; A341-L344 PolarHBondContact O-N 2.79Å; A341-L344 VanDerWaalsContact O-N 3.12Å; E342-L344 PolarHBondContact O-N 3.42Å; E342-L344 VanDerWaalsContact O-N 3.15Å; L344-C346 HydrophobicContact CB-CB 4.16Å; L344-C346 PolarHBondContact O-N 3.5Å; L344-C346 PolarHBondContact O-SG 3.22Å; L344-C346 VanDerWaalsContact O-SG 3.42Å; L344-Y374 HydrophobicContact CB-CD2 4.11Å; L344-Y374 HydrophobicContact CB-CE2 3.69Å; L344-Y374 HydrophobicContact CD1-CD2 4.05Å; L344-Y374 HydrophobicContact CD1-CE2 4.34Å; L344-Y374 HydrophobicContact CD2-CD2 4.21Å; L344-Y374 HydrophobicContact CD2-CE2 3.78Å; L344-Y374 HydrophobicContact CG-CD2 4.35Å; L344-Y374 HydrophobicContact CG-CE2 4.13Å
345	N	90.6	Very high	92.9	Very high	130 Å²	130	36.8 Å²	36.8	70%	0.695	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	21.4	-167.7	-58.8	-35.9	0	0	0	114.1	A341 E342	A341-N345 PolarHBondContact O-N 3.23Å; E342-N345 PolarHBondContact O-N 2.87Å
346	C	90.8	Very high	92.7	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.034	17%	0.167	C	C	.	.			trans	-105.4	-1.6	-173	-69.4	0	0	0	0	114.7	A341 L344 V348 F366 N369 L370	A341-C346 HydrophobicContact CB-CB 4.35Å; A341-C346 WeakPolarHBondContact O-CA 3.36Å; A341-C346 PolarHBondContact O-N 3.23Å; L344-C346 HydrophobicContact CB-CB 4.16Å; L344-C346 PolarHBondContact O-N 3.5Å; L344-C346 PolarHBondContact O-SG 3.22Å; L344-C346 VanDerWaalsContact O-SG 3.42Å; C346-V348 PolarHBondContact O-N 3.31Å; C346-F366 WeakPolarHBondContact O-CE2 3.41Å; C346-N369 WeakPolarHBondContact CA-ND2 3.15Å; C346-N369 PolarHBondContact O-ND2 2.97Å; C346-L370 HydrophobicContact CB-CD2 3.64Å; C346-L370 HydrophobicContact CB-CG 4.45Å
347	R	91.2	Very high	92.4	Very high	78 Å²	78	35 Å²	35	29%	0.294	17%	0.167	S	C	.	.			trans	-68.5	83.5	176.9	-175.7	-179.1	-179.1	142.9	15	111.8	E335 L338 A341 E342	E335-R347 IonicContact OE1-CZ 3.69Å; E335-R347 IonicContact OE1-NH1 2.7Å; E335-R347 PolarHBondContact OE1-NH1 3.32Å; E335-R347 IonicContact OE1-NH2 2.71Å; E335-R347 PolarHBondContact OE1-NH2 2.91Å; E335-R347 IonicContact OE2-CZ 3.58Å; E335-R347 IonicContact OE2-NH1 3.29Å; E335-R347 IonicContact OE2-NH2 2.88Å; E335-R347 PolarHBondContact OE2-NH2 3.41Å; L338-R347 HydrophobicContact CB-CG 4.19Å; L338-R347 HydrophobicContact CD2-CG 4.32Å; A341-R347 HydrophobicContact CB-CB 4.43Å; A341-R347 PolarHBondContact O-N 3.26Å; E342-R347 HydrophobicContact CB-CB 4.07Å; E342-R347 HydrophobicContact CG-CB 4.28Å; E342-R347 WeakPolarHBondContact OE2-CD 3.46Å; E342-R347 IonicContact OE2-CZ 2.65Å; E342-R347 IonicContact OE2-NE 2.66Å; E342-R347 IonicContact OE2-NH1 2.76Å; E342-R347 PolarHBondContact OE2-NH1 2.92Å
348	V	87	Confident	92	Very high	10 Å²	10	35.3 Å²	35.3	6%	0.061	17%	0.17	C	C	.	.			trans	-146.7	158.7	-176.5	-176.7	0	0	0	0	110.3	W130 C346 V350	W130-V348 HydrophobicContact CB-CG1 4.3Å; C346-V348 PolarHBondContact O-N 3.31Å; V348-V350 PolarHBondContact O-N 2.97Å
349	F	87.2	Confident	91.8	Very high	4 Å²	4	36 Å²	36	2%	0.018	18%	0.175	C	C	.	.	S	Bend	trans	69.7	-46.8	-175.9	-56.4	-74.7	0	0	0	115.7	G126 W130 I234 L238 L362 A365 N369	G126-F349 VanDerWaalsContact CA-O 3.28Å; G126-F349 WeakPolarHBondContact CA-O 3.44Å; W130-F349 HydrophobicContact CB-CD1 4.03Å; W130-F349 HydrophobicContact CB-CE1 3.53Å; W130-F349 HydrophobicContact CB-CZ 4.13Å; W130-F349 AromaticContact CD1-CE1 3.36Å; W130-F349 AromaticContact CD1-CE2 3.89Å; W130-F349 AromaticContact CD1-CZ 3.03Å; W130-F349 HydrophobicContact CD2-CE1 4.3Å; W130-F349 HydrophobicContact CD2-CZ 4.48Å; W130-F349 HydrophobicContact CG-CD1 4.4Å; W130-F349 AromaticContact CG-CE1 3.45Å; W130-F349 HydrophobicContact CG-CE1 3.45Å; W130-F349 VanDerWaalsContact CG-CE1 3.45Å; W130-F349 AromaticContact CG-CZ 3.65Å; W130-F349 HydrophobicContact CG-CZ 3.65Å; W130-F349 AromaticContact NE1-CZ 3.55Å; I234-F349 HydrophobicContact CG2-CE1 3.86Å; I234-F349 HydrophobicContact CG2-CZ 4.23Å; L238-F349 HydrophobicContact CD1-CE1 4.21Å; L238-F349 HydrophobicContact CD1-CE2 3.96Å; L238-F349 HydrophobicContact CD1-CZ 3.52Å; L238-F349 HydrophobicContact CD2-CE2 4.13Å; L238-F349 HydrophobicContact CD2-CZ 3.95Å; L238-F349 HydrophobicContact CG-CZ 4.24Å; F349-L362 HydrophobicContact CB-CD2 4.34Å; F349-A365 HydrophobicContact CB-CB 4.11Å; F349-A365 HydrophobicContact CD1-CB 3.77Å; F349-A365 VanDerWaalsContact CD2-C 3.44Å; F349-A365 HydrophobicContact CD2-CB 3.59Å; F349-A365 WeakPolarHBondContact CD2-O 3.31Å; F349-A365 HydrophobicContact CE1-CB 3.97Å; F349-A365 HydrophobicContact CE2-CB 3.8Å; F349-A365 WeakPolarHBondContact CE2-O 3.47Å; F349-A365 HydrophobicContact CG-CB 3.55Å; F349-A365 HydrophobicContact CZ-CB 3.97Å; F349-N369 HydrophobicContact CD2-CB 4.43Å; F349-N369 HydrophobicContact CE2-CB 4.06Å
350	V	91.3	Very high	91.6	Very high	11 Å²	11	36 Å²	36	7%	0.067	18%	0.175	C	C	.	.			trans	-103.8	138.7	-173.7	-73.7	0	0	0	0	113.2	L338 V348 D354 I355 L362 F366	L338-V350 HydrophobicContact CD1-CG2 4.42Å; L338-V350 HydrophobicContact CD2-CG2 3.62Å; V348-V350 PolarHBondContact O-N 2.97Å; V350-D354 HydrophobicContact CB-CB 4.36Å; V350-D354 HydrophobicContact CG1-CB 4.23Å; V350-I355 HydrophobicContact CB-CD1 4.5Å; V350-I355 HydrophobicContact CB-CG1 4.07Å; V350-I355 HydrophobicContact CG1-CG1 4.21Å; V350-I355 HydrophobicContact CG2-CD1 4.21Å; V350-I355 HydrophobicContact CG2-CG1 4.26Å; V350-L362 HydrophobicContact CG1-CB 3.61Å; V350-F366 HydrophobicContact CG1-CB 4.15Å; V350-F366 HydrophobicContact CG2-CB 3.79Å; V350-F366 HydrophobicContact CG2-CD1 3.9Å; V350-F366 HydrophobicContact CG2-CD2 3.66Å; V350-F366 HydrophobicContact CG2-CE1 4.39Å; V350-F366 HydrophobicContact CG2-CE2 4.18Å; V350-F366 HydrophobicContact CG2-CG 3.51Å
351	R	91.8	Very high	91.4	Very high	84 Å²	84	38.8 Å²	38.8	32%	0.317	19%	0.188	S	C	.	.			trans	-88.3	165.7	154.9	-58.5	168.8	162.1	172.4	-7.3	109.9	S149 E353 D354 I355	S149-R351 PolarHBondContact O-NH2 3.17Å; R351-E353 WeakPolarHBondContact CB-OE2 3.49Å; R351-E353 PolarHBondContact O-N 3.44Å; R351-D354 WeakPolarHBondContact CB-OD2 3.33Å; R351-D354 WeakPolarHBondContact CG-OD2 3.47Å; R351-D354 PolarHBondContact N-OD2 3.07Å; R351-D354 PolarHBondContact O-N 3.28Å; R351-D354 VanDerWaalsContact O-N 3.15Å; R351-I355 PolarHBondContact O-N 3.47Å
352	P	93.1	Very high	91.4	Very high	13 Å²	13	38.8 Å²	38.8	8%	0.084	19%	0.188	C	C	.	.	H	α-helix	trans	-53.5	-39.1	172.1	-26.9	36.1	0	0	0	113.1	V331 A334 E335 L338 D354 I355 V356	V331-P352 HydrophobicContact CG1-CB 3.85Å; A334-P352 HydrophobicContact CB-CB 3.95Å; E335-P352 HydrophobicContact CB-CB 4.32Å; E335-P352 HydrophobicContact CB-CG 3.85Å; E335-P352 VanDerWaalsContact OE2-CG 3.24Å; E335-P352 WeakPolarHBondContact OE2-CG 3.26Å; L338-P352 HydrophobicContact CD1-CG 4.01Å; P352-D354 VanDerWaalsContact C-N 3.34Å; P352-D354 PolarHBondContact O-N 3.18Å; P352-I355 PolarHBondContact O-N 2.94Å; P352-V356 WeakPolarHBondContact O-CG2 3.38Å; P352-V356 PolarHBondContact O-N 2.94Å
353	E	91.8	Very high	91.4	Very high	100 Å²	100	34.1 Å²	34.1	47%	0.467	17%	0.166	S	C	.	.	H	α-helix	trans	-65.8	-33.9	-180	-61.5	77.1	-169.8	0	0	112.8	R351 V356 S357	R351-E353 WeakPolarHBondContact CB-OE2 3.49Å; R351-E353 PolarHBondContact O-N 3.44Å; E353-V356 PolarHBondContact O-N 3.4Å; E353-S357 WeakPolarHBondContact O-CB 3.4Å; E353-S357 PolarHBondContact O-N 3.41Å
354	D	91.6	Very high	91.5	Very high	3 Å²	3	30.4 Å²	30.4	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-74	-31.3	-176.5	-50.4	-25.9	0	0	0	111.8	E122 V350 R351 P352 S357 G358 S359 L362	E122-D354 WeakPolarHBondContact CG-OD1 3.45Å; V350-D354 HydrophobicContact CB-CB 4.36Å; V350-D354 HydrophobicContact CG1-CB 4.23Å; R351-D354 WeakPolarHBondContact CB-OD2 3.33Å; R351-D354 WeakPolarHBondContact CG-OD2 3.47Å; R351-D354 PolarHBondContact N-OD2 3.07Å; R351-D354 PolarHBondContact O-N 3.28Å; R351-D354 VanDerWaalsContact O-N 3.15Å; P352-D354 VanDerWaalsContact C-N 3.34Å; P352-D354 PolarHBondContact O-N 3.18Å; D354-S357 PolarHBondContact O-OG 2.61Å; D354-S357 VanDerWaalsContact O-OG 3.05Å; D354-G358 PolarHBondContact O-N 3.16Å; D354-S359 PolarHBondContact O-N 3.46Å; D354-S359 VanDerWaalsContact O-N 3.09Å; D354-L362 HydrophobicContact CB-CD1 3.96Å
355	I	93.2	Very high	91.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.3	-48.2	170.4	-65.2	175	0	0	0	109.2	V296 R297 Y302 A334 L338 V350 R351 P352 G358	V296-I355 WeakPolarHBondContact O-CG2 3.23Å; R297-I355 WeakPolarHBondContact CA-O 3.38Å; Y302-I355 HydrophobicContact CD2-CD1 4.39Å; Y302-I355 HydrophobicContact CD2-CG2 4.18Å; Y302-I355 HydrophobicContact CE2-CD1 4.44Å; Y302-I355 HydrophobicContact CE2-CG1 4.39Å; Y302-I355 HydrophobicContact CE2-CG2 4.14Å; A334-I355 HydrophobicContact CB-CB 4.19Å; A334-I355 HydrophobicContact CB-CD1 4.23Å; A334-I355 HydrophobicContact CB-CG2 4.32Å; L338-I355 HydrophobicContact CD1-CD1 4.05Å; L338-I355 HydrophobicContact CD2-CD1 4.17Å; L338-I355 HydrophobicContact CG-CD1 4.05Å; V350-I355 HydrophobicContact CB-CD1 4.5Å; V350-I355 HydrophobicContact CB-CG1 4.07Å; V350-I355 HydrophobicContact CG1-CG1 4.21Å; V350-I355 HydrophobicContact CG2-CD1 4.21Å; V350-I355 HydrophobicContact CG2-CG1 4.26Å; R351-I355 PolarHBondContact O-N 3.47Å; P352-I355 PolarHBondContact O-N 2.94Å; I355-G358 WeakPolarHBondContact O-CA 3.46Å; I355-G358 PolarHBondContact O-N 3.27Å; I355-G358 VanDerWaalsContact O-N 3.09Å
356	V	93	Very high	91.9	Very high	17 Å²	17	24.1 Å²	24.1	10%	0.103	12%	0.115	C	C	.	.	H	α-helix	trans	-71.6	-32.1	-177.8	-179.5	0	0	0	0	112.3	L330 V331 A334 P352 E353 G358	L330-V356 HydrophobicContact CB-CG1 4.2Å; L330-V356 HydrophobicContact CB-CG2 3.84Å; L330-V356 HydrophobicContact CD1-CG1 4.49Å; L330-V356 WeakPolarHBondContact O-CG2 3.5Å; V331-V356 HydrophobicContact CG2-CG2 4.34Å; A334-V356 HydrophobicContact CB-CG2 4.24Å; P352-V356 WeakPolarHBondContact O-CG2 3.38Å; P352-V356 PolarHBondContact O-N 2.94Å; E353-V356 PolarHBondContact O-N 3.4Å; V356-G358 PolarHBondContact O-N 2.78Å
357	S	89.7	Confident	92.1	Very high	19 Å²	19	23.9 Å²	23.9	13%	0.133	11%	0.113	C	C	.	.	H	α-helix	trans	-63.3	-27.9	169.7	85.4	0	0	0	0	111.6	E122 R297 E353 D354 S359	E122-S357 PolarHBondContact OE2-OG 3.38Å; R297-S357 PolarHBondContact NH1-O 3.03Å; R297-S357 VanDerWaalsContact NH1-O 3.09Å; R297-S357 PolarHBondContact NH2-O 2.92Å; R297-S357 VanDerWaalsContact NH2-O 3.11Å; E353-S357 WeakPolarHBondContact O-CB 3.4Å; E353-S357 PolarHBondContact O-N 3.41Å; D354-S357 PolarHBondContact O-OG 2.61Å; D354-S357 VanDerWaalsContact O-OG 3.05Å; S357-S359 PolarHBondContact OG-N 2.68Å
358	G	89	Confident	92.3	Very high	7 Å²	7	20.1 Å²	20.1	7%	0.072	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.5	36.4	-176.9	0	0	0	0	0	112.6	S293 D354 I355 V356 Q360	S293-G358 WeakPolarHBondContact CA-O 3.22Å; S293-G358 WeakPolarHBondContact O-CA 3.35Å; D354-G358 PolarHBondContact O-N 3.16Å; I355-G358 WeakPolarHBondContact O-CA 3.46Å; I355-G358 PolarHBondContact O-N 3.27Å; I355-G358 VanDerWaalsContact O-N 3.09Å; V356-G358 PolarHBondContact O-N 2.78Å; G358-Q360 PolarHBondContact O-N 3.03Å
359	S	90.8	Very high	92.6	Very high	15 Å²	15	20.3 Å²	20.3	11%	0.105	10%	0.1	C	C	.	.			trans	-66.3	93.7	-175.5	-162.5	0	0	0	0	111.7	E122 D354 S357 K361 L362 N363	E122-S359 WeakPolarHBondContact OE2-CB 3.45Å; E122-S359 PolarHBondContact OE2-OG 2.94Å; D354-S359 PolarHBondContact O-N 3.46Å; D354-S359 VanDerWaalsContact O-N 3.09Å; S357-S359 PolarHBondContact OG-N 2.68Å; S359-K361 VanDerWaalsContact C-N 3.27Å; S359-K361 PolarHBondContact O-N 2.74Å; S359-K361 VanDerWaalsContact O-N 3.12Å; S359-L362 PolarHBondContact O-N 2.77Å; S359-N363 PolarHBondContact N-ND2 2.98Å; S359-N363 WeakPolarHBondContact O-CB 3.49Å; S359-N363 PolarHBondContact O-N 3.07Å; S359-N363 PolarHBondContact O-ND2 3.32Å
360	Q	91.9	Very high	92.9	Very high	68 Å²	68	20.1 Å²	20.1	32%	0.318	10%	0.099	S	C	.	.	H	α-helix	trans	-50	-43.8	-170.1	-168.4	-174	-4.2	0	0	113.5	F292 G358 L364 E678	F292-Q360 HydrophobicContact CB-CG 3.93Å; G358-Q360 PolarHBondContact O-N 3.03Å; Q360-L364 WeakPolarHBondContact O-CB 3.4Å; Q360-L364 PolarHBondContact O-N 2.68Å; Q360-E678 PolarHBondContact NE2-OE1 3.45Å
361	K	92.2	Very high	93.1	Very high	61 Å²	61	19.6 Å²	19.6	27%	0.265	10%	0.096	S	C	.	.	H	α-helix	trans	-64.1	-45.3	179	-64.6	175.9	-178.9	160.4	0	112.4	E123 W231 S359 A365	E123-K361 HydrophobicContact CG-CD 4.25Å; E123-K361 WeakPolarHBondContact OE1-CD 3.35Å; E123-K361 IonicContact OE1-NZ 2.81Å; E123-K361 PolarHBondContact OE1-NZ 3.14Å; E123-K361 WeakPolarHBondContact OE2-CD 3.43Å; E123-K361 IonicContact OE2-NZ 2.97Å; E123-K361 PolarHBondContact OE2-NZ 3.02Å; W231-K361 HydrophobicContact CD2-CB 4.21Å; W231-K361 HydrophobicContact CD2-CD 3.86Å; W231-K361 HydrophobicContact CD2-CG 4.04Å; W231-K361 HydrophobicContact CE3-CB 4.12Å; W231-K361 HydrophobicContact CE3-CD 4.41Å; W231-K361 HydrophobicContact CE3-CG 4.46Å; W231-K361 HydrophobicContact CG-CD 4.01Å; W231-K361 HydrophobicContact CH2-CB 3.69Å; W231-K361 HydrophobicContact CH2-CG 4.17Å; W231-K361 VanDerWaalsContact CH2-O 3.29Å; W231-K361 WeakPolarHBondContact CH2-O 3.45Å; W231-K361 HydrophobicContact CZ2-CB 3.77Å; W231-K361 HydrophobicContact CZ2-CD 4.44Å; W231-K361 HydrophobicContact CZ2-CG 3.69Å; W231-K361 HydrophobicContact CZ3-CB 3.87Å; S359-K361 VanDerWaalsContact C-N 3.27Å; S359-K361 PolarHBondContact O-N 2.74Å; S359-K361 VanDerWaalsContact O-N 3.12Å; K361-A365 VanDerWaalsContact O-CB 3.31Å; K361-A365 WeakPolarHBondContact O-CB 3.24Å; K361-A365 PolarHBondContact O-N 3.29Å
362	L	93.8	Very high	93.1	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-75.1	-39.5	-175.6	-59.3	177.8	0	0	0	110.9	E122 F127 F349 V350 D354 S359 A365 F366	E122-L362 HydrophobicContact CB-CD1 3.73Å; F127-L362 HydrophobicContact CD1-CD2 4.46Å; F127-L362 HydrophobicContact CE1-CD2 4.01Å; F349-L362 HydrophobicContact CB-CD2 4.34Å; V350-L362 HydrophobicContact CG1-CB 3.61Å; D354-L362 HydrophobicContact CB-CD1 3.96Å; S359-L362 PolarHBondContact O-N 2.77Å; L362-A365 PolarHBondContact O-N 3.3Å; L362-F366 VanDerWaalsContact O-CB 3.27Å; L362-F366 WeakPolarHBondContact O-CB 3.39Å; L362-F366 PolarHBondContact O-N 3.39Å
363	N	95.1	Very high	93	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.1	-41.1	172.8	-73.7	-28.7	0	0	0	112.4	F292 V296 Y302 S359 L367	F292-N363 HydrophobicContact CB-CB 4.33Å; F292-N363 VanDerWaalsContact O-CB 3.23Å; F292-N363 WeakPolarHBondContact O-CB 3.47Å; F292-N363 PolarHBondContact O-ND2 3.14Å; F292-N363 VanDerWaalsContact O-ND2 3.11Å; V296-N363 HydrophobicContact CG2-CB 4.27Å; V296-N363 VanDerWaalsContact CG2-ND2 3.34Å; V296-N363 WeakPolarHBondContact CG2-ND2 3.33Å; Y302-N363 WeakPolarHBondContact OH-CA 3.29Å; Y302-N363 VanDerWaalsContact OH-CB 3.31Å; Y302-N363 WeakPolarHBondContact OH-CB 3.28Å; Y302-N363 PolarHBondContact OH-O 3.43Å; Y302-N363 VanDerWaalsContact OH-O 3.12Å; S359-N363 PolarHBondContact N-ND2 2.98Å; S359-N363 WeakPolarHBondContact O-CB 3.49Å; S359-N363 PolarHBondContact O-N 3.07Å; S359-N363 PolarHBondContact O-ND2 3.32Å; N363-L367 VanDerWaalsContact O-CB 3.27Å; N363-L367 WeakPolarHBondContact O-CB 3.06Å; N363-L367 PolarHBondContact O-N 3.06Å
364	L	95.3	Very high	93	Very high	10 Å²	10	17.4 Å²	17.4	5%	0.052	10%	0.096	C	C	.	.	H	α-helix	trans	-61.7	-46.5	171.3	173.5	61.2	0	0	0	111.5	W231 L239 E269 L272 F292 Q360 L367 A368	W231-L364 HydrophobicContact CH2-CD2 4.21Å; W231-L364 HydrophobicContact CZ2-CD2 4.23Å; L239-L364 HydrophobicContact CD1-CD2 4.41Å; L239-L364 HydrophobicContact CD2-CD1 4.22Å; E269-L364 HydrophobicContact CG-CD1 3.98Å; E269-L364 HydrophobicContact CG-CD2 4.09Å; L272-L364 HydrophobicContact CD1-CD1 3.77Å; F292-L364 HydrophobicContact CB-CB 4.47Å; F292-L364 HydrophobicContact CD1-CB 4.01Å; F292-L364 HydrophobicContact CD1-CD1 3.9Å; F292-L364 HydrophobicContact CE1-CB 4.49Å; F292-L364 HydrophobicContact CE1-CD1 3.5Å; F292-L364 HydrophobicContact CE2-CD1 4.26Å; F292-L364 HydrophobicContact CG-CB 4.16Å; F292-L364 HydrophobicContact CG-CD1 4.45Å; F292-L364 HydrophobicContact CZ-CD1 3.72Å; Q360-L364 WeakPolarHBondContact O-CB 3.4Å; Q360-L364 PolarHBondContact O-N 2.68Å; L364-L367 PolarHBondContact O-N 2.99Å; L364-A368 WeakPolarHBondContact O-CB 3.43Å; L364-A368 PolarHBondContact O-N 2.71Å
365	A	94.4	Very high	93	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.008	10%	0.102	C	C	.	.	H	α-helix	trans	-67.3	-39.3	-178.8	0	0	0	0	0	112.9	W231 L238 F349 K361 L362 N369	W231-A365 HydrophobicContact CZ3-CB 4.27Å; L238-A365 HydrophobicContact CD1-CB 3.59Å; F349-A365 HydrophobicContact CB-CB 4.11Å; F349-A365 HydrophobicContact CD1-CB 3.77Å; F349-A365 VanDerWaalsContact CD2-C 3.44Å; F349-A365 HydrophobicContact CD2-CB 3.59Å; F349-A365 WeakPolarHBondContact CD2-O 3.31Å; F349-A365 HydrophobicContact CE1-CB 3.97Å; F349-A365 HydrophobicContact CE2-CB 3.8Å; F349-A365 WeakPolarHBondContact CE2-O 3.47Å; F349-A365 HydrophobicContact CG-CB 3.55Å; F349-A365 HydrophobicContact CZ-CB 3.97Å; K361-A365 VanDerWaalsContact O-CB 3.31Å; K361-A365 WeakPolarHBondContact O-CB 3.24Å; K361-A365 PolarHBondContact O-N 3.29Å; L362-A365 PolarHBondContact O-N 3.3Å; A365-N369 WeakPolarHBondContact O-CB 3.25Å; A365-N369 PolarHBondContact O-N 3.42Å
366	F	95.2	Very high	92.9	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.3	-45.6	172.1	176.2	-123.5	0	0	0	111.4	Y302 L338 A341 C346 V350 L362 N369 L370	Y302-F366 HydrophobicContact CD1-CD1 4.29Å; Y302-F366 AromaticContact CD1-CE1 3.92Å; Y302-F366 HydrophobicContact CD1-CE1 3.92Å; Y302-F366 HydrophobicContact CD2-CE1 4.35Å; Y302-F366 AromaticContact CE1-CD1 3.75Å; Y302-F366 HydrophobicContact CE1-CD1 3.75Å; Y302-F366 AromaticContact CE1-CE1 3.87Å; Y302-F366 HydrophobicContact CE1-CE1 3.87Å; Y302-F366 HydrophobicContact CE2-CD1 4.2Å; Y302-F366 HydrophobicContact CE2-CE1 4.29Å; Y302-F366 HydrophobicContact CG-CE1 4.17Å; Y302-F366 AromaticContact CZ-CD1 3.71Å; L338-F366 HydrophobicContact CD2-CD2 4.5Å; L338-F366 HydrophobicContact CD2-CE1 4.36Å; L338-F366 HydrophobicContact CD2-CE2 3.77Å; L338-F366 HydrophobicContact CD2-CZ 3.69Å; A341-F366 HydrophobicContact CB-CE2 3.85Å; A341-F366 HydrophobicContact CB-CZ 3.86Å; C346-F366 WeakPolarHBondContact O-CE2 3.41Å; V350-F366 HydrophobicContact CG1-CB 4.15Å; V350-F366 HydrophobicContact CG2-CB 3.79Å; V350-F366 HydrophobicContact CG2-CD1 3.9Å; V350-F366 HydrophobicContact CG2-CD2 3.66Å; V350-F366 HydrophobicContact CG2-CE1 4.39Å; V350-F366 HydrophobicContact CG2-CE2 4.18Å; V350-F366 HydrophobicContact CG2-CG 3.51Å; L362-F366 VanDerWaalsContact O-CB 3.27Å; L362-F366 WeakPolarHBondContact O-CB 3.39Å; L362-F366 PolarHBondContact O-N 3.39Å; F366-N369 CarbonylContact O-C 3.34Å; F366-N369 PolarHBondContact O-N 3.1Å; F366-L370 HydrophobicContact CD1-CD1 4.16Å; F366-L370 HydrophobicContact CE1-CD1 3.73Å; F366-L370 HydrophobicContact CE2-CD1 4.23Å; F366-L370 HydrophobicContact CE2-CD2 4.43Å; F366-L370 HydrophobicContact CE2-CG 4.21Å; F366-L370 HydrophobicContact CZ-CD1 3.77Å; F366-L370 HydrophobicContact CZ-CD2 4.42Å; F366-L370 HydrophobicContact CZ-CG 4.22Å; F366-L370 PolarHBondContact O-N 2.96Å
367	L	95.5	Very high	92.7	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.9	-42.8	178.4	-167.3	78.1	0	0	0	112.5	L272 W275 V276 M289 F292 Y302 L305 N363 L364 N369 L370 F371	L272-L367 HydrophobicContact CB-CD2 3.92Å; L272-L367 HydrophobicContact CD1-CD2 4.37Å; L272-L367 HydrophobicContact CD2-CD2 4.14Å; L272-L367 HydrophobicContact CD2-CG 4.22Å; L272-L367 HydrophobicContact CG-CD2 4.38Å; W275-L367 HydrophobicContact CE3-CD1 4.46Å; W275-L367 HydrophobicContact CE3-CG 4.47Å; W275-L367 HydrophobicContact CZ3-CD1 3.8Å; W275-L367 HydrophobicContact CZ3-CG 4.02Å; V276-L367 HydrophobicContact CG2-CD1 3.56Å; V276-L367 HydrophobicContact CG2-CD2 3.75Å; V276-L367 HydrophobicContact CG2-CG 4.17Å; M289-L367 HydrophobicContact CE-CD2 4.26Å; M289-L367 HydrophobicContact SD-CD2 4.4Å; F292-L367 HydrophobicContact CD1-CD2 4.16Å; F292-L367 HydrophobicContact CE1-CD2 3.75Å; Y302-L367 HydrophobicContact CD1-CD1 4.49Å; Y302-L367 HydrophobicContact CE1-CD1 3.86Å; L305-L367 HydrophobicContact CD2-CD1 3.47Å; L305-L367 VanDerWaalsContact CD2-CD1 3.47Å; N363-L367 VanDerWaalsContact O-CB 3.27Å; N363-L367 WeakPolarHBondContact O-CB 3.06Å; N363-L367 PolarHBondContact O-N 3.06Å; L364-L367 PolarHBondContact O-N 2.99Å; L367-N369 VanDerWaalsContact C-N 3.29Å; L367-N369 PolarHBondContact O-N 3.19Å; L367-L370 WeakPolarHBondContact O-CB 3.41Å; L367-L370 PolarHBondContact O-N 2.97Å; L367-F371 PolarHBondContact O-N 2.8Å
368	A	95.3	Very high	92.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.4	-38.2	173.1	0	0	0	0	0	112.1	L238 L239 I242 L272 L364 F371 H372	L238-A368 HydrophobicContact CB-CB 4.13Å; L239-A368 HydrophobicContact CD2-CB 4.2Å; I242-A368 HydrophobicContact CD1-CB 3.91Å; L272-A368 HydrophobicContact CD1-CB 4.17Å; L364-A368 WeakPolarHBondContact O-CB 3.43Å; L364-A368 PolarHBondContact O-N 2.71Å; A368-F371 PolarHBondContact O-N 3.48Å; A368-H372 VanDerWaalsContact O-CG 3.29Å; A368-H372 PolarHBondContact O-N 3.25Å; A368-H372 PolarHBondContact O-ND1 3.17Å
369	N	93.3	Very high	91.6	Very high	13 Å²	13	32.1 Å²	32.1	7%	0.07	17%	0.17	C	C	.	.	H	α-helix	trans	-73.2	-27.7	176	-178.5	84.5	0	0	0	113.3	R133 C346 F349 A365 F366 L367 G373	R133-N369 PolarHBondContact NH1-OD1 3.28Å; R133-N369 PolarHBondContact NH2-OD1 2.97Å; C346-N369 WeakPolarHBondContact CA-ND2 3.15Å; C346-N369 PolarHBondContact O-ND2 2.97Å; F349-N369 HydrophobicContact CD2-CB 4.43Å; F349-N369 HydrophobicContact CE2-CB 4.06Å; A365-N369 WeakPolarHBondContact O-CB 3.25Å; A365-N369 PolarHBondContact O-N 3.42Å; F366-N369 CarbonylContact O-C 3.34Å; F366-N369 PolarHBondContact O-N 3.1Å; L367-N369 VanDerWaalsContact C-N 3.29Å; L367-N369 PolarHBondContact O-N 3.19Å; N369-G373 PolarHBondContact O-N 2.91Å
370	L	94.7	Very high	90.6	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.6	-48.3	167.2	-74.3	170.1	0	0	0	111	W275 Y302 L305 V306 I309 A341 C346 F366 L367 H372 G373 Y374	W275-L370 HydrophobicContact CH2-CB 4.23Å; Y302-L370 HydrophobicContact CD1-CD1 4.41Å; L305-L370 HydrophobicContact CD2-CD1 4.38Å; V306-L370 HydrophobicContact CG2-CD1 4.07Å; V306-L370 HydrophobicContact CG2-CD2 4.2Å; I309-L370 HydrophobicContact CD1-CB 4.29Å; I309-L370 HydrophobicContact CD1-CD2 4.35Å; A341-L370 HydrophobicContact CB-CD2 4.45Å; C346-L370 HydrophobicContact CB-CD2 3.64Å; C346-L370 HydrophobicContact CB-CG 4.45Å; F366-L370 HydrophobicContact CD1-CD1 4.16Å; F366-L370 HydrophobicContact CE1-CD1 3.73Å; F366-L370 HydrophobicContact CE2-CD1 4.23Å; F366-L370 HydrophobicContact CE2-CD2 4.43Å; F366-L370 HydrophobicContact CE2-CG 4.21Å; F366-L370 HydrophobicContact CZ-CD1 3.77Å; F366-L370 HydrophobicContact CZ-CD2 4.42Å; F366-L370 HydrophobicContact CZ-CG 4.22Å; F366-L370 PolarHBondContact O-N 2.96Å; L367-L370 WeakPolarHBondContact O-CB 3.41Å; L367-L370 PolarHBondContact O-N 2.97Å; L370-H372 PolarHBondContact O-N 3.04Å; L370-G373 PolarHBondContact O-N 3.28Å; L370-G373 VanDerWaalsContact O-N 3.12Å; L370-Y374 PolarHBondContact O-N 3.44Å
371	F	95.2	Very high	89.5	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-56.3	-51	177.5	175.5	-95.7	0	0	0	111.6	I242 H247 L250 L272 W275 L367 A368 G373 Y374 P375	I242-F371 HydrophobicContact CB-CE1 4.31Å; I242-F371 HydrophobicContact CD1-CD1 3.89Å; I242-F371 HydrophobicContact CD1-CG 4.5Å; I242-F371 HydrophobicContact CG1-CD1 3.79Å; I242-F371 HydrophobicContact CG1-CE1 3.95Å; I242-F371 HydrophobicContact CG2-CD1 4.22Å; I242-F371 HydrophobicContact CG2-CE1 3.97Å; I242-F371 HydrophobicContact CG2-CZ 4.34Å; H247-F371 HydrophobicContact CB-CZ 4.41Å; H247-F371 AromaticContact CD2-CE1 3.69Å; H247-F371 AromaticContact CD2-CZ 3.91Å; H247-F371 AromaticContact CG-CZ 3.98Å; H247-F371 AromaticContact NE2-CE1 3.67Å; L250-F371 HydrophobicContact CD1-CZ 4.43Å; L250-F371 HydrophobicContact CD2-CE2 3.78Å; L250-F371 HydrophobicContact CD2-CZ 3.84Å; L250-F371 HydrophobicContact CG-CZ 4.34Å; L272-F371 HydrophobicContact CD2-CB 3.77Å; L272-F371 HydrophobicContact CD2-CD2 4.44Å; L272-F371 HydrophobicContact CD2-CG 4.08Å; W275-F371 AromaticContact CD1-CD2 4Å; W275-F371 AromaticContact CD2-CD2 3.73Å; W275-F371 HydrophobicContact CD2-CD2 3.73Å; W275-F371 AromaticContact CE2-CD2 3.69Å; W275-F371 HydrophobicContact CE3-CB 4.3Å; W275-F371 HydrophobicContact CE3-CD2 4.23Å; W275-F371 AromaticContact CG-CD2 3.95Å; W275-F371 HydrophobicContact CG-CD2 3.95Å; W275-F371 HydrophobicContact CG-CE2 4.31Å; W275-F371 HydrophobicContact CH2-CB 4.05Å; W275-F371 HydrophobicContact CZ2-CB 4.32Å; W275-F371 HydrophobicContact CZ2-CD2 4.16Å; W275-F371 HydrophobicContact CZ3-CB 4.02Å; W275-F371 AromaticContact NE1-CD2 3.82Å; L367-F371 PolarHBondContact O-N 2.8Å; A368-F371 PolarHBondContact O-N 3.48Å; F371-G373 PolarHBondContact O-N 2.94Å; F371-Y374 CarbonylContact O-C 3.56Å; F371-Y374 PolarHBondContact O-N 3.49Å; F371-P375 HydrophobicContact CD2-CB 4.36Å; F371-P375 HydrophobicContact CE2-CB 3.96Å; F371-P375 HydrophobicContact CZ-CB 4.35Å; F371-P375 WeakPolarHBondContact O-CD 3.4Å; F371-P375 VanDerWaalsContact O-CG 3.26Å; F371-P375 WeakPolarHBondContact O-CG 3.5Å; F371-P375 VanDerWaalsContact O-N 3.17Å
372	H	91.5	Very high	88.3	Confident	61 Å²	61	43 Å²	43	28%	0.282	23%	0.231	S	C	.	.	H	α-helix	trans	-60.7	-27.8	177.2	-70.8	154.7	0	0	0	114.4	L238 A368 L370	L238-H372 PolarHBondContact O-CE1 3.31Å; L238-H372 PolarHBondContact O-NE2 2.91Å; A368-H372 VanDerWaalsContact O-CG 3.29Å; A368-H372 PolarHBondContact O-N 3.25Å; A368-H372 PolarHBondContact O-ND1 3.17Å; L370-H372 PolarHBondContact O-N 3.04Å
373	G	89.7	Confident	87	Confident	37 Å²	37	43.8 Å²	43.8	38%	0.381	24%	0.235	S	C	.	.	H	α-helix	trans	-78.7	-44.3	175.7	0	0	0	0	0	112.5	N369 L370 F371	N369-G373 PolarHBondContact O-N 2.91Å; L370-G373 PolarHBondContact O-N 3.28Å; L370-G373 VanDerWaalsContact O-N 3.12Å; F371-G373 PolarHBondContact O-N 2.94Å
374	Y	92.5	Very high	85.6	Confident	54 Å²	54	48.7 Å²	48.7	21%	0.212	26%	0.258	C	S	.	.			trans	-148.9	79.3	-169.1	-65.1	-77.7	0	0	0	111.9	W275 P311 K314 L344 L370 F371 A376	W275-Y374 WeakPolarHBondContact CZ2-O 2.92Å; P311-Y374 HydrophobicContact CG-CD1 3.91Å; P311-Y374 HydrophobicContact CG-CE1 3.37Å; K314-Y374 PolarHBondContact NZ-OH 3.43Å; L344-Y374 HydrophobicContact CB-CD2 4.11Å; L344-Y374 HydrophobicContact CB-CE2 3.69Å; L344-Y374 HydrophobicContact CD1-CD2 4.05Å; L344-Y374 HydrophobicContact CD1-CE2 4.34Å; L344-Y374 HydrophobicContact CD2-CD2 4.21Å; L344-Y374 HydrophobicContact CD2-CE2 3.78Å; L344-Y374 HydrophobicContact CG-CD2 4.35Å; L344-Y374 HydrophobicContact CG-CE2 4.13Å; L370-Y374 PolarHBondContact O-N 3.44Å; F371-Y374 CarbonylContact O-C 3.56Å; F371-Y374 PolarHBondContact O-N 3.49Å; Y374-A376 VanDerWaalsContact C-N 3.28Å; Y374-A376 PolarHBondContact O-N 2.92Å
375	P	91.7	Very high	84	Confident	23 Å²	23	56.4 Å²	56.4	15%	0.149	29%	0.294	C	S	.	.			trans	-62.4	-36.1	175.5	-20.7	31	0	0	0	112.5	W275 H279 F371 L377	W275-P375 PolarHBondContact NE1-O 3.06Å; H279-P375 PolarHBondContact NE2-O 2.98Å; F371-P375 HydrophobicContact CD2-CB 4.36Å; F371-P375 HydrophobicContact CE2-CB 3.96Å; F371-P375 HydrophobicContact CZ-CB 4.35Å; F371-P375 WeakPolarHBondContact O-CD 3.4Å; F371-P375 VanDerWaalsContact O-CG 3.26Å; F371-P375 WeakPolarHBondContact O-CG 3.5Å; F371-P375 VanDerWaalsContact O-N 3.17Å; P375-L377 PolarHBondContact O-N 3.42Å
376	A	91.4	Very high	82.8	Confident	54 Å²	54	61.9 Å²	61.9	45%	0.446	32%	0.318	S	S	.	.			trans	53.3	34	176.7	0	0	0	0	0	114.9	H279 I309 Y374	H279-A376 PolarHBondContact CE1-O 3.26Å; H279-A376 VanDerWaalsContact CE1-O 3.3Å; I309-A376 HydrophobicContact CB-CB 3.98Å; I309-A376 HydrophobicContact CG2-CB 4.11Å; Y374-A376 VanDerWaalsContact C-N 3.28Å; Y374-A376 PolarHBondContact O-N 2.92Å
377	L	89.6	Confident	81.5	Confident	21 Å²	21	62.4 Å²	62.4	11%	0.11	32%	0.321	C	S	.	.			trans	-105.6	147.1	173.8	-58.4	179.1	0	0	0	110.6	E249 L250 L253 Y278 P375	E249-L377 HydrophobicContact CB-CB 3.92Å; E249-L377 HydrophobicContact CG-CB 3.99Å; E249-L377 HydrophobicContact CG-CD1 4.47Å; L250-L377 HydrophobicContact CD2-CD1 4Å; L253-L377 HydrophobicContact CD1-CD1 4.09Å; L253-L377 HydrophobicContact CD2-CD1 4.19Å; L253-L377 HydrophobicContact CD2-CD2 4.07Å; L253-L377 HydrophobicContact CG-CD1 4.02Å; Y278-L377 HydrophobicContact CD1-CD2 3.66Å; Y278-L377 HydrophobicContact CE1-CD2 3.5Å; Y278-L377 HydrophobicContact CG-CD2 4.36Å; P375-L377 PolarHBondContact O-N 3.42Å
378	E	80.1	Confident	79.9	Confident	161 Å²	161	65.7 Å²	65.7	75%	0.752	35%	0.348	S	S	*	.			trans	-84.2	139	174.5	-66.5	-173.1	174.7	0	0	111.1	T252 Q380	T252-E378 WeakPolarHBondContact CG2-O 3.48Å; E378-Q380 PolarHBondContact O-N 3.47Å
379	K	74.4	Confident	78.6	Confident	96 Å²	96	73.1 Å²	73.1	42%	0.417	38%	0.383	S	S	.	.			trans	-85.5	114.1	-178.4	-171.7	172.5	-173.6	174.9	0	111.5	E249 E384	E249-K379 HydrophobicContact CB-CB 4.46Å; K379-E384 WeakPolarHBondContact CE-OE1 3.45Å; K379-E384 IonicContact NZ-OE1 3.59Å; K379-E384 PolarHBondContact NZ-OE1 2.88Å
380	Q	70.9	Confident	77.6	Confident	87 Å²	87	73.2 Å²	73.2	41%	0.407	38%	0.383	S	S	.	.			trans	-70	131.5	173.2	-68.9	-178.7	-11	0	0	111.2	T252 E378 E382 V383	T252-Q380 HydrophobicContact CG2-CG 4.05Å; E378-Q380 PolarHBondContact O-N 3.47Å; Q380-E382 VanDerWaalsContact C-N 3.34Å; Q380-E382 PolarHBondContact O-N 3.46Å; Q380-V383 HydrophobicContact CB-CG2 3.85Å
381	P	67.6	Low	76.7	Confident	122 Å²	122	78.8 Å²	78.8	79%	0.792	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-64.8	-31.5	-177.2	-25	35	0	0	0	115	V383	P381-V383 VanDerWaalsContact C-N 3.27Å; P381-V383 PolarHBondContact O-N 2.9Å
382	E	66.9	Low	76.3	Confident	164 Å²	164	82 Å²	82	77%	0.766	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-85.4	10.4	-166.6	-57.3	-175.5	175.5	0	0	114.6	Q380	Q380-E382 VanDerWaalsContact C-N 3.34Å; Q380-E382 PolarHBondContact O-N 3.46Å
383	V	67.7	Low	76.2	Confident	15 Å²	15	82 Å²	82	9%	0.091	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-113.1	-22.5	-166.5	-172.1	0	0	0	0	114.1	A251 I260 Q380 P381 E385 K386 V387	A251-V383 HydrophobicContact CB-CB 4.35Å; A251-V383 HydrophobicContact CB-CG1 3.69Å; A251-V383 HydrophobicContact CB-CG2 4.05Å; I260-V383 HydrophobicContact CD1-CG1 4.33Å; I260-V383 HydrophobicContact CG1-CG1 4.48Å; Q380-V383 HydrophobicContact CB-CG2 3.85Å; P381-V383 VanDerWaalsContact C-N 3.27Å; P381-V383 PolarHBondContact O-N 2.9Å; V383-E385 VanDerWaalsContact C-N 3.29Å; V383-E385 PolarHBondContact O-N 3.5Å; V383-K386 PolarHBondContact O-N 3.14Å; V383-V387 HydrophobicContact CG1-CG2 3.72Å; V383-V387 WeakPolarHBondContact O-CG2 3.46Å; V383-V387 PolarHBondContact O-N 2.84Å; V383-V387 VanDerWaalsContact O-N 3.13Å
384	E	65.2	Low	76.1	Confident	103 Å²	103	83.4 Å²	83.4	48%	0.481	42%	0.422	S	S	.	.	H	α-helix	trans	-54.6	-42.4	-177	-66.7	-167.4	159.4	0	0	113	K379 A388	K379-E384 WeakPolarHBondContact CE-OE1 3.45Å; K379-E384 IonicContact NZ-OE1 3.59Å; K379-E384 PolarHBondContact NZ-OE1 2.88Å; E384-A388 PolarHBondContact O-N 3.4Å
385	E	62.3	Low	76	Confident	172 Å²	172	84.4 Å²	84.4	80%	0.804	43%	0.429	S	S	*	.	H	α-helix	trans	-68.9	-44	-176.3	-171.5	168.3	-145.5	0	0	112.4	V383 V387 A388	V383-E385 VanDerWaalsContact C-N 3.29Å; V383-E385 PolarHBondContact O-N 3.5Å; E385-V387 VanDerWaalsContact C-N 3.32Å; E385-V387 PolarHBondContact O-N 3.21Å; E385-A388 WeakPolarHBondContact O-CB 3.44Å; E385-A388 PolarHBondContact O-N 3.18Å
386	K	67.7	Low	76	Confident	117 Å²	117	83.7 Å²	83.7	51%	0.509	42%	0.423	S	S	.	.	H	α-helix	trans	-67.4	-33.1	178.2	-64.6	173.7	-176.3	163.3	0	112.3	I260 V383 A388 E389	I260-K386 HydrophobicContact CG2-CB 4.12Å; I260-K386 HydrophobicContact CG2-CD 4.48Å; V383-K386 PolarHBondContact O-N 3.14Å; K386-A388 VanDerWaalsContact C-N 3.31Å; K386-A388 PolarHBondContact O-N 3.2Å; K386-E389 PolarHBondContact O-N 3.03Å
387	V	68.5	Low	76	Confident	10 Å²	10	84.2 Å²	84.2	6%	0.061	42%	0.416	C	S	.	.	H	α-helix	trans	-68	-30.8	177.5	165.1	0	0	0	0	112	V244 V245 I260 V383 E385 E389 I390	V244-V387 HydrophobicContact CB-CG2 4.39Å; V244-V387 VanDerWaalsContact O-CG1 3.25Å; V244-V387 WeakPolarHBondContact O-CG1 3.3Å; V245-V387 HydrophobicContact CB-CG1 4.41Å; V245-V387 HydrophobicContact CG2-CG1 4.35Å; I260-V387 HydrophobicContact CD1-CG2 4.45Å; I260-V387 HydrophobicContact CG1-CG2 4.19Å; V383-V387 HydrophobicContact CG1-CG2 3.72Å; V383-V387 WeakPolarHBondContact O-CG2 3.46Å; V383-V387 PolarHBondContact O-N 2.84Å; V383-V387 VanDerWaalsContact O-N 3.13Å; E385-V387 VanDerWaalsContact C-N 3.32Å; E385-V387 PolarHBondContact O-N 3.21Å; V387-E389 VanDerWaalsContact C-N 3.26Å; V387-E389 PolarHBondContact O-N 3.14Å; V387-I390 WeakPolarHBondContact O-CB 3.47Å; V387-I390 PolarHBondContact O-N 3.21Å; V387-I390 VanDerWaalsContact O-N 3.17Å
388	A	62.4	Low	76.2	Confident	70 Å²	70	83.6 Å²	83.6	58%	0.579	41%	0.413	S	S	*	.	H	α-helix	trans	-65.9	-25.8	177.2	0	0	0	0	0	113.3	E384 E385 K386 I390	E384-A388 PolarHBondContact O-N 3.4Å; E385-A388 WeakPolarHBondContact O-CB 3.44Å; E385-A388 PolarHBondContact O-N 3.18Å; K386-A388 VanDerWaalsContact C-N 3.31Å; K386-A388 PolarHBondContact O-N 3.2Å; A388-I390 PolarHBondContact O-N 3.25Å
389	E	66.7	Low	76.9	Confident	155 Å²	155	76 Å²	76	72%	0.724	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-12.8	176.1	-56.8	-164.6	127.5	0	0	113.6	K386 V387	K386-E389 PolarHBondContact O-N 3.03Å; V387-E389 VanDerWaalsContact C-N 3.26Å; V387-E389 PolarHBondContact O-N 3.14Å
390	I	72.7	Confident	77.8	Confident	15 Å²	15	73.7 Å²	73.7	8%	0.077	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-11.9	-173.2	-60.7	174.5	0	0	0	112.1	V244 V245 I260 N261 A264 V387 A388 E392	V244-I390 HydrophobicContact CG2-CD1 4.34Å; V244-I390 HydrophobicContact CG2-CG2 4.34Å; V245-I390 HydrophobicContact CG2-CB 4.26Å; V245-I390 HydrophobicContact CG2-CG2 4.07Å; I260-I390 HydrophobicContact CG1-CD1 3.9Å; I260-I390 HydrophobicContact CG2-CD1 4.16Å; N261-I390 WeakPolarHBondContact OD1-CD1 3.48Å; N261-I390 WeakPolarHBondContact OD1-CG1 3.2Å; A264-I390 HydrophobicContact CB-CD1 4.2Å; A264-I390 HydrophobicContact CB-CG2 3.69Å; V387-I390 WeakPolarHBondContact O-CB 3.47Å; V387-I390 PolarHBondContact O-N 3.21Å; V387-I390 VanDerWaalsContact O-N 3.17Å; A388-I390 PolarHBondContact O-N 3.25Å; I390-E392 PolarHBondContact O-N 3.26Å
391	E	77.1	Confident	78.9	Confident	118 Å²	118	70.3 Å²	70.3	55%	0.551	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-53	123.9	-173.8	-169.8	175.2	-175.4	0	0	113	V245 T393	V245-E391 HydrophobicContact CG1-CG 4.48Å; E391-T393 PolarHBondContact O-N 3.37Å
392	E	85.7	Confident	80.2	Confident	67 Å²	67	64.5 Å²	64.5	31%	0.313	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-65.7	122.2	178.3	178.8	-177.8	-138.4	0	0	110.5	I390 E396 K397 R400	I390-E392 PolarHBondContact O-N 3.26Å; E392-E396 HydrophobicContact CG-CB 3.84Å; E392-K397 HydrophobicContact CG-CB 4.01Å; E392-K397 VanDerWaalsContact OE1-CA 3.25Å; E392-K397 WeakPolarHBondContact OE1-CA 3.47Å; E392-K397 PolarHBondContact OE1-N 2.87Å; E392-R400 VanDerWaalsContact CD-NH2 3.33Å; E392-R400 IonicContact OE1-CZ 3.97Å; E392-R400 IonicContact OE1-NE 3.8Å; E392-R400 IonicContact OE1-NH1 3.44Å; E392-R400 PolarHBondContact OE1-NH1 3.47Å; E392-R400 IonicContact OE1-NH2 2.71Å; E392-R400 PolarHBondContact OE1-NH2 3.42Å; E392-R400 VanDerWaalsContact OE1-NH2 3.09Å; E392-R400 IonicContact OE2-CZ 3.58Å; E392-R400 VanDerWaalsContact OE2-CZ 3.24Å; E392-R400 IonicContact OE2-NH1 3.73Å; E392-R400 PolarHBondContact OE2-NH1 2.98Å; E392-R400 IonicContact OE2-NH2 2.99Å; E392-R400 PolarHBondContact OE2-NH2 3.23Å
393	T	89.2	Confident	81.6	Confident	61 Å²	61	56.7 Å²	56.7	37%	0.374	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-71.4	155.6	179.7	71.6	0	0	0	0	111.8	E391 E395 E396 K397	E391-T393 PolarHBondContact O-N 3.37Å; T393-E395 PolarHBondContact O-N 2.99Å; T393-E395 VanDerWaalsContact O-N 3.16Å; T393-E396 PolarHBondContact N-OE2 3.19Å; T393-E396 PolarHBondContact O-N 3.03Å; T393-E396 VanDerWaalsContact O-N 3.16Å; T393-E396 WeakPolarHBondContact OG1-CB 3.32Å; T393-E396 VanDerWaalsContact OG1-CG 3.25Å; T393-E396 WeakPolarHBondContact OG1-CG 3.48Å; T393-E396 PolarHBondContact OG1-N 2.85Å; T393-E396 PolarHBondContact OG1-OE1 3.41Å; T393-E396 PolarHBondContact OG1-OE2 2.93Å; T393-K397 WeakPolarHBondContact O-CB 3.39Å; T393-K397 PolarHBondContact O-N 3.38Å
394	R	88	Confident	82.9	Confident	67 Å²	67	56.9 Å²	56.9	25%	0.253	28%	0.277	S	S	.	.	H	α-helix	trans	-57.9	-31	177.1	-167	171.2	74.3	-127.4	-0	112.7	T398 M618 D621 E624	R394-T398 WeakPolarHBondContact O-CB 3.45Å; R394-T398 PolarHBondContact O-N 2.94Å; R394-T398 PolarHBondContact O-OG1 3.17Å; R394-M618 HydrophobicContact CG-CB 4.42Å; R394-M618 HydrophobicContact CG-CG 4.07Å; R394-D621 IonicContact CZ-OD1 2.82Å; R394-D621 IonicContact NE-OD1 2.68Å; R394-D621 PolarHBondContact NE-OD1 2.95Å; R394-D621 IonicContact NH2-OD1 2.7Å; R394-D621 PolarHBondContact NH2-OD1 3.08Å; R394-E624 IonicContact CZ-OE1 3.27Å; R394-E624 IonicContact CZ-OE2 3.83Å; R394-E624 IonicContact NH1-OE1 2.73Å; R394-E624 PolarHBondContact NH1-OE1 3.31Å; R394-E624 IonicContact NH1-OE2 3.54Å; R394-E624 PolarHBondContact NH1-OE2 3.13Å; R394-E624 VanDerWaalsContact NH2-CD 3.29Å; R394-E624 IonicContact NH2-OE1 2.65Å; R394-E624 IonicContact NH2-OE2 3.64Å; R394-E624 PolarHBondContact NH2-OE2 3.33Å
395	E	90	Very high	84.2	Confident	74 Å²	74	52 Å²	52	35%	0.346	25%	0.254	S	S	.	.	H	α-helix	trans	-71.9	-47.8	175.8	-179.6	162.8	-174.1	0	0	111.5	T393 K397 T398 Y399 K628	T393-E395 PolarHBondContact O-N 2.99Å; T393-E395 VanDerWaalsContact O-N 3.16Å; E395-K397 PolarHBondContact O-N 3.11Å; E395-T398 WeakPolarHBondContact O-CB 3.26Å; E395-T398 PolarHBondContact O-N 3.31Å; E395-T398 VanDerWaalsContact O-N 3.13Å; E395-Y399 HydrophobicContact CG-CD2 4.04Å; E395-Y399 HydrophobicContact CG-CE2 3.28Å; E395-Y399 WeakPolarHBondContact O-CD2 3.39Å; E395-Y399 PolarHBondContact O-N 3.21Å; E395-Y399 WeakPolarHBondContact OE1-CE2 3.43Å; E395-Y399 PolarHBondContact OE1-OH 3.2Å; E395-K628 IonicContact OE1-NZ 3.41Å
396	E	92.7	Very high	85.6	Confident	8 Å²	8	45.2 Å²	45.2	4%	0.037	22%	0.223	C	C	.	.	H	α-helix	trans	-55.4	-52.7	174	-75.5	156.8	-168	0	0	111.9	E392 T393 T398 Y399 R400 L415 F416 R488 L492	E392-E396 HydrophobicContact CG-CB 3.84Å; T393-E396 PolarHBondContact N-OE2 3.19Å; T393-E396 PolarHBondContact O-N 3.03Å; T393-E396 VanDerWaalsContact O-N 3.16Å; T393-E396 WeakPolarHBondContact OG1-CB 3.32Å; T393-E396 VanDerWaalsContact OG1-CG 3.25Å; T393-E396 WeakPolarHBondContact OG1-CG 3.48Å; T393-E396 PolarHBondContact OG1-N 2.85Å; T393-E396 PolarHBondContact OG1-OE1 3.41Å; T393-E396 PolarHBondContact OG1-OE2 2.93Å; E396-T398 PolarHBondContact O-N 2.83Å; E396-Y399 PolarHBondContact O-N 2.94Å; E396-Y399 VanDerWaalsContact O-N 3.09Å; E396-R400 PolarHBondContact O-N 3.11Å; E396-L415 HydrophobicContact CB-CD1 3.82Å; E396-L415 HydrophobicContact CG-CD1 4.04Å; E396-L415 WeakPolarHBondContact O-CD1 3.36Å; E396-F416 HydrophobicContact CG-CE2 3.94Å; E396-F416 HydrophobicContact CG-CZ 3.64Å; E396-F416 WeakPolarHBondContact OE1-CE2 3.35Å; E396-F416 VanDerWaalsContact OE1-CZ 3.25Å; E396-F416 WeakPolarHBondContact OE1-CZ 3.29Å; E396-R488 IonicContact OE1-CZ 3.41Å; E396-R488 IonicContact OE1-NE 2.81Å; E396-R488 PolarHBondContact OE1-NE 2.9Å; E396-R488 IonicContact OE1-NH2 3.56Å; E396-R488 PolarHBondContact OE1-NH2 2.61Å; E396-R488 IonicContact OE2-NH2 3.17Å; E396-R488 PolarHBondContact OE2-NH2 3.25Å; E396-L492 HydrophobicContact CG-CD1 4.23Å; E396-L492 HydrophobicContact CG-CD2 3.72Å
397	K	91.2	Very high	86.5	Confident	66 Å²	66	41 Å²	41	29%	0.287	21%	0.213	S	C	.	.	H	α-helix	trans	-54.3	-38.4	176.2	178.3	169.6	174.6	-169.4	0	113	E392 T393 E395 N401	E392-K397 HydrophobicContact CG-CB 4.01Å; E392-K397 VanDerWaalsContact OE1-CA 3.25Å; E392-K397 WeakPolarHBondContact OE1-CA 3.47Å; E392-K397 PolarHBondContact OE1-N 2.87Å; T393-K397 WeakPolarHBondContact O-CB 3.39Å; T393-K397 PolarHBondContact O-N 3.38Å; E395-K397 PolarHBondContact O-N 3.11Å; K397-N401 VanDerWaalsContact O-CB 3.26Å; K397-N401 WeakPolarHBondContact O-CB 3.36Å; K397-N401 PolarHBondContact O-N 3.26Å; K397-N401 PolarHBondContact O-OD1 2.9Å; K397-N401 VanDerWaalsContact O-OD1 3.09Å
398	T	92.9	Very high	87.6	Confident	7 Å²	7	41.5 Å²	41.5	4%	0.043	21%	0.214	C	C	.	.	H	α-helix	trans	-69.7	-42.9	179.4	-59.9	0	0	0	0	111.2	R394 E395 E396 W402 M499 M629	R394-T398 WeakPolarHBondContact O-CB 3.45Å; R394-T398 PolarHBondContact O-N 2.94Å; R394-T398 PolarHBondContact O-OG1 3.17Å; E395-T398 WeakPolarHBondContact O-CB 3.26Å; E395-T398 PolarHBondContact O-N 3.31Å; E395-T398 VanDerWaalsContact O-N 3.13Å; E396-T398 PolarHBondContact O-N 2.83Å; T398-W402 WeakPolarHBondContact O-CB 3.3Å; T398-W402 PolarHBondContact O-N 2.64Å; T398-M499 HydrophobicContact CG2-CE 4.2Å; T398-M629 HydrophobicContact CG2-CE 3.69Å
399	Y	95.2	Very high	88.5	Confident	1 Å²	1	41.4 Å²	41.4	0%	0.004	21%	0.207	C	C	.	.	H	α-helix	trans	-67.6	-43.8	175.9	-61.1	-40	0	0	0	112.4	E395 E396 N401 W402 I403 L492 L495 W496 M499	E395-Y399 HydrophobicContact CG-CD2 4.04Å; E395-Y399 HydrophobicContact CG-CE2 3.28Å; E395-Y399 WeakPolarHBondContact O-CD2 3.39Å; E395-Y399 PolarHBondContact O-N 3.21Å; E395-Y399 WeakPolarHBondContact OE1-CE2 3.43Å; E395-Y399 PolarHBondContact OE1-OH 3.2Å; E396-Y399 PolarHBondContact O-N 2.94Å; E396-Y399 VanDerWaalsContact O-N 3.09Å; Y399-N401 PolarHBondContact O-N 3.47Å; Y399-W402 HydrophobicContact CD1-CE3 4.37Å; Y399-W402 PolarHBondContact O-N 2.84Å; Y399-I403 WeakPolarHBondContact O-CB 3.34Å; Y399-I403 WeakPolarHBondContact O-CG1 3.25Å; Y399-I403 PolarHBondContact O-N 2.7Å; Y399-L492 HydrophobicContact CD2-CD2 3.69Å; Y399-L492 HydrophobicContact CE2-CD2 3.83Å; Y399-L495 HydrophobicContact CD1-CB 4.29Å; Y399-L495 HydrophobicContact CD2-CB 3.71Å; Y399-L495 HydrophobicContact CD2-CD1 3.97Å; Y399-L495 HydrophobicContact CD2-CG 4.5Å; Y399-L495 HydrophobicContact CE2-CB 3.97Å; Y399-L495 HydrophobicContact CG-CB 3.91Å; Y399-L495 HydrophobicContact CG-CD1 4.26Å; Y399-W496 WeakPolarHBondContact OH-CA 3.41Å; Y399-W496 WeakPolarHBondContact OH-CB 3.35Å; Y399-M499 HydrophobicContact CD1-CB 4.45Å; Y399-M499 HydrophobicContact CD1-SD 3.81Å; Y399-M499 HydrophobicContact CE1-CB 4.17Å; Y399-M499 HydrophobicContact CE1-SD 3.65Å
400	R	94.4	Very high	89.4	Confident	49 Å²	49	38.2 Å²	38.2	19%	0.185	20%	0.195	C	C	.	.	H	α-helix	trans	-57.5	-50.4	175	-177.3	-169.8	66.7	-141.5	-23.9	111.2	E392 E396 W402 I403 N404 V412 N413 L415	E392-R400 VanDerWaalsContact CD-NH2 3.33Å; E392-R400 IonicContact OE1-CZ 3.97Å; E392-R400 IonicContact OE1-NE 3.8Å; E392-R400 IonicContact OE1-NH1 3.44Å; E392-R400 PolarHBondContact OE1-NH1 3.47Å; E392-R400 IonicContact OE1-NH2 2.71Å; E392-R400 PolarHBondContact OE1-NH2 3.42Å; E392-R400 VanDerWaalsContact OE1-NH2 3.09Å; E392-R400 IonicContact OE2-CZ 3.58Å; E392-R400 VanDerWaalsContact OE2-CZ 3.24Å; E392-R400 IonicContact OE2-NH1 3.73Å; E392-R400 PolarHBondContact OE2-NH1 2.98Å; E392-R400 IonicContact OE2-NH2 2.99Å; E392-R400 PolarHBondContact OE2-NH2 3.23Å; E396-R400 PolarHBondContact O-N 3.11Å; R400-W402 VanDerWaalsContact C-N 3.32Å; R400-W402 PolarHBondContact O-N 3.12Å; R400-I403 PolarHBondContact O-N 2.98Å; R400-N404 VanDerWaalsContact O-CG 3.31Å; R400-N404 PolarHBondContact O-N 2.96Å; R400-V412 HydrophobicContact CB-CG1 4.49Å; R400-V412 VanDerWaalsContact CD-O 3.22Å; R400-V412 WeakPolarHBondContact CD-O 3.25Å; R400-V412 HydrophobicContact CG-CB 4.07Å; R400-V412 HydrophobicContact CG-CG1 3.89Å; R400-V412 VanDerWaalsContact CG-O 3.25Å; R400-V412 WeakPolarHBondContact CG-O 3.17Å; R400-N413 WeakPolarHBondContact CD-O 3.22Å; R400-N413 PolarHBondContact NH1-O 3.4Å; R400-L415 HydrophobicContact CB-CD2 4.37Å; R400-L415 HydrophobicContact CB-CG 4.38Å
401	N	94	Very high	90	Very high	15 Å²	15	41.7 Å²	41.7	8%	0.08	21%	0.214	C	C	.	.	H	α-helix	trans	-62.4	-39.8	-179.5	-72.7	20.3	0	0	0	111.7	A205 I206 K397 Y399 S405	A205-N401 PolarHBondContact O-ND2 2.67Å; I206-N401 WeakPolarHBondContact CA-ND2 3.35Å; I206-N401 PolarHBondContact O-ND2 2.92Å; K397-N401 VanDerWaalsContact O-CB 3.26Å; K397-N401 WeakPolarHBondContact O-CB 3.36Å; K397-N401 PolarHBondContact O-N 3.26Å; K397-N401 PolarHBondContact O-OD1 2.9Å; K397-N401 VanDerWaalsContact O-OD1 3.09Å; Y399-N401 PolarHBondContact O-N 3.47Å; N401-S405 VanDerWaalsContact O-CB 3.25Å; N401-S405 WeakPolarHBondContact O-CB 3.31Å; N401-S405 PolarHBondContact O-N 3.14Å; N401-S405 PolarHBondContact O-OG 2.92Å
402	W	94.6	Very high	90.7	Very high	1 Å²	1	36 Å²	36	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-52.9	172.8	168.2	46.8	0	0	0	111.6	T398 Y399 R400 N404 S405 L406 L428 L498 M499 Y502 Y616	T398-W402 WeakPolarHBondContact O-CB 3.3Å; T398-W402 PolarHBondContact O-N 2.64Å; Y399-W402 HydrophobicContact CD1-CE3 4.37Å; Y399-W402 PolarHBondContact O-N 2.84Å; R400-W402 VanDerWaalsContact C-N 3.32Å; R400-W402 PolarHBondContact O-N 3.12Å; W402-N404 PolarHBondContact O-N 3.04Å; W402-S405 PolarHBondContact O-N 2.9Å; W402-S405 PolarHBondContact O-OG 3.28Å; W402-L406 HydrophobicContact CZ2-CD1 4.41Å; W402-L406 PolarHBondContact O-N 3.36Å; W402-L428 HydrophobicContact CH2-CD2 3.66Å; W402-L428 HydrophobicContact CZ2-CD2 3.83Å; W402-L428 HydrophobicContact CZ3-CD2 4.17Å; W402-L498 HydrophobicContact CH2-CB 3.99Å; W402-L498 HydrophobicContact CZ3-CB 4.39Å; W402-M499 HydrophobicContact CB-CE 4.29Å; W402-M499 HydrophobicContact CD2-CB 4.44Å; W402-M499 HydrophobicContact CD2-CG 3.95Å; W402-M499 HydrophobicContact CE3-CB 3.89Å; W402-M499 HydrophobicContact CE3-CG 3.84Å; W402-M499 HydrophobicContact CE3-SD 4.42Å; W402-M499 HydrophobicContact CG-CE 4.26Å; W402-M499 HydrophobicContact CH2-CB 3.85Å; W402-M499 HydrophobicContact CH2-CG 4.29Å; W402-M499 HydrophobicContact CZ2-CB 4.38Å; W402-M499 HydrophobicContact CZ2-CG 4.4Å; W402-M499 HydrophobicContact CZ3-CB 3.57Å; W402-M499 HydrophobicContact CZ3-CG 4.02Å; W402-Y502 AromaticContact CZ2-CD1 3.96Å; W402-Y502 HydrophobicContact CZ2-CD1 3.96Å; W402-Y502 HydrophobicContact CZ2-CD2 4.42Å; W402-Y502 AromaticContact CZ2-CG 3.79Å; W402-Y502 HydrophobicContact CZ2-CG 3.79Å; W402-Y502 AromaticContact NE1-CD1 3.59Å; W402-Y502 AromaticContact NE1-CE1 3.63Å; W402-Y616 HydrophobicContact CB-CD1 4.15Å; W402-Y616 HydrophobicContact CB-CD2 4.49Å; W402-Y616 HydrophobicContact CB-CE1 4.17Å; W402-Y616 HydrophobicContact CB-CE2 4.49Å; W402-Y616 HydrophobicContact CB-CG 4.34Å; W402-Y616 AromaticContact CD1-CE2 3.68Å; W402-Y616 AromaticContact CD1-CZ 3.68Å; W402-Y616 HydrophobicContact CG-CE2 4.33Å
403	I	95.4	Very high	90.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-57.8	-52.2	-178.2	-68.5	166.8	0	0	0	111.6	Y399 R400 S405 L406 Y408 V412 L415 I424 L428 L495	Y399-I403 WeakPolarHBondContact O-CB 3.34Å; Y399-I403 WeakPolarHBondContact O-CG1 3.25Å; Y399-I403 PolarHBondContact O-N 2.7Å; R400-I403 PolarHBondContact O-N 2.98Å; I403-S405 PolarHBondContact O-N 2.67Å; I403-L406 WeakPolarHBondContact O-CB 3.38Å; I403-L406 PolarHBondContact O-N 3.17Å; I403-Y408 HydrophobicContact CG2-CD2 3.97Å; I403-Y408 HydrophobicContact CG2-CE2 4.07Å; I403-V412 HydrophobicContact CG2-CG2 3.77Å; I403-L415 HydrophobicContact CD1-CD2 3.89Å; I403-I424 HydrophobicContact CG2-CG2 3.69Å; I403-L428 HydrophobicContact CD1-CD1 4.2Å; I403-L428 HydrophobicContact CG1-CD1 4.09Å; I403-L428 HydrophobicContact CG1-CD2 4.34Å; I403-L495 HydrophobicContact CD1-CD2 3.89Å
404	N	94.3	Very high	90.9	Very high	18 Å²	18	34.9 Å²	34.9	10%	0.096	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-32.5	-177.5	-65.6	-6.5	0	0	0	111.8	R400 W402 L406 G407 N411 V412	R400-N404 VanDerWaalsContact O-CG 3.31Å; R400-N404 PolarHBondContact O-N 2.96Å; W402-N404 PolarHBondContact O-N 3.04Å; N404-L406 PolarHBondContact O-N 2.69Å; N404-G407 PolarHBondContact O-N 3.27Å; N404-G407 VanDerWaalsContact O-N 3.15Å; N404-N411 VanDerWaalsContact CG-OD1 3.27Å; N404-N411 PolarHBondContact ND2-OD1 2.89Å; N404-V412 PolarHBondContact ND2-O 3.05Å; N404-V412 WeakPolarHBondContact OD1-CB 3.41Å; N404-V412 PolarHBondContact OD1-N 2.93Å
405	S	92.9	Very high	91.1	Very high	1 Å²	1	32 Å²	32	1%	0.007	17%	0.167	C	C	.	.	H	α-helix	trans	-72.6	-12.3	179.5	83.3	0	0	0	0	115.1	R204 C208 N401 W402 I403 G407 Y616	R204-S405 VanDerWaalsContact CG-CB 3.42Å; R204-S405 WeakPolarHBondContact CG-OG 3.4Å; R204-S405 WeakPolarHBondContact O-CB 3.35Å; C208-S405 WeakPolarHBondContact O-CA 3.22Å; C208-S405 WeakPolarHBondContact O-CB 3.46Å; N401-S405 VanDerWaalsContact O-CB 3.25Å; N401-S405 WeakPolarHBondContact O-CB 3.31Å; N401-S405 PolarHBondContact O-N 3.14Å; N401-S405 PolarHBondContact O-OG 2.92Å; W402-S405 PolarHBondContact O-N 2.9Å; W402-S405 PolarHBondContact O-OG 3.28Å; I403-S405 PolarHBondContact O-N 2.67Å; S405-G407 VanDerWaalsContact C-N 3.31Å; S405-Y616 PolarHBondContact OG-OH 3.43Å; S405-Y616 VanDerWaalsContact OG-OH 3.11Å
406	L	91.4	Very high	91.2	Very high	30 Å²	30	29.2 Å²	29.2	16%	0.157	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-10.5	171.3	-59.3	175.2	0	0	0	112.8	W402 I403 N404 Y408 L428 Y502	W402-L406 HydrophobicContact CZ2-CD1 4.41Å; W402-L406 PolarHBondContact O-N 3.36Å; I403-L406 WeakPolarHBondContact O-CB 3.38Å; I403-L406 PolarHBondContact O-N 3.17Å; N404-L406 PolarHBondContact O-N 2.69Å; L406-Y408 HydrophobicContact CB-CE1 4.22Å; L406-Y408 HydrophobicContact CB-CE2 4.23Å; L406-Y408 HydrophobicContact CD1-CE2 4.1Å; L406-Y408 VanDerWaalsContact CD1-OH 3.32Å; L406-Y408 WeakPolarHBondContact CD1-OH 3.28Å; L406-L428 HydrophobicContact CD1-CD2 3.59Å; L406-Y502 HydrophobicContact CD2-CE2 4.27Å
407	G	88.1	Confident	91.2	Very high	28 Å²	28	34.6 Å²	34.6	29%	0.289	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.1	27.1	169.2	0	0	0	0	0	116.4	N209 N404 S405	N209-G407 VanDerWaalsContact CG-CA 3.46Å; N209-G407 WeakPolarHBondContact ND2-CA 3.41Å; N404-G407 PolarHBondContact O-N 3.27Å; N404-G407 VanDerWaalsContact O-N 3.15Å; S405-G407 VanDerWaalsContact C-N 3.31Å
408	Y	90.3	Very high	91.3	Very high	21 Å²	21	33 Å²	33	8%	0.082	17%	0.17	C	C	.	.			trans	-61.4	158.2	172.5	-55.9	-40	0	0	0	112.5	I403 L406 N410 I424 R427 L428 S431 F666	I403-Y408 HydrophobicContact CG2-CD2 3.97Å; I403-Y408 HydrophobicContact CG2-CE2 4.07Å; L406-Y408 HydrophobicContact CB-CE1 4.22Å; L406-Y408 HydrophobicContact CB-CE2 4.23Å; L406-Y408 HydrophobicContact CD1-CE2 4.1Å; L406-Y408 VanDerWaalsContact CD1-OH 3.32Å; L406-Y408 WeakPolarHBondContact CD1-OH 3.28Å; Y408-N410 VanDerWaalsContact C-N 3.29Å; Y408-N410 PolarHBondContact O-N 3.41Å; Y408-I424 HydrophobicContact CD2-CG2 4.01Å; Y408-I424 HydrophobicContact CE2-CG2 4.15Å; Y408-R427 HydrophobicContact CD1-CB 3.97Å; Y408-R427 HydrophobicContact CE1-CB 3.65Å; Y408-R427 HydrophobicContact CE2-CB 4.31Å; Y408-R427 HydrophobicContact CG-CB 4.44Å; Y408-R427 PolarHBondContact OH-O 3.41Å; Y408-L428 HydrophobicContact CE2-CD2 4.05Å; Y408-L428 HydrophobicContact CE2-CG 4.03Å; Y408-L428 WeakPolarHBondContact OH-CA 3.22Å; Y408-L428 VanDerWaalsContact OH-CD2 3.31Å; Y408-L428 WeakPolarHBondContact OH-CD2 3.37Å; Y408-L428 PolarHBondContact OH-N 2.7Å; Y408-S431 PolarHBondContact OH-OG 3.3Å; Y408-S431 VanDerWaalsContact OH-OG 3.13Å; Y408-F666 HydrophobicContact CD1-CZ 4.39Å; Y408-F666 HydrophobicContact CE1-CE2 4.49Å; Y408-F666 HydrophobicContact CE1-CZ 4.02Å
409	P	82.2	Confident	91.4	Very high	68 Å²	68	32.9 Å²	32.9	44%	0.442	17%	0.168	S	C	.	.	S	Bend	trans	-57.9	-36.4	-177.7	-27.2	35.3	0	0	0	114.9
410	N	84.3	Confident	91.4	Very high	87 Å²	87	34.8 Å²	34.8	47%	0.465	18%	0.178	S	C	.	.	S	Bend	trans	-102	127.6	-178.6	-60.7	4.8	0	0	0	109.2	Y408 I424	Y408-N410 VanDerWaalsContact C-N 3.29Å; Y408-N410 PolarHBondContact O-N 3.41Å; N410-I424 HydrophobicContact CB-CD1 4.3Å
411	N	86	Confident	91.4	Very high	88 Å²	88	33.7 Å²	33.7	47%	0.471	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-84.6	124.5	174.3	179.7	88.5	0	0	0	110	N404 N413	N404-N411 VanDerWaalsContact CG-OD1 3.27Å; N404-N411 PolarHBondContact ND2-OD1 2.89Å; N411-N413 PolarHBondContact ND2-OD1 3.45Å
412	V	91.9	Very high	91.5	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-73.9	127.8	174.4	178.6	0	0	0	0	109.5	R400 I403 N404 L415 D418 L419 I424	R400-V412 HydrophobicContact CB-CG1 4.49Å; R400-V412 VanDerWaalsContact CD-O 3.22Å; R400-V412 WeakPolarHBondContact CD-O 3.25Å; R400-V412 HydrophobicContact CG-CB 4.07Å; R400-V412 HydrophobicContact CG-CG1 3.89Å; R400-V412 VanDerWaalsContact CG-O 3.25Å; R400-V412 WeakPolarHBondContact CG-O 3.17Å; I403-V412 HydrophobicContact CG2-CG2 3.77Å; N404-V412 PolarHBondContact ND2-O 3.05Å; N404-V412 WeakPolarHBondContact OD1-CB 3.41Å; N404-V412 PolarHBondContact OD1-N 2.93Å; V412-L415 HydrophobicContact CG1-CD2 3.87Å; V412-L415 HydrophobicContact CG1-CG 4.25Å; V412-D418 WeakPolarHBondContact CA-OD2 3.34Å; V412-D418 HydrophobicContact CB-CB 4.42Å; V412-D418 HydrophobicContact CG1-CB 4.1Å; V412-D418 WeakPolarHBondContact CG1-OD2 3.34Å; V412-D418 HydrophobicContact CG2-CB 4.22Å; V412-L419 HydrophobicContact CG2-CD2 4.33Å; V412-I424 HydrophobicContact CG2-CD1 3.64Å
413	N	88.7	Confident	91.5	Very high	53 Å²	53	33.4 Å²	33.4	28%	0.283	18%	0.175	S	C	.	.	S	Bend	trans	-104.6	-46.8	170.6	-59.3	-43.2	0	0	0	110.3	R400 N411 D418	R400-N413 WeakPolarHBondContact CD-O 3.22Å; R400-N413 PolarHBondContact NH1-O 3.4Å; N411-N413 PolarHBondContact ND2-OD1 3.45Å; N413-D418 PolarHBondContact N-OD2 3.43Å
414	Y	89.9	Confident	91.5	Very high	51 Å²	51	33.5 Å²	33.5	20%	0.2	18%	0.175	C	C	.	.			trans	-135	102.7	-176.3	-173.8	-106.9	0	0	0	111.3	K265 F416 Y417 D418	K265-Y414 HydrophobicContact CB-CD1 4.49Å; K265-Y414 HydrophobicContact CG-CD1 3.91Å; K265-Y414 HydrophobicContact CG-CE1 4.1Å; Y414-F416 HydrophobicContact CD1-CB 4.32Å; Y414-F416 HydrophobicContact CE1-CB 3.77Å; Y414-F416 HydrophobicContact CE1-CD2 4.17Å; Y414-F416 HydrophobicContact CE1-CG 4.49Å; Y414-F416 HydrophobicContact CE2-CD2 4.1Å; Y414-F416 AromaticContact CZ-CD2 3.78Å; Y414-F416 PolarHBondContact O-N 3.29Å; Y414-Y417 PolarHBondContact O-N 2.8Å; Y414-D418 PolarHBondContact N-OD2 2.9Å; Y414-D418 PolarHBondContact O-N 3.4Å
415	L	92.9	Very high	91.7	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.026	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-31.7	-171.9	-71.6	167.6	0	0	0	115.6	E396 R400 I403 V412 Y417 L419 L495	E396-L415 HydrophobicContact CB-CD1 3.82Å; E396-L415 HydrophobicContact CG-CD1 4.04Å; E396-L415 WeakPolarHBondContact O-CD1 3.36Å; R400-L415 HydrophobicContact CB-CD2 4.37Å; R400-L415 HydrophobicContact CB-CG 4.38Å; I403-L415 HydrophobicContact CD1-CD2 3.89Å; V412-L415 HydrophobicContact CG1-CD2 3.87Å; V412-L415 HydrophobicContact CG1-CG 4.25Å; L415-Y417 VanDerWaalsContact C-N 3.29Å; L415-Y417 PolarHBondContact O-N 3.4Å; L415-L419 HydrophobicContact CB-CD1 4.29Å; L415-L419 HydrophobicContact CD2-CD1 3.8Å; L415-L419 WeakPolarHBondContact O-CB 3.34Å; L415-L419 WeakPolarHBondContact O-CD1 3.44Å; L415-L419 WeakPolarHBondContact O-CG 3.5Å; L415-L495 HydrophobicContact CD1-CD1 4.24Å; L415-L495 HydrophobicContact CD2-CD1 3.94Å
416	F	92.9	Very high	91.8	Very high	16 Å²	16	32.7 Å²	32.7	7%	0.07	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	3.3	-174.1	-47.9	-61	0	0	0	113.5	E396 Y414 G486 R488 T491 L492	E396-F416 HydrophobicContact CG-CE2 3.94Å; E396-F416 HydrophobicContact CG-CZ 3.64Å; E396-F416 WeakPolarHBondContact OE1-CE2 3.35Å; E396-F416 VanDerWaalsContact OE1-CZ 3.25Å; E396-F416 WeakPolarHBondContact OE1-CZ 3.29Å; Y414-F416 HydrophobicContact CD1-CB 4.32Å; Y414-F416 HydrophobicContact CE1-CB 3.77Å; Y414-F416 HydrophobicContact CE1-CD2 4.17Å; Y414-F416 HydrophobicContact CE1-CG 4.49Å; Y414-F416 HydrophobicContact CE2-CD2 4.1Å; Y414-F416 AromaticContact CZ-CD2 3.78Å; Y414-F416 PolarHBondContact O-N 3.29Å; F416-G486 WeakPolarHBondContact O-CA 3.39Å; F416-R488 HydrophobicContact CD1-CB 4.18Å; F416-R488 HydrophobicContact CD1-CG 3.87Å; F416-R488 HydrophobicContact CD2-CG 3.78Å; F416-R488 VanDerWaalsContact CE1-CA 3.48Å; F416-R488 HydrophobicContact CE1-CB 3.81Å; F416-R488 HydrophobicContact CE1-CG 3.85Å; F416-R488 HydrophobicContact CE2-CB 4.37Å; F416-R488 HydrophobicContact CE2-CG 3.75Å; F416-R488 HydrophobicContact CG-CG 3.82Å; F416-R488 HydrophobicContact CZ-CB 3.88Å; F416-R488 HydrophobicContact CZ-CG 3.77Å; F416-T491 HydrophobicContact CD1-CG2 4.09Å; F416-T491 HydrophobicContact CE1-CG2 4.2Å; F416-L492 HydrophobicContact CE1-CD2 4.29Å; F416-L492 HydrophobicContact CE1-CG 4.09Å; F416-L492 HydrophobicContact CZ-CD1 4.25Å; F416-L492 HydrophobicContact CZ-CD2 4.14Å; F416-L492 HydrophobicContact CZ-CG 4.11Å
417	Y	91.6	Very high	92	Very high	121 Å²	121	31.9 Å²	31.9	48%	0.475	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-48.8	171.3	-176.5	-113.9	0	0	0	110.4	K265 Y414 L415 L419 I420	K265-Y417 HydrophobicContact CB-CD1 4.15Å; K265-Y417 HydrophobicContact CB-CG 4.23Å; K265-Y417 HydrophobicContact CD-CD2 3.97Å; K265-Y417 HydrophobicContact CD-CE2 4.44Å; K265-Y417 HydrophobicContact CD-CG 4.11Å; K265-Y417 HydrophobicContact CG-CG 4.24Å; Y414-Y417 PolarHBondContact O-N 2.8Å; L415-Y417 VanDerWaalsContact C-N 3.29Å; L415-Y417 PolarHBondContact O-N 3.4Å; Y417-L419 PolarHBondContact O-N 3.1Å; Y417-I420 HydrophobicContact CD2-CD1 4Å; Y417-I420 HydrophobicContact CE2-CD1 4.16Å; Y417-I420 VanDerWaalsContact O-CG1 3.28Å; Y417-I420 WeakPolarHBondContact O-CG1 3.23Å; Y417-I420 WeakPolarHBondContact O-CG2 3.36Å; Y417-I420 PolarHBondContact O-N 3.01Å
418	D	93.1	Very high	92.4	Very high	34 Å²	34	30.6 Å²	30.6	18%	0.182	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-1.4	-173.7	-48.1	-35	0	0	0	114.7	V412 N413 Y414	V412-D418 WeakPolarHBondContact CA-OD2 3.34Å; V412-D418 HydrophobicContact CB-CB 4.42Å; V412-D418 HydrophobicContact CG1-CB 4.1Å; V412-D418 WeakPolarHBondContact CG1-OD2 3.34Å; V412-D418 HydrophobicContact CG2-CB 4.22Å; N413-D418 PolarHBondContact N-OD2 3.43Å; Y414-D418 PolarHBondContact N-OD2 2.9Å; Y414-D418 PolarHBondContact O-N 3.4Å
419	L	95.3	Very high	92.6	Very high	3 Å²	3	29.6 Å²	29.6	2%	0.016	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.8	-2.9	179.6	-57.3	-179	0	0	0	113.8	V412 L415 Y417 D421 G422 I424 L425 T491 L495	V412-L419 HydrophobicContact CG2-CD2 4.33Å; L415-L419 HydrophobicContact CB-CD1 4.29Å; L415-L419 HydrophobicContact CD2-CD1 3.8Å; L415-L419 WeakPolarHBondContact O-CB 3.34Å; L415-L419 WeakPolarHBondContact O-CD1 3.44Å; L415-L419 WeakPolarHBondContact O-CG 3.5Å; Y417-L419 PolarHBondContact O-N 3.1Å; L419-D421 PolarHBondContact O-N 3.49Å; L419-G422 PolarHBondContact O-N 3.23Å; L419-I424 HydrophobicContact CD2-CB 3.65Å; L419-I424 HydrophobicContact CD2-CD1 4.26Å; L419-I424 HydrophobicContact CD2-CG1 4.49Å; L419-I424 HydrophobicContact CD2-CG2 3.56Å; L419-L425 HydrophobicContact CB-CD1 4.33Å; L419-L425 HydrophobicContact CB-CG 4.38Å; L419-L425 HydrophobicContact CD1-CD2 4.24Å; L419-L425 HydrophobicContact CD2-CD2 4.48Å; L419-L425 HydrophobicContact CD2-CG 4.48Å; L419-T491 HydrophobicContact CD1-CG2 3.99Å; L419-L495 HydrophobicContact CD1-CD1 3.94Å; L419-L495 HydrophobicContact CD1-CD2 4.14Å; L419-L495 HydrophobicContact CD1-CG 4.43Å
420	I	95.1	Very high	93.1	Very high	42 Å²	42	27 Å²	27	22%	0.215	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-16.1	-175.4	72.5	-171.2	0	0	0	113.5	Y417 G422 C461 H484	Y417-I420 HydrophobicContact CD2-CD1 4Å; Y417-I420 HydrophobicContact CE2-CD1 4.16Å; Y417-I420 VanDerWaalsContact O-CG1 3.28Å; Y417-I420 WeakPolarHBondContact O-CG1 3.23Å; Y417-I420 WeakPolarHBondContact O-CG2 3.36Å; Y417-I420 PolarHBondContact O-N 3.01Å; I420-G422 VanDerWaalsContact C-N 3.32Å; I420-C461 PolarHBondContact O-SG 2.93Å; I420-H484 WeakPolarHBondContact CG2-O 3.21Å
421	D	94.4	Very high	93.4	Very high	25 Å²	25	24.4 Å²	24.4	13%	0.134	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-12.8	177.9	75.3	-7.4	0	0	0	113.5	L419 L423 I446 N460	L419-D421 PolarHBondContact O-N 3.49Å; D421-L423 HydrophobicContact CB-CG 4.4Å; D421-L423 PolarHBondContact O-N 3.32Å; D421-L423 PolarHBondContact OD1-N 2.95Å; D421-L423 WeakPolarHBondContact OD2-CB 3.13Å; D421-L423 WeakPolarHBondContact OD2-CD1 3.35Å; D421-I446 HydrophobicContact CB-CD1 3.69Å; D421-N460 WeakPolarHBondContact O-CB 3.38Å; D421-N460 PolarHBondContact O-ND2 3.11Å
422	G	95.4	Very high	93.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.099	C	C	.	.	S	Bend	trans	70.6	-13.3	-172.8	0	0	0	0	0	115.7	L419 I420 I424 L425 L426	L419-G422 PolarHBondContact O-N 3.23Å; I420-G422 VanDerWaalsContact C-N 3.32Å; G422-I424 PolarHBondContact O-N 3.34Å; G422-L425 WeakPolarHBondContact O-CB 3.43Å; G422-L425 PolarHBondContact O-N 3.29Å; G422-L426 VanDerWaalsContact O-CG 3.3Å; G422-L426 WeakPolarHBondContact O-CG 3.45Å; G422-L426 PolarHBondContact O-N 3.02Å
423	L	95.8	Very high	93.4	Very high	11 Å²	11	25.6 Å²	25.6	6%	0.058	12%	0.122	C	C	.	.	H	α-helix	trans	-65.1	-46	-170.3	-64.1	-177.5	0	0	0	112	D421 L425 L426 R427 V442 E444 I446 N460	D421-L423 HydrophobicContact CB-CG 4.4Å; D421-L423 PolarHBondContact O-N 3.32Å; D421-L423 PolarHBondContact OD1-N 2.95Å; D421-L423 WeakPolarHBondContact OD2-CB 3.13Å; D421-L423 WeakPolarHBondContact OD2-CD1 3.35Å; L423-L425 VanDerWaalsContact C-N 3.29Å; L423-L425 PolarHBondContact O-N 3.5Å; L423-L426 PolarHBondContact O-N 3.19Å; L423-R427 WeakPolarHBondContact O-CG 2.85Å; L423-R427 PolarHBondContact O-N 3.39Å; L423-V442 HydrophobicContact CD2-CG1 3.43Å; L423-V442 VanDerWaalsContact CD2-CG1 3.43Å; L423-E444 HydrophobicContact CD1-CB 4.3Å; L423-E444 HydrophobicContact CD1-CG 4.08Å; L423-E444 HydrophobicContact CD2-CB 4.1Å; L423-I446 HydrophobicContact CD1-CD1 3.96Å; L423-I446 HydrophobicContact CG-CD1 4.39Å; L423-N460 WeakPolarHBondContact CD2-ND2 3.26Å
424	I	95.7	Very high	93.3	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.01	13%	0.126	C	C	.	.	H	α-helix	trans	-65.2	-35.9	177.1	-62.4	-175.7	0	0	0	111	I403 Y408 N410 V412 L419 G422 R427 L428	I403-I424 HydrophobicContact CG2-CG2 3.69Å; Y408-I424 HydrophobicContact CD2-CG2 4.01Å; Y408-I424 HydrophobicContact CE2-CG2 4.15Å; N410-I424 HydrophobicContact CB-CD1 4.3Å; V412-I424 HydrophobicContact CG2-CD1 3.64Å; L419-I424 HydrophobicContact CD2-CB 3.65Å; L419-I424 HydrophobicContact CD2-CD1 4.26Å; L419-I424 HydrophobicContact CD2-CG1 4.49Å; L419-I424 HydrophobicContact CD2-CG2 3.56Å; G422-I424 PolarHBondContact O-N 3.34Å; I424-R427 PolarHBondContact O-N 3.09Å; I424-L428 HydrophobicContact CG2-CD1 4.42Å; I424-L428 WeakPolarHBondContact O-CG 3.34Å; I424-L428 PolarHBondContact O-N 3.2Å
425	L	96.8	Very high	93.3	Very high	2 Å²	2	30.8 Å²	30.8	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-68.3	-34.5	176.3	-63.4	173.7	0	0	0	112.2	L419 G422 L423 L428 F429 V464 L483 L494 L495 L498	L419-L425 HydrophobicContact CB-CD1 4.33Å; L419-L425 HydrophobicContact CB-CG 4.38Å; L419-L425 HydrophobicContact CD1-CD2 4.24Å; L419-L425 HydrophobicContact CD2-CD2 4.48Å; L419-L425 HydrophobicContact CD2-CG 4.48Å; G422-L425 WeakPolarHBondContact O-CB 3.43Å; G422-L425 PolarHBondContact O-N 3.29Å; L423-L425 VanDerWaalsContact C-N 3.29Å; L423-L425 PolarHBondContact O-N 3.5Å; L425-L428 HydrophobicContact CD2-CD1 4.24Å; L425-F429 VanDerWaalsContact O-CD2 3.3Å; L425-F429 WeakPolarHBondContact O-CD2 2.9Å; L425-F429 PolarHBondContact O-N 2.71Å; L425-V464 HydrophobicContact CB-CB 4.49Å; L425-V464 HydrophobicContact CB-CG1 3.82Å; L425-V464 HydrophobicContact CB-CG2 3.75Å; L425-V464 HydrophobicContact CD1-CG1 4.01Å; L425-L483 HydrophobicContact CD1-CD1 4.07Å; L425-L494 HydrophobicContact CD1-CD2 4.03Å; L425-L494 HydrophobicContact CD2-CD2 4.24Å; L425-L495 HydrophobicContact CD2-CD2 3.96Å; L425-L498 HydrophobicContact CD2-CD1 3.97Å
426	L	96.9	Very high	93.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-67.7	-46.5	171.2	-67.6	168.5	0	0	0	111.3	G422 L423 L428 F429 D430 V437 W439 V442 N460 Y463 V464 L467	G422-L426 VanDerWaalsContact O-CG 3.3Å; G422-L426 WeakPolarHBondContact O-CG 3.45Å; G422-L426 PolarHBondContact O-N 3.02Å; L423-L426 PolarHBondContact O-N 3.19Å; L426-L428 PolarHBondContact O-N 2.88Å; L426-F429 WeakPolarHBondContact O-CB 3.4Å; L426-F429 PolarHBondContact O-N 2.74Å; L426-D430 PolarHBondContact O-N 2.95Å; L426-V437 HydrophobicContact CB-CG1 4.27Å; L426-V437 HydrophobicContact CB-CG2 4.26Å; L426-V437 HydrophobicContact CD2-CG1 4.27Å; L426-V437 HydrophobicContact CD2-CG2 4.41Å; L426-V437 VanDerWaalsContact O-CG2 3.3Å; L426-V437 WeakPolarHBondContact O-CG2 3.46Å; L426-W439 HydrophobicContact CB-CH2 3.9Å; L426-W439 HydrophobicContact CB-CZ3 4.39Å; L426-V442 HydrophobicContact CD1-CB 4.33Å; L426-V442 HydrophobicContact CD1-CG1 3.61Å; L426-V442 HydrophobicContact CD1-CG2 3.72Å; L426-N460 HydrophobicContact CD1-CB 4.47Å; L426-Y463 HydrophobicContact CD2-CD1 3.88Å; L426-Y463 HydrophobicContact CD2-CE1 4.22Å; L426-Y463 HydrophobicContact CD2-CG 4.3Å; L426-V464 HydrophobicContact CD2-CG2 3.75Å; L426-V464 HydrophobicContact CG-CG2 3.7Å; L426-L467 HydrophobicContact CD2-CD1 3.66Å
427	R	95.2	Very high	93.3	Very high	12 Å²	12	32.1 Å²	32.1	5%	0.045	16%	0.159	C	C	.	.	H	α-helix	trans	-59	-32.5	175.7	-65.4	177.4	-169.9	141.9	-1.9	112.4	Y408 L423 I424 S431 W439 E444 F666	Y408-R427 HydrophobicContact CD1-CB 3.97Å; Y408-R427 HydrophobicContact CE1-CB 3.65Å; Y408-R427 HydrophobicContact CE2-CB 4.31Å; Y408-R427 HydrophobicContact CG-CB 4.44Å; Y408-R427 PolarHBondContact OH-O 3.41Å; L423-R427 WeakPolarHBondContact O-CG 2.85Å; L423-R427 PolarHBondContact O-N 3.39Å; I424-R427 PolarHBondContact O-N 3.09Å; R427-S431 WeakPolarHBondContact O-CB 3.48Å; R427-S431 PolarHBondContact O-N 3.4Å; R427-S431 PolarHBondContact O-OG 2.88Å; R427-W439 HydrophobicContact CG-CH2 3.64Å; R427-W439 HydrophobicContact CG-CZ2 4.19Å; R427-E444 IonicContact CZ-OE1 2.78Å; R427-E444 IonicContact CZ-OE2 2.77Å; R427-E444 IonicContact NH2-OE1 3.32Å; R427-E444 PolarHBondContact NH2-OE1 3.03Å; R427-E444 IonicContact NH2-OE2 2.67Å; R427-E444 PolarHBondContact NH2-OE2 2.66Å; R427-F666 HydrophobicContact CB-CZ 4.37Å; R427-F666 HydrophobicContact CG-CE1 4.28Å
428	L	95.2	Very high	93.4	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-65.5	-41.7	171.4	-74.4	163.8	0	0	0	113	W402 I403 L406 Y408 I424 L425 L426 S431 I432 L495 L498	W402-L428 HydrophobicContact CH2-CD2 3.66Å; W402-L428 HydrophobicContact CZ2-CD2 3.83Å; W402-L428 HydrophobicContact CZ3-CD2 4.17Å; I403-L428 HydrophobicContact CD1-CD1 4.2Å; I403-L428 HydrophobicContact CG1-CD1 4.09Å; I403-L428 HydrophobicContact CG1-CD2 4.34Å; L406-L428 HydrophobicContact CD1-CD2 3.59Å; Y408-L428 HydrophobicContact CE2-CD2 4.05Å; Y408-L428 HydrophobicContact CE2-CG 4.03Å; Y408-L428 WeakPolarHBondContact OH-CA 3.22Å; Y408-L428 VanDerWaalsContact OH-CD2 3.31Å; Y408-L428 WeakPolarHBondContact OH-CD2 3.37Å; Y408-L428 PolarHBondContact OH-N 2.7Å; I424-L428 HydrophobicContact CG2-CD1 4.42Å; I424-L428 WeakPolarHBondContact O-CG 3.34Å; I424-L428 PolarHBondContact O-N 3.2Å; L425-L428 HydrophobicContact CD2-CD1 4.24Å; L426-L428 PolarHBondContact O-N 2.88Å; L428-S431 PolarHBondContact O-N 2.93Å; L428-I432 WeakPolarHBondContact O-CD1 3.47Å; L428-I432 VanDerWaalsContact O-CG1 3.25Å; L428-I432 WeakPolarHBondContact O-CG1 3.35Å; L428-I432 PolarHBondContact O-N 3.35Å; L428-I432 VanDerWaalsContact O-N 3.09Å; L428-L495 HydrophobicContact CD1-CD2 4.29Å; L428-L498 HydrophobicContact CB-CD1 4.25Å; L428-L498 HydrophobicContact CB-CD2 4.35Å; L428-L498 HydrophobicContact CD1-CD1 4.09Å
429	F	95	Very high	93.5	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-45.3	173.7	-80.8	-64.2	0	0	0	112.3	L425 L426 S431 I432 Q433 I436 V437 V464 L467 G468 F471 F473 L494 L498	L425-F429 VanDerWaalsContact O-CD2 3.3Å; L425-F429 WeakPolarHBondContact O-CD2 2.9Å; L425-F429 PolarHBondContact O-N 2.71Å; L426-F429 WeakPolarHBondContact O-CB 3.4Å; L426-F429 PolarHBondContact O-N 2.74Å; F429-S431 PolarHBondContact O-N 3.43Å; F429-I432 PolarHBondContact O-N 3.23Å; F429-I432 VanDerWaalsContact O-N 3.08Å; F429-Q433 PolarHBondContact O-N 2.87Å; F429-I436 HydrophobicContact CB-CG2 4Å; F429-I436 WeakPolarHBondContact O-CG2 3.49Å; F429-V437 HydrophobicContact CB-CG2 4.19Å; F429-V464 HydrophobicContact CE2-CG1 4.05Å; F429-V464 WeakPolarHBondContact CE2-O 3.22Å; F429-L467 HydrophobicContact CB-CD1 4.17Å; F429-L467 HydrophobicContact CD1-CB 4.36Å; F429-L467 HydrophobicContact CD2-CB 3.93Å; F429-L467 HydrophobicContact CD2-CD1 3.88Å; F429-L467 HydrophobicContact CE1-CB 4.27Å; F429-L467 HydrophobicContact CE2-CB 3.84Å; F429-L467 HydrophobicContact CG-CB 4.2Å; F429-L467 HydrophobicContact CG-CD1 4.12Å; F429-L467 HydrophobicContact CZ-CB 4.02Å; F429-G468 VanDerWaalsContact CZ-CA 3.48Å; F429-F471 HydrophobicContact CB-CE2 4.49Å; F429-F471 AromaticContact CD1-CD2 3.54Å; F429-F471 HydrophobicContact CD1-CD2 3.54Å; F429-F471 AromaticContact CD1-CE2 3.33Å; F429-F471 HydrophobicContact CD1-CE2 3.33Å; F429-F471 HydrophobicContact CD1-CG 4.3Å; F429-F471 AromaticContact CD1-CZ 3.95Å; F429-F471 HydrophobicContact CD1-CZ 3.95Å; F429-F471 HydrophobicContact CE1-CB 4.46Å; F429-F471 AromaticContact CE1-CD2 3.53Å; F429-F471 HydrophobicContact CE1-CD2 3.53Å; F429-F471 AromaticContact CE1-CE2 3.86Å; F429-F471 HydrophobicContact CE1-CE2 3.86Å; F429-F471 HydrophobicContact CE1-CG 4.05Å; F429-F471 HydrophobicContact CG-CE2 4.26Å; F429-F473 HydrophobicContact CE1-CD2 4.29Å; F429-F473 AromaticContact CE1-CE2 3.53Å; F429-F473 HydrophobicContact CE1-CE2 3.53Å; F429-F473 AromaticContact CE1-CZ 3.94Å; F429-F473 HydrophobicContact CE1-CZ 3.94Å; F429-F473 HydrophobicContact CZ-CD2 4.24Å; F429-F473 AromaticContact CZ-CE2 3.76Å; F429-F473 HydrophobicContact CZ-CE2 3.76Å; F429-L494 HydrophobicContact CZ-CD1 4.5Å; F429-L498 HydrophobicContact CD1-CD2 3.76Å; F429-L498 HydrophobicContact CD2-CD2 4.25Å; F429-L498 HydrophobicContact CE1-CD2 3.6Å; F429-L498 HydrophobicContact CE2-CD2 4.09Å; F429-L498 HydrophobicContact CG-CD2 4.09Å; F429-L498 HydrophobicContact CZ-CD2 3.77Å
430	D	92.8	Very high	93.4	Very high	14 Å²	14	37.5 Å²	37.5	8%	0.075	20%	0.195	C	C	.	.	H	α-helix	trans	-66.6	-26.4	178.4	-129.7	25.1	0	0	0	112.3	L426 Q433 P434 H435 I436 V437 W439	L426-D430 PolarHBondContact O-N 2.95Å; D430-Q433 CarbonylContact O-C 3.58Å; D430-Q433 VanDerWaalsContact O-C 3.29Å; D430-P434 VanDerWaalsContact O-CA 3.25Å; D430-P434 WeakPolarHBondContact O-CA 3.33Å; D430-H435 VanDerWaalsContact OD1-CA 3.28Å; D430-H435 WeakPolarHBondContact OD1-CA 3.32Å; D430-H435 PolarHBondContact OD1-N 2.91Å; D430-I436 PolarHBondContact OD1-N 2.61Å; D430-V437 HydrophobicContact CB-CB 4.36Å; D430-V437 HydrophobicContact CB-CG2 3.88Å; D430-V437 PolarHBondContact OD1-N 3.35Å; D430-V437 VanDerWaalsContact OD1-N 3.17Å; D430-W439 HydrophobicContact CB-CZ2 4.36Å; D430-W439 PolarHBondContact OD2-NE1 3.02Å
431	S	90.1	Very high	93.3	Very high	32 Å²	32	39.7 Å²	39.7	22%	0.224	21%	0.206	C	C	.	.	H	α-helix	trans	-78.8	-20.3	172.5	-57	0	0	0	0	113.8	Y408 R427 L428 F429	Y408-S431 PolarHBondContact OH-OG 3.3Å; Y408-S431 VanDerWaalsContact OH-OG 3.13Å; R427-S431 WeakPolarHBondContact O-CB 3.48Å; R427-S431 PolarHBondContact O-N 3.4Å; R427-S431 PolarHBondContact O-OG 2.88Å; L428-S431 PolarHBondContact O-N 2.93Å; F429-S431 PolarHBondContact O-N 3.43Å
432	I	90.3	Very high	93.4	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.051	20%	0.203	C	C	.	.	H	α-helix	trans	-83	-41.7	173.1	-67	159.3	0	0	0	110.4	L428 F429 F471 L498 A501 Y502 S505	L428-I432 WeakPolarHBondContact O-CD1 3.47Å; L428-I432 VanDerWaalsContact O-CG1 3.25Å; L428-I432 WeakPolarHBondContact O-CG1 3.35Å; L428-I432 PolarHBondContact O-N 3.35Å; L428-I432 VanDerWaalsContact O-N 3.09Å; F429-I432 PolarHBondContact O-N 3.23Å; F429-I432 VanDerWaalsContact O-N 3.08Å; I432-F471 HydrophobicContact CG2-CE1 3.76Å; I432-F471 HydrophobicContact CG2-CZ 4.26Å; I432-L498 HydrophobicContact CD1-CB 4.25Å; I432-L498 HydrophobicContact CD1-CD2 3.54Å; I432-A501 HydrophobicContact CD1-CB 4.16Å; I432-A501 HydrophobicContact CG2-CB 4.15Å; I432-Y502 HydrophobicContact CG1-CD2 4.31Å; I432-S505 PolarHBondContact O-OG 2.81Å
433	Q	88.2	Confident	93.3	Very high	104 Å²	104	41.9 Å²	41.9	49%	0.486	22%	0.216	S	C	.	.	S	Bend	trans	-143.2	105.5	176.4	-178.1	180	-25.7	0	0	109.7	F429 D430 H435 I436 F471	F429-Q433 PolarHBondContact O-N 2.87Å; D430-Q433 CarbonylContact O-C 3.58Å; D430-Q433 VanDerWaalsContact O-C 3.29Å; Q433-H435 PolarHBondContact O-N 3.15Å; Q433-I436 HydrophobicContact CB-CB 4.44Å; Q433-I436 HydrophobicContact CB-CD1 4.47Å; Q433-I436 HydrophobicContact CB-CG2 4.48Å; Q433-I436 HydrophobicContact CG-CD1 4.36Å; Q433-I436 WeakPolarHBondContact O-CB 3.22Å; Q433-I436 WeakPolarHBondContact O-CG2 3.25Å; Q433-I436 PolarHBondContact O-N 3.24Å; Q433-F471 HydrophobicContact CB-CE1 4.42Å; Q433-F471 HydrophobicContact CB-CZ 3.98Å
434	P	87.8	Confident	92.9	Very high	56 Å²	56	46 Å²	46	36%	0.364	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	137.8	-179.2	-29.4	36.6	0	0	0	114	D430 I436	D430-P434 VanDerWaalsContact O-CA 3.25Å; D430-P434 WeakPolarHBondContact O-CA 3.33Å; P434-I436 VanDerWaalsContact C-N 3.32Å
435	H	89.6	Confident	92.5	Very high	156 Å²	156	50.5 Å²	50.5	72%	0.722	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	22.9	179.9	-41.5	-52.1	0	0	0	114.9	D430 Q433	D430-H435 VanDerWaalsContact OD1-CA 3.28Å; D430-H435 WeakPolarHBondContact OD1-CA 3.32Å; D430-H435 PolarHBondContact OD1-N 2.91Å; Q433-H435 PolarHBondContact O-N 3.15Å
436	I	91.6	Very high	92.2	Very high	42 Å²	42	52.4 Å²	52.4	22%	0.215	27%	0.274	C	S	.	.			trans	-80.4	-24.3	169.3	-162.2	132.1	0	0	0	112.1	F429 D430 Q433 P434 Y463 L467 F471	F429-I436 HydrophobicContact CB-CG2 4Å; F429-I436 WeakPolarHBondContact O-CG2 3.49Å; D430-I436 PolarHBondContact OD1-N 2.61Å; Q433-I436 HydrophobicContact CB-CB 4.44Å; Q433-I436 HydrophobicContact CB-CD1 4.47Å; Q433-I436 HydrophobicContact CB-CG2 4.48Å; Q433-I436 HydrophobicContact CG-CD1 4.36Å; Q433-I436 WeakPolarHBondContact O-CB 3.22Å; Q433-I436 WeakPolarHBondContact O-CG2 3.25Å; Q433-I436 PolarHBondContact O-N 3.24Å; P434-I436 VanDerWaalsContact C-N 3.32Å; I436-Y463 PolarHBondContact O-OH 2.95Å; I436-L467 HydrophobicContact CG1-CD2 4.18Å; I436-F471 HydrophobicContact CD1-CD2 4.29Å; I436-F471 HydrophobicContact CD1-CE2 3.44Å; I436-F471 VanDerWaalsContact CD1-CE2 3.44Å; I436-F471 HydrophobicContact CD1-CZ 3.69Å; I436-F471 HydrophobicContact CG1-CE2 3.87Å; I436-F471 HydrophobicContact CG1-CZ 4.36Å; I436-F471 HydrophobicContact CG2-CE2 4.09Å; I436-F471 HydrophobicContact CG2-CZ 4.24Å
437	V	94	Very high	91.7	Very high	7 Å²	7	54 Å²	54	4%	0.042	28%	0.284	C	S	.	.	S	Bend	trans	-86.7	118.5	174	-176.7	0	0	0	0	109.6	L426 F429 D430 W439 V442 Y463 L467	L426-V437 HydrophobicContact CB-CG1 4.27Å; L426-V437 HydrophobicContact CB-CG2 4.26Å; L426-V437 HydrophobicContact CD2-CG1 4.27Å; L426-V437 HydrophobicContact CD2-CG2 4.41Å; L426-V437 VanDerWaalsContact O-CG2 3.3Å; L426-V437 WeakPolarHBondContact O-CG2 3.46Å; F429-V437 HydrophobicContact CB-CG2 4.19Å; D430-V437 HydrophobicContact CB-CB 4.36Å; D430-V437 HydrophobicContact CB-CG2 3.88Å; D430-V437 PolarHBondContact OD1-N 3.35Å; D430-V437 VanDerWaalsContact OD1-N 3.17Å; V437-W439 HydrophobicContact CB-CD2 4.4Å; V437-W439 HydrophobicContact CB-CZ2 3.95Å; V437-W439 HydrophobicContact CG1-CD2 3.7Å; V437-W439 VanDerWaalsContact CG1-CE2 3.5Å; V437-W439 HydrophobicContact CG1-CE3 4.14Å; V437-W439 HydrophobicContact CG1-CG 4.11Å; V437-W439 HydrophobicContact CG1-CH2 4.13Å; V437-W439 HydrophobicContact CG1-CZ2 3.73Å; V437-W439 HydrophobicContact CG1-CZ3 4.34Å; V437-W439 HydrophobicContact CG2-CZ2 4.25Å; V437-W439 VanDerWaalsContact O-CD1 3.29Å; V437-W439 PolarHBondContact O-N 3.06Å; V437-V442 HydrophobicContact CG1-CG2 3.89Å; V437-Y463 HydrophobicContact CG1-CE1 4.11Å; V437-L467 HydrophobicContact CG2-CD1 3.99Å
438	N	94.1	Very high	91.3	Very high	75 Å²	75	60.3 Å²	60.3	40%	0.401	32%	0.319	S	S	.	.			trans	-81.3	91.3	165.9	-179	27	0	0	0	109.7	T440 I441 Y463	N438-T440 PolarHBondContact ND2-OG1 3.48Å; N438-T440 PolarHBondContact O-N 3.19Å; N438-T440 WeakPolarHBondContact OD1-CG2 3.33Å; N438-T440 PolarHBondContact OD1-N 3.13Å; N438-T440 PolarHBondContact OD1-OG1 2.85Å; N438-I441 HydrophobicContact CB-CG1 4.26Å; N438-I441 WeakPolarHBondContact O-CG1 3.25Å; N438-I441 PolarHBondContact O-N 2.82Å; N438-I441 VanDerWaalsContact O-N 3.13Å; N438-Y463 PolarHBondContact N-OH 2.97Å
439	W	94.8	Very high	91.1	Very high	77 Å²	77	64.1 Å²	64.1	29%	0.292	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-58.5	-15.7	178.9	-64	99.2	0	0	0	114.2	L426 R427 D430 V437 I441 V442	L426-W439 HydrophobicContact CB-CH2 3.9Å; L426-W439 HydrophobicContact CB-CZ3 4.39Å; R427-W439 HydrophobicContact CG-CH2 3.64Å; R427-W439 HydrophobicContact CG-CZ2 4.19Å; D430-W439 HydrophobicContact CB-CZ2 4.36Å; D430-W439 PolarHBondContact OD2-NE1 3.02Å; V437-W439 HydrophobicContact CB-CD2 4.4Å; V437-W439 HydrophobicContact CB-CZ2 3.95Å; V437-W439 HydrophobicContact CG1-CD2 3.7Å; V437-W439 VanDerWaalsContact CG1-CE2 3.5Å; V437-W439 HydrophobicContact CG1-CE3 4.14Å; V437-W439 HydrophobicContact CG1-CG 4.11Å; V437-W439 HydrophobicContact CG1-CH2 4.13Å; V437-W439 HydrophobicContact CG1-CZ2 3.73Å; V437-W439 HydrophobicContact CG1-CZ3 4.34Å; V437-W439 HydrophobicContact CG2-CZ2 4.25Å; V437-W439 VanDerWaalsContact O-CD1 3.29Å; V437-W439 PolarHBondContact O-N 3.06Å; W439-I441 PolarHBondContact O-N 2.89Å; W439-V442 HydrophobicContact CE3-CB 4.03Å; W439-V442 HydrophobicContact CE3-CG1 3.98Å; W439-V442 HydrophobicContact CE3-CG2 4.02Å; W439-V442 HydrophobicContact CZ3-CB 4.47Å; W439-V442 HydrophobicContact CZ3-CG1 3.96Å; W439-V442 HydrophobicContact CZ3-CG2 4.43Å; W439-V442 PolarHBondContact O-N 3.09Å
440	T	93.1	Very high	90.7	Very high	120 Å²	120	68.6 Å²	68.6	74%	0.736	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-73.2	-8.1	175.6	83.8	0	0	0	0	114.7	N438	N438-T440 PolarHBondContact ND2-OG1 3.48Å; N438-T440 PolarHBondContact O-N 3.19Å; N438-T440 WeakPolarHBondContact OD1-CG2 3.33Å; N438-T440 PolarHBondContact OD1-N 3.13Å; N438-T440 PolarHBondContact OD1-OG1 2.85Å
441	I	93	Very high	90.6	Very high	87 Å²	87	70.9 Å²	70.9	45%	0.446	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-117.5	11.9	174.4	62.6	162.1	0	0	0	112.4	N438 W439 Y463	N438-I441 HydrophobicContact CB-CG1 4.26Å; N438-I441 WeakPolarHBondContact O-CG1 3.25Å; N438-I441 PolarHBondContact O-N 2.82Å; N438-I441 VanDerWaalsContact O-N 3.13Å; W439-I441 PolarHBondContact O-N 2.89Å; I441-Y463 HydrophobicContact CD1-CD1 3.96Å; I441-Y463 HydrophobicContact CD1-CD2 4.38Å; I441-Y463 HydrophobicContact CD1-CE1 3.76Å; I441-Y463 HydrophobicContact CD1-CE2 4.23Å; I441-Y463 HydrophobicContact CD1-CG 4.29Å; I441-Y463 HydrophobicContact CG1-CD1 4.13Å; I441-Y463 HydrophobicContact CG1-CE1 3.82Å
442	V	95.4	Very high	90.6	Very high	14 Å²	14	74.5 Å²	74.5	9%	0.085	40%	0.404	C	S	.	.	S	Bend	trans	-99.1	137.2	176.9	-179.8	0	0	0	0	108.3	L423 L426 V437 W439 E444 Y463	L423-V442 HydrophobicContact CD2-CG1 3.43Å; L423-V442 VanDerWaalsContact CD2-CG1 3.43Å; L426-V442 HydrophobicContact CD1-CB 4.33Å; L426-V442 HydrophobicContact CD1-CG1 3.61Å; L426-V442 HydrophobicContact CD1-CG2 3.72Å; V437-V442 HydrophobicContact CG1-CG2 3.89Å; W439-V442 HydrophobicContact CE3-CB 4.03Å; W439-V442 HydrophobicContact CE3-CG1 3.98Å; W439-V442 HydrophobicContact CE3-CG2 4.02Å; W439-V442 HydrophobicContact CZ3-CB 4.47Å; W439-V442 HydrophobicContact CZ3-CG1 3.96Å; W439-V442 HydrophobicContact CZ3-CG2 4.43Å; W439-V442 PolarHBondContact O-N 3.09Å; V442-E444 PolarHBondContact O-N 2.94Å; V442-Y463 HydrophobicContact CG2-CD1 4.05Å; V442-Y463 HydrophobicContact CG2-CE1 3.98Å
443	H	93.7	Very high	90.7	Very high	57 Å²	57	74.9 Å²	74.9	26%	0.264	41%	0.409	S	S	.	.			trans	-87.8	93.5	175.4	-67.8	-51.4	0	0	0	110.5	I446 Q456 E459 N460	H443-I446 WeakPolarHBondContact O-CG1 3.44Å; H443-Q456 HydrophobicContact CB-CB 3.75Å; H443-Q456 HydrophobicContact CB-CG 4.07Å; H443-Q456 VanDerWaalsContact CG-NE2 3.27Å; H443-Q456 PolarHBondContact ND1-NE2 3.22Å; H443-Q456 VanDerWaalsContact ND1-NE2 3.18Å; H443-E459 IonicContact NE2-OE2 2.71Å; H443-N460 PolarHBondContact N-OD1 3.4Å; H443-N460 PolarHBondContact O-ND2 3.16Å
444	E	88.8	Confident	90.9	Very high	99 Å²	99	74.2 Å²	74.2	46%	0.463	41%	0.409	S	S	.	.			trans	-139.7	120.5	171.7	-171	173.1	159.4	0	0	108.8	L423 R427 V442	L423-E444 HydrophobicContact CD1-CB 4.3Å; L423-E444 HydrophobicContact CD1-CG 4.08Å; L423-E444 HydrophobicContact CD2-CB 4.1Å; R427-E444 IonicContact CZ-OE1 2.78Å; R427-E444 IonicContact CZ-OE2 2.77Å; R427-E444 IonicContact NH2-OE1 3.32Å; R427-E444 PolarHBondContact NH2-OE1 3.03Å; R427-E444 IonicContact NH2-OE2 2.67Å; R427-E444 PolarHBondContact NH2-OE2 2.66Å; V442-E444 PolarHBondContact O-N 2.94Å
445	P	87.5	Confident	91.2	Very high	95 Å²	95	78.1 Å²	78.1	62%	0.617	42%	0.42	S	S	*	.	S	Bend	cis	-67.6	160.2	-7.6	31.5	-36.3	0	0	0	112.9
446	I	88.4	Confident	91.5	Very high	42 Å²	42	71.5 Å²	71.5	22%	0.215	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-85.8	144.9	175	-62.4	163.3	0	0	0	108.3	D421 L423 H443 A453 Q456	D421-I446 HydrophobicContact CB-CD1 3.69Å; L423-I446 HydrophobicContact CD1-CD1 3.96Å; L423-I446 HydrophobicContact CG-CD1 4.39Å; H443-I446 WeakPolarHBondContact O-CG1 3.44Å; I446-A453 HydrophobicContact CG2-CB 3.9Å; I446-Q456 HydrophobicContact CG2-CB 4.39Å
447	C	87	Confident	91.7	Very high	33 Å²	33	70.1 Å²	70.1	22%	0.223	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-80.8	131.4	-173.9	-173.9	0	0	0	0	112.7	T449 K452 A453	C447-T449 PolarHBondContact O-N 3.16Å; C447-K452 HydrophobicContact CB-CB 4.49Å; C447-K452 HydrophobicContact CB-CD 3.8Å; C447-K452 HydrophobicContact CB-CG 4.09Å; C447-A453 WeakPolarHBondContact O-CB 3.48Å
448	D	87.2	Confident	91.8	Very high	145 Å²	145	72.2 Å²	72.2	78%	0.775	39%	0.394	S	S	*	.	S	Bend	trans	-55.3	-18.2	-177.4	-21.4	-62.9	0	0	0	115.2	P450	D448-P450 VanDerWaalsContact O-CD 3.25Å; D448-P450 WeakPolarHBondContact O-CD 3.45Å
449	T	90.4	Very high	92	Very high	82 Å²	82	74 Å²	74	50%	0.503	40%	0.4	S	S	.	.	S	Bend	trans	-74.4	112.2	177.2	-58.6	0	0	0	0	110	C447 A451 K452 A453	C447-T449 PolarHBondContact O-N 3.16Å; T449-A451 VanDerWaalsContact C-N 3.3Å; T449-A451 PolarHBondContact O-N 3.29Å; T449-A451 VanDerWaalsContact O-N 3.09Å; T449-K452 WeakPolarHBondContact O-CA 3.27Å; T449-K452 PolarHBondContact O-N 2.99Å; T449-A453 PolarHBondContact O-N 3.5Å
450	P	88.1	Confident	92.1	Very high	94 Å²	94	70.3 Å²	70.3	61%	0.61	39%	0.386	S	S	*	.	H	α-helix	trans	-58.4	-36.5	-165.7	-28.8	36.8	0	0	0	114.7	D448 K452 A453 N454	D448-P450 VanDerWaalsContact O-CD 3.25Å; D448-P450 WeakPolarHBondContact O-CD 3.45Å; P450-K452 VanDerWaalsContact C-N 3.34Å; P450-K452 PolarHBondContact O-N 3.34Å; P450-A453 PolarHBondContact O-N 2.83Å; P450-N454 PolarHBondContact O-N 3.4Å; P450-N454 PolarHBondContact O-ND2 2.86Å; P450-N454 PolarHBondContact O-OD1 3.45Å
451	A	88.9	Confident	92.3	Very high	62 Å²	62	64.6 Å²	64.6	51%	0.512	35%	0.351	S	S	.	.	H	α-helix	trans	-62.2	-41.1	175.4	0	0	0	0	0	112.2	T449 F455	T449-A451 VanDerWaalsContact C-N 3.3Å; T449-A451 PolarHBondContact O-N 3.29Å; T449-A451 VanDerWaalsContact O-N 3.09Å; A451-F455 WeakPolarHBondContact O-CD2 3.19Å; A451-F455 PolarHBondContact O-N 3.03Å
452	K	91.2	Very high	92.5	Very high	108 Å²	108	64.2 Å²	64.2	47%	0.47	35%	0.35	S	S	.	.	H	α-helix	trans	-76.1	-37.8	178	-174.4	176.4	164.5	-165.8	0	111.5	C447 T449 P450 N454 F455 Q456	C447-K452 HydrophobicContact CB-CB 4.49Å; C447-K452 HydrophobicContact CB-CD 3.8Å; C447-K452 HydrophobicContact CB-CG 4.09Å; T449-K452 WeakPolarHBondContact O-CA 3.27Å; T449-K452 PolarHBondContact O-N 2.99Å; P450-K452 VanDerWaalsContact C-N 3.34Å; P450-K452 PolarHBondContact O-N 3.34Å; K452-N454 VanDerWaalsContact C-N 3.34Å; K452-N454 PolarHBondContact O-N 2.62Å; K452-F455 PolarHBondContact O-N 2.92Å; K452-Q456 HydrophobicContact CG-CG 4.34Å; K452-Q456 WeakPolarHBondContact O-CG 3.45Å; K452-Q456 PolarHBondContact O-N 3.13Å
453	A	91.9	Very high	92.7	Very high	18 Å²	18	64.6 Å²	64.6	15%	0.149	35%	0.35	C	S	.	.	H	α-helix	trans	-51.5	-53.9	171.6	0	0	0	0	0	110.8	I446 C447 T449 P450 F455 Q456 C457	I446-A453 HydrophobicContact CG2-CB 3.9Å; C447-A453 WeakPolarHBondContact O-CB 3.48Å; T449-A453 PolarHBondContact O-N 3.5Å; P450-A453 PolarHBondContact O-N 2.83Å; A453-F455 VanDerWaalsContact C-N 3.33Å; A453-F455 PolarHBondContact O-N 3.49Å; A453-Q456 PolarHBondContact O-N 3.45Å; A453-Q456 VanDerWaalsContact O-N 3.07Å; A453-C457 WeakPolarHBondContact O-CB 3.39Å; A453-C457 PolarHBondContact O-N 3.21Å; A453-C457 PolarHBondContact O-SG 3.45Å
454	N	93	Very high	92.8	Very high	89 Å²	89	61.9 Å²	61.9	48%	0.476	34%	0.338	S	S	.	.	H	α-helix	trans	-58.2	-40.9	-179	-66.1	-7.2	0	0	0	112.9	P450 K452 L458 H484	P450-N454 PolarHBondContact O-N 3.4Å; P450-N454 PolarHBondContact O-ND2 2.86Å; P450-N454 PolarHBondContact O-OD1 3.45Å; K452-N454 VanDerWaalsContact C-N 3.34Å; K452-N454 PolarHBondContact O-N 2.62Å; N454-L458 WeakPolarHBondContact O-CB 3.47Å; N454-L458 PolarHBondContact O-N 3.1Å; N454-H484 PolarHBondContact O-NE2 3.09Å
455	F	94.1	Very high	93.2	Very high	138 Å²	138	57.4 Å²	57.4	61%	0.605	32%	0.316	S	S	*	.	H	α-helix	trans	-64.3	-46.1	174.3	-71.8	-60.4	0	0	0	111.7	A451 K452 A453 L458 E459	A451-F455 WeakPolarHBondContact O-CD2 3.19Å; A451-F455 PolarHBondContact O-N 3.03Å; K452-F455 PolarHBondContact O-N 2.92Å; A453-F455 VanDerWaalsContact C-N 3.33Å; A453-F455 PolarHBondContact O-N 3.49Å; F455-L458 PolarHBondContact O-N 3.35Å; F455-E459 WeakPolarHBondContact O-CG 3.38Å; F455-E459 PolarHBondContact O-N 3.2Å
456	Q	95.8	Very high	93.6	Very high	18 Å²	18	58.4 Å²	58.4	8%	0.084	31%	0.311	C	S	.	.	H	α-helix	trans	-65	-42.3	-179.6	-69.8	-174.7	-72.6	0	0	112.8	H443 I446 K452 A453 L458 E459 N460	H443-Q456 HydrophobicContact CB-CB 3.75Å; H443-Q456 HydrophobicContact CB-CG 4.07Å; H443-Q456 VanDerWaalsContact CG-NE2 3.27Å; H443-Q456 PolarHBondContact ND1-NE2 3.22Å; H443-Q456 VanDerWaalsContact ND1-NE2 3.18Å; I446-Q456 HydrophobicContact CG2-CB 4.39Å; K452-Q456 HydrophobicContact CG-CG 4.34Å; K452-Q456 WeakPolarHBondContact O-CG 3.45Å; K452-Q456 PolarHBondContact O-N 3.13Å; A453-Q456 PolarHBondContact O-N 3.45Å; A453-Q456 VanDerWaalsContact O-N 3.07Å; Q456-L458 VanDerWaalsContact C-N 3.34Å; Q456-E459 PolarHBondContact O-N 3.35Å; Q456-N460 PolarHBondContact O-N 3.01Å
457	C	95.8	Very high	94	Very high	13 Å²	13	56.5 Å²	56.5	9%	0.088	30%	0.301	C	S	.	.	H	α-helix	trans	-62.2	-41.3	173.8	-64	0	0	0	0	111.5	A453 N460 C461 H484	A453-C457 WeakPolarHBondContact O-CB 3.39Å; A453-C457 PolarHBondContact O-N 3.21Å; A453-C457 PolarHBondContact O-SG 3.45Å; C457-N460 PolarHBondContact O-N 3.01Å; C457-C461 WeakPolarHBondContact O-CB 3.3Å; C457-C461 PolarHBondContact O-N 3.48Å; C457-C461 PolarHBondContact O-SG 3.3Å; C457-C461 VanDerWaalsContact O-SG 3.35Å; C457-H484 VanDerWaalsContact CB-CD2 3.47Å; C457-H484 WeakPolarHBondContact CB-CD2 3.32Å
458	L	96.6	Very high	94.3	Very high	51 Å²	51	54.9 Å²	54.9	27%	0.267	29%	0.291	S	S	.	.	H	α-helix	trans	-67.1	-37.4	175.8	179.6	60.1	0	0	0	112.3	N454 F455 Q456 C461 N462 A481 H484	N454-L458 WeakPolarHBondContact O-CB 3.47Å; N454-L458 PolarHBondContact O-N 3.1Å; F455-L458 PolarHBondContact O-N 3.35Å; Q456-L458 VanDerWaalsContact C-N 3.34Å; L458-C461 PolarHBondContact O-N 3.37Å; L458-N462 WeakPolarHBondContact O-CB 3.24Å; L458-N462 VanDerWaalsContact O-CG 3.31Å; L458-N462 PolarHBondContact O-N 3.01Å; L458-N462 PolarHBondContact O-ND2 2.82Å; L458-A481 HydrophobicContact CD1-CB 4.05Å; L458-H484 HydrophobicContact CD1-CB 4.37Å
459	E	96.7	Very high	94.7	Very high	112 Å²	112	55 Å²	55	52%	0.523	28%	0.28	S	S	.	.	H	α-helix	trans	-66.1	-45.5	174.3	-74.5	178.4	116.7	0	0	111.6	H443 F455 Q456 C461 N462 Y463	H443-E459 IonicContact NE2-OE2 2.71Å; F455-E459 WeakPolarHBondContact O-CG 3.38Å; F455-E459 PolarHBondContact O-N 3.2Å; Q456-E459 PolarHBondContact O-N 3.35Å; E459-C461 PolarHBondContact O-N 2.99Å; E459-N462 PolarHBondContact O-N 3.13Å; E459-Y463 PolarHBondContact O-N 2.73Å
460	N	97.8	Very high	94.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-56.1	-49.1	170.8	-73.5	-11.8	0	0	0	111.4	D421 L423 L426 H443 Q456 C457 N462 Y463 V464	D421-N460 WeakPolarHBondContact O-CB 3.38Å; D421-N460 PolarHBondContact O-ND2 3.11Å; L423-N460 WeakPolarHBondContact CD2-ND2 3.26Å; L426-N460 HydrophobicContact CD1-CB 4.47Å; H443-N460 PolarHBondContact N-OD1 3.4Å; H443-N460 PolarHBondContact O-ND2 3.16Å; Q456-N460 PolarHBondContact O-N 3.01Å; C457-N460 PolarHBondContact O-N 3.01Å; N460-N462 VanDerWaalsContact C-N 3.35Å; N460-N462 PolarHBondContact O-N 2.99Å; N460-Y463 WeakPolarHBondContact O-CA 3.48Å; N460-Y463 WeakPolarHBondContact O-CB 3.49Å; N460-Y463 PolarHBondContact O-N 2.78Å; N460-V464 WeakPolarHBondContact O-CG2 3.36Å; N460-V464 PolarHBondContact O-N 3.25Å
461	C	97.6	Very high	94.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-33.8	178.6	-75.4	0	0	0	0	113.4	I420 C457 L458 E459 Y463 V464 I465 G480 L483	I420-C461 PolarHBondContact O-SG 2.93Å; C457-C461 WeakPolarHBondContact O-CB 3.3Å; C457-C461 PolarHBondContact O-N 3.48Å; C457-C461 PolarHBondContact O-SG 3.3Å; C457-C461 VanDerWaalsContact O-SG 3.35Å; L458-C461 PolarHBondContact O-N 3.37Å; E459-C461 PolarHBondContact O-N 2.99Å; C461-Y463 VanDerWaalsContact C-N 3.32Å; C461-V464 WeakPolarHBondContact O-CB 3.35Å; C461-V464 PolarHBondContact O-N 3.25Å; C461-I465 WeakPolarHBondContact O-CG1 3.38Å; C461-I465 PolarHBondContact O-N 3.34Å; C461-I465 VanDerWaalsContact O-N 3.14Å; C461-G480 VanDerWaalsContact CB-O 3.3Å; C461-G480 WeakPolarHBondContact CB-O 3.15Å; C461-L483 HydrophobicContact CB-CB 4.21Å; C461-L483 HydrophobicContact CB-CD1 4.47Å
462	N	97.4	Very high	94.7	Very high	78 Å²	78	55.6 Å²	55.6	42%	0.417	28%	0.275	S	S	.	.	H	α-helix	trans	-67.2	-34	171.5	-78.5	-49.5	0	0	0	111.7	L458 E459 N460 I465 K466 G480	L458-N462 WeakPolarHBondContact O-CB 3.24Å; L458-N462 VanDerWaalsContact O-CG 3.31Å; L458-N462 PolarHBondContact O-N 3.01Å; L458-N462 PolarHBondContact O-ND2 2.82Å; E459-N462 PolarHBondContact O-N 3.13Å; N460-N462 VanDerWaalsContact C-N 3.35Å; N460-N462 PolarHBondContact O-N 2.99Å; N462-I465 PolarHBondContact O-N 3.22Å; N462-K466 WeakPolarHBondContact O-CB 3.44Å; N462-K466 PolarHBondContact O-N 3.25Å; N462-G480 WeakPolarHBondContact OD1-CA 3.39Å; N462-G480 PolarHBondContact OD1-N 3.45Å
463	Y	97.7	Very high	94.7	Very high	23 Å²	23	51.6 Å²	51.6	9%	0.09	26%	0.258	C	S	.	.	H	α-helix	trans	-69.2	-40.9	172.8	-174.2	-156	0	0	0	112.2	L426 I436 V437 N438 I441 V442 E459 N460 C461 I465 K466 L467	L426-Y463 HydrophobicContact CD2-CD1 3.88Å; L426-Y463 HydrophobicContact CD2-CE1 4.22Å; L426-Y463 HydrophobicContact CD2-CG 4.3Å; I436-Y463 PolarHBondContact O-OH 2.95Å; V437-Y463 HydrophobicContact CG1-CE1 4.11Å; N438-Y463 PolarHBondContact N-OH 2.97Å; I441-Y463 HydrophobicContact CD1-CD1 3.96Å; I441-Y463 HydrophobicContact CD1-CD2 4.38Å; I441-Y463 HydrophobicContact CD1-CE1 3.76Å; I441-Y463 HydrophobicContact CD1-CE2 4.23Å; I441-Y463 HydrophobicContact CD1-CG 4.29Å; I441-Y463 HydrophobicContact CG1-CD1 4.13Å; I441-Y463 HydrophobicContact CG1-CE1 3.82Å; V442-Y463 HydrophobicContact CG2-CD1 4.05Å; V442-Y463 HydrophobicContact CG2-CE1 3.98Å; E459-Y463 PolarHBondContact O-N 2.73Å; N460-Y463 WeakPolarHBondContact O-CA 3.48Å; N460-Y463 WeakPolarHBondContact O-CB 3.49Å; N460-Y463 PolarHBondContact O-N 2.78Å; C461-Y463 VanDerWaalsContact C-N 3.32Å; Y463-I465 VanDerWaalsContact C-N 3.31Å; Y463-I465 PolarHBondContact O-N 3.23Å; Y463-K466 HydrophobicContact CD2-CB 4.39Å; Y463-K466 HydrophobicContact CD2-CD 4.19Å; Y463-K466 WeakPolarHBondContact O-CB 3.08Å; Y463-K466 PolarHBondContact O-N 3.21Å; Y463-K466 VanDerWaalsContact O-N 3.09Å; Y463-L467 HydrophobicContact CD2-CD1 4.33Å; Y463-L467 HydrophobicContact CD2-CD2 4.41Å; Y463-L467 HydrophobicContact CD2-CG 3.9Å; Y463-L467 HydrophobicContact CE1-CD1 4.47Å; Y463-L467 HydrophobicContact CE2-CD1 3.92Å; Y463-L467 HydrophobicContact CE2-CD2 3.57Å; Y463-L467 HydrophobicContact CE2-CG 3.5Å; Y463-L467 PolarHBondContact O-N 3.31Å
464	V	97.5	Very high	94.7	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-52.2	-47.7	171.1	168.3	0	0	0	0	111.5	L425 L426 F429 N460 C461 L467 G468 L483 L494	L425-V464 HydrophobicContact CB-CB 4.49Å; L425-V464 HydrophobicContact CB-CG1 3.82Å; L425-V464 HydrophobicContact CB-CG2 3.75Å; L425-V464 HydrophobicContact CD1-CG1 4.01Å; L426-V464 HydrophobicContact CD2-CG2 3.75Å; L426-V464 HydrophobicContact CG-CG2 3.7Å; F429-V464 HydrophobicContact CE2-CG1 4.05Å; F429-V464 WeakPolarHBondContact CE2-O 3.22Å; N460-V464 WeakPolarHBondContact O-CG2 3.36Å; N460-V464 PolarHBondContact O-N 3.25Å; C461-V464 WeakPolarHBondContact O-CB 3.35Å; C461-V464 PolarHBondContact O-N 3.25Å; V464-L467 PolarHBondContact O-N 3.35Å; V464-G468 PolarHBondContact O-N 2.9Å; V464-L483 HydrophobicContact CB-CD1 4.26Å; V464-L483 HydrophobicContact CG1-CD1 3.67Å; V464-L494 HydrophobicContact CG1-CD2 3.66Å
465	I	97.3	Very high	94.6	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-68.3	-35.4	177.9	-65.9	-63	0	0	0	112.3	C461 N462 Y463 G468 R469 L475 V478 L483	C461-I465 WeakPolarHBondContact O-CG1 3.38Å; C461-I465 PolarHBondContact O-N 3.34Å; C461-I465 VanDerWaalsContact O-N 3.14Å; N462-I465 PolarHBondContact O-N 3.22Å; Y463-I465 VanDerWaalsContact C-N 3.31Å; Y463-I465 PolarHBondContact O-N 3.23Å; I465-G468 PolarHBondContact O-N 3.35Å; I465-R469 VanDerWaalsContact CG2-CZ 3.48Å; I465-R469 VanDerWaalsContact O-CG 3.31Å; I465-R469 WeakPolarHBondContact O-CG 3.26Å; I465-R469 PolarHBondContact O-N 3.04Å; I465-L475 HydrophobicContact CD1-CD1 4.04Å; I465-L475 HydrophobicContact CD1-CD2 4.49Å; I465-V478 HydrophobicContact CD1-CB 4.33Å; I465-V478 HydrophobicContact CD1-CG1 3.65Å; I465-L483 HydrophobicContact CD1-CD1 3.76Å; I465-L483 HydrophobicContact CD1-CG 4.31Å; I465-L483 HydrophobicContact CG1-CD1 3.9Å
466	K	96	Very high	94.4	Very high	116 Å²	116	50.8 Å²	50.8	50%	0.504	27%	0.269	S	S	.	.	H	α-helix	trans	-62.9	-45.3	173.6	177.2	-177.2	173.4	-171.1	0	111.5	N462 Y463 R469 Q470	N462-K466 WeakPolarHBondContact O-CB 3.44Å; N462-K466 PolarHBondContact O-N 3.25Å; Y463-K466 HydrophobicContact CD2-CB 4.39Å; Y463-K466 HydrophobicContact CD2-CD 4.19Å; Y463-K466 WeakPolarHBondContact O-CB 3.08Å; Y463-K466 PolarHBondContact O-N 3.21Å; Y463-K466 VanDerWaalsContact O-N 3.09Å; K466-R469 PolarHBondContact O-N 2.84Å; K466-Q470 WeakPolarHBondContact O-CG 3.38Å; K466-Q470 PolarHBondContact O-N 3.26Å; K466-Q470 VanDerWaalsContact O-N 3.13Å
467	L	95.6	Very high	94	Very high	2 Å²	2	53 Å²	53	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-62	-48.7	174.5	-70.9	177.2	0	0	0	111.3	L426 F429 I436 V437 Y463 V464 R469 Q470 F471	L426-L467 HydrophobicContact CD2-CD1 3.66Å; F429-L467 HydrophobicContact CB-CD1 4.17Å; F429-L467 HydrophobicContact CD1-CB 4.36Å; F429-L467 HydrophobicContact CD2-CB 3.93Å; F429-L467 HydrophobicContact CD2-CD1 3.88Å; F429-L467 HydrophobicContact CE1-CB 4.27Å; F429-L467 HydrophobicContact CE2-CB 3.84Å; F429-L467 HydrophobicContact CG-CB 4.2Å; F429-L467 HydrophobicContact CG-CD1 4.12Å; F429-L467 HydrophobicContact CZ-CB 4.02Å; I436-L467 HydrophobicContact CG1-CD2 4.18Å; V437-L467 HydrophobicContact CG2-CD1 3.99Å; Y463-L467 HydrophobicContact CD2-CD1 4.33Å; Y463-L467 HydrophobicContact CD2-CD2 4.41Å; Y463-L467 HydrophobicContact CD2-CG 3.9Å; Y463-L467 HydrophobicContact CE1-CD1 4.47Å; Y463-L467 HydrophobicContact CE2-CD1 3.92Å; Y463-L467 HydrophobicContact CE2-CD2 3.57Å; Y463-L467 HydrophobicContact CE2-CG 3.5Å; Y463-L467 PolarHBondContact O-N 3.31Å; V464-L467 PolarHBondContact O-N 3.35Å; L467-R469 VanDerWaalsContact C-N 3.26Å; L467-R469 PolarHBondContact O-N 3.3Å; L467-Q470 CarbonylContact O-C 3.58Å; L467-Q470 WeakPolarHBondContact O-CA 3.48Å; L467-Q470 WeakPolarHBondContact O-CB 3.47Å; L467-Q470 PolarHBondContact O-N 3.07Å; L467-F471 WeakPolarHBondContact O-CD2 3.3Å; L467-F471 PolarHBondContact O-N 3.11Å
468	G	94.4	Very high	93.9	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-56.5	-39.6	178.6	0	0	0	0	0	113.1	F429 V464 I465 F471 G472 F473	F429-G468 VanDerWaalsContact CZ-CA 3.48Å; V464-G468 PolarHBondContact O-N 2.9Å; I465-G468 PolarHBondContact O-N 3.35Å; G468-F471 PolarHBondContact O-N 2.81Å; G468-G472 PolarHBondContact O-N 3.27Å; G468-F473 VanDerWaalsContact O-CB 3.27Å; G468-F473 WeakPolarHBondContact O-CB 3.38Å; G468-F473 PolarHBondContact O-N 3.31Å
469	R	93.8	Very high	93.8	Very high	148 Å²	148	51.3 Å²	51.3	56%	0.558	29%	0.292	S	S	*	.	H	α-helix	trans	-67.2	-33.2	173.8	-69.1	171.6	-172.4	173.3	5.4	112.8	I465 K466 L467 G472 L475 V478	I465-R469 VanDerWaalsContact CG2-CZ 3.48Å; I465-R469 VanDerWaalsContact O-CG 3.31Å; I465-R469 WeakPolarHBondContact O-CG 3.26Å; I465-R469 PolarHBondContact O-N 3.04Å; K466-R469 PolarHBondContact O-N 2.84Å; L467-R469 VanDerWaalsContact C-N 3.26Å; L467-R469 PolarHBondContact O-N 3.3Å; R469-G472 PolarHBondContact O-N 2.99Å; R469-L475 HydrophobicContact CG-CB 4.46Å; R469-L475 HydrophobicContact CG-CD1 4.43Å; R469-V478 PolarHBondContact NH2-O 3.33Å
470	Q	91.3	Very high	93.7	Very high	132 Å²	132	46 Å²	46	62%	0.617	27%	0.267	S	S	*	.	H	α-helix	trans	-71	-33.9	173.2	-69.8	174.7	-52.2	0	0	112.6	K466 L467 G472	K466-Q470 WeakPolarHBondContact O-CG 3.38Å; K466-Q470 PolarHBondContact O-N 3.26Å; K466-Q470 VanDerWaalsContact O-N 3.13Å; L467-Q470 CarbonylContact O-C 3.58Å; L467-Q470 WeakPolarHBondContact O-CA 3.48Å; L467-Q470 WeakPolarHBondContact O-CB 3.47Å; L467-Q470 PolarHBondContact O-N 3.07Å; Q470-G472 PolarHBondContact O-N 2.87Å
471	F	87.6	Confident	93.6	Very high	53 Å²	53	48 Å²	48	23%	0.232	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-3.8	169.3	-88.4	-92.3	0	0	0	113.9	F429 I432 Q433 I436 L467 G468 F473	F429-F471 HydrophobicContact CB-CE2 4.49Å; F429-F471 AromaticContact CD1-CD2 3.54Å; F429-F471 HydrophobicContact CD1-CD2 3.54Å; F429-F471 AromaticContact CD1-CE2 3.33Å; F429-F471 HydrophobicContact CD1-CE2 3.33Å; F429-F471 HydrophobicContact CD1-CG 4.3Å; F429-F471 AromaticContact CD1-CZ 3.95Å; F429-F471 HydrophobicContact CD1-CZ 3.95Å; F429-F471 HydrophobicContact CE1-CB 4.46Å; F429-F471 AromaticContact CE1-CD2 3.53Å; F429-F471 HydrophobicContact CE1-CD2 3.53Å; F429-F471 AromaticContact CE1-CE2 3.86Å; F429-F471 HydrophobicContact CE1-CE2 3.86Å; F429-F471 HydrophobicContact CE1-CG 4.05Å; F429-F471 HydrophobicContact CG-CE2 4.26Å; I432-F471 HydrophobicContact CG2-CE1 3.76Å; I432-F471 HydrophobicContact CG2-CZ 4.26Å; Q433-F471 HydrophobicContact CB-CE1 4.42Å; Q433-F471 HydrophobicContact CB-CZ 3.98Å; I436-F471 HydrophobicContact CD1-CD2 4.29Å; I436-F471 HydrophobicContact CD1-CE2 3.44Å; I436-F471 VanDerWaalsContact CD1-CE2 3.44Å; I436-F471 HydrophobicContact CD1-CZ 3.69Å; I436-F471 HydrophobicContact CG1-CE2 3.87Å; I436-F471 HydrophobicContact CG1-CZ 4.36Å; I436-F471 HydrophobicContact CG2-CE2 4.09Å; I436-F471 HydrophobicContact CG2-CZ 4.24Å; L467-F471 WeakPolarHBondContact O-CD2 3.3Å; L467-F471 PolarHBondContact O-N 3.11Å; G468-F471 PolarHBondContact O-N 2.81Å; F471-F473 HydrophobicContact CB-CD1 3.85Å; F471-F473 HydrophobicContact CB-CE1 3.7Å; F471-F473 HydrophobicContact CB-CG 4.36Å; F471-F473 HydrophobicContact CB-CZ 4.1Å; F471-F473 HydrophobicContact CD1-CE1 4.4Å; F471-F473 HydrophobicContact CG-CE1 4.33Å; F471-F473 HydrophobicContact CG-CZ 4.41Å
472	G	88.6	Confident	93.6	Very high	65 Å²	65	49.4 Å²	49.4	67%	0.67	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.6	20.3	-177.6	0	0	0	0	0	114.5	G468 R469 Q470	G468-G472 PolarHBondContact O-N 3.27Å; R469-G472 PolarHBondContact O-N 2.99Å; Q470-G472 PolarHBondContact O-N 2.87Å
473	F	92.8	Very high	93.5	Very high	23 Å²	23	45.9 Å²	45.9	10%	0.101	27%	0.272	C	S	.	.			trans	-67.2	141.9	175.4	-64.6	-4.8	0	0	0	111.2	F429 G468 F471 L475 L494 Q497 L498 A501	F429-F473 HydrophobicContact CE1-CD2 4.29Å; F429-F473 AromaticContact CE1-CE2 3.53Å; F429-F473 HydrophobicContact CE1-CE2 3.53Å; F429-F473 AromaticContact CE1-CZ 3.94Å; F429-F473 HydrophobicContact CE1-CZ 3.94Å; F429-F473 HydrophobicContact CZ-CD2 4.24Å; F429-F473 AromaticContact CZ-CE2 3.76Å; F429-F473 HydrophobicContact CZ-CE2 3.76Å; G468-F473 VanDerWaalsContact O-CB 3.27Å; G468-F473 WeakPolarHBondContact O-CB 3.38Å; G468-F473 PolarHBondContact O-N 3.31Å; F471-F473 HydrophobicContact CB-CD1 3.85Å; F471-F473 HydrophobicContact CB-CE1 3.7Å; F471-F473 HydrophobicContact CB-CG 4.36Å; F471-F473 HydrophobicContact CB-CZ 4.1Å; F471-F473 HydrophobicContact CD1-CE1 4.4Å; F471-F473 HydrophobicContact CG-CE1 4.33Å; F471-F473 HydrophobicContact CG-CZ 4.41Å; F473-L475 HydrophobicContact CB-CD1 4.11Å; F473-L475 HydrophobicContact CB-CG 3.93Å; F473-L475 PolarHBondContact O-N 3Å; F473-L494 HydrophobicContact CD2-CD1 3.96Å; F473-L494 HydrophobicContact CE2-CD1 4.21Å; F473-Q497 HydrophobicContact CB-CB 4.46Å; F473-Q497 HydrophobicContact CD1-CB 4.16Å; F473-Q497 HydrophobicContact CD2-CB 3.87Å; F473-Q497 HydrophobicContact CE1-CB 4.35Å; F473-Q497 HydrophobicContact CE2-CB 4.08Å; F473-Q497 HydrophobicContact CG-CB 3.92Å; F473-Q497 HydrophobicContact CZ-CB 4.32Å; F473-L498 HydrophobicContact CE2-CD2 3.78Å; F473-L498 HydrophobicContact CE2-CG 3.99Å; F473-L498 HydrophobicContact CZ-CD2 4.16Å; F473-A501 HydrophobicContact CE1-CB 3.84Å; F473-A501 HydrophobicContact CZ-CB 3.82Å
474	S	91.6	Very high	93.4	Very high	85 Å²	85	46.6 Å²	46.6	59%	0.594	28%	0.276	S	S	*	.			trans	-73.3	96.8	170.3	-169.8	0	0	0	0	109.1	Q497	S474-Q497 PolarHBondContact O-NE2 3.11Å
475	L	91.3	Very high	93.3	Very high	7 Å²	7	51.1 Å²	51.1	4%	0.037	30%	0.301	C	S	.	.			trans	-122.6	34.4	178.6	-62.2	175.6	0	0	0	110.6	I465 R469 F473 G477 V478 L494	I465-L475 HydrophobicContact CD1-CD1 4.04Å; I465-L475 HydrophobicContact CD1-CD2 4.49Å; R469-L475 HydrophobicContact CG-CB 4.46Å; R469-L475 HydrophobicContact CG-CD1 4.43Å; F473-L475 HydrophobicContact CB-CD1 4.11Å; F473-L475 HydrophobicContact CB-CG 3.93Å; F473-L475 PolarHBondContact O-N 3Å; L475-G477 PolarHBondContact O-N 3.04Å; L475-V478 HydrophobicContact CB-CB 4.32Å; L475-V478 HydrophobicContact CD2-CB 4.47Å; L475-V478 HydrophobicContact CD2-CG2 4.47Å; L475-V478 PolarHBondContact O-N 2.74Å; L475-L494 HydrophobicContact CD1-CD1 4.49Å; L475-L494 HydrophobicContact CD2-CD1 4.2Å
476	V	88.2	Confident	93	Very high	136 Å²	136	51.6 Å²	51.6	82%	0.824	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	122.6	175.4	-177.2	0	0	0	0	108.3	V478	V476-V478 VanDerWaalsContact C-N 3.34Å
477	G	89.2	Confident	92.9	Very high	64 Å²	64	49.9 Å²	49.9	66%	0.66	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	10.7	-174.8	0	0	0	0	0	115.1	L475	L475-G477 PolarHBondContact O-N 3.04Å
478	V	92.3	Very high	92.8	Very high	8 Å²	8	53.6 Å²	53.6	5%	0.048	31%	0.313	C	S	.	.			trans	-114.7	124	174.4	-167.3	0	0	0	0	110.7	I465 R469 L475 V476 D482 M490	I465-V478 HydrophobicContact CD1-CB 4.33Å; I465-V478 HydrophobicContact CD1-CG1 3.65Å; R469-V478 PolarHBondContact NH2-O 3.33Å; L475-V478 HydrophobicContact CB-CB 4.32Å; L475-V478 HydrophobicContact CD2-CB 4.47Å; L475-V478 HydrophobicContact CD2-CG2 4.47Å; L475-V478 PolarHBondContact O-N 2.74Å; V476-V478 VanDerWaalsContact C-N 3.34Å; V478-D482 HydrophobicContact CG1-CB 4.31Å; V478-M490 HydrophobicContact CG1-CB 4.04Å; V478-M490 HydrophobicContact CG2-CB 4.41Å; V478-M490 HydrophobicContact CG2-CG 4.41Å; V478-M490 HydrophobicContact CG2-SD 3.89Å
479	G	94.4	Very high	92.7	Very high	22 Å²	22	58.9 Å²	58.9	23%	0.227	35%	0.345	C	S	.	.			trans	-115.2	172.7	170.4	0	0	0	0	0	112.7	A481 D482	G479-A481 PolarHBondContact O-N 3.27Å; G479-D482 PolarHBondContact N-OD2 3.35Å; G479-D482 PolarHBondContact O-N 3.14Å; G479-D482 VanDerWaalsContact O-N 3.11Å
480	G	95.6	Very high	92.7	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63.5	-31.9	179.6	0	0	0	0	0	113	C461 N462 D482 L483 H484	C461-G480 VanDerWaalsContact CB-O 3.3Å; C461-G480 WeakPolarHBondContact CB-O 3.15Å; N462-G480 WeakPolarHBondContact OD1-CA 3.39Å; N462-G480 PolarHBondContact OD1-N 3.45Å; G480-D482 VanDerWaalsContact C-N 3.26Å; G480-D482 PolarHBondContact O-N 3.15Å; G480-L483 PolarHBondContact O-N 3.49Å; G480-H484 PolarHBondContact O-N 2.97Å
481	A	96.4	Very high	92.9	Very high	41 Å²	41	48.7 Å²	48.7	34%	0.339	31%	0.305	S	S	.	.	H	α-helix	trans	-58.8	-35	173.3	0	0	0	0	0	112.4	L458 G479 L483 H484 D485	L458-A481 HydrophobicContact CD1-CB 4.05Å; G479-A481 PolarHBondContact O-N 3.27Å; A481-L483 VanDerWaalsContact C-N 3.27Å; A481-L483 PolarHBondContact O-N 3.46Å; A481-H484 PolarHBondContact O-N 2.77Å; A481-D485 WeakPolarHBondContact O-CB 3.37Å; A481-D485 PolarHBondContact O-N 3.25Å
482	D	96.4	Very high	93.3	Very high	31 Å²	31	47.4 Å²	47.4	17%	0.166	30%	0.3	C	S	.	.	H	α-helix	trans	-69.3	-26.4	-179.2	-57.6	-60.3	0	0	0	113.4	V478 G479 G480 K487 M490	V478-D482 HydrophobicContact CG1-CB 4.31Å; G479-D482 PolarHBondContact N-OD2 3.35Å; G479-D482 PolarHBondContact O-N 3.14Å; G479-D482 VanDerWaalsContact O-N 3.11Å; G480-D482 VanDerWaalsContact C-N 3.26Å; G480-D482 PolarHBondContact O-N 3.15Å; D482-K487 HydrophobicContact CB-CD 3.99Å; D482-K487 VanDerWaalsContact O-CB 3.31Å; D482-K487 WeakPolarHBondContact O-CB 3.35Å; D482-K487 PolarHBondContact O-N 3.12Å; D482-K487 WeakPolarHBondContact OD1-CD 3.28Å; D482-K487 IonicContact OD1-NZ 3.22Å; D482-K487 PolarHBondContact OD1-NZ 2.96Å; D482-M490 HydrophobicContact CB-CB 4.2Å; D482-M490 HydrophobicContact CB-CG 4.06Å
483	L	95.6	Very high	93.5	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-80.1	-45.1	172.8	-57.4	178.2	0	0	0	110.8	L425 C461 V464 I465 G480 A481 D485 G486 L494	L425-L483 HydrophobicContact CD1-CD1 4.07Å; C461-L483 HydrophobicContact CB-CB 4.21Å; C461-L483 HydrophobicContact CB-CD1 4.47Å; V464-L483 HydrophobicContact CB-CD1 4.26Å; V464-L483 HydrophobicContact CG1-CD1 3.67Å; I465-L483 HydrophobicContact CD1-CD1 3.76Å; I465-L483 HydrophobicContact CD1-CG 4.31Å; I465-L483 HydrophobicContact CG1-CD1 3.9Å; G480-L483 PolarHBondContact O-N 3.49Å; A481-L483 VanDerWaalsContact C-N 3.27Å; A481-L483 PolarHBondContact O-N 3.46Å; L483-D485 VanDerWaalsContact C-N 3.31Å; L483-D485 PolarHBondContact O-N 3.09Å; L483-G486 PolarHBondContact O-N 2.76Å; L483-L494 HydrophobicContact CD1-CD2 3.78Å; L483-L494 HydrophobicContact CD2-CD2 3.88Å
484	H	95.9	Very high	93.6	Very high	37 Å²	37	45 Å²	45	17%	0.171	28%	0.279	C	S	.	.	H	α-helix	trans	-60.8	-37.9	176.8	-177.7	-85.1	0	0	0	112.7	I420 N454 C457 L458 G480 A481 G486	I420-H484 WeakPolarHBondContact CG2-O 3.21Å; N454-H484 PolarHBondContact O-NE2 3.09Å; C457-H484 VanDerWaalsContact CB-CD2 3.47Å; C457-H484 WeakPolarHBondContact CB-CD2 3.32Å; L458-H484 HydrophobicContact CD1-CB 4.37Å; G480-H484 PolarHBondContact O-N 2.97Å; A481-H484 PolarHBondContact O-N 2.77Å; H484-G486 PolarHBondContact O-N 3.31Å
485	D	94.3	Very high	93.8	Very high	96 Å²	96	41 Å²	41	51%	0.513	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	0.2	174.2	-63.2	-16.2	0	0	0	113	A481 L483 K487	A481-D485 WeakPolarHBondContact O-CB 3.37Å; A481-D485 PolarHBondContact O-N 3.25Å; L483-D485 VanDerWaalsContact C-N 3.31Å; L483-D485 PolarHBondContact O-N 3.09Å; D485-K487 VanDerWaalsContact C-N 3.34Å; D485-K487 HydrophobicContact CB-CD 4.3Å; D485-K487 HydrophobicContact CB-CG 4.01Å; D485-K487 PolarHBondContact O-N 2.92Å; D485-K487 WeakPolarHBondContact OD2-CE 3.5Å; D485-K487 IonicContact OD2-NZ 3.85Å; D485-K487 PolarHBondContact OD2-NZ 3.47Å
486	G	92.5	Very high	93.9	Very high	13 Å²	13	42.2 Å²	42.2	13%	0.134	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	25.5	179.1	0	0	0	0	0	115.1	F416 L483 H484 R488	F416-G486 WeakPolarHBondContact O-CA 3.39Å; L483-G486 PolarHBondContact O-N 2.76Å; H484-G486 PolarHBondContact O-N 3.31Å; G486-R488 PolarHBondContact O-N 2.81Å
487	K	93.7	Very high	94.1	Very high	80 Å²	80	37.3 Å²	37.3	35%	0.348	22%	0.223	S	C	.	.			trans	-67.2	112.1	-170.8	-64.8	174.7	-170.7	145.9	0	111	D482 D485 T489 M490 T491	D482-K487 HydrophobicContact CB-CD 3.99Å; D482-K487 VanDerWaalsContact O-CB 3.31Å; D482-K487 WeakPolarHBondContact O-CB 3.35Å; D482-K487 PolarHBondContact O-N 3.12Å; D482-K487 WeakPolarHBondContact OD1-CD 3.28Å; D482-K487 IonicContact OD1-NZ 3.22Å; D482-K487 PolarHBondContact OD1-NZ 2.96Å; D485-K487 VanDerWaalsContact C-N 3.34Å; D485-K487 HydrophobicContact CB-CD 4.3Å; D485-K487 HydrophobicContact CB-CG 4.01Å; D485-K487 PolarHBondContact O-N 2.92Å; D485-K487 WeakPolarHBondContact OD2-CE 3.5Å; D485-K487 IonicContact OD2-NZ 3.85Å; D485-K487 PolarHBondContact OD2-NZ 3.47Å; K487-T489 PolarHBondContact O-N 3Å; K487-M490 HydrophobicContact CB-CG 4.32Å; K487-M490 PolarHBondContact O-N 3.27Å; K487-M490 VanDerWaalsContact O-N 3.15Å; K487-T491 PolarHBondContact O-N 3.26Å; K487-T491 PolarHBondContact O-OG1 3.13Å
488	R	92.6	Very high	94.4	Very high	81 Å²	81	34.3 Å²	34.3	31%	0.306	19%	0.191	S	C	.	.	H	α-helix	trans	-49.6	-55.9	-169.7	-62	-176.6	77.4	149.1	-5.3	113.1	E396 F416 G486 M490 T491 L492	E396-R488 IonicContact OE1-CZ 3.41Å; E396-R488 IonicContact OE1-NE 2.81Å; E396-R488 PolarHBondContact OE1-NE 2.9Å; E396-R488 IonicContact OE1-NH2 3.56Å; E396-R488 PolarHBondContact OE1-NH2 2.61Å; E396-R488 IonicContact OE2-NH2 3.17Å; E396-R488 PolarHBondContact OE2-NH2 3.25Å; F416-R488 HydrophobicContact CD1-CB 4.18Å; F416-R488 HydrophobicContact CD1-CG 3.87Å; F416-R488 HydrophobicContact CD2-CG 3.78Å; F416-R488 VanDerWaalsContact CE1-CA 3.48Å; F416-R488 HydrophobicContact CE1-CB 3.81Å; F416-R488 HydrophobicContact CE1-CG 3.85Å; F416-R488 HydrophobicContact CE2-CB 4.37Å; F416-R488 HydrophobicContact CE2-CG 3.75Å; F416-R488 HydrophobicContact CG-CG 3.82Å; F416-R488 HydrophobicContact CZ-CB 3.88Å; F416-R488 HydrophobicContact CZ-CG 3.77Å; G486-R488 PolarHBondContact O-N 2.81Å; R488-M490 VanDerWaalsContact C-N 3.34Å; R488-M490 PolarHBondContact O-N 2.91Å; R488-T491 PolarHBondContact O-N 3.42Å; R488-L492 WeakPolarHBondContact O-CG 3.02Å; R488-L492 PolarHBondContact O-N 2.79Å
489	T	93	Very high	94.4	Very high	111 Å²	111	34 Å²	34	68%	0.681	19%	0.189	S	C	*	.	H	α-helix	trans	-58	-42.3	-177.4	-45.1	0	0	0	0	113.1	K487 A493	K487-T489 PolarHBondContact O-N 3Å; T489-A493 VanDerWaalsContact O-CB 3.26Å; T489-A493 WeakPolarHBondContact O-CB 3.34Å; T489-A493 PolarHBondContact O-N 3.21Å
490	M	94.4	Very high	94.2	Very high	61 Å²	61	37.4 Å²	37.4	30%	0.3	20%	0.196	S	C	.	.	H	α-helix	trans	-73.6	-39.7	-177.5	-54.8	-44.4	-167.7	0	0	111.5	V478 D482 K487 R488 A493 L494	V478-M490 HydrophobicContact CG1-CB 4.04Å; V478-M490 HydrophobicContact CG2-CB 4.41Å; V478-M490 HydrophobicContact CG2-CG 4.41Å; V478-M490 HydrophobicContact CG2-SD 3.89Å; D482-M490 HydrophobicContact CB-CB 4.2Å; D482-M490 HydrophobicContact CB-CG 4.06Å; K487-M490 HydrophobicContact CB-CG 4.32Å; K487-M490 PolarHBondContact O-N 3.27Å; K487-M490 VanDerWaalsContact O-N 3.15Å; R488-M490 VanDerWaalsContact C-N 3.34Å; R488-M490 PolarHBondContact O-N 2.91Å; M490-A493 PolarHBondContact O-N 3.34Å; M490-L494 PolarHBondContact O-N 3.37Å
491	T	95.4	Very high	93.9	Very high	4 Å²	4	38.3 Å²	38.3	3%	0.025	20%	0.203	C	C	.	.	H	α-helix	trans	-62	-48.2	175.6	-52.4	0	0	0	0	110.7	F416 L419 K487 R488 A493 L494 L495	F416-T491 HydrophobicContact CD1-CG2 4.09Å; F416-T491 HydrophobicContact CE1-CG2 4.2Å; L419-T491 HydrophobicContact CD1-CG2 3.99Å; K487-T491 PolarHBondContact O-N 3.26Å; K487-T491 PolarHBondContact O-OG1 3.13Å; R488-T491 PolarHBondContact O-N 3.42Å; T491-A493 PolarHBondContact O-N 3.45Å; T491-L494 PolarHBondContact O-N 2.95Å; T491-L495 HydrophobicContact CG2-CD1 4.02Å; T491-L495 WeakPolarHBondContact O-CB 3.46Å; T491-L495 VanDerWaalsContact O-CG 3.29Å; T491-L495 WeakPolarHBondContact O-CG 3.34Å; T491-L495 PolarHBondContact O-N 3.18Å
492	L	94.5	Very high	93.6	Very high	26 Å²	26	38.3 Å²	38.3	14%	0.136	20%	0.195	C	C	.	.	H	α-helix	trans	-65.2	-37.3	176.7	-64.6	175.1	0	0	0	112.7	E396 Y399 F416 R488 L494 L495 W496	E396-L492 HydrophobicContact CG-CD1 4.23Å; E396-L492 HydrophobicContact CG-CD2 3.72Å; Y399-L492 HydrophobicContact CD2-CD2 3.69Å; Y399-L492 HydrophobicContact CE2-CD2 3.83Å; F416-L492 HydrophobicContact CE1-CD2 4.29Å; F416-L492 HydrophobicContact CE1-CG 4.09Å; F416-L492 HydrophobicContact CZ-CD1 4.25Å; F416-L492 HydrophobicContact CZ-CD2 4.14Å; F416-L492 HydrophobicContact CZ-CG 4.11Å; R488-L492 WeakPolarHBondContact O-CG 3.02Å; R488-L492 PolarHBondContact O-N 2.79Å; L492-L494 VanDerWaalsContact C-N 3.32Å; L492-L494 PolarHBondContact O-N 2.92Å; L492-L495 HydrophobicContact CD2-CD1 4.49Å; L492-L495 PolarHBondContact O-N 3.39Å; L492-W496 WeakPolarHBondContact O-CB 3.44Å; L492-W496 PolarHBondContact O-N 3.09Å
493	A	93	Very high	93.1	Very high	39 Å²	39	37.3 Å²	37.3	32%	0.322	19%	0.19	S	C	.	.	H	α-helix	trans	-65.8	-31.9	175.9	0	0	0	0	0	113.2	T489 M490 T491 Q497	T489-A493 VanDerWaalsContact O-CB 3.26Å; T489-A493 WeakPolarHBondContact O-CB 3.34Å; T489-A493 PolarHBondContact O-N 3.21Å; M490-A493 PolarHBondContact O-N 3.34Å; T491-A493 PolarHBondContact O-N 3.45Å; A493-Q497 WeakPolarHBondContact O-CG 3.13Å; A493-Q497 PolarHBondContact O-NE2 2.93Å
494	L	95.8	Very high	92.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-74.6	-47.7	171.4	176	61	0	0	0	111.5	L425 F429 V464 F473 L475 L483 M490 T491 L492 W496 Q497 L498	L425-L494 HydrophobicContact CD1-CD2 4.03Å; L425-L494 HydrophobicContact CD2-CD2 4.24Å; F429-L494 HydrophobicContact CZ-CD1 4.5Å; V464-L494 HydrophobicContact CG1-CD2 3.66Å; F473-L494 HydrophobicContact CD2-CD1 3.96Å; F473-L494 HydrophobicContact CE2-CD1 4.21Å; L475-L494 HydrophobicContact CD1-CD1 4.49Å; L475-L494 HydrophobicContact CD2-CD1 4.2Å; L483-L494 HydrophobicContact CD1-CD2 3.78Å; L483-L494 HydrophobicContact CD2-CD2 3.88Å; M490-L494 PolarHBondContact O-N 3.37Å; T491-L494 PolarHBondContact O-N 2.95Å; L492-L494 VanDerWaalsContact C-N 3.32Å; L492-L494 PolarHBondContact O-N 2.92Å; L494-W496 VanDerWaalsContact C-N 3.33Å; L494-W496 PolarHBondContact O-N 2.82Å; L494-Q497 PolarHBondContact O-N 3.48Å; L494-L498 HydrophobicContact CD1-CD1 4.17Å; L494-L498 HydrophobicContact CD1-CG 4.22Å; L494-L498 HydrophobicContact CG-CD1 3.93Å; L494-L498 HydrophobicContact CG-CG 4.44Å; L494-L498 PolarHBondContact O-N 2.98Å
495	L	95.8	Very high	92	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.6	-40.3	179.9	-72.6	172.5	0	0	0	112.6	Y399 I403 L415 L419 L425 L428 T491 L492 Q497 L498 M499	Y399-L495 HydrophobicContact CD1-CB 4.29Å; Y399-L495 HydrophobicContact CD2-CB 3.71Å; Y399-L495 HydrophobicContact CD2-CD1 3.97Å; Y399-L495 HydrophobicContact CD2-CG 4.5Å; Y399-L495 HydrophobicContact CE2-CB 3.97Å; Y399-L495 HydrophobicContact CG-CB 3.91Å; Y399-L495 HydrophobicContact CG-CD1 4.26Å; I403-L495 HydrophobicContact CD1-CD2 3.89Å; L415-L495 HydrophobicContact CD1-CD1 4.24Å; L415-L495 HydrophobicContact CD2-CD1 3.94Å; L419-L495 HydrophobicContact CD1-CD1 3.94Å; L419-L495 HydrophobicContact CD1-CD2 4.14Å; L419-L495 HydrophobicContact CD1-CG 4.43Å; L425-L495 HydrophobicContact CD2-CD2 3.96Å; L428-L495 HydrophobicContact CD1-CD2 4.29Å; T491-L495 HydrophobicContact CG2-CD1 4.02Å; T491-L495 WeakPolarHBondContact O-CB 3.46Å; T491-L495 VanDerWaalsContact O-CG 3.29Å; T491-L495 WeakPolarHBondContact O-CG 3.34Å; T491-L495 PolarHBondContact O-N 3.18Å; L492-L495 HydrophobicContact CD2-CD1 4.49Å; L492-L495 PolarHBondContact O-N 3.39Å; L495-Q497 VanDerWaalsContact C-N 3.31Å; L495-Q497 PolarHBondContact O-N 3.37Å; L495-L498 HydrophobicContact CD2-CD1 4.48Å; L495-L498 PolarHBondContact O-N 3.11Å; L495-M499 WeakPolarHBondContact O-CB 3.49Å; L495-M499 PolarHBondContact O-N 2.98Å
496	W	93	Very high	91.3	Very high	32 Å²	32	33.9 Å²	33.9	12%	0.121	17%	0.174	C	C	.	.	H	α-helix	trans	-55.6	-46	171.3	169.6	-122.1	0	0	0	112.2	Y399 L492 L494 M499 R500 K628 M631 T632	Y399-W496 WeakPolarHBondContact OH-CA 3.41Å; Y399-W496 WeakPolarHBondContact OH-CB 3.35Å; L492-W496 WeakPolarHBondContact O-CB 3.44Å; L492-W496 PolarHBondContact O-N 3.09Å; L494-W496 VanDerWaalsContact C-N 3.33Å; L494-W496 PolarHBondContact O-N 2.82Å; W496-M499 PolarHBondContact O-N 3.32Å; W496-R500 HydrophobicContact CH2-CB 4.25Å; W496-R500 HydrophobicContact CZ2-CB 4.2Å; W496-R500 HydrophobicContact CZ2-CG 4.34Å; W496-R500 WeakPolarHBondContact O-CB 3.49Å; W496-R500 PolarHBondContact O-N 2.64Å; W496-K628 HydrophobicContact CD2-CD 3.67Å; W496-K628 HydrophobicContact CD2-CG 4.19Å; W496-K628 HydrophobicContact CE3-CB 4.22Å; W496-K628 HydrophobicContact CE3-CD 3.98Å; W496-K628 HydrophobicContact CE3-CG 4.4Å; W496-K628 HydrophobicContact CG-CD 4.17Å; W496-K628 HydrophobicContact CH2-CB 3.46Å; W496-K628 VanDerWaalsContact CH2-CB 3.46Å; W496-K628 HydrophobicContact CH2-CD 4.34Å; W496-K628 HydrophobicContact CH2-CG 3.85Å; W496-K628 VanDerWaalsContact CH2-O 3.31Å; W496-K628 WeakPolarHBondContact CH2-O 3.43Å; W496-K628 HydrophobicContact CZ2-CB 3.73Å; W496-K628 HydrophobicContact CZ2-CD 4Å; W496-K628 HydrophobicContact CZ2-CG 3.53Å; W496-K628 HydrophobicContact CZ3-CB 3.71Å; W496-K628 HydrophobicContact CZ3-CD 4.31Å; W496-K628 HydrophobicContact CZ3-CG 4.26Å; W496-M631 HydrophobicContact CH2-CE 3.88Å; W496-T632 HydrophobicContact CZ3-CG2 4.42Å
497	Q	93	Very high	90.7	Very high	34 Å²	34	33.3 Å²	33.3	16%	0.159	17%	0.167	C	C	.	.	H	α-helix	trans	-72.4	-37.1	-176.7	-69.7	179.8	98.1	0	0	111.8	F473 S474 A493 L494 L495 A501	F473-Q497 HydrophobicContact CB-CB 4.46Å; F473-Q497 HydrophobicContact CD1-CB 4.16Å; F473-Q497 HydrophobicContact CD2-CB 3.87Å; F473-Q497 HydrophobicContact CE1-CB 4.35Å; F473-Q497 HydrophobicContact CE2-CB 4.08Å; F473-Q497 HydrophobicContact CG-CB 3.92Å; F473-Q497 HydrophobicContact CZ-CB 4.32Å; S474-Q497 PolarHBondContact O-NE2 3.11Å; A493-Q497 WeakPolarHBondContact O-CG 3.13Å; A493-Q497 PolarHBondContact O-NE2 2.93Å; L494-Q497 PolarHBondContact O-N 3.48Å; L495-Q497 VanDerWaalsContact C-N 3.31Å; L495-Q497 PolarHBondContact O-N 3.37Å; Q497-A501 WeakPolarHBondContact O-CB 3.49Å; Q497-A501 PolarHBondContact O-N 2.67Å
498	L	94.5	Very high	89.9	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61	-48.1	169.3	-71.7	167.5	0	0	0	111.5	W402 L425 L428 F429 I432 F473 L494 L495 R500 A501 Y502	W402-L498 HydrophobicContact CH2-CB 3.99Å; W402-L498 HydrophobicContact CZ3-CB 4.39Å; L425-L498 HydrophobicContact CD2-CD1 3.97Å; L428-L498 HydrophobicContact CB-CD1 4.25Å; L428-L498 HydrophobicContact CB-CD2 4.35Å; L428-L498 HydrophobicContact CD1-CD1 4.09Å; F429-L498 HydrophobicContact CD1-CD2 3.76Å; F429-L498 HydrophobicContact CD2-CD2 4.25Å; F429-L498 HydrophobicContact CE1-CD2 3.6Å; F429-L498 HydrophobicContact CE2-CD2 4.09Å; F429-L498 HydrophobicContact CG-CD2 4.09Å; F429-L498 HydrophobicContact CZ-CD2 3.77Å; I432-L498 HydrophobicContact CD1-CB 4.25Å; I432-L498 HydrophobicContact CD1-CD2 3.54Å; F473-L498 HydrophobicContact CE2-CD2 3.78Å; F473-L498 HydrophobicContact CE2-CG 3.99Å; F473-L498 HydrophobicContact CZ-CD2 4.16Å; L494-L498 HydrophobicContact CD1-CD1 4.17Å; L494-L498 HydrophobicContact CD1-CG 4.22Å; L494-L498 HydrophobicContact CG-CD1 3.93Å; L494-L498 HydrophobicContact CG-CG 4.44Å; L494-L498 PolarHBondContact O-N 2.98Å; L495-L498 HydrophobicContact CD2-CD1 4.48Å; L495-L498 PolarHBondContact O-N 3.11Å; L498-R500 PolarHBondContact O-N 2.74Å; L498-A501 PolarHBondContact O-N 3.09Å; L498-Y502 WeakPolarHBondContact O-CB 3.41Å; L498-Y502 PolarHBondContact O-N 3.47Å
499	M	92.2	Very high	88.9	Confident	2 Å²	2	30 Å²	30	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-64.7	-39.9	-179.6	-164.1	-174	-169.7	0	0	112.2	T398 Y399 W402 L495 W496 T503 Y616 M629	T398-M499 HydrophobicContact CG2-CE 4.2Å; Y399-M499 HydrophobicContact CD1-CB 4.45Å; Y399-M499 HydrophobicContact CD1-SD 3.81Å; Y399-M499 HydrophobicContact CE1-CB 4.17Å; Y399-M499 HydrophobicContact CE1-SD 3.65Å; W402-M499 HydrophobicContact CB-CE 4.29Å; W402-M499 HydrophobicContact CD2-CB 4.44Å; W402-M499 HydrophobicContact CD2-CG 3.95Å; W402-M499 HydrophobicContact CE3-CB 3.89Å; W402-M499 HydrophobicContact CE3-CG 3.84Å; W402-M499 HydrophobicContact CE3-SD 4.42Å; W402-M499 HydrophobicContact CG-CE 4.26Å; W402-M499 HydrophobicContact CH2-CB 3.85Å; W402-M499 HydrophobicContact CH2-CG 4.29Å; W402-M499 HydrophobicContact CZ2-CB 4.38Å; W402-M499 HydrophobicContact CZ2-CG 4.4Å; W402-M499 HydrophobicContact CZ3-CB 3.57Å; W402-M499 HydrophobicContact CZ3-CG 4.02Å; L495-M499 WeakPolarHBondContact O-CB 3.49Å; L495-M499 PolarHBondContact O-N 2.98Å; W496-M499 PolarHBondContact O-N 3.32Å; M499-T503 WeakPolarHBondContact O-CB 3.27Å; M499-T503 PolarHBondContact O-N 3.35Å; M499-T503 PolarHBondContact O-OG1 2.89Å; M499-Y616 HydrophobicContact CE-CD2 3.69Å; M499-Y616 HydrophobicContact CE-CG 4.05Å; M499-M629 HydrophobicContact CE-CE 4.45Å
500	R	89.8	Confident	87.7	Confident	94 Å²	94	25.1 Å²	25.1	36%	0.355	13%	0.128	S	C	.	.	H	α-helix	trans	-63.8	-46.6	173	-178.1	171.9	-176.7	-106.4	10.5	111.3	W496 L498 T503 L504 E534 M631	W496-R500 HydrophobicContact CH2-CB 4.25Å; W496-R500 HydrophobicContact CZ2-CB 4.2Å; W496-R500 HydrophobicContact CZ2-CG 4.34Å; W496-R500 WeakPolarHBondContact O-CB 3.49Å; W496-R500 PolarHBondContact O-N 2.64Å; L498-R500 PolarHBondContact O-N 2.74Å; R500-T503 PolarHBondContact O-N 2.87Å; R500-L504 HydrophobicContact CG-CD1 4.08Å; R500-L504 WeakPolarHBondContact O-CB 3.31Å; R500-L504 VanDerWaalsContact O-CG 3.28Å; R500-L504 WeakPolarHBondContact O-CG 3.41Å; R500-L504 PolarHBondContact O-N 2.71Å; R500-E534 IonicContact CZ-OE1 3.86Å; R500-E534 VanDerWaalsContact CZ-OE1 3.26Å; R500-E534 IonicContact NE-OE1 2.69Å; R500-E534 PolarHBondContact NE-OE1 2.89Å; R500-E534 IonicContact NH2-OE1 3.66Å; R500-E534 PolarHBondContact NH2-OE1 2.63Å; R500-M631 HydrophobicContact CG-CE 3.92Å
501	A	89.6	Confident	86.7	Confident	19 Å²	19	24 Å²	24	16%	0.157	12%	0.124	C	C	.	.	H	α-helix	trans	-63.4	-42.6	178.7	0	0	0	0	0	112.3	I432 F473 Q497 L498 L504 S505	I432-A501 HydrophobicContact CD1-CB 4.16Å; I432-A501 HydrophobicContact CG2-CB 4.15Å; F473-A501 HydrophobicContact CE1-CB 3.84Å; F473-A501 HydrophobicContact CZ-CB 3.82Å; Q497-A501 WeakPolarHBondContact O-CB 3.49Å; Q497-A501 PolarHBondContact O-N 2.67Å; L498-A501 PolarHBondContact O-N 3.09Å; A501-L504 PolarHBondContact O-N 3.02Å; A501-S505 WeakPolarHBondContact O-CB 3.04Å; A501-S505 PolarHBondContact O-N 3.2Å; A501-S505 PolarHBondContact O-OG 2.85Å
502	Y	90.5	Very high	85.5	Confident	41 Å²	41	28.4 Å²	28.4	16%	0.161	15%	0.145	C	C	.	.	H	α-helix	trans	-59.7	-49.1	172.9	178.1	-100.1	0	0	0	112.1	W402 L406 I432 L498 L504 S505 L506	W402-Y502 AromaticContact CZ2-CD1 3.96Å; W402-Y502 HydrophobicContact CZ2-CD1 3.96Å; W402-Y502 HydrophobicContact CZ2-CD2 4.42Å; W402-Y502 AromaticContact CZ2-CG 3.79Å; W402-Y502 HydrophobicContact CZ2-CG 3.79Å; W402-Y502 AromaticContact NE1-CD1 3.59Å; W402-Y502 AromaticContact NE1-CE1 3.63Å; L406-Y502 HydrophobicContact CD2-CE2 4.27Å; I432-Y502 HydrophobicContact CG1-CD2 4.31Å; L498-Y502 WeakPolarHBondContact O-CB 3.41Å; L498-Y502 PolarHBondContact O-N 3.47Å; Y502-L504 VanDerWaalsContact C-N 3.26Å; Y502-L504 PolarHBondContact O-N 2.9Å; Y502-S505 PolarHBondContact O-N 2.72Å; Y502-S505 PolarHBondContact O-OG 2.91Å; Y502-S505 VanDerWaalsContact O-OG 3.12Å; Y502-L506 HydrophobicContact CD1-CD1 4.18Å; Y502-L506 HydrophobicContact CE1-CD1 3.67Å; Y502-L506 WeakPolarHBondContact O-CG 3.27Å; Y502-L506 PolarHBondContact O-N 3.32Å
503	T	86.6	Confident	83.9	Confident	10 Å²	10	28.2 Å²	28.2	6%	0.061	15%	0.147	C	C	.	.	H	α-helix	trans	-62.5	-35.2	179.6	-55	0	0	0	0	111.9	M499 R500 T632 A635	M499-T503 WeakPolarHBondContact O-CB 3.27Å; M499-T503 PolarHBondContact O-N 3.35Å; M499-T503 PolarHBondContact O-OG1 2.89Å; R500-T503 PolarHBondContact O-N 2.87Å; T503-T632 HydrophobicContact CG2-CG2 4.32Å; T503-A635 HydrophobicContact CG2-CB 3.52Å
504	L	83.8	Confident	82.5	Confident	13 Å²	13	29 Å²	29	7%	0.068	14%	0.143	C	C	.	.	H	α-helix	trans	-79.2	-34.3	176.4	-66.7	177.3	0	0	0	113.1	R500 A501 Y502 L506 L507 T508 I532 I537	R500-L504 HydrophobicContact CG-CD1 4.08Å; R500-L504 WeakPolarHBondContact O-CB 3.31Å; R500-L504 VanDerWaalsContact O-CG 3.28Å; R500-L504 WeakPolarHBondContact O-CG 3.41Å; R500-L504 PolarHBondContact O-N 2.71Å; A501-L504 PolarHBondContact O-N 3.02Å; Y502-L504 VanDerWaalsContact C-N 3.26Å; Y502-L504 PolarHBondContact O-N 2.9Å; L504-L506 PolarHBondContact O-N 3.33Å; L504-L507 HydrophobicContact CD2-CD1 4.46Å; L504-L507 WeakPolarHBondContact O-CB 3.45Å; L504-L507 PolarHBondContact O-N 3.47Å; L504-L507 VanDerWaalsContact O-N 3.1Å; L504-T508 PolarHBondContact O-N 3.18Å; L504-T508 PolarHBondContact O-OG1 3.14Å; L504-I532 HydrophobicContact CD2-CB 4.37Å; L504-I532 WeakPolarHBondContact CD2-O 3.4Å; L504-I537 HydrophobicContact CD2-CD1 4.12Å
505	S	83.3	Confident	81	Confident	19 Å²	19	32 Å²	32	13%	0.133	16%	0.159	C	C	.	.	H	α-helix	trans	-66.8	-37.6	178.7	71.2	0	0	0	0	111.7	I432 A501 Y502 L507 T508 Q509	I432-S505 PolarHBondContact O-OG 2.81Å; A501-S505 WeakPolarHBondContact O-CB 3.04Å; A501-S505 PolarHBondContact O-N 3.2Å; A501-S505 PolarHBondContact O-OG 2.85Å; Y502-S505 PolarHBondContact O-N 2.72Å; Y502-S505 PolarHBondContact O-OG 2.91Å; Y502-S505 VanDerWaalsContact O-OG 3.12Å; S505-L507 VanDerWaalsContact C-N 3.26Å; S505-L507 PolarHBondContact O-N 3.07Å; S505-T508 PolarHBondContact O-N 3.48Å; S505-Q509 WeakPolarHBondContact O-CG 3.15Å; S505-Q509 PolarHBondContact O-N 3.46Å
506	L	80.2	Confident	79.4	Confident	33 Å²	33	35.9 Å²	35.9	17%	0.173	19%	0.191	C	C	.	.	H	α-helix	trans	-56.1	-38.4	169.4	-69.3	174.4	0	0	0	112.3	Y502 L504 L510	Y502-L506 HydrophobicContact CD1-CD1 4.18Å; Y502-L506 HydrophobicContact CE1-CD1 3.67Å; Y502-L506 WeakPolarHBondContact O-CG 3.27Å; Y502-L506 PolarHBondContact O-N 3.32Å; L504-L506 PolarHBondContact O-N 3.33Å; L506-L510 WeakPolarHBondContact O-CD1 3.5Å; L506-L510 VanDerWaalsContact O-CG 3.23Å; L506-L510 WeakPolarHBondContact O-CG 3.23Å; L506-L510 PolarHBondContact O-N 2.64Å
507	L	79.2	Confident	77.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-74.9	-38.5	174.7	-75.1	177	0	0	0	113.2	L504 S505 L510 T511 I532 I537 A635 M638 A639 L642	L504-L507 HydrophobicContact CD2-CD1 4.46Å; L504-L507 WeakPolarHBondContact O-CB 3.45Å; L504-L507 PolarHBondContact O-N 3.47Å; L504-L507 VanDerWaalsContact O-N 3.1Å; S505-L507 VanDerWaalsContact C-N 3.26Å; S505-L507 PolarHBondContact O-N 3.07Å; L507-L510 CarbonylContact O-C 3.58Å; L507-L510 WeakPolarHBondContact O-CA 3.44Å; L507-L510 WeakPolarHBondContact O-CB 3.34Å; L507-L510 PolarHBondContact O-N 3.08Å; L507-L510 VanDerWaalsContact O-N 3.12Å; L507-T511 PolarHBondContact O-N 3.08Å; L507-T511 PolarHBondContact O-OG1 2.88Å; L507-I532 HydrophobicContact CB-CD1 3.78Å; L507-I537 HydrophobicContact CD1-CD1 4.27Å; L507-A635 HydrophobicContact CD1-CB 3.77Å; L507-M638 HydrophobicContact CD1-SD 4.24Å; L507-M638 HydrophobicContact CD2-CB 3.89Å; L507-M638 HydrophobicContact CD2-CG 3.84Å; L507-M638 HydrophobicContact CD2-SD 4.21Å; L507-A639 HydrophobicContact CD2-CB 3.82Å; L507-L642 HydrophobicContact CD2-CD1 4.31Å
508	T	76.8	Confident	76.1	Confident	15 Å²	15	39.3 Å²	39.3	9%	0.092	22%	0.217	C	C	.	.	H	α-helix	trans	-59.8	-49.1	176.3	-65.3	0	0	0	0	110.8	L504 S505 L510 T511 E512 S529	L504-T508 PolarHBondContact O-N 3.18Å; L504-T508 PolarHBondContact O-OG1 3.14Å; S505-T508 PolarHBondContact O-N 3.48Å; T508-L510 PolarHBondContact O-N 3.24Å; T508-L510 VanDerWaalsContact O-N 3.13Å; T508-T511 PolarHBondContact O-N 2.84Å; T508-T511 PolarHBondContact O-OG1 2.77Å; T508-E512 HydrophobicContact CG2-CG 3.97Å; T508-E512 WeakPolarHBondContact O-CB 3.27Å; T508-E512 WeakPolarHBondContact O-CG 3.21Å; T508-E512 PolarHBondContact O-N 2.7Å; T508-S529 WeakPolarHBondContact CG2-OG 3.08Å
509	Q	73.2	Confident	74	Confident	78 Å²	78	42.5 Å²	42.5	36%	0.364	25%	0.25	S	C	.	.	H	α-helix	trans	-59.2	-28	175.7	-65.3	175.2	36.3	0	0	112.6	S505 R646	S505-Q509 WeakPolarHBondContact O-CG 3.15Å; S505-Q509 PolarHBondContact O-N 3.46Å; Q509-R646 PolarHBondContact O-NH2 3.16Å; Q509-R646 VanDerWaalsContact O-NH2 3.14Å
510	L	68.1	Low	72.2	Confident	8 Å²	8	49.8 Å²	49.8	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-78.2	-36.4	174.8	-69.9	172.3	0	0	0	113.3	L506 L507 T508 E514 A639 L642 K643 R646	L506-L510 WeakPolarHBondContact O-CD1 3.5Å; L506-L510 VanDerWaalsContact O-CG 3.23Å; L506-L510 WeakPolarHBondContact O-CG 3.23Å; L506-L510 PolarHBondContact O-N 2.64Å; L507-L510 CarbonylContact O-C 3.58Å; L507-L510 WeakPolarHBondContact O-CA 3.44Å; L507-L510 WeakPolarHBondContact O-CB 3.34Å; L507-L510 PolarHBondContact O-N 3.08Å; L507-L510 VanDerWaalsContact O-N 3.12Å; T508-L510 PolarHBondContact O-N 3.24Å; T508-L510 VanDerWaalsContact O-N 3.13Å; L510-E514 WeakPolarHBondContact O-CG 3.04Å; L510-E514 PolarHBondContact O-N 2.99Å; L510-A639 HydrophobicContact CD1-CB 3.63Å; L510-A639 WeakPolarHBondContact CD1-O 3.19Å; L510-L642 HydrophobicContact CB-CB 4.08Å; L510-L642 HydrophobicContact CB-CD1 3.74Å; L510-L642 HydrophobicContact CD1-CB 4.39Å; L510-K643 HydrophobicContact CD1-CG 3.95Å; L510-K643 HydrophobicContact CD2-CD 4.31Å; L510-K643 HydrophobicContact CD2-CG 3.49Å; L510-K643 VanDerWaalsContact CD2-CG 3.49Å; L510-K643 HydrophobicContact CG-CG 4.4Å; L510-R646 VanDerWaalsContact C-NH2 3.33Å; L510-R646 VanDerWaalsContact CA-NH2 3.29Å; L510-R646 PolarHBondContact O-NH2 3.3Å
511	T	72.6	Confident	69.9	Low	37 Å²	37	50.3 Å²	50.3	23%	0.227	30%	0.299	C	S	.	.	H	α-helix	trans	-78.9	-40	176.2	57.6	0	0	0	0	112.9	L507 T508 E514 I515 I532 L642	L507-T511 PolarHBondContact O-N 3.08Å; L507-T511 PolarHBondContact O-OG1 2.88Å; T508-T511 PolarHBondContact O-N 2.84Å; T508-T511 PolarHBondContact O-OG1 2.77Å; T511-E514 WeakPolarHBondContact O-CB 3.47Å; T511-E514 PolarHBondContact O-N 2.97Å; T511-E514 VanDerWaalsContact O-N 3.14Å; T511-I515 WeakPolarHBondContact O-CG1 3.46Å; T511-I515 PolarHBondContact O-N 2.77Å; T511-I532 HydrophobicContact CG2-CD1 3.76Å; T511-L642 HydrophobicContact CG2-CD1 3.97Å
512	E	70.6	Confident	67.6	Low	97 Å²	97	53.1 Å²	53.1	45%	0.453	32%	0.315	S	S	.	.	H	α-helix	trans	-61.9	-48.1	-179.2	-72.8	-174.6	147.5	0	0	112.5	T508 E514 I515 A516	T508-E512 HydrophobicContact CG2-CG 3.97Å; T508-E512 WeakPolarHBondContact O-CB 3.27Å; T508-E512 WeakPolarHBondContact O-CG 3.21Å; T508-E512 PolarHBondContact O-N 2.7Å; E512-E514 VanDerWaalsContact C-N 3.29Å; E512-E514 PolarHBondContact O-N 3.06Å; E512-I515 WeakPolarHBondContact O-CB 3.28Å; E512-I515 PolarHBondContact O-N 3.32Å; E512-A516 PolarHBondContact O-N 2.88Å
513	A	60.2	Low	65.2	Low	22 Å²	22	58.7 Å²	58.7	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-74.7	-15	176.4	0	0	0	0	0	113.5	I517	A513-I517 WeakPolarHBondContact O-CB 3.48Å; A513-I517 WeakPolarHBondContact O-CD1 3.39Å; A513-I517 WeakPolarHBondContact O-CG1 3.25Å; A513-I517 PolarHBondContact O-N 3.09Å; A513-I517 VanDerWaalsContact O-N 3.11Å
514	E	63.8	Low	63.1	Low	54 Å²	54	63.5 Å²	63.5	25%	0.252	37%	0.372	S	S	.	.	H	α-helix	trans	-75	-37.7	164.4	-82.6	-176.3	-176.3	0	0	112.4	L510 T511 E512 A516 I517 S518 L642 R646	L510-E514 WeakPolarHBondContact O-CG 3.04Å; L510-E514 PolarHBondContact O-N 2.99Å; T511-E514 WeakPolarHBondContact O-CB 3.47Å; T511-E514 PolarHBondContact O-N 2.97Å; T511-E514 VanDerWaalsContact O-N 3.14Å; E512-E514 VanDerWaalsContact C-N 3.29Å; E512-E514 PolarHBondContact O-N 3.06Å; E514-A516 VanDerWaalsContact C-N 3.34Å; E514-I517 PolarHBondContact O-N 2.99Å; E514-S518 WeakPolarHBondContact O-CB 3.38Å; E514-S518 PolarHBondContact O-N 2.82Å; E514-S518 PolarHBondContact O-OG 3.06Å; E514-L642 WeakPolarHBondContact OE1-CB 3.45Å; E514-R646 HydrophobicContact CG-CG 4.41Å
515	I	64.9	Low	60.8	Low	64 Å²	64	69.1 Å²	69.1	33%	0.328	40%	0.402	S	S	.	.	H	α-helix	trans	-62.5	-45	172.3	-66.9	164.7	0	0	0	109.5	T511 E512 I517 S518 G519 L524	T511-I515 WeakPolarHBondContact O-CG1 3.46Å; T511-I515 PolarHBondContact O-N 2.77Å; E512-I515 WeakPolarHBondContact O-CB 3.28Å; E512-I515 PolarHBondContact O-N 3.32Å; I515-I517 PolarHBondContact O-N 2.86Å; I515-S518 PolarHBondContact O-N 2.68Å; I515-S518 PolarHBondContact O-OG 3.26Å; I515-G519 PolarHBondContact O-N 3.49Å; I515-L524 HydrophobicContact CD1-CD1 4.19Å
516	A	62	Low	58.3	Low	82 Å²	82	77.5 Å²	77.5	68%	0.678	44%	0.439	S	S	*	.	H	α-helix	trans	-61.2	-40.9	176.7	0	0	0	0	0	113.4	E512 E514	E512-A516 PolarHBondContact O-N 2.88Å; E514-A516 VanDerWaalsContact C-N 3.34Å
517	I	58.5	Low	56.3	Low	73 Å²	73	80.1 Å²	80.1	37%	0.374	47%	0.474	S	S	.	.	H	α-helix	trans	-74.3	-40.4	178.2	-70.9	165.8	0	0	0	111.9	A513 E514 I515 G519 V655	A513-I517 WeakPolarHBondContact O-CB 3.48Å; A513-I517 WeakPolarHBondContact O-CD1 3.39Å; A513-I517 WeakPolarHBondContact O-CG1 3.25Å; A513-I517 PolarHBondContact O-N 3.09Å; A513-I517 VanDerWaalsContact O-N 3.11Å; E514-I517 PolarHBondContact O-N 2.99Å; I515-I517 PolarHBondContact O-N 2.86Å; I517-G519 VanDerWaalsContact C-N 3.3Å; I517-G519 PolarHBondContact O-N 2.69Å; I517-V655 HydrophobicContact CD1-CG2 4.08Å
518	S	58.3	Low	54.2	Low	65 Å²	65	83.8 Å²	83.8	46%	0.455	50%	0.496	S	S	.	.	H	α-helix	trans	-77.6	-12.7	-172.7	64.5	0	0	0	0	114.4	E514 I515 K520	E514-S518 WeakPolarHBondContact O-CB 3.38Å; E514-S518 PolarHBondContact O-N 2.82Å; E514-S518 PolarHBondContact O-OG 3.06Å; I515-S518 PolarHBondContact O-N 2.68Å; I515-S518 PolarHBondContact O-OG 3.26Å; S518-K520 PolarHBondContact O-N 3.41Å
519	G	50.8	Low	52.8	Low	66 Å²	66	86.5 Å²	86.5	68%	0.68	52%	0.516	S	S	*	.			trans	64.6	2.1	-178.3	0	0	0	0	0	114.4	I515 I517 S521	I515-G519 PolarHBondContact O-N 3.49Å; I517-G519 VanDerWaalsContact C-N 3.3Å; I517-G519 PolarHBondContact O-N 2.69Å; G519-S521 PolarHBondContact O-N 2.93Å
520	K	52.5	Low	51.7	Low	156 Å²	156	89.4 Å²	89.4	68%	0.678	52%	0.524	S	S	*	.			trans	-80.9	89.9	-179.5	-73.2	180	-179.3	175.6	0	109.2	S518 T522	S518-K520 PolarHBondContact O-N 3.41Å; K520-T522 PolarHBondContact O-N 3.05Å
521	S	42.6	Very low	51.2	Low	104 Å²	104	92.9 Å²	92.9	73%	0.727	55%	0.548	S	S	*	.			trans	-58.7	85.1	165.4	-178.6	0	0	0	0	110.3	G519	G519-S521 PolarHBondContact O-N 2.93Å
522	T	42	Very low	50.9	Low	79 Å²	79	92 Å²	92	49%	0.485	54%	0.541	S	S	.	.			trans	-62.6	142.4	157.7	48.4	0	0	0	0	107.9	K520 L524	K520-T522 PolarHBondContact O-N 3.05Å; T522-L524 PolarHBondContact O-N 3.15Å
523	N	39.9	Very low	50.9	Low	157 Å²	157	92.6 Å²	92.6	84%	0.84	54%	0.544	S	S	*	.			trans	-76.4	61.1	179.4	-69.7	-23.1	0	0	0	111.2
524	L	41.5	Very low	51.9	Low	111 Å²	111	94 Å²	94	58%	0.581	55%	0.547	S	S	*	.			trans	-80.2	116.6	164.4	-72.6	166.9	0	0	0	107.4	I515 T522	I515-L524 HydrophobicContact CD1-CD1 4.19Å; T522-L524 PolarHBondContact O-N 3.15Å
525	N	36.1	Very low	52.9	Low	131 Å²	131	95.5 Å²	95.5	70%	0.701	56%	0.555	S	S	*	*			trans	-60.8	148	-178.5	-66.6	-45.8	0	0	0	111.2	G527	N525-G527 PolarHBondContact O-N 3.31Å
526	H	31.1	Very low	53.9	Low	196 Å²	196	96.6 Å²	96.6	91%	0.907	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-41	121.6	-172.1	-78.1	-85.1	0	0	0	115.3	T528	H526-T528 PolarHBondContact O-N 3.32Å
527	G	36.8	Very low	55.2	Low	87 Å²	87	92.7 Å²	92.7	90%	0.897	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	-0.8	148.5	0	0	0	0	0	118.4	N525	N525-G527 PolarHBondContact O-N 3.31Å
528	T	36.8	Very low	56.8	Low	78 Å²	78	89.4 Å²	89.4	48%	0.479	51%	0.508	S	S	.	.			trans	-111.8	107.1	176.6	54.2	0	0	0	0	111.8	H526 Y530	H526-T528 PolarHBondContact O-N 3.32Å; T528-Y530 VanDerWaalsContact O-CD2 3.29Å; T528-Y530 WeakPolarHBondContact O-CD2 3.49Å; T528-Y530 PolarHBondContact O-N 2.87Å; T528-Y530 WeakPolarHBondContact OG1-CE2 3.39Å; T528-Y530 VanDerWaalsContact OG1-CZ 3.28Å; T528-Y530 PolarHBondContact OG1-OH 3.07Å
529	S	47.5	Very low	58.4	Low	72 Å²	72	91.7 Å²	91.7	50%	0.503	51%	0.512	S	S	.	.			trans	-61.8	99.3	164.1	150.3	0	0	0	0	109	T508	T508-S529 WeakPolarHBondContact CG2-OG 3.08Å
530	Y	49.2	Very low	60.4	Low	138 Å²	138	90.2 Å²	90.2	54%	0.541	49%	0.485	S	S	.	.			trans	-76.1	125.2	172.1	-68.5	-75.2	0	0	0	109.5	T528	T528-Y530 VanDerWaalsContact O-CD2 3.29Å; T528-Y530 WeakPolarHBondContact O-CD2 3.49Å; T528-Y530 PolarHBondContact O-N 2.87Å; T528-Y530 WeakPolarHBondContact OG1-CE2 3.39Å; T528-Y530 VanDerWaalsContact OG1-CZ 3.28Å; T528-Y530 PolarHBondContact OG1-OH 3.07Å
531	P	57.7	Low	62.4	Low	82 Å²	82	82.8 Å²	82.8	53%	0.532	45%	0.453	S	S	.	.			trans	-61.1	146.4	177.7	26.6	-34.6	0	0	0	110.7	E533	P531-E533 PolarHBondContact O-N 3.08Å; P531-E533 VanDerWaalsContact O-N 3.08Å
532	I	65.5	Low	64.9	Low	18 Å²	18	78.2 Å²	78.2	9%	0.092	42%	0.421	C	S	.	.			trans	-68.6	112.2	-179.3	-54.8	-166.5	0	0	0	109.7	L504 L507 T511 K536 I537	L504-I532 HydrophobicContact CD2-CB 4.37Å; L504-I532 WeakPolarHBondContact CD2-O 3.4Å; L507-I532 HydrophobicContact CB-CD1 3.78Å; T511-I532 HydrophobicContact CG2-CD1 3.76Å; I532-K536 HydrophobicContact CG2-CB 3.86Å; I532-K536 HydrophobicContact CG2-CD 4.28Å; I532-I537 HydrophobicContact CG2-CG1 4.06Å
533	E	72	Confident	67.4	Low	109 Å²	109	81.3 Å²	81.3	51%	0.509	43%	0.427	S	S	.	.			trans	-62.9	143.5	174.1	-68.4	151.2	-112.7	0	0	111.7	P531 M535 K536	P531-E533 PolarHBondContact O-N 3.08Å; P531-E533 VanDerWaalsContact O-N 3.08Å; E533-M535 PolarHBondContact O-N 3.42Å; E533-M535 VanDerWaalsContact O-N 3.1Å; E533-K536 HydrophobicContact CB-CD 4.19Å; E533-K536 HydrophobicContact CB-CG 4.43Å; E533-K536 WeakPolarHBondContact O-CB 3.25Å; E533-K536 PolarHBondContact O-N 2.81Å; E533-K536 WeakPolarHBondContact OE1-CE 3.36Å; E533-K536 IonicContact OE1-NZ 2.62Å; E533-K536 PolarHBondContact OE1-NZ 3.33Å
534	E	81.3	Confident	69.9	Low	52 Å²	52	75.7 Å²	75.7	24%	0.243	40%	0.395	C	S	.	.	H	α-helix	trans	-57.5	-31.6	-176.4	-64	178.5	-162.2	0	0	112.8	R500 K536 I537 I538 F560 M631	R500-E534 IonicContact CZ-OE1 3.86Å; R500-E534 VanDerWaalsContact CZ-OE1 3.26Å; R500-E534 IonicContact NE-OE1 2.69Å; R500-E534 PolarHBondContact NE-OE1 2.89Å; R500-E534 IonicContact NH2-OE1 3.66Å; R500-E534 PolarHBondContact NH2-OE1 2.63Å; E534-K536 VanDerWaalsContact C-N 3.33Å; E534-K536 PolarHBondContact O-N 3.3Å; E534-I537 WeakPolarHBondContact O-CB 3.36Å; E534-I537 PolarHBondContact O-N 3.05Å; E534-I538 WeakPolarHBondContact O-CG1 3.42Å; E534-I538 PolarHBondContact O-N 3.02Å; E534-I538 VanDerWaalsContact O-N 3.14Å; E534-F560 HydrophobicContact CB-CE2 4.13Å; E534-M631 HydrophobicContact CG-CG 3.91Å
535	M	84.1	Confident	72.5	Confident	86 Å²	86	70.4 Å²	70.4	42%	0.424	37%	0.368	S	S	.	.	H	α-helix	trans	-60.2	-38.1	173.9	-63.1	-63.4	-80.3	0	0	112.7	E533 I537 I538 E539 T556	E533-M535 PolarHBondContact O-N 3.42Å; E533-M535 VanDerWaalsContact O-N 3.1Å; M535-I537 VanDerWaalsContact C-N 3.28Å; M535-I537 PolarHBondContact O-N 2.97Å; M535-I538 PolarHBondContact O-N 3.35Å; M535-I538 HydrophobicContact SD-CD1 4.28Å; M535-E539 WeakPolarHBondContact O-CB 3.22Å; M535-E539 WeakPolarHBondContact O-CG 3.5Å; M535-E539 PolarHBondContact O-N 2.94Å; M535-T556 HydrophobicContact CE-CG2 3.73Å
536	K	86.2	Confident	75.3	Confident	87 Å²	87	69.2 Å²	69.2	38%	0.378	36%	0.361	S	S	.	.	H	α-helix	trans	-66.5	-31.8	178.8	-64.7	167.1	177.6	163.7	0	111.5	I532 E533 E534 W540	I532-K536 HydrophobicContact CG2-CB 3.86Å; I532-K536 HydrophobicContact CG2-CD 4.28Å; E533-K536 HydrophobicContact CB-CD 4.19Å; E533-K536 HydrophobicContact CB-CG 4.43Å; E533-K536 WeakPolarHBondContact O-CB 3.25Å; E533-K536 PolarHBondContact O-N 2.81Å; E533-K536 WeakPolarHBondContact OE1-CE 3.36Å; E533-K536 IonicContact OE1-NZ 2.62Å; E533-K536 PolarHBondContact OE1-NZ 3.33Å; E534-K536 VanDerWaalsContact C-N 3.33Å; E534-K536 PolarHBondContact O-N 3.3Å; K536-W540 WeakPolarHBondContact O-CB 3.28Å; K536-W540 PolarHBondContact O-N 3.45Å
537	I	89.5	Confident	78.2	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-70.5	-43.5	174.7	-50.1	177.6	0	0	0	110	L504 L507 I532 E534 M535 W540 A541 F560 M631 F634 A635 M638	L504-I537 HydrophobicContact CD2-CD1 4.12Å; L507-I537 HydrophobicContact CD1-CD1 4.27Å; I532-I537 HydrophobicContact CG2-CG1 4.06Å; E534-I537 WeakPolarHBondContact O-CB 3.36Å; E534-I537 PolarHBondContact O-N 3.05Å; M535-I537 VanDerWaalsContact C-N 3.28Å; M535-I537 PolarHBondContact O-N 2.97Å; I537-W540 HydrophobicContact CG2-CE3 4.5Å; I537-W540 PolarHBondContact O-N 3.31Å; I537-A541 WeakPolarHBondContact O-CB 3.48Å; I537-A541 PolarHBondContact O-N 3.45Å; I537-F560 HydrophobicContact CB-CZ 4.21Å; I537-F560 HydrophobicContact CG2-CZ 4.06Å; I537-M631 HydrophobicContact CD1-CG 4.45Å; I537-M631 HydrophobicContact CD1-SD 4.12Å; I537-F634 HydrophobicContact CG2-CB 3.83Å; I537-A635 HydrophobicContact CD1-CB 4.19Å; I537-M638 HydrophobicContact CG1-SD 4.38Å; I537-M638 HydrophobicContact CG2-SD 4.43Å
538	I	91.7	Very high	80.9	Confident	3 Å²	3	64 Å²	64	2%	0.015	33%	0.325	C	S	.	.	H	α-helix	trans	-64.6	-40.9	176.4	-64.3	155.3	0	0	0	111.2	E534 M535 N542 I554 G559 F560	E534-I538 WeakPolarHBondContact O-CG1 3.42Å; E534-I538 PolarHBondContact O-N 3.02Å; E534-I538 VanDerWaalsContact O-N 3.14Å; M535-I538 PolarHBondContact O-N 3.35Å; M535-I538 HydrophobicContact SD-CD1 4.28Å; I538-N542 WeakPolarHBondContact O-CB 3.47Å; I538-N542 PolarHBondContact O-N 2.7Å; I538-N542 PolarHBondContact O-ND2 2.73Å; I538-I554 HydrophobicContact CG2-CB 4.31Å; I538-I554 HydrophobicContact CG2-CG2 4.17Å; I538-G559 VanDerWaalsContact CD1-CA 3.5Å; I538-F560 HydrophobicContact CD1-CD2 4.17Å; I538-F560 HydrophobicContact CD1-CE2 3.93Å; I538-F560 HydrophobicContact CD1-CZ 4.18Å; I538-F560 HydrophobicContact CG1-CD1 4.4Å; I538-F560 HydrophobicContact CG1-CD2 4.37Å; I538-F560 HydrophobicContact CG1-CE1 3.84Å; I538-F560 HydrophobicContact CG1-CE2 3.81Å; I538-F560 HydrophobicContact CG1-CZ 3.52Å
539	E	91.5	Very high	83.6	Confident	113 Å²	113	62.9 Å²	62.9	53%	0.528	33%	0.329	S	S	.	.	H	α-helix	trans	-64.6	-45.6	175	-75.8	175.3	-170.3	0	0	112.3	M535 K543	M535-E539 WeakPolarHBondContact O-CB 3.22Å; M535-E539 WeakPolarHBondContact O-CG 3.5Å; M535-E539 PolarHBondContact O-N 2.94Å; E539-K543 WeakPolarHBondContact O-CB 3.43Å; E539-K543 PolarHBondContact O-N 2.86Å
540	W	92.9	Very high	85.7	Confident	35 Å²	35	61.7 Å²	61.7	13%	0.133	32%	0.315	C	S	.	.	H	α-helix	trans	-59.2	-48.9	173.5	162.1	84.5	0	0	0	111.4	K536 I537 N542 K543 K544 L574 I578 L637 M638 D641	K536-W540 WeakPolarHBondContact O-CB 3.28Å; K536-W540 PolarHBondContact O-N 3.45Å; I537-W540 HydrophobicContact CG2-CE3 4.5Å; I537-W540 PolarHBondContact O-N 3.31Å; W540-N542 PolarHBondContact O-N 3.05Å; W540-K543 PolarHBondContact O-N 3.44Å; W540-K544 HydrophobicContact CZ2-CG 4.47Å; W540-K544 WeakPolarHBondContact O-CB 3.39Å; W540-K544 PolarHBondContact O-N 3.31Å; W540-L574 HydrophobicContact CH2-CD1 3.88Å; W540-L574 HydrophobicContact CH2-CD2 3.83Å; W540-L574 HydrophobicContact CH2-CG 4.2Å; W540-L574 HydrophobicContact CZ2-CD1 4.3Å; W540-L574 HydrophobicContact CZ3-CD1 4.35Å; W540-L574 HydrophobicContact CZ3-CD2 3.81Å; W540-I578 HydrophobicContact CH2-CD1 3.98Å; W540-I578 HydrophobicContact CZ2-CD1 4.2Å; W540-I578 HydrophobicContact CZ2-CG1 4.41Å; W540-L637 HydrophobicContact CH2-CB 4.21Å; W540-M638 HydrophobicContact CB-CE 4.09Å; W540-M638 HydrophobicContact CB-SD 4.28Å; W540-M638 HydrophobicContact CD2-CB 3.99Å; W540-M638 HydrophobicContact CD2-CG 3.67Å; W540-M638 HydrophobicContact CD2-SD 4.04Å; W540-M638 HydrophobicContact CE3-CB 3.69Å; W540-M638 HydrophobicContact CE3-CG 3.84Å; W540-M638 HydrophobicContact CE3-SD 4.09Å; W540-M638 HydrophobicContact CG-CE 4.01Å; W540-M638 HydrophobicContact CG-CG 4.12Å; W540-M638 HydrophobicContact CG-SD 4.09Å; W540-M638 VanDerWaalsContact CH2-CA 3.4Å; W540-M638 HydrophobicContact CH2-CB 3.79Å; W540-M638 HydrophobicContact CH2-CG 4.43Å; W540-M638 HydrophobicContact CZ2-CB 4.07Å; W540-M638 HydrophobicContact CZ2-CG 4.29Å; W540-M638 HydrophobicContact CZ3-CB 3.58Å; W540-M638 HydrophobicContact CZ3-CG 4.22Å; W540-D641 HydrophobicContact CZ2-CB 3.77Å; W540-D641 PolarHBondContact NE1-OD2 2.76Å
541	A	94.5	Very high	87.6	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-60.2	-48.9	-178.5	0	0	0	0	0	111.4	I537 K543 K544 L545 I554 L574 F634	I537-A541 WeakPolarHBondContact O-CB 3.48Å; I537-A541 PolarHBondContact O-N 3.45Å; A541-K543 PolarHBondContact O-N 3.09Å; A541-K544 PolarHBondContact O-N 2.65Å; A541-L545 WeakPolarHBondContact O-CB 3.31Å; A541-L545 VanDerWaalsContact O-CG 3.28Å; A541-L545 WeakPolarHBondContact O-CG 3.35Å; A541-L545 PolarHBondContact O-N 2.9Å; A541-I554 HydrophobicContact CB-CD1 4.16Å; A541-L574 HydrophobicContact CB-CD2 4.08Å; A541-F634 HydrophobicContact CB-CD1 4Å; A541-F634 HydrophobicContact CB-CE1 4.33Å
542	N	95.1	Very high	89.2	Confident	9 Å²	9	62.7 Å²	62.7	5%	0.048	32%	0.317	C	S	.	.	H	α-helix	trans	-60.5	-42	175.9	-79.3	-33.6	0	0	0	112.6	I538 W540 L545 I546 K553 I554	I538-N542 WeakPolarHBondContact O-CB 3.47Å; I538-N542 PolarHBondContact O-N 2.7Å; I538-N542 PolarHBondContact O-ND2 2.73Å; W540-N542 PolarHBondContact O-N 3.05Å; N542-L545 PolarHBondContact O-N 2.91Å; N542-I546 WeakPolarHBondContact O-CB 3.25Å; N542-I546 WeakPolarHBondContact O-CD1 3.13Å; N542-I546 VanDerWaalsContact O-CG1 3.24Å; N542-I546 WeakPolarHBondContact O-CG1 3.38Å; N542-I546 PolarHBondContact O-N 3.39Å; N542-K553 WeakPolarHBondContact OD1-CG 3.39Å; N542-I554 PolarHBondContact ND2-O 3.43Å; N542-I554 PolarHBondContact OD1-N 2.88Å; N542-I554 PolarHBondContact OD1-O 3.45Å
543	K	94.1	Very high	90.4	Very high	143 Å²	143	68 Å²	68	62%	0.622	34%	0.339	S	S	*	.	H	α-helix	trans	-64.7	-39.9	176.6	-176.9	178.8	178.9	-179.1	0	111.9	E539 W540 A541 N547	E539-K543 WeakPolarHBondContact O-CB 3.43Å; E539-K543 PolarHBondContact O-N 2.86Å; W540-K543 PolarHBondContact O-N 3.44Å; A541-K543 PolarHBondContact O-N 3.09Å; K543-N547 VanDerWaalsContact O-CB 3.31Å; K543-N547 WeakPolarHBondContact O-CB 3.21Å; K543-N547 PolarHBondContact O-N 2.88Å; K543-N547 PolarHBondContact O-OD1 2.88Å
544	K	94	Very high	91.3	Very high	39 Å²	39	62.8 Å²	62.8	17%	0.17	32%	0.315	C	S	.	.	H	α-helix	trans	-64.8	-45.3	177.3	-168.3	74.8	178.9	-162.4	0	111.3	W540 A541 N547 A548 L574 A577 D641	W540-K544 HydrophobicContact CZ2-CG 4.47Å; W540-K544 WeakPolarHBondContact O-CB 3.39Å; W540-K544 PolarHBondContact O-N 3.31Å; A541-K544 PolarHBondContact O-N 2.65Å; K544-N547 PolarHBondContact O-N 3.18Å; K544-A548 WeakPolarHBondContact O-CB 3.46Å; K544-A548 PolarHBondContact O-N 2.8Å; K544-A548 VanDerWaalsContact O-N 3.08Å; K544-L574 HydrophobicContact CB-CD1 3.83Å; K544-L574 HydrophobicContact CG-CD1 3.74Å; K544-A577 WeakPolarHBondContact CE-O 3.39Å; K544-A577 HydrophobicContact CG-CB 4.06Å; K544-D641 WeakPolarHBondContact CD-OD2 3.47Å; K544-D641 WeakPolarHBondContact CE-OD2 3.45Å; K544-D641 IonicContact NZ-OD1 2.66Å; K544-D641 PolarHBondContact NZ-OD1 3.27Å; K544-D641 IonicContact NZ-OD2 2.92Å; K544-D641 PolarHBondContact NZ-OD2 2.91Å
545	L	95.3	Very high	91.7	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.5	-48.7	176.1	-71.6	166.6	0	0	0	112.1	A541 N542 N547 A548 G549 K550 D573 L574	A541-L545 WeakPolarHBondContact O-CB 3.31Å; A541-L545 VanDerWaalsContact O-CG 3.28Å; A541-L545 WeakPolarHBondContact O-CG 3.35Å; A541-L545 PolarHBondContact O-N 2.9Å; N542-L545 PolarHBondContact O-N 2.91Å; L545-N547 PolarHBondContact O-N 2.77Å; L545-A548 CarbonylContact O-C 3.56Å; L545-A548 PolarHBondContact O-N 3.49Å; L545-A548 VanDerWaalsContact O-N 3.17Å; L545-G549 PolarHBondContact O-N 3.24Å; L545-K550 HydrophobicContact CB-CB 4.28Å; L545-K550 HydrophobicContact CD2-CB 4Å; L545-K550 HydrophobicContact CD2-CG 4.15Å; L545-K550 WeakPolarHBondContact O-CB 3Å; L545-K550 PolarHBondContact O-N 3.29Å; L545-D573 HydrophobicContact CD2-CB 3.67Å; L545-L574 HydrophobicContact CD2-CB 4.05Å; L545-L574 HydrophobicContact CG-CB 4.48Å; L545-L574 HydrophobicContact CG-CD1 4.44Å
546	I	94.5	Very high	91.8	Very high	107 Å²	107	60.6 Å²	60.6	55%	0.549	31%	0.312	S	S	.	.	H	α-helix	trans	-61	-45	177	-69.5	165	0	0	0	111.1	N542 A548 G549	N542-I546 WeakPolarHBondContact O-CB 3.25Å; N542-I546 WeakPolarHBondContact O-CD1 3.13Å; N542-I546 VanDerWaalsContact O-CG1 3.24Å; N542-I546 WeakPolarHBondContact O-CG1 3.38Å; N542-I546 PolarHBondContact O-N 3.39Å; I546-A548 PolarHBondContact O-N 3.02Å; I546-G549 PolarHBondContact O-N 2.9Å
547	N	93.1	Very high	91.8	Very high	126 Å²	126	62.1 Å²	62.1	67%	0.674	33%	0.333	S	S	*	.	H	α-helix	trans	-62.9	-27.2	177.8	-74.6	0.5	0	0	0	113.2	K543 K544 L545 G549	K543-N547 VanDerWaalsContact O-CB 3.31Å; K543-N547 WeakPolarHBondContact O-CB 3.21Å; K543-N547 PolarHBondContact O-N 2.88Å; K543-N547 PolarHBondContact O-OD1 2.88Å; K544-N547 PolarHBondContact O-N 3.18Å; L545-N547 PolarHBondContact O-N 2.77Å; N547-G549 VanDerWaalsContact C-N 3.35Å
548	A	92.9	Very high	91.7	Very high	46 Å²	46	64.1 Å²	64.1	38%	0.38	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	7.9	175.5	0	0	0	0	0	113.7	K544 L545 I546 K550 A577	K544-A548 WeakPolarHBondContact O-CB 3.46Å; K544-A548 PolarHBondContact O-N 2.8Å; K544-A548 VanDerWaalsContact O-N 3.08Å; L545-A548 CarbonylContact O-C 3.56Å; L545-A548 PolarHBondContact O-N 3.49Å; L545-A548 VanDerWaalsContact O-N 3.17Å; I546-A548 PolarHBondContact O-N 3.02Å; A548-K550 VanDerWaalsContact C-N 3.27Å; A548-K550 HydrophobicContact CB-CG 4.17Å; A548-K550 PolarHBondContact O-N 3.38Å; A548-A577 HydrophobicContact CB-CB 3.43Å; A548-A577 VanDerWaalsContact CB-CB 3.43Å
549	G	92.4	Very high	91.6	Very high	56 Å²	56	64.4 Å²	64.4	58%	0.577	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	19.8	179.4	0	0	0	0	0	114.6	L545 I546 N547	L545-G549 PolarHBondContact O-N 3.24Å; I546-G549 PolarHBondContact O-N 2.9Å; N547-G549 VanDerWaalsContact C-N 3.35Å
550	K	92.6	Very high	91.7	Very high	47 Å²	47	59.4 Å²	59.4	20%	0.204	33%	0.327	C	S	.	.			trans	-83.3	142.3	178.9	-56	-61.9	-172.8	171.2	0	110.8	L545 A548 D573 Y585	L545-K550 HydrophobicContact CB-CB 4.28Å; L545-K550 HydrophobicContact CD2-CB 4Å; L545-K550 HydrophobicContact CD2-CG 4.15Å; L545-K550 WeakPolarHBondContact O-CB 3Å; L545-K550 PolarHBondContact O-N 3.29Å; A548-K550 VanDerWaalsContact C-N 3.27Å; A548-K550 HydrophobicContact CB-CG 4.17Å; A548-K550 PolarHBondContact O-N 3.38Å; K550-D573 HydrophobicContact CB-CB 4.24Å; K550-D573 HydrophobicContact CD-CB 4.11Å; K550-D573 HydrophobicContact CG-CB 3.99Å; K550-D573 IonicContact NZ-OD1 3.66Å; K550-Y585 PolarHBondContact NZ-OH 2.94Å
551	F	89.3	Confident	91.7	Very high	207 Å²	207	61.2 Å²	61.2	91%	0.908	34%	0.343	S	S	*	.			trans	-87.8	-18.3	179.9	-60.8	-75.2	0	0	0	113.4	K553	F551-K553 PolarHBondContact O-N 3.33Å
552	T	90.7	Very high	91.6	Very high	34 Å²	34	61.4 Å²	61.4	21%	0.209	34%	0.344	C	S	.	.			trans	-63.4	132.7	174.3	57.3	0	0	0	0	110.5	H569 D573	T552-H569 HydrophobicContact CG2-CB 4.07Å; T552-D573 HydrophobicContact CG2-CB 4.4Å; T552-D573 WeakPolarHBondContact CG2-OD2 3.42Å; T552-D573 PolarHBondContact OG1-OD2 3.02Å
553	K	90.6	Very high	91.5	Very high	128 Å²	128	65.1 Å²	65.1	56%	0.557	37%	0.368	S	S	*	.			trans	-138.4	137.9	174	-170.8	-172.4	175	-176.6	0	109.4	N542 F551	N542-K553 WeakPolarHBondContact OD1-CG 3.39Å; F551-K553 PolarHBondContact O-N 3.33Å
554	I	91.3	Very high	91.4	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.005	37%	0.366	C	S	.	.			trans	-82.8	125	171.1	-50	176	0	0	0	108.3	I538 A541 N542 T556 G559 D562 L565 F634	I538-I554 HydrophobicContact CG2-CB 4.31Å; I538-I554 HydrophobicContact CG2-CG2 4.17Å; A541-I554 HydrophobicContact CB-CD1 4.16Å; N542-I554 PolarHBondContact ND2-O 3.43Å; N542-I554 PolarHBondContact OD1-N 2.88Å; N542-I554 PolarHBondContact OD1-O 3.45Å; I554-T556 PolarHBondContact O-N 2.77Å; I554-T556 VanDerWaalsContact O-N 3.14Å; I554-G559 WeakPolarHBondContact CG2-O 3.24Å; I554-D562 HydrophobicContact CG2-CB 4.32Å; I554-L565 HydrophobicContact CD1-CD2 4.3Å; I554-L565 HydrophobicContact CG1-CD2 4.19Å; I554-F634 HydrophobicContact CD1-CD1 4.17Å; I554-F634 HydrophobicContact CD1-CE1 3.57Å; I554-F634 HydrophobicContact CD1-CE2 4.23Å; I554-F634 HydrophobicContact CD1-CZ 3.61Å
555	S	90.4	Very high	91.5	Very high	32 Å²	32	61.6 Å²	61.6	22%	0.224	36%	0.358	C	S	.	.			trans	-56.8	110.9	175	170.7	0	0	0	0	111.1	S557 S558 G559 D562	S555-S557 PolarHBondContact O-N 2.98Å; S555-S557 PolarHBondContact OG-OG 3.04Å; S555-S558 CarbonylContact O-C 3.55Å; S555-S558 PolarHBondContact O-N 3.33Å; S555-S558 WeakPolarHBondContact OG-CB 3.32Å; S555-S558 PolarHBondContact OG-N 3.4Å; S555-S558 PolarHBondContact OG-OG 2.97Å; S555-G559 PolarHBondContact O-N 3.21Å; S555-D562 WeakPolarHBondContact CB-OD2 3.46Å; S555-D562 PolarHBondContact N-OD2 3.12Å
556	T	86.1	Confident	91.4	Very high	60 Å²	60	65.1 Å²	65.1	37%	0.368	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-24.3	178.9	-47.7	0	0	0	0	113	M535 I554	M535-T556 HydrophobicContact CE-CG2 3.73Å; I554-T556 PolarHBondContact O-N 2.77Å; I554-T556 VanDerWaalsContact O-N 3.14Å
557	S	86.1	Confident	91.4	Very high	118 Å²	118	61.4 Å²	61.4	83%	0.825	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-19.3	174.8	48.4	0	0	0	0	113.9	S555	S555-S557 PolarHBondContact O-N 2.98Å; S555-S557 PolarHBondContact OG-OG 3.04Å
558	S	86.4	Confident	91.6	Very high	43 Å²	43	55.4 Å²	55.4	30%	0.301	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-19.8	177.7	-46.9	0	0	0	0	112.8	S555 F560 T561	S555-S558 CarbonylContact O-C 3.55Å; S555-S558 PolarHBondContact O-N 3.33Å; S555-S558 WeakPolarHBondContact OG-CB 3.32Å; S555-S558 PolarHBondContact OG-N 3.4Å; S555-S558 PolarHBondContact OG-OG 2.97Å; S558-F560 PolarHBondContact O-N 2.91Å; S558-T561 WeakPolarHBondContact O-CB 3.41Å; S558-T561 PolarHBondContact O-N 3.4Å; S558-T561 PolarHBondContact O-OG1 3.44Å
559	G	90.8	Very high	91.8	Very high	9 Å²	9	55.8 Å²	55.8	9%	0.093	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	48.4	-134.2	-174.6	0	0	0	0	0	112.6	I538 I554 S555 T561 D562	I538-G559 VanDerWaalsContact CD1-CA 3.5Å; I554-G559 WeakPolarHBondContact CG2-O 3.24Å; S555-G559 PolarHBondContact O-N 3.21Å; G559-T561 PolarHBondContact O-N 2.98Å; G559-T561 VanDerWaalsContact O-N 3.07Å; G559-D562 WeakPolarHBondContact O-CB 3.48Å; G559-D562 PolarHBondContact O-N 3.27Å; G559-D562 VanDerWaalsContact O-N 3.15Å
560	F	92.3	Very high	91.9	Very high	7 Å²	7	53.5 Å²	53.5	3%	0.031	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-73	9	178.4	-57.9	-59.5	0	0	0	114.9	E534 I537 I538 S558 H627 I630 M631 F634	E534-F560 HydrophobicContact CB-CE2 4.13Å; I537-F560 HydrophobicContact CB-CZ 4.21Å; I537-F560 HydrophobicContact CG2-CZ 4.06Å; I538-F560 HydrophobicContact CD1-CD2 4.17Å; I538-F560 HydrophobicContact CD1-CE2 3.93Å; I538-F560 HydrophobicContact CD1-CZ 4.18Å; I538-F560 HydrophobicContact CG1-CD1 4.4Å; I538-F560 HydrophobicContact CG1-CD2 4.37Å; I538-F560 HydrophobicContact CG1-CE1 3.84Å; I538-F560 HydrophobicContact CG1-CE2 3.81Å; I538-F560 HydrophobicContact CG1-CZ 3.52Å; S558-F560 PolarHBondContact O-N 2.91Å; F560-H627 HydrophobicContact CB-CB 3.91Å; F560-H627 VanDerWaalsContact O-CB 3.29Å; F560-H627 WeakPolarHBondContact O-CB 3.38Å; F560-I630 HydrophobicContact CB-CB 4.4Å; F560-I630 HydrophobicContact CB-CG2 4.24Å; F560-I630 HydrophobicContact CD1-CG2 3.86Å; F560-I630 HydrophobicContact CG-CG2 4.38Å; F560-M631 HydrophobicContact CD2-CB 3.62Å; F560-M631 HydrophobicContact CD2-CG 3.93Å; F560-M631 HydrophobicContact CE2-CB 3.72Å; F560-M631 HydrophobicContact CE2-CG 3.58Å; F560-M631 HydrophobicContact CG-CB 4.23Å; F560-M631 HydrophobicContact CZ-CB 4.4Å; F560-M631 HydrophobicContact CZ-CG 4.35Å; F560-F634 AromaticContact CD1-CD2 3.86Å; F560-F634 HydrophobicContact CD1-CD2 3.86Å; F560-F634 HydrophobicContact CD1-CE2 4.31Å; F560-F634 HydrophobicContact CE1-CB 3.81Å; F560-F634 AromaticContact CE1-CD2 3.45Å; F560-F634 HydrophobicContact CE1-CD2 3.45Å; F560-F634 VanDerWaalsContact CE1-CD2 3.45Å; F560-F634 HydrophobicContact CE1-CE2 4.19Å; F560-F634 AromaticContact CE1-CG 3.71Å; F560-F634 HydrophobicContact CE1-CG 3.71Å; F560-F634 HydrophobicContact CZ-CB 4.08Å; F560-F634 HydrophobicContact CZ-CD2 4.48Å; F560-F634 HydrophobicContact CZ-CG 4.45Å
561	T	92.7	Very high	92.1	Very high	74 Å²	74	51.3 Å²	51.3	45%	0.454	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-101.2	3.1	167.7	70	0	0	0	0	113.6	S558 G559 P563 H627	S558-T561 WeakPolarHBondContact O-CB 3.41Å; S558-T561 PolarHBondContact O-N 3.4Å; S558-T561 PolarHBondContact O-OG1 3.44Å; G559-T561 PolarHBondContact O-N 2.98Å; G559-T561 VanDerWaalsContact O-N 3.07Å; T561-P563 WeakPolarHBondContact O-CD 3.41Å; T561-H627 HydrophobicContact CG2-CB 3.85Å
562	D	92.8	Very high	92.5	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.021	24%	0.24	C	C	.	.			trans	-56.3	120.7	178.9	-176.7	-15.4	0	0	0	112.1	I554 S555 G559 N564 L565 L625	I554-D562 HydrophobicContact CG2-CB 4.32Å; S555-D562 WeakPolarHBondContact CB-OD2 3.46Å; S555-D562 PolarHBondContact N-OD2 3.12Å; G559-D562 WeakPolarHBondContact O-CB 3.48Å; G559-D562 PolarHBondContact O-N 3.27Å; G559-D562 VanDerWaalsContact O-N 3.15Å; D562-N564 PolarHBondContact O-N 2.86Å; D562-N564 VanDerWaalsContact O-N 3.08Å; D562-N564 WeakPolarHBondContact OD1-CB 3.35Å; D562-N564 PolarHBondContact OD1-N 3.05Å; D562-N564 PolarHBondContact OD1-ND2 3.09Å; D562-L565 HydrophobicContact CB-CD1 3.9Å; D562-L565 HydrophobicContact CB-CG 4.09Å; D562-L565 WeakPolarHBondContact O-CB 3.49Å; D562-L565 WeakPolarHBondContact O-CG 3.35Å; D562-L565 PolarHBondContact O-N 3.1Å; D562-L625 WeakPolarHBondContact O-CD2 3.42Å
563	P	93.3	Very high	92.8	Very high	86 Å²	86	40.9 Å²	40.9	56%	0.558	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-52.7	-29.4	177.9	-29	36.7	0	0	0	115.5	T561 L565 K566	T561-P563 WeakPolarHBondContact O-CD 3.41Å; P563-L565 PolarHBondContact O-N 3.1Å; P563-K566 WeakPolarHBondContact O-CB 3.48Å; P563-K566 WeakPolarHBondContact O-CG 3.31Å; P563-K566 PolarHBondContact O-N 2.95Å
564	N	92.3	Very high	93.1	Very high	107 Å²	107	34.8 Å²	34.8	57%	0.572	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-66.2	-21	-179.5	-61.5	-72.4	0	0	0	112.7	D562 K566 T567	D562-N564 PolarHBondContact O-N 2.86Å; D562-N564 VanDerWaalsContact O-N 3.08Å; D562-N564 WeakPolarHBondContact OD1-CB 3.35Å; D562-N564 PolarHBondContact OD1-N 3.05Å; D562-N564 PolarHBondContact OD1-ND2 3.09Å; N564-K566 PolarHBondContact O-N 2.86Å; N564-T567 PolarHBondContact O-N 3.28Å; N564-T567 PolarHBondContact O-OG1 3.05Å
565	L	94.6	Very high	93.3	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-64.2	-22.5	177.9	-64.1	165.9	0	0	0	112.6	I554 D562 P563 T567 S568 A570 L625 I630 F634	I554-L565 HydrophobicContact CD1-CD2 4.3Å; I554-L565 HydrophobicContact CG1-CD2 4.19Å; D562-L565 HydrophobicContact CB-CD1 3.9Å; D562-L565 HydrophobicContact CB-CG 4.09Å; D562-L565 WeakPolarHBondContact O-CB 3.49Å; D562-L565 WeakPolarHBondContact O-CG 3.35Å; D562-L565 PolarHBondContact O-N 3.1Å; P563-L565 PolarHBondContact O-N 3.1Å; L565-T567 VanDerWaalsContact C-N 3.26Å; L565-T567 PolarHBondContact O-N 2.96Å; L565-S568 PolarHBondContact O-N 3.06Å; L565-A570 HydrophobicContact CD2-CB 4.13Å; L565-L625 HydrophobicContact CB-CD2 3.81Å; L565-I630 HydrophobicContact CD1-CG2 4.28Å; L565-F634 HydrophobicContact CD2-CE2 3.96Å; L565-F634 HydrophobicContact CD2-CZ 3.9Å
566	K	94.7	Very high	93.6	Very high	75 Å²	75	34.5 Å²	34.5	33%	0.326	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-60.9	-29.4	178.2	-66.8	-167.9	177.2	-165.6	0	113.9	P563 N564 S568 Q597 I623 L625	P563-K566 WeakPolarHBondContact O-CB 3.48Å; P563-K566 WeakPolarHBondContact O-CG 3.31Å; P563-K566 PolarHBondContact O-N 2.95Å; N564-K566 PolarHBondContact O-N 2.86Å; K566-S568 PolarHBondContact O-N 3.42Å; K566-Q597 WeakPolarHBondContact O-CB 3.49Å; K566-Q597 WeakPolarHBondContact O-CG 3.47Å; K566-I623 WeakPolarHBondContact CD-O 3.31Å; K566-I623 WeakPolarHBondContact CE-O 3.18Å; K566-I623 PolarHBondContact NZ-O 3.04Å; K566-L625 HydrophobicContact CD-CD1 4.31Å; K566-L625 HydrophobicContact CD-CG 4.32Å; K566-L625 VanDerWaalsContact CE-CD1 3.4Å; K566-L625 HydrophobicContact CG-CD1 4.07Å; K566-L625 HydrophobicContact CG-CD2 3.82Å; K566-L625 HydrophobicContact CG-CG 3.75Å
567	T	94.8	Very high	94.1	Very high	29 Å²	29	32.3 Å²	32.3	18%	0.178	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-73	-12.6	178	72	0	0	0	0	112.8	N564 L565 H569 N600	N564-T567 PolarHBondContact O-N 3.28Å; N564-T567 PolarHBondContact O-OG1 3.05Å; L565-T567 VanDerWaalsContact C-N 3.26Å; L565-T567 PolarHBondContact O-N 2.96Å; T567-H569 WeakPolarHBondContact CB-ND1 3.27Å; T567-H569 PolarHBondContact O-N 2.95Å; T567-H569 VanDerWaalsContact O-N 3.13Å; T567-H569 WeakPolarHBondContact OG1-CB 3.31Å; T567-H569 PolarHBondContact OG1-N 2.97Å; T567-H569 PolarHBondContact OG1-ND1 2.83Å; T567-N600 WeakPolarHBondContact O-CB 3.17Å; T567-N600 PolarHBondContact O-ND2 2.93Å
568	S	96.3	Very high	94.4	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.156	C	C	.	.			trans	59.8	1.5	-167.7	-53.3	0	0	0	0	115.6	L565 K566 A570 V571 I572 A601	L565-S568 PolarHBondContact O-N 3.06Å; K566-S568 PolarHBondContact O-N 3.42Å; S568-A570 VanDerWaalsContact C-N 3.34Å; S568-A570 PolarHBondContact O-N 2.84Å; S568-V571 WeakPolarHBondContact O-CB 3.45Å; S568-V571 PolarHBondContact O-N 2.75Å; S568-I572 WeakPolarHBondContact O-CG1 3.39Å; S568-I572 PolarHBondContact O-N 3.06Å; S568-A601 WeakPolarHBondContact OG-CA 3.49Å; S568-A601 WeakPolarHBondContact OG-CB 3.35Å
569	H	96.2	Very high	94.7	Very high	54 Å²	54	28.1 Å²	28.1	25%	0.25	15%	0.153	C	C	.	.	H	α-helix	trans	-58.5	-42.2	-178	-62	149.1	0	0	0	112.7	T552 T567 V571 I572 D573 L589 P590	T552-H569 HydrophobicContact CG2-CB 4.07Å; T567-H569 WeakPolarHBondContact CB-ND1 3.27Å; T567-H569 PolarHBondContact O-N 2.95Å; T567-H569 VanDerWaalsContact O-N 3.13Å; T567-H569 WeakPolarHBondContact OG1-CB 3.31Å; T567-H569 PolarHBondContact OG1-N 2.97Å; T567-H569 PolarHBondContact OG1-ND1 2.83Å; H569-V571 PolarHBondContact O-N 3.14Å; H569-I572 PolarHBondContact O-N 2.93Å; H569-I572 VanDerWaalsContact O-N 3.17Å; H569-D573 WeakPolarHBondContact O-CB 3.48Å; H569-D573 PolarHBondContact O-N 2.6Å; H569-L589 PolarHBondContact NE2-O 3.34Å; H569-P590 PolarHBondContact CE1-O 2.74Å
570	A	95.8	Very high	94.8	Very high	7 Å²	7	31.8 Å²	31.8	6%	0.058	18%	0.175	C	C	.	.	H	α-helix	trans	-64.7	-23.8	178.3	0	0	0	0	0	113.7	L565 S568 L574	L565-A570 HydrophobicContact CD2-CB 4.13Å; S568-A570 VanDerWaalsContact C-N 3.34Å; S568-A570 PolarHBondContact O-N 2.84Å; A570-L574 VanDerWaalsContact O-CB 3.23Å; A570-L574 WeakPolarHBondContact O-CB 3.43Å; A570-L574 PolarHBondContact O-N 3.25Å
571	V	96.9	Very high	94.7	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-79.5	-44	173.4	-176.3	0	0	0	0	109.8	S568 H569 L574 I575 A604 L622 I633 F634 L637	S568-V571 WeakPolarHBondContact O-CB 3.45Å; S568-V571 PolarHBondContact O-N 2.75Å; H569-V571 PolarHBondContact O-N 3.14Å; V571-L574 PolarHBondContact O-N 2.79Å; V571-I575 HydrophobicContact CG1-CD1 4.04Å; V571-I575 WeakPolarHBondContact O-CD1 3.33Å; V571-I575 VanDerWaalsContact O-CG1 3.28Å; V571-I575 WeakPolarHBondContact O-CG1 3.41Å; V571-I575 PolarHBondContact O-N 3.49Å; V571-A604 HydrophobicContact CB-CB 4.28Å; V571-A604 HydrophobicContact CG1-CB 4.05Å; V571-L622 HydrophobicContact CG2-CD2 3.97Å; V571-I633 HydrophobicContact CG1-CG2 4.1Å; V571-F634 HydrophobicContact CG2-CE2 4.12Å; V571-F634 HydrophobicContact CG2-CZ 3.85Å; V571-L637 HydrophobicContact CG1-CD1 4.1Å
572	I	97.2	Very high	94.6	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-63.4	-49.3	178.9	-65.7	167.7	0	0	0	111.2	S568 H569 L574 I575 E576 V583 Y585 V588 N600 Y603 A604	S568-I572 WeakPolarHBondContact O-CG1 3.39Å; S568-I572 PolarHBondContact O-N 3.06Å; H569-I572 PolarHBondContact O-N 2.93Å; H569-I572 VanDerWaalsContact O-N 3.17Å; I572-L574 VanDerWaalsContact C-N 3.27Å; I572-L574 PolarHBondContact O-N 3.28Å; I572-I575 WeakPolarHBondContact O-CB 3.19Å; I572-I575 PolarHBondContact O-N 3.14Å; I572-E576 PolarHBondContact O-N 2.82Å; I572-V583 HydrophobicContact CG2-CB 4.3Å; I572-V583 HydrophobicContact CG2-CG1 3.48Å; I572-V583 VanDerWaalsContact CG2-CG1 3.48Å; I572-V583 HydrophobicContact CG2-CG2 3.79Å; I572-Y585 HydrophobicContact CG2-CE1 4.4Å; I572-V588 HydrophobicContact CD1-CG1 3.98Å; I572-V588 HydrophobicContact CD1-CG2 4.25Å; I572-V588 HydrophobicContact CG2-CG2 4.12Å; I572-N600 HydrophobicContact CD1-CB 4.32Å; I572-Y603 HydrophobicContact CD1-CD1 4.5Å; I572-A604 HydrophobicContact CD1-CB 4.31Å; I572-A604 HydrophobicContact CG1-CB 3.74Å
573	D	96.9	Very high	94.6	Very high	21 Å²	21	35.8 Å²	35.8	11%	0.112	20%	0.195	C	C	.	.	H	α-helix	trans	-64.6	-31	177.8	-89	3.2	0	0	0	112.4	L545 K550 T552 H569 A577 Y585	L545-D573 HydrophobicContact CD2-CB 3.67Å; K550-D573 HydrophobicContact CB-CB 4.24Å; K550-D573 HydrophobicContact CD-CB 4.11Å; K550-D573 HydrophobicContact CG-CB 3.99Å; K550-D573 IonicContact NZ-OD1 3.66Å; T552-D573 HydrophobicContact CG2-CB 4.4Å; T552-D573 WeakPolarHBondContact CG2-OD2 3.42Å; T552-D573 PolarHBondContact OG1-OD2 3.02Å; H569-D573 WeakPolarHBondContact O-CB 3.48Å; H569-D573 PolarHBondContact O-N 2.6Å; D573-A577 VanDerWaalsContact O-CB 3.27Å; D573-A577 WeakPolarHBondContact O-CB 3.41Å; D573-A577 PolarHBondContact O-N 3.24Å; D573-Y585 VanDerWaalsContact OD1-CE1 3.26Å; D573-Y585 WeakPolarHBondContact OD1-CE1 3.46Å; D573-Y585 VanDerWaalsContact OD1-CZ 3.31Å; D573-Y585 PolarHBondContact OD1-OH 3.11Å
574	L	96.9	Very high	94.6	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-73.2	-38.4	174.8	179.7	61.4	0	0	0	111.7	W540 A541 K544 L545 A570 V571 I572 A577 I578 F634 L637	W540-L574 HydrophobicContact CH2-CD1 3.88Å; W540-L574 HydrophobicContact CH2-CD2 3.83Å; W540-L574 HydrophobicContact CH2-CG 4.2Å; W540-L574 HydrophobicContact CZ2-CD1 4.3Å; W540-L574 HydrophobicContact CZ3-CD1 4.35Å; W540-L574 HydrophobicContact CZ3-CD2 3.81Å; A541-L574 HydrophobicContact CB-CD2 4.08Å; K544-L574 HydrophobicContact CB-CD1 3.83Å; K544-L574 HydrophobicContact CG-CD1 3.74Å; L545-L574 HydrophobicContact CD2-CB 4.05Å; L545-L574 HydrophobicContact CG-CB 4.48Å; L545-L574 HydrophobicContact CG-CD1 4.44Å; A570-L574 VanDerWaalsContact O-CB 3.23Å; A570-L574 WeakPolarHBondContact O-CB 3.43Å; A570-L574 PolarHBondContact O-N 3.25Å; V571-L574 PolarHBondContact O-N 2.79Å; I572-L574 VanDerWaalsContact C-N 3.27Å; I572-L574 PolarHBondContact O-N 3.28Å; L574-A577 PolarHBondContact O-N 3.02Å; L574-I578 HydrophobicContact CD1-CD1 4.17Å; L574-I578 HydrophobicContact CD1-CG1 4.35Å; L574-I578 HydrophobicContact CG-CD1 3.94Å; L574-I578 WeakPolarHBondContact O-CD1 3.29Å; L574-I578 VanDerWaalsContact O-CG1 3.22Å; L574-I578 WeakPolarHBondContact O-CG1 3.33Å; L574-I578 PolarHBondContact O-N 3.28Å; L574-F634 HydrophobicContact CD2-CD1 3.39Å; L574-F634 HydrophobicContact CD2-CE1 3.47Å; L574-F634 VanDerWaalsContact CD2-CE1 3.47Å; L574-L637 HydrophobicContact CD2-CB 4.39Å; L574-L637 HydrophobicContact CD2-CD1 3.93Å; L574-L637 HydrophobicContact CG-CD1 4.41Å
575	I	96.7	Very high	94.7	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-59.6	-47.5	173	-73.1	161.2	0	0	0	110.3	V571 I572 A577 I578 R579 T582 V583 A604 L607 A608 I611 L637	V571-I575 HydrophobicContact CG1-CD1 4.04Å; V571-I575 WeakPolarHBondContact O-CD1 3.33Å; V571-I575 VanDerWaalsContact O-CG1 3.28Å; V571-I575 WeakPolarHBondContact O-CG1 3.41Å; V571-I575 PolarHBondContact O-N 3.49Å; I572-I575 WeakPolarHBondContact O-CB 3.19Å; I572-I575 PolarHBondContact O-N 3.14Å; I575-A577 VanDerWaalsContact C-N 3.32Å; I575-A577 PolarHBondContact O-N 3.4Å; I575-I578 PolarHBondContact O-N 2.69Å; I575-I578 VanDerWaalsContact O-N 3.14Å; I575-R579 PolarHBondContact O-N 3.41Å; I575-T582 HydrophobicContact CG2-CG2 3.57Å; I575-V583 HydrophobicContact CG2-CG2 4.38Å; I575-A604 WeakPolarHBondContact CD1-O 3.34Å; I575-L607 HydrophobicContact CD1-CB 4.02Å; I575-L607 HydrophobicContact CG2-CB 4.24Å; I575-A608 HydrophobicContact CD1-CB 3.99Å; I575-I611 HydrophobicContact CG1-CD1 4.33Å; I575-I611 HydrophobicContact CG2-CD1 4.27Å; I575-I611 HydrophobicContact CG2-CG2 4.12Å; I575-L637 HydrophobicContact CD1-CD2 4.5Å; I575-L637 HydrophobicContact CG1-CD1 4.37Å; I575-L637 HydrophobicContact CG1-CD2 3.74Å
576	E	95.9	Very high	94.7	Very high	28 Å²	28	41.2 Å²	41.2	13%	0.131	21%	0.213	C	C	.	.	H	α-helix	trans	-63.5	-36.9	175.7	-175	61.4	-164.5	0	0	112.2	I572 I578 R579 P580 N581 T582 V583 Y585	I572-E576 PolarHBondContact O-N 2.82Å; E576-I578 VanDerWaalsContact C-N 3.29Å; E576-I578 PolarHBondContact O-N 3.21Å; E576-R579 CarbonylContact O-C 3.54Å; E576-R579 VanDerWaalsContact O-C 3.23Å; E576-P580 WeakPolarHBondContact O-CA 3.47Å; E576-P580 WeakPolarHBondContact OE1-CA 3.08Å; E576-N581 PolarHBondContact OE1-N 3.2Å; E576-N581 PolarHBondContact OE2-N 3.23Å; E576-T582 PolarHBondContact OE2-N 3.5Å; E576-V583 HydrophobicContact CB-CB 4.32Å; E576-V583 HydrophobicContact CB-CG2 3.8Å; E576-V583 PolarHBondContact OE2-N 2.81Å; E576-Y585 HydrophobicContact CG-CE2 4.09Å
577	A	95.6	Very high	94.6	Very high	14 Å²	14	40.2 Å²	40.2	12%	0.116	21%	0.211	C	C	.	.	H	α-helix	trans	-68.8	-24.4	174.7	0	0	0	0	0	113.5	K544 A548 D573 L574 I575	K544-A577 WeakPolarHBondContact CE-O 3.39Å; K544-A577 HydrophobicContact CG-CB 4.06Å; A548-A577 HydrophobicContact CB-CB 3.43Å; A548-A577 VanDerWaalsContact CB-CB 3.43Å; D573-A577 VanDerWaalsContact O-CB 3.27Å; D573-A577 WeakPolarHBondContact O-CB 3.41Å; D573-A577 PolarHBondContact O-N 3.24Å; L574-A577 PolarHBondContact O-N 3.02Å; I575-A577 VanDerWaalsContact C-N 3.32Å; I575-A577 PolarHBondContact O-N 3.4Å
578	I	94	Very high	94.6	Very high	13 Å²	13	40.1 Å²	40.1	7%	0.067	21%	0.21	C	C	.	.	H	α-helix	trans	-84.2	-42	174.9	-68.8	161.7	0	0	0	111.1	W540 L574 I575 E576 I611 L637 V640 D641 Q644	W540-I578 HydrophobicContact CH2-CD1 3.98Å; W540-I578 HydrophobicContact CZ2-CD1 4.2Å; W540-I578 HydrophobicContact CZ2-CG1 4.41Å; L574-I578 HydrophobicContact CD1-CD1 4.17Å; L574-I578 HydrophobicContact CD1-CG1 4.35Å; L574-I578 HydrophobicContact CG-CD1 3.94Å; L574-I578 WeakPolarHBondContact O-CD1 3.29Å; L574-I578 VanDerWaalsContact O-CG1 3.22Å; L574-I578 WeakPolarHBondContact O-CG1 3.33Å; L574-I578 PolarHBondContact O-N 3.28Å; I575-I578 PolarHBondContact O-N 2.69Å; I575-I578 VanDerWaalsContact O-N 3.14Å; E576-I578 VanDerWaalsContact C-N 3.29Å; E576-I578 PolarHBondContact O-N 3.21Å; I578-I611 HydrophobicContact CB-CD1 4.36Å; I578-I611 HydrophobicContact CD1-CD1 4.5Å; I578-I611 HydrophobicContact CG2-CD1 3.98Å; I578-L637 HydrophobicContact CD1-CB 3.9Å; I578-L637 HydrophobicContact CD1-CD2 4.26Å; I578-V640 HydrophobicContact CG2-CG1 4.22Å; I578-D641 HydrophobicContact CG1-CB 4.25Å; I578-D641 HydrophobicContact CG2-CB 4.42Å; I578-Q644 VanDerWaalsContact CG2-NE2 3.31Å
579	R	92.4	Very high	94.5	Very high	59 Å²	59	43.2 Å²	43.2	22%	0.223	23%	0.226	C	C	.	.	S	Bend	trans	-138	100.3	176.1	-174	176.4	-60.4	156.8	14.9	110.3	E194 I575 E576 T582 I611	E194-R579 WeakPolarHBondContact OE1-CD 3.43Å; E194-R579 IonicContact OE1-CZ 3.32Å; E194-R579 IonicContact OE1-NE 2.89Å; E194-R579 IonicContact OE1-NH1 2.64Å; E194-R579 PolarHBondContact OE1-NH1 2.97Å; I575-R579 PolarHBondContact O-N 3.41Å; E576-R579 CarbonylContact O-C 3.54Å; E576-R579 VanDerWaalsContact O-C 3.23Å; R579-T582 WeakPolarHBondContact CB-OG1 3.43Å; R579-T582 WeakPolarHBondContact CG-OG1 3.28Å; R579-T582 WeakPolarHBondContact O-CB 3.38Å; R579-T582 PolarHBondContact O-N 2.97Å; R579-T582 PolarHBondContact O-OG1 3.36Å; R579-I611 HydrophobicContact CB-CG2 4.29Å; R579-I611 PolarHBondContact NH2-O 2.79Å
580	P	92.5	Very high	94.4	Very high	86 Å²	86	44.3 Å²	44.3	56%	0.558	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	151.4	178.2	-26.3	35.8	0	0	0	113.4	E576 T582	E576-P580 WeakPolarHBondContact O-CA 3.47Å; E576-P580 WeakPolarHBondContact OE1-CA 3.08Å; P580-T582 VanDerWaalsContact C-N 3.27Å
581	N	89.8	Confident	94.3	Very high	152 Å²	152	44 Å²	44	81%	0.813	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	65	24.3	-172.5	-38.4	-88.7	0	0	0	113.8	E576	E576-N581 PolarHBondContact OE1-N 3.2Å; E576-N581 PolarHBondContact OE2-N 3.23Å
582	T	90.8	Very high	94	Very high	6 Å²	6	50.4 Å²	50.4	4%	0.037	27%	0.27	C	S	.	.			trans	-87.2	-37.9	175.4	-66	0	0	0	0	111.4	I575 E576 R579 P580 L607 R610 I611	I575-T582 HydrophobicContact CG2-CG2 3.57Å; E576-T582 PolarHBondContact OE2-N 3.5Å; R579-T582 WeakPolarHBondContact CB-OG1 3.43Å; R579-T582 WeakPolarHBondContact CG-OG1 3.28Å; R579-T582 WeakPolarHBondContact O-CB 3.38Å; R579-T582 PolarHBondContact O-N 2.97Å; R579-T582 PolarHBondContact O-OG1 3.36Å; P580-T582 VanDerWaalsContact C-N 3.27Å; T582-L607 HydrophobicContact CG2-CD2 4.18Å; T582-R610 PolarHBondContact O-NH2 2.99Å; T582-I611 HydrophobicContact CG2-CG2 3.68Å
583	V	93.4	Very high	93.9	Very high	12 Å²	12	53.3 Å²	53.3	7%	0.073	29%	0.288	C	S	.	.			trans	-96.9	115.8	-173.2	180	0	0	0	0	111.2	I572 I575 E576 Y585 V588 Y603 L607	I572-V583 HydrophobicContact CG2-CB 4.3Å; I572-V583 HydrophobicContact CG2-CG1 3.48Å; I572-V583 VanDerWaalsContact CG2-CG1 3.48Å; I572-V583 HydrophobicContact CG2-CG2 3.79Å; I575-V583 HydrophobicContact CG2-CG2 4.38Å; E576-V583 HydrophobicContact CB-CB 4.32Å; E576-V583 HydrophobicContact CB-CG2 3.8Å; E576-V583 PolarHBondContact OE2-N 2.81Å; V583-Y585 HydrophobicContact CB-CD2 4.09Å; V583-Y585 HydrophobicContact CB-CE2 3.7Å; V583-Y585 HydrophobicContact CG1-CD1 4.14Å; V583-Y585 HydrophobicContact CG1-CD2 3.67Å; V583-Y585 HydrophobicContact CG1-CE1 4.06Å; V583-Y585 HydrophobicContact CG1-CE2 3.57Å; V583-Y585 HydrophobicContact CG1-CG 3.96Å; V583-Y585 WeakPolarHBondContact O-CD2 3.43Å; V583-Y585 PolarHBondContact O-N 3.15Å; V583-V588 HydrophobicContact CG1-CG2 4.09Å; V583-Y603 HydrophobicContact CG1-CE1 4.45Å; V583-L607 HydrophobicContact CG2-CD1 4.05Å
584	D	93.5	Very high	93.8	Very high	69 Å²	69	59.2 Å²	59.2	37%	0.369	31%	0.313	S	S	.	.			trans	-77	108.7	156	-175.8	1.9	0	0	0	109	N586 L587 Y603	D584-N586 VanDerWaalsContact C-N 3.3Å; D584-N586 VanDerWaalsContact OD1-CB 3.3Å; D584-N586 WeakPolarHBondContact OD1-CB 3.25Å; D584-N586 PolarHBondContact OD1-N 2.99Å; D584-N586 PolarHBondContact OD1-ND2 2.93Å; D584-L587 HydrophobicContact CB-CD1 4.02Å; D584-L587 HydrophobicContact CB-CG 4.15Å; D584-L587 PolarHBondContact O-N 2.83Å; D584-Y603 PolarHBondContact N-OH 2.9Å; D584-Y603 PolarHBondContact O-OH 2.77Å
585	Y	94.4	Very high	93.8	Very high	88 Å²	88	64 Å²	64	35%	0.345	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-73	-18.3	179	-79.1	-87.4	0	0	0	113.5	K550 I572 D573 E576 V583 L587 V588	K550-Y585 PolarHBondContact NZ-OH 2.94Å; I572-Y585 HydrophobicContact CG2-CE1 4.4Å; D573-Y585 VanDerWaalsContact OD1-CE1 3.26Å; D573-Y585 WeakPolarHBondContact OD1-CE1 3.46Å; D573-Y585 VanDerWaalsContact OD1-CZ 3.31Å; D573-Y585 PolarHBondContact OD1-OH 3.11Å; E576-Y585 HydrophobicContact CG-CE2 4.09Å; V583-Y585 HydrophobicContact CB-CD2 4.09Å; V583-Y585 HydrophobicContact CB-CE2 3.7Å; V583-Y585 HydrophobicContact CG1-CD1 4.14Å; V583-Y585 HydrophobicContact CG1-CD2 3.67Å; V583-Y585 HydrophobicContact CG1-CE1 4.06Å; V583-Y585 HydrophobicContact CG1-CE2 3.57Å; V583-Y585 HydrophobicContact CG1-CG 3.96Å; V583-Y585 WeakPolarHBondContact O-CD2 3.43Å; V583-Y585 PolarHBondContact O-N 3.15Å; Y585-L587 PolarHBondContact O-N 3.2Å; Y585-V588 HydrophobicContact CD1-CG2 4.38Å; Y585-V588 PolarHBondContact O-N 3.45Å; Y585-V588 VanDerWaalsContact O-N 3.17Å
586	N	94.1	Very high	93.7	Very high	150 Å²	150	65.8 Å²	65.8	80%	0.802	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-67.2	-16.4	174.9	-56.5	-78.2	0	0	0	112.1	D584	D584-N586 VanDerWaalsContact C-N 3.3Å; D584-N586 VanDerWaalsContact OD1-CB 3.3Å; D584-N586 WeakPolarHBondContact OD1-CB 3.25Å; D584-N586 PolarHBondContact OD1-N 2.99Å; D584-N586 PolarHBondContact OD1-ND2 2.93Å
587	L	91.9	Very high	93.8	Very high	55 Å²	55	65.9 Å²	65.9	29%	0.288	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-97.3	-4.2	178.7	-53.9	-178.7	0	0	0	113.2	R179 D584 Y585 Y603	R179-L587 HydrophobicContact CB-CD1 3.93Å; R179-L587 HydrophobicContact CG-CD1 4.18Å; R179-L587 PolarHBondContact NH1-O 3.34Å; D584-L587 HydrophobicContact CB-CD1 4.02Å; D584-L587 HydrophobicContact CB-CG 4.15Å; D584-L587 PolarHBondContact O-N 2.83Å; Y585-L587 PolarHBondContact O-N 3.2Å; L587-Y603 HydrophobicContact CB-CE1 4.31Å
588	V	95.1	Very high	93.8	Very high	27 Å²	27	67.3 Å²	67.3	16%	0.164	36%	0.356	C	S	.	.			trans	-92.8	122.9	-178	-178.2	0	0	0	0	109.5	I572 V583 Y585 Y603	I572-V588 HydrophobicContact CD1-CG1 3.98Å; I572-V588 HydrophobicContact CD1-CG2 4.25Å; I572-V588 HydrophobicContact CG2-CG2 4.12Å; V583-V588 HydrophobicContact CG1-CG2 4.09Å; Y585-V588 HydrophobicContact CD1-CG2 4.38Å; Y585-V588 PolarHBondContact O-N 3.45Å; Y585-V588 VanDerWaalsContact O-N 3.17Å; V588-Y603 HydrophobicContact CG2-CD1 4.15Å; V588-Y603 HydrophobicContact CG2-CE1 3.75Å
589	L	95.6	Very high	93.9	Very high	65 Å²	65	68.7 Å²	68.7	34%	0.34	37%	0.365	S	S	.	.			trans	-88.3	162.3	-178	-58.9	179.3	0	0	0	111.6	H569 G591 E596 T599 N600	H569-L589 PolarHBondContact NE2-O 3.34Å; L589-G591 PolarHBondContact O-N 3.27Å; L589-E596 HydrophobicContact CB-CB 3.97Å; L589-E596 HydrophobicContact CB-CG 3.96Å; L589-E596 HydrophobicContact CD1-CB 4.22Å; L589-E596 HydrophobicContact CD1-CG 3.95Å; L589-T599 HydrophobicContact CD1-CG2 3.73Å; L589-N600 WeakPolarHBondContact CB-OD1 3.4Å; L589-N600 PolarHBondContact N-OD1 2.81Å; L589-N600 PolarHBondContact O-ND2 2.93Å
590	P	93.7	Very high	94.2	Very high	76 Å²	76	65.9 Å²	65.9	49%	0.494	36%	0.355	S	S	.	.			trans	-59.3	-27	177.9	-26.3	36.3	0	0	0	114.5	H569 N592	H569-P590 PolarHBondContact CE1-O 2.74Å; P590-N592 VanDerWaalsContact C-N 3.35Å; P590-N592 WeakPolarHBondContact CB-ND2 3.02Å
591	G	92.1	Very high	94.4	Very high	2 Å²	2	61.8 Å²	61.8	2%	0.021	33%	0.328	C	S	.	.			trans	77.1	22.7	179.9	0	0	0	0	0	113	L589 E596 Q597	L589-G591 PolarHBondContact O-N 3.27Å; G591-E596 PolarHBondContact N-OE2 3.42Å; G591-Q597 WeakPolarHBondContact O-CG 3.24Å; G591-Q597 PolarHBondContact O-NE2 3.31Å
592	N	92.6	Very high	94.7	Very high	134 Å²	134	56.1 Å²	56.1	72%	0.717	30%	0.297	S	S	*	.			trans	-76	-35.2	-179	-70.8	-37	0	0	0	112	P590 E596	P590-N592 VanDerWaalsContact C-N 3.35Å; P590-N592 WeakPolarHBondContact CB-ND2 3.02Å; N592-E596 PolarHBondContact N-OE2 3.36Å
593	T	95.1	Very high	95	Very high	62 Å²	62	56 Å²	56	38%	0.38	30%	0.296	S	S	.	.	S	Bend	trans	-102.4	154.2	176.7	62.7	0	0	0	0	112.1	T595 E596 Q597	T593-T595 PolarHBondContact O-N 3.13Å; T593-T595 VanDerWaalsContact O-N 3.14Å; T593-T595 PolarHBondContact OG1-OG1 3.19Å; T593-E596 WeakPolarHBondContact CB-OE1 3.3Å; T593-E596 VanDerWaalsContact CG2-OE1 3.26Å; T593-E596 WeakPolarHBondContact CG2-OE1 3.45Å; T593-E596 PolarHBondContact N-OE1 3.27Å; T593-E596 PolarHBondContact O-N 3.36Å; T593-E596 VanDerWaalsContact OG1-CD 3.25Å; T593-E596 VanDerWaalsContact OG1-CG 3.25Å; T593-E596 WeakPolarHBondContact OG1-CG 3.41Å; T593-E596 PolarHBondContact OG1-N 2.78Å; T593-E596 PolarHBondContact OG1-OE1 3.12Å; T593-Q597 VanDerWaalsContact O-CG 3.31Å; T593-Q597 WeakPolarHBondContact O-CG 3.14Å; T593-Q597 PolarHBondContact O-N 3.32Å
594	K	94.4	Very high	95.2	Very high	145 Å²	145	55.4 Å²	55.4	63%	0.63	29%	0.292	S	S	*	.	H	α-helix	trans	-56.7	-31	176.1	-166.5	-179.8	-179.9	-177.5	0	112.3	L598 I623	K594-L598 WeakPolarHBondContact O-CB 3.26Å; K594-L598 PolarHBondContact O-N 3Å; K594-I623 HydrophobicContact CD-CG2 4.46Å; K594-I623 HydrophobicContact CG-CG2 3.86Å
595	T	95.3	Very high	95.4	Very high	101 Å²	101	52.2 Å²	52.2	62%	0.62	28%	0.275	S	S	*	.	H	α-helix	trans	-68.7	-42.9	174.6	34.1	0	0	0	0	113	T593 T599	T593-T595 PolarHBondContact O-N 3.13Å; T593-T595 VanDerWaalsContact O-N 3.14Å; T593-T595 PolarHBondContact OG1-OG1 3.19Å; T595-T599 WeakPolarHBondContact O-CB 3.38Å; T595-T599 PolarHBondContact O-N 2.98Å; T595-T599 PolarHBondContact O-OG1 2.98Å
596	E	96.4	Very high	95.6	Very high	37 Å²	37	48.2 Å²	48.2	17%	0.173	26%	0.26	C	S	.	.	H	α-helix	trans	-65.9	-40.6	172.1	-68.8	157.9	-115.6	0	0	111.4	L589 G591 N592 T593 T599 N600	L589-E596 HydrophobicContact CB-CB 3.97Å; L589-E596 HydrophobicContact CB-CG 3.96Å; L589-E596 HydrophobicContact CD1-CB 4.22Å; L589-E596 HydrophobicContact CD1-CG 3.95Å; G591-E596 PolarHBondContact N-OE2 3.42Å; N592-E596 PolarHBondContact N-OE2 3.36Å; T593-E596 WeakPolarHBondContact CB-OE1 3.3Å; T593-E596 VanDerWaalsContact CG2-OE1 3.26Å; T593-E596 WeakPolarHBondContact CG2-OE1 3.45Å; T593-E596 PolarHBondContact N-OE1 3.27Å; T593-E596 PolarHBondContact O-N 3.36Å; T593-E596 VanDerWaalsContact OG1-CD 3.25Å; T593-E596 VanDerWaalsContact OG1-CG 3.25Å; T593-E596 WeakPolarHBondContact OG1-CG 3.41Å; T593-E596 PolarHBondContact OG1-N 2.78Å; T593-E596 PolarHBondContact OG1-OE1 3.12Å; E596-T599 PolarHBondContact O-N 3.19Å; E596-N600 WeakPolarHBondContact O-CB 3.4Å; E596-N600 PolarHBondContact O-N 3.33Å
597	Q	96.4	Very high	95.7	Very high	31 Å²	31	41.1 Å²	41.1	15%	0.145	22%	0.222	C	C	.	.	H	α-helix	trans	-60.3	-46	177.5	-68.7	169.2	2.1	0	0	111.3	K566 G591 T593 N600 A601 I623	K566-Q597 WeakPolarHBondContact O-CB 3.49Å; K566-Q597 WeakPolarHBondContact O-CG 3.47Å; G591-Q597 WeakPolarHBondContact O-CG 3.24Å; G591-Q597 PolarHBondContact O-NE2 3.31Å; T593-Q597 VanDerWaalsContact O-CG 3.31Å; T593-Q597 WeakPolarHBondContact O-CG 3.14Å; T593-Q597 PolarHBondContact O-N 3.32Å; Q597-N600 PolarHBondContact O-N 3.09Å; Q597-A601 VanDerWaalsContact O-CB 3.29Å; Q597-A601 WeakPolarHBondContact O-CB 3.25Å; Q597-A601 PolarHBondContact O-N 2.92Å; Q597-I623 HydrophobicContact CB-CG1 4.31Å; Q597-I623 HydrophobicContact CB-CG2 4.47Å
598	L	96.5	Very high	96	Very high	43 Å²	43	38.5 Å²	38.5	23%	0.225	21%	0.208	C	C	.	.	H	α-helix	trans	-61.5	-45.9	172.8	-178.5	62	0	0	0	112	K594 N600 A601 E602 P619 E620 I623	K594-L598 WeakPolarHBondContact O-CB 3.26Å; K594-L598 PolarHBondContact O-N 3Å; L598-N600 VanDerWaalsContact C-N 3.29Å; L598-N600 PolarHBondContact O-N 3.3Å; L598-A601 PolarHBondContact O-N 3.06Å; L598-A601 VanDerWaalsContact O-N 3.12Å; L598-E602 HydrophobicContact CD1-CG 4.24Å; L598-E602 HydrophobicContact CG-CG 4.42Å; L598-E602 WeakPolarHBondContact O-CG 3.41Å; L598-E602 PolarHBondContact O-N 2.92Å; L598-P619 HydrophobicContact CD1-CB 3.8Å; L598-E620 HydrophobicContact CD1-CG 4.48Å; L598-I623 HydrophobicContact CB-CD1 3.63Å; L598-I623 HydrophobicContact CD1-CD1 3.76Å; L598-I623 HydrophobicContact CG-CD1 4.28Å
599	T	96.5	Very high	96.1	Very high	42 Å²	42	37.8 Å²	37.8	26%	0.258	20%	0.203	S	C	.	.	H	α-helix	trans	-63.2	-35.5	179.8	-56.1	0	0	0	0	111.7	R179 L589 T595 E596 Y603	R179-T599 VanDerWaalsContact NH2-CG2 3.32Å; R179-T599 PolarHBondContact NH2-O 2.98Å; L589-T599 HydrophobicContact CD1-CG2 3.73Å; T595-T599 WeakPolarHBondContact O-CB 3.38Å; T595-T599 PolarHBondContact O-N 2.98Å; T595-T599 PolarHBondContact O-OG1 2.98Å; E596-T599 PolarHBondContact O-N 3.19Å; T599-Y603 PolarHBondContact O-N 3.12Å
600	N	97.4	Very high	96.2	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-73.5	-36.7	173	-74.4	-3.2	0	0	0	112.1	T567 I572 L589 E596 Q597 L598 Y603 A604	T567-N600 WeakPolarHBondContact O-CB 3.17Å; T567-N600 PolarHBondContact O-ND2 2.93Å; I572-N600 HydrophobicContact CD1-CB 4.32Å; L589-N600 WeakPolarHBondContact CB-OD1 3.4Å; L589-N600 PolarHBondContact N-OD1 2.81Å; L589-N600 PolarHBondContact O-ND2 2.93Å; E596-N600 WeakPolarHBondContact O-CB 3.4Å; E596-N600 PolarHBondContact O-N 3.33Å; Q597-N600 PolarHBondContact O-N 3.09Å; L598-N600 VanDerWaalsContact C-N 3.29Å; L598-N600 PolarHBondContact O-N 3.3Å; N600-Y603 PolarHBondContact O-N 3.19Å; N600-A604 VanDerWaalsContact O-CB 3.27Å; N600-A604 WeakPolarHBondContact O-CB 3.43Å; N600-A604 PolarHBondContact O-N 3.14Å
601	A	97.2	Very high	96.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-70.1	-40.8	179.2	0	0	0	0	0	112.4	S568 Q597 L598 Y603 A604 I605 P619 L622	S568-A601 WeakPolarHBondContact OG-CA 3.49Å; S568-A601 WeakPolarHBondContact OG-CB 3.35Å; Q597-A601 VanDerWaalsContact O-CB 3.29Å; Q597-A601 WeakPolarHBondContact O-CB 3.25Å; Q597-A601 PolarHBondContact O-N 2.92Å; L598-A601 PolarHBondContact O-N 3.06Å; L598-A601 VanDerWaalsContact O-N 3.12Å; A601-Y603 VanDerWaalsContact C-N 3.29Å; A601-Y603 PolarHBondContact O-N 2.88Å; A601-A604 PolarHBondContact O-N 2.96Å; A601-I605 WeakPolarHBondContact O-CB 3.49Å; A601-I605 VanDerWaalsContact O-CG1 3.28Å; A601-I605 WeakPolarHBondContact O-CG1 3.42Å; A601-I605 PolarHBondContact O-N 2.94Å; A601-P619 HydrophobicContact CB-CB 3.73Å; A601-P619 WeakPolarHBondContact CB-O 3.43Å; A601-L622 HydrophobicContact CB-CB 4.36Å; A601-L622 HydrophobicContact CB-CD1 4Å
602	E	96.9	Very high	96.3	Very high	34 Å²	34	32.9 Å²	32.9	16%	0.159	18%	0.177	C	C	.	.	H	α-helix	trans	-56	-43.9	171.7	-74.9	178.2	162.7	0	0	110.8	K174 L598 T606 P619	K174-E602 IonicContact NZ-OE1 3.27Å; K174-E602 PolarHBondContact NZ-OE1 3.48Å; K174-E602 IonicContact NZ-OE2 3.13Å; L598-E602 HydrophobicContact CD1-CG 4.24Å; L598-E602 HydrophobicContact CG-CG 4.42Å; L598-E602 WeakPolarHBondContact O-CG 3.41Å; L598-E602 PolarHBondContact O-N 2.92Å; E602-T606 WeakPolarHBondContact O-CB 3.3Å; E602-T606 WeakPolarHBondContact O-CG2 3.42Å; E602-T606 PolarHBondContact O-N 2.9Å; E602-T606 PolarHBondContact O-OG1 2.88Å; E602-P619 HydrophobicContact CB-CG 4.49Å; E602-P619 HydrophobicContact CG-CB 4.05Å; E602-P619 HydrophobicContact CG-CG 3.87Å
603	Y	97.4	Very high	96.4	Very high	3 Å²	3	26.5 Å²	26.5	1%	0.012	14%	0.143	C	C	.	.	H	α-helix	trans	-69	-45.9	175.3	-171.8	-135	0	0	0	112.3	R179 A180 I572 V583 D584 L587 V588 T599 N600 A601 T606 L607	R179-Y603 HydrophobicContact CB-CD2 4.05Å; R179-Y603 HydrophobicContact CB-CE2 3.98Å; A180-Y603 HydrophobicContact CB-CD2 4.23Å; A180-Y603 HydrophobicContact CB-CE2 4.4Å; I572-Y603 HydrophobicContact CD1-CD1 4.5Å; V583-Y603 HydrophobicContact CG1-CE1 4.45Å; D584-Y603 PolarHBondContact N-OH 2.9Å; D584-Y603 PolarHBondContact O-OH 2.77Å; L587-Y603 HydrophobicContact CB-CE1 4.31Å; V588-Y603 HydrophobicContact CG2-CD1 4.15Å; V588-Y603 HydrophobicContact CG2-CE1 3.75Å; T599-Y603 PolarHBondContact O-N 3.12Å; N600-Y603 PolarHBondContact O-N 3.19Å; A601-Y603 VanDerWaalsContact C-N 3.29Å; A601-Y603 PolarHBondContact O-N 2.88Å; Y603-T606 PolarHBondContact O-N 3.36Å; Y603-T606 PolarHBondContact O-OG1 3.45Å; Y603-T606 VanDerWaalsContact O-OG1 3.1Å; Y603-L607 HydrophobicContact CD1-CD1 3.93Å; Y603-L607 HydrophobicContact CD2-CD1 4.03Å; Y603-L607 HydrophobicContact CD2-CD2 4.49Å; Y603-L607 HydrophobicContact CD2-CG 4Å; Y603-L607 HydrophobicContact CE1-CD1 3.73Å; Y603-L607 HydrophobicContact CE2-CD1 3.81Å; Y603-L607 HydrophobicContact CE2-CD2 4.01Å; Y603-L607 HydrophobicContact CE2-CG 3.92Å; Y603-L607 HydrophobicContact CG-CD1 4.09Å; Y603-L607 HydrophobicContact CG-CG 4.4Å; Y603-L607 WeakPolarHBondContact O-CB 3.26Å; Y603-L607 VanDerWaalsContact O-CG 3.29Å; Y603-L607 WeakPolarHBondContact O-CG 3.47Å; Y603-L607 PolarHBondContact O-N 3.21Å
604	A	97.4	Very high	96.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.6	-45.9	-177.3	0	0	0	0	0	113	V571 I572 I575 N600 A601 T606 A608	V571-A604 HydrophobicContact CB-CB 4.28Å; V571-A604 HydrophobicContact CG1-CB 4.05Å; I572-A604 HydrophobicContact CD1-CB 4.31Å; I572-A604 HydrophobicContact CG1-CB 3.74Å; I575-A604 WeakPolarHBondContact CD1-O 3.34Å; N600-A604 VanDerWaalsContact O-CB 3.27Å; N600-A604 WeakPolarHBondContact O-CB 3.43Å; N600-A604 PolarHBondContact O-N 3.14Å; A601-A604 PolarHBondContact O-N 2.96Å; A604-T606 VanDerWaalsContact C-N 3.29Å; A604-T606 PolarHBondContact O-N 3.04Å; A604-A608 WeakPolarHBondContact O-CB 3.45Å; A604-A608 PolarHBondContact O-N 3.28Å
605	I	97.3	Very high	96.2	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.01	11%	0.107	C	C	.	.	H	α-helix	trans	-63	-37.8	177.7	-65.6	-68.7	0	0	0	110.8	A601 A608 R609 V615 A617 P619 L622 I633	A601-I605 WeakPolarHBondContact O-CB 3.49Å; A601-I605 VanDerWaalsContact O-CG1 3.28Å; A601-I605 WeakPolarHBondContact O-CG1 3.42Å; A601-I605 PolarHBondContact O-N 2.94Å; I605-A608 WeakPolarHBondContact O-CB 3.3Å; I605-A608 PolarHBondContact O-N 2.97Å; I605-R609 WeakPolarHBondContact O-CG 3.31Å; I605-R609 PolarHBondContact O-N 2.89Å; I605-R609 VanDerWaalsContact O-N 3.09Å; I605-V615 HydrophobicContact CD1-CG1 3.84Å; I605-V615 HydrophobicContact CG2-CG1 4.38Å; I605-A617 HydrophobicContact CD1-CB 4.48Å; I605-P619 HydrophobicContact CG1-CG 4.44Å; I605-L622 HydrophobicContact CD1-CD1 4.03Å; I605-L622 HydrophobicContact CG1-CD1 4.19Å; I605-I633 HydrophobicContact CD1-CD1 3.69Å; I605-I633 HydrophobicContact CD1-CG1 4.24Å
606	T	97.4	Very high	96	Very high	4 Å²	4	14.8 Å²	14.8	3%	0.025	8%	0.081	C	C	.	.	H	α-helix	trans	-80.9	-35.5	-176.6	56	0	0	0	0	112.1	D177 A180 L198 E602 Y603 A604 A608 R609 R610	D177-T606 HydrophobicContact CB-CG2 4.37Å; D177-T606 WeakPolarHBondContact CB-OG1 3.43Å; A180-T606 WeakPolarHBondContact CB-OG1 3.28Å; L198-T606 VanDerWaalsContact CD1-O 3.27Å; L198-T606 WeakPolarHBondContact CD1-O 3.13Å; E602-T606 WeakPolarHBondContact O-CB 3.3Å; E602-T606 WeakPolarHBondContact O-CG2 3.42Å; E602-T606 PolarHBondContact O-N 2.9Å; E602-T606 PolarHBondContact O-OG1 2.88Å; Y603-T606 PolarHBondContact O-N 3.36Å; Y603-T606 PolarHBondContact O-OG1 3.45Å; Y603-T606 VanDerWaalsContact O-OG1 3.1Å; A604-T606 VanDerWaalsContact C-N 3.29Å; A604-T606 PolarHBondContact O-N 3.04Å; T606-A608 VanDerWaalsContact C-N 3.35Å; T606-R609 PolarHBondContact O-N 2.8Å; T606-R610 PolarHBondContact O-N 3.33Å
607	L	97.4	Very high	95.9	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61.4	-40.3	166	-70.8	178.6	0	0	0	112.3	A180 I575 T582 V583 Y603 R609 R610 I611	A180-L607 HydrophobicContact CB-CD2 3.97Å; A180-L607 HydrophobicContact CB-CG 4.3Å; I575-L607 HydrophobicContact CD1-CB 4.02Å; I575-L607 HydrophobicContact CG2-CB 4.24Å; T582-L607 HydrophobicContact CG2-CD2 4.18Å; V583-L607 HydrophobicContact CG2-CD1 4.05Å; Y603-L607 HydrophobicContact CD1-CD1 3.93Å; Y603-L607 HydrophobicContact CD2-CD1 4.03Å; Y603-L607 HydrophobicContact CD2-CD2 4.49Å; Y603-L607 HydrophobicContact CD2-CG 4Å; Y603-L607 HydrophobicContact CE1-CD1 3.73Å; Y603-L607 HydrophobicContact CE2-CD1 3.81Å; Y603-L607 HydrophobicContact CE2-CD2 4.01Å; Y603-L607 HydrophobicContact CE2-CG 3.92Å; Y603-L607 HydrophobicContact CG-CD1 4.09Å; Y603-L607 HydrophobicContact CG-CG 4.4Å; Y603-L607 WeakPolarHBondContact O-CB 3.26Å; Y603-L607 VanDerWaalsContact O-CG 3.29Å; Y603-L607 WeakPolarHBondContact O-CG 3.47Å; Y603-L607 PolarHBondContact O-N 3.21Å; L607-R609 VanDerWaalsContact C-N 3.34Å; L607-R609 PolarHBondContact O-N 2.9Å; L607-R610 VanDerWaalsContact CD2-NH1 3.28Å; L607-R610 WeakPolarHBondContact O-CB 3.31Å; L607-R610 PolarHBondContact O-N 2.95Å; L607-R610 VanDerWaalsContact O-N 3.14Å; L607-I611 PolarHBondContact O-N 2.95Å
608	A	97.6	Very high	95.7	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-58.5	-46.9	174.2	0	0	0	0	0	111.1	I575 A604 I605 T606 R610 I611 G612 A613 V615 L637	I575-A608 HydrophobicContact CD1-CB 3.99Å; A604-A608 WeakPolarHBondContact O-CB 3.45Å; A604-A608 PolarHBondContact O-N 3.28Å; I605-A608 WeakPolarHBondContact O-CB 3.3Å; I605-A608 PolarHBondContact O-N 2.97Å; T606-A608 VanDerWaalsContact C-N 3.35Å; A608-R610 VanDerWaalsContact C-N 3.34Å; A608-R610 PolarHBondContact O-N 3.23Å; A608-I611 VanDerWaalsContact O-CG1 3.28Å; A608-I611 WeakPolarHBondContact O-CG1 3.39Å; A608-I611 PolarHBondContact O-N 2.89Å; A608-G612 PolarHBondContact O-N 3.31Å; A608-A613 HydrophobicContact CB-CB 4.18Å; A608-A613 VanDerWaalsContact O-CB 3.25Å; A608-A613 WeakPolarHBondContact O-CB 3.39Å; A608-A613 PolarHBondContact O-N 3.37Å; A608-V615 HydrophobicContact CB-CG2 4.18Å; A608-L637 HydrophobicContact CB-CD2 4.01Å
609	R	97.5	Very high	95.6	Very high	12 Å²	12	12.9 Å²	12.9	5%	0.045	7%	0.073	C	C	.	.	H	α-helix	trans	-60.8	-38.9	174.1	-71.1	176.7	-173.6	147.8	7.7	112.2	T175 L198 N201 I605 T606 L607 G612 V615	T175-R609 PolarHBondContact O-NH1 2.74Å; L198-R609 HydrophobicContact CD1-CB 3.91Å; N201-R609 HydrophobicContact CB-CB 3.84Å; N201-R609 HydrophobicContact CB-CG 4.07Å; N201-R609 PolarHBondContact ND2-O 2.94Å; I605-R609 WeakPolarHBondContact O-CG 3.31Å; I605-R609 PolarHBondContact O-N 2.89Å; I605-R609 VanDerWaalsContact O-N 3.09Å; T606-R609 PolarHBondContact O-N 2.8Å; L607-R609 VanDerWaalsContact C-N 3.34Å; L607-R609 PolarHBondContact O-N 2.9Å; R609-G612 PolarHBondContact O-N 2.99Å; R609-V615 PolarHBondContact NE-O 3.49Å; R609-V615 PolarHBondContact NH2-O 2.91Å
610	R	96.7	Very high	95.5	Very high	13 Å²	13	13.7 Å²	13.7	5%	0.049	7%	0.074	C	C	.	.	H	α-helix	trans	-63.6	-41.6	176.8	-168.8	175.4	104.1	-146	-5.2	113	A180 E194 L198 T582 T606 L607 A608 G612	A180-R610 WeakPolarHBondContact O-CD 3.45Å; A180-R610 PolarHBondContact O-NH1 3.26Å; E194-R610 HydrophobicContact CB-CG 3.89Å; E194-R610 HydrophobicContact CG-CG 4.44Å; E194-R610 IonicContact OE2-CZ 3.09Å; E194-R610 IonicContact OE2-NE 2.98Å; E194-R610 PolarHBondContact OE2-NE 3.27Å; E194-R610 IonicContact OE2-NH2 3.24Å; L198-R610 HydrophobicContact CB-CB 4.05Å; L198-R610 HydrophobicContact CB-CG 4.19Å; L198-R610 HydrophobicContact CD1-CB 4.34Å; L198-R610 HydrophobicContact CD2-CB 4.42Å; T582-R610 PolarHBondContact O-NH2 2.99Å; T606-R610 PolarHBondContact O-N 3.33Å; L607-R610 VanDerWaalsContact CD2-NH1 3.28Å; L607-R610 WeakPolarHBondContact O-CB 3.31Å; L607-R610 PolarHBondContact O-N 2.95Å; L607-R610 VanDerWaalsContact O-N 3.14Å; A608-R610 VanDerWaalsContact C-N 3.34Å; A608-R610 PolarHBondContact O-N 3.23Å; R610-G612 PolarHBondContact O-N 3.21Å
611	I	95.4	Very high	95.4	Very high	5 Å²	5	14 Å²	14	3%	0.026	8%	0.076	C	C	.	.	H	α-helix	trans	-73	-15.5	178.4	66.8	161.9	0	0	0	113.8	I575 I578 R579 T582 L607 A608 L637 V640	I575-I611 HydrophobicContact CG1-CD1 4.33Å; I575-I611 HydrophobicContact CG2-CD1 4.27Å; I575-I611 HydrophobicContact CG2-CG2 4.12Å; I578-I611 HydrophobicContact CB-CD1 4.36Å; I578-I611 HydrophobicContact CD1-CD1 4.5Å; I578-I611 HydrophobicContact CG2-CD1 3.98Å; R579-I611 HydrophobicContact CB-CG2 4.29Å; R579-I611 PolarHBondContact NH2-O 2.79Å; T582-I611 HydrophobicContact CG2-CG2 3.68Å; L607-I611 PolarHBondContact O-N 2.95Å; A608-I611 VanDerWaalsContact O-CG1 3.28Å; A608-I611 WeakPolarHBondContact O-CG1 3.39Å; A608-I611 PolarHBondContact O-N 2.89Å; I611-L637 HydrophobicContact CD1-CD2 3.84Å; I611-V640 HydrophobicContact CD1-CG1 3.95Å; I611-V640 HydrophobicContact CG1-CG1 4.18Å
612	G	93.7	Very high	95.2	Very high	23 Å²	23	14 Å²	14	24%	0.237	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	125.7	0.2	175.6	0	0	0	0	0	115.1	N201 A608 R609 R610	N201-G612 VanDerWaalsContact ND2-C 3.32Å; N201-G612 WeakPolarHBondContact ND2-CA 3.37Å; N201-G612 PolarHBondContact ND2-O 3.01Å; A608-G612 PolarHBondContact O-N 3.31Å; R609-G612 PolarHBondContact O-N 2.99Å; R610-G612 PolarHBondContact O-N 3.21Å
613	A	94.4	Very high	95.1	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.071	C	C	.	.			trans	-78.1	127.4	-172.5	0	0	0	0	0	111.6	A608 V615 C636 L637 V640	A608-A613 HydrophobicContact CB-CB 4.18Å; A608-A613 VanDerWaalsContact O-CB 3.25Å; A608-A613 WeakPolarHBondContact O-CB 3.39Å; A608-A613 PolarHBondContact O-N 3.37Å; A613-V615 HydrophobicContact CB-CG2 3.86Å; A613-V615 PolarHBondContact O-N 2.94Å; A613-C636 HydrophobicContact CB-CB 4.1Å; A613-L637 HydrophobicContact CB-CD2 4.16Å; A613-V640 HydrophobicContact CB-CG2 3.95Å
614	T	91.9	Very high	95	Very high	42 Å²	42	16.8 Å²	16.8	26%	0.258	9%	0.089	S	C	.	.			trans	-81.2	66.1	-177.3	54.7	0	0	0	0	111.4	C636	T614-C636 PolarHBondContact O-SG 3.37Å; T614-C636 VanDerWaalsContact O-SG 3.41Å
615	V	93.5	Very high	94.8	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.012	10%	0.097	C	C	.	.			trans	-93.7	111.3	-172.2	179.8	0	0	0	0	111.8	I605 A608 R609 A613 A617 I633 C636	I605-V615 HydrophobicContact CD1-CG1 3.84Å; I605-V615 HydrophobicContact CG2-CG1 4.38Å; A608-V615 HydrophobicContact CB-CG2 4.18Å; R609-V615 PolarHBondContact NE-O 3.49Å; R609-V615 PolarHBondContact NH2-O 2.91Å; A613-V615 HydrophobicContact CB-CG2 3.86Å; A613-V615 PolarHBondContact O-N 2.94Å; V615-A617 HydrophobicContact CG1-CB 3.92Å; V615-I633 HydrophobicContact CG1-CG1 3.92Å; V615-C636 HydrophobicContact CG2-CB 3.98Å
616	Y	92.2	Very high	94.6	Very high	18 Å²	18	22.9 Å²	22.9	7%	0.071	12%	0.117	C	C	.	.			trans	-85.9	-19.5	171.6	-55.9	-84	0	0	0	113.6	R204 W402 S405 M499	R204-Y616 WeakPolarHBondContact CD-OH 3.5Å; R204-Y616 HydrophobicContact CG-CE1 4.13Å; W402-Y616 HydrophobicContact CB-CD1 4.15Å; W402-Y616 HydrophobicContact CB-CD2 4.49Å; W402-Y616 HydrophobicContact CB-CE1 4.17Å; W402-Y616 HydrophobicContact CB-CE2 4.49Å; W402-Y616 HydrophobicContact CB-CG 4.34Å; W402-Y616 AromaticContact CD1-CE2 3.68Å; W402-Y616 AromaticContact CD1-CZ 3.68Å; W402-Y616 HydrophobicContact CG-CE2 4.33Å; S405-Y616 PolarHBondContact OG-OH 3.43Å; S405-Y616 VanDerWaalsContact OG-OH 3.11Å; M499-Y616 HydrophobicContact CE-CD2 3.69Å; M499-Y616 HydrophobicContact CE-CG 4.05Å
617	A	92.8	Very high	94.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.135	C	C	.	.			trans	-56.3	145.3	178.5	0	0	0	0	0	112.1	I605 V615 M629 I633	I605-A617 HydrophobicContact CD1-CB 4.48Å; V615-A617 HydrophobicContact CG1-CB 3.92Å; A617-M629 HydrophobicContact CB-CB 4.18Å; A617-M629 HydrophobicContact CB-CE 3.91Å; A617-I633 HydrophobicContact CB-CD1 3.88Å; A617-I633 HydrophobicContact CB-CG1 3.73Å
618	M	92.7	Very high	93.9	Very high	57 Å²	57	29.8 Å²	29.8	28%	0.281	15%	0.147	S	C	.	.			trans	-93.2	153.8	179.6	-72	-66.1	-62.5	0	0	111	R394 E620 D621	R394-M618 HydrophobicContact CG-CB 4.42Å; R394-M618 HydrophobicContact CG-CG 4.07Å; M618-E620 WeakPolarHBondContact CB-OE2 3.29Å; M618-E620 PolarHBondContact O-N 3.25Å; M618-E620 VanDerWaalsContact O-N 3.17Å; M618-D621 PolarHBondContact N-OD2 2.9Å; M618-D621 WeakPolarHBondContact O-CB 3.28Å; M618-D621 PolarHBondContact O-N 3.48Å
619	P	94.8	Very high	93.6	Very high	13 Å²	13	30.5 Å²	30.5	8%	0.084	15%	0.151	C	C	.	.	H	α-helix	trans	-52.1	-36.8	176	-29.8	38.6	0	0	0	113.8	L598 A601 E602 I605 D621 L622	L598-P619 HydrophobicContact CD1-CB 3.8Å; A601-P619 HydrophobicContact CB-CB 3.73Å; A601-P619 WeakPolarHBondContact CB-O 3.43Å; E602-P619 HydrophobicContact CB-CG 4.49Å; E602-P619 HydrophobicContact CG-CB 4.05Å; E602-P619 HydrophobicContact CG-CG 3.87Å; I605-P619 HydrophobicContact CG1-CG 4.44Å; P619-D621 VanDerWaalsContact C-N 3.26Å; P619-D621 PolarHBondContact O-N 3.17Å; P619-L622 PolarHBondContact O-N 2.7Å
620	E	94.7	Very high	93.4	Very high	60 Å²	60	30 Å²	30	28%	0.28	15%	0.149	S	C	.	.	H	α-helix	trans	-64.4	-26.6	178.9	-62.6	82.3	177.7	0	0	113.4	L598 M618 L622 I623 E624	L598-E620 HydrophobicContact CD1-CG 4.48Å; M618-E620 WeakPolarHBondContact CB-OE2 3.29Å; M618-E620 PolarHBondContact O-N 3.25Å; M618-E620 VanDerWaalsContact O-N 3.17Å; E620-L622 VanDerWaalsContact C-N 3.26Å; E620-L622 PolarHBondContact O-N 3.04Å; E620-I623 PolarHBondContact O-N 3.02Å; E620-E624 WeakPolarHBondContact O-CB 3.4Å; E620-E624 WeakPolarHBondContact O-CG 3.35Å; E620-E624 PolarHBondContact O-N 3.42Å
621	D	94	Very high	93.2	Very high	7 Å²	7	29.3 Å²	29.3	4%	0.037	15%	0.146	C	C	.	.	H	α-helix	trans	-65.2	-30.3	179	-65.6	-41.2	0	0	0	112.5	R394 M618 P619 L625 K626 M629	R394-D621 IonicContact CZ-OD1 2.82Å; R394-D621 IonicContact NE-OD1 2.68Å; R394-D621 PolarHBondContact NE-OD1 2.95Å; R394-D621 IonicContact NH2-OD1 2.7Å; R394-D621 PolarHBondContact NH2-OD1 3.08Å; M618-D621 PolarHBondContact N-OD2 2.9Å; M618-D621 WeakPolarHBondContact O-CB 3.28Å; M618-D621 PolarHBondContact O-N 3.48Å; P619-D621 VanDerWaalsContact C-N 3.26Å; P619-D621 PolarHBondContact O-N 3.17Å; D621-L625 PolarHBondContact O-N 3.34Å; D621-K626 HydrophobicContact CB-CB 4.05Å; D621-K626 HydrophobicContact CB-CG 4.31Å; D621-K626 PolarHBondContact O-N 3.38Å; D621-M629 HydrophobicContact CB-CB 3.9Å; D621-M629 HydrophobicContact CB-CG 4.4Å
622	L	94.5	Very high	93	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-72	-43.6	173.8	-74.4	161	0	0	0	111.5	V571 A601 I605 P619 E620 L625 I630 I633	V571-L622 HydrophobicContact CG2-CD2 3.97Å; A601-L622 HydrophobicContact CB-CB 4.36Å; A601-L622 HydrophobicContact CB-CD1 4Å; I605-L622 HydrophobicContact CD1-CD1 4.03Å; I605-L622 HydrophobicContact CG1-CD1 4.19Å; P619-L622 PolarHBondContact O-N 2.7Å; E620-L622 VanDerWaalsContact C-N 3.26Å; E620-L622 PolarHBondContact O-N 3.04Å; L622-L625 PolarHBondContact O-N 3.28Å; L622-I630 HydrophobicContact CD2-CD1 4.24Å; L622-I630 HydrophobicContact CD2-CG1 4.05Å; L622-I630 HydrophobicContact CD2-CG2 4.46Å; L622-I633 HydrophobicContact CD1-CD1 4.1Å; L622-I633 HydrophobicContact CD2-CD1 3.89Å; L622-I633 HydrophobicContact CG-CD1 3.91Å
623	I	94.3	Very high	93	Very high	11 Å²	11	28.2 Å²	28.2	6%	0.056	14%	0.135	C	C	.	.	H	α-helix	trans	-67.5	-39.6	-178.4	-48.9	170.8	0	0	0	111.3	K566 K594 Q597 L598 E620 L625	K566-I623 WeakPolarHBondContact CD-O 3.31Å; K566-I623 WeakPolarHBondContact CE-O 3.18Å; K566-I623 PolarHBondContact NZ-O 3.04Å; K594-I623 HydrophobicContact CD-CG2 4.46Å; K594-I623 HydrophobicContact CG-CG2 3.86Å; Q597-I623 HydrophobicContact CB-CG1 4.31Å; Q597-I623 HydrophobicContact CB-CG2 4.47Å; L598-I623 HydrophobicContact CB-CD1 3.63Å; L598-I623 HydrophobicContact CD1-CD1 3.76Å; L598-I623 HydrophobicContact CG-CD1 4.28Å; E620-I623 PolarHBondContact O-N 3.02Å; I623-L625 VanDerWaalsContact C-N 3.31Å
624	E	94.1	Very high	93	Very high	84 Å²	84	28.2 Å²	28.2	39%	0.393	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-4	179.7	-69.5	173.5	-152.1	0	0	113.5	R394 E620 K626	R394-E624 IonicContact CZ-OE1 3.27Å; R394-E624 IonicContact CZ-OE2 3.83Å; R394-E624 IonicContact NH1-OE1 2.73Å; R394-E624 PolarHBondContact NH1-OE1 3.31Å; R394-E624 IonicContact NH1-OE2 3.54Å; R394-E624 PolarHBondContact NH1-OE2 3.13Å; R394-E624 VanDerWaalsContact NH2-CD 3.29Å; R394-E624 IonicContact NH2-OE1 2.65Å; R394-E624 IonicContact NH2-OE2 3.64Å; R394-E624 PolarHBondContact NH2-OE2 3.33Å; E620-E624 WeakPolarHBondContact O-CB 3.4Å; E620-E624 WeakPolarHBondContact O-CG 3.35Å; E620-E624 PolarHBondContact O-N 3.42Å; E624-K626 HydrophobicContact CB-CD 4.5Å; E624-K626 HydrophobicContact CB-CG 4.1Å; E624-K626 PolarHBondContact O-N 2.65Å; E624-K626 WeakPolarHBondContact OE2-CE 3.48Å; E624-K626 IonicContact OE2-NZ 3.65Å
625	L	93.5	Very high	93.1	Very high	32 Å²	32	26.2 Å²	26.2	17%	0.168	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	52	49.1	-173.1	-62.8	173.4	0	0	0	113.3	D562 L565 K566 D621 L622 I623 H627 I630	D562-L625 WeakPolarHBondContact O-CD2 3.42Å; L565-L625 HydrophobicContact CB-CD2 3.81Å; K566-L625 HydrophobicContact CD-CD1 4.31Å; K566-L625 HydrophobicContact CD-CG 4.32Å; K566-L625 VanDerWaalsContact CE-CD1 3.4Å; K566-L625 HydrophobicContact CG-CD1 4.07Å; K566-L625 HydrophobicContact CG-CD2 3.82Å; K566-L625 HydrophobicContact CG-CG 3.75Å; D621-L625 PolarHBondContact O-N 3.34Å; L622-L625 PolarHBondContact O-N 3.28Å; I623-L625 VanDerWaalsContact C-N 3.31Å; L625-H627 PolarHBondContact O-N 3.31Å; L625-I630 HydrophobicContact CD2-CD1 4.05Å
626	K	92.8	Very high	93	Very high	98 Å²	98	26.7 Å²	26.7	43%	0.426	13%	0.126	S	C	.	.			trans	-71.9	75.8	170.6	-60.6	-66.3	-177.3	174.1	0	109.1	D621 E624 K628 M629 I630	D621-K626 HydrophobicContact CB-CB 4.05Å; D621-K626 HydrophobicContact CB-CG 4.31Å; D621-K626 PolarHBondContact O-N 3.38Å; E624-K626 HydrophobicContact CB-CD 4.5Å; E624-K626 HydrophobicContact CB-CG 4.1Å; E624-K626 PolarHBondContact O-N 2.65Å; E624-K626 WeakPolarHBondContact OE2-CE 3.48Å; E624-K626 IonicContact OE2-NZ 3.65Å; K626-K628 CarbonylContact O-C 3.59Å; K626-K628 PolarHBondContact O-N 3.12Å; K626-M629 HydrophobicContact CB-CB 4.31Å; K626-M629 HydrophobicContact CB-CG 4.36Å; K626-M629 WeakPolarHBondContact O-CA 3.14Å; K626-M629 PolarHBondContact O-N 2.59Å; K626-I630 PolarHBondContact O-N 2.83Å
627	H	90.8	Very high	93.2	Very high	87 Å²	87	25.8 Å²	25.8	40%	0.403	12%	0.123	S	C	.	.	H	α-helix	trans	-47.8	-36.9	-172.3	69	95.6	0	0	0	113.9	F560 T561 L625 I630 M631	F560-H627 HydrophobicContact CB-CB 3.91Å; F560-H627 VanDerWaalsContact O-CB 3.29Å; F560-H627 WeakPolarHBondContact O-CB 3.38Å; T561-H627 HydrophobicContact CG2-CB 3.85Å; L625-H627 PolarHBondContact O-N 3.31Å; H627-I630 PolarHBondContact O-N 3.41Å; H627-M631 WeakPolarHBondContact O-CB 3.49Å; H627-M631 PolarHBondContact O-N 2.76Å
628	K	89.6	Confident	93.2	Very high	62 Å²	62	26.6 Å²	26.6	27%	0.27	13%	0.127	S	C	.	.	H	α-helix	trans	-47.8	-58.1	167.9	-74.5	-171.1	172.5	-171.8	0	112.9	E395 W496 K626 M631	E395-K628 IonicContact OE1-NZ 3.41Å; W496-K628 HydrophobicContact CD2-CD 3.67Å; W496-K628 HydrophobicContact CD2-CG 4.19Å; W496-K628 HydrophobicContact CE3-CB 4.22Å; W496-K628 HydrophobicContact CE3-CD 3.98Å; W496-K628 HydrophobicContact CE3-CG 4.4Å; W496-K628 HydrophobicContact CG-CD 4.17Å; W496-K628 HydrophobicContact CH2-CB 3.46Å; W496-K628 VanDerWaalsContact CH2-CB 3.46Å; W496-K628 HydrophobicContact CH2-CD 4.34Å; W496-K628 HydrophobicContact CH2-CG 3.85Å; W496-K628 VanDerWaalsContact CH2-O 3.31Å; W496-K628 WeakPolarHBondContact CH2-O 3.43Å; W496-K628 HydrophobicContact CZ2-CB 3.73Å; W496-K628 HydrophobicContact CZ2-CD 4Å; W496-K628 HydrophobicContact CZ2-CG 3.53Å; W496-K628 HydrophobicContact CZ3-CB 3.71Å; W496-K628 HydrophobicContact CZ3-CD 4.31Å; W496-K628 HydrophobicContact CZ3-CG 4.26Å; K626-K628 CarbonylContact O-C 3.59Å; K626-K628 PolarHBondContact O-N 3.12Å; K628-M631 WeakPolarHBondContact O-CB 3.39Å
629	M	91	Very high	93.1	Very high	15 Å²	15	24.7 Å²	24.7	7%	0.074	12%	0.12	C	C	.	.	H	α-helix	trans	-71	-38.2	-178.6	-63.3	-49.4	-58.6	0	0	111.5	T398 M499 A617 D621 K626 M631 T632 I633	T398-M629 HydrophobicContact CG2-CE 3.69Å; M499-M629 HydrophobicContact CE-CE 4.45Å; A617-M629 HydrophobicContact CB-CB 4.18Å; A617-M629 HydrophobicContact CB-CE 3.91Å; D621-M629 HydrophobicContact CB-CB 3.9Å; D621-M629 HydrophobicContact CB-CG 4.4Å; K626-M629 HydrophobicContact CB-CB 4.31Å; K626-M629 HydrophobicContact CB-CG 4.36Å; K626-M629 WeakPolarHBondContact O-CA 3.14Å; K626-M629 PolarHBondContact O-N 2.59Å; M629-M631 VanDerWaalsContact C-N 3.31Å; M629-M631 PolarHBondContact O-N 2.95Å; M629-T632 PolarHBondContact O-N 3.12Å; M629-T632 PolarHBondContact O-OG1 2.97Å; M629-I633 PolarHBondContact O-N 3.46Å
630	I	94.2	Very high	92.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.4	-41.8	177	-62	179	0	0	0	111.1	F560 L565 L622 L625 K626 H627 T632 I633 F634	F560-I630 HydrophobicContact CB-CB 4.4Å; F560-I630 HydrophobicContact CB-CG2 4.24Å; F560-I630 HydrophobicContact CD1-CG2 3.86Å; F560-I630 HydrophobicContact CG-CG2 4.38Å; L565-I630 HydrophobicContact CD1-CG2 4.28Å; L622-I630 HydrophobicContact CD2-CD1 4.24Å; L622-I630 HydrophobicContact CD2-CG1 4.05Å; L622-I630 HydrophobicContact CD2-CG2 4.46Å; L625-I630 HydrophobicContact CD2-CD1 4.05Å; K626-I630 PolarHBondContact O-N 2.83Å; H627-I630 PolarHBondContact O-N 3.41Å; I630-T632 VanDerWaalsContact C-N 3.27Å; I630-T632 PolarHBondContact O-N 3.28Å; I630-I633 WeakPolarHBondContact O-CB 3.39Å; I630-I633 PolarHBondContact O-N 2.79Å; I630-F634 HydrophobicContact CG2-CD2 3.78Å; I630-F634 HydrophobicContact CG2-CE2 3.66Å; I630-F634 WeakPolarHBondContact O-CD2 3.22Å; I630-F634 PolarHBondContact O-N 3.41Å; I630-F634 VanDerWaalsContact O-N 3.16Å
631	M	91.8	Very high	92.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-54.1	-43.5	173.3	-177.5	-75.6	-60.5	0	0	111.5	W496 R500 E534 I537 F560 H627 K628 M629 I633 F634 A635	W496-M631 HydrophobicContact CH2-CE 3.88Å; R500-M631 HydrophobicContact CG-CE 3.92Å; E534-M631 HydrophobicContact CG-CG 3.91Å; I537-M631 HydrophobicContact CD1-CG 4.45Å; I537-M631 HydrophobicContact CD1-SD 4.12Å; F560-M631 HydrophobicContact CD2-CB 3.62Å; F560-M631 HydrophobicContact CD2-CG 3.93Å; F560-M631 HydrophobicContact CE2-CB 3.72Å; F560-M631 HydrophobicContact CE2-CG 3.58Å; F560-M631 HydrophobicContact CG-CB 4.23Å; F560-M631 HydrophobicContact CZ-CB 4.4Å; F560-M631 HydrophobicContact CZ-CG 4.35Å; H627-M631 WeakPolarHBondContact O-CB 3.49Å; H627-M631 PolarHBondContact O-N 2.76Å; K628-M631 WeakPolarHBondContact O-CB 3.39Å; M629-M631 VanDerWaalsContact C-N 3.31Å; M629-M631 PolarHBondContact O-N 2.95Å; M631-I633 VanDerWaalsContact C-N 3.33Å; M631-I633 PolarHBondContact O-N 3.33Å; M631-F634 PolarHBondContact O-N 2.87Å; M631-A635 WeakPolarHBondContact O-CB 3.39Å; M631-A635 PolarHBondContact O-N 3.06Å; M631-A635 HydrophobicContact SD-CB 4.27Å
632	T	91.5	Very high	92.5	Very high	4 Å²	4	22.8 Å²	22.8	3%	0.025	11%	0.111	C	C	.	.	H	α-helix	trans	-66	-31.8	177.7	72.2	0	0	0	0	113.3	W496 T503 M629 I630 C636	W496-T632 HydrophobicContact CZ3-CG2 4.42Å; T503-T632 HydrophobicContact CG2-CG2 4.32Å; M629-T632 PolarHBondContact O-N 3.12Å; M629-T632 PolarHBondContact O-OG1 2.97Å; I630-T632 VanDerWaalsContact C-N 3.27Å; I630-T632 PolarHBondContact O-N 3.28Å; T632-C636 WeakPolarHBondContact O-CB 3.5Å; T632-C636 PolarHBondContact O-N 2.91Å; T632-C636 PolarHBondContact O-SG 3.44Å; T632-C636 VanDerWaalsContact O-SG 3.32Å
633	I	94.5	Very high	92	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.1	-53.3	173.2	-57.8	170.5	0	0	0	109.7	V571 I605 V615 A617 L622 M629 I630 M631 A635 C636 L637	V571-I633 HydrophobicContact CG1-CG2 4.1Å; I605-I633 HydrophobicContact CD1-CD1 3.69Å; I605-I633 HydrophobicContact CD1-CG1 4.24Å; V615-I633 HydrophobicContact CG1-CG1 3.92Å; A617-I633 HydrophobicContact CB-CD1 3.88Å; A617-I633 HydrophobicContact CB-CG1 3.73Å; L622-I633 HydrophobicContact CD1-CD1 4.1Å; L622-I633 HydrophobicContact CD2-CD1 3.89Å; L622-I633 HydrophobicContact CG-CD1 3.91Å; M629-I633 PolarHBondContact O-N 3.46Å; I630-I633 WeakPolarHBondContact O-CB 3.39Å; I630-I633 PolarHBondContact O-N 2.79Å; M631-I633 VanDerWaalsContact C-N 3.33Å; M631-I633 PolarHBondContact O-N 3.33Å; I633-A635 VanDerWaalsContact C-N 3.32Å; I633-A635 PolarHBondContact O-N 3.44Å; I633-C636 PolarHBondContact O-N 3.25Å; I633-L637 HydrophobicContact CG2-CD1 4.08Å; I633-L637 WeakPolarHBondContact O-CG 3.38Å; I633-L637 PolarHBondContact O-N 2.91Å
634	F	94.7	Very high	91.5	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.8	-34.5	-179.1	-76.7	-82.8	0	0	0	112.5	I537 A541 I554 F560 L565 V571 L574 I630 M631 L637 M638	I537-F634 HydrophobicContact CG2-CB 3.83Å; A541-F634 HydrophobicContact CB-CD1 4Å; A541-F634 HydrophobicContact CB-CE1 4.33Å; I554-F634 HydrophobicContact CD1-CD1 4.17Å; I554-F634 HydrophobicContact CD1-CE1 3.57Å; I554-F634 HydrophobicContact CD1-CE2 4.23Å; I554-F634 HydrophobicContact CD1-CZ 3.61Å; F560-F634 AromaticContact CD1-CD2 3.86Å; F560-F634 HydrophobicContact CD1-CD2 3.86Å; F560-F634 HydrophobicContact CD1-CE2 4.31Å; F560-F634 HydrophobicContact CE1-CB 3.81Å; F560-F634 AromaticContact CE1-CD2 3.45Å; F560-F634 HydrophobicContact CE1-CD2 3.45Å; F560-F634 VanDerWaalsContact CE1-CD2 3.45Å; F560-F634 HydrophobicContact CE1-CE2 4.19Å; F560-F634 AromaticContact CE1-CG 3.71Å; F560-F634 HydrophobicContact CE1-CG 3.71Å; F560-F634 HydrophobicContact CZ-CB 4.08Å; F560-F634 HydrophobicContact CZ-CD2 4.48Å; F560-F634 HydrophobicContact CZ-CG 4.45Å; L565-F634 HydrophobicContact CD2-CE2 3.96Å; L565-F634 HydrophobicContact CD2-CZ 3.9Å; V571-F634 HydrophobicContact CG2-CE2 4.12Å; V571-F634 HydrophobicContact CG2-CZ 3.85Å; L574-F634 HydrophobicContact CD2-CD1 3.39Å; L574-F634 HydrophobicContact CD2-CE1 3.47Å; L574-F634 VanDerWaalsContact CD2-CE1 3.47Å; I630-F634 HydrophobicContact CG2-CD2 3.78Å; I630-F634 HydrophobicContact CG2-CE2 3.66Å; I630-F634 WeakPolarHBondContact O-CD2 3.22Å; I630-F634 PolarHBondContact O-N 3.41Å; I630-F634 VanDerWaalsContact O-N 3.16Å; M631-F634 PolarHBondContact O-N 2.87Å; F634-L637 PolarHBondContact O-N 3.48Å; F634-M638 WeakPolarHBondContact O-CB 3.26Å; F634-M638 PolarHBondContact O-N 2.99Å
635	A	92.5	Very high	90.6	Very high	1 Å²	1	28 Å²	28	1%	0.008	14%	0.136	C	C	.	.	H	α-helix	trans	-64.8	-46.3	173.2	0	0	0	0	0	112.4	T503 L507 I537 M631 I633 L637 M638 A639	T503-A635 HydrophobicContact CG2-CB 3.52Å; L507-A635 HydrophobicContact CD1-CB 3.77Å; I537-A635 HydrophobicContact CD1-CB 4.19Å; M631-A635 WeakPolarHBondContact O-CB 3.39Å; M631-A635 PolarHBondContact O-N 3.06Å; M631-A635 HydrophobicContact SD-CB 4.27Å; I633-A635 VanDerWaalsContact C-N 3.32Å; I633-A635 PolarHBondContact O-N 3.44Å; A635-L637 VanDerWaalsContact C-N 3.33Å; A635-L637 PolarHBondContact O-N 3.45Å; A635-M638 WeakPolarHBondContact O-CB 3.44Å; A635-M638 PolarHBondContact O-N 3.14Å; A635-A639 PolarHBondContact O-N 3.21Å
636	C	93.1	Very high	89.3	Confident	11 Å²	11	28.1 Å²	28.1	7%	0.074	14%	0.135	C	C	.	.	H	α-helix	trans	-65.1	-34.5	176	-72.3	0	0	0	0	112.5	A613 T614 V615 T632 I633 A639 V640	A613-C636 HydrophobicContact CB-CB 4.1Å; T614-C636 PolarHBondContact O-SG 3.37Å; T614-C636 VanDerWaalsContact O-SG 3.41Å; V615-C636 HydrophobicContact CG2-CB 3.98Å; T632-C636 WeakPolarHBondContact O-CB 3.5Å; T632-C636 PolarHBondContact O-N 2.91Å; T632-C636 PolarHBondContact O-SG 3.44Å; T632-C636 VanDerWaalsContact O-SG 3.32Å; I633-C636 PolarHBondContact O-N 3.25Å; C636-A639 PolarHBondContact O-N 3.31Å; C636-V640 WeakPolarHBondContact O-CG2 3.21Å; C636-V640 PolarHBondContact O-N 2.99Å
637	L	94.9	Very high	87.7	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.3	-41.6	171.8	-70.7	173.6	0	0	0	111.9	W540 V571 L574 I575 I578 A608 I611 A613 I633 F634 A635 V640 D641	W540-L637 HydrophobicContact CH2-CB 4.21Å; V571-L637 HydrophobicContact CG1-CD1 4.1Å; L574-L637 HydrophobicContact CD2-CB 4.39Å; L574-L637 HydrophobicContact CD2-CD1 3.93Å; L574-L637 HydrophobicContact CG-CD1 4.41Å; I575-L637 HydrophobicContact CD1-CD2 4.5Å; I575-L637 HydrophobicContact CG1-CD1 4.37Å; I575-L637 HydrophobicContact CG1-CD2 3.74Å; I578-L637 HydrophobicContact CD1-CB 3.9Å; I578-L637 HydrophobicContact CD1-CD2 4.26Å; A608-L637 HydrophobicContact CB-CD2 4.01Å; I611-L637 HydrophobicContact CD1-CD2 3.84Å; A613-L637 HydrophobicContact CB-CD2 4.16Å; I633-L637 HydrophobicContact CG2-CD1 4.08Å; I633-L637 WeakPolarHBondContact O-CG 3.38Å; I633-L637 PolarHBondContact O-N 2.91Å; F634-L637 PolarHBondContact O-N 3.48Å; A635-L637 VanDerWaalsContact C-N 3.33Å; A635-L637 PolarHBondContact O-N 3.45Å; L637-V640 PolarHBondContact O-N 3.13Å; L637-D641 PolarHBondContact O-N 2.78Å
638	M	93.1	Very high	86.1	Confident	17 Å²	17	31 Å²	31	8%	0.084	16%	0.156	C	C	.	.	H	α-helix	trans	-61	-44.5	174.4	-173.1	175.6	-179	0	0	111.3	L507 I537 W540 F634 A635 V640 D641 L642	L507-M638 HydrophobicContact CD1-SD 4.24Å; L507-M638 HydrophobicContact CD2-CB 3.89Å; L507-M638 HydrophobicContact CD2-CG 3.84Å; L507-M638 HydrophobicContact CD2-SD 4.21Å; I537-M638 HydrophobicContact CG1-SD 4.38Å; I537-M638 HydrophobicContact CG2-SD 4.43Å; W540-M638 HydrophobicContact CB-CE 4.09Å; W540-M638 HydrophobicContact CB-SD 4.28Å; W540-M638 HydrophobicContact CD2-CB 3.99Å; W540-M638 HydrophobicContact CD2-CG 3.67Å; W540-M638 HydrophobicContact CD2-SD 4.04Å; W540-M638 HydrophobicContact CE3-CB 3.69Å; W540-M638 HydrophobicContact CE3-CG 3.84Å; W540-M638 HydrophobicContact CE3-SD 4.09Å; W540-M638 HydrophobicContact CG-CE 4.01Å; W540-M638 HydrophobicContact CG-CG 4.12Å; W540-M638 HydrophobicContact CG-SD 4.09Å; W540-M638 VanDerWaalsContact CH2-CA 3.4Å; W540-M638 HydrophobicContact CH2-CB 3.79Å; W540-M638 HydrophobicContact CH2-CG 4.43Å; W540-M638 HydrophobicContact CZ2-CB 4.07Å; W540-M638 HydrophobicContact CZ2-CG 4.29Å; W540-M638 HydrophobicContact CZ3-CB 3.58Å; W540-M638 HydrophobicContact CZ3-CG 4.22Å; F634-M638 WeakPolarHBondContact O-CB 3.26Å; F634-M638 PolarHBondContact O-N 2.99Å; A635-M638 WeakPolarHBondContact O-CB 3.44Å; A635-M638 PolarHBondContact O-N 3.14Å; M638-V640 VanDerWaalsContact C-N 3.26Å; M638-V640 PolarHBondContact O-N 3.22Å; M638-D641 WeakPolarHBondContact O-CB 3.37Å; M638-D641 PolarHBondContact O-N 3.19Å; M638-D641 VanDerWaalsContact O-N 3.11Å; M638-L642 HydrophobicContact CE-CD1 4.47Å; M638-L642 HydrophobicContact CG-CD1 4.41Å; M638-L642 WeakPolarHBondContact O-CG 3.41Å; M638-L642 PolarHBondContact O-N 3.33Å
639	A	90.2	Very high	84.2	Confident	17 Å²	17	31.8 Å²	31.8	14%	0.14	17%	0.165	C	C	.	.	H	α-helix	trans	-59	-37.9	177.1	0	0	0	0	0	112.5	L507 L510 A635 C636 K643	L507-A639 HydrophobicContact CD2-CB 3.82Å; L510-A639 HydrophobicContact CD1-CB 3.63Å; L510-A639 WeakPolarHBondContact CD1-O 3.19Å; A635-A639 PolarHBondContact O-N 3.21Å; C636-A639 PolarHBondContact O-N 3.31Å; A639-K643 WeakPolarHBondContact O-CB 3.35Å; A639-K643 WeakPolarHBondContact O-CG 3.35Å; A639-K643 PolarHBondContact O-N 2.55Å
640	V	91.4	Very high	81.6	Confident	17 Å²	17	38.8 Å²	38.8	10%	0.103	20%	0.203	C	C	.	.	H	α-helix	trans	-70.8	-32.7	176.3	168.2	0	0	0	0	112.8	I578 I611 A613 C636 L637 M638 Q644	I578-V640 HydrophobicContact CG2-CG1 4.22Å; I611-V640 HydrophobicContact CD1-CG1 3.95Å; I611-V640 HydrophobicContact CG1-CG1 4.18Å; A613-V640 HydrophobicContact CB-CG2 3.95Å; C636-V640 WeakPolarHBondContact O-CG2 3.21Å; C636-V640 PolarHBondContact O-N 2.99Å; L637-V640 PolarHBondContact O-N 3.13Å; M638-V640 VanDerWaalsContact C-N 3.26Å; M638-V640 PolarHBondContact O-N 3.22Å; V640-Q644 VanDerWaalsContact CG1-NE2 3.31Å; V640-Q644 WeakPolarHBondContact O-CB 3.48Å; V640-Q644 WeakPolarHBondContact O-CG 3.4Å; V640-Q644 PolarHBondContact O-N 3.07Å; V640-Q644 PolarHBondContact O-NE2 3.25Å
641	D	92.1	Very high	78.7	Confident	8 Å²	8	41.3 Å²	41.3	4%	0.043	22%	0.221	C	C	.	.	H	α-helix	trans	-66.1	-52.7	172.2	-169.7	19.5	0	0	0	110.8	W540 K544 I578 L637 M638 K643 Q644 N645	W540-D641 HydrophobicContact CZ2-CB 3.77Å; W540-D641 PolarHBondContact NE1-OD2 2.76Å; K544-D641 WeakPolarHBondContact CD-OD2 3.47Å; K544-D641 WeakPolarHBondContact CE-OD2 3.45Å; K544-D641 IonicContact NZ-OD1 2.66Å; K544-D641 PolarHBondContact NZ-OD1 3.27Å; K544-D641 IonicContact NZ-OD2 2.92Å; K544-D641 PolarHBondContact NZ-OD2 2.91Å; I578-D641 HydrophobicContact CG1-CB 4.25Å; I578-D641 HydrophobicContact CG2-CB 4.42Å; L637-D641 PolarHBondContact O-N 2.78Å; M638-D641 WeakPolarHBondContact O-CB 3.37Å; M638-D641 PolarHBondContact O-N 3.19Å; M638-D641 VanDerWaalsContact O-N 3.11Å; D641-K643 PolarHBondContact O-N 3.39Å; D641-Q644 PolarHBondContact O-N 3.23Å; D641-N645 PolarHBondContact O-N 3.38Å; D641-N645 PolarHBondContact O-ND2 3.37Å; D641-N645 PolarHBondContact OD1-ND2 3.37Å
642	L	87.7	Confident	75.9	Confident	14 Å²	14	46.9 Å²	46.9	7%	0.073	24%	0.242	C	C	.	.	H	α-helix	trans	-59	-45.7	178.5	-57	-178.7	0	0	0	111.8	L507 L510 T511 E514 M638 Q644 N645 R646	L507-L642 HydrophobicContact CD2-CD1 4.31Å; L510-L642 HydrophobicContact CB-CB 4.08Å; L510-L642 HydrophobicContact CB-CD1 3.74Å; L510-L642 HydrophobicContact CD1-CB 4.39Å; T511-L642 HydrophobicContact CG2-CD1 3.97Å; E514-L642 WeakPolarHBondContact OE1-CB 3.45Å; M638-L642 HydrophobicContact CE-CD1 4.47Å; M638-L642 HydrophobicContact CG-CD1 4.41Å; M638-L642 WeakPolarHBondContact O-CG 3.41Å; M638-L642 PolarHBondContact O-N 3.33Å; L642-Q644 VanDerWaalsContact C-N 3.25Å; L642-Q644 PolarHBondContact O-N 2.98Å; L642-N645 PolarHBondContact O-N 3.47Å; L642-R646 WeakPolarHBondContact O-CG 3.44Å; L642-R646 PolarHBondContact O-N 3.43Å; L642-R646 VanDerWaalsContact O-N 3.16Å
643	K	85.1	Confident	73.3	Confident	84 Å²	84	56.3 Å²	56.3	37%	0.365	28%	0.282	S	S	.	.	H	α-helix	trans	-61.5	-28.6	174.8	-76.2	-164.3	177.6	-160	0	113.2	L510 A639 D641	L510-K643 HydrophobicContact CD1-CG 3.95Å; L510-K643 HydrophobicContact CD2-CD 4.31Å; L510-K643 HydrophobicContact CD2-CG 3.49Å; L510-K643 VanDerWaalsContact CD2-CG 3.49Å; L510-K643 HydrophobicContact CG-CG 4.4Å; A639-K643 WeakPolarHBondContact O-CB 3.35Å; A639-K643 WeakPolarHBondContact O-CG 3.35Å; A639-K643 PolarHBondContact O-N 2.55Å; D641-K643 PolarHBondContact O-N 3.39Å
644	Q	82.3	Confident	70.6	Confident	50 Å²	50	63.9 Å²	63.9	23%	0.234	32%	0.318	C	S	.	.	H	α-helix	trans	-79.5	-41.6	174.4	-79.2	172.6	110.7	0	0	112.8	I578 V640 D641 L642 R646 K647	I578-Q644 VanDerWaalsContact CG2-NE2 3.31Å; V640-Q644 VanDerWaalsContact CG1-NE2 3.31Å; V640-Q644 WeakPolarHBondContact O-CB 3.48Å; V640-Q644 WeakPolarHBondContact O-CG 3.4Å; V640-Q644 PolarHBondContact O-N 3.07Å; V640-Q644 PolarHBondContact O-NE2 3.25Å; D641-Q644 PolarHBondContact O-N 3.23Å; L642-Q644 VanDerWaalsContact C-N 3.25Å; L642-Q644 PolarHBondContact O-N 2.98Å; Q644-R646 PolarHBondContact O-N 3.31Å; Q644-K647 WeakPolarHBondContact O-CB 3.49Å; Q644-K647 PolarHBondContact O-N 3.35Å
645	N	75.7	Confident	67.8	Low	70 Å²	70	65 Å²	65	37%	0.374	33%	0.325	S	S	.	.	H	α-helix	trans	-64.5	-26	178.7	-65.3	-50.8	0	0	0	112.7	D641 L642 T648	D641-N645 PolarHBondContact O-N 3.38Å; D641-N645 PolarHBondContact O-ND2 3.37Å; D641-N645 PolarHBondContact OD1-ND2 3.37Å; L642-N645 PolarHBondContact O-N 3.47Å; N645-T648 PolarHBondContact O-OG1 2.86Å; N645-T648 VanDerWaalsContact O-OG1 3.08Å
646	R	66.3	Low	65	Low	35 Å²	35	71.7 Å²	71.7	13%	0.132	36%	0.356	C	S	.	.	H	α-helix	trans	-64.8	-36.2	168	-70.5	175.9	176	-156.8	-3	113.1	Q509 L510 E514 L642 Q644 T648 V649 W652	Q509-R646 PolarHBondContact O-NH2 3.16Å; Q509-R646 VanDerWaalsContact O-NH2 3.14Å; L510-R646 VanDerWaalsContact C-NH2 3.33Å; L510-R646 VanDerWaalsContact CA-NH2 3.29Å; L510-R646 PolarHBondContact O-NH2 3.3Å; E514-R646 HydrophobicContact CG-CG 4.41Å; L642-R646 WeakPolarHBondContact O-CG 3.44Å; L642-R646 PolarHBondContact O-N 3.43Å; L642-R646 VanDerWaalsContact O-N 3.16Å; Q644-R646 PolarHBondContact O-N 3.31Å; R646-T648 VanDerWaalsContact C-N 3.31Å; R646-T648 PolarHBondContact O-N 3.01Å; R646-V649 PolarHBondContact O-N 3.19Å; R646-W652 HydrophobicContact CB-CZ2 4.24Å; R646-W652 WeakPolarHBondContact O-CZ2 3.23Å; R646-W652 PolarHBondContact O-NE1 3.44Å
647	K	59.2	Low	62.2	Low	137 Å²	137	79.2 Å²	79.2	60%	0.596	39%	0.387	S	S	*	.	H	α-helix	trans	-73.5	-18.9	-175.5	-73.2	-174.8	176.8	-169.8	0	113.8	Q644 W652	Q644-K647 WeakPolarHBondContact O-CB 3.49Å; Q644-K647 PolarHBondContact O-N 3.35Å; K647-W652 HydrophobicContact CB-CZ2 4.15Å; K647-W652 HydrophobicContact CG-CH2 3.71Å; K647-W652 HydrophobicContact CG-CZ2 3.48Å; K647-W652 VanDerWaalsContact CG-CZ2 3.48Å
648	T	56.8	Low	59.3	Low	110 Å²	110	83.1 Å²	83.1	68%	0.675	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-8.8	174.4	53.2	0	0	0	0	113.7	N645 R646	N645-T648 PolarHBondContact O-OG1 2.86Å; N645-T648 VanDerWaalsContact O-OG1 3.08Å; R646-T648 VanDerWaalsContact C-N 3.31Å; R646-T648 PolarHBondContact O-N 3.01Å
649	V	50.7	Low	56.5	Low	78 Å²	78	86.6 Å²	86.6	47%	0.473	42%	0.423	S	S	.	.	S	Bend	trans	-100.2	118.2	176.8	179.1	0	0	0	0	109.8	R646 S651 W652	R646-V649 PolarHBondContact O-N 3.19Å; V649-S651 VanDerWaalsContact C-N 3.33Å; V649-S651 PolarHBondContact O-N 2.96Å; V649-W652 VanDerWaalsContact O-CD1 3.25Å; V649-W652 PolarHBondContact O-NE1 2.97Å; V649-W652 VanDerWaalsContact O-NE1 3.1Å
650	N	36.6	Very low	53.7	Low	161 Å²	161	89.2 Å²	89.2	86%	0.861	43%	0.434	S	S	*	.	S	Bend	trans	-73.3	71.3	-172	-73	-28.4	0	0	0	114
651	S	33.6	Very low	50.8	Low	53 Å²	53	92.3 Å²	92.3	37%	0.371	45%	0.453	S	S	.	.			trans	-129.1	32.9	176.5	-157.7	0	0	0	0	113.4	V649 K653	V649-S651 VanDerWaalsContact C-N 3.33Å; V649-S651 PolarHBondContact O-N 2.96Å; S651-K653 VanDerWaalsContact C-N 3.26Å; S651-K653 PolarHBondContact O-N 2.82Å
652	W	32.2	Very low	48.2	Very low	118 Å²	118	96.1 Å²	96.1	45%	0.447	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	46.1	-165.1	-74.1	83.5	0	0	0	115.1	R646 K647 V649	R646-W652 HydrophobicContact CB-CZ2 4.24Å; R646-W652 WeakPolarHBondContact O-CZ2 3.23Å; R646-W652 PolarHBondContact O-NE1 3.44Å; K647-W652 HydrophobicContact CB-CZ2 4.15Å; K647-W652 HydrophobicContact CG-CH2 3.71Å; K647-W652 HydrophobicContact CG-CZ2 3.48Å; K647-W652 VanDerWaalsContact CG-CZ2 3.48Å; V649-W652 VanDerWaalsContact O-CD1 3.25Å; V649-W652 PolarHBondContact O-NE1 2.97Å; V649-W652 VanDerWaalsContact O-NE1 3.1Å
653	K	36.9	Very low	45.6	Very low	201 Å²	201	99.3 Å²	99.3	87%	0.874	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.6	1.5	172.2	-74.9	-166.3	174.9	-175.8	0	116	S651	S651-K653 VanDerWaalsContact C-N 3.26Å; S651-K653 PolarHBondContact O-N 2.82Å
654	Q	38.3	Very low	43.1	Very low	159 Å²	159	101.4 Å²	101.4	74%	0.743	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	-27.1	176.8	-81.4	-178.8	-29.9	0	0	114.6
655	V	35.5	Very low	40.7	Very low	24 Å²	24	100.8 Å²	100.8	15%	0.145	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-21.2	-173.7	-175.2	0	0	0	0	113.2	I517 K657 I658	I517-V655 HydrophobicContact CD1-CG2 4.08Å; V655-K657 PolarHBondContact O-N 3.2Å; V655-I658 WeakPolarHBondContact O-CB 3.4Å; V655-I658 PolarHBondContact O-N 3.35Å
656	E	33.7	Very low	38.7	Very low	142 Å²	142	102.2 Å²	102.2	66%	0.664	50%	0.497	S	S	*	.	H	α-helix	trans	-56.1	-23.6	178	-164.5	169.9	-126.5	0	0	113	I658 I660	E656-I658 VanDerWaalsContact C-N 3.27Å; E656-I658 PolarHBondContact O-N 2.9Å; E656-I660 WeakPolarHBondContact O-CD1 3.45Å; E656-I660 WeakPolarHBondContact O-CG1 3.44Å
657	K	34	Very low	36.9	Very low	168 Å²	168	105.9 Å²	105.9	73%	0.73	52%	0.516	S	S	*	.	H	α-helix	trans	-68.8	-14.7	171.7	-99.9	-178.2	176.9	176.7	0	115.4	V655 V661	V655-K657 PolarHBondContact O-N 3.2Å; K657-V661 WeakPolarHBondContact O-CG2 3.49Å
658	I	34.3	Very low	35.5	Very low	82 Å²	82	103.4 Å²	103.4	42%	0.421	52%	0.515	S	S	.	.	H	α-helix	trans	-97.9	-40	-172.1	-56.3	179.6	0	0	0	111.5	V655 E656 I660 V661	V655-I658 WeakPolarHBondContact O-CB 3.4Å; V655-I658 PolarHBondContact O-N 3.35Å; E656-I658 VanDerWaalsContact C-N 3.27Å; E656-I658 PolarHBondContact O-N 2.9Å; I658-I660 PolarHBondContact O-N 3.22Å; I658-V661 WeakPolarHBondContact O-CB 3.27Å; I658-V661 PolarHBondContact O-N 3.26Å
659	E	33.2	Very low	34	Very low	90 Å²	90	104.5 Å²	104.5	42%	0.421	52%	0.524	S	S	.	.	H	α-helix	trans	-66.1	-15	169.6	-64	-173.1	139.5	0	0	111.6	N663	E659-N663 PolarHBondContact O-ND2 3.12Å
660	I	32.4	Very low	33.1	Very low	72 Å²	72	106.6 Å²	106.6	37%	0.369	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-19	168.3	-70.6	173.5	0	0	0	112.8	E656 I658 R664	E656-I660 WeakPolarHBondContact O-CD1 3.45Å; E656-I660 WeakPolarHBondContact O-CG1 3.44Å; I658-I660 PolarHBondContact O-N 3.22Å; I660-R664 HydrophobicContact CG2-CG 4.16Å; I660-R664 WeakPolarHBondContact O-CB 2.83Å; I660-R664 VanDerWaalsContact O-CG 3.27Å; I660-R664 WeakPolarHBondContact O-CG 3.22Å; I660-R664 PolarHBondContact O-N 3.13Å
661	V	31.2	Very low	32.7	Very low	82 Å²	82	107.9 Å²	107.9	50%	0.497	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-40.4	179.1	175.6	0	0	0	0	111.8	K657 I658 N663 R664	K657-V661 WeakPolarHBondContact O-CG2 3.49Å; I658-V661 WeakPolarHBondContact O-CB 3.27Å; I658-V661 PolarHBondContact O-N 3.26Å; V661-N663 PolarHBondContact O-N 3.31Å; V661-N663 VanDerWaalsContact O-N 3.07Å; V661-R664 PolarHBondContact O-N 3.28Å; V661-R664 VanDerWaalsContact O-N 3.16Å
662	E	35.7	Very low	32.4	Very low	89 Å²	89	110.3 Å²	110.3	42%	0.416	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56	-24.1	171.6	-68.3	-175.4	131.1	0	0	111.9
663	N	34.8	Very low	32.3	Very low	81 Å²	81	109.2 Å²	109.2	43%	0.433	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109	13.2	-177.6	-60.9	-60.7	0	0	0	114.5	N212 E659 V661	N212-N663 PolarHBondContact OD1-OD1 3.49Å; E659-N663 PolarHBondContact O-ND2 3.12Å; V661-N663 PolarHBondContact O-N 3.31Å; V661-N663 VanDerWaalsContact O-N 3.07Å
664	R	30.9	Very low	31.8	Very low	128 Å²	128	107 Å²	107	48%	0.483	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-132.3	2.2	-179	-77.4	-170.6	-178.1	-161.3	-1.1	116.3	I660 V661 F666 N688	I660-R664 HydrophobicContact CG2-CG 4.16Å; I660-R664 WeakPolarHBondContact O-CB 2.83Å; I660-R664 VanDerWaalsContact O-CG 3.27Å; I660-R664 WeakPolarHBondContact O-CG 3.22Å; I660-R664 PolarHBondContact O-N 3.13Å; V661-R664 PolarHBondContact O-N 3.28Å; V661-R664 VanDerWaalsContact O-N 3.16Å; R664-F666 PolarHBondContact O-N 3.44Å; R664-N688 PolarHBondContact NH1-OD1 3.07Å; R664-N688 PolarHBondContact NH2-OD1 3.38Å
665	S	31.8	Very low	31.2	Very low	37 Å²	37	105.6 Å²	105.6	26%	0.259	55%	0.545	S	S	.	.	S	Bend	trans	-75.7	-19.1	-174.1	48.9	0	0	0	0	115.7	H667	S665-H667 PolarHBondContact O-N 2.66Å
666	F	33.7	Very low	30.9	Very low	100 Å²	100	109.7 Å²	109.7	44%	0.439	58%	0.575	S	S	.	*			trans	-100.1	46.2	-168.4	-89.1	-76.2	0	0	0	116	Y408 R427 R664	Y408-F666 HydrophobicContact CD1-CZ 4.39Å; Y408-F666 HydrophobicContact CE1-CE2 4.49Å; Y408-F666 HydrophobicContact CE1-CZ 4.02Å; R427-F666 HydrophobicContact CB-CZ 4.37Å; R427-F666 HydrophobicContact CG-CE1 4.28Å; R664-F666 PolarHBondContact O-N 3.44Å
667	H	30.1	Very low	30.5	Very low	112 Å²	112	109.4 Å²	109.4	52%	0.519	58%	0.577	S	S	.	*			trans	-139.7	95.8	169.9	-78.1	-39.9	0	0	0	114.2	S665	S665-H667 PolarHBondContact O-N 2.66Å
668	S	28.8	Very low	30.2	Very low	84 Å²	84	107.2 Å²	107.2	59%	0.587	57%	0.57	S	S	*	*			trans	-98.8	128.8	156.5	45.8	0	0	0	0	109.6	T670	S668-T670 PolarHBondContact O-N 2.68Å
669	P	26.3	Very low	29.9	Very low	133 Å²	133	107.9 Å²	107.9	86%	0.864	58%	0.578	S	S	*	*			trans	-86.6	86.3	-179.3	32.8	-33.7	0	0	0	111.6
670	T	30.6	Very low	29.6	Very low	123 Å²	123	113.5 Å²	113.5	76%	0.755	60%	0.601	S	S	*	*			trans	-94.2	127.5	170.2	39.3	0	0	0	0	111.4	S668	S668-T670 PolarHBondContact O-N 2.68Å
671	H	27.8	Very low	29.4	Very low	187 Å²	187	112.9 Å²	112.9	87%	0.866	60%	0.603	S	S	*	*			trans	-84.5	144.9	172.2	-104.1	-100.7	0	0	0	110.5
672	S	27.9	Very low	29.3	Very low	104 Å²	104	114.8 Å²	114.8	73%	0.727	60%	0.602	S	S	*	*			trans	66.3	144.3	-177.6	74.6	0	0	0	0	114.6
673	S	30.3	Very low	28.9	Very low	96 Å²	96	116.1 Å²	116.1	67%	0.671	61%	0.611	S	S	*	*			cis	-127.5	172	9.1	-71.9	0	0	0	0	112.5
674	R	26.4	Very low	28.4	Very low	153 Å²	153	118.1 Å²	118.1	58%	0.577	61%	0.614	S	S	*	*			trans	-69	132	170.2	-72.4	172.3	168.3	148.9	-15.6	110.4	E9	E9-R674 WeakPolarHBondContact OE1-CD 3.36Å; E9-R674 IonicContact OE1-CZ 2.65Å; E9-R674 VanDerWaalsContact OE1-CZ 3.31Å; E9-R674 IonicContact OE1-NE 2.66Å; E9-R674 PolarHBondContact OE1-NE 3.33Å; E9-R674 IonicContact OE1-NH1 3.94Å; E9-R674 PolarHBondContact OE1-NH1 2.99Å; E9-R674 IonicContact OE2-CZ 3.16Å; E9-R674 IonicContact OE2-NH1 3.86Å; E9-R674 PolarHBondContact OE2-NH1 2.9Å; E9-R674 IonicContact OE2-NH2 2.89Å
675	E	26.2	Very low	28.2	Very low	130 Å²	130	116.8 Å²	116.8	61%	0.607	62%	0.62	S	S	*	*				-174.8	-170.1	121.6	-103.7	-175.7	170.6	0	0	109.8	V5	V5-E675 WeakPolarHBondContact CG1-OE1 3.46Å; V5-E675 WeakPolarHBondContact CG2-OE1 3.32Å
676	S	28.6	Very low	28	Very low	110 Å²	110	116.6 Å²	116.6	77%	0.769	62%	0.623	S	S	*	*			trans	62.5	99.2	-169.7	69.8	0	0	0	0	115	E678	S676-E678 VanDerWaalsContact C-N 3.34Å; S676-E678 PolarHBondContact O-N 3.42Å
677	L	26.4	Very low	27.7	Very low	137 Å²	137	117.4 Å²	117.4	72%	0.717	64%	0.637	S	S	*	*			trans	-98.9	48.6	172.1	-100.1	166.5	0	0	0	111.5	I12	I12-L677 HydrophobicContact CD1-CD1 3.68Å
678	E	26.3	Very low	27.6	Very low	121 Å²	121	117.8 Å²	117.8	57%	0.565	64%	0.642	S	S	*	*			trans	-141.6	165.9	172.2	-107.8	163.1	-137.8	0	0	110	Q360 S676	Q360-E678 PolarHBondContact NE2-OE1 3.45Å; S676-E678 VanDerWaalsContact C-N 3.34Å; S676-E678 PolarHBondContact O-N 3.42Å
679	T	27.7	Very low	27.6	Very low	96 Å²	96	119.1 Å²	119.1	59%	0.589	65%	0.65	S	S	*	*			trans	61.5	67.2	-174.3	-48.6	0	0	0	0	115	S681	T679-S681 PolarHBondContact O-N 3.21Å
680	K	26.6	Very low	27.7	Very low	209 Å²	209	121.7 Å²	121.7	91%	0.909	65%	0.648	S	S	*	*			trans	-73.1	81.6	149.8	-85.4	-170.1	175.6	-175.5	0	110
681	S	30	Very low	27.7	Very low	59 Å²	59	123 Å²	123	41%	0.413	65%	0.651	S	S	.	*			trans	-70.7	143.2	159.3	51	0	0	0	0	109.5	T679 L683	T679-S681 PolarHBondContact O-N 3.21Å; S681-L683 PolarHBondContact O-N 2.9Å
682	Y	28.4	Very low	27.8	Very low	122 Å²	122	121 Å²	121	48%	0.478	65%	0.646	S	S	.	*			trans	-78.7	90.5	177.2	-72.7	-80.8	0	0	0	109.7	S118	S118-Y682 PolarHBondContact O-OH 3.01Å; S118-Y682 PolarHBondContact OG-OH 2.91Å
683	L	27.5	Very low	28	Very low	117 Å²	117	124.1 Å²	124.1	61%	0.613	65%	0.654	S	S	*	*			trans	-80.2	127.3	174.8	-78.4	163.7	0	0	0	111.1	S681	S681-L683 PolarHBondContact O-N 2.9Å
684	Y	24.7	Very low	28.1	Very low	123 Å²	123	126.5 Å²	126.5	48%	0.482	65%	0.654	S	S	.	*			trans	-97.3	109.6	-178.2	-178.9	-92.5	0	0	0	110.6
685	V	26.6	Very low	28.3	Very low	100 Å²	100	125.7 Å²	125.7	61%	0.606	67%	0.666	S	S	*	*			trans	-106.8	70.8	-175.5	-169.1	0	0	0	0	110.9	T687	V685-T687 HydrophobicContact CG1-CG2 4.5Å; V685-T687 PolarHBondContact O-N 3.2Å
686	G	27.3	Very low	28.6	Very low	32 Å²	32	126.1 Å²	126.1	33%	0.33	67%	0.672	S	S	.	*			trans	-72.5	103.8	177.6	0	0	0	0	0	112.8
687	T	28.2	Very low	28.6	Very low	118 Å²	118	129.4 Å²	129.4	72%	0.724	68%	0.675	S	S	*	*			trans	-87.6	132.5	175.9	62	0	0	0	0	111.8	V685	V685-T687 HydrophobicContact CG1-CG2 4.5Å; V685-T687 PolarHBondContact O-N 3.2Å
688	N	27.1	Very low	29	Very low	120 Å²	120	130.6 Å²	130.6	64%	0.642	68%	0.683	S	S	*	*			trans	-98	91.3	177.9	-82.1	59.6	0	0	0	110.5	R664	R664-N688 PolarHBondContact NH1-OD1 3.07Å; R664-N688 PolarHBondContact NH2-OD1 3.38Å
689	C	27.9	Very low	29.2	Very low	111 Å²	111	131.1 Å²	131.1	75%	0.75	69%	0.689	S	S	*	*			trans	-75.1	141.3	160.2	-77.6	0	0	0	0	110.5
690	K	29	Very low	29.6	Very low	187 Å²	187	133.7 Å²	133.7	81%	0.813	70%	0.7	S	S	*	*			trans	-115.8	98.5	172	-76.7	-175.8	177.7	-178.6	0	108.5
691	D	30.7	Very low	30	Very low	152 Å²	152	131 Å²	131	81%	0.813	70%	0.695	S	S	*	*			trans	-92.5	119.9	165.5	-71	-45	0	0	0	109.6
692	N	29.1	Very low	30.4	Very low	144 Å²	144	132.9 Å²	132.9	77%	0.77	71%	0.714	S	S	*	*			trans	-88	109.4	172.3	-58.7	-43.4	0	0	0	107.8
693	L	34.1	Very low	30.9	Very low	169 Å²	169	134.3 Å²	134.3	89%	0.885	73%	0.73	S	S	*	*			trans	-91	102	161.7	-81.5	164.1	0	0	0	108.2	V695	L693-V695 PolarHBondContact O-N 3.36Å
694	E	30.7	Very low	31.4	Very low	147 Å²	147	135.1 Å²	135.1	69%	0.687	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-69.9	123.5	172	-65.8	-172.4	136.8	0	0	109.4
695	V	30.9	Very low	32.1	Very low	135 Å²	135	136 Å²	136	82%	0.818	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-80.7	117.7	168	178.3	0	0	0	0	107.5	L693	L693-V695 PolarHBondContact O-N 3.36Å
696	N	32.4	Very low	32.7	Very low	140 Å²	140	136.5 Å²	136.5	75%	0.749	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-90.9	122.4	164.3	-71.9	-59.1	0	0	0	108.5
697	E	29.3	Very low	33.2	Very low	178 Å²	178	142.6 Å²	142.6	83%	0.832	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-76	134.3	162.7	-61.1	173.6	140.3	0	0	108.5
698	D	35.3	Very low	33.7	Very low	163 Å²	163	143 Å²	143	87%	0.872	77%	0.767	S	S	*	*			trans	-148.5	143.9	153.4	-114.5	-35.8	0	0	0	108.4
699	N	30.5	Very low	34.2	Very low	132 Å²	132	143.4 Å²	143.4	71%	0.706	77%	0.769	S	S	*	*			trans	-90.6	163	-165.8	-60.4	-87.1	0	0	0	112.2
700	N	35.8	Very low	34.8	Very low	150 Å²	150	144.3 Å²	144.3	80%	0.802	77%	0.767	S	S	*	*				174.6	108.7	128.4	-82.7	-26.6	0	0	0	111.8
701	D	35.3	Very low	35.3	Very low	152 Å²	152	139.6 Å²	139.6	81%	0.813	75%	0.751	S	S	*	*			trans	23.7	124.5	135	-43.9	-21.1	0	0	0	120.9
702	A	38	Very low	35.5	Very low	98 Å²	98	141.3 Å²	141.3	81%	0.81	75%	0.745	S	S	*	*				-174.2	146.3	121.9	0	0	0	0	0	112.6
703	D	38.2	Very low	35.9	Very low	153 Å²	153	143.8 Å²	143.8	82%	0.818	75%	0.75	S	S	*	*			trans	-62.6	167.2	179.1	-48.7	-75.9	0	0	0	113.5
704	D	39.2	Very low	36	Very low	133 Å²	133	141.5 Å²	141.5	71%	0.711	75%	0.745	S	S	*	*				-172.8	151.9	57.4	-128	-14.1	0	0	0	114.4
705	I	39.2	Very low	35.8	Very low	142 Å²	142	140.1 Å²	140.1	73%	0.728	75%	0.75	S	S	*	*			trans	38.9	134	131.1	-73.2	175.6	0	0	0	120
706	V	38.6	Very low	36	Very low	110 Å²	110	138.2 Å²	138.2	67%	0.667	74%	0.743	S	S	*	*			cis	-166.2	173.4	7.1	114.3	0	0	0	0	112.9
707	E	37.9	Very low	35.9	Very low	161 Å²	161	141.4 Å²	141.4	75%	0.752	75%	0.75	S	S	*	*			trans	-14.4	169.4	163.2	-48.3	158.1	152.2	0	0	120.6
708	D	38.2	Very low	36.2	Very low	126 Å²	126	138.2 Å²	138.2	67%	0.674	75%	0.745	S	S	*	*			cis	-162.5	161	22.5	-155.5	18.7	0	0	0	118
709	N	38.6	Very low	35.8	Very low	129 Å²	129	136.7 Å²	136.7	69%	0.69	74%	0.742	S	S	*	*			trans	33.5	119.7	149.1	-81.1	-38.7	0	0	0	127.8
710	D	39.8	Very low	35.7	Very low	129 Å²	129	138 Å²	138	69%	0.69	75%	0.747	S	S	*	*				96	149.4	106.7	-152.7	29.3	0	0	0	124.8
711	D	38.7	Very low	35.6	Very low	89 Å²	89	138.3 Å²	138.3	48%	0.476	75%	0.749	S	S	.	*			trans	101.2	102.5	141.8	-115.5	19	0	0	0	125.5
712	R	36.5	Very low	35.5	Very low	187 Å²	187	140 Å²	140	71%	0.706	75%	0.748	S	S	*	*			trans	73.3	101.1	134	-76.4	166.7	-150.2	151.7	33.2	125.4
713	K	36.9	Very low	35.2	Very low	197 Å²	197	143 Å²	143	86%	0.857	75%	0.751	S	S	*	*				80.9	155.9	118	-76.7	-177.6	176	176.3	0	122.6
714	P	36.1	Very low	34.9	Very low	121 Å²	121	142 Å²	142	79%	0.786	75%	0.751	S	S	*	*			trans	-124.1	171.7	-169	43.8	-30.7	0	0	0	116.2
715	C	27.1	Very low	34.6	Very low	118 Å²	118	141.8 Å²	141.8	80%	0.797	76%	0.757	S	S	*	*				178	157.6	120.9	-152.2	0	0	0	0	115.5
716	S	33.6	Very low	34.2	Very low	95 Å²	95	146.3 Å²	146.3	66%	0.664	77%	0.765	S	S	*	*			trans	69.7	101.9	145.9	53.7	0	0	0	0	124.6
717	K	31.1	Very low	33.8	Very low	206 Å²	206	146.1 Å²	146.1	90%	0.896	77%	0.765	S	S	*	*			trans	79.3	155.2	130.9	-72.2	-171.4	175.2	-177.9	0	121.5
718	P	34.7	Very low	33.6	Very low	112 Å²	112	144 Å²	144	73%	0.727	77%	0.766	S	S	*	*			trans	-130.6	158.9	-151.2	41.2	-24.9	0	0	0	117.2
719	T	28.6	Very low	33.6	Very low	131 Å²	131	144 Å²	144	80%	0.804	77%	0.772	S	S	*	*			trans	-160.6	144.2	152.7	-24	0	0	0	0	113.4
720	L	28.5	Very low	33.2	Very low	158 Å²	158	146.7 Å²	146.7	83%	0.827	78%	0.781	S	S	*	*			trans	30.3	118.1	153.1	-77.1	163.8	0	0	0	121.6
721	L	33.2	Very low	32.6	Very low	158 Å²	158	149.6 Å²	149.6	83%	0.827	79%	0.787	S	S	*	*			trans	-167.2	101.8	139.5	-100.2	156.9	0	0	0	107.8
722	K	33.9	Very low	32.1	Very low	186 Å²	186	151.3 Å²	151.3	81%	0.809	80%	0.801	S	S	*	*				76.1	130.7	102.4	-79.9	-164.2	-176.6	-179.6	0	116.3
723	D	31	Very low	31.6	Very low	163 Å²	163	151.1 Å²	151.1	87%	0.872	81%	0.806	S	S	*	*			trans	-69.5	152.4	-179.3	-46.4	-95.3	0	0	0	113.9
724	T	32	Very low	31.1	Very low	132 Å²	132	147.4 Å²	147.4	81%	0.81	80%	0.8	S	S	*	*			trans	-134	131.2	160.4	27.1	0	0	0	0	109.1
725	P	32.9	Very low	30.6	Very low	128 Å²	128	151.7 Å²	151.7	83%	0.831	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-70	137.4	-177.4	-16	30.1	0	0	0	112
726	R	30.5	Very low	30.7	Very low	237 Å²	237	150.9 Å²	150.9	89%	0.894	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-76.6	131	164.8	-169.1	176.8	-67.1	-149	0.8	108.4
727	P	31.2	Very low	30.3	Very low	105 Å²	105	153.2 Å²	153.2	68%	0.682	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-69	155.2	-177.1	28.4	-35.7	0	0	0	112.2
728	P	32.9	Very low	30.1	Very low	117 Å²	117	153.7 Å²	153.7	76%	0.76	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-71.2	136.4	173.3	30.6	-33.9	0	0	0	110.5
729	P	37.1	Very low	29.8	Very low	126 Å²	126	152.7 Å²	152.7	82%	0.818	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-71	132.7	171.6	28.8	-32.9	0	0	0	110.8
730	E	30.7	Very low	29.7	Very low	185 Å²	185	153.9 Å²	153.9	86%	0.864	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-69.5	148	177.8	-79.1	-177.6	105.1	0	0	112.9	T732	E730-T732 PolarHBondContact O-N 2.88Å; E730-T732 VanDerWaalsContact O-N 3.11Å
731	K	27.2	Very low	29.7	Very low	190 Å²	190	154 Å²	154	83%	0.826	79%	0.789	S	S	*	*			trans	-75	98.9	179.6	-66.1	-177.8	-179.9	-178.6	0	111	F733	K731-F733 HydrophobicContact CB-CE2 4.33Å
732	T	29.3	Very low	29.5	Very low	125 Å²	125	151.6 Å²	151.6	77%	0.767	79%	0.786	S	S	*	*			trans	-98.4	109.7	168.4	-49.3	0	0	0	0	109.6	E730	E730-T732 PolarHBondContact O-N 2.88Å; E730-T732 VanDerWaalsContact O-N 3.11Å
733	F	24.9	Very low	29.4	Very low	184 Å²	184	147.8 Å²	147.8	81%	0.807	78%	0.783	S	S	*	*			trans	-83.6	125.7	177.9	-79.4	-95.4	0	0	0	111.1	K731	K731-F733 HydrophobicContact CB-CE2 4.33Å
734	V	27.9	Very low	29.3	Very low	119 Å²	119	144.9 Å²	144.9	72%	0.721	77%	0.774	S	S	*	*			trans	-127.6	121.9	166.7	-178.3	0	0	0	0	108.7
735	K	24.8	Very low	29.1	Very low	210 Å²	210	149.8 Å²	149.8	91%	0.913	78%	0.778	S	S	*	*			trans	-95.3	120.7	162.3	-82.2	-175.9	173.3	-178.2	0	107.8
736	S	29.5	Very low	29.1	Very low	102 Å²	102	154 Å²	154	71%	0.713	78%	0.783	S	S	*	*			trans	-132	105	175.4	50.5	0	0	0	0	110.3
737	F	25	Very low	28.9	Very low	143 Å²	143	147.8 Å²	147.8	63%	0.627	78%	0.776	S	S	*	*			trans	-84.9	126.4	167.8	-99.4	-100.2	0	0	0	109.4	N29	N29-F737 HydrophobicContact CB-CB 3.76Å; N29-F737 WeakPolarHBondContact CB-O 3.19Å; N29-F737 PolarHBondContact ND2-O 3.29Å
738	R	27.1	Very low	29	Very low	217 Å²	217	149.1 Å²	149.1	82%	0.819	79%	0.785	S	S	*	*			trans	-124.3	126.8	159.4	-85.9	-175.9	171.9	169.2	-2.5	108.8
739	V	28.5	Very low	28.7	Very low	91 Å²	91	151 Å²	151	55%	0.552	79%	0.787	S	S	*	*			trans	-121.5	110.9	171.1	179.1	0	0	0	0	106.4	L741	V739-L741 HydrophobicContact CG1-CG 4.31Å; V739-L741 PolarHBondContact O-N 3.1Å
740	N	26.4	Very low	28.5	Very low	155 Å²	155	151.9 Å²	151.9	83%	0.829	79%	0.79	S	S	*	*			trans	-80	105.1	175.9	-81.8	-21.8	0	0	0	109.6
741	L	27.2	Very low	28.3	Very low	160 Å²	160	147.9 Å²	147.9	84%	0.838	78%	0.782	S	S	*	*			trans	-100.4	91.6	175.9	-94.7	166.5	0	0	0	111.7	V739	V739-L741 HydrophobicContact CG1-CG 4.31Å; V739-L741 PolarHBondContact O-N 3.1Å
742	S	30.6	Very low	28.5	Very low	109 Å²	109	146.7 Å²	146.7	76%	0.762	78%	0.784	S	S	*	*			trans	-147.6	134.2	164.7	57.6	0	0	0	0	108.1
743	S	30.4	Very low	28.4	Very low	105 Å²	105	147.5 Å²	147.5	73%	0.734	78%	0.784	S	S	*	*			cis	-152	155.4	25	-171.7	0	0	0	0	113.4
744	C	29.2	Very low	28.8	Very low	103 Å²	103	146.1 Å²	146.1	70%	0.696	79%	0.785	S	S	*	*			trans	33.9	113.2	159.4	-66.5	0	0	0	0	120.3
745	R	28.5	Very low	29	Very low	235 Å²	235	143.6 Å²	143.6	89%	0.887	78%	0.777	S	S	*	*				57.6	107.5	75.3	-67.9	-175.2	173.8	-169.9	-0.4	115.9
746	K	32.3	Very low	29.3	Very low	216 Å²	216	144.1 Å²	144.1	94%	0.939	77%	0.773	S	S	*	*				-175.8	137.3	118.1	-102	168.7	-176.3	178.8	0	111.8
747	S	25.6	Very low	29.4	Very low	107 Å²	107	146.8 Å²	146.8	75%	0.748	77%	0.774	S	S	*	*			trans	-140.9	156.6	165.8	56.6	0	0	0	0	109.3
748	P	33.3	Very low	29.5	Very low	133 Å²	133	144.5 Å²	144.5	86%	0.864	78%	0.776	S	S	*	*			trans	-114	157.5	151.2	-2.3	23.7	0	0	0	111.9
749	I	27.7	Very low	29.6	Very low	155 Å²	155	144.6 Å²	144.6	80%	0.795	78%	0.778	S	S	*	*			trans	-106.9	137.5	179.7	-62.7	158.9	0	0	0	109
750	T	31.8	Very low	29.6	Very low	146 Å²	146	144.8 Å²	144.8	90%	0.896	78%	0.783	S	S	*	*			trans	-146.7	133.6	149.3	39.2	0	0	0	0	110
751	S	26.8	Very low	30	Very low	100 Å²	100	145.8 Å²	145.8	70%	0.699	78%	0.783	S	S	*	*			trans	-108.5	148.6	178.4	53.9	0	0	0	0	111.4
752	L	30.7	Very low	30.1	Very low	165 Å²	165	146.2 Å²	146.2	86%	0.864	79%	0.785	S	S	*	*				-163.7	148.9	126.3	-136	67.8	0	0	0	111.8
753	D	28.9	Very low	30.1	Very low	142 Å²	142	144.9 Å²	144.9	76%	0.759	79%	0.789	S	S	*	*			trans	-66.2	167.1	159	-52.7	-82.1	0	0	0	109.3
754	D	32.9	Very low	30	Very low	155 Å²	155	145.3 Å²	145.3	83%	0.829	78%	0.782	S	S	*	*			cis	-171	167.2	49.4	-158.6	-3.4	0	0	0	113.5
755	A	31.8	Very low	29.9	Very low	66 Å²	66	146.2 Å²	146.2	55%	0.545	79%	0.788	S	S	.	*			trans	40.9	114.6	148.4	0	0	0	0	0	123.7
756	R	31	Very low	30.1	Very low	222 Å²	222	140 Å²	140	84%	0.838	79%	0.788	S	S	*	*				88.2	124.7	124.2	-70.1	176.9	-177.3	179.6	1.4	123.1
757	Q	31.2	Very low	29.7	Very low	157 Å²	157	138.8 Å²	138.8	73%	0.734	79%	0.785	S	S	*	*				73.6	86.8	128.5	-67.3	178	-47.6	0	0	121.8
758	S	27.3	Very low	30	Very low	95 Å²	95	140.7 Å²	140.7	66%	0.664	79%	0.792	S	S	*	*				79.5	143.9	111.6	72.4	0	0	0	0	122.8
759	Y	29.6	Very low	29.7	Very low	220 Å²	220	141.7 Å²	141.7	86%	0.863	79%	0.79	S	S	*	*			trans	86.9	119.6	159.6	-77.2	-75.1	0	0	0	122
760	S	29.5	Very low	29.8	Very low	94 Å²	94	139.1 Å²	139.1	66%	0.657	79%	0.786	S	S	*	*			trans	70.7	109.3	139.5	58.3	0	0	0	0	122.9
761	Q	33.4	Very low	29.7	Very low	176 Å²	176	140.6 Å²	140.6	82%	0.822	79%	0.787	S	S	*	*				74.4	117.8	125	-67.6	-176.4	-34.2	0	0	122.1
762	L	28.9	Very low	29.7	Very low	170 Å²	170	143.1 Å²	143.1	89%	0.89	79%	0.793	S	S	*	*			trans	35.3	120.6	139.8	-69.8	87.6	0	0	0	120.1
763	G	30.9	Very low	29.7	Very low	81 Å²	81	137.9 Å²	137.9	84%	0.835	78%	0.779	S	S	*	*			trans	-160.8	123.3	161.1	0	0	0	0	0	112.1
764	D	29.4	Very low	29.7	Very low	113 Å²	113	139.2 Å²	139.2	60%	0.604	79%	0.785	S	S	*	*			trans	-54	142.6	-168.7	-71.6	-32.1	0	0	0	118.4	N836	D764-N836 PolarHBondContact OD2-ND2 3.3Å
765	C	27.5	Very low	29.6	Very low	122 Å²	122	137.4 Å²	137.4	82%	0.824	78%	0.78	S	S	*	*				31.6	125	128.7	-50.4	0	0	0	0	122
766	A	31.1	Very low	29.5	Very low	105 Å²	105	140.3 Å²	140.3	87%	0.868	79%	0.79	S	S	*	*			trans	-159.6	146.1	133.7	0	0	0	0	0	111.8
767	E	24.8	Very low	29.4	Very low	191 Å²	191	133.2 Å²	133.2	89%	0.893	78%	0.78	S	S	*	*			trans	-86.8	149.3	174.8	-57.7	149.8	123	0	0	111.5
768	V	31.2	Very low	29.5	Very low	147 Å²	147	132.5 Å²	132.5	89%	0.891	78%	0.781	S	S	*	*			trans	-144.6	129	153	-164.4	0	0	0	0	109.6
769	D	27.7	Very low	29.6	Very low	153 Å²	153	135.2 Å²	135.2	82%	0.818	79%	0.787	S	S	*	*			trans	-76.9	156.7	177.6	-87.3	-56.6	0	0	0	114.3
770	S	28.7	Very low	29.8	Very low	102 Å²	102	130.3 Å²	130.3	71%	0.713	78%	0.78	S	S	*	*			trans	53.8	120.7	143	-168.2	0	0	0	0	120.5
771	L	31.3	Very low	30	Very low	176 Å²	176	134.6 Å²	134.6	92%	0.921	79%	0.787	S	S	*	*				-147.1	141.7	120.7	-149.5	68.1	0	0	0	111.8
772	D	26.2	Very low	29.9	Very low	154 Å²	154	131.4 Å²	131.4	82%	0.824	78%	0.779	S	S	*	*			trans	-108.4	149.3	-176.4	-175.5	21.6	0	0	0	112
773	G	29.7	Very low	30.1	Very low	55 Å²	55	128.4 Å²	128.4	57%	0.567	77%	0.768	S	S	*	*			trans	77.7	130.6	164.4	0	0	0	0	0	118.6
774	L	29	Very low	30.2	Very low	169 Å²	169	131 Å²	131	89%	0.885	76%	0.763	S	S	*	*				-166.9	128.8	114	-124.6	77.8	0	0	0	115.1
775	V	30.4	Very low	30.4	Very low	118 Å²	118	132.5 Å²	132.5	72%	0.715	77%	0.769	S	S	*	*			trans	64.5	97.4	138.2	169.9	0	0	0	0	122.6
776	T	29.6	Very low	30.8	Very low	126 Å²	126	137.1 Å²	137.1	77%	0.773	77%	0.769	S	S	*	*				37.5	140.9	114.7	-5.1	0	0	0	0	125.3
777	A	29.8	Very low	30.8	Very low	74 Å²	74	137.4 Å²	137.4	61%	0.612	76%	0.76	S	S	*	*			trans	90.4	122.5	135.2	0	0	0	0	0	121.8
778	N	32.6	Very low	31.3	Very low	142 Å²	142	135.7 Å²	135.7	76%	0.759	76%	0.755	S	S	*	*				-176	103.7	99.1	-93.6	-52.1	0	0	0	116.3
779	L	30.6	Very low	31.4	Very low	152 Å²	152	134.2 Å²	134.2	80%	0.796	75%	0.749	S	S	*	*				63	151.4	117.6	-94.1	167.6	0	0	0	125.8
780	V	33.3	Very low	31.6	Very low	117 Å²	117	131.9 Å²	131.9	71%	0.709	74%	0.744	S	S	*	*			trans	77.9	133.2	158.5	167.2	0	0	0	0	117.4
781	K	33.2	Very low	32.3	Very low	184 Å²	184	133.2 Å²	133.2	80%	0.8	75%	0.751	S	S	*	*			cis	-167.3	179.6	-9.1	-102.4	-177	-177.4	179.5	0	106.8
782	V	33.1	Very low	32.4	Very low	108 Å²	108	134.3 Å²	134.3	66%	0.655	75%	0.748	S	S	*	*			cis	-157.2	118.2	-2.5	114.3	0	0	0	0	106.5
783	T	32.5	Very low	32.6	Very low	107 Å²	107	138.8 Å²	138.8	66%	0.656	75%	0.753	S	S	*	*				55.3	114.8	99.9	69.9	0	0	0	0	120.5
784	N	32.9	Very low	32.8	Very low	137 Å²	137	141.6 Å²	141.6	73%	0.733	76%	0.764	S	S	*	*				176.5	112.4	115.5	-83.9	-10.6	0	0	0	110.6
785	I	34.1	Very low	33.2	Very low	143 Å²	143	142.2 Å²	142.2	73%	0.733	76%	0.762	S	S	*	*				84	104	81.8	-67.7	167.5	0	0	0	115.4
786	R	34.4	Very low	33.3	Very low	220 Å²	220	142 Å²	142	83%	0.83	77%	0.766	S	S	*	*			trans	-152.6	158.8	134.7	-101.9	174.8	179.7	178.6	-0.2	107.6
787	T	31.5	Very low	33.9	Very low	111 Å²	111	142.2 Å²	142.2	68%	0.681	77%	0.77	S	S	*	*			trans	-143	-178.5	-151.4	46.7	0	0	0	0	114.9
788	I	35	Very low	34.2	Very low	154 Å²	154	146 Å²	146	79%	0.79	78%	0.778	S	S	*	*			trans	90	133.2	164.3	-52.2	153.1	0	0	0	115.2
789	P	34	Very low	34.1	Very low	117 Å²	117	145.1 Å²	145.1	76%	0.76	77%	0.772	S	S	*	*			cis	-134.3	-179.8	-32.9	38.1	-19.2	0	0	0	113.8
790	S	32.5	Very low	34.4	Very low	103 Å²	103	147.1 Å²	147.1	72%	0.72	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-94.6	148.5	171.5	52.4	0	0	0	0	113.7
791	P	42	Very low	34.5	Very low	130 Å²	130	148.5 Å²	148.5	84%	0.844	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-73.5	135.4	172.8	30.2	-33.7	0	0	0	111.3
792	K	33.8	Very low	34.7	Very low	200 Å²	200	148.3 Å²	148.3	87%	0.87	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-81.3	134.4	-176.7	-70.9	-179.2	178.4	176.8	0	112.6	S794	K792-S794 PolarHBondContact O-N 3.02Å; K792-S794 VanDerWaalsContact O-N 3.14Å
793	R	30.8	Very low	34.8	Very low	248 Å²	248	148.8 Å²	148.8	94%	0.936	78%	0.783	S	S	*	*			trans	-71	95.3	161.9	-175.6	-177.5	-172.5	-179.3	3.8	109.3
794	S	34.4	Very low	34.9	Very low	113 Å²	113	146.8 Å²	146.8	79%	0.79	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-74.7	124.8	179.1	52.6	0	0	0	0	112	K792	K792-S794 PolarHBondContact O-N 3.02Å; K792-S794 VanDerWaalsContact O-N 3.14Å
795	Q	37.5	Very low	35	Very low	182 Å²	182	148.7 Å²	148.7	85%	0.85	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-83.4	149.2	172.4	-66.9	170.8	-27.7	0	0	111.1
796	S	32.6	Very low	35	Very low	114 Å²	114	146.9 Å²	146.9	80%	0.797	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-72.9	130.5	173.8	-48.2	0	0	0	0	111.4
797	P	40.9	Very low	35.1	Very low	131 Å²	131	145.9 Å²	145.9	85%	0.851	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-69.5	160	172.8	-20.4	34	0	0	0	113.5
798	I	36.7	Very low	35.3	Very low	153 Å²	153	148 Å²	148	79%	0.785	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-102.5	136	-174	-69.9	172.6	0	0	0	111.8
799	I	30.7	Very low	35.4	Very low	124 Å²	124	149.7 Å²	149.7	64%	0.636	78%	0.779	S	S	*	*			trans	13.3	128	150.9	-53.5	166.4	0	0	0	117.9
800	H	36.2	Very low	35.5	Very low	194 Å²	194	150.6 Å²	150.6	90%	0.898	77%	0.774	S	S	*	*			trans	-147.9	147.8	132.7	-105.4	-77	0	0	0	111.5
801	H	35.1	Very low	35.5	Very low	146 Å²	146	155.2 Å²	155.2	68%	0.676	78%	0.782	S	S	*	*			trans	-88.7	149.2	-174	-67.8	-95.8	0	0	0	113.4
802	H	37.1	Very low	35.2	Very low	180 Å²	180	155.1 Å²	155.1	83%	0.833	78%	0.784	S	S	*	*				-178.8	167.7	97.5	-97.2	-73.6	0	0	0	111.9
803	P	36.2	Very low	35.2	Very low	118 Å²	118	150.6 Å²	150.6	77%	0.766	78%	0.778	S	S	*	*			trans	-121.9	176.1	-151.5	44.2	-35.8	0	0	0	115.8
804	G	34.7	Very low	35.4	Very low	65 Å²	65	143.2 Å²	143.2	67%	0.67	76%	0.764	S	S	*	*			trans	174.9	101.7	158.9	0	0	0	0	0	116.7
805	M	35.4	Very low	35.4	Very low	177 Å²	177	148.8 Å²	148.8	87%	0.872	77%	0.768	S	S	*	*			trans	52.6	150.7	139.3	-59.4	-63.2	158.8	0	0	121.7
806	N	34.1	Very low	34.9	Very low	104 Å²	104	145.1 Å²	145.1	56%	0.556	76%	0.762	S	S	*	*			cis	-170.2	178.1	-29.8	-157.5	-9.7	0	0	0	108.1
807	Y	36.2	Very low	34.9	Very low	200 Å²	200	151.4 Å²	151.4	78%	0.784	77%	0.769	S	S	*	*			trans	71.2	155.1	171.1	-54	-82.4	0	0	0	117.3
808	H	36.2	Very low	34.3	Very low	155 Å²	155	150.1 Å²	150.1	72%	0.718	76%	0.763	S	S	*	*			cis	-176.7	135.3	-46.4	-122.6	-65.9	0	0	0	108.2
809	Y	36.5	Very low	34.3	Very low	189 Å²	189	148 Å²	148	74%	0.741	76%	0.759	S	S	*	*				173	177.1	113.2	-136.4	-122.1	0	0	0	114.5
810	M	35.7	Very low	34.5	Very low	136 Å²	136	149 Å²	149	67%	0.67	77%	0.77	S	S	*	*			trans	-53.5	151.5	-161.7	-69.1	-179.5	174.8	0	0	118.5
811	K	32.5	Very low	34.3	Very low	201 Å²	201	146.6 Å²	146.6	87%	0.874	76%	0.764	S	S	*	*			cis	92.3	112.8	37.4	-107.7	-170.6	180	-177.2	0	115.7
812	S	35.4	Very low	34.1	Very low	128 Å²	128	147.5 Å²	147.5	90%	0.895	77%	0.773	S	S	*	*			trans	-151.7	168.1	139.5	69.1	0	0	0	0	109.7
813	S	33.6	Very low	33.7	Very low	105 Å²	105	144.3 Å²	144.3	73%	0.734	77%	0.771	S	S	*	*			trans	-133.6	151.9	-159.6	173.9	0	0	0	0	109.4
814	S	35.6	Very low	33.7	Very low	93 Å²	93	145.9 Å²	145.9	65%	0.65	77%	0.772	S	S	*	*				-179.2	153.3	71.6	-63.4	0	0	0	0	117.6
815	R	33.7	Very low	33.3	Very low	230 Å²	230	150.1 Å²	150.1	87%	0.868	78%	0.779	S	S	*	*			trans	76.7	97.2	147.3	-75.4	168.2	-171.2	-121.6	-2	120.5
816	S	27.9	Very low	33.3	Very low	105 Å²	105	147.8 Å²	147.8	73%	0.734	78%	0.775	S	S	*	*			trans	-92.5	165.7	151.6	53.1	0	0	0	0	112.1
817	W	31.7	Very low	33.1	Very low	245 Å²	245	147.2 Å²	147.2	93%	0.928	78%	0.779	S	S	*	*			trans	-145.8	123	159	-92.5	86.4	0	0	0	111.7
818	S	28.5	Very low	32.8	Very low	104 Å²	104	144.3 Å²	144.3	73%	0.727	78%	0.777	S	S	*	*			trans	174.8	162.2	175.4	55.4	0	0	0	0	108.9
819	P	38	Very low	32.6	Very low	110 Å²	110	145.4 Å²	145.4	71%	0.714	78%	0.779	S	S	*	*			cis	-119.5	-169	-37.8	40.1	-26.1	0	0	0	110.2
820	V	35.4	Very low	32.3	Very low	143 Å²	143	141.9 Å²	141.9	87%	0.867	78%	0.778	S	S	*	*			trans	-142.8	125.6	162.2	179.7	0	0	0	0	109.8
821	D	30.2	Very low	32.2	Very low	144 Å²	144	145.7 Å²	145.7	77%	0.77	79%	0.786	S	S	*	*			trans	-84.1	152.1	169.6	-62.2	-73.8	0	0	0	111.8
822	L	32.6	Very low	32	Very low	166 Å²	166	140 Å²	140	87%	0.869	77%	0.772	S	S	*	*			trans	-150.9	132.7	150.6	-148.6	75.7	0	0	0	112
823	S	27.8	Very low	31.8	Very low	112 Å²	112	142.1 Å²	142.1	78%	0.783	77%	0.765	S	S	*	*			trans	-114.1	130.6	-179.6	59.3	0	0	0	0	111.4
824	I	35.4	Very low	31.7	Very low	152 Å²	152	146.8 Å²	146.8	78%	0.779	77%	0.768	S	S	*	*			trans	-130.9	135.1	162	-62.9	-176.5	0	0	0	108.6
825	N	27.1	Very low	31.5	Very low	153 Å²	153	147.8 Å²	147.8	82%	0.818	77%	0.77	S	S	*	*			trans	-130.8	122.2	-176.8	-176	10.2	0	0	0	108.2
826	T	35.4	Very low	31.3	Very low	129 Å²	129	141.7 Å²	141.7	79%	0.791	76%	0.755	S	S	*	*			trans	-151.7	152.5	176.4	-0.7	0	0	0	0	111.2
827	S	30.3	Very low	31.6	Very low	91 Å²	91	146.1 Å²	146.1	64%	0.636	76%	0.764	S	S	*	*			trans	-129.7	160.6	-156.4	69.6	0	0	0	0	114.9
828	N	29.4	Very low	31.3	Very low	139 Å²	139	141 Å²	141	74%	0.743	75%	0.754	S	S	*	*			trans	84.1	143.4	144.6	-79.6	-55.3	0	0	0	121.4
829	K	32.9	Very low	31.1	Very low	178 Å²	178	140.9 Å²	140.9	77%	0.774	75%	0.753	S	S	*	*			trans	93.3	89.2	142.9	-82	170.5	-179.5	-177.8	0	123.1
830	T	29.2	Very low	30.7	Very low	115 Å²	115	144.9 Å²	144.9	71%	0.706	76%	0.759	S	S	*	*				74.5	153	117.2	49.2	0	0	0	0	123.5
831	Y	32.7	Very low	30.3	Very low	216 Å²	216	142.9 Å²	142.9	85%	0.847	75%	0.752	S	S	*	*			trans	85.2	144.9	170	-66.1	-88.7	0	0	0	118.4
832	S	29.4	Very low	30.2	Very low	83 Å²	83	141.6 Å²	141.6	58%	0.58	75%	0.749	S	S	*	*			cis	157.5	128.3	-40.9	160.5	0	0	0	0	112
833	K	30.5	Very low	30.1	Very low	172 Å²	172	140.9 Å²	140.9	75%	0.748	75%	0.746	S	S	*	*			trans	66.2	151.3	171.6	-60.2	168.6	-178.4	-177.7	0	114.4
834	Y	33.1	Very low	30.2	Very low	203 Å²	203	140.4 Å²	140.4	80%	0.796	74%	0.743	S	S	*	*			cis	-137.8	137.8	27.5	-89.3	-102.4	0	0	0	110.3
835	V	31.4	Very low	30.2	Very low	114 Å²	114	138.1 Å²	138.1	69%	0.691	74%	0.735	S	S	*	*				86	124.1	73.2	171.5	0	0	0	0	116.1
836	N	29.4	Very low	30.6	Very low	102 Å²	102	138.5 Å²	138.5	55%	0.545	74%	0.738	S	S	.	*			trans	1	138.9	161.9	-55.9	14.3	0	0	0	121.6	D764	D764-N836 PolarHBondContact OD2-ND2 3.3Å
837	Q	33.5	Very low	30.6	Very low	198 Å²	198	140.2 Å²	140.2	93%	0.925	74%	0.736	S	S	*	*				-159.4	156.9	119.7	-119	162.9	93.9	0	0	114
838	L	24.7	Very low	30.8	Very low	138 Å²	138	143.1 Å²	143.1	72%	0.723	75%	0.75	S	S	*	*			trans	-98.3	161.3	-178.7	-71.6	83.3	0	0	0	112.8
839	S	25.7	Very low	31	Very low	101 Å²	101	139.6 Å²	139.6	71%	0.706	75%	0.746	S	S	*	*			trans	92.2	123.2	140.4	80.8	0	0	0	0	121.6
840	K	27.7	Very low	31.2	Very low	194 Å²	194	138.8 Å²	138.8	84%	0.843	75%	0.75	S	S	*	*			trans	68.7	147.7	138.9	-66.6	174.6	178.3	178.1	0	121.8
841	S	28	Very low	31.5	Very low	101 Å²	101	140.2 Å²	140.2	71%	0.706	75%	0.753	S	S	*	*			trans	90.2	104.5	150.7	-5.5	0	0	0	0	121.5
842	T	28.8	Very low	31.5	Very low	117 Å²	117	138.7 Å²	138.7	72%	0.718	75%	0.753	S	S	*	*				66.5	124.8	125.8	57.2	0	0	0	0	123.6
843	N	28.9	Very low	31.8	Very low	150 Å²	150	140.1 Å²	140.1	80%	0.802	76%	0.76	S	S	*	*			trans	53.8	135.4	131.7	-52.9	1.4	0	0	0	118.9
844	S	31.8	Very low	31.8	Very low	103 Å²	103	141 Å²	141	72%	0.72	77%	0.767	S	S	*	*			cis	173.2	166.6	42.2	-135	0	0	0	0	112.4
845	V	33.6	Very low	31.9	Very low	103 Å²	103	141.5 Å²	141.5	62%	0.624	77%	0.773	S	S	*	*			trans	65.6	119.7	149.6	174.9	0	0	0	0	120.5
846	N	36.2	Very low	31.8	Very low	161 Å²	161	140.2 Å²	140.2	86%	0.861	77%	0.769	S	S	*	*				-157.2	154.8	112.3	-108.4	-62.1	0	0	0	113.2
847	H	35	Very low	32.1	Very low	166 Å²	166	144.6 Å²	144.6	77%	0.769	78%	0.784	S	S	*	*			trans	-104.3	146.5	-169.6	-77.4	-90.5	0	0	0	114.1
848	V	35.6	Very low	31.9	Very low	152 Å²	152	140.3 Å²	140.3	92%	0.921	78%	0.776	S	S	*	*				-141.9	152.2	118.5	-173.9	0	0	0	0	106.8
849	G	33	Very low	32.6	Very low	65 Å²	65	139.5 Å²	139.5	67%	0.67	78%	0.779	S	S	*	*			trans	-168.6	-170.8	179.2	0	0	0	0	0	112.7
850	L	36.2	Very low	32.9	Very low	161 Å²	161	141.2 Å²	141.2	84%	0.843	79%	0.785	S	S	*	*			trans	-159.2	110.7	169.5	-105.5	167.2	0	0	0	113.2
851	N	35.5	Very low	32.9	Very low	144 Å²	144	139.3 Å²	139.3	77%	0.77	78%	0.783	S	S	*	*			trans	45.1	95.1	147.3	-58.2	-7.7	0	0	0	122.5
852	H	33.7	Very low	33.2	Very low	185 Å²	185	140.8 Å²	140.8	86%	0.856	79%	0.789	S	S	*	*				13.4	163.3	112.7	-91.2	5.6	0	0	0	122.7
853	P	36	Very low	33.3	Very low	112 Å²	112	141.5 Å²	141.5	73%	0.727	79%	0.788	S	S	*	*			cis	-136.8	167.9	-10.4	37	-18.6	0	0	0	116.3
854	Q	31	Very low	33.5	Very low	191 Å²	191	140.2 Å²	140.2	89%	0.893	78%	0.781	S	S	*	*			trans	-83.2	165	161	-75.5	-176.6	-27.4	0	0	112.4
855	K	34.5	Very low	33.5	Very low	213 Å²	213	141.8 Å²	141.8	93%	0.926	78%	0.781	S	S	*	*			trans	-135.5	139.2	150.7	-107.6	-175.6	177.9	-179.4	0	110.8
856	S	30.1	Very low	33.6	Very low	87 Å²	87	144.7 Å²	144.7	61%	0.608	79%	0.786	S	S	*	*			trans	-84.3	158.1	177.9	52.3	0	0	0	0	112.4
857	F	35.5	Very low	33.6	Very low	195 Å²	195	144.4 Å²	144.4	86%	0.855	78%	0.779	S	S	*	*				176.6	152.1	110.7	-92.8	-64.8	0	0	0	113.4
858	S	29.3	Very low	33.7	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	78%	0.775	S	S	*	*			trans	-54.3	173.2	-170.2	-46.7	0	0	0	0	118.6
859	P	39.3	Very low	33.7	Very low	120 Å²	120	139.8 Å²	139.8	78%	0.779	76%	0.762	S	S	*	*			trans	-105.5	159.8	-156.7	39.9	-35.2	0	0	0	116.3
860	T	32	Very low	33.9	Very low	137 Å²	137	147.4 Å²	147.4	84%	0.84	77%	0.771	S	S	*	*			trans	-156.2	125.6	153.7	8.3	0	0	0	0	114.3
861	L	27.7	Very low	33.7	Very low	154 Å²	154	144.4 Å²	144.4	81%	0.806	76%	0.763	S	S	*	*			trans	29.3	145.4	137.6	-75.2	166.3	0	0	0	123.8
862	T	33	Very low	33.6	Very low	133 Å²	133	141.9 Å²	141.9	82%	0.816	76%	0.763	S	S	*	*			trans	75.6	159.4	161.5	71.7	0	0	0	0	119.1
863	N	30.7	Very low	33.6	Very low	131 Å²	131	138.8 Å²	138.8	70%	0.701	76%	0.757	S	S	*	*			cis	-171.7	155.4	-43.7	-167.1	2.7	0	0	0	106.9
864	N	33.8	Very low	33.6	Very low	124 Å²	124	142.3 Å²	142.3	66%	0.663	76%	0.763	S	S	*	*			trans	64.8	156.2	167.8	-73.2	-51.8	0	0	0	117.3
865	N	32.6	Very low	33.5	Very low	135 Å²	135	138.3 Å²	138.3	72%	0.722	76%	0.757	S	S	*	*			cis	-168.4	-178.6	-32.9	-145.5	-54.4	0	0	0	108.3
866	K	35.9	Very low	34	Very low	165 Å²	165	133 Å²	133	72%	0.717	74%	0.744	S	S	*	*			trans	77.8	115.1	168.5	-64.4	-175.5	179.4	177.1	0	116
867	Q	36.1	Very low	34.4	Very low	155 Å²	155	137 Å²	137	72%	0.724	75%	0.752	S	S	*	*				79.1	143.5	80.4	-74.3	171.5	-19.1	0	0	112.5
868	N	36.4	Very low	34.3	Very low	127 Å²	127	134.1 Å²	134.1	68%	0.679	74%	0.742	S	S	*	*			cis	-162.8	145.5	18.1	-135.5	-7.5	0	0	0	113.7
869	S	35	Very low	34.7	Very low	93 Å²	93	134.3 Å²	134.3	65%	0.65	73%	0.734	S	S	*	*			trans	64.7	158.3	144.1	75.8	0	0	0	0	120
870	R	37.1	Very low	34.4	Very low	225 Å²	225	135.5 Å²	135.5	85%	0.849	73%	0.727	S	S	*	*			cis	-162	140.7	-0.6	-130.9	168.4	-165.8	170.9	1.9	112.9
871	S	33.6	Very low	34.6	Very low	98 Å²	98	138.9 Å²	138.9	69%	0.685	73%	0.725	S	S	*	*			trans	35.3	127.1	141.3	61.7	0	0	0	0	124.3
872	A	33.6	Very low	34.9	Very low	92 Å²	92	138.7 Å²	138.7	76%	0.76	72%	0.724	S	S	*	*				55.1	157.6	124.5	0	0	0	0	0	120.7
873	T	33.1	Very low	35.1	Very low	120 Å²	120	137.7 Å²	137.7	74%	0.736	72%	0.718	S	S	*	*			cis	-156.7	154.2	11.1	-17.5	0	0	0	0	106.8
874	Q	36.4	Very low	35.3	Very low	185 Å²	185	136.8 Å²	136.8	86%	0.864	72%	0.718	S	S	*	*				153.6	173.7	87.5	-122.9	163	24	0	0	109.3
875	S	29	Very low	35.3	Very low	107 Å²	107	136.9 Å²	136.9	75%	0.748	72%	0.718	S	S	*	*			trans	-150.3	-173.7	178.8	64.4	0	0	0	0	109.9
876	P	44.8	Very low	35.4	Very low	101 Å²	101	136.4 Å²	136.4	66%	0.656	72%	0.716	S	S	*	*			cis	-126.2	-171.8	-27.6	39.6	-22.6	0	0	0	112.4
877	H	38.8	Very low	35.5	Very low	171 Å²	171	136 Å²	136	79%	0.792	72%	0.716	S	S	*	*			trans	157.9	143.5	144.2	-86.1	-66.7	0	0	0	108.6
878	E	32.7	Very low	35.5	Very low	135 Å²	135	135.5 Å²	135.5	63%	0.631	72%	0.718	S	S	*	*			cis	113.9	141	16.7	-126.7	-143.1	135.3	0	0	113.2	K880	E878-K880 IonicContact OE1-NZ 2.74Å; E878-K880 PolarHBondContact OE1-NZ 3.13Å
879	N	36.6	Very low	35.4	Very low	112 Å²	112	136.8 Å²	136.8	60%	0.599	73%	0.725	S	S	*	*			trans	81.5	148.8	173.2	-59.5	-67.2	0	0	0	119.2
880	K	34	Very low	35.4	Very low	145 Å²	145	137.6 Å²	137.6	63%	0.63	73%	0.727	S	S	*	*			cis	-175.3	158	-35.4	-119.1	-178.5	-159.9	92.8	0	110.6	E878	E878-K880 IonicContact OE1-NZ 2.74Å; E878-K880 PolarHBondContact OE1-NZ 3.13Å
881	R	36.1	Very low	35.1	Very low	208 Å²	208	135.3 Å²	135.3	79%	0.785	72%	0.724	S	S	*	*			trans	76.7	122.5	160.8	-67.2	166.9	176.4	165	-2.1	117.8
882	N	33.9	Very low	35.2	Very low	150 Å²	150	137.9 Å²	137.9	80%	0.802	74%	0.736	S	S	*	*				82	149.1	88.2	-58.1	6.2	0	0	0	112.4
883	T	36.5	Very low	35.1	Very low	112 Å²	112	139.3 Å²	139.3	69%	0.687	74%	0.735	S	S	*	*			cis	-152	161.8	22.7	47.9	0	0	0	0	112.4
884	T	34.8	Very low	35.2	Very low	113 Å²	113	143.1 Å²	143.1	69%	0.693	74%	0.744	S	S	*	*			trans	45.4	146.1	140.5	59	0	0	0	0	121.8
885	D	35.6	Very low	34.9	Very low	126 Å²	126	143.8 Å²	143.8	67%	0.674	75%	0.745	S	S	*	*			cis	-166.3	153.5	8.9	-117.2	2.1	0	0	0	113.5
886	N	34.4	Very low	35	Very low	124 Å²	124	147.2 Å²	147.2	66%	0.663	75%	0.749	S	S	*	*			trans	58.9	150.9	144.5	-62.5	-41.4	0	0	0	126
887	H	38	Very low	34.4	Very low	156 Å²	156	153.2 Å²	153.2	72%	0.722	76%	0.76	S	S	*	*			trans	94.1	105.9	153.5	-76.9	-65.6	0	0	0	123.1
888	D	36.1	Very low	34.1	Very low	146 Å²	146	151.8 Å²	151.8	78%	0.781	76%	0.756	S	S	*	*			trans	100.1	127.7	130.7	-59.9	-14.8	0	0	0	123.4
889	L	32.7	Very low	34	Very low	154 Å²	154	153.7 Å²	153.7	81%	0.806	77%	0.765	S	S	*	*			trans	-82.4	165.5	172.1	-87.6	157.8	0	0	0	110
890	P	35.8	Very low	33.8	Very low	109 Å²	109	156.2 Å²	156.2	71%	0.708	77%	0.774	S	S	*	*			cis	-150.9	165	44.5	38.1	-15.3	0	0	0	120.3
891	F	30.3	Very low	33.6	Very low	178 Å²	178	158.2 Å²	158.2	78%	0.781	78%	0.782	S	S	*	*			trans	31.3	116.6	147	-77.2	-95	0	0	0	121.2	T893	F891-T893 HydrophobicContact CD1-CG2 4.47Å
892	T	36.3	Very low	33.2	Very low	152 Å²	152	153.3 Å²	153.3	93%	0.933	78%	0.776	S	S	*	*				-140	153.5	123.2	20.7	0	0	0	0	109.6
893	T	32.1	Very low	33	Very low	121 Å²	121	152.2 Å²	152.2	74%	0.742	78%	0.775	S	S	*	*			trans	-118.8	125.2	-175.5	51.4	0	0	0	0	111.8	F891	F891-T893 HydrophobicContact CD1-CG2 4.47Å
894	E	34	Very low	32.6	Very low	200 Å²	200	154.4 Å²	154.4	94%	0.935	78%	0.777	S	S	*	*			trans	-137.7	147	160.7	-123.5	160.6	-163.5	0	0	109.5
895	K	30.6	Very low	32.3	Very low	200 Å²	200	153.5 Å²	153.5	87%	0.87	78%	0.775	S	S	*	*			trans	-121.5	100.8	-175.5	-78.4	-175.4	176.3	-178.3	0	109.6
896	E	31.5	Very low	32	Very low	179 Å²	179	150.9 Å²	150.9	84%	0.836	76%	0.764	S	S	*	*			trans	-104.5	125.4	155.8	-67.8	-162.1	125	0	0	108.9
897	Y	31.7	Very low	31.6	Very low	227 Å²	227	152.5 Å²	152.5	89%	0.89	77%	0.772	S	S	*	*			trans	-103.3	90	-179.4	-140.3	-97.2	0	0	0	107.4	E899	Y897-E899 PolarHBondContact O-N 3.46Å
898	I	33.3	Very low	31.1	Very low	140 Å²	140	154 Å²	154	72%	0.718	77%	0.772	S	S	*	*			trans	-76.5	117.4	178.1	-62.9	177.5	0	0	0	108.3	E900	I898-E900 PolarHBondContact O-N 3.38Å; I898-E900 VanDerWaalsContact O-N 3.08Å
899	E	30.6	Very low	30.6	Very low	175 Å²	175	153 Å²	153	82%	0.818	77%	0.771	S	S	*	*			trans	-73.5	94.6	173.1	-68.6	-169.6	133.1	0	0	110.5	Y897 K901	Y897-E899 PolarHBondContact O-N 3.46Å; E899-K901 PolarHBondContact O-N 2.74Å
900	E	30.7	Very low	30.3	Very low	165 Å²	165	152.4 Å²	152.4	77%	0.771	77%	0.768	S	S	*	*			trans	-65.2	98.7	166.5	-74	-165.6	135.7	0	0	110.3	I898 T902	I898-E900 PolarHBondContact O-N 3.38Å; I898-E900 VanDerWaalsContact O-N 3.08Å; E900-T902 VanDerWaalsContact C-N 3.26Å; E900-T902 PolarHBondContact O-N 2.71Å; E900-T902 PolarHBondContact O-OG1 3.3Å
901	K	29.8	Very low	29.9	Very low	187 Å²	187	153 Å²	153	81%	0.813	77%	0.77	S	S	*	*			trans	-61.1	85.1	167.2	-76.3	-175.2	176.1	-179.6	0	110.4	E899 T903	E899-K901 PolarHBondContact O-N 2.74Å; K901-T903 VanDerWaalsContact C-N 3.34Å; K901-T903 PolarHBondContact O-N 2.61Å
902	T	29.6	Very low	29.9	Very low	105 Å²	105	154.1 Å²	154.1	64%	0.644	77%	0.77	S	S	*	*			trans	-74.2	86.1	172.7	21.3	0	0	0	0	110	E900 H904	E900-T902 VanDerWaalsContact C-N 3.26Å; E900-T902 PolarHBondContact O-N 2.71Å; E900-T902 PolarHBondContact O-OG1 3.3Å; T902-H904 VanDerWaalsContact C-N 3.27Å; T902-H904 PolarHBondContact O-N 2.95Å
903	T	28.4	Very low	29.6	Very low	128 Å²	128	152.7 Å²	152.7	79%	0.785	76%	0.764	S	S	*	*			trans	-68.5	77.6	176.9	40.7	0	0	0	0	111.5	K901 S905	K901-T903 VanDerWaalsContact C-N 3.34Å; K901-T903 PolarHBondContact O-N 2.61Å; T903-S905 PolarHBondContact O-N 2.74Å
904	H	28.7	Very low	29.4	Very low	157 Å²	157	155.3 Å²	155.3	73%	0.727	77%	0.765	S	S	*	*			trans	-72.6	50.8	177.2	-89.7	-64.9	0	0	0	113.9	T902 T906	T902-H904 VanDerWaalsContact C-N 3.27Å; T902-H904 PolarHBondContact O-N 2.95Å; H904-T906 VanDerWaalsContact C-N 3.29Å; H904-T906 PolarHBondContact O-N 3.3Å; H904-T906 PolarHBondContact O-OG1 3.13Å
905	S	27.7	Very low	29.2	Very low	94 Å²	94	152.6 Å²	152.6	66%	0.657	75%	0.752	S	S	*	*			trans	-64.3	92.7	162.2	-172.9	0	0	0	0	108.4	T903	T903-S905 PolarHBondContact O-N 2.74Å
906	T	29.2	Very low	29.2	Very low	71 Å²	71	152 Å²	152	44%	0.436	75%	0.752	S	S	.	*			trans	-109.5	87.3	-170.4	-37.1	0	0	0	0	109.3	H904 Y908	H904-T906 VanDerWaalsContact C-N 3.29Å; H904-T906 PolarHBondContact O-N 3.3Å; H904-T906 PolarHBondContact O-OG1 3.13Å; T906-Y908 HydrophobicContact CG2-CD2 3.66Å; T906-Y908 HydrophobicContact CG2-CE2 3.25Å; T906-Y908 PolarHBondContact O-N 3.45Å
907	L	26.2	Very low	29	Very low	159 Å²	159	152.4 Å²	152.4	83%	0.832	75%	0.751	S	S	*	*			trans	-64.3	75.4	176	-77	169.1	0	0	0	111.6	T909	L907-T909 PolarHBondContact O-N 3.37Å
908	Y	28	Very low	29.1	Very low	186 Å²	186	148.4 Å²	148.4	73%	0.729	74%	0.744	S	S	*	*			trans	-71.2	91.4	174.5	-86.3	-69	0	0	0	111.1	T906 L910	T906-Y908 HydrophobicContact CG2-CD2 3.66Å; T906-Y908 HydrophobicContact CG2-CE2 3.25Å; T906-Y908 PolarHBondContact O-N 3.45Å; Y908-L910 PolarHBondContact O-N 3.16Å
909	T	25.7	Very low	28.8	Very low	125 Å²	125	148.5 Å²	148.5	77%	0.767	75%	0.746	S	S	*	*			trans	-69.1	82.8	165.5	-58.3	0	0	0	0	108.7	L907 V911	L907-T909 PolarHBondContact O-N 3.37Å; T909-V911 PolarHBondContact O-N 3.2Å
910	L	27.1	Very low	28.9	Very low	142 Å²	142	147.9 Å²	147.9	74%	0.743	75%	0.747	S	S	*	*			trans	-72.7	93	176.6	-84.3	169.1	0	0	0	110.3	Y908 Y912	Y908-L910 PolarHBondContact O-N 3.16Å; L910-Y912 PolarHBondContact O-N 3.14Å
911	V	27.2	Very low	28.9	Very low	122 Å²	122	149.1 Å²	149.1	74%	0.739	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-63.7	118	162.5	179.1	0	0	0	0	107.9	T909 P913	T909-V911 PolarHBondContact O-N 3.2Å; V911-P913 WeakPolarHBondContact O-CD 3.46Å
912	Y	29	Very low	28.8	Very low	202 Å²	202	145.9 Å²	145.9	79%	0.792	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-61.7	125.3	174	-82.3	-91.6	0	0	0	110.5	L910	L910-Y912 PolarHBondContact O-N 3.14Å
913	P	31.1	Very low	29	Very low	122 Å²	122	146.6 Å²	146.6	79%	0.792	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-62.9	136	160.5	-14.8	29.7	0	0	0	108.8	V911	V911-P913 WeakPolarHBondContact O-CD 3.46Å
914	K	27.7	Very low	29	Very low	176 Å²	176	146.2 Å²	146.2	77%	0.765	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-74.2	154.3	164	-70.6	-173.2	177	-175.2	0	109.9
915	E	29.1	Very low	29.2	Very low	143 Å²	143	149.9 Å²	149.9	67%	0.668	76%	0.764	S	S	*	*			trans	59	106.1	152.8	-67.6	152.6	-126.4	0	0	117.7
916	H	30.5	Very low	29.3	Very low	188 Å²	188	150.6 Å²	150.6	87%	0.87	77%	0.765	S	S	*	*				-133.3	99.3	127.9	-90.7	-57.9	0	0	0	109.6
917	F	28.4	Very low	29.5	Very low	186 Å²	186	154.7 Å²	154.7	82%	0.816	78%	0.784	S	S	*	*			trans	-65	131.8	158.3	-97	-103.8	0	0	0	108.3
918	I	32.7	Very low	29.8	Very low	143 Å²	143	150.5 Å²	150.5	73%	0.733	78%	0.779	S	S	*	*			trans	-100.8	105.3	165	-62.2	179.4	0	0	0	106.9	L920	I918-L920 PolarHBondContact O-N 3.11Å
919	D	26.3	Very low	30.1	Very low	143 Å²	143	150.2 Å²	150.2	77%	0.765	79%	0.79	S	S	*	*			trans	-68.5	89.1	175.4	-84.7	-32.7	0	0	0	111	K921	D919-K921 PolarHBondContact O-N 2.99Å
920	L	33.1	Very low	30.3	Very low	161 Å²	161	151 Å²	151	84%	0.843	79%	0.789	S	S	*	*			trans	-70.9	93.6	163.9	-73.1	173.9	0	0	0	109	I918	I918-L920 PolarHBondContact O-N 3.11Å
921	K	30.9	Very low	30.7	Very low	191 Å²	191	152.2 Å²	152.2	83%	0.83	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-49.2	131.2	177.4	-68.2	179	178	176.5	0	111.2	D919 S923	D919-K921 PolarHBondContact O-N 2.99Å; K921-S923 PolarHBondContact O-N 3.31Å
922	P	28.4	Very low	30.8	Very low	120 Å²	120	151.6 Å²	151.6	78%	0.779	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70.8	125.2	178.9	28.6	-33.9	0	0	0	110.8
923	S	32.6	Very low	31.2	Very low	120 Å²	120	150.3 Å²	150.3	84%	0.839	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-81.3	120.5	164.7	45.1	0	0	0	0	109.7	K921	K921-S923 PolarHBondContact O-N 3.31Å
924	T	29.3	Very low	31.2	Very low	120 Å²	120	152.6 Å²	152.6	74%	0.736	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-79.3	121.2	-177.5	36.9	0	0	0	0	112.3
925	Y	32.8	Very low	31.4	Very low	234 Å²	234	150.3 Å²	150.3	92%	0.918	80%	0.796	S	S	*	*			trans	-133.1	139.2	149.6	-93.6	-81.6	0	0	0	109.4
926	T	30.2	Very low	31.6	Very low	109 Å²	109	149.5 Å²	149.5	67%	0.669	80%	0.801	S	S	*	*			trans	-110.1	171.4	-164.8	54.7	0	0	0	0	113.1
927	N	32.8	Very low	31.3	Very low	156 Å²	156	145.2 Å²	145.2	83%	0.834	79%	0.792	S	S	*	*			trans	78.7	120.7	175.3	-40.1	-20.2	0	0	0	113.3
928	G	31.6	Very low	31.5	Very low	71 Å²	71	143.3 Å²	143.3	73%	0.732	80%	0.796	S	S	*	*			cis	119.4	114.8	-13	0	0	0	0	0	114.9
929	L	35.8	Very low	31.1	Very low	181 Å²	181	141.6 Å²	141.6	95%	0.948	79%	0.792	S	S	*	*			trans	-160	152	143.4	-136.9	74.6	0	0	0	110.2
930	N	30	Very low	31.3	Very low	141 Å²	141	141.5 Å²	141.5	75%	0.754	80%	0.797	S	S	*	*			trans	-90.6	158.2	179	-61	-50.4	0	0	0	111.5
931	N	35.2	Very low	31	Very low	168 Å²	168	139.5 Å²	139.5	90%	0.898	79%	0.791	S	S	*	*				-157.8	155.5	121.4	-106	-29.8	0	0	0	112.3
932	T	29.4	Very low	31	Very low	108 Å²	108	136.8 Å²	136.8	66%	0.663	79%	0.791	S	S	*	*			trans	-141.3	127.1	-166.6	-51.5	0	0	0	0	111.1
933	I	37.4	Very low	31.2	Very low	175 Å²	175	137.6 Å²	137.6	90%	0.897	79%	0.794	S	S	*	*			trans	-129.2	151.3	163.1	-62.9	-175.5	0	0	0	108.2
934	K	30.8	Very low	30.9	Very low	170 Å²	170	136.7 Å²	136.7	74%	0.739	79%	0.794	S	S	*	*			trans	-120.1	-175.7	-160	-56.9	174.4	179.4	175.7	0	112.2
935	T	31.8	Very low	31	Very low	128 Å²	128	137.8 Å²	137.8	79%	0.785	80%	0.8	S	S	*	*			trans	77.3	144.4	150.6	14.8	0	0	0	0	116.1
936	T	32.7	Very low	30.7	Very low	126 Å²	126	136.3 Å²	136.3	77%	0.773	80%	0.799	S	S	*	*			cis	-142.7	150	7.8	-47.7	0	0	0	0	111.5
937	S	25.8	Very low	30.6	Very low	98 Å²	98	138.7 Å²	138.7	69%	0.685	81%	0.807	S	S	*	*			trans	-99.7	148.3	171.4	54.2	0	0	0	0	112.6
938	V	31	Very low	30.3	Very low	147 Å²	147	142.9 Å²	142.9	89%	0.891	81%	0.811	S	S	*	*			trans	-116.7	146.6	163.9	179.1	0	0	0	0	108.8
939	T	25.4	Very low	30.1	Very low	106 Å²	106	145.3 Å²	145.3	65%	0.65	82%	0.815	S	S	*	*			trans	-137.8	138.1	-169.6	-50.5	0	0	0	0	110.9	T941	T939-T941 HydrophobicContact CG2-CG2 3.99Å
940	T	30.9	Very low	29.7	Very low	142 Å²	142	145.7 Å²	145.7	87%	0.871	81%	0.811	S	S	*	*			trans	-131.1	122.7	167.4	40.5	0	0	0	0	109.8
941	T	26.8	Very low	29.5	Very low	118 Å²	118	143.2 Å²	143.2	72%	0.724	82%	0.819	S	S	*	*			trans	-117.5	124.8	-170.4	45.3	0	0	0	0	112.8	T939	T939-T941 HydrophobicContact CG2-CG2 3.99Å
942	T	30.5	Very low	29.1	Very low	135 Å²	135	138.2 Å²	138.2	83%	0.828	81%	0.807	S	S	*	*			trans	178.9	141.2	156.1	24.9	0	0	0	0	108
943	T	32.5	Very low	28.8	Very low	137 Å²	137	136 Å²	136	84%	0.84	81%	0.806	S	S	*	*			cis	-153.8	159.3	-14.9	-12.5	0	0	0	0	108
944	A	26.8	Very low	28.6	Very low	101 Å²	101	136.4 Å²	136.4	84%	0.835	80%	0.796	S	S	*	*			trans	-92.6	133.1	-173.6	0	0	0	0	0	114.3
945	T	30.9	Very low	28.5	Very low	142 Å²	142	133.7 Å²	133.7	87%	0.871	79%	0.789	S	S	*	*			trans	-127.3	139.4	157.1	48.2	0	0	0	0	109.4
946	K	26.8	Very low	28.5	Very low	203 Å²	203	129.7 Å²	129.7	88%	0.883	76%	0.761	S	S	*	*			trans	-84.8	118.9	-179	-64	175.2	-178.9	176.6	0	109.5
947	N	27.5	Very low	28.3	Very low	159 Å²	159	128.7 Å²	128.7	85%	0.85	75%	0.75	S	S	*	*			trans	170.1	106.5	144.6	-88.5	-14.1	0	0	0	110.4
948	R	26.5	Very low	28.4	Very low	244 Å²	244	127.2 Å²	127.2	92%	0.921	74%	0.744	S	S	*	*			trans	-148	110.1	163.8	-88.8	-169.4	172	178.2	-3.7	109.7
949	P	27.8	Very low	28.4	Very low	123 Å²	123	124.6 Å²	124.6	80%	0.799	73%	0.728	S	S	*	*			trans	-71.3	158.6	165.2	31.6	-33.2	0	0	0	110.4	G951	P949-G951 PolarHBondContact O-N 3.25Å
950	H	26.2	Very low	28.5	Very low	189 Å²	189	122.9 Å²	122.9	88%	0.875	73%	0.732	S	S	*	*			trans	-62.7	122.7	-168.7	-54.3	-79.6	0	0	0	113.9	G952	H950-G952 PolarHBondContact O-N 3.01Å
951	G	26.7	Very low	28.4	Very low	89 Å²	89	120.2 Å²	120.2	92%	0.918	72%	0.724	S	S	*	*			trans	-73.4	76	155.9	0	0	0	0	0	109.8	P949	P949-G951 PolarHBondContact O-N 3.25Å
952	G	26.3	Very low	28.5	Very low	63 Å²	63	125.7 Å²	125.7	65%	0.649	73%	0.732	S	S	*	*			trans	-77.9	133.2	175.8	0	0	0	0	0	111.2	H950	H950-G952 PolarHBondContact O-N 3.01Å
953	G	24.6	Very low	28.5	Very low	62 Å²	62	127.9 Å²	127.9	64%	0.639	73%	0.73	S	S	*	*			trans	-61.1	144.7	-177.7	0	0	0	0	0	113.3
954	R	32.5	Very low	28.4	Very low	182 Å²	182	128.5 Å²	128.5	69%	0.687	73%	0.728	S	S	*	*			trans	-121.3	88.6	170.5	-105.1	-177	163.1	178.6	-6.5	110.7	L957 T959	R954-L957 PolarHBondContact NE-O 3.33Å; R954-L957 PolarHBondContact NH2-O 3.26Å; R954-T959 PolarHBondContact NH2-OG1 3.38Å
955	L	28.5	Very low	28.6	Very low	114 Å²	114	131.5 Å²	131.5	60%	0.597	73%	0.729	S	S	*	*	S	Bend	trans	-49.2	147.8	145.6	-140.8	78.2	0	0	0	108.6	L957	L955-L957 WeakPolarHBondContact O-CB 3.22Å; L955-L957 PolarHBondContact O-N 2.84Å
956	F	32.4	Very low	28.5	Very low	44 Å²	44	132.4 Å²	132.4	19%	0.193	73%	0.727	C	S	.	*	S	Bend	trans	-49.9	89.6	-168.5	-77.3	-116.8	0	0	0	114.1	W130 C170 P173	W130-F956 HydrophobicContact CZ2-CZ 4.15Å; C170-F956 HydrophobicContact CB-CD2 4.48Å; C170-F956 HydrophobicContact CB-CE2 3.9Å; C170-F956 WeakPolarHBondContact O-CD1 3.35Å; C170-F956 WeakPolarHBondContact O-CD2 3.44Å; C170-F956 VanDerWaalsContact O-CE2 3.28Å; C170-F956 WeakPolarHBondContact O-CE2 3.33Å; C170-F956 WeakPolarHBondContact O-CG 3.11Å; P173-F956 HydrophobicContact CG-CB 3.78Å
957	L	27.2	Very low	28.9	Very low	105 Å²	105	133.9 Å²	133.9	55%	0.55	74%	0.742	S	S	.	*			trans	-146.6	79.8	-175.4	-76.9	178.4	0	0	0	111.5	R954 L955 T959	R954-L957 PolarHBondContact NE-O 3.33Å; R954-L957 PolarHBondContact NH2-O 3.26Å; L955-L957 WeakPolarHBondContact O-CB 3.22Å; L955-L957 PolarHBondContact O-N 2.84Å; L957-T959 HydrophobicContact CB-CG2 4.36Å; L957-T959 PolarHBondContact O-N 3.41Å
958	A	28.4	Very low	29	Very low	67 Å²	67	132.7 Å²	132.7	55%	0.554	74%	0.737	S	S	*	*			trans	-72.7	76.2	156.2	0	0	0	0	0	109.2	Q241	Q241-A958 VanDerWaalsContact OE1-CB 3.3Å
959	T	30.1	Very low	29.1	Very low	91 Å²	91	126.8 Å²	126.8	56%	0.558	73%	0.727	S	S	*	*			trans	-68.9	134.5	170.4	51.3	0	0	0	0	109.8	R954 L957	R954-T959 PolarHBondContact NH2-OG1 3.38Å; L957-T959 HydrophobicContact CB-CG2 4.36Å; L957-T959 PolarHBondContact O-N 3.41Å
960	G	28	Very low	29.2	Very low	71 Å²	71	127 Å²	127	73%	0.732	72%	0.723	S	S	*	*			trans	-60	174.8	-173.1	0	0	0	0	0	116.6
961	A	29.6	Very low	29.4	Very low	86 Å²	86	123.4 Å²	123.4	71%	0.711	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-53.8	135.3	-167.6	0	0	0	0	0	114.7
962	R	28.7	Very low	29.6	Very low	232 Å²	232	125.5 Å²	125.5	88%	0.875	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-72.6	124.3	157.6	-73.4	-178.2	172.9	177.8	-3	108.3
963	K	31.4	Very low	29.8	Very low	181 Å²	181	129.7 Å²	129.7	79%	0.787	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-85.1	118	155.2	-75.3	-176	175	178.2	0	107.2
964	D	28.9	Very low	30.2	Very low	151 Å²	151	134.5 Å²	134.5	81%	0.807	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-66.2	136.2	166.7	-65	-49.4	0	0	0	109
965	L	31.3	Very low	30	Very low	164 Å²	164	130.8 Å²	130.8	86%	0.859	71%	0.711	S	S	*	*			trans	-135.7	113.8	177.8	-126.2	170	0	0	0	108.3	I967	L965-I967 PolarHBondContact O-N 3.37Å
966	I	29.2	Very low	30.1	Very low	160 Å²	160	132.3 Å²	132.3	82%	0.821	72%	0.721	S	S	*	*			trans	-82.6	110.1	-170.4	-59.2	167.7	0	0	0	110
967	I	35.8	Very low	29.9	Very low	235 Å²	235	140.3 Å²	140.3	100%	1.205	77%	0.769	S	S	*	*			trans	-140.9	0	144.5	-58.6	-172.7	0	0	0	107.3	L965	L965-I967 PolarHBondContact O-N 3.37Å

Retrieved 967 of 967 residues in 1213 ms (Link to these results)

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