G4VEX1_SCHMA Loading...

Fanconi-associated nuclease

Nuclease required for the repair of DNA interstrand cross-links (ICL). Acts as a 5'-3' exonuclease that anchors at a cut end of DNA and cleaves DNA successively at every third nucleotide, allowing to excise an ICL from one strand through flanking incisions.

AlphaFold DB , UniProt , Accession G4VEX1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 811 aa.

						>G4VEX1_SCHMA|G4VEX1
MLKLDEIIPEDSLDSLSGSISSSLAGNTYAVESINDALLMLSRESGFSELFSESEQKWFEDFKKLSNLSKSLIIRLYGRSQKIFRKSDLMKIIPNDIDQCLRELNSLKFLCTDMLSLSSEMLVHALNRQELDQLAGMYNIKNFKSLTMIQLRDTLLKTSSVSPMASFFKVSIQSKDRFKGLIARILHGCWYVDETYTQLITQLLWLTSLGSESAYNRPNKLQSIEAIMKTELYSMMLVRRGELVFPSYVVNRKSTIYHTSDEFQKFLELMGLEIRLEYLISQKLYDLALQLCLDNKTKLIGEVTNLSFRRIDLPQFLRRFTSPYRAFRSLLLMIDIYERQRKYNEAIQLIETLLSLTWSLHNDDQFLNLKLTGCVLDQLGPCRLGYLLNRYIINQGTHEKQPIKAFKYVTNYFKLYNECQCLRAGRRLMIHEQLMKLFDGVKKGENNHRSSQNGYTTAATTTNNVTNNKPSNADDKNNASDRNGIKNTTSQVKRRKIQKPVNIHGKDYENNNDSTEGICRTNEFFIDSEKEESLTAIPSLVINIKEPPKVEITAPINASAKEIGTHRPHYVWFENTSPNKLQEHQSPQESNTLLLTVEQWTVRYYMANKNFEHGIHCESQIYHLLFCILFYDILFEISPSPPDVFYSYRQSAPLDLFTDEFYQSRKDLIDARLQWLLAVDQSDDHSNSLAFRIHTYWELHNGERCLWANWDLLKNSQELIDIFWCLGPSVVHDVCRKLATDYRNWRSGLPDLLLWSPTETRAKIVEVKGPGDHLSTQQIMWLDVLVQAGADVEICLISAEPLKSLRSKFNN
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	24.6	Very low	26	Very low	182 Å²	182	129.4 Å²	129.4	90%	0.897	66%	0.659	S	S	*	*				0	88.4	0	-78.4	-178.6	86	0	0	109	P218	M1-P218 HydrophobicContact CE-CB 3.81Å
2	L	22.8	Very low	25.9	Very low	157 Å²	157	128.3 Å²	128.3	82%	0.822	67%	0.672	S	S	*	*			trans	-67.9	145.7	170.6	-78	149.8	0	0	0	109.5	L4	L2-L4 PolarHBondContact O-N 2.92Å
3	K	22.6	Very low	26	Very low	139 Å²	139	132.2 Å²	132.2	60%	0.604	69%	0.692	S	S	*	*			trans	-63.2	108	176.5	-73.4	176.7	179.9	173	0	108.3	D5 E6	K3-D5 PolarHBondContact O-N 3.36Å; K3-D5 VanDerWaalsContact O-N 3.08Å; K3-E6 PolarHBondContact O-N 3.3Å; K3-E6 VanDerWaalsContact O-N 3.1Å
4	L	30.3	Very low	25.9	Very low	73 Å²	73	133.6 Å²	133.6	38%	0.382	70%	0.701	S	S	.	*	G	3₁₀ helix	trans	-62	-12	179.7	-91.1	138.8	0	0	0	114	L2 E6 I7 P218 L221	L2-L4 PolarHBondContact O-N 2.92Å; L4-E6 VanDerWaalsContact C-N 3.26Å; L4-E6 PolarHBondContact O-N 2.79Å; L4-I7 HydrophobicContact CD2-CD1 4.33Å; L4-P218 HydrophobicContact CD1-CG 4.48Å; L4-L221 HydrophobicContact CD1-CD2 4.22Å
5	D	26.2	Very low	25.8	Very low	155 Å²	155	131.9 Å²	131.9	83%	0.829	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-78.9	-8.1	175.2	-59.5	-34.3	0	0	0	113	K3	K3-D5 PolarHBondContact O-N 3.36Å; K3-D5 VanDerWaalsContact O-N 3.08Å
6	E	27.4	Very low	25.7	Very low	145 Å²	145	133.6 Å²	133.6	68%	0.678	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-110.1	4	179.2	-77.1	173.1	-177.7	0	0	114	K3 L4 I8	K3-E6 PolarHBondContact O-N 3.3Å; K3-E6 VanDerWaalsContact O-N 3.1Å; L4-E6 VanDerWaalsContact C-N 3.26Å; L4-E6 PolarHBondContact O-N 2.79Å; E6-I8 PolarHBondContact O-N 2.89Å
7	I	27.6	Very low	25.8	Very low	89 Å²	89	133.3 Å²	133.3	46%	0.456	72%	0.723	S	S	.	*			trans	-81.8	71	170.4	-52	178.7	0	0	0	108.7	L4	L4-I7 HydrophobicContact CD2-CD1 4.33Å
8	I	27	Very low	25.9	Very low	147 Å²	147	130.4 Å²	130.4	75%	0.754	73%	0.73	S	S	*	*			trans	-83.3	117	146.2	-59.7	173.9	0	0	0	104.4	E6 E10	E6-I8 PolarHBondContact O-N 2.89Å; I8-E10 PolarHBondContact O-N 2.84Å
9	P	27.3	Very low	25.9	Very low	78 Å²	78	128.4 Å²	128.4	51%	0.506	73%	0.725	S	S	.	*			trans	-72.8	132	171.2	28	-26.4	0	0	0	108.8
10	E	26.9	Very low	26.3	Very low	88 Å²	88	128.7 Å²	128.7	41%	0.411	72%	0.723	S	S	.	*			trans	91	89.2	161.1	-59.6	170.8	-163.2	0	0	117.2	I8 S22 S23	I8-E10 PolarHBondContact O-N 2.84Å; E10-S22 WeakPolarHBondContact OE1-CB 3.33Å; E10-S22 PolarHBondContact OE1-OG 3.34Å; E10-S22 WeakPolarHBondContact OE2-CB 3Å; E10-S22 PolarHBondContact OE2-OG 3.5Å; E10-S23 PolarHBondContact OE1-N 3.33Å; E10-S23 PolarHBondContact OE2-N 2.92Å
11	D	23.6	Very low	26.7	Very low	170 Å²	170	125.6 Å²	125.6	91%	0.909	71%	0.71	S	S	*	*	S	Bend	trans	-148.1	81	139	-90.9	-29.4	0	0	0	107.8
12	S	25	Very low	27.6	Very low	116 Å²	116	120.1 Å²	120.1	81%	0.811	69%	0.69	S	S	*	*			trans	170.2	87.4	156.5	38.5	0	0	0	0	109.9
13	L	26.9	Very low	29	Very low	179 Å²	179	114.4 Å²	114.4	94%	0.937	66%	0.663	S	S	*	*			trans	-157.3	100.1	150	-105.3	154.7	0	0	0	107.3
14	D	24.6	Very low	30.3	Very low	153 Å²	153	111.9 Å²	111.9	82%	0.818	66%	0.656	S	S	*	*			trans	-60.3	143.3	174.4	-83.6	-47	0	0	0	111.9
15	S	24.3	Very low	31.4	Very low	108 Å²	108	110.5 Å²	110.5	76%	0.755	66%	0.655	S	S	*	*			trans	50.5	86.8	151.3	65.6	0	0	0	0	118.1
16	L	24.9	Very low	32.9	Very low	159 Å²	159	103.5 Å²	103.5	83%	0.832	62%	0.619	S	S	*	*			trans	-144.5	104.2	141.8	-102.5	143.3	0	0	0	108.3	G18	L16-G18 PolarHBondContact O-N 3.28Å; L16-G18 VanDerWaalsContact O-N 3.13Å
17	S	26.1	Very low	35	Very low	128 Å²	128	97.1 Å²	97.1	90%	0.895	59%	0.59	S	S	*	*	S	Bend	trans	-61.8	110	172.9	50.6	0	0	0	0	109.5
18	G	27.7	Very low	37.6	Very low	81 Å²	81	95.9 Å²	95.9	84%	0.835	59%	0.586	S	S	*	*	S	Bend	trans	116.7	62.3	170.2	0	0	0	0	0	114.2	L16	L16-G18 PolarHBondContact O-N 3.28Å; L16-G18 VanDerWaalsContact O-N 3.13Å
19	S	27.2	Very low	40.4	Very low	93 Å²	93	92.9 Å²	92.9	65%	0.65	57%	0.566	S	S	*	*			trans	-145.8	139	166	64.9	0	0	0	0	111.3	S21	S19-S21 PolarHBondContact O-N 3.07Å; S19-S21 VanDerWaalsContact O-N 3.13Å
20	I	32.3	Very low	43.2	Very low	133 Å²	133	89.5 Å²	89.5	68%	0.682	55%	0.545	S	S	*	.			trans	-48.4	118.8	163	-65.2	163	0	0	0	106.1	S22 L24	I20-S22 PolarHBondContact O-N 3.38Å; I20-L24 HydrophobicContact CG2-CB 3.82Å; I20-L24 HydrophobicContact CG2-CD2 3.74Å; I20-L24 HydrophobicContact CG2-CG 4.43Å
21	S	35.3	Very low	46.2	Very low	64 Å²	64	85.4 Å²	85.4	45%	0.448	53%	0.526	S	S	.	.			trans	-35.3	125.8	-177.8	167	0	0	0	0	111	S19 S23 L24	S19-S21 PolarHBondContact O-N 3.07Å; S19-S21 VanDerWaalsContact O-N 3.13Å; S21-S23 PolarHBondContact O-N 2.87Å; S21-S23 WeakPolarHBondContact OG-CB 3.28Å; S21-S23 PolarHBondContact OG-N 3.12Å; S21-S23 PolarHBondContact OG-OG 2.88Å; S21-L24 WeakPolarHBondContact O-CB 3.4Å; S21-L24 PolarHBondContact O-N 3.43Å
22	S	44.5	Very low	49.4	Very low	67 Å²	67	80.8 Å²	80.8	47%	0.469	50%	0.499	S	S	.	.	H	α-helix	trans	-42.5	-32.3	173.7	38.6	0	0	0	0	113.2	E10 I20 L24 A25 G26	E10-S22 WeakPolarHBondContact OE1-CB 3.33Å; E10-S22 PolarHBondContact OE1-OG 3.34Å; E10-S22 WeakPolarHBondContact OE2-CB 3Å; E10-S22 PolarHBondContact OE2-OG 3.5Å; I20-S22 PolarHBondContact O-N 3.38Å; S22-L24 VanDerWaalsContact C-N 3.32Å; S22-L24 PolarHBondContact O-N 3.2Å; S22-A25 PolarHBondContact O-N 3.33Å; S22-G26 PolarHBondContact O-N 2.96Å
23	S	51.4	Low	52.6	Low	38 Å²	38	75.4 Å²	75.4	27%	0.266	46%	0.461	S	S	.	.	H	α-helix	trans	-61.1	-31.4	174.1	80.7	0	0	0	0	115.2	E10 S21 N27 R75	E10-S23 PolarHBondContact OE1-N 3.33Å; E10-S23 PolarHBondContact OE2-N 2.92Å; S21-S23 PolarHBondContact O-N 2.87Å; S21-S23 WeakPolarHBondContact OG-CB 3.28Å; S21-S23 PolarHBondContact OG-N 3.12Å; S21-S23 PolarHBondContact OG-OG 2.88Å; S23-N27 PolarHBondContact O-N 2.93Å; S23-R75 PolarHBondContact O-NH2 3.29Å; S23-R75 VanDerWaalsContact O-NH2 3.13Å
24	L	50.6	Low	55.7	Low	86 Å²	86	67 Å²	67	45%	0.45	42%	0.417	S	S	.	.	H	α-helix	trans	-82.6	-38.8	-179.7	-139.7	83.8	0	0	0	111.4	I20 S21 S22 G26 N27 T28	I20-L24 HydrophobicContact CG2-CB 3.82Å; I20-L24 HydrophobicContact CG2-CD2 3.74Å; I20-L24 HydrophobicContact CG2-CG 4.43Å; S21-L24 WeakPolarHBondContact O-CB 3.4Å; S21-L24 PolarHBondContact O-N 3.43Å; S22-L24 VanDerWaalsContact C-N 3.32Å; S22-L24 PolarHBondContact O-N 3.2Å; L24-G26 VanDerWaalsContact C-N 3.32Å; L24-G26 PolarHBondContact O-N 3.45Å; L24-N27 PolarHBondContact O-N 3.15Å; L24-T28 PolarHBondContact O-N 2.66Å; L24-T28 VanDerWaalsContact O-N 3.11Å; L24-T28 PolarHBondContact O-OG1 3Å
25	A	52.6	Low	59	Low	44 Å²	44	61.9 Å²	61.9	36%	0.364	39%	0.39	S	S	.	.	H	α-helix	trans	-61.4	-43.2	172.5	0	0	0	0	0	110.6	S22 N27 T28 Y29	S22-A25 PolarHBondContact O-N 3.33Å; A25-N27 VanDerWaalsContact C-N 3.32Å; A25-N27 PolarHBondContact O-N 3.44Å; A25-T28 WeakPolarHBondContact O-CB 3.49Å; A25-T28 PolarHBondContact O-N 3.13Å; A25-T28 VanDerWaalsContact O-N 3.13Å; A25-Y29 WeakPolarHBondContact O-CD2 3.31Å; A25-Y29 PolarHBondContact O-N 3.46Å
26	G	58.8	Low	62.1	Low	7 Å²	7	60.4 Å²	60.4	7%	0.072	37%	0.373	C	S	.	.	H	α-helix	trans	-62.4	-35.2	174.7	0	0	0	0	0	114.6	S22 L24 T28 A30	S22-G26 PolarHBondContact O-N 2.96Å; L24-G26 VanDerWaalsContact C-N 3.32Å; L24-G26 PolarHBondContact O-N 3.45Å; G26-T28 VanDerWaalsContact C-N 3.33Å; G26-A30 PolarHBondContact O-N 3.43Å
27	N	70.4	Confident	65.3	Low	12 Å²	12	53 Å²	53	6%	0.064	34%	0.335	C	S	.	.	H	α-helix	trans	-66.5	-35.2	173.6	-84.3	-17.4	0	0	0	112.5	S23 L24 A25 A30 V31 R75	S23-N27 PolarHBondContact O-N 2.93Å; L24-N27 PolarHBondContact O-N 3.15Å; A25-N27 VanDerWaalsContact C-N 3.32Å; A25-N27 PolarHBondContact O-N 3.44Å; N27-A30 PolarHBondContact O-N 2.83Å; N27-V31 WeakPolarHBondContact O-CG2 3.44Å; N27-V31 PolarHBondContact O-N 2.68Å; N27-R75 PolarHBondContact OD1-NE 3.43Å; N27-R75 PolarHBondContact OD1-NH2 3.1Å
28	T	81.7	Confident	68.6	Low	62 Å²	62	47.3 Å²	47.3	38%	0.38	30%	0.295	S	S	.	.	H	α-helix	trans	-61.4	-50.7	-178.1	-54.3	0	0	0	0	110.9	L24 A25 G26 A30 V31 E32	L24-T28 PolarHBondContact O-N 2.66Å; L24-T28 VanDerWaalsContact O-N 3.11Å; L24-T28 PolarHBondContact O-OG1 3Å; A25-T28 WeakPolarHBondContact O-CB 3.49Å; A25-T28 PolarHBondContact O-N 3.13Å; A25-T28 VanDerWaalsContact O-N 3.13Å; G26-T28 VanDerWaalsContact C-N 3.33Å; T28-A30 VanDerWaalsContact C-N 3.3Å; T28-A30 PolarHBondContact O-N 3.14Å; T28-V31 PolarHBondContact O-N 3.42Å; T28-E32 WeakPolarHBondContact O-CG 3.32Å; T28-E32 PolarHBondContact O-N 3.3Å
29	Y	85.6	Confident	71.6	Confident	84 Å²	84	46.5 Å²	46.5	33%	0.329	27%	0.271	S	S	.	.	H	α-helix	trans	-60	-38.5	176.7	-66.7	-67.2	0	0	0	112.9	A25 E32 S33 R239 R240	A25-Y29 WeakPolarHBondContact O-CD2 3.31Å; A25-Y29 PolarHBondContact O-N 3.46Å; Y29-E32 PolarHBondContact O-N 2.92Å; Y29-S33 PolarHBondContact O-N 3.23Å; Y29-S33 PolarHBondContact O-OG 2.89Å; Y29-R239 HydrophobicContact CD1-CB 4Å; Y29-R240 HydrophobicContact CD1-CG 4.31Å; Y29-R240 HydrophobicContact CD2-CG 3.64Å; Y29-R240 HydrophobicContact CE1-CG 4.32Å; Y29-R240 HydrophobicContact CE2-CG 3.66Å; Y29-R240 HydrophobicContact CG-CG 3.97Å
30	A	86.1	Confident	74.6	Confident	7 Å²	7	43.6 Å²	43.6	6%	0.058	25%	0.247	C	C	.	.	H	α-helix	trans	-68.3	-38.4	178.1	0	0	0	0	0	112.4	G26 N27 T28 E32 S33 I34 I74	G26-A30 PolarHBondContact O-N 3.43Å; N27-A30 PolarHBondContact O-N 2.83Å; T28-A30 VanDerWaalsContact C-N 3.3Å; T28-A30 PolarHBondContact O-N 3.14Å; A30-E32 VanDerWaalsContact C-N 3.33Å; A30-S33 WeakPolarHBondContact O-CB 3.21Å; A30-S33 PolarHBondContact O-N 3.45Å; A30-I34 PolarHBondContact O-N 3.37Å; A30-I34 VanDerWaalsContact O-N 3.14Å; A30-I74 VanDerWaalsContact C-CD1 3.46Å; A30-I74 HydrophobicContact CB-CD1 3.89Å; A30-I74 HydrophobicContact CB-CG2 4.07Å
31	V	91	Very high	77.4	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.012	22%	0.218	C	C	.	.	H	α-helix	trans	-61.8	-44.3	173.7	168.7	0	0	0	0	110.8	N27 T28 I34 N35 N67 K70 S71 I74	N27-V31 WeakPolarHBondContact O-CG2 3.44Å; N27-V31 PolarHBondContact O-N 2.68Å; T28-V31 PolarHBondContact O-N 3.42Å; V31-I34 PolarHBondContact O-N 3.08Å; V31-N35 PolarHBondContact O-N 3.37Å; V31-N35 PolarHBondContact O-ND2 3.46Å; V31-N67 HydrophobicContact CG1-CB 4.21Å; V31-K70 HydrophobicContact CB-CB 4.48Å; V31-K70 HydrophobicContact CG1-CB 3.92Å; V31-K70 HydrophobicContact CG1-CD 3.85Å; V31-K70 HydrophobicContact CG2-CB 3.85Å; V31-S71 VanDerWaalsContact CG2-OG 3.26Å; V31-S71 WeakPolarHBondContact CG2-OG 3.29Å; V31-I74 HydrophobicContact CB-CD1 4.31Å; V31-I74 HydrophobicContact CG2-CD1 3.7Å
32	E	91.6	Very high	79.9	Confident	73 Å²	73	37.9 Å²	37.9	34%	0.341	22%	0.218	S	C	.	.	H	α-helix	trans	-66.9	-37.7	178.6	-65.3	174.6	-179.1	0	0	112.1	T28 Y29 A30 I34 N35 D36 R239	T28-E32 WeakPolarHBondContact O-CG 3.32Å; T28-E32 PolarHBondContact O-N 3.3Å; Y29-E32 PolarHBondContact O-N 2.92Å; A30-E32 VanDerWaalsContact C-N 3.33Å; E32-I34 VanDerWaalsContact C-N 3.3Å; E32-I34 PolarHBondContact O-N 3.5Å; E32-N35 WeakPolarHBondContact O-CB 3.05Å; E32-N35 PolarHBondContact O-N 2.91Å; E32-N35 VanDerWaalsContact O-N 3.08Å; E32-D36 PolarHBondContact O-N 2.93Å; E32-R239 PolarHBondContact O-NH2 3.25Å; E32-R239 IonicContact OE2-CZ 2.68Å; E32-R239 IonicContact OE2-NH1 2.6Å; E32-R239 PolarHBondContact OE2-NH1 3.34Å
33	S	91	Very high	81.9	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-57.1	-41.4	170.9	-61.2	0	0	0	0	112.6	Y29 A30 D36 A37 M235 R239	Y29-S33 PolarHBondContact O-N 3.23Å; Y29-S33 PolarHBondContact O-OG 2.89Å; A30-S33 WeakPolarHBondContact O-CB 3.21Å; A30-S33 PolarHBondContact O-N 3.45Å; S33-D36 PolarHBondContact O-N 3.28Å; S33-A37 PolarHBondContact O-N 3.45Å; S33-A37 VanDerWaalsContact O-N 3.11Å; S33-M235 WeakPolarHBondContact OG-CB 3.48Å; S33-R239 WeakPolarHBondContact OG-CD 3.43Å
34	I	92.1	Very high	83.5	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.015	23%	0.231	C	C	.	.	H	α-helix	trans	-66.1	-40.3	174.6	-72	-167.7	0	0	0	111.1	A30 V31 E32 D36 A37 L38 F62 I74 L232	A30-I34 PolarHBondContact O-N 3.37Å; A30-I34 VanDerWaalsContact O-N 3.14Å; V31-I34 PolarHBondContact O-N 3.08Å; E32-I34 VanDerWaalsContact C-N 3.3Å; E32-I34 PolarHBondContact O-N 3.5Å; I34-D36 VanDerWaalsContact C-N 3.28Å; I34-D36 PolarHBondContact O-N 3.2Å; I34-A37 WeakPolarHBondContact O-CB 3.21Å; I34-A37 PolarHBondContact O-N 3.18Å; I34-L38 HydrophobicContact CG2-CD1 4.06Å; I34-L38 HydrophobicContact CG2-CG 4.43Å; I34-L38 WeakPolarHBondContact O-CG 3.47Å; I34-L38 PolarHBondContact O-N 3.29Å; I34-F62 HydrophobicContact CD1-CZ 4.39Å; I34-F62 HydrophobicContact CG2-CE1 3.87Å; I34-F62 HydrophobicContact CG2-CZ 3.7Å; I34-I74 HydrophobicContact CD1-CD1 3.73Å; I34-I74 HydrophobicContact CD1-CG1 3.36Å; I34-I74 HydrophobicContact CG1-CD1 4.26Å; I34-I74 HydrophobicContact CG1-CG1 4.33Å; I34-L232 HydrophobicContact CD1-CD2 4.48Å; I34-L232 HydrophobicContact CG1-CD1 3.9Å
35	N	92.9	Very high	84.6	Confident	45 Å²	45	44.9 Å²	44.9	24%	0.241	24%	0.239	C	C	.	.	H	α-helix	trans	-62.3	-37.4	176.9	-68	-36.5	0	0	0	111.6	V31 E32 L38 L39 K70	V31-N35 PolarHBondContact O-N 3.37Å; V31-N35 PolarHBondContact O-ND2 3.46Å; E32-N35 WeakPolarHBondContact O-CB 3.05Å; E32-N35 PolarHBondContact O-N 2.91Å; E32-N35 VanDerWaalsContact O-N 3.08Å; N35-L38 PolarHBondContact O-N 2.88Å; N35-L39 WeakPolarHBondContact O-CB 3.38Å; N35-L39 PolarHBondContact O-N 3.36Å; N35-K70 PolarHBondContact OD1-NZ 3.18Å
36	D	90.5	Very high	86.1	Confident	78 Å²	78	44.1 Å²	44.1	42%	0.417	24%	0.235	S	C	.	.	H	α-helix	trans	-63.7	-42.4	173.8	-66	-16.1	0	0	0	111.6	E32 S33 I34 L39 M40 R239	E32-D36 PolarHBondContact O-N 2.93Å; S33-D36 PolarHBondContact O-N 3.28Å; I34-D36 VanDerWaalsContact C-N 3.28Å; I34-D36 PolarHBondContact O-N 3.2Å; D36-L39 PolarHBondContact O-N 3.15Å; D36-M40 WeakPolarHBondContact O-CB 3.31Å; D36-M40 PolarHBondContact O-N 2.95Å; D36-R239 IonicContact OD1-NH2 2.59Å; D36-R239 PolarHBondContact OD1-NH2 2.85Å; D36-R239 IonicContact OD2-CZ 2.88Å; D36-R239 IonicContact OD2-NE 2.67Å; D36-R239 PolarHBondContact OD2-NE 3.38Å; D36-R239 IonicContact OD2-NH2 3.13Å; D36-R239 PolarHBondContact OD2-NH2 2.89Å
37	A	92.6	Very high	87.7	Confident	4 Å²	4	44.6 Å²	44.6	3%	0.033	24%	0.235	C	C	.	.	H	α-helix	trans	-60.7	-46.3	176.1	0	0	0	0	0	111.3	S33 I34 L39 M40 L41 L203 L204 T207	S33-A37 PolarHBondContact O-N 3.45Å; S33-A37 VanDerWaalsContact O-N 3.11Å; I34-A37 WeakPolarHBondContact O-CB 3.21Å; I34-A37 PolarHBondContact O-N 3.18Å; A37-L39 VanDerWaalsContact C-N 3.33Å; A37-L39 PolarHBondContact O-N 3.28Å; A37-M40 PolarHBondContact O-N 2.87Å; A37-L41 PolarHBondContact O-N 3.39Å; A37-L203 HydrophobicContact CB-CD1 4.32Å; A37-L203 HydrophobicContact CB-CD2 4.4Å; A37-L203 HydrophobicContact CB-CG 4.19Å; A37-L204 HydrophobicContact CB-CD2 4.35Å; A37-T207 HydrophobicContact CB-CG2 3.98Å; A37-T207 WeakPolarHBondContact O-CG2 3.38Å
38	L	94.1	Very high	88.7	Confident	8 Å²	8	45.7 Å²	45.7	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-60.9	-41.1	175.3	-71.6	168.2	0	0	0	111.9	I34 N35 M40 L41 S42 F59 F62 K63 L203	I34-L38 HydrophobicContact CG2-CD1 4.06Å; I34-L38 HydrophobicContact CG2-CG 4.43Å; I34-L38 WeakPolarHBondContact O-CG 3.47Å; I34-L38 PolarHBondContact O-N 3.29Å; N35-L38 PolarHBondContact O-N 2.88Å; L38-M40 VanDerWaalsContact C-N 3.34Å; L38-L41 PolarHBondContact O-N 2.85Å; L38-S42 PolarHBondContact O-N 3.19Å; L38-F59 HydrophobicContact CD2-CB 4.02Å; L38-F59 HydrophobicContact CD2-CD1 3.79Å; L38-F59 HydrophobicContact CD2-CG 4.26Å; L38-F62 HydrophobicContact CD1-CD1 4.19Å; L38-F62 HydrophobicContact CD1-CE1 4.42Å; L38-F62 HydrophobicContact CD2-CD1 4.16Å; L38-K63 HydrophobicContact CD1-CB 4.14Å; L38-L203 HydrophobicContact CD2-CD2 3.56Å; L38-L203 HydrophobicContact CG-CD2 3.93Å
39	L	92.3	Very high	89.3	Confident	63 Å²	63	49.5 Å²	49.5	33%	0.33	26%	0.257	S	S	.	.	H	α-helix	trans	-63.5	-42.2	176	-177.9	63.8	0	0	0	111.1	N35 D36 A37 S42 R43	N35-L39 WeakPolarHBondContact O-CB 3.38Å; N35-L39 PolarHBondContact O-N 3.36Å; D36-L39 PolarHBondContact O-N 3.15Å; A37-L39 VanDerWaalsContact C-N 3.33Å; A37-L39 PolarHBondContact O-N 3.28Å; L39-S42 PolarHBondContact O-N 3.06Å; L39-S42 PolarHBondContact O-OG 2.6Å; L39-R43 WeakPolarHBondContact O-CG 3.39Å; L39-R43 PolarHBondContact O-N 3.48Å
40	M	89.9	Confident	89.7	Confident	32 Å²	32	45.8 Å²	45.8	16%	0.158	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-40.2	178.7	-166.8	175.1	120.6	0	0	112	D36 A37 L38 S42 R43 E44 F47 T207 R252	D36-M40 WeakPolarHBondContact O-CB 3.31Å; D36-M40 PolarHBondContact O-N 2.95Å; A37-M40 PolarHBondContact O-N 2.87Å; L38-M40 VanDerWaalsContact C-N 3.34Å; M40-S42 PolarHBondContact O-N 2.88Å; M40-R43 PolarHBondContact O-N 3.33Å; M40-R43 VanDerWaalsContact O-N 3.11Å; M40-E44 HydrophobicContact CG-CG 4.15Å; M40-E44 PolarHBondContact O-N 3.28Å; M40-F47 HydrophobicContact CE-CD2 4.3Å; M40-F47 HydrophobicContact CE-CE2 3.56Å; M40-T207 HydrophobicContact CB-CG2 4.1Å; M40-T207 VanDerWaalsContact CE-CA 3.43Å; M40-T207 HydrophobicContact CE-CG2 3.91Å; M40-T207 HydrophobicContact CG-CG2 4.43Å; M40-T207 HydrophobicContact SD-CG2 4.3Å; M40-R252 VanDerWaalsContact CE-NH2 3.31Å
41	L	91.1	Very high	90.2	Very high	13 Å²	13	45.8 Å²	45.8	7%	0.068	24%	0.242	C	C	.	.	H	α-helix	trans	-54.8	-40.7	173.2	178.4	65	0	0	0	112	A37 L38 F47 F51 F59 L203	A37-L41 PolarHBondContact O-N 3.39Å; L38-L41 PolarHBondContact O-N 2.85Å; L41-F47 HydrophobicContact CD1-CB 3.79Å; L41-F51 HydrophobicContact CD1-CD2 3.96Å; L41-F51 HydrophobicContact CD1-CE2 3.57Å; L41-F51 HydrophobicContact CD2-CE2 4.47Å; L41-F59 HydrophobicContact CD2-CB 4.31Å; L41-F59 HydrophobicContact CD2-CD1 4.45Å; L41-F59 HydrophobicContact CD2-CD2 3.53Å; L41-F59 HydrophobicContact CD2-CE2 3.86Å; L41-F59 HydrophobicContact CD2-CG 3.86Å; L41-F59 HydrophobicContact CD2-CZ 4.46Å; L41-L203 HydrophobicContact CB-CD1 3.77Å; L41-L203 HydrophobicContact CD2-CD1 3.91Å; L41-L203 HydrophobicContact CG-CD1 4.31Å
42	S	86.2	Confident	90.4	Very high	65 Å²	65	48 Å²	48	46%	0.455	26%	0.257	S	S	.	.	H	α-helix	trans	-76.3	-20.3	179.9	68.5	0	0	0	0	114.7	L38 L39 M40	L38-S42 PolarHBondContact O-N 3.19Å; L39-S42 PolarHBondContact O-N 3.06Å; L39-S42 PolarHBondContact O-OG 2.6Å; M40-S42 PolarHBondContact O-N 2.88Å
43	R	87.4	Confident	90.6	Very high	187 Å²	187	52.7 Å²	52.7	71%	0.706	28%	0.28	S	S	*	.	H	α-helix	trans	-92.1	-31.7	-177.6	-74.4	-179.2	175.6	-175.9	-0.5	112.9	L39 M40 S45	L39-R43 WeakPolarHBondContact O-CG 3.39Å; L39-R43 PolarHBondContact O-N 3.48Å; M40-R43 PolarHBondContact O-N 3.33Å; M40-R43 VanDerWaalsContact O-N 3.11Å; R43-S45 PolarHBondContact O-N 3.25Å
44	E	85.1	Confident	90.9	Very high	63 Å²	63	56.7 Å²	56.7	29%	0.294	31%	0.307	S	S	.	.			trans	-90.5	100.8	-179	-66.1	-68.3	174.5	0	0	109.6	M40 G46 F47 R252	M40-E44 HydrophobicContact CG-CG 4.15Å; M40-E44 PolarHBondContact O-N 3.28Å; E44-G46 VanDerWaalsContact C-N 3.27Å; E44-G46 PolarHBondContact O-N 3.38Å; E44-F47 HydrophobicContact CB-CB 4.2Å; E44-F47 HydrophobicContact CB-CD2 3.82Å; E44-F47 HydrophobicContact CB-CE2 4.34Å; E44-F47 HydrophobicContact CB-CG 3.91Å; E44-F47 HydrophobicContact CG-CD2 4.23Å; E44-F47 HydrophobicContact CG-CE2 4.34Å; E44-F47 PolarHBondContact O-N 2.71Å; E44-R252 IonicContact OE1-CZ 3.81Å; E44-R252 IonicContact OE1-NH1 2.84Å; E44-R252 PolarHBondContact OE1-NH1 3.36Å
45	S	74	Confident	91.1	Very high	88 Å²	88	59.1 Å²	59.1	62%	0.615	32%	0.319	S	S	*	.	H	α-helix	trans	-52.7	-44.3	-172.2	56.3	0	0	0	0	112.5	R43 F47 S48 E49	R43-S45 PolarHBondContact O-N 3.25Å; S45-F47 VanDerWaalsContact C-N 3.28Å; S45-F47 PolarHBondContact O-N 2.89Å; S45-S48 PolarHBondContact O-OG 3.49Å; S45-E49 WeakPolarHBondContact O-CG 3.37Å
46	G	84.4	Confident	91.2	Very high	28 Å²	28	60.5 Å²	60.5	29%	0.289	32%	0.324	S	S	.	.	H	α-helix	trans	-69.9	-14.6	-179.5	0	0	0	0	0	115.7	E44	E44-G46 VanDerWaalsContact C-N 3.27Å; E44-G46 PolarHBondContact O-N 3.38Å
47	F	91.7	Very high	91.4	Very high	17 Å²	17	63.5 Å²	63.5	8%	0.075	33%	0.333	C	S	.	.	H	α-helix	trans	-84	-41.2	178.1	-71.5	0.3	0	0	0	111.8	M40 L41 E44 S45 E49 L50 F51 L206 L209 Y646	M40-F47 HydrophobicContact CE-CD2 4.3Å; M40-F47 HydrophobicContact CE-CE2 3.56Å; L41-F47 HydrophobicContact CD1-CB 3.79Å; E44-F47 HydrophobicContact CB-CB 4.2Å; E44-F47 HydrophobicContact CB-CD2 3.82Å; E44-F47 HydrophobicContact CB-CE2 4.34Å; E44-F47 HydrophobicContact CB-CG 3.91Å; E44-F47 HydrophobicContact CG-CD2 4.23Å; E44-F47 HydrophobicContact CG-CE2 4.34Å; E44-F47 PolarHBondContact O-N 2.71Å; S45-F47 VanDerWaalsContact C-N 3.28Å; S45-F47 PolarHBondContact O-N 2.89Å; F47-E49 PolarHBondContact O-N 2.9Å; F47-L50 WeakPolarHBondContact O-CB 3.41Å; F47-L50 PolarHBondContact O-N 2.91Å; F47-F51 VanDerWaalsContact O-CD2 3.27Å; F47-F51 WeakPolarHBondContact O-CD2 3.21Å; F47-F51 WeakPolarHBondContact O-CE2 3.49Å; F47-L206 HydrophobicContact CB-CD1 4.43Å; F47-L206 HydrophobicContact CD2-CB 4.1Å; F47-L206 HydrophobicContact CE2-CB 4.15Å; F47-L206 WeakPolarHBondContact CE2-O 3.39Å; F47-L206 HydrophobicContact CG-CB 4.48Å; F47-L209 HydrophobicContact CE1-CD1 4.32Å; F47-L209 HydrophobicContact CZ-CD1 3.99Å; F47-Y646 HydrophobicContact CZ-CE1 4.44Å
48	S	91.6	Very high	91.7	Very high	35 Å²	35	64.1 Å²	64.1	25%	0.245	33%	0.334	C	S	.	.	H	α-helix	trans	-60.8	-36	178.5	66.3	0	0	0	0	112.2	S45 L50 F51 Q56	S45-S48 PolarHBondContact O-OG 3.49Å; S48-L50 PolarHBondContact O-N 3.4Å; S48-F51 PolarHBondContact O-N 3.45Å; S48-F51 VanDerWaalsContact O-N 3.13Å; S48-Q56 PolarHBondContact O-NE2 3.11Å
49	E	93	Very high	91.8	Very high	141 Å²	141	63.9 Å²	63.9	66%	0.659	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-15.7	179.6	-67.2	171.4	-169.1	0	0	113.9	S45 F47 F51	S45-E49 WeakPolarHBondContact O-CG 3.37Å; F47-E49 PolarHBondContact O-N 2.9Å; E49-F51 VanDerWaalsContact C-N 3.25Å; E49-F51 PolarHBondContact O-N 2.88Å
50	L	95.7	Very high	91.9	Very high	6 Å²	6	65.1 Å²	65.1	3%	0.031	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-11.9	175.7	-60.7	176.3	0	0	0	113.1	F47 S48 L206 Y257 S260 F263	F47-L50 WeakPolarHBondContact O-CB 3.41Å; F47-L50 PolarHBondContact O-N 2.91Å; S48-L50 PolarHBondContact O-N 3.4Å; L50-L206 HydrophobicContact CD1-CD1 3.96Å; L50-L206 HydrophobicContact CD1-CD2 3.85Å; L50-Y257 HydrophobicContact CD1-CD2 4.14Å; L50-S260 VanDerWaalsContact O-CB 3.23Å; L50-S260 WeakPolarHBondContact O-CB 3.26Å; L50-S260 PolarHBondContact O-OG 3.12Å; L50-F263 HydrophobicContact CB-CD1 4.26Å; L50-F263 HydrophobicContact CD1-CB 4.38Å; L50-F263 HydrophobicContact CD1-CD1 4.11Å; L50-F263 HydrophobicContact CD1-CG 4.22Å; L50-F263 HydrophobicContact CD2-CB 4.41Å
51	F	95.9	Very high	92.3	Very high	7 Å²	7	66.4 Å²	66.4	3%	0.031	35%	0.345	C	S	.	.	S	Bend	trans	-112.3	142	-178.2	-58.9	-84	0	0	0	110.8	L41 F47 S48 E49 E55 Q56 F59 L199 Q202 L206 F263	L41-F51 HydrophobicContact CD1-CD2 3.96Å; L41-F51 HydrophobicContact CD1-CE2 3.57Å; L41-F51 HydrophobicContact CD2-CE2 4.47Å; F47-F51 VanDerWaalsContact O-CD2 3.27Å; F47-F51 WeakPolarHBondContact O-CD2 3.21Å; F47-F51 WeakPolarHBondContact O-CE2 3.49Å; S48-F51 PolarHBondContact O-N 3.45Å; S48-F51 VanDerWaalsContact O-N 3.13Å; E49-F51 VanDerWaalsContact C-N 3.25Å; E49-F51 PolarHBondContact O-N 2.88Å; F51-E55 HydrophobicContact CB-CB 4Å; F51-E55 HydrophobicContact CD1-CB 4.38Å; F51-Q56 HydrophobicContact CB-CG 4.01Å; F51-Q56 PolarHBondContact O-NE2 2.89Å; F51-F59 AromaticContact CD1-CE2 3.67Å; F51-F59 HydrophobicContact CD1-CE2 3.67Å; F51-F59 HydrophobicContact CD1-CZ 4.24Å; F51-F59 HydrophobicContact CD2-CE2 4.27Å; F51-F59 AromaticContact CE1-CE2 3.72Å; F51-F59 HydrophobicContact CE1-CE2 3.72Å; F51-F59 AromaticContact CE1-CZ 3.87Å; F51-F59 HydrophobicContact CE1-CZ 3.87Å; F51-F59 HydrophobicContact CE2-CE2 4.35Å; F51-F59 AromaticContact CG-CE2 3.93Å; F51-F59 HydrophobicContact CG-CE2 3.93Å; F51-F59 HydrophobicContact CZ-CE2 4.08Å; F51-F59 HydrophobicContact CZ-CZ 4.21Å; F51-L199 HydrophobicContact CD1-CD2 4.14Å; F51-L199 HydrophobicContact CE1-CD2 4.25Å; F51-Q202 HydrophobicContact CE1-CB 3.89Å; F51-Q202 VanDerWaalsContact CE1-OE1 3.27Å; F51-Q202 HydrophobicContact CZ-CB 4.08Å; F51-L206 HydrophobicContact CE2-CD1 3.53Å; F51-L206 HydrophobicContact CZ-CD1 3.65Å; F51-F263 HydrophobicContact CZ-CE1 4.46Å
52	S	95.6	Very high	92.5	Very high	49 Å²	49	65.8 Å²	65.8	34%	0.343	34%	0.342	S	S	.	.			trans	-63	159.7	172	65.3	0	0	0	0	112	S54 E55 Q56	S52-S54 PolarHBondContact O-N 2.92Å; S52-S54 PolarHBondContact OG-OG 3.22Å; S52-E55 WeakPolarHBondContact CB-OE2 3.43Å; S52-E55 PolarHBondContact N-OE2 2.99Å; S52-E55 PolarHBondContact O-N 3.48Å; S52-E55 WeakPolarHBondContact OG-CG 3.46Å; S52-E55 PolarHBondContact OG-N 3.15Å; S52-E55 PolarHBondContact OG-OE2 3.49Å; S52-Q56 WeakPolarHBondContact O-CG 3.25Å; S52-Q56 PolarHBondContact O-N 3.11Å
53	E	95.3	Very high	92.9	Very high	172 Å²	172	66.7 Å²	66.7	80%	0.804	34%	0.337	S	S	*	.	H	α-helix	trans	-55.4	-36.4	176.9	-65.5	-176.8	174.7	0	0	112.8	K57	E53-K57 WeakPolarHBondContact O-CB 3.29Å; E53-K57 PolarHBondContact O-N 3.5Å
54	S	96.7	Very high	93.3	Very high	87 Å²	87	64.8 Å²	64.8	61%	0.608	33%	0.334	S	S	*	.	H	α-helix	trans	-66	-37.6	176.1	44	0	0	0	0	113.1	S52 W58	S52-S54 PolarHBondContact O-N 2.92Å; S52-S54 PolarHBondContact OG-OG 3.22Å; S54-W58 PolarHBondContact O-N 3.45Å
55	E	96.5	Very high	93.8	Very high	53 Å²	53	62.8 Å²	62.8	25%	0.248	33%	0.325	C	S	.	.	H	α-helix	trans	-75.1	-40	179.1	-68.6	162.7	147.4	0	0	110.9	F51 S52 K57 W58 F59 L199	F51-E55 HydrophobicContact CB-CB 4Å; F51-E55 HydrophobicContact CD1-CB 4.38Å; S52-E55 WeakPolarHBondContact CB-OE2 3.43Å; S52-E55 PolarHBondContact N-OE2 2.99Å; S52-E55 PolarHBondContact O-N 3.48Å; S52-E55 WeakPolarHBondContact OG-CG 3.46Å; S52-E55 PolarHBondContact OG-N 3.15Å; S52-E55 PolarHBondContact OG-OE2 3.49Å; E55-K57 VanDerWaalsContact C-N 3.33Å; E55-K57 PolarHBondContact O-N 3.31Å; E55-W58 WeakPolarHBondContact O-CA 3.06Å; E55-W58 VanDerWaalsContact O-CB 3.32Å; E55-W58 WeakPolarHBondContact O-CB 3.45Å; E55-W58 PolarHBondContact O-N 3.12Å; E55-W58 VanDerWaalsContact O-N 3.1Å; E55-F59 WeakPolarHBondContact O-CD2 3.18Å; E55-F59 PolarHBondContact O-N 3.27Å; E55-L199 HydrophobicContact CB-CD1 4.41Å; E55-L199 HydrophobicContact CB-CD2 4.12Å; E55-L199 HydrophobicContact CG-CD1 4Å; E55-L199 HydrophobicContact CG-CD2 3.75Å
56	Q	95.5	Very high	94.8	Very high	75 Å²	75	60.2 Å²	60.2	35%	0.35	31%	0.307	S	S	.	.	H	α-helix	trans	-58.9	-45.8	172.2	-67	-179.8	31.8	0	0	111.2	S48 F51 S52 W58 F59 E60	S48-Q56 PolarHBondContact O-NE2 3.11Å; F51-Q56 HydrophobicContact CB-CG 4.01Å; F51-Q56 PolarHBondContact O-NE2 2.89Å; S52-Q56 WeakPolarHBondContact O-CG 3.25Å; S52-Q56 PolarHBondContact O-N 3.11Å; Q56-W58 VanDerWaalsContact C-N 3.27Å; Q56-W58 PolarHBondContact O-N 3.18Å; Q56-F59 PolarHBondContact O-N 3.37Å; Q56-F59 VanDerWaalsContact O-N 3.17Å; Q56-E60 PolarHBondContact O-N 3.15Å; Q56-E60 VanDerWaalsContact O-N 3.07Å
57	K	95.7	Very high	95.1	Very high	140 Å²	140	63.4 Å²	63.4	61%	0.609	32%	0.318	S	S	*	.	H	α-helix	trans	-59.7	-39.7	174	-178.9	168.4	-177.1	164.2	0	112	E53 E55 F59 E60 D61	E53-K57 WeakPolarHBondContact O-CB 3.29Å; E53-K57 PolarHBondContact O-N 3.5Å; E55-K57 VanDerWaalsContact C-N 3.33Å; E55-K57 PolarHBondContact O-N 3.31Å; K57-F59 VanDerWaalsContact C-N 3.34Å; K57-F59 PolarHBondContact O-N 3.33Å; K57-E60 PolarHBondContact O-N 3.41Å; K57-D61 PolarHBondContact O-N 3.02Å
58	W	97.4	Very high	95.1	Very high	17 Å²	17	65.1 Å²	65.1	6%	0.064	33%	0.327	C	S	.	.	H	α-helix	trans	-60.9	-42.3	175.9	-173.1	90.2	0	0	0	112.1	S54 E55 Q56 E60 D61 F62 L107 Y196 L199 I200	S54-W58 PolarHBondContact O-N 3.45Å; E55-W58 WeakPolarHBondContact O-CA 3.06Å; E55-W58 VanDerWaalsContact O-CB 3.32Å; E55-W58 WeakPolarHBondContact O-CB 3.45Å; E55-W58 PolarHBondContact O-N 3.12Å; E55-W58 VanDerWaalsContact O-N 3.1Å; Q56-W58 VanDerWaalsContact C-N 3.27Å; Q56-W58 PolarHBondContact O-N 3.18Å; W58-E60 VanDerWaalsContact C-N 3.35Å; W58-E60 PolarHBondContact O-N 3.34Å; W58-D61 PolarHBondContact O-N 3.07Å; W58-F62 HydrophobicContact CE3-CB 4.24Å; W58-F62 HydrophobicContact CH2-CB 4.15Å; W58-F62 AromaticContact CH2-CD1 3.74Å; W58-F62 HydrophobicContact CH2-CD1 3.74Å; W58-F62 HydrophobicContact CH2-CE1 4.29Å; W58-F62 AromaticContact CH2-CG 3.96Å; W58-F62 HydrophobicContact CH2-CG 3.96Å; W58-F62 HydrophobicContact CZ3-CB 3.97Å; W58-F62 AromaticContact CZ3-CD1 3.56Å; W58-F62 HydrophobicContact CZ3-CD1 3.56Å; W58-F62 HydrophobicContact CZ3-CE1 4.33Å; W58-F62 HydrophobicContact CZ3-CG 4.01Å; W58-F62 WeakPolarHBondContact O-CB 3.35Å; W58-F62 PolarHBondContact O-N 2.73Å; W58-L107 HydrophobicContact CH2-CD2 4.36Å; W58-L107 HydrophobicContact CZ2-CD1 4.4Å; W58-L107 HydrophobicContact CZ2-CD2 3.6Å; W58-L107 HydrophobicContact CZ2-CG 3.85Å; W58-L107 PolarHBondContact NE1-O 2.93Å; W58-Y196 AromaticContact CD1-CD1 3.42Å; W58-Y196 VanDerWaalsContact CD1-CD1 3.42Å; W58-Y196 AromaticContact CD1-CE1 3.25Å; W58-Y196 AromaticContact CD2-CD1 3.75Å; W58-Y196 HydrophobicContact CD2-CD1 3.75Å; W58-Y196 HydrophobicContact CD2-CE1 4.3Å; W58-Y196 AromaticContact CE2-CD1 3.28Å; W58-Y196 AromaticContact CE2-CE1 3.99Å; W58-Y196 AromaticContact CE2-CG 3.85Å; W58-Y196 AromaticContact CG-CD1 3.85Å; W58-Y196 HydrophobicContact CG-CD1 3.85Å; W58-Y196 AromaticContact CG-CE1 3.89Å; W58-Y196 HydrophobicContact CG-CE1 3.89Å; W58-Y196 AromaticContact CZ2-CD1 3.85Å; W58-Y196 HydrophobicContact CZ2-CD1 3.85Å; W58-Y196 AromaticContact CZ2-CG 3.98Å; W58-Y196 HydrophobicContact CZ2-CG 3.98Å; W58-Y196 AromaticContact NE1-CD1 3.02Å; W58-Y196 AromaticContact NE1-CE1 3.28Å; W58-Y196 VanDerWaalsContact NE1-CE1 3.28Å; W58-Y196 AromaticContact NE1-CG 3.69Å; W58-L199 HydrophobicContact CD2-CD1 4.4Å; W58-L199 HydrophobicContact CE3-CD1 4.32Å; W58-L199 HydrophobicContact CZ3-CB 4.5Å; W58-I200 HydrophobicContact CH2-CD1 4.12Å; W58-I200 HydrophobicContact CH2-CG1 3.9Å; W58-I200 HydrophobicContact CZ3-CG1 4.23Å
59	F	96.6	Very high	95.2	Very high	4 Å²	4	63.4 Å²	63.4	2%	0.018	32%	0.316	C	S	.	.	H	α-helix	trans	-63.6	-38.1	174.8	-69.8	-58.1	0	0	0	112.8	L38 L41 F51 E55 Q56 K57 D61 F62 K63 L199 L203	L38-F59 HydrophobicContact CD2-CB 4.02Å; L38-F59 HydrophobicContact CD2-CD1 3.79Å; L38-F59 HydrophobicContact CD2-CG 4.26Å; L41-F59 HydrophobicContact CD2-CB 4.31Å; L41-F59 HydrophobicContact CD2-CD1 4.45Å; L41-F59 HydrophobicContact CD2-CD2 3.53Å; L41-F59 HydrophobicContact CD2-CE2 3.86Å; L41-F59 HydrophobicContact CD2-CG 3.86Å; L41-F59 HydrophobicContact CD2-CZ 4.46Å; F51-F59 AromaticContact CD1-CE2 3.67Å; F51-F59 HydrophobicContact CD1-CE2 3.67Å; F51-F59 HydrophobicContact CD1-CZ 4.24Å; F51-F59 HydrophobicContact CD2-CE2 4.27Å; F51-F59 AromaticContact CE1-CE2 3.72Å; F51-F59 HydrophobicContact CE1-CE2 3.72Å; F51-F59 AromaticContact CE1-CZ 3.87Å; F51-F59 HydrophobicContact CE1-CZ 3.87Å; F51-F59 HydrophobicContact CE2-CE2 4.35Å; F51-F59 AromaticContact CG-CE2 3.93Å; F51-F59 HydrophobicContact CG-CE2 3.93Å; F51-F59 HydrophobicContact CZ-CE2 4.08Å; F51-F59 HydrophobicContact CZ-CZ 4.21Å; E55-F59 WeakPolarHBondContact O-CD2 3.18Å; E55-F59 PolarHBondContact O-N 3.27Å; Q56-F59 PolarHBondContact O-N 3.37Å; Q56-F59 VanDerWaalsContact O-N 3.17Å; K57-F59 VanDerWaalsContact C-N 3.34Å; K57-F59 PolarHBondContact O-N 3.33Å; F59-D61 VanDerWaalsContact C-N 3.35Å; F59-F62 PolarHBondContact O-N 2.64Å; F59-K63 WeakPolarHBondContact O-CB 3.32Å; F59-K63 PolarHBondContact O-N 3.25Å; F59-L199 HydrophobicContact CE1-CB 4.31Å; F59-L199 HydrophobicContact CZ-CB 4.02Å; F59-L199 HydrophobicContact CZ-CD2 4.41Å; F59-L203 HydrophobicContact CD1-CD2 4.22Å; F59-L203 HydrophobicContact CE1-CB 3.88Å; F59-L203 HydrophobicContact CE1-CD2 3.98Å; F59-L203 HydrophobicContact CE1-CG 4.42Å; F59-L203 HydrophobicContact CZ-CB 4.09Å
60	E	95.5	Very high	95.3	Very high	88 Å²	88	57.1 Å²	57.1	41%	0.411	29%	0.286	S	S	.	.	H	α-helix	trans	-64.5	-38.6	174.7	-74	-56.8	136.1	0	0	112.5	Q56 K57 W58 K64	Q56-E60 PolarHBondContact O-N 3.15Å; Q56-E60 VanDerWaalsContact O-N 3.07Å; K57-E60 PolarHBondContact O-N 3.41Å; W58-E60 VanDerWaalsContact C-N 3.35Å; W58-E60 PolarHBondContact O-N 3.34Å; E60-K64 WeakPolarHBondContact O-CE 3.42Å; E60-K64 WeakPolarHBondContact O-CG 3.43Å; E60-K64 PolarHBondContact O-N 3.48Å
61	D	96.7	Very high	95.1	Very high	60 Å²	60	57.3 Å²	57.3	32%	0.321	29%	0.288	S	S	.	.	H	α-helix	trans	-74	-35.3	175.5	-67.6	-22.3	0	0	0	111.6	K57 W58 F59 K63 K64 L65 L107	K57-D61 PolarHBondContact O-N 3.02Å; W58-D61 PolarHBondContact O-N 3.07Å; F59-D61 VanDerWaalsContact C-N 3.35Å; D61-K63 VanDerWaalsContact C-N 3.31Å; D61-K63 PolarHBondContact O-N 2.87Å; D61-K64 PolarHBondContact O-N 2.9Å; D61-K64 VanDerWaalsContact O-N 3.17Å; D61-K64 IonicContact OD1-NZ 2.7Å; D61-K64 PolarHBondContact OD1-NZ 3.4Å; D61-L65 PolarHBondContact O-N 2.9Å; D61-L107 HydrophobicContact CB-CD1 3.94Å
62	F	96.5	Very high	94.9	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-60.7	-41.5	172	179.6	-157.6	0	0	0	111.4	I34 L38 W58 F59 K64 L65 K70 I73 L107 I200	I34-F62 HydrophobicContact CD1-CZ 4.39Å; I34-F62 HydrophobicContact CG2-CE1 3.87Å; I34-F62 HydrophobicContact CG2-CZ 3.7Å; L38-F62 HydrophobicContact CD1-CD1 4.19Å; L38-F62 HydrophobicContact CD1-CE1 4.42Å; L38-F62 HydrophobicContact CD2-CD1 4.16Å; W58-F62 HydrophobicContact CE3-CB 4.24Å; W58-F62 HydrophobicContact CH2-CB 4.15Å; W58-F62 AromaticContact CH2-CD1 3.74Å; W58-F62 HydrophobicContact CH2-CD1 3.74Å; W58-F62 HydrophobicContact CH2-CE1 4.29Å; W58-F62 AromaticContact CH2-CG 3.96Å; W58-F62 HydrophobicContact CH2-CG 3.96Å; W58-F62 HydrophobicContact CZ3-CB 3.97Å; W58-F62 AromaticContact CZ3-CD1 3.56Å; W58-F62 HydrophobicContact CZ3-CD1 3.56Å; W58-F62 HydrophobicContact CZ3-CE1 4.33Å; W58-F62 HydrophobicContact CZ3-CG 4.01Å; W58-F62 WeakPolarHBondContact O-CB 3.35Å; W58-F62 PolarHBondContact O-N 2.73Å; F59-F62 PolarHBondContact O-N 2.64Å; F62-K64 PolarHBondContact O-N 3.28Å; F62-L65 HydrophobicContact CD2-CD1 3.65Å; F62-L65 HydrophobicContact CD2-CG 4.31Å; F62-L65 HydrophobicContact CE2-CD1 4.16Å; F62-L65 WeakPolarHBondContact O-CB 3.48Å; F62-L65 WeakPolarHBondContact O-CG 3.36Å; F62-L65 PolarHBondContact O-N 3.37Å; F62-K70 HydrophobicContact CE2-CG 4Å; F62-K70 WeakPolarHBondContact O-CE 3.31Å; F62-I73 HydrophobicContact CD2-CD1 3.92Å; F62-I73 HydrophobicContact CE2-CD1 3.42Å; F62-I73 VanDerWaalsContact CE2-CD1 3.42Å; F62-I73 HydrophobicContact CE2-CG2 4.49Å; F62-I73 HydrophobicContact CZ-CD1 4.17Å; F62-I73 HydrophobicContact CZ-CG2 4.25Å; F62-L107 HydrophobicContact CB-CD1 4.24Å; F62-L107 HydrophobicContact CB-CD2 4.38Å; F62-L107 HydrophobicContact CD2-CD2 4.28Å; F62-I200 HydrophobicContact CE1-CD1 4.29Å; F62-I200 HydrophobicContact CE1-CG1 4.01Å; F62-I200 HydrophobicContact CZ-CD1 4.37Å
63	K	95	Very high	94.9	Very high	84 Å²	84	54.7 Å²	54.7	37%	0.365	27%	0.271	S	S	.	.	H	α-helix	trans	-59.7	-32.7	176.6	-172.9	177.4	177.5	-179.3	0	112.7	L38 F59 D61 K70	L38-K63 HydrophobicContact CD1-CB 4.14Å; F59-K63 WeakPolarHBondContact O-CB 3.32Å; F59-K63 PolarHBondContact O-N 3.25Å; D61-K63 VanDerWaalsContact C-N 3.31Å; D61-K63 PolarHBondContact O-N 2.87Å; K63-K70 WeakPolarHBondContact O-CE 3.44Å; K63-K70 PolarHBondContact O-NZ 2.8Å
64	K	95.4	Very high	94.6	Very high	146 Å²	146	47.5 Å²	47.5	64%	0.635	24%	0.237	S	C	*	.	H	α-helix	trans	-80.6	-12	-178.5	-65.5	166.6	-158.6	157.3	0	114.6	E60 D61 F62	E60-K64 WeakPolarHBondContact O-CE 3.42Å; E60-K64 WeakPolarHBondContact O-CG 3.43Å; E60-K64 PolarHBondContact O-N 3.48Å; D61-K64 PolarHBondContact O-N 2.9Å; D61-K64 VanDerWaalsContact O-N 3.17Å; D61-K64 IonicContact OD1-NZ 2.7Å; D61-K64 PolarHBondContact OD1-NZ 3.4Å; F62-K64 PolarHBondContact O-N 3.28Å
65	L	95.7	Very high	94.3	Very high	21 Å²	21	47 Å²	47	11%	0.11	22%	0.222	C	C	.	.	S	Bend	trans	-59.5	154	178.9	-63.6	-175.1	0	0	0	112.5	D61 F62 K70 I73 E103 L104 L107	D61-L65 PolarHBondContact O-N 2.9Å; F62-L65 HydrophobicContact CD2-CD1 3.65Å; F62-L65 HydrophobicContact CD2-CG 4.31Å; F62-L65 HydrophobicContact CE2-CD1 4.16Å; F62-L65 WeakPolarHBondContact O-CB 3.48Å; F62-L65 WeakPolarHBondContact O-CG 3.36Å; F62-L65 PolarHBondContact O-N 3.37Å; L65-K70 HydrophobicContact CB-CG 4.01Å; L65-K70 HydrophobicContact CD1-CG 4.49Å; L65-K70 VanDerWaalsContact O-CE 3.29Å; L65-K70 WeakPolarHBondContact O-CE 3.39Å; L65-I73 HydrophobicContact CD1-CD1 3.63Å; L65-E103 HydrophobicContact CD2-CB 4.14Å; L65-L104 HydrophobicContact CD1-CD2 3.88Å; L65-L107 HydrophobicContact CD1-CD2 3.6Å; L65-L107 HydrophobicContact CD2-CD2 4.47Å; L65-L107 HydrophobicContact CG-CD2 4.33Å
66	S	93.7	Very high	94	Very high	34 Å²	34	44.7 Å²	44.7	24%	0.238	21%	0.211	C	C	.	.			trans	-60.9	150.1	169.3	68.1	0	0	0	0	111.6	L68 S69 K70 E103	S66-L68 PolarHBondContact O-N 3.24Å; S66-S69 PolarHBondContact O-N 2.9Å; S66-S69 VanDerWaalsContact O-N 3.14Å; S66-S69 WeakPolarHBondContact OG-CB 3.19Å; S66-S69 PolarHBondContact OG-N 3.22Å; S66-S69 PolarHBondContact OG-OG 2.65Å; S66-S69 VanDerWaalsContact OG-OG 3.08Å; S66-K70 WeakPolarHBondContact O-CG 3.46Å; S66-K70 PolarHBondContact O-N 3.12Å; S66-E103 WeakPolarHBondContact CB-OE2 3.33Å; S66-E103 PolarHBondContact N-OE2 3.45Å; S66-E103 PolarHBondContact OG-OE2 3.44Å
67	N	91.8	Very high	93.7	Very high	95 Å²	95	41.3 Å²	41.3	51%	0.508	20%	0.195	S	C	.	.	H	α-helix	trans	-59.9	-28.8	176.5	-73.9	-11.7	0	0	0	112.1	V31 S71	V31-N67 HydrophobicContact CG1-CB 4.21Å; N67-S71 WeakPolarHBondContact O-CB 3.18Å; N67-S71 PolarHBondContact O-N 3.35Å; N67-S71 PolarHBondContact O-OG 3.13Å
68	L	91.4	Very high	92.9	Very high	53 Å²	53	35.8 Å²	35.8	28%	0.277	18%	0.178	S	C	.	.	H	α-helix	trans	-68.5	-45.2	176.1	-164.3	65.4	0	0	0	111.3	S66 S71 L72 I93 D96	S66-L68 PolarHBondContact O-N 3.24Å; L68-S71 WeakPolarHBondContact O-CB 3.45Å; L68-S71 PolarHBondContact O-N 2.81Å; L68-L72 PolarHBondContact O-N 2.9Å; L68-I93 HydrophobicContact CD1-CD1 3.91Å; L68-I93 HydrophobicContact CD1-CG1 4.37Å; L68-I93 HydrophobicContact CD1-CG2 3.76Å; L68-I93 HydrophobicContact CD2-CG2 3.73Å; L68-I93 HydrophobicContact CG-CD1 3.93Å; L68-I93 HydrophobicContact CG-CG2 3.75Å; L68-I93 VanDerWaalsContact O-CD1 3.3Å; L68-I93 WeakPolarHBondContact O-CD1 3.28Å; L68-D96 HydrophobicContact CD2-CB 3.84Å
69	S	94.2	Very high	92.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.5	-42.6	172.7	-68.7	0	0	0	0	112.4	S66 S71 L72 I73 C100 E103	S66-S69 PolarHBondContact O-N 2.9Å; S66-S69 VanDerWaalsContact O-N 3.14Å; S66-S69 WeakPolarHBondContact OG-CB 3.19Å; S66-S69 PolarHBondContact OG-N 3.22Å; S66-S69 PolarHBondContact OG-OG 2.65Å; S66-S69 VanDerWaalsContact OG-OG 3.08Å; S69-S71 VanDerWaalsContact C-N 3.34Å; S69-S71 PolarHBondContact O-N 3.36Å; S69-L72 WeakPolarHBondContact O-CB 3.49Å; S69-L72 PolarHBondContact O-N 3.5Å; S69-I73 PolarHBondContact O-N 2.96Å; S69-C100 WeakPolarHBondContact OG-CA 3.32Å; S69-E103 VanDerWaalsContact CB-OE2 3.29Å; S69-E103 WeakPolarHBondContact CB-OE2 3.46Å; S69-E103 PolarHBondContact OG-OE2 2.97Å
70	K	94.1	Very high	91.5	Very high	8 Å²	8	45.6 Å²	45.6	4%	0.035	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-40.3	174.7	-66.4	177.8	-177.2	169	0	111.9	V31 N35 F62 K63 L65 S66 L72 I73 I74	V31-K70 HydrophobicContact CB-CB 4.48Å; V31-K70 HydrophobicContact CG1-CB 3.92Å; V31-K70 HydrophobicContact CG1-CD 3.85Å; V31-K70 HydrophobicContact CG2-CB 3.85Å; N35-K70 PolarHBondContact OD1-NZ 3.18Å; F62-K70 HydrophobicContact CE2-CG 4Å; F62-K70 WeakPolarHBondContact O-CE 3.31Å; K63-K70 WeakPolarHBondContact O-CE 3.44Å; K63-K70 PolarHBondContact O-NZ 2.8Å; L65-K70 HydrophobicContact CB-CG 4.01Å; L65-K70 HydrophobicContact CD1-CG 4.49Å; L65-K70 VanDerWaalsContact O-CE 3.29Å; L65-K70 WeakPolarHBondContact O-CE 3.39Å; S66-K70 WeakPolarHBondContact O-CG 3.46Å; S66-K70 PolarHBondContact O-N 3.12Å; K70-L72 VanDerWaalsContact C-N 3.29Å; K70-L72 PolarHBondContact O-N 3.05Å; K70-I73 WeakPolarHBondContact O-CB 3.36Å; K70-I73 PolarHBondContact O-N 2.88Å; K70-I74 WeakPolarHBondContact O-CG1 3.36Å; K70-I74 PolarHBondContact O-N 2.97Å
71	S	91.7	Very high	91.1	Very high	11 Å²	11	45.2 Å²	45.2	8%	0.077	23%	0.232	C	C	.	.	H	α-helix	trans	-60.6	-40.5	174.6	-61.6	0	0	0	0	111.4	V31 N67 L68 S69 I74 R75	V31-S71 VanDerWaalsContact CG2-OG 3.26Å; V31-S71 WeakPolarHBondContact CG2-OG 3.29Å; N67-S71 WeakPolarHBondContact O-CB 3.18Å; N67-S71 PolarHBondContact O-N 3.35Å; N67-S71 PolarHBondContact O-OG 3.13Å; L68-S71 WeakPolarHBondContact O-CB 3.45Å; L68-S71 PolarHBondContact O-N 2.81Å; S69-S71 VanDerWaalsContact C-N 3.34Å; S69-S71 PolarHBondContact O-N 3.36Å; S71-I74 PolarHBondContact O-N 3.39Å; S71-R75 VanDerWaalsContact O-CG 3.3Å; S71-R75 WeakPolarHBondContact O-CG 3.5Å; S71-R75 PolarHBondContact O-N 3.35Å
72	L	92.7	Very high	90.7	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.9	-46	175.6	-167.7	49.6	0	0	0	111.5	L68 S69 K70 I74 R75 L76 L89 I92 I93 I97 C100 L104	L68-L72 PolarHBondContact O-N 2.9Å; S69-L72 WeakPolarHBondContact O-CB 3.49Å; S69-L72 PolarHBondContact O-N 3.5Å; K70-L72 VanDerWaalsContact C-N 3.29Å; K70-L72 PolarHBondContact O-N 3.05Å; L72-I74 VanDerWaalsContact C-N 3.31Å; L72-I74 PolarHBondContact O-N 2.98Å; L72-R75 PolarHBondContact O-N 3.37Å; L72-R75 VanDerWaalsContact O-N 3.15Å; L72-L76 HydrophobicContact CD1-CD1 4.07Å; L72-L76 HydrophobicContact CD1-CG 4.1Å; L72-L76 HydrophobicContact CG-CD1 3.92Å; L72-L76 HydrophobicContact CG-CG 4.35Å; L72-L76 VanDerWaalsContact O-CG 3.27Å; L72-L76 WeakPolarHBondContact O-CG 3.21Å; L72-L76 PolarHBondContact O-N 2.73Å; L72-L89 HydrophobicContact CD1-CD2 4.41Å; L72-I92 HydrophobicContact CD1-CB 4.28Å; L72-I92 HydrophobicContact CD1-CD1 4.3Å; L72-I92 HydrophobicContact CD1-CG2 4.07Å; L72-I93 HydrophobicContact CB-CD1 3.57Å; L72-I93 HydrophobicContact CD1-CD1 4.1Å; L72-I93 HydrophobicContact CD1-CG1 4.35Å; L72-I93 HydrophobicContact CD2-CD1 4.37Å; L72-I93 HydrophobicContact CG-CD1 4.21Å; L72-I97 HydrophobicContact CD2-CD1 3.93Å; L72-C100 HydrophobicContact CD2-CB 4.13Å; L72-L104 HydrophobicContact CB-CD1 4.12Å; L72-L104 HydrophobicContact CD2-CD1 3.75Å; L72-L104 HydrophobicContact CG-CD1 4.05Å
73	I	94	Very high	90.6	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-52.7	-51.3	174.7	-72.6	170	0	0	0	110.1	F62 L65 S69 K70 R75 L76 Y77 L104 L107 F109 I200	F62-I73 HydrophobicContact CD2-CD1 3.92Å; F62-I73 HydrophobicContact CE2-CD1 3.42Å; F62-I73 VanDerWaalsContact CE2-CD1 3.42Å; F62-I73 HydrophobicContact CE2-CG2 4.49Å; F62-I73 HydrophobicContact CZ-CD1 4.17Å; F62-I73 HydrophobicContact CZ-CG2 4.25Å; L65-I73 HydrophobicContact CD1-CD1 3.63Å; S69-I73 PolarHBondContact O-N 2.96Å; K70-I73 WeakPolarHBondContact O-CB 3.36Å; K70-I73 PolarHBondContact O-N 2.88Å; I73-R75 VanDerWaalsContact C-N 3.3Å; I73-R75 PolarHBondContact O-N 3.24Å; I73-L76 PolarHBondContact O-N 3.29Å; I73-L76 VanDerWaalsContact O-N 3.14Å; I73-Y77 VanDerWaalsContact O-CB 3.29Å; I73-Y77 WeakPolarHBondContact O-CB 3.32Å; I73-Y77 PolarHBondContact O-N 3.45Å; I73-L104 HydrophobicContact CD1-CD2 3.41Å; I73-L104 VanDerWaalsContact CD1-CD2 3.41Å; I73-L104 HydrophobicContact CG1-CD1 4.35Å; I73-L104 HydrophobicContact CG1-CD2 3.5Å; I73-L104 VanDerWaalsContact CG1-CD2 3.5Å; I73-L107 HydrophobicContact CD1-CD2 4.14Å; I73-F109 HydrophobicContact CB-CE1 4.22Å; I73-F109 HydrophobicContact CB-CZ 4.34Å; I73-F109 HydrophobicContact CD1-CD1 4.44Å; I73-F109 HydrophobicContact CD1-CG 4.42Å; I73-F109 HydrophobicContact CG1-CD1 3.71Å; I73-F109 HydrophobicContact CG1-CE1 3.75Å; I73-F109 HydrophobicContact CG1-CG 4.14Å; I73-F109 HydrophobicContact CG1-CZ 4.21Å; I73-F109 HydrophobicContact CG2-CE1 4.26Å; I73-F109 HydrophobicContact CG2-CE2 4.1Å; I73-F109 HydrophobicContact CG2-CZ 3.88Å; I73-I200 HydrophobicContact CG2-CD1 3.55Å
74	I	90.8	Very high	90.6	Very high	20 Å²	20	40.7 Å²	40.7	10%	0.103	21%	0.21	C	C	.	.	H	α-helix	trans	-59.2	-41.2	-179.5	-69	161	0	0	0	111.7	A30 V31 I34 K70 S71 L72 L76 L232	A30-I74 VanDerWaalsContact C-CD1 3.46Å; A30-I74 HydrophobicContact CB-CD1 3.89Å; A30-I74 HydrophobicContact CB-CG2 4.07Å; V31-I74 HydrophobicContact CB-CD1 4.31Å; V31-I74 HydrophobicContact CG2-CD1 3.7Å; I34-I74 HydrophobicContact CD1-CD1 3.73Å; I34-I74 HydrophobicContact CD1-CG1 3.36Å; I34-I74 HydrophobicContact CG1-CD1 4.26Å; I34-I74 HydrophobicContact CG1-CG1 4.33Å; K70-I74 WeakPolarHBondContact O-CG1 3.36Å; K70-I74 PolarHBondContact O-N 2.97Å; S71-I74 PolarHBondContact O-N 3.39Å; L72-I74 VanDerWaalsContact C-N 3.31Å; L72-I74 PolarHBondContact O-N 2.98Å; I74-L76 VanDerWaalsContact C-N 3.32Å; I74-L76 PolarHBondContact O-N 3.12Å; I74-L232 HydrophobicContact CG1-CD2 4.26Å; I74-L232 HydrophobicContact CG2-CD2 3.8Å
75	R	88.7	Confident	90.5	Very high	78 Å²	78	36.7 Å²	36.7	29%	0.294	19%	0.191	S	C	.	.	H	α-helix	trans	-70.1	-28.9	-179.9	-72.4	-71.4	-177.7	154.9	4.6	113	S23 N27 S71 L72 I73 R79 I92	S23-R75 PolarHBondContact O-NH2 3.29Å; S23-R75 VanDerWaalsContact O-NH2 3.13Å; N27-R75 PolarHBondContact OD1-NE 3.43Å; N27-R75 PolarHBondContact OD1-NH2 3.1Å; S71-R75 VanDerWaalsContact O-CG 3.3Å; S71-R75 WeakPolarHBondContact O-CG 3.5Å; S71-R75 PolarHBondContact O-N 3.35Å; L72-R75 PolarHBondContact O-N 3.37Å; L72-R75 VanDerWaalsContact O-N 3.15Å; I73-R75 VanDerWaalsContact C-N 3.3Å; I73-R75 PolarHBondContact O-N 3.24Å; R75-R79 VanDerWaalsContact O-CD 3.31Å; R75-R79 WeakPolarHBondContact O-CD 3.33Å; R75-I92 HydrophobicContact CB-CG2 3.8Å; R75-I92 HydrophobicContact CG-CG2 3.82Å
76	L	90.9	Very high	90.4	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.016	20%	0.201	C	C	.	.	H	α-helix	trans	-87.5	-28.8	177.4	-62.6	179.3	0	0	0	112.6	L72 I73 I74 G78 R79 F84 L89 I92 L110 V192	L72-L76 HydrophobicContact CD1-CD1 4.07Å; L72-L76 HydrophobicContact CD1-CG 4.1Å; L72-L76 HydrophobicContact CG-CD1 3.92Å; L72-L76 HydrophobicContact CG-CG 4.35Å; L72-L76 VanDerWaalsContact O-CG 3.27Å; L72-L76 WeakPolarHBondContact O-CG 3.21Å; L72-L76 PolarHBondContact O-N 2.73Å; I73-L76 PolarHBondContact O-N 3.29Å; I73-L76 VanDerWaalsContact O-N 3.14Å; I74-L76 VanDerWaalsContact C-N 3.32Å; I74-L76 PolarHBondContact O-N 3.12Å; L76-G78 PolarHBondContact O-N 3.4Å; L76-R79 WeakPolarHBondContact O-CB 3.27Å; L76-R79 WeakPolarHBondContact O-CG 3.5Å; L76-R79 PolarHBondContact O-N 2.89Å; L76-F84 HydrophobicContact CD2-CD1 4.2Å; L76-F84 HydrophobicContact CD2-CD2 4.33Å; L76-F84 HydrophobicContact CD2-CE1 3.83Å; L76-F84 HydrophobicContact CD2-CE2 3.98Å; L76-F84 HydrophobicContact CD2-CG 4.43Å; L76-F84 HydrophobicContact CD2-CZ 3.7Å; L76-L89 HydrophobicContact CD1-CD2 4.02Å; L76-L89 HydrophobicContact CD2-CD2 3.77Å; L76-L89 HydrophobicContact CG-CD2 4.48Å; L76-I92 HydrophobicContact CD2-CD1 4.05Å; L76-L110 HydrophobicContact CD1-CD1 4.18Å; L76-L110 HydrophobicContact CD1-CD2 4.08Å; L76-L110 HydrophobicContact CD1-CG 4.45Å; L76-V192 HydrophobicContact CB-CG2 4.11Å; L76-V192 HydrophobicContact CD1-CG2 4.14Å
77	Y	89.9	Confident	90.2	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.016	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	131.9	176.9	-176.2	-100.5	0	0	0	111.4	I73 R79 T197 I200 T201 L204 E225 M228	I73-Y77 VanDerWaalsContact O-CB 3.29Å; I73-Y77 WeakPolarHBondContact O-CB 3.32Å; I73-Y77 PolarHBondContact O-N 3.45Å; Y77-R79 VanDerWaalsContact C-N 3.27Å; Y77-R79 PolarHBondContact O-N 3.42Å; Y77-T197 HydrophobicContact CD2-CG2 3.82Å; Y77-T197 HydrophobicContact CE2-CG2 3.83Å; Y77-I200 HydrophobicContact CD2-CB 4.35Å; Y77-I200 HydrophobicContact CD2-CG2 3.94Å; Y77-I200 HydrophobicContact CE2-CB 4.01Å; Y77-I200 HydrophobicContact CE2-CG2 3.68Å; Y77-T201 WeakPolarHBondContact CE2-OG1 3.3Å; Y77-T201 WeakPolarHBondContact OH-CA 3.41Å; Y77-T201 WeakPolarHBondContact OH-CB 3.38Å; Y77-T201 PolarHBondContact OH-OG1 3.46Å; Y77-L204 HydrophobicContact CE1-CD1 4.07Å; Y77-E225 HydrophobicContact CD1-CG 4.48Å; Y77-E225 HydrophobicContact CD2-CG 4.29Å; Y77-E225 HydrophobicContact CE1-CG 3.94Å; Y77-E225 HydrophobicContact CE2-CG 3.72Å; Y77-M228 HydrophobicContact CE1-CB 4.33Å; Y77-M228 WeakPolarHBondContact OH-CB 3.27Å
78	G	77.5	Confident	90.2	Very high	24 Å²	24	37.7 Å²	37.7	25%	0.247	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	4.9	-179.3	0	0	0	0	0	115	L76 E225	L76-G78 PolarHBondContact O-N 3.4Å; G78-E225 VanDerWaalsContact CA-CD 3.41Å; G78-E225 WeakPolarHBondContact CA-OE1 3.37Å; G78-E225 PolarHBondContact N-OE1 3.29Å
79	R	84.9	Confident	90.2	Very high	104 Å²	104	35.2 Å²	35.2	39%	0.392	18%	0.182	S	C	.	.			trans	-76.4	141.5	176.4	-65.6	-170.9	88.3	107	-1.5	110.9	R75 L76 Y77 K82 F84	R75-R79 VanDerWaalsContact O-CD 3.31Å; R75-R79 WeakPolarHBondContact O-CD 3.33Å; L76-R79 WeakPolarHBondContact O-CB 3.27Å; L76-R79 WeakPolarHBondContact O-CG 3.5Å; L76-R79 PolarHBondContact O-N 2.89Å; Y77-R79 VanDerWaalsContact C-N 3.27Å; Y77-R79 PolarHBondContact O-N 3.42Å; R79-K82 WeakPolarHBondContact O-CE 3.41Å; R79-K82 PolarHBondContact O-NZ 2.68Å; R79-F84 HydrophobicContact CB-CZ 4.41Å
80	S	79.8	Confident	90.1	Very high	124 Å²	124	39.3 Å²	39.3	87%	0.867	20%	0.202	S	C	*	.	S	Bend	trans	-68.5	-35.8	172.4	55	0	0	0	0	112
81	Q	87	Confident	89.8	Confident	79 Å²	79	46.6 Å²	46.6	37%	0.369	23%	0.234	S	C	.	.			trans	-71	128.6	169.3	-178	176.3	4.7	0	0	109.7	I83 F84	Q81-I83 VanDerWaalsContact CG-O 3.27Å; Q81-I83 WeakPolarHBondContact CG-O 3.49Å; Q81-I83 PolarHBondContact NE2-O 3.45Å; Q81-F84 HydrophobicContact CB-CE1 4.13Å; Q81-F84 HydrophobicContact CB-CZ 4.1Å; Q81-F84 HydrophobicContact CG-CD1 4.19Å; Q81-F84 HydrophobicContact CG-CE1 3.78Å; Q81-F84 HydrophobicContact CG-CZ 3.97Å; Q81-F84 WeakPolarHBondContact O-CE2 3.36Å; Q81-F84 WeakPolarHBondContact O-CZ 3.46Å
82	K	89.3	Confident	89.5	Confident	35 Å²	35	48.2 Å²	48.2	15%	0.152	24%	0.241	C	C	.	.			trans	-109.8	-24.6	178.5	-58.2	-56.7	-170.5	-171.7	0	113.9	R79 F84 M121 Y191 V192 E225	R79-K82 WeakPolarHBondContact O-CE 3.41Å; R79-K82 PolarHBondContact O-NZ 2.68Å; K82-F84 WeakPolarHBondContact O-CD2 3.29Å; K82-F84 WeakPolarHBondContact O-CE2 3.4Å; K82-M121 HydrophobicContact CB-CE 4.06Å; K82-M121 HydrophobicContact CG-CE 4.13Å; K82-Y191 CarbonylContact O-C 3.48Å; K82-Y191 WeakPolarHBondContact O-CA 3.4Å; K82-V192 PolarHBondContact O-N 3.47Å; K82-E225 IonicContact NZ-OE1 3.92Å; K82-E225 IonicContact NZ-OE2 3.73Å
83	I	94.9	Very high	89.2	Confident	9 Å²	9	48.6 Å²	48.6	5%	0.046	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	130.3	179.1	-62.8	161.2	0	0	0	109.2	Q81 M114 L117 L122 A125 L186 C189 W190	Q81-I83 VanDerWaalsContact CG-O 3.27Å; Q81-I83 WeakPolarHBondContact CG-O 3.49Å; Q81-I83 PolarHBondContact NE2-O 3.45Å; I83-M114 HydrophobicContact CG1-SD 4.48Å; I83-M114 HydrophobicContact CG2-CE 4.33Å; I83-M114 HydrophobicContact CG2-SD 4.41Å; I83-L117 HydrophobicContact CD1-CD1 3.85Å; I83-L117 HydrophobicContact CG1-CD1 4.09Å; I83-L122 HydrophobicContact CD1-CD2 4.18Å; I83-A125 HydrophobicContact CB-CB 3.72Å; I83-A125 HydrophobicContact CD1-CB 3.44Å; I83-A125 VanDerWaalsContact CD1-CB 3.44Å; I83-A125 HydrophobicContact CG1-CB 4.13Å; I83-A125 HydrophobicContact CG2-CB 4Å; I83-L186 HydrophobicContact CD1-CD1 4.37Å; I83-C189 HydrophobicContact CG2-CB 3.92Å; I83-W190 CarbonylContact C-O 3.38Å; I83-W190 WeakPolarHBondContact CA-O 3.21Å
84	F	94.8	Very high	88.4	Confident	5 Å²	5	53 Å²	53	2%	0.022	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	138.3	-172.6	-60.7	-87.9	0	0	0	111.1	L76 R79 Q81 K82 L89 C189 W190 V192	L76-F84 HydrophobicContact CD2-CD1 4.2Å; L76-F84 HydrophobicContact CD2-CD2 4.33Å; L76-F84 HydrophobicContact CD2-CE1 3.83Å; L76-F84 HydrophobicContact CD2-CE2 3.98Å; L76-F84 HydrophobicContact CD2-CG 4.43Å; L76-F84 HydrophobicContact CD2-CZ 3.7Å; R79-F84 HydrophobicContact CB-CZ 4.41Å; Q81-F84 HydrophobicContact CB-CE1 4.13Å; Q81-F84 HydrophobicContact CB-CZ 4.1Å; Q81-F84 HydrophobicContact CG-CD1 4.19Å; Q81-F84 HydrophobicContact CG-CE1 3.78Å; Q81-F84 HydrophobicContact CG-CZ 3.97Å; Q81-F84 WeakPolarHBondContact O-CE2 3.36Å; Q81-F84 WeakPolarHBondContact O-CZ 3.46Å; K82-F84 WeakPolarHBondContact O-CD2 3.29Å; K82-F84 WeakPolarHBondContact O-CE2 3.4Å; F84-L89 HydrophobicContact CB-CD1 4.2Å; F84-L89 HydrophobicContact CB-CD2 3.76Å; F84-L89 HydrophobicContact CB-CG 3.91Å; F84-L89 HydrophobicContact CD1-CD2 4.19Å; F84-L89 HydrophobicContact CG-CD2 3.94Å; F84-C189 WeakPolarHBondContact O-CA 3.28Å; F84-W190 PolarHBondContact N-O 3.16Å; F84-W190 PolarHBondContact O-N 3.01Å; F84-V192 HydrophobicContact CD2-CG2 4.31Å; F84-V192 HydrophobicContact CE2-CG2 3.83Å
85	R	93.5	Very high	88	Confident	62 Å²	62	57.7 Å²	57.7	23%	0.234	30%	0.297	C	S	.	.			trans	-80.1	150.5	167.1	-66.9	173.5	-179.4	73.9	3.4	108.9	S87 D88 L89 E130	R85-S87 PolarHBondContact O-N 3.28Å; R85-S87 VanDerWaalsContact O-N 3.15Å; R85-D88 WeakPolarHBondContact O-CB 3.23Å; R85-D88 PolarHBondContact O-N 2.92Å; R85-L89 PolarHBondContact O-N 3.28Å; R85-E130 IonicContact CZ-OE1 2.72Å; R85-E130 IonicContact NE-OE1 3.33Å; R85-E130 IonicContact NH2-OE1 3.81Å; R85-E130 PolarHBondContact NH2-OE1 3.48Å; R85-E130 IonicContact NH2-OE2 3.7Å; R85-E130 PolarHBondContact NH2-OE2 3.02Å
86	K	92.2	Very high	88	Confident	72 Å²	72	58.9 Å²	58.9	31%	0.313	31%	0.31	S	S	.	.	H	α-helix	trans	-53.5	-37.2	175.4	-176.6	173.7	175	-179.8	0	112.1	D88 L89 M90 D98 L101	K86-D88 VanDerWaalsContact C-N 3.29Å; K86-D88 PolarHBondContact O-N 3.47Å; K86-L89 PolarHBondContact O-N 2.96Å; K86-M90 HydrophobicContact CG-SD 4.29Å; K86-M90 WeakPolarHBondContact O-CG 3.49Å; K86-M90 PolarHBondContact O-N 3.5Å; K86-D98 WeakPolarHBondContact CE-OD1 3.12Å; K86-D98 IonicContact NZ-OD1 2.79Å; K86-D98 PolarHBondContact NZ-OD1 3.34Å; K86-D98 IonicContact NZ-OD2 2.72Å; K86-D98 PolarHBondContact NZ-OD2 3.06Å; K86-L101 HydrophobicContact CD-CD1 4.23Å; K86-L101 HydrophobicContact CG-CD1 4.15Å
87	S	91.3	Very high	88.1	Confident	60 Å²	60	59.2 Å²	59.2	42%	0.42	31%	0.311	S	S	.	.	H	α-helix	trans	-61.1	-32.7	175.3	56.1	0	0	0	0	113.9	R85 K91	R85-S87 PolarHBondContact O-N 3.28Å; R85-S87 VanDerWaalsContact O-N 3.15Å; S87-K91 WeakPolarHBondContact O-CG 3.3Å
88	D	90.8	Very high	88.3	Confident	40 Å²	40	62.8 Å²	62.8	21%	0.214	33%	0.33	C	S	.	.	H	α-helix	trans	-76	-36.9	178.4	-61.2	-37.9	0	0	0	110.8	R85 K86 K91	R85-D88 WeakPolarHBondContact O-CB 3.23Å; R85-D88 PolarHBondContact O-N 2.92Å; K86-D88 VanDerWaalsContact C-N 3.29Å; K86-D88 PolarHBondContact O-N 3.47Å; D88-K91 WeakPolarHBondContact O-CB 3.39Å; D88-K91 PolarHBondContact O-N 2.75Å; D88-K91 IonicContact OD1-NZ 2.84Å; D88-K91 PolarHBondContact OD1-NZ 2.79Å
89	L	92.4	Very high	89.1	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-69.1	-37.1	175.9	-58.1	176.4	0	0	0	111.8	L72 L76 F84 R85 K86 K91 I92 I93 I97 L101 L110 W190	L72-L89 HydrophobicContact CD1-CD2 4.41Å; L76-L89 HydrophobicContact CD1-CD2 4.02Å; L76-L89 HydrophobicContact CD2-CD2 3.77Å; L76-L89 HydrophobicContact CG-CD2 4.48Å; F84-L89 HydrophobicContact CB-CD1 4.2Å; F84-L89 HydrophobicContact CB-CD2 3.76Å; F84-L89 HydrophobicContact CB-CG 3.91Å; F84-L89 HydrophobicContact CD1-CD2 4.19Å; F84-L89 HydrophobicContact CG-CD2 3.94Å; R85-L89 PolarHBondContact O-N 3.28Å; K86-L89 PolarHBondContact O-N 2.96Å; L89-K91 PolarHBondContact O-N 2.89Å; L89-I92 WeakPolarHBondContact O-CB 3.43Å; L89-I92 PolarHBondContact O-N 3.47Å; L89-I93 PolarHBondContact O-N 2.86Å; L89-I97 HydrophobicContact CB-CD1 3.89Å; L89-I97 HydrophobicContact CB-CG1 4.4Å; L89-L101 HydrophobicContact CD1-CD2 3.66Å; L89-L110 HydrophobicContact CD1-CD1 4.37Å; L89-W190 HydrophobicContact CD1-CB 4.25Å; L89-W190 HydrophobicContact CD1-CG 4.29Å
90	M	90.2	Very high	89.6	Confident	87 Å²	87	60.5 Å²	60.5	43%	0.429	32%	0.318	S	S	.	.	H	α-helix	trans	-59.2	-29.8	172.9	-81	168.9	43.7	0	0	113.5	K86 I92 I93 P94 I97	K86-M90 HydrophobicContact CG-SD 4.29Å; K86-M90 WeakPolarHBondContact O-CG 3.49Å; K86-M90 PolarHBondContact O-N 3.5Å; M90-I92 PolarHBondContact O-N 2.96Å; M90-I93 CarbonylContact O-C 3.59Å; M90-I93 VanDerWaalsContact O-C 3.25Å; M90-P94 WeakPolarHBondContact O-CA 3.42Å; M90-I97 HydrophobicContact CG-CB 4.3Å; M90-I97 HydrophobicContact CG-CG1 4.25Å; M90-I97 HydrophobicContact CG-CG2 3.78Å
91	K	88.6	Confident	90.3	Very high	160 Å²	160	54.8 Å²	54.8	70%	0.696	28%	0.277	S	S	*	.	H	α-helix	trans	-69.2	-26.5	175.5	-66.5	167.4	-171.9	163.4	0	112.2	S87 D88 L89	S87-K91 WeakPolarHBondContact O-CG 3.3Å; D88-K91 WeakPolarHBondContact O-CB 3.39Å; D88-K91 PolarHBondContact O-N 2.75Å; D88-K91 IonicContact OD1-NZ 2.84Å; D88-K91 PolarHBondContact OD1-NZ 2.79Å; L89-K91 PolarHBondContact O-N 2.89Å
92	I	85.4	Confident	90.8	Very high	46 Å²	46	58.6 Å²	58.6	24%	0.236	29%	0.288	C	S	.	.	H	α-helix	trans	-83.6	-43.4	178.7	-53.6	176	0	0	0	109.7	L72 R75 L76 L89 M90	L72-I92 HydrophobicContact CD1-CB 4.28Å; L72-I92 HydrophobicContact CD1-CD1 4.3Å; L72-I92 HydrophobicContact CD1-CG2 4.07Å; R75-I92 HydrophobicContact CB-CG2 3.8Å; R75-I92 HydrophobicContact CG-CG2 3.82Å; L76-I92 HydrophobicContact CD2-CD1 4.05Å; L89-I92 WeakPolarHBondContact O-CB 3.43Å; L89-I92 PolarHBondContact O-N 3.47Å; M90-I92 PolarHBondContact O-N 2.96Å
93	I	85.5	Confident	91.2	Very high	8 Å²	8	59.1 Å²	59.1	4%	0.041	29%	0.291	C	S	.	.			trans	-132.2	94.1	-179	-61.7	-171.5	0	0	0	108.2	L68 L72 L89 M90 N95 I97	L68-I93 HydrophobicContact CD1-CD1 3.91Å; L68-I93 HydrophobicContact CD1-CG1 4.37Å; L68-I93 HydrophobicContact CD1-CG2 3.76Å; L68-I93 HydrophobicContact CD2-CG2 3.73Å; L68-I93 HydrophobicContact CG-CD1 3.93Å; L68-I93 HydrophobicContact CG-CG2 3.75Å; L68-I93 VanDerWaalsContact O-CD1 3.3Å; L68-I93 WeakPolarHBondContact O-CD1 3.28Å; L72-I93 HydrophobicContact CB-CD1 3.57Å; L72-I93 HydrophobicContact CD1-CD1 4.1Å; L72-I93 HydrophobicContact CD1-CG1 4.35Å; L72-I93 HydrophobicContact CD2-CD1 4.37Å; L72-I93 HydrophobicContact CG-CD1 4.21Å; L89-I93 PolarHBondContact O-N 2.86Å; M90-I93 CarbonylContact O-C 3.59Å; M90-I93 VanDerWaalsContact O-C 3.25Å; I93-N95 WeakPolarHBondContact CG2-O 3.38Å; I93-I97 HydrophobicContact CB-CD1 4.41Å
94	P	78.4	Confident	91.3	Very high	94 Å²	94	58.7 Å²	58.7	61%	0.61	29%	0.289	S	S	*	.			trans	-68.1	-36.7	-173.9	-21.5	32.7	0	0	0	113.5	M90	M90-P94 WeakPolarHBondContact O-CA 3.42Å
95	N	82.1	Confident	91.4	Very high	118 Å²	118	61.7 Å²	61.7	63%	0.631	31%	0.306	S	S	*	.	S	Bend	trans	-103.2	146.1	-176.8	-58.5	-24.3	0	0	0	109.8	I93 I97	I93-N95 WeakPolarHBondContact CG2-O 3.38Å; N95-I97 PolarHBondContact O-N 3.31Å; N95-I97 VanDerWaalsContact O-N 3.1Å
96	D	88.4	Confident	91.6	Very high	103 Å²	103	63.8 Å²	63.8	55%	0.551	33%	0.33	S	S	*	.	S	Bend	trans	61.6	17.2	174	-50.9	-51	0	0	0	116.6	L68 D98 Q99 C100	L68-D96 HydrophobicContact CD2-CB 3.84Å; D96-D98 PolarHBondContact O-N 3.19Å; D96-D98 VanDerWaalsContact O-N 3.1Å; D96-Q99 WeakPolarHBondContact O-CB 3.2Å; D96-Q99 PolarHBondContact O-N 3.29Å; D96-C100 PolarHBondContact O-N 3.36Å; D96-C100 VanDerWaalsContact O-N 3.14Å
97	I	92.6	Very high	91.8	Very high	9 Å²	9	60.8 Å²	60.8	5%	0.046	32%	0.317	C	S	.	.	H	α-helix	trans	-54.4	-36.7	-179.8	-170.6	57.5	0	0	0	112.7	L72 L89 M90 I93 N95 Q99 C100 L101	L72-I97 HydrophobicContact CD2-CD1 3.93Å; L89-I97 HydrophobicContact CB-CD1 3.89Å; L89-I97 HydrophobicContact CB-CG1 4.4Å; M90-I97 HydrophobicContact CG-CB 4.3Å; M90-I97 HydrophobicContact CG-CG1 4.25Å; M90-I97 HydrophobicContact CG-CG2 3.78Å; I93-I97 HydrophobicContact CB-CD1 4.41Å; N95-I97 PolarHBondContact O-N 3.31Å; N95-I97 VanDerWaalsContact O-N 3.1Å; I97-Q99 VanDerWaalsContact C-N 3.31Å; I97-Q99 PolarHBondContact O-N 3.41Å; I97-C100 PolarHBondContact O-N 2.92Å; I97-L101 HydrophobicContact CD1-CG 4.29Å; I97-L101 HydrophobicContact CG1-CD1 4.07Å; I97-L101 HydrophobicContact CG1-CG 4.17Å; I97-L101 WeakPolarHBondContact O-CB 3.42Å; I97-L101 VanDerWaalsContact O-CG 3.24Å; I97-L101 WeakPolarHBondContact O-CG 3.4Å; I97-L101 PolarHBondContact O-N 3.18Å
98	D	94	Very high	92	Very high	79 Å²	79	63.8 Å²	63.8	42%	0.422	32%	0.323	S	S	.	.	H	α-helix	trans	-66.3	-33	179.5	-80.6	-56.7	0	0	0	112.6	K86 D96 R102	K86-D98 WeakPolarHBondContact CE-OD1 3.12Å; K86-D98 IonicContact NZ-OD1 2.79Å; K86-D98 PolarHBondContact NZ-OD1 3.34Å; K86-D98 IonicContact NZ-OD2 2.72Å; K86-D98 PolarHBondContact NZ-OD2 3.06Å; D96-D98 PolarHBondContact O-N 3.19Å; D96-D98 VanDerWaalsContact O-N 3.1Å; D98-R102 WeakPolarHBondContact O-CG 3.48Å; D98-R102 PolarHBondContact O-N 3.02Å; D98-R102 PolarHBondContact O-NH1 3.44Å; D98-R102 VanDerWaalsContact O-NH1 3.13Å
99	Q	94.3	Very high	92.2	Very high	81 Å²	81	61.9 Å²	61.9	38%	0.379	31%	0.312	S	S	.	.	H	α-helix	trans	-67.8	-48.4	171.3	177.8	177.6	-9.9	0	0	110.5	D96 I97 L101 R102 E103	D96-Q99 WeakPolarHBondContact O-CB 3.2Å; D96-Q99 PolarHBondContact O-N 3.29Å; I97-Q99 VanDerWaalsContact C-N 3.31Å; I97-Q99 PolarHBondContact O-N 3.41Å; Q99-L101 VanDerWaalsContact C-N 3.31Å; Q99-L101 PolarHBondContact O-N 3.44Å; Q99-R102 PolarHBondContact O-N 3.29Å; Q99-R102 VanDerWaalsContact O-N 3.14Å; Q99-E103 HydrophobicContact CG-CG 4.49Å; Q99-E103 WeakPolarHBondContact CG-OE1 3.27Å; Q99-E103 PolarHBondContact NE2-OE1 3.41Å; Q99-E103 PolarHBondContact O-N 3.41Å
100	C	95.3	Very high	92.4	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-57	-45.4	178.2	-64.9	0	0	0	0	111.7	S69 L72 D96 I97 R102 E103 L104	S69-C100 WeakPolarHBondContact OG-CA 3.32Å; L72-C100 HydrophobicContact CD2-CB 4.13Å; D96-C100 PolarHBondContact O-N 3.36Å; D96-C100 VanDerWaalsContact O-N 3.14Å; I97-C100 PolarHBondContact O-N 2.92Å; C100-R102 PolarHBondContact O-N 2.9Å; C100-E103 PolarHBondContact O-N 2.95Å; C100-L104 WeakPolarHBondContact O-CB 3.48Å; C100-L104 WeakPolarHBondContact O-CG 3.38Å; C100-L104 PolarHBondContact O-N 3.32Å
101	L	96.2	Very high	92.7	Very high	3 Å²	3	58.6 Å²	58.6	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-40.6	177.8	-69.8	175.8	0	0	0	112.3	K86 L89 I97 Q99 N105 L110 W190	K86-L101 HydrophobicContact CD-CD1 4.23Å; K86-L101 HydrophobicContact CG-CD1 4.15Å; L89-L101 HydrophobicContact CD1-CD2 3.66Å; I97-L101 HydrophobicContact CD1-CG 4.29Å; I97-L101 HydrophobicContact CG1-CD1 4.07Å; I97-L101 HydrophobicContact CG1-CG 4.17Å; I97-L101 WeakPolarHBondContact O-CB 3.42Å; I97-L101 VanDerWaalsContact O-CG 3.24Å; I97-L101 WeakPolarHBondContact O-CG 3.4Å; I97-L101 PolarHBondContact O-N 3.18Å; Q99-L101 VanDerWaalsContact C-N 3.31Å; Q99-L101 PolarHBondContact O-N 3.44Å; L101-N105 WeakPolarHBondContact O-CB 3.21Å; L101-N105 PolarHBondContact O-N 3.47Å; L101-L110 HydrophobicContact CD2-CD1 3.79Å; L101-W190 HydrophobicContact CB-CH2 4.1Å; L101-W190 HydrophobicContact CB-CZ2 3.93Å; L101-W190 HydrophobicContact CD1-CZ2 4Å; L101-W190 HydrophobicContact CD2-CD2 3.88Å; L101-W190 HydrophobicContact CD2-CE3 4.37Å; L101-W190 HydrophobicContact CD2-CG 4.14Å; L101-W190 HydrophobicContact CD2-CZ2 4.25Å; L101-W190 HydrophobicContact CG-CZ2 4.28Å
102	R	96.6	Very high	93	Very high	159 Å²	159	54.7 Å²	54.7	60%	0.6	29%	0.287	S	S	*	.	H	α-helix	trans	-64	-46.9	175.4	-74.6	-171.8	-54.9	-89.6	5.2	112	D98 Q99 C100 N105 S106	D98-R102 WeakPolarHBondContact O-CG 3.48Å; D98-R102 PolarHBondContact O-N 3.02Å; D98-R102 PolarHBondContact O-NH1 3.44Å; D98-R102 VanDerWaalsContact O-NH1 3.13Å; Q99-R102 PolarHBondContact O-N 3.29Å; Q99-R102 VanDerWaalsContact O-N 3.14Å; C100-R102 PolarHBondContact O-N 2.9Å; R102-N105 PolarHBondContact O-N 2.55Å; R102-S106 WeakPolarHBondContact O-CB 3.26Å; R102-S106 PolarHBondContact O-N 3.21Å
103	E	97.5	Very high	93.4	Very high	46 Å²	46	56.7 Å²	56.7	22%	0.215	30%	0.299	C	S	.	.	H	α-helix	trans	-60.1	-48.4	178.1	-77.5	-179	-162.2	0	0	111.3	L65 S66 S69 Q99 C100 N105 S106 L107	L65-E103 HydrophobicContact CD2-CB 4.14Å; S66-E103 WeakPolarHBondContact CB-OE2 3.33Å; S66-E103 PolarHBondContact N-OE2 3.45Å; S66-E103 PolarHBondContact OG-OE2 3.44Å; S69-E103 VanDerWaalsContact CB-OE2 3.29Å; S69-E103 WeakPolarHBondContact CB-OE2 3.46Å; S69-E103 PolarHBondContact OG-OE2 2.97Å; Q99-E103 HydrophobicContact CG-CG 4.49Å; Q99-E103 WeakPolarHBondContact CG-OE1 3.27Å; Q99-E103 PolarHBondContact NE2-OE1 3.41Å; Q99-E103 PolarHBondContact O-N 3.41Å; C100-E103 PolarHBondContact O-N 2.95Å; E103-N105 PolarHBondContact O-N 3.05Å; E103-S106 WeakPolarHBondContact O-CB 3.37Å; E103-S106 PolarHBondContact O-N 2.96Å; E103-L107 PolarHBondContact O-N 3.34Å
104	L	97.2	Very high	93.7	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-71	-29.1	-178.5	-64	-177.7	0	0	0	113.6	L65 L72 I73 C100 K108 F109 L110	L65-L104 HydrophobicContact CD1-CD2 3.88Å; L72-L104 HydrophobicContact CB-CD1 4.12Å; L72-L104 HydrophobicContact CD2-CD1 3.75Å; L72-L104 HydrophobicContact CG-CD1 4.05Å; I73-L104 HydrophobicContact CD1-CD2 3.41Å; I73-L104 VanDerWaalsContact CD1-CD2 3.41Å; I73-L104 HydrophobicContact CG1-CD1 4.35Å; I73-L104 HydrophobicContact CG1-CD2 3.5Å; I73-L104 VanDerWaalsContact CG1-CD2 3.5Å; C100-L104 WeakPolarHBondContact O-CB 3.48Å; C100-L104 WeakPolarHBondContact O-CG 3.38Å; C100-L104 PolarHBondContact O-N 3.32Å; L104-K108 PolarHBondContact O-N 2.96Å; L104-K108 VanDerWaalsContact O-N 3.16Å; L104-F109 HydrophobicContact CD2-CD1 4.49Å; L104-F109 PolarHBondContact O-N 3.47Å; L104-L110 HydrophobicContact CB-CB 3.98Å; L104-L110 HydrophobicContact CB-CD1 4.09Å; L104-L110 HydrophobicContact CB-CG 4.16Å; L104-L110 HydrophobicContact CD1-CD1 3.65Å; L104-L110 HydrophobicContact CD1-CG 4.21Å; L104-L110 PolarHBondContact O-N 3.44Å; L104-L110 VanDerWaalsContact O-N 3.16Å
105	N	96.9	Very high	94.3	Very high	69 Å²	69	56.8 Å²	56.8	37%	0.369	29%	0.293	S	S	.	.	H	α-helix	trans	-71	-41.1	170.6	-166.9	40.6	0	0	0	111.9	L101 R102 E103 L107 K108 L110 W190	L101-N105 WeakPolarHBondContact O-CB 3.21Å; L101-N105 PolarHBondContact O-N 3.47Å; R102-N105 PolarHBondContact O-N 2.55Å; E103-N105 PolarHBondContact O-N 3.05Å; N105-L107 PolarHBondContact O-N 3.05Å; N105-K108 WeakPolarHBondContact O-CA 3.49Å; N105-K108 PolarHBondContact O-N 3.15Å; N105-L110 WeakPolarHBondContact CA-O 3.4Å; N105-L110 PolarHBondContact OD1-O 3.24Å; N105-W190 HydrophobicContact CB-CH2 4.22Å; N105-W190 HydrophobicContact CB-CZ3 3.78Å
106	S	96.8	Very high	94.6	Very high	105 Å²	105	54.5 Å²	54.5	73%	0.734	29%	0.286	S	S	*	.	H	α-helix	trans	-61.3	-36.4	173.8	-173	0	0	0	0	111.8	R102 E103 K108	R102-S106 WeakPolarHBondContact O-CB 3.26Å; R102-S106 PolarHBondContact O-N 3.21Å; E103-S106 WeakPolarHBondContact O-CB 3.37Å; E103-S106 PolarHBondContact O-N 2.96Å; S106-K108 PolarHBondContact O-N 3.39Å
107	L	96.8	Very high	94.7	Very high	10 Å²	10	50.4 Å²	50.4	5%	0.052	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-9.7	174	-165.6	73.6	0	0	0	113.1	W58 D61 F62 L65 I73 E103 N105 F109	W58-L107 HydrophobicContact CH2-CD2 4.36Å; W58-L107 HydrophobicContact CZ2-CD1 4.4Å; W58-L107 HydrophobicContact CZ2-CD2 3.6Å; W58-L107 HydrophobicContact CZ2-CG 3.85Å; W58-L107 PolarHBondContact NE1-O 2.93Å; D61-L107 HydrophobicContact CB-CD1 3.94Å; F62-L107 HydrophobicContact CB-CD1 4.24Å; F62-L107 HydrophobicContact CB-CD2 4.38Å; F62-L107 HydrophobicContact CD2-CD2 4.28Å; L65-L107 HydrophobicContact CD1-CD2 3.6Å; L65-L107 HydrophobicContact CD2-CD2 4.47Å; L65-L107 HydrophobicContact CG-CD2 4.33Å; I73-L107 HydrophobicContact CD1-CD2 4.14Å; E103-L107 PolarHBondContact O-N 3.34Å; N105-L107 PolarHBondContact O-N 3.05Å; L107-F109 HydrophobicContact CD2-CB 4.08Å; L107-F109 PolarHBondContact O-N 3.07Å
108	K	95.7	Very high	94.6	Very high	123 Å²	123	51.9 Å²	51.9	54%	0.535	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	14.5	-172.5	-52.5	177.4	176.7	179.9	0	115	L104 N105 S106 C111 Y196	L104-K108 PolarHBondContact O-N 2.96Å; L104-K108 VanDerWaalsContact O-N 3.16Å; N105-K108 WeakPolarHBondContact O-CA 3.49Å; N105-K108 PolarHBondContact O-N 3.15Å; S106-K108 PolarHBondContact O-N 3.39Å; K108-C111 PolarHBondContact O-SG 2.88Å; K108-C111 VanDerWaalsContact O-SG 3.38Å; K108-Y196 HydrophobicContact CB-CD2 4.3Å; K108-Y196 HydrophobicContact CB-CE2 3.5Å; K108-Y196 VanDerWaalsContact CB-CE2 3.5Å; K108-Y196 WeakPolarHBondContact CD-OH 3.47Å; K108-Y196 WeakPolarHBondContact O-CD2 3.46Å; K108-Y196 VanDerWaalsContact O-CE2 3.23Å; K108-Y196 WeakPolarHBondContact O-CE2 3.29Å
109	F	96.2	Very high	94.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	-74.5	-39.8	174.7	-178.9	-93.6	0	0	0	111.6	I73 L104 L107 V192 D193 I200	I73-F109 HydrophobicContact CB-CE1 4.22Å; I73-F109 HydrophobicContact CB-CZ 4.34Å; I73-F109 HydrophobicContact CD1-CD1 4.44Å; I73-F109 HydrophobicContact CD1-CG 4.42Å; I73-F109 HydrophobicContact CG1-CD1 3.71Å; I73-F109 HydrophobicContact CG1-CE1 3.75Å; I73-F109 HydrophobicContact CG1-CG 4.14Å; I73-F109 HydrophobicContact CG1-CZ 4.21Å; I73-F109 HydrophobicContact CG2-CE1 4.26Å; I73-F109 HydrophobicContact CG2-CE2 4.1Å; I73-F109 HydrophobicContact CG2-CZ 3.88Å; L104-F109 HydrophobicContact CD2-CD1 4.49Å; L104-F109 PolarHBondContact O-N 3.47Å; L107-F109 HydrophobicContact CD2-CB 4.08Å; L107-F109 PolarHBondContact O-N 3.07Å; F109-V192 HydrophobicContact CE1-CG1 3.97Å; F109-V192 HydrophobicContact CE1-CG2 4.22Å; F109-V192 HydrophobicContact CE2-CG1 3.99Å; F109-V192 HydrophobicContact CZ-CG1 3.6Å; F109-V192 WeakPolarHBondContact O-CA 3.19Å; F109-D193 PolarHBondContact O-N 3.02Å; F109-I200 HydrophobicContact CD2-CD1 4.21Å; F109-I200 HydrophobicContact CE2-CD1 3.75Å
110	L	96.4	Very high	94.2	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	121.9	170.7	-79.4	-179.4	0	0	0	110.2	L76 L89 L101 L104 N105 W190 Y191 V192	L76-L110 HydrophobicContact CD1-CD1 4.18Å; L76-L110 HydrophobicContact CD1-CD2 4.08Å; L76-L110 HydrophobicContact CD1-CG 4.45Å; L89-L110 HydrophobicContact CD1-CD1 4.37Å; L101-L110 HydrophobicContact CD2-CD1 3.79Å; L104-L110 HydrophobicContact CB-CB 3.98Å; L104-L110 HydrophobicContact CB-CD1 4.09Å; L104-L110 HydrophobicContact CB-CG 4.16Å; L104-L110 HydrophobicContact CD1-CD1 3.65Å; L104-L110 HydrophobicContact CD1-CG 4.21Å; L104-L110 PolarHBondContact O-N 3.44Å; L104-L110 VanDerWaalsContact O-N 3.16Å; N105-L110 WeakPolarHBondContact CA-O 3.4Å; N105-L110 PolarHBondContact OD1-O 3.24Å; L110-W190 HydrophobicContact CB-CE3 3.97Å; L110-W190 HydrophobicContact CD2-CB 4.34Å; L110-Y191 CarbonylContact C-O 3.51Å; L110-Y191 WeakPolarHBondContact CA-O 3.19Å; L110-V192 HydrophobicContact CD2-CB 4.48Å; L110-V192 HydrophobicContact CD2-CG2 3.67Å
111	C	96.1	Very high	93.9	Very high	18 Å²	18	52.4 Å²	52.4	12%	0.122	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	157	-175.9	-69.2	0	0	0	0	111.3	K108 W190 Y191	K108-C111 PolarHBondContact O-SG 2.88Å; K108-C111 VanDerWaalsContact O-SG 3.38Å; C111-W190 CarbonylContact O-C 3.56Å; C111-W190 WeakPolarHBondContact O-CA 3.3Å; C111-Y191 HydrophobicContact CB-CD1 3.96Å; C111-Y191 HydrophobicContact CB-CD2 4.43Å; C111-Y191 HydrophobicContact CB-CE1 3.34Å; C111-Y191 HydrophobicContact CB-CE2 3.87Å; C111-Y191 HydrophobicContact CB-CG 4.48Å; C111-Y191 PolarHBondContact N-O 3.45Å; C111-Y191 WeakPolarHBondContact O-CD1 3.17Å; C111-Y191 PolarHBondContact O-N 2.95Å
112	T	94.4	Very high	93.8	Very high	77 Å²	77	52.3 Å²	52.3	47%	0.472	28%	0.277	S	S	.	.			trans	-110.1	-12.1	177.2	57.4	0	0	0	0	113.7	M114 W190	T112-M114 PolarHBondContact O-N 3.01Å; T112-W190 HydrophobicContact CG2-CD2 3.89Å; T112-W190 HydrophobicContact CG2-CE3 3.54Å; T112-W190 HydrophobicContact CG2-CH2 3.7Å; T112-W190 HydrophobicContact CG2-CZ2 4.01Å; T112-W190 HydrophobicContact CG2-CZ3 3.43Å; T112-W190 VanDerWaalsContact CG2-CZ3 3.43Å
113	D	93.2	Very high	93.6	Very high	89 Å²	89	44.7 Å²	44.7	48%	0.476	25%	0.248	S	C	.	.			trans	-76.3	88.6	179.7	-179.2	16.6	0	0	0	111.6	L115 S116 Y191	D113-L115 PolarHBondContact O-N 3.48Å; D113-L115 PolarHBondContact OD1-N 2.89Å; D113-L115 VanDerWaalsContact OD1-N 3.16Å; D113-S116 PolarHBondContact O-OG 3.35Å; D113-Y191 WeakPolarHBondContact O-CE1 3.46Å; D113-Y191 PolarHBondContact O-OH 3.49Å
114	M	92.8	Very high	93.3	Very high	9 Å²	9	47.2 Å²	47.2	4%	0.044	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-68.8	-18.7	-179.3	-63.1	-64.6	157.5	0	0	113.4	I83 T112 S116 L117 L122 A183 L186 C189 Y191	I83-M114 HydrophobicContact CG1-SD 4.48Å; I83-M114 HydrophobicContact CG2-CE 4.33Å; I83-M114 HydrophobicContact CG2-SD 4.41Å; T112-M114 PolarHBondContact O-N 3.01Å; M114-S116 VanDerWaalsContact C-N 3.27Å; M114-S116 PolarHBondContact O-N 3.18Å; M114-L117 PolarHBondContact O-N 3.19Å; M114-L117 HydrophobicContact SD-CD1 4.03Å; M114-L122 HydrophobicContact CB-CD2 3.97Å; M114-L122 HydrophobicContact SD-CD2 4.36Å; M114-A183 HydrophobicContact CB-CB 3.93Å; M114-L186 HydrophobicContact CG-CB 4.37Å; M114-C189 HydrophobicContact CE-CB 3.75Å; M114-C189 WeakPolarHBondContact CE-O 3.37Å; M114-Y191 HydrophobicContact CE-CD1 3.86Å; M114-Y191 HydrophobicContact SD-CD1 3.93Å
115	L	91	Very high	93.1	Very high	94 Å²	94	48.3 Å²	48.3	49%	0.492	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-72.2	-23.6	-175.6	-68.5	173.4	0	0	0	112.6	D113 L117 K179 A183	D113-L115 PolarHBondContact O-N 3.48Å; D113-L115 PolarHBondContact OD1-N 2.89Å; D113-L115 VanDerWaalsContact OD1-N 3.16Å; L115-L117 PolarHBondContact O-N 2.81Å; L115-K179 HydrophobicContact CD2-CB 4.36Å; L115-A183 HydrophobicContact CD2-CB 3.75Å; L115-A183 HydrophobicContact CG-CB 4.19Å
116	S	89.2	Confident	92.9	Very high	70 Å²	70	45.1 Å²	45.1	49%	0.49	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-66.5	-24	175.1	69.7	0	0	0	0	112.9	D113 M114 Y191	D113-S116 PolarHBondContact O-OG 3.35Å; M114-S116 VanDerWaalsContact C-N 3.27Å; M114-S116 PolarHBondContact O-N 3.18Å; S116-Y191 PolarHBondContact OG-OH 3.1Å
117	L	90.6	Very high	92.8	Very high	17 Å²	17	43 Å²	43	9%	0.089	23%	0.232	C	C	.	.	S	Bend	trans	-78.7	157.1	-174.4	-62.3	179.6	0	0	0	113.2	I83 M114 L115 M121 L122 K179 Y191	I83-L117 HydrophobicContact CD1-CD1 3.85Å; I83-L117 HydrophobicContact CG1-CD1 4.09Å; M114-L117 PolarHBondContact O-N 3.19Å; M114-L117 HydrophobicContact SD-CD1 4.03Å; L115-L117 PolarHBondContact O-N 2.81Å; L117-M121 HydrophobicContact CD2-CE 4.33Å; L117-M121 HydrophobicContact CD2-SD 4.34Å; L117-L122 HydrophobicContact CB-CD1 4.48Å; L117-L122 HydrophobicContact CB-CD2 4.04Å; L117-L122 HydrophobicContact CB-CG 4.01Å; L117-L122 HydrophobicContact CD1-CD2 4.01Å; L117-K179 WeakPolarHBondContact O-CE 3.33Å; L117-K179 PolarHBondContact O-NZ 3.46Å; L117-Y191 HydrophobicContact CD1-CD1 3.91Å; L117-Y191 HydrophobicContact CD1-CD2 4.07Å; L117-Y191 HydrophobicContact CD1-CE1 4.32Å; L117-Y191 HydrophobicContact CD1-CE2 4.49Å; L117-Y191 HydrophobicContact CD1-CG 3.75Å; L117-Y191 HydrophobicContact CD2-CD2 3.75Å; L117-Y191 HydrophobicContact CD2-CE2 3.64Å; L117-Y191 HydrophobicContact CD2-CG 4.29Å; L117-Y191 HydrophobicContact CG-CD1 4.43Å; L117-Y191 HydrophobicContact CG-CD2 4.3Å; L117-Y191 HydrophobicContact CG-CE1 4.38Å; L117-Y191 HydrophobicContact CG-CE2 4.26Å; L117-Y191 HydrophobicContact CG-CG 4.37Å
118	S	90.1	Very high	92.7	Very high	40 Å²	40	45.9 Å²	45.9	28%	0.28	24%	0.242	S	C	.	.			trans	-67.2	153.3	175.4	102.9	0	0	0	0	111.8	E120 M121 L122	S118-E120 WeakPolarHBondContact CB-OE2 3.38Å; S118-E120 PolarHBondContact O-N 2.83Å; S118-E120 PolarHBondContact OG-N 2.92Å; S118-E120 PolarHBondContact OG-OE2 2.89Å; S118-M121 PolarHBondContact O-N 2.84Å; S118-M121 PolarHBondContact OG-N 2.83Å; S118-L122 WeakPolarHBondContact O-CG 3.34Å; S118-L122 PolarHBondContact O-N 3.03Å; S118-L122 VanDerWaalsContact O-N 3.15Å
119	S	90.1	Very high	92.6	Very high	12 Å²	12	47.4 Å²	47.4	8%	0.084	25%	0.251	C	S	.	.	H	α-helix	trans	-61.8	-35.3	176.8	-60	0	0	0	0	111.5	V123 K179	S119-V123 WeakPolarHBondContact O-CB 3.46Å; S119-V123 VanDerWaalsContact O-CG2 3.26Å; S119-V123 WeakPolarHBondContact O-CG2 3.16Å; S119-V123 PolarHBondContact O-N 2.76Å; S119-K179 VanDerWaalsContact OG-CE 3.25Å; S119-K179 WeakPolarHBondContact OG-CE 3.07Å; S119-K179 WeakPolarHBondContact OG-CG 3.17Å
120	E	89.4	Confident	92.5	Very high	108 Å²	108	48.8 Å²	48.8	51%	0.505	26%	0.258	S	S	.	.	H	α-helix	trans	-61.8	-47.4	176.8	-61.6	79.2	-163.5	0	0	111.7	S118 V123 H124 L156	S118-E120 WeakPolarHBondContact CB-OE2 3.38Å; S118-E120 PolarHBondContact O-N 2.83Å; S118-E120 PolarHBondContact OG-N 2.92Å; S118-E120 PolarHBondContact OG-OE2 2.89Å; E120-V123 PolarHBondContact O-N 3.45Å; E120-H124 WeakPolarHBondContact O-CB 3.28Å; E120-H124 PolarHBondContact O-N 2.91Å; E120-H124 PolarHBondContact O-ND1 3.39Å; E120-L156 HydrophobicContact CB-CD1 4.46Å; E120-L156 HydrophobicContact CG-CD1 4.07Å; E120-L156 HydrophobicContact CG-CD2 4.28Å
121	M	89.6	Confident	92.4	Very high	52 Å²	52	48.8 Å²	48.8	26%	0.256	26%	0.258	S	S	.	.	H	α-helix	trans	-61.9	-46.2	180	-68.6	-178.6	76.9	0	0	111.6	K82 L117 S118 V123 H124 A125	K82-M121 HydrophobicContact CB-CE 4.06Å; K82-M121 HydrophobicContact CG-CE 4.13Å; L117-M121 HydrophobicContact CD2-CE 4.33Å; L117-M121 HydrophobicContact CD2-SD 4.34Å; S118-M121 PolarHBondContact O-N 2.84Å; S118-M121 PolarHBondContact OG-N 2.83Å; M121-V123 PolarHBondContact O-N 2.91Å; M121-H124 PolarHBondContact O-N 2.68Å; M121-A125 PolarHBondContact O-N 2.88Å
122	L	93.4	Very high	92.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-46.5	-179.9	-69.4	173.6	0	0	0	111.7	I83 M114 L117 S118 H124 A125 K179 I182 L186	I83-L122 HydrophobicContact CD1-CD2 4.18Å; M114-L122 HydrophobicContact CB-CD2 3.97Å; M114-L122 HydrophobicContact SD-CD2 4.36Å; L117-L122 HydrophobicContact CB-CD1 4.48Å; L117-L122 HydrophobicContact CB-CD2 4.04Å; L117-L122 HydrophobicContact CB-CG 4.01Å; L117-L122 HydrophobicContact CD1-CD2 4.01Å; S118-L122 WeakPolarHBondContact O-CG 3.34Å; S118-L122 PolarHBondContact O-N 3.03Å; S118-L122 VanDerWaalsContact O-N 3.15Å; L122-H124 VanDerWaalsContact C-N 3.31Å; L122-H124 PolarHBondContact O-N 3.21Å; L122-A125 PolarHBondContact O-N 3.05Å; L122-K179 HydrophobicContact CD1-CB 4.35Å; L122-K179 HydrophobicContact CD1-CD 4.38Å; L122-K179 HydrophobicContact CD1-CG 4.07Å; L122-I182 HydrophobicContact CB-CB 4.46Å; L122-I182 HydrophobicContact CB-CD1 4.46Å; L122-I182 HydrophobicContact CB-CG2 3.76Å; L122-L186 HydrophobicContact CD2-CD1 3.9Å
123	V	92.4	Very high	92.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.8	-35.2	178	168.7	0	0	0	0	111.8	S119 E120 M121 A125 L126 L131 R152 L156 F178 I182	S119-V123 WeakPolarHBondContact O-CB 3.46Å; S119-V123 VanDerWaalsContact O-CG2 3.26Å; S119-V123 WeakPolarHBondContact O-CG2 3.16Å; S119-V123 PolarHBondContact O-N 2.76Å; E120-V123 PolarHBondContact O-N 3.45Å; M121-V123 PolarHBondContact O-N 2.91Å; V123-A125 VanDerWaalsContact C-N 3.28Å; V123-A125 PolarHBondContact O-N 2.84Å; V123-L126 PolarHBondContact O-N 2.89Å; V123-L131 HydrophobicContact CG1-CD2 4.1Å; V123-R152 HydrophobicContact CG1-CB 3.63Å; V123-R152 HydrophobicContact CG1-CG 3.58Å; V123-L156 HydrophobicContact CB-CD2 4.28Å; V123-L156 HydrophobicContact CB-CG 4.43Å; V123-L156 HydrophobicContact CG1-CG 4.33Å; V123-L156 HydrophobicContact CG2-CD2 3.91Å; V123-L156 HydrophobicContact CG2-CG 4.29Å; V123-F178 HydrophobicContact CG2-CE1 3.61Å; V123-F178 HydrophobicContact CG2-CZ 3.52Å; V123-I182 HydrophobicContact CG2-CD1 3.51Å
124	H	91.5	Very high	92.1	Very high	98 Å²	98	47 Å²	47	45%	0.454	24%	0.241	S	C	.	.	H	α-helix	trans	-69.4	-23.3	177.7	-83.7	74.1	0	0	0	113.7	E120 M121 L122 R152	E120-H124 WeakPolarHBondContact O-CB 3.28Å; E120-H124 PolarHBondContact O-N 2.91Å; E120-H124 PolarHBondContact O-ND1 3.39Å; M121-H124 PolarHBondContact O-N 2.68Å; L122-H124 VanDerWaalsContact C-N 3.31Å; L122-H124 PolarHBondContact O-N 3.21Å; H124-R152 PolarHBondContact CD2-NH1 3.25Å; H124-R152 PolarHBondContact O-NH2 2.73Å
125	A	92.2	Very high	92	Very high	24 Å²	24	46.5 Å²	46.5	20%	0.198	24%	0.239	C	C	.	.	H	α-helix	trans	-79	-18.1	177.5	0	0	0	0	0	114.2	I83 M121 L122 V123 L186	I83-A125 HydrophobicContact CB-CB 3.72Å; I83-A125 HydrophobicContact CD1-CB 3.44Å; I83-A125 VanDerWaalsContact CD1-CB 3.44Å; I83-A125 HydrophobicContact CG1-CB 4.13Å; I83-A125 HydrophobicContact CG2-CB 4Å; M121-A125 PolarHBondContact O-N 2.88Å; L122-A125 PolarHBondContact O-N 3.05Å; V123-A125 VanDerWaalsContact C-N 3.28Å; V123-A125 PolarHBondContact O-N 2.84Å; A125-L186 HydrophobicContact CB-CD1 4.26Å; A125-L186 HydrophobicContact CB-CD2 4.49Å
126	L	93.7	Very high	91.9	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	23%	0.232	C	C	.	.			trans	-71.8	137.5	-179.4	-61	179.7	0	0	0	111.5	V123 E130 L131 L134 R152 I182 I185 L186	V123-L126 PolarHBondContact O-N 2.89Å; L126-E130 WeakPolarHBondContact CA-OE2 3.43Å; L126-E130 HydrophobicContact CB-CB 4.07Å; L126-E130 HydrophobicContact CD2-CB 3.99Å; L126-E130 HydrophobicContact CG-CB 4.47Å; L126-L131 HydrophobicContact CB-CD2 3.82Å; L126-L131 HydrophobicContact CB-CG 3.76Å; L126-L131 HydrophobicContact CD1-CD2 3.87Å; L126-L131 HydrophobicContact CD1-CG 4.5Å; L126-L131 HydrophobicContact CG-CD2 4.45Å; L126-L134 HydrophobicContact CD1-CD2 3.94Å; L126-R152 PolarHBondContact O-NH2 3.33Å; L126-I182 HydrophobicContact CD1-CG1 4.39Å; L126-I182 HydrophobicContact CD1-CG2 4.04Å; L126-I182 HydrophobicContact CD2-CG2 4.11Å; L126-I182 HydrophobicContact CG-CG2 4.24Å; L126-I185 HydrophobicContact CD2-CB 4.45Å; L126-I185 HydrophobicContact CD2-CG2 3.78Å; L126-L186 HydrophobicContact CD2-CD1 4.33Å; L126-L186 HydrophobicContact CD2-CD2 3.69Å; L126-L186 HydrophobicContact CD2-CG 3.86Å
127	N	93.1	Very high	91.8	Very high	60 Å²	60	43.9 Å²	43.9	32%	0.321	23%	0.226	S	C	.	.			trans	-76.8	173.6	169.5	70.8	45.6	0	0	0	110.5	Q129 E130 L131	N127-Q129 VanDerWaalsContact C-N 3.34Å; N127-Q129 PolarHBondContact O-N 3.06Å; N127-Q129 WeakPolarHBondContact OD1-CB 3.41Å; N127-Q129 PolarHBondContact OD1-N 3.06Å; N127-E130 VanDerWaalsContact CG-CD 3.46Å; N127-E130 VanDerWaalsContact CG-OE2 3.31Å; N127-E130 PolarHBondContact N-OE2 3.41Å; N127-E130 PolarHBondContact ND2-OE1 2.87Å; N127-E130 VanDerWaalsContact ND2-OE1 3.15Å; N127-E130 PolarHBondContact ND2-OE2 3.18Å; N127-E130 PolarHBondContact O-N 3.29Å; N127-E130 WeakPolarHBondContact OD1-CG 3.29Å; N127-E130 PolarHBondContact OD1-N 2.88Å; N127-L131 WeakPolarHBondContact O-CG 3.31Å; N127-L131 PolarHBondContact O-N 3.42Å
128	R	94.7	Very high	91.6	Very high	70 Å²	70	43.7 Å²	43.7	26%	0.264	22%	0.224	S	C	.	.	H	α-helix	trans	-59.2	-44.1	-176.3	179.6	56.3	-177.3	-153.2	-10	112.8	E130 L131 D132 F143 K144 L146 M148	R128-E130 VanDerWaalsContact C-N 3.34Å; R128-E130 PolarHBondContact O-N 3.46Å; R128-L131 PolarHBondContact O-N 3.12Å; R128-D132 IonicContact CZ-OD1 3.42Å; R128-D132 IonicContact NE-OD1 3.05Å; R128-D132 PolarHBondContact NE-OD1 3.32Å; R128-D132 IonicContact NE-OD2 3.31Å; R128-D132 PolarHBondContact NE-OD2 2.71Å; R128-D132 IonicContact NH2-OD1 3.7Å; R128-D132 WeakPolarHBondContact O-CB 3.26Å; R128-D132 VanDerWaalsContact O-CG 3.31Å; R128-D132 PolarHBondContact O-N 2.94Å; R128-F143 PolarHBondContact NH2-O 3.17Å; R128-K144 PolarHBondContact NH2-O 2.95Å; R128-L146 VanDerWaalsContact CZ-O 3.24Å; R128-L146 PolarHBondContact NH1-O 3.19Å; R128-L146 PolarHBondContact NH2-O 3.05Å; R128-M148 HydrophobicContact CB-SD 3.7Å; R128-M148 WeakPolarHBondContact CD-SD 3.26Å; R128-M148 HydrophobicContact CG-SD 4.17Å
129	Q	94.1	Very high	91.4	Very high	155 Å²	155	46.2 Å²	46.2	72%	0.724	24%	0.235	S	C	*	.	H	α-helix	trans	-64.5	-41	-177.7	-175.6	179.9	-6.2	0	0	111.6	N127 D132 Q133	N127-Q129 VanDerWaalsContact C-N 3.34Å; N127-Q129 PolarHBondContact O-N 3.06Å; N127-Q129 WeakPolarHBondContact OD1-CB 3.41Å; N127-Q129 PolarHBondContact OD1-N 3.06Å; Q129-D132 PolarHBondContact O-N 2.62Å; Q129-Q133 PolarHBondContact O-N 3.47Å
130	E	94.8	Very high	91.2	Very high	29 Å²	29	46.7 Å²	46.7	14%	0.136	24%	0.236	C	C	.	.	H	α-helix	trans	-68.2	-38.3	177	-68.5	162.2	171.9	0	0	112.2	R85 L126 N127 R128 Q133 L134 I185	R85-E130 IonicContact CZ-OE1 2.72Å; R85-E130 IonicContact NE-OE1 3.33Å; R85-E130 IonicContact NH2-OE1 3.81Å; R85-E130 PolarHBondContact NH2-OE1 3.48Å; R85-E130 IonicContact NH2-OE2 3.7Å; R85-E130 PolarHBondContact NH2-OE2 3.02Å; L126-E130 WeakPolarHBondContact CA-OE2 3.43Å; L126-E130 HydrophobicContact CB-CB 4.07Å; L126-E130 HydrophobicContact CD2-CB 3.99Å; L126-E130 HydrophobicContact CG-CB 4.47Å; N127-E130 VanDerWaalsContact CG-CD 3.46Å; N127-E130 VanDerWaalsContact CG-OE2 3.31Å; N127-E130 PolarHBondContact N-OE2 3.41Å; N127-E130 PolarHBondContact ND2-OE1 2.87Å; N127-E130 VanDerWaalsContact ND2-OE1 3.15Å; N127-E130 PolarHBondContact ND2-OE2 3.18Å; N127-E130 PolarHBondContact O-N 3.29Å; N127-E130 WeakPolarHBondContact OD1-CG 3.29Å; N127-E130 PolarHBondContact OD1-N 2.88Å; R128-E130 VanDerWaalsContact C-N 3.34Å; R128-E130 PolarHBondContact O-N 3.46Å; E130-Q133 PolarHBondContact O-N 3.21Å; E130-L134 WeakPolarHBondContact O-CB 3.37Å; E130-L134 PolarHBondContact O-N 3.25Å; E130-I185 HydrophobicContact CB-CG2 4.04Å; E130-I185 HydrophobicContact CG-CG2 3.81Å
131	L	94.7	Very high	91.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-64.8	-41.5	173.1	-72.3	170.8	0	0	0	111.7	V123 L126 N127 R128 Q133 L134 A135 M148 L151 R152 L155	V123-L131 HydrophobicContact CG1-CD2 4.1Å; L126-L131 HydrophobicContact CB-CD2 3.82Å; L126-L131 HydrophobicContact CB-CG 3.76Å; L126-L131 HydrophobicContact CD1-CD2 3.87Å; L126-L131 HydrophobicContact CD1-CG 4.5Å; L126-L131 HydrophobicContact CG-CD2 4.45Å; N127-L131 WeakPolarHBondContact O-CG 3.31Å; N127-L131 PolarHBondContact O-N 3.42Å; R128-L131 PolarHBondContact O-N 3.12Å; L131-Q133 VanDerWaalsContact C-N 3.33Å; L131-L134 PolarHBondContact O-N 2.87Å; L131-A135 VanDerWaalsContact O-CB 3.24Å; L131-A135 WeakPolarHBondContact O-CB 3.21Å; L131-A135 PolarHBondContact O-N 3.4Å; L131-M148 HydrophobicContact CD1-CE 3.35Å; L131-M148 HydrophobicContact CD1-SD 3.57Å; L131-M148 VanDerWaalsContact CD1-SD 3.57Å; L131-L151 HydrophobicContact CB-CD2 3.64Å; L131-L151 HydrophobicContact CB-CG 4.28Å; L131-R152 HydrophobicContact CD1-CG 3.9Å; L131-R152 HydrophobicContact CD2-CG 4.11Å; L131-L155 HydrophobicContact CB-CD1 4.47Å; L131-L155 HydrophobicContact CD2-CD1 3.64Å
132	D	93.8	Very high	91.1	Very high	36 Å²	36	54.1 Å²	54.1	19%	0.193	27%	0.271	C	S	.	.	H	α-helix	trans	-62.9	-40.8	176.4	-76.9	-13.9	0	0	0	111	R128 Q129 A135 G136 F143	R128-D132 IonicContact CZ-OD1 3.42Å; R128-D132 IonicContact NE-OD1 3.05Å; R128-D132 PolarHBondContact NE-OD1 3.32Å; R128-D132 IonicContact NE-OD2 3.31Å; R128-D132 PolarHBondContact NE-OD2 2.71Å; R128-D132 IonicContact NH2-OD1 3.7Å; R128-D132 WeakPolarHBondContact O-CB 3.26Å; R128-D132 VanDerWaalsContact O-CG 3.31Å; R128-D132 PolarHBondContact O-N 2.94Å; Q129-D132 PolarHBondContact O-N 2.62Å; D132-A135 PolarHBondContact O-N 2.84Å; D132-G136 PolarHBondContact O-N 2.8Å; D132-F143 HydrophobicContact CB-CD2 4.13Å; D132-F143 HydrophobicContact CB-CE2 3.76Å; D132-F143 WeakPolarHBondContact O-CE2 3.36Å; D132-F143 WeakPolarHBondContact OD1-CD2 3.48Å
133	Q	91.5	Very high	90.9	Very high	110 Å²	110	56 Å²	56	51%	0.514	28%	0.279	S	S	.	.	H	α-helix	trans	-60.6	-49.4	172.9	-177.5	-178	1.7	0	0	111.2	Q129 E130 L131 A135 G136 M137	Q129-Q133 PolarHBondContact O-N 3.47Å; E130-Q133 PolarHBondContact O-N 3.21Å; L131-Q133 VanDerWaalsContact C-N 3.33Å; Q133-A135 VanDerWaalsContact C-N 3.34Å; Q133-A135 PolarHBondContact O-N 3.02Å; Q133-G136 PolarHBondContact O-N 3.47Å; Q133-M137 WeakPolarHBondContact O-CG 3.2Å; Q133-M137 PolarHBondContact O-N 3.49Å; Q133-M137 VanDerWaalsContact O-N 3.08Å
134	L	91	Very high	90.9	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-40.2	179.6	-171.8	66.7	0	0	0	111.9	L126 E130 L131 G136 M137 Y138 L155 F178 L181 I182 I185	L126-L134 HydrophobicContact CD1-CD2 3.94Å; E130-L134 WeakPolarHBondContact O-CB 3.37Å; E130-L134 PolarHBondContact O-N 3.25Å; L131-L134 PolarHBondContact O-N 2.87Å; L134-G136 VanDerWaalsContact C-N 3.34Å; L134-G136 PolarHBondContact O-N 3.44Å; L134-M137 WeakPolarHBondContact O-CB 3.23Å; L134-M137 PolarHBondContact O-N 3.39Å; L134-Y138 HydrophobicContact CD1-CD2 4.31Å; L134-Y138 HydrophobicContact CD1-CE2 4.19Å; L134-Y138 PolarHBondContact O-N 2.79Å; L134-Y138 VanDerWaalsContact O-N 3.12Å; L134-L155 HydrophobicContact CB-CD2 4.42Å; L134-L155 HydrophobicContact CD2-CD1 4.17Å; L134-L155 HydrophobicContact CD2-CD2 4.01Å; L134-L155 HydrophobicContact CG-CD2 3.9Å; L134-F178 HydrophobicContact CD2-CE2 3.84Å; L134-F178 HydrophobicContact CD2-CZ 4.2Å; L134-F178 HydrophobicContact CG-CE2 4.41Å; L134-L181 HydrophobicContact CD1-CB 4.32Å; L134-I182 HydrophobicContact CD1-CG1 4.27Å; L134-I182 HydrophobicContact CD2-CD1 3.97Å; L134-I182 HydrophobicContact CD2-CG1 3.65Å; L134-I185 HydrophobicContact CB-CD1 4.42Å; L134-I185 HydrophobicContact CD1-CD1 4.23Å
135	A	91.5	Very high	90.9	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-64.6	-38.8	176.9	0	0	0	0	0	112.3	L131 D132 Q133 M137 Y138 N139 I140 F143 L151 L155	L131-A135 VanDerWaalsContact O-CB 3.24Å; L131-A135 WeakPolarHBondContact O-CB 3.21Å; L131-A135 PolarHBondContact O-N 3.4Å; D132-A135 PolarHBondContact O-N 2.84Å; Q133-A135 VanDerWaalsContact C-N 3.34Å; Q133-A135 PolarHBondContact O-N 3.02Å; A135-M137 VanDerWaalsContact C-N 3.35Å; A135-Y138 CarbonylContact O-C 3.55Å; A135-Y138 PolarHBondContact O-N 2.75Å; A135-N139 PolarHBondContact O-N 3.07Å; A135-I140 HydrophobicContact CB-CB 4.33Å; A135-I140 HydrophobicContact CB-CD1 4.16Å; A135-I140 PolarHBondContact O-N 3.39Å; A135-I140 VanDerWaalsContact O-N 3.09Å; A135-F143 HydrophobicContact CB-CB 3.72Å; A135-F143 HydrophobicContact CB-CD1 4.15Å; A135-F143 HydrophobicContact CB-CD2 3.81Å; A135-F143 HydrophobicContact CB-CE2 4.43Å; A135-F143 HydrophobicContact CB-CG 3.63Å; A135-L151 HydrophobicContact CB-CD1 3.9Å; A135-L155 HydrophobicContact CB-CD2 4.38Å
136	G	88.9	Confident	90.9	Very high	34 Å²	34	64.7 Å²	64.7	35%	0.351	33%	0.326	S	S	.	.	H	α-helix	trans	-59.4	-43.4	170.5	0	0	0	0	0	112.3	D132 Q133 L134 Y138 N139	D132-G136 PolarHBondContact O-N 2.8Å; Q133-G136 PolarHBondContact O-N 3.47Å; L134-G136 VanDerWaalsContact C-N 3.34Å; L134-G136 PolarHBondContact O-N 3.44Å; G136-Y138 VanDerWaalsContact C-N 3.27Å; G136-Y138 PolarHBondContact O-N 2.62Å; G136-N139 PolarHBondContact O-N 3.49Å; G136-N139 VanDerWaalsContact O-N 3.12Å
137	M	87.3	Confident	90.9	Very high	75 Å²	75	68.3 Å²	68.3	37%	0.369	35%	0.348	S	S	.	.	H	α-helix	trans	-64.3	-30.1	177.8	-65.1	178.3	69.5	0	0	113.4	Q133 L134 A135 L181	Q133-M137 WeakPolarHBondContact O-CG 3.2Å; Q133-M137 PolarHBondContact O-N 3.49Å; Q133-M137 VanDerWaalsContact O-N 3.08Å; L134-M137 WeakPolarHBondContact O-CB 3.23Å; L134-M137 PolarHBondContact O-N 3.39Å; A135-M137 VanDerWaalsContact C-N 3.35Å; M137-L181 HydrophobicContact CE-CD1 4.04Å; M137-L181 HydrophobicContact CE-CD2 3.46Å; M137-L181 VanDerWaalsContact CE-CD2 3.46Å; M137-L181 HydrophobicContact CE-CG 4.34Å
138	Y	86.1	Confident	90.9	Very high	12 Å²	12	68.2 Å²	68.2	5%	0.047	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	5.7	176.7	-85	-101.1	0	0	0	113.6	L134 A135 G136 I140 T158 P163 F178 L181	L134-Y138 HydrophobicContact CD1-CD2 4.31Å; L134-Y138 HydrophobicContact CD1-CE2 4.19Å; L134-Y138 PolarHBondContact O-N 2.79Å; L134-Y138 VanDerWaalsContact O-N 3.12Å; A135-Y138 CarbonylContact O-C 3.55Å; A135-Y138 PolarHBondContact O-N 2.75Å; G136-Y138 VanDerWaalsContact C-N 3.27Å; G136-Y138 PolarHBondContact O-N 2.62Å; Y138-I140 PolarHBondContact O-N 3.34Å; Y138-T158 HydrophobicContact CD1-CG2 3.95Å; Y138-P163 HydrophobicContact CD1-CB 3.71Å; Y138-P163 HydrophobicContact CD1-CG 3.46Å; Y138-P163 VanDerWaalsContact CD1-CG 3.46Å; Y138-P163 HydrophobicContact CE1-CB 4.23Å; Y138-P163 HydrophobicContact CE1-CG 3.5Å; Y138-P163 HydrophobicContact CG-CB 4.22Å; Y138-P163 HydrophobicContact CG-CG 4.06Å; Y138-F178 HydrophobicContact CE1-CD2 4.2Å; Y138-F178 AromaticContact CE2-CD2 3.74Å; Y138-F178 HydrophobicContact CE2-CD2 3.74Å; Y138-F178 HydrophobicContact CE2-CE2 4.29Å; Y138-F178 AromaticContact CZ-CD2 3.54Å; Y138-F178 WeakPolarHBondContact OH-CA 3.48Å; Y138-F178 WeakPolarHBondContact OH-CB 3.34Å; Y138-F178 WeakPolarHBondContact OH-CD2 3.39Å; Y138-L181 HydrophobicContact CE2-CD1 3.94Å
139	N	85.8	Confident	90.7	Very high	94 Å²	94	70.5 Å²	70.5	50%	0.503	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	34.5	-177.8	-65.6	-55.3	0	0	0	113.6	A135 G136 K141 M164	A135-N139 PolarHBondContact O-N 3.07Å; G136-N139 PolarHBondContact O-N 3.49Å; G136-N139 VanDerWaalsContact O-N 3.12Å; N139-K141 PolarHBondContact O-N 3.39Å; N139-M164 HydrophobicContact CB-CE 3.64Å; N139-M164 WeakPolarHBondContact ND2-CE 3.25Å
140	I	86.8	Confident	90.7	Very high	21 Å²	21	67.6 Å²	67.6	11%	0.108	35%	0.349	C	S	.	.			trans	-65	128.6	174	-63.4	176.8	0	0	0	107.3	A135 Y138 F143 T154 L155	A135-I140 HydrophobicContact CB-CB 4.33Å; A135-I140 HydrophobicContact CB-CD1 4.16Å; A135-I140 PolarHBondContact O-N 3.39Å; A135-I140 VanDerWaalsContact O-N 3.09Å; Y138-I140 PolarHBondContact O-N 3.34Å; I140-F143 HydrophobicContact CB-CB 4.41Å; I140-F143 HydrophobicContact CG2-CB 4.04Å; I140-F143 WeakPolarHBondContact O-CD1 3.39Å; I140-T154 HydrophobicContact CD1-CG2 4.04Å; I140-T154 HydrophobicContact CG2-CG2 4Å; I140-L155 HydrophobicContact CD1-CD2 3.54Å; I140-L155 HydrophobicContact CD1-CG 3.81Å
141	K	87.9	Confident	90.7	Very high	184 Å²	184	66.2 Å²	66.2	80%	0.8	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	145.1	177.8	-66.5	-175.5	179.7	-179.6	0	110.3	N139 F143	N139-K141 PolarHBondContact O-N 3.39Å; K141-F143 PolarHBondContact O-N 2.84Å; K141-F143 VanDerWaalsContact O-N 3.1Å
142	N	88.2	Confident	90.6	Very high	132 Å²	132	68.3 Å²	68.3	71%	0.706	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	22.6	174.5	-56.3	-25.4	0	0	0	115.5	K144 S145	N142-K144 PolarHBondContact O-N 3.34Å; N142-K144 VanDerWaalsContact O-N 3.07Å; N142-S145 PolarHBondContact O-N 3.28Å; N142-S145 VanDerWaalsContact O-N 3.1Å; N142-S145 PolarHBondContact O-OG 2.78Å
143	F	89.9	Confident	90.5	Very high	39 Å²	39	70 Å²	70	17%	0.171	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-57.4	-29.3	-176.7	62.6	-89.4	0	0	0	114	R128 D132 A135 I140 K141 S145 L146 L151	R128-F143 PolarHBondContact NH2-O 3.17Å; D132-F143 HydrophobicContact CB-CD2 4.13Å; D132-F143 HydrophobicContact CB-CE2 3.76Å; D132-F143 WeakPolarHBondContact O-CE2 3.36Å; D132-F143 WeakPolarHBondContact OD1-CD2 3.48Å; A135-F143 HydrophobicContact CB-CB 3.72Å; A135-F143 HydrophobicContact CB-CD1 4.15Å; A135-F143 HydrophobicContact CB-CD2 3.81Å; A135-F143 HydrophobicContact CB-CE2 4.43Å; A135-F143 HydrophobicContact CB-CG 3.63Å; I140-F143 HydrophobicContact CB-CB 4.41Å; I140-F143 HydrophobicContact CG2-CB 4.04Å; I140-F143 WeakPolarHBondContact O-CD1 3.39Å; K141-F143 PolarHBondContact O-N 2.84Å; K141-F143 VanDerWaalsContact O-N 3.1Å; F143-S145 PolarHBondContact O-N 3.1Å; F143-L146 WeakPolarHBondContact O-CB 3.26Å; F143-L146 PolarHBondContact O-N 3.25Å; F143-L146 VanDerWaalsContact O-N 3.13Å; F143-L151 HydrophobicContact CB-CD1 3.74Å
144	K	91	Very high	90.4	Very high	163 Å²	163	66.9 Å²	66.9	71%	0.709	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-62.1	-25.9	178.9	-68.1	-170	176.9	-175.7	0	114	R128 N142	R128-K144 PolarHBondContact NH2-O 2.95Å; N142-K144 PolarHBondContact O-N 3.34Å; N142-K144 VanDerWaalsContact O-N 3.07Å
145	S	91.6	Very high	90.5	Very high	99 Å²	99	66.9 Å²	66.9	69%	0.692	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-88.6	-11.6	177.6	63.9	0	0	0	0	113.8	N142 F143	N142-S145 PolarHBondContact O-N 3.28Å; N142-S145 VanDerWaalsContact O-N 3.1Å; N142-S145 PolarHBondContact O-OG 2.78Å; F143-S145 PolarHBondContact O-N 3.1Å
146	L	92.4	Very high	90.4	Very high	44 Å²	44	68.4 Å²	68.4	23%	0.23	36%	0.356	C	S	.	.	S	Bend	trans	-76.2	142.7	179.8	-61.1	179	0	0	0	110.9	R128 F143 Q150 L151	R128-L146 VanDerWaalsContact CZ-O 3.24Å; R128-L146 PolarHBondContact NH1-O 3.19Å; R128-L146 PolarHBondContact NH2-O 3.05Å; F143-L146 WeakPolarHBondContact O-CB 3.26Å; F143-L146 PolarHBondContact O-N 3.25Å; F143-L146 VanDerWaalsContact O-N 3.13Å; L146-Q150 HydrophobicContact CB-CB 4.16Å; L146-Q150 HydrophobicContact CD2-CB 4.4Å; L146-L151 HydrophobicContact CB-CB 4.26Å; L146-L151 HydrophobicContact CD1-CD1 4.17Å
147	T	94	Very high	90.3	Very high	78 Å²	78	74.2 Å²	74.2	48%	0.479	37%	0.372	S	S	.	.			trans	-63.9	164.4	168.8	62.4	0	0	0	0	111.4	I149 Q150 L151	T147-I149 VanDerWaalsContact C-N 3.29Å; T147-I149 PolarHBondContact O-N 3.23Å; T147-Q150 PolarHBondContact O-N 2.97Å; T147-Q150 WeakPolarHBondContact OG1-CB 3.38Å; T147-Q150 VanDerWaalsContact OG1-CD 3.25Å; T147-Q150 VanDerWaalsContact OG1-CG 3.25Å; T147-Q150 WeakPolarHBondContact OG1-CG 3.37Å; T147-Q150 PolarHBondContact OG1-N 3.43Å; T147-Q150 PolarHBondContact OG1-OE1 3.36Å; T147-L151 VanDerWaalsContact O-CB 3.31Å; T147-L151 WeakPolarHBondContact O-CB 3.2Å; T147-L151 PolarHBondContact O-N 3.11Å
148	M	93.2	Very high	90.1	Very high	57 Å²	57	72.3 Å²	72.3	28%	0.281	37%	0.365	S	S	.	.	H	α-helix	trans	-54.4	-44.7	176.3	-76.8	-70.3	-71.7	0	0	112.3	R128 L131 L151 R152	R128-M148 HydrophobicContact CB-SD 3.7Å; R128-M148 WeakPolarHBondContact CD-SD 3.26Å; R128-M148 HydrophobicContact CG-SD 4.17Å; L131-M148 HydrophobicContact CD1-CE 3.35Å; L131-M148 HydrophobicContact CD1-SD 3.57Å; L131-M148 VanDerWaalsContact CD1-SD 3.57Å; M148-L151 PolarHBondContact O-N 3.05Å; M148-R152 WeakPolarHBondContact O-CG 3.33Å; M148-R152 PolarHBondContact O-N 3.49Å
149	I	91.4	Very high	89.7	Confident	119 Å²	119	72 Å²	72	61%	0.61	36%	0.364	S	S	*	.	H	α-helix	trans	-64.3	-51.9	-179.3	-61.7	172.5	0	0	0	110.1	T147 L151 R152 D153	T147-I149 VanDerWaalsContact C-N 3.29Å; T147-I149 PolarHBondContact O-N 3.23Å; I149-L151 VanDerWaalsContact C-N 3.27Å; I149-L151 PolarHBondContact O-N 3.24Å; I149-R152 PolarHBondContact O-N 3.11Å; I149-D153 PolarHBondContact O-N 2.79Å
150	Q	93.4	Very high	88.7	Confident	94 Å²	94	70.8 Å²	70.8	44%	0.439	36%	0.363	S	S	.	.	H	α-helix	trans	-59	-39.7	178.9	-71.8	166.3	-32.2	0	0	112.2	L146 T147 D153 T154	L146-Q150 HydrophobicContact CB-CB 4.16Å; L146-Q150 HydrophobicContact CD2-CB 4.4Å; T147-Q150 PolarHBondContact O-N 2.97Å; T147-Q150 WeakPolarHBondContact OG1-CB 3.38Å; T147-Q150 VanDerWaalsContact OG1-CD 3.25Å; T147-Q150 VanDerWaalsContact OG1-CG 3.25Å; T147-Q150 WeakPolarHBondContact OG1-CG 3.37Å; T147-Q150 PolarHBondContact OG1-N 3.43Å; T147-Q150 PolarHBondContact OG1-OE1 3.36Å; Q150-D153 PolarHBondContact O-N 3.49Å; Q150-T154 WeakPolarHBondContact O-CB 3.48Å; Q150-T154 PolarHBondContact O-N 3.41Å; Q150-T154 PolarHBondContact O-OG1 3.25Å
151	L	93.7	Very high	87.3	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-66.7	-43.1	-180	-174.3	56	0	0	0	111.6	L131 A135 F143 L146 T147 M148 I149 T154 L155	L131-L151 HydrophobicContact CB-CD2 3.64Å; L131-L151 HydrophobicContact CB-CG 4.28Å; A135-L151 HydrophobicContact CB-CD1 3.9Å; F143-L151 HydrophobicContact CB-CD1 3.74Å; L146-L151 HydrophobicContact CB-CB 4.26Å; L146-L151 HydrophobicContact CD1-CD1 4.17Å; T147-L151 VanDerWaalsContact O-CB 3.31Å; T147-L151 WeakPolarHBondContact O-CB 3.2Å; T147-L151 PolarHBondContact O-N 3.11Å; M148-L151 PolarHBondContact O-N 3.05Å; I149-L151 VanDerWaalsContact C-N 3.27Å; I149-L151 PolarHBondContact O-N 3.24Å; L151-T154 PolarHBondContact O-N 2.98Å; L151-L155 HydrophobicContact CD1-CD1 4.29Å; L151-L155 HydrophobicContact CG-CD1 4.06Å; L151-L155 WeakPolarHBondContact O-CB 3.48Å; L151-L155 WeakPolarHBondContact O-CG 3.43Å; L151-L155 PolarHBondContact O-N 2.97Å
152	R	93.6	Very high	85.6	Confident	43 Å²	43	69.2 Å²	69.2	16%	0.162	37%	0.373	C	S	.	.	H	α-helix	trans	-60.4	-48.2	174.4	-69.6	174.2	176	167.9	-1.3	111.2	V123 H124 L126 L131 M148 I149 T154 L155 L156	V123-R152 HydrophobicContact CG1-CB 3.63Å; V123-R152 HydrophobicContact CG1-CG 3.58Å; H124-R152 PolarHBondContact CD2-NH1 3.25Å; H124-R152 PolarHBondContact O-NH2 2.73Å; L126-R152 PolarHBondContact O-NH2 3.33Å; L131-R152 HydrophobicContact CD1-CG 3.9Å; L131-R152 HydrophobicContact CD2-CG 4.11Å; M148-R152 WeakPolarHBondContact O-CG 3.33Å; M148-R152 PolarHBondContact O-N 3.49Å; I149-R152 PolarHBondContact O-N 3.11Å; R152-T154 VanDerWaalsContact C-N 3.32Å; R152-T154 PolarHBondContact O-N 3.12Å; R152-L155 PolarHBondContact O-N 2.53Å; R152-L156 WeakPolarHBondContact O-CB 3.25Å; R152-L156 VanDerWaalsContact O-CG 3.31Å; R152-L156 WeakPolarHBondContact O-CG 3.45Å; R152-L156 PolarHBondContact O-N 2.99Å
153	D	91.2	Very high	83.6	Confident	72 Å²	72	64.8 Å²	64.8	39%	0.385	35%	0.351	S	S	.	.	H	α-helix	trans	-61	-41.1	177.4	-70.1	-15.1	0	0	0	112.1	I149 Q150 L156 K157	I149-D153 PolarHBondContact O-N 2.79Å; Q150-D153 PolarHBondContact O-N 3.49Å; D153-L156 PolarHBondContact O-N 3.29Å; D153-K157 WeakPolarHBondContact O-CB 3.49Å; D153-K157 VanDerWaalsContact O-CG 3.26Å; D153-K157 WeakPolarHBondContact O-CG 3.48Å; D153-K157 PolarHBondContact O-N 2.89Å
154	T	90.8	Very high	81.4	Confident	44 Å²	44	69.6 Å²	69.6	27%	0.27	38%	0.376	S	S	.	.	H	α-helix	trans	-64.3	-48.5	177.8	-55.3	0	0	0	0	110.4	I140 Q150 L151 R152 L156 K157 T158	I140-T154 HydrophobicContact CD1-CG2 4.04Å; I140-T154 HydrophobicContact CG2-CG2 4Å; Q150-T154 WeakPolarHBondContact O-CB 3.48Å; Q150-T154 PolarHBondContact O-N 3.41Å; Q150-T154 PolarHBondContact O-OG1 3.25Å; L151-T154 PolarHBondContact O-N 2.98Å; R152-T154 VanDerWaalsContact C-N 3.32Å; R152-T154 PolarHBondContact O-N 3.12Å; T154-L156 PolarHBondContact O-N 2.97Å; T154-K157 PolarHBondContact O-N 3.45Å; T154-T158 PolarHBondContact O-N 2.83Å; T154-T158 PolarHBondContact O-OG1 2.91Å
155	L	91.3	Very high	78.9	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-59.8	-44	177.5	-80.2	161.9	0	0	0	112.3	L131 L134 A135 I140 L151 R152 K157 T158 S159 F178	L131-L155 HydrophobicContact CB-CD1 4.47Å; L131-L155 HydrophobicContact CD2-CD1 3.64Å; L134-L155 HydrophobicContact CB-CD2 4.42Å; L134-L155 HydrophobicContact CD2-CD1 4.17Å; L134-L155 HydrophobicContact CD2-CD2 4.01Å; L134-L155 HydrophobicContact CG-CD2 3.9Å; A135-L155 HydrophobicContact CB-CD2 4.38Å; I140-L155 HydrophobicContact CD1-CD2 3.54Å; I140-L155 HydrophobicContact CD1-CG 3.81Å; L151-L155 HydrophobicContact CD1-CD1 4.29Å; L151-L155 HydrophobicContact CG-CD1 4.06Å; L151-L155 WeakPolarHBondContact O-CB 3.48Å; L151-L155 WeakPolarHBondContact O-CG 3.43Å; L151-L155 PolarHBondContact O-N 2.97Å; R152-L155 PolarHBondContact O-N 2.53Å; L155-K157 VanDerWaalsContact C-N 3.34Å; L155-K157 PolarHBondContact O-N 2.87Å; L155-T158 PolarHBondContact O-N 2.84Å; L155-S159 WeakPolarHBondContact O-CB 3.48Å; L155-S159 PolarHBondContact O-N 2.85Å; L155-F178 HydrophobicContact CB-CE2 4.43Å; L155-F178 HydrophobicContact CB-CZ 4.21Å; L155-F178 HydrophobicContact CD2-CE2 4.36Å
156	L	89.3	Confident	76.3	Confident	32 Å²	32	66.4 Å²	66.4	17%	0.168	38%	0.38	C	S	.	.	H	α-helix	trans	-62.5	-41.7	176.6	-72.9	167.4	0	0	0	111.4	E120 V123 R152 D153 T154 S159 F178	E120-L156 HydrophobicContact CB-CD1 4.46Å; E120-L156 HydrophobicContact CG-CD1 4.07Å; E120-L156 HydrophobicContact CG-CD2 4.28Å; V123-L156 HydrophobicContact CB-CD2 4.28Å; V123-L156 HydrophobicContact CB-CG 4.43Å; V123-L156 HydrophobicContact CG1-CG 4.33Å; V123-L156 HydrophobicContact CG2-CD2 3.91Å; V123-L156 HydrophobicContact CG2-CG 4.29Å; R152-L156 WeakPolarHBondContact O-CB 3.25Å; R152-L156 VanDerWaalsContact O-CG 3.31Å; R152-L156 WeakPolarHBondContact O-CG 3.45Å; R152-L156 PolarHBondContact O-N 2.99Å; D153-L156 PolarHBondContact O-N 3.29Å; T154-L156 PolarHBondContact O-N 2.97Å; L156-S159 WeakPolarHBondContact O-CB 3.25Å; L156-S159 PolarHBondContact O-N 3.21Å; L156-S159 PolarHBondContact O-OG 3.37Å; L156-F178 HydrophobicContact CD2-CE1 4.34Å
157	K	87.6	Confident	73.7	Confident	157 Å²	157	73.4 Å²	73.4	68%	0.683	41%	0.408	S	S	*	.	H	α-helix	trans	-65.7	-39.2	174.1	-73.7	171.9	-176.2	176.2	0	112.5	D153 T154 L155 S159 S160	D153-K157 WeakPolarHBondContact O-CB 3.49Å; D153-K157 VanDerWaalsContact O-CG 3.26Å; D153-K157 WeakPolarHBondContact O-CG 3.48Å; D153-K157 PolarHBondContact O-N 2.89Å; T154-K157 PolarHBondContact O-N 3.45Å; L155-K157 VanDerWaalsContact C-N 3.34Å; L155-K157 PolarHBondContact O-N 2.87Å; K157-S159 VanDerWaalsContact C-N 3.32Å; K157-S160 PolarHBondContact O-OG 3.18Å
158	T	82.9	Confident	70.9	Confident	35 Å²	35	79 Å²	79	22%	0.215	43%	0.427	C	S	.	.	H	α-helix	trans	-74.3	-23.2	178.3	-47.2	0	0	0	0	112	Y138 T154 L155 S160 V161	Y138-T158 HydrophobicContact CD1-CG2 3.95Å; T154-T158 PolarHBondContact O-N 2.83Å; T154-T158 PolarHBondContact O-OG1 2.91Å; L155-T158 PolarHBondContact O-N 2.84Å; T158-S160 PolarHBondContact O-N 3.05Å; T158-S160 VanDerWaalsContact O-N 3.08Å; T158-V161 CarbonylContact O-C 3.59Å; T158-V161 PolarHBondContact O-N 3.32Å
159	S	77.2	Confident	68.1	Low	6 Å²	6	86.7 Å²	86.7	4%	0.042	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.4	-179.5	75.7	0	0	0	0	114.5	L155 L156 K157 S174 F178	L155-S159 WeakPolarHBondContact O-CB 3.48Å; L155-S159 PolarHBondContact O-N 2.85Å; L156-S159 WeakPolarHBondContact O-CB 3.25Å; L156-S159 PolarHBondContact O-N 3.21Å; L156-S159 PolarHBondContact O-OG 3.37Å; K157-S159 VanDerWaalsContact C-N 3.32Å; S159-S174 PolarHBondContact O-OG 3.41Å; S159-F178 VanDerWaalsContact CB-CD1 3.43Å; S159-F178 VanDerWaalsContact CB-CG 3.47Å
160	S	66.6	Low	65.6	Low	68 Å²	68	86 Å²	86	48%	0.476	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-20.4	174.5	57.9	0	0	0	0	112.9	K157 T158 S174	K157-S160 PolarHBondContact O-OG 3.18Å; T158-S160 PolarHBondContact O-N 3.05Å; T158-S160 VanDerWaalsContact O-N 3.08Å; S160-S174 PolarHBondContact O-OG 2.85Å
161	V	57.2	Low	63	Low	91 Å²	91	87.3 Å²	87.3	55%	0.552	48%	0.479	S	S	*	.	S	Bend	trans	-108.9	116.2	-174	-163.7	0	0	0	0	109	T158 P163	T158-V161 CarbonylContact O-C 3.59Å; T158-V161 PolarHBondContact O-N 3.32Å; V161-P163 WeakPolarHBondContact O-CD 3.41Å
162	S	50.9	Low	60.7	Low	80 Å²	80	92.9 Å²	92.9	56%	0.559	51%	0.508	S	S	*	.			trans	-56.8	123.2	178.6	-176.2	0	0	0	0	110.2	M164	S162-M164 PolarHBondContact O-N 3.43Å
163	P	46.8	Very low	58.8	Low	39 Å²	39	97.7 Å²	97.7	25%	0.253	53%	0.532	S	S	.	.			trans	-76	95.6	-179.1	31.1	-33.9	0	0	0	109.4	Y138 V161	Y138-P163 HydrophobicContact CD1-CB 3.71Å; Y138-P163 HydrophobicContact CD1-CG 3.46Å; Y138-P163 VanDerWaalsContact CD1-CG 3.46Å; Y138-P163 HydrophobicContact CE1-CB 4.23Å; Y138-P163 HydrophobicContact CE1-CG 3.5Å; Y138-P163 HydrophobicContact CG-CB 4.22Å; Y138-P163 HydrophobicContact CG-CG 4.06Å; V161-P163 WeakPolarHBondContact O-CD 3.41Å
164	M	42.8	Very low	57.5	Low	141 Å²	141	96 Å²	96	70%	0.695	53%	0.526	S	S	*	.	S	Bend	trans	59.1	139.1	167.1	-69.9	-158.8	-93.2	0	0	119	N139 S162	N139-M164 HydrophobicContact CB-CE 3.64Å; N139-M164 WeakPolarHBondContact ND2-CE 3.25Å; S162-M164 PolarHBondContact O-N 3.43Å
165	A	38.7	Very low	56.4	Low	89 Å²	89	99.5 Å²	99.5	74%	0.736	54%	0.537	S	S	*	.			trans	86.9	92.4	164	0	0	0	0	0	119.2
166	S	38.2	Very low	55.7	Low	106 Å²	106	103.7 Å²	103.7	74%	0.741	56%	0.56	S	S	*	*				20.1	112.2	107.3	-28.4	0	0	0	0	116.2
167	F	37.1	Very low	55.3	Low	190 Å²	190	110.1 Å²	110.1	83%	0.833	58%	0.582	S	S	*	*			trans	151	-12.2	137.7	-94.1	-81.5	0	0	0	115.8
168	F	34.8	Very low	55.3	Low	197 Å²	197	102.6 Å²	102.6	86%	0.864	55%	0.549	S	S	*	.			trans	-127.9	117.1	172.9	-74.8	-82.1	0	0	0	112.3	V170	F168-V170 VanDerWaalsContact C-N 3.29Å; F168-V170 PolarHBondContact O-N 3.04Å
169	K	35.1	Very low	55.6	Low	217 Å²	217	103 Å²	103	94%	0.943	55%	0.548	S	S	*	.			trans	-65.1	84.3	169.8	-78.2	-178.6	174.3	177.4	0	109.5
170	V	38	Very low	56.2	Low	105 Å²	105	104.2 Å²	104.2	64%	0.636	56%	0.561	S	S	*	*			trans	-136.2	102.9	157	-175.5	0	0	0	0	107.4	F168 I172	F168-V170 VanDerWaalsContact C-N 3.29Å; F168-V170 PolarHBondContact O-N 3.04Å; V170-I172 HydrophobicContact CG1-CD1 3.73Å; V170-I172 HydrophobicContact CG1-CG1 3.84Å; V170-I172 PolarHBondContact O-N 2.98Å
171	S	39.8	Very low	57.3	Low	122 Å²	122	102.4 Å²	102.4	85%	0.853	55%	0.546	S	S	*	.			trans	-74.4	67.8	174.1	58.3	0	0	0	0	110.2
172	I	44.8	Very low	59	Low	116 Å²	116	98.1 Å²	98.1	60%	0.595	52%	0.52	S	S	*	.			trans	-81.6	119.7	159.4	-72.1	157.3	0	0	0	105.7	V170 S174	V170-I172 HydrophobicContact CG1-CD1 3.73Å; V170-I172 HydrophobicContact CG1-CG1 3.84Å; V170-I172 PolarHBondContact O-N 2.98Å; I172-S174 PolarHBondContact O-N 2.86Å
173	Q	54.3	Low	61	Low	145 Å²	145	95.1 Å²	95.1	68%	0.678	50%	0.5	S	S	*	.			trans	-52.1	123.1	-175	-66.4	-178.9	-3.3	0	0	109.5	K175 D176	Q173-K175 PolarHBondContact O-N 2.75Å; Q173-D176 PolarHBondContact O-N 3.14Å
174	S	63.5	Low	63.1	Low	36 Å²	36	101.2 Å²	101.2	25%	0.252	52%	0.518	S	S	.	.	H	α-helix	trans	-49.5	-30.8	-171.6	49.2	0	0	0	0	114.2	S159 S160 I172 F178	S159-S174 PolarHBondContact O-OG 3.41Å; S160-S174 PolarHBondContact O-OG 2.85Å; I172-S174 PolarHBondContact O-N 2.86Å; S174-F178 PolarHBondContact O-N 2.91Å; S174-F178 VanDerWaalsContact O-N 3.14Å
175	K	67.6	Low	65.5	Low	117 Å²	117	96.3 Å²	96.3	51%	0.509	49%	0.494	S	S	.	.	H	α-helix	trans	-65.6	-38.2	177.2	-71.1	-172	175.4	-175.8	0	113.8	Q173 R177 F178 K179	Q173-K175 PolarHBondContact O-N 2.75Å; K175-R177 VanDerWaalsContact C-N 3.33Å; K175-F178 WeakPolarHBondContact O-CB 3.28Å; K175-F178 PolarHBondContact O-N 2.72Å; K175-K179 PolarHBondContact O-N 2.79Å
176	D	76.5	Confident	68.1	Low	89 Å²	89	92.1 Å²	92.1	48%	0.476	46%	0.459	S	S	.	.	H	α-helix	trans	-69.3	-36.9	-179.8	-65.2	-27.3	0	0	0	110.9	Q173 K179 G180	Q173-D176 PolarHBondContact O-N 3.14Å; D176-K179 PolarHBondContact O-N 3.23Å; D176-G180 PolarHBondContact O-N 3.42Å
177	R	81.5	Confident	70.6	Confident	166 Å²	166	95 Å²	95	63%	0.626	46%	0.461	S	S	*	.	H	α-helix	trans	-65.4	-40.6	173.6	-171.3	176.8	179.8	175.5	-0.6	111.8	K175 G180 L181	K175-R177 VanDerWaalsContact C-N 3.33Å; R177-G180 PolarHBondContact O-N 3.04Å; R177-L181 WeakPolarHBondContact O-CG 3.49Å; R177-L181 PolarHBondContact O-N 2.47Å
178	F	87.5	Confident	73.2	Confident	0 Å²	0	88.2 Å²	88.2	0%	0	45%	0.445	C	S	.	.	H	α-helix	trans	-61.1	-50.2	175.1	-179.6	-109	0	0	0	111.4	V123 L134 Y138 L155 L156 S159 S174 K175 G180 L181 I182	V123-F178 HydrophobicContact CG2-CE1 3.61Å; V123-F178 HydrophobicContact CG2-CZ 3.52Å; L134-F178 HydrophobicContact CD2-CE2 3.84Å; L134-F178 HydrophobicContact CD2-CZ 4.2Å; L134-F178 HydrophobicContact CG-CE2 4.41Å; Y138-F178 HydrophobicContact CE1-CD2 4.2Å; Y138-F178 AromaticContact CE2-CD2 3.74Å; Y138-F178 HydrophobicContact CE2-CD2 3.74Å; Y138-F178 HydrophobicContact CE2-CE2 4.29Å; Y138-F178 AromaticContact CZ-CD2 3.54Å; Y138-F178 WeakPolarHBondContact OH-CA 3.48Å; Y138-F178 WeakPolarHBondContact OH-CB 3.34Å; Y138-F178 WeakPolarHBondContact OH-CD2 3.39Å; L155-F178 HydrophobicContact CB-CE2 4.43Å; L155-F178 HydrophobicContact CB-CZ 4.21Å; L155-F178 HydrophobicContact CD2-CE2 4.36Å; L156-F178 HydrophobicContact CD2-CE1 4.34Å; S159-F178 VanDerWaalsContact CB-CD1 3.43Å; S159-F178 VanDerWaalsContact CB-CG 3.47Å; S174-F178 PolarHBondContact O-N 2.91Å; S174-F178 VanDerWaalsContact O-N 3.14Å; K175-F178 WeakPolarHBondContact O-CB 3.28Å; K175-F178 PolarHBondContact O-N 2.72Å; F178-G180 VanDerWaalsContact C-N 3.34Å; F178-G180 PolarHBondContact O-N 3.35Å; F178-L181 PolarHBondContact O-N 3.49Å; F178-I182 HydrophobicContact CD1-CD1 3.74Å; F178-I182 HydrophobicContact CD2-CD1 4.34Å; F178-I182 HydrophobicContact CE1-CD1 3.35Å; F178-I182 HydrophobicContact CE2-CD1 4.02Å; F178-I182 HydrophobicContact CG-CD1 4.25Å; F178-I182 HydrophobicContact CZ-CD1 3.53Å; F178-I182 WeakPolarHBondContact O-CG1 3.38Å; F178-I182 PolarHBondContact O-N 3.15Å; F178-I182 VanDerWaalsContact O-N 3.14Å
179	K	89.4	Confident	76.1	Confident	44 Å²	44	79.2 Å²	79.2	19%	0.191	41%	0.407	C	S	.	.	H	α-helix	trans	-59	-44.3	174.7	-75.9	-167	178.3	-172.6	0	112	L115 L117 S119 L122 K175 D176 L181 I182 A183	L115-K179 HydrophobicContact CD2-CB 4.36Å; L117-K179 WeakPolarHBondContact O-CE 3.33Å; L117-K179 PolarHBondContact O-NZ 3.46Å; S119-K179 VanDerWaalsContact OG-CE 3.25Å; S119-K179 WeakPolarHBondContact OG-CE 3.07Å; S119-K179 WeakPolarHBondContact OG-CG 3.17Å; L122-K179 HydrophobicContact CD1-CB 4.35Å; L122-K179 HydrophobicContact CD1-CD 4.38Å; L122-K179 HydrophobicContact CD1-CG 4.07Å; K175-K179 PolarHBondContact O-N 2.79Å; D176-K179 PolarHBondContact O-N 3.23Å; K179-L181 VanDerWaalsContact C-N 3.32Å; K179-L181 PolarHBondContact O-N 3.4Å; K179-I182 PolarHBondContact O-N 2.97Å; K179-A183 VanDerWaalsContact O-CB 3.3Å; K179-A183 WeakPolarHBondContact O-CB 3.49Å; K179-A183 PolarHBondContact O-N 2.6Å
180	G	89.4	Confident	79	Confident	31 Å²	31	70.5 Å²	70.5	32%	0.32	37%	0.368	S	S	.	.	H	α-helix	trans	-59.7	-39.2	178.6	0	0	0	0	0	113.6	D176 R177 F178 R184	D176-G180 PolarHBondContact O-N 3.42Å; R177-G180 PolarHBondContact O-N 3.04Å; F178-G180 VanDerWaalsContact C-N 3.34Å; F178-G180 PolarHBondContact O-N 3.35Å; G180-R184 WeakPolarHBondContact O-CB 3.37Å; G180-R184 PolarHBondContact O-N 3.45Å
181	L	90.1	Very high	81.7	Confident	30 Å²	30	66.2 Å²	66.2	16%	0.157	34%	0.34	C	S	.	.	H	α-helix	trans	-65.6	-45.3	174.5	-77.5	171.9	0	0	0	112.1	L134 M137 Y138 R177 F178 K179 R184 I185	L134-L181 HydrophobicContact CD1-CB 4.32Å; M137-L181 HydrophobicContact CE-CD1 4.04Å; M137-L181 HydrophobicContact CE-CD2 3.46Å; M137-L181 VanDerWaalsContact CE-CD2 3.46Å; M137-L181 HydrophobicContact CE-CG 4.34Å; Y138-L181 HydrophobicContact CE2-CD1 3.94Å; R177-L181 WeakPolarHBondContact O-CG 3.49Å; R177-L181 PolarHBondContact O-N 2.47Å; F178-L181 PolarHBondContact O-N 3.49Å; K179-L181 VanDerWaalsContact C-N 3.32Å; K179-L181 PolarHBondContact O-N 3.4Å; L181-R184 WeakPolarHBondContact O-CB 3.4Å; L181-R184 PolarHBondContact O-N 2.99Å; L181-I185 WeakPolarHBondContact O-CG1 3.41Å; L181-I185 PolarHBondContact O-N 3.16Å; L181-I185 VanDerWaalsContact O-N 3.1Å
182	I	92.6	Very high	84.3	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-66.9	-42.9	178.6	-60.6	165.5	0	0	0	111	L122 V123 L126 L134 F178 K179 R184 I185 L186	L122-I182 HydrophobicContact CB-CB 4.46Å; L122-I182 HydrophobicContact CB-CD1 4.46Å; L122-I182 HydrophobicContact CB-CG2 3.76Å; V123-I182 HydrophobicContact CG2-CD1 3.51Å; L126-I182 HydrophobicContact CD1-CG1 4.39Å; L126-I182 HydrophobicContact CD1-CG2 4.04Å; L126-I182 HydrophobicContact CD2-CG2 4.11Å; L126-I182 HydrophobicContact CG-CG2 4.24Å; L134-I182 HydrophobicContact CD1-CG1 4.27Å; L134-I182 HydrophobicContact CD2-CD1 3.97Å; L134-I182 HydrophobicContact CD2-CG1 3.65Å; F178-I182 HydrophobicContact CD1-CD1 3.74Å; F178-I182 HydrophobicContact CD2-CD1 4.34Å; F178-I182 HydrophobicContact CE1-CD1 3.35Å; F178-I182 HydrophobicContact CE2-CD1 4.02Å; F178-I182 HydrophobicContact CG-CD1 4.25Å; F178-I182 HydrophobicContact CZ-CD1 3.53Å; F178-I182 WeakPolarHBondContact O-CG1 3.38Å; F178-I182 PolarHBondContact O-N 3.15Å; F178-I182 VanDerWaalsContact O-N 3.14Å; K179-I182 PolarHBondContact O-N 2.97Å; I182-R184 PolarHBondContact O-N 3.49Å; I182-I185 WeakPolarHBondContact O-CA 3.24Å; I182-I185 WeakPolarHBondContact O-CB 3.3Å; I182-I185 PolarHBondContact O-N 2.87Å; I182-L186 HydrophobicContact CG2-CD1 3.8Å; I182-L186 HydrophobicContact CG2-CG 4.22Å; I182-L186 PolarHBondContact O-N 3.29Å
183	A	91.7	Very high	86.6	Confident	18 Å²	18	56.6 Å²	56.6	15%	0.149	28%	0.281	C	S	.	.	H	α-helix	trans	-58.2	-36.5	175.7	0	0	0	0	0	111.6	M114 L115 K179 L186 H187	M114-A183 HydrophobicContact CB-CB 3.93Å; L115-A183 HydrophobicContact CD2-CB 3.75Å; L115-A183 HydrophobicContact CG-CB 4.19Å; K179-A183 VanDerWaalsContact O-CB 3.3Å; K179-A183 WeakPolarHBondContact O-CB 3.49Å; K179-A183 PolarHBondContact O-N 2.6Å; A183-L186 CarbonylContact O-C 3.55Å; A183-L186 PolarHBondContact O-N 3.31Å; A183-H187 PolarHBondContact O-N 2.99Å; A183-H187 VanDerWaalsContact O-N 3.12Å
184	R	91.5	Very high	88.4	Confident	167 Å²	167	53.9 Å²	53.9	63%	0.63	27%	0.268	S	S	*	.	H	α-helix	trans	-67.5	-38.3	173.3	-168.2	178.8	69.5	162.2	3.4	112.7	G180 L181 I182 L186 H187	G180-R184 WeakPolarHBondContact O-CB 3.37Å; G180-R184 PolarHBondContact O-N 3.45Å; L181-R184 WeakPolarHBondContact O-CB 3.4Å; L181-R184 PolarHBondContact O-N 2.99Å; I182-R184 PolarHBondContact O-N 3.49Å; R184-L186 VanDerWaalsContact C-N 3.35Å; R184-H187 VanDerWaalsContact O-CB 3.29Å; R184-H187 WeakPolarHBondContact O-CB 3.28Å; R184-H187 PolarHBondContact O-N 2.97Å
185	I	92.8	Very high	89.8	Confident	37 Å²	37	56 Å²	56	19%	0.19	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-41.8	174.5	-66.5	168.1	0	0	0	110.4	L126 E130 L134 L181 I182 H187	L126-I185 HydrophobicContact CD2-CB 4.45Å; L126-I185 HydrophobicContact CD2-CG2 3.78Å; E130-I185 HydrophobicContact CB-CG2 4.04Å; E130-I185 HydrophobicContact CG-CG2 3.81Å; L134-I185 HydrophobicContact CB-CD1 4.42Å; L134-I185 HydrophobicContact CD1-CD1 4.23Å; L181-I185 WeakPolarHBondContact O-CG1 3.41Å; L181-I185 PolarHBondContact O-N 3.16Å; L181-I185 VanDerWaalsContact O-N 3.1Å; I182-I185 WeakPolarHBondContact O-CA 3.24Å; I182-I185 WeakPolarHBondContact O-CB 3.3Å; I182-I185 PolarHBondContact O-N 2.87Å; I185-H187 PolarHBondContact O-N 2.89Å
186	L	93.2	Very high	91	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	12.3	179.5	-66.2	176.8	0	0	0	113.6	I83 M114 L122 A125 L126 I182 A183 R184 G188 C189	I83-L186 HydrophobicContact CD1-CD1 4.37Å; M114-L186 HydrophobicContact CG-CB 4.37Å; L122-L186 HydrophobicContact CD2-CD1 3.9Å; A125-L186 HydrophobicContact CB-CD1 4.26Å; A125-L186 HydrophobicContact CB-CD2 4.49Å; L126-L186 HydrophobicContact CD2-CD1 4.33Å; L126-L186 HydrophobicContact CD2-CD2 3.69Å; L126-L186 HydrophobicContact CD2-CG 3.86Å; I182-L186 HydrophobicContact CG2-CD1 3.8Å; I182-L186 HydrophobicContact CG2-CG 4.22Å; I182-L186 PolarHBondContact O-N 3.29Å; A183-L186 CarbonylContact O-C 3.55Å; A183-L186 PolarHBondContact O-N 3.31Å; R184-L186 VanDerWaalsContact C-N 3.35Å; L186-G188 PolarHBondContact O-N 2.92Å; L186-C189 HydrophobicContact CB-CB 4.45Å; L186-C189 WeakPolarHBondContact O-CB 3.31Å; L186-C189 PolarHBondContact O-N 2.73Å; L186-C189 PolarHBondContact O-SG 3.26Å; L186-C189 VanDerWaalsContact O-SG 3.33Å
187	H	91.6	Very high	91.8	Very high	166 Å²	166	48.3 Å²	48.3	77%	0.769	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	130.6	-179.4	178.3	-89.2	0	0	0	111.3	A183 R184 I185 C189	A183-H187 PolarHBondContact O-N 2.99Å; A183-H187 VanDerWaalsContact O-N 3.12Å; R184-H187 VanDerWaalsContact O-CB 3.29Å; R184-H187 WeakPolarHBondContact O-CB 3.28Å; R184-H187 PolarHBondContact O-N 2.97Å; I185-H187 PolarHBondContact O-N 2.89Å; H187-C189 VanDerWaalsContact C-N 3.31Å
188	G	90.9	Very high	92.5	Very high	49 Å²	49	45 Å²	45	51%	0.505	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	0.9	-175.9	0	0	0	0	0	115	L186	L186-G188 PolarHBondContact O-N 2.92Å
189	C	95.6	Very high	92.9	Very high	8 Å²	8	45.3 Å²	45.3	5%	0.054	23%	0.234	C	C	.	.			trans	-77.6	162.5	166	-61.5	0	0	0	0	111.1	I83 F84 M114 L186 H187	I83-C189 HydrophobicContact CG2-CB 3.92Å; F84-C189 WeakPolarHBondContact O-CA 3.28Å; M114-C189 HydrophobicContact CE-CB 3.75Å; M114-C189 WeakPolarHBondContact CE-O 3.37Å; L186-C189 HydrophobicContact CB-CB 4.45Å; L186-C189 WeakPolarHBondContact O-CB 3.31Å; L186-C189 PolarHBondContact O-N 2.73Å; L186-C189 PolarHBondContact O-SG 3.26Å; L186-C189 VanDerWaalsContact O-SG 3.33Å; H187-C189 VanDerWaalsContact C-N 3.31Å
190	W	96	Very high	93.2	Very high	34 Å²	34	43.2 Å²	43.2	13%	0.129	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	148.2	176.5	-63.4	83.3	0	0	0	108.8	I83 F84 L89 L101 N105 L110 C111 T112	I83-W190 CarbonylContact C-O 3.38Å; I83-W190 WeakPolarHBondContact CA-O 3.21Å; F84-W190 PolarHBondContact N-O 3.16Å; F84-W190 PolarHBondContact O-N 3.01Å; L89-W190 HydrophobicContact CD1-CB 4.25Å; L89-W190 HydrophobicContact CD1-CG 4.29Å; L101-W190 HydrophobicContact CB-CH2 4.1Å; L101-W190 HydrophobicContact CB-CZ2 3.93Å; L101-W190 HydrophobicContact CD1-CZ2 4Å; L101-W190 HydrophobicContact CD2-CD2 3.88Å; L101-W190 HydrophobicContact CD2-CE3 4.37Å; L101-W190 HydrophobicContact CD2-CG 4.14Å; L101-W190 HydrophobicContact CD2-CZ2 4.25Å; L101-W190 HydrophobicContact CG-CZ2 4.28Å; N105-W190 HydrophobicContact CB-CH2 4.22Å; N105-W190 HydrophobicContact CB-CZ3 3.78Å; L110-W190 HydrophobicContact CB-CE3 3.97Å; L110-W190 HydrophobicContact CD2-CB 4.34Å; C111-W190 CarbonylContact O-C 3.56Å; C111-W190 WeakPolarHBondContact O-CA 3.3Å; T112-W190 HydrophobicContact CG2-CD2 3.89Å; T112-W190 HydrophobicContact CG2-CE3 3.54Å; T112-W190 HydrophobicContact CG2-CH2 3.7Å; T112-W190 HydrophobicContact CG2-CZ2 4.01Å; T112-W190 HydrophobicContact CG2-CZ3 3.43Å; T112-W190 VanDerWaalsContact CG2-CZ3 3.43Å
191	Y	95.6	Very high	93.4	Very high	14 Å²	14	42.4 Å²	42.4	6%	0.055	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	149	169.4	74.3	-88.3	0	0	0	111.5	K82 L110 C111 D113 M114 S116 L117 D193	K82-Y191 CarbonylContact O-C 3.48Å; K82-Y191 WeakPolarHBondContact O-CA 3.4Å; L110-Y191 CarbonylContact C-O 3.51Å; L110-Y191 WeakPolarHBondContact CA-O 3.19Å; C111-Y191 HydrophobicContact CB-CD1 3.96Å; C111-Y191 HydrophobicContact CB-CD2 4.43Å; C111-Y191 HydrophobicContact CB-CE1 3.34Å; C111-Y191 HydrophobicContact CB-CE2 3.87Å; C111-Y191 HydrophobicContact CB-CG 4.48Å; C111-Y191 PolarHBondContact N-O 3.45Å; C111-Y191 WeakPolarHBondContact O-CD1 3.17Å; C111-Y191 PolarHBondContact O-N 2.95Å; D113-Y191 WeakPolarHBondContact O-CE1 3.46Å; D113-Y191 PolarHBondContact O-OH 3.49Å; M114-Y191 HydrophobicContact CE-CD1 3.86Å; M114-Y191 HydrophobicContact SD-CD1 3.93Å; S116-Y191 PolarHBondContact OG-OH 3.1Å; L117-Y191 HydrophobicContact CD1-CD1 3.91Å; L117-Y191 HydrophobicContact CD1-CD2 4.07Å; L117-Y191 HydrophobicContact CD1-CE1 4.32Å; L117-Y191 HydrophobicContact CD1-CE2 4.49Å; L117-Y191 HydrophobicContact CD1-CG 3.75Å; L117-Y191 HydrophobicContact CD2-CD2 3.75Å; L117-Y191 HydrophobicContact CD2-CE2 3.64Å; L117-Y191 HydrophobicContact CD2-CG 4.29Å; L117-Y191 HydrophobicContact CG-CD1 4.43Å; L117-Y191 HydrophobicContact CG-CD2 4.3Å; L117-Y191 HydrophobicContact CG-CE1 4.38Å; L117-Y191 HydrophobicContact CG-CE2 4.26Å; L117-Y191 HydrophobicContact CG-CG 4.37Å; Y191-D193 HydrophobicContact CE2-CB 4.28Å
192	V	94.8	Very high	93.7	Very high	5 Å²	5	42 Å²	42	3%	0.03	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	121.7	172.3	177.5	0	0	0	0	108.4	L76 K82 F84 F109 L110 T197	L76-V192 HydrophobicContact CB-CG2 4.11Å; L76-V192 HydrophobicContact CD1-CG2 4.14Å; K82-V192 PolarHBondContact O-N 3.47Å; F84-V192 HydrophobicContact CD2-CG2 4.31Å; F84-V192 HydrophobicContact CE2-CG2 3.83Å; F109-V192 HydrophobicContact CE1-CG1 3.97Å; F109-V192 HydrophobicContact CE1-CG2 4.22Å; F109-V192 HydrophobicContact CE2-CG1 3.99Å; F109-V192 HydrophobicContact CZ-CG1 3.6Å; F109-V192 WeakPolarHBondContact O-CA 3.19Å; L110-V192 HydrophobicContact CD2-CB 4.48Å; L110-V192 HydrophobicContact CD2-CG2 3.67Å; V192-T197 VanDerWaalsContact CG1-OG1 3.26Å; V192-T197 WeakPolarHBondContact CG1-OG1 3.35Å
193	D	93.2	Very high	93.8	Very high	32 Å²	32	42 Å²	42	17%	0.171	21%	0.212	C	C	.	.			trans	-74.8	125.1	175.7	-171.7	-47	0	0	0	110.1	F109 Y191 T195 Y196 T197	F109-D193 PolarHBondContact O-N 3.02Å; Y191-D193 HydrophobicContact CE2-CB 4.28Å; D193-T195 VanDerWaalsContact C-N 3.27Å; D193-T195 PolarHBondContact O-N 3.32Å; D193-T195 WeakPolarHBondContact OD1-CB 3.14Å; D193-T195 PolarHBondContact OD1-N 3.05Å; D193-T195 PolarHBondContact OD1-OG1 2.95Å; D193-Y196 HydrophobicContact CB-CD2 3.92Å; D193-Y196 HydrophobicContact CB-CE2 4.39Å; D193-T197 PolarHBondContact O-N 2.9Å; D193-T197 PolarHBondContact O-OG1 3.24Å; D193-T197 VanDerWaalsContact O-OG1 3.05Å
194	E	90.5	Very high	94	Very high	88 Å²	88	41.2 Å²	41.2	41%	0.411	21%	0.205	S	C	.	.	H	α-helix	trans	-68.8	-26.7	-174.7	-66	-169.2	166.3	0	0	112.5	Y196 T197 Q198	E194-Y196 VanDerWaalsContact C-N 3.35Å; E194-Y196 PolarHBondContact O-N 2.74Å; E194-T197 WeakPolarHBondContact O-CB 3.3Å; E194-T197 PolarHBondContact O-N 3.38Å; E194-Q198 VanDerWaalsContact O-CG 3.26Å; E194-Q198 WeakPolarHBondContact O-CG 3.49Å; E194-Q198 PolarHBondContact O-N 3.06Å
195	T	92.9	Very high	94.1	Very high	79 Å²	79	33.3 Å²	33.3	49%	0.485	18%	0.175	S	C	.	.	H	α-helix	trans	-58.5	-48.3	179.1	-44.2	0	0	0	0	110.5	D193 Q198 L199	D193-T195 VanDerWaalsContact C-N 3.27Å; D193-T195 PolarHBondContact O-N 3.32Å; D193-T195 WeakPolarHBondContact OD1-CB 3.14Å; D193-T195 PolarHBondContact OD1-N 3.05Å; D193-T195 PolarHBondContact OD1-OG1 2.95Å; T195-Q198 WeakPolarHBondContact O-CB 3.43Å; T195-Q198 PolarHBondContact O-N 3.07Å; T195-L199 PolarHBondContact O-N 3.04Å
196	Y	94.6	Very high	94.1	Very high	40 Å²	40	31.6 Å²	31.6	16%	0.157	17%	0.166	C	C	.	.	H	α-helix	trans	-78.8	-26.1	-178.6	-57	-70.2	0	0	0	112.5	W58 K108 D193 E194 Q198 L199 I200	W58-Y196 AromaticContact CD1-CD1 3.42Å; W58-Y196 VanDerWaalsContact CD1-CD1 3.42Å; W58-Y196 AromaticContact CD1-CE1 3.25Å; W58-Y196 AromaticContact CD2-CD1 3.75Å; W58-Y196 HydrophobicContact CD2-CD1 3.75Å; W58-Y196 HydrophobicContact CD2-CE1 4.3Å; W58-Y196 AromaticContact CE2-CD1 3.28Å; W58-Y196 AromaticContact CE2-CE1 3.99Å; W58-Y196 AromaticContact CE2-CG 3.85Å; W58-Y196 AromaticContact CG-CD1 3.85Å; W58-Y196 HydrophobicContact CG-CD1 3.85Å; W58-Y196 AromaticContact CG-CE1 3.89Å; W58-Y196 HydrophobicContact CG-CE1 3.89Å; W58-Y196 AromaticContact CZ2-CD1 3.85Å; W58-Y196 HydrophobicContact CZ2-CD1 3.85Å; W58-Y196 AromaticContact CZ2-CG 3.98Å; W58-Y196 HydrophobicContact CZ2-CG 3.98Å; W58-Y196 AromaticContact NE1-CD1 3.02Å; W58-Y196 AromaticContact NE1-CE1 3.28Å; W58-Y196 VanDerWaalsContact NE1-CE1 3.28Å; W58-Y196 AromaticContact NE1-CG 3.69Å; K108-Y196 HydrophobicContact CB-CD2 4.3Å; K108-Y196 HydrophobicContact CB-CE2 3.5Å; K108-Y196 VanDerWaalsContact CB-CE2 3.5Å; K108-Y196 WeakPolarHBondContact CD-OH 3.47Å; K108-Y196 WeakPolarHBondContact O-CD2 3.46Å; K108-Y196 VanDerWaalsContact O-CE2 3.23Å; K108-Y196 WeakPolarHBondContact O-CE2 3.29Å; D193-Y196 HydrophobicContact CB-CD2 3.92Å; D193-Y196 HydrophobicContact CB-CE2 4.39Å; E194-Y196 VanDerWaalsContact C-N 3.35Å; E194-Y196 PolarHBondContact O-N 2.74Å; Y196-Q198 VanDerWaalsContact C-N 3.3Å; Y196-L199 HydrophobicContact CD1-CD1 3.82Å; Y196-L199 HydrophobicContact CE1-CD1 4.34Å; Y196-L199 PolarHBondContact O-N 3.36Å; Y196-I200 WeakPolarHBondContact O-CG1 3.42Å; Y196-I200 PolarHBondContact O-N 3.29Å
197	T	93.6	Very high	94	Very high	5 Å²	5	31.7 Å²	31.7	3%	0.031	17%	0.167	C	C	.	.	H	α-helix	trans	-64.2	-39	168.7	-55.5	0	0	0	0	110.9	Y77 V192 D193 E194 I200 T201 E225	Y77-T197 HydrophobicContact CD2-CG2 3.82Å; Y77-T197 HydrophobicContact CE2-CG2 3.83Å; V192-T197 VanDerWaalsContact CG1-OG1 3.26Å; V192-T197 WeakPolarHBondContact CG1-OG1 3.35Å; D193-T197 PolarHBondContact O-N 2.9Å; D193-T197 PolarHBondContact O-OG1 3.24Å; D193-T197 VanDerWaalsContact O-OG1 3.05Å; E194-T197 WeakPolarHBondContact O-CB 3.3Å; E194-T197 PolarHBondContact O-N 3.38Å; T197-I200 PolarHBondContact O-N 3.02Å; T197-T201 WeakPolarHBondContact O-CB 3.26Å; T197-T201 PolarHBondContact O-N 2.99Å; T197-T201 PolarHBondContact O-OG1 3.06Å; T197-E225 HydrophobicContact CG2-CG 4.25Å; T197-E225 WeakPolarHBondContact CG2-OE1 3.47Å
198	Q	94.1	Very high	94	Very high	97 Å²	97	23.8 Å²	23.8	45%	0.453	13%	0.131	S	C	.	.	H	α-helix	trans	-65.8	-41.6	173.6	-70.8	169.9	15.1	0	0	111.4	E194 T195 Y196 I200 T201 Q202	E194-Q198 VanDerWaalsContact O-CG 3.26Å; E194-Q198 WeakPolarHBondContact O-CG 3.49Å; E194-Q198 PolarHBondContact O-N 3.06Å; T195-Q198 WeakPolarHBondContact O-CB 3.43Å; T195-Q198 PolarHBondContact O-N 3.07Å; Y196-Q198 VanDerWaalsContact C-N 3.3Å; Q198-I200 PolarHBondContact O-N 2.86Å; Q198-T201 CarbonylContact O-C 3.57Å; Q198-T201 WeakPolarHBondContact O-CA 3.5Å; Q198-T201 VanDerWaalsContact O-CB 3.29Å; Q198-T201 WeakPolarHBondContact O-CB 3.49Å; Q198-T201 PolarHBondContact O-N 3.21Å; Q198-Q202 VanDerWaalsContact O-CG 3.32Å; Q198-Q202 WeakPolarHBondContact O-CG 3.34Å; Q198-Q202 PolarHBondContact O-N 3.03Å
199	L	96	Very high	93.9	Very high	6 Å²	6	21.6 Å²	21.6	3%	0.031	11%	0.107	C	C	.	.	H	α-helix	trans	-60.4	-43.1	174.4	-71.7	175	0	0	0	112.9	F51 E55 W58 F59 T195 Y196 T201 Q202 L203	F51-L199 HydrophobicContact CD1-CD2 4.14Å; F51-L199 HydrophobicContact CE1-CD2 4.25Å; E55-L199 HydrophobicContact CB-CD1 4.41Å; E55-L199 HydrophobicContact CB-CD2 4.12Å; E55-L199 HydrophobicContact CG-CD1 4Å; E55-L199 HydrophobicContact CG-CD2 3.75Å; W58-L199 HydrophobicContact CD2-CD1 4.4Å; W58-L199 HydrophobicContact CE3-CD1 4.32Å; W58-L199 HydrophobicContact CZ3-CB 4.5Å; F59-L199 HydrophobicContact CE1-CB 4.31Å; F59-L199 HydrophobicContact CZ-CB 4.02Å; F59-L199 HydrophobicContact CZ-CD2 4.41Å; T195-L199 PolarHBondContact O-N 3.04Å; Y196-L199 HydrophobicContact CD1-CD1 3.82Å; Y196-L199 HydrophobicContact CE1-CD1 4.34Å; Y196-L199 PolarHBondContact O-N 3.36Å; L199-T201 VanDerWaalsContact C-N 3.28Å; L199-T201 PolarHBondContact O-N 3.14Å; L199-Q202 PolarHBondContact O-N 3.38Å; L199-L203 WeakPolarHBondContact O-CB 3.03Å; L199-L203 PolarHBondContact O-N 3.24Å
200	I	95.8	Very high	93.5	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-61.5	-41	173.2	-65.8	168.2	0	0	0	110.4	W58 F62 I73 Y77 F109 Y196 T197 Q198 Q202 L203 L204	W58-I200 HydrophobicContact CH2-CD1 4.12Å; W58-I200 HydrophobicContact CH2-CG1 3.9Å; W58-I200 HydrophobicContact CZ3-CG1 4.23Å; F62-I200 HydrophobicContact CE1-CD1 4.29Å; F62-I200 HydrophobicContact CE1-CG1 4.01Å; F62-I200 HydrophobicContact CZ-CD1 4.37Å; I73-I200 HydrophobicContact CG2-CD1 3.55Å; Y77-I200 HydrophobicContact CD2-CB 4.35Å; Y77-I200 HydrophobicContact CD2-CG2 3.94Å; Y77-I200 HydrophobicContact CE2-CB 4.01Å; Y77-I200 HydrophobicContact CE2-CG2 3.68Å; F109-I200 HydrophobicContact CD2-CD1 4.21Å; F109-I200 HydrophobicContact CE2-CD1 3.75Å; Y196-I200 WeakPolarHBondContact O-CG1 3.42Å; Y196-I200 PolarHBondContact O-N 3.29Å; T197-I200 PolarHBondContact O-N 3.02Å; Q198-I200 PolarHBondContact O-N 2.86Å; I200-Q202 PolarHBondContact O-N 2.9Å; I200-L203 PolarHBondContact O-N 3.36Å; I200-L204 HydrophobicContact CG2-CD1 3.92Å; I200-L204 HydrophobicContact CG2-CG 4.27Å; I200-L204 WeakPolarHBondContact O-CB 3.27Å; I200-L204 VanDerWaalsContact O-CG 3.32Å; I200-L204 WeakPolarHBondContact O-CG 3.46Å; I200-L204 PolarHBondContact O-N 2.88Å
201	T	95.1	Very high	93.2	Very high	14 Å²	14	19.6 Å²	19.6	9%	0.086	10%	0.099	C	C	.	.	H	α-helix	trans	-62.5	-42.3	177.3	-55.5	0	0	0	0	111.8	Y77 T197 Q198 L199 W205 I224 M228	Y77-T201 WeakPolarHBondContact CE2-OG1 3.3Å; Y77-T201 WeakPolarHBondContact OH-CA 3.41Å; Y77-T201 WeakPolarHBondContact OH-CB 3.38Å; Y77-T201 PolarHBondContact OH-OG1 3.46Å; T197-T201 WeakPolarHBondContact O-CB 3.26Å; T197-T201 PolarHBondContact O-N 2.99Å; T197-T201 PolarHBondContact O-OG1 3.06Å; Q198-T201 CarbonylContact O-C 3.57Å; Q198-T201 WeakPolarHBondContact O-CA 3.5Å; Q198-T201 VanDerWaalsContact O-CB 3.29Å; Q198-T201 WeakPolarHBondContact O-CB 3.49Å; Q198-T201 PolarHBondContact O-N 3.21Å; L199-T201 VanDerWaalsContact C-N 3.28Å; L199-T201 PolarHBondContact O-N 3.14Å; T201-W205 VanDerWaalsContact O-CB 3.25Å; T201-W205 WeakPolarHBondContact O-CB 2.89Å; T201-W205 PolarHBondContact O-N 3.12Å; T201-I224 HydrophobicContact CG2-CB 4.02Å; T201-I224 HydrophobicContact CG2-CG2 3.49Å; T201-I224 VanDerWaalsContact CG2-CG2 3.49Å; T201-M228 HydrophobicContact CG2-CG 3.99Å
202	Q	96	Very high	92.5	Very high	20 Å²	20	21 Å²	21	9%	0.093	11%	0.106	C	C	.	.	H	α-helix	trans	-63.9	-45.8	176.5	-72.8	172.6	10.4	0	0	111.6	F51 Q198 L199 I200 W205 L206 F263 Q264 L267	F51-Q202 HydrophobicContact CE1-CB 3.89Å; F51-Q202 VanDerWaalsContact CE1-OE1 3.27Å; F51-Q202 HydrophobicContact CZ-CB 4.08Å; Q198-Q202 VanDerWaalsContact O-CG 3.32Å; Q198-Q202 WeakPolarHBondContact O-CG 3.34Å; Q198-Q202 PolarHBondContact O-N 3.03Å; L199-Q202 PolarHBondContact O-N 3.38Å; I200-Q202 PolarHBondContact O-N 2.9Å; Q202-W205 PolarHBondContact O-N 3.14Å; Q202-L206 WeakPolarHBondContact O-CG 3.37Å; Q202-L206 PolarHBondContact O-N 3Å; Q202-F263 HydrophobicContact CB-CE1 3.94Å; Q202-F263 HydrophobicContact CB-CZ 4.07Å; Q202-F263 HydrophobicContact CG-CE1 4.01Å; Q202-F263 HydrophobicContact CG-CZ 4.19Å; Q202-Q264 VanDerWaalsContact NE2-OE1 3.17Å; Q202-L267 HydrophobicContact CG-CD1 3.54Å
203	L	95.4	Very high	91.8	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-57.2	-52.7	174.2	170	67.2	0	0	0	111.7	A37 L38 L41 F59 L199 I200 W205 L206 T207	A37-L203 HydrophobicContact CB-CD1 4.32Å; A37-L203 HydrophobicContact CB-CD2 4.4Å; A37-L203 HydrophobicContact CB-CG 4.19Å; L38-L203 HydrophobicContact CD2-CD2 3.56Å; L38-L203 HydrophobicContact CG-CD2 3.93Å; L41-L203 HydrophobicContact CB-CD1 3.77Å; L41-L203 HydrophobicContact CD2-CD1 3.91Å; L41-L203 HydrophobicContact CG-CD1 4.31Å; F59-L203 HydrophobicContact CD1-CD2 4.22Å; F59-L203 HydrophobicContact CE1-CB 3.88Å; F59-L203 HydrophobicContact CE1-CD2 3.98Å; F59-L203 HydrophobicContact CE1-CG 4.42Å; F59-L203 HydrophobicContact CZ-CB 4.09Å; L199-L203 WeakPolarHBondContact O-CB 3.03Å; L199-L203 PolarHBondContact O-N 3.24Å; I200-L203 PolarHBondContact O-N 3.36Å; L203-W205 VanDerWaalsContact C-N 3.27Å; L203-W205 PolarHBondContact O-N 3.28Å; L203-L206 PolarHBondContact O-N 2.92Å; L203-T207 HydrophobicContact CD1-CG2 4.1Å; L203-T207 WeakPolarHBondContact O-CB 2.87Å; L203-T207 VanDerWaalsContact O-CG2 3.28Å; L203-T207 WeakPolarHBondContact O-CG2 3.19Å; L203-T207 PolarHBondContact O-N 2.98Å; L203-T207 PolarHBondContact O-OG1 3.13Å
204	L	94.1	Very high	90.9	Very high	2 Å²	2	20 Å²	20	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-63	-37.2	-179.6	-70.3	176.9	0	0	0	111.2	A37 Y77 I200 T207 S208 M228 L232	A37-L204 HydrophobicContact CB-CD2 4.35Å; Y77-L204 HydrophobicContact CE1-CD1 4.07Å; I200-L204 HydrophobicContact CG2-CD1 3.92Å; I200-L204 HydrophobicContact CG2-CG 4.27Å; I200-L204 WeakPolarHBondContact O-CB 3.27Å; I200-L204 VanDerWaalsContact O-CG 3.32Å; I200-L204 WeakPolarHBondContact O-CG 3.46Å; I200-L204 PolarHBondContact O-N 2.88Å; L204-T207 WeakPolarHBondContact CA-OG1 3.19Å; L204-T207 PolarHBondContact O-OG1 3.28Å; L204-S208 WeakPolarHBondContact O-CB 3.06Å; L204-S208 PolarHBondContact O-N 2.93Å; L204-S208 PolarHBondContact O-OG 3.02Å; L204-M228 VanDerWaalsContact C-SD 3.57Å; L204-M228 HydrophobicContact CB-CB 4.11Å; L204-M228 HydrophobicContact CB-CG 4.08Å; L204-M228 HydrophobicContact CB-SD 3.87Å; L204-M228 HydrophobicContact CD1-CB 4.06Å; L204-L232 HydrophobicContact CD2-CD1 4.4Å
205	W	93.8	Very high	89.9	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.1	-55.2	176.8	177	-94.3	0	0	0	112	T201 Q202 L203 T207 S208 L209 A214 M228 Y257 F263 F266 L267 M270 F320	T201-W205 VanDerWaalsContact O-CB 3.25Å; T201-W205 WeakPolarHBondContact O-CB 2.89Å; T201-W205 PolarHBondContact O-N 3.12Å; Q202-W205 PolarHBondContact O-N 3.14Å; L203-W205 VanDerWaalsContact C-N 3.27Å; L203-W205 PolarHBondContact O-N 3.28Å; W205-T207 PolarHBondContact O-N 3.5Å; W205-S208 CarbonylContact O-C 3.6Å; W205-S208 PolarHBondContact O-N 3.32Å; W205-L209 HydrophobicContact CZ2-CD2 4.28Å; W205-L209 PolarHBondContact O-N 3.41Å; W205-A214 HydrophobicContact CH2-CB 4.03Å; W205-A214 HydrophobicContact CZ3-CB 4.06Å; W205-M228 VanDerWaalsContact CA-SD 3.53Å; W205-M228 HydrophobicContact CB-SD 4.05Å; W205-M228 HydrophobicContact CE3-CE 3.65Å; W205-M228 HydrophobicContact CE3-SD 4.13Å; W205-M228 HydrophobicContact CZ3-CE 4.07Å; W205-M228 PolarHBondContact N-SD 3.22Å; W205-M228 VanDerWaalsContact N-SD 3.42Å; W205-Y257 PolarHBondContact NE1-OH 3.36Å; W205-F263 AromaticContact CD1-CE2 3.58Å; W205-F266 AromaticContact CE2-CE1 3.5Å; W205-F266 VanDerWaalsContact CE2-CE1 3.5Å; W205-F266 HydrophobicContact CH2-CE1 4.42Å; W205-F266 HydrophobicContact CH2-CZ 4.25Å; W205-F266 AromaticContact CZ2-CE1 3.43Å; W205-F266 HydrophobicContact CZ2-CE1 3.43Å; W205-F266 VanDerWaalsContact CZ2-CE1 3.43Å; W205-F266 AromaticContact CZ2-CZ 3.43Å; W205-F266 HydrophobicContact CZ2-CZ 3.43Å; W205-F266 VanDerWaalsContact CZ2-CZ 3.43Å; W205-F266 AromaticContact NE1-CE1 3.44Å; W205-L267 HydrophobicContact CD2-CD2 4.48Å; W205-L267 HydrophobicContact CG-CD2 4.15Å; W205-M270 HydrophobicContact CE3-CE 4.17Å; W205-M270 HydrophobicContact CE3-SD 4.45Å; W205-M270 HydrophobicContact CH2-CE 3.57Å; W205-M270 HydrophobicContact CH2-SD 3.48Å; W205-M270 WeakPolarHBondContact CH2-SD 3.35Å; W205-M270 HydrophobicContact CZ2-SD 3.89Å; W205-M270 HydrophobicContact CZ3-CE 3.36Å; W205-M270 HydrophobicContact CZ3-SD 3.81Å; W205-F320 HydrophobicContact CZ2-CD1 4.13Å
206	L	93.2	Very high	88.7	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-57.7	-39.9	-179.7	-71.4	174.5	0	0	0	111.3	F47 L50 F51 Q202 L203 S208 L209 Y257 F263	F47-L206 HydrophobicContact CB-CD1 4.43Å; F47-L206 HydrophobicContact CD2-CB 4.1Å; F47-L206 HydrophobicContact CE2-CB 4.15Å; F47-L206 WeakPolarHBondContact CE2-O 3.39Å; F47-L206 HydrophobicContact CG-CB 4.48Å; L50-L206 HydrophobicContact CD1-CD1 3.96Å; L50-L206 HydrophobicContact CD1-CD2 3.85Å; F51-L206 HydrophobicContact CE2-CD1 3.53Å; F51-L206 HydrophobicContact CZ-CD1 3.65Å; Q202-L206 WeakPolarHBondContact O-CG 3.37Å; Q202-L206 PolarHBondContact O-N 3Å; L203-L206 PolarHBondContact O-N 2.92Å; L206-S208 PolarHBondContact O-N 3.47Å; L206-L209 HydrophobicContact CD2-CD1 4.04Å; L206-L209 WeakPolarHBondContact O-CG 3.41Å; L206-L209 PolarHBondContact O-N 3.11Å; L206-Y257 HydrophobicContact CD2-CD2 3.89Å; L206-Y257 HydrophobicContact CD2-CE2 3.87Å; L206-F263 HydrophobicContact CD1-CE1 3.85Å; L206-F263 HydrophobicContact CD1-CZ 3.99Å; L206-F263 HydrophobicContact CD2-CD2 4.27Å; L206-F263 HydrophobicContact CD2-CE1 4.18Å; L206-F263 HydrophobicContact CD2-CE2 3.79Å; L206-F263 HydrophobicContact CD2-CZ 3.72Å; L206-F263 HydrophobicContact CG-CE1 3.99Å; L206-F263 HydrophobicContact CG-CE2 4.17Å; L206-F263 HydrophobicContact CG-CZ 3.59Å
207	T	90.7	Very high	87.5	Confident	4 Å²	4	17 Å²	17	3%	0.025	8%	0.083	C	C	.	.	H	α-helix	trans	-78.2	-8.3	-179.4	59.6	0	0	0	0	114.8	A37 M40 L203 L204 W205 R649	A37-T207 HydrophobicContact CB-CG2 3.98Å; A37-T207 WeakPolarHBondContact O-CG2 3.38Å; M40-T207 HydrophobicContact CB-CG2 4.1Å; M40-T207 VanDerWaalsContact CE-CA 3.43Å; M40-T207 HydrophobicContact CE-CG2 3.91Å; M40-T207 HydrophobicContact CG-CG2 4.43Å; M40-T207 HydrophobicContact SD-CG2 4.3Å; L203-T207 HydrophobicContact CD1-CG2 4.1Å; L203-T207 WeakPolarHBondContact O-CB 2.87Å; L203-T207 VanDerWaalsContact O-CG2 3.28Å; L203-T207 WeakPolarHBondContact O-CG2 3.19Å; L203-T207 PolarHBondContact O-N 2.98Å; L203-T207 PolarHBondContact O-OG1 3.13Å; L204-T207 WeakPolarHBondContact CA-OG1 3.19Å; L204-T207 PolarHBondContact O-OG1 3.28Å; W205-T207 PolarHBondContact O-N 3.5Å; T207-R649 PolarHBondContact O-NH2 3.24Å; T207-R649 VanDerWaalsContact O-NH2 3.11Å
208	S	91.4	Very high	86	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.4	13.3	176.9	-49.7	0	0	0	0	112.2	L204 W205 L206 G210 S211 A214 E231 M235 R649	L204-S208 WeakPolarHBondContact O-CB 3.06Å; L204-S208 PolarHBondContact O-N 2.93Å; L204-S208 PolarHBondContact O-OG 3.02Å; W205-S208 CarbonylContact O-C 3.6Å; W205-S208 PolarHBondContact O-N 3.32Å; L206-S208 PolarHBondContact O-N 3.47Å; S208-G210 PolarHBondContact O-N 2.92Å; S208-S211 VanDerWaalsContact O-CB 3.32Å; S208-S211 WeakPolarHBondContact O-CB 3.39Å; S208-S211 PolarHBondContact O-N 3.34Å; S208-S211 PolarHBondContact O-OG 2.85Å; S208-A214 WeakPolarHBondContact O-CB 3.36Å; S208-E231 VanDerWaalsContact OG-CG 3.24Å; S208-E231 WeakPolarHBondContact OG-CG 3.47Å; S208-E231 PolarHBondContact OG-OE1 2.78Å; S208-M235 WeakPolarHBondContact OG-CE 3.35Å; S208-R649 PolarHBondContact OG-NH2 3.49Å
209	L	89.3	Confident	84.3	Confident	2 Å²	2	19 Å²	19	1%	0.01	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	124.4	171.2	-78.6	169.4	0	0	0	109.5	F47 W205 L206 I256 Y257 F320 Y646 S647	F47-L209 HydrophobicContact CE1-CD1 4.32Å; F47-L209 HydrophobicContact CZ-CD1 3.99Å; W205-L209 HydrophobicContact CZ2-CD2 4.28Å; W205-L209 PolarHBondContact O-N 3.41Å; L206-L209 HydrophobicContact CD2-CD1 4.04Å; L206-L209 WeakPolarHBondContact O-CG 3.41Å; L206-L209 PolarHBondContact O-N 3.11Å; L209-I256 HydrophobicContact CD1-CD1 4.32Å; L209-I256 HydrophobicContact CD2-CD1 4.44Å; L209-Y257 HydrophobicContact CD1-CE2 4.25Å; L209-Y257 HydrophobicContact CD2-CE2 4.44Å; L209-F320 HydrophobicContact CD2-CD1 4.13Å; L209-F320 HydrophobicContact CD2-CG 4.25Å; L209-Y646 HydrophobicContact CB-CD1 3.58Å; L209-Y646 HydrophobicContact CB-CE1 3.66Å; L209-Y646 HydrophobicContact CD1-CE1 3.97Å; L209-Y646 HydrophobicContact CG-CE1 4.47Å; L209-Y646 WeakPolarHBondContact O-CD1 3.37Å; L209-S647 WeakPolarHBondContact O-CB 3.31Å
210	G	87.2	Confident	83.2	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.01	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.1	-9.3	-175.8	0	0	0	0	0	115.6	S208 Q650	S208-G210 PolarHBondContact O-N 2.92Å; G210-Q650 WeakPolarHBondContact O-CG 3.39Å
211	S	89.4	Confident	82.3	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	-62.5	159.7	177.7	86	0	0	0	0	112.3	S208 S213 A214 Y215 E231 S647 R649	S208-S211 VanDerWaalsContact O-CB 3.32Å; S208-S211 WeakPolarHBondContact O-CB 3.39Å; S208-S211 PolarHBondContact O-N 3.34Å; S208-S211 PolarHBondContact O-OG 2.85Å; S211-S213 PolarHBondContact O-N 2.89Å; S211-S213 PolarHBondContact OG-N 3.37Å; S211-A214 PolarHBondContact O-N 3.39Å; S211-A214 VanDerWaalsContact O-N 3.08Å; S211-A214 PolarHBondContact OG-N 2.81Å; S211-Y215 WeakPolarHBondContact O-CB 3.49Å; S211-Y215 PolarHBondContact O-N 2.84Å; S211-E231 WeakPolarHBondContact CB-OE1 3.47Å; S211-E231 VanDerWaalsContact OG-CD 3.24Å; S211-E231 PolarHBondContact OG-OE1 3.38Å; S211-E231 PolarHBondContact OG-OE2 2.79Å; S211-S647 PolarHBondContact N-OG 3.47Å; S211-R649 WeakPolarHBondContact CA-O 3.44Å
212	E	82.5	Confident	81.6	Confident	42 Å²	42	29.8 Å²	29.8	20%	0.196	15%	0.146	C	C	.	.	H	α-helix	trans	-54.1	-40.5	174.7	-171.5	178.6	171.4	0	0	111.6	A214 Y215 N216 R649 R704	E212-A214 PolarHBondContact O-N 3.23Å; E212-Y215 PolarHBondContact O-N 3.3Å; E212-N216 HydrophobicContact CG-CB 4.49Å; E212-N216 PolarHBondContact O-N 2.95Å; E212-R649 PolarHBondContact N-O 2.99Å; E212-R704 IonicContact OE1-CZ 2.84Å; E212-R704 IonicContact OE1-NE 2.8Å; E212-R704 IonicContact OE1-NH2 3.41Å; E212-R704 PolarHBondContact OE1-NH2 2.8Å; E212-R704 IonicContact OE2-CZ 3.85Å; E212-R704 IonicContact OE2-NE 3.5Å; E212-R704 PolarHBondContact OE2-NE 3.19Å; E212-R704 IonicContact OE2-NH2 3.85Å
213	S	80.2	Confident	81.2	Confident	15 Å²	15	30.9 Å²	30.9	11%	0.105	16%	0.156	C	C	.	.	H	α-helix	trans	-68	-32.9	178.7	-46.2	0	0	0	0	113.2	S211 Y215 R217 E231	S211-S213 PolarHBondContact O-N 2.89Å; S211-S213 PolarHBondContact OG-N 3.37Å; S213-Y215 VanDerWaalsContact C-N 3.33Å; S213-R217 VanDerWaalsContact O-CG 3.3Å; S213-R217 WeakPolarHBondContact O-CG 3.3Å; S213-E231 WeakPolarHBondContact CB-OE2 3.41Å; S213-E231 PolarHBondContact OG-OE2 2.83Å
214	A	73.9	Confident	81	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-72.1	-31.6	174.6	0	0	0	0	0	111.7	W205 S208 S211 E212	W205-A214 HydrophobicContact CH2-CB 4.03Å; W205-A214 HydrophobicContact CZ3-CB 4.06Å; S208-A214 WeakPolarHBondContact O-CB 3.36Å; S211-A214 PolarHBondContact O-N 3.39Å; S211-A214 VanDerWaalsContact O-N 3.08Å; S211-A214 PolarHBondContact OG-N 2.81Å; E212-A214 PolarHBondContact O-N 3.23Å
215	Y	69.1	Low	80.9	Confident	43 Å²	43	33.2 Å²	33.2	17%	0.169	17%	0.167	C	C	.	.	H	α-helix	trans	-85.2	-50.1	-177	-173.4	-85.7	0	0	0	113.7	S211 E212 S213 R319 L654 F657	S211-Y215 WeakPolarHBondContact O-CB 3.49Å; S211-Y215 PolarHBondContact O-N 2.84Å; E212-Y215 PolarHBondContact O-N 3.3Å; S213-Y215 VanDerWaalsContact C-N 3.33Å; Y215-R319 PolarHBondContact OH-NH1 3.27Å; Y215-R319 PolarHBondContact OH-NH2 2.89Å; Y215-L654 HydrophobicContact CD2-CD2 4.07Å; Y215-F657 HydrophobicContact CE1-CD2 4.11Å; Y215-F657 HydrophobicContact CE1-CE1 4.46Å; Y215-F657 AromaticContact CE1-CE2 3.68Å; Y215-F657 HydrophobicContact CE1-CE2 3.68Å; Y215-F657 AromaticContact CE1-CZ 3.86Å; Y215-F657 HydrophobicContact CE1-CZ 3.86Å; Y215-F657 AromaticContact CE2-CD2 3.83Å; Y215-F657 HydrophobicContact CE2-CD2 3.83Å; Y215-F657 HydrophobicContact CE2-CE2 4.04Å; Y215-F657 AromaticContact CZ-CD2 3.33Å; Y215-F657 AromaticContact CZ-CE2 3.38Å; Y215-F657 AromaticContact CZ-CG 3.81Å; Y215-F657 AromaticContact CZ-CZ 3.92Å; Y215-F657 WeakPolarHBondContact OH-CB 3.28Å; Y215-F657 WeakPolarHBondContact OH-CD1 3.49Å; Y215-F657 WeakPolarHBondContact OH-CD2 3.45Å; Y215-F657 VanDerWaalsContact OH-CE2 3.32Å; Y215-F657 WeakPolarHBondContact OH-CE2 3.45Å; Y215-F657 WeakPolarHBondContact OH-CG 3.09Å
216	N	66.6	Low	80.5	Confident	65 Å²	65	34.4 Å²	34.4	35%	0.348	18%	0.177	S	C	.	.	S	Bend	trans	-117.2	99.1	-175.5	-80.8	-28.1	0	0	0	110	E212	E212-N216 HydrophobicContact CG-CB 4.49Å; E212-N216 PolarHBondContact O-N 2.95Å
217	R	69.6	Low	80.3	Confident	38 Å²	38	34.5 Å²	34.5	14%	0.143	18%	0.177	C	C	.	.			trans	-96.9	135.9	-178.6	-63.3	-175.8	-62.9	-119.1	16.3	111.9	S213 N219 I227 E273	S213-R217 VanDerWaalsContact O-CG 3.3Å; S213-R217 WeakPolarHBondContact O-CG 3.3Å; R217-N219 PolarHBondContact O-N 3.45Å; R217-I227 VanDerWaalsContact CD-CD1 3.41Å; R217-I227 HydrophobicContact CG-CD1 4.29Å; R217-I227 HydrophobicContact CG-CG2 4.43Å; R217-E273 IonicContact NH2-OE1 2.9Å; R217-E273 IonicContact NH2-OE2 2.86Å; R217-E273 PolarHBondContact NH2-OE2 3.34Å
218	P	61.8	Low	80.3	Confident	36 Å²	36	34.3 Å²	34.3	23%	0.234	18%	0.176	C	C	.	.			trans	-62.3	128.4	168.5	-20.2	30.4	0	0	0	111.4	M1 L4 K220 L221	M1-P218 HydrophobicContact CE-CB 3.81Å; L4-P218 HydrophobicContact CD1-CG 4.48Å; P218-K220 PolarHBondContact O-N 3.01Å; P218-L221 HydrophobicContact CB-CD1 4.34Å; P218-L221 HydrophobicContact CB-CG 4.27Å; P218-L221 HydrophobicContact CG-CD1 4.01Å; P218-L221 HydrophobicContact CG-CG 4.43Å; P218-L221 PolarHBondContact O-N 2.83Å
219	N	60.3	Low	80.1	Confident	107 Å²	107	38.9 Å²	38.9	57%	0.572	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	14.6	-179.8	-64.6	-7.2	0	0	0	115.6	R217	R217-N219 PolarHBondContact O-N 3.45Å
220	K	71.5	Confident	80	Confident	128 Å²	128	40.4 Å²	40.4	56%	0.557	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.4	-6.2	-174.1	-64.5	-173.8	179.1	-178.3	0	113.8	P218	P218-K220 PolarHBondContact O-N 3.01Å
221	L	77.5	Confident	80	Confident	20 Å²	20	40.5 Å²	40.5	11%	0.105	21%	0.206	C	C	.	.			trans	-76.8	143.2	-178.9	-64.1	176	0	0	0	110.7	L4 P218 A226 I227 I274	L4-L221 HydrophobicContact CD1-CD2 4.22Å; P218-L221 HydrophobicContact CB-CD1 4.34Å; P218-L221 HydrophobicContact CB-CG 4.27Å; P218-L221 HydrophobicContact CG-CD1 4.01Å; P218-L221 HydrophobicContact CG-CG 4.43Å; P218-L221 PolarHBondContact O-N 2.83Å; L221-A226 HydrophobicContact CB-CB 4.32Å; L221-A226 HydrophobicContact CD2-CB 4.05Å; L221-I227 HydrophobicContact CB-CG1 4.24Å; L221-I227 HydrophobicContact CD1-CB 4.25Å; L221-I227 HydrophobicContact CD1-CG1 3.54Å; L221-I274 VanDerWaalsContact O-CG2 3.31Å; L221-I274 WeakPolarHBondContact O-CG2 3.35Å
222	Q	80.3	Confident	80	Confident	100 Å²	100	41 Å²	41	47%	0.467	21%	0.208	S	C	.	.			trans	-94.4	-19	-171.2	-64.6	-175.7	22.3	0	0	113.9	Y278	Q222-Y278 HydrophobicContact CG-CD1 4.24Å; Q222-Y278 HydrophobicContact CG-CD2 3.5Å; Q222-Y278 HydrophobicContact CG-CE1 4.17Å; Q222-Y278 HydrophobicContact CG-CE2 3.42Å; Q222-Y278 VanDerWaalsContact CG-CE2 3.42Å; Q222-Y278 HydrophobicContact CG-CG 3.91Å; Q222-Y278 PolarHBondContact NE2-OH 3.26Å
223	S	88.6	Confident	80.3	Confident	43 Å²	43	44.1 Å²	44.1	30%	0.301	22%	0.219	S	C	.	.	S	Bend	trans	-156.3	165.9	-172.3	66.4	0	0	0	0	112.1	E225 A226 I227	S223-E225 VanDerWaalsContact C-N 3.28Å; S223-E225 PolarHBondContact O-N 2.86Å; S223-A226 PolarHBondContact O-N 2.95Å; S223-A226 PolarHBondContact OG-N 3.32Å; S223-I227 PolarHBondContact O-N 3.41Å
224	I	91	Very high	80.6	Confident	21 Å²	21	44.6 Å²	44.6	11%	0.108	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-40.8	172.4	-56.1	176.7	0	0	0	110.5	T201 A226 I227 M228 L267 M270 I274	T201-I224 HydrophobicContact CG2-CB 4.02Å; T201-I224 HydrophobicContact CG2-CG2 3.49Å; T201-I224 VanDerWaalsContact CG2-CG2 3.49Å; I224-A226 VanDerWaalsContact C-N 3.26Å; I224-A226 PolarHBondContact O-N 2.94Å; I224-I227 WeakPolarHBondContact O-CB 3.4Å; I224-I227 PolarHBondContact O-N 3.16Å; I224-M228 HydrophobicContact CG2-CG 4.29Å; I224-M228 WeakPolarHBondContact O-CG 3.17Å; I224-M228 PolarHBondContact O-N 2.9Å; I224-L267 HydrophobicContact CD1-CB 4.29Å; I224-L267 HydrophobicContact CD1-CD2 4.04Å; I224-L267 WeakPolarHBondContact CD1-O 3.47Å; I224-M270 HydrophobicContact CD1-CB 4.36Å; I224-M270 HydrophobicContact CD1-CG 4.25Å; I224-M270 HydrophobicContact CG1-CG 4.37Å; I224-I274 HydrophobicContact CG1-CD1 3.61Å
225	E	90.4	Very high	81.4	Confident	31 Å²	31	45 Å²	45	15%	0.145	22%	0.224	C	C	.	.	H	α-helix	trans	-54.7	-41.3	175.7	-163.5	-174.8	178.7	0	0	112	Y77 G78 K82 T197 S223 I227 M228 K229	Y77-E225 HydrophobicContact CD1-CG 4.48Å; Y77-E225 HydrophobicContact CD2-CG 4.29Å; Y77-E225 HydrophobicContact CE1-CG 3.94Å; Y77-E225 HydrophobicContact CE2-CG 3.72Å; G78-E225 VanDerWaalsContact CA-CD 3.41Å; G78-E225 WeakPolarHBondContact CA-OE1 3.37Å; G78-E225 PolarHBondContact N-OE1 3.29Å; K82-E225 IonicContact NZ-OE1 3.92Å; K82-E225 IonicContact NZ-OE2 3.73Å; T197-E225 HydrophobicContact CG2-CG 4.25Å; T197-E225 WeakPolarHBondContact CG2-OE1 3.47Å; S223-E225 VanDerWaalsContact C-N 3.28Å; S223-E225 PolarHBondContact O-N 2.86Å; E225-I227 PolarHBondContact O-N 3.42Å; E225-M228 PolarHBondContact O-N 2.78Å; E225-K229 WeakPolarHBondContact O-CB 3.22Å; E225-K229 PolarHBondContact O-N 3.21Å
226	A	86.8	Confident	82.4	Confident	25 Å²	25	43.9 Å²	43.9	21%	0.207	22%	0.22	C	C	.	.	H	α-helix	trans	-68.3	-33.3	177.8	0	0	0	0	0	112.9	L221 S223 I224 T230	L221-A226 HydrophobicContact CB-CB 4.32Å; L221-A226 HydrophobicContact CD2-CB 4.05Å; S223-A226 PolarHBondContact O-N 2.95Å; S223-A226 PolarHBondContact OG-N 3.32Å; I224-A226 VanDerWaalsContact C-N 3.26Å; I224-A226 PolarHBondContact O-N 2.94Å; A226-T230 PolarHBondContact O-N 3.27Å; A226-T230 PolarHBondContact O-OG1 3.33Å
227	I	88	Confident	83.5	Confident	2 Å²	2	42 Å²	42	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-68	-47.2	172.8	-59.8	158.2	0	0	0	109.6	R217 L221 S223 I224 E225 K229 T230 E231 M270 I274	R217-I227 VanDerWaalsContact CD-CD1 3.41Å; R217-I227 HydrophobicContact CG-CD1 4.29Å; R217-I227 HydrophobicContact CG-CG2 4.43Å; L221-I227 HydrophobicContact CB-CG1 4.24Å; L221-I227 HydrophobicContact CD1-CB 4.25Å; L221-I227 HydrophobicContact CD1-CG1 3.54Å; S223-I227 PolarHBondContact O-N 3.41Å; I224-I227 WeakPolarHBondContact O-CB 3.4Å; I224-I227 PolarHBondContact O-N 3.16Å; E225-I227 PolarHBondContact O-N 3.42Å; I227-K229 VanDerWaalsContact C-N 3.25Å; I227-K229 PolarHBondContact O-N 3.25Å; I227-T230 WeakPolarHBondContact O-CA 3.34Å; I227-T230 WeakPolarHBondContact O-CB 3.48Å; I227-T230 PolarHBondContact O-N 2.72Å; I227-E231 PolarHBondContact O-N 3.27Å; I227-M270 HydrophobicContact CD1-CE 3.86Å; I227-I274 HydrophobicContact CD1-CD1 3.33Å; I227-I274 HydrophobicContact CD1-CG1 4.01Å
228	M	91.3	Very high	84.5	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-29.2	179.5	-66	-56.6	91.7	0	0	112.6	Y77 T201 L204 W205 I224 E225 E231 L232	Y77-M228 HydrophobicContact CE1-CB 4.33Å; Y77-M228 WeakPolarHBondContact OH-CB 3.27Å; T201-M228 HydrophobicContact CG2-CG 3.99Å; L204-M228 VanDerWaalsContact C-SD 3.57Å; L204-M228 HydrophobicContact CB-CB 4.11Å; L204-M228 HydrophobicContact CB-CG 4.08Å; L204-M228 HydrophobicContact CB-SD 3.87Å; L204-M228 HydrophobicContact CD1-CB 4.06Å; W205-M228 VanDerWaalsContact CA-SD 3.53Å; W205-M228 HydrophobicContact CB-SD 4.05Å; W205-M228 HydrophobicContact CE3-CE 3.65Å; W205-M228 HydrophobicContact CE3-SD 4.13Å; W205-M228 HydrophobicContact CZ3-CE 4.07Å; W205-M228 PolarHBondContact N-SD 3.22Å; W205-M228 VanDerWaalsContact N-SD 3.42Å; I224-M228 HydrophobicContact CG2-CG 4.29Å; I224-M228 WeakPolarHBondContact O-CG 3.17Å; I224-M228 PolarHBondContact O-N 2.9Å; E225-M228 PolarHBondContact O-N 2.78Å; M228-E231 HydrophobicContact CE-CB 4.36Å; M228-E231 PolarHBondContact O-N 3.41Å; M228-L232 WeakPolarHBondContact O-CB 3.42Å; M228-L232 PolarHBondContact O-N 2.89Å
229	K	87.3	Confident	85.8	Confident	96 Å²	96	44.3 Å²	44.3	42%	0.417	22%	0.22	S	C	.	.	H	α-helix	trans	-65.2	-39.8	170	-171.3	175.1	-179.1	175.7	0	112.5	E225 I227 E231 L232 Y233	E225-K229 WeakPolarHBondContact O-CB 3.22Å; E225-K229 PolarHBondContact O-N 3.21Å; I227-K229 VanDerWaalsContact C-N 3.25Å; I227-K229 PolarHBondContact O-N 3.25Å; K229-E231 VanDerWaalsContact C-N 3.34Å; K229-L232 PolarHBondContact O-N 2.94Å; K229-Y233 PolarHBondContact O-N 3.29Å
230	T	85.9	Confident	87.1	Confident	35 Å²	35	43.2 Å²	43.2	22%	0.215	21%	0.207	C	C	.	.	H	α-helix	trans	-66.6	-38.9	174.9	-52.7	0	0	0	0	110.9	A226 I227 Y233 S234	A226-T230 PolarHBondContact O-N 3.27Å; A226-T230 PolarHBondContact O-OG1 3.33Å; I227-T230 WeakPolarHBondContact O-CA 3.34Å; I227-T230 WeakPolarHBondContact O-CB 3.48Å; I227-T230 PolarHBondContact O-N 2.72Å; T230-Y233 PolarHBondContact O-N 3.48Å; T230-S234 PolarHBondContact O-N 3.29Å; T230-S234 PolarHBondContact O-OG 3.01Å
231	E	89.1	Confident	88	Confident	3 Å²	3	39.5 Å²	39.5	1%	0.014	21%	0.206	C	C	.	.	H	α-helix	trans	-64.9	-45.1	174.4	178.4	64.1	-166.1	0	0	111.8	S208 S211 S213 I227 M228 K229 Y233 S234 M235 R649	S208-E231 VanDerWaalsContact OG-CG 3.24Å; S208-E231 WeakPolarHBondContact OG-CG 3.47Å; S208-E231 PolarHBondContact OG-OE1 2.78Å; S211-E231 WeakPolarHBondContact CB-OE1 3.47Å; S211-E231 VanDerWaalsContact OG-CD 3.24Å; S211-E231 PolarHBondContact OG-OE1 3.38Å; S211-E231 PolarHBondContact OG-OE2 2.79Å; S213-E231 WeakPolarHBondContact CB-OE2 3.41Å; S213-E231 PolarHBondContact OG-OE2 2.83Å; I227-E231 PolarHBondContact O-N 3.27Å; M228-E231 HydrophobicContact CE-CB 4.36Å; M228-E231 PolarHBondContact O-N 3.41Å; K229-E231 VanDerWaalsContact C-N 3.34Å; E231-Y233 VanDerWaalsContact C-N 3.27Å; E231-Y233 PolarHBondContact O-N 3.16Å; E231-S234 CarbonylContact O-C 3.4Å; E231-S234 WeakPolarHBondContact O-CA 3.21Å; E231-S234 WeakPolarHBondContact O-CB 3.46Å; E231-S234 PolarHBondContact O-N 3.42Å; E231-M235 HydrophobicContact CG-CE 3.9Å; E231-M235 WeakPolarHBondContact O-CG 3.36Å; E231-M235 PolarHBondContact O-N 3.46Å; E231-R649 IonicContact OE1-CZ 2.62Å; E231-R649 IonicContact OE1-NE 3.51Å; E231-R649 PolarHBondContact OE1-NE 3.21Å; E231-R649 IonicContact OE1-NH2 3.64Å; E231-R649 PolarHBondContact OE1-NH2 2.88Å; E231-R649 VanDerWaalsContact OE1-NH2 3.08Å
232	L	89.3	Confident	88.7	Confident	9 Å²	9	44.5 Å²	44.5	5%	0.047	23%	0.229	C	C	.	.	H	α-helix	trans	-61.4	-38.3	177.3	-173.2	67	0	0	0	111.7	I34 I74 L204 M228 K229 M235 M236	I34-L232 HydrophobicContact CD1-CD2 4.48Å; I34-L232 HydrophobicContact CG1-CD1 3.9Å; I74-L232 HydrophobicContact CG1-CD2 4.26Å; I74-L232 HydrophobicContact CG2-CD2 3.8Å; L204-L232 HydrophobicContact CD2-CD1 4.4Å; M228-L232 WeakPolarHBondContact O-CB 3.42Å; M228-L232 PolarHBondContact O-N 2.89Å; K229-L232 PolarHBondContact O-N 2.94Å; L232-M235 HydrophobicContact CD1-SD 4.13Å; L232-M235 PolarHBondContact O-N 2.95Å; L232-M236 PolarHBondContact O-N 2.92Å
233	Y	87.2	Confident	89.2	Confident	108 Å²	108	41.3 Å²	41.3	42%	0.424	22%	0.215	S	C	.	.	H	α-helix	trans	-62.7	-43.2	171.3	179.8	-103.4	0	0	0	111.6	K229 T230 E231 M235 M236 L237	K229-Y233 PolarHBondContact O-N 3.29Å; T230-Y233 PolarHBondContact O-N 3.48Å; E231-Y233 VanDerWaalsContact C-N 3.27Å; E231-Y233 PolarHBondContact O-N 3.16Å; Y233-M235 PolarHBondContact O-N 3.07Å; Y233-M236 HydrophobicContact CD2-CE 3.55Å; Y233-M236 HydrophobicContact CE2-CE 3.44Å; Y233-M236 VanDerWaalsContact CE2-CE 3.44Å; Y233-M236 VanDerWaalsContact O-CB 3.3Å; Y233-M236 WeakPolarHBondContact O-CB 3.44Å; Y233-M236 PolarHBondContact O-N 3.21Å; Y233-M236 VanDerWaalsContact O-N 3.16Å; Y233-L237 HydrophobicContact CD1-CD1 4.02Å; Y233-L237 HydrophobicContact CD1-CG 4.3Å; Y233-L237 HydrophobicContact CE1-CD1 3.47Å; Y233-L237 VanDerWaalsContact CE1-CD1 3.47Å; Y233-L237 HydrophobicContact CE1-CD2 4.25Å; Y233-L237 HydrophobicContact CE1-CG 3.91Å; Y233-L237 HydrophobicContact CE2-CD2 4.4Å; Y233-L237 WeakPolarHBondContact O-CG 3.34Å; Y233-L237 PolarHBondContact O-N 2.89Å
234	S	87.6	Confident	89.5	Confident	25 Å²	25	42.8 Å²	42.8	18%	0.175	22%	0.222	C	C	.	.	H	α-helix	trans	-63.5	-42.3	176.8	-54.5	0	0	0	0	111.7	T230 E231 M236 L237 V238	T230-S234 PolarHBondContact O-N 3.29Å; T230-S234 PolarHBondContact O-OG 3.01Å; E231-S234 CarbonylContact O-C 3.4Å; E231-S234 WeakPolarHBondContact O-CA 3.21Å; E231-S234 WeakPolarHBondContact O-CB 3.46Å; E231-S234 PolarHBondContact O-N 3.42Å; S234-M236 VanDerWaalsContact C-N 3.27Å; S234-M236 PolarHBondContact O-N 3.26Å; S234-L237 PolarHBondContact O-N 3.44Å; S234-V238 WeakPolarHBondContact O-CG2 3.32Å; S234-V238 PolarHBondContact O-N 3.07Å
235	M	90.4	Very high	89.7	Confident	11 Å²	11	42.7 Å²	42.7	5%	0.054	22%	0.221	C	C	.	.	H	α-helix	trans	-58	-40.8	172.7	-67.3	168.9	169.9	0	0	111.8	S33 S208 E231 L232 Y233 V238 R239 R649	S33-M235 WeakPolarHBondContact OG-CB 3.48Å; S208-M235 WeakPolarHBondContact OG-CE 3.35Å; E231-M235 HydrophobicContact CG-CE 3.9Å; E231-M235 WeakPolarHBondContact O-CG 3.36Å; E231-M235 PolarHBondContact O-N 3.46Å; L232-M235 HydrophobicContact CD1-SD 4.13Å; L232-M235 PolarHBondContact O-N 2.95Å; Y233-M235 PolarHBondContact O-N 3.07Å; M235-V238 PolarHBondContact O-N 3.48Å; M235-R239 WeakPolarHBondContact O-CG 3.41Å; M235-R239 PolarHBondContact O-N 2.73Å; M235-R649 VanDerWaalsContact CE-CZ 3.45Å
236	M	89.2	Confident	89.9	Confident	18 Å²	18	41.5 Å²	41.5	9%	0.089	22%	0.216	C	C	.	.	H	α-helix	trans	-62.7	-46.2	175.7	-175.3	-161.7	69.5	0	0	111.4	L232 Y233 S234 V238 R239 R240	L232-M236 PolarHBondContact O-N 2.92Å; Y233-M236 HydrophobicContact CD2-CE 3.55Å; Y233-M236 HydrophobicContact CE2-CE 3.44Å; Y233-M236 VanDerWaalsContact CE2-CE 3.44Å; Y233-M236 VanDerWaalsContact O-CB 3.3Å; Y233-M236 WeakPolarHBondContact O-CB 3.44Å; Y233-M236 PolarHBondContact O-N 3.21Å; Y233-M236 VanDerWaalsContact O-N 3.16Å; S234-M236 VanDerWaalsContact C-N 3.27Å; S234-M236 PolarHBondContact O-N 3.26Å; M236-V238 VanDerWaalsContact C-N 3.32Å; M236-V238 PolarHBondContact O-N 2.66Å; M236-R239 PolarHBondContact O-N 2.84Å; M236-R240 WeakPolarHBondContact O-CG 3.44Å; M236-R240 PolarHBondContact O-N 3.2Å; M236-R240 PolarHBondContact SD-NH2 3.22Å
237	L	90	Very high	90.2	Very high	26 Å²	26	44.7 Å²	44.7	14%	0.136	24%	0.236	C	C	.	.	H	α-helix	trans	-60.8	-40.9	177	-66.2	-177.1	0	0	0	112.2	Y233 S234 R239 R240 G241 E242 L243	Y233-L237 HydrophobicContact CD1-CD1 4.02Å; Y233-L237 HydrophobicContact CD1-CG 4.3Å; Y233-L237 HydrophobicContact CE1-CD1 3.47Å; Y233-L237 VanDerWaalsContact CE1-CD1 3.47Å; Y233-L237 HydrophobicContact CE1-CD2 4.25Å; Y233-L237 HydrophobicContact CE1-CG 3.91Å; Y233-L237 HydrophobicContact CE2-CD2 4.4Å; Y233-L237 WeakPolarHBondContact O-CG 3.34Å; Y233-L237 PolarHBondContact O-N 2.89Å; S234-L237 PolarHBondContact O-N 3.44Å; L237-R239 VanDerWaalsContact C-N 3.35Å; L237-R239 PolarHBondContact O-N 3.43Å; L237-R240 PolarHBondContact O-N 2.91Å; L237-G241 PolarHBondContact O-N 3.4Å; L237-E242 HydrophobicContact CD2-CB 4.35Å; L237-E242 VanDerWaalsContact CD2-OE2 3.28Å; L237-E242 WeakPolarHBondContact CD2-OE2 3.31Å; L237-E242 PolarHBondContact O-N 2.92Å; L237-L243 HydrophobicContact CB-CB 3.84Å; L237-L243 PolarHBondContact O-N 2.95Å
238	V	90.9	Very high	90.5	Very high	48 Å²	48	46 Å²	46	29%	0.291	24%	0.241	S	C	.	.	H	α-helix	trans	-59.9	-46.8	175.2	173.7	0	0	0	0	111	S234 M235 M236 R240 G241 L243 F245	S234-V238 WeakPolarHBondContact O-CG2 3.32Å; S234-V238 PolarHBondContact O-N 3.07Å; M235-V238 PolarHBondContact O-N 3.48Å; M236-V238 VanDerWaalsContact C-N 3.32Å; M236-V238 PolarHBondContact O-N 2.66Å; V238-R240 PolarHBondContact O-N 3.02Å; V238-G241 PolarHBondContact O-N 2.91Å; V238-L243 VanDerWaalsContact CA-O 3.31Å; V238-L243 WeakPolarHBondContact CA-O 3.46Å; V238-L243 HydrophobicContact CG2-CB 4.15Å; V238-L243 HydrophobicContact CG2-CD2 4.02Å; V238-L243 HydrophobicContact CG2-CG 4.07Å; V238-F245 HydrophobicContact CG2-CD2 3.77Å; V238-F245 HydrophobicContact CG2-CE2 3.55Å
239	R	88.7	Confident	90.5	Very high	75 Å²	75	51 Å²	51	28%	0.283	27%	0.271	S	S	.	.	H	α-helix	trans	-66.2	-25.8	-179.9	-77.6	164.6	134.5	-84.8	2.1	113.3	Y29 E32 S33 D36 M235 M236 L237 G241	Y29-R239 HydrophobicContact CD1-CB 4Å; E32-R239 PolarHBondContact O-NH2 3.25Å; E32-R239 IonicContact OE2-CZ 2.68Å; E32-R239 IonicContact OE2-NH1 2.6Å; E32-R239 PolarHBondContact OE2-NH1 3.34Å; S33-R239 WeakPolarHBondContact OG-CD 3.43Å; D36-R239 IonicContact OD1-NH2 2.59Å; D36-R239 PolarHBondContact OD1-NH2 2.85Å; D36-R239 IonicContact OD2-CZ 2.88Å; D36-R239 IonicContact OD2-NE 2.67Å; D36-R239 PolarHBondContact OD2-NE 3.38Å; D36-R239 IonicContact OD2-NH2 3.13Å; D36-R239 PolarHBondContact OD2-NH2 2.89Å; M235-R239 WeakPolarHBondContact O-CG 3.41Å; M235-R239 PolarHBondContact O-N 2.73Å; M236-R239 PolarHBondContact O-N 2.84Å; L237-R239 VanDerWaalsContact C-N 3.35Å; L237-R239 PolarHBondContact O-N 3.43Å; R239-G241 VanDerWaalsContact C-N 3.31Å
240	R	89.2	Confident	90.7	Very high	83 Å²	83	47.5 Å²	47.5	31%	0.313	26%	0.258	S	S	.	.	H	α-helix	trans	-79.6	-12	171.9	-68.4	-179.1	-173.1	-170.5	1.1	113.8	Y29 M236 L237 V238 E242	Y29-R240 HydrophobicContact CD1-CG 4.31Å; Y29-R240 HydrophobicContact CD2-CG 3.64Å; Y29-R240 HydrophobicContact CE1-CG 4.32Å; Y29-R240 HydrophobicContact CE2-CG 3.66Å; Y29-R240 HydrophobicContact CG-CG 3.97Å; M236-R240 WeakPolarHBondContact O-CG 3.44Å; M236-R240 PolarHBondContact O-N 3.2Å; M236-R240 PolarHBondContact SD-NH2 3.22Å; L237-R240 PolarHBondContact O-N 2.91Å; V238-R240 PolarHBondContact O-N 3.02Å; R240-E242 VanDerWaalsContact C-N 3.25Å; R240-E242 HydrophobicContact CB-CG 4.02Å; R240-E242 WeakPolarHBondContact CD-OE1 3.15Å; R240-E242 IonicContact NH1-OE1 3.79Å; R240-E242 PolarHBondContact NH1-OE1 2.96Å; R240-E242 PolarHBondContact O-N 3.36Å
241	G	89.6	Confident	91	Very high	51 Å²	51	48.4 Å²	48.4	53%	0.526	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.4	8.5	-171.7	0	0	0	0	0	114.2	L237 V238 R239 L243	L237-G241 PolarHBondContact O-N 3.4Å; V238-G241 PolarHBondContact O-N 2.91Å; R239-G241 VanDerWaalsContact C-N 3.31Å; G241-L243 VanDerWaalsContact C-N 3.31Å
242	E	91.6	Very high	91	Very high	124 Å²	124	50.6 Å²	50.6	58%	0.579	27%	0.27	S	S	*	.	S	Bend	trans	-78.4	-18.5	176.5	-65.8	174.9	-144.2	0	0	112.1	L237 R240	L237-E242 HydrophobicContact CD2-CB 4.35Å; L237-E242 VanDerWaalsContact CD2-OE2 3.28Å; L237-E242 WeakPolarHBondContact CD2-OE2 3.31Å; L237-E242 PolarHBondContact O-N 2.92Å; R240-E242 VanDerWaalsContact C-N 3.25Å; R240-E242 HydrophobicContact CB-CG 4.02Å; R240-E242 WeakPolarHBondContact CD-OE1 3.15Å; R240-E242 IonicContact NH1-OE1 3.79Å; R240-E242 PolarHBondContact NH1-OE1 2.96Å; R240-E242 PolarHBondContact O-N 3.36Å
243	L	92	Very high	91.2	Very high	33 Å²	33	57 Å²	57	17%	0.173	30%	0.298	C	S	.	.	S	Bend	trans	-132.2	115.4	176.2	179.3	62.2	0	0	0	109.5	L237 V238 G241 F245 R704	L237-L243 HydrophobicContact CB-CB 3.84Å; L237-L243 PolarHBondContact O-N 2.95Å; V238-L243 VanDerWaalsContact CA-O 3.31Å; V238-L243 WeakPolarHBondContact CA-O 3.46Å; V238-L243 HydrophobicContact CG2-CB 4.15Å; V238-L243 HydrophobicContact CG2-CD2 4.02Å; V238-L243 HydrophobicContact CG2-CG 4.07Å; G241-L243 VanDerWaalsContact C-N 3.31Å; L243-F245 HydrophobicContact CD2-CE2 3.73Å; L243-F245 HydrophobicContact CD2-CZ 4.01Å; L243-F245 HydrophobicContact CG-CD2 4.45Å; L243-F245 HydrophobicContact CG-CE2 3.93Å; L243-F245 HydrophobicContact CG-CZ 4.42Å; L243-R704 HydrophobicContact CD1-CB 3.8Å; L243-R704 HydrophobicContact CD1-CG 4.01Å
244	V	94.2	Very high	91.4	Very high	74 Å²	74	53.1 Å²	53.1	45%	0.448	29%	0.286	S	S	.	.			trans	-110	130.4	179.6	-174.2	0	0	0	0	108.9	E703 R704	V244-E703 HydrophobicContact CG1-CG 4.08Å; V244-R704 WeakPolarHBondContact O-CB 3.18Å; V244-R704 PolarHBondContact O-N 3.25Å
245	F	94.4	Very high	91.7	Very high	20 Å²	20	55.5 Å²	55.5	9%	0.088	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-100.3	156.1	171.7	-74.8	-85.1	0	0	0	110	V238 L243 R649 Q650 R704	V238-F245 HydrophobicContact CG2-CD2 3.77Å; V238-F245 HydrophobicContact CG2-CE2 3.55Å; L243-F245 HydrophobicContact CD2-CE2 3.73Å; L243-F245 HydrophobicContact CD2-CZ 4.01Å; L243-F245 HydrophobicContact CG-CD2 4.45Å; L243-F245 HydrophobicContact CG-CE2 3.93Å; L243-F245 HydrophobicContact CG-CZ 4.42Å; F245-R649 HydrophobicContact CD2-CB 4.18Å; F245-R649 HydrophobicContact CD2-CG 4.24Å; F245-R649 HydrophobicContact CE2-CB 3.81Å; F245-R649 HydrophobicContact CE2-CG 4.03Å; F245-R649 HydrophobicContact CZ-CB 4.02Å; F245-Q650 VanDerWaalsContact CD1-C 3.48Å; F245-Q650 WeakPolarHBondContact CD1-O 3.35Å; F245-R704 HydrophobicContact CD1-CB 4.09Å; F245-R704 HydrophobicContact CD1-CG 4.25Å; F245-R704 HydrophobicContact CE1-CB 4.16Å; F245-R704 HydrophobicContact CE1-CG 3.85Å; F245-R704 HydrophobicContact CZ-CG 4.39Å
246	P	95	Very high	91.8	Very high	6 Å²	6	55.2 Å²	55.2	4%	0.039	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-51.6	149.8	172.6	-30.8	39	0	0	0	113.1	Y248 Y631 F635 E703 C705	P246-Y248 HydrophobicContact CB-CD1 4.02Å; P246-Y248 HydrophobicContact CB-CE1 4.15Å; P246-Y248 WeakPolarHBondContact O-CD1 3.35Å; P246-Y248 WeakPolarHBondContact O-CE1 3.35Å; P246-Y631 WeakPolarHBondContact CB-OH 3.32Å; P246-F635 HydrophobicContact CB-CB 4.37Å; P246-F635 HydrophobicContact CB-CD1 3.58Å; P246-F635 HydrophobicContact CB-CD2 4.29Å; P246-F635 HydrophobicContact CB-CE1 3.85Å; P246-F635 HydrophobicContact CB-CG 3.82Å; P246-F635 HydrophobicContact CB-CZ 4.33Å; P246-F635 HydrophobicContact CG-CD1 4.01Å; P246-F635 HydrophobicContact CG-CE1 3.73Å; P246-F635 HydrophobicContact CG-CE2 4.26Å; P246-F635 HydrophobicContact CG-CG 4.4Å; P246-F635 HydrophobicContact CG-CZ 3.88Å; P246-E703 WeakPolarHBondContact CA-OE2 3.43Å; P246-C705 HydrophobicContact CG-CB 4.48Å; P246-C705 WeakPolarHBondContact CG-SG 3.43Å
247	S	92.9	Very high	92	Very high	91 Å²	91	54.8 Å²	54.8	64%	0.636	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-83.8	124.9	173.8	-68.3	0	0	0	0	110.7
248	Y	94.2	Very high	92.1	Very high	29 Å²	29	58.7 Å²	58.7	11%	0.114	31%	0.313	C	S	.	.			trans	-157.6	169.8	176.5	49.9	-103.1	0	0	0	110.5	P246 V250 F635 F645 S647 Y648 R649 Q650	P246-Y248 HydrophobicContact CB-CD1 4.02Å; P246-Y248 HydrophobicContact CB-CE1 4.15Å; P246-Y248 WeakPolarHBondContact O-CD1 3.35Å; P246-Y248 WeakPolarHBondContact O-CE1 3.35Å; Y248-V250 HydrophobicContact CE2-CG2 4.16Å; Y248-F635 WeakPolarHBondContact CB-O 3.35Å; Y248-F635 HydrophobicContact CD1-CD1 4.14Å; Y248-F645 AromaticContact CD1-CD1 3.73Å; Y248-F645 HydrophobicContact CD1-CD1 3.73Å; Y248-F645 AromaticContact CD1-CE1 3.54Å; Y248-F645 HydrophobicContact CD1-CE1 3.54Å; Y248-F645 HydrophobicContact CD1-CG 4.31Å; Y248-F645 AromaticContact CD1-CZ 3.98Å; Y248-F645 HydrophobicContact CD1-CZ 3.98Å; Y248-F645 HydrophobicContact CD2-CB 3.48Å; Y248-F645 VanDerWaalsContact CD2-CB 3.48Å; Y248-F645 AromaticContact CD2-CD1 3.4Å; Y248-F645 HydrophobicContact CD2-CD1 3.4Å; Y248-F645 AromaticContact CD2-CD2 3.92Å; Y248-F645 HydrophobicContact CD2-CD2 3.92Å; Y248-F645 HydrophobicContact CD2-CE1 4.07Å; Y248-F645 AromaticContact CD2-CG 3.31Å; Y248-F645 HydrophobicContact CD2-CG 3.31Å; Y248-F645 AromaticContact CE1-CD1 3.87Å; Y248-F645 HydrophobicContact CE1-CD1 3.87Å; Y248-F645 AromaticContact CE1-CE1 3.86Å; Y248-F645 HydrophobicContact CE1-CE1 3.86Å; Y248-F645 HydrophobicContact CE2-CB 3.77Å; Y248-F645 AromaticContact CE2-CD1 3.55Å; Y248-F645 HydrophobicContact CE2-CD1 3.55Å; Y248-F645 HydrophobicContact CE2-CE1 4.35Å; Y248-F645 AromaticContact CE2-CG 3.81Å; Y248-F645 HydrophobicContact CE2-CG 3.81Å; Y248-F645 HydrophobicContact CG-CB 4.28Å; Y248-F645 AromaticContact CG-CD1 3.5Å; Y248-F645 HydrophobicContact CG-CD1 3.5Å; Y248-F645 AromaticContact CG-CD2 3.86Å; Y248-F645 HydrophobicContact CG-CD2 3.86Å; Y248-F645 AromaticContact CG-CE1 3.66Å; Y248-F645 HydrophobicContact CG-CE1 3.66Å; Y248-F645 HydrophobicContact CG-CE2 4.01Å; Y248-F645 AromaticContact CG-CG 3.61Å; Y248-F645 HydrophobicContact CG-CG 3.61Å; Y248-F645 AromaticContact CG-CZ 3.92Å; Y248-F645 HydrophobicContact CG-CZ 3.92Å; Y248-F645 AromaticContact CZ-CD1 3.8Å; Y248-S647 WeakPolarHBondContact CE2-O 3.33Å; Y248-S647 PolarHBondContact OH-O 3.19Å; Y248-Y648 WeakPolarHBondContact OH-CA 3.28Å; Y248-Y648 PolarHBondContact OH-O 2.73Å; Y248-R649 PolarHBondContact OH-N 3.08Å; Y248-Q650 HydrophobicContact CE1-CB 4.36Å; Y248-Q650 WeakPolarHBondContact CE1-O 3.4Å; Y248-Q650 WeakPolarHBondContact OH-CA 3.21Å; Y248-Q650 VanDerWaalsContact OH-CB 3.28Å; Y248-Q650 WeakPolarHBondContact OH-CB 3.34Å; Y248-Q650 PolarHBondContact OH-N 2.98Å; Y248-Q650 PolarHBondContact OH-O 3.17Å
249	V	92.2	Very high	92.3	Very high	105 Å²	105	60 Å²	60	64%	0.636	32%	0.321	S	S	*	.			trans	-97	121.3	179.5	-177.6	0	0	0	0	110.5	N251	V249-N251 PolarHBondContact O-N 3.5Å
250	V	91.6	Very high	92.6	Very high	24 Å²	24	59.1 Å²	59.1	15%	0.145	33%	0.327	C	S	.	.			trans	-74.5	121.5	170.8	174.8	0	0	0	0	109.3	Y248 R252 F645 Y648	Y248-V250 HydrophobicContact CE2-CG2 4.16Å; V250-R252 HydrophobicContact CG1-CG 4.16Å; V250-F645 WeakPolarHBondContact CA-O 3.34Å; V250-Y648 HydrophobicContact CB-CE1 4.07Å; V250-Y648 HydrophobicContact CG2-CD1 3.58Å; V250-Y648 HydrophobicContact CG2-CD2 4.35Å; V250-Y648 HydrophobicContact CG2-CE1 3.55Å; V250-Y648 HydrophobicContact CG2-CE2 4.32Å; V250-Y648 HydrophobicContact CG2-CG 4Å
251	N	90.8	Very high	92.9	Very high	54 Å²	54	60.8 Å²	60.8	29%	0.289	34%	0.342	S	S	.	.			trans	-137.6	84.4	-176.5	-179.1	18.1	0	0	0	110.5	V249 D643 F645	V249-N251 PolarHBondContact O-N 3.5Å; N251-D643 PolarHBondContact O-N 3.19Å; N251-F645 PolarHBondContact N-O 3.13Å
252	R	90.7	Very high	93.1	Very high	48 Å²	48	59.7 Å²	59.7	18%	0.181	32%	0.323	C	S	.	.			trans	-82.1	124.3	179	-58.1	174.8	-173.6	125.4	-0.4	109.5	M40 E44 V250 D643 Y646	M40-R252 VanDerWaalsContact CE-NH2 3.31Å; E44-R252 IonicContact OE1-CZ 3.81Å; E44-R252 IonicContact OE1-NH1 2.84Å; E44-R252 PolarHBondContact OE1-NH1 3.36Å; V250-R252 HydrophobicContact CG1-CG 4.16Å; R252-D643 WeakPolarHBondContact CA-OD1 3.27Å; R252-Y646 HydrophobicContact CB-CE2 4.19Å; R252-Y646 HydrophobicContact CG-CD1 4.22Å; R252-Y646 HydrophobicContact CG-CD2 4Å; R252-Y646 HydrophobicContact CG-CE1 4.15Å; R252-Y646 HydrophobicContact CG-CE2 3.92Å; R252-Y646 HydrophobicContact CG-CG 4.15Å; R252-Y646 PolarHBondContact NE-O 3.32Å; R252-Y646 PolarHBondContact NH2-O 3.42Å
253	K	91.8	Very high	93.4	Very high	145 Å²	145	53.9 Å²	53.9	63%	0.63	30%	0.296	S	S	*	.			trans	-122.6	-35.8	174.4	-67.7	-158.1	-178	-178.7	0	112.6	P642 D643	K253-P642 HydrophobicContact CB-CB 4.12Å; K253-P642 HydrophobicContact CD-CB 3.6Å; K253-P642 HydrophobicContact CD-CG 4.39Å; K253-P642 HydrophobicContact CG-CB 3.76Å; K253-D643 PolarHBondContact N-OD1 2.78Å
254	S	92.9	Very high	93.6	Very high	25 Å²	25	56.4 Å²	56.4	18%	0.175	31%	0.306	C	S	.	.	S	Bend	trans	-84	135.8	-175.6	-62.8	0	0	0	0	111.7	I256 D643 Y646	S254-I256 PolarHBondContact O-N 2.9Å; S254-D643 VanDerWaalsContact CB-OD2 3.26Å; S254-D643 WeakPolarHBondContact CB-OD2 3.48Å; S254-D643 PolarHBondContact N-OD1 2.8Å; S254-D643 PolarHBondContact N-OD2 2.87Å; S254-D643 VanDerWaalsContact N-OD2 3.15Å; S254-D643 PolarHBondContact OG-OD2 3.24Å; S254-Y646 PolarHBondContact O-OH 3.1Å
255	T	92.3	Very high	93.7	Very high	76 Å²	76	54.8 Å²	54.8	47%	0.466	29%	0.294	S	S	.	.			trans	-88.4	106.7	173.5	-60.9	0	0	0	0	109.9	Y257 R310	T255-Y257 WeakPolarHBondContact CG2-O 3.45Å; T255-R310 PolarHBondContact O-NH2 2.96Å
256	I	93.1	Very high	93.7	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.021	29%	0.289	C	S	.	.	S	Bend	trans	-72.1	-40.2	-177	-62.2	177.6	0	0	0	112	L209 S254 R310 L317 F320 Y646	L209-I256 HydrophobicContact CD1-CD1 4.32Å; L209-I256 HydrophobicContact CD2-CD1 4.44Å; S254-I256 PolarHBondContact O-N 2.9Å; I256-R310 PolarHBondContact O-NH1 3.08Å; I256-L317 HydrophobicContact CD1-CD1 4.33Å; I256-L317 HydrophobicContact CD1-CD2 4.21Å; I256-L317 HydrophobicContact CG1-CD1 4.18Å; I256-F320 HydrophobicContact CD1-CB 4.37Å; I256-F320 HydrophobicContact CD1-CD2 4.09Å; I256-F320 HydrophobicContact CG2-CB 3.77Å; I256-Y646 HydrophobicContact CD1-CE1 4.1Å; I256-Y646 HydrophobicContact CD1-CE2 4.05Å
257	Y	94.7	Very high	93.8	Very high	9 Å²	9	54.2 Å²	54.2	4%	0.035	29%	0.291	C	S	.	.			trans	-121.7	120.2	179.4	-51.1	-65.4	0	0	0	108.7	L50 W205 L206 L209 T255 E262 F263 F266 F320	L50-Y257 HydrophobicContact CD1-CD2 4.14Å; W205-Y257 PolarHBondContact NE1-OH 3.36Å; L206-Y257 HydrophobicContact CD2-CD2 3.89Å; L206-Y257 HydrophobicContact CD2-CE2 3.87Å; L209-Y257 HydrophobicContact CD1-CE2 4.25Å; L209-Y257 HydrophobicContact CD2-CE2 4.44Å; T255-Y257 WeakPolarHBondContact CG2-O 3.45Å; Y257-E262 HydrophobicContact CD1-CG 4.37Å; Y257-F263 HydrophobicContact CD1-CB 4.17Å; Y257-F263 HydrophobicContact CD1-CD2 4.22Å; Y257-F263 HydrophobicContact CD2-CB 4.3Å; Y257-F263 AromaticContact CD2-CD2 3.7Å; Y257-F263 HydrophobicContact CD2-CD2 3.7Å; Y257-F263 HydrophobicContact CD2-CE2 4.36Å; Y257-F263 HydrophobicContact CD2-CG 4.18Å; Y257-F263 HydrophobicContact CE1-CD2 4.12Å; Y257-F263 AromaticContact CE2-CD2 3.58Å; Y257-F263 HydrophobicContact CE2-CD2 3.58Å; Y257-F263 AromaticContact CE2-CE2 3.94Å; Y257-F263 HydrophobicContact CE2-CE2 3.94Å; Y257-F263 HydrophobicContact CE2-CG 4.5Å; Y257-F263 HydrophobicContact CG-CB 3.91Å; Y257-F263 HydrophobicContact CG-CD2 4.03Å; Y257-F263 HydrophobicContact CG-CG 4.28Å; Y257-F263 AromaticContact CZ-CD2 3.82Å; Y257-F266 HydrophobicContact CE1-CB 3.79Å; Y257-F266 HydrophobicContact CE1-CD1 4.02Å; Y257-F266 HydrophobicContact CE1-CD2 4.32Å; Y257-F266 AromaticContact CE1-CG 3.75Å; Y257-F266 HydrophobicContact CE1-CG 3.75Å; Y257-F266 AromaticContact CZ-CD1 3.86Å; Y257-F266 WeakPolarHBondContact OH-CD1 3.42Å; Y257-F266 VanDerWaalsContact OH-CE1 3.26Å; Y257-F266 WeakPolarHBondContact OH-CE1 3.28Å; Y257-F320 WeakPolarHBondContact CE1-O 3.33Å; Y257-F320 PolarHBondContact OH-O 3.2Å
258	H	92.1	Very high	93.9	Very high	109 Å²	109	54 Å²	54	51%	0.505	28%	0.28	S	S	.	.	S	Bend	trans	-86.3	-25.7	179.3	-62	126.7	0	0	0	112.7	E262 R310 D312	H258-E262 IonicContact CG-OE2 3.54Å; H258-E262 PolarHBondContact N-OE2 3.43Å; H258-E262 IonicContact ND1-OE2 2.72Å; H258-R310 PolarHBondContact CE1-NH2 3.11Å; H258-R310 PolarHBondContact ND1-NH1 3.48Å; H258-R310 PolarHBondContact NE2-NH2 3.29Å; H258-D312 IonicContact CE1-OD2 3.74Å
259	T	94	Very high	94	Very high	74 Å²	74	52.7 Å²	52.7	45%	0.454	28%	0.275	S	S	.	.	S	Bend	trans	-138.2	157.1	-177.3	68.9	0	0	0	0	110.9	D261 E262 F263	T259-D261 PolarHBondContact O-N 3.31Å; T259-E262 PolarHBondContact O-N 3.2Å; T259-E262 PolarHBondContact OG1-N 2.66Å; T259-E262 VanDerWaalsContact OG1-N 3.12Å; T259-F263 PolarHBondContact O-N 2.66Å; T259-F263 VanDerWaalsContact O-N 3.11Å
260	S	95.3	Very high	94.1	Very high	58 Å²	58	47.7 Å²	47.7	41%	0.406	25%	0.245	S	C	.	.	H	α-helix	trans	-58	-37.2	172.4	-169.5	0	0	0	0	111.9	L50 F263 Q264	L50-S260 VanDerWaalsContact O-CB 3.23Å; L50-S260 WeakPolarHBondContact O-CB 3.26Å; L50-S260 PolarHBondContact O-OG 3.12Å; S260-F263 PolarHBondContact O-N 2.79Å; S260-Q264 WeakPolarHBondContact O-CB 3.45Å; S260-Q264 PolarHBondContact O-N 2.69Å
261	D	95.2	Very high	94.2	Very high	118 Å²	118	47.8 Å²	47.8	63%	0.631	25%	0.25	S	S	*	.	H	α-helix	trans	-63.1	-44.4	176.5	-174.8	72.8	0	0	0	112.1	T259 F263 Q264 K265	T259-D261 PolarHBondContact O-N 3.31Å; D261-F263 VanDerWaalsContact C-N 3.31Å; D261-F263 PolarHBondContact O-N 3.42Å; D261-Q264 PolarHBondContact O-N 3.37Å; D261-K265 WeakPolarHBondContact O-CB 3.19Å; D261-K265 PolarHBondContact O-N 2.7Å
262	E	94.8	Very high	94.4	Very high	27 Å²	27	46 Å²	46	13%	0.126	24%	0.241	C	C	.	.	H	α-helix	trans	-60.7	-43.3	176.3	-174.2	178.8	-166.6	0	0	111.2	Y257 H258 T259 F266 R310	Y257-E262 HydrophobicContact CD1-CG 4.37Å; H258-E262 IonicContact CG-OE2 3.54Å; H258-E262 PolarHBondContact N-OE2 3.43Å; H258-E262 IonicContact ND1-OE2 2.72Å; T259-E262 PolarHBondContact O-N 3.2Å; T259-E262 PolarHBondContact OG1-N 2.66Å; T259-E262 VanDerWaalsContact OG1-N 3.12Å; E262-F266 WeakPolarHBondContact O-CB 3.44Å; E262-F266 PolarHBondContact O-N 3.4Å; E262-R310 IonicContact OE1-CZ 3.53Å; E262-R310 IonicContact OE1-NH1 2.73Å; E262-R310 PolarHBondContact OE1-NH1 3.11Å; E262-R310 IonicContact OE2-NH1 2.76Å; E262-R310 PolarHBondContact OE2-NH1 3.29Å
263	F	96.1	Very high	94.6	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.009	23%	0.233	C	C	.	.	H	α-helix	trans	-65	-46.5	177.8	179.2	-139.3	0	0	0	112.1	L50 F51 Q202 W205 L206 Y257 T259 S260 D261 K265 F266 L267	L50-F263 HydrophobicContact CB-CD1 4.26Å; L50-F263 HydrophobicContact CD1-CB 4.38Å; L50-F263 HydrophobicContact CD1-CD1 4.11Å; L50-F263 HydrophobicContact CD1-CG 4.22Å; L50-F263 HydrophobicContact CD2-CB 4.41Å; F51-F263 HydrophobicContact CZ-CE1 4.46Å; Q202-F263 HydrophobicContact CB-CE1 3.94Å; Q202-F263 HydrophobicContact CB-CZ 4.07Å; Q202-F263 HydrophobicContact CG-CE1 4.01Å; Q202-F263 HydrophobicContact CG-CZ 4.19Å; W205-F263 AromaticContact CD1-CE2 3.58Å; L206-F263 HydrophobicContact CD1-CE1 3.85Å; L206-F263 HydrophobicContact CD1-CZ 3.99Å; L206-F263 HydrophobicContact CD2-CD2 4.27Å; L206-F263 HydrophobicContact CD2-CE1 4.18Å; L206-F263 HydrophobicContact CD2-CE2 3.79Å; L206-F263 HydrophobicContact CD2-CZ 3.72Å; L206-F263 HydrophobicContact CG-CE1 3.99Å; L206-F263 HydrophobicContact CG-CE2 4.17Å; L206-F263 HydrophobicContact CG-CZ 3.59Å; Y257-F263 HydrophobicContact CD1-CB 4.17Å; Y257-F263 HydrophobicContact CD1-CD2 4.22Å; Y257-F263 HydrophobicContact CD2-CB 4.3Å; Y257-F263 AromaticContact CD2-CD2 3.7Å; Y257-F263 HydrophobicContact CD2-CD2 3.7Å; Y257-F263 HydrophobicContact CD2-CE2 4.36Å; Y257-F263 HydrophobicContact CD2-CG 4.18Å; Y257-F263 HydrophobicContact CE1-CD2 4.12Å; Y257-F263 AromaticContact CE2-CD2 3.58Å; Y257-F263 HydrophobicContact CE2-CD2 3.58Å; Y257-F263 AromaticContact CE2-CE2 3.94Å; Y257-F263 HydrophobicContact CE2-CE2 3.94Å; Y257-F263 HydrophobicContact CE2-CG 4.5Å; Y257-F263 HydrophobicContact CG-CB 3.91Å; Y257-F263 HydrophobicContact CG-CD2 4.03Å; Y257-F263 HydrophobicContact CG-CG 4.28Å; Y257-F263 AromaticContact CZ-CD2 3.82Å; T259-F263 PolarHBondContact O-N 2.66Å; T259-F263 VanDerWaalsContact O-N 3.11Å; S260-F263 PolarHBondContact O-N 2.79Å; D261-F263 VanDerWaalsContact C-N 3.31Å; D261-F263 PolarHBondContact O-N 3.42Å; F263-K265 PolarHBondContact O-N 3.47Å; F263-F266 WeakPolarHBondContact O-CB 3.04Å; F263-F266 PolarHBondContact O-N 3Å; F263-L267 HydrophobicContact CD2-CD1 4.27Å; F263-L267 HydrophobicContact CD2-CG 4.22Å; F263-L267 HydrophobicContact CE1-CD1 4.06Å; F263-L267 HydrophobicContact CE2-CD1 3.71Å; F263-L267 HydrophobicContact CE2-CD2 4.04Å; F263-L267 HydrophobicContact CE2-CG 3.8Å; F263-L267 HydrophobicContact CZ-CD1 3.61Å; F263-L267 HydrophobicContact CZ-CD2 4.47Å; F263-L267 HydrophobicContact CZ-CG 4.22Å; F263-L267 WeakPolarHBondContact O-CG 3.4Å; F263-L267 PolarHBondContact O-N 2.82Å
264	Q	96.3	Very high	94.6	Very high	86 Å²	86	37.1 Å²	37.1	40%	0.402	20%	0.203	S	C	.	.	H	α-helix	trans	-66.2	-40.5	-179.4	-174.6	57.9	23.4	0	0	111.7	Q202 S260 D261 F266 L267 E268	Q202-Q264 VanDerWaalsContact NE2-OE1 3.17Å; S260-Q264 WeakPolarHBondContact O-CB 3.45Å; S260-Q264 PolarHBondContact O-N 2.69Å; D261-Q264 PolarHBondContact O-N 3.37Å; Q264-F266 VanDerWaalsContact C-N 3.33Å; Q264-F266 PolarHBondContact O-N 2.97Å; Q264-L267 PolarHBondContact O-N 2.89Å; Q264-E268 PolarHBondContact O-N 3.43Å
265	K	96.3	Very high	94.6	Very high	41 Å²	41	40.3 Å²	40.3	18%	0.178	21%	0.212	C	C	.	.	H	α-helix	trans	-64	-38.5	175	-168.8	-179.7	-171	-167.9	0	111.9	D261 F263 E268 L269 E302	D261-K265 WeakPolarHBondContact O-CB 3.19Å; D261-K265 PolarHBondContact O-N 2.7Å; F263-K265 PolarHBondContact O-N 3.47Å; K265-E268 PolarHBondContact O-N 3.27Å; K265-L269 WeakPolarHBondContact O-CG 3.5Å; K265-L269 PolarHBondContact O-N 2.86Å; K265-L269 VanDerWaalsContact O-N 3.09Å; K265-E302 WeakPolarHBondContact CE-OE1 3.34Å; K265-E302 WeakPolarHBondContact CE-OE2 3.49Å; K265-E302 IonicContact NZ-OE1 2.86Å; K265-E302 PolarHBondContact NZ-OE1 3.24Å; K265-E302 IonicContact NZ-OE2 2.86Å; K265-E302 PolarHBondContact NZ-OE2 3.04Å
266	F	95.8	Very high	94.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.6	-48.9	171.4	166.3	-92.6	0	0	0	111.5	W205 Y257 E262 F263 Q264 E268 L269 M270 F320 R325	W205-F266 AromaticContact CE2-CE1 3.5Å; W205-F266 VanDerWaalsContact CE2-CE1 3.5Å; W205-F266 HydrophobicContact CH2-CE1 4.42Å; W205-F266 HydrophobicContact CH2-CZ 4.25Å; W205-F266 AromaticContact CZ2-CE1 3.43Å; W205-F266 HydrophobicContact CZ2-CE1 3.43Å; W205-F266 VanDerWaalsContact CZ2-CE1 3.43Å; W205-F266 AromaticContact CZ2-CZ 3.43Å; W205-F266 HydrophobicContact CZ2-CZ 3.43Å; W205-F266 VanDerWaalsContact CZ2-CZ 3.43Å; W205-F266 AromaticContact NE1-CE1 3.44Å; Y257-F266 HydrophobicContact CE1-CB 3.79Å; Y257-F266 HydrophobicContact CE1-CD1 4.02Å; Y257-F266 HydrophobicContact CE1-CD2 4.32Å; Y257-F266 AromaticContact CE1-CG 3.75Å; Y257-F266 HydrophobicContact CE1-CG 3.75Å; Y257-F266 AromaticContact CZ-CD1 3.86Å; Y257-F266 WeakPolarHBondContact OH-CD1 3.42Å; Y257-F266 VanDerWaalsContact OH-CE1 3.26Å; Y257-F266 WeakPolarHBondContact OH-CE1 3.28Å; E262-F266 WeakPolarHBondContact O-CB 3.44Å; E262-F266 PolarHBondContact O-N 3.4Å; F263-F266 WeakPolarHBondContact O-CB 3.04Å; F263-F266 PolarHBondContact O-N 3Å; Q264-F266 VanDerWaalsContact C-N 3.33Å; Q264-F266 PolarHBondContact O-N 2.97Å; F266-E268 VanDerWaalsContact C-N 3.35Å; F266-E268 PolarHBondContact O-N 3.18Å; F266-L269 PolarHBondContact O-N 3.16Å; F266-M270 HydrophobicContact CE1-CB 4.44Å; F266-M270 HydrophobicContact CE1-SD 3.9Å; F266-M270 HydrophobicContact CZ-CB 4.4Å; F266-M270 HydrophobicContact CZ-SD 3.72Å; F266-M270 WeakPolarHBondContact O-CB 3.35Å; F266-M270 PolarHBondContact O-N 2.63Å; F266-F320 WeakPolarHBondContact CD2-O 3.33Å; F266-F320 VanDerWaalsContact CE2-O 3.23Å; F266-F320 WeakPolarHBondContact CE2-O 3.27Å; F266-R325 HydrophobicContact CD2-CG 3.83Å; F266-R325 HydrophobicContact CE2-CG 3.6Å; F266-R325 VanDerWaalsContact CE2-NE 3.27Å; F266-R325 HydrophobicContact CZ-CG 4.48Å
267	L	95.8	Very high	94.7	Very high	13 Å²	13	38 Å²	38	7%	0.068	20%	0.195	C	C	.	.	H	α-helix	trans	-64.5	-39.4	-179.8	-69.1	175.6	0	0	0	112.1	Q202 W205 I224 F263 Q264 M270 G271	Q202-L267 HydrophobicContact CG-CD1 3.54Å; W205-L267 HydrophobicContact CD2-CD2 4.48Å; W205-L267 HydrophobicContact CG-CD2 4.15Å; I224-L267 HydrophobicContact CD1-CB 4.29Å; I224-L267 HydrophobicContact CD1-CD2 4.04Å; I224-L267 WeakPolarHBondContact CD1-O 3.47Å; F263-L267 HydrophobicContact CD2-CD1 4.27Å; F263-L267 HydrophobicContact CD2-CG 4.22Å; F263-L267 HydrophobicContact CE1-CD1 4.06Å; F263-L267 HydrophobicContact CE2-CD1 3.71Å; F263-L267 HydrophobicContact CE2-CD2 4.04Å; F263-L267 HydrophobicContact CE2-CG 3.8Å; F263-L267 HydrophobicContact CZ-CD1 3.61Å; F263-L267 HydrophobicContact CZ-CD2 4.47Å; F263-L267 HydrophobicContact CZ-CG 4.22Å; F263-L267 WeakPolarHBondContact O-CG 3.4Å; F263-L267 PolarHBondContact O-N 2.82Å; Q264-L267 PolarHBondContact O-N 2.89Å; L267-M270 PolarHBondContact O-N 3.08Å; L267-G271 PolarHBondContact O-N 3.17Å
268	E	96.3	Very high	94.6	Very high	88 Å²	88	39.3 Å²	39.3	41%	0.411	20%	0.201	S	C	.	.	H	α-helix	trans	-58.1	-52.3	175.5	-170.5	-160.4	159.5	0	0	111.2	Q264 K265 F266 M270 G271 L272 K298	Q264-E268 PolarHBondContact O-N 3.43Å; K265-E268 PolarHBondContact O-N 3.27Å; F266-E268 VanDerWaalsContact C-N 3.35Å; F266-E268 PolarHBondContact O-N 3.18Å; E268-M270 VanDerWaalsContact C-N 3.33Å; E268-M270 PolarHBondContact O-N 3.27Å; E268-G271 PolarHBondContact O-N 3.28Å; E268-L272 PolarHBondContact O-N 3.25Å; E268-K298 IonicContact OE1-NZ 3.26Å; E268-K298 PolarHBondContact OE1-NZ 3Å; E268-K298 IonicContact OE2-NZ 2.59Å; E268-K298 PolarHBondContact OE2-NZ 3.47Å
269	L	96.3	Very high	94.7	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-69.7	-31.5	-178.5	-64.3	-178.9	0	0	0	112.3	K265 F266 L272 E273 L299 E302 R325 A326	K265-L269 WeakPolarHBondContact O-CG 3.5Å; K265-L269 PolarHBondContact O-N 2.86Å; K265-L269 VanDerWaalsContact O-N 3.09Å; F266-L269 PolarHBondContact O-N 3.16Å; L269-L272 HydrophobicContact CD2-CD2 4.48Å; L269-E273 WeakPolarHBondContact O-CB 3.45Å; L269-E273 PolarHBondContact O-N 3.46Å; L269-L299 HydrophobicContact CD2-CD2 3.93Å; L269-E302 HydrophobicContact CD1-CG 4.01Å; L269-R325 HydrophobicContact CB-CB 3.69Å; L269-A326 HydrophobicContact CD1-CB 4.02Å
270	M	94.1	Very high	94.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.9	-40.8	170.6	177.9	163.9	167.5	0	0	111.8	W205 I224 I227 F266 L267 E268 L272 E273 I274 R325	W205-M270 HydrophobicContact CE3-CE 4.17Å; W205-M270 HydrophobicContact CE3-SD 4.45Å; W205-M270 HydrophobicContact CH2-CE 3.57Å; W205-M270 HydrophobicContact CH2-SD 3.48Å; W205-M270 WeakPolarHBondContact CH2-SD 3.35Å; W205-M270 HydrophobicContact CZ2-SD 3.89Å; W205-M270 HydrophobicContact CZ3-CE 3.36Å; W205-M270 HydrophobicContact CZ3-SD 3.81Å; I224-M270 HydrophobicContact CD1-CB 4.36Å; I224-M270 HydrophobicContact CD1-CG 4.25Å; I224-M270 HydrophobicContact CG1-CG 4.37Å; I227-M270 HydrophobicContact CD1-CE 3.86Å; F266-M270 HydrophobicContact CE1-CB 4.44Å; F266-M270 HydrophobicContact CE1-SD 3.9Å; F266-M270 HydrophobicContact CZ-CB 4.4Å; F266-M270 HydrophobicContact CZ-SD 3.72Å; F266-M270 WeakPolarHBondContact O-CB 3.35Å; F266-M270 PolarHBondContact O-N 2.63Å; L267-M270 PolarHBondContact O-N 3.08Å; E268-M270 VanDerWaalsContact C-N 3.33Å; E268-M270 PolarHBondContact O-N 3.27Å; M270-L272 VanDerWaalsContact C-N 3.33Å; M270-L272 PolarHBondContact O-N 3.15Å; M270-E273 PolarHBondContact O-N 3.19Å; M270-I274 HydrophobicContact CE-CD1 3.84Å; M270-I274 HydrophobicContact CG-CD1 3.84Å; M270-I274 HydrophobicContact CG-CG1 4.49Å; M270-I274 WeakPolarHBondContact O-CD1 3.34Å; M270-I274 VanDerWaalsContact O-CG1 3.28Å; M270-I274 WeakPolarHBondContact O-CG1 3.47Å; M270-I274 PolarHBondContact O-N 3.31Å; M270-R325 HydrophobicContact CB-CG 4.27Å
271	G	93.7	Very high	94.4	Very high	26 Å²	26	32.2 Å²	32.2	27%	0.268	16%	0.163	S	C	.	.	H	α-helix	trans	-61.3	-42	174.9	0	0	0	0	0	112	L267 E268 R275	L267-G271 PolarHBondContact O-N 3.17Å; E268-G271 PolarHBondContact O-N 3.28Å; G271-R275 WeakPolarHBondContact O-CB 3.45Å; G271-R275 PolarHBondContact O-N 3.04Å
272	L	95.2	Very high	94.3	Very high	16 Å²	16	31.2 Å²	31.2	8%	0.084	15%	0.154	C	C	.	.	H	α-helix	trans	-61.3	-48.6	172.6	178.4	61.6	0	0	0	111.8	E268 L269 M270 I274 R275 L276 L291 N295 L299	E268-L272 PolarHBondContact O-N 3.25Å; L269-L272 HydrophobicContact CD2-CD2 4.48Å; M270-L272 VanDerWaalsContact C-N 3.33Å; M270-L272 PolarHBondContact O-N 3.15Å; L272-I274 PolarHBondContact O-N 2.64Å; L272-R275 PolarHBondContact O-N 2.93Å; L272-L276 HydrophobicContact CD1-CD1 4.24Å; L272-L276 HydrophobicContact CD1-CG 4.26Å; L272-L276 HydrophobicContact CG-CD1 4.19Å; L272-L276 WeakPolarHBondContact O-CG 3.31Å; L272-L276 PolarHBondContact O-N 3.02Å; L272-L291 HydrophobicContact CD1-CD1 3.95Å; L272-L291 HydrophobicContact CD1-CD2 3.78Å; L272-L291 HydrophobicContact CD1-CG 3.63Å; L272-N295 HydrophobicContact CD2-CB 3.8Å; L272-L299 HydrophobicContact CD2-CD1 4.2Å; L272-L299 HydrophobicContact CD2-CD2 4.06Å; L272-L299 HydrophobicContact CD2-CG 4.4Å
273	E	94.2	Very high	94.2	Very high	3 Å²	3	37.3 Å²	37.3	1%	0.014	18%	0.18	C	C	.	.	H	α-helix	trans	-53.4	-52.6	176.6	-176.3	-173.4	-173.2	0	0	110.6	R217 L269 M270 R275 L276 E277 R325 R328 L332	R217-E273 IonicContact NH2-OE1 2.9Å; R217-E273 IonicContact NH2-OE2 2.86Å; R217-E273 PolarHBondContact NH2-OE2 3.34Å; L269-E273 WeakPolarHBondContact O-CB 3.45Å; L269-E273 PolarHBondContact O-N 3.46Å; M270-E273 PolarHBondContact O-N 3.19Å; E273-R275 VanDerWaalsContact C-N 3.33Å; E273-R275 PolarHBondContact O-N 3.28Å; E273-L276 PolarHBondContact O-N 3.14Å; E273-E277 WeakPolarHBondContact O-CG 2.93Å; E273-E277 PolarHBondContact O-N 3.32Å; E273-R325 IonicContact OE1-NH1 2.66Å; E273-R325 WeakPolarHBondContact OE2-CD 3.34Å; E273-R325 IonicContact OE2-CZ 2.73Å; E273-R325 IonicContact OE2-NE 2.66Å; E273-R325 IonicContact OE2-NH1 3.82Å; E273-R325 PolarHBondContact OE2-NH1 3.41Å; E273-R328 HydrophobicContact CG-CB 4.31Å; E273-R328 WeakPolarHBondContact OE1-CB 3.44Å; E273-R328 IonicContact OE1-NE 3.82Å; E273-R328 PolarHBondContact OE1-NE 3.03Å; E273-L332 HydrophobicContact CG-CD1 4.19Å
274	I	92.2	Very high	94.2	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.015	20%	0.201	C	C	.	.	H	α-helix	trans	-60.2	-43.2	-179.7	-67.4	158.4	0	0	0	111.2	L221 I224 I227 M270 L272 L276 E277 Y278	L221-I274 VanDerWaalsContact O-CG2 3.31Å; L221-I274 WeakPolarHBondContact O-CG2 3.35Å; I224-I274 HydrophobicContact CG1-CD1 3.61Å; I227-I274 HydrophobicContact CD1-CD1 3.33Å; I227-I274 HydrophobicContact CD1-CG1 4.01Å; M270-I274 HydrophobicContact CE-CD1 3.84Å; M270-I274 HydrophobicContact CG-CD1 3.84Å; M270-I274 HydrophobicContact CG-CG1 4.49Å; M270-I274 WeakPolarHBondContact O-CD1 3.34Å; M270-I274 VanDerWaalsContact O-CG1 3.28Å; M270-I274 WeakPolarHBondContact O-CG1 3.47Å; M270-I274 PolarHBondContact O-N 3.31Å; L272-I274 PolarHBondContact O-N 2.64Å; I274-L276 VanDerWaalsContact C-N 3.32Å; I274-L276 PolarHBondContact O-N 3.24Å; I274-E277 PolarHBondContact O-N 3.03Å; I274-Y278 PolarHBondContact O-N 3.11Å
275	R	93.2	Very high	94.2	Very high	92 Å²	92	39.7 Å²	39.7	35%	0.347	19%	0.192	S	C	.	.	H	α-helix	trans	-63.7	-41.3	-179.7	-176.3	57.5	177	173.4	0.2	111.3	G271 L272 E273 Y278 L279 L291	G271-R275 WeakPolarHBondContact O-CB 3.45Å; G271-R275 PolarHBondContact O-N 3.04Å; L272-R275 PolarHBondContact O-N 2.93Å; E273-R275 VanDerWaalsContact C-N 3.33Å; E273-R275 PolarHBondContact O-N 3.28Å; R275-Y278 VanDerWaalsContact NH1-CD1 3.32Å; R275-Y278 PolarHBondContact O-N 3.18Å; R275-L279 HydrophobicContact CG-CD1 4.27Å; R275-L279 VanDerWaalsContact O-CG 3.28Å; R275-L279 WeakPolarHBondContact O-CG 3.33Å; R275-L279 PolarHBondContact O-N 2.96Å; R275-L291 HydrophobicContact CB-CD2 4.29Å; R275-L291 HydrophobicContact CG-CD2 3.7Å
276	L	94.1	Very high	94.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.3	-46.7	175.5	-69.2	173.2	0	0	0	111.4	L272 E273 I274 Y278 L279 I280 A288 L291 C292 L332 I336	L272-L276 HydrophobicContact CD1-CD1 4.24Å; L272-L276 HydrophobicContact CD1-CG 4.26Å; L272-L276 HydrophobicContact CG-CD1 4.19Å; L272-L276 WeakPolarHBondContact O-CG 3.31Å; L272-L276 PolarHBondContact O-N 3.02Å; E273-L276 PolarHBondContact O-N 3.14Å; I274-L276 VanDerWaalsContact C-N 3.32Å; I274-L276 PolarHBondContact O-N 3.24Å; L276-Y278 VanDerWaalsContact C-N 3.3Å; L276-Y278 PolarHBondContact O-N 3.42Å; L276-L279 PolarHBondContact O-N 3.29Å; L276-I280 VanDerWaalsContact O-CG1 3.28Å; L276-I280 WeakPolarHBondContact O-CG1 3.49Å; L276-I280 PolarHBondContact O-N 3.43Å; L276-A288 HydrophobicContact CD2-CB 4.42Å; L276-L291 HydrophobicContact CD2-CB 4.33Å; L276-L291 HydrophobicContact CD2-CD2 3.99Å; L276-L291 HydrophobicContact CD2-CG 4.25Å; L276-L291 HydrophobicContact CG-CD2 4.43Å; L276-C292 WeakPolarHBondContact CD2-SG 3.32Å; L276-L332 HydrophobicContact CB-CD1 3.99Å; L276-I336 HydrophobicContact CD2-CD1 4.08Å
277	E	93.2	Very high	94.2	Very high	31 Å²	31	47.9 Å²	47.9	15%	0.145	24%	0.237	C	C	.	.	H	α-helix	trans	-56.6	-44.9	176	-70.6	179.7	156.8	0	0	111.5	E273 I274 I280 S281 R328 L332	E273-E277 WeakPolarHBondContact O-CG 2.93Å; E273-E277 PolarHBondContact O-N 3.32Å; I274-E277 PolarHBondContact O-N 3.03Å; E277-I280 PolarHBondContact O-N 3.05Å; E277-S281 WeakPolarHBondContact O-CB 3.39Å; E277-S281 PolarHBondContact O-N 3.38Å; E277-R328 IonicContact OE1-NH2 3.86Å; E277-L332 HydrophobicContact CG-CD1 3.64Å; E277-L332 HydrophobicContact CG-CD2 4.26Å
278	Y	92.2	Very high	94.3	Very high	38 Å²	38	47.2 Å²	47.2	15%	0.149	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-49.9	176.2	174.6	-103.6	0	0	0	112.2	Q222 I274 R275 L276 I280 S281 Q282	Q222-Y278 HydrophobicContact CG-CD1 4.24Å; Q222-Y278 HydrophobicContact CG-CD2 3.5Å; Q222-Y278 HydrophobicContact CG-CE1 4.17Å; Q222-Y278 HydrophobicContact CG-CE2 3.42Å; Q222-Y278 VanDerWaalsContact CG-CE2 3.42Å; Q222-Y278 HydrophobicContact CG-CG 3.91Å; Q222-Y278 PolarHBondContact NE2-OH 3.26Å; I274-Y278 PolarHBondContact O-N 3.11Å; R275-Y278 VanDerWaalsContact NH1-CD1 3.32Å; R275-Y278 PolarHBondContact O-N 3.18Å; L276-Y278 VanDerWaalsContact C-N 3.3Å; L276-Y278 PolarHBondContact O-N 3.42Å; Y278-I280 VanDerWaalsContact C-N 3.3Å; Y278-I280 PolarHBondContact O-N 3.1Å; Y278-S281 WeakPolarHBondContact O-CB 3.31Å; Y278-S281 PolarHBondContact O-N 3.42Å; Y278-S281 VanDerWaalsContact O-N 3.07Å; Y278-S281 PolarHBondContact O-OG 2.81Å; Y278-Q282 HydrophobicContact CD1-CG 4.36Å; Y278-Q282 HydrophobicContact CD2-CG 4.11Å; Y278-Q282 HydrophobicContact CE1-CG 3.89Å; Y278-Q282 HydrophobicContact CE2-CG 3.59Å; Y278-Q282 HydrophobicContact CG-CG 4.48Å; Y278-Q282 VanDerWaalsContact CZ-CG 3.49Å; Y278-Q282 WeakPolarHBondContact O-CG 3.47Å; Y278-Q282 PolarHBondContact O-N 2.91Å
279	L	93.5	Very high	94.3	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-61.1	-39.5	-179.4	-68.6	173.7	0	0	0	112.1	R275 L276 Q282 K283 L284 L287 A288 L291	R275-L279 HydrophobicContact CG-CD1 4.27Å; R275-L279 VanDerWaalsContact O-CG 3.28Å; R275-L279 WeakPolarHBondContact O-CG 3.33Å; R275-L279 PolarHBondContact O-N 2.96Å; L276-L279 PolarHBondContact O-N 3.29Å; L279-Q282 CarbonylContact O-C 3.47Å; L279-Q282 PolarHBondContact O-N 3.31Å; L279-K283 PolarHBondContact O-N 3.41Å; L279-K283 VanDerWaalsContact O-N 3.13Å; L279-L284 HydrophobicContact CB-CB 4.5Å; L279-L284 HydrophobicContact CD2-CB 4.06Å; L279-L284 HydrophobicContact CD2-CD1 3.95Å; L279-L284 PolarHBondContact O-N 2.98Å; L279-L287 HydrophobicContact CD1-CB 4.47Å; L279-L287 HydrophobicContact CD1-CD2 4.36Å; L279-L287 HydrophobicContact CD1-CG 4.07Å; L279-L287 HydrophobicContact CD2-CD2 3.71Å; L279-L287 HydrophobicContact CD2-CG 4.24Å; L279-A288 HydrophobicContact CB-CB 3.88Å; L279-A288 HydrophobicContact CD1-CB 4.16Å; L279-L291 HydrophobicContact CD1-CD2 4.23Å
280	I	92.8	Very high	94.3	Very high	42 Å²	42	48.5 Å²	48.5	22%	0.215	24%	0.24	C	C	.	.	H	α-helix	trans	-61.4	-45.7	173	-68.3	165.2	0	0	0	110.4	L276 E277 Y278 Q282 K283 Y285 L332 I336	L276-I280 VanDerWaalsContact O-CG1 3.28Å; L276-I280 WeakPolarHBondContact O-CG1 3.49Å; L276-I280 PolarHBondContact O-N 3.43Å; E277-I280 PolarHBondContact O-N 3.05Å; Y278-I280 VanDerWaalsContact C-N 3.3Å; Y278-I280 PolarHBondContact O-N 3.1Å; I280-Q282 PolarHBondContact O-N 3.12Å; I280-K283 PolarHBondContact O-N 3.43Å; I280-Y285 HydrophobicContact CG2-CE1 4.35Å; I280-L332 HydrophobicContact CD1-CB 4.14Å; I280-L332 HydrophobicContact CD1-CD2 3.96Å; I280-I336 HydrophobicContact CD1-CD1 3.94Å; I280-I336 HydrophobicContact CD1-CG1 3.79Å; I280-I336 HydrophobicContact CG1-CD1 4.16Å; I280-I336 HydrophobicContact CG1-CG1 3.82Å
281	S	91.9	Very high	94.4	Very high	49 Å²	49	50.6 Å²	50.6	34%	0.343	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-34.5	178.9	82.7	0	0	0	0	112.8	E277 Y278 K283	E277-S281 WeakPolarHBondContact O-CB 3.39Å; E277-S281 PolarHBondContact O-N 3.38Å; Y278-S281 WeakPolarHBondContact O-CB 3.31Å; Y278-S281 PolarHBondContact O-N 3.42Å; Y278-S281 VanDerWaalsContact O-N 3.07Å; Y278-S281 PolarHBondContact O-OG 2.81Å; S281-K283 VanDerWaalsContact C-N 3.28Å
282	Q	91.7	Very high	94.5	Very high	96 Å²	96	49.4 Å²	49.4	45%	0.449	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	2.2	176.5	-60.2	-54.8	-43.1	0	0	113.2	Y278 L279 I280 L284	Y278-Q282 HydrophobicContact CD1-CG 4.36Å; Y278-Q282 HydrophobicContact CD2-CG 4.11Å; Y278-Q282 HydrophobicContact CE1-CG 3.89Å; Y278-Q282 HydrophobicContact CE2-CG 3.59Å; Y278-Q282 HydrophobicContact CG-CG 4.48Å; Y278-Q282 VanDerWaalsContact CZ-CG 3.49Å; Y278-Q282 WeakPolarHBondContact O-CG 3.47Å; Y278-Q282 PolarHBondContact O-N 2.91Å; L279-Q282 CarbonylContact O-C 3.47Å; L279-Q282 PolarHBondContact O-N 3.31Å; I280-Q282 PolarHBondContact O-N 3.12Å; Q282-L284 HydrophobicContact CB-CD1 4.04Å; Q282-L284 HydrophobicContact CB-CG 3.97Å; Q282-L284 PolarHBondContact O-N 3.49Å
283	K	94.2	Very high	94.5	Very high	155 Å²	155	52 Å²	52	67%	0.674	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	25.9	-176.7	-51.7	177.2	-178.8	177	0	113.8	L279 I280 S281 Y285	L279-K283 PolarHBondContact O-N 3.41Å; L279-K283 VanDerWaalsContact O-N 3.13Å; I280-K283 PolarHBondContact O-N 3.43Å; S281-K283 VanDerWaalsContact C-N 3.28Å; K283-Y285 VanDerWaalsContact C-N 3.29Å; K283-Y285 HydrophobicContact CB-CE2 3.84Å; K283-Y285 HydrophobicContact CG-CE2 4.43Å; K283-Y285 WeakPolarHBondContact O-CD2 3.47Å; K283-Y285 PolarHBondContact O-N 3.46Å; K283-Y285 VanDerWaalsContact O-N 3.15Å
284	L	95	Very high	94.7	Very high	86 Å²	86	57 Å²	57	45%	0.45	28%	0.278	S	S	.	.			trans	-88.4	61.5	178.1	-64.4	176.2	0	0	0	110.8	L279 Q282 D286 L287 A288	L279-L284 HydrophobicContact CB-CB 4.5Å; L279-L284 HydrophobicContact CD2-CB 4.06Å; L279-L284 HydrophobicContact CD2-CD1 3.95Å; L279-L284 PolarHBondContact O-N 2.98Å; Q282-L284 HydrophobicContact CB-CD1 4.04Å; Q282-L284 HydrophobicContact CB-CG 3.97Å; Q282-L284 PolarHBondContact O-N 3.49Å; L284-D286 VanDerWaalsContact C-N 3.35Å; L284-D286 PolarHBondContact O-N 3.46Å; L284-L287 PolarHBondContact O-N 3.49Å; L284-A288 PolarHBondContact O-N 3.43Å; L284-A288 VanDerWaalsContact O-N 3.12Å
285	Y	96.4	Very high	94.9	Very high	53 Å²	53	58.2 Å²	58.2	21%	0.208	29%	0.285	C	S	.	.	H	α-helix	trans	-68.8	-27.8	-169.3	-58.7	-66.4	0	0	0	114.3	I280 K283 L289 R339 Q340	I280-Y285 HydrophobicContact CG2-CE1 4.35Å; K283-Y285 VanDerWaalsContact C-N 3.29Å; K283-Y285 HydrophobicContact CB-CE2 3.84Å; K283-Y285 HydrophobicContact CG-CE2 4.43Å; K283-Y285 WeakPolarHBondContact O-CD2 3.47Å; K283-Y285 PolarHBondContact O-N 3.46Å; K283-Y285 VanDerWaalsContact O-N 3.15Å; Y285-L289 VanDerWaalsContact O-CB 3.27Å; Y285-L289 WeakPolarHBondContact O-CB 3.32Å; Y285-L289 PolarHBondContact O-N 3.18Å; Y285-R339 HydrophobicContact CD1-CB 3.9Å; Y285-R339 HydrophobicContact CD1-CG 4.2Å; Y285-R339 HydrophobicContact CD2-CB 4.5Å; Y285-R339 HydrophobicContact CE1-CB 3.92Å; Y285-R339 HydrophobicContact CE1-CG 3.73Å; Y285-R339 HydrophobicContact CG-CB 4.2Å; Y285-Q340 PolarHBondContact O-NE2 3.45Å
286	D	96.4	Very high	95.1	Very high	119 Å²	119	56.3 Å²	56.3	64%	0.636	28%	0.28	S	S	*	.	H	α-helix	trans	-68.7	-45	178.9	-61.9	-38.2	0	0	0	111.1	L284 A288 L289 Q290 Q340	L284-D286 VanDerWaalsContact C-N 3.35Å; L284-D286 PolarHBondContact O-N 3.46Å; D286-A288 VanDerWaalsContact C-N 3.35Å; D286-L289 PolarHBondContact O-N 2.91Å; D286-Q290 PolarHBondContact O-N 2.94Å; D286-Q340 PolarHBondContact OD1-NE2 2.97Å
287	L	96.2	Very high	95.2	Very high	93 Å²	93	62.2 Å²	62.2	49%	0.487	32%	0.316	S	S	.	.	H	α-helix	trans	-66.9	-39.1	176.7	-173.8	60.6	0	0	0	111.3	L279 L284 L289 Q290 L291	L279-L287 HydrophobicContact CD1-CB 4.47Å; L279-L287 HydrophobicContact CD1-CD2 4.36Å; L279-L287 HydrophobicContact CD1-CG 4.07Å; L279-L287 HydrophobicContact CD2-CD2 3.71Å; L279-L287 HydrophobicContact CD2-CG 4.24Å; L284-L287 PolarHBondContact O-N 3.49Å; L287-L289 VanDerWaalsContact C-N 3.33Å; L287-Q290 PolarHBondContact O-N 2.75Å; L287-L291 WeakPolarHBondContact O-CB 3.42Å; L287-L291 PolarHBondContact O-N 2.9Å; L287-L291 VanDerWaalsContact O-N 3.08Å
288	A	96.7	Very high	95.3	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-62.3	-42.6	174.9	0	0	0	0	0	111.4	L276 L279 L284 D286 L291 C292 I336	L276-A288 HydrophobicContact CD2-CB 4.42Å; L279-A288 HydrophobicContact CB-CB 3.88Å; L279-A288 HydrophobicContact CD1-CB 4.16Å; L284-A288 PolarHBondContact O-N 3.43Å; L284-A288 VanDerWaalsContact O-N 3.12Å; D286-A288 VanDerWaalsContact C-N 3.35Å; A288-L291 PolarHBondContact O-N 3.46Å; A288-C292 PolarHBondContact O-N 3.33Å; A288-C292 PolarHBondContact O-SG 3.22Å; A288-I336 HydrophobicContact CB-CD1 3.74Å; A288-I336 HydrophobicContact CB-CG1 4.15Å; A288-I336 HydrophobicContact CB-CG2 4.41Å
289	L	97.1	Very high	95.6	Very high	13 Å²	13	62.9 Å²	62.9	7%	0.068	32%	0.319	C	S	.	.	H	α-helix	trans	-64	-46.2	178.2	177.7	60.9	0	0	0	111.7	Y285 D286 L287 L291 C292 L293 I336 Y337 Q340 K342	Y285-L289 VanDerWaalsContact O-CB 3.27Å; Y285-L289 WeakPolarHBondContact O-CB 3.32Å; Y285-L289 PolarHBondContact O-N 3.18Å; D286-L289 PolarHBondContact O-N 2.91Å; L287-L289 VanDerWaalsContact C-N 3.33Å; L289-L291 VanDerWaalsContact C-N 3.32Å; L289-L291 PolarHBondContact O-N 3.22Å; L289-C292 WeakPolarHBondContact O-CB 3.44Å; L289-C292 PolarHBondContact O-N 2.9Å; L289-L293 HydrophobicContact CD1-CD1 4.22Å; L289-L293 HydrophobicContact CD1-CG 4.15Å; L289-L293 HydrophobicContact CG-CD1 4.12Å; L289-L293 HydrophobicContact CG-CG 4.46Å; L289-L293 WeakPolarHBondContact O-CG 3.49Å; L289-L293 PolarHBondContact O-N 2.96Å; L289-I336 HydrophobicContact CB-CG2 3.88Å; L289-I336 HydrophobicContact CD1-CG2 4.3Å; L289-Y337 HydrophobicContact CD1-CD1 3.76Å; L289-Y337 HydrophobicContact CD1-CE1 3.53Å; L289-Q340 HydrophobicContact CD2-CG 4.23Å; L289-K342 HydrophobicContact CD2-CD 4.01Å
290	Q	97.2	Very high	95.7	Very high	103 Å²	103	64.2 Å²	64.2	48%	0.481	33%	0.326	S	S	.	.	H	α-helix	trans	-56.9	-49.4	176.6	-175.2	61.8	37.7	0	0	110.7	D286 L287 C292 L293 D294	D286-Q290 PolarHBondContact O-N 2.94Å; L287-Q290 PolarHBondContact O-N 2.75Å; Q290-C292 VanDerWaalsContact C-N 3.3Å; Q290-C292 PolarHBondContact O-N 3.04Å; Q290-L293 PolarHBondContact O-N 2.94Å; Q290-L293 VanDerWaalsContact O-N 3.09Å; Q290-D294 PolarHBondContact NE2-OD1 2.9Å; Q290-D294 PolarHBondContact O-N 3.41Å
291	L	96.4	Very high	95.7	Very high	44 Å²	44	63.7 Å²	63.7	23%	0.23	33%	0.33	C	S	.	.	H	α-helix	trans	-60.7	-38.5	179.8	-176.1	60.9	0	0	0	112.6	L272 R275 L276 L279 L287 A288 L289 N295	L272-L291 HydrophobicContact CD1-CD1 3.95Å; L272-L291 HydrophobicContact CD1-CD2 3.78Å; L272-L291 HydrophobicContact CD1-CG 3.63Å; R275-L291 HydrophobicContact CB-CD2 4.29Å; R275-L291 HydrophobicContact CG-CD2 3.7Å; L276-L291 HydrophobicContact CD2-CB 4.33Å; L276-L291 HydrophobicContact CD2-CD2 3.99Å; L276-L291 HydrophobicContact CD2-CG 4.25Å; L276-L291 HydrophobicContact CG-CD2 4.43Å; L279-L291 HydrophobicContact CD1-CD2 4.23Å; L287-L291 WeakPolarHBondContact O-CB 3.42Å; L287-L291 PolarHBondContact O-N 2.9Å; L287-L291 VanDerWaalsContact O-N 3.08Å; A288-L291 PolarHBondContact O-N 3.46Å; L289-L291 VanDerWaalsContact C-N 3.32Å; L289-L291 PolarHBondContact O-N 3.22Å; L291-N295 PolarHBondContact O-N 3.39Å; L291-N295 PolarHBondContact O-ND2 3.08Å
292	C	94	Very high	95.9	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-64.1	-44.3	173.5	-79.6	0	0	0	0	112.4	L276 A288 L289 Q290 N295 K296 M333 I336	L276-C292 WeakPolarHBondContact CD2-SG 3.32Å; A288-C292 PolarHBondContact O-N 3.33Å; A288-C292 PolarHBondContact O-SG 3.22Å; L289-C292 WeakPolarHBondContact O-CB 3.44Å; L289-C292 PolarHBondContact O-N 2.9Å; Q290-C292 VanDerWaalsContact C-N 3.3Å; Q290-C292 PolarHBondContact O-N 3.04Å; C292-N295 CarbonylContact O-C 3.59Å; C292-N295 PolarHBondContact O-N 3.38Å; C292-K296 PolarHBondContact O-N 3.42Å; C292-M333 HydrophobicContact CB-CB 4.41Å; C292-M333 HydrophobicContact CB-CE 3.87Å; C292-M333 HydrophobicContact CB-CG 3.82Å; C292-M333 HydrophobicContact CB-SD 3.85Å; C292-I336 VanDerWaalsContact SG-CD1 3.57Å
293	L	96.3	Very high	96	Very high	71 Å²	71	57.1 Å²	57.1	37%	0.372	29%	0.294	S	S	.	.	H	α-helix	trans	-64	-42.8	-179.2	-69.8	173.8	0	0	0	111.2	L289 Q290 N295 K296 M333 Y337	L289-L293 HydrophobicContact CD1-CD1 4.22Å; L289-L293 HydrophobicContact CD1-CG 4.15Å; L289-L293 HydrophobicContact CG-CD1 4.12Å; L289-L293 HydrophobicContact CG-CG 4.46Å; L289-L293 WeakPolarHBondContact O-CG 3.49Å; L289-L293 PolarHBondContact O-N 2.96Å; Q290-L293 PolarHBondContact O-N 2.94Å; Q290-L293 VanDerWaalsContact O-N 3.09Å; L293-N295 PolarHBondContact O-N 3.46Å; L293-N295 VanDerWaalsContact O-N 3.14Å; L293-K296 PolarHBondContact O-N 3Å; L293-M333 HydrophobicContact CD2-CE 4.11Å; L293-Y337 WeakPolarHBondContact CD2-OH 3.33Å
294	D	97.4	Very high	95.7	Very high	107 Å²	107	52.1 Å²	52.1	57%	0.572	28%	0.277	S	S	*	.	H	α-helix	trans	-59.9	-25.8	177.7	-62.6	-19	0	0	0	112.4	Q290	Q290-D294 PolarHBondContact NE2-OD1 2.9Å; Q290-D294 PolarHBondContact O-N 3.41Å
295	N	97.3	Very high	95.4	Very high	30 Å²	30	50.9 Å²	50.9	16%	0.16	27%	0.271	C	S	.	.	H	α-helix	trans	-110.1	-2.1	-176.8	-70.9	-83.3	0	0	0	114.5	L272 L291 C292 L293 T297 K298 L299	L272-N295 HydrophobicContact CD2-CB 3.8Å; L291-N295 PolarHBondContact O-N 3.39Å; L291-N295 PolarHBondContact O-ND2 3.08Å; C292-N295 CarbonylContact O-C 3.59Å; C292-N295 PolarHBondContact O-N 3.38Å; L293-N295 PolarHBondContact O-N 3.46Å; L293-N295 VanDerWaalsContact O-N 3.14Å; N295-T297 PolarHBondContact O-N 3.08Å; N295-K298 PolarHBondContact O-N 3.47Å; N295-L299 HydrophobicContact CB-CD1 4.1Å; N295-L299 HydrophobicContact CB-CG 4.28Å; N295-L299 VanDerWaalsContact O-CG 3.28Å; N295-L299 WeakPolarHBondContact O-CG 3.32Å; N295-L299 PolarHBondContact O-N 3.05Å
296	K	96.8	Very high	94.7	Very high	52 Å²	52	51.4 Å²	51.4	23%	0.226	28%	0.277	C	S	.	.	H	α-helix	trans	-56.5	-51.1	-168.4	-174.2	-178.4	-178.9	175.2	0	112.9	C292 L293 K298 L299 I300 M333	C292-K296 PolarHBondContact O-N 3.42Å; L293-K296 PolarHBondContact O-N 3Å; K296-K298 VanDerWaalsContact C-N 3.34Å; K296-K298 PolarHBondContact O-N 2.9Å; K296-L299 PolarHBondContact O-N 3.22Å; K296-I300 HydrophobicContact CG-CD1 3.92Å; K296-I300 WeakPolarHBondContact O-CG1 3.36Å; K296-I300 PolarHBondContact O-N 3.29Å; K296-M333 HydrophobicContact CB-CE 4.02Å; K296-M333 HydrophobicContact CD-CE 3.7Å; K296-M333 HydrophobicContact CG-CE 3.81Å; K296-M333 HydrophobicContact CG-SD 4.23Å
297	T	96.5	Very high	94.2	Very high	123 Å²	123	50 Å²	50	76%	0.755	28%	0.276	S	S	*	.	H	α-helix	trans	-62.5	-42.9	-176.9	-53.2	0	0	0	0	111.5	N295 I300 G301	N295-T297 PolarHBondContact O-N 3.08Å; T297-I300 PolarHBondContact O-N 3.44Å; T297-G301 PolarHBondContact O-N 3.05Å
298	K	96.4	Very high	93.8	Very high	82 Å²	82	49.1 Å²	49.1	36%	0.357	27%	0.269	S	S	.	.	H	α-helix	trans	-61.1	-47.9	176.5	178.7	174.8	178.7	168.1	0	111.3	E268 N295 K296 G301 E302	E268-K298 IonicContact OE1-NZ 3.26Å; E268-K298 PolarHBondContact OE1-NZ 3Å; E268-K298 IonicContact OE2-NZ 2.59Å; E268-K298 PolarHBondContact OE2-NZ 3.47Å; N295-K298 PolarHBondContact O-N 3.47Å; K296-K298 VanDerWaalsContact C-N 3.34Å; K296-K298 PolarHBondContact O-N 2.9Å; K298-G301 PolarHBondContact O-N 2.99Å; K298-E302 PolarHBondContact O-N 3.5Å
299	L	97.3	Very high	93.4	Very high	1 Å²	1	50 Å²	50	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-62.3	-43.5	179.6	-69.5	172.2	0	0	0	112.4	L269 L272 N295 K296 E302 V303 A326 L330	L269-L299 HydrophobicContact CD2-CD2 3.93Å; L272-L299 HydrophobicContact CD2-CD1 4.2Å; L272-L299 HydrophobicContact CD2-CD2 4.06Å; L272-L299 HydrophobicContact CD2-CG 4.4Å; N295-L299 HydrophobicContact CB-CD1 4.1Å; N295-L299 HydrophobicContact CB-CG 4.28Å; N295-L299 VanDerWaalsContact O-CG 3.28Å; N295-L299 WeakPolarHBondContact O-CG 3.32Å; N295-L299 PolarHBondContact O-N 3.05Å; K296-L299 PolarHBondContact O-N 3.22Å; L299-E302 PolarHBondContact O-N 2.97Å; L299-V303 WeakPolarHBondContact O-CG2 3.32Å; L299-V303 PolarHBondContact O-N 3.49Å; L299-A326 HydrophobicContact CD2-CB 3.84Å; L299-L330 HydrophobicContact CB-CD1 4.31Å; L299-L330 HydrophobicContact CB-CD2 3.64Å; L299-L330 HydrophobicContact CB-CG 3.92Å; L299-L330 HydrophobicContact CD1-CD2 4.07Å
300	I	95.5	Very high	93	Very high	30 Å²	30	50.1 Å²	50.1	15%	0.154	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-47.5	177.1	-70.1	174.2	0	0	0	110.2	K296 T297 E302 V303 T304 L330 L349 T352	K296-I300 HydrophobicContact CG-CD1 3.92Å; K296-I300 WeakPolarHBondContact O-CG1 3.36Å; K296-I300 PolarHBondContact O-N 3.29Å; T297-I300 PolarHBondContact O-N 3.44Å; I300-E302 PolarHBondContact O-N 2.84Å; I300-V303 PolarHBondContact O-N 3.36Å; I300-V303 VanDerWaalsContact O-N 3.07Å; I300-T304 HydrophobicContact CG2-CG2 3.83Å; I300-T304 WeakPolarHBondContact O-CG2 3.44Å; I300-T304 PolarHBondContact O-N 3.45Å; I300-T304 PolarHBondContact O-OG1 3.42Å; I300-L330 HydrophobicContact CG1-CD1 4.24Å; I300-L330 HydrophobicContact CG1-CD2 4.16Å; I300-L349 HydrophobicContact CD1-CD1 4.42Å; I300-T352 HydrophobicContact CG2-CG2 4.5Å
301	G	94.4	Very high	92.6	Very high	30 Å²	30	48.7 Å²	48.7	31%	0.309	27%	0.266	S	S	.	.	H	α-helix	trans	-57.3	-37	178	0	0	0	0	0	113.1	T297 K298 V303 T304 N305	T297-G301 PolarHBondContact O-N 3.05Å; K298-G301 PolarHBondContact O-N 2.99Å; G301-V303 VanDerWaalsContact C-N 3.29Å; G301-V303 PolarHBondContact O-N 2.97Å; G301-T304 PolarHBondContact O-OG1 2.7Å; G301-N305 VanDerWaalsContact O-CB 3.26Å; G301-N305 WeakPolarHBondContact O-CB 3.03Å; G301-N305 PolarHBondContact O-N 3.08Å; G301-N305 VanDerWaalsContact O-N 3.1Å
302	E	94.8	Very high	92.3	Very high	6 Å²	6	51 Å²	51	3%	0.028	28%	0.279	C	S	.	.	H	α-helix	trans	-65.5	-32.4	177.9	-161.5	66.2	-178.2	0	0	113.3	K265 L269 K298 L299 I300 F308 S322 P323 A326	K265-E302 WeakPolarHBondContact CE-OE1 3.34Å; K265-E302 WeakPolarHBondContact CE-OE2 3.49Å; K265-E302 IonicContact NZ-OE1 2.86Å; K265-E302 PolarHBondContact NZ-OE1 3.24Å; K265-E302 IonicContact NZ-OE2 2.86Å; K265-E302 PolarHBondContact NZ-OE2 3.04Å; L269-E302 HydrophobicContact CD1-CG 4.01Å; K298-E302 PolarHBondContact O-N 3.5Å; L299-E302 PolarHBondContact O-N 2.97Å; I300-E302 PolarHBondContact O-N 2.84Å; E302-F308 WeakPolarHBondContact OE2-CD2 3.37Å; E302-S322 VanDerWaalsContact OE1-CB 3.31Å; E302-S322 WeakPolarHBondContact OE1-CB 3.45Å; E302-S322 PolarHBondContact OE1-OG 3.2Å; E302-P323 HydrophobicContact CG-CG 4.49Å; E302-A326 HydrophobicContact CB-CB 3.64Å; E302-A326 HydrophobicContact CG-CB 3.79Å
303	V	93.1	Very high	92.2	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-90.2	-33.9	-176	173	0	0	0	0	111.9	L299 I300 G301 A326 F327 L330 L353 L356 L379	L299-V303 WeakPolarHBondContact O-CG2 3.32Å; L299-V303 PolarHBondContact O-N 3.49Å; I300-V303 PolarHBondContact O-N 3.36Å; I300-V303 VanDerWaalsContact O-N 3.07Å; G301-V303 VanDerWaalsContact C-N 3.29Å; G301-V303 PolarHBondContact O-N 2.97Å; V303-A326 HydrophobicContact CG2-CB 3.81Å; V303-F327 HydrophobicContact CG1-CD2 4.43Å; V303-F327 HydrophobicContact CG2-CB 3.97Å; V303-L330 HydrophobicContact CB-CD1 4.47Å; V303-L330 HydrophobicContact CG2-CD1 4.04Å; V303-L353 HydrophobicContact CG1-CD2 4.28Å; V303-L356 HydrophobicContact CG1-CD1 3.46Å; V303-L356 VanDerWaalsContact CG1-CD1 3.46Å; V303-L379 HydrophobicContact CG1-CD1 3.55Å; V303-L379 HydrophobicContact CG1-CD2 4.07Å; V303-L379 HydrophobicContact CG1-CG 4.47Å
304	T	89	Confident	92	Very high	50 Å²	50	49.2 Å²	49.2	31%	0.307	27%	0.272	S	S	.	.	H	α-helix	trans	-80.5	-31.9	-178.6	56.6	0	0	0	0	112.4	I300 G301 L306 L356	I300-T304 HydrophobicContact CG2-CG2 3.83Å; I300-T304 WeakPolarHBondContact O-CG2 3.44Å; I300-T304 PolarHBondContact O-N 3.45Å; I300-T304 PolarHBondContact O-OG1 3.42Å; G301-T304 PolarHBondContact O-OG1 2.7Å; T304-L306 PolarHBondContact O-N 2.7Å; T304-L306 VanDerWaalsContact O-N 3.11Å; T304-L356 HydrophobicContact CG2-CD2 3.84Å
305	N	87.9	Confident	91.6	Very high	61 Å²	61	44.6 Å²	44.6	33%	0.326	25%	0.247	S	C	.	.			trans	-72.8	106.8	179.3	-172.8	-11.7	0	0	0	111.2	G301 S307 F308	G301-N305 VanDerWaalsContact O-CB 3.26Å; G301-N305 WeakPolarHBondContact O-CB 3.03Å; G301-N305 PolarHBondContact O-N 3.08Å; G301-N305 VanDerWaalsContact O-N 3.1Å; N305-S307 VanDerWaalsContact CG-OG 3.27Å; N305-S307 PolarHBondContact ND2-OG 2.9Å; N305-S307 PolarHBondContact O-N 3.2Å; N305-S307 WeakPolarHBondContact OD1-CB 3.48Å; N305-S307 PolarHBondContact OD1-N 3.23Å; N305-S307 PolarHBondContact OD1-OG 3.45Å; N305-F308 HydrophobicContact CB-CD2 3.63Å; N305-F308 HydrophobicContact CB-CE2 3.75Å; N305-F308 HydrophobicContact CB-CG 4.22Å; N305-F308 HydrophobicContact CB-CZ 4.42Å; N305-F308 WeakPolarHBondContact ND2-CE2 3.45Å; N305-F308 WeakPolarHBondContact ND2-CZ 3.43Å; N305-F308 PolarHBondContact O-N 3.26Å
306	L	82.6	Confident	91.4	Very high	63 Å²	63	43.6 Å²	43.6	33%	0.33	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-61.9	-28.3	-178.1	-60.1	179.8	0	0	0	113.4	T304 F308 R309 L360 F366	T304-L306 PolarHBondContact O-N 2.7Å; T304-L306 VanDerWaalsContact O-N 3.11Å; L306-F308 PolarHBondContact O-N 2.87Å; L306-R309 WeakPolarHBondContact O-CB 3.42Å; L306-R309 PolarHBondContact O-N 3.21Å; L306-R309 VanDerWaalsContact O-N 3.08Å; L306-L360 HydrophobicContact CD1-CD2 4Å; L306-F366 HydrophobicContact CD1-CE1 3.63Å; L306-F366 HydrophobicContact CD1-CZ 3.49Å; L306-F366 VanDerWaalsContact CD1-CZ 3.49Å
307	S	85.2	Confident	91.2	Very high	90 Å²	90	41.1 Å²	41.1	63%	0.629	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-66.4	-21.4	179.5	66.5	0	0	0	0	113.4	N305 R309	N305-S307 VanDerWaalsContact CG-OG 3.27Å; N305-S307 PolarHBondContact ND2-OG 2.9Å; N305-S307 PolarHBondContact O-N 3.2Å; N305-S307 WeakPolarHBondContact OD1-CB 3.48Å; N305-S307 PolarHBondContact OD1-N 3.23Å; N305-S307 PolarHBondContact OD1-OG 3.45Å; S307-R309 VanDerWaalsContact C-N 3.3Å
308	F	88.7	Confident	90.9	Very high	74 Å²	74	36.9 Å²	36.9	33%	0.325	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-82.5	-9.9	176	-57.4	-25	0	0	0	112.6	E302 N305 L306 R310 P323	E302-F308 WeakPolarHBondContact OE2-CD2 3.37Å; N305-F308 HydrophobicContact CB-CD2 3.63Å; N305-F308 HydrophobicContact CB-CE2 3.75Å; N305-F308 HydrophobicContact CB-CG 4.22Å; N305-F308 HydrophobicContact CB-CZ 4.42Å; N305-F308 WeakPolarHBondContact ND2-CE2 3.45Å; N305-F308 WeakPolarHBondContact ND2-CZ 3.43Å; N305-F308 PolarHBondContact O-N 3.26Å; L306-F308 PolarHBondContact O-N 2.87Å; F308-R310 PolarHBondContact O-N 2.72Å; F308-P323 HydrophobicContact CB-CG 3.98Å; F308-P323 VanDerWaalsContact O-CG 3.25Å; F308-P323 WeakPolarHBondContact O-CG 3.45Å
309	R	86.8	Confident	90.7	Very high	18 Å²	18	33.8 Å²	33.8	7%	0.068	19%	0.186	C	C	.	.			trans	-73	118.1	-179.1	-63.1	-174.4	177.2	-179.2	5.6	110.4	L306 S307 I311 L379	L306-R309 WeakPolarHBondContact O-CB 3.42Å; L306-R309 PolarHBondContact O-N 3.21Å; L306-R309 VanDerWaalsContact O-N 3.08Å; S307-R309 VanDerWaalsContact C-N 3.3Å; R309-I311 HydrophobicContact CB-CG2 4.15Å; R309-I311 PolarHBondContact O-N 3.08Å; R309-L379 HydrophobicContact CG-CD2 4.46Å
310	R	90.1	Very high	90.4	Very high	16 Å²	16	33.8 Å²	33.8	6%	0.06	19%	0.186	C	C	.	.			trans	-82.9	61.7	176.6	-64.3	-60.3	-54.5	-75.7	-10	112.2	T255 I256 H258 E262 F308 D312 L313 R318 T321	T255-R310 PolarHBondContact O-NH2 2.96Å; I256-R310 PolarHBondContact O-NH1 3.08Å; H258-R310 PolarHBondContact CE1-NH2 3.11Å; H258-R310 PolarHBondContact ND1-NH1 3.48Å; H258-R310 PolarHBondContact NE2-NH2 3.29Å; E262-R310 IonicContact OE1-CZ 3.53Å; E262-R310 IonicContact OE1-NH1 2.73Å; E262-R310 PolarHBondContact OE1-NH1 3.11Å; E262-R310 IonicContact OE2-NH1 2.76Å; E262-R310 PolarHBondContact OE2-NH1 3.29Å; F308-R310 PolarHBondContact O-N 2.72Å; R310-D312 WeakPolarHBondContact CA-OD1 3.14Å; R310-D312 IonicContact CZ-OD1 3.72Å; R310-D312 IonicContact CZ-OD2 3.07Å; R310-D312 IonicContact NE-OD1 3.85Å; R310-D312 PolarHBondContact NE-OD1 3.01Å; R310-D312 IonicContact NE-OD2 2.85Å; R310-D312 PolarHBondContact NE-OD2 3.34Å; R310-D312 IonicContact NH2-OD1 2.68Å; R310-D312 IonicContact NH2-OD2 3.56Å; R310-D312 PolarHBondContact NH2-OD2 3.39Å; R310-D312 PolarHBondContact O-N 3.35Å; R310-L313 HydrophobicContact CB-CB 4.49Å; R310-L313 HydrophobicContact CB-CD1 3.79Å; R310-L313 HydrophobicContact CB-CG 4.07Å; R310-L313 HydrophobicContact CG-CD1 4.37Å; R310-L313 WeakPolarHBondContact O-CB 3.22Å; R310-L313 PolarHBondContact O-N 2.8Å; R310-L313 VanDerWaalsContact O-N 3.16Å; R310-R318 PolarHBondContact O-NE 3.06Å; R310-T321 HydrophobicContact CB-CG2 3.91Å; R310-T321 HydrophobicContact CG-CG2 3.81Å
311	I	87.7	Confident	90.3	Very high	73 Å²	73	32.5 Å²	32.5	37%	0.374	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-16	178.3	61.2	171.2	0	0	0	112.8	R309 L313 R318 L371 Q378	R309-I311 HydrophobicContact CB-CG2 4.15Å; R309-I311 PolarHBondContact O-N 3.08Å; I311-L313 PolarHBondContact O-N 3.27Å; I311-R318 PolarHBondContact O-NH2 3.05Å; I311-L371 HydrophobicContact CD1-CD2 4.18Å; I311-Q378 HydrophobicContact CG2-CB 4.11Å; I311-Q378 HydrophobicContact CG2-CG 4.06Å
312	D	90.3	Very high	90.4	Very high	93 Å²	93	31.4 Å²	31.4	50%	0.497	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-26	169.4	61.6	-60.1	0	0	0	112.5	H258 R310	H258-D312 IonicContact CE1-OD2 3.74Å; R310-D312 WeakPolarHBondContact CA-OD1 3.14Å; R310-D312 IonicContact CZ-OD1 3.72Å; R310-D312 IonicContact CZ-OD2 3.07Å; R310-D312 IonicContact NE-OD1 3.85Å; R310-D312 PolarHBondContact NE-OD1 3.01Å; R310-D312 IonicContact NE-OD2 2.85Å; R310-D312 PolarHBondContact NE-OD2 3.34Å; R310-D312 IonicContact NH2-OD1 2.68Å; R310-D312 IonicContact NH2-OD2 3.56Å; R310-D312 PolarHBondContact NH2-OD2 3.39Å; R310-D312 PolarHBondContact O-N 3.35Å
313	L	92.6	Very high	90.4	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.021	17%	0.166	C	C	.	.	S	Bend	trans	-82.5	144.2	176.3	-64.4	178.6	0	0	0	111.6	R310 I311 L317 R318 T321	R310-L313 HydrophobicContact CB-CB 4.49Å; R310-L313 HydrophobicContact CB-CD1 3.79Å; R310-L313 HydrophobicContact CB-CG 4.07Å; R310-L313 HydrophobicContact CG-CD1 4.37Å; R310-L313 WeakPolarHBondContact O-CB 3.22Å; R310-L313 PolarHBondContact O-N 2.8Å; R310-L313 VanDerWaalsContact O-N 3.16Å; I311-L313 PolarHBondContact O-N 3.27Å; L313-L317 HydrophobicContact CB-CB 4.31Å; L313-L317 HydrophobicContact CD2-CD1 4.48Å; L313-R318 HydrophobicContact CB-CG 4.09Å; L313-R318 PolarHBondContact O-NE 3.29Å; L313-R318 PolarHBondContact O-NH2 3.36Å; L313-T321 HydrophobicContact CD1-CG2 3.67Å
314	P	92.1	Very high	90.4	Very high	30 Å²	30	32 Å²	32	20%	0.195	17%	0.17	C	C	.	.			trans	-51.8	148.4	164.6	-23.6	32.1	0	0	0	111.8	F316 L317 R318	P314-F316 HydrophobicContact CB-CD1 3.87Å; P314-F316 HydrophobicContact CB-CE1 3.38Å; P314-F316 HydrophobicContact CB-CE2 4.18Å; P314-F316 HydrophobicContact CB-CG 4.43Å; P314-F316 HydrophobicContact CB-CZ 3.57Å; P314-F316 HydrophobicContact CG-CE1 4.26Å; P314-F316 HydrophobicContact CG-CZ 4.01Å; P314-F316 PolarHBondContact O-N 3.25Å; P314-F316 VanDerWaalsContact O-N 3.1Å; P314-L317 HydrophobicContact CG-CD1 4.46Å; P314-L317 PolarHBondContact O-N 3.35Å; P314-R318 PolarHBondContact O-N 3.25Å
315	Q	89.7	Confident	90.7	Very high	10 Å²	10	30 Å²	30	5%	0.047	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-38.3	-174.7	-172.5	-170.5	-1.3	0	0	112.1	L317 R318 D377 T658 E660	Q315-L317 VanDerWaalsContact C-N 3.34Å; Q315-L317 PolarHBondContact O-N 2.65Å; Q315-R318 PolarHBondContact O-N 2.85Å; Q315-D377 WeakPolarHBondContact CG-OD2 3.17Å; Q315-D377 PolarHBondContact NE2-OD1 3.39Å; Q315-D377 PolarHBondContact NE2-OD2 3.36Å; Q315-T658 HydrophobicContact CB-CG2 4.05Å; Q315-T658 HydrophobicContact CG-CG2 3.87Å; Q315-T658 VanDerWaalsContact OE1-CB 3.31Å; Q315-E660 WeakPolarHBondContact CB-OE1 3.46Å; Q315-E660 PolarHBondContact N-OE1 3.48Å; Q315-E660 PolarHBondContact N-OE2 3.38Å; Q315-E660 VanDerWaalsContact N-OE2 3.12Å
316	F	91.1	Very high	91.1	Very high	8 Å²	8	27.1 Å²	27.1	4%	0.035	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-25.3	-178.2	56.2	-93.7	0	0	0	114.1	P314 R319 D643 V644 L654 D655 T658 E660	P314-F316 HydrophobicContact CB-CD1 3.87Å; P314-F316 HydrophobicContact CB-CE1 3.38Å; P314-F316 HydrophobicContact CB-CE2 4.18Å; P314-F316 HydrophobicContact CB-CG 4.43Å; P314-F316 HydrophobicContact CB-CZ 3.57Å; P314-F316 HydrophobicContact CG-CE1 4.26Å; P314-F316 HydrophobicContact CG-CZ 4.01Å; P314-F316 PolarHBondContact O-N 3.25Å; P314-F316 VanDerWaalsContact O-N 3.1Å; F316-R319 WeakPolarHBondContact O-CD 3.46Å; F316-R319 WeakPolarHBondContact O-CG 3.45Å; F316-R319 PolarHBondContact O-NE 3.42Å; F316-R319 VanDerWaalsContact O-NE 3.1Å; F316-D643 HydrophobicContact CE2-CB 3.86Å; F316-D643 WeakPolarHBondContact CE2-O 3.43Å; F316-D643 HydrophobicContact CZ-CB 4Å; F316-V644 HydrophobicContact CE1-CG1 4.36Å; F316-V644 HydrophobicContact CZ-CG1 4.01Å; F316-L654 HydrophobicContact CB-CB 4.27Å; F316-L654 VanDerWaalsContact CB-O 3.27Å; F316-L654 WeakPolarHBondContact CB-O 3.44Å; F316-L654 HydrophobicContact CD2-CB 3.52Å; F316-L654 HydrophobicContact CD2-CD1 4.27Å; F316-L654 HydrophobicContact CE2-CB 4.16Å; F316-L654 HydrophobicContact CG-CB 4.11Å; F316-D655 HydrophobicContact CD1-CB 3.36Å; F316-D655 HydrophobicContact CE1-CB 3.62Å; F316-D655 HydrophobicContact CG-CB 4.02Å; F316-D655 HydrophobicContact CZ-CB 4.43Å; F316-T658 HydrophobicContact CB-CG2 3.8Å; F316-E660 WeakPolarHBondContact CD1-OE2 3.32Å; F316-E660 WeakPolarHBondContact CE1-OE2 3.46Å
317	L	92.9	Very high	91.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-22.9	177.3	-66.8	-169	0	0	0	113.5	I256 L313 P314 Q315 R319 F320 D643 Y646 L654	I256-L317 HydrophobicContact CD1-CD1 4.33Å; I256-L317 HydrophobicContact CD1-CD2 4.21Å; I256-L317 HydrophobicContact CG1-CD1 4.18Å; L313-L317 HydrophobicContact CB-CB 4.31Å; L313-L317 HydrophobicContact CD2-CD1 4.48Å; P314-L317 HydrophobicContact CG-CD1 4.46Å; P314-L317 PolarHBondContact O-N 3.35Å; Q315-L317 VanDerWaalsContact C-N 3.34Å; Q315-L317 PolarHBondContact O-N 2.65Å; L317-R319 PolarHBondContact O-N 3.4Å; L317-F320 HydrophobicContact CD2-CD2 4.13Å; L317-F320 HydrophobicContact CD2-CE2 4.07Å; L317-F320 WeakPolarHBondContact O-CB 3.42Å; L317-F320 WeakPolarHBondContact O-CD2 3.36Å; L317-F320 PolarHBondContact O-N 2.94Å; L317-D643 HydrophobicContact CD1-CB 3.9Å; L317-D643 HydrophobicContact CG-CB 4.48Å; L317-Y646 HydrophobicContact CD1-CE2 4.28Å; L317-Y646 HydrophobicContact CD2-CD2 4.2Å; L317-Y646 HydrophobicContact CD2-CE2 4.46Å; L317-L654 HydrophobicContact CD2-CD1 3.86Å
318	R	91.8	Very high	92.2	Very high	34 Å²	34	22.2 Å²	22.2	13%	0.128	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-56.6	-22.4	179.8	-66	179.5	-164.2	150.7	4.3	113.5	R310 I311 L313 P314 Q315 F320 T321 Y324	R310-R318 PolarHBondContact O-NE 3.06Å; I311-R318 PolarHBondContact O-NH2 3.05Å; L313-R318 HydrophobicContact CB-CG 4.09Å; L313-R318 PolarHBondContact O-NE 3.29Å; L313-R318 PolarHBondContact O-NH2 3.36Å; P314-R318 PolarHBondContact O-N 3.25Å; Q315-R318 PolarHBondContact O-N 2.85Å; R318-F320 PolarHBondContact O-N 2.96Å; R318-F320 VanDerWaalsContact O-N 3.16Å; R318-T321 WeakPolarHBondContact O-CB 3.25Å; R318-T321 WeakPolarHBondContact O-CG2 3.3Å; R318-T321 PolarHBondContact O-N 3.2Å; R318-T321 PolarHBondContact O-OG1 3.35Å; R318-Y324 WeakPolarHBondContact O-CB 3.24Å
319	R	90.4	Very high	92.5	Very high	18 Å²	18	18.7 Å²	18.7	7%	0.068	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-62.9	-16.2	173.7	72.8	-179.5	61.6	-147.7	6.3	114.4	Y215 F316 L317 T321 Y324 R325	Y215-R319 PolarHBondContact OH-NH1 3.27Å; Y215-R319 PolarHBondContact OH-NH2 2.89Å; F316-R319 WeakPolarHBondContact O-CD 3.46Å; F316-R319 WeakPolarHBondContact O-CG 3.45Å; F316-R319 PolarHBondContact O-NE 3.42Å; F316-R319 VanDerWaalsContact O-NE 3.1Å; L317-R319 PolarHBondContact O-N 3.4Å; R319-T321 VanDerWaalsContact C-N 3.3Å; R319-Y324 VanDerWaalsContact CA-CD1 3.41Å; R319-Y324 HydrophobicContact CB-CD1 3.84Å; R319-Y324 HydrophobicContact CB-CE1 3.69Å; R319-Y324 HydrophobicContact CB-CG 4.31Å; R319-Y324 WeakPolarHBondContact O-CD1 3.43Å; R319-R325 PolarHBondContact O-NE 3.04Å; R319-R325 PolarHBondContact O-NH2 3.02Å
320	F	92.1	Very high	93	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-95	19	178.4	-55.7	-63.9	0	0	0	112.3	W205 L209 I256 Y257 F266 L317 R318 L654	W205-F320 HydrophobicContact CZ2-CD1 4.13Å; L209-F320 HydrophobicContact CD2-CD1 4.13Å; L209-F320 HydrophobicContact CD2-CG 4.25Å; I256-F320 HydrophobicContact CD1-CB 4.37Å; I256-F320 HydrophobicContact CD1-CD2 4.09Å; I256-F320 HydrophobicContact CG2-CB 3.77Å; Y257-F320 WeakPolarHBondContact CE1-O 3.33Å; Y257-F320 PolarHBondContact OH-O 3.2Å; F266-F320 WeakPolarHBondContact CD2-O 3.33Å; F266-F320 VanDerWaalsContact CE2-O 3.23Å; F266-F320 WeakPolarHBondContact CE2-O 3.27Å; L317-F320 HydrophobicContact CD2-CD2 4.13Å; L317-F320 HydrophobicContact CD2-CE2 4.07Å; L317-F320 WeakPolarHBondContact O-CB 3.42Å; L317-F320 WeakPolarHBondContact O-CD2 3.36Å; L317-F320 PolarHBondContact O-N 2.94Å; R318-F320 PolarHBondContact O-N 2.96Å; R318-F320 VanDerWaalsContact O-N 3.16Å; F320-L654 HydrophobicContact CE2-CD1 4.39Å
321	T	94	Very high	93.3	Very high	4 Å²	4	17.3 Å²	17.3	3%	0.025	8%	0.084	C	C	.	.	S	Bend	trans	-115.5	156	-177.4	69.8	0	0	0	0	112.2	R310 L313 R318 R319 Y324 R325	R310-T321 HydrophobicContact CB-CG2 3.91Å; R310-T321 HydrophobicContact CG-CG2 3.81Å; L313-T321 HydrophobicContact CD1-CG2 3.67Å; R318-T321 WeakPolarHBondContact O-CB 3.25Å; R318-T321 WeakPolarHBondContact O-CG2 3.3Å; R318-T321 PolarHBondContact O-N 3.2Å; R318-T321 PolarHBondContact O-OG1 3.35Å; R319-T321 VanDerWaalsContact C-N 3.3Å; T321-Y324 PolarHBondContact O-N 3.08Å; T321-R325 PolarHBondContact O-N 2.9Å
322	S	95.3	Very high	93.7	Very high	6 Å²	6	14.6 Å²	14.6	4%	0.042	7%	0.07	C	C	.	.	H	α-helix	trans	-61.5	-39.8	-178.7	56.1	0	0	0	0	114	E302 Y324 R325 A326	E302-S322 VanDerWaalsContact OE1-CB 3.31Å; E302-S322 WeakPolarHBondContact OE1-CB 3.45Å; E302-S322 PolarHBondContact OE1-OG 3.2Å; S322-Y324 VanDerWaalsContact C-N 3.27Å; S322-Y324 PolarHBondContact O-N 2.9Å; S322-R325 PolarHBondContact O-N 3.48Å; S322-R325 VanDerWaalsContact O-N 3.12Å; S322-A326 PolarHBondContact O-N 2.73Å
323	P	94.7	Very high	94.1	Very high	2 Å²	2	10.2 Å²	10.2	1%	0.013	5%	0.047	C	C	.	.	H	α-helix	trans	-61.6	-35	177.7	-22	34.2	0	0	0	112.9	E302 F308 A326 F327 L379	E302-P323 HydrophobicContact CG-CG 4.49Å; F308-P323 HydrophobicContact CB-CG 3.98Å; F308-P323 VanDerWaalsContact O-CG 3.25Å; F308-P323 WeakPolarHBondContact O-CG 3.45Å; P323-A326 PolarHBondContact O-N 2.97Å; P323-F327 VanDerWaalsContact O-CB 3.32Å; P323-F327 WeakPolarHBondContact O-CB 3.37Å; P323-F327 PolarHBondContact O-N 3.46Å; P323-L379 HydrophobicContact CB-CD2 3.86Å
324	Y	94.2	Very high	94.4	Very high	19 Å²	19	10 Å²	10	8%	0.075	5%	0.046	C	C	.	.	H	α-helix	trans	-63.6	-46.8	174.9	178.3	-110.4	0	0	0	111.8	R318 R319 T321 S322 A326 F327 R328 L379 P381	R318-Y324 WeakPolarHBondContact O-CB 3.24Å; R319-Y324 VanDerWaalsContact CA-CD1 3.41Å; R319-Y324 HydrophobicContact CB-CD1 3.84Å; R319-Y324 HydrophobicContact CB-CE1 3.69Å; R319-Y324 HydrophobicContact CB-CG 4.31Å; R319-Y324 WeakPolarHBondContact O-CD1 3.43Å; T321-Y324 PolarHBondContact O-N 3.08Å; S322-Y324 VanDerWaalsContact C-N 3.27Å; S322-Y324 PolarHBondContact O-N 2.9Å; Y324-A326 VanDerWaalsContact C-N 3.32Å; Y324-A326 PolarHBondContact O-N 2.86Å; Y324-F327 PolarHBondContact O-N 3.24Å; Y324-R328 HydrophobicContact CD1-CG 4.15Å; Y324-R328 HydrophobicContact CD2-CG 4.27Å; Y324-R328 HydrophobicContact CE1-CG 3.77Å; Y324-R328 HydrophobicContact CE2-CG 3.89Å; Y324-R328 HydrophobicContact CG-CG 4.44Å; Y324-R328 VanDerWaalsContact O-CG 3.31Å; Y324-R328 WeakPolarHBondContact O-CG 3.35Å; Y324-R328 PolarHBondContact O-N 2.88Å; Y324-L379 WeakPolarHBondContact CA-O 3.11Å; Y324-L379 WeakPolarHBondContact CB-O 3.25Å; Y324-L379 WeakPolarHBondContact CD2-O 3.32Å; Y324-P381 HydrophobicContact CE2-CG 4.46Å
325	R	94.9	Very high	94.6	Very high	8 Å²	8	11.3 Å²	11.3	3%	0.03	5%	0.051	C	C	.	.	H	α-helix	trans	-64.4	-39.2	179.7	-61.4	-62	173.3	-157.9	-6.6	111.6	F266 L269 M270 E273 R319 T321 S322 R328 S329	F266-R325 HydrophobicContact CD2-CG 3.83Å; F266-R325 HydrophobicContact CE2-CG 3.6Å; F266-R325 VanDerWaalsContact CE2-NE 3.27Å; F266-R325 HydrophobicContact CZ-CG 4.48Å; L269-R325 HydrophobicContact CB-CB 3.69Å; M270-R325 HydrophobicContact CB-CG 4.27Å; E273-R325 IonicContact OE1-NH1 2.66Å; E273-R325 WeakPolarHBondContact OE2-CD 3.34Å; E273-R325 IonicContact OE2-CZ 2.73Å; E273-R325 IonicContact OE2-NE 2.66Å; E273-R325 IonicContact OE2-NH1 3.82Å; E273-R325 PolarHBondContact OE2-NH1 3.41Å; R319-R325 PolarHBondContact O-NE 3.04Å; R319-R325 PolarHBondContact O-NH2 3.02Å; T321-R325 PolarHBondContact O-N 2.9Å; S322-R325 PolarHBondContact O-N 3.48Å; S322-R325 VanDerWaalsContact O-N 3.12Å; R325-R328 PolarHBondContact O-N 2.79Å; R325-S329 WeakPolarHBondContact O-CB 3.33Å; R325-S329 PolarHBondContact O-N 3.37Å; R325-S329 PolarHBondContact O-OG 3.33Å
326	A	96.4	Very high	94.9	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-62.2	-47.9	173.3	0	0	0	0	0	111.6	L269 L299 E302 V303 S322 P323 Y324 R328 S329 L330	L269-A326 HydrophobicContact CD1-CB 4.02Å; L299-A326 HydrophobicContact CD2-CB 3.84Å; E302-A326 HydrophobicContact CB-CB 3.64Å; E302-A326 HydrophobicContact CG-CB 3.79Å; V303-A326 HydrophobicContact CG2-CB 3.81Å; S322-A326 PolarHBondContact O-N 2.73Å; P323-A326 PolarHBondContact O-N 2.97Å; Y324-A326 VanDerWaalsContact C-N 3.32Å; Y324-A326 PolarHBondContact O-N 2.86Å; A326-R328 VanDerWaalsContact C-N 3.35Å; A326-R328 PolarHBondContact O-N 2.85Å; A326-S329 PolarHBondContact O-N 3.11Å; A326-S329 VanDerWaalsContact O-N 3.16Å; A326-L330 WeakPolarHBondContact O-CG 3.44Å; A326-L330 PolarHBondContact O-N 3.12Å
327	F	95.3	Very high	95.3	Very high	1 Å²	1	10.7 Å²	10.7	0%	0.004	5%	0.048	C	C	.	.	H	α-helix	trans	-59.2	-44.8	177.3	-177.5	-126.8	0	0	0	111.9	V303 P323 Y324 S329 L330 L331 L353 L376 L379 R383	V303-F327 HydrophobicContact CG1-CD2 4.43Å; V303-F327 HydrophobicContact CG2-CB 3.97Å; P323-F327 VanDerWaalsContact O-CB 3.32Å; P323-F327 WeakPolarHBondContact O-CB 3.37Å; P323-F327 PolarHBondContact O-N 3.46Å; Y324-F327 PolarHBondContact O-N 3.24Å; F327-S329 VanDerWaalsContact C-N 3.33Å; F327-S329 PolarHBondContact O-N 3.24Å; F327-L330 PolarHBondContact O-N 2.62Å; F327-L331 HydrophobicContact CD1-CD1 4.3Å; F327-L331 HydrophobicContact CE1-CD1 4.05Å; F327-L331 HydrophobicContact CE2-CD2 4.29Å; F327-L331 HydrophobicContact CE2-CG 4.5Å; F327-L331 HydrophobicContact CZ-CD1 4.25Å; F327-L331 HydrophobicContact CZ-CD2 4.26Å; F327-L331 HydrophobicContact CZ-CG 4.5Å; F327-L331 WeakPolarHBondContact O-CG 3.38Å; F327-L331 PolarHBondContact O-N 3.05Å; F327-L331 VanDerWaalsContact O-N 3.07Å; F327-L353 HydrophobicContact CD2-CD2 4.11Å; F327-L353 HydrophobicContact CE2-CD1 4.16Å; F327-L353 HydrophobicContact CE2-CD2 4.11Å; F327-L376 HydrophobicContact CE2-CD2 4.43Å; F327-L376 HydrophobicContact CZ-CD2 4.35Å; F327-L379 HydrophobicContact CB-CB 4.5Å; F327-L379 HydrophobicContact CD1-CB 4.33Å; F327-L379 HydrophobicContact CD2-CD1 4.17Å; F327-L379 HydrophobicContact CG-CB 4.47Å; F327-L379 HydrophobicContact CG-CD1 4.19Å; F327-R383 HydrophobicContact CE1-CB 3.96Å; F327-R383 HydrophobicContact CE1-CG 3.81Å; F327-R383 HydrophobicContact CZ-CB 3.91Å; F327-R383 HydrophobicContact CZ-CG 4.26Å
328	R	94.6	Very high	95.5	Very high	48 Å²	48	11.8 Å²	11.8	18%	0.181	5%	0.053	C	C	.	.	H	α-helix	trans	-58.7	-43.1	174.9	-73	-68	-61.5	154.1	-0.2	112.6	E273 E277 Y324 R325 A326 L331 L332	E273-R328 HydrophobicContact CG-CB 4.31Å; E273-R328 WeakPolarHBondContact OE1-CB 3.44Å; E273-R328 IonicContact OE1-NE 3.82Å; E273-R328 PolarHBondContact OE1-NE 3.03Å; E277-R328 IonicContact OE1-NH2 3.86Å; Y324-R328 HydrophobicContact CD1-CG 4.15Å; Y324-R328 HydrophobicContact CD2-CG 4.27Å; Y324-R328 HydrophobicContact CE1-CG 3.77Å; Y324-R328 HydrophobicContact CE2-CG 3.89Å; Y324-R328 HydrophobicContact CG-CG 4.44Å; Y324-R328 VanDerWaalsContact O-CG 3.31Å; Y324-R328 WeakPolarHBondContact O-CG 3.35Å; Y324-R328 PolarHBondContact O-N 2.88Å; R325-R328 PolarHBondContact O-N 2.79Å; A326-R328 VanDerWaalsContact C-N 3.35Å; A326-R328 PolarHBondContact O-N 2.85Å; R328-L331 WeakPolarHBondContact O-CB 3.4Å; R328-L331 PolarHBondContact O-N 3.21Å; R328-L332 PolarHBondContact O-N 2.9Å; R328-L332 VanDerWaalsContact O-N 3.11Å
329	S	96.3	Very high	95.7	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65.2	-38.1	178.4	-58.1	0	0	0	0	112	R325 A326 F327 L331 L332 M333	R325-S329 WeakPolarHBondContact O-CB 3.33Å; R325-S329 PolarHBondContact O-N 3.37Å; R325-S329 PolarHBondContact O-OG 3.33Å; A326-S329 PolarHBondContact O-N 3.11Å; A326-S329 VanDerWaalsContact O-N 3.16Å; F327-S329 VanDerWaalsContact C-N 3.33Å; F327-S329 PolarHBondContact O-N 3.24Å; S329-L331 VanDerWaalsContact C-N 3.33Å; S329-L331 PolarHBondContact O-N 3.27Å; S329-L332 PolarHBondContact O-N 2.88Å; S329-M333 PolarHBondContact O-N 3.46Å
330	L	97.5	Very high	96	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-65.8	-33.3	173.5	-67	174.7	0	0	0	112.6	L299 I300 V303 A326 F327 M333 I334 L349 L353	L299-L330 HydrophobicContact CB-CD1 4.31Å; L299-L330 HydrophobicContact CB-CD2 3.64Å; L299-L330 HydrophobicContact CB-CG 3.92Å; L299-L330 HydrophobicContact CD1-CD2 4.07Å; I300-L330 HydrophobicContact CG1-CD1 4.24Å; I300-L330 HydrophobicContact CG1-CD2 4.16Å; V303-L330 HydrophobicContact CB-CD1 4.47Å; V303-L330 HydrophobicContact CG2-CD1 4.04Å; A326-L330 WeakPolarHBondContact O-CG 3.44Å; A326-L330 PolarHBondContact O-N 3.12Å; F327-L330 PolarHBondContact O-N 2.62Å; L330-M333 HydrophobicContact CD2-SD 4.26Å; L330-M333 WeakPolarHBondContact O-CB 3.48Å; L330-M333 PolarHBondContact O-N 3.12Å; L330-I334 PolarHBondContact O-N 3.35Å; L330-I334 VanDerWaalsContact O-N 3.16Å; L330-L349 HydrophobicContact CD2-CD1 4.13Å; L330-L353 HydrophobicContact CB-CD1 4.29Å; L330-L353 HydrophobicContact CD1-CD2 3.87Å
331	L	96.1	Very high	96.2	Very high	6 Å²	6	29.7 Å²	29.7	3%	0.031	12%	0.123	C	C	.	.	H	α-helix	trans	-66.7	-41.8	173.3	-61.9	170.2	0	0	0	111.7	F327 R328 S329 M333 I334 D335 L353 R383 Y386 L387	F327-L331 HydrophobicContact CD1-CD1 4.3Å; F327-L331 HydrophobicContact CE1-CD1 4.05Å; F327-L331 HydrophobicContact CE2-CD2 4.29Å; F327-L331 HydrophobicContact CE2-CG 4.5Å; F327-L331 HydrophobicContact CZ-CD1 4.25Å; F327-L331 HydrophobicContact CZ-CD2 4.26Å; F327-L331 HydrophobicContact CZ-CG 4.5Å; F327-L331 WeakPolarHBondContact O-CG 3.38Å; F327-L331 PolarHBondContact O-N 3.05Å; F327-L331 VanDerWaalsContact O-N 3.07Å; R328-L331 WeakPolarHBondContact O-CB 3.4Å; R328-L331 PolarHBondContact O-N 3.21Å; S329-L331 VanDerWaalsContact C-N 3.33Å; S329-L331 PolarHBondContact O-N 3.27Å; L331-M333 VanDerWaalsContact C-N 3.26Å; L331-M333 PolarHBondContact O-N 3.33Å; L331-I334 HydrophobicContact CD2-CD1 4.31Å; L331-I334 WeakPolarHBondContact O-CB 3.41Å; L331-I334 PolarHBondContact O-N 3.5Å; L331-D335 PolarHBondContact O-N 2.9Å; L331-L353 HydrophobicContact CD2-CD1 4.46Å; L331-R383 HydrophobicContact CD1-CB 4.24Å; L331-R383 HydrophobicContact CD1-CG 3.73Å; L331-Y386 HydrophobicContact CD2-CD1 4.04Å; L331-Y386 HydrophobicContact CD2-CE1 3.92Å; L331-L387 HydrophobicContact CD2-CD2 3.77Å; L331-L387 HydrophobicContact CD2-CG 4.4Å
332	L	96.3	Very high	96.4	Very high	16 Å²	16	32.9 Å²	32.9	8%	0.084	14%	0.137	C	C	.	.	H	α-helix	trans	-63	-35.3	173.2	-65.1	172.3	0	0	0	111.6	E273 L276 E277 I280 R328 S329 I334 D335 I336	E273-L332 HydrophobicContact CG-CD1 4.19Å; L276-L332 HydrophobicContact CB-CD1 3.99Å; E277-L332 HydrophobicContact CG-CD1 3.64Å; E277-L332 HydrophobicContact CG-CD2 4.26Å; I280-L332 HydrophobicContact CD1-CB 4.14Å; I280-L332 HydrophobicContact CD1-CD2 3.96Å; R328-L332 PolarHBondContact O-N 2.9Å; R328-L332 VanDerWaalsContact O-N 3.11Å; S329-L332 PolarHBondContact O-N 2.88Å; L332-I334 VanDerWaalsContact C-N 3.31Å; L332-I334 PolarHBondContact O-N 3.07Å; L332-D335 WeakPolarHBondContact O-CB 3.41Å; L332-D335 PolarHBondContact O-N 3.26Å; L332-I336 WeakPolarHBondContact O-CD1 3.15Å; L332-I336 VanDerWaalsContact O-CG1 3.29Å; L332-I336 WeakPolarHBondContact O-CG1 3.43Å; L332-I336 PolarHBondContact O-N 3.48Å
333	M	97.8	Very high	96.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.2	-36.5	175.4	-172.4	171.3	-172.9	0	0	112.4	C292 L293 K296 S329 L330 L331 I336 Y337 L349	C292-M333 HydrophobicContact CB-CB 4.41Å; C292-M333 HydrophobicContact CB-CE 3.87Å; C292-M333 HydrophobicContact CB-CG 3.82Å; C292-M333 HydrophobicContact CB-SD 3.85Å; L293-M333 HydrophobicContact CD2-CE 4.11Å; K296-M333 HydrophobicContact CB-CE 4.02Å; K296-M333 HydrophobicContact CD-CE 3.7Å; K296-M333 HydrophobicContact CG-CE 3.81Å; K296-M333 HydrophobicContact CG-SD 4.23Å; S329-M333 PolarHBondContact O-N 3.46Å; L330-M333 HydrophobicContact CD2-SD 4.26Å; L330-M333 WeakPolarHBondContact O-CB 3.48Å; L330-M333 PolarHBondContact O-N 3.12Å; L331-M333 VanDerWaalsContact C-N 3.26Å; L331-M333 PolarHBondContact O-N 3.33Å; M333-I336 PolarHBondContact O-N 2.89Å; M333-Y337 HydrophobicContact CE-CE1 4.44Å; M333-Y337 HydrophobicContact CE-CE2 3.65Å; M333-Y337 VanDerWaalsContact CE-CZ 3.47Å; M333-Y337 WeakPolarHBondContact CE-OH 3.49Å; M333-Y337 HydrophobicContact CG-CD2 4.05Å; M333-Y337 HydrophobicContact CG-CE2 3.75Å; M333-Y337 VanDerWaalsContact O-CD2 3.31Å; M333-Y337 WeakPolarHBondContact O-CD2 3.24Å; M333-Y337 PolarHBondContact O-N 3.38Å; M333-Y337 HydrophobicContact SD-CE2 4.29Å; M333-L349 HydrophobicContact CB-CD2 4.05Å; M333-L349 HydrophobicContact CG-CD2 3.94Å; M333-L349 HydrophobicContact SD-CD2 4.05Å
334	I	98.2	Very high	96.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.3	-50.3	171.3	-65.7	164.5	0	0	0	109.9	L330 L331 L332 I336 Y337 E338 A346 L349 I350 L353 L387	L330-I334 PolarHBondContact O-N 3.35Å; L330-I334 VanDerWaalsContact O-N 3.16Å; L331-I334 HydrophobicContact CD2-CD1 4.31Å; L331-I334 WeakPolarHBondContact O-CB 3.41Å; L331-I334 PolarHBondContact O-N 3.5Å; L332-I334 VanDerWaalsContact C-N 3.31Å; L332-I334 PolarHBondContact O-N 3.07Å; I334-I336 VanDerWaalsContact C-N 3.29Å; I334-I336 PolarHBondContact O-N 3.26Å; I334-Y337 PolarHBondContact O-N 3.1Å; I334-E338 WeakPolarHBondContact CG2-OE1 3.35Å; I334-E338 VanDerWaalsContact O-CG 3.28Å; I334-E338 WeakPolarHBondContact O-CG 3.31Å; I334-E338 PolarHBondContact O-N 2.92Å; I334-A346 HydrophobicContact CG2-CB 4.44Å; I334-L349 HydrophobicContact CG1-CD2 3.81Å; I334-L349 HydrophobicContact CG1-CG 4.11Å; I334-I350 HydrophobicContact CD1-CD1 4.48Å; I334-I350 HydrophobicContact CD1-CG1 3.57Å; I334-I350 HydrophobicContact CG1-CG1 4.06Å; I334-I350 HydrophobicContact CG2-CD1 4.03Å; I334-I350 HydrophobicContact CG2-CG1 4.25Å; I334-L353 HydrophobicContact CD1-CD1 4.09Å; I334-L387 HydrophobicContact CD1-CD2 3.76Å
335	D	96.3	Very high	96.8	Very high	57 Å²	57	40.1 Å²	40.1	31%	0.305	17%	0.171	S	C	.	.	H	α-helix	trans	-59.4	-40.3	178.9	-67	-32.2	0	0	0	111.5	L331 L332 E338 R339 Y386	L331-D335 PolarHBondContact O-N 2.9Å; L332-D335 WeakPolarHBondContact O-CB 3.41Å; L332-D335 PolarHBondContact O-N 3.26Å; D335-E338 PolarHBondContact O-N 2.81Å; D335-R339 VanDerWaalsContact O-CG 3.25Å; D335-R339 WeakPolarHBondContact O-CG 3.28Å; D335-R339 PolarHBondContact O-N 3.4Å; D335-Y386 PolarHBondContact OD1-OH 3.49Å
336	I	97.8	Very high	96.9	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-64.8	-46.7	177.3	-68.7	159.5	0	0	0	111.1	L276 I280 A288 L289 C292 L332 M333 I334 E338 R339 Q340	L276-I336 HydrophobicContact CD2-CD1 4.08Å; I280-I336 HydrophobicContact CD1-CD1 3.94Å; I280-I336 HydrophobicContact CD1-CG1 3.79Å; I280-I336 HydrophobicContact CG1-CD1 4.16Å; I280-I336 HydrophobicContact CG1-CG1 3.82Å; A288-I336 HydrophobicContact CB-CD1 3.74Å; A288-I336 HydrophobicContact CB-CG1 4.15Å; A288-I336 HydrophobicContact CB-CG2 4.41Å; L289-I336 HydrophobicContact CB-CG2 3.88Å; L289-I336 HydrophobicContact CD1-CG2 4.3Å; C292-I336 VanDerWaalsContact SG-CD1 3.57Å; L332-I336 WeakPolarHBondContact O-CD1 3.15Å; L332-I336 VanDerWaalsContact O-CG1 3.29Å; L332-I336 WeakPolarHBondContact O-CG1 3.43Å; L332-I336 PolarHBondContact O-N 3.48Å; M333-I336 PolarHBondContact O-N 2.89Å; I334-I336 VanDerWaalsContact C-N 3.29Å; I334-I336 PolarHBondContact O-N 3.26Å; I336-E338 VanDerWaalsContact C-N 3.29Å; I336-E338 PolarHBondContact O-N 3.36Å; I336-R339 PolarHBondContact O-N 2.89Å; I336-Q340 WeakPolarHBondContact O-CB 3.44Å; I336-Q340 WeakPolarHBondContact O-CG 3.44Å; I336-Q340 PolarHBondContact O-N 3.31Å
337	Y	98.1	Very high	97	Very high	5 Å²	5	40 Å²	40	2%	0.02	17%	0.171	C	C	.	.	H	α-helix	trans	-57.4	-44.2	176.7	-81	-43.3	0	0	0	111.6	L289 L293 M333 I334 R339 Q340 R341 K342 E345 A346 L349	L289-Y337 HydrophobicContact CD1-CD1 3.76Å; L289-Y337 HydrophobicContact CD1-CE1 3.53Å; L293-Y337 WeakPolarHBondContact CD2-OH 3.33Å; M333-Y337 HydrophobicContact CE-CE1 4.44Å; M333-Y337 HydrophobicContact CE-CE2 3.65Å; M333-Y337 VanDerWaalsContact CE-CZ 3.47Å; M333-Y337 WeakPolarHBondContact CE-OH 3.49Å; M333-Y337 HydrophobicContact CG-CD2 4.05Å; M333-Y337 HydrophobicContact CG-CE2 3.75Å; M333-Y337 VanDerWaalsContact O-CD2 3.31Å; M333-Y337 WeakPolarHBondContact O-CD2 3.24Å; M333-Y337 PolarHBondContact O-N 3.38Å; M333-Y337 HydrophobicContact SD-CE2 4.29Å; I334-Y337 PolarHBondContact O-N 3.1Å; Y337-R339 PolarHBondContact O-N 3.44Å; Y337-Q340 CarbonylContact O-C 3.57Å; Y337-Q340 PolarHBondContact O-N 2.86Å; Y337-R341 PolarHBondContact O-N 3.45Å; Y337-R341 VanDerWaalsContact O-N 3.07Å; Y337-K342 HydrophobicContact CD1-CB 3.79Å; Y337-K342 HydrophobicContact CD1-CD 4.02Å; Y337-K342 HydrophobicContact CE1-CD 4.28Å; Y337-K342 HydrophobicContact CG-CB 4.37Å; Y337-K342 PolarHBondContact O-N 3.01Å; Y337-E345 HydrophobicContact CD1-CB 4Å; Y337-E345 HydrophobicContact CD2-CB 4.19Å; Y337-E345 HydrophobicContact CE1-CB 3.79Å; Y337-E345 HydrophobicContact CE1-CG 4.4Å; Y337-E345 HydrophobicContact CE2-CB 3.98Å; Y337-E345 HydrophobicContact CG-CB 4.2Å; Y337-A346 HydrophobicContact CD2-CB 4.48Å; Y337-L349 HydrophobicContact CD2-CD2 4.48Å; Y337-L349 HydrophobicContact CE2-CD2 4.23Å
338	E	97.2	Very high	97.1	Very high	22 Å²	22	45.3 Å²	45.3	10%	0.103	20%	0.196	C	C	.	.	H	α-helix	trans	-64.2	-41.2	178.3	-67.3	171	174.7	0	0	112.6	I334 D335 I336 Q340 R341 Y343 A346 R390 N394	I334-E338 WeakPolarHBondContact CG2-OE1 3.35Å; I334-E338 VanDerWaalsContact O-CG 3.28Å; I334-E338 WeakPolarHBondContact O-CG 3.31Å; I334-E338 PolarHBondContact O-N 2.92Å; D335-E338 PolarHBondContact O-N 2.81Å; I336-E338 VanDerWaalsContact C-N 3.29Å; I336-E338 PolarHBondContact O-N 3.36Å; E338-Q340 PolarHBondContact O-N 3.35Å; E338-R341 PolarHBondContact O-N 3.22Å; E338-Y343 HydrophobicContact CB-CE1 4.46Å; E338-Y343 HydrophobicContact CG-CD1 4.45Å; E338-A346 HydrophobicContact CG-CB 4.25Å; E338-R390 VanDerWaalsContact CD-NE 3.34Å; E338-R390 IonicContact OE1-CZ 3.79Å; E338-R390 IonicContact OE1-NE 3.16Å; E338-R390 PolarHBondContact OE1-NE 2.81Å; E338-R390 IonicContact OE1-NH2 3.37Å; E338-R390 PolarHBondContact OE1-NH2 3.36Å; E338-R390 IonicContact OE2-CZ 3.76Å; E338-R390 IonicContact OE2-NE 3.05Å; E338-R390 PolarHBondContact OE2-NE 3.49Å; E338-R390 IonicContact OE2-NH1 2.7Å; E338-R390 IonicContact OE2-NH2 3.81Å; E338-R390 PolarHBondContact OE2-NH2 3.01Å; E338-N394 PolarHBondContact OE1-ND2 2.98Å; E338-N394 PolarHBondContact OE1-OD1 3.5Å
339	R	96.2	Very high	97.2	Very high	174 Å²	174	43.1 Å²	43.1	66%	0.657	19%	0.188	S	C	*	.	H	α-helix	trans	-63.6	-31.9	175.1	-68.6	-68.7	-178.9	-172.4	0.2	112.4	Y285 D335 I336 Y337 R341	Y285-R339 HydrophobicContact CD1-CB 3.9Å; Y285-R339 HydrophobicContact CD1-CG 4.2Å; Y285-R339 HydrophobicContact CD2-CB 4.5Å; Y285-R339 HydrophobicContact CE1-CB 3.92Å; Y285-R339 HydrophobicContact CE1-CG 3.73Å; Y285-R339 HydrophobicContact CG-CB 4.2Å; D335-R339 VanDerWaalsContact O-CG 3.25Å; D335-R339 WeakPolarHBondContact O-CG 3.28Å; D335-R339 PolarHBondContact O-N 3.4Å; I336-R339 PolarHBondContact O-N 2.89Å; Y337-R339 PolarHBondContact O-N 3.44Å; R339-R341 VanDerWaalsContact C-N 3.29Å
340	Q	96.3	Very high	97.2	Very high	53 Å²	53	43.1 Å²	43.1	25%	0.248	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	4.7	175.5	-70.1	-71.8	-1.8	0	0	113.5	Y285 D286 L289 I336 Y337 E338 K342	Y285-Q340 PolarHBondContact O-NE2 3.45Å; D286-Q340 PolarHBondContact OD1-NE2 2.97Å; L289-Q340 HydrophobicContact CD2-CG 4.23Å; I336-Q340 WeakPolarHBondContact O-CB 3.44Å; I336-Q340 WeakPolarHBondContact O-CG 3.44Å; I336-Q340 PolarHBondContact O-N 3.31Å; Y337-Q340 CarbonylContact O-C 3.57Å; Y337-Q340 PolarHBondContact O-N 2.86Å; E338-Q340 PolarHBondContact O-N 3.35Å; Q340-K342 HydrophobicContact CB-CG 4.2Å; Q340-K342 PolarHBondContact O-N 3.09Å
341	R	96.8	Very high	97	Very high	201 Å²	201	45.3 Å²	45.3	76%	0.758	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	25.3	-177	-51.9	-178.9	177.5	-167.5	-0.5	114.2	Y337 E338 R339 Y343	Y337-R341 PolarHBondContact O-N 3.45Å; Y337-R341 VanDerWaalsContact O-N 3.07Å; E338-R341 PolarHBondContact O-N 3.22Å; R339-R341 VanDerWaalsContact C-N 3.29Å; R341-Y343 VanDerWaalsContact C-N 3.32Å; R341-Y343 HydrophobicContact CB-CE2 3.89Å; R341-Y343 HydrophobicContact CG-CE2 4.45Å; R341-Y343 PolarHBondContact O-N 3.34Å
342	K	97.2	Very high	96.9	Very high	72 Å²	72	46 Å²	46	31%	0.313	20%	0.203	S	C	.	.			trans	-90.7	60.6	175.5	-68.6	-167.5	176.1	-157.9	0	110.6	L289 Y337 Q340 E345 A346	L289-K342 HydrophobicContact CD2-CD 4.01Å; Y337-K342 HydrophobicContact CD1-CB 3.79Å; Y337-K342 HydrophobicContact CD1-CD 4.02Å; Y337-K342 HydrophobicContact CE1-CD 4.28Å; Y337-K342 HydrophobicContact CG-CB 4.37Å; Y337-K342 PolarHBondContact O-N 3.01Å; Q340-K342 HydrophobicContact CB-CG 4.2Å; Q340-K342 PolarHBondContact O-N 3.09Å; K342-E345 VanDerWaalsContact C-OE2 3.28Å; K342-E345 WeakPolarHBondContact CA-OE2 3.41Å; K342-E345 HydrophobicContact CB-CB 4.45Å; K342-E345 WeakPolarHBondContact CB-OE2 3.32Å; K342-E345 PolarHBondContact O-N 3.35Å; K342-A346 PolarHBondContact O-N 3.38Å; K342-A346 VanDerWaalsContact O-N 3.15Å
343	Y	98.1	Very high	96.7	Very high	43 Å²	43	45.4 Å²	45.4	17%	0.169	20%	0.199	C	C	.	.	H	α-helix	trans	-70.8	-33.1	-169.1	-53.2	-69.8	0	0	0	112.9	E338 R341 A346 I347 H398 E399	E338-Y343 HydrophobicContact CB-CE1 4.46Å; E338-Y343 HydrophobicContact CG-CD1 4.45Å; R341-Y343 VanDerWaalsContact C-N 3.32Å; R341-Y343 HydrophobicContact CB-CE2 3.89Å; R341-Y343 HydrophobicContact CG-CE2 4.45Å; R341-Y343 PolarHBondContact O-N 3.34Å; Y343-A346 WeakPolarHBondContact O-CB 3.14Å; Y343-A346 PolarHBondContact O-N 2.88Å; Y343-I347 WeakPolarHBondContact O-CD1 3.41Å; Y343-I347 WeakPolarHBondContact O-CG1 3.49Å; Y343-I347 PolarHBondContact O-N 2.95Å; Y343-H398 HydrophobicContact CD1-CB 3.85Å; Y343-H398 AromaticContact CD1-CD2 3.73Å; Y343-H398 AromaticContact CD1-CG 3.78Å; Y343-H398 HydrophobicContact CD2-CB 3.72Å; Y343-H398 HydrophobicContact CE1-CB 4.04Å; Y343-H398 AromaticContact CE1-CD2 3.5Å; Y343-H398 AromaticContact CE1-CE1 3.95Å; Y343-H398 AromaticContact CE1-CG 3.54Å; Y343-H398 AromaticContact CE1-ND1 3.82Å; Y343-H398 AromaticContact CE1-NE2 3.8Å; Y343-H398 HydrophobicContact CE2-CB 3.91Å; Y343-H398 HydrophobicContact CG-CB 3.68Å; Y343-H398 AromaticContact CZ-CE1 3.93Å; Y343-H398 AromaticContact CZ-CG 3.66Å; Y343-H398 AromaticContact CZ-ND1 3.56Å; Y343-E399 WeakPolarHBondContact CB-OE1 3.21Å
344	N	97.7	Very high	96.2	Very high	75 Å²	75	45.4 Å²	45.4	40%	0.401	20%	0.199	S	C	.	.	H	α-helix	trans	-63.6	-41.8	176.4	-78.1	-52.4	0	0	0	111.8	A346 I347 Q348 E399	N344-A346 VanDerWaalsContact C-N 3.35Å; N344-I347 PolarHBondContact O-N 3.48Å; N344-Q348 WeakPolarHBondContact O-CG 3.43Å; N344-Q348 PolarHBondContact O-N 2.84Å; N344-E399 VanDerWaalsContact ND2-CD 3.29Å; N344-E399 PolarHBondContact ND2-OE1 2.87Å; N344-E399 PolarHBondContact ND2-OE2 2.82Å; N344-E399 PolarHBondContact OD1-OE2 3.48Å
345	E	97.6	Very high	95.6	Very high	61 Å²	61	47.9 Å²	47.9	29%	0.285	22%	0.216	S	C	.	.	H	α-helix	trans	-66.7	-37.3	175.3	-60.1	94.9	134.3	0	0	111.9	Y337 K342 L349	Y337-E345 HydrophobicContact CD1-CB 4Å; Y337-E345 HydrophobicContact CD2-CB 4.19Å; Y337-E345 HydrophobicContact CE1-CB 3.79Å; Y337-E345 HydrophobicContact CE1-CG 4.4Å; Y337-E345 HydrophobicContact CE2-CB 3.98Å; Y337-E345 HydrophobicContact CG-CB 4.2Å; K342-E345 VanDerWaalsContact C-OE2 3.28Å; K342-E345 WeakPolarHBondContact CA-OE2 3.41Å; K342-E345 HydrophobicContact CB-CB 4.45Å; K342-E345 WeakPolarHBondContact CB-OE2 3.32Å; K342-E345 PolarHBondContact O-N 3.35Å; E345-L349 WeakPolarHBondContact O-CB 3.27Å; E345-L349 PolarHBondContact O-N 2.83Å; E345-L349 VanDerWaalsContact O-N 3.09Å
346	A	98.1	Very high	94.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.3	-44.5	172.1	0	0	0	0	0	111.6	I334 Y337 E338 K342 Y343 N344 L349 I350	I334-A346 HydrophobicContact CG2-CB 4.44Å; Y337-A346 HydrophobicContact CD2-CB 4.48Å; E338-A346 HydrophobicContact CG-CB 4.25Å; K342-A346 PolarHBondContact O-N 3.38Å; K342-A346 VanDerWaalsContact O-N 3.15Å; Y343-A346 WeakPolarHBondContact O-CB 3.14Å; Y343-A346 PolarHBondContact O-N 2.88Å; N344-A346 VanDerWaalsContact C-N 3.35Å; A346-L349 PolarHBondContact O-N 2.63Å; A346-I350 WeakPolarHBondContact O-CD1 3.45Å; A346-I350 WeakPolarHBondContact O-CG1 3.4Å; A346-I350 PolarHBondContact O-N 2.86Å
347	I	98.3	Very high	93.8	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-60.5	-50.1	178	-71.2	161.4	0	0	0	110.6	Y343 N344 L349 I350 E351 Y391 N394 Q395 E399	Y343-I347 WeakPolarHBondContact O-CD1 3.41Å; Y343-I347 WeakPolarHBondContact O-CG1 3.49Å; Y343-I347 PolarHBondContact O-N 2.95Å; N344-I347 PolarHBondContact O-N 3.48Å; I347-L349 VanDerWaalsContact C-N 3.29Å; I347-L349 PolarHBondContact O-N 3.11Å; I347-I350 PolarHBondContact O-N 2.8Å; I347-I350 VanDerWaalsContact O-N 3.12Å; I347-E351 HydrophobicContact CG2-CG 4.41Å; I347-E351 WeakPolarHBondContact O-CG 3.36Å; I347-E351 PolarHBondContact O-N 3.05Å; I347-Y391 HydrophobicContact CG2-CD2 4.31Å; I347-Y391 HydrophobicContact CG2-CE2 3.75Å; I347-N394 HydrophobicContact CD1-CB 4.1Å; I347-N394 HydrophobicContact CG1-CB 3.71Å; I347-Q395 HydrophobicContact CD1-CB 4.01Å; I347-Q395 HydrophobicContact CG1-CB 4.36Å; I347-E399 HydrophobicContact CD1-CB 4.46Å; I347-E399 HydrophobicContact CD1-CG 3.6Å
348	Q	96.9	Very high	92.2	Very high	112 Å²	112	48.8 Å²	48.8	52%	0.523	22%	0.216	S	C	.	.	H	α-helix	trans	-58.6	-41.2	178.6	-72	173.6	-2.2	0	0	112.2	N344 E351 T352	N344-Q348 WeakPolarHBondContact O-CG 3.43Å; N344-Q348 PolarHBondContact O-N 2.84Å; Q348-E351 PolarHBondContact O-N 3.23Å; Q348-T352 WeakPolarHBondContact O-CB 3.39Å; Q348-T352 PolarHBondContact O-N 3.32Å; Q348-T352 PolarHBondContact O-OG1 3.09Å
349	L	97.2	Very high	90.2	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-66.8	-42	176.4	179.9	56.2	0	0	0	111.5	I300 L330 M333 I334 Y337 E345 A346 I347 T352 L353	I300-L349 HydrophobicContact CD1-CD1 4.42Å; L330-L349 HydrophobicContact CD2-CD1 4.13Å; M333-L349 HydrophobicContact CB-CD2 4.05Å; M333-L349 HydrophobicContact CG-CD2 3.94Å; M333-L349 HydrophobicContact SD-CD2 4.05Å; I334-L349 HydrophobicContact CG1-CD2 3.81Å; I334-L349 HydrophobicContact CG1-CG 4.11Å; Y337-L349 HydrophobicContact CD2-CD2 4.48Å; Y337-L349 HydrophobicContact CE2-CD2 4.23Å; E345-L349 WeakPolarHBondContact O-CB 3.27Å; E345-L349 PolarHBondContact O-N 2.83Å; E345-L349 VanDerWaalsContact O-N 3.09Å; A346-L349 PolarHBondContact O-N 2.63Å; I347-L349 VanDerWaalsContact C-N 3.29Å; I347-L349 PolarHBondContact O-N 3.11Å; L349-T352 WeakPolarHBondContact O-CB 3.46Å; L349-T352 PolarHBondContact O-N 3.04Å; L349-L353 HydrophobicContact CD1-CD1 4.49Å; L349-L353 HydrophobicContact CD1-CG 4.36Å; L349-L353 HydrophobicContact CG-CD1 4.46Å; L349-L353 WeakPolarHBondContact O-CG 3.38Å; L349-L353 PolarHBondContact O-N 3.08Å
350	I	96.2	Very high	88.1	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.2	-46.3	175.2	-68.5	160.5	0	0	0	110.8	I334 A346 I347 T352 L353 L354 L387 R390 Y391	I334-I350 HydrophobicContact CD1-CD1 4.48Å; I334-I350 HydrophobicContact CD1-CG1 3.57Å; I334-I350 HydrophobicContact CG1-CG1 4.06Å; I334-I350 HydrophobicContact CG2-CD1 4.03Å; I334-I350 HydrophobicContact CG2-CG1 4.25Å; A346-I350 WeakPolarHBondContact O-CD1 3.45Å; A346-I350 WeakPolarHBondContact O-CG1 3.4Å; A346-I350 PolarHBondContact O-N 2.86Å; I347-I350 PolarHBondContact O-N 2.8Å; I347-I350 VanDerWaalsContact O-N 3.12Å; I350-T352 VanDerWaalsContact C-N 3.31Å; I350-T352 PolarHBondContact O-N 3.49Å; I350-L353 PolarHBondContact O-N 2.94Å; I350-L354 HydrophobicContact CG2-CD1 3.76Å; I350-L354 HydrophobicContact CG2-CG 4.14Å; I350-L354 WeakPolarHBondContact O-CB 3.44Å; I350-L354 WeakPolarHBondContact O-CG 3.45Å; I350-L354 PolarHBondContact O-N 2.74Å; I350-L387 HydrophobicContact CG1-CD2 4.35Å; I350-L387 HydrophobicContact CG2-CB 4.26Å; I350-L387 HydrophobicContact CG2-CD2 4.4Å; I350-R390 HydrophobicContact CD1-CB 3.77Å; I350-Y391 HydrophobicContact CG2-CD2 4.01Å; I350-Y391 HydrophobicContact CG2-CG 4.45Å
351	E	93.6	Very high	85.8	Confident	46 Å²	46	48.8 Å²	48.8	22%	0.215	23%	0.234	C	C	.	.	H	α-helix	trans	-61.4	-40.5	177.4	-71.6	179.6	162.5	0	0	111.4	I347 Q348 L353 L354 S355 Y391 Y408	I347-E351 HydrophobicContact CG2-CG 4.41Å; I347-E351 WeakPolarHBondContact O-CG 3.36Å; I347-E351 PolarHBondContact O-N 3.05Å; Q348-E351 PolarHBondContact O-N 3.23Å; E351-L353 PolarHBondContact O-N 3.49Å; E351-L354 PolarHBondContact O-N 2.9Å; E351-S355 WeakPolarHBondContact O-CB 3.34Å; E351-S355 PolarHBondContact O-N 2.89Å; E351-Y391 HydrophobicContact CG-CD2 4.17Å; E351-Y391 HydrophobicContact CG-CE2 3.51Å; E351-Y391 WeakPolarHBondContact OE1-CE2 3.26Å; E351-Y391 PolarHBondContact OE1-OH 2.86Å; E351-Y408 HydrophobicContact CG-CE2 4.28Å
352	T	92.5	Very high	83.2	Confident	22 Å²	22	46.8 Å²	46.8	14%	0.135	24%	0.238	C	C	.	.	H	α-helix	trans	-59.4	-48	174.3	-57.6	0	0	0	0	110.9	I300 Q348 L349 I350 S355	I300-T352 HydrophobicContact CG2-CG2 4.5Å; Q348-T352 WeakPolarHBondContact O-CB 3.39Å; Q348-T352 PolarHBondContact O-N 3.32Å; Q348-T352 PolarHBondContact O-OG1 3.09Å; L349-T352 WeakPolarHBondContact O-CB 3.46Å; L349-T352 PolarHBondContact O-N 3.04Å; I350-T352 VanDerWaalsContact C-N 3.31Å; I350-T352 PolarHBondContact O-N 3.49Å; T352-S355 WeakPolarHBondContact O-CB 3.26Å; T352-S355 PolarHBondContact O-N 2.89Å; T352-S355 PolarHBondContact O-OG 3Å
353	L	91.8	Very high	80.7	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.016	25%	0.246	C	C	.	.	H	α-helix	trans	-68	-38	178.8	-67.8	176.8	0	0	0	112.7	V303 F327 L330 L331 I334 L349 I350 E351 S355 L356 L387	V303-L353 HydrophobicContact CG1-CD2 4.28Å; F327-L353 HydrophobicContact CD2-CD2 4.11Å; F327-L353 HydrophobicContact CE2-CD1 4.16Å; F327-L353 HydrophobicContact CE2-CD2 4.11Å; L330-L353 HydrophobicContact CB-CD1 4.29Å; L330-L353 HydrophobicContact CD1-CD2 3.87Å; L331-L353 HydrophobicContact CD2-CD1 4.46Å; I334-L353 HydrophobicContact CD1-CD1 4.09Å; L349-L353 HydrophobicContact CD1-CD1 4.49Å; L349-L353 HydrophobicContact CD1-CG 4.36Å; L349-L353 HydrophobicContact CG-CD1 4.46Å; L349-L353 WeakPolarHBondContact O-CG 3.38Å; L349-L353 PolarHBondContact O-N 3.08Å; I350-L353 PolarHBondContact O-N 2.94Å; E351-L353 PolarHBondContact O-N 3.49Å; L353-S355 VanDerWaalsContact C-N 3.32Å; L353-L356 HydrophobicContact CD2-CD1 4.18Å; L353-L356 WeakPolarHBondContact O-CB 3.18Å; L353-L356 WeakPolarHBondContact O-CG 3.46Å; L353-L356 PolarHBondContact O-N 3.16Å; L353-L387 HydrophobicContact CB-CD1 4.03Å; L353-L387 HydrophobicContact CB-CD2 4.42Å; L353-L387 HydrophobicContact CD1-CD2 3.98Å
354	L	88.3	Confident	78.1	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-67.1	-34.9	175	-72.4	177.2	0	0	0	111.1	I350 E351 L356 T357 W358 L384 L387 L388 Y408 Y412	I350-L354 HydrophobicContact CG2-CD1 3.76Å; I350-L354 HydrophobicContact CG2-CG 4.14Å; I350-L354 WeakPolarHBondContact O-CB 3.44Å; I350-L354 WeakPolarHBondContact O-CG 3.45Å; I350-L354 PolarHBondContact O-N 2.74Å; E351-L354 PolarHBondContact O-N 2.9Å; L354-L356 PolarHBondContact O-N 3.36Å; L354-L356 VanDerWaalsContact O-N 3.1Å; L354-T357 PolarHBondContact O-N 3.09Å; L354-T357 PolarHBondContact O-OG1 2.73Å; L354-W358 PolarHBondContact O-NE1 3.03Å; L354-L384 HydrophobicContact CD2-CD1 3.45Å; L354-L384 VanDerWaalsContact CD2-CD1 3.45Å; L354-L387 HydrophobicContact CD2-CB 3.79Å; L354-L387 HydrophobicContact CD2-CD1 4.05Å; L354-L387 HydrophobicContact CG-CB 4.21Å; L354-L387 HydrophobicContact CG-CD1 4.49Å; L354-L388 HydrophobicContact CD1-CD2 3.92Å; L354-L388 HydrophobicContact CD2-CD2 4.24Å; L354-L388 HydrophobicContact CD2-CG 4.43Å; L354-Y408 HydrophobicContact CD1-CE1 3.86Å; L354-Y412 HydrophobicContact CB-CE2 4.4Å; L354-Y412 HydrophobicContact CD2-CE2 4.14Å
355	S	85	Confident	75.6	Confident	51 Å²	51	56.2 Å²	56.2	36%	0.357	29%	0.29	S	S	.	.	H	α-helix	trans	-57.2	-27.3	178.4	81.1	0	0	0	0	113.1	E351 T352 L353 T357 W358 S359	E351-S355 WeakPolarHBondContact O-CB 3.34Å; E351-S355 PolarHBondContact O-N 2.89Å; T352-S355 WeakPolarHBondContact O-CB 3.26Å; T352-S355 PolarHBondContact O-N 2.89Å; T352-S355 PolarHBondContact O-OG 3Å; L353-S355 VanDerWaalsContact C-N 3.32Å; S355-T357 PolarHBondContact O-N 3.33Å; S355-W358 WeakPolarHBondContact O-CB 3.35Å; S355-W358 PolarHBondContact O-N 3.45Å; S355-S359 PolarHBondContact O-N 2.93Å
356	L	82.1	Confident	73	Confident	12 Å²	12	55.4 Å²	55.4	6%	0.063	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-29.3	175.4	-59.9	171.9	0	0	0	112.3	V303 T304 L353 L354 W358 V375 L376 L379	V303-L356 HydrophobicContact CG1-CD1 3.46Å; V303-L356 VanDerWaalsContact CG1-CD1 3.46Å; T304-L356 HydrophobicContact CG2-CD2 3.84Å; L353-L356 HydrophobicContact CD2-CD1 4.18Å; L353-L356 WeakPolarHBondContact O-CB 3.18Å; L353-L356 WeakPolarHBondContact O-CG 3.46Å; L353-L356 PolarHBondContact O-N 3.16Å; L354-L356 PolarHBondContact O-N 3.36Å; L354-L356 VanDerWaalsContact O-N 3.1Å; L356-W358 PolarHBondContact O-N 3.31Å; L356-V375 WeakPolarHBondContact O-CG1 3.28Å; L356-L376 HydrophobicContact CB-CD2 4.38Å; L356-L376 HydrophobicContact CD1-CD2 4.31Å; L356-L379 HydrophobicContact CD1-CD1 4.37Å
357	T	75	Confident	70.3	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.006	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-16.3	177.5	63.5	0	0	0	0	113.2	L354 S355 L376 Y412	L354-T357 PolarHBondContact O-N 3.09Å; L354-T357 PolarHBondContact O-OG1 2.73Å; S355-T357 PolarHBondContact O-N 3.33Å; T357-L376 HydrophobicContact CG2-CD1 3.94Å; T357-L376 HydrophobicContact CG2-CD2 4.42Å; T357-L376 HydrophobicContact CG2-CG 3.73Å; T357-Y412 WeakPolarHBondContact CB-OH 3.46Å; T357-Y412 WeakPolarHBondContact CG2-OH 3.37Å; T357-Y412 PolarHBondContact OG1-OH 3.41Å
358	W	65.1	Low	67.5	Low	69 Å²	69	68.9 Å²	68.9	26%	0.261	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-31	-174	-55.8	79.5	0	0	0	112.9	L354 S355 L356 L360 H361 Y412 L415	L354-W358 PolarHBondContact O-NE1 3.03Å; S355-W358 WeakPolarHBondContact O-CB 3.35Å; S355-W358 PolarHBondContact O-N 3.45Å; L356-W358 PolarHBondContact O-N 3.31Å; W358-L360 PolarHBondContact O-N 3.01Å; W358-H361 PolarHBondContact O-N 2.75Å; W358-Y412 AromaticContact CE2-CD2 3.82Å; W358-Y412 AromaticContact CE2-CE2 3.82Å; W358-Y412 HydrophobicContact CH2-CD2 4.47Å; W358-Y412 AromaticContact CZ2-CD2 3.37Å; W358-Y412 HydrophobicContact CZ2-CD2 3.37Å; W358-Y412 AromaticContact CZ2-CE2 3.82Å; W358-Y412 HydrophobicContact CZ2-CE2 3.82Å; W358-Y412 AromaticContact CZ2-CG 3.99Å; W358-Y412 HydrophobicContact CZ2-CG 3.99Å; W358-Y412 AromaticContact NE1-CD2 3.75Å; W358-Y412 AromaticContact NE1-CE2 3.41Å; W358-L415 HydrophobicContact CE3-CB 4.44Å; W358-L415 HydrophobicContact CH2-CB 3.49Å; W358-L415 VanDerWaalsContact CH2-CB 3.49Å; W358-L415 HydrophobicContact CH2-CD1 3.51Å; W358-L415 HydrophobicContact CH2-CG 4.06Å; W358-L415 HydrophobicContact CZ3-CB 3.28Å; W358-L415 HydrophobicContact CZ3-CD1 3.38Å; W358-L415 HydrophobicContact CZ3-CG 3.83Å
359	S	54.6	Low	64.8	Low	84 Å²	84	67.8 Å²	67.8	59%	0.587	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-1.6	-172.6	-99.9	0	0	0	0	116.1	S355	S355-S359 PolarHBondContact O-N 2.93Å
360	L	51	Low	62.2	Low	25 Å²	25	76.7 Å²	76.7	13%	0.131	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-2.5	-175.4	-71.1	165.9	0	0	0	114.5	L306 W358 F366 L371 V375	L306-L360 HydrophobicContact CD1-CD2 4Å; W358-L360 PolarHBondContact O-N 3.01Å; L360-F366 HydrophobicContact CD2-CB 4.28Å; L360-F366 HydrophobicContact CD2-CD1 3.23Å; L360-F366 HydrophobicContact CD2-CD2 4.29Å; L360-F366 HydrophobicContact CD2-CE1 3.48Å; L360-F366 VanDerWaalsContact CD2-CE1 3.48Å; L360-F366 HydrophobicContact CD2-CE2 4.47Å; L360-F366 HydrophobicContact CD2-CG 3.67Å; L360-F366 HydrophobicContact CD2-CZ 4.1Å; L360-L371 HydrophobicContact CD1-CD1 4.28Å; L360-L371 HydrophobicContact CD2-CD1 4.14Å; L360-V375 HydrophobicContact CD1-CB 4.41Å; L360-V375 HydrophobicContact CD1-CG1 3.76Å; L360-V375 HydrophobicContact CD1-CG2 3.69Å
361	H	48.3	Very low	60	Low	141 Å²	141	79.3 Å²	79.3	65%	0.653	41%	0.406	S	S	*	.	S	Bend	trans	-93.1	-13.1	-179.4	-81.7	-60.8	0	0	0	114.9	W358	W358-H361 PolarHBondContact O-N 2.75Å
362	N	43.4	Very low	58.1	Low	158 Å²	158	83.3 Å²	83.3	85%	0.845	43%	0.434	S	S	*	.	S	Bend	trans	-115.7	10.1	-171.4	-73.7	-15.2	0	0	0	114.9
363	D	44.4	Very low	56.8	Low	90 Å²	90	85 Å²	85	48%	0.481	46%	0.456	S	S	.	.			trans	-123.7	112	-171.1	-142.6	-12.2	0	0	0	110.7	Q365 F366	D363-Q365 PolarHBondContact O-N 3.15Å; D363-Q365 VanDerWaalsContact O-N 3.11Å; D363-F366 HydrophobicContact CB-CD2 3.9Å; D363-F366 PolarHBondContact O-N 3.42Å
364	D	43.8	Very low	56	Low	143 Å²	143	85.4 Å²	85.4	77%	0.765	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-61.4	-21.4	-170.4	-85.7	-27.8	0	0	0	113.3	F366	D364-F366 PolarHBondContact O-N 3.31Å
365	Q	45.3	Very low	55.5	Low	155 Å²	155	86 Å²	86	72%	0.724	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-67.2	-20.7	173.3	-78.9	-170.8	-5.4	0	0	113.3	D363	D363-Q365 PolarHBondContact O-N 3.15Å; D363-Q365 VanDerWaalsContact O-N 3.11Å
366	F	41.9	Very low	55.5	Low	45 Å²	45	83.5 Å²	83.5	20%	0.197	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-95.9	-5.8	-172.5	-76.2	-88.4	0	0	0	114.9	L306 L360 D363 D364 N368 L369 L371	L306-F366 HydrophobicContact CD1-CE1 3.63Å; L306-F366 HydrophobicContact CD1-CZ 3.49Å; L306-F366 VanDerWaalsContact CD1-CZ 3.49Å; L360-F366 HydrophobicContact CD2-CB 4.28Å; L360-F366 HydrophobicContact CD2-CD1 3.23Å; L360-F366 HydrophobicContact CD2-CD2 4.29Å; L360-F366 HydrophobicContact CD2-CE1 3.48Å; L360-F366 VanDerWaalsContact CD2-CE1 3.48Å; L360-F366 HydrophobicContact CD2-CE2 4.47Å; L360-F366 HydrophobicContact CD2-CG 3.67Å; L360-F366 HydrophobicContact CD2-CZ 4.1Å; D363-F366 HydrophobicContact CB-CD2 3.9Å; D363-F366 PolarHBondContact O-N 3.42Å; D364-F366 PolarHBondContact O-N 3.31Å; F366-N368 PolarHBondContact O-N 3.36Å; F366-L369 HydrophobicContact CD1-CD1 4.14Å; F366-L369 HydrophobicContact CE1-CD1 4.21Å; F366-L369 PolarHBondContact O-N 2.64Å; F366-L371 HydrophobicContact CD1-CD1 3.98Å
367	L	42.6	Very low	55.5	Low	140 Å²	140	83.7 Å²	83.7	73%	0.733	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-64.3	-23	167	-100.8	127.2	0	0	0	112.6
368	N	37.8	Very low	55.9	Low	148 Å²	148	84.5 Å²	84.5	79%	0.791	45%	0.45	S	S	*	.	S	Bend	trans	-84.9	-26.5	-178.5	-72.6	-29.6	0	0	0	113.8	F366 K370	F366-N368 PolarHBondContact O-N 3.36Å; N368-K370 PolarHBondContact O-N 3.3Å
369	L	42.2	Very low	57	Low	88 Å²	88	81.2 Å²	81.2	46%	0.461	44%	0.437	S	S	.	.	S	Bend	trans	-84.9	98.5	164.5	-80.2	141.7	0	0	0	105.9	F366 L371	F366-L369 HydrophobicContact CD1-CD1 4.14Å; F366-L369 HydrophobicContact CE1-CD1 4.21Å; F366-L369 PolarHBondContact O-N 2.64Å; L369-L371 HydrophobicContact CB-CD1 3.99Å; L369-L371 HydrophobicContact CB-CG 4Å; L369-L371 PolarHBondContact O-N 3.05Å
370	K	41.5	Very low	58.4	Low	190 Å²	190	77.2 Å²	77.2	83%	0.826	41%	0.409	S	S	*	.			trans	-59.1	73.9	168.6	-77.9	-178.6	175.8	178.1	0	109.7	N368 T372	N368-K370 PolarHBondContact O-N 3.3Å; K370-T372 PolarHBondContact O-N 3.25Å
371	L	50.5	Low	59.8	Low	55 Å²	55	76.3 Å²	76.3	29%	0.288	41%	0.405	S	S	.	.			trans	-78.4	73.7	175.8	-72	157.8	0	0	0	106.5	I311 L360 F366 L369 G373 Q378	I311-L371 HydrophobicContact CD1-CD2 4.18Å; L360-L371 HydrophobicContact CD1-CD1 4.28Å; L360-L371 HydrophobicContact CD2-CD1 4.14Å; F366-L371 HydrophobicContact CD1-CD1 3.98Å; L369-L371 HydrophobicContact CB-CD1 3.99Å; L369-L371 HydrophobicContact CB-CG 4Å; L369-L371 PolarHBondContact O-N 3.05Å; L371-G373 PolarHBondContact O-N 3.31Å; L371-Q378 VanDerWaalsContact CD2-NE2 3.28Å
372	T	52.7	Low	61.6	Low	130 Å²	130	70.1 Å²	70.1	80%	0.798	38%	0.378	S	S	*	.			trans	-72.4	115.9	170.5	51.7	0	0	0	0	108	K370	K370-T372 PolarHBondContact O-N 3.25Å
373	G	64.7	Low	63.8	Low	57 Å²	57	66.3 Å²	66.3	59%	0.588	35%	0.351	S	S	*	.	S	Bend	trans	126.4	-177.8	171.5	0	0	0	0	0	115	L371	L371-G373 PolarHBondContact O-N 3.31Å
374	C	75.9	Confident	65.9	Low	11 Å²	11	62.1 Å²	62.1	7%	0.074	33%	0.329	C	S	.	.			trans	-75.4	126.9	-177.3	178.4	0	0	0	0	111.5	L376 D377 C421	C374-L376 VanDerWaalsContact C-N 3.34Å; C374-L376 PolarHBondContact O-N 2.98Å; C374-D377 HydrophobicContact CB-CB 3.94Å; C374-D377 WeakPolarHBondContact O-CA 3.45Å; C374-D377 WeakPolarHBondContact O-CB 3.12Å; C374-D377 PolarHBondContact O-N 3.29Å; C374-C421 VanDerWaalsContact CB-SG 3.54Å
375	V	77.9	Confident	68.1	Low	12 Å²	12	55.6 Å²	55.6	7%	0.073	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-58.1	-42.3	-178.6	-176	0	0	0	0	113.1	L356 L360 D377 Q378	L356-V375 WeakPolarHBondContact O-CG1 3.28Å; L360-V375 HydrophobicContact CD1-CB 4.41Å; L360-V375 HydrophobicContact CD1-CG1 3.76Å; L360-V375 HydrophobicContact CD1-CG2 3.69Å; V375-D377 PolarHBondContact O-N 2.93Å; V375-Q378 WeakPolarHBondContact O-CB 3.23Å; V375-Q378 PolarHBondContact O-N 3Å
376	L	85.1	Confident	70.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-66.7	-22.4	177.1	-67.5	177.9	0	0	0	112.6	F327 L356 T357 C374 Q378 L379 G380 L384 L387	F327-L376 HydrophobicContact CE2-CD2 4.43Å; F327-L376 HydrophobicContact CZ-CD2 4.35Å; L356-L376 HydrophobicContact CB-CD2 4.38Å; L356-L376 HydrophobicContact CD1-CD2 4.31Å; T357-L376 HydrophobicContact CG2-CD1 3.94Å; T357-L376 HydrophobicContact CG2-CD2 4.42Å; T357-L376 HydrophobicContact CG2-CG 3.73Å; C374-L376 VanDerWaalsContact C-N 3.34Å; C374-L376 PolarHBondContact O-N 2.98Å; L376-Q378 VanDerWaalsContact C-N 3.27Å; L376-Q378 PolarHBondContact O-N 2.94Å; L376-L379 HydrophobicContact CD2-CD1 4.2Å; L376-L379 PolarHBondContact O-N 3.38Å; L376-G380 VanDerWaalsContact O-O 3.12Å; L376-L384 HydrophobicContact CD1-CB 4.04Å; L376-L384 HydrophobicContact CD1-CD1 4.4Å; L376-L387 HydrophobicContact CD1-CD1 3.96Å
377	D	82.8	Confident	72.8	Confident	16 Å²	16	48.3 Å²	48.3	9%	0.086	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-74.8	-20.1	178.9	-158.7	67.8	0	0	0	112.9	Q315 C374 V375 L379 G380 C382	Q315-D377 WeakPolarHBondContact CG-OD2 3.17Å; Q315-D377 PolarHBondContact NE2-OD1 3.39Å; Q315-D377 PolarHBondContact NE2-OD2 3.36Å; C374-D377 HydrophobicContact CB-CB 3.94Å; C374-D377 WeakPolarHBondContact O-CA 3.45Å; C374-D377 WeakPolarHBondContact O-CB 3.12Å; C374-D377 PolarHBondContact O-N 3.29Å; V375-D377 PolarHBondContact O-N 2.93Å; D377-L379 PolarHBondContact O-N 3.08Å; D377-G380 CarbonylContact C-O 3.56Å; D377-G380 WeakPolarHBondContact CA-O 3.06Å; D377-G380 PolarHBondContact O-N 3.37Å; D377-C382 HydrophobicContact CB-CB 4.04Å; D377-C382 PolarHBondContact OD1-N 3.41Å
378	Q	83.3	Confident	75.2	Confident	17 Å²	17	41.7 Å²	41.7	8%	0.079	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-68.1	-24	172.1	-60.5	172.6	5.5	0	0	112.5	I311 L371 V375 L376 G380	I311-Q378 HydrophobicContact CG2-CB 4.11Å; I311-Q378 HydrophobicContact CG2-CG 4.06Å; L371-Q378 VanDerWaalsContact CD2-NE2 3.28Å; V375-Q378 WeakPolarHBondContact O-CB 3.23Å; V375-Q378 PolarHBondContact O-N 3Å; L376-Q378 VanDerWaalsContact C-N 3.27Å; L376-Q378 PolarHBondContact O-N 2.94Å; Q378-G380 VanDerWaalsContact C-N 3.27Å
379	L	87.3	Confident	77.9	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-80.5	-12.6	172.8	-61.2	165.7	0	0	0	111.6	V303 R309 P323 Y324 F327 L356 L376 D377	V303-L379 HydrophobicContact CG1-CD1 3.55Å; V303-L379 HydrophobicContact CG1-CD2 4.07Å; V303-L379 HydrophobicContact CG1-CG 4.47Å; R309-L379 HydrophobicContact CG-CD2 4.46Å; P323-L379 HydrophobicContact CB-CD2 3.86Å; Y324-L379 WeakPolarHBondContact CA-O 3.11Å; Y324-L379 WeakPolarHBondContact CB-O 3.25Å; Y324-L379 WeakPolarHBondContact CD2-O 3.32Å; F327-L379 HydrophobicContact CB-CB 4.5Å; F327-L379 HydrophobicContact CD1-CB 4.33Å; F327-L379 HydrophobicContact CD2-CD1 4.17Å; F327-L379 HydrophobicContact CG-CB 4.47Å; F327-L379 HydrophobicContact CG-CD1 4.19Å; L356-L379 HydrophobicContact CD1-CD1 4.37Å; L376-L379 HydrophobicContact CD2-CD1 4.2Å; L376-L379 PolarHBondContact O-N 3.38Å; D377-L379 PolarHBondContact O-N 3.08Å
380	G	83.3	Confident	80.5	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	124.8	-172.3	-170.1	0	0	0	0	0	111.1	L376 D377 Q378 C382	L376-G380 VanDerWaalsContact O-O 3.12Å; D377-G380 CarbonylContact C-O 3.56Å; D377-G380 WeakPolarHBondContact CA-O 3.06Å; D377-G380 PolarHBondContact O-N 3.37Å; Q378-G380 VanDerWaalsContact C-N 3.27Å; G380-C382 PolarHBondContact O-N 3.41Å
381	P	81.4	Confident	83.1	Confident	6 Å²	6	24.3 Å²	24.3	4%	0.039	14%	0.139	C	C	.	.	S	Bend	trans	-45	112	-172.1	-32.3	33	0	0	0	114.1	Y324 R383 R743	Y324-P381 HydrophobicContact CE2-CG 4.46Å; P381-R383 WeakPolarHBondContact O-CG 3.19Å; P381-R383 PolarHBondContact O-N 3.37Å; P381-R743 VanDerWaalsContact CB-NH1 3.33Å
382	C	86.1	Confident	85.2	Confident	11 Å²	11	21.7 Å²	21.7	7%	0.074	13%	0.125	C	C	.	.			trans	-50.9	136.4	-173.5	175.3	0	0	0	0	113.8	D377 G380 L384 C421	D377-C382 HydrophobicContact CB-CB 4.04Å; D377-C382 PolarHBondContact OD1-N 3.41Å; G380-C382 PolarHBondContact O-N 3.41Å; C382-L384 PolarHBondContact SG-N 3.01Å; C382-C421 HydrophobicContact CB-CB 3.41Å; C382-C421 VanDerWaalsContact CB-CB 3.41Å
383	R	89.6	Confident	87.3	Confident	78 Å²	78	16.8 Å²	16.8	29%	0.294	9%	0.094	S	C	.	.			trans	-119.8	17.3	-179.1	-62	-63.3	-172.6	163.9	1.3	114.2	F327 L331 P381 G385 Y386 L387	F327-R383 HydrophobicContact CE1-CB 3.96Å; F327-R383 HydrophobicContact CE1-CG 3.81Å; F327-R383 HydrophobicContact CZ-CB 3.91Å; F327-R383 HydrophobicContact CZ-CG 4.26Å; L331-R383 HydrophobicContact CD1-CB 4.24Å; L331-R383 HydrophobicContact CD1-CG 3.73Å; P381-R383 WeakPolarHBondContact O-CG 3.19Å; P381-R383 PolarHBondContact O-N 3.37Å; R383-G385 VanDerWaalsContact C-N 3.3Å; R383-G385 PolarHBondContact O-N 3.12Å; R383-Y386 WeakPolarHBondContact O-CB 3.31Å; R383-Y386 PolarHBondContact O-N 3.3Å; R383-L387 PolarHBondContact O-N 3.16Å
384	L	89.3	Confident	88.8	Confident	1 Å²	1	14.1 Å²	14.1	1%	0.005	7%	0.066	C	C	.	.	H	α-helix	trans	-51	-49.1	-179.9	177.9	57.5	0	0	0	112.5	L354 L376 C382 Y386 L387 L388 Y412 Y416 C419	L354-L384 HydrophobicContact CD2-CD1 3.45Å; L354-L384 VanDerWaalsContact CD2-CD1 3.45Å; L376-L384 HydrophobicContact CD1-CB 4.04Å; L376-L384 HydrophobicContact CD1-CD1 4.4Å; C382-L384 PolarHBondContact SG-N 3.01Å; L384-Y386 VanDerWaalsContact C-N 3.25Å; L384-Y386 PolarHBondContact O-N 3.43Å; L384-L387 PolarHBondContact O-N 3.19Å; L384-L387 VanDerWaalsContact O-N 3.15Å; L384-L388 HydrophobicContact CD1-CD1 3.84Å; L384-L388 HydrophobicContact CD1-CD2 4.49Å; L384-L388 HydrophobicContact CD1-CG 3.86Å; L384-L388 HydrophobicContact CG-CD1 3.92Å; L384-L388 HydrophobicContact CG-CG 4.35Å; L384-L388 PolarHBondContact O-N 2.96Å; L384-Y412 HydrophobicContact CD1-CE1 3.78Å; L384-Y412 HydrophobicContact CD1-CE2 4.36Å; L384-Y412 WeakPolarHBondContact CD1-OH 3.38Å; L384-Y412 HydrophobicContact CD2-CE1 4.01Å; L384-Y412 HydrophobicContact CG-CE1 4.41Å; L384-Y416 HydrophobicContact CD2-CD1 4.34Å; L384-Y416 HydrophobicContact CD2-CE1 3.91Å; L384-C419 HydrophobicContact CD2-CB 3.59Å
385	G	89.2	Confident	89.8	Confident	6 Å²	6	13.7 Å²	13.7	6%	0.062	6%	0.063	C	C	.	.	H	α-helix	trans	-65	-29.4	-177.6	0	0	0	0	0	114	R383 N389	R383-G385 VanDerWaalsContact C-N 3.3Å; R383-G385 PolarHBondContact O-N 3.12Å; G385-N389 VanDerWaalsContact O-CB 3.25Å; G385-N389 WeakPolarHBondContact O-CB 3.36Å; G385-N389 PolarHBondContact O-N 2.91Å
386	Y	92	Very high	90.5	Very high	48 Å²	48	13.3 Å²	13.3	19%	0.188	6%	0.061	C	C	.	.	H	α-helix	trans	-70.4	-48.2	172.2	167.9	-87.9	0	0	0	110.4	L331 D335 R383 L384 L388 N389 R390	L331-Y386 HydrophobicContact CD2-CD1 4.04Å; L331-Y386 HydrophobicContact CD2-CE1 3.92Å; D335-Y386 PolarHBondContact OD1-OH 3.49Å; R383-Y386 WeakPolarHBondContact O-CB 3.31Å; R383-Y386 PolarHBondContact O-N 3.3Å; L384-Y386 VanDerWaalsContact C-N 3.25Å; L384-Y386 PolarHBondContact O-N 3.43Å; Y386-L388 PolarHBondContact O-N 3.4Å; Y386-N389 PolarHBondContact O-N 2.95Å; Y386-R390 HydrophobicContact CD1-CG 4.24Å; Y386-R390 HydrophobicContact CD2-CG 4.25Å; Y386-R390 HydrophobicContact CE1-CG 3.79Å; Y386-R390 HydrophobicContact CE2-CG 3.83Å; Y386-R390 HydrophobicContact CG-CG 4.44Å; Y386-R390 WeakPolarHBondContact O-CG 3.48Å; Y386-R390 PolarHBondContact O-N 3.19Å
387	L	94.4	Very high	90.9	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-59.5	-48.6	-179.4	-69.2	172.5	0	0	0	112	L331 I334 I350 L353 L354 L376 R383 L384 N389 R390 Y391	L331-L387 HydrophobicContact CD2-CD2 3.77Å; L331-L387 HydrophobicContact CD2-CG 4.4Å; I334-L387 HydrophobicContact CD1-CD2 3.76Å; I350-L387 HydrophobicContact CG1-CD2 4.35Å; I350-L387 HydrophobicContact CG2-CB 4.26Å; I350-L387 HydrophobicContact CG2-CD2 4.4Å; L353-L387 HydrophobicContact CB-CD1 4.03Å; L353-L387 HydrophobicContact CB-CD2 4.42Å; L353-L387 HydrophobicContact CD1-CD2 3.98Å; L354-L387 HydrophobicContact CD2-CB 3.79Å; L354-L387 HydrophobicContact CD2-CD1 4.05Å; L354-L387 HydrophobicContact CG-CB 4.21Å; L354-L387 HydrophobicContact CG-CD1 4.49Å; L376-L387 HydrophobicContact CD1-CD1 3.96Å; R383-L387 PolarHBondContact O-N 3.16Å; L384-L387 PolarHBondContact O-N 3.19Å; L384-L387 VanDerWaalsContact O-N 3.15Å; L387-N389 VanDerWaalsContact C-N 3.34Å; L387-N389 PolarHBondContact O-N 3.41Å; L387-R390 PolarHBondContact O-N 3.45Å; L387-Y391 WeakPolarHBondContact O-CB 3.15Å; L387-Y391 PolarHBondContact O-N 3.11Å
388	L	93	Very high	91.4	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61	-42.5	177.4	-70	174.9	0	0	0	111.8	L354 L384 Y386 Y391 I392 V409 Y412 F413 I430	L354-L388 HydrophobicContact CD1-CD2 3.92Å; L354-L388 HydrophobicContact CD2-CD2 4.24Å; L354-L388 HydrophobicContact CD2-CG 4.43Å; L384-L388 HydrophobicContact CD1-CD1 3.84Å; L384-L388 HydrophobicContact CD1-CD2 4.49Å; L384-L388 HydrophobicContact CD1-CG 3.86Å; L384-L388 HydrophobicContact CG-CD1 3.92Å; L384-L388 HydrophobicContact CG-CG 4.35Å; L384-L388 PolarHBondContact O-N 2.96Å; Y386-L388 PolarHBondContact O-N 3.4Å; L388-Y391 WeakPolarHBondContact O-CB 3.35Å; L388-Y391 PolarHBondContact O-N 2.97Å; L388-I392 VanDerWaalsContact O-CG1 3.27Å; L388-I392 WeakPolarHBondContact O-CG1 3.38Å; L388-I392 PolarHBondContact O-N 2.97Å; L388-V409 HydrophobicContact CD2-CG2 4.39Å; L388-Y412 HydrophobicContact CD1-CD1 4.04Å; L388-Y412 HydrophobicContact CD1-CE1 4.07Å; L388-Y412 HydrophobicContact CD2-CD1 4Å; L388-Y412 HydrophobicContact CD2-CD2 4.17Å; L388-Y412 HydrophobicContact CD2-CE1 4.35Å; L388-Y412 HydrophobicContact CD2-CG 3.96Å; L388-F413 HydrophobicContact CD1-CE2 3.99Å; L388-F413 HydrophobicContact CD1-CZ 3.8Å; L388-I430 HydrophobicContact CB-CD1 3.99Å; L388-I430 HydrophobicContact CB-CG1 4.49Å; L388-I430 HydrophobicContact CD1-CD1 4.06Å
389	N	94.2	Very high	92	Very high	16 Å²	16	21.6 Å²	21.6	9%	0.086	11%	0.105	C	C	.	.	H	α-helix	trans	-64.8	-43.4	177.8	-177.3	72.8	0	0	0	112.5	G385 Y386 L387 Y391 I392 I393 M429 Q433	G385-N389 VanDerWaalsContact O-CB 3.25Å; G385-N389 WeakPolarHBondContact O-CB 3.36Å; G385-N389 PolarHBondContact O-N 2.91Å; Y386-N389 PolarHBondContact O-N 2.95Å; L387-N389 VanDerWaalsContact C-N 3.34Å; L387-N389 PolarHBondContact O-N 3.41Å; N389-Y391 VanDerWaalsContact C-N 3.33Å; N389-I392 PolarHBondContact O-N 3.03Å; N389-I393 WeakPolarHBondContact O-CG1 3.46Å; N389-I393 PolarHBondContact O-N 3.38Å; N389-I393 VanDerWaalsContact O-N 3.09Å; N389-M429 HydrophobicContact CB-CE 3.61Å; N389-Q433 WeakPolarHBondContact OD1-CG 3.04Å
390	R	96	Very high	92.3	Very high	44 Å²	44	29.8 Å²	29.8	17%	0.166	14%	0.141	C	C	.	.	H	α-helix	trans	-64.4	-38.6	175	-68.4	-44.6	-47.9	-178	8.7	111.8	E338 I350 Y386 L387 I393 N394	E338-R390 VanDerWaalsContact CD-NE 3.34Å; E338-R390 IonicContact OE1-CZ 3.79Å; E338-R390 IonicContact OE1-NE 3.16Å; E338-R390 PolarHBondContact OE1-NE 2.81Å; E338-R390 IonicContact OE1-NH2 3.37Å; E338-R390 PolarHBondContact OE1-NH2 3.36Å; E338-R390 IonicContact OE2-CZ 3.76Å; E338-R390 IonicContact OE2-NE 3.05Å; E338-R390 PolarHBondContact OE2-NE 3.49Å; E338-R390 IonicContact OE2-NH1 2.7Å; E338-R390 IonicContact OE2-NH2 3.81Å; E338-R390 PolarHBondContact OE2-NH2 3.01Å; I350-R390 HydrophobicContact CD1-CB 3.77Å; Y386-R390 HydrophobicContact CD1-CG 4.24Å; Y386-R390 HydrophobicContact CD2-CG 4.25Å; Y386-R390 HydrophobicContact CE1-CG 3.79Å; Y386-R390 HydrophobicContact CE2-CG 3.83Å; Y386-R390 HydrophobicContact CG-CG 4.44Å; Y386-R390 WeakPolarHBondContact O-CG 3.48Å; Y386-R390 PolarHBondContact O-N 3.19Å; L387-R390 PolarHBondContact O-N 3.45Å; R390-I393 PolarHBondContact O-N 3.39Å; R390-N394 PolarHBondContact NH2-OD1 2.88Å; R390-N394 VanDerWaalsContact NH2-OD1 3.07Å; R390-N394 WeakPolarHBondContact O-CB 3.44Å; R390-N394 PolarHBondContact O-N 3.21Å; R390-N394 PolarHBondContact O-ND2 2.64Å
391	Y	96.6	Very high	92.7	Very high	1 Å²	1	33.4 Å²	33.4	0%	0.004	16%	0.157	C	C	.	.	H	α-helix	trans	-58.2	-49.8	173.7	-171.5	-93.1	0	0	0	111.5	I347 I350 E351 L387 L388 N389 I393 N394 Q395 Y408 V409	I347-Y391 HydrophobicContact CG2-CD2 4.31Å; I347-Y391 HydrophobicContact CG2-CE2 3.75Å; I350-Y391 HydrophobicContact CG2-CD2 4.01Å; I350-Y391 HydrophobicContact CG2-CG 4.45Å; E351-Y391 HydrophobicContact CG-CD2 4.17Å; E351-Y391 HydrophobicContact CG-CE2 3.51Å; E351-Y391 WeakPolarHBondContact OE1-CE2 3.26Å; E351-Y391 PolarHBondContact OE1-OH 2.86Å; L387-Y391 WeakPolarHBondContact O-CB 3.15Å; L387-Y391 PolarHBondContact O-N 3.11Å; L388-Y391 WeakPolarHBondContact O-CB 3.35Å; L388-Y391 PolarHBondContact O-N 2.97Å; N389-Y391 VanDerWaalsContact C-N 3.33Å; Y391-I393 VanDerWaalsContact C-N 3.32Å; Y391-I393 PolarHBondContact O-N 3.05Å; Y391-N394 PolarHBondContact O-N 2.91Å; Y391-Q395 HydrophobicContact CD1-CB 4.26Å; Y391-Q395 HydrophobicContact CE1-CB 3.97Å; Y391-Q395 HydrophobicContact CE1-CG 4.01Å; Y391-Q395 HydrophobicContact CE2-CB 4.48Å; Y391-Q395 WeakPolarHBondContact O-CB 3.43Å; Y391-Q395 PolarHBondContact O-N 2.88Å; Y391-Y408 AromaticContact CD1-CD1 3.82Å; Y391-Y408 HydrophobicContact CD1-CD1 3.82Å; Y391-Y408 HydrophobicContact CD1-CE1 4.4Å; Y391-Y408 HydrophobicContact CD1-CG 4.35Å; Y391-Y408 AromaticContact CE1-CD1 3.45Å; Y391-Y408 HydrophobicContact CE1-CD1 3.45Å; Y391-Y408 VanDerWaalsContact CE1-CD1 3.45Å; Y391-Y408 HydrophobicContact CE1-CD2 4.3Å; Y391-Y408 HydrophobicContact CE1-CE1 4.2Å; Y391-Y408 AromaticContact CE1-CG 3.51Å; Y391-Y408 HydrophobicContact CE1-CG 3.51Å; Y391-Y408 HydrophobicContact CE2-CD1 4.33Å; Y391-Y408 HydrophobicContact CE2-CE1 4.34Å; Y391-Y408 HydrophobicContact CE2-CG 4.5Å; Y391-Y408 HydrophobicContact CG-CD1 4.41Å; Y391-Y408 AromaticContact CZ-CD1 3.72Å; Y391-Y408 AromaticContact CZ-CD2 3.91Å; Y391-Y408 AromaticContact CZ-CG 3.59Å; Y391-Y408 WeakPolarHBondContact OH-CD2 3.47Å; Y391-V409 HydrophobicContact CD1-CG2 4.09Å
392	I	95.3	Very high	93.1	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.167	C	C	.	.	I	π-helix	trans	-55.4	-48.7	178.3	-70.6	163.9	0	0	0	110.9	L388 N389 G396 V409 I430 Q433 L434 L437	L388-I392 VanDerWaalsContact O-CG1 3.27Å; L388-I392 WeakPolarHBondContact O-CG1 3.38Å; L388-I392 PolarHBondContact O-N 2.97Å; N389-I392 PolarHBondContact O-N 3.03Å; I392-G396 WeakPolarHBondContact O-CA 3.34Å; I392-G396 PolarHBondContact O-N 3.46Å; I392-V409 HydrophobicContact CD1-CG1 4.29Å; I392-V409 HydrophobicContact CD1-CG2 4.15Å; I392-V409 HydrophobicContact CG1-CG2 3.7Å; I392-I430 HydrophobicContact CD1-CG2 4.01Å; I392-Q433 HydrophobicContact CD1-CB 4.29Å; I392-Q433 HydrophobicContact CG2-CB 3.73Å; I392-L434 HydrophobicContact CD1-CD2 4.01Å; I392-L434 HydrophobicContact CD1-CG 4.06Å; I392-L434 HydrophobicContact CG1-CD2 4.37Å; I392-L437 HydrophobicContact CG2-CD1 3.58Å; I392-L437 HydrophobicContact CG2-CG 4.09Å
393	I	95.4	Very high	93.3	Very high	28 Å²	28	38.1 Å²	38.1	14%	0.144	18%	0.183	C	C	.	.	I	π-helix	trans	-65.9	-48.6	-178.4	-66.9	167.2	0	0	0	110.8	N389 R390 Y391 T397 H398	N389-I393 WeakPolarHBondContact O-CG1 3.46Å; N389-I393 PolarHBondContact O-N 3.38Å; N389-I393 VanDerWaalsContact O-N 3.09Å; R390-I393 PolarHBondContact O-N 3.39Å; Y391-I393 VanDerWaalsContact C-N 3.32Å; Y391-I393 PolarHBondContact O-N 3.05Å; I393-T397 WeakPolarHBondContact O-CA 3.41Å; I393-T397 WeakPolarHBondContact O-CB 3.21Å; I393-T397 PolarHBondContact O-N 2.79Å; I393-H398 PolarHBondContact O-N 2.69Å; I393-H398 VanDerWaalsContact O-N 3.08Å
394	N	97.3	Very high	93.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.187	C	C	.	.	I	π-helix	trans	-70.2	-52	-175.1	-63.2	-14.1	0	0	0	111.3	E338 I347 R390 Y391 H398 E399	E338-N394 PolarHBondContact OE1-ND2 2.98Å; E338-N394 PolarHBondContact OE1-OD1 3.5Å; I347-N394 HydrophobicContact CD1-CB 4.1Å; I347-N394 HydrophobicContact CG1-CB 3.71Å; R390-N394 PolarHBondContact NH2-OD1 2.88Å; R390-N394 VanDerWaalsContact NH2-OD1 3.07Å; R390-N394 WeakPolarHBondContact O-CB 3.44Å; R390-N394 PolarHBondContact O-N 3.21Å; R390-N394 PolarHBondContact O-ND2 2.64Å; Y391-N394 PolarHBondContact O-N 2.91Å; N394-H398 WeakPolarHBondContact O-CB 3.44Å; N394-H398 PolarHBondContact O-N 3.45Å; N394-E399 PolarHBondContact O-N 2.83Å
395	Q	96.2	Very high	93.5	Very high	3 Å²	3	38.6 Å²	38.6	1%	0.014	19%	0.187	C	C	.	.	I	π-helix	trans	-72.8	-40.9	-177.8	-174.8	63.5	93	0	0	112	I347 Y391 Q401 K404 A405	I347-Q395 HydrophobicContact CD1-CB 4.01Å; I347-Q395 HydrophobicContact CG1-CB 4.36Å; Y391-Q395 HydrophobicContact CD1-CB 4.26Å; Y391-Q395 HydrophobicContact CE1-CB 3.97Å; Y391-Q395 HydrophobicContact CE1-CG 4.01Å; Y391-Q395 HydrophobicContact CE2-CB 4.48Å; Y391-Q395 WeakPolarHBondContact O-CB 3.43Å; Y391-Q395 PolarHBondContact O-N 2.88Å; Q395-Q401 VanDerWaalsContact NE2-CD 3.3Å; Q395-Q401 CarbonylContact O-C 3.51Å; Q395-Q401 WeakPolarHBondContact O-CA 3.44Å; Q395-Q401 WeakPolarHBondContact O-CB 3.35Å; Q395-Q401 PolarHBondContact O-N 3.37Å; Q395-K404 HydrophobicContact CG-CD 4.35Å; Q395-K404 HydrophobicContact CG-CG 4.45Å; Q395-A405 HydrophobicContact CB-CB 4Å; Q395-A405 HydrophobicContact CG-CB 3.93Å
396	G	93.8	Very high	93.5	Very high	4 Å²	4	38.4 Å²	38.4	4%	0.041	18%	0.184	C	C	.	.	I	π-helix	trans	-81.5	-47.5	-174.5	0	0	0	0	0	113.4	I392 K400 Q401	I392-G396 WeakPolarHBondContact O-CA 3.34Å; I392-G396 PolarHBondContact O-N 3.46Å; G396-K400 WeakPolarHBondContact O-CA 3.22Å; G396-Q401 PolarHBondContact O-N 2.93Å
397	T	92.5	Very high	93.3	Very high	81 Å²	81	40.9 Å²	40.9	50%	0.497	20%	0.196	S	C	.	.	I	π-helix	trans	-96.2	-51.4	-172.7	-52.2	0	0	0	0	112.4	I393	I393-T397 WeakPolarHBondContact O-CA 3.41Å; I393-T397 WeakPolarHBondContact O-CB 3.21Å; I393-T397 PolarHBondContact O-N 2.79Å
398	H	94.3	Very high	93.1	Very high	75 Å²	75	43 Å²	43	35%	0.347	20%	0.204	S	C	.	.	I	π-helix	trans	-73.9	-49	-175.2	-69.5	-58.1	0	0	0	112.6	Y343 I393 N394 K400	Y343-H398 HydrophobicContact CD1-CB 3.85Å; Y343-H398 AromaticContact CD1-CD2 3.73Å; Y343-H398 AromaticContact CD1-CG 3.78Å; Y343-H398 HydrophobicContact CD2-CB 3.72Å; Y343-H398 HydrophobicContact CE1-CB 4.04Å; Y343-H398 AromaticContact CE1-CD2 3.5Å; Y343-H398 AromaticContact CE1-CE1 3.95Å; Y343-H398 AromaticContact CE1-CG 3.54Å; Y343-H398 AromaticContact CE1-ND1 3.82Å; Y343-H398 AromaticContact CE1-NE2 3.8Å; Y343-H398 HydrophobicContact CE2-CB 3.91Å; Y343-H398 HydrophobicContact CG-CB 3.68Å; Y343-H398 AromaticContact CZ-CE1 3.93Å; Y343-H398 AromaticContact CZ-CG 3.66Å; Y343-H398 AromaticContact CZ-ND1 3.56Å; I393-H398 PolarHBondContact O-N 2.69Å; I393-H398 VanDerWaalsContact O-N 3.08Å; N394-H398 WeakPolarHBondContact O-CB 3.44Å; N394-H398 PolarHBondContact O-N 3.45Å; H398-K400 PolarHBondContact O-N 3.21Å
399	E	95.1	Very high	92.8	Very high	51 Å²	51	43 Å²	43	24%	0.238	20%	0.204	C	C	.	.	S	Bend	trans	-80.6	-3	174.9	-67.3	-58	125.8	0	0	113.2	Y343 N344 I347 N394 Q401	Y343-E399 WeakPolarHBondContact CB-OE1 3.21Å; N344-E399 VanDerWaalsContact ND2-CD 3.29Å; N344-E399 PolarHBondContact ND2-OE1 2.87Å; N344-E399 PolarHBondContact ND2-OE2 2.82Å; N344-E399 PolarHBondContact OD1-OE2 3.48Å; I347-E399 HydrophobicContact CD1-CB 4.46Å; I347-E399 HydrophobicContact CD1-CG 3.6Å; N394-E399 PolarHBondContact O-N 2.83Å; E399-Q401 VanDerWaalsContact C-N 3.28Å; E399-Q401 WeakPolarHBondContact O-CG 3.16Å; E399-Q401 PolarHBondContact O-N 3.03Å
400	K	92.9	Very high	92.4	Very high	173 Å²	173	42.3 Å²	42.3	75%	0.752	20%	0.201	S	C	*	.			trans	56.1	36.8	179	-54.4	178	-178.8	176.9	0	113.8	G396 H398 P402	G396-K400 WeakPolarHBondContact O-CA 3.22Å; H398-K400 PolarHBondContact O-N 3.21Å; K400-P402 WeakPolarHBondContact O-CD 3.46Å
401	Q	92.1	Very high	91.8	Very high	76 Å²	76	43.4 Å²	43.4	36%	0.355	21%	0.21	S	C	.	.			trans	-114.8	64.6	176	-56.9	179	12.6	0	0	111.3	Q395 G396 E399 I403 K404 A405	Q395-Q401 VanDerWaalsContact NE2-CD 3.3Å; Q395-Q401 CarbonylContact O-C 3.51Å; Q395-Q401 WeakPolarHBondContact O-CA 3.44Å; Q395-Q401 WeakPolarHBondContact O-CB 3.35Å; Q395-Q401 PolarHBondContact O-N 3.37Å; G396-Q401 PolarHBondContact O-N 2.93Å; E399-Q401 VanDerWaalsContact C-N 3.28Å; E399-Q401 WeakPolarHBondContact O-CG 3.16Å; E399-Q401 PolarHBondContact O-N 3.03Å; Q401-I403 VanDerWaalsContact C-N 3.32Å; Q401-I403 PolarHBondContact O-N 2.91Å; Q401-K404 HydrophobicContact CB-CB 4Å; Q401-K404 PolarHBondContact O-N 3.13Å; Q401-A405 PolarHBondContact O-N 3.19Å
402	P	90.9	Very high	91.2	Very high	38 Å²	38	43.4 Å²	43.4	25%	0.247	21%	0.21	C	C	.	.	H	α-helix	trans	-62.5	-36.3	-173.5	27.1	-36.8	0	0	0	113	K400 A405 F406 L437 V441	K400-P402 WeakPolarHBondContact O-CD 3.46Å; P402-A405 PolarHBondContact O-N 2.93Å; P402-F406 VanDerWaalsContact O-CB 3.24Å; P402-F406 WeakPolarHBondContact O-CB 3.35Å; P402-F406 PolarHBondContact O-N 3.32Å; P402-L437 HydrophobicContact CB-CD2 3.84Å; P402-V441 HydrophobicContact CB-CG2 3.78Å; P402-V441 HydrophobicContact CG-CG2 3.88Å
403	I	88.8	Confident	90.5	Very high	77 Å²	77	43.8 Å²	43.8	40%	0.395	21%	0.212	S	C	.	.	H	α-helix	trans	-66.4	-43.2	178.5	-61.3	173	0	0	0	110.8	Q401 F406 K407 V441	Q401-I403 VanDerWaalsContact C-N 3.32Å; Q401-I403 PolarHBondContact O-N 2.91Å; I403-F406 PolarHBondContact O-N 2.89Å; I403-K407 HydrophobicContact CG2-CD 4.18Å; I403-K407 HydrophobicContact CG2-CG 4.41Å; I403-K407 WeakPolarHBondContact O-CB 3.39Å; I403-K407 WeakPolarHBondContact O-CG 3.07Å; I403-K407 PolarHBondContact O-N 2.95Å; I403-V441 HydrophobicContact CD1-CG1 4.22Å; I403-V441 HydrophobicContact CG1-CG1 3.92Å; I403-V441 HydrophobicContact CG1-CG2 3.79Å
404	K	91.5	Very high	89.6	Confident	90 Å²	90	48.3 Å²	48.3	39%	0.391	23%	0.23	S	C	.	.	H	α-helix	trans	-63.3	-47.6	178.1	-171.9	-176.7	176.1	-164.6	0	110.6	Q395 Q401 F406 K407 Y408	Q395-K404 HydrophobicContact CG-CD 4.35Å; Q395-K404 HydrophobicContact CG-CG 4.45Å; Q401-K404 HydrophobicContact CB-CB 4Å; Q401-K404 PolarHBondContact O-N 3.13Å; K404-F406 PolarHBondContact O-N 3.42Å; K404-K407 PolarHBondContact O-N 2.75Å; K404-Y408 WeakPolarHBondContact O-CB 3.28Å; K404-Y408 PolarHBondContact O-N 2.79Å
405	A	92.3	Very high	88.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58.4	-47.4	176.8	0	0	0	0	0	112	Q395 Q401 P402 Y408 V409 L437	Q395-A405 HydrophobicContact CB-CB 4Å; Q395-A405 HydrophobicContact CG-CB 3.93Å; Q401-A405 PolarHBondContact O-N 3.19Å; P402-A405 PolarHBondContact O-N 2.93Å; A405-Y408 PolarHBondContact O-N 2.97Å; A405-V409 WeakPolarHBondContact O-CG2 3.44Å; A405-V409 PolarHBondContact O-N 3.46Å; A405-V409 VanDerWaalsContact O-N 3.12Å; A405-L437 HydrophobicContact CB-CD1 3.81Å
406	F	89.6	Confident	87	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.009	26%	0.262	C	S	.	.	H	α-helix	trans	-61.1	-48.9	178.4	-174.8	-90.5	0	0	0	112	P402 I403 K404 Y408 V409 T410 L434 F438 L534 I537	P402-F406 VanDerWaalsContact O-CB 3.24Å; P402-F406 WeakPolarHBondContact O-CB 3.35Å; P402-F406 PolarHBondContact O-N 3.32Å; I403-F406 PolarHBondContact O-N 2.89Å; K404-F406 PolarHBondContact O-N 3.42Å; F406-Y408 PolarHBondContact O-N 2.97Å; F406-V409 PolarHBondContact O-N 3.43Å; F406-T410 HydrophobicContact CD1-CG2 4.06Å; F406-T410 HydrophobicContact CD2-CG2 4.47Å; F406-T410 HydrophobicContact CE1-CG2 3.72Å; F406-T410 HydrophobicContact CE2-CG2 4.16Å; F406-T410 HydrophobicContact CG-CG2 4.43Å; F406-T410 HydrophobicContact CZ-CG2 3.77Å; F406-T410 WeakPolarHBondContact O-CB 3.12Å; F406-T410 WeakPolarHBondContact O-CG2 3.3Å; F406-T410 PolarHBondContact O-N 2.86Å; F406-T410 PolarHBondContact O-OG1 2.77Å; F406-L434 HydrophobicContact CD2-CD2 4.05Å; F406-F438 HydrophobicContact CD2-CB 4.45Å; F406-F438 HydrophobicContact CE2-CB 4.04Å; F406-F438 AromaticContact CE2-CD2 3.98Å; F406-F438 HydrophobicContact CE2-CD2 3.98Å; F406-F438 HydrophobicContact CE2-CG 4.44Å; F406-F438 AromaticContact CZ-CD2 3.9Å; F406-F438 HydrophobicContact CZ-CD2 3.9Å; F406-L534 HydrophobicContact CD1-CD2 3.68Å; F406-L534 HydrophobicContact CE1-CD2 3.68Å; F406-L534 HydrophobicContact CG-CD2 4.36Å; F406-L534 HydrophobicContact CZ-CD2 4.35Å; F406-I537 HydrophobicContact CE2-CD1 4.4Å; F406-I537 HydrophobicContact CE2-CG1 3.9Å; F406-I537 HydrophobicContact CZ-CG1 3.87Å
407	K	87.4	Confident	85.7	Confident	99 Å²	99	58.9 Å²	58.9	43%	0.43	28%	0.283	S	S	.	.	H	α-helix	trans	-61	-45	178.3	-76.6	-174.8	177	-172.6	0	111.8	I403 K404 V409 T410 N411	I403-K407 HydrophobicContact CG2-CD 4.18Å; I403-K407 HydrophobicContact CG2-CG 4.41Å; I403-K407 WeakPolarHBondContact O-CB 3.39Å; I403-K407 WeakPolarHBondContact O-CG 3.07Å; I403-K407 PolarHBondContact O-N 2.95Å; K404-K407 PolarHBondContact O-N 2.75Å; K407-V409 PolarHBondContact O-N 3.48Å; K407-T410 PolarHBondContact O-OG1 2.85Å; K407-N411 WeakPolarHBondContact O-CB 3.47Å; K407-N411 PolarHBondContact O-N 3.35Å; K407-N411 PolarHBondContact O-ND2 3.04Å
408	Y	89.7	Confident	84.4	Confident	45 Å²	45	63.1 Å²	63.1	18%	0.176	30%	0.298	C	S	.	.	H	α-helix	trans	-58.8	-51	179.5	-174.8	-85.3	0	0	0	111.5	E351 L354 Y391 K404 A405 F406 N411 Y412	E351-Y408 HydrophobicContact CG-CE2 4.28Å; L354-Y408 HydrophobicContact CD1-CE1 3.86Å; Y391-Y408 AromaticContact CD1-CD1 3.82Å; Y391-Y408 HydrophobicContact CD1-CD1 3.82Å; Y391-Y408 HydrophobicContact CD1-CE1 4.4Å; Y391-Y408 HydrophobicContact CD1-CG 4.35Å; Y391-Y408 AromaticContact CE1-CD1 3.45Å; Y391-Y408 HydrophobicContact CE1-CD1 3.45Å; Y391-Y408 VanDerWaalsContact CE1-CD1 3.45Å; Y391-Y408 HydrophobicContact CE1-CD2 4.3Å; Y391-Y408 HydrophobicContact CE1-CE1 4.2Å; Y391-Y408 AromaticContact CE1-CG 3.51Å; Y391-Y408 HydrophobicContact CE1-CG 3.51Å; Y391-Y408 HydrophobicContact CE2-CD1 4.33Å; Y391-Y408 HydrophobicContact CE2-CE1 4.34Å; Y391-Y408 HydrophobicContact CE2-CG 4.5Å; Y391-Y408 HydrophobicContact CG-CD1 4.41Å; Y391-Y408 AromaticContact CZ-CD1 3.72Å; Y391-Y408 AromaticContact CZ-CD2 3.91Å; Y391-Y408 AromaticContact CZ-CG 3.59Å; Y391-Y408 WeakPolarHBondContact OH-CD2 3.47Å; K404-Y408 WeakPolarHBondContact O-CB 3.28Å; K404-Y408 PolarHBondContact O-N 2.79Å; A405-Y408 PolarHBondContact O-N 2.97Å; F406-Y408 PolarHBondContact O-N 2.97Å; Y408-N411 PolarHBondContact O-N 3.07Å; Y408-Y412 WeakPolarHBondContact O-CB 3.46Å; Y408-Y412 PolarHBondContact O-N 3.26Å
409	V	87.9	Confident	83.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-72.2	-39.2	-176	177.3	0	0	0	0	112.3	L388 Y391 I392 A405 F406 K407 N411 Y412 F413 I430 L434	L388-V409 HydrophobicContact CD2-CG2 4.39Å; Y391-V409 HydrophobicContact CD1-CG2 4.09Å; I392-V409 HydrophobicContact CD1-CG1 4.29Å; I392-V409 HydrophobicContact CD1-CG2 4.15Å; I392-V409 HydrophobicContact CG1-CG2 3.7Å; A405-V409 WeakPolarHBondContact O-CG2 3.44Å; A405-V409 PolarHBondContact O-N 3.46Å; A405-V409 VanDerWaalsContact O-N 3.12Å; F406-V409 PolarHBondContact O-N 3.43Å; K407-V409 PolarHBondContact O-N 3.48Å; V409-N411 VanDerWaalsContact C-N 3.35Å; V409-Y412 WeakPolarHBondContact O-CB 3.44Å; V409-Y412 PolarHBondContact O-N 3.3Å; V409-F413 HydrophobicContact CG1-CD2 3.87Å; V409-F413 HydrophobicContact CG1-CE2 3.74Å; V409-F413 VanDerWaalsContact O-CD2 3.31Å; V409-F413 WeakPolarHBondContact O-CD2 3.44Å; V409-F413 PolarHBondContact O-N 2.98Å; V409-I430 HydrophobicContact CG1-CG2 4.38Å; V409-L434 HydrophobicContact CB-CD2 4.05Å; V409-L434 HydrophobicContact CG1-CD1 3.97Å; V409-L434 HydrophobicContact CG1-CD2 4.01Å; V409-L434 HydrophobicContact CG1-CG 4.41Å
410	T	84.9	Confident	82.5	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.012	31%	0.305	C	S	.	.	H	α-helix	trans	-64.9	-40.7	175.7	51.7	0	0	0	0	111.5	F406 K407 Y412 F413 K414 P538	F406-T410 HydrophobicContact CD1-CG2 4.06Å; F406-T410 HydrophobicContact CD2-CG2 4.47Å; F406-T410 HydrophobicContact CE1-CG2 3.72Å; F406-T410 HydrophobicContact CE2-CG2 4.16Å; F406-T410 HydrophobicContact CG-CG2 4.43Å; F406-T410 HydrophobicContact CZ-CG2 3.77Å; F406-T410 WeakPolarHBondContact O-CB 3.12Å; F406-T410 WeakPolarHBondContact O-CG2 3.3Å; F406-T410 PolarHBondContact O-N 2.86Å; F406-T410 PolarHBondContact O-OG1 2.77Å; K407-T410 PolarHBondContact O-OG1 2.85Å; T410-Y412 VanDerWaalsContact C-N 3.35Å; T410-F413 PolarHBondContact O-N 3.22Å; T410-K414 WeakPolarHBondContact O-CG 3.49Å; T410-K414 PolarHBondContact O-N 3.39Å; T410-P538 HydrophobicContact CG2-CG 4.28Å
411	N	83	Confident	81.8	Confident	67 Å²	67	57.1 Å²	57.1	36%	0.358	27%	0.274	S	S	.	.	H	α-helix	trans	-66.9	-36.7	173.4	-71.3	-12.7	0	0	0	112	K407 Y408 V409 F413 K414 L415	K407-N411 WeakPolarHBondContact O-CB 3.47Å; K407-N411 PolarHBondContact O-N 3.35Å; K407-N411 PolarHBondContact O-ND2 3.04Å; Y408-N411 PolarHBondContact O-N 3.07Å; V409-N411 VanDerWaalsContact C-N 3.35Å; N411-F413 VanDerWaalsContact C-N 3.35Å; N411-F413 PolarHBondContact O-N 3.49Å; N411-K414 PolarHBondContact O-N 2.89Å; N411-K414 PolarHBondContact OD1-NZ 3.45Å; N411-L415 WeakPolarHBondContact O-CG 3.49Å; N411-L415 PolarHBondContact O-N 2.85Å
412	Y	84.9	Confident	81.4	Confident	1 Å²	1	53.8 Å²	53.8	0%	0.004	26%	0.259	C	S	.	.	H	α-helix	trans	-54.7	-50.5	171.7	-173.3	-78	0	0	0	110.7	L354 T357 W358 L384 L388 Y408 V409 T410 K414 L415 Y416	L354-Y412 HydrophobicContact CB-CE2 4.4Å; L354-Y412 HydrophobicContact CD2-CE2 4.14Å; T357-Y412 WeakPolarHBondContact CB-OH 3.46Å; T357-Y412 WeakPolarHBondContact CG2-OH 3.37Å; T357-Y412 PolarHBondContact OG1-OH 3.41Å; W358-Y412 AromaticContact CE2-CD2 3.82Å; W358-Y412 AromaticContact CE2-CE2 3.82Å; W358-Y412 HydrophobicContact CH2-CD2 4.47Å; W358-Y412 AromaticContact CZ2-CD2 3.37Å; W358-Y412 HydrophobicContact CZ2-CD2 3.37Å; W358-Y412 AromaticContact CZ2-CE2 3.82Å; W358-Y412 HydrophobicContact CZ2-CE2 3.82Å; W358-Y412 AromaticContact CZ2-CG 3.99Å; W358-Y412 HydrophobicContact CZ2-CG 3.99Å; W358-Y412 AromaticContact NE1-CD2 3.75Å; W358-Y412 AromaticContact NE1-CE2 3.41Å; L384-Y412 HydrophobicContact CD1-CE1 3.78Å; L384-Y412 HydrophobicContact CD1-CE2 4.36Å; L384-Y412 WeakPolarHBondContact CD1-OH 3.38Å; L384-Y412 HydrophobicContact CD2-CE1 4.01Å; L384-Y412 HydrophobicContact CG-CE1 4.41Å; L388-Y412 HydrophobicContact CD1-CD1 4.04Å; L388-Y412 HydrophobicContact CD1-CE1 4.07Å; L388-Y412 HydrophobicContact CD2-CD1 4Å; L388-Y412 HydrophobicContact CD2-CD2 4.17Å; L388-Y412 HydrophobicContact CD2-CE1 4.35Å; L388-Y412 HydrophobicContact CD2-CG 3.96Å; Y408-Y412 WeakPolarHBondContact O-CB 3.46Å; Y408-Y412 PolarHBondContact O-N 3.26Å; V409-Y412 WeakPolarHBondContact O-CB 3.44Å; V409-Y412 PolarHBondContact O-N 3.3Å; T410-Y412 VanDerWaalsContact C-N 3.35Å; Y412-K414 PolarHBondContact O-N 3.48Å; Y412-L415 PolarHBondContact O-N 3.09Å; Y412-Y416 AromaticContact CE1-CD1 3.68Å; Y412-Y416 HydrophobicContact CE1-CD1 3.68Å; Y412-Y416 HydrophobicContact CE1-CG 4.48Å; Y412-Y416 AromaticContact CZ-CD1 3.83Å; Y412-Y416 CarbonylContact O-C 3.47Å; Y412-Y416 WeakPolarHBondContact O-CA 3.45Å; Y412-Y416 PolarHBondContact O-N 2.87Å; Y412-Y416 WeakPolarHBondContact OH-CD1 3.42Å
413	F	80.2	Confident	81	Confident	8 Å²	8	54.5 Å²	54.5	4%	0.035	26%	0.257	C	S	.	.	H	α-helix	trans	-69.5	-30.3	177.9	-79.2	-70.3	0	0	0	114.2	L388 V409 T410 N411 L415 Y416 N417 L422 I430 P538 L540	L388-F413 HydrophobicContact CD1-CE2 3.99Å; L388-F413 HydrophobicContact CD1-CZ 3.8Å; V409-F413 HydrophobicContact CG1-CD2 3.87Å; V409-F413 HydrophobicContact CG1-CE2 3.74Å; V409-F413 VanDerWaalsContact O-CD2 3.31Å; V409-F413 WeakPolarHBondContact O-CD2 3.44Å; V409-F413 PolarHBondContact O-N 2.98Å; T410-F413 PolarHBondContact O-N 3.22Å; N411-F413 VanDerWaalsContact C-N 3.35Å; N411-F413 PolarHBondContact O-N 3.49Å; F413-L415 VanDerWaalsContact C-N 3.3Å; F413-Y416 CarbonylContact O-C 3.56Å; F413-N417 VanDerWaalsContact O-CB 3.25Å; F413-N417 WeakPolarHBondContact O-CB 3.46Å; F413-N417 PolarHBondContact O-N 2.99Å; F413-L422 HydrophobicContact CE1-CD2 3.56Å; F413-L422 HydrophobicContact CZ-CD2 3.62Å; F413-I430 HydrophobicContact CE2-CG2 3.93Å; F413-I430 HydrophobicContact CZ-CD1 4.3Å; F413-I430 HydrophobicContact CZ-CG2 4.33Å; F413-P538 HydrophobicContact CB-CG 4.2Å; F413-L540 HydrophobicContact CD1-CD2 3.93Å; F413-L540 HydrophobicContact CD2-CD2 4.45Å; F413-L540 HydrophobicContact CE1-CD2 3.77Å; F413-L540 HydrophobicContact CE2-CD1 3.92Å; F413-L540 HydrophobicContact CE2-CD2 4.32Å; F413-L540 HydrophobicContact CG-CD2 4.28Å; F413-L540 HydrophobicContact CZ-CD1 3.91Å; F413-L540 HydrophobicContact CZ-CD2 3.97Å
414	K	76.4	Confident	80.6	Confident	122 Å²	122	52.3 Å²	52.3	53%	0.53	25%	0.25	S	C	.	.	H	α-helix	trans	-63.7	-39.8	174.3	-74.5	172.6	-167.8	162.5	0	111.7	T410 N411 Y412 T535	T410-K414 WeakPolarHBondContact O-CG 3.49Å; T410-K414 PolarHBondContact O-N 3.39Å; N411-K414 PolarHBondContact O-N 2.89Å; N411-K414 PolarHBondContact OD1-NZ 3.45Å; Y412-K414 PolarHBondContact O-N 3.48Å; K414-T535 PolarHBondContact NZ-OG1 3.4Å; K414-T535 VanDerWaalsContact NZ-OG1 3.11Å
415	L	70.8	Confident	80.2	Confident	112 Å²	112	48.2 Å²	48.2	59%	0.586	23%	0.234	S	C	*	.	H	α-helix	trans	-88.2	-29.2	-176.7	-67.1	161.2	0	0	0	111.8	W358 N411 Y412 F413	W358-L415 HydrophobicContact CE3-CB 4.44Å; W358-L415 HydrophobicContact CH2-CB 3.49Å; W358-L415 VanDerWaalsContact CH2-CB 3.49Å; W358-L415 HydrophobicContact CH2-CD1 3.51Å; W358-L415 HydrophobicContact CH2-CG 4.06Å; W358-L415 HydrophobicContact CZ3-CB 3.28Å; W358-L415 HydrophobicContact CZ3-CD1 3.38Å; W358-L415 HydrophobicContact CZ3-CG 3.83Å; N411-L415 WeakPolarHBondContact O-CG 3.49Å; N411-L415 PolarHBondContact O-N 2.85Å; Y412-L415 PolarHBondContact O-N 3.09Å; F413-L415 VanDerWaalsContact C-N 3.3Å
416	Y	68.3	Low	79.9	Confident	27 Å²	27	53.4 Å²	53.4	11%	0.106	25%	0.253	C	S	.	.			trans	-141.9	88.6	-179.1	-172.1	-103.2	0	0	0	110.9	L384 Y412 F413 C419	L384-Y416 HydrophobicContact CD2-CD1 4.34Å; L384-Y416 HydrophobicContact CD2-CE1 3.91Å; Y412-Y416 AromaticContact CE1-CD1 3.68Å; Y412-Y416 HydrophobicContact CE1-CD1 3.68Å; Y412-Y416 HydrophobicContact CE1-CG 4.48Å; Y412-Y416 AromaticContact CZ-CD1 3.83Å; Y412-Y416 CarbonylContact O-C 3.47Å; Y412-Y416 WeakPolarHBondContact O-CA 3.45Å; Y412-Y416 PolarHBondContact O-N 2.87Å; Y412-Y416 WeakPolarHBondContact OH-CD1 3.42Å; F413-Y416 CarbonylContact O-C 3.56Å; Y416-C419 HydrophobicContact CD1-CB 4.45Å; Y416-C419 HydrophobicContact CE1-CB 3.61Å
417	N	66.3	Low	79.8	Confident	90 Å²	90	56 Å²	56	48%	0.481	26%	0.263	S	S	.	.			trans	-100.3	-11.7	178.3	-157	9.1	0	0	0	113.9	F413 C419	F413-N417 VanDerWaalsContact O-CB 3.25Å; F413-N417 WeakPolarHBondContact O-CB 3.46Å; F413-N417 PolarHBondContact O-N 2.99Å; N417-C419 PolarHBondContact O-N 3.42Å
418	E	64.9	Low	79.9	Confident	171 Å²	171	51.7 Å²	51.7	80%	0.799	24%	0.244	S	C	*	.			trans	-95.2	15.7	-163	-60.6	-170.5	171.1	0	0	113.9	Q420	E418-Q420 PolarHBondContact O-N 3.44Å
419	C	76	Confident	79.9	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.02	24%	0.242	C	C	.	.			trans	-64	99.1	175.3	-170.1	0	0	0	0	110.7	L384 Y416 N417 C421 L422 R427	L384-C419 HydrophobicContact CD2-CB 3.59Å; Y416-C419 HydrophobicContact CD1-CB 4.45Å; Y416-C419 HydrophobicContact CE1-CB 3.61Å; N417-C419 PolarHBondContact O-N 3.42Å; C419-C421 PolarHBondContact O-N 3.11Å; C419-L422 HydrophobicContact CB-CB 4.21Å; C419-L422 WeakPolarHBondContact O-CB 3.2Å; C419-L422 PolarHBondContact O-N 3.16Å; C419-R427 PolarHBondContact O-NH2 2.67Å
420	Q	73.3	Confident	80	Confident	155 Å²	155	50.8 Å²	50.8	72%	0.724	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.3	175.8	-62.6	-176.7	-3.9	0	0	111.8	E418 L422 R423	E418-Q420 PolarHBondContact O-N 3.44Å; Q420-L422 VanDerWaalsContact C-N 3.28Å; Q420-L422 PolarHBondContact O-N 3.41Å; Q420-R423 WeakPolarHBondContact O-CD 3.47Å; Q420-R423 PolarHBondContact O-NE 2.59Å
421	C	78.4	Confident	80.2	Confident	15 Å²	15	52.7 Å²	52.7	10%	0.101	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-13	175.7	-47	0	0	0	0	113.7	C374 C382 C419 R423	C374-C421 VanDerWaalsContact CB-SG 3.54Å; C382-C421 HydrophobicContact CB-CB 3.41Å; C382-C421 VanDerWaalsContact CB-CB 3.41Å; C419-C421 PolarHBondContact O-N 3.11Å; C421-R423 PolarHBondContact O-N 3.19Å; C421-R423 VanDerWaalsContact O-N 3.14Å
422	L	83.8	Confident	80.6	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.026	25%	0.247	C	C	.	.	S	Bend	trans	-80.8	92.9	174.4	-173.1	68.6	0	0	0	109.1	F413 C419 Q420 R426 R427 I430	F413-L422 HydrophobicContact CE1-CD2 3.56Å; F413-L422 HydrophobicContact CZ-CD2 3.62Å; C419-L422 HydrophobicContact CB-CB 4.21Å; C419-L422 WeakPolarHBondContact O-CB 3.2Å; C419-L422 PolarHBondContact O-N 3.16Å; Q420-L422 VanDerWaalsContact C-N 3.28Å; Q420-L422 PolarHBondContact O-N 3.41Å; L422-R426 HydrophobicContact CD1-CB 3.81Å; L422-R427 HydrophobicContact CD2-CG 3.89Å; L422-R427 HydrophobicContact CG-CG 3.71Å; L422-R427 WeakPolarHBondContact O-CD 3.24Å; L422-R427 PolarHBondContact O-NE 3.3Å; L422-I430 HydrophobicContact CD1-CD1 3.82Å; L422-I430 HydrophobicContact CD2-CD1 4.21Å
423	R	82.2	Confident	80.8	Confident	54 Å²	54	54.3 Å²	54.3	20%	0.204	26%	0.256	C	S	.	.			trans	-86.8	167.6	-173.7	-57.9	-62.6	178	114.3	-6.4	113.3	Q420 C421 G425 R426 R427 D659 D741 N744	Q420-R423 WeakPolarHBondContact O-CD 3.47Å; Q420-R423 PolarHBondContact O-NE 2.59Å; C421-R423 PolarHBondContact O-N 3.19Å; C421-R423 VanDerWaalsContact O-N 3.14Å; R423-G425 PolarHBondContact O-N 3.26Å; R423-R426 PolarHBondContact O-N 3.21Å; R423-R427 PolarHBondContact O-N 2.67Å; R423-D659 IonicContact CZ-OD1 2.89Å; R423-D659 IonicContact NH1-OD1 3.75Å; R423-D659 IonicContact NH2-OD1 3.33Å; R423-D659 PolarHBondContact NH2-OD1 3.15Å; R423-D659 IonicContact NH2-OD2 3.75Å; R423-D659 PolarHBondContact NH2-OD2 3.41Å; R423-D741 VanDerWaalsContact CD-OD2 3.26Å; R423-D741 WeakPolarHBondContact CD-OD2 3.48Å; R423-D741 WeakPolarHBondContact CG-OD2 3.49Å; R423-D741 IonicContact CZ-OD2 2.64Å; R423-D741 IonicContact NE-OD2 3.66Å; R423-D741 VanDerWaalsContact NH1-CB 3.29Å; R423-D741 IonicContact NH1-OD1 2.77Å; R423-D741 IonicContact NH1-OD2 3.31Å; R423-D741 PolarHBondContact NH1-OD2 2.72Å; R423-N744 HydrophobicContact CB-CB 4.28Å; R423-N744 HydrophobicContact CG-CB 4.49Å; R423-N744 WeakPolarHBondContact CG-ND2 3.19Å
424	A	79.9	Confident	81.2	Confident	30 Å²	30	53.9 Å²	53.9	25%	0.248	25%	0.254	C	S	.	.	H	α-helix	trans	-52	-50.4	-164.3	0	0	0	0	0	114.4	R426 R427 L428 W745 M780	A424-R426 VanDerWaalsContact C-N 3.27Å; A424-R426 PolarHBondContact O-N 3.41Å; A424-R427 WeakPolarHBondContact O-CB 3.45Å; A424-R427 PolarHBondContact O-N 3.02Å; A424-R427 VanDerWaalsContact O-N 3.12Å; A424-L428 PolarHBondContact O-N 3.37Å; A424-W745 HydrophobicContact CB-CZ2 4.4Å; A424-M780 HydrophobicContact CB-CE 3.64Å; A424-M780 HydrophobicContact CB-CG 4.11Å; A424-M780 HydrophobicContact CB-SD 3.97Å
425	G	83.1	Confident	81.7	Confident	5 Å²	5	51.2 Å²	51.2	5%	0.052	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-31.1	180	0	0	0	0	0	114	R423 M429 T776	R423-G425 PolarHBondContact O-N 3.26Å; G425-M429 WeakPolarHBondContact O-CB 3.06Å; G425-M429 PolarHBondContact O-N 2.97Å; G425-M429 VanDerWaalsContact O-N 3.13Å; G425-T776 WeakPolarHBondContact O-CB 3.35Å; G425-T776 PolarHBondContact O-OG1 3.07Å
426	R	86.7	Confident	82.5	Confident	108 Å²	108	51.9 Å²	51.9	41%	0.408	24%	0.243	S	C	.	.	H	α-helix	trans	-79.1	-36.1	174.5	-65.5	-64	-178.1	-147.6	-4.2	112.1	L422 R423 A424 L428 M429 I430	L422-R426 HydrophobicContact CD1-CB 3.81Å; R423-R426 PolarHBondContact O-N 3.21Å; A424-R426 VanDerWaalsContact C-N 3.27Å; A424-R426 PolarHBondContact O-N 3.41Å; R426-L428 VanDerWaalsContact C-N 3.34Å; R426-M429 VanDerWaalsContact CD-CE 3.43Å; R426-M429 PolarHBondContact NH1-SD 3.16Å; R426-M429 PolarHBondContact O-N 3.29Å; R426-I430 WeakPolarHBondContact O-CG1 3.33Å; R426-I430 PolarHBondContact O-N 3.47Å
427	R	87.4	Confident	83.4	Confident	58 Å²	58	51.2 Å²	51.2	22%	0.219	24%	0.241	C	C	.	.	H	α-helix	trans	-58.9	-47.4	171.4	-72.5	-174.6	176.1	-103.7	-5.9	110.7	C419 L422 R423 A424 I430 H431 L540 V541	C419-R427 PolarHBondContact O-NH2 2.67Å; L422-R427 HydrophobicContact CD2-CG 3.89Å; L422-R427 HydrophobicContact CG-CG 3.71Å; L422-R427 WeakPolarHBondContact O-CD 3.24Å; L422-R427 PolarHBondContact O-NE 3.3Å; R423-R427 PolarHBondContact O-N 2.67Å; A424-R427 WeakPolarHBondContact O-CB 3.45Å; A424-R427 PolarHBondContact O-N 3.02Å; A424-R427 VanDerWaalsContact O-N 3.12Å; R427-I430 PolarHBondContact O-N 3.3Å; R427-H431 WeakPolarHBondContact O-CB 3.3Å; R427-H431 PolarHBondContact O-N 3.26Å; R427-L540 HydrophobicContact CB-CB 4.13Å; R427-L540 WeakPolarHBondContact CD-O 3.43Å; R427-V541 HydrophobicContact CB-CG2 4.03Å
428	L	89.5	Confident	84.1	Confident	8 Å²	8	48.3 Å²	48.3	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-60.4	-48.3	176.5	-178.1	54.6	0	0	0	111.6	A424 R426 I430 H431 E432 V541 I544 T776 I779 M780	A424-L428 PolarHBondContact O-N 3.37Å; R426-L428 VanDerWaalsContact C-N 3.34Å; L428-I430 VanDerWaalsContact C-N 3.33Å; L428-I430 PolarHBondContact O-N 2.94Å; L428-H431 WeakPolarHBondContact O-CB 3.26Å; L428-H431 PolarHBondContact O-N 2.76Å; L428-H431 VanDerWaalsContact O-N 3.11Å; L428-E432 HydrophobicContact CD1-CG 4.03Å; L428-E432 HydrophobicContact CG-CG 4.39Å; L428-E432 WeakPolarHBondContact O-CG 3.25Å; L428-E432 PolarHBondContact O-N 3.07Å; L428-V541 HydrophobicContact CB-CG2 3.91Å; L428-V541 HydrophobicContact CD1-CG2 4.21Å; L428-I544 HydrophobicContact CD1-CD1 3.67Å; L428-I544 HydrophobicContact CD2-CD1 3.84Å; L428-I544 HydrophobicContact CG-CD1 4.35Å; L428-T776 HydrophobicContact CD2-CG2 4.33Å; L428-T776 HydrophobicContact CG-CG2 4.14Å; L428-I779 HydrophobicContact CD2-CB 3.94Å; L428-I779 HydrophobicContact CD2-CD1 4.26Å; L428-I779 HydrophobicContact CD2-CG2 3.72Å; L428-M780 HydrophobicContact CB-SD 4.41Å; L428-M780 HydrophobicContact CD2-CG 4.43Å; L428-M780 HydrophobicContact CD2-SD 4.09Å
429	M	90.7	Very high	84.9	Confident	25 Å²	25	43.7 Å²	43.7	12%	0.123	21%	0.205	C	C	.	.	H	α-helix	trans	-56.3	-46	178.3	-174.3	-179.6	65.9	0	0	112.4	N389 G425 R426 Q433 T776	N389-M429 HydrophobicContact CB-CE 3.61Å; G425-M429 WeakPolarHBondContact O-CB 3.06Å; G425-M429 PolarHBondContact O-N 2.97Å; G425-M429 VanDerWaalsContact O-N 3.13Å; R426-M429 VanDerWaalsContact CD-CE 3.43Å; R426-M429 PolarHBondContact NH1-SD 3.16Å; R426-M429 PolarHBondContact O-N 3.29Å; M429-Q433 VanDerWaalsContact O-CG 3.24Å; M429-Q433 WeakPolarHBondContact O-CG 3.23Å; M429-Q433 PolarHBondContact O-N 3.19Å; M429-Q433 VanDerWaalsContact O-N 3.14Å; M429-T776 HydrophobicContact CB-CG2 3.95Å
430	I	90.5	Very high	84.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.8	-43.3	177	-67.3	168	0	0	0	110.8	L388 I392 V409 F413 L422 R426 R427 L428 Q433 L434 L540	L388-I430 HydrophobicContact CB-CD1 3.99Å; L388-I430 HydrophobicContact CB-CG1 4.49Å; L388-I430 HydrophobicContact CD1-CD1 4.06Å; I392-I430 HydrophobicContact CD1-CG2 4.01Å; V409-I430 HydrophobicContact CG1-CG2 4.38Å; F413-I430 HydrophobicContact CE2-CG2 3.93Å; F413-I430 HydrophobicContact CZ-CD1 4.3Å; F413-I430 HydrophobicContact CZ-CG2 4.33Å; L422-I430 HydrophobicContact CD1-CD1 3.82Å; L422-I430 HydrophobicContact CD2-CD1 4.21Å; R426-I430 WeakPolarHBondContact O-CG1 3.33Å; R426-I430 PolarHBondContact O-N 3.47Å; R427-I430 PolarHBondContact O-N 3.3Å; L428-I430 VanDerWaalsContact C-N 3.33Å; L428-I430 PolarHBondContact O-N 2.94Å; I430-Q433 PolarHBondContact O-N 2.72Å; I430-L434 HydrophobicContact CG2-CD1 3.91Å; I430-L434 HydrophobicContact CG2-CG 4.29Å; I430-L434 WeakPolarHBondContact O-CG 3.49Å; I430-L434 PolarHBondContact O-N 3.12Å; I430-L540 HydrophobicContact CB-CD1 4.09Å; I430-L540 HydrophobicContact CG2-CD1 3.71Å
431	H	88.9	Confident	84.8	Confident	42 Å²	42	38.7 Å²	38.7	19%	0.194	19%	0.193	C	C	.	.	H	α-helix	trans	-58.8	-49.4	179.1	-173.4	77.9	0	0	0	111.6	R427 L428 Q433 L434 M435 P538 L540	R427-H431 WeakPolarHBondContact O-CB 3.3Å; R427-H431 PolarHBondContact O-N 3.26Å; L428-H431 WeakPolarHBondContact O-CB 3.26Å; L428-H431 PolarHBondContact O-N 2.76Å; L428-H431 VanDerWaalsContact O-N 3.11Å; H431-Q433 VanDerWaalsContact C-N 3.33Å; H431-Q433 PolarHBondContact O-N 3.28Å; H431-L434 PolarHBondContact O-N 2.96Å; H431-M435 WeakPolarHBondContact O-CG 3.48Å; H431-M435 PolarHBondContact O-N 3.46Å; H431-P538 PolarHBondContact ND1-O 3.05Å; H431-L540 HydrophobicContact CB-CB 4.23Å; H431-L540 HydrophobicContact CB-CD1 4.35Å
432	E	89.5	Confident	84.6	Confident	61 Å²	61	42.8 Å²	42.8	29%	0.285	21%	0.209	S	C	.	.	H	α-helix	trans	-59.9	-41.1	177.1	-73.1	179	178.5	0	0	112.6	L428 M435 K436	L428-E432 HydrophobicContact CD1-CG 4.03Å; L428-E432 HydrophobicContact CG-CG 4.39Å; L428-E432 WeakPolarHBondContact O-CG 3.25Å; L428-E432 PolarHBondContact O-N 3.07Å; E432-M435 PolarHBondContact O-N 2.91Å; E432-K436 VanDerWaalsContact O-CG 3.3Å; E432-K436 WeakPolarHBondContact O-CG 3.43Å; E432-K436 PolarHBondContact O-N 3.36Å
433	Q	91	Very high	83.9	Confident	41 Å²	41	49.7 Å²	49.7	19%	0.192	24%	0.239	C	C	.	.	H	α-helix	trans	-68.6	-38	178.1	-67	-64	-31	0	0	112	N389 I392 M429 I430 H431 K436 L437	N389-Q433 WeakPolarHBondContact OD1-CG 3.04Å; I392-Q433 HydrophobicContact CD1-CB 4.29Å; I392-Q433 HydrophobicContact CG2-CB 3.73Å; M429-Q433 VanDerWaalsContact O-CG 3.24Å; M429-Q433 WeakPolarHBondContact O-CG 3.23Å; M429-Q433 PolarHBondContact O-N 3.19Å; M429-Q433 VanDerWaalsContact O-N 3.14Å; I430-Q433 PolarHBondContact O-N 2.72Å; H431-Q433 VanDerWaalsContact C-N 3.33Å; H431-Q433 PolarHBondContact O-N 3.28Å; Q433-K436 PolarHBondContact O-N 3.37Å; Q433-L437 PolarHBondContact O-N 2.96Å
434	L	88.4	Confident	82.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.3	-41.9	173.6	-72.8	174.3	0	0	0	112	I392 F406 V409 I430 H431 L437 F438	I392-L434 HydrophobicContact CD1-CD2 4.01Å; I392-L434 HydrophobicContact CD1-CG 4.06Å; I392-L434 HydrophobicContact CG1-CD2 4.37Å; F406-L434 HydrophobicContact CD2-CD2 4.05Å; V409-L434 HydrophobicContact CB-CD2 4.05Å; V409-L434 HydrophobicContact CG1-CD1 3.97Å; V409-L434 HydrophobicContact CG1-CD2 4.01Å; V409-L434 HydrophobicContact CG1-CG 4.41Å; I430-L434 HydrophobicContact CG2-CD1 3.91Å; I430-L434 HydrophobicContact CG2-CG 4.29Å; I430-L434 WeakPolarHBondContact O-CG 3.49Å; I430-L434 PolarHBondContact O-N 3.12Å; H431-L434 PolarHBondContact O-N 2.96Å; L434-L437 PolarHBondContact O-N 3.35Å; L434-F438 WeakPolarHBondContact O-CB 3.33Å; L434-F438 PolarHBondContact O-N 3.09Å
435	M	87.1	Confident	81.9	Confident	66 Å²	66	51.4 Å²	51.4	33%	0.325	25%	0.254	S	S	.	.	H	α-helix	trans	-58.9	-46.7	174.1	-72.9	-62.6	-54.6	0	0	111.2	H431 E432 L437 F438 D439 I537	H431-M435 WeakPolarHBondContact O-CG 3.48Å; H431-M435 PolarHBondContact O-N 3.46Å; E432-M435 PolarHBondContact O-N 2.91Å; M435-L437 PolarHBondContact O-N 3.08Å; M435-F438 PolarHBondContact O-N 3.34Å; M435-D439 PolarHBondContact O-N 3.32Å; M435-I537 HydrophobicContact CE-CD1 4.27Å; M435-I537 HydrophobicContact CG-CD1 4.39Å; M435-I537 HydrophobicContact SD-CD1 3.18Å; M435-I537 WeakPolarHBondContact SD-CD1 3.38Å; M435-I537 HydrophobicContact SD-CG1 4.42Å; M435-I537 HydrophobicContact SD-CG2 4.27Å
436	K	87.6	Confident	80.5	Confident	126 Å²	126	56 Å²	56	55%	0.548	28%	0.277	S	S	.	.	H	α-helix	trans	-58.7	-44.3	176.9	-74.7	170.3	-175.2	171.3	0	112.4	E432 Q433 G440	E432-K436 VanDerWaalsContact O-CG 3.3Å; E432-K436 WeakPolarHBondContact O-CG 3.43Å; E432-K436 PolarHBondContact O-N 3.36Å; Q433-K436 PolarHBondContact O-N 3.37Å; K436-G440 PolarHBondContact O-N 2.86Å; K436-G440 VanDerWaalsContact O-N 3.11Å
437	L	85.4	Confident	78.7	Confident	13 Å²	13	56.2 Å²	56.2	7%	0.068	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-45.5	175.4	-73.7	-173.8	0	0	0	111.5	I392 P402 A405 Q433 L434 M435 G440 V441	I392-L437 HydrophobicContact CG2-CD1 3.58Å; I392-L437 HydrophobicContact CG2-CG 4.09Å; P402-L437 HydrophobicContact CB-CD2 3.84Å; A405-L437 HydrophobicContact CB-CD1 3.81Å; Q433-L437 PolarHBondContact O-N 2.96Å; L434-L437 PolarHBondContact O-N 3.35Å; M435-L437 PolarHBondContact O-N 3.08Å; L437-G440 PolarHBondContact O-N 2.98Å; L437-V441 WeakPolarHBondContact O-CG2 3.36Å; L437-V441 PolarHBondContact O-N 2.79Å
438	F	82.8	Confident	76.8	Confident	28 Å²	28	59.6 Å²	59.6	12%	0.123	30%	0.304	C	S	.	.	H	α-helix	trans	-61.8	-45.6	-178.7	-179	-99	0	0	0	112.5	F406 L434 M435 G440 V441 K442 L534 I537	F406-F438 HydrophobicContact CD2-CB 4.45Å; F406-F438 HydrophobicContact CE2-CB 4.04Å; F406-F438 AromaticContact CE2-CD2 3.98Å; F406-F438 HydrophobicContact CE2-CD2 3.98Å; F406-F438 HydrophobicContact CE2-CG 4.44Å; F406-F438 AromaticContact CZ-CD2 3.9Å; F406-F438 HydrophobicContact CZ-CD2 3.9Å; L434-F438 WeakPolarHBondContact O-CB 3.33Å; L434-F438 PolarHBondContact O-N 3.09Å; M435-F438 PolarHBondContact O-N 3.34Å; F438-G440 VanDerWaalsContact C-N 3.28Å; F438-G440 PolarHBondContact O-N 2.97Å; F438-V441 PolarHBondContact O-N 3.27Å; F438-K442 HydrophobicContact CD1-CD 4.2Å; F438-K442 HydrophobicContact CE1-CD 3.64Å; F438-K442 HydrophobicContact CE1-CG 4.33Å; F438-K442 VanDerWaalsContact CE1-NZ 3.34Å; F438-K442 HydrophobicContact CZ-CD 4.05Å; F438-K442 PolarHBondContact O-N 2.87Å; F438-L534 HydrophobicContact CD2-CB 4.36Å; F438-L534 HydrophobicContact CD2-CD2 4.02Å; F438-L534 HydrophobicContact CE2-CB 3.73Å; F438-L534 HydrophobicContact CE2-CD1 4.17Å; F438-L534 HydrophobicContact CE2-CD2 4.22Å; F438-L534 HydrophobicContact CE2-CG 4.26Å; F438-I537 HydrophobicContact CB-CD1 3.88Å; F438-I537 HydrophobicContact CD1-CD1 3.9Å; F438-I537 HydrophobicContact CD2-CD1 4.16Å; F438-I537 HydrophobicContact CD2-CG1 4.44Å; F438-I537 HydrophobicContact CE1-CD1 4.38Å; F438-I537 HydrophobicContact CG-CD1 3.75Å; F438-I537 HydrophobicContact CG-CG1 4.49Å
439	D	81.5	Confident	74.7	Confident	75 Å²	75	67.6 Å²	67.6	40%	0.401	33%	0.334	S	S	.	.	H	α-helix	trans	-63.8	-36.7	176.1	-72.6	-18.4	0	0	0	111.7	M435 K443	M435-D439 PolarHBondContact O-N 3.32Å; D439-K443 WeakPolarHBondContact O-CB 3.04Å; D439-K443 WeakPolarHBondContact O-CG 3.33Å; D439-K443 PolarHBondContact O-N 2.92Å
440	G	76.4	Confident	72.4	Confident	42 Å²	42	70.4 Å²	70.4	43%	0.433	36%	0.356	S	S	.	.	H	α-helix	trans	-61.4	-45.3	172.9	0	0	0	0	0	112.6	K436 L437 F438 K443 G444	K436-G440 PolarHBondContact O-N 2.86Å; K436-G440 VanDerWaalsContact O-N 3.11Å; L437-G440 PolarHBondContact O-N 2.98Å; F438-G440 VanDerWaalsContact C-N 3.28Å; F438-G440 PolarHBondContact O-N 2.97Å; G440-K443 PolarHBondContact O-N 3.01Å; G440-G444 PolarHBondContact O-N 3.45Å; G440-G444 VanDerWaalsContact O-N 3.08Å
441	V	70.7	Confident	70.2	Confident	10 Å²	10	73.7 Å²	73.7	6%	0.061	38%	0.379	C	S	.	.	H	α-helix	trans	-63.5	-47.5	177.5	173.7	0	0	0	0	111	P402 I403 L437 F438 K443 G444 E445 L534	P402-V441 HydrophobicContact CB-CG2 3.78Å; P402-V441 HydrophobicContact CG-CG2 3.88Å; I403-V441 HydrophobicContact CD1-CG1 4.22Å; I403-V441 HydrophobicContact CG1-CG1 3.92Å; I403-V441 HydrophobicContact CG1-CG2 3.79Å; L437-V441 WeakPolarHBondContact O-CG2 3.36Å; L437-V441 PolarHBondContact O-N 2.79Å; F438-V441 PolarHBondContact O-N 3.27Å; V441-K443 VanDerWaalsContact C-N 3.35Å; V441-K443 PolarHBondContact O-N 3.3Å; V441-G444 PolarHBondContact O-N 2.99Å; V441-G444 VanDerWaalsContact O-N 3.09Å; V441-E445 HydrophobicContact CG1-CG 4.47Å; V441-E445 PolarHBondContact O-N 3.36Å; V441-L534 HydrophobicContact CG1-CD1 4.07Å
442	K	73.8	Confident	67.9	Low	102 Å²	102	78.9 Å²	78.9	44%	0.443	40%	0.403	S	S	.	.	H	α-helix	trans	-59.4	-41.8	177.6	-83.2	-170.5	168.9	177.9	0	113.1	F438 G444 E445 N446	F438-K442 HydrophobicContact CD1-CD 4.2Å; F438-K442 HydrophobicContact CE1-CD 3.64Å; F438-K442 HydrophobicContact CE1-CG 4.33Å; F438-K442 VanDerWaalsContact CE1-NZ 3.34Å; F438-K442 HydrophobicContact CZ-CD 4.05Å; F438-K442 PolarHBondContact O-N 2.87Å; K442-G444 VanDerWaalsContact C-N 3.32Å; K442-E445 PolarHBondContact O-N 3.43Å; K442-N446 PolarHBondContact O-N 3.43Å; K442-N446 VanDerWaalsContact O-N 3.08Å
443	K	69.5	Low	65.5	Low	149 Å²	149	82.9 Å²	82.9	65%	0.648	43%	0.427	S	S	*	.	H	α-helix	trans	-63.9	-38.1	175.7	-74.6	176.8	-178.5	178.7	0	111.6	D439 G440 V441 N447	D439-K443 WeakPolarHBondContact O-CB 3.04Å; D439-K443 WeakPolarHBondContact O-CG 3.33Å; D439-K443 PolarHBondContact O-N 2.92Å; G440-K443 PolarHBondContact O-N 3.01Å; V441-K443 VanDerWaalsContact C-N 3.35Å; V441-K443 PolarHBondContact O-N 3.3Å; K443-N447 VanDerWaalsContact O-CG 3.3Å; K443-N447 PolarHBondContact O-N 3.25Å; K443-N447 VanDerWaalsContact O-N 3.16Å; K443-N447 PolarHBondContact O-ND2 2.69Å
444	G	60.4	Low	62.7	Low	35 Å²	35	83.3 Å²	83.3	36%	0.361	44%	0.442	S	S	.	.	H	α-helix	trans	-65.2	-44.7	175.2	0	0	0	0	0	113.6	G440 V441 K442 N447 H448	G440-G444 PolarHBondContact O-N 3.45Å; G440-G444 VanDerWaalsContact O-N 3.08Å; V441-G444 PolarHBondContact O-N 2.99Å; V441-G444 VanDerWaalsContact O-N 3.09Å; K442-G444 VanDerWaalsContact C-N 3.32Å; G444-N447 PolarHBondContact O-N 3.01Å; G444-H448 PolarHBondContact O-N 3.19Å
445	E	59.6	Low	59.8	Low	86 Å²	86	93.4 Å²	93.4	40%	0.402	48%	0.482	S	S	.	.	H	α-helix	trans	-66.2	-38.9	178.4	-73.4	178	175.8	0	0	112.6	V441 K442 H448 R449	V441-E445 HydrophobicContact CG1-CG 4.47Å; V441-E445 PolarHBondContact O-N 3.36Å; K442-E445 PolarHBondContact O-N 3.43Å; E445-H448 PolarHBondContact O-N 3.32Å; E445-R449 PolarHBondContact O-N 3.32Å
446	N	52.9	Low	57.1	Low	102 Å²	102	96.3 Å²	96.3	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-66.4	-38.2	175.5	-76.7	-18.2	0	0	0	112.2	K442 R449 S450	K442-N446 PolarHBondContact O-N 3.43Å; K442-N446 VanDerWaalsContact O-N 3.08Å; N446-R449 PolarHBondContact O-N 3.11Å; N446-S450 PolarHBondContact O-N 3.13Å
447	N	49.3	Very low	54.5	Low	111 Å²	111	96.4 Å²	96.4	59%	0.594	52%	0.515	S	S	*	.	H	α-helix	trans	-66.3	-39	174.1	-73.3	-11.4	0	0	0	111.3	K443 G444 S450 S451	K443-N447 VanDerWaalsContact O-CG 3.3Å; K443-N447 PolarHBondContact O-N 3.25Å; K443-N447 VanDerWaalsContact O-N 3.16Å; K443-N447 PolarHBondContact O-ND2 2.69Å; G444-N447 PolarHBondContact O-N 3.01Å; N447-S450 PolarHBondContact O-N 3.06Å; N447-S450 PolarHBondContact O-OG 3.5Å; N447-S451 PolarHBondContact O-N 3.39Å; N447-S451 VanDerWaalsContact O-N 3.09Å
448	H	47.1	Very low	51.6	Low	129 Å²	129	100.7 Å²	100.7	60%	0.597	55%	0.552	S	S	*	*	H	α-helix	trans	-66.4	-40.7	174.7	-95.1	-43.1	0	0	0	113.4	G444 E445 S450 S451 Q452	G444-H448 PolarHBondContact O-N 3.19Å; E445-H448 PolarHBondContact O-N 3.32Å; H448-S450 VanDerWaalsContact C-N 3.32Å; H448-S450 PolarHBondContact O-N 3.07Å; H448-S451 WeakPolarHBondContact CA-OG 3.16Å; H448-S451 PolarHBondContact O-N 2.88Å; H448-S451 VanDerWaalsContact O-N 3.15Å; H448-S451 PolarHBondContact O-OG 2.94Å; H448-Q452 PolarHBondContact O-N 2.83Å
449	R	44.8	Very low	49	Very low	176 Å²	176	103.7 Å²	103.7	66%	0.664	58%	0.582	S	S	*	*	H	α-helix	trans	-62.8	-35.4	173.2	-78.4	-178.9	175.6	176.1	-0.1	112.8	E445 N446 S451 N453	E445-R449 PolarHBondContact O-N 3.32Å; N446-R449 PolarHBondContact O-N 3.11Å; R449-S451 VanDerWaalsContact C-N 3.34Å; R449-N453 PolarHBondContact O-N 2.79Å
450	S	42.8	Very low	46.6	Very low	84 Å²	84	106.1 Å²	106.1	59%	0.587	60%	0.6	S	S	*	*	H	α-helix	trans	-69.4	-30.1	174.2	73.8	0	0	0	0	113.3	N446 N447 H448	N446-S450 PolarHBondContact O-N 3.13Å; N447-S450 PolarHBondContact O-N 3.06Å; N447-S450 PolarHBondContact O-OG 3.5Å; H448-S450 VanDerWaalsContact C-N 3.32Å; H448-S450 PolarHBondContact O-N 3.07Å
451	S	44.4	Very low	44.2	Very low	69 Å²	69	109.7 Å²	109.7	48%	0.483	61%	0.613	S	S	.	*	H	α-helix	trans	-80.2	-26	176.2	68.5	0	0	0	0	114	N447 H448 R449	N447-S451 PolarHBondContact O-N 3.39Å; N447-S451 VanDerWaalsContact O-N 3.09Å; H448-S451 WeakPolarHBondContact CA-OG 3.16Å; H448-S451 PolarHBondContact O-N 2.88Å; H448-S451 VanDerWaalsContact O-N 3.15Å; H448-S451 PolarHBondContact O-OG 2.94Å; R449-S451 VanDerWaalsContact C-N 3.34Å
452	Q	41.5	Very low	42.3	Very low	151 Å²	151	114.6 Å²	114.6	71%	0.706	64%	0.643	S	S	*	*	H	α-helix	trans	-86.4	-17.5	178.7	-76.8	-175.6	-26.6	0	0	113.9	H448 G454	H448-Q452 PolarHBondContact O-N 2.83Å; Q452-G454 PolarHBondContact O-N 2.99Å
453	N	38.6	Very low	40.2	Very low	146 Å²	146	116.5 Å²	116.5	78%	0.781	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	14.5	170.1	-79.5	-8.1	0	0	0	113.7	R449	R449-N453 PolarHBondContact O-N 2.79Å
454	G	31.2	Very low	38.2	Very low	50 Å²	50	116.5 Å²	116.5	52%	0.515	67%	0.665	S	S	.	*			trans	-94.1	22.8	-179.6	0	0	0	0	0	115.6	Q452	Q452-G454 PolarHBondContact O-N 2.99Å
455	Y	27.7	Very low	36.7	Very low	212 Å²	212	120.9 Å²	120.9	83%	0.831	69%	0.685	S	S	*	*			trans	-142.5	74.9	174.9	-73.2	-78.2	0	0	0	111.8
456	T	32.1	Very low	35.4	Very low	127 Å²	127	122.3 Å²	122.3	78%	0.779	70%	0.7	S	S	*	*	S	Bend	trans	-150.8	101.4	155.2	-30.2	0	0	0	0	110.3
457	T	31.2	Very low	34.2	Very low	128 Å²	128	124.2 Å²	124.2	79%	0.785	71%	0.71	S	S	*	*			trans	40.8	105.1	148.9	54.4	0	0	0	0	121.4
458	A	25.8	Very low	33.3	Very low	102 Å²	102	126 Å²	126	84%	0.843	72%	0.719	S	S	*	*				20.7	136.4	129.3	0	0	0	0	0	123.5
459	A	27.2	Very low	32.5	Very low	91 Å²	91	129.3 Å²	129.3	75%	0.752	73%	0.732	S	S	*	*			trans	78.8	117.6	147.8	0	0	0	0	0	116.5
460	T	30.7	Very low	32.1	Very low	127 Å²	127	126 Å²	126	78%	0.779	73%	0.733	S	S	*	*				-175.3	141.9	60	-51.3	0	0	0	0	109.8
461	T	26.3	Very low	31.4	Very low	117 Å²	117	126.6 Å²	126.6	72%	0.718	74%	0.738	S	S	*	*			trans	-25.4	149.7	157.8	-1.6	0	0	0	0	116.4
462	T	30.6	Very low	30.7	Very low	112 Å²	112	131.2 Å²	131.2	69%	0.687	76%	0.757	S	S	*	*			cis	-175.1	147.1	45.4	14.8	0	0	0	0	111.7
463	N	30.9	Very low	30	Very low	142 Å²	142	127.8 Å²	127.8	76%	0.759	75%	0.754	S	S	*	*			trans	61.1	105	138.7	-60.4	-12.3	0	0	0	124.2
464	N	26.2	Very low	29.7	Very low	150 Å²	150	128 Å²	128	80%	0.802	76%	0.755	S	S	*	*				19	138.7	125	-63.7	-17.1	0	0	0	121.3
465	V	30.1	Very low	29.6	Very low	127 Å²	127	132.2 Å²	132.2	77%	0.77	77%	0.766	S	S	*	*				177.8	116.9	106	158	0	0	0	0	112.3
466	T	31.6	Very low	29.9	Very low	116 Å²	116	131.4 Å²	131.4	71%	0.712	77%	0.767	S	S	*	*			trans	42.6	117.6	144.6	68.2	0	0	0	0	125.4
467	N	27.1	Very low	29.7	Very low	142 Å²	142	132.2 Å²	132.2	76%	0.759	77%	0.766	S	S	*	*				35.6	124.5	121.2	-67.3	-14.9	0	0	0	122.3
468	N	30.7	Very low	29.7	Very low	149 Å²	149	134 Å²	134	80%	0.797	77%	0.771	S	S	*	*				-179.8	119	104.6	-93.8	-25.5	0	0	0	115
469	K	31.4	Very low	29.9	Very low	197 Å²	197	133.4 Å²	133.4	86%	0.857	77%	0.766	S	S	*	*				58	162.1	126.7	-96.9	-165.3	176.3	179	0	122.9
470	P	36.4	Very low	30	Very low	106 Å²	106	134 Å²	134	69%	0.688	77%	0.765	S	S	*	*				-131.7	-169.1	-124.1	40.3	-18.5	0	0	0	116.6
471	S	26.9	Very low	29.9	Very low	98 Å²	98	135.1 Å²	135.1	69%	0.685	77%	0.766	S	S	*	*			trans	75.7	118.3	156.8	62.8	0	0	0	0	120.9
472	N	29.5	Very low	30.1	Very low	165 Å²	165	141.6 Å²	141.6	88%	0.882	78%	0.777	S	S	*	*				-171.1	160.5	108.8	-99	-14.5	0	0	0	113.6
473	A	27.1	Very low	29.9	Very low	79 Å²	79	144.2 Å²	144.2	65%	0.653	79%	0.787	S	S	*	*			trans	-75	162.4	-168	0	0	0	0	0	115.8
474	D	32	Very low	29.8	Very low	151 Å²	151	141.3 Å²	141.3	81%	0.807	79%	0.791	S	S	*	*				176.3	120.4	122	-88.2	-15.1	0	0	0	112.7
475	D	30.3	Very low	29.7	Very low	139 Å²	139	141.5 Å²	141.5	74%	0.743	79%	0.79	S	S	*	*				48.6	114.7	124.7	-91.4	7.6	0	0	0	122.9
476	K	33.4	Very low	29.7	Very low	195 Å²	195	144.9 Å²	144.9	85%	0.848	79%	0.794	S	S	*	*				162.7	141.1	104	-96.8	166.7	-172.6	175.6	0	116
477	N	27.8	Very low	29.3	Very low	143 Å²	143	146.5 Å²	146.5	77%	0.765	80%	0.799	S	S	*	*			trans	-42.2	148.3	170.3	-62.6	-39.6	0	0	0	118.5
478	N	31	Very low	29.5	Very low	166 Å²	166	146.1 Å²	146.1	89%	0.888	80%	0.802	S	S	*	*				-178.2	151.1	108	-96.2	-20.7	0	0	0	115.4
479	A	29.5	Very low	29.1	Very low	90 Å²	90	145.2 Å²	145.2	74%	0.744	80%	0.802	S	S	*	*			trans	-60.1	173	-179.2	0	0	0	0	0	114.8
480	S	31.2	Very low	29	Very low	102 Å²	102	141.1 Å²	141.1	71%	0.713	80%	0.798	S	S	*	*			cis	179.5	154.6	41.4	40.1	0	0	0	0	110.6
481	D	27.4	Very low	28.4	Very low	152 Å²	152	144.9 Å²	144.9	81%	0.813	81%	0.807	S	S	*	*			trans	36.3	132.4	146.2	-64	-23.1	0	0	0	123.8
482	R	31.2	Very low	28.4	Very low	252 Å²	252	146.5 Å²	146.5	95%	0.951	81%	0.812	S	S	*	*				-175.2	140.2	111.9	-99.7	171.7	-171.6	-172.6	3.8	115.1
483	N	25.7	Very low	28.3	Very low	168 Å²	168	147.8 Å²	147.8	90%	0.898	81%	0.81	S	S	*	*			trans	-58.5	156.3	174	-76.8	-41.6	0	0	0	116.1
484	G	28.4	Very low	28	Very low	81 Å²	81	156 Å²	156	84%	0.835	82%	0.824	S	S	*	*			trans	-166.2	100.4	165.2	0	0	0	0	0	114.2
485	I	25	Very low	27.8	Very low	153 Å²	153	159.9 Å²	159.9	79%	0.785	83%	0.827	S	S	*	*			trans	-63.2	150.4	177.9	-66	155.5	0	0	0	113.1
486	K	30.3	Very low	27.5	Very low	198 Å²	198	162.9 Å²	162.9	86%	0.861	83%	0.834	S	S	*	*			trans	-171.2	117.7	132.4	-101.9	162	-169	-175.3	0	115.1
487	N	23.8	Very low	27.2	Very low	151 Å²	151	161.5 Å²	161.5	81%	0.807	83%	0.834	S	S	*	*			trans	-65.4	141.1	155.3	-79	-29	0	0	0	110.7
488	T	29.9	Very low	27	Very low	134 Å²	134	162.7 Å²	162.7	82%	0.822	84%	0.835	S	S	*	*			trans	-144.7	111.9	152.2	34	0	0	0	0	112
489	T	22.7	Very low	26.8	Very low	130 Å²	130	163.9 Å²	163.9	80%	0.798	83%	0.832	S	S	*	*			trans	-55.8	137.3	157	-37.4	0	0	0	0	110.3
490	S	30.1	Very low	26.8	Very low	111 Å²	111	165.2 Å²	165.2	78%	0.776	83%	0.833	S	S	*	*			trans	-151.1	104.8	162.7	-72.1	0	0	0	0	111.3
491	Q	22.4	Very low	26.6	Very low	185 Å²	185	166.7 Å²	166.7	86%	0.864	84%	0.837	S	S	*	*			trans	-67.4	132.4	160.3	-68.2	173.8	-22.3	0	0	109.7
492	V	27	Very low	26.5	Very low	131 Å²	131	166.8 Å²	166.8	79%	0.794	84%	0.838	S	S	*	*			trans	-139.5	99.7	158.1	-175.4	0	0	0	0	111.6
493	K	27.8	Very low	26.4	Very low	192 Å²	192	162.3 Å²	162.3	84%	0.835	83%	0.831	S	S	*	*			trans	38.9	107.3	134.9	-67.6	177	177.3	173.5	0	119.9
494	R	21.9	Very low	26.4	Very low	252 Å²	252	163.1 Å²	163.1	95%	0.951	83%	0.829	S	S	*	*			trans	-57.1	133.7	146.6	-74.7	175.3	169.4	162.2	-3.9	110.8
495	R	27.4	Very low	26.4	Very low	232 Å²	232	162.9 Å²	162.9	88%	0.875	83%	0.827	S	S	*	*			trans	-124.3	117.9	159.2	-93.8	-175.9	172.8	171.5	-2.3	109.9
496	K	23	Very low	26.4	Very low	203 Å²	203	164.6 Å²	164.6	88%	0.883	83%	0.829	S	S	*	*			trans	-75.8	137.9	156.3	-78.9	178.2	171.1	-179.3	0	108.2
497	I	27.5	Very low	26.1	Very low	166 Å²	166	160.5 Å²	160.5	85%	0.851	82%	0.816	S	S	*	*			trans	-132.2	127	147.7	-63.3	-177.3	0	0	0	108.1
498	Q	24	Very low	26.2	Very low	167 Å²	167	162.2 Å²	162.2	78%	0.78	81%	0.813	S	S	*	*			trans	-107.3	131.6	173.4	-138.3	179.5	20.6	0	0	105.3
499	K	27.7	Very low	26	Very low	192 Å²	192	163.2 Å²	163.2	84%	0.835	81%	0.808	S	S	*	*				166.3	152.2	118.1	-93.4	-175.5	178.9	-177.7	0	113.6
500	P	28.5	Very low	26.1	Very low	117 Å²	117	163 Å²	163	76%	0.76	80%	0.802	S	S	*	*			trans	-97	165.4	-169.7	39.7	-33.2	0	0	0	112.7
501	V	28	Very low	25.9	Very low	134 Å²	134	163.8 Å²	163.8	81%	0.812	80%	0.798	S	S	*	*			trans	-135.7	120.2	162.6	178.7	0	0	0	0	110.2	I503	V501-I503 HydrophobicContact CG1-CG1 4.32Å
502	N	24	Very low	26	Very low	153 Å²	153	161.9 Å²	161.9	82%	0.818	79%	0.793	S	S	*	*			trans	-78.7	138.5	163.9	-101.7	-21.1	0	0	0	109.6
503	I	30.4	Very low	25.9	Very low	159 Å²	159	163.1 Å²	163.1	82%	0.815	80%	0.795	S	S	*	*			trans	-136.9	125	149.8	-60.8	-177	0	0	0	108.8	V501	V501-I503 HydrophobicContact CG1-CG1 4.32Å
504	H	25.1	Very low	25.9	Very low	184 Å²	184	158.9 Å²	158.9	85%	0.852	79%	0.79	S	S	*	*			trans	-78.2	148.1	170.6	-97.6	6.8	0	0	0	111.7
505	G	28.3	Very low	26.2	Very low	77 Å²	77	154.1 Å²	154.1	79%	0.794	79%	0.789	S	S	*	*			trans	178.6	95.7	164.4	0	0	0	0	0	113.7
506	K	24.3	Very low	26.1	Very low	188 Å²	188	152 Å²	152	82%	0.817	79%	0.789	S	S	*	*			trans	-32.3	150.6	155.5	-81.6	-178.4	176.6	-172.7	0	113.9
507	D	24.9	Very low	26.3	Very low	112 Å²	112	145.7 Å²	145.7	60%	0.599	78%	0.782	S	S	*	*			cis	179.1	160	36.9	-111.9	-12.9	0	0	0	110.6
508	Y	26.4	Very low	26.2	Very low	187 Å²	187	145.6 Å²	145.6	73%	0.733	78%	0.781	S	S	*	*			trans	73.4	111.8	155.2	-63.5	-66.3	0	0	0	125.8
509	E	24.7	Very low	26.5	Very low	156 Å²	156	141.2 Å²	141.2	73%	0.729	77%	0.768	S	S	*	*				31.5	117.5	125.7	-67.1	-178.9	172.9	0	0	121.8
510	N	26.1	Very low	26.5	Very low	125 Å²	125	143.6 Å²	143.6	67%	0.668	77%	0.772	S	S	*	*				157.5	132.1	90.8	-106.7	-29.1	0	0	0	113.7
511	N	25.1	Very low	26.6	Very low	128 Å²	128	142.2 Å²	142.2	68%	0.684	76%	0.762	S	S	*	*			trans	65.6	120.5	144.9	-66.5	-25.1	0	0	0	124.3
512	N	24.1	Very low	26.6	Very low	144 Å²	144	142.6 Å²	142.6	77%	0.77	76%	0.759	S	S	*	*			trans	80.8	135.9	134.9	-67	-11.2	0	0	0	121
513	D	25.2	Very low	26.8	Very low	157 Å²	157	142.9 Å²	142.9	84%	0.84	76%	0.755	S	S	*	*			trans	70.6	89.8	168.9	-69.6	-18.8	0	0	0	118.3
514	S	27.4	Very low	27.1	Very low	103 Å²	103	142.1 Å²	142.1	72%	0.72	75%	0.746	S	S	*	*			trans	177.7	97.6	135.2	35.5	0	0	0	0	111.3	E516	S514-E516 PolarHBondContact O-N 3.25Å
515	T	27.7	Very low	27.3	Very low	153 Å²	153	142 Å²	142	94%	0.939	74%	0.743	S	S	*	*			trans	-78.4	61.2	155.1	47.3	0	0	0	0	109.4
516	E	26.8	Very low	27.4	Very low	188 Å²	188	143.6 Å²	143.6	88%	0.879	73%	0.733	S	S	*	*			trans	-120.9	78.9	164.3	-94.8	-171.2	159.7	0	0	106.4	S514	S514-E516 PolarHBondContact O-N 3.25Å
517	G	25.9	Very low	27.6	Very low	70 Å²	70	141 Å²	141	72%	0.722	73%	0.728	S	S	*	*			trans	-167.7	25	-169.4	0	0	0	0	0	116.1
518	I	27	Very low	27.8	Very low	164 Å²	164	141.3 Å²	141.3	84%	0.841	74%	0.739	S	S	*	*	S	Bend	trans	-141.2	85.4	168.4	-54	179.7	0	0	0	108.8
519	C	29.5	Very low	27.9	Very low	74 Å²	74	139.9 Å²	139.9	50%	0.5	74%	0.739	S	S	.	*			trans	151.2	73.9	158.6	-88.9	0	0	0	0	106.3	T521	C519-T521 PolarHBondContact O-N 2.94Å
520	R	26.7	Very low	28.1	Very low	242 Å²	242	141.7 Å²	141.7	91%	0.913	74%	0.744	S	S	*	*			trans	-62.1	96.7	154.9	-77.6	-175.6	179.4	172.4	0.4	105.5	N522	R520-N522 PolarHBondContact O-N 3.26Å
521	T	30.6	Very low	28.7	Very low	89 Å²	89	145.6 Å²	145.6	55%	0.546	76%	0.759	S	S	.	*			trans	-49.8	113.3	152.4	44.3	0	0	0	0	104.7	C519 E523	C519-T521 PolarHBondContact O-N 2.94Å; T521-E523 PolarHBondContact O-N 3.14Å
522	N	28.1	Very low	29.3	Very low	141 Å²	141	147.3 Å²	147.3	75%	0.754	76%	0.762	S	S	*	*			trans	-59	96.8	166.6	-80.1	-22.1	0	0	0	105.3	R520 F524	R520-N522 PolarHBondContact O-N 3.26Å; N522-F524 VanDerWaalsContact C-N 3.31Å; N522-F524 PolarHBondContact O-N 2.86Å
523	E	29.6	Very low	30.2	Very low	160 Å²	160	145.3 Å²	145.3	75%	0.748	76%	0.76	S	S	*	*			trans	-56.6	104.8	166.1	-78.6	-175.7	152.1	0	0	105.2	T521 F525	T521-E523 PolarHBondContact O-N 3.14Å; E523-F525 VanDerWaalsContact C-N 3.31Å; E523-F525 PolarHBondContact O-N 3.41Å
524	F	35.7	Very low	31.4	Very low	142 Å²	142	140.3 Å²	140.3	62%	0.623	73%	0.733	S	S	*	*			trans	-61.9	102.1	168.8	-88.3	-90.6	0	0	0	106.4	N522 I526	N522-F524 VanDerWaalsContact C-N 3.31Å; N522-F524 PolarHBondContact O-N 2.86Å; F524-I526 PolarHBondContact O-N 3.43Å
525	F	28.8	Very low	32.8	Very low	181 Å²	181	137.7 Å²	137.7	79%	0.794	71%	0.713	S	S	*	*			trans	-56.9	98.3	152.8	-94.3	-93.6	0	0	0	106.3	E523 D527	E523-F525 VanDerWaalsContact C-N 3.31Å; E523-F525 PolarHBondContact O-N 3.41Å; F525-D527 PolarHBondContact O-N 3.27Å; F525-D527 VanDerWaalsContact O-N 3.08Å
526	I	31.9	Very low	34.7	Very low	112 Å²	112	134.8 Å²	134.8	57%	0.574	70%	0.704	S	S	*	*			trans	-69.4	97.8	158.3	-61.3	176.4	0	0	0	103.4	F524 S528	F524-I526 PolarHBondContact O-N 3.43Å; I526-S528 PolarHBondContact O-N 3.17Å
527	D	28.7	Very low	36.7	Very low	132 Å²	132	127.5 Å²	127.5	71%	0.706	67%	0.671	S	S	*	*			trans	-49.8	117.6	167.8	-91.7	-30.8	0	0	0	107.8	F525 E529	F525-D527 PolarHBondContact O-N 3.27Å; F525-D527 VanDerWaalsContact O-N 3.08Å; D527-E529 PolarHBondContact O-N 2.81Å
528	S	28.7	Very low	38.8	Very low	119 Å²	119	125.5 Å²	125.5	83%	0.832	65%	0.645	S	S	*	*			trans	-74.4	66.9	172.3	57.5	0	0	0	0	108.4	I526	I526-S528 PolarHBondContact O-N 3.17Å
529	E	28.1	Very low	41.1	Very low	158 Å²	158	121.7 Å²	121.7	74%	0.738	63%	0.633	S	S	*	*			trans	-128.5	106.1	171	-73.3	-157.2	161.4	0	0	110.6	D527	D527-E529 PolarHBondContact O-N 2.81Å
530	K	29.6	Very low	43.4	Very low	193 Å²	193	118.7 Å²	118.7	84%	0.839	61%	0.612	S	S	*	*			trans	68.8	137.1	164.3	-63.6	177.4	179.9	172.9	0	116.7	E532	K530-E532 PolarHBondContact O-N 3.35Å
531	E	36.9	Very low	45.7	Very low	208 Å²	208	108.6 Å²	108.6	97%	0.972	58%	0.577	S	S	*	*			trans	-58.2	73	163.3	-72.9	175.5	132.3	0	0	109.9	S533	E531-S533 PolarHBondContact O-N 3Å
532	E	38.1	Very low	47.6	Very low	163 Å²	163	110.1 Å²	110.1	76%	0.762	58%	0.581	S	S	*	*			trans	-72.4	116.2	161.3	-83.5	-170.4	158.4	0	0	107.6	K530 L534	K530-E532 PolarHBondContact O-N 3.35Å; E532-L534 PolarHBondContact O-N 3.28Å
533	S	43.7	Very low	50.1	Low	102 Å²	102	110.3 Å²	110.3	71%	0.713	58%	0.582	S	S	*	*			trans	-33.4	130.9	172	57.1	0	0	0	0	111.6	E531 T535	E531-S533 PolarHBondContact O-N 3Å; S533-T535 PolarHBondContact O-N 2.89Å
534	L	51.3	Low	52.9	Low	52 Å²	52	105.3 Å²	105.3	27%	0.272	56%	0.56	S	S	.	*			trans	-37.9	108.1	172.7	-79.8	134.9	0	0	0	110.2	F406 F438 V441 E532	F406-L534 HydrophobicContact CD1-CD2 3.68Å; F406-L534 HydrophobicContact CE1-CD2 3.68Å; F406-L534 HydrophobicContact CG-CD2 4.36Å; F406-L534 HydrophobicContact CZ-CD2 4.35Å; F438-L534 HydrophobicContact CD2-CB 4.36Å; F438-L534 HydrophobicContact CD2-CD2 4.02Å; F438-L534 HydrophobicContact CE2-CB 3.73Å; F438-L534 HydrophobicContact CE2-CD1 4.17Å; F438-L534 HydrophobicContact CE2-CD2 4.22Å; F438-L534 HydrophobicContact CE2-CG 4.26Å; V441-L534 HydrophobicContact CG1-CD1 4.07Å; E532-L534 PolarHBondContact O-N 3.28Å
535	T	55.5	Low	55.5	Low	49 Å²	49	103.7 Å²	103.7	30%	0.301	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-57.5	144.5	-177.1	50.2	0	0	0	0	110.4	K414 S533 I537	K414-T535 PolarHBondContact NZ-OG1 3.4Å; K414-T535 VanDerWaalsContact NZ-OG1 3.11Å; S533-T535 PolarHBondContact O-N 2.89Å; T535-I537 PolarHBondContact O-N 3.44Å
536	A	66.9	Low	58.4	Low	92 Å²	92	101.5 Å²	101.5	76%	0.76	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-47.3	135.2	-177.8	0	0	0	0	0	112
537	I	70.5	Confident	61.5	Low	34 Å²	34	96.6 Å²	96.6	17%	0.174	52%	0.52	C	S	.	.	P	Polyproline II helix	trans	-61.1	127.3	178.2	-63.2	175.1	0	0	0	107.7	F406 M435 F438 T535 S539	F406-I537 HydrophobicContact CE2-CD1 4.4Å; F406-I537 HydrophobicContact CE2-CG1 3.9Å; F406-I537 HydrophobicContact CZ-CG1 3.87Å; M435-I537 HydrophobicContact CE-CD1 4.27Å; M435-I537 HydrophobicContact CG-CD1 4.39Å; M435-I537 HydrophobicContact SD-CD1 3.18Å; M435-I537 WeakPolarHBondContact SD-CD1 3.38Å; M435-I537 HydrophobicContact SD-CG1 4.42Å; M435-I537 HydrophobicContact SD-CG2 4.27Å; F438-I537 HydrophobicContact CB-CD1 3.88Å; F438-I537 HydrophobicContact CD1-CD1 3.9Å; F438-I537 HydrophobicContact CD2-CD1 4.16Å; F438-I537 HydrophobicContact CD2-CG1 4.44Å; F438-I537 HydrophobicContact CE1-CD1 4.38Å; F438-I537 HydrophobicContact CG-CD1 3.75Å; F438-I537 HydrophobicContact CG-CG1 4.49Å; T535-I537 PolarHBondContact O-N 3.44Å; I537-S539 PolarHBondContact O-N 3.43Å; I537-S539 VanDerWaalsContact O-N 3.1Å
538	P	69	Low	64.7	Low	29 Å²	29	94.2 Å²	94.2	19%	0.188	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-53.5	123	175.8	-24.3	32.3	0	0	0	109.3	T410 F413 H431 L540	T410-P538 HydrophobicContact CG2-CG 4.28Å; F413-P538 HydrophobicContact CB-CG 4.2Å; H431-P538 PolarHBondContact ND1-O 3.05Å; P538-L540 HydrophobicContact CB-CD2 3.89Å; P538-L540 HydrophobicContact CB-CG 4.04Å; P538-L540 PolarHBondContact O-N 3.33Å
539	S	75.5	Confident	68	Low	84 Å²	84	94 Å²	94	59%	0.587	50%	0.496	S	S	*	.			trans	-71.2	86.9	171.2	-177.4	0	0	0	0	107.5	I537 V541 I542	I537-S539 PolarHBondContact O-N 3.43Å; I537-S539 VanDerWaalsContact O-N 3.1Å; S539-V541 VanDerWaalsContact C-N 3.35Å; S539-V541 PolarHBondContact OG-O 3.48Å; S539-I542 WeakPolarHBondContact OG-CG1 3.31Å
540	L	77.5	Confident	71.2	Confident	11 Å²	11	88.8 Å²	88.8	6%	0.058	47%	0.474	C	S	.	.			trans	-83.4	-18.6	-179.7	-61.8	178.3	0	0	0	111.7	F413 R427 I430 H431 P538	F413-L540 HydrophobicContact CD1-CD2 3.93Å; F413-L540 HydrophobicContact CD2-CD2 4.45Å; F413-L540 HydrophobicContact CE1-CD2 3.77Å; F413-L540 HydrophobicContact CE2-CD1 3.92Å; F413-L540 HydrophobicContact CE2-CD2 4.32Å; F413-L540 HydrophobicContact CG-CD2 4.28Å; F413-L540 HydrophobicContact CZ-CD1 3.91Å; F413-L540 HydrophobicContact CZ-CD2 3.97Å; R427-L540 HydrophobicContact CB-CB 4.13Å; R427-L540 WeakPolarHBondContact CD-O 3.43Å; I430-L540 HydrophobicContact CB-CD1 4.09Å; I430-L540 HydrophobicContact CG2-CD1 3.71Å; H431-L540 HydrophobicContact CB-CB 4.23Å; H431-L540 HydrophobicContact CB-CD1 4.35Å; P538-L540 HydrophobicContact CB-CD2 3.89Å; P538-L540 HydrophobicContact CB-CG 4.04Å; P538-L540 PolarHBondContact O-N 3.33Å
541	V	75.2	Confident	74.4	Confident	30 Å²	30	86.6 Å²	86.6	18%	0.182	47%	0.467	C	S	.	.	S	Bend	trans	-140.8	142	176.4	-163.2	0	0	0	0	108.7	R427 L428 S539 I544 M780	R427-V541 HydrophobicContact CB-CG2 4.03Å; L428-V541 HydrophobicContact CB-CG2 3.91Å; L428-V541 HydrophobicContact CD1-CG2 4.21Å; S539-V541 VanDerWaalsContact C-N 3.35Å; S539-V541 PolarHBondContact OG-O 3.48Å; V541-I544 HydrophobicContact CG1-CD1 3.76Å; V541-I544 HydrophobicContact CG1-CG1 3.65Å; V541-M780 HydrophobicContact CG1-SD 4.5Å
542	I	70.6	Confident	77.1	Confident	121 Å²	121	77.5 Å²	77.5	62%	0.621	43%	0.425	S	S	*	.			trans	-127.3	127.4	-176.1	-58.7	170.5	0	0	0	108.1	S539	S539-I542 WeakPolarHBondContact OG-CG1 3.31Å
543	N	80.7	Confident	79.7	Confident	145 Å²	145	73.2 Å²	73.2	78%	0.775	41%	0.41	S	S	*	.			trans	53.4	58.7	166.8	-60.1	-20.5	0	0	0	116.2	K545	N543-K545 PolarHBondContact O-N 3.24Å
544	I	88.1	Confident	82	Confident	55 Å²	55	68.3 Å²	68.3	28%	0.282	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-67.7	127.1	170.9	-55.8	178.3	0	0	0	109.4	L428 V541 I779 D783	L428-I544 HydrophobicContact CD1-CD1 3.67Å; L428-I544 HydrophobicContact CD2-CD1 3.84Å; L428-I544 HydrophobicContact CG-CD1 4.35Å; V541-I544 HydrophobicContact CG1-CD1 3.76Å; V541-I544 HydrophobicContact CG1-CG1 3.65Å; I544-I779 HydrophobicContact CD1-CG2 4.18Å; I544-I779 HydrophobicContact CG2-CG2 3.7Å; I544-D783 HydrophobicContact CG2-CB 3.93Å
545	K	91.6	Very high	83.9	Confident	107 Å²	107	66.9 Å²	66.9	47%	0.465	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-85.8	131.3	170.8	-61.5	-170.1	-176.5	177.4	0	110.4	N543 D783 V786 Q787	N543-K545 PolarHBondContact O-N 3.24Å; K545-D783 WeakPolarHBondContact CB-OD1 3.25Å; K545-D783 PolarHBondContact N-OD1 2.69Å; K545-V786 HydrophobicContact CB-CB 4.24Å; K545-V786 HydrophobicContact CB-CG1 3.83Å; K545-V786 HydrophobicContact CD-CG1 3.88Å; K545-Q787 HydrophobicContact CD-CG 3.76Å; K545-Q787 HydrophobicContact CG-CG 4.38Å
546	E	89.6	Confident	85.5	Confident	136 Å²	136	65 Å²	65	64%	0.636	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-99.7	136.5	173.5	-74.7	-169.4	-157.4	0	0	111.1	K549	E546-K549 IonicContact OE2-NZ 3.79Å; E546-K549 PolarHBondContact OE2-NZ 3.07Å
547	P	95.3	Very high	86.1	Confident	9 Å²	9	65.6 Å²	65.6	6%	0.058	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-75.1	162.8	170.9	34.5	-37.7	0	0	0	111.5	L782 V786 V792 I794	P547-L782 HydrophobicContact CG-CB 4.13Å; P547-L782 HydrophobicContact CG-CD1 4Å; P547-L782 HydrophobicContact CG-CD2 4.17Å; P547-L782 HydrophobicContact CG-CG 4.32Å; P547-V786 HydrophobicContact CB-CG2 3.87Å; P547-V792 HydrophobicContact CB-CG1 4.02Å; P547-V792 HydrophobicContact CB-CG2 4.46Å; P547-V792 WeakPolarHBondContact CB-O 3.34Å; P547-I794 HydrophobicContact CG-CD1 3.68Å; P547-I794 HydrophobicContact CG-CG1 3.83Å
548	P	97.1	Very high	86.4	Confident	81 Å²	81	65.1 Å²	65.1	53%	0.526	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-59.3	150.1	172.5	25.9	-35.3	0	0	0	112.2	V792 E793 I794	P548-V792 WeakPolarHBondContact CD-O 3.36Å; P548-E793 HydrophobicContact CG-CB 4.1Å; P548-E793 WeakPolarHBondContact O-CA 3.33Å; P548-I794 PolarHBondContact O-N 3.06Å
549	K	97.1	Very high	86.5	Confident	115 Å²	115	65.6 Å²	65.6	50%	0.5	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	132.6	174.6	-68.6	166.3	-170.7	156.9	0	108.8	E546 I794 L796	E546-K549 IonicContact OE2-NZ 3.79Å; E546-K549 PolarHBondContact OE2-NZ 3.07Å; K549-I794 WeakPolarHBondContact CA-O 3.45Å; K549-I794 HydrophobicContact CG-CB 4.02Å; K549-I794 HydrophobicContact CG-CD1 3.98Å; K549-I794 HydrophobicContact CG-CG2 4.44Å; K549-L796 HydrophobicContact CB-CD1 4.5Å
550	V	96.6	Very high	86.3	Confident	48 Å²	48	62.7 Å²	62.7	29%	0.291	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	141.6	172.1	-69	0	0	0	0	109.2	Y605 E793 I794 C795 L796	V550-Y605 WeakPolarHBondContact CG2-OH 3.2Å; V550-E793 HydrophobicContact CG2-CG 4.41Å; V550-E793 WeakPolarHBondContact CG2-OE1 3.47Å; V550-I794 PolarHBondContact N-O 2.84Å; V550-C795 HydrophobicContact CG2-CB 4.15Å; V550-L796 PolarHBondContact O-N 3.18Å
551	E	96	Very high	86.2	Confident	148 Å²	148	71.4 Å²	71.4	69%	0.692	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	126	179.2	-168.2	172.4	-169.7	0	0	109.5	L796	E551-L796 WeakPolarHBondContact CA-O 3.45Å; E551-L796 HydrophobicContact CG-CB 4.38Å
552	I	94.1	Very high	86.1	Confident	16 Å²	16	76.9 Å²	76.9	8%	0.082	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	140.1	-179.5	-64.8	157.7	0	0	0	108.3	W600 Y604 Y605 L796 I797 S798	I552-W600 HydrophobicContact CG2-CH2 3.8Å; I552-W600 HydrophobicContact CG2-CZ3 3.75Å; I552-Y604 HydrophobicContact CD1-CD1 3.63Å; I552-Y604 HydrophobicContact CD1-CE1 3.25Å; I552-Y604 HydrophobicContact CG1-CE1 3.93Å; I552-Y604 HydrophobicContact CG2-CD2 4.13Å; I552-Y604 HydrophobicContact CG2-CE1 4.34Å; I552-Y604 HydrophobicContact CG2-CE2 3.92Å; I552-Y604 HydrophobicContact CG2-CG 4.42Å; I552-Y605 HydrophobicContact CD1-CE2 4.13Å; I552-L796 PolarHBondContact N-O 3.48Å; I552-I797 HydrophobicContact CB-CD1 3.87Å; I552-I797 HydrophobicContact CG2-CD1 4.22Å; I552-I797 WeakPolarHBondContact O-CA 3.24Å; I552-S798 PolarHBondContact O-N 3.17Å; I552-S798 PolarHBondContact O-OG 2.97Å
553	T	92.7	Very high	86.2	Confident	73 Å²	73	74.7 Å²	74.7	45%	0.448	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.9	175.1	-55.6	0	0	0	0	109.9	S798 E800	T553-S798 WeakPolarHBondContact CA-O 3.41Å; T553-S798 WeakPolarHBondContact CA-OG 3.48Å; T553-S798 PolarHBondContact OG1-OG 3.37Å; T553-E800 HydrophobicContact CG2-CB 3.45Å; T553-E800 VanDerWaalsContact CG2-CB 3.45Å; T553-E800 HydrophobicContact CG2-CG 4.44Å
554	A	91.7	Very high	85.9	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	134.1	-178.3	0	0	0	0	0	111.1	Y570 W600 I797 S798 E800	A554-Y570 HydrophobicContact CB-CD1 3.37Å; A554-Y570 HydrophobicContact CB-CE1 3.73Å; A554-Y570 HydrophobicContact CB-CG 4.41Å; A554-W600 HydrophobicContact CB-CD2 3.76Å; A554-W600 HydrophobicContact CB-CE3 3.75Å; A554-W600 HydrophobicContact CB-CH2 3.61Å; A554-W600 HydrophobicContact CB-CZ2 3.59Å; A554-W600 HydrophobicContact CB-CZ3 3.68Å; A554-I797 HydrophobicContact CB-CG2 3.65Å; A554-S798 PolarHBondContact N-O 3.1Å; A554-E800 PolarHBondContact O-N 3.5Å
555	P	91	Very high	85.2	Confident	22 Å²	22	71.2 Å²	71.2	14%	0.143	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	138.2	178.2	-10.1	22.4	0	0	0	111.1	Y570 V571 E800 L802 L805	P555-Y570 CarbonylContact O-C 3.25Å; P555-Y570 WeakPolarHBondContact O-CA 3.39Å; P555-V571 HydrophobicContact CB-CB 4.32Å; P555-V571 PolarHBondContact O-N 3.07Å; P555-E800 CarbonylContact C-O 3.59Å; P555-E800 WeakPolarHBondContact CA-O 3.46Å; P555-L802 HydrophobicContact CB-CD1 3.72Å; P555-L805 HydrophobicContact CB-CD1 3.59Å; P555-L805 HydrophobicContact CG-CD1 3.85Å
556	I	88.2	Confident	84.3	Confident	9 Å²	9	75.5 Å²	75.5	5%	0.046	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	143.5	170.3	57.3	161.9	0	0	0	111	P568 Y570 A799 E800 L802	I556-P568 HydrophobicContact CG2-CB 4.07Å; I556-P568 HydrophobicContact CG2-CG 4.26Å; I556-Y570 HydrophobicContact CG2-CD1 3.49Å; I556-Y570 VanDerWaalsContact CG2-CD1 3.49Å; I556-Y570 HydrophobicContact CG2-CE1 3.61Å; I556-Y570 HydrophobicContact CG2-CG 4.09Å; I556-A799 HydrophobicContact CD1-CB 3.88Å; I556-A799 HydrophobicContact CG1-CB 4.16Å; I556-A799 HydrophobicContact CG2-CB 3.82Å; I556-E800 PolarHBondContact N-O 3.02Å; I556-L802 PolarHBondContact O-N 3.49Å
557	N	80.9	Confident	83.7	Confident	105 Å²	105	75.2 Å²	75.2	56%	0.561	40%	0.4	S	S	*	.	S	Bend	trans	-71.3	-45.7	175	-176.8	6.7	0	0	0	110.7	V571 L594	N557-V571 HydrophobicContact CB-CG2 3.71Å; N557-L594 HydrophobicContact CB-CD2 3.95Å
558	A	75.8	Confident	83.1	Confident	23 Å²	23	75.8 Å²	75.8	19%	0.19	40%	0.403	C	S	.	.	S	Bend	trans	-149.6	155	178.1	0	0	0	0	0	109.4	E562 I563	A558-E562 HydrophobicContact CB-CB 4.17Å; A558-I563 HydrophobicContact CB-CD1 4.06Å; A558-I563 HydrophobicContact CB-CG1 3.65Å
559	S	72.3	Confident	82.7	Confident	40 Å²	40	75.6 Å²	75.6	28%	0.28	40%	0.395	S	S	.	.			trans	-70.1	154.6	175.8	66.4	0	0	0	0	111.5	K561 E562 I563	S559-K561 PolarHBondContact O-N 3.39Å; S559-K561 VanDerWaalsContact O-N 3.1Å; S559-E562 WeakPolarHBondContact CB-OE2 3.41Å; S559-E562 PolarHBondContact N-OE2 3.02Å; S559-E562 PolarHBondContact O-N 3.33Å; S559-E562 VanDerWaalsContact OG-CD 3.24Å; S559-E562 VanDerWaalsContact OG-CG 3.26Å; S559-E562 WeakPolarHBondContact OG-CG 3.45Å; S559-E562 PolarHBondContact OG-N 2.87Å; S559-E562 PolarHBondContact OG-OE2 3.04Å; S559-I563 WeakPolarHBondContact O-CG1 3.37Å; S559-I563 PolarHBondContact O-N 3.26Å
560	A	71.1	Confident	82.4	Confident	22 Å²	22	70.3 Å²	70.3	18%	0.182	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-39.5	177.8	0	0	0	0	0	112.5	I563 G564 T565	A560-I563 PolarHBondContact O-N 3.05Å; A560-G564 PolarHBondContact O-N 2.92Å; A560-G564 VanDerWaalsContact O-N 3.15Å; A560-T565 CarbonylContact C-O 3.56Å; A560-T565 WeakPolarHBondContact CB-O 3.04Å; A560-T565 PolarHBondContact O-N 2.87Å; A560-T565 VanDerWaalsContact O-O 3.07Å
561	K	73.6	Confident	82.1	Confident	195 Å²	195	68.2 Å²	68.2	85%	0.848	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-39.2	178.1	-170.4	178.8	179.6	-176.9	0	113	S559 I563	S559-K561 PolarHBondContact O-N 3.39Å; S559-K561 VanDerWaalsContact O-N 3.1Å; K561-I563 VanDerWaalsContact C-N 3.33Å
562	E	73.5	Confident	81.8	Confident	144 Å²	144	63.2 Å²	63.2	67%	0.673	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-31.4	179.4	-74.6	164	147.6	0	0	112.3	A558 S559	A558-E562 HydrophobicContact CB-CB 4.17Å; S559-E562 WeakPolarHBondContact CB-OE2 3.41Å; S559-E562 PolarHBondContact N-OE2 3.02Å; S559-E562 PolarHBondContact O-N 3.33Å; S559-E562 VanDerWaalsContact OG-CD 3.24Å; S559-E562 VanDerWaalsContact OG-CG 3.26Å; S559-E562 WeakPolarHBondContact OG-CG 3.45Å; S559-E562 PolarHBondContact OG-N 2.87Å; S559-E562 PolarHBondContact OG-OE2 3.04Å
563	I	72.8	Confident	81.4	Confident	76 Å²	76	66.7 Å²	66.7	39%	0.39	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-2.5	-177.5	-32.7	152.6	0	0	0	111.8	A558 S559 A560 K561 T565	A558-I563 HydrophobicContact CB-CD1 4.06Å; A558-I563 HydrophobicContact CB-CG1 3.65Å; S559-I563 WeakPolarHBondContact O-CG1 3.37Å; S559-I563 PolarHBondContact O-N 3.26Å; A560-I563 PolarHBondContact O-N 3.05Å; K561-I563 VanDerWaalsContact C-N 3.33Å; I563-T565 HydrophobicContact CB-CG2 4.29Å; I563-T565 HydrophobicContact CG2-CG2 4.3Å; I563-T565 PolarHBondContact O-N 2.98Å
564	G	74	Confident	80.8	Confident	73 Å²	73	67.1 Å²	67.1	75%	0.753	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	28.3	-175.5	0	0	0	0	0	113.5	A560	A560-G564 PolarHBondContact O-N 2.92Å; A560-G564 VanDerWaalsContact O-N 3.15Å
565	T	73.9	Confident	79.5	Confident	53 Å²	53	74 Å²	74	33%	0.325	38%	0.383	S	S	.	.	S	Bend	trans	-114.4	162.5	-178.8	57	0	0	0	0	110.8	A560 I563 R567	A560-T565 CarbonylContact C-O 3.56Å; A560-T565 WeakPolarHBondContact CB-O 3.04Å; A560-T565 PolarHBondContact O-N 2.87Å; A560-T565 VanDerWaalsContact O-O 3.07Å; I563-T565 HydrophobicContact CB-CG2 4.29Å; I563-T565 HydrophobicContact CG2-CG2 4.3Å; I563-T565 PolarHBondContact O-N 2.98Å; T565-R567 PolarHBondContact OG1-O 3.47Å
566	H	73.2	Confident	77.2	Confident	198 Å²	198	78.9 Å²	78.9	92%	0.917	41%	0.412	S	S	*	.	S	Bend	trans	-77.1	-25.7	176.9	-75.2	-65.9	0	0	0	113.5
567	R	77.8	Confident	74.7	Confident	129 Å²	129	82.9 Å²	82.9	49%	0.487	44%	0.441	S	S	.	.	S	Bend	trans	-136.2	139.5	-178.6	-68.1	-175.6	173.3	-170.7	-2.1	109.4	T565 E598 D772	T565-R567 PolarHBondContact OG1-O 3.47Å; R567-E598 IonicContact NH1-OE1 2.94Å; R567-E598 PolarHBondContact NH1-OE1 3.07Å; R567-D772 IonicContact CZ-OD2 3.52Å; R567-D772 IonicContact NH2-OD2 3.19Å; R567-D772 PolarHBondContact NH2-OD2 3.37Å
568	P	82.6	Confident	72.4	Confident	21 Å²	21	83.8 Å²	83.8	14%	0.136	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-70.2	160.4	177.8	31.7	-32.6	0	0	0	110.9	I556 Y570	I556-P568 HydrophobicContact CG2-CB 4.07Å; I556-P568 HydrophobicContact CG2-CG 4.26Å; P568-Y570 HydrophobicContact CG-CE2 3.9Å
569	H	87.8	Confident	70.2	Confident	78 Å²	78	90 Å²	90	36%	0.361	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-95.2	134.6	166.6	-68.9	80.7	0	0	0	109.7	L594	H569-L594 HydrophobicContact CB-CB 4.3Å; H569-L594 HydrophobicContact CB-CD2 3.96Å
570	Y	91	Very high	68.3	Low	3 Å²	3	97.2 Å²	97.2	1%	0.012	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	140	-177.3	-65.8	-93.6	0	0	0	110.1	A554 P555 I556 P568 L594 L595 V597 P770 I797 A799	A554-Y570 HydrophobicContact CB-CD1 3.37Å; A554-Y570 HydrophobicContact CB-CE1 3.73Å; A554-Y570 HydrophobicContact CB-CG 4.41Å; P555-Y570 CarbonylContact O-C 3.25Å; P555-Y570 WeakPolarHBondContact O-CA 3.39Å; I556-Y570 HydrophobicContact CG2-CD1 3.49Å; I556-Y570 VanDerWaalsContact CG2-CD1 3.49Å; I556-Y570 HydrophobicContact CG2-CE1 3.61Å; I556-Y570 HydrophobicContact CG2-CG 4.09Å; P568-Y570 HydrophobicContact CG-CE2 3.9Å; Y570-L594 WeakPolarHBondContact O-CA 3.4Å; Y570-L595 PolarHBondContact N-O 3.45Å; Y570-L595 PolarHBondContact O-N 2.81Å; Y570-V597 HydrophobicContact CD2-CB 3.94Å; Y570-V597 HydrophobicContact CD2-CG2 4.35Å; Y570-V597 HydrophobicContact CE2-CB 3.49Å; Y570-V597 VanDerWaalsContact CE2-CB 3.49Å; Y570-V597 HydrophobicContact CE2-CG2 3.77Å; Y570-P770 VanDerWaalsContact OH-CD 3.26Å; Y570-P770 WeakPolarHBondContact OH-CD 3.47Å; Y570-I797 HydrophobicContact CD1-CG2 4.4Å; Y570-I797 HydrophobicContact CE1-CG2 3.59Å; Y570-A799 HydrophobicContact CE1-CB 4.24Å
571	V	90.4	Very high	66.1	Low	5 Å²	5	104.2 Å²	104.2	3%	0.03	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	128.5	-177.1	-179.7	0	0	0	0	109.3	P555 N557 F573 T592 L593 L594 W600 L802	P555-V571 HydrophobicContact CB-CB 4.32Å; P555-V571 PolarHBondContact O-N 3.07Å; N557-V571 HydrophobicContact CB-CG2 3.71Å; V571-F573 HydrophobicContact CG1-CE1 4Å; V571-F573 HydrophobicContact CG1-CE2 4.11Å; V571-F573 HydrophobicContact CG1-CZ 3.76Å; V571-T592 HydrophobicContact CG1-CG2 3.46Å; V571-T592 VanDerWaalsContact CG1-CG2 3.46Å; V571-L593 WeakPolarHBondContact CA-O 3.48Å; V571-L594 HydrophobicContact CG2-CD2 3.81Å; V571-W600 PolarHBondContact O-NE1 3.32Å; V571-L802 HydrophobicContact CB-CD1 3.62Å; V571-L802 HydrophobicContact CG1-CD1 3.86Å; V571-L802 HydrophobicContact CG2-CD1 3.65Å
572	W	89.6	Confident	64	Low	43 Å²	43	103.3 Å²	103.3	16%	0.163	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.7	172.5	-176.1	-90.4	0	0	0	109.8	T592 L593 L595 W600 R603 A607	W572-T592 WeakPolarHBondContact O-CA 3.41Å; W572-L593 HydrophobicContact CB-CB 4.38Å; W572-L593 PolarHBondContact N-O 3.45Å; W572-L593 PolarHBondContact O-N 3.33Å; W572-L595 HydrophobicContact CB-CD1 3.71Å; W572-L595 HydrophobicContact CG-CD1 4.26Å; W572-W600 AromaticContact CE3-CD1 3.88Å; W572-W600 HydrophobicContact CE3-CD2 4.38Å; W572-W600 AromaticContact CE3-CE2 3.91Å; W572-W600 HydrophobicContact CE3-CG 4.34Å; W572-W600 HydrophobicContact CE3-CZ2 4.44Å; W572-W600 AromaticContact CE3-NE1 3.62Å; W572-W600 HydrophobicContact CZ3-CZ2 4.35Å; W572-R603 HydrophobicContact CD2-CB 4Å; W572-R603 HydrophobicContact CE3-CB 3.99Å; W572-R603 VanDerWaalsContact CH2-C 3.49Å; W572-R603 HydrophobicContact CH2-CB 3.78Å; W572-R603 WeakPolarHBondContact CH2-O 3.4Å; W572-R603 HydrophobicContact CZ2-CB 3.77Å; W572-R603 HydrophobicContact CZ3-CB 3.89Å; W572-A607 HydrophobicContact CH2-CB 4.02Å; W572-A607 HydrophobicContact CZ2-CB 4.16Å
573	F	86.6	Confident	61.9	Low	88 Å²	88	105 Å²	105	39%	0.386	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	112.8	174.2	-57	-76.7	0	0	0	108.3	V571 N575 T592 L802	V571-F573 HydrophobicContact CG1-CE1 4Å; V571-F573 HydrophobicContact CG1-CE2 4.11Å; V571-F573 HydrophobicContact CG1-CZ 3.76Å; F573-N575 PolarHBondContact O-N 3.23Å; F573-N575 VanDerWaalsContact O-N 3.08Å; F573-T592 HydrophobicContact CD1-CG2 4.31Å; F573-T592 HydrophobicContact CE1-CG2 4.17Å; F573-L802 HydrophobicContact CZ-CD1 4.3Å; F573-L802 HydrophobicContact CZ-CD2 4.19Å; F573-L802 HydrophobicContact CZ-CG 4.49Å
574	E	79.6	Confident	60	Low	82 Å²	82	110.2 Å²	110.2	38%	0.383	57%	0.572	S	S	.	*			trans	-69.7	105.2	170	-82.5	-179.5	167.2	0	0	109.2	T576 N591 L593	E574-T576 PolarHBondContact O-N 3.27Å; E574-N591 HydrophobicContact CB-CB 4.38Å; E574-N591 PolarHBondContact N-O 3.29Å; E574-N591 VanDerWaalsContact N-O 3.12Å; E574-N591 WeakPolarHBondContact OE2-CB 3.2Å; E574-L593 HydrophobicContact CG-CD1 4.34Å
575	N	64.1	Low	57.8	Low	145 Å²	145	113.9 Å²	113.9	78%	0.775	57%	0.569	S	S	*	*			trans	-78.3	112.3	160.5	-75.1	-12.4	0	0	0	107.1	F573 S577	F573-N575 PolarHBondContact O-N 3.23Å; F573-N575 VanDerWaalsContact O-N 3.08Å; N575-S577 PolarHBondContact O-N 3.11Å
576	T	41.8	Very low	55.8	Low	124 Å²	124	116 Å²	116	76%	0.761	59%	0.586	S	S	*	*			trans	-54.1	127.9	162.6	34.6	0	0	0	0	108	E574	E574-T576 PolarHBondContact O-N 3.27Å
577	S	36.6	Very low	54	Low	93 Å²	93	112.9 Å²	112.9	65%	0.65	58%	0.583	S	S	*	*			trans	-47.3	153.5	-165	-52.6	0	0	0	0	115.1	N575 N579	N575-S577 PolarHBondContact O-N 3.11Å; S577-N579 PolarHBondContact O-N 2.67Å
578	P	31.4	Very low	52.2	Low	124 Å²	124	113.1 Å²	113.1	81%	0.805	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-1.2	176	-17.8	30.1	0	0	0	115.9
579	N	31.4	Very low	50.4	Low	154 Å²	154	120.9 Å²	120.9	82%	0.824	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	24	-172.4	-83.9	-8.6	0	0	0	115.2	S577	S577-N579 PolarHBondContact O-N 2.67Å
580	K	31.2	Very low	48.8	Very low	191 Å²	191	120.5 Å²	120.5	83%	0.83	63%	0.63	S	S	*	*			trans	-130.5	70.6	162.8	-75.5	-174.5	176.2	178.5	0	110.7	Q582	K580-Q582 PolarHBondContact O-N 3.13Å
581	L	26.1	Very low	48.1	Very low	170 Å²	170	125.5 Å²	125.5	89%	0.89	66%	0.657	S	S	*	*			trans	-67.5	84.7	150.9	-86.7	150.8	0	0	0	107.5
582	Q	28.9	Very low	47.7	Very low	176 Å²	176	128.9 Å²	128.9	82%	0.822	68%	0.678	S	S	*	*			trans	-119	116.3	151.2	-83.1	-175	-6.3	0	0	107.1	K580	K580-Q582 PolarHBondContact O-N 3.13Å
583	E	29.9	Very low	47.8	Very low	178 Å²	178	129.3 Å²	129.3	83%	0.832	68%	0.683	S	S	*	*	S	Bend	trans	-49.1	142.3	171.8	-64.6	170.2	152.2	0	0	110
584	H	31.9	Very low	47.9	Very low	186 Å²	186	129.6 Å²	129.6	86%	0.861	69%	0.688	S	S	*	*			trans	73.2	68.9	177	-65.3	-72.8	0	0	0	118.2
585	Q	29.1	Very low	48.5	Very low	151 Å²	151	126.2 Å²	126.2	71%	0.706	67%	0.673	S	S	*	*			trans	-136.3	131.2	140.5	-68.8	-168.6	-7.5	0	0	110.5
586	S	30.4	Very low	49.9	Very low	97 Å²	97	121.8 Å²	121.8	68%	0.678	65%	0.651	S	S	*	*			trans	-40.8	151.3	166.7	39.1	0	0	0	0	111.8	Q588	S586-Q588 VanDerWaalsContact C-N 3.31Å; S586-Q588 PolarHBondContact O-N 3.17Å
587	P	34.9	Very low	52.3	Low	132 Å²	132	116.2 Å²	116.2	86%	0.857	62%	0.617	S	S	*	*			trans	-58	96.5	-177.3	25.3	-32.8	0	0	0	109	E589	P587-E589 PolarHBondContact O-N 2.97Å
588	Q	40.6	Very low	55.1	Low	134 Å²	134	112.7 Å²	112.7	63%	0.626	59%	0.591	S	S	*	*			trans	-60.9	124.9	172.4	-87	176.6	-26.3	0	0	105.7	S586 S590	S586-Q588 VanDerWaalsContact C-N 3.31Å; S586-Q588 PolarHBondContact O-N 3.17Å; Q588-S590 PolarHBondContact O-N 3.46Å
589	E	44.5	Very low	58.2	Low	185 Å²	185	110.8 Å²	110.8	86%	0.864	57%	0.571	S	S	*	*			trans	-44.6	111	176.9	-69	178.9	151.9	0	0	108.5	P587 N591	P587-E589 PolarHBondContact O-N 2.97Å; E589-N591 PolarHBondContact O-N 3.38Å
590	S	55.6	Low	61.2	Low	69 Å²	69	104 Å²	104	48%	0.483	53%	0.534	S	S	.	.			trans	-60.9	110.8	176.8	37.6	0	0	0	0	107.5	Q588 T592	Q588-S590 PolarHBondContact O-N 3.46Å; S590-T592 PolarHBondContact O-N 2.92Å; S590-T592 PolarHBondContact O-OG1 2.99Å; S590-T592 VanDerWaalsContact O-OG1 3.07Å
591	N	75.1	Confident	64.3	Low	108 Å²	108	94.9 Å²	94.9	58%	0.578	49%	0.494	S	S	*	.			trans	-54.8	109.6	178.8	-97.1	-9.3	0	0	0	108.3	E574 E589	E574-N591 HydrophobicContact CB-CB 4.38Å; E574-N591 PolarHBondContact N-O 3.29Å; E574-N591 VanDerWaalsContact N-O 3.12Å; E574-N591 WeakPolarHBondContact OE2-CB 3.2Å; E589-N591 PolarHBondContact O-N 3.38Å
592	T	83.2	Confident	67.6	Low	77 Å²	77	87.4 Å²	87.4	47%	0.472	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	117.3	-178.6	-61.1	0	0	0	0	107.6	V571 W572 F573 S590	V571-T592 HydrophobicContact CG1-CG2 3.46Å; V571-T592 VanDerWaalsContact CG1-CG2 3.46Å; W572-T592 WeakPolarHBondContact O-CA 3.41Å; F573-T592 HydrophobicContact CD1-CG2 4.31Å; F573-T592 HydrophobicContact CE1-CG2 4.17Å; S590-T592 PolarHBondContact O-N 2.92Å; S590-T592 PolarHBondContact O-OG1 2.99Å; S590-T592 VanDerWaalsContact O-OG1 3.07Å
593	L	90	Very high	70.8	Confident	51 Å²	51	82.9 Å²	82.9	27%	0.267	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	141.7	179.7	-60.1	174.1	0	0	0	110.5	V571 W572 E574 L595	V571-L593 WeakPolarHBondContact CA-O 3.48Å; W572-L593 HydrophobicContact CB-CB 4.38Å; W572-L593 PolarHBondContact N-O 3.45Å; W572-L593 PolarHBondContact O-N 3.33Å; E574-L593 HydrophobicContact CG-CD1 4.34Å; L593-L595 HydrophobicContact CB-CD1 4.39Å; L593-L595 HydrophobicContact CB-CD2 4.07Å; L593-L595 HydrophobicContact CB-CG 4.02Å
594	L	90.5	Very high	73.9	Confident	94 Å²	94	76.9 Å²	76.9	49%	0.492	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	116.3	167.2	-74.9	166.2	0	0	0	108.6	N557 H569 Y570 V571	N557-L594 HydrophobicContact CB-CD2 3.95Å; H569-L594 HydrophobicContact CB-CB 4.3Å; H569-L594 HydrophobicContact CB-CD2 3.96Å; Y570-L594 WeakPolarHBondContact O-CA 3.4Å; V571-L594 HydrophobicContact CG2-CD2 3.81Å
595	L	91.9	Very high	77	Confident	12 Å²	12	68.1 Å²	68.1	6%	0.063	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	156.6	-169.5	-60.2	177.3	0	0	0	111.7	Y570 W572 L593 Q599 W600	Y570-L595 PolarHBondContact N-O 3.45Å; Y570-L595 PolarHBondContact O-N 2.81Å; W572-L595 HydrophobicContact CB-CD1 3.71Å; W572-L595 HydrophobicContact CG-CD1 4.26Å; L593-L595 HydrophobicContact CB-CD1 4.39Å; L593-L595 HydrophobicContact CB-CD2 4.07Å; L593-L595 HydrophobicContact CB-CG 4.02Å; L595-Q599 HydrophobicContact CB-CB 4Å; L595-Q599 HydrophobicContact CD2-CB 4.29Å; L595-W600 HydrophobicContact CB-CB 4.26Å; L595-W600 HydrophobicContact CD1-CB 4.45Å
596	T	92.4	Very high	80.2	Confident	52 Å²	52	64.2 Å²	64.2	32%	0.319	34%	0.343	S	S	.	.			trans	-66	163.1	161.7	57	0	0	0	0	110.7	E598 Q599 W600	T596-E598 WeakPolarHBondContact CB-OE2 3.32Å; T596-E598 PolarHBondContact O-N 3.01Å; T596-Q599 VanDerWaalsContact N-OE1 3.09Å; T596-Q599 PolarHBondContact O-N 2.71Å; T596-Q599 WeakPolarHBondContact OG1-CB 3.22Å; T596-Q599 WeakPolarHBondContact OG1-CG 3.41Å; T596-Q599 PolarHBondContact OG1-N 2.76Å; T596-Q599 PolarHBondContact OG1-OE1 2.98Å; T596-W600 WeakPolarHBondContact O-CB 3.46Å; T596-W600 PolarHBondContact O-N 3.32Å
597	V	93.4	Very high	83.1	Confident	7 Å²	7	62.4 Å²	62.4	4%	0.042	33%	0.333	C	S	.	.	H	α-helix	trans	-62.7	-36.5	-178.3	68.2	0	0	0	0	111.3	Y570 T601 V767 I797	Y570-V597 HydrophobicContact CD2-CB 3.94Å; Y570-V597 HydrophobicContact CD2-CG2 4.35Å; Y570-V597 HydrophobicContact CE2-CB 3.49Å; Y570-V597 VanDerWaalsContact CE2-CB 3.49Å; Y570-V597 HydrophobicContact CE2-CG2 3.77Å; V597-T601 VanDerWaalsContact O-CB 3.31Å; V597-T601 WeakPolarHBondContact O-CB 3.38Å; V597-T601 PolarHBondContact O-N 3.48Å; V597-T601 PolarHBondContact O-OG1 3.49Å; V597-V767 HydrophobicContact CG1-CG1 4.08Å; V597-V767 HydrophobicContact CG2-CG1 3.83Å; V597-I797 HydrophobicContact CG2-CB 3.74Å; V597-I797 HydrophobicContact CG2-CG1 3.63Å; V597-I797 HydrophobicContact CG2-CG2 3.86Å
598	E	95.6	Very high	85.9	Confident	19 Å²	19	60.5 Å²	60.5	9%	0.089	32%	0.316	C	S	.	.	H	α-helix	trans	-70	-46.3	-179.9	-57.3	83.1	-177.4	0	0	110.3	R567 T596 W600 T601 V602 H616 D751 L752 V767	R567-E598 IonicContact NH1-OE1 2.94Å; R567-E598 PolarHBondContact NH1-OE1 3.07Å; T596-E598 WeakPolarHBondContact CB-OE2 3.32Å; T596-E598 PolarHBondContact O-N 3.01Å; E598-W600 VanDerWaalsContact C-N 3.34Å; E598-W600 PolarHBondContact O-N 3.47Å; E598-T601 PolarHBondContact O-N 3.43Å; E598-V602 WeakPolarHBondContact O-CG2 3.42Å; E598-V602 PolarHBondContact O-N 3.29Å; E598-H616 HydrophobicContact CB-CB 4.34Å; E598-D751 HydrophobicContact CG-CB 4.33Å; E598-L752 HydrophobicContact CB-CD2 4.07Å; E598-V767 HydrophobicContact CG-CB 4.43Å
599	Q	95.1	Very high	88.4	Confident	83 Å²	83	59.2 Å²	59.2	39%	0.388	31%	0.308	S	S	.	.	H	α-helix	trans	-63.9	-35.7	176	-75.3	169.5	-27.5	0	0	113.6	L595 T596 R603	L595-Q599 HydrophobicContact CB-CB 4Å; L595-Q599 HydrophobicContact CD2-CB 4.29Å; T596-Q599 VanDerWaalsContact N-OE1 3.09Å; T596-Q599 PolarHBondContact O-N 2.71Å; T596-Q599 WeakPolarHBondContact OG1-CB 3.22Å; T596-Q599 WeakPolarHBondContact OG1-CG 3.41Å; T596-Q599 PolarHBondContact OG1-N 2.76Å; T596-Q599 PolarHBondContact OG1-OE1 2.98Å; Q599-R603 PolarHBondContact O-NH1 3.37Å; Q599-R603 VanDerWaalsContact O-NH1 3.08Å
600	W	95.3	Very high	90.7	Very high	12 Å²	12	55.9 Å²	55.9	5%	0.045	30%	0.297	C	S	.	.	H	α-helix	trans	-68.2	-45.6	174.8	-173.2	98.2	0	0	0	110.3	I552 A554 V571 W572 L595 T596 E598 V602 R603 Y604 I797	I552-W600 HydrophobicContact CG2-CH2 3.8Å; I552-W600 HydrophobicContact CG2-CZ3 3.75Å; A554-W600 HydrophobicContact CB-CD2 3.76Å; A554-W600 HydrophobicContact CB-CE3 3.75Å; A554-W600 HydrophobicContact CB-CH2 3.61Å; A554-W600 HydrophobicContact CB-CZ2 3.59Å; A554-W600 HydrophobicContact CB-CZ3 3.68Å; V571-W600 PolarHBondContact O-NE1 3.32Å; W572-W600 AromaticContact CE3-CD1 3.88Å; W572-W600 HydrophobicContact CE3-CD2 4.38Å; W572-W600 AromaticContact CE3-CE2 3.91Å; W572-W600 HydrophobicContact CE3-CG 4.34Å; W572-W600 HydrophobicContact CE3-CZ2 4.44Å; W572-W600 AromaticContact CE3-NE1 3.62Å; W572-W600 HydrophobicContact CZ3-CZ2 4.35Å; L595-W600 HydrophobicContact CB-CB 4.26Å; L595-W600 HydrophobicContact CD1-CB 4.45Å; T596-W600 WeakPolarHBondContact O-CB 3.46Å; T596-W600 PolarHBondContact O-N 3.32Å; E598-W600 VanDerWaalsContact C-N 3.34Å; E598-W600 PolarHBondContact O-N 3.47Å; W600-V602 PolarHBondContact O-N 2.9Å; W600-R603 PolarHBondContact O-N 3.04Å; W600-Y604 AromaticContact CH2-CD2 3.75Å; W600-Y604 HydrophobicContact CH2-CD2 3.75Å; W600-Y604 HydrophobicContact CH2-CG 4.13Å; W600-Y604 HydrophobicContact CZ3-CD2 4.06Å; W600-Y604 AromaticContact CZ3-CG 3.96Å; W600-Y604 HydrophobicContact CZ3-CG 3.96Å; W600-Y604 PolarHBondContact O-N 2.77Å; W600-I797 HydrophobicContact CE3-CD1 4.48Å; W600-I797 HydrophobicContact CZ3-CD1 4.21Å
601	T	96	Very high	92.6	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61	-46.3	-179.8	-56.4	0	0	0	0	111.4	V597 E598 R603 Y604 Y605 L752 V767 C795	V597-T601 VanDerWaalsContact O-CB 3.31Å; V597-T601 WeakPolarHBondContact O-CB 3.38Å; V597-T601 PolarHBondContact O-N 3.48Å; V597-T601 PolarHBondContact O-OG1 3.49Å; E598-T601 PolarHBondContact O-N 3.43Å; T601-R603 VanDerWaalsContact C-N 3.29Å; T601-R603 PolarHBondContact O-N 3.25Å; T601-Y604 WeakPolarHBondContact O-CB 3.19Å; T601-Y604 PolarHBondContact O-N 3.03Å; T601-Y605 HydrophobicContact CG2-CD2 3.68Å; T601-Y605 HydrophobicContact CG2-CE2 3.49Å; T601-Y605 VanDerWaalsContact CG2-CE2 3.49Å; T601-Y605 VanDerWaalsContact O-CD2 3.32Å; T601-Y605 WeakPolarHBondContact O-CD2 3.49Å; T601-Y605 PolarHBondContact O-N 2.91Å; T601-L752 HydrophobicContact CG2-CD1 3.64Å; T601-V767 HydrophobicContact CG2-CG2 3.89Å; T601-C795 HydrophobicContact CG2-CB 4.45Å
602	V	96.5	Very high	93.7	Very high	12 Å²	12	51.7 Å²	51.7	7%	0.073	27%	0.266	C	S	.	.	H	α-helix	trans	-51.8	-48.8	175	170.2	0	0	0	0	111.6	E598 W600 Y604 Y605 M606 L752	E598-V602 WeakPolarHBondContact O-CG2 3.42Å; E598-V602 PolarHBondContact O-N 3.29Å; W600-V602 PolarHBondContact O-N 2.9Å; V602-Y604 PolarHBondContact O-N 2.89Å; V602-Y605 PolarHBondContact O-N 3.02Å; V602-M606 HydrophobicContact CG1-CG 4.41Å; V602-M606 HydrophobicContact CG1-SD 3.84Å; V602-M606 WeakPolarHBondContact O-CG 3.35Å; V602-M606 PolarHBondContact O-N 2.82Å; V602-L752 HydrophobicContact CG2-CB 4.42Å; V602-L752 HydrophobicContact CG2-CD1 3.7Å; V602-L752 HydrophobicContact CG2-CD2 3.44Å; V602-L752 VanDerWaalsContact CG2-CD2 3.44Å; V602-L752 HydrophobicContact CG2-CG 4.05Å
603	R	95.4	Very high	94.3	Very high	82 Å²	82	51.5 Å²	51.5	31%	0.309	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-39.2	179.3	-72.2	178.1	175.6	70.7	-0.1	112.5	W572 Q599 W600 T601 Y605 M606 A607	W572-R603 HydrophobicContact CD2-CB 4Å; W572-R603 HydrophobicContact CE3-CB 3.99Å; W572-R603 VanDerWaalsContact CH2-C 3.49Å; W572-R603 HydrophobicContact CH2-CB 3.78Å; W572-R603 WeakPolarHBondContact CH2-O 3.4Å; W572-R603 HydrophobicContact CZ2-CB 3.77Å; W572-R603 HydrophobicContact CZ3-CB 3.89Å; Q599-R603 PolarHBondContact O-NH1 3.37Å; Q599-R603 VanDerWaalsContact O-NH1 3.08Å; W600-R603 PolarHBondContact O-N 3.04Å; T601-R603 VanDerWaalsContact C-N 3.29Å; T601-R603 PolarHBondContact O-N 3.25Å; R603-Y605 PolarHBondContact O-N 2.7Å; R603-M606 PolarHBondContact O-N 3.5Å; R603-A607 VanDerWaalsContact O-CB 3.27Å; R603-A607 WeakPolarHBondContact O-CB 3.45Å; R603-A607 PolarHBondContact O-N 3.36Å
604	Y	95.2	Very high	94.7	Very high	51 Å²	51	50.2 Å²	50.2	20%	0.2	26%	0.258	C	S	.	.	H	α-helix	trans	-57.6	-48.3	174.8	173	-88.7	0	0	0	111.4	I552 W600 T601 V602 A607 N608	I552-Y604 HydrophobicContact CD1-CD1 3.63Å; I552-Y604 HydrophobicContact CD1-CE1 3.25Å; I552-Y604 HydrophobicContact CG1-CE1 3.93Å; I552-Y604 HydrophobicContact CG2-CD2 4.13Å; I552-Y604 HydrophobicContact CG2-CE1 4.34Å; I552-Y604 HydrophobicContact CG2-CE2 3.92Å; I552-Y604 HydrophobicContact CG2-CG 4.42Å; W600-Y604 AromaticContact CH2-CD2 3.75Å; W600-Y604 HydrophobicContact CH2-CD2 3.75Å; W600-Y604 HydrophobicContact CH2-CG 4.13Å; W600-Y604 HydrophobicContact CZ3-CD2 4.06Å; W600-Y604 AromaticContact CZ3-CG 3.96Å; W600-Y604 HydrophobicContact CZ3-CG 3.96Å; W600-Y604 PolarHBondContact O-N 2.77Å; T601-Y604 WeakPolarHBondContact O-CB 3.19Å; T601-Y604 PolarHBondContact O-N 3.03Å; V602-Y604 PolarHBondContact O-N 2.89Å; Y604-A607 PolarHBondContact O-N 2.98Å; Y604-N608 VanDerWaalsContact CD2-ND2 3.31Å; Y604-N608 WeakPolarHBondContact CD2-ND2 3.21Å; Y604-N608 HydrophobicContact CE1-CB 4.48Å; Y604-N608 HydrophobicContact CE2-CB 4.35Å; Y604-N608 VanDerWaalsContact O-CB 3.31Å; Y604-N608 WeakPolarHBondContact O-CB 3.29Å; Y604-N608 PolarHBondContact O-N 3.18Å; Y604-N608 PolarHBondContact O-ND2 2.98Å
605	Y	96.4	Very high	95	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-66.9	-42.5	179.4	-82.7	-94.7	0	0	0	112.2	V550 I552 T601 V602 R603 A607 K609 F611 L754 K763 V765 E793 C795	V550-Y605 WeakPolarHBondContact CG2-OH 3.2Å; I552-Y605 HydrophobicContact CD1-CE2 4.13Å; T601-Y605 HydrophobicContact CG2-CD2 3.68Å; T601-Y605 HydrophobicContact CG2-CE2 3.49Å; T601-Y605 VanDerWaalsContact CG2-CE2 3.49Å; T601-Y605 VanDerWaalsContact O-CD2 3.32Å; T601-Y605 WeakPolarHBondContact O-CD2 3.49Å; T601-Y605 PolarHBondContact O-N 2.91Å; V602-Y605 PolarHBondContact O-N 3.02Å; R603-Y605 PolarHBondContact O-N 2.7Å; Y605-A607 VanDerWaalsContact C-N 3.34Å; Y605-A607 PolarHBondContact O-N 2.89Å; Y605-K609 HydrophobicContact CD1-CB 4.25Å; Y605-K609 HydrophobicContact CD1-CG 3.79Å; Y605-K609 HydrophobicContact CE1-CG 4.35Å; Y605-K609 HydrophobicContact CG-CG 4.49Å; Y605-K609 CarbonylContact O-C 3.53Å; Y605-K609 VanDerWaalsContact O-CA 3.28Å; Y605-K609 WeakPolarHBondContact O-CA 3.45Å; Y605-K609 VanDerWaalsContact O-CB 3.24Å; Y605-K609 WeakPolarHBondContact O-CB 3.46Å; Y605-K609 PolarHBondContact O-N 3.47Å; Y605-F611 HydrophobicContact CD1-CE2 4.22Å; Y605-L754 VanDerWaalsContact CB-CD1 3.49Å; Y605-L754 HydrophobicContact CD1-CD1 3.73Å; Y605-L754 HydrophobicContact CD2-CD1 4.23Å; Y605-L754 HydrophobicContact CG-CD1 3.55Å; Y605-K763 HydrophobicContact CD1-CD 4.27Å; Y605-K763 HydrophobicContact CE1-CD 3.95Å; Y605-V765 HydrophobicContact CE1-CG2 4.28Å; Y605-V765 HydrophobicContact CE2-CG1 4.35Å; Y605-E793 WeakPolarHBondContact CE1-OE1 3.43Å; Y605-E793 PolarHBondContact OH-OE1 3.31Å; Y605-C795 HydrophobicContact CE2-CB 4.47Å
606	M	95.7	Very high	95.2	Very high	70 Å²	70	49.9 Å²	49.9	35%	0.345	26%	0.255	S	S	.	.	H	α-helix	trans	-60.5	-44.6	176.3	-68.2	178.3	73.6	0	0	111.5	V602 R603 N610 F611 E612 L754	V602-M606 HydrophobicContact CG1-CG 4.41Å; V602-M606 HydrophobicContact CG1-SD 3.84Å; V602-M606 WeakPolarHBondContact O-CG 3.35Å; V602-M606 PolarHBondContact O-N 2.82Å; R603-M606 PolarHBondContact O-N 3.5Å; M606-N610 PolarHBondContact O-N 2.94Å; M606-F611 HydrophobicContact CG-CB 4.48Å; M606-E612 WeakPolarHBondContact CE-O 3.26Å; M606-L754 HydrophobicContact CG-CD2 4.12Å
607	A	92.9	Very high	95.2	Very high	58 Å²	58	47.5 Å²	47.5	48%	0.479	24%	0.24	S	C	.	.	H	α-helix	trans	-75.2	-33.9	-177.2	0	0	0	0	0	114.4	W572 R603 Y604 Y605	W572-A607 HydrophobicContact CH2-CB 4.02Å; W572-A607 HydrophobicContact CZ2-CB 4.16Å; R603-A607 VanDerWaalsContact O-CB 3.27Å; R603-A607 WeakPolarHBondContact O-CB 3.45Å; R603-A607 PolarHBondContact O-N 3.36Å; Y604-A607 PolarHBondContact O-N 2.98Å; Y605-A607 VanDerWaalsContact C-N 3.34Å; Y605-A607 PolarHBondContact O-N 2.89Å
608	N	93.6	Very high	95.1	Very high	92 Å²	92	52 Å²	52	49%	0.492	26%	0.26	S	S	.	.	H	α-helix	trans	-110.6	-17.2	-171.1	-61.9	-83.3	0	0	0	114.2	Y604	Y604-N608 VanDerWaalsContact CD2-ND2 3.31Å; Y604-N608 WeakPolarHBondContact CD2-ND2 3.21Å; Y604-N608 HydrophobicContact CE1-CB 4.48Å; Y604-N608 HydrophobicContact CE2-CB 4.35Å; Y604-N608 VanDerWaalsContact O-CB 3.31Å; Y604-N608 WeakPolarHBondContact O-CB 3.29Å; Y604-N608 PolarHBondContact O-N 3.18Å; Y604-N608 PolarHBondContact O-ND2 2.98Å
609	K	92.9	Very high	95.1	Very high	107 Å²	107	51.5 Å²	51.5	47%	0.465	26%	0.259	S	S	.	.	S	Bend	trans	-118.6	12.2	-179.9	-53.8	-65.3	-175.7	179.3	0	112.2	Y605 F611 R761	Y605-K609 HydrophobicContact CD1-CB 4.25Å; Y605-K609 HydrophobicContact CD1-CG 3.79Å; Y605-K609 HydrophobicContact CE1-CG 4.35Å; Y605-K609 HydrophobicContact CG-CG 4.49Å; Y605-K609 CarbonylContact O-C 3.53Å; Y605-K609 VanDerWaalsContact O-CA 3.28Å; Y605-K609 WeakPolarHBondContact O-CA 3.45Å; Y605-K609 VanDerWaalsContact O-CB 3.24Å; Y605-K609 WeakPolarHBondContact O-CB 3.46Å; Y605-K609 PolarHBondContact O-N 3.47Å; K609-F611 HydrophobicContact CB-CD2 3.81Å; K609-F611 HydrophobicContact CB-CE2 3.83Å; K609-F611 PolarHBondContact O-N 3.3Å; K609-R761 PolarHBondContact O-NH2 3.01Å
610	N	91.5	Very high	95.1	Very high	116 Å²	116	51 Å²	51	62%	0.62	26%	0.257	S	S	*	.			trans	51.4	40.6	174	-57.4	-24.4	0	0	0	113.2	M606 R761	M606-N610 PolarHBondContact O-N 2.94Å; N610-R761 PolarHBondContact O-NH2 2.95Å
611	F	96.6	Very high	95.1	Very high	8 Å²	8	50.5 Å²	50.5	4%	0.035	26%	0.255	C	S	.	.			trans	-81.6	127.6	169.2	-75.5	-84.2	0	0	0	109.6	Y605 M606 K609 H613 L754 S756 K763	Y605-F611 HydrophobicContact CD1-CE2 4.22Å; M606-F611 HydrophobicContact CG-CB 4.48Å; K609-F611 HydrophobicContact CB-CD2 3.81Å; K609-F611 HydrophobicContact CB-CE2 3.83Å; K609-F611 PolarHBondContact O-N 3.3Å; F611-H613 VanDerWaalsContact C-N 3.32Å; F611-L754 HydrophobicContact CB-CB 4.19Å; F611-L754 HydrophobicContact CB-CD2 4.09Å; F611-L754 HydrophobicContact CD1-CB 3.6Å; F611-L754 HydrophobicContact CD2-CB 4.05Å; F611-L754 HydrophobicContact CD2-CD1 4.25Å; F611-L754 HydrophobicContact CD2-CD2 4.37Å; F611-L754 HydrophobicContact CD2-CG 4.47Å; F611-L754 HydrophobicContact CE1-CB 3.85Å; F611-L754 HydrophobicContact CE2-CB 4.31Å; F611-L754 HydrophobicContact CE2-CD1 4.28Å; F611-L754 HydrophobicContact CG-CB 3.69Å; F611-L754 HydrophobicContact CG-CD2 4.26Å; F611-L754 HydrophobicContact CG-CG 4.44Å; F611-L754 HydrophobicContact CZ-CB 4.22Å; F611-S756 WeakPolarHBondContact CA-OG 3.26Å; F611-K763 HydrophobicContact CE1-CB 3.81Å; F611-K763 HydrophobicContact CE2-CB 4.19Å; F611-K763 HydrophobicContact CE2-CD 4.11Å; F611-K763 HydrophobicContact CZ-CB 3.32Å; F611-K763 HydrophobicContact CZ-CD 3.94Å; F611-K763 HydrophobicContact CZ-CG 4.25Å
612	E	96.8	Very high	95.2	Very high	80 Å²	80	50.6 Å²	50.6	37%	0.374	26%	0.255	S	S	.	.	S	Bend	trans	-66.1	-35.6	178.6	-61.3	-176.9	161	0	0	112.5	M606 S756 P757 T758	M606-E612 WeakPolarHBondContact CE-O 3.26Å; E612-S756 PolarHBondContact N-OG 3.15Å; E612-P757 VanDerWaalsContact OE2-CD 3.26Å; E612-P757 WeakPolarHBondContact OE2-CD 3.41Å; E612-T758 WeakPolarHBondContact OE1-CB 3.21Å; E612-T758 WeakPolarHBondContact OE1-CG2 3.25Å; E612-T758 PolarHBondContact OE1-OG1 3.45Å; E612-T758 PolarHBondContact OE2-OG1 2.94Å
613	H	97.5	Very high	95.2	Very high	73 Å²	73	50.3 Å²	50.3	34%	0.338	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	152.7	-177.5	-57.1	-72.2	0	0	0	111.7	F611 L754 W755	F611-H613 VanDerWaalsContact C-N 3.32Å; H613-L754 WeakPolarHBondContact O-CA 3.18Å; H613-W755 HydrophobicContact CB-CD2 3.56Å; H613-W755 HydrophobicContact CB-CE3 3.83Å; H613-W755 HydrophobicContact CB-CG 4.25Å; H613-W755 HydrophobicContact CB-CH2 3.67Å; H613-W755 HydrophobicContact CB-CZ2 3.39Å; H613-W755 HydrophobicContact CB-CZ3 3.87Å; H613-W755 AromaticContact CD2-NE1 3.66Å; H613-W755 AromaticContact CG-CE2 3.8Å; H613-W755 AromaticContact CG-CZ2 3.85Å; H613-W755 AromaticContact CG-NE1 3.94Å; H613-W755 PolarHBondContact N-O 3.29Å; H613-W755 PolarHBondContact O-N 3.48Å
614	G	97.1	Very high	95.2	Very high	24 Å²	24	46.4 Å²	46.4	25%	0.247	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	140.1	177.3	0	0	0	0	0	112.2	L753	G614-L753 WeakPolarHBondContact CA-O 3.37Å
615	I	96.4	Very high	95.3	Very high	31 Å²	31	44.2 Å²	44.2	16%	0.159	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	142.5	179.3	-165.7	167.8	0	0	0	110.9	C617 L712 L752 L753 W755	I615-C617 HydrophobicContact CD1-CB 4.5Å; I615-C617 HydrophobicContact CG1-CB 4.28Å; I615-C617 HydrophobicContact CG2-CB 3.87Å; I615-L712 HydrophobicContact CD1-CB 4.28Å; I615-L712 HydrophobicContact CD1-CD2 3.89Å; I615-L752 WeakPolarHBondContact O-CA 3.43Å; I615-L753 HydrophobicContact CG2-CB 4.11Å; I615-L753 PolarHBondContact N-O 3.41Å; I615-L753 PolarHBondContact O-N 3.31Å; I615-W755 HydrophobicContact CB-CZ3 4.28Å; I615-W755 HydrophobicContact CG2-CZ3 3.95Å
616	H	96.3	Very high	95.4	Very high	69 Å²	69	44.3 Å²	44.3	32%	0.319	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	98.7	163	171.5	-138.5	0	0	0	107.5	E598 D751 L752	E598-H616 HydrophobicContact CB-CB 4.34Å; H616-D751 CarbonylContact C-O 3.46Å; H616-D751 WeakPolarHBondContact CA-O 3.36Å; H616-D751 PolarHBondContact CD2-O 3.05Å; H616-L752 HydrophobicContact CB-CD2 3.72Å
617	C	92.7	Very high	95.4	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.014	22%	0.217	C	C	.	.			trans	-117.9	-13.7	-170.1	57.7	0	0	0	0	113.9	I615 S619 Q620 I621 D751	I615-C617 HydrophobicContact CD1-CB 4.5Å; I615-C617 HydrophobicContact CG1-CB 4.28Å; I615-C617 HydrophobicContact CG2-CB 3.87Å; C617-S619 PolarHBondContact O-N 2.93Å; C617-Q620 WeakPolarHBondContact O-CB 3.34Å; C617-Q620 WeakPolarHBondContact O-CG 3.48Å; C617-Q620 PolarHBondContact O-N 3.22Å; C617-I621 HydrophobicContact CB-CB 4.04Å; C617-I621 HydrophobicContact CB-CG2 4.02Å; C617-I621 WeakPolarHBondContact SG-CG2 3.39Å; C617-D751 PolarHBondContact N-O 3.43Å
618	E	92.7	Very high	95.6	Very high	100 Å²	100	38.6 Å²	38.6	47%	0.467	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	46	-126.3	-165.6	-56.4	175.6	-159.1	0	0	109.7	P750 D751	E618-P750 CarbonylContact C-O 3.55Å; E618-P750 WeakPolarHBondContact CA-O 3.17Å; E618-D751 PolarHBondContact N-O 3.33Å
619	S	94.8	Very high	95.7	Very high	10 Å²	10	34.2 Å²	34.2	7%	0.07	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-9.7	177.9	-50.9	0	0	0	0	114.9	C617 I621 Y622 H623 G748 L749	C617-S619 PolarHBondContact O-N 2.93Å; S619-I621 PolarHBondContact O-N 3.43Å; S619-Y622 PolarHBondContact O-N 3.23Å; S619-H623 PolarHBondContact O-CD2 3.38Å; S619-H623 PolarHBondContact O-N 2.6Å; S619-G748 PolarHBondContact OG-N 2.98Å; S619-L749 PolarHBondContact OG-N 2.97Å
620	Q	95.4	Very high	96	Very high	73 Å²	73	29.2 Å²	29.2	34%	0.341	15%	0.149	S	C	.	.	H	α-helix	trans	-68.6	-37.8	-163.4	-56.3	-179.7	19.4	0	0	113.9	C617 Y622 H623 L624 N709 L712	C617-Q620 WeakPolarHBondContact O-CB 3.34Å; C617-Q620 WeakPolarHBondContact O-CG 3.48Å; C617-Q620 PolarHBondContact O-N 3.22Å; Q620-Y622 VanDerWaalsContact C-N 3.28Å; Q620-Y622 PolarHBondContact O-N 2.68Å; Q620-H623 WeakPolarHBondContact O-CB 3.39Å; Q620-H623 PolarHBondContact O-N 2.98Å; Q620-L624 PolarHBondContact O-N 3.35Å; Q620-N709 PolarHBondContact OE1-ND2 3.23Å; Q620-L712 HydrophobicContact CB-CD1 3.54Å
621	I	95.6	Very high	96.2	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.2	-37.4	179.1	-172	58.1	0	0	0	111.9	C617 S619 H623 L624 L625 L713 L719 I722 L753	C617-I621 HydrophobicContact CB-CB 4.04Å; C617-I621 HydrophobicContact CB-CG2 4.02Å; C617-I621 WeakPolarHBondContact SG-CG2 3.39Å; S619-I621 PolarHBondContact O-N 3.43Å; I621-H623 VanDerWaalsContact C-N 3.33Å; I621-L624 HydrophobicContact CD1-CD2 4.38Å; I621-L624 WeakPolarHBondContact O-CB 3.36Å; I621-L624 PolarHBondContact O-N 2.95Å; I621-L625 PolarHBondContact O-N 3.39Å; I621-L713 HydrophobicContact CD1-CD1 3.79Å; I621-L713 HydrophobicContact CD1-CD2 4.1Å; I621-L713 HydrophobicContact CD1-CG 4.05Å; I621-L719 HydrophobicContact CD1-CD1 4.06Å; I621-I722 HydrophobicContact CD1-CD1 3.97Å; I621-I722 HydrophobicContact CG1-CD1 4.32Å; I621-L753 HydrophobicContact CG1-CD2 4Å; I621-L753 HydrophobicContact CG2-CD2 4.06Å
622	Y	96.5	Very high	96.1	Very high	2 Å²	2	24.8 Å²	24.8	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-71.1	-32.3	178.4	-55.7	-79.2	0	0	0	111.7	S619 Q620 F626 L726 V734 L749 I764	S619-Y622 PolarHBondContact O-N 3.23Å; Q620-Y622 VanDerWaalsContact C-N 3.28Å; Q620-Y622 PolarHBondContact O-N 2.68Å; Y622-F626 WeakPolarHBondContact O-CB 3.37Å; Y622-F626 PolarHBondContact O-N 3.18Å; Y622-L726 HydrophobicContact CE1-CD1 4.45Å; Y622-V734 HydrophobicContact CD1-CG1 4Å; Y622-V734 HydrophobicContact CD1-CG2 4.33Å; Y622-V734 HydrophobicContact CG-CG1 4.29Å; Y622-L749 HydrophobicContact CD1-CD2 4.22Å; Y622-L749 HydrophobicContact CD2-CB 3.9Å; Y622-L749 HydrophobicContact CD2-CD1 3.68Å; Y622-L749 HydrophobicContact CD2-CD2 3.81Å; Y622-L749 HydrophobicContact CD2-CG 3.98Å; Y622-L749 HydrophobicContact CE1-CD2 4.3Å; Y622-L749 HydrophobicContact CE2-CB 3.96Å; Y622-L749 HydrophobicContact CE2-CD1 4.5Å; Y622-L749 HydrophobicContact CE2-CD2 3.9Å; Y622-L749 HydrophobicContact CE2-CG 4.32Å; Y622-L749 HydrophobicContact CG-CD1 3.85Å; Y622-L749 HydrophobicContact CG-CD2 3.96Å; Y622-L749 HydrophobicContact CG-CG 4.38Å; Y622-I764 WeakPolarHBondContact OH-CG2 3.4Å
623	H	96.5	Very high	96.1	Very high	7 Å²	7	21.2 Å²	21.2	3%	0.032	11%	0.109	C	C	.	.	H	α-helix	trans	-68.4	-38.5	171.4	-69.4	-48.1	0	0	0	112.4	S619 Q620 I621 F626 C627 W707 Y742 R746	S619-H623 PolarHBondContact O-CD2 3.38Å; S619-H623 PolarHBondContact O-N 2.6Å; Q620-H623 WeakPolarHBondContact O-CB 3.39Å; Q620-H623 PolarHBondContact O-N 2.98Å; I621-H623 VanDerWaalsContact C-N 3.33Å; H623-F626 PolarHBondContact O-N 3.43Å; H623-C627 WeakPolarHBondContact O-CB 3.37Å; H623-C627 PolarHBondContact O-N 3.03Å; H623-W707 HydrophobicContact CB-CB 3.87Å; H623-Y742 AromaticContact CE1-CZ 3.62Å; H623-Y742 PolarHBondContact CE1-OH 3.19Å; H623-Y742 AromaticContact ND1-CE2 3.88Å; H623-Y742 AromaticContact ND1-CZ 3.61Å; H623-Y742 PolarHBondContact ND1-OH 3.41Å; H623-R746 PolarHBondContact CE1-O 3.3Å; H623-R746 PolarHBondContact NE2-O 3.26Å
624	L	96.5	Very high	96.1	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-63.9	-47.5	174.3	-177.2	60.3	0	0	0	111.1	Q620 I621 F626 C627 I628 W697 A708 W710 L713 L719	Q620-L624 PolarHBondContact O-N 3.35Å; I621-L624 HydrophobicContact CD1-CD2 4.38Å; I621-L624 WeakPolarHBondContact O-CB 3.36Å; I621-L624 PolarHBondContact O-N 2.95Å; L624-F626 PolarHBondContact O-N 3.44Å; L624-C627 PolarHBondContact O-N 2.93Å; L624-I628 HydrophobicContact CD1-CD1 3.68Å; L624-I628 HydrophobicContact CD1-CG1 4.37Å; L624-I628 HydrophobicContact CG-CD1 4.02Å; L624-I628 PolarHBondContact O-N 3.24Å; L624-W697 HydrophobicContact CD1-CZ3 4.4Å; L624-W697 HydrophobicContact CD2-CH2 4.47Å; L624-W697 HydrophobicContact CD2-CZ3 4.02Å; L624-A708 HydrophobicContact CD1-CB 4.01Å; L624-W710 HydrophobicContact CD1-CD2 4.19Å; L624-W710 HydrophobicContact CD1-CE3 3.89Å; L624-W710 HydrophobicContact CD1-CZ3 4.23Å; L624-L713 HydrophobicContact CD2-CD1 4.1Å; L624-L713 HydrophobicContact CD2-CG 4.31Å; L624-L719 HydrophobicContact CD2-CD1 4.46Å; L624-L719 HydrophobicContact CG-CD1 4.47Å; L624-L719 HydrophobicContact CG-CD2 4.46Å
625	L	96.9	Very high	96	Very high	4 Å²	4	17.1 Å²	17.1	2%	0.021	8%	0.084	C	C	.	.	H	α-helix	trans	-54.2	-53.2	172.1	-83.2	169.9	0	0	0	111.3	I621 C627 I628 L629 L719 I722 L726	I621-L625 PolarHBondContact O-N 3.39Å; L625-C627 PolarHBondContact O-N 2.89Å; L625-I628 PolarHBondContact O-N 3.34Å; L625-L629 HydrophobicContact CB-CD1 4.48Å; L625-L629 HydrophobicContact CD2-CD1 4.31Å; L625-L629 WeakPolarHBondContact O-CB 3.49Å; L625-L629 WeakPolarHBondContact O-CG 3.32Å; L625-L629 PolarHBondContact O-N 3.45Å; L625-L719 HydrophobicContact CD2-CD1 3.51Å; L625-L719 HydrophobicContact CD2-CD2 4.39Å; L625-L719 HydrophobicContact CD2-CG 3.81Å; L625-L719 HydrophobicContact CG-CD1 3.69Å; L625-L719 HydrophobicContact CG-CG 4.49Å; L625-I722 HydrophobicContact CD1-CG2 4.31Å; L625-L726 HydrophobicContact CD1-CD1 3.99Å
626	F	97.6	Very high	95.9	Very high	5 Å²	5	20.2 Å²	20.2	2%	0.022	10%	0.098	C	C	.	.	H	α-helix	trans	-60.3	-45.7	-179.5	175.9	-110.4	0	0	0	112.1	Y622 H623 L624 L629 F630 L634 C735 L738 A739 Y742	Y622-F626 WeakPolarHBondContact O-CB 3.37Å; Y622-F626 PolarHBondContact O-N 3.18Å; H623-F626 PolarHBondContact O-N 3.43Å; L624-F626 PolarHBondContact O-N 3.44Å; F626-L629 PolarHBondContact O-N 3.28Å; F626-F630 HydrophobicContact CD2-CB 4.42Å; F626-F630 AromaticContact CD2-CD2 3.66Å; F626-F630 HydrophobicContact CD2-CD2 3.66Å; F626-F630 HydrophobicContact CD2-CE2 4.11Å; F626-F630 HydrophobicContact CD2-CG 4.05Å; F626-F630 HydrophobicContact CE2-CB 4.09Å; F626-F630 HydrophobicContact CE2-CD1 4.07Å; F626-F630 AromaticContact CE2-CD2 3.78Å; F626-F630 HydrophobicContact CE2-CD2 3.78Å; F626-F630 HydrophobicContact CE2-CE1 4.48Å; F626-F630 HydrophobicContact CE2-CE2 4.23Å; F626-F630 AromaticContact CE2-CG 3.71Å; F626-F630 HydrophobicContact CE2-CG 3.71Å; F626-F630 HydrophobicContact CZ-CB 4.44Å; F626-F630 HydrophobicContact CZ-CG 4.46Å; F626-F630 WeakPolarHBondContact O-CB 3.34Å; F626-F630 PolarHBondContact O-N 3.15Å; F626-L634 HydrophobicContact CE1-CD1 4.22Å; F626-L634 HydrophobicContact CE1-CD2 4.17Å; F626-L634 HydrophobicContact CZ-CD2 4.38Å; F626-C735 HydrophobicContact CD2-CB 4.17Å; F626-L738 HydrophobicContact CB-CD1 3.76Å; F626-L738 HydrophobicContact CD1-CB 4.31Å; F626-L738 HydrophobicContact CD1-CD1 4.42Å; F626-L738 HydrophobicContact CD2-CB 4.14Å; F626-L738 HydrophobicContact CE1-CB 4.46Å; F626-L738 HydrophobicContact CE2-CB 4.31Å; F626-L738 HydrophobicContact CG-CB 4.14Å; F626-L738 HydrophobicContact CG-CD1 3.99Å; F626-L738 HydrophobicContact CZ-CB 4.46Å; F626-A739 HydrophobicContact CE2-CB 3.92Å; F626-A739 HydrophobicContact CZ-CB 4.24Å; F626-Y742 HydrophobicContact CD1-CD2 4.46Å; F626-Y742 HydrophobicContact CD1-CE2 4.01Å; F626-Y742 HydrophobicContact CE1-CD2 4.03Å; F626-Y742 AromaticContact CE1-CE2 3.98Å; F626-Y742 HydrophobicContact CE1-CE2 3.98Å
627	C	96.8	Very high	95.7	Very high	8 Å²	8	18.3 Å²	18.3	5%	0.054	9%	0.089	C	C	.	.	H	α-helix	trans	-57.9	-52.5	179.7	-174.2	0	0	0	0	111.3	H623 L624 L625 F630 Y631 C705 A708	H623-C627 WeakPolarHBondContact O-CB 3.37Å; H623-C627 PolarHBondContact O-N 3.03Å; L624-C627 PolarHBondContact O-N 2.93Å; L625-C627 PolarHBondContact O-N 2.89Å; C627-F630 CarbonylContact O-C 3.43Å; C627-F630 PolarHBondContact O-N 3.39Å; C627-Y631 WeakPolarHBondContact O-CA 3.32Å; C627-Y631 VanDerWaalsContact O-CB 3.29Å; C627-Y631 WeakPolarHBondContact O-CB 3.18Å; C627-Y631 PolarHBondContact O-N 3.46Å; C627-C705 VanDerWaalsContact SG-CB 3.59Å; C627-A708 HydrophobicContact CB-CB 3.89Å
628	I	96.3	Very high	95.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67	-45.1	-178.5	-73.5	166	0	0	0	111	L624 L625 F630 I693 W697 W710 L719	L624-I628 HydrophobicContact CD1-CD1 3.68Å; L624-I628 HydrophobicContact CD1-CG1 4.37Å; L624-I628 HydrophobicContact CG-CD1 4.02Å; L624-I628 PolarHBondContact O-N 3.24Å; L625-I628 PolarHBondContact O-N 3.34Å; I628-F630 PolarHBondContact O-N 3.03Å; I628-I693 HydrophobicContact CG2-CB 4.27Å; I628-I693 HydrophobicContact CG2-CG1 4.08Å; I628-I693 HydrophobicContact CG2-CG2 4.31Å; I628-W697 HydrophobicContact CD1-CE3 3.6Å; I628-W697 HydrophobicContact CD1-CZ3 4.05Å; I628-W710 HydrophobicContact CD1-CE3 4.38Å; I628-W710 HydrophobicContact CD1-CH2 4.27Å; I628-W710 HydrophobicContact CD1-CZ3 3.66Å; I628-W710 HydrophobicContact CG1-CH2 3.9Å; I628-W710 HydrophobicContact CG1-CZ3 3.8Å; I628-L719 HydrophobicContact CB-CD2 4.37Å; I628-L719 HydrophobicContact CD1-CD2 3.27Å; I628-L719 HydrophobicContact CG1-CD2 4.41Å; I628-L719 HydrophobicContact CG2-CD2 4.36Å
629	L	97.1	Very high	95.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-70.7	-17.8	-177.4	-68.5	172.5	0	0	0	113.3	L625 F626 R672 L676 L689 I693 F723 V731	L625-L629 HydrophobicContact CB-CD1 4.48Å; L625-L629 HydrophobicContact CD2-CD1 4.31Å; L625-L629 WeakPolarHBondContact O-CB 3.49Å; L625-L629 WeakPolarHBondContact O-CG 3.32Å; L625-L629 PolarHBondContact O-N 3.45Å; F626-L629 PolarHBondContact O-N 3.28Å; L629-R672 PolarHBondContact O-NH1 2.99Å; L629-L676 HydrophobicContact CD1-CD2 4.13Å; L629-L676 HydrophobicContact CD2-CD2 4.23Å; L629-L689 HydrophobicContact CD2-CD1 3.79Å; L629-I693 HydrophobicContact CD2-CD1 4.22Å; L629-I693 HydrophobicContact CD2-CG1 3.97Å; L629-F723 HydrophobicContact CD1-CD2 4.28Å; L629-F723 HydrophobicContact CD1-CE2 4.3Å; L629-V731 HydrophobicContact CD1-CG1 3.7Å
630	F	97.3	Very high	95.2	Very high	1 Å²	1	24.9 Å²	24.9	0%	0.004	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	14.6	-179.6	-73.1	-107.6	0	0	0	113.1	F626 C627 I628 D632 I633 L634 I669 R672 L673 L676 C735	F626-F630 HydrophobicContact CD2-CB 4.42Å; F626-F630 AromaticContact CD2-CD2 3.66Å; F626-F630 HydrophobicContact CD2-CD2 3.66Å; F626-F630 HydrophobicContact CD2-CE2 4.11Å; F626-F630 HydrophobicContact CD2-CG 4.05Å; F626-F630 HydrophobicContact CE2-CB 4.09Å; F626-F630 HydrophobicContact CE2-CD1 4.07Å; F626-F630 AromaticContact CE2-CD2 3.78Å; F626-F630 HydrophobicContact CE2-CD2 3.78Å; F626-F630 HydrophobicContact CE2-CE1 4.48Å; F626-F630 HydrophobicContact CE2-CE2 4.23Å; F626-F630 AromaticContact CE2-CG 3.71Å; F626-F630 HydrophobicContact CE2-CG 3.71Å; F626-F630 HydrophobicContact CZ-CB 4.44Å; F626-F630 HydrophobicContact CZ-CG 4.46Å; F626-F630 WeakPolarHBondContact O-CB 3.34Å; F626-F630 PolarHBondContact O-N 3.15Å; C627-F630 CarbonylContact O-C 3.43Å; C627-F630 PolarHBondContact O-N 3.39Å; I628-F630 PolarHBondContact O-N 3.03Å; F630-D632 VanDerWaalsContact C-N 3.33Å; F630-D632 PolarHBondContact O-N 2.96Å; F630-I633 HydrophobicContact CD1-CB 4.45Å; F630-I633 HydrophobicContact CD1-CD1 3.76Å; F630-I633 HydrophobicContact CE1-CD1 4.21Å; F630-I633 WeakPolarHBondContact O-CA 3.29Å; F630-I633 WeakPolarHBondContact O-CB 3.44Å; F630-I633 PolarHBondContact O-N 2.78Å; F630-L634 HydrophobicContact CB-CD1 4.18Å; F630-L634 HydrophobicContact CB-CG 4.28Å; F630-L634 WeakPolarHBondContact O-CG 3.47Å; F630-L634 PolarHBondContact O-N 3.27Å; F630-I669 HydrophobicContact CE1-CG1 4.49Å; F630-I669 HydrophobicContact CE1-CG2 4.22Å; F630-R672 HydrophobicContact CD1-CB 4.47Å; F630-R672 HydrophobicContact CD1-CG 3.99Å; F630-R672 HydrophobicContact CD2-CG 4.29Å; F630-R672 HydrophobicContact CE1-CB 3.82Å; F630-R672 HydrophobicContact CE1-CG 3.52Å; F630-R672 HydrophobicContact CE2-CG 3.85Å; F630-R672 HydrophobicContact CG-CG 4.35Å; F630-R672 HydrophobicContact CZ-CB 4.05Å; F630-R672 HydrophobicContact CZ-CG 3.43Å; F630-R672 VanDerWaalsContact CZ-CG 3.43Å; F630-L673 HydrophobicContact CZ-CD2 3.92Å; F630-L673 HydrophobicContact CZ-CG 4.19Å; F630-L676 HydrophobicContact CE2-CD1 4Å; F630-L676 HydrophobicContact CZ-CD1 4.31Å; F630-C735 HydrophobicContact CE2-CB 3.66Å; F630-C735 HydrophobicContact CZ-CB 4.11Å
631	Y	96.4	Very high	95.1	Very high	1 Å²	1	22.4 Å²	22.4	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-55.1	-46.5	-170.6	-168	-78	0	0	0	112.4	P246 C627 I633 L634 F635 E636 Y696 H700 E703	P246-Y631 WeakPolarHBondContact CB-OH 3.32Å; C627-Y631 WeakPolarHBondContact O-CA 3.32Å; C627-Y631 VanDerWaalsContact O-CB 3.29Å; C627-Y631 WeakPolarHBondContact O-CB 3.18Å; C627-Y631 PolarHBondContact O-N 3.46Å; Y631-I633 VanDerWaalsContact C-N 3.34Å; Y631-I633 PolarHBondContact O-N 3.43Å; Y631-L634 PolarHBondContact O-N 3.05Å; Y631-L634 VanDerWaalsContact O-N 3.15Å; Y631-F635 HydrophobicContact CD1-CB 4.49Å; Y631-F635 HydrophobicContact CD1-CD2 4.12Å; Y631-F635 AromaticContact CD2-CD2 3.9Å; Y631-F635 HydrophobicContact CD2-CD2 3.9Å; Y631-F635 HydrophobicContact CD2-CE2 4.16Å; Y631-F635 HydrophobicContact CE1-CB 4.05Å; Y631-F635 AromaticContact CE1-CD2 3.94Å; Y631-F635 HydrophobicContact CE1-CD2 3.94Å; Y631-F635 HydrophobicContact CE1-CG 4.38Å; Y631-F635 AromaticContact CE2-CD2 3.76Å; Y631-F635 HydrophobicContact CE2-CD2 3.76Å; Y631-F635 HydrophobicContact CE2-CE2 4.04Å; Y631-F635 HydrophobicContact CG-CD2 4.06Å; Y631-F635 AromaticContact CZ-CD2 3.76Å; Y631-F635 PolarHBondContact O-N 3.33Å; Y631-E636 HydrophobicContact CD1-CG 4.29Å; Y631-E636 HydrophobicContact CE1-CG 4.22Å; Y631-Y696 AromaticContact CD1-CD1 3.64Å; Y631-Y696 HydrophobicContact CD1-CD1 3.64Å; Y631-Y696 AromaticContact CD1-CE1 3.74Å; Y631-Y696 HydrophobicContact CD1-CE1 3.74Å; Y631-Y696 AromaticContact CG-CD1 3.68Å; Y631-Y696 HydrophobicContact CG-CD1 3.68Å; Y631-Y696 HydrophobicContact CG-CE1 4.12Å; Y631-Y696 HydrophobicContact CG-CG 4.41Å; Y631-H700 AromaticContact CD1-CD2 3.94Å; Y631-H700 AromaticContact CD1-NE2 3.77Å; Y631-H700 HydrophobicContact CD2-CB 4.49Å; Y631-H700 AromaticContact CE1-CD2 3.68Å; Y631-H700 AromaticContact CE1-CE1 3.42Å; Y631-H700 VanDerWaalsContact CE1-CE1 3.42Å; Y631-H700 WeakPolarHBondContact CE1-CE1 3.29Å; Y631-H700 AromaticContact CE1-CG 3.9Å; Y631-H700 AromaticContact CE1-ND1 3.77Å; Y631-H700 AromaticContact CE1-NE2 3.38Å; Y631-H700 WeakPolarHBondContact CE1-NE2 3.2Å; Y631-H700 HydrophobicContact CE2-CB 3.77Å; Y631-H700 AromaticContact CE2-CD2 3.83Å; Y631-H700 AromaticContact CE2-CG 3.58Å; Y631-H700 AromaticContact CZ-CD2 3.62Å; Y631-H700 AromaticContact CZ-CE1 3.53Å; Y631-H700 AromaticContact CZ-CG 3.38Å; Y631-H700 AromaticContact CZ-ND1 3.35Å; Y631-H700 VanDerWaalsContact CZ-ND1 3.35Å; Y631-H700 AromaticContact CZ-NE2 3.72Å; Y631-H700 PolarHBondContact OH-CE1 3.38Å; Y631-H700 PolarHBondContact OH-ND1 3.38Å; Y631-E703 PolarHBondContact OH-OE2 3.03Å
632	D	95.6	Very high	95.1	Very high	30 Å²	30	25.1 Å²	25.1	16%	0.16	15%	0.152	C	C	.	.	H	α-helix	trans	-58	-41.2	174.6	47.2	-0.9	0	0	0	113.7	F630 L634 E636 I637 R672 R692 Y696	F630-D632 VanDerWaalsContact C-N 3.33Å; F630-D632 PolarHBondContact O-N 2.96Å; D632-L634 VanDerWaalsContact C-N 3.34Å; D632-E636 HydrophobicContact CB-CB 4.45Å; D632-E636 CarbonylContact O-C 3.57Å; D632-E636 WeakPolarHBondContact O-CA 3.49Å; D632-E636 PolarHBondContact O-N 3.13Å; D632-I637 PolarHBondContact O-N 3.42Å; D632-R672 VanDerWaalsContact CG-NH2 3.29Å; D632-R672 IonicContact OD1-CZ 3.61Å; D632-R672 IonicContact OD1-NH1 3.68Å; D632-R672 PolarHBondContact OD1-NH1 3.07Å; D632-R672 IonicContact OD1-NH2 2.68Å; D632-R672 PolarHBondContact OD1-NH2 3.38Å; D632-R672 VanDerWaalsContact OD1-NH2 3.08Å; D632-R672 IonicContact OD2-CZ 3.37Å; D632-R672 IonicContact OD2-NH1 3.68Å; D632-R672 IonicContact OD2-NH2 3.38Å; D632-R672 PolarHBondContact OD2-NH2 2.94Å; D632-R692 VanDerWaalsContact CG-NH1 3.34Å; D632-R692 IonicContact OD1-NH1 2.83Å; D632-R692 PolarHBondContact OD1-NH1 2.91Å; D632-R692 IonicContact OD2-CZ 3.08Å; D632-R692 IonicContact OD2-NH1 3.43Å; D632-R692 PolarHBondContact OD2-NH1 2.96Å; D632-R692 IonicContact OD2-NH2 2.66Å; D632-R692 PolarHBondContact OD2-NH2 3.33Å; D632-Y696 WeakPolarHBondContact CB-OH 3.27Å
633	I	96.6	Very high	95	Very high	5 Å²	5	25.2 Å²	25.2	3%	0.026	15%	0.152	C	C	.	.	H	α-helix	trans	-71.8	-32.8	178.6	-63.8	172.3	0	0	0	111	F630 Y631 R665 L668 I669 R672	F630-I633 HydrophobicContact CD1-CB 4.45Å; F630-I633 HydrophobicContact CD1-CD1 3.76Å; F630-I633 HydrophobicContact CE1-CD1 4.21Å; F630-I633 WeakPolarHBondContact O-CA 3.29Å; F630-I633 WeakPolarHBondContact O-CB 3.44Å; F630-I633 PolarHBondContact O-N 2.78Å; Y631-I633 VanDerWaalsContact C-N 3.34Å; Y631-I633 PolarHBondContact O-N 3.43Å; I633-R665 HydrophobicContact CG2-CB 4.28Å; I633-R665 HydrophobicContact CG2-CG 4.46Å; I633-R665 WeakPolarHBondContact O-CD 3.42Å; I633-R665 PolarHBondContact O-NE 2.95Å; I633-L668 HydrophobicContact CD1-CB 4.19Å; I633-L668 HydrophobicContact CG1-CB 4.28Å; I633-I669 HydrophobicContact CG2-CG1 3.93Å; I633-R672 HydrophobicContact CD1-CB 3.79Å; I633-R672 HydrophobicContact CD1-CG 4.15Å
634	L	96.2	Very high	95	Very high	6 Å²	6	24.9 Å²	24.9	3%	0.031	15%	0.151	C	C	.	.	H	α-helix	trans	-75.2	-45.9	-179.7	-72	166.7	0	0	0	111.9	F626 F630 Y631 D632 F645 L656 F661	F626-L634 HydrophobicContact CE1-CD1 4.22Å; F626-L634 HydrophobicContact CE1-CD2 4.17Å; F626-L634 HydrophobicContact CZ-CD2 4.38Å; F630-L634 HydrophobicContact CB-CD1 4.18Å; F630-L634 HydrophobicContact CB-CG 4.28Å; F630-L634 WeakPolarHBondContact O-CG 3.47Å; F630-L634 PolarHBondContact O-N 3.27Å; Y631-L634 PolarHBondContact O-N 3.05Å; Y631-L634 VanDerWaalsContact O-N 3.15Å; D632-L634 VanDerWaalsContact C-N 3.34Å; L634-F645 WeakPolarHBondContact O-CZ 3.35Å; L634-L656 HydrophobicContact CD2-CD1 4.25Å; L634-F661 HydrophobicContact CD2-CE2 3.84Å; L634-F661 HydrophobicContact CD2-CZ 3.63Å
635	F	95.8	Very high	94.9	Very high	6 Å²	6	25 Å²	25	3%	0.026	15%	0.151	C	C	.	.	H	α-helix	trans	-123	-31.3	-165.7	-57.4	-70.4	0	0	0	114.7	P246 Y248 Y631 F645 C705	P246-F635 HydrophobicContact CB-CB 4.37Å; P246-F635 HydrophobicContact CB-CD1 3.58Å; P246-F635 HydrophobicContact CB-CD2 4.29Å; P246-F635 HydrophobicContact CB-CE1 3.85Å; P246-F635 HydrophobicContact CB-CG 3.82Å; P246-F635 HydrophobicContact CB-CZ 4.33Å; P246-F635 HydrophobicContact CG-CD1 4.01Å; P246-F635 HydrophobicContact CG-CE1 3.73Å; P246-F635 HydrophobicContact CG-CE2 4.26Å; P246-F635 HydrophobicContact CG-CG 4.4Å; P246-F635 HydrophobicContact CG-CZ 3.88Å; Y248-F635 WeakPolarHBondContact CB-O 3.35Å; Y248-F635 HydrophobicContact CD1-CD1 4.14Å; Y631-F635 HydrophobicContact CD1-CB 4.49Å; Y631-F635 HydrophobicContact CD1-CD2 4.12Å; Y631-F635 AromaticContact CD2-CD2 3.9Å; Y631-F635 HydrophobicContact CD2-CD2 3.9Å; Y631-F635 HydrophobicContact CD2-CE2 4.16Å; Y631-F635 HydrophobicContact CE1-CB 4.05Å; Y631-F635 AromaticContact CE1-CD2 3.94Å; Y631-F635 HydrophobicContact CE1-CD2 3.94Å; Y631-F635 HydrophobicContact CE1-CG 4.38Å; Y631-F635 AromaticContact CE2-CD2 3.76Å; Y631-F635 HydrophobicContact CE2-CD2 3.76Å; Y631-F635 HydrophobicContact CE2-CE2 4.04Å; Y631-F635 HydrophobicContact CG-CD2 4.06Å; Y631-F635 AromaticContact CZ-CD2 3.76Å; Y631-F635 PolarHBondContact O-N 3.33Å; F635-F645 AromaticContact CD1-CE1 3.99Å; F635-F645 HydrophobicContact CD1-CE1 3.99Å; F635-F645 AromaticContact CD1-CZ 3.71Å; F635-F645 HydrophobicContact CD1-CZ 3.71Å; F635-F645 HydrophobicContact CE1-CE1 4.34Å; F635-F645 HydrophobicContact CE1-CZ 4.38Å; F635-C705 HydrophobicContact CZ-CB 4.47Å
636	E	94.7	Very high	94.6	Very high	96 Å²	96	25.1 Å²	25.1	45%	0.449	15%	0.151	S	C	.	.			trans	-103.4	7.3	-170.2	-51.7	-173.8	150.5	0	0	114.5	Y631 D632 S638 H700	Y631-E636 HydrophobicContact CD1-CG 4.29Å; Y631-E636 HydrophobicContact CE1-CG 4.22Å; D632-E636 HydrophobicContact CB-CB 4.45Å; D632-E636 CarbonylContact O-C 3.57Å; D632-E636 WeakPolarHBondContact O-CA 3.49Å; D632-E636 PolarHBondContact O-N 3.13Å; E636-S638 PolarHBondContact O-N 3.23Å; E636-H700 IonicContact OE1-NE2 3.64Å
637	I	92.6	Very high	94.2	Very high	28 Å²	28	25 Å²	25	14%	0.144	15%	0.151	C	C	.	.			trans	-59.7	130.2	-178.7	-173.1	168.3	0	0	0	111.7	D632 P639 S640 R665 L668	D632-I637 PolarHBondContact O-N 3.42Å; I637-P639 CarbonylContact O-C 3.55Å; I637-S640 WeakPolarHBondContact O-CA 3.38Å; I637-S640 PolarHBondContact O-N 2.62Å; I637-S640 VanDerWaalsContact O-N 3.13Å; I637-R665 HydrophobicContact CD1-CG 3.77Å; I637-L668 HydrophobicContact CD1-CD1 3.57Å; I637-L668 HydrophobicContact CG1-CD1 4.14Å
638	S	89.5	Confident	93.8	Very high	114 Å²	114	31.9 Å²	31.9	80%	0.797	18%	0.177	S	C	*	.	S	Bend	trans	-130.9	123.7	-178.4	-170.5	0	0	0	0	111.9	E636	E636-S638 PolarHBondContact O-N 3.23Å
639	P	90.5	Very high	93.6	Very high	117 Å²	117	33.8 Å²	33.8	76%	0.76	18%	0.184	S	C	*	.	S	Bend	cis	-69.7	141.7	-6.6	30.3	-34.2	0	0	0	111.4	I637	I637-P639 CarbonylContact O-C 3.55Å
640	S	89.5	Confident	93.4	Very high	20 Å²	20	33.9 Å²	33.9	14%	0.14	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-62.1	136.1	173.6	177.2	0	0	0	0	110.4	I637	I637-S640 WeakPolarHBondContact O-CA 3.38Å; I637-S640 PolarHBondContact O-N 2.62Å; I637-S640 VanDerWaalsContact O-N 3.13Å
641	P	93.6	Very high	93.2	Very high	21 Å²	21	34.2 Å²	34.2	14%	0.136	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-51	142.2	168	-25.8	35.1	0	0	0	110.3	V644	P641-V644 HydrophobicContact CB-CG1 3.79Å; P641-V644 HydrophobicContact CB-CG2 4.32Å; P641-V644 VanDerWaalsContact O-CG2 3.28Å; P641-V644 WeakPolarHBondContact O-CG2 3.22Å
642	P	94.5	Very high	93.1	Very high	57 Å²	57	34.6 Å²	34.6	37%	0.37	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	151.4	-178.6	28.7	-34.9	0	0	0	111.1	K253 V644	K253-P642 HydrophobicContact CB-CB 4.12Å; K253-P642 HydrophobicContact CD-CB 3.6Å; K253-P642 HydrophobicContact CD-CG 4.39Å; K253-P642 HydrophobicContact CG-CB 3.76Å; P642-V644 PolarHBondContact O-N 3.23Å
643	D	94.8	Very high	93.1	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.016	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.8	-10.1	174.5	-58.4	-56.4	0	0	0	117.3	N251 R252 K253 S254 F316 L317 F645 Y646	N251-D643 PolarHBondContact O-N 3.19Å; R252-D643 WeakPolarHBondContact CA-OD1 3.27Å; K253-D643 PolarHBondContact N-OD1 2.78Å; S254-D643 VanDerWaalsContact CB-OD2 3.26Å; S254-D643 WeakPolarHBondContact CB-OD2 3.48Å; S254-D643 PolarHBondContact N-OD1 2.8Å; S254-D643 PolarHBondContact N-OD2 2.87Å; S254-D643 VanDerWaalsContact N-OD2 3.15Å; S254-D643 PolarHBondContact OG-OD2 3.24Å; F316-D643 HydrophobicContact CE2-CB 3.86Å; F316-D643 WeakPolarHBondContact CE2-O 3.43Å; F316-D643 HydrophobicContact CZ-CB 4Å; L317-D643 HydrophobicContact CD1-CB 3.9Å; L317-D643 HydrophobicContact CG-CB 4.48Å; D643-F645 VanDerWaalsContact C-N 3.31Å; D643-F645 PolarHBondContact O-N 3.34Å; D643-Y646 HydrophobicContact CB-CD2 4.36Å
644	V	95.5	Very high	93	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.006	18%	0.183	C	C	.	.	S	Bend	trans	-67	-34	-178.3	-55.6	0	0	0	0	112.2	F316 P641 P642 Q650 P653 L654 D655	F316-V644 HydrophobicContact CE1-CG1 4.36Å; F316-V644 HydrophobicContact CZ-CG1 4.01Å; P641-V644 HydrophobicContact CB-CG1 3.79Å; P641-V644 HydrophobicContact CB-CG2 4.32Å; P641-V644 VanDerWaalsContact O-CG2 3.28Å; P641-V644 WeakPolarHBondContact O-CG2 3.22Å; P642-V644 PolarHBondContact O-N 3.23Å; V644-Q650 PolarHBondContact O-NE2 3.48Å; V644-P653 HydrophobicContact CB-CB 4.09Å; V644-P653 HydrophobicContact CG2-CB 4.31Å; V644-L654 WeakPolarHBondContact O-CG 3.35Å; V644-L654 PolarHBondContact O-N 3.3Å; V644-D655 HydrophobicContact CG1-CB 4.03Å; V644-D655 VanDerWaalsContact CG1-CG 3.47Å; V644-D655 WeakPolarHBondContact CG1-OD2 3.41Å
645	F	94.5	Very high	92.9	Very high	1 Å²	1	33 Å²	33	0%	0.004	18%	0.182	C	C	.	.			trans	-110.6	102.1	167.8	-64.9	-66.2	0	0	0	108.7	Y248 V250 N251 L634 F635 D643 Q650 P653	Y248-F645 AromaticContact CD1-CD1 3.73Å; Y248-F645 HydrophobicContact CD1-CD1 3.73Å; Y248-F645 AromaticContact CD1-CE1 3.54Å; Y248-F645 HydrophobicContact CD1-CE1 3.54Å; Y248-F645 HydrophobicContact CD1-CG 4.31Å; Y248-F645 AromaticContact CD1-CZ 3.98Å; Y248-F645 HydrophobicContact CD1-CZ 3.98Å; Y248-F645 HydrophobicContact CD2-CB 3.48Å; Y248-F645 VanDerWaalsContact CD2-CB 3.48Å; Y248-F645 AromaticContact CD2-CD1 3.4Å; Y248-F645 HydrophobicContact CD2-CD1 3.4Å; Y248-F645 AromaticContact CD2-CD2 3.92Å; Y248-F645 HydrophobicContact CD2-CD2 3.92Å; Y248-F645 HydrophobicContact CD2-CE1 4.07Å; Y248-F645 AromaticContact CD2-CG 3.31Å; Y248-F645 HydrophobicContact CD2-CG 3.31Å; Y248-F645 AromaticContact CE1-CD1 3.87Å; Y248-F645 HydrophobicContact CE1-CD1 3.87Å; Y248-F645 AromaticContact CE1-CE1 3.86Å; Y248-F645 HydrophobicContact CE1-CE1 3.86Å; Y248-F645 HydrophobicContact CE2-CB 3.77Å; Y248-F645 AromaticContact CE2-CD1 3.55Å; Y248-F645 HydrophobicContact CE2-CD1 3.55Å; Y248-F645 HydrophobicContact CE2-CE1 4.35Å; Y248-F645 AromaticContact CE2-CG 3.81Å; Y248-F645 HydrophobicContact CE2-CG 3.81Å; Y248-F645 HydrophobicContact CG-CB 4.28Å; Y248-F645 AromaticContact CG-CD1 3.5Å; Y248-F645 HydrophobicContact CG-CD1 3.5Å; Y248-F645 AromaticContact CG-CD2 3.86Å; Y248-F645 HydrophobicContact CG-CD2 3.86Å; Y248-F645 AromaticContact CG-CE1 3.66Å; Y248-F645 HydrophobicContact CG-CE1 3.66Å; Y248-F645 HydrophobicContact CG-CE2 4.01Å; Y248-F645 AromaticContact CG-CG 3.61Å; Y248-F645 HydrophobicContact CG-CG 3.61Å; Y248-F645 AromaticContact CG-CZ 3.92Å; Y248-F645 HydrophobicContact CG-CZ 3.92Å; Y248-F645 AromaticContact CZ-CD1 3.8Å; V250-F645 WeakPolarHBondContact CA-O 3.34Å; N251-F645 PolarHBondContact N-O 3.13Å; L634-F645 WeakPolarHBondContact O-CZ 3.35Å; F635-F645 AromaticContact CD1-CE1 3.99Å; F635-F645 HydrophobicContact CD1-CE1 3.99Å; F635-F645 AromaticContact CD1-CZ 3.71Å; F635-F645 HydrophobicContact CD1-CZ 3.71Å; F635-F645 HydrophobicContact CE1-CE1 4.34Å; F635-F645 HydrophobicContact CE1-CZ 4.38Å; D643-F645 VanDerWaalsContact C-N 3.31Å; D643-F645 PolarHBondContact O-N 3.34Å; F645-Q650 HydrophobicContact CD1-CB 4.3Å; F645-P653 HydrophobicContact CE1-CB 3.92Å; F645-P653 HydrophobicContact CE2-CB 4.2Å; F645-P653 HydrophobicContact CZ-CB 3.7Å; F645-P653 HydrophobicContact CZ-CG 4.26Å
646	Y	90.9	Very high	92.9	Very high	7 Å²	7	32.9 Å²	32.9	3%	0.027	18%	0.181	C	C	.	.			trans	-101.4	-17.4	-176.4	-146.4	-86.3	0	0	0	112.3	F47 L209 R252 S254 I256 L317 D643	F47-Y646 HydrophobicContact CZ-CE1 4.44Å; L209-Y646 HydrophobicContact CB-CD1 3.58Å; L209-Y646 HydrophobicContact CB-CE1 3.66Å; L209-Y646 HydrophobicContact CD1-CE1 3.97Å; L209-Y646 HydrophobicContact CG-CE1 4.47Å; L209-Y646 WeakPolarHBondContact O-CD1 3.37Å; R252-Y646 HydrophobicContact CB-CE2 4.19Å; R252-Y646 HydrophobicContact CG-CD1 4.22Å; R252-Y646 HydrophobicContact CG-CD2 4Å; R252-Y646 HydrophobicContact CG-CE1 4.15Å; R252-Y646 HydrophobicContact CG-CE2 3.92Å; R252-Y646 HydrophobicContact CG-CG 4.15Å; R252-Y646 PolarHBondContact NE-O 3.32Å; R252-Y646 PolarHBondContact NH2-O 3.42Å; S254-Y646 PolarHBondContact O-OH 3.1Å; I256-Y646 HydrophobicContact CD1-CE1 4.1Å; I256-Y646 HydrophobicContact CD1-CE2 4.05Å; L317-Y646 HydrophobicContact CD1-CE2 4.28Å; L317-Y646 HydrophobicContact CD2-CD2 4.2Å; L317-Y646 HydrophobicContact CD2-CE2 4.46Å; D643-Y646 HydrophobicContact CB-CD2 4.36Å
647	S	89.6	Confident	92.7	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.014	16%	0.162	C	C	.	.	S	Bend	trans	-145.5	160	171.8	74.9	0	0	0	0	112.2	L209 S211 Y248 R649	L209-S647 WeakPolarHBondContact O-CB 3.31Å; S211-S647 PolarHBondContact N-OG 3.47Å; Y248-S647 WeakPolarHBondContact CE2-O 3.33Å; Y248-S647 PolarHBondContact OH-O 3.19Å; S647-R649 PolarHBondContact O-N 3.21Å; S647-R649 VanDerWaalsContact O-N 3.16Å; S647-R649 PolarHBondContact OG-N 3.14Å
648	Y	89.1	Confident	92.6	Very high	154 Å²	154	27.8 Å²	27.8	60%	0.604	16%	0.158	S	C	*	.	S	Bend	trans	-74	7	175.1	-57.1	-73.4	0	0	0	114.3	Y248 V250	Y248-Y648 WeakPolarHBondContact OH-CA 3.28Å; Y248-Y648 PolarHBondContact OH-O 2.73Å; V250-Y648 HydrophobicContact CB-CE1 4.07Å; V250-Y648 HydrophobicContact CG2-CD1 3.58Å; V250-Y648 HydrophobicContact CG2-CD2 4.35Å; V250-Y648 HydrophobicContact CG2-CE1 3.55Å; V250-Y648 HydrophobicContact CG2-CE2 4.32Å; V250-Y648 HydrophobicContact CG2-CG 4Å
649	R	91.8	Very high	92.5	Very high	39 Å²	39	23.6 Å²	23.6	15%	0.147	13%	0.126	C	C	.	.			trans	-125	44.5	-176.2	-62.8	-179.4	-59.3	-75	-7.3	111.2	T207 S208 S211 E212 E231 M235 F245 Y248 S647	T207-R649 PolarHBondContact O-NH2 3.24Å; T207-R649 VanDerWaalsContact O-NH2 3.11Å; S208-R649 PolarHBondContact OG-NH2 3.49Å; S211-R649 WeakPolarHBondContact CA-O 3.44Å; E212-R649 PolarHBondContact N-O 2.99Å; E231-R649 IonicContact OE1-CZ 2.62Å; E231-R649 IonicContact OE1-NE 3.51Å; E231-R649 PolarHBondContact OE1-NE 3.21Å; E231-R649 IonicContact OE1-NH2 3.64Å; E231-R649 PolarHBondContact OE1-NH2 2.88Å; E231-R649 VanDerWaalsContact OE1-NH2 3.08Å; M235-R649 VanDerWaalsContact CE-CZ 3.45Å; F245-R649 HydrophobicContact CD2-CB 4.18Å; F245-R649 HydrophobicContact CD2-CG 4.24Å; F245-R649 HydrophobicContact CE2-CB 3.81Å; F245-R649 HydrophobicContact CE2-CG 4.03Å; F245-R649 HydrophobicContact CZ-CB 4.02Å; Y248-R649 PolarHBondContact OH-N 3.08Å; S647-R649 PolarHBondContact O-N 3.21Å; S647-R649 VanDerWaalsContact O-N 3.16Å; S647-R649 PolarHBondContact OG-N 3.14Å
650	Q	92.8	Very high	92.6	Very high	3 Å²	3	20.3 Å²	20.3	1%	0.014	10%	0.101	C	C	.	.			trans	-107.8	127.8	178.4	-84.7	176.3	-124.9	0	0	110.4	G210 F245 Y248 V644 F645 A652	G210-Q650 WeakPolarHBondContact O-CG 3.39Å; F245-Q650 VanDerWaalsContact CD1-C 3.48Å; F245-Q650 WeakPolarHBondContact CD1-O 3.35Å; Y248-Q650 HydrophobicContact CE1-CB 4.36Å; Y248-Q650 WeakPolarHBondContact CE1-O 3.4Å; Y248-Q650 WeakPolarHBondContact OH-CA 3.21Å; Y248-Q650 VanDerWaalsContact OH-CB 3.28Å; Y248-Q650 WeakPolarHBondContact OH-CB 3.34Å; Y248-Q650 PolarHBondContact OH-N 2.98Å; Y248-Q650 PolarHBondContact OH-O 3.17Å; V644-Q650 PolarHBondContact O-NE2 3.48Å; F645-Q650 HydrophobicContact CD1-CB 4.3Å; Q650-A652 VanDerWaalsContact C-N 3.31Å; Q650-A652 PolarHBondContact NE2-O 2.77Å
651	S	93.2	Very high	92.9	Very high	8 Å²	8	19.4 Å²	19.4	6%	0.056	9%	0.094	C	C	.	.	S	Bend	trans	-85.4	-8.5	174.2	61.7	0	0	0	0	112.9	R704 C705 L706	S651-R704 WeakPolarHBondContact CA-O 3.46Å; S651-R704 WeakPolarHBondContact CB-O 3.43Å; S651-C705 CarbonylContact O-C 3.55Å; S651-L706 WeakPolarHBondContact O-CB 3.27Å; S651-L706 PolarHBondContact O-N 3.25Å
652	A	94.4	Very high	93.1	Very high	9 Å²	9	20.4 Å²	20.4	7%	0.074	10%	0.096	C	C	.	.	S	Bend	trans	-157.5	159.2	174.8	0	0	0	0	0	111.3	Q650 L656 L706	Q650-A652 VanDerWaalsContact C-N 3.31Å; Q650-A652 PolarHBondContact NE2-O 2.77Å; A652-L656 HydrophobicContact CB-CD2 3.88Å; A652-L706 HydrophobicContact CB-CB 4.02Å; A652-L706 HydrophobicContact CB-CD1 3.22Å; A652-L706 HydrophobicContact CB-CD2 4.21Å; A652-L706 HydrophobicContact CB-CG 3.95Å
653	P	95.3	Very high	93.1	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.107	C	C	.	.			trans	-64.2	140.6	167.7	29.8	-35.4	0	0	0	110.4	V644 F645 D655 L656 F661	V644-P653 HydrophobicContact CB-CB 4.09Å; V644-P653 HydrophobicContact CG2-CB 4.31Å; F645-P653 HydrophobicContact CE1-CB 3.92Å; F645-P653 HydrophobicContact CE2-CB 4.2Å; F645-P653 HydrophobicContact CZ-CB 3.7Å; F645-P653 HydrophobicContact CZ-CG 4.26Å; P653-D655 WeakPolarHBondContact CB-OD1 3.28Å; P653-D655 PolarHBondContact O-N 3.03Å; P653-L656 HydrophobicContact CG-CB 4.3Å; P653-L656 VanDerWaalsContact O-CB 3.3Å; P653-L656 WeakPolarHBondContact O-CB 3.49Å; P653-L656 PolarHBondContact O-N 3.39Å; P653-L656 VanDerWaalsContact O-N 3.14Å; P653-F661 HydrophobicContact CG-CD2 4.35Å; P653-F661 HydrophobicContact CG-CE2 4.17Å
654	L	94.1	Very high	93.1	Very high	5 Å²	5	26.6 Å²	26.6	3%	0.026	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-63.2	-28.5	-172.8	-70.4	179.8	0	0	0	113.4	Y215 F316 L317 F320 V644 L656	Y215-L654 HydrophobicContact CD2-CD2 4.07Å; F316-L654 HydrophobicContact CB-CB 4.27Å; F316-L654 VanDerWaalsContact CB-O 3.27Å; F316-L654 WeakPolarHBondContact CB-O 3.44Å; F316-L654 HydrophobicContact CD2-CB 3.52Å; F316-L654 HydrophobicContact CD2-CD1 4.27Å; F316-L654 HydrophobicContact CE2-CB 4.16Å; F316-L654 HydrophobicContact CG-CB 4.11Å; L317-L654 HydrophobicContact CD2-CD1 3.86Å; F320-L654 HydrophobicContact CE2-CD1 4.39Å; V644-L654 WeakPolarHBondContact O-CG 3.35Å; V644-L654 PolarHBondContact O-N 3.3Å; L654-L656 VanDerWaalsContact C-N 3.3Å; L654-L656 PolarHBondContact O-N 3.25Å
655	D	94.7	Very high	93.1	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.011	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-76.2	-12.7	179.9	67.1	-21	0	0	0	113.4	F316 V644 P653 F657 T658 F661 R665	F316-D655 HydrophobicContact CD1-CB 3.36Å; F316-D655 HydrophobicContact CE1-CB 3.62Å; F316-D655 HydrophobicContact CG-CB 4.02Å; F316-D655 HydrophobicContact CZ-CB 4.43Å; V644-D655 HydrophobicContact CG1-CB 4.03Å; V644-D655 VanDerWaalsContact CG1-CG 3.47Å; V644-D655 WeakPolarHBondContact CG1-OD2 3.41Å; P653-D655 WeakPolarHBondContact CB-OD1 3.28Å; P653-D655 PolarHBondContact O-N 3.03Å; D655-F657 PolarHBondContact O-N 3.26Å; D655-T658 PolarHBondContact O-N 2.77Å; D655-T658 PolarHBondContact O-OG1 3.33Å; D655-F661 HydrophobicContact CB-CB 4.36Å; D655-F661 WeakPolarHBondContact O-CB 3.5Å; D655-F661 WeakPolarHBondContact OD2-CA 3.4Å; D655-R665 IonicContact OD1-NH1 3.41Å; D655-R665 IonicContact OD1-NH2 3.45Å; D655-R665 IonicContact OD2-CZ 2.65Å; D655-R665 IonicContact OD2-NH1 2.95Å; D655-R665 PolarHBondContact OD2-NH1 3.26Å; D655-R665 IonicContact OD2-NH2 3.44Å
656	L	94.6	Very high	93.3	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.016	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-52.4	-27.6	-178.7	-177.2	60.2	0	0	0	113.4	L634 A652 P653 L654 F661 L706 Y742	L634-L656 HydrophobicContact CD2-CD1 4.25Å; A652-L656 HydrophobicContact CB-CD2 3.88Å; P653-L656 HydrophobicContact CG-CB 4.3Å; P653-L656 VanDerWaalsContact O-CB 3.3Å; P653-L656 WeakPolarHBondContact O-CB 3.49Å; P653-L656 PolarHBondContact O-N 3.39Å; P653-L656 VanDerWaalsContact O-N 3.14Å; L654-L656 VanDerWaalsContact C-N 3.3Å; L654-L656 PolarHBondContact O-N 3.25Å; L656-F661 HydrophobicContact CB-CD2 4.41Å; L656-F661 HydrophobicContact CD1-CD1 3.83Å; L656-F661 HydrophobicContact CD1-CD2 4.03Å; L656-F661 HydrophobicContact CD1-CE1 3.75Å; L656-F661 HydrophobicContact CD1-CE2 3.95Å; L656-F661 HydrophobicContact CD1-CG 3.98Å; L656-F661 HydrophobicContact CD1-CZ 3.82Å; L656-L706 HydrophobicContact CD2-CD1 4.3Å; L656-L706 HydrophobicContact CD2-CD2 3.26Å; L656-L706 HydrophobicContact CD2-CG 4.35Å; L656-Y742 HydrophobicContact CD1-CD2 3.91Å; L656-Y742 HydrophobicContact CD1-CG 3.93Å; L656-Y742 HydrophobicContact CD2-CD1 4.25Å; L656-Y742 HydrophobicContact CD2-CD2 4.16Å; L656-Y742 HydrophobicContact CD2-CE2 4.41Å; L656-Y742 HydrophobicContact CD2-CG 4.09Å; L656-Y742 HydrophobicContact CG-CD1 4.18Å; L656-Y742 HydrophobicContact CG-CD2 4.11Å; L656-Y742 HydrophobicContact CG-CG 3.76Å; L656-Y742 WeakPolarHBondContact O-CB 3.31Å
657	F	90.9	Very high	93.6	Very high	11 Å²	11	36.9 Å²	36.9	5%	0.048	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-95.4	7.6	-177.8	-57.3	-85.6	0	0	0	114.5	Y215 D655 L706 W707 Y742 R743	Y215-F657 HydrophobicContact CE1-CD2 4.11Å; Y215-F657 HydrophobicContact CE1-CE1 4.46Å; Y215-F657 AromaticContact CE1-CE2 3.68Å; Y215-F657 HydrophobicContact CE1-CE2 3.68Å; Y215-F657 AromaticContact CE1-CZ 3.86Å; Y215-F657 HydrophobicContact CE1-CZ 3.86Å; Y215-F657 AromaticContact CE2-CD2 3.83Å; Y215-F657 HydrophobicContact CE2-CD2 3.83Å; Y215-F657 HydrophobicContact CE2-CE2 4.04Å; Y215-F657 AromaticContact CZ-CD2 3.33Å; Y215-F657 AromaticContact CZ-CE2 3.38Å; Y215-F657 AromaticContact CZ-CG 3.81Å; Y215-F657 AromaticContact CZ-CZ 3.92Å; Y215-F657 WeakPolarHBondContact OH-CB 3.28Å; Y215-F657 WeakPolarHBondContact OH-CD1 3.49Å; Y215-F657 WeakPolarHBondContact OH-CD2 3.45Å; Y215-F657 VanDerWaalsContact OH-CE2 3.32Å; Y215-F657 WeakPolarHBondContact OH-CE2 3.45Å; Y215-F657 WeakPolarHBondContact OH-CG 3.09Å; D655-F657 PolarHBondContact O-N 3.26Å; F657-L706 HydrophobicContact CE2-CD1 4.2Å; F657-L706 HydrophobicContact CZ-CD1 3.72Å; F657-W707 AromaticContact CE1-CH2 3.26Å; F657-W707 HydrophobicContact CE1-CH2 3.26Å; F657-W707 AromaticContact CE1-CZ3 3.31Å; F657-W707 HydrophobicContact CE1-CZ3 3.31Å; F657-W707 AromaticContact CZ-CH2 3.32Å; F657-W707 HydrophobicContact CZ-CH2 3.32Å; F657-W707 AromaticContact CZ-CZ3 3.29Å; F657-W707 HydrophobicContact CZ-CZ3 3.29Å; F657-Y742 HydrophobicContact CD1-CD1 4.17Å; F657-Y742 AromaticContact CE1-CD1 3.83Å; F657-Y742 HydrophobicContact CE1-CD1 3.83Å; F657-Y742 HydrophobicContact CE1-CE1 4.19Å; F657-R743 HydrophobicContact CB-CB 4.26Å; F657-R743 HydrophobicContact CD1-CB 4.32Å; F657-R743 WeakPolarHBondContact O-CD 3.44Å
658	T	90.6	Very high	94	Very high	7 Å²	7	41 Å²	41	4%	0.043	20%	0.198	C	C	.	.	S	Bend	trans	-123.1	166.9	179.2	65	0	0	0	0	110.2	Q315 F316 D655 E660	Q315-T658 HydrophobicContact CB-CG2 4.05Å; Q315-T658 HydrophobicContact CG-CG2 3.87Å; Q315-T658 VanDerWaalsContact OE1-CB 3.31Å; F316-T658 HydrophobicContact CB-CG2 3.8Å; D655-T658 PolarHBondContact O-N 2.77Å; D655-T658 PolarHBondContact O-OG1 3.33Å; T658-E660 PolarHBondContact O-N 3Å
659	D	88.7	Confident	94.4	Very high	26 Å²	26	33.6 Å²	33.6	14%	0.139	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-18.2	178.9	-64.8	-25.1	0	0	0	111.5	R423 F661 Q663	R423-D659 IonicContact CZ-OD1 2.89Å; R423-D659 IonicContact NH1-OD1 3.75Å; R423-D659 IonicContact NH2-OD1 3.33Å; R423-D659 PolarHBondContact NH2-OD1 3.15Å; R423-D659 IonicContact NH2-OD2 3.75Å; R423-D659 PolarHBondContact NH2-OD2 3.41Å; D659-F661 VanDerWaalsContact C-N 3.3Å; D659-F661 PolarHBondContact O-N 3.14Å; D659-Q663 VanDerWaalsContact O-CG 3.3Å; D659-Q663 WeakPolarHBondContact O-CG 3.39Å; D659-Q663 PolarHBondContact O-N 2.88Å
660	E	92.5	Very high	94.8	Very high	47 Å²	47	33.3 Å²	33.3	22%	0.22	17%	0.171	C	C	.	.	H	α-helix	trans	-65.4	-27.6	179.5	-63.9	168.6	164.4	0	0	112.6	Q315 F316 T658 Q663 S664	Q315-E660 WeakPolarHBondContact CB-OE1 3.46Å; Q315-E660 PolarHBondContact N-OE1 3.48Å; Q315-E660 PolarHBondContact N-OE2 3.38Å; Q315-E660 VanDerWaalsContact N-OE2 3.12Å; F316-E660 WeakPolarHBondContact CD1-OE2 3.32Å; F316-E660 WeakPolarHBondContact CE1-OE2 3.46Å; T658-E660 PolarHBondContact O-N 3Å; E660-Q663 PolarHBondContact O-N 3.47Å; E660-S664 VanDerWaalsContact O-CB 3.28Å; E660-S664 WeakPolarHBondContact O-CB 3.43Å; E660-S664 PolarHBondContact O-N 3.35Å; E660-S664 PolarHBondContact O-OG 3.35Å
661	F	95.8	Very high	95	Very high	1 Å²	1	35.8 Å²	35.8	0%	0.004	19%	0.192	C	C	.	.	H	α-helix	trans	-60.9	-51	177.7	171.8	-97.9	0	0	0	112.4	L634 P653 D655 L656 D659 S664 R665 I669 A739	L634-F661 HydrophobicContact CD2-CE2 3.84Å; L634-F661 HydrophobicContact CD2-CZ 3.63Å; P653-F661 HydrophobicContact CG-CD2 4.35Å; P653-F661 HydrophobicContact CG-CE2 4.17Å; D655-F661 HydrophobicContact CB-CB 4.36Å; D655-F661 WeakPolarHBondContact O-CB 3.5Å; D655-F661 WeakPolarHBondContact OD2-CA 3.4Å; L656-F661 HydrophobicContact CB-CD2 4.41Å; L656-F661 HydrophobicContact CD1-CD1 3.83Å; L656-F661 HydrophobicContact CD1-CD2 4.03Å; L656-F661 HydrophobicContact CD1-CE1 3.75Å; L656-F661 HydrophobicContact CD1-CE2 3.95Å; L656-F661 HydrophobicContact CD1-CG 3.98Å; L656-F661 HydrophobicContact CD1-CZ 3.82Å; D659-F661 VanDerWaalsContact C-N 3.3Å; D659-F661 PolarHBondContact O-N 3.14Å; F661-S664 PolarHBondContact O-OG 3.06Å; F661-S664 VanDerWaalsContact O-OG 3.1Å; F661-R665 PolarHBondContact O-N 3.28Å; F661-I669 HydrophobicContact CD1-CD1 4.3Å; F661-I669 HydrophobicContact CE1-CD1 3.82Å; F661-I669 HydrophobicContact CZ-CD1 4.35Å; F661-A739 VanDerWaalsContact CD1-O 3.29Å; F661-A739 WeakPolarHBondContact CD1-O 3.48Å
662	Y	96.2	Very high	95.2	Very high	43 Å²	43	36.7 Å²	36.7	17%	0.169	19%	0.194	C	C	.	.	H	α-helix	trans	-66.4	-43.6	177.1	178.1	-108.5	0	0	0	111.1	S664 R665 K666 I669 D670 T740	Y662-S664 PolarHBondContact O-N 3.08Å; Y662-R665 CarbonylContact O-C 3.53Å; Y662-R665 PolarHBondContact O-N 2.85Å; Y662-K666 HydrophobicContact CE1-CD 4.27Å; Y662-K666 HydrophobicContact CE1-CG 4.21Å; Y662-K666 WeakPolarHBondContact O-CA 3.47Å; Y662-K666 WeakPolarHBondContact O-CB 3.39Å; Y662-K666 PolarHBondContact O-N 3.34Å; Y662-K666 PolarHBondContact OH-NZ 3.42Å; Y662-I669 HydrophobicContact CD2-CB 4.26Å; Y662-I669 HydrophobicContact CD2-CD1 3.86Å; Y662-I669 HydrophobicContact CD2-CG2 3.87Å; Y662-I669 HydrophobicContact CE2-CB 4.17Å; Y662-I669 HydrophobicContact CE2-CG2 3.71Å; Y662-D670 WeakPolarHBondContact CE2-OD1 3.2Å; Y662-D670 VanDerWaalsContact OH-CG 3.25Å; Y662-D670 PolarHBondContact OH-OD1 2.78Å; Y662-D670 PolarHBondContact OH-OD2 2.68Å; Y662-D670 VanDerWaalsContact OH-OD2 3.13Å; Y662-T740 HydrophobicContact CD1-CG2 4.28Å; Y662-T740 HydrophobicContact CD2-CG2 3.68Å; Y662-T740 HydrophobicContact CE1-CG2 4.36Å; Y662-T740 HydrophobicContact CE2-CG2 3.79Å; Y662-T740 HydrophobicContact CG-CG2 3.94Å
663	Q	94.4	Very high	95.4	Very high	131 Å²	131	36.2 Å²	36.2	61%	0.612	19%	0.19	S	C	*	.	H	α-helix	trans	-61.2	-44	-177.4	-70.4	172.6	4.3	0	0	112.4	D659 E660 R665	D659-Q663 VanDerWaalsContact O-CG 3.3Å; D659-Q663 WeakPolarHBondContact O-CG 3.39Å; D659-Q663 PolarHBondContact O-N 2.88Å; E660-Q663 PolarHBondContact O-N 3.47Å; Q663-R665 VanDerWaalsContact C-N 3.27Å; Q663-R665 PolarHBondContact O-N 2.65Å
664	S	95.2	Very high	95.6	Very high	59 Å²	59	42.6 Å²	42.6	41%	0.413	22%	0.22	S	C	.	.	H	α-helix	trans	-72.3	-18	-179.3	57.7	0	0	0	0	113.9	E660 F661 Y662	E660-S664 VanDerWaalsContact O-CB 3.28Å; E660-S664 WeakPolarHBondContact O-CB 3.43Å; E660-S664 PolarHBondContact O-N 3.35Å; E660-S664 PolarHBondContact O-OG 3.35Å; F661-S664 PolarHBondContact O-OG 3.06Å; F661-S664 VanDerWaalsContact O-OG 3.1Å; Y662-S664 PolarHBondContact O-N 3.08Å
665	R	96.9	Very high	95.7	Very high	3 Å²	3	44.8 Å²	44.8	1%	0.011	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.2	19.1	-177.4	-63.5	172.1	-175	76.3	-10.8	112.6	I633 I637 D655 F661 Y662 Q663 D667 L668 I669	I633-R665 HydrophobicContact CG2-CB 4.28Å; I633-R665 HydrophobicContact CG2-CG 4.46Å; I633-R665 WeakPolarHBondContact O-CD 3.42Å; I633-R665 PolarHBondContact O-NE 2.95Å; I637-R665 HydrophobicContact CD1-CG 3.77Å; D655-R665 IonicContact OD1-NH1 3.41Å; D655-R665 IonicContact OD1-NH2 3.45Å; D655-R665 IonicContact OD2-CZ 2.65Å; D655-R665 IonicContact OD2-NH1 2.95Å; D655-R665 PolarHBondContact OD2-NH1 3.26Å; D655-R665 IonicContact OD2-NH2 3.44Å; F661-R665 PolarHBondContact O-N 3.28Å; Y662-R665 CarbonylContact O-C 3.53Å; Y662-R665 PolarHBondContact O-N 2.85Å; Q663-R665 VanDerWaalsContact C-N 3.27Å; Q663-R665 PolarHBondContact O-N 2.65Å; R665-D667 PolarHBondContact O-N 3.21Å; R665-L668 PolarHBondContact O-N 3.35Å; R665-I669 HydrophobicContact CB-CD1 3.66Å; R665-I669 HydrophobicContact CB-CG1 4.02Å; R665-I669 WeakPolarHBondContact O-CB 3.38Å; R665-I669 WeakPolarHBondContact O-CG1 3.5Å; R665-I669 PolarHBondContact O-N 2.97Å
666	K	97.1	Very high	95.8	Very high	88 Å²	88	44.7 Å²	44.7	38%	0.383	23%	0.227	S	C	.	.	H	α-helix	trans	-53.6	-51.8	-167.4	177.1	168.9	172.1	47.1	0	112.5	Y662 L668 I669 D670	Y662-K666 HydrophobicContact CE1-CD 4.27Å; Y662-K666 HydrophobicContact CE1-CG 4.21Å; Y662-K666 WeakPolarHBondContact O-CA 3.47Å; Y662-K666 WeakPolarHBondContact O-CB 3.39Å; Y662-K666 PolarHBondContact O-N 3.34Å; Y662-K666 PolarHBondContact OH-NZ 3.42Å; K666-L668 PolarHBondContact O-N 3Å; K666-I669 PolarHBondContact O-N 3.1Å; K666-D670 IonicContact NZ-OD2 3.06Å; K666-D670 PolarHBondContact NZ-OD2 3.39Å; K666-D670 VanDerWaalsContact O-CB 3.29Å; K666-D670 WeakPolarHBondContact O-CB 3.46Å; K666-D670 VanDerWaalsContact O-CG 3.26Å; K666-D670 PolarHBondContact O-N 2.76Å
667	D	97.8	Very high	95.9	Very high	134 Å²	134	48.7 Å²	48.7	72%	0.717	25%	0.248	S	C	*	.	H	α-helix	trans	-64.7	-40.6	-175.8	-60	-30.4	0	0	0	111.7	R665 A671	R665-D667 PolarHBondContact O-N 3.21Å; D667-A671 WeakPolarHBondContact O-CB 3.36Å; D667-A671 PolarHBondContact O-N 2.99Å
668	L	97.9	Very high	96.1	Very high	87 Å²	87	51.9 Å²	51.9	46%	0.455	28%	0.277	S	S	.	.	H	α-helix	trans	-67.3	-44.7	177.5	-66.5	173.8	0	0	0	112	I633 I637 R665 K666 A671 R672	I633-L668 HydrophobicContact CD1-CB 4.19Å; I633-L668 HydrophobicContact CG1-CB 4.28Å; I637-L668 HydrophobicContact CD1-CD1 3.57Å; I637-L668 HydrophobicContact CG1-CD1 4.14Å; R665-L668 PolarHBondContact O-N 3.35Å; K666-L668 PolarHBondContact O-N 3Å; L668-A671 PolarHBondContact O-N 3.27Å; L668-R672 WeakPolarHBondContact O-CB 3.3Å; L668-R672 PolarHBondContact O-N 3.37Å
669	I	98.3	Very high	96.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65	-47.4	178.9	-69.9	168.7	0	0	0	109.9	F630 I633 F661 Y662 R665 K666 A671 R672 L673 A739	F630-I669 HydrophobicContact CE1-CG1 4.49Å; F630-I669 HydrophobicContact CE1-CG2 4.22Å; I633-I669 HydrophobicContact CG2-CG1 3.93Å; F661-I669 HydrophobicContact CD1-CD1 4.3Å; F661-I669 HydrophobicContact CE1-CD1 3.82Å; F661-I669 HydrophobicContact CZ-CD1 4.35Å; Y662-I669 HydrophobicContact CD2-CB 4.26Å; Y662-I669 HydrophobicContact CD2-CD1 3.86Å; Y662-I669 HydrophobicContact CD2-CG2 3.87Å; Y662-I669 HydrophobicContact CE2-CB 4.17Å; Y662-I669 HydrophobicContact CE2-CG2 3.71Å; R665-I669 HydrophobicContact CB-CD1 3.66Å; R665-I669 HydrophobicContact CB-CG1 4.02Å; R665-I669 WeakPolarHBondContact O-CB 3.38Å; R665-I669 WeakPolarHBondContact O-CG1 3.5Å; R665-I669 PolarHBondContact O-N 2.97Å; K666-I669 PolarHBondContact O-N 3.1Å; I669-A671 VanDerWaalsContact C-N 3.33Å; I669-A671 PolarHBondContact O-N 3.42Å; I669-R672 PolarHBondContact O-N 2.96Å; I669-L673 HydrophobicContact CG2-CD1 3.82Å; I669-L673 HydrophobicContact CG2-CG 4.3Å; I669-L673 WeakPolarHBondContact O-CB 3.37Å; I669-L673 VanDerWaalsContact O-CG 3.26Å; I669-L673 WeakPolarHBondContact O-CG 3.48Å; I669-L673 PolarHBondContact O-N 3.31Å; I669-A739 HydrophobicContact CD1-CB 4.39Å; I669-A739 HydrophobicContact CG2-CB 3.79Å
670	D	98.7	Very high	96.3	Very high	32 Å²	32	55.8 Å²	55.8	17%	0.171	30%	0.298	C	S	.	.	H	α-helix	trans	-63.9	-40.3	-179.8	-72.9	-10.7	0	0	0	111.2	Y662 K666 L673 Q674	Y662-D670 WeakPolarHBondContact CE2-OD1 3.2Å; Y662-D670 VanDerWaalsContact OH-CG 3.25Å; Y662-D670 PolarHBondContact OH-OD1 2.78Å; Y662-D670 PolarHBondContact OH-OD2 2.68Å; Y662-D670 VanDerWaalsContact OH-OD2 3.13Å; K666-D670 IonicContact NZ-OD2 3.06Å; K666-D670 PolarHBondContact NZ-OD2 3.39Å; K666-D670 VanDerWaalsContact O-CB 3.29Å; K666-D670 WeakPolarHBondContact O-CB 3.46Å; K666-D670 VanDerWaalsContact O-CG 3.26Å; K666-D670 PolarHBondContact O-N 2.76Å; D670-L673 PolarHBondContact O-N 2.82Å; D670-Q674 VanDerWaalsContact O-CG 3.32Å; D670-Q674 WeakPolarHBondContact O-CG 3.43Å; D670-Q674 PolarHBondContact O-N 3.33Å
671	A	98.2	Very high	96	Very high	55 Å²	55	59.5 Å²	59.5	46%	0.455	32%	0.315	S	S	.	.	H	α-helix	trans	-63.6	-43.4	173.7	0	0	0	0	0	112.3	D667 L668 I669 L673 Q674 W675	D667-A671 WeakPolarHBondContact O-CB 3.36Å; D667-A671 PolarHBondContact O-N 2.99Å; L668-A671 PolarHBondContact O-N 3.27Å; I669-A671 VanDerWaalsContact C-N 3.33Å; I669-A671 PolarHBondContact O-N 3.42Å; A671-L673 PolarHBondContact O-N 3.36Å; A671-Q674 PolarHBondContact O-N 3.45Å; A671-W675 WeakPolarHBondContact O-CB 3.05Å; A671-W675 PolarHBondContact O-N 2.9Å
672	R	97.7	Very high	95.3	Very high	27 Å²	27	64.1 Å²	64.1	10%	0.102	35%	0.348	C	S	.	.	H	α-helix	trans	-62.7	-42.4	176.2	-179.2	59.9	54.7	71.3	6.9	111.7	L629 F630 D632 I633 L668 I669 W675 L676	L629-R672 PolarHBondContact O-NH1 2.99Å; F630-R672 HydrophobicContact CD1-CB 4.47Å; F630-R672 HydrophobicContact CD1-CG 3.99Å; F630-R672 HydrophobicContact CD2-CG 4.29Å; F630-R672 HydrophobicContact CE1-CB 3.82Å; F630-R672 HydrophobicContact CE1-CG 3.52Å; F630-R672 HydrophobicContact CE2-CG 3.85Å; F630-R672 HydrophobicContact CG-CG 4.35Å; F630-R672 HydrophobicContact CZ-CB 4.05Å; F630-R672 HydrophobicContact CZ-CG 3.43Å; F630-R672 VanDerWaalsContact CZ-CG 3.43Å; D632-R672 VanDerWaalsContact CG-NH2 3.29Å; D632-R672 IonicContact OD1-CZ 3.61Å; D632-R672 IonicContact OD1-NH1 3.68Å; D632-R672 PolarHBondContact OD1-NH1 3.07Å; D632-R672 IonicContact OD1-NH2 2.68Å; D632-R672 PolarHBondContact OD1-NH2 3.38Å; D632-R672 VanDerWaalsContact OD1-NH2 3.08Å; D632-R672 IonicContact OD2-CZ 3.37Å; D632-R672 IonicContact OD2-NH1 3.68Å; D632-R672 IonicContact OD2-NH2 3.38Å; D632-R672 PolarHBondContact OD2-NH2 2.94Å; I633-R672 HydrophobicContact CD1-CB 3.79Å; I633-R672 HydrophobicContact CD1-CG 4.15Å; L668-R672 WeakPolarHBondContact O-CB 3.3Å; L668-R672 PolarHBondContact O-N 3.37Å; I669-R672 PolarHBondContact O-N 2.96Å; R672-W675 PolarHBondContact O-N 3.13Å; R672-L676 WeakPolarHBondContact O-CG 3.29Å; R672-L676 PolarHBondContact O-N 3.24Å
673	L	98.6	Very high	94.5	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-63.9	-42.4	176.3	-72.5	172.6	0	0	0	111.6	F630 I669 D670 A671 L676 L677 H732 C735 R736	F630-L673 HydrophobicContact CZ-CD2 3.92Å; F630-L673 HydrophobicContact CZ-CG 4.19Å; I669-L673 HydrophobicContact CG2-CD1 3.82Å; I669-L673 HydrophobicContact CG2-CG 4.3Å; I669-L673 WeakPolarHBondContact O-CB 3.37Å; I669-L673 VanDerWaalsContact O-CG 3.26Å; I669-L673 WeakPolarHBondContact O-CG 3.48Å; I669-L673 PolarHBondContact O-N 3.31Å; D670-L673 PolarHBondContact O-N 2.82Å; A671-L673 PolarHBondContact O-N 3.36Å; L673-L676 HydrophobicContact CD2-CD1 4.41Å; L673-L676 PolarHBondContact O-N 2.88Å; L673-L677 PolarHBondContact O-N 3.14Å; L673-H732 PolarHBondContact O-CD2 3.26Å; L673-H732 VanDerWaalsContact O-CD2 3.28Å; L673-C735 HydrophobicContact CD2-CB 4.06Å; L673-R736 HydrophobicContact CD1-CB 3.92Å; L673-R736 HydrophobicContact CD1-CG 4.03Å; L673-R736 HydrophobicContact CD2-CB 3.94Å
674	Q	98.2	Very high	93.5	Very high	133 Å²	133	65.8 Å²	65.8	62%	0.621	36%	0.364	S	S	*	.	H	α-helix	trans	-63.3	-43	174.2	-73.9	176.3	14	0	0	111.9	D670 A671 L676 L677 A678	D670-Q674 VanDerWaalsContact O-CG 3.32Å; D670-Q674 WeakPolarHBondContact O-CG 3.43Å; D670-Q674 PolarHBondContact O-N 3.33Å; A671-Q674 PolarHBondContact O-N 3.45Å; Q674-L676 VanDerWaalsContact C-N 3.33Å; Q674-L676 PolarHBondContact O-N 2.98Å; Q674-L677 PolarHBondContact O-N 3.22Å; Q674-L677 VanDerWaalsContact O-N 3.15Å; Q674-A678 PolarHBondContact O-N 3.09Å
675	W	96.8	Very high	92.7	Very high	51 Å²	51	69.4 Å²	69.4	19%	0.193	37%	0.374	C	S	.	.	H	α-helix	trans	-58.5	-44	174.8	171.4	80.7	0	0	0	111.6	A671 R672 L677 A678 V679 N687 L689 R692	A671-W675 WeakPolarHBondContact O-CB 3.05Å; A671-W675 PolarHBondContact O-N 2.9Å; R672-W675 PolarHBondContact O-N 3.13Å; W675-L677 PolarHBondContact O-N 3.44Å; W675-A678 CarbonylContact O-C 3.56Å; W675-A678 PolarHBondContact O-N 2.95Å; W675-V679 HydrophobicContact CD2-CG1 3.98Å; W675-V679 HydrophobicContact CE3-CG1 4.24Å; W675-V679 HydrophobicContact CH2-CG1 4.11Å; W675-V679 HydrophobicContact CZ2-CG1 3.8Å; W675-V679 HydrophobicContact CZ3-CG1 4.32Å; W675-V679 VanDerWaalsContact O-CG1 3.31Å; W675-V679 WeakPolarHBondContact O-CG1 3.42Å; W675-V679 PolarHBondContact O-N 2.94Å; W675-V679 VanDerWaalsContact O-N 3.12Å; W675-N687 WeakPolarHBondContact CZ2-O 3.49Å; W675-L689 HydrophobicContact CH2-CB 4.4Å; W675-L689 HydrophobicContact CH2-CD1 3.98Å; W675-L689 HydrophobicContact CZ3-CD1 4.33Å; W675-R692 HydrophobicContact CH2-CB 4.49Å
676	L	97.5	Very high	91.6	Very high	0 Å²	0	73.9 Å²	73.9	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-57.5	-32.7	176.7	-74.7	175.4	0	0	0	113.2	L629 F630 R672 L673 Q674 A678 V679 L689 F723 P728 C735	L629-L676 HydrophobicContact CD1-CD2 4.13Å; L629-L676 HydrophobicContact CD2-CD2 4.23Å; F630-L676 HydrophobicContact CE2-CD1 4Å; F630-L676 HydrophobicContact CZ-CD1 4.31Å; R672-L676 WeakPolarHBondContact O-CG 3.29Å; R672-L676 PolarHBondContact O-N 3.24Å; L673-L676 HydrophobicContact CD2-CD1 4.41Å; L673-L676 PolarHBondContact O-N 2.88Å; Q674-L676 VanDerWaalsContact C-N 3.33Å; Q674-L676 PolarHBondContact O-N 2.98Å; L676-A678 VanDerWaalsContact C-N 3.33Å; L676-V679 WeakPolarHBondContact O-CG2 3.26Å; L676-L689 HydrophobicContact CD2-CD1 4.37Å; L676-F723 HydrophobicContact CD2-CE2 3.94Å; L676-F723 HydrophobicContact CD2-CZ 4.29Å; L676-P728 WeakPolarHBondContact O-CB 3.46Å; L676-C735 HydrophobicContact CD1-CB 4.37Å
677	L	96.7	Very high	90.6	Very high	88 Å²	88	73.6 Å²	73.6	46%	0.461	41%	0.408	S	S	.	.	H	α-helix	trans	-78.2	-19.5	176.4	-69.5	173.5	0	0	0	113.2	L673 Q674 W675 H732	L673-L677 PolarHBondContact O-N 3.14Å; Q674-L677 PolarHBondContact O-N 3.22Å; Q674-L677 VanDerWaalsContact O-N 3.15Å; W675-L677 PolarHBondContact O-N 3.44Å; L677-H732 HydrophobicContact CD2-CB 3.72Å; L677-H732 HydrophobicContact CG-CB 4.09Å
678	A	94.9	Very high	90.3	Very high	78 Å²	78	67.5 Å²	67.5	65%	0.645	38%	0.376	S	S	*	.	H	α-helix	trans	-101.6	-2.9	-175.2	0	0	0	0	0	113.7	Q674 W675 L676	Q674-A678 PolarHBondContact O-N 3.09Å; W675-A678 CarbonylContact O-C 3.56Å; W675-A678 PolarHBondContact O-N 2.95Å; L676-A678 VanDerWaalsContact C-N 3.33Å
679	V	94.3	Very high	90.2	Very high	21 Å²	21	63.5 Å²	63.5	13%	0.127	36%	0.355	C	S	.	.			trans	-63.5	142.4	-179.7	-61.8	0	0	0	0	111.7	W675 L676 L689 F723 W724 P728	W675-V679 HydrophobicContact CD2-CG1 3.98Å; W675-V679 HydrophobicContact CE3-CG1 4.24Å; W675-V679 HydrophobicContact CH2-CG1 4.11Å; W675-V679 HydrophobicContact CZ2-CG1 3.8Å; W675-V679 HydrophobicContact CZ3-CG1 4.32Å; W675-V679 VanDerWaalsContact O-CG1 3.31Å; W675-V679 WeakPolarHBondContact O-CG1 3.42Å; W675-V679 PolarHBondContact O-N 2.94Å; W675-V679 VanDerWaalsContact O-N 3.12Å; L676-V679 WeakPolarHBondContact O-CG2 3.26Å; V679-L689 HydrophobicContact CG1-CB 4.41Å; V679-F723 HydrophobicContact CG2-CE1 3.85Å; V679-F723 HydrophobicContact CG2-CZ 3.87Å; V679-W724 HydrophobicContact CB-CH2 4.33Å; V679-W724 HydrophobicContact CG2-CH2 3.82Å; V679-W724 HydrophobicContact CG2-CZ3 4.3Å; V679-P728 HydrophobicContact CG2-CB 4.39Å; V679-P728 HydrophobicContact CG2-CG 4.16Å
680	D	89	Confident	90.1	Very high	94 Å²	94	65.4 Å²	65.4	50%	0.503	37%	0.371	S	S	.	.			trans	-118.9	139.9	175.2	-169.3	-31.9	0	0	0	109	S682 D683	D680-S682 PolarHBondContact O-N 3.32Å; D680-S682 PolarHBondContact OD1-N 3.25Å; D680-S682 PolarHBondContact OD1-OG 3.43Å; D680-S682 PolarHBondContact OD2-OG 3.44Å; D680-D683 HydrophobicContact CB-CB 4.45Å; D680-D683 WeakPolarHBondContact O-CB 3.01Å; D680-D683 PolarHBondContact O-N 3.31Å
681	Q	85	Confident	89.9	Confident	125 Å²	125	68.8 Å²	68.8	58%	0.584	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-24	179	-167.6	174.1	19.4	0	0	112.4	D683 W724	Q681-D683 VanDerWaalsContact C-N 3.31Å; Q681-W724 HydrophobicContact CB-CD2 4.23Å; Q681-W724 HydrophobicContact CB-CE3 4.29Å; Q681-W724 HydrophobicContact CB-CH2 3.81Å; Q681-W724 HydrophobicContact CB-CZ2 3.71Å; Q681-W724 HydrophobicContact CB-CZ3 4.09Å; Q681-W724 HydrophobicContact CG-CD2 4.1Å; Q681-W724 HydrophobicContact CG-CZ2 4.05Å; Q681-W724 VanDerWaalsContact N-CH2 3.27Å
682	S	82.6	Confident	89.8	Confident	98 Å²	98	67.6 Å²	67.6	69%	0.685	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-5.7	178.6	63.9	0	0	0	0	114.2	D680 D684	D680-S682 PolarHBondContact O-N 3.32Å; D680-S682 PolarHBondContact OD1-N 3.25Å; D680-S682 PolarHBondContact OD1-OG 3.43Å; D680-S682 PolarHBondContact OD2-OG 3.44Å; S682-D684 PolarHBondContact O-N 2.97Å
683	D	78.7	Confident	89.7	Confident	58 Å²	58	66.3 Å²	66.3	31%	0.31	36%	0.363	S	S	.	.			trans	-76.8	113.9	-179	-167.6	-4.2	0	0	0	111.1	D680 Q681 H685 S688	D680-D683 HydrophobicContact CB-CB 4.45Å; D680-D683 WeakPolarHBondContact O-CB 3.01Å; D680-D683 PolarHBondContact O-N 3.31Å; Q681-D683 VanDerWaalsContact C-N 3.31Å; D683-H685 VanDerWaalsContact OD1-CB 3.28Å; D683-H685 WeakPolarHBondContact OD1-CB 3.45Å; D683-H685 IonicContact OD1-CD2 2.92Å; D683-H685 PolarHBondContact OD1-CD2 3.36Å; D683-H685 IonicContact OD1-CG 3.23Å; D683-H685 VanDerWaalsContact OD1-CG 3.23Å; D683-H685 PolarHBondContact OD1-N 2.92Å; D683-H685 IonicContact OD1-NE2 3.91Å; D683-S688 WeakPolarHBondContact O-CB 3.34Å
684	D	73.3	Confident	89.6	Confident	150 Å²	150	70.6 Å²	70.6	80%	0.802	38%	0.383	S	S	*	.			trans	-106.8	21.2	178.5	-166.8	23.8	0	0	0	112.3	S682	S682-D684 PolarHBondContact O-N 2.97Å
685	H	78.2	Confident	89.5	Confident	136 Å²	136	66.1 Å²	66.1	63%	0.63	37%	0.365	S	S	*	.	S	Bend	trans	-80	163.7	177.5	-62.3	-39.9	0	0	0	112.6	D683 N687 S688	D683-H685 VanDerWaalsContact OD1-CB 3.28Å; D683-H685 WeakPolarHBondContact OD1-CB 3.45Å; D683-H685 IonicContact OD1-CD2 2.92Å; D683-H685 PolarHBondContact OD1-CD2 3.36Å; D683-H685 IonicContact OD1-CG 3.23Å; D683-H685 VanDerWaalsContact OD1-CG 3.23Å; D683-H685 PolarHBondContact OD1-N 2.92Å; D683-H685 IonicContact OD1-NE2 3.91Å; H685-N687 PolarHBondContact O-N 3.41Å; H685-S688 WeakPolarHBondContact O-CB 3.45Å; H685-S688 PolarHBondContact O-N 3.01Å; H685-S688 PolarHBondContact O-OG 3.24Å
686	S	74.6	Confident	89.4	Confident	97 Å²	97	65 Å²	65	68%	0.678	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	7.7	178	64.8	0	0	0	0	114.9	F691	S686-F691 WeakPolarHBondContact O-CD1 3.44Å; S686-F691 WeakPolarHBondContact O-CE1 3.46Å
687	N	76	Confident	89.4	Confident	82 Å²	82	65.3 Å²	65.3	44%	0.439	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	18.4	172.9	-166.5	42.2	0	0	0	111.6	W675 H685	W675-N687 WeakPolarHBondContact CZ2-O 3.49Å; H685-N687 PolarHBondContact O-N 3.41Å
688	S	91.2	Very high	89.4	Confident	6 Å²	6	66.9 Å²	66.9	4%	0.042	37%	0.367	C	S	.	.	S	Bend	trans	-66.2	159.9	172.4	74.9	0	0	0	0	110.8	D683 H685 A690 F691 R692	D683-S688 WeakPolarHBondContact O-CB 3.34Å; H685-S688 WeakPolarHBondContact O-CB 3.45Å; H685-S688 PolarHBondContact O-N 3.01Å; H685-S688 PolarHBondContact O-OG 3.24Å; S688-A690 VanDerWaalsContact C-N 3.33Å; S688-A690 PolarHBondContact O-N 3.49Å; S688-F691 PolarHBondContact O-N 3.22Å; S688-F691 VanDerWaalsContact OG-CB 3.31Å; S688-F691 WeakPolarHBondContact OG-CB 3.28Å; S688-F691 PolarHBondContact OG-N 3.27Å; S688-F691 VanDerWaalsContact OG-N 3.14Å; S688-R692 PolarHBondContact O-N 3.13Å
689	L	96.1	Very high	89.4	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.016	37%	0.365	C	S	.	.	H	α-helix	trans	-57.4	-47.3	175.5	179.2	84.9	0	0	0	111.5	L629 W675 L676 V679 R692 I693 F723 W724	L629-L689 HydrophobicContact CD2-CD1 3.79Å; W675-L689 HydrophobicContact CH2-CB 4.4Å; W675-L689 HydrophobicContact CH2-CD1 3.98Å; W675-L689 HydrophobicContact CZ3-CD1 4.33Å; L676-L689 HydrophobicContact CD2-CD1 4.37Å; V679-L689 HydrophobicContact CG1-CB 4.41Å; L689-R692 PolarHBondContact O-N 2.78Å; L689-I693 HydrophobicContact CD1-CD1 4.15Å; L689-I693 HydrophobicContact CD2-CD1 4.34Å; L689-I693 HydrophobicContact CG-CD1 3.93Å; L689-I693 WeakPolarHBondContact O-CG1 3.28Å; L689-I693 PolarHBondContact O-N 3.19Å; L689-F723 HydrophobicContact CD1-CD1 4.31Å; L689-F723 HydrophobicContact CD1-CD2 3.91Å; L689-F723 HydrophobicContact CD1-CE1 4.09Å; L689-F723 HydrophobicContact CD1-CE2 3.68Å; L689-F723 HydrophobicContact CD1-CG 4.24Å; L689-F723 HydrophobicContact CD1-CZ 3.77Å; L689-F723 HydrophobicContact CD2-CB 4.15Å; L689-F723 HydrophobicContact CD2-CD1 3.12Å; L689-F723 HydrophobicContact CD2-CD2 4.07Å; L689-F723 HydrophobicContact CD2-CE1 3.38Å; L689-F723 HydrophobicContact CD2-CE2 4.29Å; L689-F723 HydrophobicContact CD2-CG 3.52Å; L689-F723 HydrophobicContact CD2-CZ 3.98Å; L689-F723 HydrophobicContact CG-CD1 4.31Å; L689-F723 HydrophobicContact CG-CE1 4.34Å; L689-F723 HydrophobicContact CG-CG 4.44Å; L689-W724 HydrophobicContact CB-CZ2 4.47Å; L689-W724 HydrophobicContact CD2-CH2 4.46Å; L689-W724 HydrophobicContact CD2-CZ2 3.67Å
690	A	95.5	Very high	89.4	Confident	40 Å²	40	68.4 Å²	68.4	33%	0.331	36%	0.363	S	S	.	.	H	α-helix	trans	-62.2	-45.8	-178.5	0	0	0	0	0	111.1	S688 R692 I693 H694 I720	S688-A690 VanDerWaalsContact C-N 3.33Å; S688-A690 PolarHBondContact O-N 3.49Å; A690-R692 PolarHBondContact O-N 3.05Å; A690-I693 PolarHBondContact O-N 2.83Å; A690-H694 VanDerWaalsContact O-CB 3.29Å; A690-H694 WeakPolarHBondContact O-CB 3.29Å; A690-H694 PolarHBondContact O-N 3.07Å; A690-I720 HydrophobicContact CB-CD1 3.87Å; A690-I720 HydrophobicContact CB-CG1 4.48Å; A690-I720 HydrophobicContact CB-CG2 4.44Å
691	F	94.9	Very high	89.7	Confident	103 Å²	103	68 Å²	68	45%	0.452	36%	0.36	S	S	.	.	H	α-helix	trans	-59.3	-46	176.3	-178.7	-93.1	0	0	0	111.5	S686 S688 T695	S686-F691 WeakPolarHBondContact O-CD1 3.44Å; S686-F691 WeakPolarHBondContact O-CE1 3.46Å; S688-F691 PolarHBondContact O-N 3.22Å; S688-F691 VanDerWaalsContact OG-CB 3.31Å; S688-F691 WeakPolarHBondContact OG-CB 3.28Å; S688-F691 PolarHBondContact OG-N 3.27Å; S688-F691 VanDerWaalsContact OG-N 3.14Å; F691-T695 WeakPolarHBondContact CE1-OG1 3.49Å; F691-T695 VanDerWaalsContact O-CB 3.25Å; F691-T695 WeakPolarHBondContact O-CB 3.25Å; F691-T695 PolarHBondContact O-N 3.19Å; F691-T695 PolarHBondContact O-OG1 2.94Å
692	R	95.3	Very high	90.1	Very high	29 Å²	29	64.7 Å²	64.7	11%	0.109	36%	0.36	C	S	.	.	H	α-helix	trans	-60.9	-51.1	177.9	176.2	169.5	-74.2	-91.1	-0.3	111.8	D632 W675 S688 L689 A690 H694 T695 Y696	D632-R692 VanDerWaalsContact CG-NH1 3.34Å; D632-R692 IonicContact OD1-NH1 2.83Å; D632-R692 PolarHBondContact OD1-NH1 2.91Å; D632-R692 IonicContact OD2-CZ 3.08Å; D632-R692 IonicContact OD2-NH1 3.43Å; D632-R692 PolarHBondContact OD2-NH1 2.96Å; D632-R692 IonicContact OD2-NH2 2.66Å; D632-R692 PolarHBondContact OD2-NH2 3.33Å; W675-R692 HydrophobicContact CH2-CB 4.49Å; S688-R692 PolarHBondContact O-N 3.13Å; L689-R692 PolarHBondContact O-N 2.78Å; A690-R692 PolarHBondContact O-N 3.05Å; R692-H694 PolarHBondContact O-N 3.39Å; R692-T695 PolarHBondContact O-N 3Å; R692-Y696 HydrophobicContact CG-CD2 3.83Å; R692-Y696 HydrophobicContact CG-CE2 3.91Å; R692-Y696 VanDerWaalsContact NH1-CE2 3.33Å; R692-Y696 VanDerWaalsContact O-CD2 3.32Å; R692-Y696 WeakPolarHBondContact O-CD2 3.32Å; R692-Y696 PolarHBondContact O-N 2.97Å; R692-Y696 VanDerWaalsContact O-N 3.12Å
693	I	96.7	Very high	90.7	Very high	0 Å²	0	61 Å²	61	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-60.1	-48.2	-179.3	-72.4	173.7	0	0	0	110.5	I628 L629 L689 A690 T695 W697 L719 I720	I628-I693 HydrophobicContact CG2-CB 4.27Å; I628-I693 HydrophobicContact CG2-CG1 4.08Å; I628-I693 HydrophobicContact CG2-CG2 4.31Å; L629-I693 HydrophobicContact CD2-CD1 4.22Å; L629-I693 HydrophobicContact CD2-CG1 3.97Å; L689-I693 HydrophobicContact CD1-CD1 4.15Å; L689-I693 HydrophobicContact CD2-CD1 4.34Å; L689-I693 HydrophobicContact CG-CD1 3.93Å; L689-I693 WeakPolarHBondContact O-CG1 3.28Å; L689-I693 PolarHBondContact O-N 3.19Å; A690-I693 PolarHBondContact O-N 2.83Å; I693-T695 PolarHBondContact O-N 3.42Å; I693-W697 WeakPolarHBondContact O-CB 3.42Å; I693-W697 PolarHBondContact O-N 2.58Å; I693-L719 HydrophobicContact CG2-CB 4.22Å; I693-L719 HydrophobicContact CG2-CD2 3.92Å; I693-L719 HydrophobicContact CG2-CG 4.35Å; I693-I720 HydrophobicContact CB-CD1 4.47Å; I693-I720 HydrophobicContact CB-CG1 3.94Å; I693-I720 HydrophobicContact CD1-CG1 3.97Å; I693-I720 HydrophobicContact CG2-CD1 4.32Å; I693-I720 HydrophobicContact CG2-CG1 3.74Å
694	H	96.2	Very high	91.4	Very high	90 Å²	90	63.8 Å²	63.8	42%	0.417	34%	0.338	S	S	.	.	H	α-helix	trans	-62.3	-44.3	179.9	-171	61.4	0	0	0	111.8	A690 R692 W697 E698 S716	A690-H694 VanDerWaalsContact O-CB 3.29Å; A690-H694 WeakPolarHBondContact O-CB 3.29Å; A690-H694 PolarHBondContact O-N 3.07Å; R692-H694 PolarHBondContact O-N 3.39Å; H694-W697 PolarHBondContact O-N 3.43Å; H694-E698 IonicContact CE1-OE1 3.08Å; H694-E698 WeakPolarHBondContact O-CG 3.38Å; H694-E698 PolarHBondContact O-N 2.97Å; H694-S716 PolarHBondContact ND1-OG 2.88Å
695	T	95.5	Very high	92.2	Very high	39 Å²	39	56.7 Å²	56.7	24%	0.239	30%	0.3	C	S	.	.	H	α-helix	trans	-60.2	-53.8	-179.4	-60.2	0	0	0	0	112.1	F691 R692 I693 W697 E698 L699	F691-T695 WeakPolarHBondContact CE1-OG1 3.49Å; F691-T695 VanDerWaalsContact O-CB 3.25Å; F691-T695 WeakPolarHBondContact O-CB 3.25Å; F691-T695 PolarHBondContact O-N 3.19Å; F691-T695 PolarHBondContact O-OG1 2.94Å; R692-T695 PolarHBondContact O-N 3Å; I693-T695 PolarHBondContact O-N 3.42Å; T695-W697 VanDerWaalsContact C-N 3.28Å; T695-W697 PolarHBondContact O-N 2.99Å; T695-E698 PolarHBondContact O-N 3.26Å; T695-L699 HydrophobicContact CG2-CD1 3.78Å; T695-L699 WeakPolarHBondContact O-CB 3.41Å; T695-L699 VanDerWaalsContact O-CG 3.28Å; T695-L699 WeakPolarHBondContact O-CG 3.45Å; T695-L699 PolarHBondContact O-N 2.9Å
696	Y	95.7	Very high	92.1	Very high	27 Å²	27	51.7 Å²	51.7	11%	0.106	28%	0.278	C	S	.	.	H	α-helix	trans	-71.1	-26.2	-179.3	-72.7	-73.1	0	0	0	112.6	Y631 D632 R692 H700	Y631-Y696 AromaticContact CD1-CD1 3.64Å; Y631-Y696 HydrophobicContact CD1-CD1 3.64Å; Y631-Y696 AromaticContact CD1-CE1 3.74Å; Y631-Y696 HydrophobicContact CD1-CE1 3.74Å; Y631-Y696 AromaticContact CG-CD1 3.68Å; Y631-Y696 HydrophobicContact CG-CD1 3.68Å; Y631-Y696 HydrophobicContact CG-CE1 4.12Å; Y631-Y696 HydrophobicContact CG-CG 4.41Å; D632-Y696 WeakPolarHBondContact CB-OH 3.27Å; R692-Y696 HydrophobicContact CG-CD2 3.83Å; R692-Y696 HydrophobicContact CG-CE2 3.91Å; R692-Y696 VanDerWaalsContact NH1-CE2 3.33Å; R692-Y696 VanDerWaalsContact O-CD2 3.32Å; R692-Y696 WeakPolarHBondContact O-CD2 3.32Å; R692-Y696 PolarHBondContact O-N 2.97Å; R692-Y696 VanDerWaalsContact O-N 3.12Å; Y696-H700 AromaticContact CD1-CD2 3.67Å; Y696-H700 AromaticContact CD1-NE2 3.69Å; Y696-H700 WeakPolarHBondContact O-CB 3.49Å; Y696-H700 PolarHBondContact O-CD2 3.25Å; Y696-H700 PolarHBondContact O-N 3.1Å
697	W	96.5	Very high	92.3	Very high	8 Å²	8	50.5 Å²	50.5	3%	0.03	26%	0.259	C	S	.	.	H	α-helix	trans	-63.8	-56.9	170.6	-173.7	-78.4	0	0	0	110.9	L624 I628 I693 H694 T695 L699 H700 N701 W710 L713 L719	L624-W697 HydrophobicContact CD1-CZ3 4.4Å; L624-W697 HydrophobicContact CD2-CH2 4.47Å; L624-W697 HydrophobicContact CD2-CZ3 4.02Å; I628-W697 HydrophobicContact CD1-CE3 3.6Å; I628-W697 HydrophobicContact CD1-CZ3 4.05Å; I693-W697 WeakPolarHBondContact O-CB 3.42Å; I693-W697 PolarHBondContact O-N 2.58Å; H694-W697 PolarHBondContact O-N 3.43Å; T695-W697 VanDerWaalsContact C-N 3.28Å; T695-W697 PolarHBondContact O-N 2.99Å; W697-L699 VanDerWaalsContact C-N 3.28Å; W697-L699 PolarHBondContact O-N 3.47Å; W697-H700 PolarHBondContact O-N 3.46Å; W697-N701 WeakPolarHBondContact O-CB 3.46Å; W697-N701 PolarHBondContact O-N 3.47Å; W697-W710 HydrophobicContact CD2-CE3 4.38Å; W697-W710 HydrophobicContact CD2-CZ3 4.42Å; W697-W710 HydrophobicContact CE3-CE3 4.14Å; W697-W710 HydrophobicContact CE3-CZ3 4.16Å; W697-W710 HydrophobicContact CZ3-CE3 4.21Å; W697-L713 HydrophobicContact CH2-CB 4.03Å; W697-L719 HydrophobicContact CE3-CD2 4.4Å; W697-L719 HydrophobicContact CZ3-CD2 4.44Å
698	E	96.4	Very high	92.7	Very high	121 Å²	121	47.4 Å²	47.4	57%	0.565	24%	0.244	S	C	*	.	H	α-helix	trans	-62.2	-35	-176.7	-68.6	-59.4	128.4	0	0	112.8	H694 T695	H694-E698 IonicContact CE1-OE1 3.08Å; H694-E698 WeakPolarHBondContact O-CG 3.38Å; H694-E698 PolarHBondContact O-N 2.97Å; T695-E698 PolarHBondContact O-N 3.26Å
699	L	95.5	Very high	92.6	Very high	116 Å²	116	49.5 Å²	49.5	61%	0.607	26%	0.255	S	S	*	.	H	α-helix	trans	-75.6	-34.6	-179.6	-69.9	175	0	0	0	113.9	T695 W697	T695-L699 HydrophobicContact CG2-CD1 3.78Å; T695-L699 WeakPolarHBondContact O-CB 3.41Å; T695-L699 VanDerWaalsContact O-CG 3.28Å; T695-L699 WeakPolarHBondContact O-CG 3.45Å; T695-L699 PolarHBondContact O-N 2.9Å; W697-L699 VanDerWaalsContact C-N 3.28Å; W697-L699 PolarHBondContact O-N 3.47Å
700	H	95.4	Very high	92.5	Very high	15 Å²	15	50 Å²	50	7%	0.069	26%	0.257	C	S	.	.	H	α-helix	trans	-124.5	1.5	-165.7	-55	-67.5	0	0	0	114.8	Y631 E636 Y696 W697 G702 E703 W710	Y631-H700 AromaticContact CD1-CD2 3.94Å; Y631-H700 AromaticContact CD1-NE2 3.77Å; Y631-H700 HydrophobicContact CD2-CB 4.49Å; Y631-H700 AromaticContact CE1-CD2 3.68Å; Y631-H700 AromaticContact CE1-CE1 3.42Å; Y631-H700 VanDerWaalsContact CE1-CE1 3.42Å; Y631-H700 WeakPolarHBondContact CE1-CE1 3.29Å; Y631-H700 AromaticContact CE1-CG 3.9Å; Y631-H700 AromaticContact CE1-ND1 3.77Å; Y631-H700 AromaticContact CE1-NE2 3.38Å; Y631-H700 WeakPolarHBondContact CE1-NE2 3.2Å; Y631-H700 HydrophobicContact CE2-CB 3.77Å; Y631-H700 AromaticContact CE2-CD2 3.83Å; Y631-H700 AromaticContact CE2-CG 3.58Å; Y631-H700 AromaticContact CZ-CD2 3.62Å; Y631-H700 AromaticContact CZ-CE1 3.53Å; Y631-H700 AromaticContact CZ-CG 3.38Å; Y631-H700 AromaticContact CZ-ND1 3.35Å; Y631-H700 VanDerWaalsContact CZ-ND1 3.35Å; Y631-H700 AromaticContact CZ-NE2 3.72Å; Y631-H700 PolarHBondContact OH-CE1 3.38Å; Y631-H700 PolarHBondContact OH-ND1 3.38Å; E636-H700 IonicContact OE1-NE2 3.64Å; Y696-H700 AromaticContact CD1-CD2 3.67Å; Y696-H700 AromaticContact CD1-NE2 3.69Å; Y696-H700 WeakPolarHBondContact O-CB 3.49Å; Y696-H700 PolarHBondContact O-CD2 3.25Å; Y696-H700 PolarHBondContact O-N 3.1Å; W697-H700 PolarHBondContact O-N 3.46Å; H700-G702 PolarHBondContact O-N 2.96Å; H700-E703 HydrophobicContact CB-CG 4.29Å; H700-E703 IonicContact CG-OE1 2.73Å; H700-E703 IonicContact CG-OE2 3.87Å; H700-E703 IonicContact ND1-OE1 3.97Å; H700-E703 PolarHBondContact ND1-OE1 3.16Å; H700-E703 IonicContact ND1-OE2 3.74Å; H700-E703 PolarHBondContact ND1-OE2 2.96Å; H700-E703 VanDerWaalsContact O-CB 3.28Å; H700-E703 WeakPolarHBondContact O-CB 3.43Å; H700-E703 WeakPolarHBondContact O-CG 3.3Å; H700-E703 PolarHBondContact O-N 3.16Å; H700-W710 HydrophobicContact CB-CH2 4.07Å; H700-W710 HydrophobicContact CB-CZ2 4.2Å; H700-W710 WeakPolarHBondContact O-CZ2 3.5Å
701	N	94.6	Very high	92.4	Very high	85 Å²	85	55.2 Å²	55.2	46%	0.455	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	128.9	176.8	-177.3	22.2	0	0	0	111	W697 W710	W697-N701 WeakPolarHBondContact O-CB 3.46Å; W697-N701 PolarHBondContact O-N 3.47Å; N701-W710 HydrophobicContact CB-CE3 4.35Å; N701-W710 VanDerWaalsContact OD1-CB 3.25Å; N701-W710 WeakPolarHBondContact OD1-CB 3.36Å
702	G	93.3	Very high	92.3	Very high	56 Å²	56	51.8 Å²	51.8	58%	0.577	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.9	-9.2	-176.8	0	0	0	0	0	115.1	H700	H700-G702 PolarHBondContact O-N 2.96Å
703	E	95.4	Very high	92.3	Very high	21 Å²	21	50.9 Å²	50.9	10%	0.098	26%	0.263	C	S	.	.			trans	-68	146.1	173.7	-70.4	-177.8	177.4	0	0	112.3	V244 P246 Y631 H700 C705 W710	V244-E703 HydrophobicContact CG1-CG 4.08Å; P246-E703 WeakPolarHBondContact CA-OE2 3.43Å; Y631-E703 PolarHBondContact OH-OE2 3.03Å; H700-E703 HydrophobicContact CB-CG 4.29Å; H700-E703 IonicContact CG-OE1 2.73Å; H700-E703 IonicContact CG-OE2 3.87Å; H700-E703 IonicContact ND1-OE1 3.97Å; H700-E703 PolarHBondContact ND1-OE1 3.16Å; H700-E703 IonicContact ND1-OE2 3.74Å; H700-E703 PolarHBondContact ND1-OE2 2.96Å; H700-E703 VanDerWaalsContact O-CB 3.28Å; H700-E703 WeakPolarHBondContact O-CB 3.43Å; H700-E703 WeakPolarHBondContact O-CG 3.3Å; H700-E703 PolarHBondContact O-N 3.16Å; E703-C705 VanDerWaalsContact C-N 3.28Å; E703-C705 VanDerWaalsContact CB-SG 3.54Å; E703-C705 PolarHBondContact O-N 2.88Å; E703-W710 PolarHBondContact O-NE1 3.15Å
704	R	92.9	Very high	92.2	Very high	115 Å²	115	59.4 Å²	59.4	43%	0.434	30%	0.3	S	S	.	.			trans	-75.9	75.5	175.3	-171.7	73.9	178.8	172.9	6.7	110.6	E212 L243 V244 F245 S651	E212-R704 IonicContact OE1-CZ 2.84Å; E212-R704 IonicContact OE1-NE 2.8Å; E212-R704 IonicContact OE1-NH2 3.41Å; E212-R704 PolarHBondContact OE1-NH2 2.8Å; E212-R704 IonicContact OE2-CZ 3.85Å; E212-R704 IonicContact OE2-NE 3.5Å; E212-R704 PolarHBondContact OE2-NE 3.19Å; E212-R704 IonicContact OE2-NH2 3.85Å; L243-R704 HydrophobicContact CD1-CB 3.8Å; L243-R704 HydrophobicContact CD1-CG 4.01Å; V244-R704 WeakPolarHBondContact O-CB 3.18Å; V244-R704 PolarHBondContact O-N 3.25Å; F245-R704 HydrophobicContact CD1-CB 4.09Å; F245-R704 HydrophobicContact CD1-CG 4.25Å; F245-R704 HydrophobicContact CE1-CB 4.16Å; F245-R704 HydrophobicContact CE1-CG 3.85Å; F245-R704 HydrophobicContact CZ-CG 4.39Å; S651-R704 WeakPolarHBondContact CA-O 3.46Å; S651-R704 WeakPolarHBondContact CB-O 3.43Å
705	C	89.3	Confident	92.1	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.014	30%	0.297	C	S	.	.			trans	-100.1	90.5	179.7	-53.2	0	0	0	0	111.3	P246 C627 F635 S651 E703 W707 A708	P246-C705 HydrophobicContact CG-CB 4.48Å; P246-C705 WeakPolarHBondContact CG-SG 3.43Å; C627-C705 VanDerWaalsContact SG-CB 3.59Å; F635-C705 HydrophobicContact CZ-CB 4.47Å; S651-C705 CarbonylContact O-C 3.55Å; E703-C705 VanDerWaalsContact C-N 3.28Å; E703-C705 VanDerWaalsContact CB-SG 3.54Å; E703-C705 PolarHBondContact O-N 2.88Å; C705-W707 PolarHBondContact O-N 3.05Å; C705-A708 HydrophobicContact CB-CB 4.13Å; C705-A708 VanDerWaalsContact O-CB 3.3Å; C705-A708 WeakPolarHBondContact O-CB 3.31Å; C705-A708 PolarHBondContact O-N 3.38Å
706	L	76.7	Confident	92.2	Very high	30 Å²	30	56.8 Å²	56.8	16%	0.157	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	50	-89.9	169.8	-167.7	73.4	0	0	0	116.9	S651 A652 L656 F657 Y742	S651-L706 WeakPolarHBondContact O-CB 3.27Å; S651-L706 PolarHBondContact O-N 3.25Å; A652-L706 HydrophobicContact CB-CB 4.02Å; A652-L706 HydrophobicContact CB-CD1 3.22Å; A652-L706 HydrophobicContact CB-CD2 4.21Å; A652-L706 HydrophobicContact CB-CG 3.95Å; L656-L706 HydrophobicContact CD2-CD1 4.3Å; L656-L706 HydrophobicContact CD2-CD2 3.26Å; L656-L706 HydrophobicContact CD2-CG 4.35Å; F657-L706 HydrophobicContact CE2-CD1 4.2Å; F657-L706 HydrophobicContact CZ-CD1 3.72Å; L706-Y742 HydrophobicContact CD2-CE1 3.89Å; L706-Y742 HydrophobicContact CD2-CE2 4.07Å
707	W	78.8	Confident	92.2	Very high	72 Å²	72	60.3 Å²	60.3	27%	0.273	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	5.5	180	-80.1	-67.6	0	0	0	112.5	H623 F657 C705 N709 Y742 R746	H623-W707 HydrophobicContact CB-CB 3.87Å; F657-W707 AromaticContact CE1-CH2 3.26Å; F657-W707 HydrophobicContact CE1-CH2 3.26Å; F657-W707 AromaticContact CE1-CZ3 3.31Å; F657-W707 HydrophobicContact CE1-CZ3 3.31Å; F657-W707 AromaticContact CZ-CH2 3.32Å; F657-W707 HydrophobicContact CZ-CH2 3.32Å; F657-W707 AromaticContact CZ-CZ3 3.29Å; F657-W707 HydrophobicContact CZ-CZ3 3.29Å; C705-W707 PolarHBondContact O-N 3.05Å; W707-N709 PolarHBondContact O-N 2.96Å; W707-Y742 HydrophobicContact CD2-CE1 4.35Å; W707-Y742 HydrophobicContact CE3-CD1 4.37Å; W707-Y742 AromaticContact CE3-CE1 3.19Å; W707-Y742 HydrophobicContact CE3-CE1 3.19Å; W707-Y742 AromaticContact CE3-CZ 3.45Å; W707-Y742 VanDerWaalsContact CE3-CZ 3.45Å; W707-Y742 HydrophobicContact CH2-CE1 4.2Å; W707-Y742 AromaticContact CZ3-CD1 3.92Å; W707-Y742 HydrophobicContact CZ3-CD1 3.92Å; W707-Y742 AromaticContact CZ3-CE1 3.08Å; W707-Y742 HydrophobicContact CZ3-CE1 3.08Å; W707-Y742 AromaticContact CZ3-CZ 3.84Å; W707-R746 VanDerWaalsContact CH2-NH1 3.35Å
708	A	84.6	Confident	92.3	Very high	17 Å²	17	61.3 Å²	61.3	14%	0.14	31%	0.311	C	S	.	.			trans	-66	122.4	168.6	0	0	0	0	0	108	L624 C627 C705	L624-A708 HydrophobicContact CD1-CB 4.01Å; C627-A708 HydrophobicContact CB-CB 3.89Å; C705-A708 HydrophobicContact CB-CB 4.13Å; C705-A708 VanDerWaalsContact O-CB 3.3Å; C705-A708 WeakPolarHBondContact O-CB 3.31Å; C705-A708 PolarHBondContact O-N 3.38Å
709	N	90.2	Very high	92.3	Very high	51 Å²	51	55.6 Å²	55.6	27%	0.273	28%	0.284	S	S	.	.			trans	-110.6	96.9	171.5	178.8	6.4	0	0	0	107.1	Q620 W707 D711 L712	Q620-N709 PolarHBondContact OE1-ND2 3.23Å; W707-N709 PolarHBondContact O-N 2.96Å; N709-D711 PolarHBondContact O-N 3.24Å; N709-D711 PolarHBondContact OD1-N 3.12Å; N709-L712 HydrophobicContact CB-CD1 3.81Å; N709-L712 HydrophobicContact CB-CG 3.79Å; N709-L712 WeakPolarHBondContact O-CB 3.23Å; N709-L712 WeakPolarHBondContact O-CD1 3.47Å; N709-L712 WeakPolarHBondContact O-CG 3.14Å; N709-L712 PolarHBondContact O-N 3.47Å
710	W	92.6	Very high	92.4	Very high	12 Å²	12	50.5 Å²	50.5	5%	0.045	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-63.7	-27.8	-177.3	-56.9	99.6	0	0	0	112.5	L624 I628 W697 H700 N701 E703 L712	L624-W710 HydrophobicContact CD1-CD2 4.19Å; L624-W710 HydrophobicContact CD1-CE3 3.89Å; L624-W710 HydrophobicContact CD1-CZ3 4.23Å; I628-W710 HydrophobicContact CD1-CE3 4.38Å; I628-W710 HydrophobicContact CD1-CH2 4.27Å; I628-W710 HydrophobicContact CD1-CZ3 3.66Å; I628-W710 HydrophobicContact CG1-CH2 3.9Å; I628-W710 HydrophobicContact CG1-CZ3 3.8Å; W697-W710 HydrophobicContact CD2-CE3 4.38Å; W697-W710 HydrophobicContact CD2-CZ3 4.42Å; W697-W710 HydrophobicContact CE3-CE3 4.14Å; W697-W710 HydrophobicContact CE3-CZ3 4.16Å; W697-W710 HydrophobicContact CZ3-CE3 4.21Å; H700-W710 HydrophobicContact CB-CH2 4.07Å; H700-W710 HydrophobicContact CB-CZ2 4.2Å; H700-W710 WeakPolarHBondContact O-CZ2 3.5Å; N701-W710 HydrophobicContact CB-CE3 4.35Å; N701-W710 VanDerWaalsContact OD1-CB 3.25Å; N701-W710 WeakPolarHBondContact OD1-CB 3.36Å; E703-W710 PolarHBondContact O-NE1 3.15Å; W710-L712 PolarHBondContact O-N 3.08Å
711	D	93.5	Very high	92.5	Very high	151 Å²	151	51.7 Å²	51.7	81%	0.807	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-75.5	-2.3	-179.6	-56.9	-43.3	0	0	0	113.5	N709 L713	N709-D711 PolarHBondContact O-N 3.24Å; N709-D711 PolarHBondContact OD1-N 3.12Å; D711-L713 VanDerWaalsContact C-N 3.33Å
712	L	93.2	Very high	92.7	Very high	31 Å²	31	47.7 Å²	47.7	16%	0.162	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-67.1	-35.4	176.8	-75.6	171.8	0	0	0	113.1	I615 Q620 N709 W710	I615-L712 HydrophobicContact CD1-CB 4.28Å; I615-L712 HydrophobicContact CD1-CD2 3.89Å; Q620-L712 HydrophobicContact CB-CD1 3.54Å; N709-L712 HydrophobicContact CB-CD1 3.81Å; N709-L712 HydrophobicContact CB-CG 3.79Å; N709-L712 WeakPolarHBondContact O-CB 3.23Å; N709-L712 WeakPolarHBondContact O-CD1 3.47Å; N709-L712 WeakPolarHBondContact O-CG 3.14Å; N709-L712 PolarHBondContact O-N 3.47Å; W710-L712 PolarHBondContact O-N 3.08Å
713	L	95.4	Very high	92.9	Very high	10 Å²	10	45 Å²	45	5%	0.052	22%	0.215	C	C	.	.	S	Bend	trans	-122.9	153.5	-174.9	-57.9	-179	0	0	0	109.1	I621 L624 W697 D711 E718 L719 I722	I621-L713 HydrophobicContact CD1-CD1 3.79Å; I621-L713 HydrophobicContact CD1-CD2 4.1Å; I621-L713 HydrophobicContact CD1-CG 4.05Å; L624-L713 HydrophobicContact CD2-CD1 4.1Å; L624-L713 HydrophobicContact CD2-CG 4.31Å; W697-L713 HydrophobicContact CH2-CB 4.03Å; D711-L713 VanDerWaalsContact C-N 3.33Å; L713-E718 HydrophobicContact CB-CB 4.3Å; L713-E718 HydrophobicContact CD1-CB 4.29Å; L713-E718 HydrophobicContact CD2-CB 4.33Å; L713-L719 HydrophobicContact CD1-CB 3.72Å; L713-L719 HydrophobicContact CD1-CD1 3.68Å; L713-L719 HydrophobicContact CD1-CG 4.29Å; L713-I722 HydrophobicContact CD1-CD1 4.07Å; L713-I722 HydrophobicContact CD2-CD1 3.79Å
714	K	93.8	Very high	93	Very high	178 Å²	178	46.1 Å²	46.1	77%	0.774	22%	0.218	S	C	*	.	S	Bend	trans	-77.7	-30.7	-176.6	-62	177.6	-169.5	159.4	0	113.1	E718	K714-E718 WeakPolarHBondContact CD-OE1 3.15Å; K714-E718 PolarHBondContact N-OE2 3.46Å; K714-E718 VanDerWaalsContact N-OE2 3.12Å
715	N	95.5	Very high	93.2	Very high	68 Å²	68	41.1 Å²	41.1	36%	0.364	20%	0.201	S	C	.	.	S	Bend	trans	-162.6	172.6	-175	56.4	57	0	0	0	110.9	Q717 E718	N715-Q717 PolarHBondContact O-N 3.37Å; N715-Q717 WeakPolarHBondContact OD1-CA 3.26Å; N715-Q717 VanDerWaalsContact OD1-CB 3.27Å; N715-Q717 WeakPolarHBondContact OD1-CB 3.44Å; N715-Q717 PolarHBondContact OD1-N 3.15Å; N715-E718 PolarHBondContact O-N 2.99Å; N715-E718 PolarHBondContact OD1-N 3.42Å
716	S	96.6	Very high	93.7	Very high	7 Å²	7	41.9 Å²	41.9	5%	0.049	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-27.1	178.6	65.8	0	0	0	0	114.1	H694 L719 I720	H694-S716 PolarHBondContact ND1-OG 2.88Å; S716-L719 WeakPolarHBondContact O-CB 3.44Å; S716-L719 PolarHBondContact O-N 2.85Å; S716-I720 WeakPolarHBondContact O-CG1 3.39Å; S716-I720 PolarHBondContact O-N 3.1Å; S716-I720 VanDerWaalsContact O-N 3.11Å
717	Q	96.8	Very high	94.6	Very high	100 Å²	100	41.3 Å²	41.3	47%	0.467	21%	0.206	S	C	.	.	H	α-helix	trans	-65.7	-41.3	-178	-173.1	60.8	49.2	0	0	111.3	N715 L719 I720 D721	N715-Q717 PolarHBondContact O-N 3.37Å; N715-Q717 WeakPolarHBondContact OD1-CA 3.26Å; N715-Q717 VanDerWaalsContact OD1-CB 3.27Å; N715-Q717 WeakPolarHBondContact OD1-CB 3.44Å; N715-Q717 PolarHBondContact OD1-N 3.15Å; Q717-L719 PolarHBondContact O-N 3.13Å; Q717-I720 WeakPolarHBondContact O-CB 3.26Å; Q717-I720 PolarHBondContact O-N 3.14Å; Q717-I720 VanDerWaalsContact O-N 3.11Å; Q717-D721 PolarHBondContact NE2-OD1 2.98Å; Q717-D721 VanDerWaalsContact O-CG 3.27Å; Q717-D721 PolarHBondContact O-N 3.14Å
718	E	97.3	Very high	95.5	Very high	30 Å²	30	39.4 Å²	39.4	14%	0.14	20%	0.203	C	C	.	.	H	α-helix	trans	-58.2	-35.8	175.3	-70.1	-176.6	-174.8	0	0	111.7	L713 K714 N715 D721 I722	L713-E718 HydrophobicContact CB-CB 4.3Å; L713-E718 HydrophobicContact CD1-CB 4.29Å; L713-E718 HydrophobicContact CD2-CB 4.33Å; K714-E718 WeakPolarHBondContact CD-OE1 3.15Å; K714-E718 PolarHBondContact N-OE2 3.46Å; K714-E718 VanDerWaalsContact N-OE2 3.12Å; N715-E718 PolarHBondContact O-N 2.99Å; N715-E718 PolarHBondContact OD1-N 3.42Å; E718-D721 PolarHBondContact O-N 3.18Å; E718-I722 WeakPolarHBondContact O-CB 3.4Å; E718-I722 WeakPolarHBondContact O-CD1 3.38Å; E718-I722 WeakPolarHBondContact O-CG1 3.4Å; E718-I722 PolarHBondContact O-N 2.75Å
719	L	97.4	Very high	96.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-71.4	-37.7	177.6	-167.3	67.1	0	0	0	112.5	I621 L624 L625 I628 I693 W697 L713 S716 Q717 I722 F723	I621-L719 HydrophobicContact CD1-CD1 4.06Å; L624-L719 HydrophobicContact CD2-CD1 4.46Å; L624-L719 HydrophobicContact CG-CD1 4.47Å; L624-L719 HydrophobicContact CG-CD2 4.46Å; L625-L719 HydrophobicContact CD2-CD1 3.51Å; L625-L719 HydrophobicContact CD2-CD2 4.39Å; L625-L719 HydrophobicContact CD2-CG 3.81Å; L625-L719 HydrophobicContact CG-CD1 3.69Å; L625-L719 HydrophobicContact CG-CG 4.49Å; I628-L719 HydrophobicContact CB-CD2 4.37Å; I628-L719 HydrophobicContact CD1-CD2 3.27Å; I628-L719 HydrophobicContact CG1-CD2 4.41Å; I628-L719 HydrophobicContact CG2-CD2 4.36Å; I693-L719 HydrophobicContact CG2-CB 4.22Å; I693-L719 HydrophobicContact CG2-CD2 3.92Å; I693-L719 HydrophobicContact CG2-CG 4.35Å; W697-L719 HydrophobicContact CE3-CD2 4.4Å; W697-L719 HydrophobicContact CZ3-CD2 4.44Å; L713-L719 HydrophobicContact CD1-CB 3.72Å; L713-L719 HydrophobicContact CD1-CD1 3.68Å; L713-L719 HydrophobicContact CD1-CG 4.29Å; S716-L719 WeakPolarHBondContact O-CB 3.44Å; S716-L719 PolarHBondContact O-N 2.85Å; Q717-L719 PolarHBondContact O-N 3.13Å; L719-I722 PolarHBondContact O-N 2.96Å; L719-F723 PolarHBondContact O-N 3.42Å
720	I	97.3	Very high	96.5	Very high	9 Å²	9	39 Å²	39	5%	0.046	20%	0.203	C	C	.	.	H	α-helix	trans	-62.5	-46.1	173.7	-66.3	164.6	0	0	0	109.7	A690 I693 S716 Q717 I722 F723 W724	A690-I720 HydrophobicContact CB-CD1 3.87Å; A690-I720 HydrophobicContact CB-CG1 4.48Å; A690-I720 HydrophobicContact CB-CG2 4.44Å; I693-I720 HydrophobicContact CB-CD1 4.47Å; I693-I720 HydrophobicContact CB-CG1 3.94Å; I693-I720 HydrophobicContact CD1-CG1 3.97Å; I693-I720 HydrophobicContact CG2-CD1 4.32Å; I693-I720 HydrophobicContact CG2-CG1 3.74Å; S716-I720 WeakPolarHBondContact O-CG1 3.39Å; S716-I720 PolarHBondContact O-N 3.1Å; S716-I720 VanDerWaalsContact O-N 3.11Å; Q717-I720 WeakPolarHBondContact O-CB 3.26Å; Q717-I720 PolarHBondContact O-N 3.14Å; Q717-I720 VanDerWaalsContact O-N 3.11Å; I720-I722 PolarHBondContact O-N 3.1Å; I720-F723 WeakPolarHBondContact O-CB 3.41Å; I720-F723 PolarHBondContact O-N 3.04Å; I720-W724 PolarHBondContact O-N 3.44Å; I720-W724 VanDerWaalsContact O-N 3.15Å
721	D	97.4	Very high	96.8	Very high	41 Å²	41	38.6 Å²	38.6	22%	0.219	20%	0.202	C	C	.	.	H	α-helix	trans	-63.2	-43.3	178.9	-63.3	-14.9	0	0	0	111.3	Q717 E718 F723 W724 C725 P757	Q717-D721 PolarHBondContact NE2-OD1 2.98Å; Q717-D721 VanDerWaalsContact O-CG 3.27Å; Q717-D721 PolarHBondContact O-N 3.14Å; E718-D721 PolarHBondContact O-N 3.18Å; D721-F723 VanDerWaalsContact C-N 3.33Å; D721-F723 PolarHBondContact O-N 3.36Å; D721-W724 PolarHBondContact O-N 2.84Å; D721-C725 WeakPolarHBondContact O-CB 3.42Å; D721-C725 PolarHBondContact O-N 3.23Å; D721-C725 PolarHBondContact O-SG 3.01Å; D721-P757 HydrophobicContact CB-CB 4.12Å; D721-P757 HydrophobicContact CB-CG 3.83Å
722	I	98.2	Very high	97.1	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-58.7	-44	174.6	-76.6	166.8	0	0	0	111	I621 L625 L713 E718 L719 I720 W724 C725 L726 L753 W755	I621-I722 HydrophobicContact CD1-CD1 3.97Å; I621-I722 HydrophobicContact CG1-CD1 4.32Å; L625-I722 HydrophobicContact CD1-CG2 4.31Å; L713-I722 HydrophobicContact CD1-CD1 4.07Å; L713-I722 HydrophobicContact CD2-CD1 3.79Å; E718-I722 WeakPolarHBondContact O-CB 3.4Å; E718-I722 WeakPolarHBondContact O-CD1 3.38Å; E718-I722 WeakPolarHBondContact O-CG1 3.4Å; E718-I722 PolarHBondContact O-N 2.75Å; L719-I722 PolarHBondContact O-N 2.96Å; I720-I722 PolarHBondContact O-N 3.1Å; I722-W724 PolarHBondContact O-N 3.45Å; I722-C725 PolarHBondContact O-N 3.14Å; I722-L726 HydrophobicContact CG2-CD1 3.67Å; I722-L726 HydrophobicContact CG2-CG 4.27Å; I722-L726 WeakPolarHBondContact O-CB 3.12Å; I722-L726 WeakPolarHBondContact O-CG 3.2Å; I722-L726 PolarHBondContact O-N 2.89Å; I722-L753 HydrophobicContact CD1-CD2 4.35Å; I722-L753 HydrophobicContact CG1-CD2 4.37Å; I722-L753 HydrophobicContact CG2-CD2 3.79Å; I722-W755 HydrophobicContact CD1-CD2 4.28Å; I722-W755 HydrophobicContact CD1-CE3 4.42Å; I722-W755 HydrophobicContact CD1-CH2 4.05Å; I722-W755 HydrophobicContact CD1-CZ2 3.89Å; I722-W755 HydrophobicContact CD1-CZ3 4.32Å; I722-W755 HydrophobicContact CG1-CD2 3.75Å; I722-W755 HydrophobicContact CG1-CE3 4.25Å; I722-W755 HydrophobicContact CG1-CG 4.02Å; I722-W755 HydrophobicContact CG1-CZ2 4.09Å
723	F	98.2	Very high	97.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-56.7	-50.6	177.6	178.7	-79.6	0	0	0	111.2	L629 L676 V679 L689 L719 I720 D721 L726 G727 P728 V731	L629-F723 HydrophobicContact CD1-CD2 4.28Å; L629-F723 HydrophobicContact CD1-CE2 4.3Å; L676-F723 HydrophobicContact CD2-CE2 3.94Å; L676-F723 HydrophobicContact CD2-CZ 4.29Å; V679-F723 HydrophobicContact CG2-CE1 3.85Å; V679-F723 HydrophobicContact CG2-CZ 3.87Å; L689-F723 HydrophobicContact CD1-CD1 4.31Å; L689-F723 HydrophobicContact CD1-CD2 3.91Å; L689-F723 HydrophobicContact CD1-CE1 4.09Å; L689-F723 HydrophobicContact CD1-CE2 3.68Å; L689-F723 HydrophobicContact CD1-CG 4.24Å; L689-F723 HydrophobicContact CD1-CZ 3.77Å; L689-F723 HydrophobicContact CD2-CB 4.15Å; L689-F723 HydrophobicContact CD2-CD1 3.12Å; L689-F723 HydrophobicContact CD2-CD2 4.07Å; L689-F723 HydrophobicContact CD2-CE1 3.38Å; L689-F723 HydrophobicContact CD2-CE2 4.29Å; L689-F723 HydrophobicContact CD2-CG 3.52Å; L689-F723 HydrophobicContact CD2-CZ 3.98Å; L689-F723 HydrophobicContact CG-CD1 4.31Å; L689-F723 HydrophobicContact CG-CE1 4.34Å; L689-F723 HydrophobicContact CG-CG 4.44Å; L719-F723 PolarHBondContact O-N 3.42Å; I720-F723 WeakPolarHBondContact O-CB 3.41Å; I720-F723 PolarHBondContact O-N 3.04Å; D721-F723 VanDerWaalsContact C-N 3.33Å; D721-F723 PolarHBondContact O-N 3.36Å; F723-L726 PolarHBondContact O-N 2.96Å; F723-G727 PolarHBondContact O-N 3.28Å; F723-P728 HydrophobicContact CE1-CB 4.42Å; F723-P728 HydrophobicContact CE1-CG 4.05Å; F723-P728 HydrophobicContact CZ-CB 4.29Å; F723-P728 HydrophobicContact CZ-CG 4.41Å; F723-V731 HydrophobicContact CD2-CB 4Å; F723-V731 HydrophobicContact CD2-CG1 3.78Å; F723-V731 HydrophobicContact CD2-CG2 3.75Å; F723-V731 HydrophobicContact CE2-CB 3.76Å; F723-V731 HydrophobicContact CE2-CG1 3.63Å; F723-V731 HydrophobicContact CE2-CG2 3.98Å; F723-V731 HydrophobicContact CG-CG2 4.34Å
724	W	97.5	Very high	97.4	Very high	43 Å²	43	32 Å²	32	16%	0.163	17%	0.167	C	C	.	.	H	α-helix	trans	-68.6	-36.1	-178	-70.2	118.1	0	0	0	112.6	V679 Q681 L689 I720 D721 I722 G727 P728	V679-W724 HydrophobicContact CB-CH2 4.33Å; V679-W724 HydrophobicContact CG2-CH2 3.82Å; V679-W724 HydrophobicContact CG2-CZ3 4.3Å; Q681-W724 HydrophobicContact CB-CD2 4.23Å; Q681-W724 HydrophobicContact CB-CE3 4.29Å; Q681-W724 HydrophobicContact CB-CH2 3.81Å; Q681-W724 HydrophobicContact CB-CZ2 3.71Å; Q681-W724 HydrophobicContact CB-CZ3 4.09Å; Q681-W724 HydrophobicContact CG-CD2 4.1Å; Q681-W724 HydrophobicContact CG-CZ2 4.05Å; Q681-W724 VanDerWaalsContact N-CH2 3.27Å; L689-W724 HydrophobicContact CB-CZ2 4.47Å; L689-W724 HydrophobicContact CD2-CH2 4.46Å; L689-W724 HydrophobicContact CD2-CZ2 3.67Å; I720-W724 PolarHBondContact O-N 3.44Å; I720-W724 VanDerWaalsContact O-N 3.15Å; D721-W724 PolarHBondContact O-N 2.84Å; I722-W724 PolarHBondContact O-N 3.45Å; W724-G727 PolarHBondContact O-N 2.93Å; W724-P728 HydrophobicContact CZ3-CG 4.07Å
725	C	98.1	Very high	97.6	Very high	11 Å²	11	23.6 Å²	23.6	7%	0.074	13%	0.13	C	C	.	.	H	α-helix	trans	-68.7	-35.9	176.3	-68.8	0	0	0	0	112.9	D721 I722 W755 A762	D721-C725 WeakPolarHBondContact O-CB 3.42Å; D721-C725 PolarHBondContact O-N 3.23Å; D721-C725 PolarHBondContact O-SG 3.01Å; I722-C725 PolarHBondContact O-N 3.14Å; C725-W755 HydrophobicContact CB-CB 3.97Å; C725-A762 HydrophobicContact CB-CB 3.88Å; C725-A762 VanDerWaalsContact O-CB 3.31Å; C725-A762 WeakPolarHBondContact O-CB 3.34Å; C725-A762 PolarHBondContact O-N 3.1Å; C725-A762 VanDerWaalsContact O-N 3.12Å
726	L	98.1	Very high	97.8	Very high	17 Å²	17	24.8 Å²	24.8	9%	0.089	13%	0.13	C	C	.	.	H	α-helix	trans	-72.2	-36.2	173.1	-75.5	171.7	0	0	0	111.8	Y622 L625 I722 F723 V730 V731 L753 A762 I764	Y622-L726 HydrophobicContact CE1-CD1 4.45Å; L625-L726 HydrophobicContact CD1-CD1 3.99Å; I722-L726 HydrophobicContact CG2-CD1 3.67Å; I722-L726 HydrophobicContact CG2-CG 4.27Å; I722-L726 WeakPolarHBondContact O-CB 3.12Å; I722-L726 WeakPolarHBondContact O-CG 3.2Å; I722-L726 PolarHBondContact O-N 2.89Å; F723-L726 PolarHBondContact O-N 2.96Å; L726-V730 HydrophobicContact CD2-CG1 4.44Å; L726-V730 WeakPolarHBondContact O-CB 3.24Å; L726-V730 VanDerWaalsContact O-CG2 3.27Å; L726-V730 WeakPolarHBondContact O-CG2 3.46Å; L726-V731 HydrophobicContact CB-CG2 4.06Å; L726-V731 HydrophobicContact CD1-CG2 4.2Å; L726-L753 HydrophobicContact CD2-CD1 3.74Å; L726-L753 HydrophobicContact CG-CD1 4.39Å; L726-A762 HydrophobicContact CD2-CB 3.93Å; L726-A762 HydrophobicContact CG-CB 4.25Å; L726-I764 HydrophobicContact CD2-CD1 3.87Å; L726-I764 HydrophobicContact CD2-CG1 4.07Å
727	G	97.2	Very high	97.8	Very high	18 Å²	18	27.7 Å²	27.7	19%	0.186	14%	0.142	C	C	.	.			trans	90.6	147.1	-177.3	0	0	0	0	0	113.2	F723 W724 S729 V730 V731	F723-G727 PolarHBondContact O-N 3.28Å; W724-G727 PolarHBondContact O-N 2.93Å; G727-S729 VanDerWaalsContact C-N 3.32Å; G727-S729 PolarHBondContact O-N 2.94Å; G727-V730 PolarHBondContact O-N 3.31Å; G727-V731 PolarHBondContact O-N 2.87Å
728	P	97.3	Very high	97.8	Very high	33 Å²	33	23 Å²	23	21%	0.214	12%	0.119	C	C	.	.	H	α-helix	trans	-54.4	-40.9	-177	-28.6	34.3	0	0	0	115	L676 V679 F723 W724 V730 V731 H732	L676-P728 WeakPolarHBondContact O-CB 3.46Å; V679-P728 HydrophobicContact CG2-CB 4.39Å; V679-P728 HydrophobicContact CG2-CG 4.16Å; F723-P728 HydrophobicContact CE1-CB 4.42Å; F723-P728 HydrophobicContact CE1-CG 4.05Å; F723-P728 HydrophobicContact CZ-CB 4.29Å; F723-P728 HydrophobicContact CZ-CG 4.41Å; W724-P728 HydrophobicContact CZ3-CG 4.07Å; P728-V730 PolarHBondContact O-N 2.86Å; P728-V731 PolarHBondContact O-N 2.59Å; P728-H732 WeakPolarHBondContact O-CB 3.46Å; P728-H732 PolarHBondContact O-N 3.31Å
729	S	97.8	Very high	97.8	Very high	54 Å²	54	21.6 Å²	21.6	38%	0.378	11%	0.113	S	C	.	.	H	α-helix	trans	-59.7	-44.7	-179.7	-180	0	0	0	0	112.4	G727 H732 D733 A788	G727-S729 VanDerWaalsContact C-N 3.32Å; G727-S729 PolarHBondContact O-N 2.94Å; S729-H732 PolarHBondContact O-N 3.25Å; S729-D733 PolarHBondContact O-N 3.25Å; S729-A788 PolarHBondContact OG-O 3.29Å
730	V	98.3	Very high	97.7	Very high	5 Å²	5	23.6 Å²	23.6	3%	0.03	13%	0.125	C	C	.	.	H	α-helix	trans	-67.1	-47.9	-179	178.5	0	0	0	0	110.5	L726 G727 P728 H732 D733 V734 L785 A788 A790	L726-V730 HydrophobicContact CD2-CG1 4.44Å; L726-V730 WeakPolarHBondContact O-CB 3.24Å; L726-V730 VanDerWaalsContact O-CG2 3.27Å; L726-V730 WeakPolarHBondContact O-CG2 3.46Å; G727-V730 PolarHBondContact O-N 3.31Å; P728-V730 PolarHBondContact O-N 2.86Å; V730-H732 VanDerWaalsContact C-N 3.33Å; V730-H732 PolarHBondContact O-N 2.9Å; V730-D733 PolarHBondContact O-N 3Å; V730-V734 WeakPolarHBondContact O-CG2 3.17Å; V730-V734 PolarHBondContact O-N 3.16Å; V730-L785 HydrophobicContact CG1-CD2 4.04Å; V730-A788 HydrophobicContact CG2-CB 4.26Å; V730-A790 HydrophobicContact CG1-CB 3.99Å; V730-A790 HydrophobicContact CG2-CB 3.71Å
731	V	98.5	Very high	97.4	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.018	13%	0.125	C	C	.	.	H	α-helix	trans	-63.9	-40.7	179.3	-178.8	0	0	0	0	111.1	L629 F723 L726 G727 P728 V734 C735	L629-V731 HydrophobicContact CD1-CG1 3.7Å; F723-V731 HydrophobicContact CD2-CB 4Å; F723-V731 HydrophobicContact CD2-CG1 3.78Å; F723-V731 HydrophobicContact CD2-CG2 3.75Å; F723-V731 HydrophobicContact CE2-CB 3.76Å; F723-V731 HydrophobicContact CE2-CG1 3.63Å; F723-V731 HydrophobicContact CE2-CG2 3.98Å; F723-V731 HydrophobicContact CG-CG2 4.34Å; L726-V731 HydrophobicContact CB-CG2 4.06Å; L726-V731 HydrophobicContact CD1-CG2 4.2Å; G727-V731 PolarHBondContact O-N 2.87Å; P728-V731 PolarHBondContact O-N 2.59Å; V731-V734 PolarHBondContact O-N 3.35Å; V731-C735 VanDerWaalsContact O-CB 3.3Å; V731-C735 WeakPolarHBondContact O-CB 3.22Å; V731-C735 PolarHBondContact O-N 3.41Å; V731-C735 PolarHBondContact O-SG 3.15Å
732	H	98.5	Very high	97.3	Very high	10 Å²	10	21.7 Å²	21.7	5%	0.046	12%	0.115	C	C	.	.	H	α-helix	trans	-55.2	-51.4	173.6	161.1	-89.5	0	0	0	111.9	L673 L677 P728 S729 V730 C735 R736	L673-H732 PolarHBondContact O-CD2 3.26Å; L673-H732 VanDerWaalsContact O-CD2 3.28Å; L677-H732 HydrophobicContact CD2-CB 3.72Å; L677-H732 HydrophobicContact CG-CB 4.09Å; P728-H732 WeakPolarHBondContact O-CB 3.46Å; P728-H732 PolarHBondContact O-N 3.31Å; S729-H732 PolarHBondContact O-N 3.25Å; V730-H732 VanDerWaalsContact C-N 3.33Å; V730-H732 PolarHBondContact O-N 2.9Å; H732-C735 PolarHBondContact O-N 3.38Å; H732-R736 PolarHBondContact CE1-NE 2.85Å; H732-R736 PolarHBondContact CE1-NH2 2.9Å; H732-R736 PolarHBondContact NE2-NE 2.75Å; H732-R736 VanDerWaalsContact NE2-NE 3.19Å; H732-R736 PolarHBondContact NE2-NH2 2.81Å; H732-R736 VanDerWaalsContact O-CB 3.27Å; H732-R736 WeakPolarHBondContact O-CB 3.21Å; H732-R736 PolarHBondContact O-N 3.49Å
733	D	98.3	Very high	96.8	Very high	40 Å²	40	23.8 Å²	23.8	21%	0.214	12%	0.123	C	C	.	.	H	α-helix	trans	-68.4	-38.9	-175.8	-88.3	8	0	0	0	112.2	S729 V730 R736 K737 V784 A788	S729-D733 PolarHBondContact O-N 3.25Å; V730-D733 PolarHBondContact O-N 3Å; D733-R736 PolarHBondContact O-N 3.24Å; D733-K737 WeakPolarHBondContact O-CG 3.34Å; D733-K737 PolarHBondContact O-N 3.24Å; D733-V784 HydrophobicContact CB-CG1 4.36Å; D733-A788 HydrophobicContact CB-CB 3.89Å; D733-A788 WeakPolarHBondContact OD2-CB 3.46Å
734	V	98.1	Very high	96.3	Very high	4 Å²	4	25.3 Å²	25.3	2%	0.024	13%	0.131	C	C	.	.	H	α-helix	trans	-60.2	-51.9	172.5	171.8	0	0	0	0	110.6	Y622 V730 V731 R736 K737 L738 W781 L785	Y622-V734 HydrophobicContact CD1-CG1 4Å; Y622-V734 HydrophobicContact CD1-CG2 4.33Å; Y622-V734 HydrophobicContact CG-CG1 4.29Å; V730-V734 WeakPolarHBondContact O-CG2 3.17Å; V730-V734 PolarHBondContact O-N 3.16Å; V731-V734 PolarHBondContact O-N 3.35Å; V734-R736 VanDerWaalsContact C-N 3.29Å; V734-R736 PolarHBondContact O-N 3.29Å; V734-K737 PolarHBondContact O-N 3.33Å; V734-L738 HydrophobicContact CG1-CD1 4.06Å; V734-L738 WeakPolarHBondContact O-CG 3.41Å; V734-L738 PolarHBondContact O-N 2.98Å; V734-W781 HydrophobicContact CB-CH2 4.29Å; V734-W781 HydrophobicContact CB-CZ3 4.3Å; V734-W781 HydrophobicContact CG1-CH2 3.97Å; V734-W781 HydrophobicContact CG1-CZ3 4.37Å; V734-W781 HydrophobicContact CG2-CH2 4.32Å; V734-W781 HydrophobicContact CG2-CZ3 3.89Å; V734-L785 HydrophobicContact CG2-CD2 4.01Å
735	C	98.2	Very high	96.1	Very high	1 Å²	1	24 Å²	24	1%	0.007	13%	0.126	C	C	.	.	H	α-helix	trans	-61.4	-38.6	179.2	-69.6	0	0	0	0	111.7	F626 F630 L673 L676 V731 H732 L738 A739	F626-C735 HydrophobicContact CD2-CB 4.17Å; F630-C735 HydrophobicContact CE2-CB 3.66Å; F630-C735 HydrophobicContact CZ-CB 4.11Å; L673-C735 HydrophobicContact CD2-CB 4.06Å; L676-C735 HydrophobicContact CD1-CB 4.37Å; V731-C735 VanDerWaalsContact O-CB 3.3Å; V731-C735 WeakPolarHBondContact O-CB 3.22Å; V731-C735 PolarHBondContact O-N 3.41Å; V731-C735 PolarHBondContact O-SG 3.15Å; H732-C735 PolarHBondContact O-N 3.38Å; C735-L738 PolarHBondContact O-N 2.69Å; C735-A739 WeakPolarHBondContact O-CB 3.48Å; C735-A739 PolarHBondContact O-N 3.29Å
736	R	98.3	Very high	95.9	Very high	94 Å²	94	28.1 Å²	28.1	36%	0.355	14%	0.14	S	C	.	.	H	α-helix	trans	-61.2	-45.4	176.1	179.2	-179.4	-71.3	-107.6	2.6	111.5	L673 H732 D733 V734 T740	L673-R736 HydrophobicContact CD1-CB 3.92Å; L673-R736 HydrophobicContact CD1-CG 4.03Å; L673-R736 HydrophobicContact CD2-CB 3.94Å; H732-R736 PolarHBondContact CE1-NE 2.85Å; H732-R736 PolarHBondContact CE1-NH2 2.9Å; H732-R736 PolarHBondContact NE2-NE 2.75Å; H732-R736 VanDerWaalsContact NE2-NE 3.19Å; H732-R736 PolarHBondContact NE2-NH2 2.81Å; H732-R736 VanDerWaalsContact O-CB 3.27Å; H732-R736 WeakPolarHBondContact O-CB 3.21Å; H732-R736 PolarHBondContact O-N 3.49Å; D733-R736 PolarHBondContact O-N 3.24Å; V734-R736 VanDerWaalsContact C-N 3.29Å; V734-R736 PolarHBondContact O-N 3.29Å; R736-T740 HydrophobicContact CG-CG2 4.47Å; R736-T740 WeakPolarHBondContact O-CB 3.41Å; R736-T740 VanDerWaalsContact O-CG2 3.29Å; R736-T740 WeakPolarHBondContact O-CG2 3.41Å; R736-T740 PolarHBondContact O-N 3.34Å; R736-T740 PolarHBondContact O-OG1 3.01Å
737	K	96.7	Very high	95.6	Very high	68 Å²	68	30.2 Å²	30.2	30%	0.296	16%	0.156	S	C	.	.	H	α-helix	trans	-63.5	-43.9	177	-68.1	-54.1	-177.2	-177.3	0	111.8	D733 V734 T740 D741 W745 W781 V784	D733-K737 WeakPolarHBondContact O-CG 3.34Å; D733-K737 PolarHBondContact O-N 3.24Å; V734-K737 PolarHBondContact O-N 3.33Å; K737-T740 PolarHBondContact O-OG1 3.46Å; K737-D741 PolarHBondContact O-N 2.74Å; K737-W745 HydrophobicContact CB-CB 4.18Å; K737-W745 HydrophobicContact CB-CD2 3.84Å; K737-W745 HydrophobicContact CB-CE3 4.15Å; K737-W745 HydrophobicContact CB-CG 3.84Å; K737-W745 HydrophobicContact CD-CD2 4.16Å; K737-W745 HydrophobicContact CD-CH2 4.25Å; K737-W745 HydrophobicContact CD-CZ2 3.86Å; K737-W745 HydrophobicContact CG-CD2 4.09Å; K737-W745 HydrophobicContact CG-CE3 4.16Å; K737-W745 HydrophobicContact CG-CZ2 4.49Å; K737-W745 HydrophobicContact CG-CZ3 4.39Å; K737-W781 HydrophobicContact CB-CH2 3.79Å; K737-W781 HydrophobicContact CB-CZ2 4.41Å; K737-W781 HydrophobicContact CB-CZ3 4.31Å; K737-W781 HydrophobicContact CG-CH2 4.28Å; K737-W781 HydrophobicContact CG-CZ3 4.3Å; K737-V784 HydrophobicContact CG-CG1 4.17Å; K737-V784 HydrophobicContact CG-CG2 4.46Å
738	L	96.9	Very high	95.5	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65.1	-43.7	177.6	-66.8	176.4	0	0	0	112	F626 V734 C735 T740 Y742 W745 W781	F626-L738 HydrophobicContact CB-CD1 3.76Å; F626-L738 HydrophobicContact CD1-CB 4.31Å; F626-L738 HydrophobicContact CD1-CD1 4.42Å; F626-L738 HydrophobicContact CD2-CB 4.14Å; F626-L738 HydrophobicContact CE1-CB 4.46Å; F626-L738 HydrophobicContact CE2-CB 4.31Å; F626-L738 HydrophobicContact CG-CB 4.14Å; F626-L738 HydrophobicContact CG-CD1 3.99Å; F626-L738 HydrophobicContact CZ-CB 4.46Å; V734-L738 HydrophobicContact CG1-CD1 4.06Å; V734-L738 WeakPolarHBondContact O-CG 3.41Å; V734-L738 PolarHBondContact O-N 2.98Å; C735-L738 PolarHBondContact O-N 2.69Å; L738-T740 PolarHBondContact O-N 2.83Å; L738-Y742 HydrophobicContact CB-CD2 4.08Å; L738-Y742 HydrophobicContact CB-CE2 4.32Å; L738-Y742 HydrophobicContact CD2-CD2 4.23Å; L738-Y742 HydrophobicContact CD2-CE2 4.09Å; L738-Y742 WeakPolarHBondContact O-CA 3.06Å; L738-Y742 VanDerWaalsContact O-CB 3.23Å; L738-Y742 WeakPolarHBondContact O-CB 3.46Å; L738-Y742 WeakPolarHBondContact O-CD2 3.47Å; L738-Y742 PolarHBondContact O-N 3.42Å; L738-W745 HydrophobicContact CD2-CB 4.29Å; L738-W781 HydrophobicContact CD2-CZ2 4.32Å
739	A	97.1	Very high	95.4	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-69.3	-31.9	-179.6	0	0	0	0	0	113.3	F626 F661 I669 C735	F626-A739 HydrophobicContact CE2-CB 3.92Å; F626-A739 HydrophobicContact CZ-CB 4.24Å; F661-A739 VanDerWaalsContact CD1-O 3.29Å; F661-A739 WeakPolarHBondContact CD1-O 3.48Å; I669-A739 HydrophobicContact CD1-CB 4.39Å; I669-A739 HydrophobicContact CG2-CB 3.79Å; C735-A739 WeakPolarHBondContact O-CB 3.48Å; C735-A739 PolarHBondContact O-N 3.29Å
740	T	95.4	Very high	95.4	Very high	42 Å²	42	26.1 Å²	26.1	26%	0.258	13%	0.127	S	C	.	.	H	α-helix	trans	-90	-25.1	-176.9	54.7	0	0	0	0	113.9	Y662 R736 K737 L738	Y662-T740 HydrophobicContact CD1-CG2 4.28Å; Y662-T740 HydrophobicContact CD2-CG2 3.68Å; Y662-T740 HydrophobicContact CE1-CG2 4.36Å; Y662-T740 HydrophobicContact CE2-CG2 3.79Å; Y662-T740 HydrophobicContact CG-CG2 3.94Å; R736-T740 HydrophobicContact CG-CG2 4.47Å; R736-T740 WeakPolarHBondContact O-CB 3.41Å; R736-T740 VanDerWaalsContact O-CG2 3.29Å; R736-T740 WeakPolarHBondContact O-CG2 3.41Å; R736-T740 PolarHBondContact O-N 3.34Å; R736-T740 PolarHBondContact O-OG1 3.01Å; K737-T740 PolarHBondContact O-OG1 3.46Å; L738-T740 PolarHBondContact O-N 2.83Å
741	D	92.2	Very high	95.4	Very high	7 Å²	7	26.7 Å²	26.7	4%	0.037	13%	0.13	C	C	.	.	H	α-helix	trans	-160.2	59.8	-176.4	-175.7	8.8	0	0	0	112	R423 K737 R743 N744 W745	R423-D741 VanDerWaalsContact CD-OD2 3.26Å; R423-D741 WeakPolarHBondContact CD-OD2 3.48Å; R423-D741 WeakPolarHBondContact CG-OD2 3.49Å; R423-D741 IonicContact CZ-OD2 2.64Å; R423-D741 IonicContact NE-OD2 3.66Å; R423-D741 VanDerWaalsContact NH1-CB 3.29Å; R423-D741 IonicContact NH1-OD1 2.77Å; R423-D741 IonicContact NH1-OD2 3.31Å; R423-D741 PolarHBondContact NH1-OD2 2.72Å; K737-D741 PolarHBondContact O-N 2.74Å; D741-R743 PolarHBondContact O-N 3.25Å; D741-N744 PolarHBondContact O-N 3.15Å; D741-N744 VanDerWaalsContact O-N 3.17Å; D741-N744 PolarHBondContact OD1-N 3.33Å; D741-N744 PolarHBondContact OD1-ND2 2.96Å; D741-N744 PolarHBondContact OD2-ND2 2.79Å; D741-W745 VanDerWaalsContact O-CD1 3.3Å; D741-W745 PolarHBondContact O-N 3.31Å
742	Y	93.6	Very high	95.4	Very high	4 Å²	4	26.5 Å²	26.5	2%	0.016	13%	0.129	C	C	.	.	H	α-helix	trans	-51.8	-45	-176.8	-162.5	-81.2	0	0	0	112.3	H623 F626 L656 F657 L706 W707 L738 N744 W745 R746	H623-Y742 AromaticContact CE1-CZ 3.62Å; H623-Y742 PolarHBondContact CE1-OH 3.19Å; H623-Y742 AromaticContact ND1-CE2 3.88Å; H623-Y742 AromaticContact ND1-CZ 3.61Å; H623-Y742 PolarHBondContact ND1-OH 3.41Å; F626-Y742 HydrophobicContact CD1-CD2 4.46Å; F626-Y742 HydrophobicContact CD1-CE2 4.01Å; F626-Y742 HydrophobicContact CE1-CD2 4.03Å; F626-Y742 AromaticContact CE1-CE2 3.98Å; F626-Y742 HydrophobicContact CE1-CE2 3.98Å; L656-Y742 HydrophobicContact CD1-CD2 3.91Å; L656-Y742 HydrophobicContact CD1-CG 3.93Å; L656-Y742 HydrophobicContact CD2-CD1 4.25Å; L656-Y742 HydrophobicContact CD2-CD2 4.16Å; L656-Y742 HydrophobicContact CD2-CE2 4.41Å; L656-Y742 HydrophobicContact CD2-CG 4.09Å; L656-Y742 HydrophobicContact CG-CD1 4.18Å; L656-Y742 HydrophobicContact CG-CD2 4.11Å; L656-Y742 HydrophobicContact CG-CG 3.76Å; L656-Y742 WeakPolarHBondContact O-CB 3.31Å; F657-Y742 HydrophobicContact CD1-CD1 4.17Å; F657-Y742 AromaticContact CE1-CD1 3.83Å; F657-Y742 HydrophobicContact CE1-CD1 3.83Å; F657-Y742 HydrophobicContact CE1-CE1 4.19Å; L706-Y742 HydrophobicContact CD2-CE1 3.89Å; L706-Y742 HydrophobicContact CD2-CE2 4.07Å; W707-Y742 HydrophobicContact CD2-CE1 4.35Å; W707-Y742 HydrophobicContact CE3-CD1 4.37Å; W707-Y742 AromaticContact CE3-CE1 3.19Å; W707-Y742 HydrophobicContact CE3-CE1 3.19Å; W707-Y742 AromaticContact CE3-CZ 3.45Å; W707-Y742 VanDerWaalsContact CE3-CZ 3.45Å; W707-Y742 HydrophobicContact CH2-CE1 4.2Å; W707-Y742 AromaticContact CZ3-CD1 3.92Å; W707-Y742 HydrophobicContact CZ3-CD1 3.92Å; W707-Y742 AromaticContact CZ3-CE1 3.08Å; W707-Y742 HydrophobicContact CZ3-CE1 3.08Å; W707-Y742 AromaticContact CZ3-CZ 3.84Å; L738-Y742 HydrophobicContact CB-CD2 4.08Å; L738-Y742 HydrophobicContact CB-CE2 4.32Å; L738-Y742 HydrophobicContact CD2-CD2 4.23Å; L738-Y742 HydrophobicContact CD2-CE2 4.09Å; L738-Y742 WeakPolarHBondContact O-CA 3.06Å; L738-Y742 VanDerWaalsContact O-CB 3.23Å; L738-Y742 WeakPolarHBondContact O-CB 3.46Å; L738-Y742 WeakPolarHBondContact O-CD2 3.47Å; L738-Y742 PolarHBondContact O-N 3.42Å; Y742-N744 VanDerWaalsContact C-N 3.25Å; Y742-N744 PolarHBondContact O-N 3.24Å; Y742-N744 VanDerWaalsContact O-N 3.16Å; Y742-W745 PolarHBondContact O-N 3.36Å; Y742-R746 HydrophobicContact CD1-CB 3.87Å; Y742-R746 HydrophobicContact CE1-CB 3.38Å; Y742-R746 HydrophobicContact CE1-CG 4.36Å; Y742-R746 WeakPolarHBondContact O-CB 3.41Å; Y742-R746 PolarHBondContact O-N 3.39Å
743	R	89.4	Confident	95.4	Very high	44 Å²	44	26.1 Å²	26.1	17%	0.166	13%	0.127	C	C	.	.	H	α-helix	trans	-52.6	-41.4	-177.4	177.7	176.3	60.6	140.8	-7.2	113.1	P381 F657 D741	P381-R743 VanDerWaalsContact CB-NH1 3.33Å; F657-R743 HydrophobicContact CB-CB 4.26Å; F657-R743 HydrophobicContact CD1-CB 4.32Å; F657-R743 WeakPolarHBondContact O-CD 3.44Å; D741-R743 PolarHBondContact O-N 3.25Å
744	N	87.8	Confident	95.4	Very high	32 Å²	32	24.2 Å²	24.2	17%	0.171	12%	0.117	C	C	.	.	H	α-helix	trans	-93.8	-28.1	-176.4	-64.5	-76.4	0	0	0	112.7	R423 D741 Y742 Q777	R423-N744 HydrophobicContact CB-CB 4.28Å; R423-N744 HydrophobicContact CG-CB 4.49Å; R423-N744 WeakPolarHBondContact CG-ND2 3.19Å; D741-N744 PolarHBondContact O-N 3.15Å; D741-N744 VanDerWaalsContact O-N 3.17Å; D741-N744 PolarHBondContact OD1-N 3.33Å; D741-N744 PolarHBondContact OD1-ND2 2.96Å; D741-N744 PolarHBondContact OD2-ND2 2.79Å; Y742-N744 VanDerWaalsContact C-N 3.25Å; Y742-N744 PolarHBondContact O-N 3.24Å; Y742-N744 VanDerWaalsContact O-N 3.16Å; N744-Q777 VanDerWaalsContact O-CD 3.27Å; N744-Q777 PolarHBondContact O-NE2 2.84Å; N744-Q777 PolarHBondContact O-OE1 3.22Å
745	W	93.1	Very high	95.4	Very high	16 Å²	16	24.5 Å²	24.5	6%	0.061	12%	0.118	C	C	.	.	H	α-helix	trans	-94.7	-7.3	-177.8	-68.9	93.3	0	0	0	114.5	A424 K737 L738 D741 Y742 S747 M780 W781 V784	A424-W745 HydrophobicContact CB-CZ2 4.4Å; K737-W745 HydrophobicContact CB-CB 4.18Å; K737-W745 HydrophobicContact CB-CD2 3.84Å; K737-W745 HydrophobicContact CB-CE3 4.15Å; K737-W745 HydrophobicContact CB-CG 3.84Å; K737-W745 HydrophobicContact CD-CD2 4.16Å; K737-W745 HydrophobicContact CD-CH2 4.25Å; K737-W745 HydrophobicContact CD-CZ2 3.86Å; K737-W745 HydrophobicContact CG-CD2 4.09Å; K737-W745 HydrophobicContact CG-CE3 4.16Å; K737-W745 HydrophobicContact CG-CZ2 4.49Å; K737-W745 HydrophobicContact CG-CZ3 4.39Å; L738-W745 HydrophobicContact CD2-CB 4.29Å; D741-W745 VanDerWaalsContact O-CD1 3.3Å; D741-W745 PolarHBondContact O-N 3.31Å; Y742-W745 PolarHBondContact O-N 3.36Å; W745-S747 PolarHBondContact O-N 3.48Å; W745-M780 HydrophobicContact CH2-CB 3.96Å; W745-M780 HydrophobicContact CZ3-CB 4.18Å; W745-W781 HydrophobicContact CB-CZ2 3.87Å; W745-W781 HydrophobicContact CD2-CZ2 4.42Å; W745-W781 AromaticContact CE3-CD2 3.65Å; W745-W781 HydrophobicContact CE3-CD2 3.65Å; W745-W781 AromaticContact CE3-CE2 3.44Å; W745-W781 VanDerWaalsContact CE3-CE2 3.44Å; W745-W781 HydrophobicContact CE3-CE3 4.08Å; W745-W781 HydrophobicContact CE3-CG 4.12Å; W745-W781 HydrophobicContact CE3-CH2 4.14Å; W745-W781 AromaticContact CE3-CZ2 3.73Å; W745-W781 HydrophobicContact CE3-CZ2 3.73Å; W745-W781 HydrophobicContact CE3-CZ3 4.29Å; W745-W781 AromaticContact CE3-NE1 3.72Å; W745-W781 AromaticContact CZ3-CD2 3.86Å; W745-W781 HydrophobicContact CZ3-CD2 3.86Å; W745-W781 HydrophobicContact CZ3-CE3 4.1Å; W745-W781 HydrophobicContact CZ3-CG 4.11Å; W745-W781 VanDerWaalsContact O-CZ2 3.25Å; W745-W781 WeakPolarHBondContact O-CZ2 3.5Å; W745-W781 PolarHBondContact O-NE1 2.91Å; W745-V784 HydrophobicContact CH2-CG2 3.57Å; W745-V784 HydrophobicContact CZ3-CG2 3.74Å
746	R	92.9	Very high	95.4	Very high	98 Å²	98	24.4 Å²	24.4	37%	0.37	12%	0.117	S	C	.	.	S	Bend	trans	-62.3	-12.4	-177.4	67.5	178.9	-175.1	127.5	6.1	116.8	H623 W707 Y742	H623-R746 PolarHBondContact CE1-O 3.3Å; H623-R746 PolarHBondContact NE2-O 3.26Å; W707-R746 VanDerWaalsContact CH2-NH1 3.35Å; Y742-R746 HydrophobicContact CD1-CB 3.87Å; Y742-R746 HydrophobicContact CE1-CB 3.38Å; Y742-R746 HydrophobicContact CE1-CG 4.36Å; Y742-R746 WeakPolarHBondContact O-CB 3.41Å; Y742-R746 PolarHBondContact O-N 3.39Å
747	S	92.7	Very high	95.3	Very high	60 Å²	60	21.5 Å²	21.5	42%	0.42	11%	0.111	S	C	.	.	S	Bend	trans	-136.7	157.9	-176	57.9	0	0	0	0	110.6	W745 Q777 W781	W745-S747 PolarHBondContact O-N 3.48Å; S747-Q777 WeakPolarHBondContact O-CG 3.36Å; S747-W781 PolarHBondContact O-NE1 3.05Å
748	G	94.2	Very high	95.3	Very high	15 Å²	15	23.1 Å²	23.1	16%	0.155	13%	0.126	C	C	.	.			trans	91.7	10	175.9	0	0	0	0	0	114.5	S619 Q778 W781	S619-G748 PolarHBondContact OG-N 2.98Å; G748-Q778 WeakPolarHBondContact O-CA 3.1Å; G748-Q778 WeakPolarHBondContact O-CG 3.27Å; G748-W781 WeakPolarHBondContact O-CB 3.42Å
749	L	96	Very high	95.2	Very high	3 Å²	3	28.1 Å²	28.1	2%	0.016	15%	0.15	C	C	.	.			trans	-65.8	153	162.5	-78.1	141	0	0	0	110	S619 Y622 W781	S619-L749 PolarHBondContact OG-N 2.97Å; Y622-L749 HydrophobicContact CD1-CD2 4.22Å; Y622-L749 HydrophobicContact CD2-CB 3.9Å; Y622-L749 HydrophobicContact CD2-CD1 3.68Å; Y622-L749 HydrophobicContact CD2-CD2 3.81Å; Y622-L749 HydrophobicContact CD2-CG 3.98Å; Y622-L749 HydrophobicContact CE1-CD2 4.3Å; Y622-L749 HydrophobicContact CE2-CB 3.96Å; Y622-L749 HydrophobicContact CE2-CD1 4.5Å; Y622-L749 HydrophobicContact CE2-CD2 3.9Å; Y622-L749 HydrophobicContact CE2-CG 4.32Å; Y622-L749 HydrophobicContact CG-CD1 3.85Å; Y622-L749 HydrophobicContact CG-CD2 3.96Å; Y622-L749 HydrophobicContact CG-CG 4.38Å; L749-W781 HydrophobicContact CD1-CH2 4.34Å; L749-W781 HydrophobicContact CD1-CZ2 3.75Å; L749-W781 HydrophobicContact CD2-CD2 3.69Å; L749-W781 HydrophobicContact CD2-CE3 3.69Å; L749-W781 HydrophobicContact CD2-CG 4.27Å; L749-W781 HydrophobicContact CD2-CH2 4.12Å; L749-W781 HydrophobicContact CD2-CZ2 4.1Å; L749-W781 HydrophobicContact CD2-CZ3 3.93Å; L749-W781 HydrophobicContact CG-CD2 3.7Å; L749-W781 HydrophobicContact CG-CE3 4.22Å; L749-W781 HydrophobicContact CG-CG 4.04Å; L749-W781 HydrophobicContact CG-CH2 4.39Å; L749-W781 HydrophobicContact CG-CZ2 3.87Å
750	P	97.5	Very high	95.2	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	17%	0.174	C	C	.	.			trans	-60.6	153	-174.3	-29	40.3	0	0	0	115	E618 L752 I764 E766 L782 L785	E618-P750 CarbonylContact C-O 3.55Å; E618-P750 WeakPolarHBondContact CA-O 3.17Å; P750-L752 PolarHBondContact O-N 3.35Å; P750-I764 HydrophobicContact CB-CG2 3.44Å; P750-I764 VanDerWaalsContact CB-CG2 3.44Å; P750-I764 HydrophobicContact CG-CG2 3.42Å; P750-I764 VanDerWaalsContact CG-CG2 3.42Å; P750-E766 WeakPolarHBondContact CA-OE2 3.12Å; P750-E766 HydrophobicContact CB-CB 4.05Å; P750-L782 HydrophobicContact CG-CD2 3.83Å; P750-L785 HydrophobicContact CG-CD1 3.78Å
751	D	97.8	Very high	95.3	Very high	17 Å²	17	33.3 Å²	33.3	9%	0.091	17%	0.174	C	C	.	.	S	Bend	trans	-59.8	-43.8	-174.1	-54.6	-55.6	0	0	0	112.8	E598 H616 C617 E618 V765 V767	E598-D751 HydrophobicContact CG-CB 4.33Å; H616-D751 CarbonylContact C-O 3.46Å; H616-D751 WeakPolarHBondContact CA-O 3.36Å; H616-D751 PolarHBondContact CD2-O 3.05Å; C617-D751 PolarHBondContact N-O 3.43Å; E618-D751 PolarHBondContact N-O 3.33Å; D751-V765 PolarHBondContact N-O 3.05Å; D751-V767 HydrophobicContact CB-CG2 4.38Å; D751-V767 PolarHBondContact OD2-N 3.33Å
752	L	98.3	Very high	95.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	144.2	-170.2	-44.8	-176.6	0	0	0	113.1	E598 T601 V602 I615 H616 P750 V765 V767	E598-L752 HydrophobicContact CB-CD2 4.07Å; T601-L752 HydrophobicContact CG2-CD1 3.64Å; V602-L752 HydrophobicContact CG2-CB 4.42Å; V602-L752 HydrophobicContact CG2-CD1 3.7Å; V602-L752 HydrophobicContact CG2-CD2 3.44Å; V602-L752 VanDerWaalsContact CG2-CD2 3.44Å; V602-L752 HydrophobicContact CG2-CG 4.05Å; I615-L752 WeakPolarHBondContact O-CA 3.43Å; H616-L752 HydrophobicContact CB-CD2 3.72Å; P750-L752 PolarHBondContact O-N 3.35Å; L752-V765 HydrophobicContact CB-CB 4.11Å; L752-V765 HydrophobicContact CD1-CB 4.28Å; L752-V765 HydrophobicContact CG-CB 4.45Å; L752-V765 PolarHBondContact N-O 3.34Å; L752-V765 PolarHBondContact O-N 2.9Å; L752-V767 HydrophobicContact CD1-CG2 3.58Å; L752-V767 HydrophobicContact CD2-CG2 4.42Å; L752-V767 HydrophobicContact CG-CG2 3.74Å
753	L	98.4	Very high	95.8	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	123.6	162.6	176.5	63.7	0	0	0	109	G614 I615 I621 I722 L726 W755 A762 I764	G614-L753 WeakPolarHBondContact CA-O 3.37Å; I615-L753 HydrophobicContact CG2-CB 4.11Å; I615-L753 PolarHBondContact N-O 3.41Å; I615-L753 PolarHBondContact O-N 3.31Å; I621-L753 HydrophobicContact CG1-CD2 4Å; I621-L753 HydrophobicContact CG2-CD2 4.06Å; I722-L753 HydrophobicContact CD1-CD2 4.35Å; I722-L753 HydrophobicContact CG1-CD2 4.37Å; I722-L753 HydrophobicContact CG2-CD2 3.79Å; L726-L753 HydrophobicContact CD2-CD1 3.74Å; L726-L753 HydrophobicContact CG-CD1 4.39Å; L753-W755 HydrophobicContact CG-CE3 4.25Å; L753-A762 HydrophobicContact CD1-CB 4.18Å; L753-I764 HydrophobicContact CD1-CG1 4.11Å
754	L	98.4	Very high	96.2	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	139.5	173.4	-63.9	146.8	0	0	0	108.3	Y605 M606 F611 H613 A762 K763 V765	Y605-L754 VanDerWaalsContact CB-CD1 3.49Å; Y605-L754 HydrophobicContact CD1-CD1 3.73Å; Y605-L754 HydrophobicContact CD2-CD1 4.23Å; Y605-L754 HydrophobicContact CG-CD1 3.55Å; M606-L754 HydrophobicContact CG-CD2 4.12Å; F611-L754 HydrophobicContact CB-CB 4.19Å; F611-L754 HydrophobicContact CB-CD2 4.09Å; F611-L754 HydrophobicContact CD1-CB 3.6Å; F611-L754 HydrophobicContact CD2-CB 4.05Å; F611-L754 HydrophobicContact CD2-CD1 4.25Å; F611-L754 HydrophobicContact CD2-CD2 4.37Å; F611-L754 HydrophobicContact CD2-CG 4.47Å; F611-L754 HydrophobicContact CE1-CB 3.85Å; F611-L754 HydrophobicContact CE2-CB 4.31Å; F611-L754 HydrophobicContact CE2-CD1 4.28Å; F611-L754 HydrophobicContact CG-CB 3.69Å; F611-L754 HydrophobicContact CG-CD2 4.26Å; F611-L754 HydrophobicContact CG-CG 4.44Å; F611-L754 HydrophobicContact CZ-CB 4.22Å; H613-L754 WeakPolarHBondContact O-CA 3.18Å; L754-A762 CarbonylContact O-C 3.38Å; L754-A762 WeakPolarHBondContact O-CA 3.3Å; L754-K763 HydrophobicContact CB-CB 4.49Å; L754-K763 PolarHBondContact N-O 3.29Å; L754-K763 PolarHBondContact O-N 2.96Å; L754-V765 HydrophobicContact CD1-CG2 3.9Å
755	W	98.1	Very high	96.7	Very high	10 Å²	10	31 Å²	31	4%	0.038	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	159.4	178	73.4	104.7	0	0	0	112.4	H613 I615 I722 C725 L753 R761 A762	H613-W755 HydrophobicContact CB-CD2 3.56Å; H613-W755 HydrophobicContact CB-CE3 3.83Å; H613-W755 HydrophobicContact CB-CG 4.25Å; H613-W755 HydrophobicContact CB-CH2 3.67Å; H613-W755 HydrophobicContact CB-CZ2 3.39Å; H613-W755 HydrophobicContact CB-CZ3 3.87Å; H613-W755 AromaticContact CD2-NE1 3.66Å; H613-W755 AromaticContact CG-CE2 3.8Å; H613-W755 AromaticContact CG-CZ2 3.85Å; H613-W755 AromaticContact CG-NE1 3.94Å; H613-W755 PolarHBondContact N-O 3.29Å; H613-W755 PolarHBondContact O-N 3.48Å; I615-W755 HydrophobicContact CB-CZ3 4.28Å; I615-W755 HydrophobicContact CG2-CZ3 3.95Å; I722-W755 HydrophobicContact CD1-CD2 4.28Å; I722-W755 HydrophobicContact CD1-CE3 4.42Å; I722-W755 HydrophobicContact CD1-CH2 4.05Å; I722-W755 HydrophobicContact CD1-CZ2 3.89Å; I722-W755 HydrophobicContact CD1-CZ3 4.32Å; I722-W755 HydrophobicContact CG1-CD2 3.75Å; I722-W755 HydrophobicContact CG1-CE3 4.25Å; I722-W755 HydrophobicContact CG1-CG 4.02Å; I722-W755 HydrophobicContact CG1-CZ2 4.09Å; C725-W755 HydrophobicContact CB-CB 3.97Å; L753-W755 HydrophobicContact CG-CE3 4.25Å; W755-R761 CarbonylContact C-O 3.55Å; W755-R761 VanDerWaalsContact CA-O 3.3Å; W755-R761 WeakPolarHBondContact CA-O 3.44Å; W755-A762 HydrophobicContact CB-CB 4.26Å
756	S	98.2	Very high	97	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	96.2	178.4	-60.5	0	0	0	0	108.3	F611 E612 T758 E759 T760 R761	F611-S756 WeakPolarHBondContact CA-OG 3.26Å; E612-S756 PolarHBondContact N-OG 3.15Å; S756-T758 PolarHBondContact O-N 2.87Å; S756-E759 CarbonylContact O-C 3.58Å; S756-E759 PolarHBondContact O-N 3.41Å; S756-E759 VanDerWaalsContact O-N 3.15Å; S756-T760 PolarHBondContact O-N 3.47Å; S756-R761 PolarHBondContact N-O 3.42Å; S756-R761 PolarHBondContact O-N 3.12Å
757	P	96.5	Very high	97.2	Very high	32 Å²	32	25.8 Å²	25.8	21%	0.208	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-54.7	-37.1	-178.9	-25.8	32	0	0	0	113.1	E612 D721 E759 T760	E612-P757 VanDerWaalsContact OE2-CD 3.26Å; E612-P757 WeakPolarHBondContact OE2-CD 3.41Å; D721-P757 HydrophobicContact CB-CB 4.12Å; D721-P757 HydrophobicContact CB-CG 3.83Å; P757-E759 VanDerWaalsContact C-N 3.3Å; P757-E759 PolarHBondContact O-N 3.25Å; P757-T760 PolarHBondContact O-N 3.01Å
758	T	96.6	Very high	97.3	Very high	102 Å²	102	23.5 Å²	23.5	63%	0.626	13%	0.129	S	C	*	.	G	3₁₀ helix	trans	-61.9	-35.7	179.2	56.7	0	0	0	0	113.5	E612 S756	E612-T758 WeakPolarHBondContact OE1-CB 3.21Å; E612-T758 WeakPolarHBondContact OE1-CG2 3.25Å; E612-T758 PolarHBondContact OE1-OG1 3.45Å; E612-T758 PolarHBondContact OE2-OG1 2.94Å; S756-T758 PolarHBondContact O-N 2.87Å
759	E	96	Very high	97.1	Very high	106 Å²	106	23.5 Å²	23.5	50%	0.495	13%	0.128	S	C	.	.	G	3₁₀ helix	trans	-99.1	-0.4	178.5	-66.8	-177.4	-148.9	0	0	112.2	S756 P757 R761	S756-E759 CarbonylContact O-C 3.58Å; S756-E759 PolarHBondContact O-N 3.41Å; S756-E759 VanDerWaalsContact O-N 3.15Å; P757-E759 VanDerWaalsContact C-N 3.3Å; P757-E759 PolarHBondContact O-N 3.25Å; E759-R761 HydrophobicContact CB-CG 3.97Å; E759-R761 PolarHBondContact O-N 3.36Å; E759-R761 IonicContact OE1-NH2 2.85Å; E759-R761 WeakPolarHBondContact OE2-CD 3.31Å; E759-R761 IonicContact OE2-CZ 2.9Å; E759-R761 IonicContact OE2-NE 3.59Å; E759-R761 PolarHBondContact OE2-NE 2.86Å; E759-R761 IonicContact OE2-NH2 3.71Å; E759-R761 PolarHBondContact OE2-NH2 3.34Å
760	T	96.1	Very high	96.6	Very high	85 Å²	85	27.1 Å²	27.1	52%	0.521	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	43.1	-176.2	52.9	0	0	0	0	113.3	S756 P757	S756-T760 PolarHBondContact O-N 3.47Å; P757-T760 PolarHBondContact O-N 3.01Å
761	R	97.3	Very high	96	Very high	67 Å²	67	30.5 Å²	30.5	25%	0.253	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	144.5	-178.9	69.6	177.5	174.6	94.7	1.9	112.4	K609 N610 W755 S756 E759	K609-R761 PolarHBondContact O-NH2 3.01Å; N610-R761 PolarHBondContact O-NH2 2.95Å; W755-R761 CarbonylContact C-O 3.55Å; W755-R761 VanDerWaalsContact CA-O 3.3Å; W755-R761 WeakPolarHBondContact CA-O 3.44Å; S756-R761 PolarHBondContact N-O 3.42Å; S756-R761 PolarHBondContact O-N 3.12Å; E759-R761 HydrophobicContact CB-CG 3.97Å; E759-R761 PolarHBondContact O-N 3.36Å; E759-R761 IonicContact OE1-NH2 2.85Å; E759-R761 WeakPolarHBondContact OE2-CD 3.31Å; E759-R761 IonicContact OE2-CZ 2.9Å; E759-R761 IonicContact OE2-NE 3.59Å; E759-R761 PolarHBondContact OE2-NE 2.86Å; E759-R761 IonicContact OE2-NH2 3.71Å; E759-R761 PolarHBondContact OE2-NH2 3.34Å
762	A	98.3	Very high	95.7	Very high	12 Å²	12	32.3 Å²	32.3	10%	0.099	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	156.1	169.1	0	0	0	0	0	111.1	C725 L726 L753 L754 W755	C725-A762 HydrophobicContact CB-CB 3.88Å; C725-A762 VanDerWaalsContact O-CB 3.31Å; C725-A762 WeakPolarHBondContact O-CB 3.34Å; C725-A762 PolarHBondContact O-N 3.1Å; C725-A762 VanDerWaalsContact O-N 3.12Å; L726-A762 HydrophobicContact CD2-CB 3.93Å; L726-A762 HydrophobicContact CG-CB 4.25Å; L753-A762 HydrophobicContact CD1-CB 4.18Å; L754-A762 CarbonylContact O-C 3.38Å; L754-A762 WeakPolarHBondContact O-CA 3.3Å; W755-A762 HydrophobicContact CB-CB 4.26Å
763	K	98.3	Very high	95.3	Very high	25 Å²	25	39.4 Å²	39.4	11%	0.109	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	131.9	167.8	-179.8	175	-74.4	-72.9	0	109.9	Y605 F611 L754 V765 D791 E793	Y605-K763 HydrophobicContact CD1-CD 4.27Å; Y605-K763 HydrophobicContact CE1-CD 3.95Å; F611-K763 HydrophobicContact CE1-CB 3.81Å; F611-K763 HydrophobicContact CE2-CB 4.19Å; F611-K763 HydrophobicContact CE2-CD 4.11Å; F611-K763 HydrophobicContact CZ-CB 3.32Å; F611-K763 HydrophobicContact CZ-CD 3.94Å; F611-K763 HydrophobicContact CZ-CG 4.25Å; L754-K763 HydrophobicContact CB-CB 4.49Å; L754-K763 PolarHBondContact N-O 3.29Å; L754-K763 PolarHBondContact O-N 2.96Å; K763-V765 HydrophobicContact CD-CG2 4.08Å; K763-V765 HydrophobicContact CG-CG2 3.8Å; K763-D791 WeakPolarHBondContact CA-O 3.46Å; K763-D791 WeakPolarHBondContact CE-OD2 3.26Å; K763-D791 IonicContact NZ-OD1 3.69Å; K763-D791 PolarHBondContact NZ-OD1 2.96Å; K763-D791 IonicContact NZ-OD2 2.79Å; K763-D791 PolarHBondContact NZ-OD2 3.46Å; K763-E793 HydrophobicContact CD-CG 4.31Å; K763-E793 IonicContact NZ-OE2 3.64Å; K763-E793 PolarHBondContact NZ-OE2 3.05Å
764	I	98.6	Very high	95.1	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	124.6	179.1	-54.8	174.2	0	0	0	107.8	Y622 L726 P750 L753 L785 A790 D791 V792 E793	Y622-I764 WeakPolarHBondContact OH-CG2 3.4Å; L726-I764 HydrophobicContact CD2-CD1 3.87Å; L726-I764 HydrophobicContact CD2-CG1 4.07Å; P750-I764 HydrophobicContact CB-CG2 3.44Å; P750-I764 VanDerWaalsContact CB-CG2 3.44Å; P750-I764 HydrophobicContact CG-CG2 3.42Å; P750-I764 VanDerWaalsContact CG-CG2 3.42Å; L753-I764 HydrophobicContact CD1-CG1 4.11Å; I764-L785 HydrophobicContact CD1-CD1 4.15Å; I764-L785 HydrophobicContact CD1-CD2 3.83Å; I764-L785 HydrophobicContact CG2-CD1 4.16Å; I764-A790 HydrophobicContact CD1-CB 3.99Å; I764-D791 PolarHBondContact N-O 3.31Å; I764-V792 HydrophobicContact CB-CB 4.24Å; I764-V792 HydrophobicContact CB-CG2 4.22Å; I764-V792 HydrophobicContact CG2-CG2 4.31Å; I764-V792 VanDerWaalsContact O-CA 3.26Å; I764-V792 WeakPolarHBondContact O-CA 3.41Å; I764-E793 PolarHBondContact O-N 3.39Å
765	V	98.4	Very high	94.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	124.4	-174	-173.2	0	0	0	0	110.8	Y605 D751 L752 L754 K763 V767 E793 C795	Y605-V765 HydrophobicContact CE1-CG2 4.28Å; Y605-V765 HydrophobicContact CE2-CG1 4.35Å; D751-V765 PolarHBondContact N-O 3.05Å; L752-V765 HydrophobicContact CB-CB 4.11Å; L752-V765 HydrophobicContact CD1-CB 4.28Å; L752-V765 HydrophobicContact CG-CB 4.45Å; L752-V765 PolarHBondContact N-O 3.34Å; L752-V765 PolarHBondContact O-N 2.9Å; L754-V765 HydrophobicContact CD1-CG2 3.9Å; K763-V765 HydrophobicContact CD-CG2 4.08Å; K763-V765 HydrophobicContact CG-CG2 3.8Å; V765-V767 HydrophobicContact CG1-CG2 4.27Å; V765-E793 WeakPolarHBondContact CA-O 3.46Å; V765-E793 HydrophobicContact CG1-CG 4.34Å; V765-E793 HydrophobicContact CG2-CG 4.04Å; V765-C795 HydrophobicContact CG1-CB 3.37Å
766	E	98.4	Very high	94.5	Very high	0 Å²	0	45 Å²	45	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	121.2	168.3	174.4	66.7	-155.8	0	0	108.8	P750 K768 L774 Q778 L782 E793 I794 C795	P750-E766 WeakPolarHBondContact CA-OE2 3.12Å; P750-E766 HydrophobicContact CB-CB 4.05Å; E766-K768 WeakPolarHBondContact OE1-CE 3.42Å; E766-K768 IonicContact OE1-NZ 3.56Å; E766-K768 PolarHBondContact OE1-NZ 3Å; E766-L774 HydrophobicContact CG-CD2 3.51Å; E766-Q778 VanDerWaalsContact CD-NE2 3.27Å; E766-Q778 PolarHBondContact OE1-NE2 2.9Å; E766-Q778 PolarHBondContact OE1-OE1 2.96Å; E766-Q778 PolarHBondContact OE2-NE2 3.46Å; E766-L782 HydrophobicContact CB-CD2 4.4Å; E766-E793 PolarHBondContact N-O 2.93Å; E766-I794 CarbonylContact O-C 3.49Å; E766-I794 WeakPolarHBondContact O-CA 3.29Å; E766-C795 PolarHBondContact O-N 2.79Å
767	V	97.3	Very high	94.2	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.018	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	127.3	-173	-176.4	0	0	0	0	109.5	V597 E598 T601 D751 L752 V765 C795 I797	V597-V767 HydrophobicContact CG1-CG1 4.08Å; V597-V767 HydrophobicContact CG2-CG1 3.83Å; E598-V767 HydrophobicContact CG-CB 4.43Å; T601-V767 HydrophobicContact CG2-CG2 3.89Å; D751-V767 HydrophobicContact CB-CG2 4.38Å; D751-V767 PolarHBondContact OD2-N 3.33Å; L752-V767 HydrophobicContact CD1-CG2 3.58Å; L752-V767 HydrophobicContact CD2-CG2 4.42Å; L752-V767 HydrophobicContact CG-CG2 3.74Å; V765-V767 HydrophobicContact CG1-CG2 4.27Å; V767-C795 WeakPolarHBondContact CA-O 3.35Å; V767-I797 HydrophobicContact CG1-CG1 4.04Å
768	K	95.2	Very high	94.1	Very high	13 Å²	13	46.2 Å²	46.2	6%	0.057	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	113.3	173.5	-64.2	-60.6	179	-158.6	0	110.8	E766 D772 H773 L774 I794 C795 L796 I797	E766-K768 WeakPolarHBondContact OE1-CE 3.42Å; E766-K768 IonicContact OE1-NZ 3.56Å; E766-K768 PolarHBondContact OE1-NZ 3Å; K768-D772 HydrophobicContact CB-CB 4.36Å; K768-D772 HydrophobicContact CD-CB 3.98Å; K768-H773 WeakPolarHBondContact CE-O 3.45Å; K768-H773 PolarHBondContact NZ-O 3.33Å; K768-L774 VanDerWaalsContact CE-CD2 3.46Å; K768-I794 HydrophobicContact CG-CG2 4.38Å; K768-C795 PolarHBondContact N-O 3.24Å; K768-L796 HydrophobicContact CB-CD2 3.91Å; K768-L796 HydrophobicContact CG-CD2 4.5Å; K768-I797 PolarHBondContact O-N 3.12Å
769	G	90	Very high	94	Very high	14 Å²	14	42.9 Å²	42.9	14%	0.144	25%	0.247	C	C	.	.			trans	-71.4	174.8	169.3	0	0	0	0	0	112.4	G771 D772	G769-G771 PolarHBondContact O-N 2.77Å; G769-D772 WeakPolarHBondContact O-CB 3.49Å; G769-D772 PolarHBondContact O-N 3.19Å
770	P	85.5	Confident	93.9	Very high	79 Å²	79	38.5 Å²	38.5	51%	0.513	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	123.2	-178.8	-24.8	34	0	0	0	112.4	Y570 D772 I797 A799	Y570-P770 VanDerWaalsContact OH-CD 3.26Å; Y570-P770 WeakPolarHBondContact OH-CD 3.47Å; P770-D772 VanDerWaalsContact C-N 3.26Å; P770-D772 PolarHBondContact O-N 3.14Å; P770-I797 VanDerWaalsContact CD-O 3.28Å; P770-I797 WeakPolarHBondContact CD-O 3.46Å; P770-I797 WeakPolarHBondContact CG-O 3.48Å; P770-A799 HydrophobicContact CG-CB 4.05Å
771	G	84.9	Confident	93.9	Very high	73 Å²	73	34.4 Å²	34.4	75%	0.753	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.2	3.2	179.6	0	0	0	0	0	115.2	G769	G769-G771 PolarHBondContact O-N 2.77Å
772	D	89.9	Confident	93.9	Very high	54 Å²	54	31.4 Å²	31.4	29%	0.289	19%	0.19	S	C	.	.			trans	-82.8	149.3	173.8	-150.8	-23.6	0	0	0	111	R567 K768 G769 P770	R567-D772 IonicContact CZ-OD2 3.52Å; R567-D772 IonicContact NH2-OD2 3.19Å; R567-D772 PolarHBondContact NH2-OD2 3.37Å; K768-D772 HydrophobicContact CB-CB 4.36Å; K768-D772 HydrophobicContact CD-CB 3.98Å; G769-D772 WeakPolarHBondContact O-CB 3.49Å; G769-D772 PolarHBondContact O-N 3.19Å; P770-D772 VanDerWaalsContact C-N 3.26Å; P770-D772 PolarHBondContact O-N 3.14Å
773	H	91.3	Very high	93.8	Very high	150 Å²	150	31.4 Å²	31.4	69%	0.694	19%	0.188	S	C	*	.			trans	-132.2	152.1	-177.6	-63.1	-43.8	0	0	0	110.5	K768 S775	K768-H773 WeakPolarHBondContact CE-O 3.45Å; K768-H773 PolarHBondContact NZ-O 3.33Å; H773-S775 PolarHBondContact O-N 3.31Å
774	L	93.9	Very high	93.7	Very high	51 Å²	51	30.6 Å²	30.6	27%	0.267	19%	0.186	S	C	.	.			trans	-64.4	133.6	173.7	-67.9	167.5	0	0	0	110.2	E766 K768 Q778 I779 L782 I794	E766-L774 HydrophobicContact CG-CD2 3.51Å; K768-L774 VanDerWaalsContact CE-CD2 3.46Å; L774-Q778 HydrophobicContact CD2-CB 4.09Å; L774-I779 HydrophobicContact CB-CD1 4.23Å; L774-I779 HydrophobicContact CB-CG1 3.8Å; L774-I779 HydrophobicContact CD1-CG1 4.19Å; L774-L782 HydrophobicContact CD1-CD1 4.05Å; L774-L782 HydrophobicContact CD2-CD1 3.94Å; L774-I794 HydrophobicContact CD1-CD1 3.72Å; L774-I794 HydrophobicContact CD1-CG1 4.39Å
775	S	92.2	Very high	93.7	Very high	55 Å²	55	30.6 Å²	30.6	39%	0.385	19%	0.185	S	C	.	.			trans	-73.3	155.7	165.5	72	0	0	0	0	110.3	H773 Q777 Q778 I779	H773-S775 PolarHBondContact O-N 3.31Å; S775-Q777 PolarHBondContact O-N 3.44Å; S775-Q778 WeakPolarHBondContact O-CB 3.48Å; S775-Q778 PolarHBondContact O-N 3.29Å; S775-Q778 VanDerWaalsContact OG-CG 3.32Å; S775-Q778 WeakPolarHBondContact OG-CG 3.47Å; S775-Q778 PolarHBondContact OG-N 2.89Å; S775-Q778 PolarHBondContact OG-OE1 3.28Å; S775-I779 WeakPolarHBondContact O-CG1 3.44Å; S775-I779 PolarHBondContact O-N 3.14Å
776	T	91.6	Very high	93.6	Very high	23 Å²	23	32.5 Å²	32.5	14%	0.141	20%	0.197	C	C	.	.	H	α-helix	trans	-60.4	-29.9	177.6	61.2	0	0	0	0	112.6	G425 L428 M429 M780	G425-T776 WeakPolarHBondContact O-CB 3.35Å; G425-T776 PolarHBondContact O-OG1 3.07Å; L428-T776 HydrophobicContact CD2-CG2 4.33Å; L428-T776 HydrophobicContact CG-CG2 4.14Å; M429-T776 HydrophobicContact CB-CG2 3.95Å; T776-M780 WeakPolarHBondContact O-CG 3.45Å; T776-M780 PolarHBondContact O-N 3.02Å; T776-M780 VanDerWaalsContact O-N 3.14Å
777	Q	91	Very high	93.5	Very high	31 Å²	31	37.4 Å²	37.4	15%	0.145	22%	0.22	C	C	.	.	H	α-helix	trans	-71.3	-37.4	176	-171.3	59.1	40	0	0	112	N744 S747 S775 M780 W781	N744-Q777 VanDerWaalsContact O-CD 3.27Å; N744-Q777 PolarHBondContact O-NE2 2.84Å; N744-Q777 PolarHBondContact O-OE1 3.22Å; S747-Q777 WeakPolarHBondContact O-CG 3.36Å; S775-Q777 PolarHBondContact O-N 3.44Å; Q777-M780 PolarHBondContact O-N 3.39Å; Q777-W781 PolarHBondContact O-N 3.25Å
778	Q	95.2	Very high	93.5	Very high	25 Å²	25	37.7 Å²	37.7	12%	0.117	22%	0.223	C	C	.	.	H	α-helix	trans	-63.3	-45.2	172.8	-75	169.2	-34.7	0	0	111.1	G748 E766 L774 S775 M780 W781 L782	G748-Q778 WeakPolarHBondContact O-CA 3.1Å; G748-Q778 WeakPolarHBondContact O-CG 3.27Å; E766-Q778 VanDerWaalsContact CD-NE2 3.27Å; E766-Q778 PolarHBondContact OE1-NE2 2.9Å; E766-Q778 PolarHBondContact OE1-OE1 2.96Å; E766-Q778 PolarHBondContact OE2-NE2 3.46Å; L774-Q778 HydrophobicContact CD2-CB 4.09Å; S775-Q778 WeakPolarHBondContact O-CB 3.48Å; S775-Q778 PolarHBondContact O-N 3.29Å; S775-Q778 VanDerWaalsContact OG-CG 3.32Å; S775-Q778 WeakPolarHBondContact OG-CG 3.47Å; S775-Q778 PolarHBondContact OG-N 2.89Å; S775-Q778 PolarHBondContact OG-OE1 3.28Å; Q778-M780 VanDerWaalsContact C-N 3.26Å; Q778-M780 PolarHBondContact O-N 3.45Å; Q778-W781 PolarHBondContact O-N 3.48Å; Q778-L782 VanDerWaalsContact O-CG 3.3Å; Q778-L782 WeakPolarHBondContact O-CG 3.4Å; Q778-L782 PolarHBondContact O-N 2.87Å
779	I	95.5	Very high	93.6	Very high	33 Å²	33	40 Å²	40	17%	0.169	25%	0.251	C	S	.	.	H	α-helix	trans	-55.3	-44.9	176	-63.7	170.3	0	0	0	110.8	L428 I544 L774 S775 W781 L782 D783	L428-I779 HydrophobicContact CD2-CB 3.94Å; L428-I779 HydrophobicContact CD2-CD1 4.26Å; L428-I779 HydrophobicContact CD2-CG2 3.72Å; I544-I779 HydrophobicContact CD1-CG2 4.18Å; I544-I779 HydrophobicContact CG2-CG2 3.7Å; L774-I779 HydrophobicContact CB-CD1 4.23Å; L774-I779 HydrophobicContact CB-CG1 3.8Å; L774-I779 HydrophobicContact CD1-CG1 4.19Å; S775-I779 WeakPolarHBondContact O-CG1 3.44Å; S775-I779 PolarHBondContact O-N 3.14Å; I779-W781 PolarHBondContact O-N 2.93Å; I779-L782 PolarHBondContact O-N 2.83Å; I779-D783 WeakPolarHBondContact O-CB 3.31Å; I779-D783 PolarHBondContact O-N 2.96Å
780	M	94.2	Very high	93.9	Very high	13 Å²	13	40.2 Å²	40.2	6%	0.064	25%	0.251	C	S	.	.	H	α-helix	trans	-66.3	-35	178.2	-67.4	-53.3	-39	0	0	113.4	A424 L428 V541 W745 T776 Q777 Q778 V784	A424-M780 HydrophobicContact CB-CE 3.64Å; A424-M780 HydrophobicContact CB-CG 4.11Å; A424-M780 HydrophobicContact CB-SD 3.97Å; L428-M780 HydrophobicContact CB-SD 4.41Å; L428-M780 HydrophobicContact CD2-CG 4.43Å; L428-M780 HydrophobicContact CD2-SD 4.09Å; V541-M780 HydrophobicContact CG1-SD 4.5Å; W745-M780 HydrophobicContact CH2-CB 3.96Å; W745-M780 HydrophobicContact CZ3-CB 4.18Å; T776-M780 WeakPolarHBondContact O-CG 3.45Å; T776-M780 PolarHBondContact O-N 3.02Å; T776-M780 VanDerWaalsContact O-N 3.14Å; Q777-M780 PolarHBondContact O-N 3.39Å; Q778-M780 VanDerWaalsContact C-N 3.26Å; Q778-M780 PolarHBondContact O-N 3.45Å; M780-V784 WeakPolarHBondContact O-CG2 3.44Å; M780-V784 PolarHBondContact O-N 3.5Å
781	W	95.8	Very high	94.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-70.3	-42.5	175.1	-96.3	122.9	0	0	0	112.2	V734 K737 L738 W745 S747 G748 L749 Q777 Q778 I779 D783 V784 L785	V734-W781 HydrophobicContact CB-CH2 4.29Å; V734-W781 HydrophobicContact CB-CZ3 4.3Å; V734-W781 HydrophobicContact CG1-CH2 3.97Å; V734-W781 HydrophobicContact CG1-CZ3 4.37Å; V734-W781 HydrophobicContact CG2-CH2 4.32Å; V734-W781 HydrophobicContact CG2-CZ3 3.89Å; K737-W781 HydrophobicContact CB-CH2 3.79Å; K737-W781 HydrophobicContact CB-CZ2 4.41Å; K737-W781 HydrophobicContact CB-CZ3 4.31Å; K737-W781 HydrophobicContact CG-CH2 4.28Å; K737-W781 HydrophobicContact CG-CZ3 4.3Å; L738-W781 HydrophobicContact CD2-CZ2 4.32Å; W745-W781 HydrophobicContact CB-CZ2 3.87Å; W745-W781 HydrophobicContact CD2-CZ2 4.42Å; W745-W781 AromaticContact CE3-CD2 3.65Å; W745-W781 HydrophobicContact CE3-CD2 3.65Å; W745-W781 AromaticContact CE3-CE2 3.44Å; W745-W781 VanDerWaalsContact CE3-CE2 3.44Å; W745-W781 HydrophobicContact CE3-CE3 4.08Å; W745-W781 HydrophobicContact CE3-CG 4.12Å; W745-W781 HydrophobicContact CE3-CH2 4.14Å; W745-W781 AromaticContact CE3-CZ2 3.73Å; W745-W781 HydrophobicContact CE3-CZ2 3.73Å; W745-W781 HydrophobicContact CE3-CZ3 4.29Å; W745-W781 AromaticContact CE3-NE1 3.72Å; W745-W781 AromaticContact CZ3-CD2 3.86Å; W745-W781 HydrophobicContact CZ3-CD2 3.86Å; W745-W781 HydrophobicContact CZ3-CE3 4.1Å; W745-W781 HydrophobicContact CZ3-CG 4.11Å; W745-W781 VanDerWaalsContact O-CZ2 3.25Å; W745-W781 WeakPolarHBondContact O-CZ2 3.5Å; W745-W781 PolarHBondContact O-NE1 2.91Å; S747-W781 PolarHBondContact O-NE1 3.05Å; G748-W781 WeakPolarHBondContact O-CB 3.42Å; L749-W781 HydrophobicContact CD1-CH2 4.34Å; L749-W781 HydrophobicContact CD1-CZ2 3.75Å; L749-W781 HydrophobicContact CD2-CD2 3.69Å; L749-W781 HydrophobicContact CD2-CE3 3.69Å; L749-W781 HydrophobicContact CD2-CG 4.27Å; L749-W781 HydrophobicContact CD2-CH2 4.12Å; L749-W781 HydrophobicContact CD2-CZ2 4.1Å; L749-W781 HydrophobicContact CD2-CZ3 3.93Å; L749-W781 HydrophobicContact CG-CD2 3.7Å; L749-W781 HydrophobicContact CG-CE3 4.22Å; L749-W781 HydrophobicContact CG-CG 4.04Å; L749-W781 HydrophobicContact CG-CH2 4.39Å; L749-W781 HydrophobicContact CG-CZ2 3.87Å; Q777-W781 PolarHBondContact O-N 3.25Å; Q778-W781 PolarHBondContact O-N 3.48Å; I779-W781 PolarHBondContact O-N 2.93Å; W781-D783 VanDerWaalsContact C-N 3.3Å; W781-D783 PolarHBondContact O-N 2.84Å; W781-V784 HydrophobicContact CE3-CB 4.22Å; W781-V784 HydrophobicContact CE3-CG1 4.19Å; W781-V784 HydrophobicContact CZ3-CG1 4.04Å; W781-V784 PolarHBondContact O-N 2.91Å; W781-L785 VanDerWaalsContact O-CG 3.31Å; W781-L785 WeakPolarHBondContact O-CG 3.46Å; W781-L785 PolarHBondContact O-N 3.34Å
782	L	97	Very high	95.2	Very high	3 Å²	3	37 Å²	37	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-59.5	-42.9	175.9	-66.7	173.7	0	0	0	111.1	P547 P750 E766 L774 Q778 I779 V784 L785 V786 V792 I794	P547-L782 HydrophobicContact CG-CB 4.13Å; P547-L782 HydrophobicContact CG-CD1 4Å; P547-L782 HydrophobicContact CG-CD2 4.17Å; P547-L782 HydrophobicContact CG-CG 4.32Å; P750-L782 HydrophobicContact CG-CD2 3.83Å; E766-L782 HydrophobicContact CB-CD2 4.4Å; L774-L782 HydrophobicContact CD1-CD1 4.05Å; L774-L782 HydrophobicContact CD2-CD1 3.94Å; Q778-L782 VanDerWaalsContact O-CG 3.3Å; Q778-L782 WeakPolarHBondContact O-CG 3.4Å; Q778-L782 PolarHBondContact O-N 2.87Å; I779-L782 PolarHBondContact O-N 2.83Å; L782-V784 PolarHBondContact O-N 3.21Å; L782-L785 PolarHBondContact O-N 2.87Å; L782-V786 WeakPolarHBondContact O-CB 3.37Å; L782-V786 VanDerWaalsContact O-CG2 3.26Å; L782-V786 WeakPolarHBondContact O-CG2 3.45Å; L782-V786 PolarHBondContact O-N 2.95Å; L782-V792 HydrophobicContact CD2-CG2 3.49Å; L782-V792 VanDerWaalsContact CD2-CG2 3.49Å; L782-I794 HydrophobicContact CD1-CD1 4.08Å; L782-I794 HydrophobicContact CD1-CG1 3.98Å
783	D	95.8	Very high	95.5	Very high	12 Å²	12	35.3 Å²	35.3	6%	0.064	20%	0.202	C	C	.	.	H	α-helix	trans	-57.3	-47.3	173.9	177.7	49.6	0	0	0	112.3	I544 K545 I779 W781 V786 Q787	I544-D783 HydrophobicContact CG2-CB 3.93Å; K545-D783 WeakPolarHBondContact CB-OD1 3.25Å; K545-D783 PolarHBondContact N-OD1 2.69Å; I779-D783 WeakPolarHBondContact O-CB 3.31Å; I779-D783 PolarHBondContact O-N 2.96Å; W781-D783 VanDerWaalsContact C-N 3.3Å; W781-D783 PolarHBondContact O-N 2.84Å; D783-V786 PolarHBondContact O-N 2.98Å; D783-Q787 WeakPolarHBondContact O-CB 3.33Å; D783-Q787 VanDerWaalsContact O-CG 3.23Å; D783-Q787 WeakPolarHBondContact O-CG 3.44Å; D783-Q787 PolarHBondContact O-N 3.46Å; D783-Q787 PolarHBondContact OD1-NE2 2.64Å; D783-Q787 PolarHBondContact OD2-NE2 3.37Å
784	V	95.7	Very high	95.9	Very high	9 Å²	9	28.2 Å²	28.2	6%	0.055	17%	0.17	C	C	.	.	H	α-helix	trans	-61.4	-45.9	176.5	170.6	0	0	0	0	111.6	D733 K737 W745 M780 W781 L782 Q787 A788	D733-V784 HydrophobicContact CB-CG1 4.36Å; K737-V784 HydrophobicContact CG-CG1 4.17Å; K737-V784 HydrophobicContact CG-CG2 4.46Å; W745-V784 HydrophobicContact CH2-CG2 3.57Å; W745-V784 HydrophobicContact CZ3-CG2 3.74Å; M780-V784 WeakPolarHBondContact O-CG2 3.44Å; M780-V784 PolarHBondContact O-N 3.5Å; W781-V784 HydrophobicContact CE3-CB 4.22Å; W781-V784 HydrophobicContact CE3-CG1 4.19Å; W781-V784 HydrophobicContact CZ3-CG1 4.04Å; W781-V784 PolarHBondContact O-N 2.91Å; L782-V784 PolarHBondContact O-N 3.21Å; V784-Q787 PolarHBondContact O-N 3.19Å; V784-A788 WeakPolarHBondContact O-CB 3.49Å; V784-A788 PolarHBondContact O-N 2.92Å
785	L	98	Very high	96	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-64.7	-43.9	-178.9	-70.3	170.8	0	0	0	111.8	V730 V734 P750 I764 W781 L782 Q787 A788 G789 A790 V792	V730-L785 HydrophobicContact CG1-CD2 4.04Å; V734-L785 HydrophobicContact CG2-CD2 4.01Å; P750-L785 HydrophobicContact CG-CD1 3.78Å; I764-L785 HydrophobicContact CD1-CD1 4.15Å; I764-L785 HydrophobicContact CD1-CD2 3.83Å; I764-L785 HydrophobicContact CG2-CD1 4.16Å; W781-L785 VanDerWaalsContact O-CG 3.31Å; W781-L785 WeakPolarHBondContact O-CG 3.46Å; W781-L785 PolarHBondContact O-N 3.34Å; L782-L785 PolarHBondContact O-N 2.87Å; L785-Q787 VanDerWaalsContact C-N 3.33Å; L785-Q787 PolarHBondContact O-N 3.08Å; L785-A788 PolarHBondContact O-N 3.08Å; L785-G789 PolarHBondContact O-N 3.46Å; L785-A790 HydrophobicContact CB-CB 4.13Å; L785-A790 HydrophobicContact CD2-CB 4.41Å; L785-A790 WeakPolarHBondContact O-CB 3.41Å; L785-A790 PolarHBondContact O-N 3.4Å; L785-V792 HydrophobicContact CB-CG1 4.18Å; L785-V792 HydrophobicContact CD1-CG2 4.41Å
786	V	97.5	Very high	96.3	Very high	40 Å²	40	26.2 Å²	26.2	24%	0.242	16%	0.155	C	C	.	.	H	α-helix	trans	-62.6	-40.9	175.1	173.3	0	0	0	0	110.8	K545 P547 L782 D783 A788 G789 V792	K545-V786 HydrophobicContact CB-CB 4.24Å; K545-V786 HydrophobicContact CB-CG1 3.83Å; K545-V786 HydrophobicContact CD-CG1 3.88Å; P547-V786 HydrophobicContact CB-CG2 3.87Å; L782-V786 WeakPolarHBondContact O-CB 3.37Å; L782-V786 VanDerWaalsContact O-CG2 3.26Å; L782-V786 WeakPolarHBondContact O-CG2 3.45Å; L782-V786 PolarHBondContact O-N 2.95Å; D783-V786 PolarHBondContact O-N 2.98Å; V786-A788 VanDerWaalsContact C-N 3.34Å; V786-G789 PolarHBondContact O-N 2.94Å; V786-V792 HydrophobicContact CB-CG1 4.47Å; V786-V792 HydrophobicContact CG2-CG1 3.43Å; V786-V792 VanDerWaalsContact CG2-CG1 3.43Å
787	Q	95.8	Very high	96.4	Very high	103 Å²	103	25.4 Å²	25.4	48%	0.481	15%	0.149	S	C	.	.	H	α-helix	trans	-66.2	-36.1	177.1	-74.4	-179.9	48.6	0	0	112.9	K545 D783 V784 L785 G789	K545-Q787 HydrophobicContact CD-CG 3.76Å; K545-Q787 HydrophobicContact CG-CG 4.38Å; D783-Q787 WeakPolarHBondContact O-CB 3.33Å; D783-Q787 VanDerWaalsContact O-CG 3.23Å; D783-Q787 WeakPolarHBondContact O-CG 3.44Å; D783-Q787 PolarHBondContact O-N 3.46Å; D783-Q787 PolarHBondContact OD1-NE2 2.64Å; D783-Q787 PolarHBondContact OD2-NE2 3.37Å; V784-Q787 PolarHBondContact O-N 3.19Å; L785-Q787 VanDerWaalsContact C-N 3.33Å; L785-Q787 PolarHBondContact O-N 3.08Å; Q787-G789 PolarHBondContact O-N 3.3Å
788	A	96.8	Very high	96.5	Very high	9 Å²	9	25.6 Å²	25.6	7%	0.074	15%	0.154	C	C	.	.	H	α-helix	trans	-73.2	-10	177.6	0	0	0	0	0	113.6	S729 V730 D733 V784 L785 V786	S729-A788 PolarHBondContact OG-O 3.29Å; V730-A788 HydrophobicContact CG2-CB 4.26Å; D733-A788 HydrophobicContact CB-CB 3.89Å; D733-A788 WeakPolarHBondContact OD2-CB 3.46Å; V784-A788 WeakPolarHBondContact O-CB 3.49Å; V784-A788 PolarHBondContact O-N 2.92Å; L785-A788 PolarHBondContact O-N 3.08Å; V786-A788 VanDerWaalsContact C-N 3.34Å
789	G	97.2	Very high	96.1	Very high	63 Å²	63	26.1 Å²	26.1	65%	0.649	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	89.9	16	-180	0	0	0	0	0	114.6	L785 V786 Q787	L785-G789 PolarHBondContact O-N 3.46Å; V786-G789 PolarHBondContact O-N 2.94Å; Q787-G789 PolarHBondContact O-N 3.3Å
790	A	97.9	Very high	95.7	Very high	17 Å²	17	26.2 Å²	26.2	14%	0.14	16%	0.163	C	C	.	.			trans	-67.4	143	177	0	0	0	0	0	111.6	V730 I764 L785 V792	V730-A790 HydrophobicContact CG1-CB 3.99Å; V730-A790 HydrophobicContact CG2-CB 3.71Å; I764-A790 HydrophobicContact CD1-CB 3.99Å; L785-A790 HydrophobicContact CB-CB 4.13Å; L785-A790 HydrophobicContact CD2-CB 4.41Å; L785-A790 WeakPolarHBondContact O-CB 3.41Å; L785-A790 PolarHBondContact O-N 3.4Å; A790-V792 PolarHBondContact O-N 2.96Å; A790-V792 VanDerWaalsContact O-N 3.12Å
791	D	97.9	Very high	95.2	Very high	81 Å²	81	29 Å²	29	43%	0.433	18%	0.182	S	C	.	.			trans	-75.6	96.3	165.2	-178.2	10.9	0	0	0	108.9	K763 I764	K763-D791 WeakPolarHBondContact CA-O 3.46Å; K763-D791 WeakPolarHBondContact CE-OD2 3.26Å; K763-D791 IonicContact NZ-OD1 3.69Å; K763-D791 PolarHBondContact NZ-OD1 2.96Å; K763-D791 IonicContact NZ-OD2 2.79Å; K763-D791 PolarHBondContact NZ-OD2 3.46Å; I764-D791 PolarHBondContact N-O 3.31Å
792	V	98	Very high	94.2	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.024	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	140.6	-175.8	57.5	0	0	0	0	111.2	P547 P548 I764 L782 L785 V786 A790	P547-V792 HydrophobicContact CB-CG1 4.02Å; P547-V792 HydrophobicContact CB-CG2 4.46Å; P547-V792 WeakPolarHBondContact CB-O 3.34Å; P548-V792 WeakPolarHBondContact CD-O 3.36Å; I764-V792 HydrophobicContact CB-CB 4.24Å; I764-V792 HydrophobicContact CB-CG2 4.22Å; I764-V792 HydrophobicContact CG2-CG2 4.31Å; I764-V792 VanDerWaalsContact O-CA 3.26Å; I764-V792 WeakPolarHBondContact O-CA 3.41Å; L782-V792 HydrophobicContact CD2-CG2 3.49Å; L782-V792 VanDerWaalsContact CD2-CG2 3.49Å; L785-V792 HydrophobicContact CB-CG1 4.18Å; L785-V792 HydrophobicContact CD1-CG2 4.41Å; V786-V792 HydrophobicContact CB-CG1 4.47Å; V786-V792 HydrophobicContact CG2-CG1 3.43Å; V786-V792 VanDerWaalsContact CG2-CG1 3.43Å; A790-V792 PolarHBondContact O-N 2.96Å; A790-V792 VanDerWaalsContact O-N 3.12Å
793	E	97.8	Very high	93	Very high	18 Å²	18	39.1 Å²	39.1	8%	0.084	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	159.8	176.9	64.5	-170.9	-138.7	0	0	112.7	P548 V550 Y605 K763 I764 V765 E766	P548-E793 HydrophobicContact CG-CB 4.1Å; P548-E793 WeakPolarHBondContact O-CA 3.33Å; V550-E793 HydrophobicContact CG2-CG 4.41Å; V550-E793 WeakPolarHBondContact CG2-OE1 3.47Å; Y605-E793 WeakPolarHBondContact CE1-OE1 3.43Å; Y605-E793 PolarHBondContact OH-OE1 3.31Å; K763-E793 HydrophobicContact CD-CG 4.31Å; K763-E793 IonicContact NZ-OE2 3.64Å; K763-E793 PolarHBondContact NZ-OE2 3.05Å; I764-E793 PolarHBondContact O-N 3.39Å; V765-E793 WeakPolarHBondContact CA-O 3.46Å; V765-E793 HydrophobicContact CG1-CG 4.34Å; V765-E793 HydrophobicContact CG2-CG 4.04Å; E766-E793 PolarHBondContact N-O 2.93Å
794	I	98.2	Very high	91.5	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	118.9	171	-60.7	153.8	0	0	0	107.9	P547 P548 K549 V550 E766 K768 L774 L782 L796	P547-I794 HydrophobicContact CG-CD1 3.68Å; P547-I794 HydrophobicContact CG-CG1 3.83Å; P548-I794 PolarHBondContact O-N 3.06Å; K549-I794 WeakPolarHBondContact CA-O 3.45Å; K549-I794 HydrophobicContact CG-CB 4.02Å; K549-I794 HydrophobicContact CG-CD1 3.98Å; K549-I794 HydrophobicContact CG-CG2 4.44Å; V550-I794 PolarHBondContact N-O 2.84Å; E766-I794 CarbonylContact O-C 3.49Å; E766-I794 WeakPolarHBondContact O-CA 3.29Å; K768-I794 HydrophobicContact CG-CG2 4.38Å; L774-I794 HydrophobicContact CD1-CD1 3.72Å; L774-I794 HydrophobicContact CD1-CG1 4.39Å; L782-I794 HydrophobicContact CD1-CD1 4.08Å; L782-I794 HydrophobicContact CD1-CG1 3.98Å; I794-L796 HydrophobicContact CG2-CD2 3.81Å; I794-L796 HydrophobicContact CG2-CG 4.44Å
795	C	97.8	Very high	89.9	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	106.1	177.4	176.1	0	0	0	0	110.7	V550 T601 Y605 V765 E766 V767 K768 I797	V550-C795 HydrophobicContact CG2-CB 4.15Å; T601-C795 HydrophobicContact CG2-CB 4.45Å; Y605-C795 HydrophobicContact CE2-CB 4.47Å; V765-C795 HydrophobicContact CG1-CB 3.37Å; E766-C795 PolarHBondContact O-N 2.79Å; V767-C795 WeakPolarHBondContact CA-O 3.35Å; K768-C795 PolarHBondContact N-O 3.24Å; C795-I797 WeakPolarHBondContact SG-CD1 3.47Å
796	L	97	Very high	88	Confident	64 Å²	64	50 Å²	50	34%	0.335	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	116.3	175.3	-54.8	179.9	0	0	0	109.4	K549 V550 E551 I552 K768 I794	K549-L796 HydrophobicContact CB-CD1 4.5Å; V550-L796 PolarHBondContact O-N 3.18Å; E551-L796 WeakPolarHBondContact CA-O 3.45Å; E551-L796 HydrophobicContact CG-CB 4.38Å; I552-L796 PolarHBondContact N-O 3.48Å; K768-L796 HydrophobicContact CB-CD2 3.91Å; K768-L796 HydrophobicContact CG-CD2 4.5Å; I794-L796 HydrophobicContact CG2-CD2 3.81Å; I794-L796 HydrophobicContact CG2-CG 4.44Å
797	I	94.7	Very high	86.1	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.026	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	115.7	177.9	-59.4	-59.2	0	0	0	110.3	I552 A554 Y570 V597 W600 V767 K768 P770 C795	I552-I797 HydrophobicContact CB-CD1 3.87Å; I552-I797 HydrophobicContact CG2-CD1 4.22Å; I552-I797 WeakPolarHBondContact O-CA 3.24Å; A554-I797 HydrophobicContact CB-CG2 3.65Å; Y570-I797 HydrophobicContact CD1-CG2 4.4Å; Y570-I797 HydrophobicContact CE1-CG2 3.59Å; V597-I797 HydrophobicContact CG2-CB 3.74Å; V597-I797 HydrophobicContact CG2-CG1 3.63Å; V597-I797 HydrophobicContact CG2-CG2 3.86Å; W600-I797 HydrophobicContact CE3-CD1 4.48Å; W600-I797 HydrophobicContact CZ3-CD1 4.21Å; V767-I797 HydrophobicContact CG1-CG1 4.04Å; K768-I797 PolarHBondContact O-N 3.12Å; P770-I797 VanDerWaalsContact CD-O 3.28Å; P770-I797 WeakPolarHBondContact CD-O 3.46Å; P770-I797 WeakPolarHBondContact CG-O 3.48Å; C795-I797 WeakPolarHBondContact SG-CD1 3.47Å
798	S	91.9	Very high	84.1	Confident	35 Å²	35	52.4 Å²	52.4	25%	0.245	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	139.4	165.6	56.8	0	0	0	0	110.2	I552 T553 A554	I552-S798 PolarHBondContact O-N 3.17Å; I552-S798 PolarHBondContact O-OG 2.97Å; T553-S798 WeakPolarHBondContact CA-O 3.41Å; T553-S798 WeakPolarHBondContact CA-OG 3.48Å; T553-S798 PolarHBondContact OG1-OG 3.37Å; A554-S798 PolarHBondContact N-O 3.1Å
799	A	88	Confident	81.9	Confident	36 Å²	36	60.2 Å²	60.2	30%	0.298	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	125.4	179.6	0	0	0	0	0	110.7	I556 Y570 P770	I556-A799 HydrophobicContact CD1-CB 3.88Å; I556-A799 HydrophobicContact CG1-CB 4.16Å; I556-A799 HydrophobicContact CG2-CB 3.82Å; Y570-A799 HydrophobicContact CE1-CB 4.24Å; P770-A799 HydrophobicContact CG-CB 4.05Å
800	E	86.2	Confident	79.4	Confident	36 Å²	36	64 Å²	64	17%	0.168	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122.6	175.2	-176.4	168	-163	0	0	110.7	T553 A554 P555 I556 L802 S804 L805 K808	T553-E800 HydrophobicContact CG2-CB 3.45Å; T553-E800 VanDerWaalsContact CG2-CB 3.45Å; T553-E800 HydrophobicContact CG2-CG 4.44Å; A554-E800 PolarHBondContact O-N 3.5Å; P555-E800 CarbonylContact C-O 3.59Å; P555-E800 WeakPolarHBondContact CA-O 3.46Å; I556-E800 PolarHBondContact N-O 3.02Å; E800-L802 PolarHBondContact O-N 2.95Å; E800-S804 WeakPolarHBondContact CG-OG 3.2Å; E800-S804 PolarHBondContact OE1-OG 2.81Å; E800-L805 HydrophobicContact CG-CD1 4.28Å; E800-L805 HydrophobicContact CG-CG 4.23Å; E800-K808 IonicContact OE1-NZ 3.26Å; E800-K808 PolarHBondContact OE1-NZ 3.2Å; E800-K808 IonicContact OE2-NZ 3.66Å
801	P	83.1	Confident	76.4	Confident	71 Å²	71	72.5 Å²	72.5	46%	0.461	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	134.5	178.1	-23.1	33.1	0	0	0	112.4	K803 S804	P801-K803 PolarHBondContact O-N 2.87Å; P801-S804 PolarHBondContact O-N 3.13Å; P801-S804 PolarHBondContact O-OG 3.24Å
802	L	76.8	Confident	75.3	Confident	28 Å²	28	72.1 Å²	72.1	15%	0.147	37%	0.366	C	S	.	.	H	α-helix	trans	-53.7	-31.5	-179.3	-131.1	94.2	0	0	0	113.9	P555 I556 V571 F573 E800 S804 L805 R806	P555-L802 HydrophobicContact CB-CD1 3.72Å; I556-L802 PolarHBondContact O-N 3.49Å; V571-L802 HydrophobicContact CB-CD1 3.62Å; V571-L802 HydrophobicContact CG1-CD1 3.86Å; V571-L802 HydrophobicContact CG2-CD1 3.65Å; F573-L802 HydrophobicContact CZ-CD1 4.3Å; F573-L802 HydrophobicContact CZ-CD2 4.19Å; F573-L802 HydrophobicContact CZ-CG 4.49Å; E800-L802 PolarHBondContact O-N 2.95Å; L802-S804 VanDerWaalsContact C-N 3.32Å; L802-S804 PolarHBondContact O-N 3.1Å; L802-L805 PolarHBondContact O-N 3.07Å; L802-R806 PolarHBondContact O-N 2.92Å; L802-R806 VanDerWaalsContact O-N 3.07Å
803	K	70.9	Confident	74.1	Confident	187 Å²	187	75.7 Å²	75.7	81%	0.813	38%	0.384	S	S	*	.	H	α-helix	trans	-63.5	-35.8	178	-67.8	-179.3	-178.3	174.6	0	112.3	P801 S807	P801-K803 PolarHBondContact O-N 2.87Å; K803-S807 PolarHBondContact O-N 3.18Å
804	S	64.3	Low	72.8	Confident	37 Å²	37	78.9 Å²	78.9	26%	0.259	40%	0.401	S	S	.	.	H	α-helix	trans	-71.4	-37.6	176.7	69.9	0	0	0	0	111.2	E800 P801 L802 S807 K808	E800-S804 WeakPolarHBondContact CG-OG 3.2Å; E800-S804 PolarHBondContact OE1-OG 2.81Å; P801-S804 PolarHBondContact O-N 3.13Å; P801-S804 PolarHBondContact O-OG 3.24Å; L802-S804 VanDerWaalsContact C-N 3.32Å; L802-S804 PolarHBondContact O-N 3.1Å; S804-S807 PolarHBondContact O-N 3.29Å; S804-S807 PolarHBondContact O-OG 3.12Å; S804-K808 PolarHBondContact O-N 3.34Å; S804-K808 VanDerWaalsContact O-N 3.13Å
805	L	61.7	Low	71.3	Confident	41 Å²	41	83.4 Å²	83.4	22%	0.215	42%	0.424	C	S	.	.	H	α-helix	trans	-62	-45.1	175.3	-82.5	154.9	0	0	0	112.1	P555 E800 L802 S807 K808 F809	P555-L805 HydrophobicContact CB-CD1 3.59Å; P555-L805 HydrophobicContact CG-CD1 3.85Å; E800-L805 HydrophobicContact CG-CD1 4.28Å; E800-L805 HydrophobicContact CG-CG 4.23Å; L802-L805 PolarHBondContact O-N 3.07Å; L805-S807 VanDerWaalsContact C-N 3.27Å; L805-S807 PolarHBondContact O-N 3.1Å; L805-K808 PolarHBondContact O-N 3.09Å; L805-K808 VanDerWaalsContact O-N 3.11Å; L805-F809 WeakPolarHBondContact O-CD2 3.37Å; L805-F809 PolarHBondContact O-N 3.35Å
806	R	58.5	Low	69.6	Low	173 Å²	173	88.6 Å²	88.6	65%	0.653	45%	0.45	S	S	*	.	H	α-helix	trans	-62.2	-33.4	175.6	-74	-174.3	-179.2	174.6	0.7	113	L802 K808 F809 N810	L802-R806 PolarHBondContact O-N 2.92Å; L802-R806 VanDerWaalsContact O-N 3.07Å; R806-K808 VanDerWaalsContact C-N 3.34Å; R806-F809 PolarHBondContact O-N 2.94Å; R806-N810 PolarHBondContact O-N 2.92Å
807	S	57.1	Low	67.8	Low	65 Å²	65	90.3 Å²	90.3	46%	0.455	46%	0.458	S	S	.	.	H	α-helix	trans	-69.7	-30.4	175.3	73.1	0	0	0	0	113.2	K803 S804 L805	K803-S807 PolarHBondContact O-N 3.18Å; S804-S807 PolarHBondContact O-N 3.29Å; S804-S807 PolarHBondContact O-OG 3.12Å; L805-S807 VanDerWaalsContact C-N 3.27Å; L805-S807 PolarHBondContact O-N 3.1Å
808	K	54.6	Low	65.9	Low	128 Å²	128	96.4 Å²	96.4	56%	0.557	49%	0.489	S	S	*	.	H	α-helix	trans	-74.4	-27.8	175.7	-77.1	175.7	176.9	164.7	0	113.4	E800 S804 L805 R806	E800-K808 IonicContact OE1-NZ 3.26Å; E800-K808 PolarHBondContact OE1-NZ 3.2Å; E800-K808 IonicContact OE2-NZ 3.66Å; S804-K808 PolarHBondContact O-N 3.34Å; S804-K808 VanDerWaalsContact O-N 3.13Å; L805-K808 PolarHBondContact O-N 3.09Å; L805-K808 VanDerWaalsContact O-N 3.11Å; R806-K808 VanDerWaalsContact C-N 3.34Å
809	F	50.9	Low	63.9	Low	173 Å²	173	101.1 Å²	101.1	76%	0.759	51%	0.507	S	S	*	.	H	α-helix	trans	-82.2	-18.5	175.6	-85.3	-77.2	0	0	0	113.6	L805 R806	L805-F809 WeakPolarHBondContact O-CD2 3.37Å; L805-F809 PolarHBondContact O-N 3.35Å; R806-F809 PolarHBondContact O-N 2.94Å
810	N	43.8	Very low	61.9	Low	142 Å²	142	106.5 Å²	106.5	76%	0.759	53%	0.525	S	S	*	.			trans	-94.7	-1.7	179.4	-77.7	-6.7	0	0	0	113.8	R806	R806-N810 PolarHBondContact O-N 2.92Å
811	N	34.5	Very low	59.7	Low	197 Å²	197	112.9 Å²	112.9	100%	1.053	56%	0.557	S	S	*	*			trans	-110.6	0	169.7	-76.6	-16.1	0	0	0	108.9

Retrieved 811 of 811 residues in 1830.7 ms (Link to these results)

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