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Spliceosome RNA helicase DDX39B

Involved in nuclear export of spliced and unspliced mRNA. Component of the TREX complex which is thought to couple mRNA transcription, processing and nuclear export, and specifically associates with spliced mRNA and not with unspliced pre-mRNA. The TREX complex is recruited to spliced mRNAs by a transcription-independent mechanism, binds to mRNA upstream of the exon-junction complex (EJC) and is recruited in a splicing- and cap-dependent manner to a region near the 5' end of the mRNA where it functions in mRNA export to the cytoplasm via the TAP/NXF1 pathway. The THOC1-THOC2-THOC3 core complex alone is sufficient to promote ATPase activity of DDX39B; in the complex THOC2 is the only component that directly interacts with DDX39B. Associates with SARNP/CIP29, which facilitates RNA binding of DDX39B and likely plays a role in mRNA export. May undergo several rounds of ATP hydrolysis during assembly of TREX to drive subsequent loading of components such as ALYREF/THOC4 and CHTOP onto mRNA. Also associates with pre-mRNA independent of ALYREF/THOC4. Involved in the nuclear export of intronless mRNA; the ATP-bound form is proposed to recruit export adapter ALYREF/THOC4 to intronless mRNA; its ATPase activity is cooperatively stimulated by RNA and ALYREF/THOC4 and ATP hydrolysis is thought to trigger the dissociation from RNA to allow the association of ALYREF/THOC4 and the NXF1-NXT1 heterodimer. Involved in transcription elongation and genome stability. Splice factor that is required for the first ATP-dependent step in spliceosome assembly and for the interaction of U2 snRNP with the branchpoint. Has both RNA-stimulated ATP binding/hydrolysis activity and ATP-dependent RNA unwinding activity. Even with the stimulation of RNA, the ATPase activity is weak. Can only hydrolyze ATP but not other NTPs. The RNA stimulation of ATPase activity does not have a strong preference for the sequence and length of the RNA. However, ssRNA stimulates the ATPase activity much more strongly than dsRNA. Can unwind 5' or 3' overhangs or blunt end RNA duplexes in vitro. The ATPase and helicase activities are not influenced by U2AF2; the effect of ALYREF/THOC4 is reported conflictingly.

AlphaFold DB , UniProt , Accession Q29024, Species PIG (Sus scrofa, Pig), Gene DDX39B, Length 428 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.4	Very low	34.6	Very low	252 Å²	252	148.8 Å²	148.8	100%	1.241	80%	0.796	S	S	*	*				0	99.9	0	-64.3	-177.3	-175.5	0	0	106.4
2	A	36.5	Very low	34.3	Very low	96 Å²	96	147.1 Å²	147.1	79%	0.793	79%	0.787	S	S	*	*			cis	-132.1	136.4	10.5	0	0	0	0	0	109
3	E	28.5	Very low	34	Very low	186 Å²	186	149.5 Å²	149.5	87%	0.869	78%	0.78	S	S	*	*			trans	-79.5	140.8	159.4	-70.5	167.1	155.2	0	0	106.9
4	N	38.3	Very low	33.9	Very low	149 Å²	149	151.4 Å²	151.4	80%	0.797	78%	0.783	S	S	*	*			trans	-148.9	106.5	163.2	-98.3	-7.2	0	0	0	109.5
5	D	33.4	Very low	34	Very low	159 Å²	159	151.5 Å²	151.5	85%	0.85	79%	0.785	S	S	*	*			trans	1.1	110.8	147.2	-73.7	-38.4	0	0	0	118.2
6	V	38.6	Very low	34	Very low	135 Å²	135	152 Å²	152	82%	0.818	79%	0.79	S	S	*	*			trans	-146.3	28.4	156.7	-156.4	0	0	0	0	111.8
7	D	37.1	Very low	33.7	Very low	166 Å²	166	154.3 Å²	154.3	89%	0.888	80%	0.796	S	S	*	*			trans	-99.9	9.8	-173.4	-89.3	-22.6	0	0	0	115.3
8	N	32.8	Very low	33.7	Very low	134 Å²	134	153.7 Å²	153.7	72%	0.717	80%	0.8	S	S	*	*			trans	-121.9	13.1	-164.5	-103.8	-10.7	0	0	0	118.9
9	E	37.2	Very low	33.4	Very low	182 Å²	182	154.5 Å²	154.5	85%	0.85	80%	0.799	S	S	*	*	S	Bend	trans	-107.1	4.8	-177.4	-77.1	-169.5	161	0	0	116.8
10	L	36.3	Very low	33.2	Very low	54 Å²	54	153.2 Å²	153.2	28%	0.283	80%	0.799	S	S	.	*	S	Bend	trans	-121.8	73.6	166.5	-84.3	156.7	0	0	0	108.7	D12 R216	L10-D12 PolarHBondContact O-N 3.29Å; L10-D12 VanDerWaalsContact O-N 3.17Å; L10-R216 HydrophobicContact CD1-CG 3.6Å
11	L	29	Very low	33.2	Very low	124 Å²	124	150.9 Å²	150.9	65%	0.649	80%	0.802	S	S	*	*			trans	-63	114.2	172.5	-77.2	164.9	0	0	0	109.5	Y13	L11-Y13 HydrophobicContact CB-CE2 4.36Å; L11-Y13 PolarHBondContact O-N 3.4Å
12	D	30.5	Very low	33	Very low	128 Å²	128	144.2 Å²	144.2	68%	0.684	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-60	118.7	166.7	-71.8	-38.1	0	0	0	108.5	L10	L10-D12 PolarHBondContact O-N 3.29Å; L10-D12 VanDerWaalsContact O-N 3.17Å
13	Y	31.1	Very low	32.9	Very low	178 Å²	178	143.7 Å²	143.7	70%	0.698	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-97.6	120	168.8	-86.9	-95.7	0	0	0	108.6	L11	L11-Y13 HydrophobicContact CB-CE2 4.36Å; L11-Y13 PolarHBondContact O-N 3.4Å
14	E	32.4	Very low	33.1	Very low	176 Å²	176	138.2 Å²	138.2	82%	0.822	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-83	125.1	154.8	-66.4	-176.7	152.4	0	0	106.5	D16	E14-D16 PolarHBondContact O-N 3.48Å
15	D	35.6	Very low	33	Very low	153 Å²	153	139.3 Å²	139.3	82%	0.818	79%	0.79	S	S	*	*			trans	-73.1	114.6	-179.9	-72.6	-42.8	0	0	0	110.1
16	D	33.1	Very low	33	Very low	160 Å²	160	135.6 Å²	135.6	86%	0.856	79%	0.789	S	S	*	*			trans	-88.8	125.6	159.9	-82.5	-36.5	0	0	0	109.3	E14	E14-D16 PolarHBondContact O-N 3.48Å
17	E	29.3	Very low	33	Very low	191 Å²	191	134.3 Å²	134.3	89%	0.893	79%	0.793	S	S	*	*			trans	-68.1	130.1	168.7	-66.1	177.9	152	0	0	111
18	V	33.9	Very low	32.8	Very low	144 Å²	144	135.7 Å²	135.7	87%	0.873	79%	0.794	S	S	*	*			trans	-145	126.7	151.9	-171	0	0	0	0	111.7
19	E	27.8	Very low	33.1	Very low	169 Å²	169	133.9 Å²	133.9	79%	0.79	80%	0.797	S	S	*	*			trans	-70.4	147.7	175.3	-74.4	-178.4	139.6	0	0	115.4
20	T	29.9	Very low	33	Very low	128 Å²	128	131 Å²	131	79%	0.785	79%	0.794	S	S	*	*			trans	59.6	128	141.8	60.8	0	0	0	0	121.7
21	A	33.1	Very low	32.8	Very low	105 Å²	105	133.4 Å²	133.4	87%	0.868	82%	0.822	S	S	*	*				171.5	146.7	105.1	0	0	0	0	0	112.3
22	A	29.8	Very low	33.2	Very low	112 Å²	112	137.3 Å²	137.3	93%	0.926	83%	0.834	S	S	*	*			trans	-91.7	158.5	-175.9	0	0	0	0	0	114.2
23	G	33.4	Very low	33.3	Very low	84 Å²	84	140.8 Å²	140.8	87%	0.866	84%	0.843	S	S	*	*			trans	140.6	131.8	168.8	0	0	0	0	0	109.5
24	G	31.8	Very low	33.4	Very low	71 Å²	71	139.9 Å²	139.9	73%	0.732	85%	0.85	S	S	*	*			cis	153.9	131.6	13.2	0	0	0	0	0	106.3
25	D	36.9	Very low	33.6	Very low	173 Å²	173	138 Å²	138	93%	0.925	85%	0.851	S	S	*	*			trans	67.9	110.9	162.8	-61.6	-16.9	0	0	0	122.4
26	G	34.6	Very low	33.5	Very low	81 Å²	81	140.3 Å²	140.3	84%	0.835	85%	0.853	S	S	*	*				93.4	99.8	103.4	0	0	0	0	0	119.3
27	A	36.7	Very low	33.5	Very low	108 Å²	108	135.9 Å²	135.9	89%	0.893	85%	0.845	S	S	*	*			trans	-167.4	126.6	140.2	0	0	0	0	0	111.4
28	E	33.9	Very low	33.5	Very low	195 Å²	195	131.2 Å²	131.2	91%	0.911	83%	0.834	S	S	*	*			trans	-80.1	153	-178.3	-78.9	179.4	136.1	0	0	115.1
29	A	39.6	Very low	33.5	Very low	95 Å²	95	135.5 Å²	135.5	79%	0.785	84%	0.836	S	S	*	*			trans	84.3	155.9	145.4	0	0	0	0	0	120.4
30	P	34.8	Very low	33.7	Very low	121 Å²	121	132.5 Å²	132.5	79%	0.786	83%	0.829	S	S	*	*			cis	-131.2	165.1	-5.8	23.7	0.2	0	0	0	116.2
31	A	31.8	Very low	33.7	Very low	105 Å²	105	131 Å²	131	87%	0.868	82%	0.824	S	S	*	*			trans	-17.3	125.7	166.6	0	0	0	0	0	119
32	K	36.3	Very low	34.1	Very low	207 Å²	207	131.6 Å²	131.6	90%	0.9	81%	0.811	S	S	*	*			trans	-113.9	130.5	159.2	-82.1	-177.3	177.8	176.5	0	110.1
33	K	33.8	Very low	34.7	Very low	200 Å²	200	134.2 Å²	134.2	87%	0.87	80%	0.804	S	S	*	*			trans	-46.8	131.1	-176.5	-74.2	167.8	168.4	175.5	0	114.4	V35	K33-V35 PolarHBondContact O-N 2.99Å
34	D	32.7	Very low	35.5	Very low	159 Å²	159	135.2 Å²	135.2	85%	0.85	80%	0.798	S	S	*	*			trans	-61.5	115.1	160.1	-68.5	-43.4	0	0	0	110.3	K36	D34-K36 PolarHBondContact O-N 3.23Å
35	V	36.8	Very low	37.1	Very low	138 Å²	138	133.3 Å²	133.3	84%	0.836	77%	0.773	S	S	*	*			trans	-90.4	95.9	163	-179.6	0	0	0	0	106.6	K33 G37	K33-V35 PolarHBondContact O-N 2.99Å; V35-G37 PolarHBondContact O-N 3.11Å
36	K	33.6	Very low	39.4	Very low	200 Å²	200	126 Å²	126	87%	0.87	74%	0.739	S	S	*	*			trans	-63.1	99.3	165.1	-84.1	-178.6	173.2	179	0	108.3	D34 S38	D34-K36 PolarHBondContact O-N 3.23Å; K36-S38 PolarHBondContact O-N 2.83Å; K36-S38 VanDerWaalsContact O-N 3.11Å
37	G	32.3	Very low	42.1	Very low	67 Å²	67	122.6 Å²	122.6	69%	0.691	70%	0.701	S	S	*	*			trans	-60.5	109.1	165.1	0	0	0	0	0	109	V35	V35-G37 PolarHBondContact O-N 3.11Å
38	S	30	Very low	44.6	Very low	93 Å²	93	126.6 Å²	126.6	65%	0.65	69%	0.693	S	S	*	*			trans	-69.3	129.4	175.1	66.8	0	0	0	0	109.2	K36 V40	K36-S38 PolarHBondContact O-N 2.83Å; K36-S38 VanDerWaalsContact O-N 3.11Å; S38-V40 VanDerWaalsContact C-N 3.27Å; S38-V40 PolarHBondContact O-N 3.35Å; S38-V40 WeakPolarHBondContact OG-CG2 3.42Å
39	Y	34	Very low	47.3	Very low	235 Å²	235	122 Å²	122	92%	0.922	68%	0.675	S	S	*	*			trans	-57.7	91	162.7	-87.1	-99.8	0	0	0	108.9
40	V	31.1	Very low	49.9	Very low	105 Å²	105	118.1 Å²	118.1	64%	0.636	64%	0.64	S	S	*	*			trans	-84.7	119.2	168.5	-178.1	0	0	0	0	106.5	S38 I42	S38-V40 VanDerWaalsContact C-N 3.27Å; S38-V40 PolarHBondContact O-N 3.35Å; S38-V40 WeakPolarHBondContact OG-CG2 3.42Å; V40-I42 PolarHBondContact O-N 3.3Å
41	S	30.9	Very low	52.7	Low	97 Å²	97	119.3 Å²	119.3	68%	0.678	64%	0.639	S	S	*	*			trans	-45.5	110.6	167.1	51.9	0	0	0	0	110	H43	S41-H43 PolarHBondContact O-N 3.1Å
42	I	41.3	Very low	55.7	Low	117 Å²	117	114.8 Å²	114.8	60%	0.6	60%	0.6	S	S	*	*			trans	-59.2	108.5	172.5	-61.5	171	0	0	0	106.2	V40 S44	V40-I42 PolarHBondContact O-N 3.3Å; I42-S44 PolarHBondContact O-N 3.33Å
43	H	42.2	Very low	58.6	Low	167 Å²	167	107.7 Å²	107.7	77%	0.773	57%	0.569	S	S	*	*			trans	-47.7	132.1	164.1	-83.1	-80.9	0	0	0	107.1	S41 S45	S41-H43 PolarHBondContact O-N 3.1Å; H43-S45 PolarHBondContact O-N 3.38Å; H43-S45 PolarHBondContact O-OG 3.22Å
44	S	49.9	Very low	61.6	Low	106 Å²	106	102.9 Å²	102.9	74%	0.741	56%	0.558	S	S	*	*			trans	-59.7	77.3	-172.9	62.3	0	0	0	0	112.5	I42	I42-S44 PolarHBondContact O-N 3.33Å
45	S	66.8	Low	64.7	Low	30 Å²	30	99.2 Å²	99.2	21%	0.21	54%	0.536	C	S	.	.			trans	-83.1	130.1	175.8	41	0	0	0	0	108.5	H43 D49 P68 H73	H43-S45 PolarHBondContact O-N 3.38Å; H43-S45 PolarHBondContact O-OG 3.22Å; S45-D49 WeakPolarHBondContact CA-OD2 3.42Å; S45-D49 WeakPolarHBondContact CB-OD2 3.49Å; S45-P68 VanDerWaalsContact O-CD 3.24Å; S45-P68 WeakPolarHBondContact O-CD 3.02Å; S45-H73 PolarHBondContact OG-CE1 3.3Å; S45-H73 PolarHBondContact OG-NE2 3.02Å
46	G	84.6	Confident	67.5	Low	20 Å²	20	92.7 Å²	92.7	21%	0.206	50%	0.497	C	S	.	.			trans	-95.7	175.1	176.9	0	0	0	0	0	110.6	R48 D49	G46-R48 PolarHBondContact O-N 3.33Å; G46-D49 PolarHBondContact N-OD2 2.87Å; G46-D49 PolarHBondContact O-N 2.98Å
47	F	90	Very high	70.5	Confident	10 Å²	10	85 Å²	85	4%	0.044	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-57.3	-18.8	172.1	-74.1	-90.1	0	0	0	114.1	D49 F50 L57 I60 F65 P68 I76 L101	F47-D49 PolarHBondContact O-N 2.62Å; F47-F50 HydrophobicContact CB-CD2 4.4Å; F47-F50 AromaticContact CD1-CD2 3.89Å; F47-F50 HydrophobicContact CD1-CD2 3.89Å; F47-F50 AromaticContact CD1-CE2 3.79Å; F47-F50 HydrophobicContact CD1-CE2 3.79Å; F47-F50 HydrophobicContact CE1-CE2 4.21Å; F47-F50 HydrophobicContact CG-CD2 4.47Å; F47-F50 HydrophobicContact CG-CE2 4.4Å; F47-F50 PolarHBondContact O-N 3.22Å; F47-L57 HydrophobicContact CB-CD2 4.2Å; F47-L57 WeakPolarHBondContact O-CD2 3.19Å; F47-I60 HydrophobicContact CB-CD1 4.08Å; F47-I60 HydrophobicContact CB-CG2 4.07Å; F47-I60 HydrophobicContact CD1-CD1 3.88Å; F47-I60 HydrophobicContact CD1-CG2 4.2Å; F47-I60 HydrophobicContact CD2-CG2 3.66Å; F47-I60 HydrophobicContact CE2-CG2 4.11Å; F47-I60 HydrophobicContact CG-CD1 4.12Å; F47-I60 HydrophobicContact CG-CG2 3.71Å; F47-F65 HydrophobicContact CD2-CB 4.5Å; F47-F65 HydrophobicContact CE2-CB 3.79Å; F47-F65 HydrophobicContact CZ-CB 4.23Å; F47-P68 HydrophobicContact CD1-CG 4.35Å; F47-P68 HydrophobicContact CD2-CG 4.04Å; F47-P68 HydrophobicContact CE1-CB 4.2Å; F47-P68 HydrophobicContact CE1-CG 4.36Å; F47-P68 HydrophobicContact CE2-CB 4.23Å; F47-P68 HydrophobicContact CE2-CG 4.04Å; F47-P68 HydrophobicContact CG-CG 4.19Å; F47-P68 HydrophobicContact CZ-CB 3.98Å; F47-P68 HydrophobicContact CZ-CG 4.21Å; F47-I76 HydrophobicContact CE1-CD1 4.41Å; F47-L101 HydrophobicContact CD1-CD1 4.18Å; F47-L101 HydrophobicContact CE1-CD1 3.95Å
48	R	90.2	Very high	73.5	Confident	191 Å²	191	88.7 Å²	88.7	72%	0.721	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-62.5	-29.9	175.3	-68.8	-173.7	176.8	-175.9	0.6	112.9	G46 F50 L51 L57	G46-R48 PolarHBondContact O-N 3.33Å; R48-F50 PolarHBondContact O-N 3.3Å; R48-L51 PolarHBondContact O-N 3.3Å; R48-L57 HydrophobicContact CG-CD1 4.37Å; R48-L57 HydrophobicContact CG-CD2 4.27Å
49	D	91.1	Very high	76.7	Confident	100 Å²	100	84.2 Å²	84.2	54%	0.535	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-73.3	-14.9	-177.6	-58.2	-41.3	0	0	0	112.3	S45 G46 F47 L51	S45-D49 WeakPolarHBondContact CA-OD2 3.42Å; S45-D49 WeakPolarHBondContact CB-OD2 3.49Å; G46-D49 PolarHBondContact N-OD2 2.87Å; G46-D49 PolarHBondContact O-N 2.98Å; F47-D49 PolarHBondContact O-N 2.62Å; D49-L51 PolarHBondContact O-N 3.27Å
50	F	93.1	Very high	79.5	Confident	13 Å²	13	73.1 Å²	73.1	6%	0.057	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-78.8	-0.9	172.6	-57.6	-39.2	0	0	0	114.1	F47 R48 L52 P68 H73 I76 P77 I80	F47-F50 HydrophobicContact CB-CD2 4.4Å; F47-F50 AromaticContact CD1-CD2 3.89Å; F47-F50 HydrophobicContact CD1-CD2 3.89Å; F47-F50 AromaticContact CD1-CE2 3.79Å; F47-F50 HydrophobicContact CD1-CE2 3.79Å; F47-F50 HydrophobicContact CE1-CE2 4.21Å; F47-F50 HydrophobicContact CG-CD2 4.47Å; F47-F50 HydrophobicContact CG-CE2 4.4Å; F47-F50 PolarHBondContact O-N 3.22Å; R48-F50 PolarHBondContact O-N 3.3Å; F50-L52 VanDerWaalsContact C-N 3.27Å; F50-L52 HydrophobicContact CB-CD1 4.37Å; F50-L52 HydrophobicContact CB-CD2 4.18Å; F50-L52 HydrophobicContact CB-CG 3.91Å; F50-L52 PolarHBondContact O-N 3.23Å; F50-P68 HydrophobicContact CE2-CB 3.76Å; F50-P68 HydrophobicContact CE2-CG 3.53Å; F50-P68 HydrophobicContact CZ-CB 3.76Å; F50-P68 HydrophobicContact CZ-CG 3.65Å; F50-H73 AromaticContact CE1-ND1 3.6Å; F50-H73 AromaticContact CZ-CE1 3.81Å; F50-H73 AromaticContact CZ-ND1 3.53Å; F50-I76 HydrophobicContact CB-CG2 4Å; F50-I76 HydrophobicContact CD1-CB 4.48Å; F50-I76 HydrophobicContact CD1-CG2 4.23Å; F50-I76 HydrophobicContact CD2-CB 4.33Å; F50-I76 HydrophobicContact CD2-CD1 4.08Å; F50-I76 HydrophobicContact CD2-CG2 3.87Å; F50-I76 HydrophobicContact CE2-CB 4.36Å; F50-I76 HydrophobicContact CE2-CD1 3.8Å; F50-I76 HydrophobicContact CE2-CG2 4.39Å; F50-I76 HydrophobicContact CG-CB 4.4Å; F50-I76 HydrophobicContact CG-CG2 3.79Å; F50-I76 HydrophobicContact CZ-CB 4.44Å; F50-I76 HydrophobicContact CZ-CD1 4.44Å; F50-P77 HydrophobicContact CD1-CG 3.92Å; F50-P77 HydrophobicContact CE1-CG 3.95Å; F50-I80 WeakPolarHBondContact O-CD1 3.38Å
51	L	93.8	Very high	82.4	Confident	145 Å²	145	72.8 Å²	72.8	76%	0.759	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	38.8	177.5	-56.3	176.6	0	0	0	114	R48 D49	R48-L51 PolarHBondContact O-N 3.3Å; D49-L51 PolarHBondContact O-N 3.27Å
52	L	95.5	Very high	85.3	Confident	10 Å²	10	71.9 Å²	71.9	5%	0.052	37%	0.369	C	S	.	.			trans	-72.4	159.2	178.5	-55.7	176.7	0	0	0	112.1	F50 L56 L57 I60 I76 I80 Q105	F50-L52 VanDerWaalsContact C-N 3.27Å; F50-L52 HydrophobicContact CB-CD1 4.37Å; F50-L52 HydrophobicContact CB-CD2 4.18Å; F50-L52 HydrophobicContact CB-CG 3.91Å; F50-L52 PolarHBondContact O-N 3.23Å; L52-L56 HydrophobicContact CB-CB 4.34Å; L52-L57 HydrophobicContact CB-CD2 4.13Å; L52-L57 HydrophobicContact CB-CG 4.13Å; L52-L57 HydrophobicContact CD1-CD2 4.38Å; L52-I60 HydrophobicContact CD1-CD1 3.7Å; L52-I76 HydrophobicContact CD2-CG2 4.46Å; L52-I80 HydrophobicContact CD2-CG2 4.03Å; L52-Q105 HydrophobicContact CD2-CB 4.21Å; L52-Q105 HydrophobicContact CD2-CG 4.08Å
53	K	96.9	Very high	87.4	Confident	58 Å²	58	68.2 Å²	68.2	25%	0.252	35%	0.353	S	S	.	.			trans	-50.1	137.7	171.1	-78.5	168.9	-175.8	169.1	0	110.4	E55 L56 L57 L104 Q105 L107 M140	K53-E55 PolarHBondContact O-N 3.18Å; K53-E55 VanDerWaalsContact O-N 3.11Å; K53-L56 HydrophobicContact CB-CD1 4.24Å; K53-L56 HydrophobicContact CB-CG 4.32Å; K53-L56 WeakPolarHBondContact O-CB 3.15Å; K53-L56 PolarHBondContact O-N 2.95Å; K53-L57 PolarHBondContact O-N 3.02Å; K53-L57 VanDerWaalsContact O-N 3.12Å; K53-L104 PolarHBondContact NZ-O 3.29Å; K53-Q105 WeakPolarHBondContact CE-O 3.38Å; K53-Q105 VanDerWaalsContact CG-OE1 3.28Å; K53-Q105 PolarHBondContact NZ-O 2.93Å; K53-L107 PolarHBondContact NZ-O 2.89Å; K53-M140 HydrophobicContact CD-CE 4.08Å
54	P	97.1	Very high	89.4	Confident	99 Å²	99	63 Å²	63	64%	0.643	35%	0.345	S	S	*	.	H	α-helix	trans	-53.1	-34.8	-179.8	-28.2	35.3	0	0	0	114.3	L57 R58	P54-L57 PolarHBondContact O-N 3.12Å; P54-R58 WeakPolarHBondContact O-CB 3.39Å; P54-R58 PolarHBondContact O-N 2.83Å
55	E	96.9	Very high	91	Very high	83 Å²	83	59.9 Å²	59.9	39%	0.388	32%	0.318	S	S	.	.	H	α-helix	trans	-64.3	-39.3	177.6	-57.5	90.5	154.7	0	0	112	K53 A59 M140	K53-E55 PolarHBondContact O-N 3.18Å; K53-E55 VanDerWaalsContact O-N 3.11Å; E55-A59 PolarHBondContact O-N 2.98Å; E55-A59 VanDerWaalsContact O-N 3.09Å; E55-M140 HydrophobicContact CB-CG 4Å
56	L	96.7	Very high	91.5	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-69.8	-46.3	175.9	-72.6	174.6	0	0	0	111.1	L52 K53 R58 A59 I60 L101 L104 Q105 M140	L52-L56 HydrophobicContact CB-CB 4.34Å; K53-L56 HydrophobicContact CB-CD1 4.24Å; K53-L56 HydrophobicContact CB-CG 4.32Å; K53-L56 WeakPolarHBondContact O-CB 3.15Å; K53-L56 PolarHBondContact O-N 2.95Å; L56-R58 PolarHBondContact O-N 3.38Å; L56-A59 PolarHBondContact O-N 2.96Å; L56-A59 VanDerWaalsContact O-N 3.07Å; L56-I60 VanDerWaalsContact O-CG1 3.26Å; L56-I60 WeakPolarHBondContact O-CG1 3.39Å; L56-I60 PolarHBondContact O-N 3.11Å; L56-L101 HydrophobicContact CD2-CD2 4.3Å; L56-L104 HydrophobicContact CD1-CB 4.08Å; L56-L104 HydrophobicContact CD2-CB 3.74Å; L56-L104 HydrophobicContact CD2-CD1 3.78Å; L56-L104 HydrophobicContact CD2-CG 4.39Å; L56-Q105 HydrophobicContact CD1-CB 4.03Å; L56-M140 HydrophobicContact CD2-SD 3.95Å; L56-M140 HydrophobicContact CG-SD 4.2Å
57	L	95.8	Very high	91.5	Very high	38 Å²	38	70.7 Å²	70.7	20%	0.199	36%	0.359	C	S	.	.	H	α-helix	trans	-57.3	-39.9	176.4	-68.8	174.6	0	0	0	111.6	F47 R48 L52 K53 P54 I60 V61	F47-L57 HydrophobicContact CB-CD2 4.2Å; F47-L57 WeakPolarHBondContact O-CD2 3.19Å; R48-L57 HydrophobicContact CG-CD1 4.37Å; R48-L57 HydrophobicContact CG-CD2 4.27Å; L52-L57 HydrophobicContact CB-CD2 4.13Å; L52-L57 HydrophobicContact CB-CG 4.13Å; L52-L57 HydrophobicContact CD1-CD2 4.38Å; K53-L57 PolarHBondContact O-N 3.02Å; K53-L57 VanDerWaalsContact O-N 3.12Å; P54-L57 PolarHBondContact O-N 3.12Å; L57-I60 HydrophobicContact CD2-CD1 4.5Å; L57-I60 PolarHBondContact O-N 3.2Å; L57-V61 WeakPolarHBondContact O-CG2 3.08Å; L57-V61 PolarHBondContact O-N 2.9Å; L57-V61 VanDerWaalsContact O-N 3.16Å
58	R	96	Very high	91.4	Very high	145 Å²	145	70.9 Å²	70.9	55%	0.547	36%	0.362	S	S	.	.	H	α-helix	trans	-64.4	-44.1	175.1	-169.1	-176.7	176.4	173.5	1.8	112.1	P54 L56 I60 V61 D62 Y139	P54-R58 WeakPolarHBondContact O-CB 3.39Å; P54-R58 PolarHBondContact O-N 2.83Å; L56-R58 PolarHBondContact O-N 3.38Å; R58-I60 VanDerWaalsContact C-N 3.34Å; R58-V61 PolarHBondContact O-N 2.88Å; R58-D62 PolarHBondContact O-N 2.9Å; R58-D62 VanDerWaalsContact O-N 3.09Å; R58-Y139 HydrophobicContact CB-CD2 3.89Å; R58-Y139 HydrophobicContact CB-CE2 4.08Å; R58-Y139 HydrophobicContact CG-CD2 3.75Å; R58-Y139 HydrophobicContact CG-CE2 3.47Å; R58-Y139 VanDerWaalsContact CG-CE2 3.47Å; R58-Y139 HydrophobicContact CG-CG 4.49Å; R58-Y139 VanDerWaalsContact CZ-CE1 3.48Å; R58-Y139 PolarHBondContact NE-OH 2.75Å
59	A	96.3	Very high	91.3	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-65.8	-36.6	178.1	0	0	0	0	0	112.6	E55 L56 D62 C63 F136 Y139	E55-A59 PolarHBondContact O-N 2.98Å; E55-A59 VanDerWaalsContact O-N 3.09Å; L56-A59 PolarHBondContact O-N 2.96Å; L56-A59 VanDerWaalsContact O-N 3.07Å; A59-D62 PolarHBondContact O-N 2.99Å; A59-C63 PolarHBondContact O-N 3.26Å; A59-C63 VanDerWaalsContact O-N 3.08Å; A59-C63 PolarHBondContact O-SG 2.74Å; A59-F136 VanDerWaalsContact CB-O 3.27Å; A59-F136 WeakPolarHBondContact CB-O 3.35Å; A59-Y139 HydrophobicContact CB-CD2 4.12Å
60	I	93.7	Very high	91	Very high	2 Å²	2	64.8 Å²	64.8	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-59.8	-48.1	174.9	-70.8	165	0	0	0	110.7	F47 L52 L56 L57 R58 D62 C63 G64 F65 L101 F136	F47-I60 HydrophobicContact CB-CD1 4.08Å; F47-I60 HydrophobicContact CB-CG2 4.07Å; F47-I60 HydrophobicContact CD1-CD1 3.88Å; F47-I60 HydrophobicContact CD1-CG2 4.2Å; F47-I60 HydrophobicContact CD2-CG2 3.66Å; F47-I60 HydrophobicContact CE2-CG2 4.11Å; F47-I60 HydrophobicContact CG-CD1 4.12Å; F47-I60 HydrophobicContact CG-CG2 3.71Å; L52-I60 HydrophobicContact CD1-CD1 3.7Å; L56-I60 VanDerWaalsContact O-CG1 3.26Å; L56-I60 WeakPolarHBondContact O-CG1 3.39Å; L56-I60 PolarHBondContact O-N 3.11Å; L57-I60 HydrophobicContact CD2-CD1 4.5Å; L57-I60 PolarHBondContact O-N 3.2Å; R58-I60 VanDerWaalsContact C-N 3.34Å; I60-D62 PolarHBondContact O-N 3.47Å; I60-C63 WeakPolarHBondContact O-CB 3.4Å; I60-C63 PolarHBondContact O-N 3.16Å; I60-C63 VanDerWaalsContact O-N 3.14Å; I60-G64 PolarHBondContact O-N 3.03Å; I60-F65 HydrophobicContact CG2-CB 3.86Å; I60-F65 PolarHBondContact O-N 2.97Å; I60-L101 HydrophobicContact CD1-CD1 3.93Å; I60-L101 HydrophobicContact CD1-CD2 3.82Å; I60-L101 HydrophobicContact CG1-CD1 4.36Å; I60-L101 HydrophobicContact CG1-CD2 3.93Å; I60-F136 HydrophobicContact CG1-CD1 3.97Å; I60-F136 HydrophobicContact CG1-CE1 3.81Å
61	V	91.6	Very high	90.9	Very high	97 Å²	97	64.8 Å²	64.8	59%	0.588	34%	0.342	S	S	*	.	H	α-helix	trans	-61.6	-43.7	177.4	172.2	0	0	0	0	111.3	L57 R58 C63 G64	L57-V61 WeakPolarHBondContact O-CG2 3.08Å; L57-V61 PolarHBondContact O-N 2.9Å; L57-V61 VanDerWaalsContact O-N 3.16Å; R58-V61 PolarHBondContact O-N 2.88Å; V61-C63 PolarHBondContact O-N 3.1Å; V61-G64 PolarHBondContact O-N 2.87Å
62	D	91.5	Very high	90.8	Very high	79 Å²	79	58 Å²	58	42%	0.422	31%	0.306	S	S	.	.	H	α-helix	trans	-62	-27.2	176.6	-83.8	14.5	0	0	0	113.4	R58 A59 I60 G64 K138 Y139	R58-D62 PolarHBondContact O-N 2.9Å; R58-D62 VanDerWaalsContact O-N 3.09Å; A59-D62 PolarHBondContact O-N 2.99Å; I60-D62 PolarHBondContact O-N 3.47Å; D62-G64 VanDerWaalsContact C-N 3.26Å; D62-K138 IonicContact OD2-NZ 3.39Å; D62-K138 PolarHBondContact OD2-NZ 2.84Å; D62-Y139 WeakPolarHBondContact OD2-CE2 3.36Å; D62-Y139 PolarHBondContact OD2-OH 2.88Å
63	C	86.8	Confident	90.6	Very high	40 Å²	40	59.2 Å²	59.2	27%	0.27	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-4.3	174.7	-64.6	0	0	0	0	112.9	A59 I60 V61 F65	A59-C63 PolarHBondContact O-N 3.26Å; A59-C63 VanDerWaalsContact O-N 3.08Å; A59-C63 PolarHBondContact O-SG 2.74Å; I60-C63 WeakPolarHBondContact O-CB 3.4Å; I60-C63 PolarHBondContact O-N 3.16Å; I60-C63 VanDerWaalsContact O-N 3.14Å; V61-C63 PolarHBondContact O-N 3.1Å; C63-F65 HydrophobicContact CB-CD2 3.5Å; C63-F65 HydrophobicContact CB-CE2 3.55Å
64	G	84.2	Confident	90.4	Very high	58 Å²	58	62 Å²	62	60%	0.598	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	12	179.6	0	0	0	0	0	114.9	I60 V61 D62 E66	I60-G64 PolarHBondContact O-N 3.03Å; V61-G64 PolarHBondContact O-N 2.87Å; D62-G64 VanDerWaalsContact C-N 3.26Å; G64-E66 PolarHBondContact O-N 3.13Å
65	F	83.1	Confident	90.2	Very high	40 Å²	40	57.2 Å²	57.2	18%	0.175	29%	0.294	C	S	.	.			trans	-83.3	113.2	177.5	-63	-65.2	0	0	0	110.9	F47 I60 C63 F136 F381	F47-F65 HydrophobicContact CD2-CB 4.5Å; F47-F65 HydrophobicContact CE2-CB 3.79Å; F47-F65 HydrophobicContact CZ-CB 4.23Å; I60-F65 HydrophobicContact CG2-CB 3.86Å; I60-F65 PolarHBondContact O-N 2.97Å; C63-F65 HydrophobicContact CB-CD2 3.5Å; C63-F65 HydrophobicContact CB-CE2 3.55Å; F65-F136 HydrophobicContact CD2-CE1 4.07Å; F65-F136 AromaticContact CD2-CZ 3.98Å; F65-F136 HydrophobicContact CD2-CZ 3.98Å; F65-F136 HydrophobicContact CE2-CE1 4.09Å; F65-F136 AromaticContact CE2-CZ 3.59Å; F65-F136 HydrophobicContact CE2-CZ 3.59Å; F65-F381 HydrophobicContact CE1-CE1 4.21Å; F65-F381 AromaticContact CE1-CZ 3.98Å; F65-F381 HydrophobicContact CE1-CZ 3.98Å; F65-F381 HydrophobicContact CZ-CZ 4.45Å
66	E	76.9	Confident	90.2	Very high	153 Å²	153	53.3 Å²	53.3	72%	0.715	28%	0.276	S	S	*	.			trans	-99.2	-42.7	179.2	-61.7	-172.6	163.7	0	0	112.4	G64	G64-E66 PolarHBondContact O-N 3.13Å
67	H	83.9	Confident	90.1	Very high	123 Å²	123	55.3 Å²	55.3	57%	0.569	29%	0.289	S	S	*	.	S	Bend	trans	-120.5	133.4	-176.4	-64.2	-63	0	0	0	111.2
68	P	89.3	Confident	90.1	Very high	15 Å²	15	56.9 Å²	56.9	10%	0.097	30%	0.296	C	S	.	.			trans	-68.8	148.6	173.9	-10.6	26	0	0	0	111	S45 F47 F50 Q72 H73	S45-P68 VanDerWaalsContact O-CD 3.24Å; S45-P68 WeakPolarHBondContact O-CD 3.02Å; F47-P68 HydrophobicContact CD1-CG 4.35Å; F47-P68 HydrophobicContact CD2-CG 4.04Å; F47-P68 HydrophobicContact CE1-CB 4.2Å; F47-P68 HydrophobicContact CE1-CG 4.36Å; F47-P68 HydrophobicContact CE2-CB 4.23Å; F47-P68 HydrophobicContact CE2-CG 4.04Å; F47-P68 HydrophobicContact CG-CG 4.19Å; F47-P68 HydrophobicContact CZ-CB 3.98Å; F47-P68 HydrophobicContact CZ-CG 4.21Å; F50-P68 HydrophobicContact CE2-CB 3.76Å; F50-P68 HydrophobicContact CE2-CG 3.53Å; F50-P68 HydrophobicContact CZ-CB 3.76Å; F50-P68 HydrophobicContact CZ-CG 3.65Å; P68-Q72 HydrophobicContact CB-CB 3.94Å; P68-H73 WeakPolarHBondContact CD-NE2 3.46Å; P68-H73 VanDerWaalsContact CG-NE2 3.32Å; P68-H73 WeakPolarHBondContact CG-NE2 3.19Å
69	S	86.2	Confident	90.1	Very high	22 Å²	22	50 Å²	50	15%	0.154	27%	0.27	C	S	.	.			trans	-72.1	164.1	167.2	67.4	0	0	0	0	111.2	V71 Q72 H73 M93	S69-V71 VanDerWaalsContact C-N 3.32Å; S69-V71 PolarHBondContact O-N 2.89Å; S69-V71 VanDerWaalsContact OG-CG1 3.31Å; S69-V71 WeakPolarHBondContact OG-CG1 3.45Å; S69-Q72 WeakPolarHBondContact O-CA 3.03Å; S69-Q72 WeakPolarHBondContact O-CB 3.43Å; S69-Q72 PolarHBondContact O-N 3.28Å; S69-Q72 VanDerWaalsContact OG-CD 3.27Å; S69-Q72 VanDerWaalsContact OG-CG 3.25Å; S69-Q72 WeakPolarHBondContact OG-CG 3.44Å; S69-Q72 PolarHBondContact OG-N 2.96Å; S69-H73 PolarHBondContact O-N 2.95Å; S69-M93 VanDerWaalsContact CB-O 3.31Å; S69-M93 WeakPolarHBondContact CB-O 3.49Å; S69-M93 PolarHBondContact OG-O 3Å
70	E	86.6	Confident	90.1	Very high	141 Å²	141	51.8 Å²	51.8	66%	0.659	28%	0.279	S	S	*	.	H	α-helix	trans	-54.2	-46.8	177	-173.1	178.5	-176.3	0	0	112	Q72 H73 E74	E70-Q72 VanDerWaalsContact C-N 3.26Å; E70-Q72 PolarHBondContact O-N 3.35Å; E70-H73 WeakPolarHBondContact O-CB 3.37Å; E70-H73 PolarHBondContact O-N 3.18Å; E70-H73 VanDerWaalsContact O-N 3.13Å; E70-E74 WeakPolarHBondContact O-CG 3.45Å; E70-E74 PolarHBondContact O-N 3.48Å
71	V	89.3	Confident	90.2	Very high	12 Å²	12	57.9 Å²	57.9	7%	0.073	31%	0.311	C	S	.	.	H	α-helix	trans	-63.2	-31.7	176.7	65.1	0	0	0	0	112.7	S69 C75 C87 A89 M93	S69-V71 VanDerWaalsContact C-N 3.32Å; S69-V71 PolarHBondContact O-N 2.89Å; S69-V71 VanDerWaalsContact OG-CG1 3.31Å; S69-V71 WeakPolarHBondContact OG-CG1 3.45Å; V71-C75 WeakPolarHBondContact O-CB 3.26Å; V71-C75 PolarHBondContact O-N 2.86Å; V71-C75 PolarHBondContact O-SG 3.34Å; V71-C87 WeakPolarHBondContact CG2-SG 3.31Å; V71-A89 HydrophobicContact CB-CB 3.89Å; V71-A89 HydrophobicContact CG1-CB 4.39Å; V71-A89 HydrophobicContact CG2-CB 3.58Å; V71-M93 HydrophobicContact CG1-CB 3.9Å; V71-M93 WeakPolarHBondContact CG1-O 3.49Å
72	Q	92.7	Very high	90.5	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.019	30%	0.297	C	S	.	.	H	α-helix	trans	-72.4	-39.7	175.2	-70.7	166.3	-3.9	0	0	111.4	P68 S69 E70 I76 G94 V98	P68-Q72 HydrophobicContact CB-CB 3.94Å; S69-Q72 WeakPolarHBondContact O-CA 3.03Å; S69-Q72 WeakPolarHBondContact O-CB 3.43Å; S69-Q72 PolarHBondContact O-N 3.28Å; S69-Q72 VanDerWaalsContact OG-CD 3.27Å; S69-Q72 VanDerWaalsContact OG-CG 3.25Å; S69-Q72 WeakPolarHBondContact OG-CG 3.44Å; S69-Q72 PolarHBondContact OG-N 2.96Å; E70-Q72 VanDerWaalsContact C-N 3.26Å; E70-Q72 PolarHBondContact O-N 3.35Å; Q72-I76 HydrophobicContact CB-CD1 3.78Å; Q72-I76 HydrophobicContact CB-CG1 4.36Å; Q72-I76 HydrophobicContact CG-CD1 4.16Å; Q72-I76 WeakPolarHBondContact O-CB 3.18Å; Q72-I76 VanDerWaalsContact O-CG1 3.25Å; Q72-I76 WeakPolarHBondContact O-CG1 3.44Å; Q72-I76 PolarHBondContact O-N 3.18Å; Q72-G94 PolarHBondContact NE2-O 2.8Å; Q72-V98 HydrophobicContact CB-CG2 4.44Å; Q72-V98 HydrophobicContact CG-CG2 3.78Å
73	H	91.2	Very high	90.7	Very high	35 Å²	35	54.4 Å²	54.4	16%	0.162	29%	0.294	C	S	.	.	H	α-helix	trans	-60.5	-44.6	174.8	-94.9	-56.5	0	0	0	113	S45 F50 P68 S69 E70 P77	S45-H73 PolarHBondContact OG-CE1 3.3Å; S45-H73 PolarHBondContact OG-NE2 3.02Å; F50-H73 AromaticContact CE1-ND1 3.6Å; F50-H73 AromaticContact CZ-CE1 3.81Å; F50-H73 AromaticContact CZ-ND1 3.53Å; P68-H73 WeakPolarHBondContact CD-NE2 3.46Å; P68-H73 VanDerWaalsContact CG-NE2 3.32Å; P68-H73 WeakPolarHBondContact CG-NE2 3.19Å; S69-H73 PolarHBondContact O-N 2.95Å; E70-H73 WeakPolarHBondContact O-CB 3.37Å; E70-H73 PolarHBondContact O-N 3.18Å; E70-H73 VanDerWaalsContact O-N 3.13Å; H73-P77 WeakPolarHBondContact O-CD 3.25Å; H73-P77 WeakPolarHBondContact O-CG 3.48Å
74	E	91.6	Very high	91.3	Very high	115 Å²	115	53.3 Å²	53.3	54%	0.537	29%	0.285	S	S	.	.	H	α-helix	trans	-72.7	-45	179	-65.1	-60.6	131.3	0	0	111.8	E70 I249	E70-E74 WeakPolarHBondContact O-CG 3.45Å; E70-E74 PolarHBondContact O-N 3.48Å; E74-I249 HydrophobicContact CB-CD1 3.72Å
75	C	94.7	Very high	91.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-83.9	-43.4	-170.9	-64.1	0	0	0	0	115	V71 Q78 A79 V98 M247 I249	V71-C75 WeakPolarHBondContact O-CB 3.26Å; V71-C75 PolarHBondContact O-N 2.86Å; V71-C75 PolarHBondContact O-SG 3.34Å; C75-Q78 PolarHBondContact O-N 2.84Å; C75-A79 WeakPolarHBondContact O-CB 3.44Å; C75-A79 PolarHBondContact O-N 3.41Å; C75-V98 HydrophobicContact CB-CB 4.38Å; C75-V98 HydrophobicContact CB-CG1 3.29Å; C75-V98 HydrophobicContact CB-CG2 4.18Å; C75-M247 HydrophobicContact CB-CE 4.43Å; C75-I249 HydrophobicContact CB-CD1 4.43Å; C75-I249 WeakPolarHBondContact SG-CD1 3.35Å
76	I	95.8	Very high	92.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.1	-46.5	-168.6	-68.7	175.8	0	0	0	111.9	F47 F50 L52 Q72 Q78 A79 I80 V98 L101	F47-I76 HydrophobicContact CE1-CD1 4.41Å; F50-I76 HydrophobicContact CB-CG2 4Å; F50-I76 HydrophobicContact CD1-CB 4.48Å; F50-I76 HydrophobicContact CD1-CG2 4.23Å; F50-I76 HydrophobicContact CD2-CB 4.33Å; F50-I76 HydrophobicContact CD2-CD1 4.08Å; F50-I76 HydrophobicContact CD2-CG2 3.87Å; F50-I76 HydrophobicContact CE2-CB 4.36Å; F50-I76 HydrophobicContact CE2-CD1 3.8Å; F50-I76 HydrophobicContact CE2-CG2 4.39Å; F50-I76 HydrophobicContact CG-CB 4.4Å; F50-I76 HydrophobicContact CG-CG2 3.79Å; F50-I76 HydrophobicContact CZ-CB 4.44Å; F50-I76 HydrophobicContact CZ-CD1 4.44Å; L52-I76 HydrophobicContact CD2-CG2 4.46Å; Q72-I76 HydrophobicContact CB-CD1 3.78Å; Q72-I76 HydrophobicContact CB-CG1 4.36Å; Q72-I76 HydrophobicContact CG-CD1 4.16Å; Q72-I76 WeakPolarHBondContact O-CB 3.18Å; Q72-I76 VanDerWaalsContact O-CG1 3.25Å; Q72-I76 WeakPolarHBondContact O-CG1 3.44Å; Q72-I76 PolarHBondContact O-N 3.18Å; I76-Q78 VanDerWaalsContact C-N 3.32Å; I76-Q78 PolarHBondContact O-N 2.89Å; I76-A79 PolarHBondContact O-N 3.44Å; I76-I80 HydrophobicContact CG2-CG2 4Å; I76-I80 WeakPolarHBondContact O-CG1 3.2Å; I76-I80 WeakPolarHBondContact O-CG2 3.39Å; I76-I80 PolarHBondContact O-N 2.87Å; I76-V98 HydrophobicContact CG1-CB 4.47Å; I76-V98 HydrophobicContact CG1-CG1 4.21Å; I76-V98 HydrophobicContact CG1-CG2 4.45Å; I76-L101 HydrophobicContact CD1-CD1 4.09Å
77	P	94.7	Very high	93.4	Very high	43 Å²	43	41.3 Å²	41.3	28%	0.279	22%	0.215	S	C	.	.	H	α-helix	trans	-58.2	-38.6	-177.9	-26.8	36.1	0	0	0	114.4	F50 H73 I80 L81	F50-P77 HydrophobicContact CD1-CG 3.92Å; F50-P77 HydrophobicContact CE1-CG 3.95Å; H73-P77 WeakPolarHBondContact O-CD 3.25Å; H73-P77 WeakPolarHBondContact O-CG 3.48Å; P77-I80 WeakPolarHBondContact O-CG1 3.4Å; P77-L81 WeakPolarHBondContact O-CG 3.32Å
78	Q	95.1	Very high	93.8	Very high	71 Å²	71	35.6 Å²	35.6	33%	0.332	19%	0.188	S	C	.	.	H	α-helix	trans	-82.2	-37.4	177.8	-56.7	-53.6	-32.2	0	0	111.5	C75 I76 I80 L81 M83 M247	C75-Q78 PolarHBondContact O-N 2.84Å; I76-Q78 VanDerWaalsContact C-N 3.32Å; I76-Q78 PolarHBondContact O-N 2.89Å; Q78-I80 VanDerWaalsContact C-N 3.33Å; Q78-I80 PolarHBondContact O-N 3.2Å; Q78-L81 WeakPolarHBondContact O-CB 3.46Å; Q78-L81 PolarHBondContact O-N 3.07Å; Q78-L81 VanDerWaalsContact O-N 3.1Å; Q78-M83 HydrophobicContact CB-CB 4.49Å; Q78-M83 HydrophobicContact CB-SD 4.16Å; Q78-M83 HydrophobicContact CG-SD 4.48Å; Q78-M83 PolarHBondContact O-N 3.47Å; Q78-M83 PolarHBondContact OE1-SD 3.09Å; Q78-M247 HydrophobicContact CB-CE 4.21Å; Q78-M247 HydrophobicContact CB-SD 3.67Å; Q78-M247 HydrophobicContact CG-SD 3.49Å; Q78-M247 WeakPolarHBondContact CG-SD 3.27Å
79	A	97.3	Very high	93.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.3	-38.1	178.8	0	0	0	0	0	112.1	C75 I76 L81 G82 V85 A102 Q106 Q223 M225	C75-A79 WeakPolarHBondContact O-CB 3.44Å; C75-A79 PolarHBondContact O-N 3.41Å; I76-A79 PolarHBondContact O-N 3.44Å; A79-L81 PolarHBondContact O-N 3.29Å; A79-G82 PolarHBondContact O-N 3.01Å; A79-V85 HydrophobicContact CB-CG2 4.26Å; A79-A102 HydrophobicContact CB-CB 3.57Å; A79-Q106 PolarHBondContact O-NE2 3.05Å; A79-Q223 PolarHBondContact O-NE2 3.46Å; A79-M225 HydrophobicContact CB-SD 3.87Å
80	I	96.6	Very high	93.3	Very high	37 Å²	37	35.6 Å²	35.6	19%	0.19	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.2	177	63	175.4	0	0	0	113.4	F50 L52 I76 P77 Q78 G82 A102 Q105 Q106	F50-I80 WeakPolarHBondContact O-CD1 3.38Å; L52-I80 HydrophobicContact CD2-CG2 4.03Å; I76-I80 HydrophobicContact CG2-CG2 4Å; I76-I80 WeakPolarHBondContact O-CG1 3.2Å; I76-I80 WeakPolarHBondContact O-CG2 3.39Å; I76-I80 PolarHBondContact O-N 2.87Å; P77-I80 WeakPolarHBondContact O-CG1 3.4Å; Q78-I80 VanDerWaalsContact C-N 3.33Å; Q78-I80 PolarHBondContact O-N 3.2Å; I80-G82 VanDerWaalsContact C-N 3.29Å; I80-A102 HydrophobicContact CG2-CB 4.26Å; I80-Q105 HydrophobicContact CB-CG 4.2Å; I80-Q105 HydrophobicContact CG2-CB 4.13Å; I80-Q105 HydrophobicContact CG2-CG 3.92Å; I80-Q106 WeakPolarHBondContact O-CG 3.21Å
81	L	95.9	Very high	92.7	Very high	130 Å²	130	29.2 Å²	29.2	68%	0.681	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.1	177.1	-64.4	175.2	0	0	0	112.9	P77 Q78 A79	P77-L81 WeakPolarHBondContact O-CG 3.32Å; Q78-L81 WeakPolarHBondContact O-CB 3.46Å; Q78-L81 PolarHBondContact O-N 3.07Å; Q78-L81 VanDerWaalsContact O-N 3.1Å; A79-L81 PolarHBondContact O-N 3.29Å
82	G	96.3	Very high	91.9	Very high	29 Å²	29	29.1 Å²	29.1	30%	0.299	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	86	10.1	178.5	0	0	0	0	0	114.6	A79 I80 Q223	A79-G82 PolarHBondContact O-N 3.01Å; I80-G82 VanDerWaalsContact C-N 3.29Å; G82-Q223 WeakPolarHBondContact O-CG 3.24Å
83	M	97.1	Very high	91.1	Very high	75 Å²	75	31 Å²	31	37%	0.369	17%	0.167	S	C	.	.			trans	-70	143.4	175.8	-69.7	-172.7	67.2	0	0	111.8	Q78 Q223	Q78-M83 HydrophobicContact CB-CB 4.49Å; Q78-M83 HydrophobicContact CB-SD 4.16Å; Q78-M83 HydrophobicContact CG-SD 4.48Å; Q78-M83 PolarHBondContact O-N 3.47Å; Q78-M83 PolarHBondContact OE1-SD 3.09Å; M83-Q223 PolarHBondContact O-NE2 3.16Å
84	D	98.3	Very high	90.7	Very high	16 Å²	16	29.8 Å²	29.8	9%	0.086	16%	0.164	C	C	.	.			trans	-64.4	146.3	170.5	-77.3	6	0	0	0	110.6	Q223 V224 M243 Q244 P246 M247	D84-Q223 WeakPolarHBondContact OD1-CA 3.38Å; D84-V224 CarbonylContact C-O 3.56Å; D84-V224 WeakPolarHBondContact CA-O 3.25Å; D84-V224 WeakPolarHBondContact CB-O 3.26Å; D84-V224 PolarHBondContact OD1-N 3.36Å; D84-M243 HydrophobicContact CB-CB 4.23Å; D84-M243 HydrophobicContact CB-CG 4.39Å; D84-M243 WeakPolarHBondContact OD2-CA 3.13Å; D84-M243 WeakPolarHBondContact OD2-CB 3.41Å; D84-Q244 PolarHBondContact OD2-N 3.3Å; D84-P246 HydrophobicContact CB-CB 3.87Å; D84-P246 WeakPolarHBondContact O-CA 3.21Å; D84-M247 PolarHBondContact O-N 3.06Å
85	V	97.6	Very high	90.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	124.3	-175.3	179.9	0	0	0	0	110.6	A79 C87 V224 M225 M226 F227 M243 M247	A79-V85 HydrophobicContact CB-CG2 4.26Å; V85-C87 HydrophobicContact CG1-CB 3.89Å; V85-V224 PolarHBondContact N-O 2.63Å; V85-M225 HydrophobicContact CB-CB 4.14Å; V85-M225 HydrophobicContact CB-CG 3.95Å; V85-M225 HydrophobicContact CB-SD 4.41Å; V85-M225 HydrophobicContact CG2-CG 4.1Å; V85-M225 HydrophobicContact CG2-SD 4.16Å; V85-M225 CarbonylContact O-C 3.6Å; V85-M225 VanDerWaalsContact O-CA 3.31Å; V85-M225 WeakPolarHBondContact O-CA 3.46Å; V85-M226 PolarHBondContact O-N 2.77Å; V85-F227 HydrophobicContact CG1-CE1 4.47Å; V85-F227 HydrophobicContact CG1-CZ 4.35Å; V85-M243 WeakPolarHBondContact O-CE 3.42Å; V85-M247 HydrophobicContact CB-CE 4.31Å; V85-M247 HydrophobicContact CG1-CE 3.7Å; V85-M247 HydrophobicContact CG2-CE 3.8Å
86	L	97	Very high	90.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	104.7	165.4	-179	57.9	0	0	0	108.8	M226 L231 C239 M243 M247 E248 I249 F250	L86-M226 HydrophobicContact CD1-CB 3.97Å; L86-L231 HydrophobicContact CD1-CD1 3.72Å; L86-L231 HydrophobicContact CG-CD1 4.16Å; L86-C239 HydrophobicContact CD1-CB 3.8Å; L86-C239 HydrophobicContact CD2-CB 4.09Å; L86-M243 HydrophobicContact CB-CE 4.03Å; L86-M243 HydrophobicContact CB-SD 3.91Å; L86-M243 HydrophobicContact CD1-CE 4.21Å; L86-M247 PolarHBondContact N-O 3.26Å; L86-E248 HydrophobicContact CB-CG 4.46Å; L86-E248 WeakPolarHBondContact O-CA 3.39Å; L86-I249 PolarHBondContact O-N 3.47Å; L86-F250 HydrophobicContact CD2-CE1 3.92Å; L86-F250 HydrophobicContact CD2-CZ 3.86Å; L86-F250 HydrophobicContact CG-CE1 4.04Å; L86-F250 HydrophobicContact CG-CZ 4.36Å
87	C	95	Very high	90.5	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	116.1	-171.4	174.4	0	0	0	0	112.2	V71 V85 M226 F227 S228	V71-C87 WeakPolarHBondContact CG2-SG 3.31Å; V85-C87 HydrophobicContact CG1-CB 3.89Å; C87-M226 PolarHBondContact N-O 3.05Å; C87-F227 HydrophobicContact CB-CD1 3.57Å; C87-F227 HydrophobicContact CB-CE1 3.68Å; C87-F227 HydrophobicContact CB-CG 4.48Å; C87-F227 WeakPolarHBondContact O-CA 3.46Å; C87-S228 PolarHBondContact O-N 3.11Å; C87-S228 VanDerWaalsContact O-N 3.08Å
88	Q	91.9	Very high	90.6	Very high	3 Å²	3	24.8 Å²	24.8	1%	0.014	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	120.7	161.1	-165.2	178.5	-2.6	0	0	109.3	S228 L231 I249 F250	Q88-S228 WeakPolarHBondContact CA-O 3.48Å; Q88-L231 HydrophobicContact CB-CB 4.43Å; Q88-L231 HydrophobicContact CB-CD1 4Å; Q88-L231 HydrophobicContact CB-CG 4.35Å; Q88-L231 HydrophobicContact CG-CB 4.25Å; Q88-L231 HydrophobicContact CG-CG 4.4Å; Q88-I249 PolarHBondContact N-O 3.09Å; Q88-F250 HydrophobicContact CB-CD1 4.26Å
89	A	85.5	Confident	90.7	Very high	8 Å²	8	21.4 Å²	21.4	7%	0.066	12%	0.124	C	C	.	.			trans	-149.8	157.7	172.2	0	0	0	0	0	111.3	V71 K95 S228 A229	V71-A89 HydrophobicContact CB-CB 3.89Å; V71-A89 HydrophobicContact CG1-CB 4.39Å; V71-A89 HydrophobicContact CG2-CB 3.58Å; A89-K95 HydrophobicContact CB-CD 4.03Å; A89-K95 HydrophobicContact CB-CG 4.07Å; A89-K95 PolarHBondContact O-NZ 2.69Å; A89-S228 PolarHBondContact N-O 3.09Å; A89-S228 VanDerWaalsContact N-O 3.11Å; A89-A229 VanDerWaalsContact O-CA 3.28Å; A89-A229 WeakPolarHBondContact O-CA 3.23Å
90	K	80	Confident	90.7	Very high	28 Å²	28	21.4 Å²	21.4	12%	0.122	12%	0.124	C	C	.	.			trans	-54.5	151.2	-176.4	-34.3	-166.6	-158.2	-152.2	0	112.3	M93 K95 K256 T258 L259	K90-M93 HydrophobicContact CB-CE 4.38Å; K90-M93 HydrophobicContact CB-CG 3.75Å; K90-M93 HydrophobicContact CD-CE 3.77Å; K90-M93 HydrophobicContact CG-CE 4.2Å; K90-M93 HydrophobicContact CG-CG 4.22Å; K90-M93 PolarHBondContact O-N 3.05Å; K90-K95 PolarHBondContact O-NZ 3.02Å; K90-K256 WeakPolarHBondContact CD-O 3.44Å; K90-K256 WeakPolarHBondContact CE-O 3.42Å; K90-K256 PolarHBondContact NZ-O 2.91Å; K90-T258 WeakPolarHBondContact CD-O 3.48Å; K90-T258 PolarHBondContact NZ-O 3.16Å; K90-L259 HydrophobicContact CD-CD2 4.45Å
91	S	74	Confident	90.8	Very high	8 Å²	8	19.6 Å²	19.6	6%	0.056	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	141.1	171.1	-73.7	0	0	0	0	110.1	M93 A229 H373	S91-M93 VanDerWaalsContact C-N 3.32Å; S91-M93 PolarHBondContact O-N 2.74Å; S91-A229 WeakPolarHBondContact OG-CB 3.18Å; S91-H373 PolarHBondContact OG-ND1 3.1Å
92	G	71.2	Confident	90.9	Very high	9 Å²	9	13.4 Å²	13.4	9%	0.093	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	3.7	178.3	0	0	0	0	0	116.4	G94 F381	G92-G94 VanDerWaalsContact C-N 3.25Å; G92-G94 PolarHBondContact O-N 3.24Å; G92-F381 PolarHBondContact O-N 2.83Å
93	M	76.9	Confident	91	Very high	43 Å²	43	12 Å²	12	21%	0.212	7%	0.068	C	C	.	.	S	Bend	trans	-83.4	12.3	177.6	-71.9	-73.3	-177.8	0	0	114.3	S69 V71 K90 S91 L259	S69-M93 VanDerWaalsContact CB-O 3.31Å; S69-M93 WeakPolarHBondContact CB-O 3.49Å; S69-M93 PolarHBondContact OG-O 3Å; V71-M93 HydrophobicContact CG1-CB 3.9Å; V71-M93 WeakPolarHBondContact CG1-O 3.49Å; K90-M93 HydrophobicContact CB-CE 4.38Å; K90-M93 HydrophobicContact CB-CG 3.75Å; K90-M93 HydrophobicContact CD-CE 3.77Å; K90-M93 HydrophobicContact CG-CE 4.2Å; K90-M93 HydrophobicContact CG-CG 4.22Å; K90-M93 PolarHBondContact O-N 3.05Å; S91-M93 VanDerWaalsContact C-N 3.32Å; S91-M93 PolarHBondContact O-N 2.74Å; M93-L259 HydrophobicContact CE-CD2 4.15Å
94	G	83.2	Confident	91.1	Very high	11 Å²	11	8.5 Å²	8.5	11%	0.113	5%	0.051	C	C	.	.	S	Bend	trans	78.4	26.5	178.2	0	0	0	0	0	115.7	Q72 G92 T96 A97	Q72-G94 PolarHBondContact NE2-O 2.8Å; G92-G94 VanDerWaalsContact C-N 3.25Å; G92-G94 PolarHBondContact O-N 3.24Å; G94-T96 VanDerWaalsContact C-N 3.25Å; G94-T96 PolarHBondContact O-N 3.04Å; G94-A97 PolarHBondContact O-N 2.9Å; G94-A97 VanDerWaalsContact O-N 3.13Å
95	K	90.7	Very high	91.1	Very high	19 Å²	19	9.7 Å²	9.7	8%	0.083	6%	0.056	C	C	.	.	H	α-helix	trans	-50.8	-42.6	173.6	-67.2	-169.1	-69.9	-91.9	0	112.9	A89 K90 A97 V98 F227	A89-K95 HydrophobicContact CB-CD 4.03Å; A89-K95 HydrophobicContact CB-CG 4.07Å; A89-K95 PolarHBondContact O-NZ 2.69Å; K90-K95 PolarHBondContact O-NZ 3.02Å; K95-A97 VanDerWaalsContact C-N 3.31Å; K95-A97 PolarHBondContact O-N 2.89Å; K95-V98 VanDerWaalsContact O-CB 3.23Å; K95-V98 WeakPolarHBondContact O-CB 3.41Å; K95-V98 PolarHBondContact O-N 2.77Å; K95-V98 VanDerWaalsContact O-N 3.09Å; K95-F227 HydrophobicContact CB-CD1 4.25Å; K95-F227 HydrophobicContact CD-CB 4.36Å
96	T	93	Very high	91.1	Very high	24 Å²	24	11.8 Å²	11.8	15%	0.147	7%	0.066	C	C	.	.	H	α-helix	trans	-59	-41.3	179.4	-52.2	0	0	0	0	112.6	G94 V98 F99 V100 I129 E132	G94-T96 VanDerWaalsContact C-N 3.25Å; G94-T96 PolarHBondContact O-N 3.04Å; T96-V98 PolarHBondContact O-N 2.84Å; T96-F99 VanDerWaalsContact CA-CE1 3.46Å; T96-F99 HydrophobicContact CG2-CE1 4.36Å; T96-F99 HydrophobicContact CG2-CE2 4.12Å; T96-F99 HydrophobicContact CG2-CZ 3.71Å; T96-V100 HydrophobicContact CG2-CG2 4.04Å; T96-V100 WeakPolarHBondContact O-CB 3.39Å; T96-V100 WeakPolarHBondContact O-CG2 3.17Å; T96-V100 PolarHBondContact O-N 3.22Å; T96-V100 VanDerWaalsContact O-N 3.09Å; T96-I129 HydrophobicContact CG2-CG1 3.89Å; T96-E132 HydrophobicContact CG2-CB 4.19Å; T96-E132 HydrophobicContact CG2-CG 3.81Å
97	A	93.5	Very high	91.1	Very high	9 Å²	9	12 Å²	12	7%	0.074	7%	0.067	C	C	.	.	H	α-helix	trans	-65.5	-27.4	179.2	0	0	0	0	0	112.4	G94 K95 L101 F136	G94-A97 PolarHBondContact O-N 2.9Å; G94-A97 VanDerWaalsContact O-N 3.13Å; K95-A97 VanDerWaalsContact C-N 3.31Å; K95-A97 PolarHBondContact O-N 2.89Å; A97-L101 WeakPolarHBondContact O-CB 3.27Å; A97-L101 WeakPolarHBondContact O-CG 3.27Å; A97-L101 PolarHBondContact O-N 3.1Å; A97-F136 HydrophobicContact CB-CE2 4.28Å; A97-F136 HydrophobicContact CB-CZ 4.32Å
98	V	96.1	Very high	91.2	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-56.8	-61.7	176.4	177.2	0	0	0	0	110.5	Q72 C75 I76 K95 T96 A102 F227	Q72-V98 HydrophobicContact CB-CG2 4.44Å; Q72-V98 HydrophobicContact CG-CG2 3.78Å; C75-V98 HydrophobicContact CB-CB 4.38Å; C75-V98 HydrophobicContact CB-CG1 3.29Å; C75-V98 HydrophobicContact CB-CG2 4.18Å; I76-V98 HydrophobicContact CG1-CB 4.47Å; I76-V98 HydrophobicContact CG1-CG1 4.21Å; I76-V98 HydrophobicContact CG1-CG2 4.45Å; K95-V98 VanDerWaalsContact O-CB 3.23Å; K95-V98 WeakPolarHBondContact O-CB 3.41Å; K95-V98 PolarHBondContact O-N 2.77Å; K95-V98 VanDerWaalsContact O-N 3.09Å; T96-V98 PolarHBondContact O-N 2.84Å; V98-A102 WeakPolarHBondContact O-CB 3.43Å; V98-A102 PolarHBondContact O-N 3.24Å; V98-F227 HydrophobicContact CB-CE1 4.11Å; V98-F227 HydrophobicContact CB-CZ 4.27Å; V98-F227 HydrophobicContact CG1-CE1 3.92Å; V98-F227 HydrophobicContact CG1-CZ 3.88Å
99	F	97.7	Very high	91.4	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-73.7	-30.4	-176.3	61	-104.8	0	0	0	112.2	T96 T103 V118 I129 Y133 I194 D196 M225 F227	T96-F99 VanDerWaalsContact CA-CE1 3.46Å; T96-F99 HydrophobicContact CG2-CE1 4.36Å; T96-F99 HydrophobicContact CG2-CE2 4.12Å; T96-F99 HydrophobicContact CG2-CZ 3.71Å; F99-T103 VanDerWaalsContact O-CB 3.3Å; F99-T103 WeakPolarHBondContact O-CB 3.21Å; F99-T103 VanDerWaalsContact O-CG2 3.25Å; F99-T103 WeakPolarHBondContact O-CG2 3.3Å; F99-T103 PolarHBondContact O-N 2.65Å; F99-T103 PolarHBondContact O-OG1 2.94Å; F99-V118 HydrophobicContact CE2-CG1 4Å; F99-V118 HydrophobicContact CZ-CG1 4.39Å; F99-I129 HydrophobicContact CE2-CG2 3.87Å; F99-I129 HydrophobicContact CZ-CD1 4.1Å; F99-I129 HydrophobicContact CZ-CG1 4.28Å; F99-I129 HydrophobicContact CZ-CG2 4.28Å; F99-Y133 HydrophobicContact CE2-CE2 4.5Å; F99-I194 HydrophobicContact CB-CD1 4.47Å; F99-I194 HydrophobicContact CB-CG2 3.9Å; F99-I194 HydrophobicContact CD1-CG2 4.03Å; F99-I194 HydrophobicContact CD2-CG2 3.93Å; F99-I194 HydrophobicContact CE1-CG2 4.44Å; F99-I194 HydrophobicContact CE2-CG2 4.41Å; F99-I194 HydrophobicContact CG-CG2 3.72Å; F99-D196 HydrophobicContact CE1-CB 4.13Å; F99-D196 HydrophobicContact CZ-CB 4.2Å; F99-M225 HydrophobicContact CB-CE 4.17Å; F99-M225 HydrophobicContact CB-SD 4.43Å; F99-F227 HydrophobicContact CB-CE2 3.71Å; F99-F227 HydrophobicContact CB-CZ 4.08Å; F99-F227 AromaticContact CD1-CD2 3.54Å; F99-F227 HydrophobicContact CD1-CD2 3.54Å; F99-F227 AromaticContact CD1-CE2 3.49Å; F99-F227 HydrophobicContact CD1-CE2 3.49Å; F99-F227 VanDerWaalsContact CD1-CE2 3.49Å; F99-F227 HydrophobicContact CD1-CG 4.17Å; F99-F227 HydrophobicContact CD1-CZ 4.08Å; F99-F227 HydrophobicContact CE1-CD2 4.1Å; F99-F227 HydrophobicContact CE1-CE2 4.47Å; F99-F227 HydrophobicContact CG-CD2 4.43Å; F99-F227 HydrophobicContact CG-CE2 4.03Å
100	V	98	Very high	92	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.7	-50.5	175.2	170.6	0	0	0	0	110.6	T96 T103 L104 E132 Y133 F136	T96-V100 HydrophobicContact CG2-CG2 4.04Å; T96-V100 WeakPolarHBondContact O-CB 3.39Å; T96-V100 WeakPolarHBondContact O-CG2 3.17Å; T96-V100 PolarHBondContact O-N 3.22Å; T96-V100 VanDerWaalsContact O-N 3.09Å; V100-T103 PolarHBondContact O-OG1 3.09Å; V100-L104 HydrophobicContact CG1-CD1 3.88Å; V100-L104 WeakPolarHBondContact O-CB 2.95Å; V100-L104 VanDerWaalsContact O-CG 3.26Å; V100-L104 WeakPolarHBondContact O-CG 3.39Å; V100-L104 PolarHBondContact O-N 2.81Å; V100-E132 HydrophobicContact CG2-CB 4.11Å; V100-Y133 HydrophobicContact CB-CD1 4.38Å; V100-Y133 HydrophobicContact CB-CE1 4.16Å; V100-Y133 HydrophobicContact CG1-CD1 3.72Å; V100-Y133 HydrophobicContact CG1-CE1 3.94Å; V100-Y133 HydrophobicContact CG1-CG 4.14Å; V100-Y133 HydrophobicContact CG2-CD1 4.28Å; V100-Y133 HydrophobicContact CG2-CD2 4.01Å; V100-Y133 HydrophobicContact CG2-CE1 4.1Å; V100-Y133 HydrophobicContact CG2-CE2 3.81Å; V100-Y133 HydrophobicContact CG2-CG 4.23Å; V100-F136 HydrophobicContact CB-CD2 4.48Å; V100-F136 HydrophobicContact CG1-CB 4.07Å; V100-F136 HydrophobicContact CG1-CD2 3.59Å; V100-F136 HydrophobicContact CG1-CE2 4.46Å; V100-F136 HydrophobicContact CG1-CG 4.2Å
101	L	97.8	Very high	92.8	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-67.2	-44.2	179.2	-67	175.7	0	0	0	111.5	F47 L56 I60 I76 A97 T103 L104 Q105 F136	F47-L101 HydrophobicContact CD1-CD1 4.18Å; F47-L101 HydrophobicContact CE1-CD1 3.95Å; L56-L101 HydrophobicContact CD2-CD2 4.3Å; I60-L101 HydrophobicContact CD1-CD1 3.93Å; I60-L101 HydrophobicContact CD1-CD2 3.82Å; I60-L101 HydrophobicContact CG1-CD1 4.36Å; I60-L101 HydrophobicContact CG1-CD2 3.93Å; I76-L101 HydrophobicContact CD1-CD1 4.09Å; A97-L101 WeakPolarHBondContact O-CB 3.27Å; A97-L101 WeakPolarHBondContact O-CG 3.27Å; A97-L101 PolarHBondContact O-N 3.1Å; L101-T103 PolarHBondContact O-N 3.09Å; L101-L104 PolarHBondContact O-N 2.81Å; L101-Q105 VanDerWaalsContact O-CB 3.25Å; L101-Q105 WeakPolarHBondContact O-CB 3.47Å; L101-Q105 PolarHBondContact O-N 3.43Å; L101-F136 HydrophobicContact CD2-CB 4.22Å; L101-F136 HydrophobicContact CD2-CD1 3.66Å; L101-F136 HydrophobicContact CD2-CD2 4.48Å; L101-F136 HydrophobicContact CD2-CE1 4.08Å; L101-F136 HydrophobicContact CD2-CG 3.87Å
102	A	98	Very high	93.8	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.3	-43.3	-179.8	0	0	0	0	0	112.5	A79 I80 V98 Q105 Q106 M225	A79-A102 HydrophobicContact CB-CB 3.57Å; I80-A102 HydrophobicContact CG2-CB 4.26Å; V98-A102 WeakPolarHBondContact O-CB 3.43Å; V98-A102 PolarHBondContact O-N 3.24Å; A102-Q105 PolarHBondContact O-N 3.42Å; A102-Q106 WeakPolarHBondContact O-CG 3.5Å; A102-Q106 PolarHBondContact O-N 3.46Å; A102-Q106 PolarHBondContact O-NE2 3.42Å; A102-M225 HydrophobicContact CB-CE 4.27Å
103	T	98.6	Very high	95.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-72.5	-39.6	179	54.7	0	0	0	0	112	F99 V100 L101 Q105 Q106 L107 V116 Y133 H192 I194 M225	F99-T103 VanDerWaalsContact O-CB 3.3Å; F99-T103 WeakPolarHBondContact O-CB 3.21Å; F99-T103 VanDerWaalsContact O-CG2 3.25Å; F99-T103 WeakPolarHBondContact O-CG2 3.3Å; F99-T103 PolarHBondContact O-N 2.65Å; F99-T103 PolarHBondContact O-OG1 2.94Å; V100-T103 PolarHBondContact O-OG1 3.09Å; L101-T103 PolarHBondContact O-N 3.09Å; T103-Q105 VanDerWaalsContact C-N 3.3Å; T103-Q105 PolarHBondContact O-N 3.29Å; T103-Q106 PolarHBondContact O-N 2.99Å; T103-L107 VanDerWaalsContact O-CB 3.28Å; T103-L107 WeakPolarHBondContact O-CB 3.31Å; T103-L107 PolarHBondContact O-N 2.91Å; T103-V116 HydrophobicContact CG2-CG1 4.03Å; T103-Y133 VanDerWaalsContact OG1-CE1 3.31Å; T103-Y133 WeakPolarHBondContact OG1-CE1 3.46Å; T103-Y133 PolarHBondContact OG1-OH 2.62Å; T103-H192 HydrophobicContact CG2-CB 3.86Å; T103-I194 HydrophobicContact CG2-CD1 4.02Å; T103-I194 HydrophobicContact CG2-CG1 4.26Å; T103-M225 HydrophobicContact CG2-CE 3.72Å
104	L	98.6	Very high	96.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.4	-35.3	173.8	-72.4	171.8	0	0	0	112.6	K53 L56 V100 L101 Q106 L107 Y133 F136 M140 V143 I168	K53-L104 PolarHBondContact NZ-O 3.29Å; L56-L104 HydrophobicContact CD1-CB 4.08Å; L56-L104 HydrophobicContact CD2-CB 3.74Å; L56-L104 HydrophobicContact CD2-CD1 3.78Å; L56-L104 HydrophobicContact CD2-CG 4.39Å; V100-L104 HydrophobicContact CG1-CD1 3.88Å; V100-L104 WeakPolarHBondContact O-CB 2.95Å; V100-L104 VanDerWaalsContact O-CG 3.26Å; V100-L104 WeakPolarHBondContact O-CG 3.39Å; V100-L104 PolarHBondContact O-N 2.81Å; L101-L104 PolarHBondContact O-N 2.81Å; L104-Q106 VanDerWaalsContact C-N 3.35Å; L104-L107 HydrophobicContact CD2-CD2 4.4Å; L104-L107 PolarHBondContact O-N 3.04Å; L104-Y133 HydrophobicContact CD1-CD1 4.13Å; L104-Y133 HydrophobicContact CD2-CD1 4.15Å; L104-Y133 HydrophobicContact CG-CD1 3.97Å; L104-Y133 HydrophobicContact CG-CE1 4.14Å; L104-F136 HydrophobicContact CD1-CB 3.68Å; L104-M140 HydrophobicContact CB-SD 4.39Å; L104-M140 HydrophobicContact CD2-SD 4.33Å; L104-V143 HydrophobicContact CD2-CG1 3.95Å; L104-I168 HydrophobicContact CD2-CD1 3.7Å
105	Q	98.3	Very high	96.9	Very high	41 Å²	41	30.2 Å²	30.2	19%	0.192	18%	0.175	C	C	.	.	H	α-helix	trans	-61.5	-45.1	175.4	177	61.5	11.1	0	0	111.1	L52 K53 L56 I80 L101 A102 T103	L52-Q105 HydrophobicContact CD2-CB 4.21Å; L52-Q105 HydrophobicContact CD2-CG 4.08Å; K53-Q105 WeakPolarHBondContact CE-O 3.38Å; K53-Q105 VanDerWaalsContact CG-OE1 3.28Å; K53-Q105 PolarHBondContact NZ-O 2.93Å; L56-Q105 HydrophobicContact CD1-CB 4.03Å; I80-Q105 HydrophobicContact CB-CG 4.2Å; I80-Q105 HydrophobicContact CG2-CB 4.13Å; I80-Q105 HydrophobicContact CG2-CG 3.92Å; L101-Q105 VanDerWaalsContact O-CB 3.25Å; L101-Q105 WeakPolarHBondContact O-CB 3.47Å; L101-Q105 PolarHBondContact O-N 3.43Å; A102-Q105 PolarHBondContact O-N 3.42Å; T103-Q105 VanDerWaalsContact C-N 3.3Å; T103-Q105 PolarHBondContact O-N 3.29Å
106	Q	98.2	Very high	97.2	Very high	44 Å²	44	29.3 Å²	29.3	21%	0.206	17%	0.171	C	C	.	.	H	α-helix	trans	-83.6	-12.8	-179.2	-65.6	172.9	74.7	0	0	114	A79 I80 A102 T103 L104 E108 H192	A79-Q106 PolarHBondContact O-NE2 3.05Å; I80-Q106 WeakPolarHBondContact O-CG 3.21Å; A102-Q106 WeakPolarHBondContact O-CG 3.5Å; A102-Q106 PolarHBondContact O-N 3.46Å; A102-Q106 PolarHBondContact O-NE2 3.42Å; T103-Q106 PolarHBondContact O-N 2.99Å; L104-Q106 VanDerWaalsContact C-N 3.35Å; Q106-E108 PolarHBondContact O-N 3.2Å; Q106-H192 PolarHBondContact OE1-NE2 3.29Å; Q106-H192 VanDerWaalsContact OE1-NE2 3.1Å
107	L	98.1	Very high	97.5	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.021	17%	0.165	C	C	.	.			trans	-65	129.4	-174.3	-174.9	66.8	0	0	0	111.6	K53 T103 L104 P109 V116 V143 H167 I168	K53-L107 PolarHBondContact NZ-O 2.89Å; T103-L107 VanDerWaalsContact O-CB 3.28Å; T103-L107 WeakPolarHBondContact O-CB 3.31Å; T103-L107 PolarHBondContact O-N 2.91Å; L104-L107 HydrophobicContact CD2-CD2 4.4Å; L104-L107 PolarHBondContact O-N 3.04Å; L107-P109 HydrophobicContact CD2-CG 4.06Å; L107-P109 HydrophobicContact CG-CG 4.02Å; L107-V116 HydrophobicContact CD1-CG2 4.06Å; L107-V143 HydrophobicContact CD2-CB 4.46Å; L107-V143 HydrophobicContact CD2-CG1 3.88Å; L107-V143 HydrophobicContact CD2-CG2 3.8Å; L107-H167 HydrophobicContact CD1-CB 4.43Å; L107-H167 HydrophobicContact CD2-CB 4.35Å; L107-I168 HydrophobicContact CD2-CD1 4.01Å; L107-I168 HydrophobicContact CD2-CG1 4.19Å
108	E	95.8	Very high	97.8	Very high	128 Å²	128	27.8 Å²	27.8	60%	0.598	16%	0.161	S	C	*	.			trans	-114.9	92.7	168.3	-65.4	173.8	156.5	0	0	107.8	Q106 V110 K191	Q106-E108 PolarHBondContact O-N 3.2Å; E108-V110 PolarHBondContact O-N 3.21Å; E108-K191 IonicContact OE2-NZ 2.87Å; E108-K191 PolarHBondContact OE2-NZ 2.83Å
109	P	96.4	Very high	97.9	Very high	56 Å²	56	27.8 Å²	27.8	36%	0.364	16%	0.161	S	C	.	.			trans	-63.7	118.7	-173.8	-23.1	33.7	0	0	0	112.3	L107 V143	L107-P109 HydrophobicContact CD2-CG 4.06Å; L107-P109 HydrophobicContact CG-CG 4.02Å; P109-V143 HydrophobicContact CG-CG2 4.06Å
110	V	97.9	Very high	97.8	Very high	65 Å²	65	27.8 Å²	27.8	39%	0.394	16%	0.161	S	C	.	.			trans	-111.9	116.4	170.8	-179.8	0	0	0	0	108.9	E108 G112 Q113 H167	E108-V110 PolarHBondContact O-N 3.21Å; V110-G112 PolarHBondContact O-N 3.1Å; V110-Q113 HydrophobicContact CB-CB 4.18Å; V110-Q113 HydrophobicContact CB-CG 4.34Å; V110-Q113 HydrophobicContact CG1-CB 4.31Å; V110-Q113 HydrophobicContact CG1-CG 3.93Å; V110-Q113 PolarHBondContact O-N 3.46Å; V110-H167 PolarHBondContact O-CD2 2.81Å; V110-H167 VanDerWaalsContact O-CD2 3.29Å; V110-H167 PolarHBondContact O-NE2 3.5Å
111	T	96.4	Very high	97.4	Very high	124 Å²	124	30.2 Å²	30.2	76%	0.761	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	125.1	-179.1	-60.4	0	0	0	0	111
112	G	95.8	Very high	96.8	Very high	47 Å²	47	30.5 Å²	30.5	49%	0.485	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.9	-3	178.5	0	0	0	0	0	114.8	V110 C165	V110-G112 PolarHBondContact O-N 3.1Å; G112-C165 PolarHBondContact O-SG 3.34Å
113	Q	98	Very high	96.4	Very high	64 Å²	64	34.5 Å²	34.5	30%	0.299	19%	0.189	S	C	.	.			trans	-117	134.2	-179.2	-62.6	-174.4	-2.7	0	0	111.8	V110 H189	V110-Q113 HydrophobicContact CB-CB 4.18Å; V110-Q113 HydrophobicContact CB-CG 4.34Å; V110-Q113 HydrophobicContact CG1-CB 4.31Å; V110-Q113 HydrophobicContact CG1-CG 3.93Å; V110-Q113 PolarHBondContact O-N 3.46Å; Q113-H189 HydrophobicContact CB-CB 4.33Å
114	V	98.7	Very high	95.7	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.012	19%	0.19	C	C	.	.			trans	-86.1	125.9	168.3	-172	0	0	0	0	108.1	V116 P166 V169 L185 H189 I190	V114-V116 WeakPolarHBondContact CG1-O 3.46Å; V114-P166 WeakPolarHBondContact CG2-O 3.34Å; V114-V169 HydrophobicContact CB-CG2 4.42Å; V114-V169 HydrophobicContact CG1-CB 4Å; V114-V169 HydrophobicContact CG1-CG2 3.58Å; V114-V169 HydrophobicContact CG2-CG2 3.87Å; V114-L185 HydrophobicContact CG2-CD1 3.78Å; V114-H189 CarbonylContact O-C 3.6Å; V114-I190 HydrophobicContact CB-CD1 4.17Å; V114-I190 HydrophobicContact CG1-CD1 3.62Å
115	S	98.6	Very high	95.2	Very high	7 Å²	7	34.6 Å²	34.6	5%	0.049	19%	0.19	C	C	.	.			trans	-113	-25	178.9	-55.9	0	0	0	0	113	H167 K191 H192	S115-H167 PolarHBondContact N-O 2.89Å; S115-K191 PolarHBondContact O-N 2.87Å; S115-H192 PolarHBondContact O-N 3.01Å; S115-H192 VanDerWaalsContact O-N 3.1Å
116	V	98.9	Very high	95	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	128.2	179.7	-175.8	0	0	0	0	109.2	T103 L107 V114 V118 H167 I168 V169 H192	T103-V116 HydrophobicContact CG2-CG1 4.03Å; L107-V116 HydrophobicContact CD1-CG2 4.06Å; V114-V116 WeakPolarHBondContact CG1-O 3.46Å; V116-V118 HydrophobicContact CG1-CG2 4.01Å; V116-H167 PolarHBondContact N-O 3Å; V116-H167 VanDerWaalsContact N-O 3.16Å; V116-I168 HydrophobicContact CB-CB 4.31Å; V116-I168 HydrophobicContact CB-CG1 4.01Å; V116-I168 HydrophobicContact CB-CG2 4.1Å; V116-I168 HydrophobicContact CG1-CG2 4.13Å; V116-I168 HydrophobicContact CG2-CG1 4.1Å; V116-V169 PolarHBondContact O-N 3.38Å; V116-H192 WeakPolarHBondContact CA-O 3.33Å; V116-H192 HydrophobicContact CB-CB 4.33Å; V116-H192 HydrophobicContact CG1-CB 4.09Å; V116-H192 HydrophobicContact CG2-CB 4.05Å
117	L	98.9	Very high	94.7	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.1	170.9	176.9	62.5	0	0	0	109.2	M119 V169 I176 L187 I190 H192 F193 I194 I214	L117-M119 HydrophobicContact CD1-CG 4.27Å; L117-M119 HydrophobicContact CD2-CE 4.46Å; L117-M119 HydrophobicContact CD2-SD 4.45Å; L117-M119 HydrophobicContact CG-CG 4.28Å; L117-V169 CarbonylContact C-O 3.57Å; L117-V169 WeakPolarHBondContact CA-O 3.21Å; L117-V169 HydrophobicContact CD1-CB 4.16Å; L117-V169 HydrophobicContact CD1-CG1 3.88Å; L117-I176 HydrophobicContact CD1-CD1 4.33Å; L117-I176 HydrophobicContact CD1-CG1 4.48Å; L117-I176 HydrophobicContact CD1-CG2 4.03Å; L117-I176 HydrophobicContact CD2-CG2 4.29Å; L117-L187 HydrophobicContact CD2-CD2 4.14Å; L117-I190 HydrophobicContact CB-CD1 3.75Å; L117-I190 HydrophobicContact CB-CG1 4.34Å; L117-I190 HydrophobicContact CB-CG2 4.48Å; L117-H192 PolarHBondContact N-O 3.07Å; L117-F193 HydrophobicContact CD2-CD2 4Å; L117-F193 HydrophobicContact CD2-CE2 3.84Å; L117-I194 PolarHBondContact O-N 2.92Å; L117-I214 HydrophobicContact CD2-CG2 3.63Å
118	V	98.8	Very high	94.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128	173	-173	0	0	0	0	109.5	F99 V116 I129 Y133 V169 V170 G171 I194	F99-V118 HydrophobicContact CE2-CG1 4Å; F99-V118 HydrophobicContact CZ-CG1 4.39Å; V116-V118 HydrophobicContact CG1-CG2 4.01Å; V118-I129 HydrophobicContact CG1-CD1 4.36Å; V118-I129 HydrophobicContact CG1-CG2 4.11Å; V118-Y133 HydrophobicContact CG2-CE2 3.79Å; V118-Y133 WeakPolarHBondContact CG2-OH 3.27Å; V118-V169 PolarHBondContact N-O 2.88Å; V118-V170 HydrophobicContact CB-CG1 4.3Å; V118-V170 HydrophobicContact CB-CG2 4.26Å; V118-V170 HydrophobicContact CG1-CG1 4.48Å; V118-V170 CarbonylContact O-C 3.58Å; V118-V170 VanDerWaalsContact O-CA 3.27Å; V118-V170 WeakPolarHBondContact O-CA 3.44Å; V118-G171 PolarHBondContact O-N 3.06Å; V118-I194 CarbonylContact C-O 3.32Å; V118-I194 WeakPolarHBondContact CA-O 3.34Å; V118-I194 HydrophobicContact CB-CB 4.26Å; V118-I194 HydrophobicContact CG1-CB 4.07Å; V118-I194 HydrophobicContact CG1-CG2 4.23Å; V118-I194 HydrophobicContact CG2-CB 3.92Å; V118-I194 HydrophobicContact CG2-CG1 3.94Å
119	M	98.3	Very high	94.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	147	173.9	-63.9	-172.8	-65.6	0	0	111.5	L117 G171 P173 I176 F193 I194 L195 D196 M201 V211 I214	L117-M119 HydrophobicContact CD1-CG 4.27Å; L117-M119 HydrophobicContact CD2-CE 4.46Å; L117-M119 HydrophobicContact CD2-SD 4.45Å; L117-M119 HydrophobicContact CG-CG 4.28Å; M119-G171 VanDerWaalsContact CA-O 3.28Å; M119-G171 WeakPolarHBondContact CA-O 3.16Å; M119-P173 HydrophobicContact SD-CG 4.44Å; M119-I176 HydrophobicContact CG-CG1 4.42Å; M119-I176 HydrophobicContact SD-CB 4.26Å; M119-I176 HydrophobicContact SD-CG1 4.43Å; M119-I176 HydrophobicContact SD-CG2 4.12Å; M119-F193 HydrophobicContact CE-CE1 4.05Å; M119-F193 HydrophobicContact CE-CE2 3.79Å; M119-F193 HydrophobicContact CE-CZ 3.27Å; M119-I194 PolarHBondContact N-O 3.01Å; M119-L195 HydrophobicContact CB-CD2 3.85Å; M119-L195 HydrophobicContact CE-CD2 3.64Å; M119-L195 WeakPolarHBondContact O-CA 3.45Å; M119-D196 PolarHBondContact O-N 3.21Å; M119-M201 HydrophobicContact CB-SD 4.23Å; M119-V211 HydrophobicContact CE-CG1 4.08Å; M119-V211 HydrophobicContact CE-CG2 4.32Å; M119-I214 HydrophobicContact CE-CB 4.38Å; M119-I214 HydrophobicContact CE-CD1 4.16Å; M119-I214 HydrophobicContact CE-CG2 4.03Å; M119-I214 HydrophobicContact SD-CD1 3.46Å; M119-I214 WeakPolarHBondContact SD-CD1 3.31Å; M119-I214 HydrophobicContact SD-CG2 4.11Å
120	C	94.9	Very high	94.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	166	174.4	63.5	0	0	0	0	110.9	T122 L125 A126 I129 G171 P173 D196 M201	C120-T122 PolarHBondContact SG-O 3.3Å; C120-L125 HydrophobicContact CB-CD2 3.75Å; C120-L125 HydrophobicContact CB-CG 4.01Å; C120-A126 WeakPolarHBondContact SG-CA 3.12Å; C120-A126 VanDerWaalsContact SG-CB 3.57Å; C120-A126 PolarHBondContact SG-N 3.31Å; C120-I129 HydrophobicContact CB-CD1 4.19Å; C120-G171 PolarHBondContact N-O 3.44Å; C120-G171 VanDerWaalsContact N-O 3.17Å; C120-P173 WeakPolarHBondContact O-CD 3.19Å; C120-D196 WeakPolarHBondContact CA-O 3.21Å; C120-D196 HydrophobicContact CB-CB 4.25Å; C120-D196 WeakPolarHBondContact CB-O 3.39Å; C120-M201 WeakPolarHBondContact CA-SD 3.24Å
121	H	89.9	Confident	94	Very high	51 Å²	51	23.8 Å²	23.8	24%	0.236	13%	0.129	C	C	.	.	S	Bend	trans	-70.1	-41.4	-173	-178.4	70	0	0	0	113.4	K200 M201 M207	H121-K200 HydrophobicContact CB-CB 4.29Å; H121-M201 HydrophobicContact CB-CG 4.04Å; H121-M207 WeakPolarHBondContact ND1-CE 3.13Å; H121-M207 PolarHBondContact ND1-SD 3.38Å; H121-M207 VanDerWaalsContact ND1-SD 3.41Å
122	T	86.7	Confident	93.9	Very high	7 Å²	7	18.3 Å²	18.3	4%	0.043	10%	0.095	C	C	.	.			trans	-106.8	149.2	-173	72.9	0	0	0	0	113.2	C120 E124 L125 A126	C120-T122 PolarHBondContact SG-O 3.3Å; T122-E124 VanDerWaalsContact C-N 3.32Å; T122-E124 PolarHBondContact O-N 2.94Å; T122-L125 PolarHBondContact O-N 3.36Å; T122-L125 WeakPolarHBondContact OG1-CB 3.23Å; T122-L125 PolarHBondContact OG1-N 3.09Å; T122-A126 PolarHBondContact O-N 3Å
123	R	88.8	Confident	94	Very high	83 Å²	83	16 Å²	16	31%	0.313	7%	0.072	S	C	.	.	H	α-helix	trans	-67.8	-36.1	-179.8	-51.9	-178.8	-179.7	163.3	0.3	111.7	A126 F127 F149 G150 T172 Q323	R123-A126 PolarHBondContact O-N 3.24Å; R123-F127 PolarHBondContact O-N 3.39Å; R123-F149 HydrophobicContact CB-CB 4.06Å; R123-F149 HydrophobicContact CB-CD1 4.18Å; R123-F149 HydrophobicContact CB-CD2 4.07Å; R123-F149 HydrophobicContact CB-CG 3.82Å; R123-F149 HydrophobicContact CG-CB 3.87Å; R123-F149 HydrophobicContact CG-CD2 4.34Å; R123-F149 HydrophobicContact CG-CG 4.12Å; R123-G150 WeakPolarHBondContact CD-O 3.25Å; R123-G150 VanDerWaalsContact CZ-C 3.5Å; R123-G150 PolarHBondContact NE-O 3.26Å; R123-G150 PolarHBondContact NH1-O 3.14Å; R123-T172 HydrophobicContact CG-CG2 4Å; R123-Q323 VanDerWaalsContact CD-CD 3.49Å
124	E	84.3	Confident	94	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-68	-41.7	178.7	-69.5	65.1	-145.3	0	0	111.3	T122 F127 Q128 Q323 R326 F347 M351	T122-E124 VanDerWaalsContact C-N 3.32Å; T122-E124 PolarHBondContact O-N 2.94Å; E124-F127 PolarHBondContact O-N 3.08Å; E124-Q128 WeakPolarHBondContact O-CB 3.25Å; E124-Q128 PolarHBondContact O-N 3.09Å; E124-Q323 PolarHBondContact OE1-NE2 3.4Å; E124-R326 IonicContact OE1-CZ 3.24Å; E124-R326 IonicContact OE1-NE 2.85Å; E124-R326 PolarHBondContact OE1-NE 2.98Å; E124-R326 IonicContact OE1-NH1 2.83Å; E124-R326 PolarHBondContact OE1-NH1 3.49Å; E124-R326 IonicContact OE1-NH2 3.47Å; E124-R326 PolarHBondContact OE1-NH2 3.2Å; E124-R326 IonicContact OE2-CZ 3.28Å; E124-R326 IonicContact OE2-NH1 3.8Å; E124-R326 IonicContact OE2-NH2 3.81Å; E124-R326 PolarHBondContact OE2-NH2 3.48Å; E124-F347 HydrophobicContact CG-CZ 4.34Å; E124-M351 HydrophobicContact CB-CG 4.31Å; E124-M351 HydrophobicContact CB-SD 4.09Å; E124-M351 HydrophobicContact CG-SD 4.43Å
125	L	88.5	Confident	93.8	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-63.8	-43.3	172.3	178.5	53.8	0	0	0	111.2	C120 T122 F127 Q128 I129 E197	C120-L125 HydrophobicContact CB-CD2 3.75Å; C120-L125 HydrophobicContact CB-CG 4.01Å; T122-L125 PolarHBondContact O-N 3.36Å; T122-L125 WeakPolarHBondContact OG1-CB 3.23Å; T122-L125 PolarHBondContact OG1-N 3.09Å; L125-F127 VanDerWaalsContact C-N 3.31Å; L125-F127 PolarHBondContact O-N 3.17Å; L125-Q128 WeakPolarHBondContact O-CB 3.31Å; L125-Q128 PolarHBondContact O-N 2.67Å; L125-Q128 VanDerWaalsContact O-N 3.13Å; L125-I129 HydrophobicContact CD1-CD1 3.79Å; L125-I129 HydrophobicContact CD1-CG1 3.83Å; L125-I129 HydrophobicContact CD2-CD1 4.47Å; L125-I129 HydrophobicContact CG-CD1 3.75Å; L125-I129 HydrophobicContact CG-CG1 4.27Å; L125-I129 WeakPolarHBondContact O-CG1 3.17Å; L125-I129 PolarHBondContact O-N 2.78Å; L125-E197 HydrophobicContact CD2-CG 3.79Å
126	A	93.5	Very high	93.7	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-58	-45.2	176.4	0	0	0	0	0	111.7	C120 T122 R123 I129 S130 V147 F149 V170	C120-A126 WeakPolarHBondContact SG-CA 3.12Å; C120-A126 VanDerWaalsContact SG-CB 3.57Å; C120-A126 PolarHBondContact SG-N 3.31Å; T122-A126 PolarHBondContact O-N 3Å; R123-A126 PolarHBondContact O-N 3.24Å; A126-I129 PolarHBondContact O-N 3.16Å; A126-S130 PolarHBondContact O-N 3.46Å; A126-V147 HydrophobicContact CB-CG2 3.86Å; A126-F149 HydrophobicContact CB-CD1 4.14Å; A126-V170 HydrophobicContact CB-CG1 4.14Å; A126-V170 WeakPolarHBondContact O-CG1 3.43Å
127	F	91.3	Very high	93.7	Very high	39 Å²	39	21.2 Å²	21.2	17%	0.171	9%	0.093	C	C	.	.	H	α-helix	trans	-60.8	-45.8	175.5	-178.2	-98.7	0	0	0	111.3	R123 E124 L125 S130 K131 V147 F149 L327	R123-F127 PolarHBondContact O-N 3.39Å; E124-F127 PolarHBondContact O-N 3.08Å; L125-F127 VanDerWaalsContact C-N 3.31Å; L125-F127 PolarHBondContact O-N 3.17Å; F127-S130 PolarHBondContact O-N 3.08Å; F127-S130 PolarHBondContact O-OG 3.04Å; F127-K131 HydrophobicContact CD1-CG 4.45Å; F127-K131 HydrophobicContact CE1-CG 4.09Å; F127-K131 HydrophobicContact CZ-CG 4.28Å; F127-K131 PolarHBondContact O-N 3.25Å; F127-K131 VanDerWaalsContact O-N 3.1Å; F127-V147 HydrophobicContact CD2-CG1 4.43Å; F127-F149 HydrophobicContact CB-CE1 4.19Å; F127-L327 HydrophobicContact CB-CD2 3.99Å; F127-L327 HydrophobicContact CD1-CD2 4.12Å; F127-L327 HydrophobicContact CD2-CD1 4.48Å; F127-L327 HydrophobicContact CD2-CD2 4.23Å; F127-L327 HydrophobicContact CG-CD2 3.85Å
128	Q	89.2	Confident	93.6	Very high	5 Å²	5	27 Å²	27	2%	0.023	12%	0.118	C	C	.	.	H	α-helix	trans	-60.7	-49.2	177.4	-178.8	-178.7	-57.3	0	0	112.3	E124 L125 S130 K131 E132 Y330 G350 M351 D352	E124-Q128 WeakPolarHBondContact O-CB 3.25Å; E124-Q128 PolarHBondContact O-N 3.09Å; L125-Q128 WeakPolarHBondContact O-CB 3.31Å; L125-Q128 PolarHBondContact O-N 2.67Å; L125-Q128 VanDerWaalsContact O-N 3.13Å; Q128-S130 VanDerWaalsContact C-N 3.26Å; Q128-S130 PolarHBondContact O-N 3.3Å; Q128-K131 CarbonylContact O-C 3.59Å; Q128-K131 WeakPolarHBondContact O-CA 3.28Å; Q128-K131 WeakPolarHBondContact O-CB 3.3Å; Q128-K131 PolarHBondContact O-N 3.29Å; Q128-E132 PolarHBondContact O-N 2.62Å; Q128-Y330 PolarHBondContact OE1-OH 3.5Å; Q128-G350 PolarHBondContact NE2-O 2.83Å; Q128-G350 PolarHBondContact OE1-O 2.85Å; Q128-M351 VanDerWaalsContact OE1-CA 3.25Å; Q128-D352 HydrophobicContact CG-CB 4.5Å
129	I	95.1	Very high	93.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-57.1	-41.4	177.3	-68.6	167.7	0	0	0	110.4	T96 F99 V118 C120 L125 A126 K131 E132 Y133 V170 D196	T96-I129 HydrophobicContact CG2-CG1 3.89Å; F99-I129 HydrophobicContact CE2-CG2 3.87Å; F99-I129 HydrophobicContact CZ-CD1 4.1Å; F99-I129 HydrophobicContact CZ-CG1 4.28Å; F99-I129 HydrophobicContact CZ-CG2 4.28Å; V118-I129 HydrophobicContact CG1-CD1 4.36Å; V118-I129 HydrophobicContact CG1-CG2 4.11Å; C120-I129 HydrophobicContact CB-CD1 4.19Å; L125-I129 HydrophobicContact CD1-CD1 3.79Å; L125-I129 HydrophobicContact CD1-CG1 3.83Å; L125-I129 HydrophobicContact CD2-CD1 4.47Å; L125-I129 HydrophobicContact CG-CD1 3.75Å; L125-I129 HydrophobicContact CG-CG1 4.27Å; L125-I129 WeakPolarHBondContact O-CG1 3.17Å; L125-I129 PolarHBondContact O-N 2.78Å; A126-I129 PolarHBondContact O-N 3.16Å; I129-K131 VanDerWaalsContact C-N 3.29Å; I129-K131 PolarHBondContact O-N 3.44Å; I129-E132 WeakPolarHBondContact O-CB 3.26Å; I129-E132 PolarHBondContact O-N 3.26Å; I129-E132 VanDerWaalsContact O-N 3.17Å; I129-Y133 HydrophobicContact CG2-CD2 3.95Å; I129-Y133 HydrophobicContact CG2-CE2 3.85Å; I129-Y133 WeakPolarHBondContact O-CD2 3.38Å; I129-Y133 PolarHBondContact O-N 3.39Å; I129-V170 HydrophobicContact CB-CG1 3.94Å; I129-V170 HydrophobicContact CG2-CG1 3.79Å; I129-V170 HydrophobicContact CG2-CG2 4.04Å; I129-D196 HydrophobicContact CD1-CB 4.12Å
130	S	96.1	Very high	93.6	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.021	13%	0.134	C	C	.	.	H	α-helix	trans	-62.7	-35.6	175.9	72.3	0	0	0	0	113.1	A126 F127 Q128 Y133 E134	A126-S130 PolarHBondContact O-N 3.46Å; F127-S130 PolarHBondContact O-N 3.08Å; F127-S130 PolarHBondContact O-OG 3.04Å; Q128-S130 VanDerWaalsContact C-N 3.26Å; Q128-S130 PolarHBondContact O-N 3.3Å; S130-Y133 PolarHBondContact O-N 2.88Å; S130-E134 WeakPolarHBondContact O-CG 3.21Å; S130-E134 PolarHBondContact O-N 3.21Å
131	K	93.4	Very high	93.6	Very high	64 Å²	64	36.4 Å²	36.4	28%	0.278	17%	0.171	S	C	.	.	H	α-helix	trans	-70.2	-35.2	174.2	-65.9	-47.2	-174.6	-171.9	0	111.9	F127 Q128 I129 Y133 E134 R135	F127-K131 HydrophobicContact CD1-CG 4.45Å; F127-K131 HydrophobicContact CE1-CG 4.09Å; F127-K131 HydrophobicContact CZ-CG 4.28Å; F127-K131 PolarHBondContact O-N 3.25Å; F127-K131 VanDerWaalsContact O-N 3.1Å; Q128-K131 CarbonylContact O-C 3.59Å; Q128-K131 WeakPolarHBondContact O-CA 3.28Å; Q128-K131 WeakPolarHBondContact O-CB 3.3Å; Q128-K131 PolarHBondContact O-N 3.29Å; I129-K131 VanDerWaalsContact C-N 3.29Å; I129-K131 PolarHBondContact O-N 3.44Å; K131-Y133 VanDerWaalsContact C-N 3.34Å; K131-Y133 PolarHBondContact O-N 3.22Å; K131-E134 WeakPolarHBondContact CD-OE2 3.37Å; K131-E134 IonicContact NZ-OE1 3.6Å; K131-E134 PolarHBondContact NZ-OE1 2.88Å; K131-E134 IonicContact NZ-OE2 3.86Å; K131-E134 PolarHBondContact NZ-OE2 2.9Å; K131-E134 PolarHBondContact O-N 3.29Å; K131-R135 VanDerWaalsContact O-CG 3.31Å; K131-R135 WeakPolarHBondContact O-CG 3.5Å; K131-R135 PolarHBondContact O-N 3.32Å
132	E	94.7	Very high	93.9	Very high	9 Å²	9	39.9 Å²	39.9	4%	0.042	19%	0.191	C	C	.	.	H	α-helix	trans	-58.2	-47.8	170.7	-65.8	-50.7	119.3	0	0	111.6	T96 V100 Q128 I129 E134 R135 F136	T96-E132 HydrophobicContact CG2-CB 4.19Å; T96-E132 HydrophobicContact CG2-CG 3.81Å; V100-E132 HydrophobicContact CG2-CB 4.11Å; Q128-E132 PolarHBondContact O-N 2.62Å; I129-E132 WeakPolarHBondContact O-CB 3.26Å; I129-E132 PolarHBondContact O-N 3.26Å; I129-E132 VanDerWaalsContact O-N 3.17Å; E132-E134 PolarHBondContact O-N 3.1Å; E132-R135 PolarHBondContact O-N 3.46Å; E132-R135 IonicContact OE1-CZ 3.69Å; E132-R135 IonicContact OE1-NE 2.83Å; E132-R135 PolarHBondContact OE1-NE 3.28Å; E132-R135 IonicContact OE1-NH2 3.87Å; E132-R135 PolarHBondContact OE1-NH2 2.67Å; E132-R135 IonicContact OE2-CZ 3.27Å; E132-R135 IonicContact OE2-NE 2.72Å; E132-R135 PolarHBondContact OE2-NE 2.61Å; E132-R135 IonicContact OE2-NH2 2.67Å; E132-R135 PolarHBondContact OE2-NH2 2.75Å; E132-F136 VanDerWaalsContact O-CD2 3.22Å; E132-F136 WeakPolarHBondContact O-CD2 3.1Å; E132-F136 PolarHBondContact O-N 3.1Å; E132-F136 WeakPolarHBondContact OE2-CE2 3.47Å
133	Y	98.2	Very high	94.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.5	-47.8	174.3	-84.6	-70	0	0	0	112.1	F99 V100 T103 L104 V118 I129 S130 K131 R135 F136 S137 V145 I168 V170	F99-Y133 HydrophobicContact CE2-CE2 4.5Å; V100-Y133 HydrophobicContact CB-CD1 4.38Å; V100-Y133 HydrophobicContact CB-CE1 4.16Å; V100-Y133 HydrophobicContact CG1-CD1 3.72Å; V100-Y133 HydrophobicContact CG1-CE1 3.94Å; V100-Y133 HydrophobicContact CG1-CG 4.14Å; V100-Y133 HydrophobicContact CG2-CD1 4.28Å; V100-Y133 HydrophobicContact CG2-CD2 4.01Å; V100-Y133 HydrophobicContact CG2-CE1 4.1Å; V100-Y133 HydrophobicContact CG2-CE2 3.81Å; V100-Y133 HydrophobicContact CG2-CG 4.23Å; T103-Y133 VanDerWaalsContact OG1-CE1 3.31Å; T103-Y133 WeakPolarHBondContact OG1-CE1 3.46Å; T103-Y133 PolarHBondContact OG1-OH 2.62Å; L104-Y133 HydrophobicContact CD1-CD1 4.13Å; L104-Y133 HydrophobicContact CD2-CD1 4.15Å; L104-Y133 HydrophobicContact CG-CD1 3.97Å; L104-Y133 HydrophobicContact CG-CE1 4.14Å; V118-Y133 HydrophobicContact CG2-CE2 3.79Å; V118-Y133 WeakPolarHBondContact CG2-OH 3.27Å; I129-Y133 HydrophobicContact CG2-CD2 3.95Å; I129-Y133 HydrophobicContact CG2-CE2 3.85Å; I129-Y133 WeakPolarHBondContact O-CD2 3.38Å; I129-Y133 PolarHBondContact O-N 3.39Å; S130-Y133 PolarHBondContact O-N 2.88Å; K131-Y133 VanDerWaalsContact C-N 3.34Å; K131-Y133 PolarHBondContact O-N 3.22Å; Y133-R135 VanDerWaalsContact C-N 3.32Å; Y133-R135 PolarHBondContact O-N 3.08Å; Y133-F136 PolarHBondContact O-N 3.11Å; Y133-S137 WeakPolarHBondContact O-CB 3.43Å; Y133-S137 PolarHBondContact O-N 2.85Å; Y133-S137 PolarHBondContact O-OG 3.03Å; Y133-V145 HydrophobicContact CG-CG1 4.48Å; Y133-V145 HydrophobicContact CG-CG2 4.5Å; Y133-I168 HydrophobicContact CD1-CD1 3.58Å; Y133-I168 HydrophobicContact CD1-CG2 4.2Å; Y133-I168 HydrophobicContact CD2-CG2 4.02Å; Y133-I168 HydrophobicContact CE1-CD1 3.76Å; Y133-I168 HydrophobicContact CE1-CG2 4.07Å; Y133-I168 HydrophobicContact CE2-CG2 3.89Å; Y133-I168 HydrophobicContact CG-CD1 4.32Å; Y133-I168 HydrophobicContact CG-CG2 4.18Å; Y133-V170 HydrophobicContact CD2-CG2 3.94Å; Y133-V170 HydrophobicContact CE2-CG2 4.08Å
134	E	97	Very high	94.9	Very high	89 Å²	89	40 Å²	40	42%	0.416	19%	0.194	S	C	.	.	H	α-helix	trans	-58.6	-41.1	176.9	-72.1	175.2	-162.3	0	0	112.5	S130 K131 E132 K138	S130-E134 WeakPolarHBondContact O-CG 3.21Å; S130-E134 PolarHBondContact O-N 3.21Å; K131-E134 WeakPolarHBondContact CD-OE2 3.37Å; K131-E134 IonicContact NZ-OE1 3.6Å; K131-E134 PolarHBondContact NZ-OE1 2.88Å; K131-E134 IonicContact NZ-OE2 3.86Å; K131-E134 PolarHBondContact NZ-OE2 2.9Å; K131-E134 PolarHBondContact O-N 3.29Å; E132-E134 PolarHBondContact O-N 3.1Å; E134-K138 PolarHBondContact O-N 3.08Å
135	R	94.8	Very high	95.6	Very high	78 Å²	78	41.3 Å²	41.3	29%	0.294	20%	0.203	S	C	.	.	H	α-helix	trans	-63.7	-51.2	178.1	-71.1	-164.7	-56.7	177.8	12	111.4	K131 E132 Y133 S137 K138	K131-R135 VanDerWaalsContact O-CG 3.31Å; K131-R135 WeakPolarHBondContact O-CG 3.5Å; K131-R135 PolarHBondContact O-N 3.32Å; E132-R135 PolarHBondContact O-N 3.46Å; E132-R135 IonicContact OE1-CZ 3.69Å; E132-R135 IonicContact OE1-NE 2.83Å; E132-R135 PolarHBondContact OE1-NE 3.28Å; E132-R135 IonicContact OE1-NH2 3.87Å; E132-R135 PolarHBondContact OE1-NH2 2.67Å; E132-R135 IonicContact OE2-CZ 3.27Å; E132-R135 IonicContact OE2-NE 2.72Å; E132-R135 PolarHBondContact OE2-NE 2.61Å; E132-R135 IonicContact OE2-NH2 2.67Å; E132-R135 PolarHBondContact OE2-NH2 2.75Å; Y133-R135 VanDerWaalsContact C-N 3.32Å; Y133-R135 PolarHBondContact O-N 3.08Å; R135-S137 VanDerWaalsContact C-N 3.35Å; R135-K138 VanDerWaalsContact O-CB 3.24Å; R135-K138 WeakPolarHBondContact O-CB 3.17Å; R135-K138 PolarHBondContact O-N 3.13Å
136	F	97.3	Very high	96.1	Very high	1 Å²	1	42 Å²	42	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-74.6	-24.9	-178.3	-70.1	-64.5	0	0	0	113	A59 I60 F65 A97 V100 L101 L104 E132 Y133 K138	A59-F136 VanDerWaalsContact CB-O 3.27Å; A59-F136 WeakPolarHBondContact CB-O 3.35Å; I60-F136 HydrophobicContact CG1-CD1 3.97Å; I60-F136 HydrophobicContact CG1-CE1 3.81Å; F65-F136 HydrophobicContact CD2-CE1 4.07Å; F65-F136 AromaticContact CD2-CZ 3.98Å; F65-F136 HydrophobicContact CD2-CZ 3.98Å; F65-F136 HydrophobicContact CE2-CE1 4.09Å; F65-F136 AromaticContact CE2-CZ 3.59Å; F65-F136 HydrophobicContact CE2-CZ 3.59Å; A97-F136 HydrophobicContact CB-CE2 4.28Å; A97-F136 HydrophobicContact CB-CZ 4.32Å; V100-F136 HydrophobicContact CB-CD2 4.48Å; V100-F136 HydrophobicContact CG1-CB 4.07Å; V100-F136 HydrophobicContact CG1-CD2 3.59Å; V100-F136 HydrophobicContact CG1-CE2 4.46Å; V100-F136 HydrophobicContact CG1-CG 4.2Å; L101-F136 HydrophobicContact CD2-CB 4.22Å; L101-F136 HydrophobicContact CD2-CD1 3.66Å; L101-F136 HydrophobicContact CD2-CD2 4.48Å; L101-F136 HydrophobicContact CD2-CE1 4.08Å; L101-F136 HydrophobicContact CD2-CG 3.87Å; L104-F136 HydrophobicContact CD1-CB 3.68Å; E132-F136 VanDerWaalsContact O-CD2 3.22Å; E132-F136 WeakPolarHBondContact O-CD2 3.1Å; E132-F136 PolarHBondContact O-N 3.1Å; E132-F136 WeakPolarHBondContact OE2-CE2 3.47Å; Y133-F136 PolarHBondContact O-N 3.11Å; F136-K138 VanDerWaalsContact C-N 3.31Å; F136-K138 PolarHBondContact O-N 2.69Å
137	S	97.8	Very high	96.3	Very high	14 Å²	14	43.7 Å²	43.7	10%	0.098	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	10.2	174.2	80.3	0	0	0	0	113.8	Y133 R135 Y139 M140	Y133-S137 WeakPolarHBondContact O-CB 3.43Å; Y133-S137 PolarHBondContact O-N 2.85Å; Y133-S137 PolarHBondContact O-OG 3.03Å; R135-S137 VanDerWaalsContact C-N 3.35Å; S137-Y139 PolarHBondContact O-N 2.83Å; S137-M140 PolarHBondContact O-N 2.91Å
138	K	97.7	Very high	96.6	Very high	122 Å²	122	42 Å²	42	53%	0.53	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-36.9	-178.5	178.9	-179.3	-178.5	-173	0	113.6	D62 E134 R135 F136	D62-K138 IonicContact OD2-NZ 3.39Å; D62-K138 PolarHBondContact OD2-NZ 2.84Å; E134-K138 PolarHBondContact O-N 3.08Å; R135-K138 VanDerWaalsContact O-CB 3.24Å; R135-K138 WeakPolarHBondContact O-CB 3.17Å; R135-K138 PolarHBondContact O-N 3.13Å; F136-K138 VanDerWaalsContact C-N 3.31Å; F136-K138 PolarHBondContact O-N 2.69Å
139	Y	98.1	Very high	96.9	Very high	58 Å²	58	42.3 Å²	42.3	23%	0.227	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	13.1	-179.1	-64.1	-65.8	0	0	0	113.9	R58 A59 D62 S137 P141	R58-Y139 HydrophobicContact CB-CD2 3.89Å; R58-Y139 HydrophobicContact CB-CE2 4.08Å; R58-Y139 HydrophobicContact CG-CD2 3.75Å; R58-Y139 HydrophobicContact CG-CE2 3.47Å; R58-Y139 VanDerWaalsContact CG-CE2 3.47Å; R58-Y139 HydrophobicContact CG-CG 4.49Å; R58-Y139 VanDerWaalsContact CZ-CE1 3.48Å; R58-Y139 PolarHBondContact NE-OH 2.75Å; A59-Y139 HydrophobicContact CB-CD2 4.12Å; D62-Y139 WeakPolarHBondContact OD2-CE2 3.36Å; D62-Y139 PolarHBondContact OD2-OH 2.88Å; S137-Y139 PolarHBondContact O-N 2.83Å; Y139-P141 VanDerWaalsContact O-CD 3.31Å; Y139-P141 WeakPolarHBondContact O-CD 3.46Å
140	M	97.9	Very high	96.7	Very high	23 Å²	23	43 Å²	43	11%	0.113	22%	0.22	C	C	.	.			trans	-117.4	73	177.8	-56.1	-179.2	78.1	0	0	109.5	K53 E55 L56 L104 S137 N142 V143	K53-M140 HydrophobicContact CD-CE 4.08Å; E55-M140 HydrophobicContact CB-CG 4Å; L56-M140 HydrophobicContact CD2-SD 3.95Å; L56-M140 HydrophobicContact CG-SD 4.2Å; L104-M140 HydrophobicContact CB-SD 4.39Å; L104-M140 HydrophobicContact CD2-SD 4.33Å; S137-M140 PolarHBondContact O-N 2.91Å; M140-N142 PolarHBondContact O-N 3.35Å; M140-V143 HydrophobicContact CB-CB 4.19Å; M140-V143 HydrophobicContact CB-CG2 3.59Å; M140-V143 HydrophobicContact CE-CG2 4.07Å; M140-V143 WeakPolarHBondContact O-CB 3.09Å; M140-V143 PolarHBondContact O-N 3.49Å; M140-V143 HydrophobicContact SD-CG2 4.33Å
141	P	96.1	Very high	96.3	Very high	117 Å²	117	45.5 Å²	45.5	76%	0.76	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-20	-166	24.7	-36.1	0	0	0	114.9	Y139	Y139-P141 VanDerWaalsContact O-CD 3.31Å; Y139-P141 WeakPolarHBondContact O-CD 3.46Å
142	N	96.2	Very high	96.1	Very high	123 Å²	123	45.4 Å²	45.4	66%	0.658	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-13.2	176.8	-63.8	-27.1	0	0	0	112.7	M140 H167	M140-N142 PolarHBondContact O-N 3.35Å; N142-H167 PolarHBondContact O-CE1 2.96Å; N142-H167 PolarHBondContact O-ND1 3.25Å; N142-H167 VanDerWaalsContact O-ND1 3.1Å
143	V	98.2	Very high	96	Very high	17 Å²	17	48.1 Å²	48.1	10%	0.103	27%	0.268	C	S	.	.			trans	-76.4	135	178.9	179.1	0	0	0	0	109.2	L104 L107 P109 M140 V145 I168	L104-V143 HydrophobicContact CD2-CG1 3.95Å; L107-V143 HydrophobicContact CD2-CB 4.46Å; L107-V143 HydrophobicContact CD2-CG1 3.88Å; L107-V143 HydrophobicContact CD2-CG2 3.8Å; P109-V143 HydrophobicContact CG-CG2 4.06Å; M140-V143 HydrophobicContact CB-CB 4.19Å; M140-V143 HydrophobicContact CB-CG2 3.59Å; M140-V143 HydrophobicContact CE-CG2 4.07Å; M140-V143 WeakPolarHBondContact O-CB 3.09Å; M140-V143 PolarHBondContact O-N 3.49Å; M140-V143 HydrophobicContact SD-CG2 4.33Å; V143-V145 HydrophobicContact CG1-CG2 4.39Å; V143-I168 HydrophobicContact CG1-CD1 3.79Å
144	K	98.2	Very high	95.9	Very high	75 Å²	75	50.6 Å²	50.6	33%	0.326	28%	0.28	S	S	.	.			trans	-129.6	131	-177.9	-67.5	179.9	-176.4	177.2	0	107.8	N164 P166 H167 I168	K144-N164 WeakPolarHBondContact CD-OD1 3.31Å; K144-N164 WeakPolarHBondContact CE-OD1 3.32Å; K144-N164 PolarHBondContact NZ-OD1 3.37Å; K144-P166 HydrophobicContact CB-CB 4.24Å; K144-P166 WeakPolarHBondContact O-CB 3.46Å; K144-H167 PolarHBondContact N-ND1 3.26Å; K144-H167 PolarHBondContact O-N 3.4Å; K144-I168 PolarHBondContact O-N 2.74Å
145	V	98.5	Very high	96	Very high	30 Å²	30	53.1 Å²	53.1	18%	0.182	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.8	-177.3	-172.5	0	0	0	0	107.4	Y133 V143 I168 V170	Y133-V145 HydrophobicContact CG-CG1 4.48Å; Y133-V145 HydrophobicContact CG-CG2 4.5Å; V143-V145 HydrophobicContact CG1-CG2 4.39Å; V145-I168 WeakPolarHBondContact CA-O 3.28Å; V145-I168 HydrophobicContact CG1-CB 4.37Å; V145-I168 HydrophobicContact CG1-CG2 4.26Å; V145-I168 HydrophobicContact CG2-CB 4.23Å; V145-I168 HydrophobicContact CG2-CD1 4.16Å; V145-V170 HydrophobicContact CG1-CG2 4.39Å
146	A	98.2	Very high	96	Very high	15 Å²	15	55.8 Å²	55.8	12%	0.124	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	153.5	167.1	0	0	0	0	0	110.6	F148 V160 P166 I168 V170	A146-F148 HydrophobicContact CB-CE1 3.91Å; A146-F148 HydrophobicContact CB-CE2 4.11Å; A146-F148 HydrophobicContact CB-CZ 3.53Å; A146-V160 HydrophobicContact CB-CG1 4.39Å; A146-P166 HydrophobicContact CB-CB 3.95Å; A146-P166 HydrophobicContact CB-CG 3.71Å; A146-I168 PolarHBondContact N-O 3.11Å; A146-V170 PolarHBondContact O-N 3.17Å
147	V	97.9	Very high	96	Very high	36 Å²	36	56.4 Å²	56.4	22%	0.218	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	132.2	176.9	65.2	0	0	0	0	110.9	A126 F127 F149 V170	A126-V147 HydrophobicContact CB-CG2 3.86Å; F127-V147 HydrophobicContact CD2-CG1 4.43Å; V147-F149 HydrophobicContact CB-CE1 4.44Å; V147-F149 HydrophobicContact CG1-CE1 4.03Å; V147-F149 HydrophobicContact CG2-CD1 3.67Å; V147-F149 HydrophobicContact CG2-CE1 3.6Å; V147-V170 CarbonylContact C-O 3.58Å; V147-V170 WeakPolarHBondContact CA-O 3.41Å; V147-V170 HydrophobicContact CG2-CB 4.29Å; V147-V170 HydrophobicContact CG2-CG1 4.48Å
148	F	97.9	Very high	96	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.018	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	121.7	-178.7	-51	-53.9	0	0	0	111.9	A146 D157 V160 L161 V169 V170 G171 T172 R175 I176 L179	A146-F148 HydrophobicContact CB-CE1 3.91Å; A146-F148 HydrophobicContact CB-CE2 4.11Å; A146-F148 HydrophobicContact CB-CZ 3.53Å; F148-D157 HydrophobicContact CD1-CB 3.67Å; F148-D157 VanDerWaalsContact CD1-CG 3.44Å; F148-D157 HydrophobicContact CE1-CB 3.87Å; F148-D157 HydrophobicContact CG-CB 4.39Å; F148-V160 HydrophobicContact CE1-CG1 4.37Å; F148-V160 HydrophobicContact CZ-CG1 4.31Å; F148-L161 HydrophobicContact CE2-CD1 4.31Å; F148-L161 HydrophobicContact CE2-CD2 3.86Å; F148-L161 HydrophobicContact CE2-CG 4.17Å; F148-L161 HydrophobicContact CZ-CD1 4.36Å; F148-L161 HydrophobicContact CZ-CD2 3.91Å; F148-L161 HydrophobicContact CZ-CG 3.91Å; F148-V169 HydrophobicContact CD2-CG1 3.62Å; F148-V169 HydrophobicContact CE2-CG1 3.83Å; F148-V169 HydrophobicContact CE2-CG2 3.95Å; F148-V170 PolarHBondContact N-O 3.15Å; F148-G171 WeakPolarHBondContact O-CA 3.48Å; F148-T172 PolarHBondContact O-N 3.05Å; F148-T172 VanDerWaalsContact O-N 3.15Å; F148-R175 HydrophobicContact CB-CG 3.73Å; F148-I176 HydrophobicContact CB-CD1 4.12Å; F148-I176 HydrophobicContact CD2-CD1 4.09Å; F148-L179 HydrophobicContact CB-CD1 3.85Å; F148-L179 HydrophobicContact CD1-CD1 4.42Å; F148-L179 HydrophobicContact CD2-CD1 3.81Å; F148-L179 HydrophobicContact CE2-CD1 4.48Å; F148-L179 HydrophobicContact CG-CD1 3.78Å
149	F	95	Very high	96	Very high	10 Å²	10	57.3 Å²	57.3	4%	0.044	31%	0.312	C	S	.	.			trans	-150.6	163.8	176.4	47.3	-111.8	0	0	0	112.6	R123 A126 F127 V147 L152 T172 R175 Q323 L327	R123-F149 HydrophobicContact CB-CB 4.06Å; R123-F149 HydrophobicContact CB-CD1 4.18Å; R123-F149 HydrophobicContact CB-CD2 4.07Å; R123-F149 HydrophobicContact CB-CG 3.82Å; R123-F149 HydrophobicContact CG-CB 3.87Å; R123-F149 HydrophobicContact CG-CD2 4.34Å; R123-F149 HydrophobicContact CG-CG 4.12Å; A126-F149 HydrophobicContact CB-CD1 4.14Å; F127-F149 HydrophobicContact CB-CE1 4.19Å; V147-F149 HydrophobicContact CB-CE1 4.44Å; V147-F149 HydrophobicContact CG1-CE1 4.03Å; V147-F149 HydrophobicContact CG2-CD1 3.67Å; V147-F149 HydrophobicContact CG2-CE1 3.6Å; F149-L152 HydrophobicContact CE2-CD1 4.04Å; F149-T172 WeakPolarHBondContact CA-OG1 3.44Å; F149-T172 HydrophobicContact CB-CG2 3.9Å; F149-T172 WeakPolarHBondContact CB-OG1 3.31Å; F149-R175 PolarHBondContact O-NH1 3.29Å; F149-R175 PolarHBondContact O-NH2 3.35Å; F149-Q323 HydrophobicContact CD2-CG 4.04Å; F149-Q323 HydrophobicContact CE2-CG 3.66Å; F149-L327 HydrophobicContact CE2-CD1 4.02Å; F149-L327 HydrophobicContact CZ-CD1 3.64Å
150	G	91.2	Very high	96	Very high	15 Å²	15	57.4 Å²	57.4	16%	0.155	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	158.1	177.8	0	0	0	0	0	114.8	R123	R123-G150 WeakPolarHBondContact CD-O 3.25Å; R123-G150 VanDerWaalsContact CZ-C 3.5Å; R123-G150 PolarHBondContact NE-O 3.26Å; R123-G150 PolarHBondContact NH1-O 3.14Å
151	G	87.6	Confident	96	Very high	55 Å²	55	56.8 Å²	56.8	57%	0.567	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	96	-10.8	175.8	0	0	0	0	0	115.4
152	L	89	Confident	96.1	Very high	63 Å²	63	60.1 Å²	60.1	33%	0.33	32%	0.318	S	S	.	.	S	Bend	trans	-111.9	158.8	167.5	-60.7	176.4	0	0	0	110.3	F149 I154 R175	F149-L152 HydrophobicContact CE2-CD1 4.04Å; L152-I154 PolarHBondContact O-N 3.17Å; L152-R175 PolarHBondContact O-NH2 3.03Å
153	S	93.3	Very high	96.1	Very high	66 Å²	66	61.8 Å²	61.8	46%	0.462	32%	0.319	S	S	.	.			trans	-63.6	124.6	177.9	179	0	0	0	0	111.4	K155 K156	S153-K155 PolarHBondContact O-N 3.16Å; S153-K155 PolarHBondContact OG-N 3.06Å; S153-K156 PolarHBondContact O-N 3.13Å; S153-K156 VanDerWaalsContact O-N 3.13Å
154	I	97	Very high	96	Very high	51 Å²	51	64.9 Å²	64.9	26%	0.262	34%	0.335	S	S	.	.	H	α-helix	trans	-59.2	-29.4	178.1	-166.5	169.6	0	0	0	112.3	L152 K156 D157 E158 A178 L179	L152-I154 PolarHBondContact O-N 3.17Å; I154-K156 PolarHBondContact O-N 2.89Å; I154-D157 WeakPolarHBondContact O-CA 3.5Å; I154-D157 WeakPolarHBondContact O-CB 3.39Å; I154-D157 PolarHBondContact O-N 2.87Å; I154-E158 HydrophobicContact CG1-CG 4.42Å; I154-E158 WeakPolarHBondContact O-CG 3.31Å; I154-E158 PolarHBondContact O-N 3.13Å; I154-A178 HydrophobicContact CD1-CB 3.88Å; I154-L179 HydrophobicContact CD1-CD2 3.97Å; I154-L179 HydrophobicContact CD1-CG 4.27Å; I154-L179 HydrophobicContact CG1-CD2 3.65Å; I154-L179 HydrophobicContact CG1-CG 4.28Å
155	K	97.2	Very high	95.9	Very high	143 Å²	143	62.5 Å²	62.5	62%	0.622	33%	0.328	S	S	*	.	H	α-helix	trans	-57.6	-33.5	177.5	-69.2	-173	174.4	-176.5	0	112.9	S153 D157 E158 E159	S153-K155 PolarHBondContact O-N 3.16Å; S153-K155 PolarHBondContact OG-N 3.06Å; K155-D157 VanDerWaalsContact C-N 3.34Å; K155-E158 PolarHBondContact O-N 3.48Å; K155-E159 WeakPolarHBondContact O-CG 3.28Å; K155-E159 PolarHBondContact O-N 3.06Å
156	K	95.9	Very high	95.9	Very high	133 Å²	133	61.2 Å²	61.2	58%	0.578	32%	0.32	S	S	*	.	H	α-helix	trans	-65.4	-41	176.3	-70.4	-174.8	174.8	-178	0	110.7	S153 I154 E159 V160	S153-K156 PolarHBondContact O-N 3.13Å; S153-K156 VanDerWaalsContact O-N 3.13Å; I154-K156 PolarHBondContact O-N 2.89Å; K156-E159 PolarHBondContact O-N 3.39Å; K156-V160 WeakPolarHBondContact O-CG2 3.26Å; K156-V160 PolarHBondContact O-N 2.89Å
157	D	97.9	Very high	96	Very high	14 Å²	14	60.7 Å²	60.7	8%	0.075	32%	0.315	C	S	.	.	H	α-helix	trans	-66	-43.6	177.5	-55.9	-3.8	0	0	0	110.8	F148 I154 K155 E159 V160 L161 R175 L179	F148-D157 HydrophobicContact CD1-CB 3.67Å; F148-D157 VanDerWaalsContact CD1-CG 3.44Å; F148-D157 HydrophobicContact CE1-CB 3.87Å; F148-D157 HydrophobicContact CG-CB 4.39Å; I154-D157 WeakPolarHBondContact O-CA 3.5Å; I154-D157 WeakPolarHBondContact O-CB 3.39Å; I154-D157 PolarHBondContact O-N 2.87Å; K155-D157 VanDerWaalsContact C-N 3.34Å; D157-E159 VanDerWaalsContact C-N 3.31Å; D157-E159 PolarHBondContact O-N 3.02Å; D157-V160 PolarHBondContact O-N 3.46Å; D157-L161 WeakPolarHBondContact O-CG 3.33Å; D157-L161 PolarHBondContact O-N 2.69Å; D157-R175 IonicContact OD1-NH1 3.62Å; D157-R175 WeakPolarHBondContact OD2-CD 3.4Å; D157-R175 IonicContact OD2-CZ 2.68Å; D157-R175 IonicContact OD2-NE 3.21Å; D157-R175 IonicContact OD2-NH1 2.81Å; D157-R175 PolarHBondContact OD2-NH1 3.38Å; D157-L179 HydrophobicContact CB-CD1 4Å; D157-L179 HydrophobicContact CB-CD2 3.9Å
158	E	98.1	Very high	96	Very high	59 Å²	59	59 Å²	59	28%	0.276	30%	0.304	S	S	.	.	H	α-helix	trans	-58.7	-42.2	175.1	-62	173.8	169.2	0	0	111.6	I154 K155 L161 K162 L179 N182 S184	I154-E158 HydrophobicContact CG1-CG 4.42Å; I154-E158 WeakPolarHBondContact O-CG 3.31Å; I154-E158 PolarHBondContact O-N 3.13Å; K155-E158 PolarHBondContact O-N 3.48Å; E158-L161 PolarHBondContact O-N 2.68Å; E158-K162 VanDerWaalsContact O-CB 3.3Å; E158-K162 WeakPolarHBondContact O-CB 3.41Å; E158-K162 PolarHBondContact O-N 3.45Å; E158-L179 HydrophobicContact CG-CD2 4.08Å; E158-N182 PolarHBondContact OE1-ND2 3.48Å; E158-S184 WeakPolarHBondContact CG-OG 3.31Å
159	E	97.7	Very high	96.1	Very high	97 Å²	97	58.8 Å²	58.8	45%	0.453	30%	0.304	S	S	.	.	H	α-helix	trans	-64.3	-41.1	175.4	-75.8	-165.3	106.6	0	0	112.6	K155 K156 D157 K162 K163	K155-E159 WeakPolarHBondContact O-CG 3.28Å; K155-E159 PolarHBondContact O-N 3.06Å; K156-E159 PolarHBondContact O-N 3.39Å; D157-E159 VanDerWaalsContact C-N 3.31Å; D157-E159 PolarHBondContact O-N 3.02Å; E159-K162 PolarHBondContact O-N 3.48Å; E159-K163 VanDerWaalsContact O-CB 3.29Å; E159-K163 WeakPolarHBondContact O-CB 3.29Å; E159-K163 WeakPolarHBondContact O-CG 3.34Å; E159-K163 PolarHBondContact O-N 3.22Å; E159-K163 IonicContact OE1-NZ 2.92Å; E159-K163 PolarHBondContact OE1-NZ 3.5Å
160	V	97.6	Very high	96.2	Very high	59 Å²	59	58.3 Å²	58.3	36%	0.358	30%	0.302	S	S	.	.	H	α-helix	trans	-61.3	-50	175.4	169.4	0	0	0	0	110.1	A146 F148 K156 D157 K162 K163 N164 C165	A146-V160 HydrophobicContact CB-CG1 4.39Å; F148-V160 HydrophobicContact CE1-CG1 4.37Å; F148-V160 HydrophobicContact CZ-CG1 4.31Å; K156-V160 WeakPolarHBondContact O-CG2 3.26Å; K156-V160 PolarHBondContact O-N 2.89Å; D157-V160 PolarHBondContact O-N 3.46Å; V160-K162 VanDerWaalsContact C-N 3.3Å; V160-K162 PolarHBondContact O-N 2.98Å; V160-K163 PolarHBondContact O-N 3.37Å; V160-N164 CarbonylContact O-C 3.47Å; V160-N164 WeakPolarHBondContact O-CA 2.76Å; V160-N164 PolarHBondContact O-N 3.45Å; V160-C165 PolarHBondContact O-N 3.4Å
161	L	97.9	Very high	96.6	Very high	11 Å²	11	57.6 Å²	57.6	6%	0.058	29%	0.294	C	S	.	.	H	α-helix	trans	-61.2	-38.3	179.8	-71	166.2	0	0	0	112.2	F148 D157 E158 C165 L179 L185	F148-L161 HydrophobicContact CE2-CD1 4.31Å; F148-L161 HydrophobicContact CE2-CD2 3.86Å; F148-L161 HydrophobicContact CE2-CG 4.17Å; F148-L161 HydrophobicContact CZ-CD1 4.36Å; F148-L161 HydrophobicContact CZ-CD2 3.91Å; F148-L161 HydrophobicContact CZ-CG 3.91Å; D157-L161 WeakPolarHBondContact O-CG 3.33Å; D157-L161 PolarHBondContact O-N 2.69Å; E158-L161 PolarHBondContact O-N 2.68Å; L161-C165 VanDerWaalsContact O-CB 3.32Å; L161-C165 WeakPolarHBondContact O-CB 3.15Å; L161-L179 HydrophobicContact CD1-CB 4.47Å; L161-L179 HydrophobicContact CD1-CD1 4.22Å; L161-L179 HydrophobicContact CD1-CD2 4.01Å; L161-L179 HydrophobicContact CD1-CG 4.47Å; L161-L185 HydrophobicContact CD1-CB 3.91Å; L161-L185 HydrophobicContact CD2-CD1 3.77Å
162	K	96.9	Very high	97	Very high	187 Å²	187	55.7 Å²	55.7	81%	0.813	27%	0.272	S	S	*	.	H	α-helix	trans	-72.9	-43.5	178.5	-175.4	178.3	180	178.3	0	113.4	E158 E159 V160	E158-K162 VanDerWaalsContact O-CB 3.3Å; E158-K162 WeakPolarHBondContact O-CB 3.41Å; E158-K162 PolarHBondContact O-N 3.45Å; E159-K162 PolarHBondContact O-N 3.48Å; V160-K162 VanDerWaalsContact C-N 3.3Å; V160-K162 PolarHBondContact O-N 2.98Å
163	K	96.8	Very high	97.4	Very high	158 Å²	158	52.8 Å²	52.8	69%	0.687	26%	0.257	S	S	*	.	H	α-helix	trans	-90.4	-35.7	-171.6	-67.1	173	-180	165.3	0	112.8	E159 V160	E159-K163 VanDerWaalsContact O-CB 3.29Å; E159-K163 WeakPolarHBondContact O-CB 3.29Å; E159-K163 WeakPolarHBondContact O-CG 3.34Å; E159-K163 PolarHBondContact O-N 3.22Å; E159-K163 IonicContact OE1-NZ 2.92Å; E159-K163 PolarHBondContact OE1-NZ 3.5Å; V160-K163 PolarHBondContact O-N 3.37Å
164	N	95.7	Very high	97.5	Very high	82 Å²	82	51.6 Å²	51.6	44%	0.439	26%	0.255	S	S	.	.	H	α-helix	trans	-148.5	59.1	-171.9	-171	39.6	0	0	0	110.8	K144 V160	K144-N164 WeakPolarHBondContact CD-OD1 3.31Å; K144-N164 WeakPolarHBondContact CE-OD1 3.32Å; K144-N164 PolarHBondContact NZ-OD1 3.37Å; V160-N164 CarbonylContact O-C 3.47Å; V160-N164 WeakPolarHBondContact O-CA 2.76Å; V160-N164 PolarHBondContact O-N 3.45Å
165	C	97.7	Very high	97.6	Very high	25 Å²	25	50.5 Å²	50.5	17%	0.169	25%	0.248	C	C	.	.			trans	-51.5	124.5	179.4	-169	0	0	0	0	110.9	G112 V160 L161	G112-C165 PolarHBondContact O-SG 3.34Å; V160-C165 PolarHBondContact O-N 3.4Å; L161-C165 VanDerWaalsContact O-CB 3.32Å; L161-C165 WeakPolarHBondContact O-CB 3.15Å
166	P	98.6	Very high	97.6	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.013	22%	0.218	C	C	.	.			trans	-77	163.8	179	36	-39.3	0	0	0	111.6	V114 K144 A146 V169	V114-P166 WeakPolarHBondContact CG2-O 3.34Å; K144-P166 HydrophobicContact CB-CB 4.24Å; K144-P166 WeakPolarHBondContact O-CB 3.46Å; A146-P166 HydrophobicContact CB-CB 3.95Å; A146-P166 HydrophobicContact CB-CG 3.71Å; P166-V169 HydrophobicContact CG-CG2 3.6Å
167	H	98.7	Very high	97.8	Very high	4 Å²	4	37.5 Å²	37.5	2%	0.019	19%	0.191	C	C	.	.	S	Bend	trans	-86.2	-28.6	171.2	-52.8	113	0	0	0	111.6	L107 V110 S115 V116 N142 K144	L107-H167 HydrophobicContact CD1-CB 4.43Å; L107-H167 HydrophobicContact CD2-CB 4.35Å; V110-H167 PolarHBondContact O-CD2 2.81Å; V110-H167 VanDerWaalsContact O-CD2 3.29Å; V110-H167 PolarHBondContact O-NE2 3.5Å; S115-H167 PolarHBondContact N-O 2.89Å; V116-H167 PolarHBondContact N-O 3Å; V116-H167 VanDerWaalsContact N-O 3.16Å; N142-H167 PolarHBondContact O-CE1 2.96Å; N142-H167 PolarHBondContact O-ND1 3.25Å; N142-H167 VanDerWaalsContact O-ND1 3.1Å; K144-H167 PolarHBondContact N-ND1 3.26Å; K144-H167 PolarHBondContact O-N 3.4Å
168	I	98.9	Very high	97.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	124.2	-177.6	-55.7	172.9	0	0	0	108.2	L104 L107 V116 Y133 V143 K144 V145 A146 V170	L104-I168 HydrophobicContact CD2-CD1 3.7Å; L107-I168 HydrophobicContact CD2-CD1 4.01Å; L107-I168 HydrophobicContact CD2-CG1 4.19Å; V116-I168 HydrophobicContact CB-CB 4.31Å; V116-I168 HydrophobicContact CB-CG1 4.01Å; V116-I168 HydrophobicContact CB-CG2 4.1Å; V116-I168 HydrophobicContact CG1-CG2 4.13Å; V116-I168 HydrophobicContact CG2-CG1 4.1Å; Y133-I168 HydrophobicContact CD1-CD1 3.58Å; Y133-I168 HydrophobicContact CD1-CG2 4.2Å; Y133-I168 HydrophobicContact CD2-CG2 4.02Å; Y133-I168 HydrophobicContact CE1-CD1 3.76Å; Y133-I168 HydrophobicContact CE1-CG2 4.07Å; Y133-I168 HydrophobicContact CE2-CG2 3.89Å; Y133-I168 HydrophobicContact CG-CD1 4.32Å; Y133-I168 HydrophobicContact CG-CG2 4.18Å; V143-I168 HydrophobicContact CG1-CD1 3.79Å; K144-I168 PolarHBondContact O-N 2.74Å; V145-I168 WeakPolarHBondContact CA-O 3.28Å; V145-I168 HydrophobicContact CG1-CB 4.37Å; V145-I168 HydrophobicContact CG1-CG2 4.26Å; V145-I168 HydrophobicContact CG2-CB 4.23Å; V145-I168 HydrophobicContact CG2-CD1 4.16Å; A146-I168 PolarHBondContact N-O 3.11Å; I168-V170 HydrophobicContact CG2-CG2 4.38Å
169	V	98.8	Very high	97.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127.8	174.3	171.2	0	0	0	0	109.1	V114 V116 L117 V118 F148 P166 I176 L185	V114-V169 HydrophobicContact CB-CG2 4.42Å; V114-V169 HydrophobicContact CG1-CB 4Å; V114-V169 HydrophobicContact CG1-CG2 3.58Å; V114-V169 HydrophobicContact CG2-CG2 3.87Å; V116-V169 PolarHBondContact O-N 3.38Å; L117-V169 CarbonylContact C-O 3.57Å; L117-V169 WeakPolarHBondContact CA-O 3.21Å; L117-V169 HydrophobicContact CD1-CB 4.16Å; L117-V169 HydrophobicContact CD1-CG1 3.88Å; V118-V169 PolarHBondContact N-O 2.88Å; F148-V169 HydrophobicContact CD2-CG1 3.62Å; F148-V169 HydrophobicContact CE2-CG1 3.83Å; F148-V169 HydrophobicContact CE2-CG2 3.95Å; P166-V169 HydrophobicContact CG-CG2 3.6Å; V169-I176 HydrophobicContact CG1-CD1 3.55Å; V169-L185 HydrophobicContact CG1-CD2 4.45Å; V169-L185 HydrophobicContact CG2-CD1 4.11Å
170	V	98.7	Very high	97.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	140.6	171.8	-172.2	0	0	0	0	108.5	V118 A126 I129 Y133 V145 A146 V147 F148 I168	V118-V170 HydrophobicContact CB-CG1 4.3Å; V118-V170 HydrophobicContact CB-CG2 4.26Å; V118-V170 HydrophobicContact CG1-CG1 4.48Å; V118-V170 CarbonylContact O-C 3.58Å; V118-V170 VanDerWaalsContact O-CA 3.27Å; V118-V170 WeakPolarHBondContact O-CA 3.44Å; A126-V170 HydrophobicContact CB-CG1 4.14Å; A126-V170 WeakPolarHBondContact O-CG1 3.43Å; I129-V170 HydrophobicContact CB-CG1 3.94Å; I129-V170 HydrophobicContact CG2-CG1 3.79Å; I129-V170 HydrophobicContact CG2-CG2 4.04Å; Y133-V170 HydrophobicContact CD2-CG2 3.94Å; Y133-V170 HydrophobicContact CE2-CG2 4.08Å; V145-V170 HydrophobicContact CG1-CG2 4.39Å; A146-V170 PolarHBondContact O-N 3.17Å; V147-V170 CarbonylContact C-O 3.58Å; V147-V170 WeakPolarHBondContact CA-O 3.41Å; V147-V170 HydrophobicContact CG2-CB 4.29Å; V147-V170 HydrophobicContact CG2-CG1 4.48Å; F148-V170 PolarHBondContact N-O 3.15Å; I168-V170 HydrophobicContact CG2-CG2 4.38Å
171	G	98.1	Very high	97.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.9	-179.2	176.1	0	0	0	0	0	116.7	V118 M119 C120 F148	V118-G171 PolarHBondContact O-N 3.06Å; M119-G171 VanDerWaalsContact CA-O 3.28Å; M119-G171 WeakPolarHBondContact CA-O 3.16Å; C120-G171 PolarHBondContact N-O 3.44Å; C120-G171 VanDerWaalsContact N-O 3.17Å; F148-G171 WeakPolarHBondContact O-CA 3.48Å
172	T	96.4	Very high	97.8	Very high	15 Å²	15	38 Å²	38	9%	0.092	19%	0.193	C	C	.	.			trans	-94.5	140.4	171.6	55.9	0	0	0	0	110.2	R123 F148 F149 G174 R175 I176	R123-T172 HydrophobicContact CG-CG2 4Å; F148-T172 PolarHBondContact O-N 3.05Å; F148-T172 VanDerWaalsContact O-N 3.15Å; F149-T172 WeakPolarHBondContact CA-OG1 3.44Å; F149-T172 HydrophobicContact CB-CG2 3.9Å; F149-T172 WeakPolarHBondContact CB-OG1 3.31Å; T172-G174 PolarHBondContact O-N 2.88Å; T172-R175 PolarHBondContact O-N 3.35Å; T172-I176 PolarHBondContact O-N 3.35Å
173	P	97.2	Very high	97.8	Very high	3 Å²	3	38 Å²	38	2%	0.019	19%	0.193	C	C	.	.	H	α-helix	trans	-46	-53.2	-172.7	-32.2	35.6	0	0	0	114.6	M119 C120 R175 I176 L177 M201 M207 D210 V211 I214	M119-P173 HydrophobicContact SD-CG 4.44Å; C120-P173 WeakPolarHBondContact O-CD 3.19Å; P173-R175 VanDerWaalsContact C-N 3.3Å; P173-R175 PolarHBondContact O-N 3.2Å; P173-R175 VanDerWaalsContact O-N 3.16Å; P173-I176 PolarHBondContact O-N 2.83Å; P173-I176 VanDerWaalsContact O-N 3.11Å; P173-L177 WeakPolarHBondContact O-CB 3.48Å; P173-L177 PolarHBondContact O-N 3.37Å; P173-M201 HydrophobicContact CG-SD 4.01Å; P173-M207 HydrophobicContact CB-CG 4.22Å; P173-M207 HydrophobicContact CG-CG 3.97Å; P173-M207 HydrophobicContact CG-SD 4.19Å; P173-D210 HydrophobicContact CB-CB 4.25Å; P173-V211 HydrophobicContact CB-CG2 3.9Å; P173-V211 HydrophobicContact CG-CG2 3.7Å; P173-I214 HydrophobicContact CB-CD1 4.38Å; P173-I214 WeakPolarHBondContact O-CD1 3.47Å
174	G	96.7	Very high	97.9	Very high	41 Å²	41	32.5 Å²	32.5	42%	0.423	17%	0.174	S	C	.	.	H	α-helix	trans	-59.5	-32.8	-176.6	0	0	0	0	0	115.2	T172 A178	T172-G174 PolarHBondContact O-N 2.88Å; G174-A178 WeakPolarHBondContact O-CB 3.39Å; G174-A178 PolarHBondContact O-N 3.37Å
175	R	97.7	Very high	98	Very high	28 Å²	28	28.8 Å²	28.8	11%	0.106	16%	0.155	C	C	.	.	H	α-helix	trans	-77.1	-42.6	175.3	176	57.1	62.6	81	1.6	111.4	F148 F149 L152 D157 T172 P173 L177 A178 L179	F148-R175 HydrophobicContact CB-CG 3.73Å; F149-R175 PolarHBondContact O-NH1 3.29Å; F149-R175 PolarHBondContact O-NH2 3.35Å; L152-R175 PolarHBondContact O-NH2 3.03Å; D157-R175 IonicContact OD1-NH1 3.62Å; D157-R175 WeakPolarHBondContact OD2-CD 3.4Å; D157-R175 IonicContact OD2-CZ 2.68Å; D157-R175 IonicContact OD2-NE 3.21Å; D157-R175 IonicContact OD2-NH1 2.81Å; D157-R175 PolarHBondContact OD2-NH1 3.38Å; T172-R175 PolarHBondContact O-N 3.35Å; P173-R175 VanDerWaalsContact C-N 3.3Å; P173-R175 PolarHBondContact O-N 3.2Å; P173-R175 VanDerWaalsContact O-N 3.16Å; R175-L177 VanDerWaalsContact C-N 3.33Å; R175-A178 PolarHBondContact O-N 3.1Å; R175-L179 HydrophobicContact CG-CD1 4.01Å; R175-L179 WeakPolarHBondContact O-CG 3.49Å; R175-L179 PolarHBondContact O-N 2.97Å; R175-L179 VanDerWaalsContact O-N 3.08Å
176	I	98.6	Very high	98	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.3	-45.3	178	-63.8	-58.6	0	0	0	110.2	L117 M119 F148 V169 T172 P173 A178 L179 A180 L185 I214	L117-I176 HydrophobicContact CD1-CD1 4.33Å; L117-I176 HydrophobicContact CD1-CG1 4.48Å; L117-I176 HydrophobicContact CD1-CG2 4.03Å; L117-I176 HydrophobicContact CD2-CG2 4.29Å; M119-I176 HydrophobicContact CG-CG1 4.42Å; M119-I176 HydrophobicContact SD-CB 4.26Å; M119-I176 HydrophobicContact SD-CG1 4.43Å; M119-I176 HydrophobicContact SD-CG2 4.12Å; F148-I176 HydrophobicContact CB-CD1 4.12Å; F148-I176 HydrophobicContact CD2-CD1 4.09Å; V169-I176 HydrophobicContact CG1-CD1 3.55Å; T172-I176 PolarHBondContact O-N 3.35Å; P173-I176 PolarHBondContact O-N 2.83Å; P173-I176 VanDerWaalsContact O-N 3.11Å; I176-A178 PolarHBondContact O-N 2.98Å; I176-L179 PolarHBondContact O-N 3.35Å; I176-A180 WeakPolarHBondContact O-CB 3.2Å; I176-A180 PolarHBondContact O-N 3.21Å; I176-L185 HydrophobicContact CD1-CD2 4.29Å; I176-L185 HydrophobicContact CG2-CD2 4.02Å; I176-I214 HydrophobicContact CB-CD1 4.01Å; I176-I214 HydrophobicContact CG2-CD1 3.83Å; I176-I214 HydrophobicContact CG2-CG1 4.26Å; I176-I214 HydrophobicContact CG2-CG2 3.95Å
177	L	98.4	Very high	98	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-59.7	-46	176.4	-178	60	0	0	0	111.9	P173 R175 L179 A180 R181 D210 E213 I214 M217	P173-L177 WeakPolarHBondContact O-CB 3.48Å; P173-L177 PolarHBondContact O-N 3.37Å; R175-L177 VanDerWaalsContact C-N 3.33Å; L177-L179 VanDerWaalsContact C-N 3.32Å; L177-L179 PolarHBondContact O-N 2.89Å; L177-A180 PolarHBondContact O-N 2.86Å; L177-R181 HydrophobicContact CD1-CG 3.98Å; L177-R181 HydrophobicContact CG-CG 4.27Å; L177-R181 WeakPolarHBondContact O-CB 3.43Å; L177-R181 WeakPolarHBondContact O-CG 3.49Å; L177-R181 PolarHBondContact O-N 3.26Å; L177-D210 HydrophobicContact CD2-CB 3.8Å; L177-D210 WeakPolarHBondContact CD2-OD1 3.36Å; L177-E213 HydrophobicContact CD1-CB 3.99Å; L177-E213 HydrophobicContact CD1-CG 3.86Å; L177-I214 HydrophobicContact CB-CD1 3.91Å; L177-I214 HydrophobicContact CB-CG1 3.87Å; L177-I214 HydrophobicContact CD1-CG1 3.9Å; L177-I214 HydrophobicContact CG-CG1 4.47Å; L177-M217 HydrophobicContact CD1-CE 4.18Å
178	A	98.2	Very high	98	Very high	37 Å²	37	38.6 Å²	38.6	31%	0.306	20%	0.198	S	C	.	.	H	α-helix	trans	-59.5	-42.6	178.3	0	0	0	0	0	112.3	I154 G174 R175 I176 N182	I154-A178 HydrophobicContact CD1-CB 3.88Å; G174-A178 WeakPolarHBondContact O-CB 3.39Å; G174-A178 PolarHBondContact O-N 3.37Å; R175-A178 PolarHBondContact O-N 3.1Å; I176-A178 PolarHBondContact O-N 2.98Å; A178-N182 VanDerWaalsContact O-CG 3.26Å; A178-N182 PolarHBondContact O-N 3.07Å; A178-N182 VanDerWaalsContact O-N 3.09Å
179	L	98.5	Very high	98	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-69.1	-32.7	176.8	-70.2	168.1	0	0	0	112.8	F148 I154 D157 E158 L161 R175 I176 L177 N182 S184 L185	F148-L179 HydrophobicContact CB-CD1 3.85Å; F148-L179 HydrophobicContact CD1-CD1 4.42Å; F148-L179 HydrophobicContact CD2-CD1 3.81Å; F148-L179 HydrophobicContact CE2-CD1 4.48Å; F148-L179 HydrophobicContact CG-CD1 3.78Å; I154-L179 HydrophobicContact CD1-CD2 3.97Å; I154-L179 HydrophobicContact CD1-CG 4.27Å; I154-L179 HydrophobicContact CG1-CD2 3.65Å; I154-L179 HydrophobicContact CG1-CG 4.28Å; D157-L179 HydrophobicContact CB-CD1 4Å; D157-L179 HydrophobicContact CB-CD2 3.9Å; E158-L179 HydrophobicContact CG-CD2 4.08Å; L161-L179 HydrophobicContact CD1-CB 4.47Å; L161-L179 HydrophobicContact CD1-CD1 4.22Å; L161-L179 HydrophobicContact CD1-CD2 4.01Å; L161-L179 HydrophobicContact CD1-CG 4.47Å; R175-L179 HydrophobicContact CG-CD1 4.01Å; R175-L179 WeakPolarHBondContact O-CG 3.49Å; R175-L179 PolarHBondContact O-N 2.97Å; R175-L179 VanDerWaalsContact O-N 3.08Å; I176-L179 PolarHBondContact O-N 3.35Å; L177-L179 VanDerWaalsContact C-N 3.32Å; L177-L179 PolarHBondContact O-N 2.89Å; L179-N182 WeakPolarHBondContact CA-OD1 3.37Å; L179-N182 PolarHBondContact O-OD1 3.3Å; L179-S184 PolarHBondContact O-N 3.49Å; L179-S184 VanDerWaalsContact O-N 3.07Å; L179-L185 HydrophobicContact CB-CB 3.78Å; L179-L185 HydrophobicContact CB-CD2 4.35Å; L179-L185 PolarHBondContact O-N 2.94Å
180	A	98.4	Very high	98	Very high	11 Å²	11	42.2 Å²	42.2	9%	0.091	22%	0.215	C	C	.	.	H	α-helix	trans	-73.8	-46.2	176.6	0	0	0	0	0	111.1	I176 L177 N182 K183 L187 M217	I176-A180 WeakPolarHBondContact O-CB 3.2Å; I176-A180 PolarHBondContact O-N 3.21Å; L177-A180 PolarHBondContact O-N 2.86Å; A180-N182 PolarHBondContact O-N 3.15Å; A180-K183 WeakPolarHBondContact O-CA 3.48Å; A180-K183 PolarHBondContact O-N 3.19Å; A180-L187 HydrophobicContact CB-CD1 3.8Å; A180-L187 HydrophobicContact CB-CG 4.44Å; A180-M217 HydrophobicContact CB-SD 3.48Å; A180-M217 WeakPolarHBondContact CB-SD 3.42Å
181	R	97.8	Very high	97.9	Very high	140 Å²	140	47.1 Å²	47.1	53%	0.528	24%	0.236	S	C	.	.	H	α-helix	trans	-60.2	-40.7	177.4	-77.5	179.6	171.1	167.7	-2.6	112.9	L177 K183 E213 M217	L177-R181 HydrophobicContact CD1-CG 3.98Å; L177-R181 HydrophobicContact CG-CG 4.27Å; L177-R181 WeakPolarHBondContact O-CB 3.43Å; L177-R181 WeakPolarHBondContact O-CG 3.49Å; L177-R181 PolarHBondContact O-N 3.26Å; R181-K183 PolarHBondContact O-N 3.36Å; R181-E213 IonicContact CZ-OE1 2.9Å; R181-E213 IonicContact CZ-OE2 3.89Å; R181-E213 IonicContact NE-OE1 3.37Å; R181-E213 PolarHBondContact NE-OE1 3.36Å; R181-E213 IonicContact NE-OE2 3.9Å; R181-E213 VanDerWaalsContact NH2-CD 3.3Å; R181-E213 IonicContact NH2-OE1 2.87Å; R181-E213 PolarHBondContact NH2-OE1 3.46Å; R181-E213 IonicContact NH2-OE2 2.73Å; R181-E213 PolarHBondContact NH2-OE2 2.88Å; R181-M217 HydrophobicContact CG-CE 3.95Å
182	N	96.9	Very high	98	Very high	63 Å²	63	47.5 Å²	47.5	34%	0.337	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	3.5	176.6	78	11.9	0	0	0	113.6	E158 A178 L179 A180 S184	E158-N182 PolarHBondContact OE1-ND2 3.48Å; A178-N182 VanDerWaalsContact O-CG 3.26Å; A178-N182 PolarHBondContact O-N 3.07Å; A178-N182 VanDerWaalsContact O-N 3.09Å; L179-N182 WeakPolarHBondContact CA-OD1 3.37Å; L179-N182 PolarHBondContact O-OD1 3.3Å; A180-N182 PolarHBondContact O-N 3.15Å; N182-S184 PolarHBondContact O-N 2.62Å; N182-S184 WeakPolarHBondContact OD1-CB 3.22Å; N182-S184 PolarHBondContact OD1-N 2.89Å; N182-S184 PolarHBondContact OD1-OG 3.49Å
183	K	97.2	Very high	98.1	Very high	186 Å²	186	46.8 Å²	46.8	81%	0.809	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.5	13.9	179.3	-51	-179.5	-179	178.7	0	115.1	A180 R181	A180-K183 WeakPolarHBondContact O-CA 3.48Å; A180-K183 PolarHBondContact O-N 3.19Å; R181-K183 PolarHBondContact O-N 3.36Å
184	S	97.8	Very high	98.2	Very high	42 Å²	42	46.6 Å²	46.6	29%	0.294	23%	0.232	S	C	.	.	S	Bend	trans	-74.4	-34.1	173.8	-59.4	0	0	0	0	111.8	E158 L179 N182	E158-S184 WeakPolarHBondContact CG-OG 3.31Å; L179-S184 PolarHBondContact O-N 3.49Å; L179-S184 VanDerWaalsContact O-N 3.07Å; N182-S184 PolarHBondContact O-N 2.62Å; N182-S184 WeakPolarHBondContact OD1-CB 3.22Å; N182-S184 PolarHBondContact OD1-N 2.89Å; N182-S184 PolarHBondContact OD1-OG 3.49Å
185	L	98.4	Very high	98.2	Very high	5 Å²	5	44.7 Å²	44.7	3%	0.026	21%	0.212	C	C	.	.	S	Bend	trans	-104.3	109.3	175.2	177.7	60.5	0	0	0	109.9	V114 L161 V169 I176 L179 L187	V114-L185 HydrophobicContact CG2-CD1 3.78Å; L161-L185 HydrophobicContact CD1-CB 3.91Å; L161-L185 HydrophobicContact CD2-CD1 3.77Å; V169-L185 HydrophobicContact CG1-CD2 4.45Å; V169-L185 HydrophobicContact CG2-CD1 4.11Å; I176-L185 HydrophobicContact CD1-CD2 4.29Å; I176-L185 HydrophobicContact CG2-CD2 4.02Å; L179-L185 HydrophobicContact CB-CB 3.78Å; L179-L185 HydrophobicContact CB-CD2 4.35Å; L179-L185 PolarHBondContact O-N 2.94Å; L185-L187 HydrophobicContact CD1-CD2 4.16Å; L185-L187 HydrophobicContact CD2-CD2 3.82Å; L185-L187 HydrophobicContact CD2-CG 4.41Å; L185-L187 HydrophobicContact CG-CD2 3.69Å; L185-L187 HydrophobicContact CG-CG 4.11Å
186	N	98.1	Very high	98.1	Very high	79 Å²	79	43.6 Å²	43.6	42%	0.422	21%	0.209	S	C	.	.			trans	-86.7	113.5	175.3	-178.8	11.2	0	0	0	110.7	K188	N186-K188 WeakPolarHBondContact OD1-CB 3.44Å; N186-K188 VanDerWaalsContact OD1-CG 3.26Å; N186-K188 WeakPolarHBondContact OD1-CG 3.37Å; N186-K188 PolarHBondContact OD1-N 2.93Å; N186-K188 VanDerWaalsContact OD1-N 3.13Å
187	L	98.5	Very high	97.7	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.026	21%	0.212	C	C	.	.			trans	-97.1	3.5	-177.1	-64.8	-179.5	0	0	0	114.3	L117 A180 L185 H189 I190 I214 M217 T218 P219	L117-L187 HydrophobicContact CD2-CD2 4.14Å; A180-L187 HydrophobicContact CB-CD1 3.8Å; A180-L187 HydrophobicContact CB-CG 4.44Å; L185-L187 HydrophobicContact CD1-CD2 4.16Å; L185-L187 HydrophobicContact CD2-CD2 3.82Å; L185-L187 HydrophobicContact CD2-CG 4.41Å; L185-L187 HydrophobicContact CG-CD2 3.69Å; L185-L187 HydrophobicContact CG-CG 4.11Å; L187-H189 PolarHBondContact O-N 3.39Å; L187-H189 VanDerWaalsContact O-N 3.08Å; L187-I190 HydrophobicContact CB-CG1 4.26Å; L187-I190 HydrophobicContact CD2-CD1 4.2Å; L187-I190 HydrophobicContact CD2-CG1 4.01Å; L187-I190 WeakPolarHBondContact O-CG1 3.24Å; L187-I190 PolarHBondContact O-N 2.87Å; L187-I214 HydrophobicContact CD1-CG2 3.81Å; L187-M217 HydrophobicContact CB-CB 4.41Å; L187-M217 HydrophobicContact CD1-CB 4.11Å; L187-T218 HydrophobicContact CB-CG2 4.06Å; L187-T218 HydrophobicContact CD1-CG2 4.48Å; L187-P219 WeakPolarHBondContact O-CD 3.32Å
188	K	98.2	Very high	97.5	Very high	152 Å²	152	44 Å²	44	66%	0.661	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-7.4	-175.9	-66	178.4	178.1	-173.3	0	115.2	N186 P219	N186-K188 WeakPolarHBondContact OD1-CB 3.44Å; N186-K188 VanDerWaalsContact OD1-CG 3.26Å; N186-K188 WeakPolarHBondContact OD1-CG 3.37Å; N186-K188 PolarHBondContact OD1-N 2.93Å; N186-K188 VanDerWaalsContact OD1-N 3.13Å; K188-P219 WeakPolarHBondContact O-CG 3.37Å
189	H	98.3	Very high	97.1	Very high	75 Å²	75	42.9 Å²	42.9	35%	0.347	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	10.1	-176.9	-55.9	-62.3	0	0	0	113	Q113 V114 L187 K191	Q113-H189 HydrophobicContact CB-CB 4.33Å; V114-H189 CarbonylContact O-C 3.6Å; L187-H189 PolarHBondContact O-N 3.39Å; L187-H189 VanDerWaalsContact O-N 3.08Å; H189-K191 PolarHBondContact O-N 2.91Å
190	I	98.7	Very high	96.7	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.01	21%	0.206	C	C	.	.			trans	-63	121.7	175.8	-65.1	-58.5	0	0	0	109.5	V114 L117 L187 H192 F193 T218 K222	V114-I190 HydrophobicContact CB-CD1 4.17Å; V114-I190 HydrophobicContact CG1-CD1 3.62Å; L117-I190 HydrophobicContact CB-CD1 3.75Å; L117-I190 HydrophobicContact CB-CG1 4.34Å; L117-I190 HydrophobicContact CB-CG2 4.48Å; L187-I190 HydrophobicContact CB-CG1 4.26Å; L187-I190 HydrophobicContact CD2-CD1 4.2Å; L187-I190 HydrophobicContact CD2-CG1 4.01Å; L187-I190 WeakPolarHBondContact O-CG1 3.24Å; L187-I190 PolarHBondContact O-N 2.87Å; I190-H192 WeakPolarHBondContact CG2-O 3.48Å; I190-F193 HydrophobicContact CG2-CB 4.37Å; I190-T218 HydrophobicContact CB-CG2 3.96Å; I190-T218 HydrophobicContact CG1-CG2 3.92Å; I190-T218 HydrophobicContact CG2-CG2 4.17Å; I190-K222 HydrophobicContact CG2-CD 4.26Å
191	K	98.6	Very high	96.3	Very high	102 Å²	102	43.9 Å²	43.9	44%	0.443	20%	0.202	S	C	.	.	S	Bend	trans	-101.7	-22.2	170.7	-64.6	-170.5	178.4	-173.2	0	112	E108 S115 H189 K222 Q223	E108-K191 IonicContact OE2-NZ 2.87Å; E108-K191 PolarHBondContact OE2-NZ 2.83Å; S115-K191 PolarHBondContact O-N 2.87Å; H189-K191 PolarHBondContact O-N 2.91Å; K191-K222 WeakPolarHBondContact O-CA 3.41Å; K191-K222 WeakPolarHBondContact O-CB 3.05Å; K191-Q223 PolarHBondContact O-N 2.85Å
192	H	98.8	Very high	96.1	Very high	8 Å²	8	37.2 Å²	37.2	4%	0.037	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	118	-175.5	-53.8	103.2	0	0	0	110.7	T103 Q106 S115 V116 L117 I190 Q223	T103-H192 HydrophobicContact CG2-CB 3.86Å; Q106-H192 PolarHBondContact OE1-NE2 3.29Å; Q106-H192 VanDerWaalsContact OE1-NE2 3.1Å; S115-H192 PolarHBondContact O-N 3.01Å; S115-H192 VanDerWaalsContact O-N 3.1Å; V116-H192 WeakPolarHBondContact CA-O 3.33Å; V116-H192 HydrophobicContact CB-CB 4.33Å; V116-H192 HydrophobicContact CG1-CB 4.09Å; V116-H192 HydrophobicContact CG2-CB 4.05Å; L117-H192 PolarHBondContact N-O 3.07Å; I190-H192 WeakPolarHBondContact CG2-O 3.48Å; H192-Q223 WeakPolarHBondContact CA-O 3.32Å; H192-Q223 PolarHBondContact CD2-OE1 3.18Å
193	F	98.8	Very high	95.8	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	112.7	180	-173.1	-81	0	0	0	110.4	L117 M119 I190 L195 V211 I214 F215 T218 K222 Q223 V224 M225	L117-F193 HydrophobicContact CD2-CD2 4Å; L117-F193 HydrophobicContact CD2-CE2 3.84Å; M119-F193 HydrophobicContact CE-CE1 4.05Å; M119-F193 HydrophobicContact CE-CE2 3.79Å; M119-F193 HydrophobicContact CE-CZ 3.27Å; I190-F193 HydrophobicContact CG2-CB 4.37Å; F193-L195 HydrophobicContact CD1-CD2 4.41Å; F193-L195 HydrophobicContact CD1-CG 4.44Å; F193-L195 HydrophobicContact CE1-CD1 4.32Å; F193-L195 HydrophobicContact CE1-CD2 3.62Å; F193-L195 HydrophobicContact CE1-CG 3.87Å; F193-L195 HydrophobicContact CZ-CD2 4.17Å; F193-V211 HydrophobicContact CZ-CG1 4.38Å; F193-I214 HydrophobicContact CE2-CG2 4.16Å; F193-F215 AromaticContact CD1-CD2 3.94Å; F193-F215 HydrophobicContact CD1-CD2 3.94Å; F193-F215 HydrophobicContact CD1-CE2 4.28Å; F193-F215 HydrophobicContact CD2-CD2 4.19Å; F193-F215 AromaticContact CE1-CD2 3.76Å; F193-F215 HydrophobicContact CE1-CD2 3.76Å; F193-F215 HydrophobicContact CE1-CE2 4.46Å; F193-F215 HydrophobicContact CE2-CB 4.28Å; F193-F215 HydrophobicContact CE2-CD2 4Å; F193-F215 HydrophobicContact CG-CD2 4.14Å; F193-F215 HydrophobicContact CG-CE2 4.48Å; F193-F215 HydrophobicContact CZ-CB 4.06Å; F193-F215 AromaticContact CZ-CD2 3.78Å; F193-F215 HydrophobicContact CZ-CD2 3.78Å; F193-F215 HydrophobicContact CZ-CG 4.44Å; F193-T218 HydrophobicContact CD2-CG2 4.17Å; F193-T218 HydrophobicContact CE2-CG2 4.45Å; F193-K222 HydrophobicContact CB-CD 4.01Å; F193-Q223 PolarHBondContact N-O 3.29Å; F193-V224 HydrophobicContact CB-CG2 4.36Å; F193-V224 HydrophobicContact CD1-CG1 4.3Å; F193-V224 VanDerWaalsContact O-CA 3.3Å; F193-V224 WeakPolarHBondContact O-CA 3.1Å; F193-M225 PolarHBondContact O-N 3.27Å
194	I	98.7	Very high	95.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	133.1	-169.5	-41.9	-61.6	0	0	0	110.6	F99 T103 L117 V118 M119 M225 F227	F99-I194 HydrophobicContact CB-CD1 4.47Å; F99-I194 HydrophobicContact CB-CG2 3.9Å; F99-I194 HydrophobicContact CD1-CG2 4.03Å; F99-I194 HydrophobicContact CD2-CG2 3.93Å; F99-I194 HydrophobicContact CE1-CG2 4.44Å; F99-I194 HydrophobicContact CE2-CG2 4.41Å; F99-I194 HydrophobicContact CG-CG2 3.72Å; T103-I194 HydrophobicContact CG2-CD1 4.02Å; T103-I194 HydrophobicContact CG2-CG1 4.26Å; L117-I194 PolarHBondContact O-N 2.92Å; V118-I194 CarbonylContact C-O 3.32Å; V118-I194 WeakPolarHBondContact CA-O 3.34Å; V118-I194 HydrophobicContact CB-CB 4.26Å; V118-I194 HydrophobicContact CG1-CB 4.07Å; V118-I194 HydrophobicContact CG1-CG2 4.23Å; V118-I194 HydrophobicContact CG2-CB 3.92Å; V118-I194 HydrophobicContact CG2-CG1 3.94Å; M119-I194 PolarHBondContact N-O 3.01Å; I194-M225 CarbonylContact C-O 3.5Å; I194-M225 VanDerWaalsContact CA-O 3.29Å; I194-M225 WeakPolarHBondContact CA-O 3.45Å; I194-M225 HydrophobicContact CD1-CB 3.75Å; I194-M225 HydrophobicContact CD1-CE 3.31Å; I194-M225 HydrophobicContact CD1-CG 3.93Å; I194-M225 HydrophobicContact CD1-SD 4.27Å; I194-M225 HydrophobicContact CG2-CB 4.49Å; I194-F227 HydrophobicContact CG2-CD2 4.31Å; I194-F227 HydrophobicContact CG2-CE2 4.25Å
195	L	97.8	Very high	95	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	119	170.2	-59.5	-170.1	0	0	0	110.4	M119 F193 C198 M201 L202 V211 M225 M226 F227	M119-L195 HydrophobicContact CB-CD2 3.85Å; M119-L195 HydrophobicContact CE-CD2 3.64Å; M119-L195 WeakPolarHBondContact O-CA 3.45Å; F193-L195 HydrophobicContact CD1-CD2 4.41Å; F193-L195 HydrophobicContact CD1-CG 4.44Å; F193-L195 HydrophobicContact CE1-CD1 4.32Å; F193-L195 HydrophobicContact CE1-CD2 3.62Å; F193-L195 HydrophobicContact CE1-CG 3.87Å; F193-L195 HydrophobicContact CZ-CD2 4.17Å; L195-C198 HydrophobicContact CB-CB 3.93Å; L195-C198 HydrophobicContact CD1-CB 4.46Å; L195-M201 HydrophobicContact CB-CE 3.47Å; L195-M201 VanDerWaalsContact CB-CE 3.47Å; L195-M201 HydrophobicContact CD1-CE 4.27Å; L195-M201 HydrophobicContact CD2-CE 3.84Å; L195-M201 HydrophobicContact CG-CE 4.06Å; L195-L202 HydrophobicContact CD1-CD1 4.31Å; L195-L202 HydrophobicContact CD1-CD2 4.35Å; L195-L202 HydrophobicContact CD1-CG 4.5Å; L195-V211 HydrophobicContact CD1-CG1 3.94Å; L195-V211 HydrophobicContact CD2-CG1 4.18Å; L195-M225 PolarHBondContact N-O 2.72Å; L195-M226 HydrophobicContact CB-CB 4.49Å; L195-M226 HydrophobicContact CB-CG 3.94Å; L195-M226 HydrophobicContact CD1-CE 3.51Å; L195-M226 HydrophobicContact CD1-CG 4.25Å; L195-M226 HydrophobicContact CD1-SD 3.98Å; L195-M226 HydrophobicContact CG-CE 4.21Å; L195-M226 HydrophobicContact CG-CG 4.26Å; L195-M226 CarbonylContact O-C 3.53Å; L195-M226 VanDerWaalsContact O-CA 3.31Å; L195-M226 WeakPolarHBondContact O-CA 3.47Å; L195-F227 PolarHBondContact O-N 2.87Å
196	D	95.3	Very high	94.6	Very high	6 Å²	6	42.7 Å²	42.7	3%	0.032	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137.9	170.4	-163	12.4	0	0	0	110	F99 M119 C120 I129 M201	F99-D196 HydrophobicContact CE1-CB 4.13Å; F99-D196 HydrophobicContact CZ-CB 4.2Å; M119-D196 PolarHBondContact O-N 3.21Å; C120-D196 WeakPolarHBondContact CA-O 3.21Å; C120-D196 HydrophobicContact CB-CB 4.25Å; C120-D196 WeakPolarHBondContact CB-O 3.39Å; I129-D196 HydrophobicContact CD1-CB 4.12Å; D196-M201 WeakPolarHBondContact O-CE 3.48Å
197	E	91.1	Very high	94.3	Very high	12 Å²	12	40.5 Å²	40.5	6%	0.056	19%	0.192	C	C	.	.	S	Bend	trans	57.5	48.4	-164.8	-53.9	-171.2	167.8	0	0	111.9	L125 D199 K200 M201 F227 R349 G350	L125-E197 HydrophobicContact CD2-CG 3.79Å; E197-D199 PolarHBondContact O-N 2.85Å; E197-K200 PolarHBondContact O-N 2.9Å; E197-M201 PolarHBondContact O-N 3.17Å; E197-F227 WeakPolarHBondContact CA-O 3.39Å; E197-F227 PolarHBondContact N-O 3.49Å; E197-R349 VanDerWaalsContact OE1-CB 3.32Å; E197-R349 WeakPolarHBondContact OE1-CB 3.47Å; E197-R349 WeakPolarHBondContact OE2-CB 3.47Å; E197-G350 WeakPolarHBondContact OE1-CA 3.21Å; E197-G350 PolarHBondContact OE1-N 3Å
198	C	93.2	Very high	94.2	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63	-28.3	-175.8	62.3	0	0	0	0	113.6	L195 K200 M201 L202 M226 F227	L195-C198 HydrophobicContact CB-CB 3.93Å; L195-C198 HydrophobicContact CD1-CB 4.46Å; C198-K200 PolarHBondContact O-N 3.27Å; C198-M201 PolarHBondContact O-N 2.78Å; C198-L202 HydrophobicContact CB-CD1 4.27Å; C198-L202 VanDerWaalsContact O-CB 3.24Å; C198-L202 WeakPolarHBondContact O-CB 3.39Å; C198-L202 WeakPolarHBondContact O-CG 3.44Å; C198-L202 PolarHBondContact O-N 2.99Å; C198-M226 HydrophobicContact CB-CB 4.02Å; C198-M226 HydrophobicContact CB-CG 4.33Å; C198-M226 HydrophobicContact CB-SD 4.17Å; C198-F227 PolarHBondContact N-O 2.62Å
199	D	91	Very high	94.1	Very high	12 Å²	12	42 Å²	42	6%	0.064	19%	0.193	C	C	.	.	H	α-helix	trans	-55.7	-51.6	173.3	59.8	-38.8	0	0	0	111.4	E197 M201 L202 E203 S228 T230 L231 R349	E197-D199 PolarHBondContact O-N 2.85Å; D199-M201 PolarHBondContact O-N 2.91Å; D199-L202 PolarHBondContact O-N 3.29Å; D199-E203 WeakPolarHBondContact O-CB 3.15Å; D199-E203 PolarHBondContact O-N 3.37Å; D199-S228 WeakPolarHBondContact OD1-CB 3.4Å; D199-S228 PolarHBondContact OD1-OG 3.03Å; D199-S228 PolarHBondContact OD2-OG 3.49Å; D199-T230 WeakPolarHBondContact CB-O 3.4Å; D199-T230 VanDerWaalsContact CG-O 3.29Å; D199-T230 PolarHBondContact OD2-OG1 3.08Å; D199-L231 HydrophobicContact CB-CD2 4.36Å; D199-R349 IonicContact OD2-NH1 3.07Å; D199-R349 PolarHBondContact OD2-NH1 2.91Å
200	K	88.1	Confident	94	Very high	32 Å²	32	40.7 Å²	40.7	14%	0.139	19%	0.188	C	C	.	.	H	α-helix	trans	-71.4	-30.8	-179.8	-70.3	-62.1	172.8	-161	0	114.4	H121 E197 C198 L202 E203	H121-K200 HydrophobicContact CB-CB 4.29Å; E197-K200 PolarHBondContact O-N 2.9Å; C198-K200 PolarHBondContact O-N 3.27Å; K200-L202 VanDerWaalsContact C-N 3.34Å; K200-E203 IonicContact NZ-OE2 2.64Å; K200-E203 PolarHBondContact NZ-OE2 3.37Å
201	M	91.1	Very high	94	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-72.5	-29.7	176.1	-68.8	-169.5	-66.5	0	0	113.1	M119 C120 H121 P173 L195 D196 E197 C198 D199 M207 R208	M119-M201 HydrophobicContact CB-SD 4.23Å; C120-M201 WeakPolarHBondContact CA-SD 3.24Å; H121-M201 HydrophobicContact CB-CG 4.04Å; P173-M201 HydrophobicContact CG-SD 4.01Å; L195-M201 HydrophobicContact CB-CE 3.47Å; L195-M201 VanDerWaalsContact CB-CE 3.47Å; L195-M201 HydrophobicContact CD1-CE 4.27Å; L195-M201 HydrophobicContact CD2-CE 3.84Å; L195-M201 HydrophobicContact CG-CE 4.06Å; D196-M201 WeakPolarHBondContact O-CE 3.48Å; E197-M201 PolarHBondContact O-N 3.17Å; C198-M201 PolarHBondContact O-N 2.78Å; D199-M201 PolarHBondContact O-N 2.91Å; M201-M207 HydrophobicContact CB-CG 4.43Å; M201-M207 HydrophobicContact CB-SD 4.09Å; M201-M207 HydrophobicContact CG-SD 3.81Å; M201-M207 CarbonylContact O-C 3.59Å; M201-R208 PolarHBondContact O-N 3.46Å
202	L	93.9	Very high	93.9	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-103.6	-16.2	-173.1	-60	177.5	0	0	0	113.4	L195 C198 D199 K200 R208 V211 M226 I235 V238 F242	L195-L202 HydrophobicContact CD1-CD1 4.31Å; L195-L202 HydrophobicContact CD1-CD2 4.35Å; L195-L202 HydrophobicContact CD1-CG 4.5Å; C198-L202 HydrophobicContact CB-CD1 4.27Å; C198-L202 VanDerWaalsContact O-CB 3.24Å; C198-L202 WeakPolarHBondContact O-CB 3.39Å; C198-L202 WeakPolarHBondContact O-CG 3.44Å; C198-L202 PolarHBondContact O-N 2.99Å; D199-L202 PolarHBondContact O-N 3.29Å; K200-L202 VanDerWaalsContact C-N 3.34Å; L202-R208 HydrophobicContact CD2-CG 4.21Å; L202-R208 WeakPolarHBondContact O-CD 3.42Å; L202-V211 HydrophobicContact CD2-CB 4.47Å; L202-V211 HydrophobicContact CD2-CG1 4.16Å; L202-M226 HydrophobicContact CD1-CE 4.42Å; L202-M226 HydrophobicContact CD1-SD 4.03Å; L202-I235 HydrophobicContact CB-CD1 3.81Å; L202-I235 HydrophobicContact CB-CG1 4.42Å; L202-V238 HydrophobicContact CB-CG1 4.13Å; L202-V238 HydrophobicContact CD1-CG1 4.32Å; L202-F242 HydrophobicContact CD1-CE2 4.27Å; L202-F242 HydrophobicContact CD2-CE2 3.88Å; L202-F242 HydrophobicContact CD2-CZ 3.97Å
203	E	89.7	Confident	93.9	Very high	119 Å²	119	38.7 Å²	38.7	56%	0.556	18%	0.181	S	C	*	.	H	α-helix	trans	-70.7	-43.4	173.9	-179.8	178.6	-156.7	0	0	111.7	D199 K200 L205	D199-E203 WeakPolarHBondContact O-CB 3.15Å; D199-E203 PolarHBondContact O-N 3.37Å; K200-E203 IonicContact NZ-OE2 2.64Å; K200-E203 PolarHBondContact NZ-OE2 3.37Å; E203-L205 PolarHBondContact O-N 3.32Å
204	Q	87.4	Confident	93.8	Very high	87 Å²	87	38.7 Å²	38.7	41%	0.407	18%	0.181	S	C	.	.	S	Bend	trans	-78.9	120.7	178.9	-62.4	-173.2	-36.1	0	0	110.9	D206 M207 R208	Q204-D206 VanDerWaalsContact C-N 3.34Å; Q204-D206 WeakPolarHBondContact CB-OD1 3.42Å; Q204-D206 PolarHBondContact O-N 3.27Å; Q204-M207 HydrophobicContact CB-CB 4.2Å; Q204-M207 PolarHBondContact O-N 3.1Å; Q204-R208 VanDerWaalsContact O-CB 3.29Å; Q204-R208 WeakPolarHBondContact O-CB 3.21Å; Q204-R208 PolarHBondContact O-N 2.81Å
205	L	90.5	Very high	93.8	Very high	96 Å²	96	40.1 Å²	40.1	50%	0.503	19%	0.187	S	C	.	.	H	α-helix	trans	-58.3	-41.5	-173.6	-178.7	63.8	0	0	0	113.4	E203 R209	E203-L205 PolarHBondContact O-N 3.32Å; L205-R209 VanDerWaalsContact O-CG 3.26Å; L205-R209 WeakPolarHBondContact O-CG 3.17Å; L205-R209 PolarHBondContact O-N 3.02Å
206	D	91.1	Very high	93.8	Very high	109 Å²	109	46.7 Å²	46.7	58%	0.583	21%	0.212	S	C	*	.	H	α-helix	trans	-63.9	-47.8	178.4	61.7	-32.9	0	0	0	111.7	Q204 R209 D210	Q204-D206 VanDerWaalsContact C-N 3.34Å; Q204-D206 WeakPolarHBondContact CB-OD1 3.42Å; Q204-D206 PolarHBondContact O-N 3.27Å; D206-R209 PolarHBondContact O-N 2.92Å; D206-D210 PolarHBondContact O-N 2.69Å
207	M	92.6	Very high	94	Very high	32 Å²	32	49.4 Å²	49.4	16%	0.158	23%	0.225	C	C	.	.	H	α-helix	trans	-67.4	-37.9	177.8	-167.5	168.1	-54.1	0	0	112	H121 P173 M201 Q204 D210 V211	H121-M207 WeakPolarHBondContact ND1-CE 3.13Å; H121-M207 PolarHBondContact ND1-SD 3.38Å; H121-M207 VanDerWaalsContact ND1-SD 3.41Å; P173-M207 HydrophobicContact CB-CG 4.22Å; P173-M207 HydrophobicContact CG-CG 3.97Å; P173-M207 HydrophobicContact CG-SD 4.19Å; M201-M207 HydrophobicContact CB-CG 4.43Å; M201-M207 HydrophobicContact CB-SD 4.09Å; M201-M207 HydrophobicContact CG-SD 3.81Å; M201-M207 CarbonylContact O-C 3.59Å; Q204-M207 HydrophobicContact CB-CB 4.2Å; Q204-M207 PolarHBondContact O-N 3.1Å; M207-D210 WeakPolarHBondContact O-CB 3.22Å; M207-D210 PolarHBondContact O-N 3.01Å; M207-V211 WeakPolarHBondContact O-CG2 3.47Å; M207-V211 PolarHBondContact O-N 3.21Å
208	R	95	Very high	94.3	Very high	55 Å²	55	49.5 Å²	49.5	21%	0.208	23%	0.226	C	C	.	.	H	α-helix	trans	-60.7	-45.1	175.4	-177.6	-177.1	177.1	173.2	-4.5	111.6	M201 L202 Q204 D210 V211 Q212	M201-R208 PolarHBondContact O-N 3.46Å; L202-R208 HydrophobicContact CD2-CG 4.21Å; L202-R208 WeakPolarHBondContact O-CD 3.42Å; Q204-R208 VanDerWaalsContact O-CB 3.29Å; Q204-R208 WeakPolarHBondContact O-CB 3.21Å; Q204-R208 PolarHBondContact O-N 2.81Å; R208-D210 VanDerWaalsContact C-N 3.32Å; R208-D210 PolarHBondContact O-N 3.4Å; R208-V211 PolarHBondContact O-N 2.68Å; R208-Q212 HydrophobicContact CG-CG 4.49Å; R208-Q212 WeakPolarHBondContact O-CG 3.47Å; R208-Q212 PolarHBondContact O-N 2.62Å
209	R	95.9	Very high	94.6	Very high	135 Å²	135	51.4 Å²	51.4	51%	0.509	24%	0.239	S	C	.	.	H	α-helix	trans	-58.6	-44.9	175.9	-76.3	172.5	179	-170.2	-0.6	111.3	L205 D206 V211 Q212 E213	L205-R209 VanDerWaalsContact O-CG 3.26Å; L205-R209 WeakPolarHBondContact O-CG 3.17Å; L205-R209 PolarHBondContact O-N 3.02Å; D206-R209 PolarHBondContact O-N 2.92Å; R209-V211 PolarHBondContact O-N 2.81Å; R209-Q212 PolarHBondContact O-N 3.35Å; R209-E213 PolarHBondContact O-N 3.35Å
210	D	97.2	Very high	94.8	Very high	46 Å²	46	57.6 Å²	57.6	25%	0.246	27%	0.267	C	S	.	.	H	α-helix	trans	-60.1	-46.4	176.4	-78.8	2.2	0	0	0	111.6	P173 L177 D206 M207 R208 E213 I214	P173-D210 HydrophobicContact CB-CB 4.25Å; L177-D210 HydrophobicContact CD2-CB 3.8Å; L177-D210 WeakPolarHBondContact CD2-OD1 3.36Å; D206-D210 PolarHBondContact O-N 2.69Å; M207-D210 WeakPolarHBondContact O-CB 3.22Å; M207-D210 PolarHBondContact O-N 3.01Å; R208-D210 VanDerWaalsContact C-N 3.32Å; R208-D210 PolarHBondContact O-N 3.4Å; D210-E213 PolarHBondContact O-N 3.07Å; D210-I214 WeakPolarHBondContact O-CD1 3.46Å; D210-I214 VanDerWaalsContact O-CG1 3.24Å; D210-I214 WeakPolarHBondContact O-CG1 3.44Å; D210-I214 PolarHBondContact O-N 3.45Å
211	V	97.7	Very high	95.2	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-42.7	178.2	172.7	0	0	0	0	111.8	M119 P173 F193 L195 L202 M207 R208 R209 I214 F215 F242	M119-V211 HydrophobicContact CE-CG1 4.08Å; M119-V211 HydrophobicContact CE-CG2 4.32Å; P173-V211 HydrophobicContact CB-CG2 3.9Å; P173-V211 HydrophobicContact CG-CG2 3.7Å; F193-V211 HydrophobicContact CZ-CG1 4.38Å; L195-V211 HydrophobicContact CD1-CG1 3.94Å; L195-V211 HydrophobicContact CD2-CG1 4.18Å; L202-V211 HydrophobicContact CD2-CB 4.47Å; L202-V211 HydrophobicContact CD2-CG1 4.16Å; M207-V211 WeakPolarHBondContact O-CG2 3.47Å; M207-V211 PolarHBondContact O-N 3.21Å; R208-V211 PolarHBondContact O-N 2.68Å; R209-V211 PolarHBondContact O-N 2.81Å; V211-I214 PolarHBondContact O-N 3.47Å; V211-F215 WeakPolarHBondContact O-CB 3.44Å; V211-F215 PolarHBondContact O-N 2.83Å; V211-F242 HydrophobicContact CG1-CE1 4.15Å; V211-F242 HydrophobicContact CG1-CZ 4.22Å
212	Q	97.1	Very high	95.5	Very high	24 Å²	24	66 Å²	66	11%	0.112	31%	0.306	C	S	.	.	H	α-helix	trans	-63.5	-39.7	177.2	-74.2	176.2	-54.3	0	0	112.2	R208 R209 F215 R216 F242	R208-Q212 HydrophobicContact CG-CG 4.49Å; R208-Q212 WeakPolarHBondContact O-CG 3.47Å; R208-Q212 PolarHBondContact O-N 2.62Å; R209-Q212 PolarHBondContact O-N 3.35Å; Q212-F215 PolarHBondContact O-N 2.85Å; Q212-R216 WeakPolarHBondContact O-CG 3.33Å; Q212-R216 PolarHBondContact O-N 2.87Å; Q212-F242 HydrophobicContact CG-CE1 4.01Å; Q212-F242 HydrophobicContact CG-CZ 3.56Å
213	E	98	Very high	95.8	Very high	46 Å²	46	66.3 Å²	66.3	22%	0.215	31%	0.308	C	S	.	.	H	α-helix	trans	-66	-45.3	175.9	-169.7	176.3	145.5	0	0	111.7	L177 R181 R209 D210 F215 R216 M217	L177-E213 HydrophobicContact CD1-CB 3.99Å; L177-E213 HydrophobicContact CD1-CG 3.86Å; R181-E213 IonicContact CZ-OE1 2.9Å; R181-E213 IonicContact CZ-OE2 3.89Å; R181-E213 IonicContact NE-OE1 3.37Å; R181-E213 PolarHBondContact NE-OE1 3.36Å; R181-E213 IonicContact NE-OE2 3.9Å; R181-E213 VanDerWaalsContact NH2-CD 3.3Å; R181-E213 IonicContact NH2-OE1 2.87Å; R181-E213 PolarHBondContact NH2-OE1 3.46Å; R181-E213 IonicContact NH2-OE2 2.73Å; R181-E213 PolarHBondContact NH2-OE2 2.88Å; R209-E213 PolarHBondContact O-N 3.35Å; D210-E213 PolarHBondContact O-N 3.07Å; E213-F215 VanDerWaalsContact C-N 3.27Å; E213-F215 PolarHBondContact O-N 3.12Å; E213-R216 PolarHBondContact O-N 3.33Å; E213-M217 HydrophobicContact CG-CE 3.83Å; E213-M217 WeakPolarHBondContact O-CG 3.27Å; E213-M217 PolarHBondContact O-N 3.29Å; E213-M217 WeakPolarHBondContact OE1-CE 3.35Å
214	I	98.5	Very high	96.2	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58	-43.6	174	-63.6	163.9	0	0	0	110.4	L117 M119 P173 I176 L177 L187 F193 D210 V211 R216 M217	L117-I214 HydrophobicContact CD2-CG2 3.63Å; M119-I214 HydrophobicContact CE-CB 4.38Å; M119-I214 HydrophobicContact CE-CD1 4.16Å; M119-I214 HydrophobicContact CE-CG2 4.03Å; M119-I214 HydrophobicContact SD-CD1 3.46Å; M119-I214 WeakPolarHBondContact SD-CD1 3.31Å; M119-I214 HydrophobicContact SD-CG2 4.11Å; P173-I214 HydrophobicContact CB-CD1 4.38Å; P173-I214 WeakPolarHBondContact O-CD1 3.47Å; I176-I214 HydrophobicContact CB-CD1 4.01Å; I176-I214 HydrophobicContact CG2-CD1 3.83Å; I176-I214 HydrophobicContact CG2-CG1 4.26Å; I176-I214 HydrophobicContact CG2-CG2 3.95Å; L177-I214 HydrophobicContact CB-CD1 3.91Å; L177-I214 HydrophobicContact CB-CG1 3.87Å; L177-I214 HydrophobicContact CD1-CG1 3.9Å; L177-I214 HydrophobicContact CG-CG1 4.47Å; L187-I214 HydrophobicContact CD1-CG2 3.81Å; F193-I214 HydrophobicContact CE2-CG2 4.16Å; D210-I214 WeakPolarHBondContact O-CD1 3.46Å; D210-I214 VanDerWaalsContact O-CG1 3.24Å; D210-I214 WeakPolarHBondContact O-CG1 3.44Å; D210-I214 PolarHBondContact O-N 3.45Å; V211-I214 PolarHBondContact O-N 3.47Å; I214-R216 PolarHBondContact O-N 2.96Å; I214-M217 WeakPolarHBondContact O-CB 3.28Å; I214-M217 PolarHBondContact O-N 3.24Å; I214-M217 VanDerWaalsContact O-N 3.1Å
215	F	98.3	Very high	96.7	Very high	31 Å²	31	56.7 Å²	56.7	14%	0.136	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-43.6	179.4	-173.2	-95.3	0	0	0	112.1	F193 V211 Q212 E213 M217 T218 K222 V224 F242	F193-F215 AromaticContact CD1-CD2 3.94Å; F193-F215 HydrophobicContact CD1-CD2 3.94Å; F193-F215 HydrophobicContact CD1-CE2 4.28Å; F193-F215 HydrophobicContact CD2-CD2 4.19Å; F193-F215 AromaticContact CE1-CD2 3.76Å; F193-F215 HydrophobicContact CE1-CD2 3.76Å; F193-F215 HydrophobicContact CE1-CE2 4.46Å; F193-F215 HydrophobicContact CE2-CB 4.28Å; F193-F215 HydrophobicContact CE2-CD2 4Å; F193-F215 HydrophobicContact CG-CD2 4.14Å; F193-F215 HydrophobicContact CG-CE2 4.48Å; F193-F215 HydrophobicContact CZ-CB 4.06Å; F193-F215 AromaticContact CZ-CD2 3.78Å; F193-F215 HydrophobicContact CZ-CD2 3.78Å; F193-F215 HydrophobicContact CZ-CG 4.44Å; V211-F215 WeakPolarHBondContact O-CB 3.44Å; V211-F215 PolarHBondContact O-N 2.83Å; Q212-F215 PolarHBondContact O-N 2.85Å; E213-F215 VanDerWaalsContact C-N 3.27Å; E213-F215 PolarHBondContact O-N 3.12Å; F215-M217 PolarHBondContact O-N 3.03Å; F215-T218 PolarHBondContact O-N 2.78Å; F215-T218 VanDerWaalsContact O-N 3.1Å; F215-T218 PolarHBondContact O-OG1 3.46Å; F215-K222 VanDerWaalsContact CZ-NZ 3.3Å; F215-V224 HydrophobicContact CE2-CG2 3.85Å; F215-V224 HydrophobicContact CZ-CG2 4.33Å; F215-F242 HydrophobicContact CB-CD1 4.16Å; F215-F242 HydrophobicContact CB-CE1 3.99Å; F215-F242 HydrophobicContact CD1-CD1 4Å; F215-F242 HydrophobicContact CD1-CE1 4.45Å; F215-F242 AromaticContact CD2-CD1 3.6Å; F215-F242 HydrophobicContact CD2-CD1 3.6Å; F215-F242 HydrophobicContact CD2-CE1 4.26Å; F215-F242 HydrophobicContact CE1-CD1 4.25Å; F215-F242 HydrophobicContact CE2-CB 4.13Å; F215-F242 AromaticContact CE2-CD1 3.85Å; F215-F242 HydrophobicContact CE2-CD1 3.85Å; F215-F242 AromaticContact CG-CD1 3.66Å; F215-F242 HydrophobicContact CG-CD1 3.66Å; F215-F242 HydrophobicContact CG-CE1 4Å; F215-F242 HydrophobicContact CZ-CB 4.24Å; F215-F242 HydrophobicContact CZ-CD1 4.17Å; F215-F242 VanDerWaalsContact CZ-O 3.27Å; F215-F242 WeakPolarHBondContact CZ-O 3.49Å
216	R	97.8	Very high	97.1	Very high	137 Å²	137	52.1 Å²	52.1	52%	0.517	24%	0.239	S	C	.	.	H	α-helix	trans	-64.3	-22.2	175.9	-73.2	-175.3	-72	-174.8	-3.2	113.8	L10 Q212 E213 I214 T218	L10-R216 HydrophobicContact CD1-CG 3.6Å; Q212-R216 WeakPolarHBondContact O-CG 3.33Å; Q212-R216 PolarHBondContact O-N 2.87Å; E213-R216 PolarHBondContact O-N 3.33Å; I214-R216 PolarHBondContact O-N 2.96Å; R216-T218 VanDerWaalsContact C-N 3.25Å; R216-T218 PolarHBondContact O-N 2.97Å
217	M	98.4	Very high	97.3	Very high	63 Å²	63	46.9 Å²	46.9	31%	0.31	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-4.6	175.6	-63.3	-177.2	-176.1	0	0	113.7	L177 A180 R181 L187 E213 I214 F215	L177-M217 HydrophobicContact CD1-CE 4.18Å; A180-M217 HydrophobicContact CB-SD 3.48Å; A180-M217 WeakPolarHBondContact CB-SD 3.42Å; R181-M217 HydrophobicContact CG-CE 3.95Å; L187-M217 HydrophobicContact CB-CB 4.41Å; L187-M217 HydrophobicContact CD1-CB 4.11Å; E213-M217 HydrophobicContact CG-CE 3.83Å; E213-M217 WeakPolarHBondContact O-CG 3.27Å; E213-M217 PolarHBondContact O-N 3.29Å; E213-M217 WeakPolarHBondContact OE1-CE 3.35Å; I214-M217 WeakPolarHBondContact O-CB 3.28Å; I214-M217 PolarHBondContact O-N 3.24Å; I214-M217 VanDerWaalsContact O-N 3.1Å; F215-M217 PolarHBondContact O-N 3.03Å
218	T	98.4	Very high	97.2	Very high	14 Å²	14	45.4 Å²	45.4	9%	0.086	20%	0.204	C	C	.	.	S	Bend	trans	-102.4	161.2	178.6	66.7	0	0	0	0	111.7	L187 I190 F193 F215 R216 K222	L187-T218 HydrophobicContact CB-CG2 4.06Å; L187-T218 HydrophobicContact CD1-CG2 4.48Å; I190-T218 HydrophobicContact CB-CG2 3.96Å; I190-T218 HydrophobicContact CG1-CG2 3.92Å; I190-T218 HydrophobicContact CG2-CG2 4.17Å; F193-T218 HydrophobicContact CD2-CG2 4.17Å; F193-T218 HydrophobicContact CE2-CG2 4.45Å; F215-T218 PolarHBondContact O-N 2.78Å; F215-T218 VanDerWaalsContact O-N 3.1Å; F215-T218 PolarHBondContact O-OG1 3.46Å; R216-T218 VanDerWaalsContact C-N 3.25Å; R216-T218 PolarHBondContact O-N 2.97Å; T218-K222 WeakPolarHBondContact OG1-CD 3.29Å; T218-K222 WeakPolarHBondContact OG1-CE 3.32Å; T218-K222 PolarHBondContact OG1-NZ 3.38Å
219	P	98.2	Very high	96.8	Very high	41 Å²	41	42.9 Å²	42.9	27%	0.266	20%	0.195	S	C	.	.			trans	-55	147.5	172.4	-26.8	36.8	0	0	0	112.8	L187 K188 K222	L187-P219 WeakPolarHBondContact O-CD 3.32Å; K188-P219 WeakPolarHBondContact O-CG 3.37Å; P219-K222 VanDerWaalsContact O-CD 3.27Å; P219-K222 WeakPolarHBondContact O-CD 3.34Å; P219-K222 PolarHBondContact O-NZ 3.46Å
220	H	96.2	Very high	96.2	Very high	142 Å²	142	36.8 Å²	36.8	66%	0.657	17%	0.173	S	C	*	.	S	Bend	trans	-64	-47.2	173.7	-173.4	-79.1	0	0	0	111.1	K222	H220-K222 PolarHBondContact O-N 3.49Å
221	E	96.4	Very high	95.8	Very high	179 Å²	179	34.8 Å²	34.8	84%	0.836	16%	0.162	S	C	*	.	S	Bend	trans	-78.6	100.6	176.1	-64.7	179.2	178.9	0	0	111
222	K	98.1	Very high	95.2	Very high	29 Å²	29	37.3 Å²	37.3	13%	0.126	18%	0.179	C	C	.	.	S	Bend	trans	-160.7	155.5	176.4	59.9	-177.3	-177.9	-70.3	0	109.2	I190 K191 F193 F215 T218 P219 H220 V224	I190-K222 HydrophobicContact CG2-CD 4.26Å; K191-K222 WeakPolarHBondContact O-CA 3.41Å; K191-K222 WeakPolarHBondContact O-CB 3.05Å; F193-K222 HydrophobicContact CB-CD 4.01Å; F215-K222 VanDerWaalsContact CZ-NZ 3.3Å; T218-K222 WeakPolarHBondContact OG1-CD 3.29Å; T218-K222 WeakPolarHBondContact OG1-CE 3.32Å; T218-K222 PolarHBondContact OG1-NZ 3.38Å; P219-K222 VanDerWaalsContact O-CD 3.27Å; P219-K222 WeakPolarHBondContact O-CD 3.34Å; P219-K222 PolarHBondContact O-NZ 3.46Å; H220-K222 PolarHBondContact O-N 3.49Å; K222-V224 HydrophobicContact CG-CG2 4.22Å
223	Q	98.6	Very high	94.8	Very high	8 Å²	8	45 Å²	45	4%	0.037	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	133.4	170.2	-177.5	-176.9	30.9	0	0	109.8	A79 G82 M83 D84 K191 H192 F193 M225	A79-Q223 PolarHBondContact O-NE2 3.46Å; G82-Q223 WeakPolarHBondContact O-CG 3.24Å; M83-Q223 PolarHBondContact O-NE2 3.16Å; D84-Q223 WeakPolarHBondContact OD1-CA 3.38Å; K191-Q223 PolarHBondContact O-N 2.85Å; H192-Q223 WeakPolarHBondContact CA-O 3.32Å; H192-Q223 PolarHBondContact CD2-OE1 3.18Å; F193-Q223 PolarHBondContact N-O 3.29Å; Q223-M225 HydrophobicContact CG-CG 4.14Å
224	V	98.7	Very high	94.3	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.018	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	123.3	176.4	-175.9	0	0	0	0	110	D84 V85 F193 F215 K222 M226 F242 M243	D84-V224 CarbonylContact C-O 3.56Å; D84-V224 WeakPolarHBondContact CA-O 3.25Å; D84-V224 WeakPolarHBondContact CB-O 3.26Å; D84-V224 PolarHBondContact OD1-N 3.36Å; V85-V224 PolarHBondContact N-O 2.63Å; F193-V224 HydrophobicContact CB-CG2 4.36Å; F193-V224 HydrophobicContact CD1-CG1 4.3Å; F193-V224 VanDerWaalsContact O-CA 3.3Å; F193-V224 WeakPolarHBondContact O-CA 3.1Å; F215-V224 HydrophobicContact CE2-CG2 3.85Å; F215-V224 HydrophobicContact CZ-CG2 4.33Å; K222-V224 HydrophobicContact CG-CG2 4.22Å; V224-M226 HydrophobicContact CG1-CE 4.13Å; V224-F242 HydrophobicContact CG1-CB 4.32Å; V224-F242 WeakPolarHBondContact CG2-O 3.24Å; V224-M243 HydrophobicContact CB-CG 4.14Å; V224-M243 HydrophobicContact CG1-CE 4.31Å; V224-M243 HydrophobicContact CG1-CG 3.9Å
225	M	98.6	Very high	93.9	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.5	175	-53	-174	-101.1	0	0	111	A79 V85 F99 A102 T103 F193 I194 L195 Q223 F227	A79-M225 HydrophobicContact CB-SD 3.87Å; V85-M225 HydrophobicContact CB-CB 4.14Å; V85-M225 HydrophobicContact CB-CG 3.95Å; V85-M225 HydrophobicContact CB-SD 4.41Å; V85-M225 HydrophobicContact CG2-CG 4.1Å; V85-M225 HydrophobicContact CG2-SD 4.16Å; V85-M225 CarbonylContact O-C 3.6Å; V85-M225 VanDerWaalsContact O-CA 3.31Å; V85-M225 WeakPolarHBondContact O-CA 3.46Å; F99-M225 HydrophobicContact CB-CE 4.17Å; F99-M225 HydrophobicContact CB-SD 4.43Å; A102-M225 HydrophobicContact CB-CE 4.27Å; T103-M225 HydrophobicContact CG2-CE 3.72Å; F193-M225 PolarHBondContact O-N 3.27Å; I194-M225 CarbonylContact C-O 3.5Å; I194-M225 VanDerWaalsContact CA-O 3.29Å; I194-M225 WeakPolarHBondContact CA-O 3.45Å; I194-M225 HydrophobicContact CD1-CB 3.75Å; I194-M225 HydrophobicContact CD1-CE 3.31Å; I194-M225 HydrophobicContact CD1-CG 3.93Å; I194-M225 HydrophobicContact CD1-SD 4.27Å; I194-M225 HydrophobicContact CG2-CB 4.49Å; L195-M225 PolarHBondContact N-O 2.72Å; Q223-M225 HydrophobicContact CG-CG 4.14Å; M225-F227 HydrophobicContact CB-CD2 4.47Å; M225-F227 HydrophobicContact CB-CE2 3.57Å; M225-F227 HydrophobicContact CB-CZ 4.16Å; M225-F227 HydrophobicContact SD-CE2 4.47Å; M225-F227 HydrophobicContact SD-CZ 4.38Å
226	M	97.9	Very high	93.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	135.7	177.3	-61.9	-170.8	-175.8	0	0	111.4	V85 L86 C87 L195 C198 L202 V224 C239 F242 M243	V85-M226 PolarHBondContact O-N 2.77Å; L86-M226 HydrophobicContact CD1-CB 3.97Å; C87-M226 PolarHBondContact N-O 3.05Å; L195-M226 HydrophobicContact CB-CB 4.49Å; L195-M226 HydrophobicContact CB-CG 3.94Å; L195-M226 HydrophobicContact CD1-CE 3.51Å; L195-M226 HydrophobicContact CD1-CG 4.25Å; L195-M226 HydrophobicContact CD1-SD 3.98Å; L195-M226 HydrophobicContact CG-CE 4.21Å; L195-M226 HydrophobicContact CG-CG 4.26Å; L195-M226 CarbonylContact O-C 3.53Å; L195-M226 VanDerWaalsContact O-CA 3.31Å; L195-M226 WeakPolarHBondContact O-CA 3.47Å; C198-M226 HydrophobicContact CB-CB 4.02Å; C198-M226 HydrophobicContact CB-CG 4.33Å; C198-M226 HydrophobicContact CB-SD 4.17Å; L202-M226 HydrophobicContact CD1-CE 4.42Å; L202-M226 HydrophobicContact CD1-SD 4.03Å; V224-M226 HydrophobicContact CG1-CE 4.13Å; M226-C239 HydrophobicContact SD-CB 3.71Å; M226-F242 HydrophobicContact CE-CB 3.36Å; M226-F242 HydrophobicContact CE-CD1 4.33Å; M226-F242 HydrophobicContact CE-CD2 3.67Å; M226-F242 HydrophobicContact CE-CE2 4.49Å; M226-F242 HydrophobicContact CE-CG 3.55Å; M226-M243 HydrophobicContact CB-CE 3.45Å; M226-M243 VanDerWaalsContact CB-CE 3.45Å; M226-M243 HydrophobicContact CE-CE 4.24Å; M226-M243 HydrophobicContact CG-CE 3.21Å; M226-M243 HydrophobicContact SD-CE 3.72Å
227	F	95.5	Very high	93.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	135.9	-176.6	-62.4	-91.4	0	0	0	110.4	V85 C87 K95 V98 F99 I194 L195 E197 C198 M225	V85-F227 HydrophobicContact CG1-CE1 4.47Å; V85-F227 HydrophobicContact CG1-CZ 4.35Å; C87-F227 HydrophobicContact CB-CD1 3.57Å; C87-F227 HydrophobicContact CB-CE1 3.68Å; C87-F227 HydrophobicContact CB-CG 4.48Å; C87-F227 WeakPolarHBondContact O-CA 3.46Å; K95-F227 HydrophobicContact CB-CD1 4.25Å; K95-F227 HydrophobicContact CD-CB 4.36Å; V98-F227 HydrophobicContact CB-CE1 4.11Å; V98-F227 HydrophobicContact CB-CZ 4.27Å; V98-F227 HydrophobicContact CG1-CE1 3.92Å; V98-F227 HydrophobicContact CG1-CZ 3.88Å; F99-F227 HydrophobicContact CB-CE2 3.71Å; F99-F227 HydrophobicContact CB-CZ 4.08Å; F99-F227 AromaticContact CD1-CD2 3.54Å; F99-F227 HydrophobicContact CD1-CD2 3.54Å; F99-F227 AromaticContact CD1-CE2 3.49Å; F99-F227 HydrophobicContact CD1-CE2 3.49Å; F99-F227 VanDerWaalsContact CD1-CE2 3.49Å; F99-F227 HydrophobicContact CD1-CG 4.17Å; F99-F227 HydrophobicContact CD1-CZ 4.08Å; F99-F227 HydrophobicContact CE1-CD2 4.1Å; F99-F227 HydrophobicContact CE1-CE2 4.47Å; F99-F227 HydrophobicContact CG-CD2 4.43Å; F99-F227 HydrophobicContact CG-CE2 4.03Å; I194-F227 HydrophobicContact CG2-CD2 4.31Å; I194-F227 HydrophobicContact CG2-CE2 4.25Å; L195-F227 PolarHBondContact O-N 2.87Å; E197-F227 WeakPolarHBondContact CA-O 3.39Å; E197-F227 PolarHBondContact N-O 3.49Å; C198-F227 PolarHBondContact N-O 2.62Å; M225-F227 HydrophobicContact CB-CD2 4.47Å; M225-F227 HydrophobicContact CB-CE2 3.57Å; M225-F227 HydrophobicContact CB-CZ 4.16Å; M225-F227 HydrophobicContact SD-CE2 4.47Å; M225-F227 HydrophobicContact SD-CZ 4.38Å
228	S	92.1	Very high	93.1	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	164.3	164.2	-172.7	0	0	0	0	111.8	C87 Q88 A89 D199 T230	C87-S228 PolarHBondContact O-N 3.11Å; C87-S228 VanDerWaalsContact O-N 3.08Å; Q88-S228 WeakPolarHBondContact CA-O 3.48Å; A89-S228 PolarHBondContact N-O 3.09Å; A89-S228 VanDerWaalsContact N-O 3.11Å; D199-S228 WeakPolarHBondContact OD1-CB 3.4Å; D199-S228 PolarHBondContact OD1-OG 3.03Å; D199-S228 PolarHBondContact OD2-OG 3.49Å; S228-T230 PolarHBondContact OG-N 3.16Å; S228-T230 VanDerWaalsContact OG-N 3.15Å; S228-T230 PolarHBondContact OG-O 3.33Å; S228-T230 VanDerWaalsContact OG-O 3.07Å
229	A	85.3	Confident	93	Very high	2 Å²	2	45.3 Å²	45.3	2%	0.017	22%	0.224	C	C	.	.	S	Bend	trans	-80.2	-27.9	165.2	0	0	0	0	0	112.2	A89 S91 L257	A89-A229 VanDerWaalsContact O-CA 3.28Å; A89-A229 WeakPolarHBondContact O-CA 3.23Å; S91-A229 WeakPolarHBondContact OG-CB 3.18Å; A229-L257 WeakPolarHBondContact O-CD2 3.4Å
230	T	83.8	Confident	92.8	Very high	7 Å²	7	48.7 Å²	48.7	4%	0.043	23%	0.232	C	C	.	.			trans	-129.7	115.4	-170.3	40.4	0	0	0	0	107.7	D199 S228 D369 L372	D199-T230 WeakPolarHBondContact CB-O 3.4Å; D199-T230 VanDerWaalsContact CG-O 3.29Å; D199-T230 PolarHBondContact OD2-OG1 3.08Å; S228-T230 PolarHBondContact OG-N 3.16Å; S228-T230 VanDerWaalsContact OG-N 3.15Å; S228-T230 PolarHBondContact OG-O 3.33Å; S228-T230 VanDerWaalsContact OG-O 3.07Å; T230-D369 HydrophobicContact CG2-CB 4.28Å; T230-D369 WeakPolarHBondContact CG2-OD1 3.4Å; T230-L372 HydrophobicContact CG2-CD2 4.34Å
231	L	88.3	Confident	92.7	Very high	4 Å²	4	48.1 Å²	48.1	2%	0.021	23%	0.227	C	C	.	.			trans	-131.4	88.6	176.2	-73.4	-177.6	0	0	0	109.5	L86 Q88 D199 I235 R236 F250	L86-L231 HydrophobicContact CD1-CD1 3.72Å; L86-L231 HydrophobicContact CG-CD1 4.16Å; Q88-L231 HydrophobicContact CB-CB 4.43Å; Q88-L231 HydrophobicContact CB-CD1 4Å; Q88-L231 HydrophobicContact CB-CG 4.35Å; Q88-L231 HydrophobicContact CG-CB 4.25Å; Q88-L231 HydrophobicContact CG-CG 4.4Å; D199-L231 HydrophobicContact CB-CD2 4.36Å; L231-I235 HydrophobicContact CB-CG2 4.3Å; L231-I235 HydrophobicContact CD2-CG2 3.77Å; L231-R236 HydrophobicContact CB-CG 4.28Å; L231-R236 PolarHBondContact O-NE 3.2Å; L231-F250 HydrophobicContact CD1-CE1 4.36Å
232	S	85.7	Confident	92.6	Very high	53 Å²	53	40 Å²	40	37%	0.371	19%	0.189	S	C	.	.			trans	-57.4	157.7	175.1	71.7	0	0	0	0	111.7	E234 I235 R236	S232-E234 PolarHBondContact O-N 3.5Å; S232-E234 VanDerWaalsContact O-N 3.15Å; S232-I235 WeakPolarHBondContact O-CG2 3.26Å; S232-I235 PolarHBondContact O-N 3.12Å; S232-I235 PolarHBondContact OG-N 2.69Å; S232-R236 WeakPolarHBondContact O-CG 3.09Å; S232-R236 PolarHBondContact O-N 3.16Å
233	K	87.2	Confident	92.6	Very high	185 Å²	185	39.7 Å²	39.7	80%	0.804	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-26	177.7	-67.1	-179.8	-178.6	173.6	0	112.7	P237	K233-P237 WeakPolarHBondContact O-CD 3.48Å
234	E	88.8	Confident	92.3	Very high	167 Å²	167	46.4 Å²	46.4	78%	0.78	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-33.5	180	-63.1	174.8	-176.3	0	0	112.7	S232 P237	S232-E234 PolarHBondContact O-N 3.5Å; S232-E234 VanDerWaalsContact O-N 3.15Å; E234-P237 WeakPolarHBondContact O-CD 3.29Å
235	I	90.5	Very high	92	Very high	13 Å²	13	53.3 Å²	53.3	7%	0.067	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-27.3	-178.8	-157.3	65.1	0	0	0	113	L202 L231 S232 V238 C239	L202-I235 HydrophobicContact CB-CD1 3.81Å; L202-I235 HydrophobicContact CB-CG1 4.42Å; L231-I235 HydrophobicContact CB-CG2 4.3Å; L231-I235 HydrophobicContact CD2-CG2 3.77Å; S232-I235 WeakPolarHBondContact O-CG2 3.26Å; S232-I235 PolarHBondContact O-N 3.12Å; S232-I235 PolarHBondContact OG-N 2.69Å; I235-V238 HydrophobicContact CD1-CB 4.17Å; I235-V238 HydrophobicContact CD1-CG1 4.45Å; I235-V238 HydrophobicContact CD1-CG2 4.36Å; I235-V238 WeakPolarHBondContact O-CA 3.44Å; I235-V238 WeakPolarHBondContact O-CB 3.07Å; I235-V238 PolarHBondContact O-N 2.91Å; I235-C239 PolarHBondContact O-N 3.25Å; I235-C239 PolarHBondContact O-SG 3.29Å
236	R	91.8	Very high	91.9	Very high	38 Å²	38	54.4 Å²	54.4	14%	0.143	26%	0.263	C	S	.	.	H	α-helix	trans	-55.3	-47.1	-179.9	-69.8	177.1	-171.9	-162.4	2.4	113.1	L231 S232 V238 C239 R240 F250 D252	L231-R236 HydrophobicContact CB-CG 4.28Å; L231-R236 PolarHBondContact O-NE 3.2Å; S232-R236 WeakPolarHBondContact O-CG 3.09Å; S232-R236 PolarHBondContact O-N 3.16Å; R236-V238 VanDerWaalsContact C-N 3.25Å; R236-V238 PolarHBondContact O-N 3.4Å; R236-C239 PolarHBondContact O-N 3.11Å; R236-R240 WeakPolarHBondContact O-CG 3.48Å; R236-R240 PolarHBondContact O-N 2.83Å; R236-R240 VanDerWaalsContact O-N 3.09Å; R236-F250 HydrophobicContact CG-CE1 4.02Å; R236-F250 HydrophobicContact CG-CZ 4.24Å; R236-F250 VanDerWaalsContact CZ-CG 3.45Å; R236-D252 IonicContact NH1-OD1 3.66Å
237	P	92.6	Very high	91.8	Very high	65 Å²	65	56 Å²	56	42%	0.422	27%	0.271	S	S	.	.	H	α-helix	trans	-59.3	-33.5	174.2	-25.1	34	0	0	0	113.9	K233 E234	K233-P237 WeakPolarHBondContact O-CD 3.48Å; E234-P237 WeakPolarHBondContact O-CD 3.29Å
238	V	93.2	Very high	91.7	Very high	16 Å²	16	59.2 Å²	59.2	10%	0.097	29%	0.286	C	S	.	.	H	α-helix	trans	-67.4	-45.5	177.1	177.7	0	0	0	0	110.6	L202 I235 R236 R240 K241 F242	L202-V238 HydrophobicContact CB-CG1 4.13Å; L202-V238 HydrophobicContact CD1-CG1 4.32Å; I235-V238 HydrophobicContact CD1-CB 4.17Å; I235-V238 HydrophobicContact CD1-CG1 4.45Å; I235-V238 HydrophobicContact CD1-CG2 4.36Å; I235-V238 WeakPolarHBondContact O-CA 3.44Å; I235-V238 WeakPolarHBondContact O-CB 3.07Å; I235-V238 PolarHBondContact O-N 2.91Å; R236-V238 VanDerWaalsContact C-N 3.25Å; R236-V238 PolarHBondContact O-N 3.4Å; V238-R240 VanDerWaalsContact C-N 3.34Å; V238-R240 PolarHBondContact O-N 2.84Å; V238-K241 PolarHBondContact O-N 3.09Å; V238-F242 WeakPolarHBondContact O-CD2 3.36Å
239	C	94.7	Very high	91.7	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.2	-44.2	176.6	-62.6	0	0	0	0	112	L86 M226 I235 R236 K241 F242	L86-C239 HydrophobicContact CD1-CB 3.8Å; L86-C239 HydrophobicContact CD2-CB 4.09Å; M226-C239 HydrophobicContact SD-CB 3.71Å; I235-C239 PolarHBondContact O-N 3.25Å; I235-C239 PolarHBondContact O-SG 3.29Å; R236-C239 PolarHBondContact O-N 3.11Å; C239-K241 PolarHBondContact O-N 3.25Å; C239-K241 VanDerWaalsContact O-N 3.16Å; C239-F242 PolarHBondContact O-N 3.43Å; C239-F242 VanDerWaalsContact O-N 3.08Å
240	R	94	Very high	91.8	Very high	112 Å²	112	62.9 Å²	62.9	42%	0.423	30%	0.303	S	S	.	.	H	α-helix	trans	-57.9	-28.9	180	-73.9	177.9	-177.5	159.5	-1.7	113.8	R236 V238 F242 M243 E248	R236-R240 WeakPolarHBondContact O-CG 3.48Å; R236-R240 PolarHBondContact O-N 2.83Å; R236-R240 VanDerWaalsContact O-N 3.09Å; V238-R240 VanDerWaalsContact C-N 3.34Å; V238-R240 PolarHBondContact O-N 2.84Å; R240-F242 PolarHBondContact O-N 3.46Å; R240-F242 VanDerWaalsContact O-N 3.16Å; R240-M243 PolarHBondContact O-N 3.27Å; R240-M243 VanDerWaalsContact O-N 3.1Å; R240-M243 VanDerWaalsContact O-O 3.12Å; R240-E248 IonicContact CZ-OE1 3.29Å; R240-E248 VanDerWaalsContact CZ-OE1 3.29Å; R240-E248 IonicContact CZ-OE2 3.72Å; R240-E248 IonicContact NE-OE1 2.69Å; R240-E248 PolarHBondContact NE-OE1 3.3Å; R240-E248 IonicContact NE-OE2 3.86Å; R240-E248 VanDerWaalsContact NH2-CD 3.34Å; R240-E248 IonicContact NH2-OE1 3.05Å; R240-E248 PolarHBondContact NH2-OE1 2.98Å; R240-E248 IonicContact NH2-OE2 2.77Å; R240-E248 PolarHBondContact NH2-OE2 3.41Å
241	K	94.3	Very high	91.3	Very high	129 Å²	129	64 Å²	64	56%	0.561	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.3	178.2	-68.4	-176.1	178.4	-170.1	0	114	V238 C239	V238-K241 PolarHBondContact O-N 3.09Å; C239-K241 PolarHBondContact O-N 3.25Å; C239-K241 VanDerWaalsContact O-N 3.16Å
242	F	95.9	Very high	90.2	Very high	10 Å²	10	70.3 Å²	70.3	4%	0.044	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-7.1	177.6	-67.9	-92.8	0	0	0	113.1	L202 V211 Q212 F215 V224 M226 V238 C239 R240	L202-F242 HydrophobicContact CD1-CE2 4.27Å; L202-F242 HydrophobicContact CD2-CE2 3.88Å; L202-F242 HydrophobicContact CD2-CZ 3.97Å; V211-F242 HydrophobicContact CG1-CE1 4.15Å; V211-F242 HydrophobicContact CG1-CZ 4.22Å; Q212-F242 HydrophobicContact CG-CE1 4.01Å; Q212-F242 HydrophobicContact CG-CZ 3.56Å; F215-F242 HydrophobicContact CB-CD1 4.16Å; F215-F242 HydrophobicContact CB-CE1 3.99Å; F215-F242 HydrophobicContact CD1-CD1 4Å; F215-F242 HydrophobicContact CD1-CE1 4.45Å; F215-F242 AromaticContact CD2-CD1 3.6Å; F215-F242 HydrophobicContact CD2-CD1 3.6Å; F215-F242 HydrophobicContact CD2-CE1 4.26Å; F215-F242 HydrophobicContact CE1-CD1 4.25Å; F215-F242 HydrophobicContact CE2-CB 4.13Å; F215-F242 AromaticContact CE2-CD1 3.85Å; F215-F242 HydrophobicContact CE2-CD1 3.85Å; F215-F242 AromaticContact CG-CD1 3.66Å; F215-F242 HydrophobicContact CG-CD1 3.66Å; F215-F242 HydrophobicContact CG-CE1 4Å; F215-F242 HydrophobicContact CZ-CB 4.24Å; F215-F242 HydrophobicContact CZ-CD1 4.17Å; F215-F242 VanDerWaalsContact CZ-O 3.27Å; F215-F242 WeakPolarHBondContact CZ-O 3.49Å; V224-F242 HydrophobicContact CG1-CB 4.32Å; V224-F242 WeakPolarHBondContact CG2-O 3.24Å; M226-F242 HydrophobicContact CE-CB 3.36Å; M226-F242 HydrophobicContact CE-CD1 4.33Å; M226-F242 HydrophobicContact CE-CD2 3.67Å; M226-F242 HydrophobicContact CE-CE2 4.49Å; M226-F242 HydrophobicContact CE-CG 3.55Å; V238-F242 WeakPolarHBondContact O-CD2 3.36Å; C239-F242 PolarHBondContact O-N 3.43Å; C239-F242 VanDerWaalsContact O-N 3.08Å; R240-F242 PolarHBondContact O-N 3.46Å; R240-F242 VanDerWaalsContact O-N 3.16Å
243	M	96.9	Very high	89.4	Confident	22 Å²	22	71 Å²	71	11%	0.108	34%	0.343	C	S	.	.			trans	-122.6	158.9	-167.5	-63.4	175.6	176	0	0	111.7	D84 V85 L86 V224 M226 R240 P246	D84-M243 HydrophobicContact CB-CB 4.23Å; D84-M243 HydrophobicContact CB-CG 4.39Å; D84-M243 WeakPolarHBondContact OD2-CA 3.13Å; D84-M243 WeakPolarHBondContact OD2-CB 3.41Å; V85-M243 WeakPolarHBondContact O-CE 3.42Å; L86-M243 HydrophobicContact CB-CE 4.03Å; L86-M243 HydrophobicContact CB-SD 3.91Å; L86-M243 HydrophobicContact CD1-CE 4.21Å; V224-M243 HydrophobicContact CB-CG 4.14Å; V224-M243 HydrophobicContact CG1-CE 4.31Å; V224-M243 HydrophobicContact CG1-CG 3.9Å; M226-M243 HydrophobicContact CB-CE 3.45Å; M226-M243 VanDerWaalsContact CB-CE 3.45Å; M226-M243 HydrophobicContact CE-CE 4.24Å; M226-M243 HydrophobicContact CG-CE 3.21Å; M226-M243 HydrophobicContact SD-CE 3.72Å; R240-M243 PolarHBondContact O-N 3.27Å; R240-M243 VanDerWaalsContact O-N 3.1Å; R240-M243 VanDerWaalsContact O-O 3.12Å; M243-P246 HydrophobicContact CB-CB 4.07Å; M243-P246 HydrophobicContact CB-CG 3.99Å; M243-P246 HydrophobicContact CG-CB 4.38Å; M243-P246 HydrophobicContact SD-CB 3.49Å; M243-P246 WeakPolarHBondContact SD-CB 3.31Å; M243-P246 HydrophobicContact SD-CG 3.74Å
244	Q	92.6	Very high	88.4	Confident	149 Å²	149	65 Å²	65	70%	0.696	32%	0.318	S	S	*	.	S	Bend	trans	-119.3	108.4	173.8	-173.1	175.2	-6.1	0	0	110.2	D84	D84-Q244 PolarHBondContact OD2-N 3.3Å
245	D	93	Very high	87.1	Confident	148 Å²	148	58.3 Å²	58.3	79%	0.791	29%	0.288	S	S	*	.	S	Bend	trans	46.7	58.9	-179.2	-163.3	32.2	0	0	0	113.4
246	P	96.2	Very high	86	Confident	22 Å²	22	63 Å²	63	14%	0.143	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-69.2	147.6	-173.2	29.8	-35.6	0	0	0	112	D84 M243 E248	D84-P246 HydrophobicContact CB-CB 3.87Å; D84-P246 WeakPolarHBondContact O-CA 3.21Å; M243-P246 HydrophobicContact CB-CB 4.07Å; M243-P246 HydrophobicContact CB-CG 3.99Å; M243-P246 HydrophobicContact CG-CB 4.38Å; M243-P246 HydrophobicContact SD-CB 3.49Å; M243-P246 WeakPolarHBondContact SD-CB 3.31Å; M243-P246 HydrophobicContact SD-CG 3.74Å; P246-E248 HydrophobicContact CG-CG 4.17Å; P246-E248 PolarHBondContact O-N 3.38Å
247	M	95.2	Very high	84.7	Confident	33 Å²	33	61.2 Å²	61.2	16%	0.163	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	116.6	159	-177.6	-167.1	62.9	0	0	108.5	C75 Q78 D84 V85 L86 I249	C75-M247 HydrophobicContact CB-CE 4.43Å; Q78-M247 HydrophobicContact CB-CE 4.21Å; Q78-M247 HydrophobicContact CB-SD 3.67Å; Q78-M247 HydrophobicContact CG-SD 3.49Å; Q78-M247 WeakPolarHBondContact CG-SD 3.27Å; D84-M247 PolarHBondContact O-N 3.06Å; V85-M247 HydrophobicContact CB-CE 4.31Å; V85-M247 HydrophobicContact CG1-CE 3.7Å; V85-M247 HydrophobicContact CG2-CE 3.8Å; L86-M247 PolarHBondContact N-O 3.26Å; M247-I249 HydrophobicContact CE-CD1 3.36Å; M247-I249 HydrophobicContact CE-CG1 4.12Å; M247-I249 HydrophobicContact CG-CG1 4.46Å; M247-I249 HydrophobicContact SD-CD1 3.91Å; M247-I249 HydrophobicContact SD-CG1 4.37Å
248	E	94.3	Very high	83.5	Confident	68 Å²	68	59 Å²	59	32%	0.318	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	117.5	179.4	-56.5	-164.2	137.8	0	0	110.7	L86 R240 P246 F250	L86-E248 HydrophobicContact CB-CG 4.46Å; L86-E248 WeakPolarHBondContact O-CA 3.39Å; R240-E248 IonicContact CZ-OE1 3.29Å; R240-E248 VanDerWaalsContact CZ-OE1 3.29Å; R240-E248 IonicContact CZ-OE2 3.72Å; R240-E248 IonicContact NE-OE1 2.69Å; R240-E248 PolarHBondContact NE-OE1 3.3Å; R240-E248 IonicContact NE-OE2 3.86Å; R240-E248 VanDerWaalsContact NH2-CD 3.34Å; R240-E248 IonicContact NH2-OE1 3.05Å; R240-E248 PolarHBondContact NH2-OE1 2.98Å; R240-E248 IonicContact NH2-OE2 2.77Å; R240-E248 PolarHBondContact NH2-OE2 3.41Å; P246-E248 HydrophobicContact CG-CG 4.17Å; P246-E248 PolarHBondContact O-N 3.38Å; E248-F250 HydrophobicContact CB-CD2 4.12Å; E248-F250 HydrophobicContact CB-CE2 3.51Å; E248-F250 HydrophobicContact CB-CZ 3.75Å; E248-F250 HydrophobicContact CG-CE2 4.12Å; E248-F250 HydrophobicContact CG-CZ 4.08Å; E248-F250 VanDerWaalsContact OE2-CE2 3.23Å; E248-F250 WeakPolarHBondContact OE2-CE2 3.41Å
249	I	90.8	Very high	82.3	Confident	33 Å²	33	58.7 Å²	58.7	17%	0.169	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	111.8	172.3	-66.7	164.3	0	0	0	107	E74 C75 L86 Q88 M247	E74-I249 HydrophobicContact CB-CD1 3.72Å; C75-I249 HydrophobicContact CB-CD1 4.43Å; C75-I249 WeakPolarHBondContact SG-CD1 3.35Å; L86-I249 PolarHBondContact O-N 3.47Å; Q88-I249 PolarHBondContact N-O 3.09Å; M247-I249 HydrophobicContact CE-CD1 3.36Å; M247-I249 HydrophobicContact CE-CG1 4.12Å; M247-I249 HydrophobicContact CG-CG1 4.46Å; M247-I249 HydrophobicContact SD-CD1 3.91Å; M247-I249 HydrophobicContact SD-CG1 4.37Å
250	F	87.3	Confident	81.1	Confident	46 Å²	46	66.7 Å²	66.7	20%	0.202	32%	0.322	C	S	.	.			trans	-117.6	147.2	179	-60.5	-55.1	0	0	0	111.5	L86 Q88 L231 R236 E248	L86-F250 HydrophobicContact CD2-CE1 3.92Å; L86-F250 HydrophobicContact CD2-CZ 3.86Å; L86-F250 HydrophobicContact CG-CE1 4.04Å; L86-F250 HydrophobicContact CG-CZ 4.36Å; Q88-F250 HydrophobicContact CB-CD1 4.26Å; L231-F250 HydrophobicContact CD1-CE1 4.36Å; R236-F250 HydrophobicContact CG-CE1 4.02Å; R236-F250 HydrophobicContact CG-CZ 4.24Å; R236-F250 VanDerWaalsContact CZ-CG 3.45Å; E248-F250 HydrophobicContact CB-CD2 4.12Å; E248-F250 HydrophobicContact CB-CE2 3.51Å; E248-F250 HydrophobicContact CB-CZ 3.75Å; E248-F250 HydrophobicContact CG-CE2 4.12Å; E248-F250 HydrophobicContact CG-CZ 4.08Å; E248-F250 VanDerWaalsContact OE2-CE2 3.23Å; E248-F250 WeakPolarHBondContact OE2-CE2 3.41Å
251	V	74.8	Confident	80.4	Confident	30 Å²	30	62.2 Å²	62.2	18%	0.182	31%	0.311	C	S	.	.			trans	-95.7	90.3	162.1	-177.8	0	0	0	0	105.4	D253 K256 L257	V251-D253 VanDerWaalsContact CG1-O 3.28Å; V251-D253 WeakPolarHBondContact CG1-O 3.41Å; V251-D253 PolarHBondContact O-N 3.24Å; V251-K256 HydrophobicContact CG1-CB 3.71Å; V251-L257 HydrophobicContact CB-CD2 3.86Å; V251-L257 HydrophobicContact CB-CG 4.47Å; V251-L257 HydrophobicContact CG1-CD2 3.9Å; V251-L257 HydrophobicContact CG1-CG 4.09Å; V251-L257 HydrophobicContact CG2-CD2 4.06Å
252	D	63.8	Low	80	Confident	137 Å²	137	56.7 Å²	56.7	73%	0.733	29%	0.287	S	S	*	.			trans	-65.7	-23.4	-175.7	-73	-29.9	0	0	0	113.1	R236	R236-D252 IonicContact NH1-OD1 3.66Å
253	D	68.7	Low	79.7	Confident	67 Å²	67	59.1 Å²	59.1	36%	0.358	30%	0.299	S	S	.	.	S	Bend	trans	-106.6	98.9	179.5	-176	0.8	0	0	0	108.8	V251 T255 K256	V251-D253 VanDerWaalsContact CG1-O 3.28Å; V251-D253 WeakPolarHBondContact CG1-O 3.41Å; V251-D253 PolarHBondContact O-N 3.24Å; D253-T255 PolarHBondContact O-N 3.46Å; D253-T255 VanDerWaalsContact OD1-CB 3.31Å; D253-T255 WeakPolarHBondContact OD1-CB 3.45Å; D253-T255 WeakPolarHBondContact OD1-CG2 3.17Å; D253-T255 PolarHBondContact OD1-N 2.99Å; D253-T255 PolarHBondContact OD1-OG1 3.17Å; D253-T255 PolarHBondContact OD2-OG1 3.21Å; D253-T255 VanDerWaalsContact OD2-OG1 3.1Å; D253-K256 HydrophobicContact CB-CD 4.07Å; D253-K256 HydrophobicContact CB-CG 4.12Å; D253-K256 VanDerWaalsContact O-CB 3.32Å; D253-K256 WeakPolarHBondContact O-CB 3.49Å; D253-K256 PolarHBondContact O-N 3.05Å; D253-K256 WeakPolarHBondContact OD2-CE 3.32Å
254	E	66.6	Low	79.6	Confident	61 Å²	61	59.3 Å²	59.3	29%	0.285	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-57	-23	-176	-67	-164.8	170.7	0	0	112.6	K256 L257 R406	E254-K256 PolarHBondContact O-N 3.08Å; E254-L257 HydrophobicContact CB-CD1 4.13Å; E254-L257 HydrophobicContact CG-CD1 4.21Å; E254-L257 WeakPolarHBondContact O-CB 3.43Å; E254-L257 WeakPolarHBondContact O-CG 3.43Å; E254-L257 PolarHBondContact O-N 2.79Å; E254-R406 IonicContact OE1-NH2 2.79Å; E254-R406 WeakPolarHBondContact OE2-CG 3.4Å; E254-R406 IonicContact OE2-CZ 3.5Å; E254-R406 IonicContact OE2-NE 3.55Å; E254-R406 PolarHBondContact OE2-NE 3.15Å; E254-R406 IonicContact OE2-NH2 3.86Å
255	T	62.1	Low	79.8	Confident	25 Å²	25	53.9 Å²	53.9	15%	0.153	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-57.8	-33	173.9	73.4	0	0	0	0	112	D253 L257 T258 F407 E408	D253-T255 PolarHBondContact O-N 3.46Å; D253-T255 VanDerWaalsContact OD1-CB 3.31Å; D253-T255 WeakPolarHBondContact OD1-CB 3.45Å; D253-T255 WeakPolarHBondContact OD1-CG2 3.17Å; D253-T255 PolarHBondContact OD1-N 2.99Å; D253-T255 PolarHBondContact OD1-OG1 3.17Å; D253-T255 PolarHBondContact OD2-OG1 3.21Å; D253-T255 VanDerWaalsContact OD2-OG1 3.1Å; T255-L257 PolarHBondContact O-N 2.79Å; T255-T258 PolarHBondContact O-N 2.92Å; T255-T258 PolarHBondContact O-OG1 3.07Å; T255-F407 WeakPolarHBondContact CA-O 3.2Å; T255-E408 HydrophobicContact CG2-CB 3.55Å; T255-E408 HydrophobicContact CG2-CG 3.41Å; T255-E408 VanDerWaalsContact CG2-CG 3.41Å; T255-E408 WeakPolarHBondContact CG2-OE2 3.5Å
256	K	66.7	Low	80	Confident	111 Å²	111	48.3 Å²	48.3	48%	0.483	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-76.9	0.1	175.8	-59.3	-179	-173.9	174.8	0	112.5	K90 V251 D253 E254 T258	K90-K256 WeakPolarHBondContact CD-O 3.44Å; K90-K256 WeakPolarHBondContact CE-O 3.42Å; K90-K256 PolarHBondContact NZ-O 2.91Å; V251-K256 HydrophobicContact CG1-CB 3.71Å; D253-K256 HydrophobicContact CB-CD 4.07Å; D253-K256 HydrophobicContact CB-CG 4.12Å; D253-K256 VanDerWaalsContact O-CB 3.32Å; D253-K256 WeakPolarHBondContact O-CB 3.49Å; D253-K256 PolarHBondContact O-N 3.05Å; D253-K256 WeakPolarHBondContact OD2-CE 3.32Å; E254-K256 PolarHBondContact O-N 3.08Å; K256-T258 VanDerWaalsContact C-N 3.26Å
257	L	66.1	Low	80.1	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.01	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-78.7	-12.2	173.3	-65.4	170.8	0	0	0	113	A229 V251 E254 T255 L372 F407	A229-L257 WeakPolarHBondContact O-CD2 3.4Å; V251-L257 HydrophobicContact CB-CD2 3.86Å; V251-L257 HydrophobicContact CB-CG 4.47Å; V251-L257 HydrophobicContact CG1-CD2 3.9Å; V251-L257 HydrophobicContact CG1-CG 4.09Å; V251-L257 HydrophobicContact CG2-CD2 4.06Å; E254-L257 HydrophobicContact CB-CD1 4.13Å; E254-L257 HydrophobicContact CG-CD1 4.21Å; E254-L257 WeakPolarHBondContact O-CB 3.43Å; E254-L257 WeakPolarHBondContact O-CG 3.43Å; E254-L257 PolarHBondContact O-N 2.79Å; T255-L257 PolarHBondContact O-N 2.79Å; L257-L372 HydrophobicContact CB-CD2 4.04Å; L257-F407 HydrophobicContact CD1-CE1 4.38Å
258	T	67.4	Low	80.3	Confident	17 Å²	17	52.4 Å²	52.4	10%	0.104	26%	0.257	C	S	.	.	S	Bend	trans	-77.9	150.6	-179.2	61.9	0	0	0	0	112.3	K90 T255 K256 F407 V409	K90-T258 WeakPolarHBondContact CD-O 3.48Å; K90-T258 PolarHBondContact NZ-O 3.16Å; T255-T258 PolarHBondContact O-N 2.92Å; T255-T258 PolarHBondContact O-OG1 3.07Å; K256-T258 VanDerWaalsContact C-N 3.26Å; T258-F407 HydrophobicContact CG2-CB 3.57Å; T258-F407 HydrophobicContact CG2-CG 4.32Å; T258-V409 HydrophobicContact CG2-CG1 3.3Å
259	L	67.1	Low	80.4	Confident	11 Å²	11	50.1 Å²	50.1	6%	0.058	25%	0.247	C	C	.	.			trans	-90.9	112.8	177.2	-67.1	169.2	0	0	0	108.9	K90 M93 G261 L262 A376	K90-L259 HydrophobicContact CD-CD2 4.45Å; M93-L259 HydrophobicContact CE-CD2 4.15Å; L259-G261 PolarHBondContact O-N 2.77Å; L259-L262 HydrophobicContact CB-CB 3.94Å; L259-L262 WeakPolarHBondContact O-CB 3.4Å; L259-L262 PolarHBondContact O-N 2.97Å; L259-A376 HydrophobicContact CD1-CB 3.78Å
260	H	70.3	Confident	80.8	Confident	167 Å²	167	55.1 Å²	55.1	77%	0.773	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.9	-177.5	-66.1	-63.4	0	0	0	114.3
261	G	77.6	Confident	81.2	Confident	19 Å²	19	56.1 Å²	56.1	20%	0.196	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-3.2	177.2	0	0	0	0	0	115.1	L259 K384 G385	L259-G261 PolarHBondContact O-N 2.77Å; G261-K384 WeakPolarHBondContact O-CA 3.48Å; G261-G385 PolarHBondContact O-N 3.33Å
262	L	85.9	Confident	82.2	Confident	13 Å²	13	60.9 Å²	60.9	7%	0.068	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	112.1	-176.2	-176.7	61.9	0	0	0	110.3	L259 Q264 V375 A378 A387	L259-L262 HydrophobicContact CB-CB 3.94Å; L259-L262 WeakPolarHBondContact O-CB 3.4Å; L259-L262 PolarHBondContact O-N 2.97Å; L262-Q264 HydrophobicContact CD2-CG 4.2Å; L262-Q264 HydrophobicContact CG-CG 3.89Å; L262-V375 HydrophobicContact CD2-CB 3.88Å; L262-V375 HydrophobicContact CD2-CG2 3.71Å; L262-A378 HydrophobicContact CD1-CB 4.01Å; L262-A387 HydrophobicContact CD1-CB 4.28Å
263	Q	91	Very high	83.8	Confident	61 Å²	61	58.8 Å²	58.8	29%	0.285	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	131.3	170.1	-60.9	-58	-56.4	0	0	109.1	Y265 G385 L386 A387	Q263-Y265 HydrophobicContact CB-CE2 3.97Å; Q263-G385 PolarHBondContact N-O 3.25Å; Q263-L386 HydrophobicContact CB-CD1 3.94Å; Q263-L386 CarbonylContact O-C 3.48Å; Q263-L386 WeakPolarHBondContact O-CA 3.47Å; Q263-A387 PolarHBondContact O-N 2.99Å
264	Q	94.1	Very high	85.2	Confident	26 Å²	26	55.8 Å²	55.8	12%	0.121	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.1	-174.6	-58.8	-177	91.6	0	0	110	L262 Y371 A387 I411	L262-Q264 HydrophobicContact CD2-CG 4.2Å; L262-Q264 HydrophobicContact CG-CG 3.89Å; Q264-Y371 VanDerWaalsContact OE1-CE1 3.3Å; Q264-Y371 PolarHBondContact OE1-OH 3.42Å; Q264-A387 WeakPolarHBondContact CA-O 3.49Å; Q264-A387 HydrophobicContact CG-CB 4.19Å; Q264-I411 HydrophobicContact CB-CG1 4.08Å; Q264-I411 HydrophobicContact CB-CG2 4.29Å
265	Y	96.8	Very high	86.7	Confident	35 Å²	35	55.8 Å²	55.8	14%	0.137	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	159.2	178	-59.2	-76.9	0	0	0	111.8	Q263 L386 A387 I388 T389 S412 L414 P415 I418	Q263-Y265 HydrophobicContact CB-CE2 3.97Å; Y265-L386 HydrophobicContact CD2-CD1 3.59Å; Y265-L386 HydrophobicContact CE2-CD1 3.82Å; Y265-A387 PolarHBondContact N-O 2.91Å; Y265-I388 CarbonylContact O-C 3.58Å; Y265-I388 WeakPolarHBondContact O-CA 3.07Å; Y265-T389 PolarHBondContact O-N 2.9Å; Y265-S412 CarbonylContact C-O 3.54Å; Y265-S412 WeakPolarHBondContact CA-O 3.24Å; Y265-L414 HydrophobicContact CD2-CD1 3.95Å; Y265-L414 HydrophobicContact CG-CD1 3.84Å; Y265-P415 HydrophobicContact CE1-CG 4.11Å; Y265-I418 HydrophobicContact CD2-CD1 3.9Å; Y265-I418 HydrophobicContact CE2-CD1 3.75Å; Y265-I418 HydrophobicContact CE2-CG1 4.31Å
266	Y	98	Very high	88.4	Confident	31 Å²	31	63.5 Å²	63.5	12%	0.122	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	158.7	167.8	76.1	-100	0	0	0	111.8	K268 T389 V391 L400 I411 S412 E413 L414	Y266-K268 HydrophobicContact CD2-CG 4.03Å; Y266-K268 HydrophobicContact CE2-CD 3.84Å; Y266-K268 VanDerWaalsContact CE2-CE 3.48Å; Y266-K268 HydrophobicContact CE2-CG 3.73Å; Y266-K268 PolarHBondContact OH-NZ 2.71Å; Y266-T389 CarbonylContact C-O 3.42Å; Y266-T389 WeakPolarHBondContact CA-O 3.47Å; Y266-V391 HydrophobicContact CD2-CG2 4.36Å; Y266-V391 HydrophobicContact CG-CG2 4.45Å; Y266-L400 HydrophobicContact CD1-CD2 3.61Å; Y266-L400 HydrophobicContact CD2-CD2 4.48Å; Y266-L400 HydrophobicContact CE1-CD2 4.43Å; Y266-L400 HydrophobicContact CG-CD2 3.64Å; Y266-I411 HydrophobicContact CD1-CG2 4.15Å; Y266-I411 WeakPolarHBondContact CD1-O 3.06Å; Y266-I411 VanDerWaalsContact CE1-O 3.23Å; Y266-I411 WeakPolarHBondContact CE1-O 3.18Å; Y266-S412 PolarHBondContact N-O 3.37Å; Y266-E413 HydrophobicContact CD2-CG 4.36Å; Y266-E413 HydrophobicContact CE1-CB 4.21Å; Y266-E413 HydrophobicContact CE2-CB 3.88Å; Y266-E413 HydrophobicContact CE2-CG 3.66Å; Y266-E413 WeakPolarHBondContact CE2-OE2 3.49Å; Y266-E413 WeakPolarHBondContact O-CA 3.31Å; Y266-E413 PolarHBondContact OH-OE2 3.32Å; Y266-L414 PolarHBondContact O-N 3.48Å
267	V	98.2	Very high	89.9	Confident	17 Å²	17	61.4 Å²	61.4	10%	0.103	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.8	167.5	-170.2	0	0	0	0	107.9	L269 K277 I388 T389 F390 V391 L414	V267-L269 HydrophobicContact CB-CD2 3.69Å; V267-L269 HydrophobicContact CG1-CD2 3.63Å; V267-L269 WeakPolarHBondContact O-CD2 3.13Å; V267-K277 HydrophobicContact CG1-CG 4.24Å; V267-I388 HydrophobicContact CG2-CG2 4.07Å; V267-T389 PolarHBondContact N-O 2.86Å; V267-F390 HydrophobicContact CB-CD1 4.08Å; V267-F390 HydrophobicContact CB-CE1 4.31Å; V267-F390 HydrophobicContact CG2-CD1 4.34Å; V267-F390 HydrophobicContact CG2-CE1 4.22Å; V267-V391 PolarHBondContact O-N 2.88Å; V267-L414 HydrophobicContact CG2-CB 3.71Å; V267-L414 HydrophobicContact CG2-CD2 3.75Å; V267-L414 HydrophobicContact CG2-CG 4.31Å
268	K	97.9	Very high	91.4	Very high	124 Å²	124	61.3 Å²	61.3	54%	0.539	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.5	171.4	-75	166.5	-175.3	160.8	0	109.5	Y266 V391 E413	Y266-K268 HydrophobicContact CD2-CG 4.03Å; Y266-K268 HydrophobicContact CE2-CD 3.84Å; Y266-K268 VanDerWaalsContact CE2-CE 3.48Å; Y266-K268 HydrophobicContact CE2-CG 3.73Å; Y266-K268 PolarHBondContact OH-NZ 2.71Å; K268-V391 WeakPolarHBondContact CA-O 3.47Å; K268-V391 HydrophobicContact CG-CB 4.33Å; K268-V391 HydrophobicContact CG-CG1 4.46Å; K268-E413 IonicContact NZ-OE2 3.23Å
269	L	98.1	Very high	92.8	Very high	19 Å²	19	61.9 Å²	61.9	10%	0.099	29%	0.288	C	S	.	.			trans	-163.2	153.6	-177.5	63.7	157	0	0	0	111.6	V267 E273 K274 K277 F390 V391 S392	V267-L269 HydrophobicContact CB-CD2 3.69Å; V267-L269 HydrophobicContact CG1-CD2 3.63Å; V267-L269 WeakPolarHBondContact O-CD2 3.13Å; L269-E273 HydrophobicContact CB-CB 4.17Å; L269-E273 HydrophobicContact CD1-CB 4.06Å; L269-K274 VanDerWaalsContact CD1-CA 3.4Å; L269-K274 HydrophobicContact CD1-CB 4.11Å; L269-K274 HydrophobicContact CD1-CG 3.71Å; L269-K274 HydrophobicContact CG-CG 4.19Å; L269-K277 HydrophobicContact CD1-CB 3.8Å; L269-K277 HydrophobicContact CD1-CG 4.27Å; L269-F390 HydrophobicContact CD1-CD2 4.37Å; L269-F390 HydrophobicContact CD1-CE2 4.46Å; L269-F390 HydrophobicContact CD2-CB 3.92Å; L269-F390 HydrophobicContact CD2-CD1 3.78Å; L269-F390 HydrophobicContact CD2-CD2 4.42Å; L269-F390 HydrophobicContact CD2-CE1 4.38Å; L269-F390 HydrophobicContact CD2-CG 3.8Å; L269-V391 PolarHBondContact N-O 3.2Å; L269-S392 WeakPolarHBondContact O-CA 3.48Å; L269-S392 WeakPolarHBondContact O-CB 3.27Å; L269-S392 PolarHBondContact O-OG 3.18Å
270	K	97.4	Very high	94.2	Very high	139 Å²	139	64.9 Å²	64.9	60%	0.604	31%	0.305	S	S	*	.			trans	-71.4	156	174.5	-64.5	176	-179.3	174.3	0	111	N272 E273 K274	K270-N272 WeakPolarHBondContact CB-OD1 3.46Å; K270-N272 PolarHBondContact O-N 3.18Å; K270-N272 VanDerWaalsContact O-N 3.13Å; K270-E273 HydrophobicContact CB-CG 4.33Å; K270-E273 WeakPolarHBondContact CB-OE2 3.02Å; K270-E273 PolarHBondContact N-OE2 3.25Å; K270-E273 WeakPolarHBondContact O-CB 3.3Å; K270-E273 PolarHBondContact O-N 2.85Å; K270-K274 PolarHBondContact O-N 3.41Å
271	D	95.8	Very high	95.5	Very high	67 Å²	67	57.4 Å²	57.4	36%	0.358	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-57.7	-33.2	-178.1	-161.9	67.2	0	0	0	112.7	E273 K274 R299	D271-E273 VanDerWaalsContact C-N 3.26Å; D271-E273 PolarHBondContact O-N 3.11Å; D271-K274 WeakPolarHBondContact O-CB 3.4Å; D271-K274 PolarHBondContact O-N 3.13Å; D271-K274 WeakPolarHBondContact OD1-CD 3.19Å; D271-K274 VanDerWaalsContact OD1-CE 3.31Å; D271-K274 WeakPolarHBondContact OD1-CE 3.37Å; D271-K274 IonicContact OD1-NZ 3.51Å; D271-K274 PolarHBondContact OD1-NZ 2.83Å; D271-R299 IonicContact OD1-CZ 3.65Å; D271-R299 IonicContact OD1-NH1 3.71Å; D271-R299 IonicContact OD1-NH2 2.75Å; D271-R299 PolarHBondContact OD1-NH2 2.84Å; D271-R299 IonicContact OD2-CZ 3.67Å; D271-R299 IonicContact OD2-NH1 2.96Å; D271-R299 PolarHBondContact OD2-NH1 3.38Å; D271-R299 IonicContact OD2-NH2 3.41Å; D271-R299 PolarHBondContact OD2-NH2 2.85Å
272	N	96.4	Very high	96.4	Very high	130 Å²	130	56.8 Å²	56.8	70%	0.695	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-73.4	-13.4	177.7	67.6	-37.2	0	0	0	114.1	K270	K270-N272 WeakPolarHBondContact CB-OD1 3.46Å; K270-N272 PolarHBondContact O-N 3.18Å; K270-N272 VanDerWaalsContact O-N 3.13Å
273	E	97.7	Very high	96.7	Very high	93 Å²	93	61.8 Å²	61.8	44%	0.435	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-93.1	-15.6	177.4	-64.4	169.4	150.2	0	0	111.8	L269 K270 D271 N275 R276 K277	L269-E273 HydrophobicContact CB-CB 4.17Å; L269-E273 HydrophobicContact CD1-CB 4.06Å; K270-E273 HydrophobicContact CB-CG 4.33Å; K270-E273 WeakPolarHBondContact CB-OE2 3.02Å; K270-E273 PolarHBondContact N-OE2 3.25Å; K270-E273 WeakPolarHBondContact O-CB 3.3Å; K270-E273 PolarHBondContact O-N 2.85Å; D271-E273 VanDerWaalsContact C-N 3.26Å; D271-E273 PolarHBondContact O-N 3.11Å; E273-N275 PolarHBondContact O-N 3.07Å; E273-R276 PolarHBondContact O-N 3.43Å; E273-K277 PolarHBondContact O-N 3.46Å
274	K	98.2	Very high	96.9	Very high	4 Å²	4	64.2 Å²	64.2	2%	0.017	31%	0.308	C	S	.	.	H	α-helix	trans	-59	-44.6	-172.4	-71.6	-174	178.7	-174.1	0	114	L269 K270 D271 R276 K277 L278 Y362 D363 F390 S392	L269-K274 VanDerWaalsContact CD1-CA 3.4Å; L269-K274 HydrophobicContact CD1-CB 4.11Å; L269-K274 HydrophobicContact CD1-CG 3.71Å; L269-K274 HydrophobicContact CG-CG 4.19Å; K270-K274 PolarHBondContact O-N 3.41Å; D271-K274 WeakPolarHBondContact O-CB 3.4Å; D271-K274 PolarHBondContact O-N 3.13Å; D271-K274 WeakPolarHBondContact OD1-CD 3.19Å; D271-K274 VanDerWaalsContact OD1-CE 3.31Å; D271-K274 WeakPolarHBondContact OD1-CE 3.37Å; D271-K274 IonicContact OD1-NZ 3.51Å; D271-K274 PolarHBondContact OD1-NZ 2.83Å; K274-R276 PolarHBondContact O-N 3.48Å; K274-K277 PolarHBondContact O-N 2.92Å; K274-L278 VanDerWaalsContact O-CB 3.27Å; K274-L278 WeakPolarHBondContact O-CB 3.39Å; K274-L278 PolarHBondContact O-N 3.37Å; K274-Y362 HydrophobicContact CB-CD2 4.4Å; K274-Y362 HydrophobicContact CB-CE1 4.23Å; K274-Y362 HydrophobicContact CB-CE2 3.56Å; K274-Y362 VanDerWaalsContact CB-CZ 3.42Å; K274-Y362 WeakPolarHBondContact CB-OH 3.33Å; K274-Y362 HydrophobicContact CD-CD1 4.19Å; K274-Y362 HydrophobicContact CD-CE1 3.8Å; K274-Y362 HydrophobicContact CD-CE2 4.37Å; K274-Y362 WeakPolarHBondContact CD-O 3.41Å; K274-Y362 WeakPolarHBondContact CE-O 3.49Å; K274-Y362 PolarHBondContact NZ-O 3.36Å; K274-D363 IonicContact NZ-OD1 2.63Å; K274-D363 PolarHBondContact NZ-OD1 3.46Å; K274-D363 VanDerWaalsContact NZ-OD1 3.15Å; K274-F390 HydrophobicContact CB-CD2 3.9Å; K274-F390 HydrophobicContact CB-CE2 4.02Å; K274-F390 HydrophobicContact CD-CB 4.46Å; K274-F390 HydrophobicContact CD-CD2 3.96Å; K274-F390 HydrophobicContact CG-CD2 3.67Å; K274-F390 HydrophobicContact CG-CE2 4.27Å; K274-F390 HydrophobicContact CG-CG 4.46Å; K274-F390 WeakPolarHBondContact O-CE2 3.45Å; K274-S392 WeakPolarHBondContact CE-OG 3.35Å
275	N	97.8	Very high	96.9	Very high	60 Å²	60	63.7 Å²	63.7	32%	0.321	31%	0.306	S	S	.	.	H	α-helix	trans	-57.9	-52.7	178.2	-75	-25.4	0	0	0	110.5	E273 K277 L278 F279 L306 Y362	E273-N275 PolarHBondContact O-N 3.07Å; N275-K277 PolarHBondContact O-N 3.41Å; N275-L278 PolarHBondContact O-N 2.95Å; N275-F279 WeakPolarHBondContact O-CD2 3.43Å; N275-F279 PolarHBondContact O-N 3.22Å; N275-L306 HydrophobicContact CB-CD2 4.17Å; N275-Y362 PolarHBondContact OD1-OH 2.79Å
276	R	97.4	Very high	96.7	Very high	187 Å²	187	67.5 Å²	67.5	71%	0.706	33%	0.325	S	S	*	.	H	α-helix	trans	-57.5	-50.4	-179.9	-178.9	178.9	178.6	172.8	1.6	111	E273 K274 L278 F279 D280	E273-R276 PolarHBondContact O-N 3.43Å; K274-R276 PolarHBondContact O-N 3.48Å; R276-L278 VanDerWaalsContact C-N 3.32Å; R276-L278 PolarHBondContact O-N 3.18Å; R276-F279 PolarHBondContact O-N 2.86Å; R276-D280 VanDerWaalsContact O-CG 3.22Å; R276-D280 PolarHBondContact O-N 3.36Å
277	K	97.8	Very high	96.4	Very high	67 Å²	67	66.8 Å²	66.8	29%	0.291	32%	0.322	S	S	.	.	H	α-helix	trans	-63.3	-38.3	-179.3	-173.3	58.4	175.1	176.3	0	112.2	V267 L269 E273 K274 N275 L281 F390	V267-K277 HydrophobicContact CG1-CG 4.24Å; L269-K277 HydrophobicContact CD1-CB 3.8Å; L269-K277 HydrophobicContact CD1-CG 4.27Å; E273-K277 PolarHBondContact O-N 3.46Å; K274-K277 PolarHBondContact O-N 2.92Å; N275-K277 PolarHBondContact O-N 3.41Å; K277-L281 HydrophobicContact CD-CD1 4.41Å; K277-L281 HydrophobicContact CD-CG 4.36Å; K277-L281 HydrophobicContact CG-CD1 4.13Å; K277-L281 WeakPolarHBondContact O-CB 3.3Å; K277-L281 WeakPolarHBondContact O-CG 3.49Å; K277-L281 PolarHBondContact O-N 2.99Å; K277-F390 HydrophobicContact CB-CZ 4.2Å; K277-F390 HydrophobicContact CG-CE1 4.15Å; K277-F390 HydrophobicContact CG-CZ 4.06Å
278	L	98.2	Very high	96.1	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-62.1	-46.1	175.1	176.6	68.7	0	0	0	111.5	K274 N275 R276 L281 L282 I292 L303 L307 F360 Y362 F390	K274-L278 VanDerWaalsContact O-CB 3.27Å; K274-L278 WeakPolarHBondContact O-CB 3.39Å; K274-L278 PolarHBondContact O-N 3.37Å; N275-L278 PolarHBondContact O-N 2.95Å; R276-L278 VanDerWaalsContact C-N 3.32Å; R276-L278 PolarHBondContact O-N 3.18Å; L278-L281 PolarHBondContact O-N 2.77Å; L278-L282 HydrophobicContact CD1-CD1 4.21Å; L278-L282 HydrophobicContact CD1-CG 4.21Å; L278-L282 HydrophobicContact CG-CD1 4Å; L278-L282 HydrophobicContact CG-CG 4.37Å; L278-L282 WeakPolarHBondContact O-CG 3.26Å; L278-L282 PolarHBondContact O-N 2.95Å; L278-I292 HydrophobicContact CD1-CD1 4.04Å; L278-I292 HydrophobicContact CD2-CD1 3.96Å; L278-L303 HydrophobicContact CD2-CD1 3.87Å; L278-L303 HydrophobicContact CD2-CD2 4.2Å; L278-L303 HydrophobicContact CD2-CG 4.46Å; L278-L307 HydrophobicContact CD2-CD2 4.47Å; L278-F360 HydrophobicContact CD1-CD1 4.04Å; L278-F360 HydrophobicContact CD1-CD2 4.07Å; L278-F360 HydrophobicContact CD1-CE1 4.15Å; L278-F360 HydrophobicContact CD1-CE2 4.17Å; L278-F360 HydrophobicContact CD1-CG 4Å; L278-F360 HydrophobicContact CD1-CZ 4.21Å; L278-Y362 HydrophobicContact CB-CD2 4.48Å; L278-Y362 HydrophobicContact CB-CE2 4.4Å; L278-Y362 HydrophobicContact CD2-CD2 3.92Å; L278-Y362 HydrophobicContact CD2-CE2 4.06Å; L278-F390 HydrophobicContact CB-CE2 4.1Å; L278-F390 HydrophobicContact CB-CZ 4.15Å
279	F	97.3	Very high	95.8	Very high	29 Å²	29	63.9 Å²	63.9	13%	0.127	31%	0.313	C	S	.	.	H	α-helix	trans	-60.8	-49	177	-79.3	-67.7	0	0	0	111.5	N275 R276 L281 L282 D283 L306 L307 Q310 F312	N275-F279 WeakPolarHBondContact O-CD2 3.43Å; N275-F279 PolarHBondContact O-N 3.22Å; R276-F279 PolarHBondContact O-N 2.86Å; F279-L281 PolarHBondContact O-N 2.85Å; F279-L282 PolarHBondContact O-N 3.4Å; F279-D283 PolarHBondContact O-N 3.45Å; F279-L306 HydrophobicContact CE2-CD2 3.93Å; F279-L306 HydrophobicContact CE2-CG 3.92Å; F279-L306 HydrophobicContact CZ-CD2 4.42Å; F279-L306 HydrophobicContact CZ-CG 3.94Å; F279-L307 HydrophobicContact CE1-CD2 3.76Å; F279-L307 HydrophobicContact CZ-CD2 4Å; F279-L307 HydrophobicContact CZ-CG 4.45Å; F279-Q310 HydrophobicContact CD1-CB 4.24Å; F279-Q310 HydrophobicContact CE1-CB 3.41Å; F279-Q310 VanDerWaalsContact CE1-CB 3.41Å; F279-Q310 HydrophobicContact CE1-CG 3.72Å; F279-Q310 HydrophobicContact CE2-CG 4.22Å; F279-Q310 HydrophobicContact CZ-CB 3.75Å; F279-Q310 HydrophobicContact CZ-CG 3.55Å; F279-F312 AromaticContact CD1-CD2 3.82Å; F279-F312 HydrophobicContact CD1-CD2 3.82Å; F279-F312 AromaticContact CD1-CE2 3.65Å; F279-F312 HydrophobicContact CD1-CE2 3.65Å; F279-F312 AromaticContact CE1-CD2 3.67Å; F279-F312 HydrophobicContact CE1-CD2 3.67Å; F279-F312 AromaticContact CE1-CE2 3.99Å; F279-F312 HydrophobicContact CE1-CE2 3.99Å
280	D	96	Very high	95.6	Very high	74 Å²	74	63 Å²	63	40%	0.396	31%	0.308	S	S	.	.	H	α-helix	trans	-54.7	-40.1	176.6	-63.8	-20.9	0	0	0	111.1	R276 V284	R276-D280 VanDerWaalsContact O-CG 3.22Å; R276-D280 PolarHBondContact O-N 3.36Å; D280-V284 WeakPolarHBondContact O-CB 3.38Å; D280-V284 VanDerWaalsContact O-CG2 3.24Å; D280-V284 WeakPolarHBondContact O-CG2 3.29Å; D280-V284 PolarHBondContact O-N 2.84Å
281	L	96.8	Very high	95.5	Very high	11 Å²	11	56.6 Å²	56.6	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-73.6	-36.3	177.9	-67.9	174.2	0	0	0	113.5	K277 L278 F279 D283 V284 L285 F360 I388 F390 L414	K277-L281 HydrophobicContact CD-CD1 4.41Å; K277-L281 HydrophobicContact CD-CG 4.36Å; K277-L281 HydrophobicContact CG-CD1 4.13Å; K277-L281 WeakPolarHBondContact O-CB 3.3Å; K277-L281 WeakPolarHBondContact O-CG 3.49Å; K277-L281 PolarHBondContact O-N 2.99Å; L278-L281 PolarHBondContact O-N 2.77Å; F279-L281 PolarHBondContact O-N 2.85Å; L281-D283 VanDerWaalsContact C-N 3.29Å; L281-V284 PolarHBondContact O-N 3.25Å; L281-L285 HydrophobicContact CB-CD1 4.11Å; L281-L285 HydrophobicContact CD2-CD1 4.35Å; L281-L285 WeakPolarHBondContact O-CB 3.46Å; L281-L285 VanDerWaalsContact O-CG 3.27Å; L281-L285 WeakPolarHBondContact O-CG 3.2Å; L281-L285 PolarHBondContact O-N 3.49Å; L281-F360 HydrophobicContact CB-CE1 4.25Å; L281-F360 HydrophobicContact CB-CZ 4.05Å; L281-F360 HydrophobicContact CD1-CE1 3.81Å; L281-F360 HydrophobicContact CD1-CZ 4.43Å; L281-I388 HydrophobicContact CD1-CD1 4.31Å; L281-I388 HydrophobicContact CD1-CG2 4.24Å; L281-F390 HydrophobicContact CD1-CE1 3.98Å; L281-F390 HydrophobicContact CD1-CZ 4.21Å; L281-L414 HydrophobicContact CD1-CD2 4.16Å; L281-L414 HydrophobicContact CD2-CD2 3.46Å; L281-L414 VanDerWaalsContact CD2-CD2 3.46Å; L281-L414 HydrophobicContact CG-CD2 4.45Å
282	L	96.6	Very high	95.5	Very high	6 Å²	6	53.4 Å²	53.4	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-70.1	-26.7	176.4	-71.8	174.9	0	0	0	112.6	L278 F279 F287 V290 L307 F312 I340 F360	L278-L282 HydrophobicContact CD1-CD1 4.21Å; L278-L282 HydrophobicContact CD1-CG 4.21Å; L278-L282 HydrophobicContact CG-CD1 4Å; L278-L282 HydrophobicContact CG-CG 4.37Å; L278-L282 WeakPolarHBondContact O-CG 3.26Å; L278-L282 PolarHBondContact O-N 2.95Å; F279-L282 PolarHBondContact O-N 3.4Å; L282-F287 HydrophobicContact CD2-CE1 3.89Å; L282-F287 HydrophobicContact CD2-CZ 4.12Å; L282-V290 HydrophobicContact CD2-CG1 4.27Å; L282-V290 HydrophobicContact CD2-CG2 4.11Å; L282-L307 HydrophobicContact CD1-CD2 3.57Å; L282-F312 HydrophobicContact CB-CD1 4.35Å; L282-F312 HydrophobicContact CB-CE1 3.68Å; L282-F312 HydrophobicContact CB-CZ 3.89Å; L282-F312 HydrophobicContact CD1-CD1 4.36Å; L282-F312 HydrophobicContact CD1-CE1 4.46Å; L282-I340 HydrophobicContact CD1-CD1 4.13Å; L282-I340 HydrophobicContact CD2-CD1 4.38Å; L282-F360 HydrophobicContact CD2-CE2 4.03Å
283	D	94.1	Very high	95.4	Very high	118 Å²	118	47.3 Å²	47.3	63%	0.631	23%	0.23	S	C	*	.	H	α-helix	trans	-77.9	-36.3	173.8	-80.2	-37.2	0	0	0	112.5	F279 L281 F312	F279-D283 PolarHBondContact O-N 3.45Å; L281-D283 VanDerWaalsContact C-N 3.29Å; D283-F312 WeakPolarHBondContact OD1-CZ 3.45Å
284	V	93.2	Very high	95.3	Very high	111 Å²	111	42.9 Å²	42.9	67%	0.673	21%	0.21	S	C	*	.	H	α-helix	trans	-86.4	-40	-175.8	172.9	0	0	0	0	112.8	D280 L281	D280-V284 WeakPolarHBondContact O-CB 3.38Å; D280-V284 VanDerWaalsContact O-CG2 3.24Å; D280-V284 WeakPolarHBondContact O-CG2 3.29Å; D280-V284 PolarHBondContact O-N 2.84Å; L281-V284 PolarHBondContact O-N 3.25Å
285	L	94.5	Very high	95.1	Very high	16 Å²	16	49.1 Å²	49.1	8%	0.084	24%	0.237	C	C	.	.	S	Bend	trans	-82	130.2	-175.5	-62.7	169.4	0	0	0	110.8	L281 F287 I358 F360 L386 I388 I418	L281-L285 HydrophobicContact CB-CD1 4.11Å; L281-L285 HydrophobicContact CD2-CD1 4.35Å; L281-L285 WeakPolarHBondContact O-CB 3.46Å; L281-L285 VanDerWaalsContact O-CG 3.27Å; L281-L285 WeakPolarHBondContact O-CG 3.2Å; L281-L285 PolarHBondContact O-N 3.49Å; L285-F287 VanDerWaalsContact O-CD1 3.27Å; L285-F287 WeakPolarHBondContact O-CD1 3.4Å; L285-I358 HydrophobicContact CB-CD1 3.88Å; L285-I358 HydrophobicContact CD1-CD1 4.17Å; L285-F360 HydrophobicContact CD1-CZ 4.14Å; L285-L386 HydrophobicContact CD1-CD2 3.99Å; L285-L386 HydrophobicContact CD2-CD2 4.06Å; L285-I388 HydrophobicContact CD1-CD1 3.57Å; L285-I418 HydrophobicContact CD2-CD1 4.44Å
286	E	92.8	Very high	94.9	Very high	114 Å²	114	47.8 Å²	47.8	53%	0.533	23%	0.232	S	C	.	.			trans	-73.5	140.8	167.5	-65.3	-169.2	-159.7	0	0	110.3	I420 Y423 I424	E286-I420 HydrophobicContact CB-CD1 4.49Å; E286-I420 HydrophobicContact CB-CG1 4.39Å; E286-I420 HydrophobicContact CB-CG2 4.35Å; E286-I420 VanDerWaalsContact CD-CD1 3.42Å; E286-I420 HydrophobicContact CG-CD1 3.9Å; E286-I420 HydrophobicContact CG-CG1 4.3Å; E286-I420 WeakPolarHBondContact OE1-CD1 3.32Å; E286-Y423 PolarHBondContact N-OH 3.38Å; E286-Y423 VanDerWaalsContact N-OH 3.1Å; E286-Y423 WeakPolarHBondContact O-CE2 3.3Å; E286-Y423 PolarHBondContact O-OH 2.98Å; E286-I424 HydrophobicContact CB-CD1 3.93Å; E286-I424 WeakPolarHBondContact O-CD1 3.34Å
287	F	92.6	Very high	94.7	Very high	16 Å²	16	40.5 Å²	40.5	7%	0.07	21%	0.208	C	C	.	.			trans	-153.5	158.4	175.8	56.7	-93.4	0	0	0	113.5	L282 L285 V290 R339 I340 N357 I358	L282-F287 HydrophobicContact CD2-CE1 3.89Å; L282-F287 HydrophobicContact CD2-CZ 4.12Å; L285-F287 VanDerWaalsContact O-CD1 3.27Å; L285-F287 WeakPolarHBondContact O-CD1 3.4Å; F287-V290 HydrophobicContact CB-CG2 3.83Å; F287-V290 HydrophobicContact CD1-CG2 3.69Å; F287-V290 HydrophobicContact CD2-CB 4.39Å; F287-V290 HydrophobicContact CD2-CG2 3.29Å; F287-V290 HydrophobicContact CE1-CG2 4.02Å; F287-V290 HydrophobicContact CE2-CG2 3.63Å; F287-V290 HydrophobicContact CG-CG2 3.32Å; F287-V290 HydrophobicContact CZ-CG2 3.99Å; F287-R339 HydrophobicContact CE2-CB 4.09Å; F287-R339 PolarHBondContact O-NH2 2.64Å; F287-I340 HydrophobicContact CE2-CG1 4.2Å; F287-I340 HydrophobicContact CZ-CD1 4.31Å; F287-I340 HydrophobicContact CZ-CG1 4.36Å; F287-N357 WeakPolarHBondContact CA-ND2 3.18Å; F287-N357 WeakPolarHBondContact CA-OD1 3.04Å; F287-N357 WeakPolarHBondContact CB-OD1 3.31Å; F287-I358 HydrophobicContact CB-CD1 3.69Å; F287-I358 HydrophobicContact CB-CG1 3.94Å; F287-I358 HydrophobicContact CD1-CD1 4.29Å; F287-I358 HydrophobicContact CG-CD1 4.4Å
288	N	91.2	Very high	94.7	Very high	81 Å²	81	44.8 Å²	44.8	43%	0.433	23%	0.23	S	C	.	.	S	Bend	trans	-85.6	-64.9	166.8	-74.3	-31.2	0	0	0	109.3	R339 R355 N357	N288-R339 PolarHBondContact O-NE 3.04Å; N288-R339 VanDerWaalsContact O-NE 3.17Å; N288-R355 HydrophobicContact CB-CB 4.49Å; N288-R355 WeakPolarHBondContact CB-O 3.4Å; N288-N357 PolarHBondContact N-OD1 3.28Å
289	Q	92.7	Very high	94.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	151.9	169.6	-59.5	-172.6	-79	0	0	111.5	F333 F336 R338 R339 R355 V356 N357	Q289-F333 HydrophobicContact CB-CE2 4.21Å; Q289-F333 HydrophobicContact CB-CZ 3.86Å; Q289-F333 HydrophobicContact CG-CE2 4.43Å; Q289-F333 HydrophobicContact CG-CZ 4.42Å; Q289-F333 VanDerWaalsContact NE2-CE2 3.33Å; Q289-F333 PolarHBondContact NE2-O 2.6Å; Q289-F336 HydrophobicContact CG-CD2 3.59Å; Q289-F336 HydrophobicContact CG-CE2 3.55Å; Q289-R338 PolarHBondContact NE2-O 2.96Å; Q289-R339 CarbonylContact C-O 3.49Å; Q289-R339 WeakPolarHBondContact CA-O 3.1Å; Q289-R339 WeakPolarHBondContact CB-O 3.48Å; Q289-R355 HydrophobicContact CG-CB 4.13Å; Q289-R355 PolarHBondContact N-O 2.8Å; Q289-V356 HydrophobicContact CB-CG2 4.01Å; Q289-V356 WeakPolarHBondContact O-CA 3.5Å; Q289-N357 PolarHBondContact N-OD1 2.87Å; Q289-N357 PolarHBondContact O-N 2.87Å; Q289-N357 PolarHBondContact O-OD1 3.27Å
290	V	93.8	Very high	94.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	139.9	-179.5	174.7	0	0	0	0	109.4	L282 F287 I292 R339 I340 L341 I358 F360	L282-V290 HydrophobicContact CD2-CG1 4.27Å; L282-V290 HydrophobicContact CD2-CG2 4.11Å; F287-V290 HydrophobicContact CB-CG2 3.83Å; F287-V290 HydrophobicContact CD1-CG2 3.69Å; F287-V290 HydrophobicContact CD2-CB 4.39Å; F287-V290 HydrophobicContact CD2-CG2 3.29Å; F287-V290 HydrophobicContact CE1-CG2 4.02Å; F287-V290 HydrophobicContact CE2-CG2 3.63Å; F287-V290 HydrophobicContact CG-CG2 3.32Å; F287-V290 HydrophobicContact CZ-CG2 3.99Å; V290-I292 HydrophobicContact CG1-CD1 4.34Å; V290-I292 HydrophobicContact CG1-CG1 3.77Å; V290-R339 PolarHBondContact N-O 3.12Å; V290-I340 HydrophobicContact CB-CG1 4.22Å; V290-I340 WeakPolarHBondContact O-CA 3.44Å; V290-L341 PolarHBondContact O-N 3.19Å; V290-I358 WeakPolarHBondContact CA-O 3.36Å; V290-I358 HydrophobicContact CG2-CB 4Å; V290-F360 HydrophobicContact CG1-CD2 3.51Å; V290-F360 HydrophobicContact CG1-CE2 3.81Å
291	V	93.9	Very high	94.6	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.03	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.2	167	-177.7	0	0	0	0	109.4	F293 F333 L341 V356 I358 A359 F360	V291-F293 HydrophobicContact CB-CE2 4.37Å; V291-F293 HydrophobicContact CB-CZ 4.44Å; V291-F293 HydrophobicContact CG1-CD1 4.38Å; V291-F293 HydrophobicContact CG1-CD2 4.26Å; V291-F293 HydrophobicContact CG1-CE1 3.83Å; V291-F293 HydrophobicContact CG1-CE2 3.7Å; V291-F293 HydrophobicContact CG1-CZ 3.46Å; V291-F293 VanDerWaalsContact CG1-CZ 3.46Å; V291-F333 HydrophobicContact CG2-CE1 4.12Å; V291-F333 HydrophobicContact CG2-CZ 4.2Å; V291-L341 CarbonylContact C-O 3.59Å; V291-L341 WeakPolarHBondContact CA-O 3.37Å; V291-L341 HydrophobicContact CG1-CD2 4.29Å; V291-L341 HydrophobicContact CG1-CG 4.43Å; V291-L341 HydrophobicContact CG2-CB 4.36Å; V291-L341 HydrophobicContact CG2-CD2 4.24Å; V291-V356 HydrophobicContact CB-CG1 4.38Å; V291-V356 HydrophobicContact CG2-CB 4.36Å; V291-V356 HydrophobicContact CG2-CG1 3.73Å; V291-V356 HydrophobicContact CG2-CG2 3.66Å; V291-I358 PolarHBondContact N-O 3.22Å; V291-A359 CarbonylContact O-C 3.59Å; V291-A359 WeakPolarHBondContact O-CA 3.4Å; V291-F360 PolarHBondContact O-N 2.73Å
292	I	95.8	Very high	94.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	114.9	-178.8	-51	179.7	0	0	0	108.8	L278 V290 L303 L307 I340 L341 V342 A343 F360 Y362	L278-I292 HydrophobicContact CD1-CD1 4.04Å; L278-I292 HydrophobicContact CD2-CD1 3.96Å; V290-I292 HydrophobicContact CG1-CD1 4.34Å; V290-I292 HydrophobicContact CG1-CG1 3.77Å; I292-L303 HydrophobicContact CG2-CD2 3.86Å; I292-L307 HydrophobicContact CD1-CD1 3.98Å; I292-I340 HydrophobicContact CD1-CG2 3.68Å; I292-I340 HydrophobicContact CG1-CG2 4.2Å; I292-L341 PolarHBondContact N-O 3Å; I292-V342 HydrophobicContact CB-CG2 4.42Å; I292-V342 HydrophobicContact CD1-CG2 4.46Å; I292-V342 CarbonylContact O-C 3.18Å; I292-V342 WeakPolarHBondContact O-CA 3.23Å; I292-A343 PolarHBondContact O-N 3.23Å; I292-F360 HydrophobicContact CB-CB 4.38Å; I292-F360 HydrophobicContact CG1-CB 4.22Å; I292-F360 HydrophobicContact CG1-CD2 4.21Å; I292-F360 HydrophobicContact CG2-CB 4.11Å; I292-Y362 HydrophobicContact CG2-CG 4.36Å
293	F	95.3	Very high	94.7	Very high	1 Å²	1	48.2 Å²	48.2	0%	0.004	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	129.5	-179.5	-63.1	-75.1	0	0	0	112.1	V291 A343 F347 A359 F360 Y362 D363 R374 R377	V291-F293 HydrophobicContact CB-CE2 4.37Å; V291-F293 HydrophobicContact CB-CZ 4.44Å; V291-F293 HydrophobicContact CG1-CD1 4.38Å; V291-F293 HydrophobicContact CG1-CD2 4.26Å; V291-F293 HydrophobicContact CG1-CE1 3.83Å; V291-F293 HydrophobicContact CG1-CE2 3.7Å; V291-F293 HydrophobicContact CG1-CZ 3.46Å; V291-F293 VanDerWaalsContact CG1-CZ 3.46Å; F293-A343 CarbonylContact C-O 3.31Å; F293-A343 VanDerWaalsContact CA-O 3.31Å; F293-A343 WeakPolarHBondContact CA-O 3.44Å; F293-F347 HydrophobicContact CE1-CB 4.06Å; F293-A359 HydrophobicContact CE2-CB 4.48Å; F293-F360 PolarHBondContact N-O 3.33Å; F293-Y362 WeakPolarHBondContact O-CB 3.32Å; F293-Y362 PolarHBondContact O-N 3.37Å; F293-Y362 VanDerWaalsContact O-N 3.08Å; F293-D363 PolarHBondContact O-N 2.77Å; F293-D363 VanDerWaalsContact O-N 3.14Å; F293-R374 HydrophobicContact CD1-CG 4.04Å; F293-R374 HydrophobicContact CD2-CB 3.83Å; F293-R374 HydrophobicContact CD2-CG 3.87Å; F293-R374 HydrophobicContact CE1-CG 4.09Å; F293-R374 HydrophobicContact CE2-CB 3.64Å; F293-R374 HydrophobicContact CE2-CG 3.92Å; F293-R374 HydrophobicContact CG-CB 4.4Å; F293-R374 HydrophobicContact CG-CG 3.92Å; F293-R374 HydrophobicContact CZ-CB 4.07Å; F293-R374 HydrophobicContact CZ-CG 4.02Å; F293-R377 HydrophobicContact CZ-CG 4.24Å
294	V	95.8	Very high	94.9	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.225	C	C	.	.			trans	-127.4	156.1	178.7	-60.6	0	0	0	0	111.3	R299 C300 L303 V342 A343 T344 Y362 D363	V294-R299 HydrophobicContact CB-CB 4.27Å; V294-C300 HydrophobicContact CG2-CB 3.55Å; V294-L303 HydrophobicContact CG1-CD2 3.82Å; V294-V342 HydrophobicContact CG1-CG1 4.12Å; V294-V342 HydrophobicContact CG2-CG1 4.29Å; V294-A343 PolarHBondContact N-O 3.39Å; V294-T344 HydrophobicContact CG2-CG2 4.27Å; V294-T344 WeakPolarHBondContact O-CA 3.36Å; V294-Y362 HydrophobicContact CG1-CD1 3.93Å; V294-Y362 HydrophobicContact CG1-CG 4.27Å; V294-D363 WeakPolarHBondContact CA-OD2 3.27Å
295	K	92.9	Very high	95.1	Very high	136 Å²	136	42.9 Å²	42.9	59%	0.591	22%	0.218	S	C	*	.	S	Bend	trans	-79.8	-21.6	-173.6	70	-170.4	171.7	-175.5	0	114.9	D363	K295-D363 HydrophobicContact CB-CB 3.88Å; K295-D363 HydrophobicContact CD-CB 4.23Å; K295-D363 HydrophobicContact CG-CB 4.13Å; K295-D363 WeakPolarHBondContact CG-OD2 3.34Å; K295-D363 PolarHBondContact N-OD2 3.23Å
296	S	93.4	Very high	95.2	Very high	32 Å²	32	44.2 Å²	44.2	22%	0.224	22%	0.224	C	C	.	.	S	Bend	trans	-139.2	157.4	-173.5	82.3	0	0	0	0	114.1	Q298 R299 C300	S296-Q298 VanDerWaalsContact C-N 3.34Å; S296-Q298 PolarHBondContact O-N 3.42Å; S296-R299 PolarHBondContact O-N 3.02Å; S296-R299 WeakPolarHBondContact OG-CG 3.43Å; S296-R299 PolarHBondContact OG-N 3.48Å; S296-C300 WeakPolarHBondContact O-CB 3.45Å; S296-C300 PolarHBondContact O-N 2.79Å
297	V	94.6	Very high	95.5	Very high	33 Å²	33	38.8 Å²	38.8	20%	0.2	20%	0.199	C	C	.	.	H	α-helix	trans	-59.1	-45.4	175.8	173.4	0	0	0	0	111.1	R299 C300 I301 H318 R319	V297-R299 VanDerWaalsContact C-N 3.32Å; V297-R299 PolarHBondContact O-N 3.16Å; V297-C300 WeakPolarHBondContact O-CB 3.23Å; V297-C300 PolarHBondContact O-N 3.41Å; V297-C300 VanDerWaalsContact O-N 3.16Å; V297-I301 HydrophobicContact CG1-CD1 3.86Å; V297-I301 HydrophobicContact CG1-CG1 4.47Å; V297-I301 WeakPolarHBondContact O-CG1 3.02Å; V297-I301 PolarHBondContact O-N 3Å; V297-H318 HydrophobicContact CG1-CB 4.43Å; V297-H318 WeakPolarHBondContact CG1-ND1 3.49Å; V297-H318 HydrophobicContact CG2-CB 4.2Å; V297-R319 HydrophobicContact CG2-CG 3.46Å; V297-R319 VanDerWaalsContact CG2-CG 3.46Å
298	Q	96.2	Very high	95.7	Very high	158 Å²	158	41.5 Å²	41.5	74%	0.738	22%	0.217	S	C	*	.	H	α-helix	trans	-60.7	-43.1	-179.5	-173.8	-179.1	7.5	0	0	111.4	S296 I301 A302	S296-Q298 VanDerWaalsContact C-N 3.34Å; S296-Q298 PolarHBondContact O-N 3.42Å; Q298-I301 PolarHBondContact O-N 3.04Å; Q298-A302 VanDerWaalsContact O-CB 3.3Å; Q298-A302 WeakPolarHBondContact O-CB 3.37Å; Q298-A302 PolarHBondContact O-N 2.92Å
299	R	96.7	Very high	96	Very high	52 Å²	52	42.9 Å²	42.9	20%	0.196	22%	0.221	C	C	.	.	H	α-helix	trans	-66.8	-37.3	176.1	-70.4	177.3	73.1	91.8	-15.2	111.9	D271 V294 S296 V297 A302 L303 Y362 D363	D271-R299 IonicContact OD1-CZ 3.65Å; D271-R299 IonicContact OD1-NH1 3.71Å; D271-R299 IonicContact OD1-NH2 2.75Å; D271-R299 PolarHBondContact OD1-NH2 2.84Å; D271-R299 IonicContact OD2-CZ 3.67Å; D271-R299 IonicContact OD2-NH1 2.96Å; D271-R299 PolarHBondContact OD2-NH1 3.38Å; D271-R299 IonicContact OD2-NH2 3.41Å; D271-R299 PolarHBondContact OD2-NH2 2.85Å; V294-R299 HydrophobicContact CB-CB 4.27Å; S296-R299 PolarHBondContact O-N 3.02Å; S296-R299 WeakPolarHBondContact OG-CG 3.43Å; S296-R299 PolarHBondContact OG-N 3.48Å; V297-R299 VanDerWaalsContact C-N 3.32Å; V297-R299 PolarHBondContact O-N 3.16Å; R299-A302 PolarHBondContact O-N 3Å; R299-L303 WeakPolarHBondContact O-CB 3.42Å; R299-L303 PolarHBondContact O-N 3.36Å; R299-Y362 VanDerWaalsContact NH2-CE1 3.31Å; R299-D363 IonicContact CZ-OD1 3.42Å; R299-D363 IonicContact CZ-OD2 3.12Å; R299-D363 IonicContact NE-OD1 3.31Å; R299-D363 PolarHBondContact NE-OD1 2.85Å; R299-D363 IonicContact NE-OD2 3.25Å; R299-D363 PolarHBondContact NE-OD2 3.02Å; R299-D363 IonicContact NH2-OD1 2.74Å; R299-D363 PolarHBondContact NH2-OD1 2.91Å; R299-D363 IonicContact NH2-OD2 2.67Å
300	C	96.5	Very high	96.1	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-48.8	176.4	-175.9	0	0	0	0	111.8	V294 S296 V297 A304 H318 V342 T344	V294-C300 HydrophobicContact CG2-CB 3.55Å; S296-C300 WeakPolarHBondContact O-CB 3.45Å; S296-C300 PolarHBondContact O-N 2.79Å; V297-C300 WeakPolarHBondContact O-CB 3.23Å; V297-C300 PolarHBondContact O-N 3.41Å; V297-C300 VanDerWaalsContact O-N 3.16Å; C300-A304 VanDerWaalsContact O-CB 3.24Å; C300-A304 WeakPolarHBondContact O-CB 3.15Å; C300-A304 PolarHBondContact O-N 3.37Å; C300-H318 HydrophobicContact CB-CB 4.24Å; C300-V342 HydrophobicContact CB-CG1 4.41Å; C300-V342 PolarHBondContact SG-O 3.49Å; C300-T344 HydrophobicContact CB-CG2 4.3Å
301	I	97	Very high	96.1	Very high	78 Å²	78	55.1 Å²	55.1	40%	0.4	28%	0.283	S	S	.	.	H	α-helix	trans	-63.4	-50.8	177.9	-63.3	168.5	0	0	0	110.3	V297 Q298 L303 A304 Q305 H318	V297-I301 HydrophobicContact CG1-CD1 3.86Å; V297-I301 HydrophobicContact CG1-CG1 4.47Å; V297-I301 WeakPolarHBondContact O-CG1 3.02Å; V297-I301 PolarHBondContact O-N 3Å; Q298-I301 PolarHBondContact O-N 3.04Å; I301-L303 PolarHBondContact O-N 2.66Å; I301-A304 PolarHBondContact O-N 2.96Å; I301-Q305 WeakPolarHBondContact O-CB 3.36Å; I301-Q305 PolarHBondContact O-N 3.31Å; I301-H318 VanDerWaalsContact CG1-NE2 3.31Å; I301-H318 WeakPolarHBondContact CG1-NE2 3.4Å
302	A	97.6	Very high	96.2	Very high	55 Å²	55	56.3 Å²	56.3	46%	0.455	29%	0.287	S	S	.	.	H	α-helix	trans	-61.6	-45.1	-176.9	0	0	0	0	0	112.3	Q298 R299 L306	Q298-A302 VanDerWaalsContact O-CB 3.3Å; Q298-A302 WeakPolarHBondContact O-CB 3.37Å; Q298-A302 PolarHBondContact O-N 2.92Å; R299-A302 PolarHBondContact O-N 3Å; A302-L306 WeakPolarHBondContact O-CB 3.34Å; A302-L306 PolarHBondContact O-N 2.94Å
303	L	98.1	Very high	96.1	Very high	6 Å²	6	59.4 Å²	59.4	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-68.7	-43.1	-179.6	-177.1	60	0	0	0	111.8	L278 I292 V294 R299 I301 Q305 L306 L307 V342 Y362	L278-L303 HydrophobicContact CD2-CD1 3.87Å; L278-L303 HydrophobicContact CD2-CD2 4.2Å; L278-L303 HydrophobicContact CD2-CG 4.46Å; I292-L303 HydrophobicContact CG2-CD2 3.86Å; V294-L303 HydrophobicContact CG1-CD2 3.82Å; R299-L303 WeakPolarHBondContact O-CB 3.42Å; R299-L303 PolarHBondContact O-N 3.36Å; I301-L303 PolarHBondContact O-N 2.66Å; L303-Q305 VanDerWaalsContact C-N 3.34Å; L303-Q305 PolarHBondContact O-N 3.25Å; L303-L306 PolarHBondContact O-N 3.35Å; L303-L307 HydrophobicContact CG-CD1 4.14Å; L303-L307 WeakPolarHBondContact O-CB 3.42Å; L303-L307 VanDerWaalsContact O-CG 3.31Å; L303-L307 WeakPolarHBondContact O-CG 3.35Å; L303-L307 PolarHBondContact O-N 3.5Å; L303-V342 HydrophobicContact CB-CG1 4.35Å; L303-V342 HydrophobicContact CD2-CG1 4.12Å; L303-V342 HydrophobicContact CG-CG1 4.44Å; L303-Y362 HydrophobicContact CD1-CE2 4.18Å; L303-Y362 HydrophobicContact CD2-CD1 4.22Å; L303-Y362 HydrophobicContact CD2-CD2 3.87Å; L303-Y362 HydrophobicContact CD2-CE1 4.4Å; L303-Y362 HydrophobicContact CD2-CE2 4.07Å; L303-Y362 HydrophobicContact CD2-CG 3.95Å
304	A	97.5	Very high	96.2	Very high	8 Å²	8	59.8 Å²	59.8	7%	0.066	31%	0.311	C	S	.	.	H	α-helix	trans	-64.3	-39.6	177.6	0	0	0	0	0	112.3	C300 I301 L307 V308 A316 V342	C300-A304 VanDerWaalsContact O-CB 3.24Å; C300-A304 WeakPolarHBondContact O-CB 3.15Å; C300-A304 PolarHBondContact O-N 3.37Å; I301-A304 PolarHBondContact O-N 2.96Å; A304-L307 PolarHBondContact O-N 2.64Å; A304-V308 WeakPolarHBondContact O-CG2 3.3Å; A304-V308 PolarHBondContact O-N 3.32Å; A304-A316 HydrophobicContact CB-CB 3.62Å; A304-V342 HydrophobicContact CB-CB 4.12Å; A304-V342 HydrophobicContact CB-CG2 3.98Å
305	Q	97.5	Very high	96.1	Very high	110 Å²	110	60.3 Å²	60.3	51%	0.514	31%	0.314	S	S	.	.	H	α-helix	trans	-62.6	-48.1	174.2	-179.6	177.4	-12.1	0	0	110.9	I301 L303 L307 V308 E309	I301-Q305 WeakPolarHBondContact O-CB 3.36Å; I301-Q305 PolarHBondContact O-N 3.31Å; L303-Q305 VanDerWaalsContact C-N 3.34Å; L303-Q305 PolarHBondContact O-N 3.25Å; Q305-L307 VanDerWaalsContact C-N 3.32Å; Q305-L307 PolarHBondContact O-N 3.1Å; Q305-V308 PolarHBondContact O-N 3.01Å; Q305-V308 VanDerWaalsContact O-N 3.15Å; Q305-E309 HydrophobicContact CG-CG 4.43Å; Q305-E309 VanDerWaalsContact CG-OE1 3.31Å; Q305-E309 WeakPolarHBondContact CG-OE1 3.36Å; Q305-E309 PolarHBondContact NE2-OE1 3.19Å; Q305-E309 WeakPolarHBondContact O-CG 3.46Å; Q305-E309 PolarHBondContact O-N 2.72Å
306	L	97.6	Very high	96.2	Very high	43 Å²	43	54.2 Å²	54.2	23%	0.225	29%	0.289	C	S	.	.	H	α-helix	trans	-59.3	-41.8	178.3	-178.4	61.8	0	0	0	112.1	N275 F279 A302 L303 E309 Q310	N275-L306 HydrophobicContact CB-CD2 4.17Å; F279-L306 HydrophobicContact CE2-CD2 3.93Å; F279-L306 HydrophobicContact CE2-CG 3.92Å; F279-L306 HydrophobicContact CZ-CD2 4.42Å; F279-L306 HydrophobicContact CZ-CG 3.94Å; A302-L306 WeakPolarHBondContact O-CB 3.34Å; A302-L306 PolarHBondContact O-N 2.94Å; L303-L306 PolarHBondContact O-N 3.35Å; L306-E309 PolarHBondContact O-N 3.38Å; L306-Q310 HydrophobicContact CD1-CG 4.42Å; L306-Q310 WeakPolarHBondContact O-CG 3.44Å; L306-Q310 PolarHBondContact O-N 3.48Å
307	L	98	Very high	96.2	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-59.6	-47.9	174.3	-74.9	162.9	0	0	0	111.4	L278 F279 L282 I292 L303 A304 Q305 E309 Q310 N311 F312 A314 I340 V342	L278-L307 HydrophobicContact CD2-CD2 4.47Å; F279-L307 HydrophobicContact CE1-CD2 3.76Å; F279-L307 HydrophobicContact CZ-CD2 4Å; F279-L307 HydrophobicContact CZ-CG 4.45Å; L282-L307 HydrophobicContact CD1-CD2 3.57Å; I292-L307 HydrophobicContact CD1-CD1 3.98Å; L303-L307 HydrophobicContact CG-CD1 4.14Å; L303-L307 WeakPolarHBondContact O-CB 3.42Å; L303-L307 VanDerWaalsContact O-CG 3.31Å; L303-L307 WeakPolarHBondContact O-CG 3.35Å; L303-L307 PolarHBondContact O-N 3.5Å; A304-L307 PolarHBondContact O-N 2.64Å; Q305-L307 VanDerWaalsContact C-N 3.32Å; Q305-L307 PolarHBondContact O-N 3.1Å; L307-E309 VanDerWaalsContact C-N 3.33Å; L307-E309 PolarHBondContact O-N 3.45Å; L307-Q310 CarbonylContact O-C 3.43Å; L307-Q310 PolarHBondContact O-N 3.41Å; L307-Q310 VanDerWaalsContact O-N 3.16Å; L307-N311 PolarHBondContact O-N 3.33Å; L307-F312 CarbonylContact C-O 3.58Å; L307-F312 VanDerWaalsContact C-O 3.31Å; L307-F312 HydrophobicContact CB-CB 4.13Å; L307-F312 HydrophobicContact CD2-CB 4.06Å; L307-F312 HydrophobicContact CD2-CG 4.4Å; L307-F312 WeakPolarHBondContact O-CA 3.21Å; L307-F312 WeakPolarHBondContact O-CB 3.45Å; L307-F312 PolarHBondContact O-N 2.98Å; L307-A314 HydrophobicContact CB-CB 3.81Å; L307-A314 HydrophobicContact CD1-CB 3.99Å; L307-I340 HydrophobicContact CD1-CG2 4.07Å; L307-V342 HydrophobicContact CD1-CG2 3.56Å
308	V	97.3	Very high	96	Very high	73 Å²	73	51.9 Å²	51.9	44%	0.442	27%	0.272	S	S	.	.	H	α-helix	trans	-62.9	-39.5	179	171.5	0	0	0	0	111.7	A304 Q305 Q310 N311 F312 A314	A304-V308 WeakPolarHBondContact O-CG2 3.3Å; A304-V308 PolarHBondContact O-N 3.32Å; Q305-V308 PolarHBondContact O-N 3.01Å; Q305-V308 VanDerWaalsContact O-N 3.15Å; V308-Q310 VanDerWaalsContact C-N 3.29Å; V308-Q310 PolarHBondContact O-N 3.26Å; V308-N311 PolarHBondContact O-N 3.35Å; V308-F312 WeakPolarHBondContact CA-O 3.35Å; V308-F312 PolarHBondContact N-O 3.03Å; V308-A314 HydrophobicContact CG2-CB 4.24Å
309	E	96.9	Very high	95.4	Very high	111 Å²	111	53 Å²	53	52%	0.519	27%	0.269	S	S	.	.	H	α-helix	trans	-64.1	-32.3	175.6	-73.9	173.2	-172	0	0	112.6	Q305 L306 L307 N311	Q305-E309 HydrophobicContact CG-CG 4.43Å; Q305-E309 VanDerWaalsContact CG-OE1 3.31Å; Q305-E309 WeakPolarHBondContact CG-OE1 3.36Å; Q305-E309 PolarHBondContact NE2-OE1 3.19Å; Q305-E309 WeakPolarHBondContact O-CG 3.46Å; Q305-E309 PolarHBondContact O-N 2.72Å; L306-E309 PolarHBondContact O-N 3.38Å; L307-E309 VanDerWaalsContact C-N 3.33Å; L307-E309 PolarHBondContact O-N 3.45Å; E309-N311 VanDerWaalsContact C-N 3.25Å; E309-N311 PolarHBondContact O-N 3.39Å
310	Q	95.5	Very high	94.9	Very high	108 Å²	108	53.3 Å²	53.3	51%	0.505	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	24.8	175	-63.5	-56.5	-56.1	0	0	113	F279 L306 L307 V308 F312	F279-Q310 HydrophobicContact CD1-CB 4.24Å; F279-Q310 HydrophobicContact CE1-CB 3.41Å; F279-Q310 VanDerWaalsContact CE1-CB 3.41Å; F279-Q310 HydrophobicContact CE1-CG 3.72Å; F279-Q310 HydrophobicContact CE2-CG 4.22Å; F279-Q310 HydrophobicContact CZ-CB 3.75Å; F279-Q310 HydrophobicContact CZ-CG 3.55Å; L306-Q310 HydrophobicContact CD1-CG 4.42Å; L306-Q310 WeakPolarHBondContact O-CG 3.44Å; L306-Q310 PolarHBondContact O-N 3.48Å; L307-Q310 CarbonylContact O-C 3.43Å; L307-Q310 PolarHBondContact O-N 3.41Å; L307-Q310 VanDerWaalsContact O-N 3.16Å; V308-Q310 VanDerWaalsContact C-N 3.29Å; V308-Q310 PolarHBondContact O-N 3.26Å; Q310-F312 HydrophobicContact CB-CD2 4.3Å; Q310-F312 VanDerWaalsContact O-CD2 3.3Å; Q310-F312 WeakPolarHBondContact O-CD2 3.22Å; Q310-F312 PolarHBondContact O-N 3.1Å
311	N	94.5	Very high	94.6	Very high	148 Å²	148	54.1 Å²	54.1	79%	0.791	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	20.8	177.1	-66.1	83.7	0	0	0	115.4	L307 V308 E309 P313	L307-N311 PolarHBondContact O-N 3.33Å; V308-N311 PolarHBondContact O-N 3.35Å; E309-N311 VanDerWaalsContact C-N 3.25Å; E309-N311 PolarHBondContact O-N 3.39Å; N311-P313 VanDerWaalsContact O-CD 3.3Å; N311-P313 WeakPolarHBondContact O-CD 3.36Å
312	F	95.2	Very high	94.3	Very high	30 Å²	30	54.5 Å²	54.5	13%	0.132	30%	0.3	C	S	.	.			trans	-96.4	106.4	168.8	-77.1	-83.2	0	0	0	110.3	F279 L282 D283 L307 V308 Q310 A314 I340	F279-F312 AromaticContact CD1-CD2 3.82Å; F279-F312 HydrophobicContact CD1-CD2 3.82Å; F279-F312 AromaticContact CD1-CE2 3.65Å; F279-F312 HydrophobicContact CD1-CE2 3.65Å; F279-F312 AromaticContact CE1-CD2 3.67Å; F279-F312 HydrophobicContact CE1-CD2 3.67Å; F279-F312 AromaticContact CE1-CE2 3.99Å; F279-F312 HydrophobicContact CE1-CE2 3.99Å; L282-F312 HydrophobicContact CB-CD1 4.35Å; L282-F312 HydrophobicContact CB-CE1 3.68Å; L282-F312 HydrophobicContact CB-CZ 3.89Å; L282-F312 HydrophobicContact CD1-CD1 4.36Å; L282-F312 HydrophobicContact CD1-CE1 4.46Å; D283-F312 WeakPolarHBondContact OD1-CZ 3.45Å; L307-F312 CarbonylContact C-O 3.58Å; L307-F312 VanDerWaalsContact C-O 3.31Å; L307-F312 HydrophobicContact CB-CB 4.13Å; L307-F312 HydrophobicContact CD2-CB 4.06Å; L307-F312 HydrophobicContact CD2-CG 4.4Å; L307-F312 WeakPolarHBondContact O-CA 3.21Å; L307-F312 WeakPolarHBondContact O-CB 3.45Å; L307-F312 PolarHBondContact O-N 2.98Å; V308-F312 WeakPolarHBondContact CA-O 3.35Å; V308-F312 PolarHBondContact N-O 3.03Å; Q310-F312 HydrophobicContact CB-CD2 4.3Å; Q310-F312 VanDerWaalsContact O-CD2 3.3Å; Q310-F312 WeakPolarHBondContact O-CD2 3.22Å; Q310-F312 PolarHBondContact O-N 3.1Å; F312-A314 PolarHBondContact O-N 2.97Å; F312-I340 HydrophobicContact CB-CD1 3.82Å; F312-I340 HydrophobicContact CD1-CD1 3.69Å; F312-I340 HydrophobicContact CG-CD1 4.15Å
313	P	94.2	Very high	93.7	Very high	66 Å²	66	52.1 Å²	52.1	43%	0.429	28%	0.279	S	S	.	.			trans	-64.4	92.9	-178.7	-24.6	38	0	0	0	112	N311 I340	N311-P313 VanDerWaalsContact O-CD 3.3Å; N311-P313 WeakPolarHBondContact O-CD 3.36Å; P313-I340 PolarHBondContact O-N 3.31Å
314	A	96.4	Very high	93.2	Very high	8 Å²	8	58.8 Å²	58.8	7%	0.066	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	155.4	-179.1	0	0	0	0	0	112.4	L307 V308 F312 I340	L307-A314 HydrophobicContact CB-CB 3.81Å; L307-A314 HydrophobicContact CD1-CB 3.99Å; V308-A314 HydrophobicContact CG2-CB 4.24Å; F312-A314 PolarHBondContact O-N 2.97Å; A314-I340 CarbonylContact C-O 3.49Å; A314-I340 VanDerWaalsContact CA-O 3.24Å; A314-I340 WeakPolarHBondContact CA-O 3.15Å; A314-I340 HydrophobicContact CB-CB 4.02Å; A314-I340 HydrophobicContact CB-CG2 4.02Å
315	I	95.4	Very high	92.9	Very high	12 Å²	12	61.9 Å²	61.9	6%	0.062	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.4	171	-164.3	162.3	0	0	0	109.4	R329 Q332 F333 R338 I340 L341 V342	I315-R329 HydrophobicContact CD1-CB 3.49Å; I315-R329 VanDerWaalsContact CD1-CB 3.49Å; I315-R329 HydrophobicContact CD1-CG 3.72Å; I315-R329 WeakPolarHBondContact CD1-O 3.49Å; I315-R329 HydrophobicContact CG1-CB 3.92Å; I315-R329 HydrophobicContact CG1-CG 4.02Å; I315-Q332 HydrophobicContact CD1-CB 4.14Å; I315-F333 HydrophobicContact CG2-CB 4.06Å; I315-F333 HydrophobicContact CG2-CD2 3.96Å; I315-F333 HydrophobicContact CG2-CG 4.25Å; I315-R338 HydrophobicContact CB-CB 4.36Å; I315-R338 HydrophobicContact CB-CG 4.23Å; I315-R338 HydrophobicContact CG2-CB 4.31Å; I315-I340 PolarHBondContact N-O 3.37Å; I315-L341 HydrophobicContact CG2-CB 4.33Å; I315-L341 HydrophobicContact CG2-CD1 3.92Å; I315-L341 CarbonylContact O-C 3.59Å; I315-L341 WeakPolarHBondContact O-CA 3.37Å; I315-V342 PolarHBondContact O-N 2.95Å
316	A	95.2	Very high	92.4	Very high	8 Å²	8	57 Å²	57	7%	0.066	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	136.4	176.9	0	0	0	0	0	110.4	A304 R329 V342	A304-A316 HydrophobicContact CB-CB 3.62Å; A316-R329 WeakPolarHBondContact O-CD 3.34Å; A316-R329 PolarHBondContact O-NH1 2.87Å; A316-V342 CarbonylContact C-O 3.53Å; A316-V342 WeakPolarHBondContact CA-O 3.4Å
317	I	91.9	Very high	91.8	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	125	165.4	-40.1	169.3	0	0	0	111.4	M321 R326 R329 L341 V342 A343 F347	I317-M321 HydrophobicContact CB-SD 4.47Å; I317-M321 HydrophobicContact CG2-SD 3.96Å; I317-R326 HydrophobicContact CG2-CB 3.89Å; I317-R326 HydrophobicContact CG2-CG 3.8Å; I317-R329 HydrophobicContact CD1-CB 3.99Å; I317-R329 HydrophobicContact CG1-CB 3.83Å; I317-L341 HydrophobicContact CB-CD1 4.23Å; I317-L341 HydrophobicContact CD1-CD1 3.6Å; I317-L341 HydrophobicContact CG1-CD1 3.61Å; I317-V342 PolarHBondContact N-O 3.12Å; I317-A343 WeakPolarHBondContact O-CA 3.25Å; I317-F347 HydrophobicContact CB-CD2 4.34Å; I317-F347 HydrophobicContact CB-CE1 3.78Å; I317-F347 HydrophobicContact CB-CE2 3.5Å; I317-F347 VanDerWaalsContact CB-CE2 3.5Å; I317-F347 HydrophobicContact CB-CZ 3.26Å; I317-F347 HydrophobicContact CD1-CD1 4.34Å; I317-F347 HydrophobicContact CD1-CE1 3.46Å; I317-F347 VanDerWaalsContact CD1-CE1 3.46Å; I317-F347 HydrophobicContact CD1-CZ 3.78Å; I317-F347 HydrophobicContact CG1-CE1 4.2Å; I317-F347 HydrophobicContact CG1-CZ 4.11Å; I317-F347 HydrophobicContact CG2-CE1 3.91Å; I317-F347 HydrophobicContact CG2-CE2 3.41Å; I317-F347 VanDerWaalsContact CG2-CE2 3.41Å; I317-F347 HydrophobicContact CG2-CZ 3.02Å
318	H	90.8	Very high	91.5	Very high	16 Å²	16	59 Å²	59	7%	0.074	32%	0.316	C	S	.	.			trans	-148.7	165	-173.7	60.5	66.6	0	0	0	112.8	V297 C300 I301 G320 M321 T344	V297-H318 HydrophobicContact CG1-CB 4.43Å; V297-H318 WeakPolarHBondContact CG1-ND1 3.49Å; V297-H318 HydrophobicContact CG2-CB 4.2Å; C300-H318 HydrophobicContact CB-CB 4.24Å; I301-H318 VanDerWaalsContact CG1-NE2 3.31Å; I301-H318 WeakPolarHBondContact CG1-NE2 3.4Å; H318-G320 PolarHBondContact ND1-N 2.97Å; H318-G320 PolarHBondContact O-N 2.83Å; H318-G320 VanDerWaalsContact O-N 3.13Å; H318-M321 WeakPolarHBondContact CE1-CG 3.38Å; H318-M321 PolarHBondContact O-N 2.88Å; H318-T344 HydrophobicContact CB-CG2 4.11Å
319	R	84.5	Confident	91.3	Very high	182 Å²	182	58.7 Å²	58.7	69%	0.687	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.1	-176	67.3	-178	180	-167.1	0.6	115.6	V297 M321 L346	V297-R319 HydrophobicContact CG2-CG 3.46Å; V297-R319 VanDerWaalsContact CG2-CG 3.46Å; R319-M321 VanDerWaalsContact C-N 3.26Å; R319-M321 PolarHBondContact O-N 2.92Å; R319-L346 HydrophobicContact CB-CD1 3.42Å; R319-L346 VanDerWaalsContact CB-CD1 3.42Å
320	G	86.2	Confident	90.8	Very high	58 Å²	58	53.5 Å²	53.5	60%	0.598	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-2.4	179.4	0	0	0	0	0	115.9	H318	H318-G320 PolarHBondContact ND1-N 2.97Å; H318-G320 PolarHBondContact O-N 2.83Å; H318-G320 VanDerWaalsContact O-N 3.13Å
321	M	89.5	Confident	90.4	Very high	17 Å²	17	51.5 Å²	51.5	8%	0.084	27%	0.273	C	S	.	.	S	Bend	trans	-88.5	149.3	-178.7	-67.9	176.9	72	0	0	112.5	I317 H318 R319 E325 R326 R329	I317-M321 HydrophobicContact CB-SD 4.47Å; I317-M321 HydrophobicContact CG2-SD 3.96Å; H318-M321 WeakPolarHBondContact CE1-CG 3.38Å; H318-M321 PolarHBondContact O-N 2.88Å; R319-M321 VanDerWaalsContact C-N 3.26Å; R319-M321 PolarHBondContact O-N 2.92Å; M321-E325 HydrophobicContact CE-CB 3.86Å; M321-E325 HydrophobicContact CE-CG 3.4Å; M321-E325 WeakPolarHBondContact CE-OE1 3.39Å; M321-R326 HydrophobicContact CB-CG 3.52Å; M321-R326 HydrophobicContact CG-CG 4.47Å; M321-R326 HydrophobicContact SD-CG 4.29Å; M321-R329 VanDerWaalsContact CE-CD 3.45Å; M321-R329 HydrophobicContact CE-CG 4.15Å; M321-R329 VanDerWaalsContact CE-CZ 3.49Å
322	P	90.5	Very high	90.2	Very high	85 Å²	85	47.2 Å²	47.2	55%	0.552	25%	0.248	S	C	*	.			trans	-55.6	143.2	164.9	-22.2	33.6	0	0	0	111.7	E324 E325 R326	P322-E324 VanDerWaalsContact C-N 3.32Å; P322-E324 PolarHBondContact O-N 3Å; P322-E325 HydrophobicContact CB-CB 4.44Å; P322-E325 PolarHBondContact O-N 3.45Å; P322-E325 VanDerWaalsContact O-N 3.13Å; P322-R326 WeakPolarHBondContact O-CG 3.44Å; P322-R326 PolarHBondContact O-N 2.64Å
323	Q	84.1	Confident	90	Very high	5 Å²	5	45.8 Å²	45.8	2%	0.023	24%	0.242	C	C	.	.	H	α-helix	trans	-61.8	-39	-174.1	-170.7	60.1	36.1	0	0	113	R123 E124 F149 E325 R326 L327	R123-Q323 VanDerWaalsContact CD-CD 3.49Å; E124-Q323 PolarHBondContact OE1-NE2 3.4Å; F149-Q323 HydrophobicContact CD2-CG 4.04Å; F149-Q323 HydrophobicContact CE2-CG 3.66Å; Q323-E325 VanDerWaalsContact C-N 3.29Å; Q323-E325 PolarHBondContact O-N 2.79Å; Q323-R326 PolarHBondContact O-N 3.46Å; Q323-L327 HydrophobicContact CG-CD1 4.32Å; Q323-L327 WeakPolarHBondContact O-CG 3.13Å; Q323-L327 PolarHBondContact O-N 3.19Å
324	E	87.8	Confident	89.6	Confident	146 Å²	146	45.7 Å²	45.7	68%	0.682	24%	0.235	S	C	*	.	H	α-helix	trans	-59.2	-42.2	176.7	-175.6	172.4	-177.7	0	0	111.5	P322 L327 S328	P322-E324 VanDerWaalsContact C-N 3.32Å; P322-E324 PolarHBondContact O-N 3Å; E324-L327 PolarHBondContact O-N 2.98Å; E324-S328 WeakPolarHBondContact O-CB 3.44Å; E324-S328 PolarHBondContact O-N 2.73Å
325	E	91.7	Very high	89.3	Confident	73 Å²	73	49.6 Å²	49.6	34%	0.341	25%	0.254	S	S	.	.	H	α-helix	trans	-69.1	-40.3	177.3	-161.5	-173.9	166.2	0	0	111.6	M321 P322 Q323 L327 S328 R329	M321-E325 HydrophobicContact CE-CB 3.86Å; M321-E325 HydrophobicContact CE-CG 3.4Å; M321-E325 WeakPolarHBondContact CE-OE1 3.39Å; P322-E325 HydrophobicContact CB-CB 4.44Å; P322-E325 PolarHBondContact O-N 3.45Å; P322-E325 VanDerWaalsContact O-N 3.13Å; Q323-E325 VanDerWaalsContact C-N 3.29Å; Q323-E325 PolarHBondContact O-N 2.79Å; E325-L327 PolarHBondContact O-N 2.85Å; E325-S328 PolarHBondContact O-N 3.28Å; E325-R329 HydrophobicContact CG-CG 4.44Å; E325-R329 WeakPolarHBondContact O-CB 3.43Å; E325-R329 WeakPolarHBondContact O-CG 3.29Å; E325-R329 PolarHBondContact O-N 2.78Å; E325-R329 IonicContact OE1-CZ 3.12Å; E325-R329 VanDerWaalsContact OE1-CZ 3.23Å; E325-R329 IonicContact OE1-NE 2.78Å; E325-R329 PolarHBondContact OE1-NE 3.24Å; E325-R329 VanDerWaalsContact OE1-NE 3.12Å; E325-R329 IonicContact OE1-NH2 3.15Å; E325-R329 PolarHBondContact OE1-NH2 2.86Å
326	R	88.1	Confident	89.1	Confident	9 Å²	9	52.6 Å²	52.6	3%	0.034	27%	0.267	C	S	.	.	H	α-helix	trans	-57.6	-47.4	175.3	-67.8	178.4	64.6	-160.9	-1.3	111.7	E124 I317 M321 P322 Q323 Y330	E124-R326 IonicContact OE1-CZ 3.24Å; E124-R326 IonicContact OE1-NE 2.85Å; E124-R326 PolarHBondContact OE1-NE 2.98Å; E124-R326 IonicContact OE1-NH1 2.83Å; E124-R326 PolarHBondContact OE1-NH1 3.49Å; E124-R326 IonicContact OE1-NH2 3.47Å; E124-R326 PolarHBondContact OE1-NH2 3.2Å; E124-R326 IonicContact OE2-CZ 3.28Å; E124-R326 IonicContact OE2-NH1 3.8Å; E124-R326 IonicContact OE2-NH2 3.81Å; E124-R326 PolarHBondContact OE2-NH2 3.48Å; I317-R326 HydrophobicContact CG2-CB 3.89Å; I317-R326 HydrophobicContact CG2-CG 3.8Å; M321-R326 HydrophobicContact CB-CG 3.52Å; M321-R326 HydrophobicContact CG-CG 4.47Å; M321-R326 HydrophobicContact SD-CG 4.29Å; P322-R326 WeakPolarHBondContact O-CG 3.44Å; P322-R326 PolarHBondContact O-N 2.64Å; Q323-R326 PolarHBondContact O-N 3.46Å; R326-Y330 WeakPolarHBondContact O-CB 3.27Å; R326-Y330 PolarHBondContact O-N 3Å
327	L	85.2	Confident	89	Confident	24 Å²	24	57.8 Å²	57.8	13%	0.126	29%	0.29	C	S	.	.	H	α-helix	trans	-67	-42.1	178.7	-67.9	172.7	0	0	0	111.7	F127 F149 Q323 E324 E325 Y330 Q331	F127-L327 HydrophobicContact CB-CD2 3.99Å; F127-L327 HydrophobicContact CD1-CD2 4.12Å; F127-L327 HydrophobicContact CD2-CD1 4.48Å; F127-L327 HydrophobicContact CD2-CD2 4.23Å; F127-L327 HydrophobicContact CG-CD2 3.85Å; F149-L327 HydrophobicContact CE2-CD1 4.02Å; F149-L327 HydrophobicContact CZ-CD1 3.64Å; Q323-L327 HydrophobicContact CG-CD1 4.32Å; Q323-L327 WeakPolarHBondContact O-CG 3.13Å; Q323-L327 PolarHBondContact O-N 3.19Å; E324-L327 PolarHBondContact O-N 2.98Å; E325-L327 PolarHBondContact O-N 2.85Å; L327-Y330 PolarHBondContact O-N 3Å; L327-Q331 WeakPolarHBondContact O-CB 3.37Å; L327-Q331 PolarHBondContact O-N 3.1Å
328	S	90.8	Very high	89	Confident	60 Å²	60	62.7 Å²	62.7	42%	0.42	31%	0.309	S	S	.	.	H	α-helix	trans	-58.9	-49.2	175.6	-179.9	0	0	0	0	111.3	E324 E325 Y330 Q331 Q332	E324-S328 WeakPolarHBondContact O-CB 3.44Å; E324-S328 PolarHBondContact O-N 2.73Å; E325-S328 PolarHBondContact O-N 3.28Å; S328-Y330 PolarHBondContact O-N 2.9Å; S328-Q331 PolarHBondContact O-N 2.85Å; S328-Q332 VanDerWaalsContact O-CG 3.26Å; S328-Q332 WeakPolarHBondContact O-CG 3.17Å; S328-Q332 PolarHBondContact O-N 3.29Å; S328-Q332 PolarHBondContact O-NE2 3.48Å; S328-Q332 PolarHBondContact OG-NE2 3.04Å
329	R	92	Very high	89.2	Confident	67 Å²	67	67.4 Å²	67.4	25%	0.253	33%	0.326	S	S	.	.	H	α-helix	trans	-65.5	-39.1	178.7	-69.5	-160.5	-168.4	-169.8	-3.5	112.4	I315 A316 I317 M321 E325 Q331 Q332 F333	I315-R329 HydrophobicContact CD1-CB 3.49Å; I315-R329 VanDerWaalsContact CD1-CB 3.49Å; I315-R329 HydrophobicContact CD1-CG 3.72Å; I315-R329 WeakPolarHBondContact CD1-O 3.49Å; I315-R329 HydrophobicContact CG1-CB 3.92Å; I315-R329 HydrophobicContact CG1-CG 4.02Å; A316-R329 WeakPolarHBondContact O-CD 3.34Å; A316-R329 PolarHBondContact O-NH1 2.87Å; I317-R329 HydrophobicContact CD1-CB 3.99Å; I317-R329 HydrophobicContact CG1-CB 3.83Å; M321-R329 VanDerWaalsContact CE-CD 3.45Å; M321-R329 HydrophobicContact CE-CG 4.15Å; M321-R329 VanDerWaalsContact CE-CZ 3.49Å; E325-R329 HydrophobicContact CG-CG 4.44Å; E325-R329 WeakPolarHBondContact O-CB 3.43Å; E325-R329 WeakPolarHBondContact O-CG 3.29Å; E325-R329 PolarHBondContact O-N 2.78Å; E325-R329 IonicContact OE1-CZ 3.12Å; E325-R329 VanDerWaalsContact OE1-CZ 3.23Å; E325-R329 IonicContact OE1-NE 2.78Å; E325-R329 PolarHBondContact OE1-NE 3.24Å; E325-R329 VanDerWaalsContact OE1-NE 3.12Å; E325-R329 IonicContact OE1-NH2 3.15Å; E325-R329 PolarHBondContact OE1-NH2 2.86Å; R329-Q331 VanDerWaalsContact C-N 3.34Å; R329-Q331 PolarHBondContact O-N 2.62Å; R329-Q332 PolarHBondContact O-N 3.18Å; R329-F333 PolarHBondContact O-N 2.83Å
330	Y	86.6	Confident	89.7	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.008	29%	0.294	C	S	.	.	H	α-helix	trans	-59.9	-46.4	174	173.1	-131.7	0	0	0	111.3	Q128 R326 L327 S328 F333 K334 M351 D352 I353	Q128-Y330 PolarHBondContact OE1-OH 3.5Å; R326-Y330 WeakPolarHBondContact O-CB 3.27Å; R326-Y330 PolarHBondContact O-N 3Å; L327-Y330 PolarHBondContact O-N 3Å; S328-Y330 PolarHBondContact O-N 2.9Å; Y330-F333 PolarHBondContact O-N 2.9Å; Y330-K334 PolarHBondContact O-N 3.27Å; Y330-M351 HydrophobicContact CD1-CE 4.25Å; Y330-M351 HydrophobicContact CD2-CE 3.09Å; Y330-M351 HydrophobicContact CE1-CE 4.11Å; Y330-M351 HydrophobicContact CE2-CE 2.95Å; Y330-M351 HydrophobicContact CG-CE 3.76Å; Y330-M351 VanDerWaalsContact CZ-CE 3.47Å; Y330-D352 PolarHBondContact OH-O 3.35Å; Y330-I353 HydrophobicContact CE2-CD1 3.95Å; Y330-I353 HydrophobicContact CE2-CG1 4.04Å
331	Q	86.8	Confident	90.1	Very high	65 Å²	65	56.1 Å²	56.1	30%	0.304	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-43.8	177.4	-168.7	61.7	49.3	0	0	111.7	L327 S328 R329 F333 K334 D335	L327-Q331 WeakPolarHBondContact O-CB 3.37Å; L327-Q331 PolarHBondContact O-N 3.1Å; S328-Q331 PolarHBondContact O-N 2.85Å; R329-Q331 VanDerWaalsContact C-N 3.34Å; R329-Q331 PolarHBondContact O-N 2.62Å; Q331-F333 VanDerWaalsContact C-N 3.28Å; Q331-F333 PolarHBondContact O-N 3.17Å; Q331-K334 PolarHBondContact O-N 3.4Å; Q331-K334 VanDerWaalsContact O-N 3.16Å; Q331-D335 PolarHBondContact NE2-OD1 3.32Å; Q331-D335 PolarHBondContact NE2-OD2 2.88Å; Q331-D335 WeakPolarHBondContact O-CB 3.45Å; Q331-D335 PolarHBondContact O-N 3.16Å
332	Q	92.3	Very high	90.4	Very high	58 Å²	58	55.3 Å²	55.3	27%	0.271	26%	0.262	S	S	.	.	H	α-helix	trans	-57.2	-41.1	175.2	-69.4	169.3	50.3	0	0	112.2	I315 S328 R329 Q337	I315-Q332 HydrophobicContact CD1-CB 4.14Å; S328-Q332 VanDerWaalsContact O-CG 3.26Å; S328-Q332 WeakPolarHBondContact O-CG 3.17Å; S328-Q332 PolarHBondContact O-N 3.29Å; S328-Q332 PolarHBondContact O-NE2 3.48Å; S328-Q332 PolarHBondContact OG-NE2 3.04Å; R329-Q332 PolarHBondContact O-N 3.18Å; Q332-Q337 HydrophobicContact CB-CB 4.4Å; Q332-Q337 HydrophobicContact CB-CG 4.5Å; Q332-Q337 VanDerWaalsContact O-CB 3.25Å; Q332-Q337 WeakPolarHBondContact O-CB 3.42Å; Q332-Q337 WeakPolarHBondContact O-CG 3.48Å; Q332-Q337 PolarHBondContact O-N 2.79Å
333	F	91	Very high	90.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-68.4	-44	176.3	-173.7	-113.7	0	0	0	111.6	Q289 V291 I315 R329 Y330 Q331 D335 F336 R338 L341 I353 V356	Q289-F333 HydrophobicContact CB-CE2 4.21Å; Q289-F333 HydrophobicContact CB-CZ 3.86Å; Q289-F333 HydrophobicContact CG-CE2 4.43Å; Q289-F333 HydrophobicContact CG-CZ 4.42Å; Q289-F333 VanDerWaalsContact NE2-CE2 3.33Å; Q289-F333 PolarHBondContact NE2-O 2.6Å; V291-F333 HydrophobicContact CG2-CE1 4.12Å; V291-F333 HydrophobicContact CG2-CZ 4.2Å; I315-F333 HydrophobicContact CG2-CB 4.06Å; I315-F333 HydrophobicContact CG2-CD2 3.96Å; I315-F333 HydrophobicContact CG2-CG 4.25Å; R329-F333 PolarHBondContact O-N 2.83Å; Y330-F333 PolarHBondContact O-N 2.9Å; Q331-F333 VanDerWaalsContact C-N 3.28Å; Q331-F333 PolarHBondContact O-N 3.17Å; F333-D335 VanDerWaalsContact C-N 3.3Å; F333-D335 PolarHBondContact O-N 2.99Å; F333-F336 PolarHBondContact O-N 3.26Å; F333-R338 HydrophobicContact CD2-CB 4.49Å; F333-R338 VanDerWaalsContact CD2-O 3.29Å; F333-R338 WeakPolarHBondContact CD2-O 3.44Å; F333-R338 WeakPolarHBondContact CE2-O 3.17Å; F333-L341 HydrophobicContact CD1-CB 3.91Å; F333-L341 HydrophobicContact CD1-CD2 3.81Å; F333-L341 HydrophobicContact CD1-CG 4.41Å; F333-L341 HydrophobicContact CD2-CB 3.86Å; F333-L341 HydrophobicContact CE1-CB 3.61Å; F333-L341 HydrophobicContact CE1-CD2 3.8Å; F333-L341 HydrophobicContact CE1-CG 4.35Å; F333-L341 HydrophobicContact CE2-CB 3.56Å; F333-L341 HydrophobicContact CG-CB 4.03Å; F333-L341 HydrophobicContact CG-CD2 4.49Å; F333-L341 HydrophobicContact CZ-CB 3.43Å; F333-L341 VanDerWaalsContact CZ-CB 3.43Å; F333-L341 HydrophobicContact CZ-CD2 4.47Å; F333-I353 HydrophobicContact CD1-CD1 3.65Å; F333-I353 HydrophobicContact CD1-CG2 4.23Å; F333-I353 HydrophobicContact CE1-CD1 3.53Å; F333-I353 HydrophobicContact CE1-CG2 3.93Å; F333-V356 HydrophobicContact CE1-CG2 3.99Å; F333-V356 HydrophobicContact CZ-CG2 4.12Å
334	K	84.9	Confident	90.8	Very high	64 Å²	64	51.5 Å²	51.5	28%	0.278	24%	0.237	S	C	.	.	H	α-helix	trans	-61.5	-37.4	176.3	-172.1	173.1	179.6	169.3	0	112.6	Y330 Q331 F336	Y330-K334 PolarHBondContact O-N 3.27Å; Q331-K334 PolarHBondContact O-N 3.4Å; Q331-K334 VanDerWaalsContact O-N 3.16Å; K334-F336 PolarHBondContact O-N 2.83Å; K334-F336 VanDerWaalsContact O-N 3.16Å
335	D	89.1	Confident	90.1	Very high	90 Å²	90	46.8 Å²	46.8	48%	0.481	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	9.9	176.1	-63.7	-16.8	0	0	0	113	Q331 F333 Q337	Q331-D335 PolarHBondContact NE2-OD1 3.32Å; Q331-D335 PolarHBondContact NE2-OD2 2.88Å; Q331-D335 WeakPolarHBondContact O-CB 3.45Å; Q331-D335 PolarHBondContact O-N 3.16Å; F333-D335 VanDerWaalsContact C-N 3.3Å; F333-D335 PolarHBondContact O-N 2.99Å; D335-Q337 VanDerWaalsContact C-N 3.25Å; D335-Q337 HydrophobicContact CB-CG 4.28Å; D335-Q337 PolarHBondContact O-N 3.3Å
336	F	91.3	Very high	88.7	Confident	76 Å²	76	45.8 Å²	45.8	33%	0.333	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	25.1	177	-160.5	-105.2	0	0	0	114.4	Q289 F333 K334 R338 R339 R355	Q289-F336 HydrophobicContact CG-CD2 3.59Å; Q289-F336 HydrophobicContact CG-CE2 3.55Å; F333-F336 PolarHBondContact O-N 3.26Å; K334-F336 PolarHBondContact O-N 2.83Å; K334-F336 VanDerWaalsContact O-N 3.16Å; F336-R338 VanDerWaalsContact C-N 3.27Å; F336-R338 PolarHBondContact O-N 3.44Å; F336-R339 HydrophobicContact CE2-CG 4.35Å; F336-R339 HydrophobicContact CZ-CG 4.15Å; F336-R355 VanDerWaalsContact CB-NH1 3.3Å
337	Q	93.7	Very high	87.4	Confident	117 Å²	117	45.6 Å²	45.6	55%	0.547	21%	0.212	S	C	.	.	S	Bend	trans	-72.2	-24	176.8	-57.7	-177.1	17.9	0	0	112.6	Q332 D335	Q332-Q337 HydrophobicContact CB-CB 4.4Å; Q332-Q337 HydrophobicContact CB-CG 4.5Å; Q332-Q337 VanDerWaalsContact O-CB 3.25Å; Q332-Q337 WeakPolarHBondContact O-CB 3.42Å; Q332-Q337 WeakPolarHBondContact O-CG 3.48Å; Q332-Q337 PolarHBondContact O-N 2.79Å; D335-Q337 VanDerWaalsContact C-N 3.25Å; D335-Q337 HydrophobicContact CB-CG 4.28Å; D335-Q337 PolarHBondContact O-N 3.3Å
338	R	92.4	Very high	85.9	Confident	102 Å²	102	44.5 Å²	44.5	39%	0.385	21%	0.207	S	C	.	.			trans	-135.7	143	176.5	-61.2	-69.9	-171.1	173.3	3.7	108.8	Q289 I315 F333 F336	Q289-R338 PolarHBondContact NE2-O 2.96Å; I315-R338 HydrophobicContact CB-CB 4.36Å; I315-R338 HydrophobicContact CB-CG 4.23Å; I315-R338 HydrophobicContact CG2-CB 4.31Å; F333-R338 HydrophobicContact CD2-CB 4.49Å; F333-R338 VanDerWaalsContact CD2-O 3.29Å; F333-R338 WeakPolarHBondContact CD2-O 3.44Å; F333-R338 WeakPolarHBondContact CE2-O 3.17Å; F336-R338 VanDerWaalsContact C-N 3.27Å; F336-R338 PolarHBondContact O-N 3.44Å
339	R	94.4	Very high	84.7	Confident	115 Å²	115	42.5 Å²	42.5	43%	0.434	19%	0.19	S	C	.	.	S	Bend	trans	-91.1	-19.4	-178.3	-68.5	176.2	66.9	-158	3.1	113.2	F287 N288 Q289 V290 F336	F287-R339 HydrophobicContact CE2-CB 4.09Å; F287-R339 PolarHBondContact O-NH2 2.64Å; N288-R339 PolarHBondContact O-NE 3.04Å; N288-R339 VanDerWaalsContact O-NE 3.17Å; Q289-R339 CarbonylContact C-O 3.49Å; Q289-R339 WeakPolarHBondContact CA-O 3.1Å; Q289-R339 WeakPolarHBondContact CB-O 3.48Å; V290-R339 PolarHBondContact N-O 3.12Å; F336-R339 HydrophobicContact CE2-CG 4.35Å; F336-R339 HydrophobicContact CZ-CG 4.15Å
340	I	96.1	Very high	83.1	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	128.6	-177.6	-61.6	161.7	0	0	0	110.4	L282 F287 V290 I292 L307 F312 P313 A314 I315 V342	L282-I340 HydrophobicContact CD1-CD1 4.13Å; L282-I340 HydrophobicContact CD2-CD1 4.38Å; F287-I340 HydrophobicContact CE2-CG1 4.2Å; F287-I340 HydrophobicContact CZ-CD1 4.31Å; F287-I340 HydrophobicContact CZ-CG1 4.36Å; V290-I340 HydrophobicContact CB-CG1 4.22Å; V290-I340 WeakPolarHBondContact O-CA 3.44Å; I292-I340 HydrophobicContact CD1-CG2 3.68Å; I292-I340 HydrophobicContact CG1-CG2 4.2Å; L307-I340 HydrophobicContact CD1-CG2 4.07Å; F312-I340 HydrophobicContact CB-CD1 3.82Å; F312-I340 HydrophobicContact CD1-CD1 3.69Å; F312-I340 HydrophobicContact CG-CD1 4.15Å; P313-I340 PolarHBondContact O-N 3.31Å; A314-I340 CarbonylContact C-O 3.49Å; A314-I340 VanDerWaalsContact CA-O 3.24Å; A314-I340 WeakPolarHBondContact CA-O 3.15Å; A314-I340 HydrophobicContact CB-CB 4.02Å; A314-I340 HydrophobicContact CB-CG2 4.02Å; I315-I340 PolarHBondContact N-O 3.37Å; I340-V342 HydrophobicContact CG2-CG2 4.48Å
341	L	94.8	Very high	82.1	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124	170.7	168.4	63.6	0	0	0	109.5	V290 V291 I292 I315 I317 F333 A343 F347 I353	V290-L341 PolarHBondContact O-N 3.19Å; V291-L341 CarbonylContact C-O 3.59Å; V291-L341 WeakPolarHBondContact CA-O 3.37Å; V291-L341 HydrophobicContact CG1-CD2 4.29Å; V291-L341 HydrophobicContact CG1-CG 4.43Å; V291-L341 HydrophobicContact CG2-CB 4.36Å; V291-L341 HydrophobicContact CG2-CD2 4.24Å; I292-L341 PolarHBondContact N-O 3Å; I315-L341 HydrophobicContact CG2-CB 4.33Å; I315-L341 HydrophobicContact CG2-CD1 3.92Å; I315-L341 CarbonylContact O-C 3.59Å; I315-L341 WeakPolarHBondContact O-CA 3.37Å; I317-L341 HydrophobicContact CB-CD1 4.23Å; I317-L341 HydrophobicContact CD1-CD1 3.6Å; I317-L341 HydrophobicContact CG1-CD1 3.61Å; F333-L341 HydrophobicContact CD1-CB 3.91Å; F333-L341 HydrophobicContact CD1-CD2 3.81Å; F333-L341 HydrophobicContact CD1-CG 4.41Å; F333-L341 HydrophobicContact CD2-CB 3.86Å; F333-L341 HydrophobicContact CE1-CB 3.61Å; F333-L341 HydrophobicContact CE1-CD2 3.8Å; F333-L341 HydrophobicContact CE1-CG 4.35Å; F333-L341 HydrophobicContact CE2-CB 3.56Å; F333-L341 HydrophobicContact CG-CB 4.03Å; F333-L341 HydrophobicContact CG-CD2 4.49Å; F333-L341 HydrophobicContact CZ-CB 3.43Å; F333-L341 VanDerWaalsContact CZ-CB 3.43Å; F333-L341 HydrophobicContact CZ-CD2 4.47Å; L341-A343 HydrophobicContact CD1-CB 4.37Å; L341-A343 HydrophobicContact CG-CB 4.23Å; L341-F347 HydrophobicContact CD2-CD1 4.06Å; L341-I353 HydrophobicContact CD2-CD1 4.44Å
342	V	96	Very high	81.2	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	127.7	168.2	-172.1	0	0	0	0	108.8	I292 V294 C300 L303 A304 L307 I315 A316 I317 I340	I292-V342 HydrophobicContact CB-CG2 4.42Å; I292-V342 HydrophobicContact CD1-CG2 4.46Å; I292-V342 CarbonylContact O-C 3.18Å; I292-V342 WeakPolarHBondContact O-CA 3.23Å; V294-V342 HydrophobicContact CG1-CG1 4.12Å; V294-V342 HydrophobicContact CG2-CG1 4.29Å; C300-V342 HydrophobicContact CB-CG1 4.41Å; C300-V342 PolarHBondContact SG-O 3.49Å; L303-V342 HydrophobicContact CB-CG1 4.35Å; L303-V342 HydrophobicContact CD2-CG1 4.12Å; L303-V342 HydrophobicContact CG-CG1 4.44Å; A304-V342 HydrophobicContact CB-CB 4.12Å; A304-V342 HydrophobicContact CB-CG2 3.98Å; L307-V342 HydrophobicContact CD1-CG2 3.56Å; I315-V342 PolarHBondContact O-N 2.95Å; A316-V342 CarbonylContact C-O 3.53Å; A316-V342 WeakPolarHBondContact CA-O 3.4Å; I317-V342 PolarHBondContact N-O 3.12Å; I340-V342 HydrophobicContact CG2-CG2 4.48Å
343	A	92.9	Very high	80.3	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	154	-172.3	0	0	0	0	0	114.9	I292 F293 V294 I317 L341 F347	I292-A343 PolarHBondContact O-N 3.23Å; F293-A343 CarbonylContact C-O 3.31Å; F293-A343 VanDerWaalsContact CA-O 3.31Å; F293-A343 WeakPolarHBondContact CA-O 3.44Å; V294-A343 PolarHBondContact N-O 3.39Å; I317-A343 WeakPolarHBondContact O-CA 3.25Å; L341-A343 HydrophobicContact CD1-CB 4.37Å; L341-A343 HydrophobicContact CG-CB 4.23Å; A343-F347 HydrophobicContact CB-CB 3.53Å; A343-F347 HydrophobicContact CB-CD1 4.22Å; A343-F347 HydrophobicContact CB-CD2 3.55Å; A343-F347 HydrophobicContact CB-CG 3.45Å; A343-F347 VanDerWaalsContact CB-CG 3.45Å
344	T	89.6	Confident	79.4	Confident	9 Å²	9	41.4 Å²	41.4	6%	0.055	19%	0.191	C	C	.	.			trans	-87.5	173.7	167.8	55.6	0	0	0	0	111.8	V294 C300 H318 L346 F347	V294-T344 HydrophobicContact CG2-CG2 4.27Å; V294-T344 WeakPolarHBondContact O-CA 3.36Å; C300-T344 HydrophobicContact CB-CG2 4.3Å; H318-T344 HydrophobicContact CB-CG2 4.11Å; T344-L346 PolarHBondContact O-N 2.78Å; T344-F347 PolarHBondContact O-N 3.27Å
345	N	72.6	Confident	79.4	Confident	47 Å²	47	44.6 Å²	44.6	25%	0.251	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-45.4	-29.3	-176.5	-65	10.1	0	0	0	115.9	F347 G348 E366 R374	N345-F347 PolarHBondContact O-N 3.06Å; N345-G348 PolarHBondContact O-N 2.84Å; N345-E366 PolarHBondContact ND2-OE1 3.49Å; N345-R374 PolarHBondContact OD1-NH2 2.91Å
346	L	62	Low	79.3	Confident	53 Å²	53	40.6 Å²	40.6	28%	0.277	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-52.8	-23.6	176.1	-75.9	167	0	0	0	113.8	R319 T344	R319-L346 HydrophobicContact CB-CD1 3.42Å; R319-L346 VanDerWaalsContact CB-CD1 3.42Å; T344-L346 PolarHBondContact O-N 2.78Å
347	F	61.3	Low	79.2	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.018	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-92.3	-9	178.5	-73.1	-96.9	0	0	0	114	E124 F293 I317 L341 A343 T344 N345 R349 M351	E124-F347 HydrophobicContact CG-CZ 4.34Å; F293-F347 HydrophobicContact CE1-CB 4.06Å; I317-F347 HydrophobicContact CB-CD2 4.34Å; I317-F347 HydrophobicContact CB-CE1 3.78Å; I317-F347 HydrophobicContact CB-CE2 3.5Å; I317-F347 VanDerWaalsContact CB-CE2 3.5Å; I317-F347 HydrophobicContact CB-CZ 3.26Å; I317-F347 HydrophobicContact CD1-CD1 4.34Å; I317-F347 HydrophobicContact CD1-CE1 3.46Å; I317-F347 VanDerWaalsContact CD1-CE1 3.46Å; I317-F347 HydrophobicContact CD1-CZ 3.78Å; I317-F347 HydrophobicContact CG1-CE1 4.2Å; I317-F347 HydrophobicContact CG1-CZ 4.11Å; I317-F347 HydrophobicContact CG2-CE1 3.91Å; I317-F347 HydrophobicContact CG2-CE2 3.41Å; I317-F347 VanDerWaalsContact CG2-CE2 3.41Å; I317-F347 HydrophobicContact CG2-CZ 3.02Å; L341-F347 HydrophobicContact CD2-CD1 4.06Å; A343-F347 HydrophobicContact CB-CB 3.53Å; A343-F347 HydrophobicContact CB-CD1 4.22Å; A343-F347 HydrophobicContact CB-CD2 3.55Å; A343-F347 HydrophobicContact CB-CG 3.45Å; A343-F347 VanDerWaalsContact CB-CG 3.45Å; T344-F347 PolarHBondContact O-N 3.27Å; N345-F347 PolarHBondContact O-N 3.06Å; F347-R349 VanDerWaalsContact C-N 3.31Å; F347-R349 PolarHBondContact O-N 2.66Å; F347-M351 HydrophobicContact CB-SD 3.97Å; F347-M351 HydrophobicContact CD1-CE 3.41Å; F347-M351 VanDerWaalsContact CD1-CE 3.41Å; F347-M351 HydrophobicContact CD1-SD 3.13Å; F347-M351 WeakPolarHBondContact CD1-SD 3.46Å; F347-M351 HydrophobicContact CE1-CE 3.5Å; F347-M351 HydrophobicContact CE1-SD 3.56Å; F347-M351 VanDerWaalsContact CE1-SD 3.56Å; F347-M351 HydrophobicContact CG-SD 3.81Å
348	G	54.6	Low	79.2	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.01	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-25.1	-176.2	0	0	0	0	0	113.3	N345 H373 R377	N345-G348 PolarHBondContact O-N 2.84Å; G348-H373 CarbonylContact O-C 3.53Å; G348-H373 WeakPolarHBondContact O-CB 3.33Å; G348-R377 VanDerWaalsContact O-CZ 3.26Å; G348-R377 PolarHBondContact O-NE 3.4Å; G348-R377 PolarHBondContact O-NH2 3.04Å
349	R	64.7	Low	79.2	Confident	19 Å²	19	27 Å²	27	7%	0.072	12%	0.123	C	C	.	.	S	Bend	trans	-112.1	147.4	-171.5	-66.6	-165.9	-175.1	-130.8	-6.6	111.9	E197 D199 F347 M351 H373 R377	E197-R349 VanDerWaalsContact OE1-CB 3.32Å; E197-R349 WeakPolarHBondContact OE1-CB 3.47Å; E197-R349 WeakPolarHBondContact OE2-CB 3.47Å; D199-R349 IonicContact OD2-NH1 3.07Å; D199-R349 PolarHBondContact OD2-NH1 2.91Å; F347-R349 VanDerWaalsContact C-N 3.31Å; F347-R349 PolarHBondContact O-N 2.66Å; R349-M351 PolarHBondContact O-N 3.09Å; R349-H373 HydrophobicContact CG-CB 3.94Å; R349-H373 VanDerWaalsContact CZ-NE2 3.35Å; R349-H373 PolarHBondContact NH1-NE2 2.89Å; R349-H373 VanDerWaalsContact NH1-NE2 3.12Å; R349-H373 PolarHBondContact NH2-CD2 2.86Å; R349-R377 VanDerWaalsContact CA-NH2 3.34Å
350	G	57.7	Low	79.3	Confident	9 Å²	9	21.6 Å²	21.6	9%	0.093	10%	0.102	C	C	.	.	S	Bend	trans	67.5	-33.2	177.7	0	0	0	0	0	120.4	Q128 E197 R380	Q128-G350 PolarHBondContact NE2-O 2.83Å; Q128-G350 PolarHBondContact OE1-O 2.85Å; E197-G350 WeakPolarHBondContact OE1-CA 3.21Å; E197-G350 PolarHBondContact OE1-N 3Å; G350-R380 PolarHBondContact O-NH2 2.93Å; G350-R380 VanDerWaalsContact O-NH2 3.11Å
351	M	66	Low	79.4	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.01	10%	0.102	C	C	.	.			trans	-71.8	131.2	-163.4	-66.5	-175.6	65.3	0	0	116.6	E124 Q128 Y330 F347 R349 I353 R377 R380	E124-M351 HydrophobicContact CB-CG 4.31Å; E124-M351 HydrophobicContact CB-SD 4.09Å; E124-M351 HydrophobicContact CG-SD 4.43Å; Q128-M351 VanDerWaalsContact OE1-CA 3.25Å; Y330-M351 HydrophobicContact CD1-CE 4.25Å; Y330-M351 HydrophobicContact CD2-CE 3.09Å; Y330-M351 HydrophobicContact CE1-CE 4.11Å; Y330-M351 HydrophobicContact CE2-CE 2.95Å; Y330-M351 HydrophobicContact CG-CE 3.76Å; Y330-M351 VanDerWaalsContact CZ-CE 3.47Å; F347-M351 HydrophobicContact CB-SD 3.97Å; F347-M351 HydrophobicContact CD1-CE 3.41Å; F347-M351 VanDerWaalsContact CD1-CE 3.41Å; F347-M351 HydrophobicContact CD1-SD 3.13Å; F347-M351 WeakPolarHBondContact CD1-SD 3.46Å; F347-M351 HydrophobicContact CE1-CE 3.5Å; F347-M351 HydrophobicContact CE1-SD 3.56Å; F347-M351 VanDerWaalsContact CE1-SD 3.56Å; F347-M351 HydrophobicContact CG-SD 3.81Å; R349-M351 PolarHBondContact O-N 3.09Å; M351-I353 HydrophobicContact CE-CD1 4.46Å; M351-R377 VanDerWaalsContact O-CD 3.3Å; M351-R377 WeakPolarHBondContact O-CD 3.38Å; M351-R377 PolarHBondContact O-NH1 2.9Å; M351-R380 PolarHBondContact O-NE 3.08Å; M351-R380 PolarHBondContact O-NH2 3.36Å
352	D	68.5	Low	79.5	Confident	12 Å²	12	21.9 Å²	21.9	6%	0.064	10%	0.103	C	C	.	.			trans	-108	109.2	-176	-164.5	1.7	0	0	0	113	Q128 Y330 R380	Q128-D352 HydrophobicContact CG-CB 4.5Å; Y330-D352 PolarHBondContact OH-O 3.35Å; D352-R380 VanDerWaalsContact CA-NH2 3.34Å; D352-R380 VanDerWaalsContact CB-CZ 3.4Å; D352-R380 WeakPolarHBondContact OD1-CD 3.35Å; D352-R380 IonicContact OD1-CZ 2.69Å; D352-R380 VanDerWaalsContact OD1-CZ 3.26Å; D352-R380 IonicContact OD1-NE 3.7Å; D352-R380 PolarHBondContact OD1-NE 2.92Å; D352-R380 IonicContact OD1-NH1 3.45Å; D352-R380 PolarHBondContact OD1-NH1 3.14Å; D352-R380 IonicContact OD2-CZ 2.68Å; D352-R380 IonicContact OD2-NH1 3.48Å; D352-R380 PolarHBondContact OD2-NH1 2.91Å
353	I	73.6	Confident	79.6	Confident	15 Å²	15	22 Å²	22	8%	0.077	10%	0.104	C	C	.	.			trans	-139.2	85	-178.9	-41.3	175.8	0	0	0	107.4	Y330 F333 L341 M351 R355 V356	Y330-I353 HydrophobicContact CE2-CD1 3.95Å; Y330-I353 HydrophobicContact CE2-CG1 4.04Å; F333-I353 HydrophobicContact CD1-CD1 3.65Å; F333-I353 HydrophobicContact CD1-CG2 4.23Å; F333-I353 HydrophobicContact CE1-CD1 3.53Å; F333-I353 HydrophobicContact CE1-CG2 3.93Å; L341-I353 HydrophobicContact CD2-CD1 4.44Å; M351-I353 HydrophobicContact CE-CD1 4.46Å; I353-R355 PolarHBondContact O-N 2.86Å; I353-V356 HydrophobicContact CB-CG2 3.71Å; I353-V356 HydrophobicContact CD1-CG2 4.45Å; I353-V356 HydrophobicContact CG2-CG2 3.6Å; I353-V356 WeakPolarHBondContact O-CB 3.42Å; I353-V356 PolarHBondContact O-N 3.37Å
354	E	72.3	Confident	79.7	Confident	130 Å²	130	22.7 Å²	22.7	61%	0.607	11%	0.107	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-29.6	-174.1	-66.2	167.8	-166.4	0	0	114	V356	E354-V356 VanDerWaalsContact C-N 3.32Å; E354-V356 PolarHBondContact O-N 2.99Å
355	R	82.9	Confident	79.9	Confident	131 Å²	131	22.3 Å²	22.3	49%	0.494	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-0.7	-177.7	-62.4	180	-175.2	-160.9	1.5	114	N288 Q289 F336 I353 N357	N288-R355 HydrophobicContact CB-CB 4.49Å; N288-R355 WeakPolarHBondContact CB-O 3.4Å; Q289-R355 HydrophobicContact CG-CB 4.13Å; Q289-R355 PolarHBondContact N-O 2.8Å; F336-R355 VanDerWaalsContact CB-NH1 3.3Å; I353-R355 PolarHBondContact O-N 2.86Å; R355-N357 PolarHBondContact O-N 3.37Å
356	V	88	Confident	80.8	Confident	6 Å²	6	26.1 Å²	26.1	4%	0.036	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	113.4	175.5	174.3	0	0	0	0	109.1	Q289 V291 F333 I353 E354	Q289-V356 HydrophobicContact CB-CG2 4.01Å; Q289-V356 WeakPolarHBondContact O-CA 3.5Å; V291-V356 HydrophobicContact CB-CG1 4.38Å; V291-V356 HydrophobicContact CG2-CB 4.36Å; V291-V356 HydrophobicContact CG2-CG1 3.73Å; V291-V356 HydrophobicContact CG2-CG2 3.66Å; F333-V356 HydrophobicContact CE1-CG2 3.99Å; F333-V356 HydrophobicContact CZ-CG2 4.12Å; I353-V356 HydrophobicContact CB-CG2 3.71Å; I353-V356 HydrophobicContact CD1-CG2 4.45Å; I353-V356 HydrophobicContact CG2-CG2 3.6Å; I353-V356 WeakPolarHBondContact O-CB 3.42Å; I353-V356 PolarHBondContact O-N 3.37Å; E354-V356 VanDerWaalsContact C-N 3.32Å; E354-V356 PolarHBondContact O-N 2.99Å
357	N	89.4	Confident	82.1	Confident	10 Å²	10	26 Å²	26	5%	0.053	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	-11	177.3	68.5	-59.8	0	0	0	112.5	F287 N288 Q289 R355 G385 L386 I424	F287-N357 WeakPolarHBondContact CA-ND2 3.18Å; F287-N357 WeakPolarHBondContact CA-OD1 3.04Å; F287-N357 WeakPolarHBondContact CB-OD1 3.31Å; N288-N357 PolarHBondContact N-OD1 3.28Å; Q289-N357 PolarHBondContact N-OD1 2.87Å; Q289-N357 PolarHBondContact O-N 2.87Å; Q289-N357 PolarHBondContact O-OD1 3.27Å; R355-N357 PolarHBondContact O-N 3.37Å; N357-G385 CarbonylContact O-C 3.6Å; N357-G385 WeakPolarHBondContact O-CA 3.42Å; N357-L386 PolarHBondContact O-N 2.85Å; N357-I424 WeakPolarHBondContact ND2-CG1 3.34Å
358	I	93.2	Very high	83.5	Confident	0 Å²	0	26 Å²	26	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	130.1	173.6	-50.3	-171.9	0	0	0	111.4	L285 F287 V290 V291 F360 L386 Y423	L285-I358 HydrophobicContact CB-CD1 3.88Å; L285-I358 HydrophobicContact CD1-CD1 4.17Å; F287-I358 HydrophobicContact CB-CD1 3.69Å; F287-I358 HydrophobicContact CB-CG1 3.94Å; F287-I358 HydrophobicContact CD1-CD1 4.29Å; F287-I358 HydrophobicContact CG-CD1 4.4Å; V290-I358 WeakPolarHBondContact CA-O 3.36Å; V290-I358 HydrophobicContact CG2-CB 4Å; V291-I358 PolarHBondContact N-O 3.22Å; I358-F360 HydrophobicContact CG2-CD2 3.87Å; I358-F360 HydrophobicContact CG2-CE2 3.51Å; I358-F360 HydrophobicContact CG2-CZ 4.04Å; I358-L386 CarbonylContact C-O 3.08Å; I358-L386 VanDerWaalsContact CA-O 3.27Å; I358-L386 WeakPolarHBondContact CA-O 3.4Å; I358-L386 HydrophobicContact CD1-CD2 4.15Å; I358-L386 HydrophobicContact CG1-CB 4.24Å; I358-L386 HydrophobicContact CG1-CD2 4.39Å; I358-L386 HydrophobicContact CG2-CG 4.47Å; I358-Y423 HydrophobicContact CD1-CE2 3.93Å; I358-Y423 HydrophobicContact CG1-CD2 4.36Å; I358-Y423 HydrophobicContact CG1-CE2 4.12Å
359	A	93.2	Very high	84.9	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.008	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	119.7	170.8	0	0	0	0	0	110.7	V291 F293 A378 L386 A387 I388	V291-A359 CarbonylContact O-C 3.59Å; V291-A359 WeakPolarHBondContact O-CA 3.4Å; F293-A359 HydrophobicContact CE2-CB 4.48Å; A359-A378 HydrophobicContact CB-CB 4.12Å; A359-L386 PolarHBondContact N-O 3.02Å; A359-A387 VanDerWaalsContact O-CA 3.29Å; A359-A387 WeakPolarHBondContact O-CA 3.46Å; A359-I388 PolarHBondContact O-N 3.31Å
360	F	96.3	Very high	86	Confident	1 Å²	1	26.7 Å²	26.7	0%	0.004	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126.3	172.1	-75.4	-82	0	0	0	110.9	L278 L281 L282 L285 V290 V291 I292 F293 I358 Y362 I388	L278-F360 HydrophobicContact CD1-CD1 4.04Å; L278-F360 HydrophobicContact CD1-CD2 4.07Å; L278-F360 HydrophobicContact CD1-CE1 4.15Å; L278-F360 HydrophobicContact CD1-CE2 4.17Å; L278-F360 HydrophobicContact CD1-CG 4Å; L278-F360 HydrophobicContact CD1-CZ 4.21Å; L281-F360 HydrophobicContact CB-CE1 4.25Å; L281-F360 HydrophobicContact CB-CZ 4.05Å; L281-F360 HydrophobicContact CD1-CE1 3.81Å; L281-F360 HydrophobicContact CD1-CZ 4.43Å; L282-F360 HydrophobicContact CD2-CE2 4.03Å; L285-F360 HydrophobicContact CD1-CZ 4.14Å; V290-F360 HydrophobicContact CG1-CD2 3.51Å; V290-F360 HydrophobicContact CG1-CE2 3.81Å; V291-F360 PolarHBondContact O-N 2.73Å; I292-F360 HydrophobicContact CB-CB 4.38Å; I292-F360 HydrophobicContact CG1-CB 4.22Å; I292-F360 HydrophobicContact CG1-CD2 4.21Å; I292-F360 HydrophobicContact CG2-CB 4.11Å; F293-F360 PolarHBondContact N-O 3.33Å; I358-F360 HydrophobicContact CG2-CD2 3.87Å; I358-F360 HydrophobicContact CG2-CE2 3.51Å; I358-F360 HydrophobicContact CG2-CZ 4.04Å; F360-Y362 PolarHBondContact O-N 3.13Å; F360-I388 CarbonylContact C-O 3.54Å; F360-I388 WeakPolarHBondContact CA-O 3.38Å; F360-I388 HydrophobicContact CD1-CB 3.75Å; F360-I388 HydrophobicContact CD1-CG2 4.06Å; F360-I388 HydrophobicContact CE1-CB 3.69Å; F360-I388 HydrophobicContact CE1-CD1 3.78Å; F360-I388 HydrophobicContact CE1-CG1 4.25Å; F360-I388 HydrophobicContact CE1-CG2 3.92Å; F360-I388 HydrophobicContact CZ-CD1 4.12Å
361	N	96.9	Very high	87.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	84.2	157.4	-70.8	-52.2	0	0	0	108	D363 R374 I388 T389 F390	N361-D363 VanDerWaalsContact C-N 3.28Å; N361-R374 WeakPolarHBondContact OD1-CD 3.27Å; N361-R374 PolarHBondContact OD1-NH1 3.06Å; N361-I388 PolarHBondContact N-O 2.85Å; N361-T389 HydrophobicContact CB-CG2 3.79Å; N361-T389 PolarHBondContact ND2-OG1 3.13Å; N361-T389 VanDerWaalsContact ND2-OG1 3.09Å; N361-F390 PolarHBondContact O-N 3.07Å
362	Y	97.8	Very high	88.5	Confident	9 Å²	9	26.8 Å²	26.8	4%	0.035	13%	0.125	C	C	.	.	S	Bend	trans	-65.1	-38.8	175.7	-178.2	-84.5	0	0	0	110.8	K274 N275 L278 I292 F293 V294 R299 L303 F360 F390	K274-Y362 HydrophobicContact CB-CD2 4.4Å; K274-Y362 HydrophobicContact CB-CE1 4.23Å; K274-Y362 HydrophobicContact CB-CE2 3.56Å; K274-Y362 VanDerWaalsContact CB-CZ 3.42Å; K274-Y362 WeakPolarHBondContact CB-OH 3.33Å; K274-Y362 HydrophobicContact CD-CD1 4.19Å; K274-Y362 HydrophobicContact CD-CE1 3.8Å; K274-Y362 HydrophobicContact CD-CE2 4.37Å; K274-Y362 WeakPolarHBondContact CD-O 3.41Å; K274-Y362 WeakPolarHBondContact CE-O 3.49Å; K274-Y362 PolarHBondContact NZ-O 3.36Å; N275-Y362 PolarHBondContact OD1-OH 2.79Å; L278-Y362 HydrophobicContact CB-CD2 4.48Å; L278-Y362 HydrophobicContact CB-CE2 4.4Å; L278-Y362 HydrophobicContact CD2-CD2 3.92Å; L278-Y362 HydrophobicContact CD2-CE2 4.06Å; I292-Y362 HydrophobicContact CG2-CG 4.36Å; F293-Y362 WeakPolarHBondContact O-CB 3.32Å; F293-Y362 PolarHBondContact O-N 3.37Å; F293-Y362 VanDerWaalsContact O-N 3.08Å; V294-Y362 HydrophobicContact CG1-CD1 3.93Å; V294-Y362 HydrophobicContact CG1-CG 4.27Å; R299-Y362 VanDerWaalsContact NH2-CE1 3.31Å; L303-Y362 HydrophobicContact CD1-CE2 4.18Å; L303-Y362 HydrophobicContact CD2-CD1 4.22Å; L303-Y362 HydrophobicContact CD2-CD2 3.87Å; L303-Y362 HydrophobicContact CD2-CE1 4.4Å; L303-Y362 HydrophobicContact CD2-CE2 4.07Å; L303-Y362 HydrophobicContact CD2-CG 3.95Å; F360-Y362 PolarHBondContact O-N 3.13Å; Y362-F390 AromaticContact CD2-CD2 3.99Å; Y362-F390 HydrophobicContact CD2-CD2 3.99Å; Y362-F390 AromaticContact CD2-CE2 3.85Å; Y362-F390 HydrophobicContact CD2-CE2 3.85Å; Y362-F390 HydrophobicContact CE2-CD2 4.42Å; Y362-F390 HydrophobicContact CE2-CE2 4.16Å; Y362-F390 HydrophobicContact CG-CD2 4.41Å
363	D	96.9	Very high	89.1	Confident	3 Å²	3	26.3 Å²	26.3	2%	0.016	12%	0.122	C	C	.	.	S	Bend	trans	-112.4	136.9	162.4	-62.5	-46.7	0	0	0	109.4	K274 F293 V294 K295 R299 N361 R374	K274-D363 IonicContact NZ-OD1 2.63Å; K274-D363 PolarHBondContact NZ-OD1 3.46Å; K274-D363 VanDerWaalsContact NZ-OD1 3.15Å; F293-D363 PolarHBondContact O-N 2.77Å; F293-D363 VanDerWaalsContact O-N 3.14Å; V294-D363 WeakPolarHBondContact CA-OD2 3.27Å; K295-D363 HydrophobicContact CB-CB 3.88Å; K295-D363 HydrophobicContact CD-CB 4.23Å; K295-D363 HydrophobicContact CG-CB 4.13Å; K295-D363 WeakPolarHBondContact CG-OD2 3.34Å; K295-D363 PolarHBondContact N-OD2 3.23Å; R299-D363 IonicContact CZ-OD1 3.42Å; R299-D363 IonicContact CZ-OD2 3.12Å; R299-D363 IonicContact NE-OD1 3.31Å; R299-D363 PolarHBondContact NE-OD1 2.85Å; R299-D363 IonicContact NE-OD2 3.25Å; R299-D363 PolarHBondContact NE-OD2 3.02Å; R299-D363 IonicContact NH2-OD1 2.74Å; R299-D363 PolarHBondContact NH2-OD1 2.91Å; R299-D363 IonicContact NH2-OD2 2.67Å; N361-D363 VanDerWaalsContact C-N 3.28Å; D363-R374 PolarHBondContact O-NH1 3.37Å
364	M	96.1	Very high	89.8	Confident	15 Å²	15	25.7 Å²	25.7	7%	0.074	12%	0.119	C	C	.	.			trans	-52.6	137.7	177.3	-164.5	68.8	-171.9	0	0	110.8	T389 D396 I399 L400	M364-T389 HydrophobicContact CE-CG2 4.39Å; M364-T389 HydrophobicContact SD-CG2 3.4Å; M364-T389 WeakPolarHBondContact SD-CG2 3.17Å; M364-D396 HydrophobicContact CB-CB 4.08Å; M364-D396 WeakPolarHBondContact CB-OD1 3.33Å; M364-D396 HydrophobicContact CG-CB 4.05Å; M364-D396 HydrophobicContact SD-CB 4.45Å; M364-I399 HydrophobicContact CE-CB 3.72Å; M364-I399 HydrophobicContact CE-CG2 3.55Å; M364-I399 HydrophobicContact CG-CB 4.27Å; M364-I399 HydrophobicContact CG-CD1 4.31Å; M364-I399 HydrophobicContact CG-CG2 4.3Å; M364-L400 HydrophobicContact CE-CB 3.68Å; M364-L400 HydrophobicContact CE-CD1 4.1Å; M364-L400 VanDerWaalsContact CE-N 3.26Å
365	P	93.2	Very high	90.4	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.006	9%	0.09	C	C	.	.			trans	-62.1	160.3	169.9	25.9	-33.1	0	0	0	111.5	T370 Y371	P365-T370 HydrophobicContact CB-CG2 3.88Å; P365-Y371 HydrophobicContact CG-CD2 3.71Å; P365-Y371 HydrophobicContact CG-CG 4.12Å
366	E	91.2	Very high	90.2	Very high	127 Å²	127	13.4 Å²	13.4	59%	0.593	7%	0.068	S	C	*	.	S	Bend	trans	-73.3	-29.5	-177.4	64.1	-159.5	137.7	0	0	113.5	N345	N345-E366 PolarHBondContact ND2-OE1 3.49Å
367	D	90.8	Very high	89.5	Confident	49 Å²	49	13.9 Å²	13.9	26%	0.262	7%	0.069	S	C	.	.	S	Bend	trans	-150.3	168.7	-178.8	55.8	40.5	0	0	0	111.1	D369 T370 Y371	D367-D369 PolarHBondContact O-N 3.43Å; D367-D369 PolarHBondContact OD1-N 3.47Å; D367-T370 PolarHBondContact O-N 2.86Å; D367-T370 WeakPolarHBondContact OD1-CA 3.22Å; D367-T370 WeakPolarHBondContact OD1-CB 3.45Å; D367-T370 PolarHBondContact OD1-N 3Å; D367-T370 PolarHBondContact OD1-OG1 3.26Å; D367-Y371 PolarHBondContact O-N 3.44Å; D367-Y371 VanDerWaalsContact O-N 3.1Å
368	S	89.8	Confident	88.4	Confident	4 Å²	4	13.4 Å²	13.4	3%	0.028	7%	0.066	C	C	.	.	H	α-helix	trans	-66.2	-33.1	-179.3	41.7	0	0	0	0	113.4	Y371 L372 D402 R406 F407	S368-Y371 WeakPolarHBondContact O-CB 3.41Å; S368-Y371 PolarHBondContact O-N 3.02Å; S368-L372 PolarHBondContact O-N 3.32Å; S368-L372 VanDerWaalsContact O-N 3.08Å; S368-D402 WeakPolarHBondContact CB-OD2 3.44Å; S368-D402 PolarHBondContact OG-OD2 3.36Å; S368-R406 WeakPolarHBondContact OG-CD 3.43Å; S368-R406 PolarHBondContact OG-NH1 3.05Å; S368-F407 WeakPolarHBondContact O-CE2 3.47Å
369	D	84.3	Confident	87	Confident	29 Å²	29	13.4 Å²	13.4	16%	0.155	7%	0.066	C	C	.	.	H	α-helix	trans	-64	-44.4	175.4	-64.7	-59.2	0	0	0	111.2	T230 D367 Y371 L372 H373 R406	T230-D369 HydrophobicContact CG2-CB 4.28Å; T230-D369 WeakPolarHBondContact CG2-OD1 3.4Å; D367-D369 PolarHBondContact O-N 3.43Å; D367-D369 PolarHBondContact OD1-N 3.47Å; D369-Y371 VanDerWaalsContact C-N 3.32Å; D369-Y371 PolarHBondContact O-N 2.9Å; D369-L372 WeakPolarHBondContact O-CB 3.44Å; D369-L372 PolarHBondContact O-N 2.92Å; D369-H373 PolarHBondContact O-CD2 2.88Å; D369-H373 PolarHBondContact O-N 2.95Å; D369-R406 IonicContact OD1-CZ 3.26Å; D369-R406 VanDerWaalsContact OD1-CZ 3.24Å; D369-R406 IonicContact OD1-NH1 3.37Å; D369-R406 PolarHBondContact OD1-NH1 3.46Å; D369-R406 VanDerWaalsContact OD1-NH1 3.12Å; D369-R406 IonicContact OD1-NH2 2.85Å; D369-R406 PolarHBondContact OD1-NH2 3.48Å; D369-R406 IonicContact OD2-CZ 3.82Å; D369-R406 IonicContact OD2-NH1 2.91Å; D369-R406 PolarHBondContact OD2-NH1 2.88Å; D369-R406 IonicContact OD2-NH2 3.88Å; D369-R406 PolarHBondContact OD2-NH2 2.96Å
370	T	87.7	Confident	85.9	Confident	7 Å²	7	14.5 Å²	14.5	4%	0.043	7%	0.07	C	C	.	.	H	α-helix	trans	-65.8	-36.4	177.6	-61.4	0	0	0	0	111.5	P365 D367 H373 R374	P365-T370 HydrophobicContact CB-CG2 3.88Å; D367-T370 PolarHBondContact O-N 2.86Å; D367-T370 WeakPolarHBondContact OD1-CA 3.22Å; D367-T370 WeakPolarHBondContact OD1-CB 3.45Å; D367-T370 PolarHBondContact OD1-N 3Å; D367-T370 PolarHBondContact OD1-OG1 3.26Å; T370-H373 PolarHBondContact O-N 3.45Å; T370-R374 HydrophobicContact CG2-CG 4.38Å; T370-R374 WeakPolarHBondContact O-CB 3.24Å; T370-R374 VanDerWaalsContact O-CG 3.3Å; T370-R374 WeakPolarHBondContact O-CG 3.49Å; T370-R374 PolarHBondContact O-N 3.36Å
371	Y	90.6	Very high	84.3	Confident	2 Å²	2	18.3 Å²	18.3	1%	0.008	9%	0.087	C	C	.	.	H	α-helix	trans	-54.6	-56.5	169.9	-176.5	-81.6	0	0	0	110.7	Q264 P365 D367 S368 D369 H373 R374 V375 T389 L400 V403 I411	Q264-Y371 VanDerWaalsContact OE1-CE1 3.3Å; Q264-Y371 PolarHBondContact OE1-OH 3.42Å; P365-Y371 HydrophobicContact CG-CD2 3.71Å; P365-Y371 HydrophobicContact CG-CG 4.12Å; D367-Y371 PolarHBondContact O-N 3.44Å; D367-Y371 VanDerWaalsContact O-N 3.1Å; S368-Y371 WeakPolarHBondContact O-CB 3.41Å; S368-Y371 PolarHBondContact O-N 3.02Å; D369-Y371 VanDerWaalsContact C-N 3.32Å; D369-Y371 PolarHBondContact O-N 2.9Å; Y371-H373 VanDerWaalsContact C-N 3.28Å; Y371-H373 PolarHBondContact O-N 3.44Å; Y371-R374 PolarHBondContact O-N 3.49Å; Y371-R374 VanDerWaalsContact O-N 3.1Å; Y371-V375 HydrophobicContact CD1-CG1 4.02Å; Y371-V375 HydrophobicContact CD1-CG2 4Å; Y371-V375 HydrophobicContact CE1-CB 4.3Å; Y371-V375 HydrophobicContact CE1-CG1 3.62Å; Y371-V375 HydrophobicContact CE1-CG2 3.76Å; Y371-V375 HydrophobicContact CE2-CG1 4.17Å; Y371-V375 HydrophobicContact CG-CG1 4.43Å; Y371-V375 WeakPolarHBondContact O-CG2 3.29Å; Y371-V375 PolarHBondContact O-N 2.88Å; Y371-T389 HydrophobicContact CE2-CG2 4.33Å; Y371-T389 WeakPolarHBondContact CE2-OG1 3.47Å; Y371-L400 HydrophobicContact CE2-CD1 4.21Å; Y371-V403 HydrophobicContact CD1-CB 4.49Å; Y371-V403 HydrophobicContact CD1-CG1 3.48Å; Y371-V403 VanDerWaalsContact CD1-CG1 3.48Å; Y371-V403 HydrophobicContact CD1-CG2 4.13Å; Y371-V403 HydrophobicContact CD2-CG1 4.41Å; Y371-V403 HydrophobicContact CD2-CG2 4.12Å; Y371-V403 HydrophobicContact CE1-CG1 3.64Å; Y371-V403 HydrophobicContact CG-CB 4.5Å; Y371-V403 HydrophobicContact CG-CG1 3.92Å; Y371-V403 HydrophobicContact CG-CG2 3.73Å; Y371-I411 HydrophobicContact CE1-CD1 4.14Å; Y371-I411 HydrophobicContact CE2-CD1 4.43Å; Y371-I411 WeakPolarHBondContact OH-CD1 3.34Å
372	L	85.5	Confident	82.7	Confident	10 Å²	10	20.3 Å²	20.3	5%	0.052	11%	0.108	C	C	.	.	H	α-helix	trans	-54.6	-44.7	-177.9	179.3	66.7	0	0	0	111.7	T230 L257 S368 D369 A376 F407	T230-L372 HydrophobicContact CG2-CD2 4.34Å; L257-L372 HydrophobicContact CB-CD2 4.04Å; S368-L372 PolarHBondContact O-N 3.32Å; S368-L372 VanDerWaalsContact O-N 3.08Å; D369-L372 WeakPolarHBondContact O-CB 3.44Å; D369-L372 PolarHBondContact O-N 2.92Å; L372-A376 WeakPolarHBondContact O-CB 3.26Å; L372-A376 PolarHBondContact O-N 3.32Å; L372-A376 VanDerWaalsContact O-N 3.09Å; L372-F407 HydrophobicContact CB-CE2 4.12Å; L372-F407 HydrophobicContact CB-CZ 3.98Å; L372-F407 HydrophobicContact CD2-CE1 3.9Å; L372-F407 HydrophobicContact CD2-CZ 3.97Å; L372-F407 HydrophobicContact CG-CZ 4.47Å
373	H	81.6	Confident	81.6	Confident	3 Å²	3	22 Å²	22	1%	0.014	12%	0.119	C	C	.	.	H	α-helix	trans	-65.4	-41.2	178.8	-74.5	-67.3	0	0	0	113.7	S91 G348 R349 D369 T370 Y371 R377	S91-H373 PolarHBondContact OG-ND1 3.1Å; G348-H373 CarbonylContact O-C 3.53Å; G348-H373 WeakPolarHBondContact O-CB 3.33Å; R349-H373 HydrophobicContact CG-CB 3.94Å; R349-H373 VanDerWaalsContact CZ-NE2 3.35Å; R349-H373 PolarHBondContact NH1-NE2 2.89Å; R349-H373 VanDerWaalsContact NH1-NE2 3.12Å; R349-H373 PolarHBondContact NH2-CD2 2.86Å; D369-H373 PolarHBondContact O-CD2 2.88Å; D369-H373 PolarHBondContact O-N 2.95Å; T370-H373 PolarHBondContact O-N 3.45Å; Y371-H373 VanDerWaalsContact C-N 3.28Å; Y371-H373 PolarHBondContact O-N 3.44Å; H373-R377 PolarHBondContact O-NE 2.86Å
374	R	86.9	Confident	81	Confident	1 Å²	1	25.9 Å²	25.9	0%	0.004	14%	0.136	C	C	.	.	H	α-helix	trans	-66.2	-47.5	179.1	-76.8	-177.8	-179	-174.2	4.4	111.5	F293 N345 N361 D363 T370 Y371 R377	F293-R374 HydrophobicContact CD1-CG 4.04Å; F293-R374 HydrophobicContact CD2-CB 3.83Å; F293-R374 HydrophobicContact CD2-CG 3.87Å; F293-R374 HydrophobicContact CE1-CG 4.09Å; F293-R374 HydrophobicContact CE2-CB 3.64Å; F293-R374 HydrophobicContact CE2-CG 3.92Å; F293-R374 HydrophobicContact CG-CB 4.4Å; F293-R374 HydrophobicContact CG-CG 3.92Å; F293-R374 HydrophobicContact CZ-CB 4.07Å; F293-R374 HydrophobicContact CZ-CG 4.02Å; N345-R374 PolarHBondContact OD1-NH2 2.91Å; N361-R374 WeakPolarHBondContact OD1-CD 3.27Å; N361-R374 PolarHBondContact OD1-NH1 3.06Å; D363-R374 PolarHBondContact O-NH1 3.37Å; T370-R374 HydrophobicContact CG2-CG 4.38Å; T370-R374 WeakPolarHBondContact O-CB 3.24Å; T370-R374 VanDerWaalsContact O-CG 3.3Å; T370-R374 WeakPolarHBondContact O-CG 3.49Å; T370-R374 PolarHBondContact O-N 3.36Å; Y371-R374 PolarHBondContact O-N 3.49Å; Y371-R374 VanDerWaalsContact O-N 3.1Å; R374-R377 WeakPolarHBondContact O-CB 3.38Å; R374-R377 VanDerWaalsContact O-CG 3.22Å; R374-R377 WeakPolarHBondContact O-CG 3.27Å; R374-R377 PolarHBondContact O-N 3.19Å
375	V	86.1	Confident	80.8	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.006	13%	0.133	C	C	.	.	H	α-helix	trans	-74.2	-32	-174.3	-57.3	0	0	0	0	112.2	L262 Y371 R377 A378 A387	L262-V375 HydrophobicContact CD2-CB 3.88Å; L262-V375 HydrophobicContact CD2-CG2 3.71Å; Y371-V375 HydrophobicContact CD1-CG1 4.02Å; Y371-V375 HydrophobicContact CD1-CG2 4Å; Y371-V375 HydrophobicContact CE1-CB 4.3Å; Y371-V375 HydrophobicContact CE1-CG1 3.62Å; Y371-V375 HydrophobicContact CE1-CG2 3.76Å; Y371-V375 HydrophobicContact CE2-CG1 4.17Å; Y371-V375 HydrophobicContact CG-CG1 4.43Å; Y371-V375 WeakPolarHBondContact O-CG2 3.29Å; Y371-V375 PolarHBondContact O-N 2.88Å; V375-R377 PolarHBondContact O-N 3.33Å; V375-A378 PolarHBondContact O-N 3.08Å; V375-A378 VanDerWaalsContact O-O 3.12Å; V375-A387 HydrophobicContact CB-CB 3.77Å; V375-A387 HydrophobicContact CG1-CB 3.66Å
376	A	79.1	Confident	80.8	Confident	3 Å²	3	25.1 Å²	25.1	3%	0.025	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-1.2	174.3	0	0	0	0	0	114.6	L259 L372 A378	L259-A376 HydrophobicContact CD1-CB 3.78Å; L372-A376 WeakPolarHBondContact O-CB 3.26Å; L372-A376 PolarHBondContact O-N 3.32Å; L372-A376 VanDerWaalsContact O-N 3.09Å; A376-A378 VanDerWaalsContact C-N 3.34Å
377	R	72.3	Confident	80.9	Confident	16 Å²	16	19.1 Å²	19.1	6%	0.06	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-30.6	168.1	-57.4	-63.1	146.5	-155.3	-10.7	111.9	F293 G348 R349 M351 H373 R374 V375	F293-R377 HydrophobicContact CZ-CG 4.24Å; G348-R377 VanDerWaalsContact O-CZ 3.26Å; G348-R377 PolarHBondContact O-NE 3.4Å; G348-R377 PolarHBondContact O-NH2 3.04Å; R349-R377 VanDerWaalsContact CA-NH2 3.34Å; M351-R377 VanDerWaalsContact O-CD 3.3Å; M351-R377 WeakPolarHBondContact O-CD 3.38Å; M351-R377 PolarHBondContact O-NH1 2.9Å; H373-R377 PolarHBondContact O-NE 2.86Å; R374-R377 WeakPolarHBondContact O-CB 3.38Å; R374-R377 VanDerWaalsContact O-CG 3.22Å; R374-R377 WeakPolarHBondContact O-CG 3.27Å; R374-R377 PolarHBondContact O-N 3.19Å; V375-R377 PolarHBondContact O-N 3.33Å
378	A	67.6	Low	81.2	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.091	C	C	.	.	S	Bend	trans	-88.4	130.9	165.8	0	0	0	0	0	108.4	L262 A359 V375 A376	L262-A378 HydrophobicContact CD1-CB 4.01Å; A359-A378 HydrophobicContact CB-CB 4.12Å; V375-A378 PolarHBondContact O-N 3.08Å; V375-A378 VanDerWaalsContact O-O 3.12Å; A376-A378 VanDerWaalsContact C-N 3.34Å
379	G	63.6	Low	81.6	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.09	C	C	.	.	S	Bend	trans	86.4	34.6	178	0	0	0	0	0	116.2	G382 T383	G379-G382 PolarHBondContact O-N 3.21Å; G379-T383 CarbonylContact C-O 3.56Å; G379-T383 VanDerWaalsContact C-OG1 3.22Å; G379-T383 WeakPolarHBondContact CA-O 3.42Å; G379-T383 VanDerWaalsContact CA-OG1 3.32Å; G379-T383 WeakPolarHBondContact CA-OG1 3.11Å
380	R	69	Low	82.3	Confident	24 Å²	24	15.2 Å²	15.2	9%	0.091	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-61.2	152.3	175.8	-80.6	-175.8	153.1	-116.5	4.6	112.3	G350 M351 D352 G382 T383	G350-R380 PolarHBondContact O-NH2 2.93Å; G350-R380 VanDerWaalsContact O-NH2 3.11Å; M351-R380 PolarHBondContact O-NE 3.08Å; M351-R380 PolarHBondContact O-NH2 3.36Å; D352-R380 VanDerWaalsContact CA-NH2 3.34Å; D352-R380 VanDerWaalsContact CB-CZ 3.4Å; D352-R380 WeakPolarHBondContact OD1-CD 3.35Å; D352-R380 IonicContact OD1-CZ 2.69Å; D352-R380 VanDerWaalsContact OD1-CZ 3.26Å; D352-R380 IonicContact OD1-NE 3.7Å; D352-R380 PolarHBondContact OD1-NE 2.92Å; D352-R380 IonicContact OD1-NH1 3.45Å; D352-R380 PolarHBondContact OD1-NH1 3.14Å; D352-R380 IonicContact OD2-CZ 2.68Å; D352-R380 IonicContact OD2-NH1 3.48Å; D352-R380 PolarHBondContact OD2-NH1 2.91Å; R380-G382 PolarHBondContact O-N 3.13Å; R380-G382 VanDerWaalsContact O-N 3.13Å; R380-T383 PolarHBondContact N-OG1 2.87Å; R380-T383 VanDerWaalsContact O-CB 3.32Å; R380-T383 WeakPolarHBondContact O-CB 3.42Å; R380-T383 VanDerWaalsContact O-CG2 3.29Å; R380-T383 WeakPolarHBondContact O-CG2 3.2Å; R380-T383 PolarHBondContact O-N 3.39Å; R380-T383 PolarHBondContact O-OG1 2.87Å
381	F	63.2	Low	82.8	Confident	80 Å²	80	15.3 Å²	15.3	35%	0.351	8%	0.083	S	C	.	.	G	3₁₀ helix	trans	53.8	27.5	-176.5	-64.9	-81.3	0	0	0	114.6	F65 G92 T383	F65-F381 HydrophobicContact CE1-CE1 4.21Å; F65-F381 AromaticContact CE1-CZ 3.98Å; F65-F381 HydrophobicContact CE1-CZ 3.98Å; F65-F381 HydrophobicContact CZ-CZ 4.45Å; G92-F381 PolarHBondContact O-N 2.83Å; F381-T383 PolarHBondContact O-N 3.18Å
382	G	63.6	Low	83.1	Confident	43 Å²	43	16.8 Å²	16.8	44%	0.443	9%	0.094	S	C	.	.	G	3₁₀ helix	trans	77.9	9.1	-179	0	0	0	0	0	114	G379 R380	G379-G382 PolarHBondContact O-N 3.21Å; R380-G382 PolarHBondContact O-N 3.13Å; R380-G382 VanDerWaalsContact O-N 3.13Å
383	T	74.3	Confident	83.7	Confident	45 Å²	45	20.5 Å²	20.5	28%	0.276	11%	0.114	S	C	.	.			trans	-65.7	162.2	173.8	57.7	0	0	0	0	111.4	G379 R380 F381 E425	G379-T383 CarbonylContact C-O 3.56Å; G379-T383 VanDerWaalsContact C-OG1 3.22Å; G379-T383 WeakPolarHBondContact CA-O 3.42Å; G379-T383 VanDerWaalsContact CA-OG1 3.32Å; G379-T383 WeakPolarHBondContact CA-OG1 3.11Å; R380-T383 PolarHBondContact N-OG1 2.87Å; R380-T383 VanDerWaalsContact O-CB 3.32Å; R380-T383 WeakPolarHBondContact O-CB 3.42Å; R380-T383 VanDerWaalsContact O-CG2 3.29Å; R380-T383 WeakPolarHBondContact O-CG2 3.2Å; R380-T383 PolarHBondContact O-N 3.39Å; R380-T383 PolarHBondContact O-OG1 2.87Å; F381-T383 PolarHBondContact O-N 3.18Å; T383-E425 WeakPolarHBondContact CA-OE1 3.31Å; T383-E425 WeakPolarHBondContact CB-OE1 3.38Å
384	K	85.2	Confident	84.3	Confident	84 Å²	84	27.9 Å²	27.9	37%	0.365	15%	0.149	S	C	.	.			trans	-68.4	145.5	175	-64.4	-179.6	173.1	-179.8	0	111.7	G261 S421 Y423 E425	G261-K384 WeakPolarHBondContact O-CA 3.48Å; K384-S421 WeakPolarHBondContact CD-O 3.06Å; K384-S421 PolarHBondContact NZ-O 3.41Å; K384-Y423 CarbonylContact C-O 3.57Å; K384-E425 HydrophobicContact CB-CG 4.17Å; K384-E425 HydrophobicContact CD-CG 4.15Å; K384-E425 HydrophobicContact CG-CG 4.06Å; K384-E425 PolarHBondContact N-OE1 2.9Å
385	G	90.6	Very high	84.8	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	168.2	175.4	0	0	0	0	0	112.2	G261 Q263 N357	G261-G385 PolarHBondContact O-N 3.33Å; Q263-G385 PolarHBondContact N-O 3.25Å; N357-G385 CarbonylContact O-C 3.6Å; N357-G385 WeakPolarHBondContact O-CA 3.42Å
386	L	93.4	Very high	85.3	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.8	179	177.7	59.8	0	0	0	110.2	Q263 Y265 L285 N357 I358 A359 I388 I418 Y423	Q263-L386 HydrophobicContact CB-CD1 3.94Å; Q263-L386 CarbonylContact O-C 3.48Å; Q263-L386 WeakPolarHBondContact O-CA 3.47Å; Y265-L386 HydrophobicContact CD2-CD1 3.59Å; Y265-L386 HydrophobicContact CE2-CD1 3.82Å; L285-L386 HydrophobicContact CD1-CD2 3.99Å; L285-L386 HydrophobicContact CD2-CD2 4.06Å; N357-L386 PolarHBondContact O-N 2.85Å; I358-L386 CarbonylContact C-O 3.08Å; I358-L386 VanDerWaalsContact CA-O 3.27Å; I358-L386 WeakPolarHBondContact CA-O 3.4Å; I358-L386 HydrophobicContact CD1-CD2 4.15Å; I358-L386 HydrophobicContact CG1-CB 4.24Å; I358-L386 HydrophobicContact CG1-CD2 4.39Å; I358-L386 HydrophobicContact CG2-CG 4.47Å; A359-L386 PolarHBondContact N-O 3.02Å; L386-I388 HydrophobicContact CD1-CG1 4.13Å; L386-I388 HydrophobicContact CD2-CD1 4.05Å; L386-I388 HydrophobicContact CD2-CG1 4.43Å; L386-I388 HydrophobicContact CG-CD1 4.23Å; L386-I388 HydrophobicContact CG-CG1 4.06Å; L386-I418 HydrophobicContact CD1-CD1 4.38Å; L386-I418 HydrophobicContact CD2-CD1 4.49Å; L386-Y423 HydrophobicContact CB-CD2 3.73Å; L386-Y423 HydrophobicContact CB-CG 3.79Å; L386-Y423 HydrophobicContact CD2-CD1 4.18Å; L386-Y423 HydrophobicContact CD2-CD2 4.05Å; L386-Y423 HydrophobicContact CD2-CE1 4.23Å; L386-Y423 HydrophobicContact CD2-CE2 4.12Å; L386-Y423 HydrophobicContact CD2-CG 4.1Å
387	A	94.3	Very high	86.2	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.9	170.8	0	0	0	0	0	109.9	L262 Q263 Q264 Y265 A359 V375	L262-A387 HydrophobicContact CD1-CB 4.28Å; Q263-A387 PolarHBondContact O-N 2.99Å; Q264-A387 WeakPolarHBondContact CA-O 3.49Å; Q264-A387 HydrophobicContact CG-CB 4.19Å; Y265-A387 PolarHBondContact N-O 2.91Å; A359-A387 VanDerWaalsContact O-CA 3.29Å; A359-A387 WeakPolarHBondContact O-CA 3.46Å; V375-A387 HydrophobicContact CB-CB 3.77Å; V375-A387 HydrophobicContact CG1-CB 3.66Å
388	I	97.1	Very high	87.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	126.5	176.2	-60.7	176.2	0	0	0	109.2	Y265 V267 L281 L285 A359 F360 N361 L386 F390 L414	Y265-I388 CarbonylContact O-C 3.58Å; Y265-I388 WeakPolarHBondContact O-CA 3.07Å; V267-I388 HydrophobicContact CG2-CG2 4.07Å; L281-I388 HydrophobicContact CD1-CD1 4.31Å; L281-I388 HydrophobicContact CD1-CG2 4.24Å; L285-I388 HydrophobicContact CD1-CD1 3.57Å; A359-I388 PolarHBondContact O-N 3.31Å; F360-I388 CarbonylContact C-O 3.54Å; F360-I388 WeakPolarHBondContact CA-O 3.38Å; F360-I388 HydrophobicContact CD1-CB 3.75Å; F360-I388 HydrophobicContact CD1-CG2 4.06Å; F360-I388 HydrophobicContact CE1-CB 3.69Å; F360-I388 HydrophobicContact CE1-CD1 3.78Å; F360-I388 HydrophobicContact CE1-CG1 4.25Å; F360-I388 HydrophobicContact CE1-CG2 3.92Å; F360-I388 HydrophobicContact CZ-CD1 4.12Å; N361-I388 PolarHBondContact N-O 2.85Å; L386-I388 HydrophobicContact CD1-CG1 4.13Å; L386-I388 HydrophobicContact CD2-CD1 4.05Å; L386-I388 HydrophobicContact CD2-CG1 4.43Å; L386-I388 HydrophobicContact CG-CD1 4.23Å; L386-I388 HydrophobicContact CG-CG1 4.06Å; I388-F390 HydrophobicContact CG2-CD1 4.43Å; I388-F390 HydrophobicContact CG2-CE1 4.18Å; I388-L414 HydrophobicContact CD1-CD1 3.75Å; I388-L414 HydrophobicContact CG1-CD1 4.03Å
389	T	98	Very high	88.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.5	-177.2	-58.9	0	0	0	0	111.9	Y265 Y266 V267 N361 M364 Y371	Y265-T389 PolarHBondContact O-N 2.9Å; Y266-T389 CarbonylContact C-O 3.42Å; Y266-T389 WeakPolarHBondContact CA-O 3.47Å; V267-T389 PolarHBondContact N-O 2.86Å; N361-T389 HydrophobicContact CB-CG2 3.79Å; N361-T389 PolarHBondContact ND2-OG1 3.13Å; N361-T389 VanDerWaalsContact ND2-OG1 3.09Å; M364-T389 HydrophobicContact CE-CG2 4.39Å; M364-T389 HydrophobicContact SD-CG2 3.4Å; M364-T389 WeakPolarHBondContact SD-CG2 3.17Å; Y371-T389 HydrophobicContact CE2-CG2 4.33Å; Y371-T389 WeakPolarHBondContact CE2-OG1 3.47Å
390	F	98.6	Very high	90.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	124.6	174.4	-69.6	-8	0	0	0	110.4	V267 L269 K274 K277 L278 L281 N361 Y362 I388	V267-F390 HydrophobicContact CB-CD1 4.08Å; V267-F390 HydrophobicContact CB-CE1 4.31Å; V267-F390 HydrophobicContact CG2-CD1 4.34Å; V267-F390 HydrophobicContact CG2-CE1 4.22Å; L269-F390 HydrophobicContact CD1-CD2 4.37Å; L269-F390 HydrophobicContact CD1-CE2 4.46Å; L269-F390 HydrophobicContact CD2-CB 3.92Å; L269-F390 HydrophobicContact CD2-CD1 3.78Å; L269-F390 HydrophobicContact CD2-CD2 4.42Å; L269-F390 HydrophobicContact CD2-CE1 4.38Å; L269-F390 HydrophobicContact CD2-CG 3.8Å; K274-F390 HydrophobicContact CB-CD2 3.9Å; K274-F390 HydrophobicContact CB-CE2 4.02Å; K274-F390 HydrophobicContact CD-CB 4.46Å; K274-F390 HydrophobicContact CD-CD2 3.96Å; K274-F390 HydrophobicContact CG-CD2 3.67Å; K274-F390 HydrophobicContact CG-CE2 4.27Å; K274-F390 HydrophobicContact CG-CG 4.46Å; K274-F390 WeakPolarHBondContact O-CE2 3.45Å; K277-F390 HydrophobicContact CB-CZ 4.2Å; K277-F390 HydrophobicContact CG-CE1 4.15Å; K277-F390 HydrophobicContact CG-CZ 4.06Å; L278-F390 HydrophobicContact CB-CE2 4.1Å; L278-F390 HydrophobicContact CB-CZ 4.15Å; L281-F390 HydrophobicContact CD1-CE1 3.98Å; L281-F390 HydrophobicContact CD1-CZ 4.21Å; N361-F390 PolarHBondContact O-N 3.07Å; Y362-F390 AromaticContact CD2-CD2 3.99Å; Y362-F390 HydrophobicContact CD2-CD2 3.99Å; Y362-F390 AromaticContact CD2-CE2 3.85Å; Y362-F390 HydrophobicContact CD2-CE2 3.85Å; Y362-F390 HydrophobicContact CE2-CD2 4.42Å; Y362-F390 HydrophobicContact CE2-CE2 4.16Å; Y362-F390 HydrophobicContact CG-CD2 4.41Å; I388-F390 HydrophobicContact CG2-CD1 4.43Å; I388-F390 HydrophobicContact CG2-CE1 4.18Å
391	V	98.4	Very high	91.5	Very high	9 Å²	9	44.6 Å²	44.6	6%	0.055	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	113.1	178.3	180	0	0	0	0	108	Y266 V267 K268 L269 D396 A397 L400	Y266-V391 HydrophobicContact CD2-CG2 4.36Å; Y266-V391 HydrophobicContact CG-CG2 4.45Å; V267-V391 PolarHBondContact O-N 2.88Å; K268-V391 WeakPolarHBondContact CA-O 3.47Å; K268-V391 HydrophobicContact CG-CB 4.33Å; K268-V391 HydrophobicContact CG-CG1 4.46Å; L269-V391 PolarHBondContact N-O 3.2Å; V391-D396 HydrophobicContact CB-CB 4.39Å; V391-D396 HydrophobicContact CG1-CB 3.83Å; V391-A397 HydrophobicContact CG1-CB 4.01Å; V391-L400 HydrophobicContact CG2-CD2 3.76Å
392	S	97.6	Very high	93	Very high	34 Å²	34	44.4 Å²	44.4	24%	0.238	24%	0.24	C	C	.	.			trans	-111.1	-17.8	-174	-73.4	0	0	0	0	116.2	L269 K274 D396	L269-S392 WeakPolarHBondContact O-CA 3.48Å; L269-S392 WeakPolarHBondContact O-CB 3.27Å; L269-S392 PolarHBondContact O-OG 3.18Å; K274-S392 WeakPolarHBondContact CE-OG 3.35Å; S392-D396 PolarHBondContact N-OD2 3.26Å
393	D	96.4	Very high	94.4	Very high	87 Å²	87	42.3 Å²	42.3	47%	0.465	22%	0.219	S	C	.	.	S	Bend	trans	-146.2	178	177.4	60.1	47.7	0	0	0	111.7	N395 D396 A397	D393-N395 PolarHBondContact O-N 2.67Å; D393-N395 WeakPolarHBondContact OD1-CA 3.18Å; D393-N395 VanDerWaalsContact OD1-CB 3.27Å; D393-N395 WeakPolarHBondContact OD1-CB 3.37Å; D393-N395 PolarHBondContact OD1-N 3.43Å; D393-D396 PolarHBondContact O-N 2.97Å; D393-D396 PolarHBondContact OD1-N 2.79Å; D393-A397 PolarHBondContact O-N 3.25Å
394	E	96	Very high	95.2	Very high	159 Å²	159	42 Å²	42	74%	0.743	21%	0.214	S	C	*	.	H	α-helix	trans	-65.7	-25.9	179.9	-63.5	-177.1	176.3	0	0	112.9	K398	E394-K398 WeakPolarHBondContact O-CG 3.47Å; E394-K398 PolarHBondContact O-N 3.12Å; E394-K398 VanDerWaalsContact O-N 3.08Å
395	N	96.5	Very high	95.5	Very high	94 Å²	94	44 Å²	44	50%	0.503	23%	0.229	S	C	.	.	H	α-helix	trans	-73.4	-43.5	177.6	-175.1	66.2	0	0	0	110.6	D393 A397 K398 I399	D393-N395 PolarHBondContact O-N 2.67Å; D393-N395 WeakPolarHBondContact OD1-CA 3.18Å; D393-N395 VanDerWaalsContact OD1-CB 3.27Å; D393-N395 WeakPolarHBondContact OD1-CB 3.37Å; D393-N395 PolarHBondContact OD1-N 3.43Å; N395-A397 PolarHBondContact O-N 2.81Å; N395-K398 WeakPolarHBondContact O-CB 3.24Å; N395-K398 PolarHBondContact O-N 3.15Å; N395-K398 VanDerWaalsContact O-N 3.12Å; N395-I399 WeakPolarHBondContact O-CG1 3.34Å; N395-I399 PolarHBondContact O-N 3.24Å
396	D	97.3	Very high	95.3	Very high	18 Å²	18	47 Å²	47	10%	0.096	24%	0.241	C	C	.	.	H	α-helix	trans	-56.5	-41.9	172.3	-68.4	-16.3	0	0	0	110.9	M364 V391 S392 D393 K398 I399 L400	M364-D396 HydrophobicContact CB-CB 4.08Å; M364-D396 WeakPolarHBondContact CB-OD1 3.33Å; M364-D396 HydrophobicContact CG-CB 4.05Å; M364-D396 HydrophobicContact SD-CB 4.45Å; V391-D396 HydrophobicContact CB-CB 4.39Å; V391-D396 HydrophobicContact CG1-CB 3.83Å; S392-D396 PolarHBondContact N-OD2 3.26Å; D393-D396 PolarHBondContact O-N 2.97Å; D393-D396 PolarHBondContact OD1-N 2.79Å; D396-K398 PolarHBondContact O-N 2.75Å; D396-I399 PolarHBondContact O-N 2.73Å; D396-L400 WeakPolarHBondContact O-CB 3.34Å; D396-L400 PolarHBondContact O-N 2.82Å
397	A	96.6	Very high	94.9	Very high	30 Å²	30	47.2 Å²	47.2	25%	0.248	24%	0.241	C	C	.	.	H	α-helix	trans	-64.4	-38.1	177.4	0	0	0	0	0	112.7	V391 D393 N395 L400 N401	V391-A397 HydrophobicContact CG1-CB 4.01Å; D393-A397 PolarHBondContact O-N 3.25Å; N395-A397 PolarHBondContact O-N 2.81Å; A397-L400 PolarHBondContact O-N 3.49Å; A397-N401 PolarHBondContact O-N 2.91Å; A397-N401 PolarHBondContact O-ND2 2.84Å
398	K	96.8	Very high	94.4	Very high	141 Å²	141	54.5 Å²	54.5	61%	0.613	28%	0.275	S	S	*	.	H	α-helix	trans	-63.5	-46	175	-74.5	173	-176	177.8	0	111.9	E394 N395 D396 L400 N401 D402	E394-K398 WeakPolarHBondContact O-CG 3.47Å; E394-K398 PolarHBondContact O-N 3.12Å; E394-K398 VanDerWaalsContact O-N 3.08Å; N395-K398 WeakPolarHBondContact O-CB 3.24Å; N395-K398 PolarHBondContact O-N 3.15Å; N395-K398 VanDerWaalsContact O-N 3.12Å; D396-K398 PolarHBondContact O-N 2.75Å; K398-L400 VanDerWaalsContact C-N 3.29Å; K398-L400 PolarHBondContact O-N 2.74Å; K398-N401 PolarHBondContact O-N 3.31Å; K398-D402 PolarHBondContact O-N 2.98Å
399	I	96.3	Very high	93.8	Very high	26 Å²	26	55.5 Å²	55.5	13%	0.133	28%	0.282	C	S	.	.	H	α-helix	trans	-64.1	-38.2	177.7	-59.5	169.2	0	0	0	110.1	M364 N395 D396 D402 V403	M364-I399 HydrophobicContact CE-CB 3.72Å; M364-I399 HydrophobicContact CE-CG2 3.55Å; M364-I399 HydrophobicContact CG-CB 4.27Å; M364-I399 HydrophobicContact CG-CD1 4.31Å; M364-I399 HydrophobicContact CG-CG2 4.3Å; N395-I399 WeakPolarHBondContact O-CG1 3.34Å; N395-I399 PolarHBondContact O-N 3.24Å; D396-I399 PolarHBondContact O-N 2.73Å; I399-D402 WeakPolarHBondContact O-CB 3.35Å; I399-D402 PolarHBondContact O-N 3.16Å; I399-V403 WeakPolarHBondContact O-CG2 2.86Å; I399-V403 PolarHBondContact O-N 3.41Å
400	L	96.3	Very high	93.4	Very high	5 Å²	5	61.5 Å²	61.5	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-40.3	178.4	-172	67.8	0	0	0	111.5	Y266 M364 Y371 V391 D396 A397 K398 V403 Q404 I411	Y266-L400 HydrophobicContact CD1-CD2 3.61Å; Y266-L400 HydrophobicContact CD2-CD2 4.48Å; Y266-L400 HydrophobicContact CE1-CD2 4.43Å; Y266-L400 HydrophobicContact CG-CD2 3.64Å; M364-L400 HydrophobicContact CE-CB 3.68Å; M364-L400 HydrophobicContact CE-CD1 4.1Å; M364-L400 VanDerWaalsContact CE-N 3.26Å; Y371-L400 HydrophobicContact CE2-CD1 4.21Å; V391-L400 HydrophobicContact CG2-CD2 3.76Å; D396-L400 WeakPolarHBondContact O-CB 3.34Å; D396-L400 PolarHBondContact O-N 2.82Å; A397-L400 PolarHBondContact O-N 3.49Å; K398-L400 VanDerWaalsContact C-N 3.29Å; K398-L400 PolarHBondContact O-N 2.74Å; L400-V403 WeakPolarHBondContact O-CB 3.47Å; L400-V403 PolarHBondContact O-N 3.38Å; L400-Q404 WeakPolarHBondContact O-CG 3.31Å; L400-Q404 PolarHBondContact O-N 3Å; L400-I411 HydrophobicContact CD1-CB 4.48Å; L400-I411 HydrophobicContact CD1-CD1 3.63Å; L400-I411 HydrophobicContact CD1-CG2 4.26Å
401	N	95.4	Very high	93.2	Very high	81 Å²	81	61.6 Å²	61.6	43%	0.433	31%	0.314	S	S	.	.	H	α-helix	trans	-65.2	-41.1	174.8	-67.8	-20.8	0	0	0	111.5	A397 K398 V403 Q404 D405	A397-N401 PolarHBondContact O-N 2.91Å; A397-N401 PolarHBondContact O-ND2 2.84Å; K398-N401 PolarHBondContact O-N 3.31Å; N401-V403 VanDerWaalsContact C-N 3.3Å; N401-V403 PolarHBondContact O-N 3.13Å; N401-Q404 PolarHBondContact O-N 2.99Å; N401-Q404 VanDerWaalsContact O-N 3.09Å; N401-Q404 PolarHBondContact OD1-NE2 3.23Å; N401-D405 WeakPolarHBondContact O-CB 3.41Å; N401-D405 VanDerWaalsContact O-CG 3.31Å; N401-D405 PolarHBondContact O-N 3.5Å
402	D	94.3	Very high	93	Very high	76 Å²	76	63.5 Å²	63.5	41%	0.406	33%	0.328	S	S	.	.	H	α-helix	trans	-56.6	-43.4	172.6	-178.9	73.2	0	0	0	111.9	S368 K398 I399 Q404 D405 R406	S368-D402 WeakPolarHBondContact CB-OD2 3.44Å; S368-D402 PolarHBondContact OG-OD2 3.36Å; K398-D402 PolarHBondContact O-N 2.98Å; I399-D402 WeakPolarHBondContact O-CB 3.35Å; I399-D402 PolarHBondContact O-N 3.16Å; D402-Q404 PolarHBondContact O-N 3.44Å; D402-D405 PolarHBondContact O-N 3.36Å; D402-R406 WeakPolarHBondContact O-CB 3.41Å; D402-R406 PolarHBondContact O-N 3.44Å
403	V	92.5	Very high	93	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-59.6	-46.3	173.6	170.8	0	0	0	0	111.7	Y371 I399 L400 N401 F407 V409 I411	Y371-V403 HydrophobicContact CD1-CB 4.49Å; Y371-V403 HydrophobicContact CD1-CG1 3.48Å; Y371-V403 VanDerWaalsContact CD1-CG1 3.48Å; Y371-V403 HydrophobicContact CD1-CG2 4.13Å; Y371-V403 HydrophobicContact CD2-CG1 4.41Å; Y371-V403 HydrophobicContact CD2-CG2 4.12Å; Y371-V403 HydrophobicContact CE1-CG1 3.64Å; Y371-V403 HydrophobicContact CG-CB 4.5Å; Y371-V403 HydrophobicContact CG-CG1 3.92Å; Y371-V403 HydrophobicContact CG-CG2 3.73Å; I399-V403 WeakPolarHBondContact O-CG2 2.86Å; I399-V403 PolarHBondContact O-N 3.41Å; L400-V403 WeakPolarHBondContact O-CB 3.47Å; L400-V403 PolarHBondContact O-N 3.38Å; N401-V403 VanDerWaalsContact C-N 3.3Å; N401-V403 PolarHBondContact O-N 3.13Å; V403-F407 HydrophobicContact CG1-CD2 3.96Å; V403-F407 HydrophobicContact CG1-CE2 4.38Å; V403-F407 VanDerWaalsContact O-CD2 3.27Å; V403-F407 WeakPolarHBondContact O-CD2 3.3Å; V403-F407 PolarHBondContact O-N 3.48Å; V403-F407 VanDerWaalsContact O-N 3.16Å; V403-V409 HydrophobicContact CG1-CG2 4.48Å; V403-I411 HydrophobicContact CB-CD1 4.49Å; V403-I411 HydrophobicContact CG1-CD1 3.69Å
404	Q	92.8	Very high	93	Very high	37 Å²	37	63.8 Å²	63.8	17%	0.173	32%	0.323	C	S	.	.	H	α-helix	trans	-64.7	-44.2	-178.9	-69.6	-173.5	100.9	0	0	112	L400 N401 D402 E408 V409 I411	L400-Q404 WeakPolarHBondContact O-CG 3.31Å; L400-Q404 PolarHBondContact O-N 3Å; N401-Q404 PolarHBondContact O-N 2.99Å; N401-Q404 VanDerWaalsContact O-N 3.09Å; N401-Q404 PolarHBondContact OD1-NE2 3.23Å; D402-Q404 PolarHBondContact O-N 3.44Å; Q404-E408 CarbonylContact O-C 3.48Å; Q404-E408 WeakPolarHBondContact O-CA 3.42Å; Q404-E408 PolarHBondContact O-N 3.22Å; Q404-V409 VanDerWaalsContact CA-O 3.31Å; Q404-V409 WeakPolarHBondContact CA-O 3.34Å; Q404-V409 WeakPolarHBondContact CB-O 3.15Å; Q404-V409 VanDerWaalsContact CG-O 3.23Å; Q404-V409 WeakPolarHBondContact CG-O 3.38Å; Q404-V409 PolarHBondContact O-N 3.42Å; Q404-V409 VanDerWaalsContact O-N 3.11Å; Q404-I411 HydrophobicContact CG-CB 4.06Å; Q404-I411 HydrophobicContact CG-CD1 3.93Å; Q404-I411 HydrophobicContact CG-CG1 3.94Å; Q404-I411 PolarHBondContact OE1-O 3.04Å
405	D	91.5	Very high	92.9	Very high	126 Å²	126	58.9 Å²	58.9	67%	0.674	31%	0.305	S	S	*	.	H	α-helix	trans	-69.6	-47.4	-179.1	-67.7	-23.1	0	0	0	111	N401 D402 F407	N401-D405 WeakPolarHBondContact O-CB 3.41Å; N401-D405 VanDerWaalsContact O-CG 3.31Å; N401-D405 PolarHBondContact O-N 3.5Å; D402-D405 PolarHBondContact O-N 3.36Å; D405-F407 PolarHBondContact O-N 2.99Å
406	R	86.2	Confident	92.5	Very high	65 Å²	65	62.6 Å²	62.6	25%	0.245	33%	0.325	C	S	.	.	H	α-helix	trans	-65.8	-38.8	-175.7	-175.5	173.3	179.4	-168.8	-7.6	113.1	E254 S368 D369 D402	E254-R406 IonicContact OE1-NH2 2.79Å; E254-R406 WeakPolarHBondContact OE2-CG 3.4Å; E254-R406 IonicContact OE2-CZ 3.5Å; E254-R406 IonicContact OE2-NE 3.55Å; E254-R406 PolarHBondContact OE2-NE 3.15Å; E254-R406 IonicContact OE2-NH2 3.86Å; S368-R406 WeakPolarHBondContact OG-CD 3.43Å; S368-R406 PolarHBondContact OG-NH1 3.05Å; D369-R406 IonicContact OD1-CZ 3.26Å; D369-R406 VanDerWaalsContact OD1-CZ 3.24Å; D369-R406 IonicContact OD1-NH1 3.37Å; D369-R406 PolarHBondContact OD1-NH1 3.46Å; D369-R406 VanDerWaalsContact OD1-NH1 3.12Å; D369-R406 IonicContact OD1-NH2 2.85Å; D369-R406 PolarHBondContact OD1-NH2 3.48Å; D369-R406 IonicContact OD2-CZ 3.82Å; D369-R406 IonicContact OD2-NH1 2.91Å; D369-R406 PolarHBondContact OD2-NH1 2.88Å; D369-R406 IonicContact OD2-NH2 3.88Å; D369-R406 PolarHBondContact OD2-NH2 2.96Å; D402-R406 WeakPolarHBondContact O-CB 3.41Å; D402-R406 PolarHBondContact O-N 3.44Å
407	F	83.2	Confident	92	Very high	3 Å²	3	70.2 Å²	70.2	1%	0.013	36%	0.36	C	S	.	.	H	α-helix	trans	-104.9	6.2	-177.3	-55.7	-60.3	0	0	0	113.6	T255 L257 T258 S368 L372 V403 D405 V409	T255-F407 WeakPolarHBondContact CA-O 3.2Å; L257-F407 HydrophobicContact CD1-CE1 4.38Å; T258-F407 HydrophobicContact CG2-CB 3.57Å; T258-F407 HydrophobicContact CG2-CG 4.32Å; S368-F407 WeakPolarHBondContact O-CE2 3.47Å; L372-F407 HydrophobicContact CB-CE2 4.12Å; L372-F407 HydrophobicContact CB-CZ 3.98Å; L372-F407 HydrophobicContact CD2-CE1 3.9Å; L372-F407 HydrophobicContact CD2-CZ 3.97Å; L372-F407 HydrophobicContact CG-CZ 4.47Å; V403-F407 HydrophobicContact CG1-CD2 3.96Å; V403-F407 HydrophobicContact CG1-CE2 4.38Å; V403-F407 VanDerWaalsContact O-CD2 3.27Å; V403-F407 WeakPolarHBondContact O-CD2 3.3Å; V403-F407 PolarHBondContact O-N 3.48Å; V403-F407 VanDerWaalsContact O-N 3.16Å; D405-F407 PolarHBondContact O-N 2.99Å; F407-V409 HydrophobicContact CB-CG2 4.18Å; F407-V409 PolarHBondContact O-N 2.95Å
408	E	84.5	Confident	91.7	Very high	153 Å²	153	70.4 Å²	70.4	72%	0.715	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	44	46.6	-174.3	-66.9	-178.7	-166.1	0	0	113.3	T255 Q404	T255-E408 HydrophobicContact CG2-CB 3.55Å; T255-E408 HydrophobicContact CG2-CG 3.41Å; T255-E408 VanDerWaalsContact CG2-CG 3.41Å; T255-E408 WeakPolarHBondContact CG2-OE2 3.5Å; Q404-E408 CarbonylContact O-C 3.48Å; Q404-E408 WeakPolarHBondContact O-CA 3.42Å; Q404-E408 PolarHBondContact O-N 3.22Å
409	V	85.4	Confident	91.3	Very high	22 Å²	22	68.5 Å²	68.5	13%	0.133	35%	0.353	C	S	.	.			trans	-109.3	134.7	175.3	-71.5	0	0	0	0	110.6	T258 V403 Q404 F407 I411	T258-V409 HydrophobicContact CG2-CG1 3.3Å; V403-V409 HydrophobicContact CG1-CG2 4.48Å; Q404-V409 VanDerWaalsContact CA-O 3.31Å; Q404-V409 WeakPolarHBondContact CA-O 3.34Å; Q404-V409 WeakPolarHBondContact CB-O 3.15Å; Q404-V409 VanDerWaalsContact CG-O 3.23Å; Q404-V409 WeakPolarHBondContact CG-O 3.38Å; Q404-V409 PolarHBondContact O-N 3.42Å; Q404-V409 VanDerWaalsContact O-N 3.11Å; F407-V409 HydrophobicContact CB-CG2 4.18Å; F407-V409 PolarHBondContact O-N 2.95Å; V409-I411 HydrophobicContact CG2-CD1 4.22Å; V409-I411 HydrophobicContact CG2-CG1 4.08Å; V409-I411 PolarHBondContact O-N 3.48Å
410	N	88.5	Confident	90.9	Very high	126 Å²	126	70 Å²	70	67%	0.674	36%	0.36	S	S	*	.			trans	-88.4	103.3	169.6	-177.1	-3.1	0	0	0	109.1	S412	N410-S412 PolarHBondContact O-N 2.91Å; N410-S412 PolarHBondContact OD1-OG 3.39Å
411	I	93.9	Very high	90.4	Very high	1 Å²	1	72 Å²	72	1%	0.005	38%	0.375	C	S	.	.			trans	-90.3	96.3	173.4	-56.9	169.7	0	0	0	106.3	Q264 Y266 Y371 L400 V403 Q404 V409	Q264-I411 HydrophobicContact CB-CG1 4.08Å; Q264-I411 HydrophobicContact CB-CG2 4.29Å; Y266-I411 HydrophobicContact CD1-CG2 4.15Å; Y266-I411 WeakPolarHBondContact CD1-O 3.06Å; Y266-I411 VanDerWaalsContact CE1-O 3.23Å; Y266-I411 WeakPolarHBondContact CE1-O 3.18Å; Y371-I411 HydrophobicContact CE1-CD1 4.14Å; Y371-I411 HydrophobicContact CE2-CD1 4.43Å; Y371-I411 WeakPolarHBondContact OH-CD1 3.34Å; L400-I411 HydrophobicContact CD1-CB 4.48Å; L400-I411 HydrophobicContact CD1-CD1 3.63Å; L400-I411 HydrophobicContact CD1-CG2 4.26Å; V403-I411 HydrophobicContact CB-CD1 4.49Å; V403-I411 HydrophobicContact CG1-CD1 3.69Å; Q404-I411 HydrophobicContact CG-CB 4.06Å; Q404-I411 HydrophobicContact CG-CD1 3.93Å; Q404-I411 HydrophobicContact CG-CG1 3.94Å; Q404-I411 PolarHBondContact OE1-O 3.04Å; V409-I411 HydrophobicContact CG2-CD1 4.22Å; V409-I411 HydrophobicContact CG2-CG1 4.08Å; V409-I411 PolarHBondContact O-N 3.48Å
412	S	95	Very high	90	Very high	49 Å²	49	69.4 Å²	69.4	34%	0.343	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	159.3	-177.3	-63.8	0	0	0	0	112	Y265 Y266 N410	Y265-S412 CarbonylContact C-O 3.54Å; Y265-S412 WeakPolarHBondContact CA-O 3.24Å; Y266-S412 PolarHBondContact N-O 3.37Å; N410-S412 PolarHBondContact O-N 2.91Å; N410-S412 PolarHBondContact OD1-OG 3.39Å
413	E	96.7	Very high	89.6	Confident	102 Å²	102	65.8 Å²	65.8	48%	0.477	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	141.8	168.3	-160.5	150.5	162.6	0	0	109.6	Y266 K268 P415	Y266-E413 HydrophobicContact CD2-CG 4.36Å; Y266-E413 HydrophobicContact CE1-CB 4.21Å; Y266-E413 HydrophobicContact CE2-CB 3.88Å; Y266-E413 HydrophobicContact CE2-CG 3.66Å; Y266-E413 WeakPolarHBondContact CE2-OE2 3.49Å; Y266-E413 WeakPolarHBondContact O-CA 3.31Å; Y266-E413 PolarHBondContact OH-OE2 3.32Å; K268-E413 IonicContact NZ-OE2 3.23Å; E413-P415 WeakPolarHBondContact O-CD 3.31Å; E413-P415 VanDerWaalsContact O-N 3.17Å
414	L	96.2	Very high	89.1	Confident	26 Å²	26	66.9 Å²	66.9	14%	0.136	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-58.8	119	-177.2	-170.4	79.5	0	0	0	110.2	Y265 Y266 V267 L281 I388 I418	Y265-L414 HydrophobicContact CD2-CD1 3.95Å; Y265-L414 HydrophobicContact CG-CD1 3.84Å; Y266-L414 PolarHBondContact O-N 3.48Å; V267-L414 HydrophobicContact CG2-CB 3.71Å; V267-L414 HydrophobicContact CG2-CD2 3.75Å; V267-L414 HydrophobicContact CG2-CG 4.31Å; L281-L414 HydrophobicContact CD1-CD2 4.16Å; L281-L414 HydrophobicContact CD2-CD2 3.46Å; L281-L414 VanDerWaalsContact CD2-CD2 3.46Å; L281-L414 HydrophobicContact CG-CD2 4.45Å; I388-L414 HydrophobicContact CD1-CD1 3.75Å; I388-L414 HydrophobicContact CG1-CD1 4.03Å; L414-I418 HydrophobicContact CD1-CD1 3.51Å; L414-I418 HydrophobicContact CG-CD1 4.4Å
415	P	94.6	Very high	88	Confident	55 Å²	55	70.2 Å²	70.2	36%	0.357	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-70.5	162.3	176	30.9	-35.4	0	0	0	110.8	Y265 E413 E417 I418	Y265-P415 HydrophobicContact CE1-CG 4.11Å; E413-P415 WeakPolarHBondContact O-CD 3.31Å; E413-P415 VanDerWaalsContact O-N 3.17Å; P415-E417 WeakPolarHBondContact CG-O 3.37Å; P415-E417 PolarHBondContact O-N 3.07Å; P415-I418 HydrophobicContact CG-CD1 4.44Å; P415-I418 HydrophobicContact CG-CG1 3.76Å
416	D	89.1	Confident	86.6	Confident	173 Å²	173	71.7 Å²	71.7	93%	0.925	37%	0.368	S	S	*	.	S	Bend	trans	-65	-29.3	176.7	-68	-31.6	0	0	0	112.3
417	E	86.8	Confident	84.9	Confident	178 Å²	178	75.3 Å²	75.3	83%	0.832	40%	0.398	S	S	*	.			trans	-127.8	133.9	178.5	-65.6	-175.1	173.3	0	0	110.8	P415	P415-E417 WeakPolarHBondContact CG-O 3.37Å; P415-E417 PolarHBondContact O-N 3.07Å
418	I	89.4	Confident	82.5	Confident	33 Å²	33	90.3 Å²	90.3	17%	0.169	45%	0.454	C	S	.	.			trans	-123.4	125.3	171.6	-63.8	175.8	0	0	0	107.8	Y265 L285 L386 L414 P415 I420 Y423	Y265-I418 HydrophobicContact CD2-CD1 3.9Å; Y265-I418 HydrophobicContact CE2-CD1 3.75Å; Y265-I418 HydrophobicContact CE2-CG1 4.31Å; L285-I418 HydrophobicContact CD2-CD1 4.44Å; L386-I418 HydrophobicContact CD1-CD1 4.38Å; L386-I418 HydrophobicContact CD2-CD1 4.49Å; L414-I418 HydrophobicContact CD1-CD1 3.51Å; L414-I418 HydrophobicContact CG-CD1 4.4Å; P415-I418 HydrophobicContact CG-CD1 4.44Å; P415-I418 HydrophobicContact CG-CG1 3.76Å; I418-I420 PolarHBondContact O-N 3.17Å; I418-Y423 HydrophobicContact CG2-CD1 3.7Å; I418-Y423 HydrophobicContact CG2-CE1 3.77Å
419	D	88.7	Confident	82.4	Confident	101 Å²	101	87.2 Å²	87.2	54%	0.54	44%	0.441	S	S	.	.			trans	-66.3	121.8	172.7	179.2	7.6	0	0	0	110.2	S421 S422	D419-S421 VanDerWaalsContact CG-OG 3.25Å; D419-S421 PolarHBondContact O-N 2.87Å; D419-S421 WeakPolarHBondContact OD1-CB 3.3Å; D419-S421 PolarHBondContact OD1-N 3.4Å; D419-S421 PolarHBondContact OD1-OG 3.19Å; D419-S421 PolarHBondContact OD2-OG 3.16Å; D419-S422 VanDerWaalsContact O-CB 3.26Å; D419-S422 WeakPolarHBondContact O-CB 3.49Å; D419-S422 PolarHBondContact O-N 3.43Å; D419-S422 PolarHBondContact O-OG 3.41Å
420	I	87.6	Confident	82.2	Confident	57 Å²	57	90.6 Å²	90.6	29%	0.292	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-54.4	-35.9	176.8	-63.9	155.5	0	0	0	111.2	E286 I418 S422 Y423 I424	E286-I420 HydrophobicContact CB-CD1 4.49Å; E286-I420 HydrophobicContact CB-CG1 4.39Å; E286-I420 HydrophobicContact CB-CG2 4.35Å; E286-I420 VanDerWaalsContact CD-CD1 3.42Å; E286-I420 HydrophobicContact CG-CD1 3.9Å; E286-I420 HydrophobicContact CG-CG1 4.3Å; E286-I420 WeakPolarHBondContact OE1-CD1 3.32Å; I418-I420 PolarHBondContact O-N 3.17Å; I420-S422 PolarHBondContact O-N 3.45Å; I420-S422 VanDerWaalsContact O-N 3.12Å; I420-Y423 PolarHBondContact O-N 2.96Å; I420-I424 HydrophobicContact CG2-CB 4.19Å; I420-I424 HydrophobicContact CG2-CD1 3.79Å; I420-I424 HydrophobicContact CG2-CG1 4.05Å; I420-I424 PolarHBondContact O-N 3.5Å
421	S	86.3	Confident	81.9	Confident	47 Å²	47	88.7 Å²	88.7	33%	0.329	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-64.2	-18.6	-179.9	94	0	0	0	0	112.9	K384 D419	K384-S421 WeakPolarHBondContact CD-O 3.06Å; K384-S421 PolarHBondContact NZ-O 3.41Å; D419-S421 VanDerWaalsContact CG-OG 3.25Å; D419-S421 PolarHBondContact O-N 2.87Å; D419-S421 WeakPolarHBondContact OD1-CB 3.3Å; D419-S421 PolarHBondContact OD1-N 3.4Å; D419-S421 PolarHBondContact OD1-OG 3.19Å; D419-S421 PolarHBondContact OD2-OG 3.16Å
422	S	86.1	Confident	81.2	Confident	27 Å²	27	93.8 Å²	93.8	19%	0.189	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-76.2	-26.1	-180	72.7	0	0	0	0	113.4	D419 I420	D419-S422 VanDerWaalsContact O-CB 3.26Å; D419-S422 WeakPolarHBondContact O-CB 3.49Å; D419-S422 PolarHBondContact O-N 3.43Å; D419-S422 PolarHBondContact O-OG 3.41Å; I420-S422 PolarHBondContact O-N 3.45Å; I420-S422 VanDerWaalsContact O-N 3.12Å
423	Y	87	Confident	80.3	Confident	1 Å²	1	96.6 Å²	96.6	0%	0.004	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	-4.8	-172.4	74	-91.5	0	0	0	114.9	E286 I358 K384 L386 I418 I420	E286-Y423 PolarHBondContact N-OH 3.38Å; E286-Y423 VanDerWaalsContact N-OH 3.1Å; E286-Y423 WeakPolarHBondContact O-CE2 3.3Å; E286-Y423 PolarHBondContact O-OH 2.98Å; I358-Y423 HydrophobicContact CD1-CE2 3.93Å; I358-Y423 HydrophobicContact CG1-CD2 4.36Å; I358-Y423 HydrophobicContact CG1-CE2 4.12Å; K384-Y423 CarbonylContact C-O 3.57Å; L386-Y423 HydrophobicContact CB-CD2 3.73Å; L386-Y423 HydrophobicContact CB-CG 3.79Å; L386-Y423 HydrophobicContact CD2-CD1 4.18Å; L386-Y423 HydrophobicContact CD2-CD2 4.05Å; L386-Y423 HydrophobicContact CD2-CE1 4.23Å; L386-Y423 HydrophobicContact CD2-CE2 4.12Å; L386-Y423 HydrophobicContact CD2-CG 4.1Å; I418-Y423 HydrophobicContact CG2-CD1 3.7Å; I418-Y423 HydrophobicContact CG2-CE1 3.77Å; I420-Y423 PolarHBondContact O-N 2.96Å
424	I	81.8	Confident	79.2	Confident	23 Å²	23	96.3 Å²	96.3	12%	0.118	48%	0.479	C	S	.	.			trans	-118.6	125.9	170.6	-52.3	-169	0	0	0	109.2	E286 N357 I420 Q426	E286-I424 HydrophobicContact CB-CD1 3.93Å; E286-I424 WeakPolarHBondContact O-CD1 3.34Å; N357-I424 WeakPolarHBondContact ND2-CG1 3.34Å; I420-I424 HydrophobicContact CG2-CB 4.19Å; I420-I424 HydrophobicContact CG2-CD1 3.79Å; I420-I424 HydrophobicContact CG2-CG1 4.05Å; I420-I424 PolarHBondContact O-N 3.5Å; I424-Q426 PolarHBondContact O-N 2.97Å
425	E	70.3	Confident	78	Confident	106 Å²	106	101.3 Å²	101.3	50%	0.495	50%	0.504	S	S	.	.			trans	-74	115	164.5	-74.3	-179.6	-172.7	0	0	109.2	T383 K384 T427	T383-E425 WeakPolarHBondContact CA-OE1 3.31Å; T383-E425 WeakPolarHBondContact CB-OE1 3.38Å; K384-E425 HydrophobicContact CB-CG 4.17Å; K384-E425 HydrophobicContact CD-CG 4.15Å; K384-E425 HydrophobicContact CG-CG 4.06Å; K384-E425 PolarHBondContact N-OE1 2.9Å; E425-T427 PolarHBondContact O-N 2.83Å; E425-T427 VanDerWaalsContact O-N 3.07Å
426	Q	61.2	Low	76.7	Confident	157 Å²	157	104.8 Å²	104.8	73%	0.734	52%	0.515	S	S	*	.			trans	-67.5	107.1	170.1	-68.3	-178.9	-9.6	0	0	108.1	I424 R428	I424-Q426 PolarHBondContact O-N 2.97Å; Q426-R428 PolarHBondContact O-N 3.15Å; Q426-R428 VanDerWaalsContact O-N 3.11Å
427	T	51.2	Low	75.7	Confident	142 Å²	142	99.2 Å²	99.2	87%	0.871	48%	0.481	S	S	*	.			trans	-56.1	114.1	164	22.4	0	0	0	0	108.4	E425	E425-T427 PolarHBondContact O-N 2.83Å; E425-T427 VanDerWaalsContact O-N 3.07Å
428	R	31.6	Very low	74.7	Confident	318 Å²	318	92 Å²	92	100%	1.2	45%	0.449	S	S	*	.			trans	-69.4	0	162.9	-84.7	-172.5	175.4	-178.5	0	111.1	Q426	Q426-R428 PolarHBondContact O-N 3.15Å; Q426-R428 VanDerWaalsContact O-N 3.11Å

Retrieved 428 of 428 residues in 1098.2 ms (Link to these results)

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