A0A096NAV8_PAPAN Loading...

Transmembrane protein 67

AlphaFold DB , UniProt , Accession A0A096NAV8, Species PAPAN (Papio anubis, Olive baboon), Gene TMEM67, Length 995 aa.

						>A0A096NAV8_PAPAN|A0A096NAV8|TMEM67
MATRGGAEVPMAAWSLLSARAVTVSLLLSLPRFLQAQTFSFPFQQPEKCDNNQYFDISALSCVPCGANQRQDARGTSCVCLPGFQMISNNGGPAVICKKCPENMKGVTEDGWNCISCPSDLTAEGKCQCPAGHILVERDINGTLLSQATCELCDGNENSFMVANALGDRCVRCEPTFVNTSKSCACSEPNILTGGLCFSNTGNFPLRRISTARYGEVGVSLTSEWFAKYLQSSAAACWVYANLTSCQALGNICVMNMNSYDFATFDACRLFQFIFENTAGLSTVHSISFWRQNLPWLFYGDQLGLAPQVLSSTSLPTNFSFKGENQNTKLKFVAASYDIRGNFLKWQTLEGGVLQLCPDTETRLNAAYSFGTTYQQNCEIPISKILIDFPTPIFYDVYLEYADENQHQYILAVPVLNLNLQHNKIFVNQDSNSGKWLLTRRIFLVDAVSGRENDLGSQPRVIRVATQISLSVHLVPNTINGNIYPPLITIAYSDIDTKDANSQSVKVSFSVTYEMDHGEAHVQTDIALGVLGGLAVLASLLKTAGWKRRIGSPMIDLQTVMKFLVYYAGDLANVFFIITVGTGLYWLIFFKAQKSVSVLLPMPVQEERFVTYVGCAFALKALQFLHKLISQITIDVFFIDWERPKGKVLKAVEGEGGVRSATVPVSIWRTYFVANEWNEIQTVRKINSLFQVLTVLFFLEIVGFKNLALMDSSSSLSRSPSSYVAPYSRILRYAVSAALWLAIGIIQIVFFAVFYERFIEDKIRQFVDLCSMSNISVFLLSHKCFGYYIHGRSVHGHADTNMEEMNMNLKREAENLCSQRGLVPNTDGQTFEIAISNQMRQHYDRIHETLIRKNGPARLLSSSENTFEQSIKAYHMMNKFLGSFIDHVHKEMDYFIKDKLLLERILGMEFMEPMEKSIFYNDEGYSFSSVLYYGNEATLLIFDLLFFCVVDLACQNFILASFLTYLQQEIFRYIRNTVGQKNLVSKTLVDQRFLI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	30.5	Very low	253 Å²	253	149.7 Å²	149.7	100%	1.246	89%	0.889	S	S	*	*				0	86.2	0	-149.6	170	-170.4	0	0	106.9
2	A	28.7	Very low	30.7	Very low	93 Å²	93	143.3 Å²	143.3	77%	0.769	87%	0.865	S	S	*	*			trans	173	96.3	170.5	0	0	0	0	0	105
3	T	30.6	Very low	30.9	Very low	144 Å²	144	137.3 Å²	137.3	88%	0.883	84%	0.84	S	S	*	*			trans	27.4	108.3	161.6	51.2	0	0	0	0	120.2
4	R	30.2	Very low	30.8	Very low	254 Å²	254	144.4 Å²	144.4	96%	0.958	84%	0.844	S	S	*	*			trans	-65.5	146.2	164	-88.9	175.5	165.3	172.5	-5.3	111.9
5	G	26.7	Very low	31.2	Very low	79 Å²	79	140.5 Å²	140.5	81%	0.814	83%	0.828	S	S	*	*			trans	-96.1	170.3	166.4	0	0	0	0	0	114.2
6	G	26.2	Very low	31.5	Very low	81 Å²	81	138.8 Å²	138.8	84%	0.835	81%	0.813	S	S	*	*			trans	105.2	102.8	141.7	0	0	0	0	0	118.1
7	A	26.4	Very low	31.9	Very low	103 Å²	103	138.1 Å²	138.1	85%	0.851	80%	0.804	S	S	*	*				137.4	109.8	112.3	0	0	0	0	0	113.7
8	E	26.3	Very low	32.4	Very low	194 Å²	194	134.7 Å²	134.7	91%	0.907	79%	0.789	S	S	*	*			trans	-156.1	115.4	155.8	-101.7	-170.9	-179.3	0	0	111.1
9	V	30.1	Very low	32.8	Very low	142 Å²	142	130.6 Å²	130.6	86%	0.861	77%	0.773	S	S	*	*			trans	-159.7	146.7	158.5	-177.6	0	0	0	0	106
10	P	41.7	Very low	33.2	Very low	101 Å²	101	133.4 Å²	133.4	66%	0.656	77%	0.769	S	S	*	*			cis	-129.9	148.1	-22.3	32	-14.1	0	0	0	114.1
11	M	29.1	Very low	33.6	Very low	203 Å²	203	129.7 Å²	129.7	100%	1	76%	0.755	S	S	*	*			trans	-111	84	149.5	-91.2	-149.5	-72	0	0	108.7
12	A	33.3	Very low	33.8	Very low	72 Å²	72	121.9 Å²	121.9	60%	0.595	72%	0.721	S	S	*	*			trans	-154.1	31.7	173.4	0	0	0	0	0	112.8
13	A	32.4	Very low	34.7	Very low	66 Å²	66	121.1 Å²	121.1	55%	0.545	71%	0.707	S	S	.	*	S	Bend	trans	-120	-6.4	-179	0	0	0	0	0	114.4
14	W	30.4	Very low	35.6	Very low	237 Å²	237	118.1 Å²	118.1	90%	0.898	69%	0.688	S	S	*	*	S	Bend	trans	-104	-8.1	-176.1	-88.3	23.5	0	0	0	115.4
15	S	35.8	Very low	36.1	Very low	85 Å²	85	109.7 Å²	109.7	59%	0.594	67%	0.668	S	S	*	*	H	α-helix	trans	-90.6	-14.7	176.1	52	0	0	0	0	114.4
16	L	36.9	Very low	36.8	Very low	114 Å²	114	110.8 Å²	110.8	60%	0.597	66%	0.655	S	S	*	*	H	α-helix	trans	-88.9	-19.7	-178.5	-85.9	151.3	0	0	0	114
17	L	37.1	Very low	37.6	Very low	127 Å²	127	113.8 Å²	113.8	67%	0.665	65%	0.651	S	S	*	*	H	α-helix	trans	-84.4	-32.5	-179.8	-84.8	152.3	0	0	0	112.9	A21	L17-A21 PolarHBondContact O-N 3.33Å
18	S	41.5	Very low	38.4	Very low	76 Å²	76	115.3 Å²	115.3	53%	0.531	64%	0.644	S	S	.	*	H	α-helix	trans	-75.8	-34.1	176.8	70.4	0	0	0	0	112.6	R20 A21 V22	S18-R20 VanDerWaalsContact C-N 3.35Å; S18-R20 PolarHBondContact O-N 2.96Å; S18-A21 PolarHBondContact O-N 3.3Å; S18-V22 WeakPolarHBondContact O-CG2 3.39Å; S18-V22 PolarHBondContact O-N 3.29Å
19	A	40.5	Very low	38.9	Very low	57 Å²	57	110 Å²	110	47%	0.471	63%	0.628	S	S	.	*	H	α-helix	trans	-67.5	-33.6	176.9	0	0	0	0	0	112.8	T23	A19-T23 PolarHBondContact O-N 3.35Å; A19-T23 PolarHBondContact O-OG1 3.13Å
20	R	39.6	Very low	39.1	Very low	186 Å²	186	108.7 Å²	108.7	70%	0.702	62%	0.616	S	S	*	*	H	α-helix	trans	-75.6	-34.7	175.9	-78.1	-174.5	173.3	-174.5	-1.2	113.2	S18 T23 V24	S18-R20 VanDerWaalsContact C-N 3.35Å; S18-R20 PolarHBondContact O-N 2.96Å; R20-T23 WeakPolarHBondContact CA-OG1 3.31Å; R20-T23 PolarHBondContact O-OG1 3.48Å; R20-V24 WeakPolarHBondContact O-CB 3.39Å; R20-V24 VanDerWaalsContact O-CG2 3.24Å; R20-V24 WeakPolarHBondContact O-CG2 3.45Å; R20-V24 PolarHBondContact O-N 2.98Å
21	A	42.3	Very low	38.7	Very low	57 Å²	57	109.2 Å²	109.2	47%	0.471	62%	0.619	S	S	.	*	H	α-helix	trans	-70.6	-34.3	176.9	0	0	0	0	0	112.8	L17 S18 S25	L17-A21 PolarHBondContact O-N 3.33Å; S18-A21 PolarHBondContact O-N 3.3Å; A21-S25 WeakPolarHBondContact O-CB 2.89Å; A21-S25 PolarHBondContact O-N 3.27Å; A21-S25 VanDerWaalsContact O-N 3.1Å; A21-S25 PolarHBondContact O-OG 3.34Å
22	V	44.7	Very low	38.9	Very low	88 Å²	88	109.7 Å²	109.7	53%	0.533	61%	0.61	S	S	.	*	H	α-helix	trans	-73.1	-38.2	175.9	174.8	0	0	0	0	111.4	S18 S25 L26	S18-V22 WeakPolarHBondContact O-CG2 3.39Å; S18-V22 PolarHBondContact O-N 3.29Å; V22-S25 PolarHBondContact O-N 2.9Å; V22-L26 HydrophobicContact CG1-CD1 3.83Å; V22-L26 WeakPolarHBondContact O-CB 3.48Å; V22-L26 WeakPolarHBondContact O-CD1 3.5Å; V22-L26 PolarHBondContact O-N 2.97Å
23	T	47.9	Very low	38.9	Very low	78 Å²	78	115.5 Å²	115.5	48%	0.479	62%	0.622	S	S	.	*	H	α-helix	trans	-69.6	-36.7	175.3	32.3	0	0	0	0	112.9	A19 R20 L26 L27	A19-T23 PolarHBondContact O-N 3.35Å; A19-T23 PolarHBondContact O-OG1 3.13Å; R20-T23 WeakPolarHBondContact CA-OG1 3.31Å; R20-T23 PolarHBondContact O-OG1 3.48Å; T23-L26 PolarHBondContact O-N 3.33Å; T23-L27 WeakPolarHBondContact O-CB 3.32Å; T23-L27 WeakPolarHBondContact O-CD1 3.37Å; T23-L27 WeakPolarHBondContact O-CG 3.3Å; T23-L27 PolarHBondContact O-N 3.38Å
24	V	48	Very low	38.9	Very low	81 Å²	81	121 Å²	121	49%	0.491	64%	0.642	S	S	.	*	H	α-helix	trans	-69.7	-35.4	175.2	172.6	0	0	0	0	111.7	R20 L27 L28	R20-V24 WeakPolarHBondContact O-CB 3.39Å; R20-V24 VanDerWaalsContact O-CG2 3.24Å; R20-V24 WeakPolarHBondContact O-CG2 3.45Å; R20-V24 PolarHBondContact O-N 2.98Å; V24-L27 PolarHBondContact O-N 3.26Å; V24-L28 HydrophobicContact CG1-CD1 3.79Å; V24-L28 WeakPolarHBondContact O-CB 3.49Å; V24-L28 WeakPolarHBondContact O-CD1 3.29Å; V24-L28 WeakPolarHBondContact O-CG 3.5Å; V24-L28 PolarHBondContact O-N 2.98Å; V24-L28 VanDerWaalsContact O-N 3.09Å
25	S	41.4	Very low	39.1	Very low	77 Å²	77	118.7 Å²	118.7	54%	0.538	64%	0.641	S	S	.	*	H	α-helix	trans	-74	-29.9	176.1	-57.1	0	0	0	0	113.2	A21 V22 S29	A21-S25 WeakPolarHBondContact O-CB 2.89Å; A21-S25 PolarHBondContact O-N 3.27Å; A21-S25 VanDerWaalsContact O-N 3.1Å; A21-S25 PolarHBondContact O-OG 3.34Å; V22-S25 PolarHBondContact O-N 2.9Å; S25-S29 PolarHBondContact O-N 3.4Å; S25-S29 PolarHBondContact O-OG 2.87Å
26	L	40.4	Very low	39.7	Very low	102 Å²	102	117.8 Å²	117.8	53%	0.534	64%	0.638	S	S	.	*	H	α-helix	trans	-72.8	-30.8	170.5	-98	135.3	0	0	0	112.6	V22 T23	V22-L26 HydrophobicContact CG1-CD1 3.83Å; V22-L26 WeakPolarHBondContact O-CB 3.48Å; V22-L26 WeakPolarHBondContact O-CD1 3.5Å; V22-L26 PolarHBondContact O-N 2.97Å; T23-L26 PolarHBondContact O-N 3.33Å
27	L	44.2	Very low	40.7	Very low	143 Å²	143	115.6 Å²	115.6	75%	0.749	63%	0.625	S	S	*	*	H	α-helix	trans	-75.2	-24.5	173.4	-79.5	159.9	0	0	0	113.2	T23 V24	T23-L27 WeakPolarHBondContact O-CB 3.32Å; T23-L27 WeakPolarHBondContact O-CD1 3.37Å; T23-L27 WeakPolarHBondContact O-CG 3.3Å; T23-L27 PolarHBondContact O-N 3.38Å; V24-L27 PolarHBondContact O-N 3.26Å
28	L	42.8	Very low	42.1	Very low	136 Å²	136	113.1 Å²	113.1	71%	0.712	62%	0.615	S	S	*	*	S	Bend	trans	-90.3	-9	179.2	-78.2	159.4	0	0	0	114.4	V24	V24-L28 HydrophobicContact CG1-CD1 3.79Å; V24-L28 WeakPolarHBondContact O-CB 3.49Å; V24-L28 WeakPolarHBondContact O-CD1 3.29Å; V24-L28 WeakPolarHBondContact O-CG 3.5Å; V24-L28 PolarHBondContact O-N 2.98Å; V24-L28 VanDerWaalsContact O-N 3.09Å
29	S	35.9	Very low	44.3	Very low	82 Å²	82	110.1 Å²	110.1	57%	0.573	59%	0.593	S	S	*	*	S	Bend	trans	-112.3	6.6	-175.6	50.8	0	0	0	0	115.3	S25 P31	S25-S29 PolarHBondContact O-N 3.4Å; S25-S29 PolarHBondContact O-OG 2.87Å; S29-P31 WeakPolarHBondContact O-CD 3.39Å
30	L	35.4	Very low	46.5	Very low	115 Å²	115	108.6 Å²	108.6	60%	0.602	58%	0.579	S	S	*	*			trans	-115.6	66.4	172.5	-89.3	142.4	0	0	0	112.6	R32	L30-R32 VanDerWaalsContact C-N 3.26Å; L30-R32 PolarHBondContact O-N 3.29Å; L30-R32 VanDerWaalsContact O-N 3.16Å
31	P	33.5	Very low	48.9	Very low	111 Å²	111	99.9 Å²	99.9	72%	0.721	55%	0.546	S	S	*	.			trans	-87	71.1	165.8	35.9	-29.7	0	0	0	108.9	S29	S29-P31 WeakPolarHBondContact O-CD 3.39Å
32	R	32.9	Very low	51.2	Low	213 Å²	213	99.7 Å²	99.7	80%	0.804	54%	0.539	S	S	*	.	S	Bend	trans	171.2	138.7	162.8	-95.6	153.4	-169.1	-159.2	3.8	106.9	L30	L30-R32 VanDerWaalsContact C-N 3.26Å; L30-R32 PolarHBondContact O-N 3.29Å; L30-R32 VanDerWaalsContact O-N 3.16Å
33	F	33	Very low	53.4	Low	195 Å²	195	96.3 Å²	96.3	86%	0.855	52%	0.518	S	S	*	.	S	Bend	trans	86.1	55.8	-176	-49.9	-73.7	0	0	0	116.7
34	L	32.1	Very low	55.2	Low	182 Å²	182	95.8 Å²	95.8	95%	0.953	51%	0.51	S	S	*	.			trans	-167.3	50.7	144.8	-99.9	157.6	0	0	0	107.7
35	Q	35.3	Very low	57	Low	188 Å²	188	94.4 Å²	94.4	88%	0.879	50%	0.498	S	S	*	.			trans	-84.2	114.1	166.6	-144.8	166.7	-9.6	0	0	105	Q37	Q35-Q37 PolarHBondContact O-N 2.99Å; Q35-Q37 VanDerWaalsContact O-N 3.11Å
36	A	47.7	Very low	59	Low	66 Å²	66	91.8 Å²	91.8	55%	0.545	48%	0.479	S	S	.	.			trans	-52.9	121.1	173.3	0	0	0	0	0	107.7	T38	A36-T38 PolarHBondContact O-N 3.3Å; A36-T38 VanDerWaalsContact O-N 3.1Å
37	Q	58.3	Low	60.9	Low	67 Å²	67	94.2 Å²	94.2	31%	0.313	49%	0.488	S	S	.	.			trans	-71.4	109.2	-175.6	-163.6	170.3	21.8	0	0	108.2	Q35 F39 S286 S288	Q35-Q37 PolarHBondContact O-N 2.99Å; Q35-Q37 VanDerWaalsContact O-N 3.11Å; Q37-F39 HydrophobicContact CG-CE1 4.4Å; Q37-S286 PolarHBondContact NE2-O 3.08Å; Q37-S288 PolarHBondContact NE2-OG 2.68Å; Q37-S288 PolarHBondContact OE1-OG 2.96Å
38	T	67.6	Low	62.7	Low	75 Å²	75	92.8 Å²	92.8	46%	0.46	48%	0.476	S	S	.	.			trans	-84.5	124.5	178.6	45.1	0	0	0	0	109.6	A36 S40 T313	A36-T38 PolarHBondContact O-N 3.3Å; A36-T38 VanDerWaalsContact O-N 3.1Å; T38-S40 PolarHBondContact O-N 3.49Å; T38-T313 HydrophobicContact CG2-CG2 4.25Å
39	F	86.5	Confident	64.7	Low	14 Å²	14	86.9 Å²	86.9	6%	0.061	45%	0.445	C	S	.	.			trans	-88.6	26.9	177.9	-58.9	-68	0	0	0	112.8	Q37 I287 F289 W296 Y299 V309 L411 A412	Q37-F39 HydrophobicContact CG-CE1 4.4Å; F39-I287 HydrophobicContact CD1-CG2 4.3Å; F39-I287 HydrophobicContact CE1-CG2 4.4Å; F39-F289 HydrophobicContact CE1-CD2 4.22Å; F39-F289 HydrophobicContact CE1-CE2 4.31Å; F39-F289 HydrophobicContact CZ-CE2 4.42Å; F39-W296 HydrophobicContact CB-CH2 4.03Å; F39-W296 AromaticContact CD1-CH2 3.53Å; F39-W296 HydrophobicContact CD1-CH2 3.53Å; F39-W296 AromaticContact CD1-CZ2 3.78Å; F39-W296 HydrophobicContact CD1-CZ2 3.78Å; F39-W296 HydrophobicContact CE1-CH2 4.31Å; F39-W296 HydrophobicContact CE1-CZ2 4.1Å; F39-W296 HydrophobicContact CG-CH2 4.01Å; F39-Y299 HydrophobicContact CD1-CD1 4.43Å; F39-Y299 HydrophobicContact CD1-CE1 4.24Å; F39-Y299 HydrophobicContact CD2-CD1 4.46Å; F39-Y299 HydrophobicContact CD2-CE1 4.19Å; F39-Y299 HydrophobicContact CE1-CD1 4.18Å; F39-Y299 HydrophobicContact CE1-CE1 4.44Å; F39-Y299 HydrophobicContact CE2-CD1 4.21Å; F39-Y299 HydrophobicContact CE2-CE1 4.4Å; F39-Y299 HydrophobicContact CG-CE1 4.11Å; F39-Y299 HydrophobicContact CZ-CD1 4.06Å; F39-V309 HydrophobicContact CD2-CG1 4.33Å; F39-V309 HydrophobicContact CE2-CB 4.33Å; F39-V309 HydrophobicContact CE2-CG1 4.05Å; F39-V309 HydrophobicContact CE2-CG2 3.92Å; F39-V309 HydrophobicContact CZ-CG2 4.19Å; F39-L411 HydrophobicContact CB-CD1 4.28Å; F39-A412 PolarHBondContact O-N 2.84Å
40	S	86.9	Confident	66.9	Low	25 Å²	25	87.8 Å²	87.8	18%	0.175	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	144	-180	58.8	0	0	0	0	111.7	T38 Y401 I410	T38-S40 PolarHBondContact O-N 3.49Å; S40-Y401 WeakPolarHBondContact CB-OH 3.36Å; S40-Y401 PolarHBondContact OG-OH 2.96Å; S40-Y401 VanDerWaalsContact OG-OH 3.13Å; S40-I410 VanDerWaalsContact CA-O 3.27Å; S40-I410 WeakPolarHBondContact CA-O 3.3Å
41	F	90.1	Very high	68.9	Low	3 Å²	3	88.8 Å²	88.8	1%	0.013	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	160.5	-179.6	54.7	-86.5	0	0	0	111	L60 H285 I287 W290 Y398 Y409 I410	F41-L60 HydrophobicContact CE2-CB 4.2Å; F41-L60 HydrophobicContact CE2-CD1 4.28Å; F41-L60 HydrophobicContact CZ-CD1 4.22Å; F41-H285 HydrophobicContact CB-CB 4.18Å; F41-H285 AromaticContact CD2-CD2 3.93Å; F41-H285 AromaticContact CD2-NE2 3.85Å; F41-H285 AromaticContact CG-CD2 3.83Å; F41-I287 HydrophobicContact CD1-CD1 4.49Å; F41-W290 HydrophobicContact CD1-CZ3 4.32Å; F41-W290 HydrophobicContact CE1-CH2 4.46Å; F41-W290 AromaticContact CE1-CZ3 3.86Å; F41-W290 HydrophobicContact CE1-CZ3 3.86Å; F41-W290 HydrophobicContact CE2-CH2 4.35Å; F41-W290 HydrophobicContact CE2-CZ3 4.42Å; F41-W290 HydrophobicContact CZ-CH2 4.04Å; F41-W290 AromaticContact CZ-CZ3 3.92Å; F41-W290 HydrophobicContact CZ-CZ3 3.92Å; F41-Y398 HydrophobicContact CE1-CD1 4.3Å; F41-Y398 AromaticContact CE1-CE1 3.87Å; F41-Y398 HydrophobicContact CE1-CE1 3.87Å; F41-Y398 HydrophobicContact CZ-CD1 4.04Å; F41-Y398 AromaticContact CZ-CE1 3.48Å; F41-Y398 HydrophobicContact CZ-CE1 3.48Å; F41-Y398 VanDerWaalsContact CZ-CE1 3.48Å; F41-Y409 VanDerWaalsContact C-CD1 3.45Å; F41-Y409 WeakPolarHBondContact O-CA 3.41Å; F41-I410 HydrophobicContact CD2-CD1 3.99Å; F41-I410 HydrophobicContact CD2-CG1 3.99Å; F41-I410 HydrophobicContact CE2-CD1 3.29Å; F41-I410 HydrophobicContact CE2-CG1 3.78Å; F41-I410 HydrophobicContact CZ-CD1 3.59Å; F41-I410 HydrophobicContact CZ-CG1 4.09Å; F41-I410 PolarHBondContact N-O 3.19Å; F41-I410 WeakPolarHBondContact O-CG1 3.49Å; F41-I410 PolarHBondContact O-N 3.45Å
42	P	89.9	Confident	71.2	Confident	52 Å²	52	89.1 Å²	89.1	34%	0.338	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	138.1	-175.7	-24.5	34.7	0	0	0	112.4	Q44 Y409	P42-Q44 PolarHBondContact O-N 2.95Å; P42-Y409 HydrophobicContact CG-CD1 4.47Å; P42-Y409 HydrophobicContact CG-CE1 3.9Å
43	F	90.8	Very high	73.7	Confident	18 Å²	18	81.3 Å²	81.3	8%	0.079	42%	0.418	C	S	.	.			trans	-84.1	115.3	177.6	-174.6	-136.9	0	0	0	111	Q45 V333 W346 E400 Q408 I410	F43-Q45 HydrophobicContact CE1-CG 4.09Å; F43-Q45 HydrophobicContact CE2-CG 4.12Å; F43-Q45 HydrophobicContact CZ-CG 3.7Å; F43-V333 HydrophobicContact CE2-CG2 4.33Å; F43-V333 HydrophobicContact CZ-CG2 4.46Å; F43-W346 HydrophobicContact CE2-CD2 4.1Å; F43-W346 HydrophobicContact CE2-CE3 4.23Å; F43-W346 HydrophobicContact CE2-CZ2 4.42Å; F43-W346 HydrophobicContact CE2-CZ3 4.45Å; F43-E400 HydrophobicContact CD1-CG 4.29Å; F43-Q408 HydrophobicContact CB-CB 4.11Å; F43-Q408 PolarHBondContact N-O 3.25Å; F43-I410 HydrophobicContact CB-CG1 4.2Å; F43-I410 HydrophobicContact CB-CG2 3.9Å; F43-I410 HydrophobicContact CD2-CD1 3.92Å; F43-I410 HydrophobicContact CD2-CG1 4.19Å; F43-I410 HydrophobicContact CD2-CG2 3.64Å; F43-I410 HydrophobicContact CE2-CG2 4.32Å; F43-I410 HydrophobicContact CG-CG2 3.78Å
44	Q	87.5	Confident	76.3	Confident	66 Å²	66	72.7 Å²	72.7	31%	0.308	38%	0.38	S	S	.	.			trans	-128.4	140.8	177.9	-66.5	-178.7	-13.3	0	0	110	P42 F55 S61 W346	P42-Q44 PolarHBondContact O-N 2.95Å; Q44-F55 HydrophobicContact CB-CE2 4.46Å; Q44-F55 WeakPolarHBondContact O-CE2 3.33Å; Q44-S61 VanDerWaalsContact OE1-CA 3.23Å; Q44-W346 PolarHBondContact O-NE1 3.06Å
45	Q	84.4	Confident	78.9	Confident	52 Å²	52	64 Å²	64	24%	0.243	34%	0.335	C	S	.	.			trans	-118.5	148.4	-179	-62.6	178.3	-64.6	0	0	109.5	F43 E47 K48 C49	F43-Q45 HydrophobicContact CE1-CG 4.09Å; F43-Q45 HydrophobicContact CE2-CG 4.12Å; F43-Q45 HydrophobicContact CZ-CG 3.7Å; Q45-E47 WeakPolarHBondContact CB-OE2 3.36Å; Q45-E47 PolarHBondContact O-N 3.37Å; Q45-E47 VanDerWaalsContact O-N 3.17Å; Q45-K48 HydrophobicContact CB-CD 4.39Å; Q45-K48 HydrophobicContact CB-CG 4.37Å; Q45-K48 PolarHBondContact O-N 2.95Å; Q45-C49 PolarHBondContact O-N 3.27Å
46	P	83	Confident	81.3	Confident	22 Å²	22	55.6 Å²	55.6	14%	0.143	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-52.4	-37.7	178.1	-25.2	31.8	0	0	0	113.5	K48 C49 F55 F343	P46-K48 PolarHBondContact O-N 2.84Å; P46-C49 PolarHBondContact O-N 3.09Å; P46-F55 HydrophobicContact CB-CB 4.12Å; P46-F55 HydrophobicContact CB-CG 4.23Å; P46-F55 HydrophobicContact CG-CB 4.22Å; P46-F55 HydrophobicContact CG-CD1 3.79Å; P46-F55 HydrophobicContact CG-CD2 4.28Å; P46-F55 HydrophobicContact CG-CE1 4.2Å; P46-F55 HydrophobicContact CG-CG 3.82Å; P46-F343 HydrophobicContact CG-CE1 4.31Å
47	E	81.3	Confident	83.1	Confident	153 Å²	153	53.8 Å²	53.8	72%	0.715	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-72.6	-16.7	-178.4	-52.3	80.9	-174	0	0	113.4	Q45	Q45-E47 WeakPolarHBondContact CB-OE2 3.36Å; Q45-E47 PolarHBondContact O-N 3.37Å; Q45-E47 VanDerWaalsContact O-N 3.17Å
48	K	81.9	Confident	84.4	Confident	114 Å²	114	50.6 Å²	50.6	50%	0.496	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-96.3	-5.6	178.7	-67.4	-179	177.9	171.2	0	112.8	Q45 P46	Q45-K48 HydrophobicContact CB-CD 4.39Å; Q45-K48 HydrophobicContact CB-CG 4.37Å; Q45-K48 PolarHBondContact O-N 2.95Å; P46-K48 PolarHBondContact O-N 2.84Å
49	C	84.9	Confident	85.2	Confident	11 Å²	11	47.5 Å²	47.5	7%	0.074	24%	0.243	C	C	.	.	S	Bend	trans	-72.6	140.2	174.3	-58.8	0	0	0	0	109.8	Q45 P46 Q53 C62	Q45-C49 PolarHBondContact O-N 3.27Å; P46-C49 PolarHBondContact O-N 3.09Å; C49-Q53 HydrophobicContact CB-CB 4.14Å; C49-C62 WeakPolarHBondContact CA-SG 3.47Å; C49-C62 HydrophobicContact CB-CB 3.86Å; C49-C62 WeakPolarHBondContact CB-SG 3.42Å; C49-C62 WeakPolarHBondContact SG-CB 3.39Å; C49-C62 CovalentContact SG-SG 2.04Å; C49-C62 PolarHBondContact SG-SG 3.31Å
50	D	82.5	Confident	85.3	Confident	102 Å²	102	46.9 Å²	46.9	55%	0.545	24%	0.241	S	C	.	.			trans	-63.2	157.5	176.1	-68	-41.8	0	0	0	111.5	N52 Q53	D50-N52 PolarHBondContact O-N 3.47Å; D50-Q53 HydrophobicContact CB-CB 4.44Å; D50-Q53 HydrophobicContact CB-CG 4.1Å; D50-Q53 WeakPolarHBondContact O-CA 3.35Å; D50-Q53 WeakPolarHBondContact O-CB 3.34Å; D50-Q53 PolarHBondContact O-N 3Å; D50-Q53 PolarHBondContact OD2-NE2 3.33Å
51	N	77.6	Confident	85.4	Confident	135 Å²	135	46.8 Å²	46.8	72%	0.722	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-18.4	178.3	-67.4	-22.5	0	0	0	114.6
52	N	81.4	Confident	85.3	Confident	118 Å²	118	47.9 Å²	47.9	63%	0.631	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.7	9.3	176.3	-70.7	-4	0	0	0	112.7	D50 C65	D50-N52 PolarHBondContact O-N 3.47Å; N52-C65 WeakPolarHBondContact O-CB 3.42Å; N52-C65 PolarHBondContact O-N 2.99Å
53	Q	85.8	Confident	85.1	Confident	50 Å²	50	47.4 Å²	47.4	23%	0.234	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	159.2	177.2	-66.2	172.7	-4.7	0	0	109.6	C49 D50 C62 V63 P64 Q71	C49-Q53 HydrophobicContact CB-CB 4.14Å; D50-Q53 HydrophobicContact CB-CB 4.44Å; D50-Q53 HydrophobicContact CB-CG 4.1Å; D50-Q53 WeakPolarHBondContact O-CA 3.35Å; D50-Q53 WeakPolarHBondContact O-CB 3.34Å; D50-Q53 PolarHBondContact O-N 3Å; D50-Q53 PolarHBondContact OD2-NE2 3.33Å; Q53-C62 HydrophobicContact CB-CB 4.41Å; Q53-V63 CarbonylContact C-O 3.54Å; Q53-V63 VanDerWaalsContact CA-O 3.23Å; Q53-V63 WeakPolarHBondContact CA-O 3.24Å; Q53-V63 WeakPolarHBondContact CB-O 3.46Å; Q53-P64 HydrophobicContact CG-CB 4.48Å; Q53-Q71 VanDerWaalsContact O-CG 3.26Å; Q53-Q71 WeakPolarHBondContact O-CG 3.43Å; Q53-Q71 PolarHBondContact O-NE2 3Å; Q53-Q71 VanDerWaalsContact O-NE2 3.11Å
54	Y	86.4	Confident	84.9	Confident	14 Å²	14	50.8 Å²	50.8	6%	0.055	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	155.7	168.6	73.7	-80.4	0	0	0	109.5	D56 C62 V63 G75 T76 C78 P93	Y54-D56 HydrophobicContact CE2-CB 3.79Å; Y54-D56 PolarHBondContact O-N 3.38Å; Y54-C62 CarbonylContact O-C 3.56Å; Y54-C62 WeakPolarHBondContact O-CA 3.3Å; Y54-V63 HydrophobicContact CD1-CB 4.23Å; Y54-V63 WeakPolarHBondContact CD1-O 3.46Å; Y54-V63 HydrophobicContact CE1-CB 3.65Å; Y54-V63 HydrophobicContact CE1-CG1 3.75Å; Y54-V63 HydrophobicContact CE2-CB 4.42Å; Y54-V63 PolarHBondContact N-O 2.75Å; Y54-V63 PolarHBondContact O-N 2.7Å; Y54-G75 WeakPolarHBondContact CA-O 3.46Å; Y54-T76 WeakPolarHBondContact CD2-O 3.41Å; Y54-C78 WeakPolarHBondContact CD1-SG 3.18Å; Y54-P93 HydrophobicContact CD2-CB 3.74Å; Y54-P93 HydrophobicContact CD2-CG 4.2Å; Y54-P93 HydrophobicContact CE2-CB 3.32Å; Y54-P93 HydrophobicContact CE2-CG 3.31Å
55	F	87.3	Confident	84.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	108.6	175.5	-172.1	-103.2	0	0	0	110.4	Q44 P46 I57 L60 G75 F343 W346	Q44-F55 HydrophobicContact CB-CE2 4.46Å; Q44-F55 WeakPolarHBondContact O-CE2 3.33Å; P46-F55 HydrophobicContact CB-CB 4.12Å; P46-F55 HydrophobicContact CB-CG 4.23Å; P46-F55 HydrophobicContact CG-CB 4.22Å; P46-F55 HydrophobicContact CG-CD1 3.79Å; P46-F55 HydrophobicContact CG-CD2 4.28Å; P46-F55 HydrophobicContact CG-CE1 4.2Å; P46-F55 HydrophobicContact CG-CG 3.82Å; F55-I57 HydrophobicContact CD1-CG1 4.28Å; F55-I57 PolarHBondContact O-N 2.66Å; F55-L60 HydrophobicContact CE1-CD2 4.1Å; F55-L60 HydrophobicContact CZ-CB 4.21Å; F55-L60 HydrophobicContact CZ-CD2 4.05Å; F55-G75 PolarHBondContact N-O 3.41Å; F55-F343 HydrophobicContact CE1-CE1 4.34Å; F55-F343 HydrophobicContact CE1-CZ 4.26Å; F55-W346 AromaticContact CZ-NE1 3.45Å
56	D	85.9	Confident	84.5	Confident	10 Å²	10	47.8 Å²	47.8	5%	0.053	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	104.4	174.1	-176.3	-2.6	0	0	0	109.9	Y54 S58 A59 L60 S61 V63 Q292	Y54-D56 HydrophobicContact CE2-CB 3.79Å; Y54-D56 PolarHBondContact O-N 3.38Å; D56-S58 VanDerWaalsContact CG-OG 3.24Å; D56-S58 PolarHBondContact O-N 3.22Å; D56-S58 VanDerWaalsContact OD1-CB 3.3Å; D56-S58 WeakPolarHBondContact OD1-CB 3.11Å; D56-S58 PolarHBondContact OD1-N 3.02Å; D56-S58 PolarHBondContact OD1-OG 3.23Å; D56-S58 PolarHBondContact OD2-OG 2.85Å; D56-A59 HydrophobicContact CB-CB 4.43Å; D56-A59 PolarHBondContact O-N 3.26Å; D56-L60 VanDerWaalsContact O-CA 3.27Å; D56-L60 WeakPolarHBondContact O-CA 3.19Å; D56-L60 PolarHBondContact O-N 3.41Å; D56-S61 PolarHBondContact N-O 2.92Å; D56-S61 PolarHBondContact O-N 3.17Å; D56-V63 HydrophobicContact CB-CG2 3.86Å; D56-Q292 PolarHBondContact OD2-NE2 3.09Å
57	I	86.3	Confident	84.2	Confident	28 Å²	28	50.5 Å²	50.5	14%	0.144	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-29.5	178.1	-65.1	159	0	0	0	112	F55 L60 T76 L243 Y337 F343	F55-I57 HydrophobicContact CD1-CG1 4.28Å; F55-I57 PolarHBondContact O-N 2.66Å; I57-L60 WeakPolarHBondContact O-CD2 3.33Å; I57-T76 HydrophobicContact CD1-CG2 4.07Å; I57-T76 HydrophobicContact CG1-CG2 4.41Å; I57-L243 HydrophobicContact CB-CD2 4.06Å; I57-L243 HydrophobicContact CG2-CD2 4.32Å; I57-Y337 HydrophobicContact CG2-CE1 4.04Å; I57-F343 HydrophobicContact CB-CB 4.43Å; I57-F343 HydrophobicContact CD1-CB 3.69Å; I57-F343 HydrophobicContact CD1-CG 4.4Å; I57-F343 HydrophobicContact CG1-CB 3.85Å; I57-F343 HydrophobicContact CG1-CD1 4.25Å; I57-F343 HydrophobicContact CG1-CG 4.11Å; I57-F343 HydrophobicContact CG2-CB 3.68Å; I57-F343 HydrophobicContact CG2-CD2 4.41Å; I57-F343 HydrophobicContact CG2-CG 4.2Å
58	S	83.8	Confident	84.3	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.007	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-32.2	-177.4	77	0	0	0	0	112.5	D56 W290 Q292	D56-S58 VanDerWaalsContact CG-OG 3.24Å; D56-S58 PolarHBondContact O-N 3.22Å; D56-S58 VanDerWaalsContact OD1-CB 3.3Å; D56-S58 WeakPolarHBondContact OD1-CB 3.11Å; D56-S58 PolarHBondContact OD1-N 3.02Å; D56-S58 PolarHBondContact OD1-OG 3.23Å; D56-S58 PolarHBondContact OD2-OG 2.85Å; S58-W290 WeakPolarHBondContact O-CZ2 3.33Å; S58-W290 PolarHBondContact O-NE1 3.41Å; S58-W290 VanDerWaalsContact O-NE1 3.09Å; S58-Q292 PolarHBondContact OG-NE2 3.08Å
59	A	84.9	Confident	84.5	Confident	9 Å²	9	42 Å²	42	7%	0.074	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	-10	179.5	0	0	0	0	0	113.9	D56 S61 V284 H285	D56-A59 HydrophobicContact CB-CB 4.43Å; D56-A59 PolarHBondContact O-N 3.26Å; A59-S61 VanDerWaalsContact C-N 3.29Å; A59-S61 PolarHBondContact O-N 3.19Å; A59-V284 HydrophobicContact CB-CG1 3.88Å; A59-H285 PolarHBondContact O-NE2 3.49Å
60	L	88.3	Confident	84.3	Confident	2 Å²	2	46 Å²	46	1%	0.01	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	42.7	-173	-57.8	176.5	0	0	0	112.8	F41 F55 D56 I57 W290 W346 Y398	F41-L60 HydrophobicContact CE2-CB 4.2Å; F41-L60 HydrophobicContact CE2-CD1 4.28Å; F41-L60 HydrophobicContact CZ-CD1 4.22Å; F55-L60 HydrophobicContact CE1-CD2 4.1Å; F55-L60 HydrophobicContact CZ-CB 4.21Å; F55-L60 HydrophobicContact CZ-CD2 4.05Å; D56-L60 VanDerWaalsContact O-CA 3.27Å; D56-L60 WeakPolarHBondContact O-CA 3.19Å; D56-L60 PolarHBondContact O-N 3.41Å; I57-L60 WeakPolarHBondContact O-CD2 3.33Å; L60-W290 HydrophobicContact CB-CH2 4.41Å; L60-W290 HydrophobicContact CD1-CH2 3.93Å; L60-W290 HydrophobicContact CD1-CZ2 4.3Å; L60-W290 HydrophobicContact CG-CH2 4.13Å; L60-W290 HydrophobicContact CG-CZ2 4.27Å; L60-W346 HydrophobicContact CB-CZ2 4.28Å; L60-W346 HydrophobicContact CD1-CH2 4Å; L60-W346 HydrophobicContact CD1-CZ2 3.94Å; L60-W346 HydrophobicContact CD2-CZ2 4.03Å; L60-W346 HydrophobicContact CG-CZ2 4.32Å; L60-Y398 VanDerWaalsContact CD1-OH 3.23Å; L60-Y398 WeakPolarHBondContact CD1-OH 3.36Å
61	S	88.6	Confident	84.4	Confident	23 Å²	23	43.1 Å²	43.1	16%	0.161	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	155.3	-178.5	59	0	0	0	0	112.6	Q44 D56 A59	Q44-S61 VanDerWaalsContact OE1-CA 3.23Å; D56-S61 PolarHBondContact N-O 2.92Å; D56-S61 PolarHBondContact O-N 3.17Å; A59-S61 VanDerWaalsContact C-N 3.29Å; A59-S61 PolarHBondContact O-N 3.19Å
62	C	87.9	Confident	84.4	Confident	25 Å²	25	37.9 Å²	37.9	17%	0.169	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	125.3	172.4	-56.8	0	0	0	0	109.7	C49 Q53 Y54	C49-C62 WeakPolarHBondContact CA-SG 3.47Å; C49-C62 HydrophobicContact CB-CB 3.86Å; C49-C62 WeakPolarHBondContact CB-SG 3.42Å; C49-C62 WeakPolarHBondContact SG-CB 3.39Å; C49-C62 CovalentContact SG-SG 2.04Å; C49-C62 PolarHBondContact SG-SG 3.31Å; Q53-C62 HydrophobicContact CB-CB 4.41Å; Y54-C62 CarbonylContact O-C 3.56Å; Y54-C62 WeakPolarHBondContact O-CA 3.3Å
63	V	86.5	Confident	84.2	Confident	42 Å²	42	37.7 Å²	37.7	26%	0.255	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136.4	179.3	179.5	0	0	0	0	108.3	Q53 Y54 D56	Q53-V63 CarbonylContact C-O 3.54Å; Q53-V63 VanDerWaalsContact CA-O 3.23Å; Q53-V63 WeakPolarHBondContact CA-O 3.24Å; Q53-V63 WeakPolarHBondContact CB-O 3.46Å; Y54-V63 HydrophobicContact CD1-CB 4.23Å; Y54-V63 WeakPolarHBondContact CD1-O 3.46Å; Y54-V63 HydrophobicContact CE1-CB 3.65Å; Y54-V63 HydrophobicContact CE1-CG1 3.75Å; Y54-V63 HydrophobicContact CE2-CB 4.42Å; Y54-V63 PolarHBondContact N-O 2.75Å; Y54-V63 PolarHBondContact O-N 2.7Å; D56-V63 HydrophobicContact CB-CG2 3.86Å
64	P	85.8	Confident	83.6	Confident	89 Å²	89	45.1 Å²	45.1	58%	0.578	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.3	136.8	177.9	26.6	-34.3	0	0	0	111.5	Q53	Q53-P64 HydrophobicContact CG-CB 4.48Å
65	C	83.1	Confident	83.2	Confident	18 Å²	18	44.9 Å²	44.9	12%	0.122	27%	0.265	C	S	.	.			trans	-65	147.5	164.8	-68.9	0	0	0	0	110	N52 Q69 C78	N52-C65 WeakPolarHBondContact O-CB 3.42Å; N52-C65 PolarHBondContact O-N 2.99Å; C65-Q69 HydrophobicContact CB-CB 3.81Å; C65-C78 WeakPolarHBondContact CA-SG 3.38Å; C65-C78 HydrophobicContact CB-CB 3.9Å; C65-C78 WeakPolarHBondContact CB-SG 3.45Å; C65-C78 WeakPolarHBondContact SG-CB 3.41Å; C65-C78 CovalentContact SG-SG 2.04Å; C65-C78 PolarHBondContact SG-SG 3.2Å
66	G	80.8	Confident	82.8	Confident	37 Å²	37	46.3 Å²	46.3	38%	0.381	27%	0.274	S	S	.	.			trans	-67.9	176.3	178.3	0	0	0	0	0	112.8	N68 Q69	G66-N68 PolarHBondContact O-N 2.83Å; G66-Q69 WeakPolarHBondContact O-CB 3.49Å; G66-Q69 PolarHBondContact O-N 3.22Å
67	A	78.2	Confident	82.5	Confident	79 Å²	79	47.4 Å²	47.4	65%	0.653	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	135.4	177.5	0	0	0	0	0	111.6
68	N	82.7	Confident	82.3	Confident	73 Å²	73	46.3 Å²	46.3	39%	0.39	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	30.9	-179.3	-44.4	-65.6	0	0	0	115.6	G66 L81 F84 C97	G66-N68 PolarHBondContact O-N 2.83Å; N68-L81 HydrophobicContact CB-CD1 4.49Å; N68-L81 PolarHBondContact O-N 3.47Å; N68-F84 HydrophobicContact CB-CD1 3.38Å; N68-F84 HydrophobicContact CB-CE1 3.33Å; N68-F84 HydrophobicContact CB-CG 4.11Å; N68-F84 HydrophobicContact CB-CZ 3.99Å; N68-F84 WeakPolarHBondContact OD1-CE1 3.2Å; N68-C97 HydrophobicContact CB-CB 4.39Å
69	Q	85.2	Confident	82.3	Confident	16 Å²	16	48.9 Å²	48.9	8%	0.075	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	159.6	176.2	-67.7	160.6	39.8	0	0	110.6	C65 G66 C78 V79 V95 C97	C65-Q69 HydrophobicContact CB-CB 3.81Å; G66-Q69 WeakPolarHBondContact O-CB 3.49Å; G66-Q69 PolarHBondContact O-N 3.22Å; Q69-C78 HydrophobicContact CB-CB 4.33Å; Q69-V79 CarbonylContact C-O 3.5Å; Q69-V79 VanDerWaalsContact CA-O 3.3Å; Q69-V79 WeakPolarHBondContact CA-O 3.39Å; Q69-V95 VanDerWaalsContact CD-O 3.27Å; Q69-V95 HydrophobicContact CG-CG2 4.13Å; Q69-V95 PolarHBondContact NE2-O 3.05Å; Q69-V95 PolarHBondContact OE1-O 2.96Å; Q69-C97 HydrophobicContact CG-CB 4.31Å; Q69-C97 WeakPolarHBondContact CG-SG 3.47Å
70	R	82.4	Confident	82.3	Confident	95 Å²	95	49.6 Å²	49.6	36%	0.358	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	160	168	62.2	175.2	179.4	176.4	3.5	109.9	C78 V79 L81	R70-C78 WeakPolarHBondContact O-CA 3.32Å; R70-V79 HydrophobicContact CG-CG2 3.79Å; R70-V79 PolarHBondContact N-O 3.44Å; R70-V79 PolarHBondContact O-N 2.76Å; R70-V79 VanDerWaalsContact O-O 3.08Å; R70-L81 HydrophobicContact CB-CD2 3.82Å; R70-L81 HydrophobicContact CG-CD2 4.01Å
71	Q	83	Confident	82.1	Confident	42 Å²	42	52.4 Å²	52.4	20%	0.196	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	143.8	171.4	-165.9	-179.6	33.4	0	0	111.1	Q53 G75	Q53-Q71 VanDerWaalsContact O-CG 3.26Å; Q53-Q71 WeakPolarHBondContact O-CG 3.43Å; Q53-Q71 PolarHBondContact O-NE2 3Å; Q53-Q71 VanDerWaalsContact O-NE2 3.11Å; Q71-G75 PolarHBondContact NE2-O 2.97Å
72	D	79.1	Confident	81.7	Confident	24 Å²	24	54 Å²	54	13%	0.128	32%	0.321	C	S	.	.			trans	-69.7	169	171.7	78.3	3.4	0	0	0	111.9	R74 G75 T76 S77 V79	D72-R74 PolarHBondContact O-N 3.16Å; D72-R74 VanDerWaalsContact O-N 3.08Å; D72-R74 VanDerWaalsContact OD1-C 3.29Å; D72-R74 WeakPolarHBondContact OD1-CA 3.29Å; D72-R74 PolarHBondContact OD1-N 3.48Å; D72-G75 PolarHBondContact O-N 3.42Å; D72-G75 WeakPolarHBondContact OD1-CA 3.35Å; D72-G75 PolarHBondContact OD1-N 2.67Å; D72-T76 PolarHBondContact OD1-N 3.02Å; D72-S77 WeakPolarHBondContact CB-O 3.45Å; D72-S77 VanDerWaalsContact CG-OG 3.26Å; D72-S77 PolarHBondContact N-O 2.86Å; D72-S77 WeakPolarHBondContact OD2-CB 3.18Å; D72-S77 PolarHBondContact OD2-N 3.49Å; D72-S77 PolarHBondContact OD2-OG 3.49Å; D72-V79 HydrophobicContact CB-CG1 4.04Å
73	A	76.4	Confident	81.1	Confident	115 Å²	115	53.8 Å²	53.8	95%	0.95	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-15.9	-179.7	0	0	0	0	0	114.2
74	R	73.2	Confident	81	Confident	206 Å²	206	53.3 Å²	53.3	78%	0.777	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-7.2	-179	-77.7	-173.2	-90.9	168.7	-6.5	113.3	D72 T76	D72-R74 PolarHBondContact O-N 3.16Å; D72-R74 VanDerWaalsContact O-N 3.08Å; D72-R74 VanDerWaalsContact OD1-C 3.29Å; D72-R74 WeakPolarHBondContact OD1-CA 3.29Å; D72-R74 PolarHBondContact OD1-N 3.48Å; R74-T76 VanDerWaalsContact C-N 3.28Å; R74-T76 PolarHBondContact O-N 3.3Å
75	G	77.9	Confident	80.8	Confident	8 Å²	8	50.9 Å²	50.9	8%	0.082	30%	0.299	C	S	.	.	S	Bend	trans	79	0.5	-177.5	0	0	0	0	0	116	Y54 F55 Q71 D72	Y54-G75 WeakPolarHBondContact CA-O 3.46Å; F55-G75 PolarHBondContact N-O 3.41Å; Q71-G75 PolarHBondContact NE2-O 2.97Å; D72-G75 PolarHBondContact O-N 3.42Å; D72-G75 WeakPolarHBondContact OD1-CA 3.35Å; D72-G75 PolarHBondContact OD1-N 2.67Å
76	T	78.1	Confident	80.7	Confident	31 Å²	31	51.5 Å²	51.5	19%	0.19	30%	0.3	C	S	.	.	S	Bend	trans	-110.1	-6.9	-163.8	52.4	0	0	0	0	114.8	Y54 I57 D72 R74	Y54-T76 WeakPolarHBondContact CD2-O 3.41Å; I57-T76 HydrophobicContact CD1-CG2 4.07Å; I57-T76 HydrophobicContact CG1-CG2 4.41Å; D72-T76 PolarHBondContact OD1-N 3.02Å; R74-T76 VanDerWaalsContact C-N 3.28Å; R74-T76 PolarHBondContact O-N 3.3Å
77	S	79.9	Confident	80.5	Confident	33 Å²	33	54 Å²	54	23%	0.231	30%	0.304	C	S	.	.	S	Bend	trans	-148.2	167.5	175.1	74.2	0	0	0	0	111.4	D72	D72-S77 WeakPolarHBondContact CB-O 3.45Å; D72-S77 VanDerWaalsContact CG-OG 3.26Å; D72-S77 PolarHBondContact N-O 2.86Å; D72-S77 WeakPolarHBondContact OD2-CB 3.18Å; D72-S77 PolarHBondContact OD2-N 3.49Å; D72-S77 PolarHBondContact OD2-OG 3.49Å
78	C	83.1	Confident	80	Confident	4 Å²	4	51.8 Å²	51.8	3%	0.027	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	141.7	173.6	-59	0	0	0	0	111.3	Y54 C65 Q69 R70 P93 V95	Y54-C78 WeakPolarHBondContact CD1-SG 3.18Å; C65-C78 WeakPolarHBondContact CA-SG 3.38Å; C65-C78 HydrophobicContact CB-CB 3.9Å; C65-C78 WeakPolarHBondContact CB-SG 3.45Å; C65-C78 WeakPolarHBondContact SG-CB 3.41Å; C65-C78 CovalentContact SG-SG 2.04Å; C65-C78 PolarHBondContact SG-SG 3.2Å; Q69-C78 HydrophobicContact CB-CB 4.33Å; R70-C78 WeakPolarHBondContact O-CA 3.32Å; C78-P93 PolarHBondContact N-O 3.39Å; C78-V95 WeakPolarHBondContact O-CG2 3.28Å
79	V	83.7	Confident	79.2	Confident	56 Å²	56	51.3 Å²	51.3	34%	0.339	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	153.5	172	-63.8	0	0	0	0	109.8	Q69 R70 D72	Q69-V79 CarbonylContact C-O 3.5Å; Q69-V79 VanDerWaalsContact CA-O 3.3Å; Q69-V79 WeakPolarHBondContact CA-O 3.39Å; R70-V79 HydrophobicContact CG-CG2 3.79Å; R70-V79 PolarHBondContact N-O 3.44Å; R70-V79 PolarHBondContact O-N 2.76Å; R70-V79 VanDerWaalsContact O-O 3.08Å; D72-V79 HydrophobicContact CB-CG1 4.04Å
80	C	83.8	Confident	77.8	Confident	23 Å²	23	57.2 Å²	57.2	16%	0.155	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	149	175.1	-61.9	0	0	0	0	111.6	F84 M86 C97	C80-F84 HydrophobicContact CB-CB 4.11Å; C80-F84 WeakPolarHBondContact CB-O 3.43Å; C80-M86 WeakPolarHBondContact SG-CG 3.03Å; C80-C97 WeakPolarHBondContact CA-SG 3.26Å; C80-C97 HydrophobicContact CB-CB 3.81Å; C80-C97 WeakPolarHBondContact CB-SG 3.34Å; C80-C97 WeakPolarHBondContact SG-CB 3.16Å; C80-C97 CovalentContact SG-SG 2.02Å; C80-C97 PolarHBondContact SG-SG 3.28Å
81	L	84.1	Confident	76.4	Confident	61 Å²	61	55.3 Å²	55.3	32%	0.319	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-62.8	152.6	169.9	-71.4	172.5	0	0	0	110.9	N68 R70 G83 F84	N68-L81 HydrophobicContact CB-CD1 4.49Å; N68-L81 PolarHBondContact O-N 3.47Å; R70-L81 HydrophobicContact CB-CD2 3.82Å; R70-L81 HydrophobicContact CG-CD2 4.01Å; L81-G83 PolarHBondContact O-N 3.37Å; L81-F84 HydrophobicContact CB-CD2 3.77Å; L81-F84 HydrophobicContact CB-CE2 4.14Å; L81-F84 HydrophobicContact CB-CG 4.45Å; L81-F84 WeakPolarHBondContact O-CB 3.32Å; L81-F84 PolarHBondContact O-N 3.23Å
82	P	80.9	Confident	75.3	Confident	57 Å²	57	55 Å²	55	37%	0.37	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	131.8	174.2	-25.9	34.7	0	0	0	111.8
83	G	75.9	Confident	74.6	Confident	20 Å²	20	55.2 Å²	55.2	21%	0.206	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	13.8	-176.7	0	0	0	0	0	115.2	L81 C100	L81-G83 PolarHBondContact O-N 3.37Å; G83-C100 VanDerWaalsContact O-CB 3.23Å; G83-C100 WeakPolarHBondContact O-CB 3.41Å; G83-C100 PolarHBondContact O-N 2.9Å; G83-C100 PolarHBondContact O-SG 3.17Å; G83-C100 VanDerWaalsContact O-SG 3.4Å
84	F	83.7	Confident	73.9	Confident	32 Å²	32	52.6 Å²	52.6	14%	0.14	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	132.9	171.9	-69.1	-109.4	0	0	0	110.5	N68 C80 L81 C97 K98 K99	N68-F84 HydrophobicContact CB-CD1 3.38Å; N68-F84 HydrophobicContact CB-CE1 3.33Å; N68-F84 HydrophobicContact CB-CG 4.11Å; N68-F84 HydrophobicContact CB-CZ 3.99Å; N68-F84 WeakPolarHBondContact OD1-CE1 3.2Å; C80-F84 HydrophobicContact CB-CB 4.11Å; C80-F84 WeakPolarHBondContact CB-O 3.43Å; L81-F84 HydrophobicContact CB-CD2 3.77Å; L81-F84 HydrophobicContact CB-CE2 4.14Å; L81-F84 HydrophobicContact CB-CG 4.45Å; L81-F84 WeakPolarHBondContact O-CB 3.32Å; L81-F84 PolarHBondContact O-N 3.23Å; F84-C97 HydrophobicContact CB-CB 4.22Å; F84-K98 CarbonylContact C-O 3.51Å; F84-K98 VanDerWaalsContact CA-O 3.26Å; F84-K98 WeakPolarHBondContact CA-O 3.34Å; F84-K98 VanDerWaalsContact CD1-C 3.42Å; F84-K99 HydrophobicContact CD1-CB 3.84Å; F84-K99 HydrophobicContact CD1-CG 4.43Å; F84-K99 HydrophobicContact CE1-CB 3.46Å; F84-K99 VanDerWaalsContact CE1-CB 3.46Å; F84-K99 HydrophobicContact CE1-CG 3.92Å; F84-K99 HydrophobicContact CE2-CG 4.25Å; F84-K99 HydrophobicContact CZ-CB 3.92Å; F84-K99 HydrophobicContact CZ-CD 4.26Å; F84-K99 HydrophobicContact CZ-CG 3.83Å
85	Q	81.7	Confident	74	Confident	38 Å²	38	43.3 Å²	43.3	18%	0.178	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	150.4	174.9	67.2	175	22.4	0	0	111.6	C97 K98 V107 G111 W112 N113 C114	Q85-C97 CarbonylContact O-C 3.57Å; Q85-C97 VanDerWaalsContact O-CA 3.27Å; Q85-C97 WeakPolarHBondContact O-CA 3.29Å; Q85-K98 PolarHBondContact N-O 3.07Å; Q85-K98 PolarHBondContact O-N 2.88Å; Q85-V107 HydrophobicContact CB-CG1 4.36Å; Q85-G111 CarbonylContact C-O 3.59Å; Q85-G111 WeakPolarHBondContact CA-O 3.48Å; Q85-W112 PolarHBondContact OE1-O 3.39Å; Q85-N113 VanDerWaalsContact OE1-CA 3.32Å; Q85-C114 PolarHBondContact OE1-SG 2.86Å
86	M	81.6	Confident	74	Confident	31 Å²	31	47.6 Å²	47.6	15%	0.153	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	136.5	169.3	-71	-173.6	-75.9	0	0	110.9	C80 N89 V95 I96 D110 G111 W112	C80-M86 WeakPolarHBondContact SG-CG 3.03Å; M86-N89 HydrophobicContact SD-CB 4.41Å; M86-V95 HydrophobicContact SD-CB 4.48Å; M86-V95 HydrophobicContact SD-CG1 4.13Å; M86-I96 CarbonylContact C-O 3.34Å; M86-I96 WeakPolarHBondContact CA-O 3.37Å; M86-D110 WeakPolarHBondContact CE-O 3.37Å; M86-G111 PolarHBondContact N-O 3.35Å; M86-W112 HydrophobicContact CB-CD2 3.97Å; M86-W112 HydrophobicContact CB-CE3 4.08Å; M86-W112 HydrophobicContact CB-CG 4.33Å; M86-W112 HydrophobicContact CE-CG 4.45Å
87	I	76.4	Confident	74.3	Confident	91 Å²	91	46.7 Å²	46.7	47%	0.467	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	-25.5	172.5	-60.9	167.4	0	0	0	111.2	I96 K98 W112	I87-I96 PolarHBondContact N-O 2.94Å; I87-K98 HydrophobicContact CD1-CB 3.24Å; I87-K98 HydrophobicContact CD1-CD 3.79Å; I87-K98 HydrophobicContact CD1-CG 4.13Å; I87-K98 HydrophobicContact CG1-CB 3.98Å; I87-W112 VanDerWaalsContact C-CZ3 3.44Å; I87-W112 WeakPolarHBondContact O-CZ3 3.29Å
88	S	67.6	Low	74.5	Confident	31 Å²	31	51 Å²	51	22%	0.217	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	135.1	178.4	174.9	0	0	0	0	109.6	N90 V95 I96	S88-N90 PolarHBondContact OG-OD1 2.76Å; S88-V95 WeakPolarHBondContact O-CA 3.46Å; S88-I96 PolarHBondContact O-N 2.99Å
89	N	65.4	Low	74.5	Confident	64 Å²	64	57 Å²	57	34%	0.342	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	106.5	169.9	177.4	-6.3	0	0	0	106.6	M86 G91 V95 W112	M86-N89 HydrophobicContact SD-CB 4.41Å; N89-G91 VanDerWaalsContact C-N 3.27Å; N89-G91 PolarHBondContact O-N 3.5Å; N89-G91 PolarHBondContact OD1-N 3.18Å; N89-V95 HydrophobicContact CB-CG1 4.1Å; N89-W112 HydrophobicContact CB-CH2 3.91Å; N89-W112 HydrophobicContact CB-CZ2 3.61Å; N89-W112 VanDerWaalsContact N-CH2 3.31Å
90	N	57.2	Low	74.4	Confident	140 Å²	140	54.9 Å²	54.9	75%	0.749	32%	0.321	S	S	*	.			trans	-93.8	26.9	-176.9	-63.7	-20.4	0	0	0	112.1	S88 G92	S88-N90 PolarHBondContact OG-OD1 2.76Å; N90-G92 VanDerWaalsContact C-N 3.33Å; N90-G92 PolarHBondContact O-N 2.76Å
91	G	51.6	Low	74.4	Confident	55 Å²	55	57 Å²	57	57%	0.567	33%	0.334	S	S	*	.	S	Bend	trans	77.1	15.9	177.4	0	0	0	0	0	114.8	N89	N89-G91 VanDerWaalsContact C-N 3.27Å; N89-G91 PolarHBondContact O-N 3.5Å; N89-G91 PolarHBondContact OD1-N 3.18Å
92	G	61.3	Low	73.9	Confident	34 Å²	34	62.6 Å²	62.6	35%	0.351	36%	0.359	S	S	.	.	S	Bend	trans	-119.9	178.8	176	0	0	0	0	0	112.4	N90 A94	N90-G92 VanDerWaalsContact C-N 3.33Å; N90-G92 PolarHBondContact O-N 2.76Å; G92-A94 PolarHBondContact O-N 3.17Å
93	P	62.9	Low	73.4	Confident	29 Å²	29	65.7 Å²	65.7	19%	0.188	37%	0.372	C	S	.	.	S	Bend	trans	-72.1	-8	-176.9	29	-35.3	0	0	0	114.6	Y54 C78	Y54-P93 HydrophobicContact CD2-CB 3.74Å; Y54-P93 HydrophobicContact CD2-CG 4.2Å; Y54-P93 HydrophobicContact CE2-CB 3.32Å; Y54-P93 HydrophobicContact CE2-CG 3.31Å; C78-P93 PolarHBondContact N-O 3.39Å
94	A	62.6	Low	73.5	Confident	61 Å²	61	67 Å²	67	50%	0.504	37%	0.373	S	S	.	.			trans	-100.1	119.2	178	0	0	0	0	0	111.2	G92	G92-A94 PolarHBondContact O-N 3.17Å
95	V	74.3	Confident	72.8	Confident	11 Å²	11	73 Å²	73	7%	0.067	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	166.9	174.5	-64.2	0	0	0	0	110.2	Q69 C78 M86 S88 N89	Q69-V95 VanDerWaalsContact CD-O 3.27Å; Q69-V95 HydrophobicContact CG-CG2 4.13Å; Q69-V95 PolarHBondContact NE2-O 3.05Å; Q69-V95 PolarHBondContact OE1-O 2.96Å; C78-V95 WeakPolarHBondContact O-CG2 3.28Å; M86-V95 HydrophobicContact SD-CB 4.48Å; M86-V95 HydrophobicContact SD-CG1 4.13Å; S88-V95 WeakPolarHBondContact O-CA 3.46Å; N89-V95 HydrophobicContact CB-CG1 4.1Å
96	I	79.3	Confident	72.5	Confident	97 Å²	97	71.2 Å²	71.2	50%	0.497	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129.6	172.1	-59.7	177.2	0	0	0	108.7	M86 I87 S88	M86-I96 CarbonylContact C-O 3.34Å; M86-I96 WeakPolarHBondContact CA-O 3.37Å; I87-I96 PolarHBondContact N-O 2.94Å; S88-I96 PolarHBondContact O-N 2.99Å
97	C	84.4	Confident	72.5	Confident	12 Å²	12	70.2 Å²	70.2	8%	0.081	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	146.8	-170.3	-53.7	0	0	0	0	112.8	N68 Q69 C80 F84 Q85	N68-C97 HydrophobicContact CB-CB 4.39Å; Q69-C97 HydrophobicContact CG-CB 4.31Å; Q69-C97 WeakPolarHBondContact CG-SG 3.47Å; C80-C97 WeakPolarHBondContact CA-SG 3.26Å; C80-C97 HydrophobicContact CB-CB 3.81Å; C80-C97 WeakPolarHBondContact CB-SG 3.34Å; C80-C97 WeakPolarHBondContact SG-CB 3.16Å; C80-C97 CovalentContact SG-SG 2.02Å; C80-C97 PolarHBondContact SG-SG 3.28Å; F84-C97 HydrophobicContact CB-CB 4.22Å; Q85-C97 CarbonylContact O-C 3.57Å; Q85-C97 VanDerWaalsContact O-CA 3.27Å; Q85-C97 WeakPolarHBondContact O-CA 3.29Å
98	K	83.9	Confident	72.5	Confident	123 Å²	123	65.9 Å²	65.9	54%	0.535	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	142	174.4	171.8	178.5	179.2	-175.7	0	111.5	F84 Q85 I87	F84-K98 CarbonylContact C-O 3.51Å; F84-K98 VanDerWaalsContact CA-O 3.26Å; F84-K98 WeakPolarHBondContact CA-O 3.34Å; F84-K98 VanDerWaalsContact CD1-C 3.42Å; Q85-K98 PolarHBondContact N-O 3.07Å; Q85-K98 PolarHBondContact O-N 2.88Å; I87-K98 HydrophobicContact CD1-CB 3.24Å; I87-K98 HydrophobicContact CD1-CD 3.79Å; I87-K98 HydrophobicContact CD1-CG 4.13Å; I87-K98 HydrophobicContact CG1-CB 3.98Å
99	K	83.1	Confident	72.7	Confident	132 Å²	132	69 Å²	69	57%	0.574	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.9	138	-177.4	-164	-179.4	177.1	-174.1	0	111.5	F84	F84-K99 HydrophobicContact CD1-CB 3.84Å; F84-K99 HydrophobicContact CD1-CG 4.43Å; F84-K99 HydrophobicContact CE1-CB 3.46Å; F84-K99 VanDerWaalsContact CE1-CB 3.46Å; F84-K99 HydrophobicContact CE1-CG 3.92Å; F84-K99 HydrophobicContact CE2-CG 4.25Å; F84-K99 HydrophobicContact CZ-CB 3.92Å; F84-K99 HydrophobicContact CZ-CD 4.26Å; F84-K99 HydrophobicContact CZ-CG 3.83Å
100	C	81.9	Confident	72.8	Confident	11 Å²	11	68.7 Å²	68.7	7%	0.074	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-71.6	146.5	172.6	-70.6	0	0	0	0	112.8	G83 C114	G83-C100 VanDerWaalsContact O-CB 3.23Å; G83-C100 WeakPolarHBondContact O-CB 3.41Å; G83-C100 PolarHBondContact O-N 2.9Å; G83-C100 PolarHBondContact O-SG 3.17Å; G83-C100 VanDerWaalsContact O-SG 3.4Å; C100-C114 WeakPolarHBondContact CA-SG 3.24Å; C100-C114 HydrophobicContact CB-CB 3.56Å; C100-C114 WeakPolarHBondContact CB-SG 3.31Å; C100-C114 WeakPolarHBondContact SG-CB 3.45Å; C100-C114 CovalentContact SG-SG 2.02Å; C100-C114 PolarHBondContact SG-SG 2.89Å
101	P	82.2	Confident	73.6	Confident	68 Å²	68	62.6 Å²	62.6	44%	0.442	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-57.6	147.7	172.6	-25.6	36.7	0	0	0	112.9	N103 M104	P101-N103 WeakPolarHBondContact CB-OD1 3.42Å; P101-N103 PolarHBondContact O-N 3.4Å; P101-N103 VanDerWaalsContact O-N 3.09Å; P101-M104 PolarHBondContact O-N 3.25Å
102	E	74.4	Confident	74.7	Confident	178 Å²	178	64.3 Å²	64.3	83%	0.832	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.1	-174.3	-65.4	-161.2	159.8	0	0	114.8
103	N	70.7	Confident	75.5	Confident	121 Å²	121	65.1 Å²	65.1	65%	0.647	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-9.2	175.9	61.4	-27.4	0	0	0	113.9	P101	P101-N103 WeakPolarHBondContact CB-OD1 3.42Å; P101-N103 PolarHBondContact O-N 3.4Å; P101-N103 VanDerWaalsContact O-N 3.09Å
104	M	77.6	Confident	76.4	Confident	47 Å²	47	63.9 Å²	63.9	23%	0.232	32%	0.322	C	S	.	.			trans	-123.6	96.4	-178.5	-68.4	173.4	174.7	0	0	109.3	P101 C114	P101-M104 PolarHBondContact O-N 3.25Å; M104-C114 HydrophobicContact CB-CB 4.04Å; M104-C114 HydrophobicContact SD-CB 4.11Å; M104-C114 VanDerWaalsContact SD-O 3.37Å
105	K	69.2	Low	77.4	Confident	160 Å²	160	61 Å²	61	70%	0.696	30%	0.298	S	S	*	.			trans	-81.9	-13.4	-172.9	-62.7	-174.3	177.9	179.4	0	114.2	L121	K105-L121 HydrophobicContact CB-CD1 3.9Å; K105-L121 WeakPolarHBondContact O-CD1 3.47Å
106	G	75.6	Confident	77.7	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	156.6	-179.9	0	0	0	0	0	113.1	C114 I115 G125	G106-C114 CarbonylContact O-C 3.56Å; G106-C114 WeakPolarHBondContact O-CA 3.25Å; G106-I115 CarbonylContact C-O 3.58Å; G106-I115 WeakPolarHBondContact CA-O 3.4Å; G106-I115 PolarHBondContact N-O 3.05Å; G106-I115 PolarHBondContact O-N 3.29Å; G106-I115 VanDerWaalsContact O-O 3.09Å; G106-G125 WeakPolarHBondContact CA-O 3.44Å
107	V	80.9	Confident	77.6	Confident	9 Å²	9	58.5 Å²	58.5	6%	0.055	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	144.7	165.5	-167.4	0	0	0	0	107.6	Q85 N113 G125	Q85-V107 HydrophobicContact CB-CG1 4.36Å; V107-N113 CarbonylContact C-O 3.58Å; V107-N113 WeakPolarHBondContact CA-O 3.31Å; V107-N113 WeakPolarHBondContact CG1-O 3.35Å; V107-G125 PolarHBondContact N-O 3.16Å
108	T	75.6	Confident	77	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.301	C	S	.	.			trans	-56.5	156.9	175.4	49.1	0	0	0	0	111.8	D110 G111 W112 N113 I115 E137 L144	T108-D110 VanDerWaalsContact CB-OD1 3.25Å; T108-D110 WeakPolarHBondContact CB-OD1 3.23Å; T108-D110 PolarHBondContact O-N 2.86Å; T108-D110 PolarHBondContact OG1-OD1 3.28Å; T108-G111 VanDerWaalsContact O-CA 3.31Å; T108-G111 WeakPolarHBondContact O-CA 3.49Å; T108-G111 PolarHBondContact O-N 3.16Å; T108-W112 PolarHBondContact OG1-N 2.92Å; T108-N113 HydrophobicContact CG2-CB 3.93Å; T108-N113 PolarHBondContact N-O 3.3Å; T108-N113 PolarHBondContact OG1-N 3.15Å; T108-N113 PolarHBondContact OG1-O 3.16Å; T108-N113 VanDerWaalsContact OG1-O 3.11Å; T108-I115 HydrophobicContact CG2-CB 4.22Å; T108-I115 HydrophobicContact CG2-CG2 4Å; T108-E137 WeakPolarHBondContact CA-OE1 3.11Å; T108-E137 VanDerWaalsContact CA-OE2 3.29Å; T108-E137 WeakPolarHBondContact CA-OE2 3.45Å; T108-E137 WeakPolarHBondContact CB-OE2 3.3Å; T108-E137 HydrophobicContact CG2-CB 4.12Å; T108-E137 HydrophobicContact CG2-CG 4.49Å; T108-E137 WeakPolarHBondContact CG2-OE2 3.18Å; T108-L144 HydrophobicContact CG2-CD1 3.74Å
109	E	72.1	Confident	76.3	Confident	97 Å²	97	57.8 Å²	57.8	45%	0.453	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-35.8	179.5	-97.6	-65.3	163.3	0	0	112.5	G111 K126 L135 E137	E109-G111 PolarHBondContact O-N 2.93Å; E109-K126 WeakPolarHBondContact O-CE 3.27Å; E109-K126 PolarHBondContact O-NZ 3.06Å; E109-K126 IonicContact OE2-NZ 2.71Å; E109-K126 PolarHBondContact OE2-NZ 2.99Å; E109-L135 HydrophobicContact CG-CD2 3.89Å; E109-E137 PolarHBondContact N-OE1 2.77Å; E109-E137 PolarHBondContact N-OE2 2.91Å
110	D	67.7	Low	75.6	Confident	58 Å²	58	57.9 Å²	57.9	31%	0.31	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-11.4	173.6	68.6	4	0	0	0	113.4	M86 T108 W112 R138	M86-D110 WeakPolarHBondContact CE-O 3.37Å; T108-D110 VanDerWaalsContact CB-OD1 3.25Å; T108-D110 WeakPolarHBondContact CB-OD1 3.23Å; T108-D110 PolarHBondContact O-N 2.86Å; T108-D110 PolarHBondContact OG1-OD1 3.28Å; D110-W112 VanDerWaalsContact C-N 3.32Å; D110-W112 PolarHBondContact O-N 3.41Å; D110-W112 PolarHBondContact OD1-N 2.96Å; D110-W112 VanDerWaalsContact OD1-N 3.09Å; D110-R138 IonicContact OD2-NH2 3.2Å
111	G	74.2	Confident	75.2	Confident	11 Å²	11	60.8 Å²	60.8	11%	0.113	32%	0.319	C	S	.	.	S	Bend	trans	77.9	3.2	176.9	0	0	0	0	0	115.5	Q85 M86 T108 E109	Q85-G111 CarbonylContact C-O 3.59Å; Q85-G111 WeakPolarHBondContact CA-O 3.48Å; M86-G111 PolarHBondContact N-O 3.35Å; T108-G111 VanDerWaalsContact O-CA 3.31Å; T108-G111 WeakPolarHBondContact O-CA 3.49Å; T108-G111 PolarHBondContact O-N 3.16Å; E109-G111 PolarHBondContact O-N 2.93Å
112	W	74.9	Confident	74.7	Confident	92 Å²	92	59.5 Å²	59.5	35%	0.348	31%	0.31	S	S	.	.	S	Bend	trans	-92.7	-17.8	-171.7	-73.1	89	0	0	0	115.1	Q85 M86 I87 N89 T108 D110	Q85-W112 PolarHBondContact OE1-O 3.39Å; M86-W112 HydrophobicContact CB-CD2 3.97Å; M86-W112 HydrophobicContact CB-CE3 4.08Å; M86-W112 HydrophobicContact CB-CG 4.33Å; M86-W112 HydrophobicContact CE-CG 4.45Å; I87-W112 VanDerWaalsContact C-CZ3 3.44Å; I87-W112 WeakPolarHBondContact O-CZ3 3.29Å; N89-W112 HydrophobicContact CB-CH2 3.91Å; N89-W112 HydrophobicContact CB-CZ2 3.61Å; N89-W112 VanDerWaalsContact N-CH2 3.31Å; T108-W112 PolarHBondContact OG1-N 2.92Å; D110-W112 VanDerWaalsContact C-N 3.32Å; D110-W112 PolarHBondContact O-N 3.41Å; D110-W112 PolarHBondContact OD1-N 2.96Å; D110-W112 VanDerWaalsContact OD1-N 3.09Å
113	N	78.5	Confident	74.3	Confident	50 Å²	50	55.9 Å²	55.9	27%	0.267	31%	0.311	S	S	.	.	S	Bend	trans	-136.2	153.8	-177	-73.6	112	0	0	0	112.8	Q85 V107 T108 R138 L144	Q85-N113 VanDerWaalsContact OE1-CA 3.32Å; V107-N113 CarbonylContact C-O 3.58Å; V107-N113 WeakPolarHBondContact CA-O 3.31Å; V107-N113 WeakPolarHBondContact CG1-O 3.35Å; T108-N113 HydrophobicContact CG2-CB 3.93Å; T108-N113 PolarHBondContact N-O 3.3Å; T108-N113 PolarHBondContact OG1-N 3.15Å; T108-N113 PolarHBondContact OG1-O 3.16Å; T108-N113 VanDerWaalsContact OG1-O 3.11Å; N113-R138 PolarHBondContact OD1-NH2 3.42Å; N113-L144 HydrophobicContact CB-CD1 3.93Å; N113-L144 HydrophobicContact CB-CD2 3.78Å
114	C	81.8	Confident	74.1	Confident	4 Å²	4	55.8 Å²	55.8	3%	0.027	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	135.8	174.6	-53	0	0	0	0	110.4	Q85 C100 M104 G106 L144	Q85-C114 PolarHBondContact OE1-SG 2.86Å; C100-C114 WeakPolarHBondContact CA-SG 3.24Å; C100-C114 HydrophobicContact CB-CB 3.56Å; C100-C114 WeakPolarHBondContact CB-SG 3.31Å; C100-C114 WeakPolarHBondContact SG-CB 3.45Å; C100-C114 CovalentContact SG-SG 2.02Å; C100-C114 PolarHBondContact SG-SG 2.89Å; M104-C114 HydrophobicContact CB-CB 4.04Å; M104-C114 HydrophobicContact SD-CB 4.11Å; M104-C114 VanDerWaalsContact SD-O 3.37Å; G106-C114 CarbonylContact O-C 3.56Å; G106-C114 WeakPolarHBondContact O-CA 3.25Å; C114-L144 WeakPolarHBondContact O-CD2 3.3Å
115	I	83.4	Confident	73.8	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	156.5	-176.3	-168	161.1	0	0	0	111.6	G106 T108 E137 L144 L145 A148	G106-I115 CarbonylContact C-O 3.58Å; G106-I115 WeakPolarHBondContact CA-O 3.4Å; G106-I115 PolarHBondContact N-O 3.05Å; G106-I115 PolarHBondContact O-N 3.29Å; G106-I115 VanDerWaalsContact O-O 3.09Å; T108-I115 HydrophobicContact CG2-CB 4.22Å; T108-I115 HydrophobicContact CG2-CG2 4Å; I115-E137 HydrophobicContact CD1-CB 3.65Å; I115-E137 HydrophobicContact CD1-CG 4.12Å; I115-E137 WeakPolarHBondContact CD1-O 3.26Å; I115-L144 HydrophobicContact CD1-CD1 4.18Å; I115-L145 HydrophobicContact CD1-CB 4.45Å; I115-A148 HydrophobicContact CD1-CB 3.86Å; I115-A148 HydrophobicContact CG1-CB 4.38Å
116	S	80.7	Confident	74.3	Confident	32 Å²	32	48.7 Å²	48.7	22%	0.224	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-85.6	129.7	170.9	-43.6	0	0	0	0	109.9	S146 Q147 A148	S116-S146 WeakPolarHBondContact CB-O 3.44Å; S116-S146 PolarHBondContact OG-O 2.76Å; S116-Q147 CarbonylContact O-C 3.52Å; S116-Q147 VanDerWaalsContact O-CA 3.25Å; S116-Q147 WeakPolarHBondContact O-CA 3.49Å; S116-Q147 WeakPolarHBondContact O-CG 3.38Å; S116-A148 PolarHBondContact O-N 2.92Å
117	C	76.9	Confident	74.3	Confident	24 Å²	24	48.9 Å²	48.9	16%	0.162	28%	0.278	C	S	.	.			trans	-89.3	144.6	-180	-56.6	0	0	0	0	112.3	L121 C127	C117-L121 HydrophobicContact CB-CD2 4.42Å; C117-L121 WeakPolarHBondContact SG-CD2 3.45Å; C117-C127 WeakPolarHBondContact CA-SG 3.33Å; C117-C127 HydrophobicContact CB-CB 3.66Å; C117-C127 WeakPolarHBondContact CB-SG 3.19Å; C117-C127 WeakPolarHBondContact SG-CA 3.06Å; C117-C127 WeakPolarHBondContact SG-CB 3.39Å; C117-C127 CovalentContact SG-SG 2.02Å; C117-C127 PolarHBondContact SG-SG 3.35Å
118	P	71.1	Confident	73.9	Confident	52 Å²	52	53.7 Å²	53.7	34%	0.338	30%	0.3	S	S	.	.	S	Bend	trans	-77.1	-23.5	176.2	30	-35.4	0	0	0	113.5	A148	P118-A148 WeakPolarHBondContact CD-O 3.25Å; P118-A148 VanDerWaalsContact CG-O 3.22Å; P118-A148 WeakPolarHBondContact CG-O 3.26Å
119	S	69.3	Low	73.5	Confident	67 Å²	67	54.9 Å²	54.9	47%	0.469	31%	0.308	S	S	.	.	S	Bend	trans	-132.7	-164.7	178.5	-56.2	0	0	0	0	110.9
120	D	69.9	Low	73.1	Confident	135 Å²	135	54 Å²	54	72%	0.722	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-58	155	176.9	-70	-38.5	0	0	0	113.4	Q128	D120-Q128 PolarHBondContact O-N 3.39Å
121	L	73.5	Confident	72.5	Confident	71 Å²	71	56.4 Å²	56.4	37%	0.372	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-87.4	145.1	174.9	-71.1	159.1	0	0	0	110.3	K105 C117 K126	K105-L121 HydrophobicContact CB-CD1 3.9Å; K105-L121 WeakPolarHBondContact O-CD1 3.47Å; C117-L121 HydrophobicContact CB-CD2 4.42Å; C117-L121 WeakPolarHBondContact SG-CD2 3.45Å; L121-K126 CarbonylContact C-O 3.57Å; L121-K126 WeakPolarHBondContact CA-O 3.17Å
122	T	71.6	Confident	71.6	Confident	41 Å²	41	59.3 Å²	59.3	25%	0.252	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-67.1	163	165.1	67.8	0	0	0	0	110.6	E124 G125 K126 Q128	T122-E124 PolarHBondContact O-N 3.05Å; T122-E124 PolarHBondContact OG1-N 3.41Å; T122-G125 PolarHBondContact O-N 3.24Å; T122-K126 PolarHBondContact N-O 3.31Å; T122-K126 WeakPolarHBondContact OG1-CB 3.45Å; T122-K126 PolarHBondContact OG1-N 2.89Å; T122-K126 VanDerWaalsContact OG1-N 3.12Å; T122-K126 PolarHBondContact OG1-O 3.39Å; T122-Q128 HydrophobicContact CG2-CB 4.38Å
123	A	65.5	Low	71	Confident	102 Å²	102	59.9 Å²	59.9	84%	0.843	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-13.6	174.9	0	0	0	0	0	113.8
124	E	66.8	Low	70.1	Confident	120 Å²	120	59.1 Å²	59.1	56%	0.561	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-4	177.1	-66.3	160.9	-169.4	0	0	112.7	T122	T122-E124 PolarHBondContact O-N 3.05Å; T122-E124 PolarHBondContact OG1-N 3.41Å
125	G	70.8	Confident	69.6	Low	8 Å²	8	60.7 Å²	60.7	8%	0.082	38%	0.378	C	S	.	.	S	Bend	trans	83.2	22.9	-179.5	0	0	0	0	0	114.5	G106 V107 T122	G106-G125 WeakPolarHBondContact CA-O 3.44Å; V107-G125 PolarHBondContact N-O 3.16Å; T122-G125 PolarHBondContact O-N 3.24Å
126	K	79.1	Confident	68.8	Low	49 Å²	49	62.3 Å²	62.3	21%	0.213	39%	0.388	C	S	.	.	B	Isolated β-bridge	trans	-100.6	156.4	176.9	-61.8	178.6	160.8	-163.3	0	111.8	E109 L121 T122	E109-K126 WeakPolarHBondContact O-CE 3.27Å; E109-K126 PolarHBondContact O-NZ 3.06Å; E109-K126 IonicContact OE2-NZ 2.71Å; E109-K126 PolarHBondContact OE2-NZ 2.99Å; L121-K126 CarbonylContact C-O 3.57Å; L121-K126 WeakPolarHBondContact CA-O 3.17Å; T122-K126 PolarHBondContact N-O 3.31Å; T122-K126 WeakPolarHBondContact OG1-CB 3.45Å; T122-K126 PolarHBondContact OG1-N 2.89Å; T122-K126 VanDerWaalsContact OG1-N 3.12Å; T122-K126 PolarHBondContact OG1-O 3.39Å
127	C	76.3	Confident	68.4	Low	4 Å²	4	61.8 Å²	61.8	3%	0.027	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-75.5	143.8	178.7	-57.1	0	0	0	0	112.4	C117 L135	C117-C127 WeakPolarHBondContact CA-SG 3.33Å; C117-C127 HydrophobicContact CB-CB 3.66Å; C117-C127 WeakPolarHBondContact CB-SG 3.19Å; C117-C127 WeakPolarHBondContact SG-CA 3.06Å; C117-C127 WeakPolarHBondContact SG-CB 3.39Å; C117-C127 CovalentContact SG-SG 2.02Å; C117-C127 PolarHBondContact SG-SG 3.35Å; C127-L135 HydrophobicContact CB-CD1 3.7Å; C127-L135 HydrophobicContact CB-CD2 3.85Å; C127-L135 HydrophobicContact CB-CG 4.42Å; C127-L135 WeakPolarHBondContact O-CD2 3.27Å
128	Q	71.7	Confident	68.1	Low	110 Å²	110	64.5 Å²	64.5	51%	0.514	39%	0.389	S	S	.	.			trans	-116.4	138.9	177.2	-168	172.3	1.8	0	0	112	D120 T122	D120-Q128 PolarHBondContact O-N 3.39Å; T122-Q128 HydrophobicContact CG2-CB 4.38Å
129	C	68.3	Low	67.9	Low	26 Å²	26	64.9 Å²	64.9	18%	0.176	39%	0.388	C	S	.	.			trans	-110.5	156.4	172.9	-75.6	0	0	0	0	111.6	L135 C150	C129-L135 VanDerWaalsContact SG-CA 3.52Å; C129-L135 WeakPolarHBondContact SG-CD1 3.49Å; C129-C150 HydrophobicContact CB-CB 3.87Å; C129-C150 WeakPolarHBondContact CB-SG 3.47Å; C129-C150 WeakPolarHBondContact SG-CB 3.34Å; C129-C150 CovalentContact SG-SG 2.03Å; C129-C150 PolarHBondContact SG-SG 3.02Å
130	P	63.5	Low	67.1	Low	79 Å²	79	69.3 Å²	69.3	51%	0.513	41%	0.405	S	S	.	.			trans	-62.9	157.1	172.8	-17.5	30.3	0	0	0	112.8	G132 H133	P130-G132 PolarHBondContact O-N 3.24Å; P130-H133 PolarHBondContact O-N 3.41Å
131	A	55.3	Low	66.3	Low	107 Å²	107	69.3 Å²	69.3	88%	0.884	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	133.3	179.5	0	0	0	0	0	112.3
132	G	55	Low	65	Low	72 Å²	72	67.9 Å²	67.9	74%	0.742	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	0.6	179.7	0	0	0	0	0	115.7	P130	P130-G132 PolarHBondContact O-N 3.24Å
133	H	61.5	Low	64.8	Low	105 Å²	105	69.8 Å²	69.8	49%	0.486	42%	0.419	S	S	.	.			trans	-119.7	146.9	174.2	-61	63.9	0	0	0	110.7	P130 C150	P130-H133 PolarHBondContact O-N 3.41Å; H133-C150 HydrophobicContact CB-CB 3.63Å
134	I	60.8	Low	65.1	Low	33 Å²	33	67.6 Å²	67.6	17%	0.169	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.4	-172.1	-52.5	-178.9	0	0	0	109.3	V136 C150 E151 C153 C170	I134-V136 PolarHBondContact O-N 2.94Å; I134-C150 CarbonylContact O-C 3.54Å; I134-C150 WeakPolarHBondContact O-CA 3.28Å; I134-E151 WeakPolarHBondContact CA-O 3.32Å; I134-E151 WeakPolarHBondContact CB-O 3.2Å; I134-E151 VanDerWaalsContact CG1-O 3.3Å; I134-E151 WeakPolarHBondContact CG1-O 3.33Å; I134-E151 PolarHBondContact N-O 3.19Å; I134-E151 PolarHBondContact O-N 3.36Å; I134-C153 HydrophobicContact CD1-CB 4.06Å; I134-C153 WeakPolarHBondContact CD1-SG 3.42Å; I134-C170 HydrophobicContact CG2-CB 4.1Å
135	L	70.1	Confident	65.5	Low	37 Å²	37	63.9 Å²	63.9	19%	0.194	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	122.9	177.3	-174.3	74.3	0	0	0	111.5	E109 C127 C129 E137 A148 T149	E109-L135 HydrophobicContact CG-CD2 3.89Å; C127-L135 HydrophobicContact CB-CD1 3.7Å; C127-L135 HydrophobicContact CB-CD2 3.85Å; C127-L135 HydrophobicContact CB-CG 4.42Å; C127-L135 WeakPolarHBondContact O-CD2 3.27Å; C129-L135 VanDerWaalsContact SG-CA 3.52Å; C129-L135 WeakPolarHBondContact SG-CD1 3.49Å; L135-E137 HydrophobicContact CD2-CG 4.04Å; L135-E137 VanDerWaalsContact CD2-OE1 3.32Å; L135-E137 WeakPolarHBondContact CD2-OE1 3.36Å; L135-E137 HydrophobicContact CG-CG 3.92Å; L135-A148 HydrophobicContact CD1-CB 3.65Å; L135-A148 HydrophobicContact CG-CB 4.42Å; L135-T149 CarbonylContact C-O 3.6Å
136	V	68.2	Low	65.5	Low	34 Å²	34	68 Å²	68	21%	0.206	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	116.3	177.1	174.6	0	0	0	0	108.6	I134 R138 L145 A148 T149 E151	I134-V136 PolarHBondContact O-N 2.94Å; V136-R138 WeakPolarHBondContact CG1-O 3.5Å; V136-L145 HydrophobicContact CG1-CD1 4.16Å; V136-A148 CarbonylContact O-C 3.58Å; V136-A148 VanDerWaalsContact O-CA 3.27Å; V136-A148 WeakPolarHBondContact O-CA 3.23Å; V136-T149 WeakPolarHBondContact CB-OG1 3.21Å; V136-T149 PolarHBondContact N-O 3.47Å; V136-T149 PolarHBondContact O-N 3.4Å; V136-E151 HydrophobicContact CB-CG 4.22Å; V136-E151 HydrophobicContact CG2-CB 3.61Å; V136-E151 HydrophobicContact CG2-CG 3.68Å
137	E	71.9	Confident	65.4	Low	22 Å²	22	70.7 Å²	70.7	10%	0.103	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-8.6	-172.9	-60	-178.8	136.8	0	0	112.6	T108 E109 I115 L135 L144 L145 A148	T108-E137 WeakPolarHBondContact CA-OE1 3.11Å; T108-E137 VanDerWaalsContact CA-OE2 3.29Å; T108-E137 WeakPolarHBondContact CA-OE2 3.45Å; T108-E137 WeakPolarHBondContact CB-OE2 3.3Å; T108-E137 HydrophobicContact CG2-CB 4.12Å; T108-E137 HydrophobicContact CG2-CG 4.49Å; T108-E137 WeakPolarHBondContact CG2-OE2 3.18Å; E109-E137 PolarHBondContact N-OE1 2.77Å; E109-E137 PolarHBondContact N-OE2 2.91Å; I115-E137 HydrophobicContact CD1-CB 3.65Å; I115-E137 HydrophobicContact CD1-CG 4.12Å; I115-E137 WeakPolarHBondContact CD1-O 3.26Å; L135-E137 HydrophobicContact CD2-CG 4.04Å; L135-E137 VanDerWaalsContact CD2-OE1 3.32Å; L135-E137 WeakPolarHBondContact CD2-OE1 3.36Å; L135-E137 HydrophobicContact CG-CG 3.92Å; E137-L144 WeakPolarHBondContact O-CD1 3.48Å; E137-L145 PolarHBondContact O-N 2.89Å; E137-A148 HydrophobicContact CG-CB 4.08Å
138	R	71.2	Confident	65.5	Low	80 Å²	80	70.6 Å²	70.6	30%	0.302	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	147.7	-175.3	-59	-176	-177.4	-91.7	-1.1	110.1	D110 N113 V136 T143 L144	D110-R138 IonicContact OD2-NH2 3.2Å; N113-R138 PolarHBondContact OD1-NH2 3.42Å; V136-R138 WeakPolarHBondContact CG1-O 3.5Å; R138-T143 CarbonylContact C-O 3.55Å; R138-T143 VanDerWaalsContact CA-O 3.3Å; R138-T143 WeakPolarHBondContact CA-O 3.22Å; R138-L144 HydrophobicContact CG-CD1 4.19Å
139	D	66.4	Low	65.7	Low	60 Å²	60	68.1 Å²	68.1	32%	0.321	41%	0.41	S	S	.	.			trans	-76.3	175.1	172.8	70.3	21.6	0	0	0	112	N141 G142 T143 L145	D139-N141 PolarHBondContact O-N 3.05Å; D139-N141 VanDerWaalsContact O-N 3.14Å; D139-N141 WeakPolarHBondContact OD1-CA 3.31Å; D139-N141 WeakPolarHBondContact OD1-CB 3.48Å; D139-N141 PolarHBondContact OD1-N 2.85Å; D139-G142 WeakPolarHBondContact O-CA 3.39Å; D139-G142 PolarHBondContact O-N 3.42Å; D139-G142 PolarHBondContact OD1-N 2.9Å; D139-G142 VanDerWaalsContact OD1-N 3.11Å; D139-T143 PolarHBondContact N-O 2.88Å; D139-T143 WeakPolarHBondContact OD1-CB 3.3Å; D139-T143 PolarHBondContact OD1-N 3.04Å; D139-T143 PolarHBondContact OD1-OG1 3.36Å; D139-T143 VanDerWaalsContact OD2-CB 3.23Å; D139-T143 WeakPolarHBondContact OD2-CB 3.28Å; D139-T143 PolarHBondContact OD2-OG1 2.98Å; D139-L145 HydrophobicContact CB-CD2 3.95Å
140	I	52.8	Low	65.8	Low	160 Å²	160	68.7 Å²	68.7	82%	0.821	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-17.4	178.4	55.7	167.1	0	0	0	114.6	G142	I140-G142 VanDerWaalsContact C-N 3.33Å
141	N	52.4	Low	66	Low	135 Å²	135	69.9 Å²	69.9	72%	0.722	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	3.7	175.3	-64.3	-40.5	0	0	0	111.8	D139 T143	D139-N141 PolarHBondContact O-N 3.05Å; D139-N141 VanDerWaalsContact O-N 3.14Å; D139-N141 WeakPolarHBondContact OD1-CA 3.31Å; D139-N141 WeakPolarHBondContact OD1-CB 3.48Å; D139-N141 PolarHBondContact OD1-N 2.85Å; N141-T143 PolarHBondContact O-N 3.03Å
142	G	46.8	Very low	66.3	Low	42 Å²	42	71.9 Å²	71.9	43%	0.433	41%	0.408	S	S	.	.	S	Bend	trans	76.9	4.3	-176.8	0	0	0	0	0	113.8	D139 I140 L144	D139-G142 WeakPolarHBondContact O-CA 3.39Å; D139-G142 PolarHBondContact O-N 3.42Å; D139-G142 PolarHBondContact OD1-N 2.9Å; D139-G142 VanDerWaalsContact OD1-N 3.11Å; I140-G142 VanDerWaalsContact C-N 3.33Å; G142-L144 PolarHBondContact O-N 2.94Å
143	T	65.8	Low	66.4	Low	80 Å²	80	71 Å²	71	49%	0.491	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-70.6	129.5	176.7	-10.4	0	0	0	0	108.7	R138 D139 N141 L145	R138-T143 CarbonylContact C-O 3.55Å; R138-T143 VanDerWaalsContact CA-O 3.3Å; R138-T143 WeakPolarHBondContact CA-O 3.22Å; D139-T143 PolarHBondContact N-O 2.88Å; D139-T143 WeakPolarHBondContact OD1-CB 3.3Å; D139-T143 PolarHBondContact OD1-N 3.04Å; D139-T143 PolarHBondContact OD1-OG1 3.36Å; D139-T143 VanDerWaalsContact OD2-CB 3.23Å; D139-T143 WeakPolarHBondContact OD2-CB 3.28Å; D139-T143 PolarHBondContact OD2-OG1 2.98Å; N141-T143 PolarHBondContact O-N 3.03Å; T143-L145 PolarHBondContact O-N 2.61Å
144	L	71.9	Confident	66.4	Low	57 Å²	57	71.8 Å²	71.8	30%	0.298	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	127.1	177.6	-173	73.8	0	0	0	109.6	T108 N113 C114 I115 E137 R138 G142	T108-L144 HydrophobicContact CG2-CD1 3.74Å; N113-L144 HydrophobicContact CB-CD1 3.93Å; N113-L144 HydrophobicContact CB-CD2 3.78Å; C114-L144 WeakPolarHBondContact O-CD2 3.3Å; I115-L144 HydrophobicContact CD1-CD1 4.18Å; E137-L144 WeakPolarHBondContact O-CD1 3.48Å; R138-L144 HydrophobicContact CG-CD1 4.19Å; G142-L144 PolarHBondContact O-N 2.94Å
145	L	76.1	Confident	66.1	Low	42 Å²	42	73.1 Å²	73.1	22%	0.22	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	145.5	175.5	-65.7	171.5	0	0	0	109.2	I115 V136 E137 D139 T143 Q147 T149	I115-L145 HydrophobicContact CD1-CB 4.45Å; V136-L145 HydrophobicContact CG1-CD1 4.16Å; E137-L145 PolarHBondContact O-N 2.89Å; D139-L145 HydrophobicContact CB-CD2 3.95Å; T143-L145 PolarHBondContact O-N 2.61Å; L145-Q147 VanDerWaalsContact CB-O 3.29Å; L145-Q147 WeakPolarHBondContact CB-O 3.35Å; L145-Q147 PolarHBondContact O-N 3.2Å; L145-T149 HydrophobicContact CD1-CG2 4.48Å
146	S	71.4	Confident	65.3	Low	95 Å²	95	77.1 Å²	77.1	66%	0.664	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.1	-25.4	172.8	51.6	0	0	0	0	112.1	S116	S116-S146 WeakPolarHBondContact CB-O 3.44Å; S116-S146 PolarHBondContact OG-O 2.76Å
147	Q	77.1	Confident	64.5	Low	104 Å²	104	82.8 Å²	82.8	49%	0.486	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	136.3	175.4	-174.1	176	23.6	0	0	110.1	S116 L145	S116-Q147 CarbonylContact O-C 3.52Å; S116-Q147 VanDerWaalsContact O-CA 3.25Å; S116-Q147 WeakPolarHBondContact O-CA 3.49Å; S116-Q147 WeakPolarHBondContact O-CG 3.38Å; L145-Q147 VanDerWaalsContact CB-O 3.29Å; L145-Q147 WeakPolarHBondContact CB-O 3.35Å; L145-Q147 PolarHBondContact O-N 3.2Å
148	A	77	Confident	63.6	Low	3 Å²	3	88.4 Å²	88.4	3%	0.025	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	143.2	178.7	0	0	0	0	0	112	I115 S116 P118 L135 V136 E137	I115-A148 HydrophobicContact CD1-CB 3.86Å; I115-A148 HydrophobicContact CG1-CB 4.38Å; S116-A148 PolarHBondContact O-N 2.92Å; P118-A148 WeakPolarHBondContact CD-O 3.25Å; P118-A148 VanDerWaalsContact CG-O 3.22Å; P118-A148 WeakPolarHBondContact CG-O 3.26Å; L135-A148 HydrophobicContact CD1-CB 3.65Å; L135-A148 HydrophobicContact CG-CB 4.42Å; V136-A148 CarbonylContact O-C 3.58Å; V136-A148 VanDerWaalsContact O-CA 3.27Å; V136-A148 WeakPolarHBondContact O-CA 3.23Å; E137-A148 HydrophobicContact CG-CB 4.08Å
149	T	75.2	Confident	62.8	Low	58 Å²	58	86.6 Å²	86.6	36%	0.356	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	169.9	175.8	54.4	0	0	0	0	110.4	L135 V136 L145 E151	L135-T149 CarbonylContact C-O 3.6Å; V136-T149 WeakPolarHBondContact CB-OG1 3.21Å; V136-T149 PolarHBondContact N-O 3.47Å; V136-T149 PolarHBondContact O-N 3.4Å; L145-T149 HydrophobicContact CD1-CG2 4.48Å; T149-E151 PolarHBondContact OG1-OE1 3.05Å
150	C	71.3	Confident	62.5	Low	38 Å²	38	86.6 Å²	86.6	26%	0.257	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	114	177.4	-50	0	0	0	0	110.2	C129 H133 I134	C129-C150 HydrophobicContact CB-CB 3.87Å; C129-C150 WeakPolarHBondContact CB-SG 3.47Å; C129-C150 WeakPolarHBondContact SG-CB 3.34Å; C129-C150 CovalentContact SG-SG 2.03Å; C129-C150 PolarHBondContact SG-SG 3.02Å; H133-C150 HydrophobicContact CB-CB 3.63Å; I134-C150 CarbonylContact O-C 3.54Å; I134-C150 WeakPolarHBondContact O-CA 3.28Å
151	E	67.4	Low	62.8	Low	103 Å²	103	82.3 Å²	82.3	48%	0.481	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	-168.3	-170	-51.3	-174.2	179.4	0	0	113.5	I134 V136 T149	I134-E151 WeakPolarHBondContact CA-O 3.32Å; I134-E151 WeakPolarHBondContact CB-O 3.2Å; I134-E151 VanDerWaalsContact CG1-O 3.3Å; I134-E151 WeakPolarHBondContact CG1-O 3.33Å; I134-E151 PolarHBondContact N-O 3.19Å; I134-E151 PolarHBondContact O-N 3.36Å; V136-E151 HydrophobicContact CB-CG 4.22Å; V136-E151 HydrophobicContact CG2-CB 3.61Å; V136-E151 HydrophobicContact CG2-CG 3.68Å; T149-E151 PolarHBondContact OG1-OE1 3.05Å
152	L	62.1	Low	63.3	Low	150 Å²	150	79.5 Å²	79.5	79%	0.785	46%	0.458	S	S	*	.			trans	-118.6	147.7	-179.3	-92.8	120.6	0	0	0	111.7
153	C	58	Low	63.9	Low	53 Å²	53	79.9 Å²	79.9	36%	0.358	46%	0.456	S	S	.	.			trans	-70.6	127.4	-173.5	-73.7	0	0	0	0	115.8	I134 C170	I134-C153 HydrophobicContact CD1-CB 4.06Å; I134-C153 WeakPolarHBondContact CD1-SG 3.42Å; C153-C170 WeakPolarHBondContact CA-SG 3.47Å; C153-C170 HydrophobicContact CB-CB 4.43Å; C153-C170 WeakPolarHBondContact CB-SG 3.43Å; C153-C170 WeakPolarHBondContact SG-CA 3.1Å; C153-C170 WeakPolarHBondContact SG-CB 3.35Å; C153-C170 PolarHBondContact SG-N 2.73Å; C153-C170 CovalentContact SG-SG 1.99Å; C153-C170 PolarHBondContact SG-SG 3.23Å
154	D	60.4	Low	63.7	Low	121 Å²	121	76.9 Å²	76.9	65%	0.647	44%	0.437	S	S	*	.			trans	-124.4	137.1	168.3	-168.5	10.7	0	0	0	111.4	S159	D154-S159 PolarHBondContact O-OG 3Å
155	G	53.5	Low	63	Low	62 Å²	62	79.5 Å²	79.5	64%	0.639	47%	0.468	S	S	*	.			trans	-106.4	24.4	-157.8	0	0	0	0	0	117.3
156	N	54.6	Low	61.8	Low	120 Å²	120	84.3 Å²	84.3	64%	0.642	49%	0.493	S	S	*	.	S	Bend	trans	-88.1	166.5	-177	-83.5	-25.5	0	0	0	114.6	N158 S159	N156-N158 PolarHBondContact O-N 3.05Å; N156-S159 PolarHBondContact O-N 3.32Å; N156-S159 PolarHBondContact O-OG 3.3Å
157	E	52	Low	61	Low	153 Å²	153	82.5 Å²	82.5	72%	0.715	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.9	-25.3	-167	-70	-173	153.1	0	0	116.8
158	N	52.1	Low	59.7	Low	141 Å²	141	82.6 Å²	82.6	75%	0.754	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-11.7	-177.5	-64.9	-17.2	0	0	0	114.4	N156	N156-N158 PolarHBondContact O-N 3.05Å
159	S	55	Low	58.6	Low	42 Å²	42	89.7 Å²	89.7	29%	0.294	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-31.2	-172.3	66.4	0	0	0	0	113.7	D154 N156 M161	D154-S159 PolarHBondContact O-OG 3Å; N156-S159 PolarHBondContact O-N 3.32Å; N156-S159 PolarHBondContact O-OG 3.3Å; S159-M161 WeakPolarHBondContact O-CG 3.11Å; S159-M161 PolarHBondContact O-N 3.22Å
160	F	58.9	Low	58	Low	59 Å²	59	88.6 Å²	88.6	26%	0.259	51%	0.514	S	S	.	.			trans	52.4	18	-171.8	-51.6	-81.5	0	0	0	115.2	R172 C173 V178 K182 C184	F160-R172 WeakPolarHBondContact O-CA 3.48Å; F160-C173 PolarHBondContact O-N 3.17Å; F160-C173 PolarHBondContact O-SG 3.23Å; F160-V178 HydrophobicContact CD1-CG1 4.17Å; F160-V178 HydrophobicContact CD1-CG2 4.1Å; F160-V178 HydrophobicContact CE1-CG1 4.23Å; F160-K182 HydrophobicContact CE1-CB 4.49Å; F160-K182 WeakPolarHBondContact CE1-O 3.39Å; F160-C184 WeakPolarHBondContact CA-SG 3.48Å
161	M	60.2	Low	57.6	Low	71 Å²	71	89 Å²	89	35%	0.35	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	140.9	-177.9	-61.7	-65.4	175	0	0	109.6	S159 C170 V171 R172	S159-M161 WeakPolarHBondContact O-CG 3.11Å; S159-M161 PolarHBondContact O-N 3.22Å; M161-C170 HydrophobicContact CB-CB 4.18Å; M161-V171 CarbonylContact C-O 3.49Å; M161-V171 WeakPolarHBondContact CA-O 3.39Å; M161-R172 HydrophobicContact CE-CB 4.18Å; M161-R172 HydrophobicContact CE-CG 4.33Å; M161-R172 WeakPolarHBondContact SD-CA 3.45Å; M161-R172 HydrophobicContact SD-CB 3.69Å; M161-R172 HydrophobicContact SD-CG 4.21Å; M161-R172 PolarHBondContact SD-N 3.08Å; M161-R172 VanDerWaalsContact SD-N 3.41Å
162	V	63.5	Low	57.4	Low	76 Å²	76	91 Å²	91	46%	0.461	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	148.2	174.3	67.6	0	0	0	0	108.8	N164 V171	V162-N164 PolarHBondContact O-N 3.48Å; V162-V171 HydrophobicContact CG1-CG2 3.94Å; V162-V171 PolarHBondContact N-O 2.69Å; V162-V171 VanDerWaalsContact O-CG2 3.24Å; V162-V171 WeakPolarHBondContact O-CG2 3.49Å; V162-V171 PolarHBondContact O-N 3.33Å; V162-V171 VanDerWaalsContact O-O 3.09Å
163	A	59	Low	57.6	Low	49 Å²	49	84.5 Å²	84.5	41%	0.405	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	140.5	172.2	0	0	0	0	0	110.3	R169	A163-R169 CarbonylContact C-O 3.56Å; A163-R169 WeakPolarHBondContact CA-O 3.41Å
164	N	60.8	Low	58.3	Low	17 Å²	17	85.4 Å²	85.4	9%	0.091	48%	0.484	C	S	.	.			trans	-66.2	172.2	171.5	74	-29.4	0	0	0	111.2	V162 L166 G167 D168 R169 V171	V162-N164 PolarHBondContact O-N 3.48Å; N164-L166 PolarHBondContact O-N 2.88Å; N164-G167 PolarHBondContact O-N 2.69Å; N164-G167 PolarHBondContact OD1-N 3.38Å; N164-D168 PolarHBondContact ND2-OD1 3.49Å; N164-D168 PolarHBondContact OD1-N 3.48Å; N164-D168 PolarHBondContact OD1-OD1 3.45Å; N164-R169 HydrophobicContact CB-CG 3.63Å; N164-R169 PolarHBondContact N-O 2.83Å; N164-R169 VanDerWaalsContact ND2-CG 3.26Å; N164-R169 WeakPolarHBondContact ND2-CG 3.48Å; N164-R169 PolarHBondContact ND2-NE 2.99Å; N164-R169 VanDerWaalsContact ND2-NE 3.15Å; N164-R169 PolarHBondContact OD1-N 3.09Å; N164-R169 PolarHBondContact OD1-O 3.31Å; N164-V171 HydrophobicContact CB-CG1 3.91Å; N164-V171 HydrophobicContact CB-CG2 4.14Å
165	A	57.6	Low	58.7	Low	113 Å²	113	83.9 Å²	83.9	93%	0.934	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-18.7	-178.8	0	0	0	0	0	115.3
166	L	50.7	Low	59.6	Low	142 Å²	142	81.1 Å²	81.1	74%	0.743	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-5.2	178.3	-64.3	169.1	0	0	0	113.2	N164 D168	N164-L166 PolarHBondContact O-N 2.88Å; L166-D168 PolarHBondContact O-N 2.9Å
167	G	54.6	Low	60.4	Low	58 Å²	58	76.6 Å²	76.6	60%	0.598	43%	0.426	S	S	*	.	S	Bend	trans	70.3	11	179.7	0	0	0	0	0	115	N164	N164-G167 PolarHBondContact O-N 2.69Å; N164-G167 PolarHBondContact OD1-N 3.38Å
168	D	49.7	Very low	61.2	Low	106 Å²	106	70.7 Å²	70.7	57%	0.567	40%	0.401	S	S	*	.	S	Bend	trans	-104.7	-6.9	-171.2	64.2	-7.1	0	0	0	113.7	N164 L166	N164-D168 PolarHBondContact ND2-OD1 3.49Å; N164-D168 PolarHBondContact OD1-N 3.48Å; N164-D168 PolarHBondContact OD1-OD1 3.45Å; L166-D168 PolarHBondContact O-N 2.9Å
169	R	54	Low	61.9	Low	151 Å²	151	69.7 Å²	69.7	57%	0.57	40%	0.395	S	S	*	.	S	Bend	trans	-146.9	144.6	174.4	56.2	174.7	-169.6	-158.9	-0.7	112.2	A163 N164 V171	A163-R169 CarbonylContact C-O 3.56Å; A163-R169 WeakPolarHBondContact CA-O 3.41Å; N164-R169 HydrophobicContact CB-CG 3.63Å; N164-R169 PolarHBondContact N-O 2.83Å; N164-R169 VanDerWaalsContact ND2-CG 3.26Å; N164-R169 WeakPolarHBondContact ND2-CG 3.48Å; N164-R169 PolarHBondContact ND2-NE 2.99Å; N164-R169 VanDerWaalsContact ND2-NE 3.15Å; N164-R169 PolarHBondContact OD1-N 3.09Å; N164-R169 PolarHBondContact OD1-O 3.31Å; R169-V171 HydrophobicContact CG-CG1 4.03Å
170	C	62.5	Low	62.6	Low	36 Å²	36	69.2 Å²	69.2	24%	0.243	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	125.2	162.5	-93.7	0	0	0	0	109.2	I134 C153 M161	I134-C170 HydrophobicContact CG2-CB 4.1Å; C153-C170 WeakPolarHBondContact CA-SG 3.47Å; C153-C170 HydrophobicContact CB-CB 4.43Å; C153-C170 WeakPolarHBondContact CB-SG 3.43Å; C153-C170 WeakPolarHBondContact SG-CA 3.1Å; C153-C170 WeakPolarHBondContact SG-CB 3.35Å; C153-C170 PolarHBondContact SG-N 2.73Å; C153-C170 CovalentContact SG-SG 1.99Å; C153-C170 PolarHBondContact SG-SG 3.23Å; M161-C170 HydrophobicContact CB-CB 4.18Å
171	V	63	Low	63.1	Low	46 Å²	46	67.8 Å²	67.8	28%	0.279	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	139	173	-66.2	0	0	0	0	109.8	M161 V162 N164 R169	M161-V171 CarbonylContact C-O 3.49Å; M161-V171 WeakPolarHBondContact CA-O 3.39Å; V162-V171 HydrophobicContact CG1-CG2 3.94Å; V162-V171 PolarHBondContact N-O 2.69Å; V162-V171 VanDerWaalsContact O-CG2 3.24Å; V162-V171 WeakPolarHBondContact O-CG2 3.49Å; V162-V171 PolarHBondContact O-N 3.33Å; V162-V171 VanDerWaalsContact O-O 3.09Å; N164-V171 HydrophobicContact CB-CG1 3.91Å; N164-V171 HydrophobicContact CB-CG2 4.14Å; R169-V171 HydrophobicContact CG-CG1 4.03Å
172	R	63.6	Low	63.5	Low	144 Å²	144	72.3 Å²	72.3	54%	0.543	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	138.2	176	-167.2	178.1	178.4	135.9	2.2	110.2	F160 M161	F160-R172 WeakPolarHBondContact O-CA 3.48Å; M161-R172 HydrophobicContact CE-CB 4.18Å; M161-R172 HydrophobicContact CE-CG 4.33Å; M161-R172 WeakPolarHBondContact SD-CA 3.45Å; M161-R172 HydrophobicContact SD-CB 3.69Å; M161-R172 HydrophobicContact SD-CG 4.21Å; M161-R172 PolarHBondContact SD-N 3.08Å; M161-R172 VanDerWaalsContact SD-N 3.41Å
173	C	66.9	Low	63.8	Low	14 Å²	14	69.3 Å²	69.3	10%	0.095	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-62.5	149.1	173.3	-61.4	0	0	0	0	110.7	F160 C184	F160-C173 PolarHBondContact O-N 3.17Å; F160-C173 PolarHBondContact O-SG 3.23Å; C173-C184 HydrophobicContact CB-CB 3.83Å; C173-C184 WeakPolarHBondContact CB-SG 3.5Å; C173-C184 WeakPolarHBondContact SG-CB 3.24Å; C173-C184 CovalentContact SG-SG 2Å; C173-C184 PolarHBondContact SG-SG 3.41Å
174	E	71.4	Confident	64.2	Low	72 Å²	72	69.2 Å²	69.2	34%	0.336	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-59	137.8	-171.2	-164.9	-72.2	152	0	0	110.4	T176 F177 L196	E174-T176 PolarHBondContact O-N 3.01Å; E174-T176 WeakPolarHBondContact OE2-CA 3.41Å; E174-T176 WeakPolarHBondContact OE2-CB 3.49Å; E174-T176 VanDerWaalsContact OE2-CG2 3.26Å; E174-T176 WeakPolarHBondContact OE2-CG2 3.39Å; E174-T176 PolarHBondContact OE2-N 2.91Å; E174-T176 PolarHBondContact OE2-OG1 3.25Å; E174-F177 HydrophobicContact CB-CD2 3.98Å; E174-F177 HydrophobicContact CB-CE2 4.25Å; E174-F177 WeakPolarHBondContact O-CB 3.5Å; E174-F177 PolarHBondContact O-N 3.26Å; E174-L196 HydrophobicContact CG-CD2 3.74Å; E174-L196 WeakPolarHBondContact OE1-CD2 3.23Å; E174-L196 WeakPolarHBondContact OE2-CD2 3.28Å
175	P	70.1	Confident	64.8	Low	90 Å²	90	70.8 Å²	70.8	58%	0.584	40%	0.399	S	S	*	.	H	α-helix	trans	-49.9	-31.7	-172.6	-32.6	35	0	0	0	116	F177 V178 N179	P175-F177 VanDerWaalsContact C-N 3.33Å; P175-F177 PolarHBondContact O-N 3.2Å; P175-V178 PolarHBondContact O-N 3.29Å; P175-N179 VanDerWaalsContact O-CB 3.24Å; P175-N179 WeakPolarHBondContact O-CB 3.46Å; P175-N179 PolarHBondContact O-N 3.36Å
176	T	71.4	Confident	65.7	Low	4 Å²	4	66.7 Å²	66.7	3%	0.025	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-31.3	178.1	70.7	0	0	0	0	112.9	E174 T180 L196 C197 Y240	E174-T176 PolarHBondContact O-N 3.01Å; E174-T176 WeakPolarHBondContact OE2-CA 3.41Å; E174-T176 WeakPolarHBondContact OE2-CB 3.49Å; E174-T176 VanDerWaalsContact OE2-CG2 3.26Å; E174-T176 WeakPolarHBondContact OE2-CG2 3.39Å; E174-T176 PolarHBondContact OE2-N 2.91Å; E174-T176 PolarHBondContact OE2-OG1 3.25Å; T176-T180 WeakPolarHBondContact O-CB 3.35Å; T176-T180 PolarHBondContact O-N 3.45Å; T176-T180 PolarHBondContact O-OG1 2.97Å; T176-L196 HydrophobicContact CG2-CB 4.48Å; T176-L196 HydrophobicContact CG2-CD2 4.15Å; T176-L196 WeakPolarHBondContact OG1-CA 3.17Å; T176-C197 CarbonylContact C-O 3.6Å; T176-C197 VanDerWaalsContact CB-O 3.27Å; T176-C197 WeakPolarHBondContact CB-O 3.5Å; T176-C197 PolarHBondContact OG1-N 3.3Å; T176-C197 PolarHBondContact OG1-O 2.87Å; T176-Y240 HydrophobicContact CG2-CD2 4.41Å; T176-Y240 HydrophobicContact CG2-CE2 3.58Å
177	F	70.8	Confident	66.9	Low	24 Å²	24	63.4 Å²	63.4	11%	0.105	35%	0.352	C	S	.	.	H	α-helix	trans	-69.6	-47.6	173	-70.1	-108.5	0	0	0	110.7	E174 P175 N179 T180 S181 K182 S183 C184 C186 L192 G195 C197	E174-F177 HydrophobicContact CB-CD2 3.98Å; E174-F177 HydrophobicContact CB-CE2 4.25Å; E174-F177 WeakPolarHBondContact O-CB 3.5Å; E174-F177 PolarHBondContact O-N 3.26Å; P175-F177 VanDerWaalsContact C-N 3.33Å; P175-F177 PolarHBondContact O-N 3.2Å; F177-N179 VanDerWaalsContact C-N 3.32Å; F177-N179 PolarHBondContact O-N 2.86Å; F177-T180 PolarHBondContact O-N 3.17Å; F177-S181 PolarHBondContact O-N 3.38Å; F177-S181 PolarHBondContact O-OG 2.84Å; F177-K182 PolarHBondContact O-N 3.48Å; F177-S183 CarbonylContact C-O 3.59Å; F177-S183 WeakPolarHBondContact CB-O 3.43Å; F177-C184 WeakPolarHBondContact CD1-O 3.04Å; F177-C186 HydrophobicContact CD1-CB 3.93Å; F177-C186 HydrophobicContact CE1-CB 3.68Å; F177-L192 HydrophobicContact CE1-CD1 3.72Å; F177-L192 HydrophobicContact CE2-CD1 4.31Å; F177-L192 HydrophobicContact CZ-CD1 3.31Å; F177-G195 VanDerWaalsContact CE2-O 3.32Å; F177-G195 WeakPolarHBondContact CE2-O 3.19Å; F177-C197 HydrophobicContact CB-CB 4.34Å; F177-C197 HydrophobicContact CD1-CB 3.8Å; F177-C197 HydrophobicContact CD2-CB 3.9Å; F177-C197 HydrophobicContact CE1-CB 4.06Å; F177-C197 HydrophobicContact CE2-CB 4.15Å; F177-C197 HydrophobicContact CG-CB 3.73Å; F177-C197 HydrophobicContact CZ-CB 4.24Å
178	V	68.4	Low	67.7	Low	29 Å²	29	69.6 Å²	69.6	18%	0.176	37%	0.366	C	S	.	.	H	α-helix	trans	-61.4	-42.9	179.3	-176.5	0	0	0	0	111	F160 P175 K182	F160-V178 HydrophobicContact CD1-CG1 4.17Å; F160-V178 HydrophobicContact CD1-CG2 4.1Å; F160-V178 HydrophobicContact CE1-CG1 4.23Å; P175-V178 PolarHBondContact O-N 3.29Å; V178-K182 WeakPolarHBondContact O-CA 3.41Å; V178-K182 PolarHBondContact O-N 3.06Å
179	N	68	Low	68.6	Low	121 Å²	121	69 Å²	69	65%	0.647	37%	0.368	S	S	*	.	H	α-helix	trans	-73.1	-29.4	-178	-157.8	28.5	0	0	0	112.9	P175 F177	P175-N179 VanDerWaalsContact O-CB 3.24Å; P175-N179 WeakPolarHBondContact O-CB 3.46Å; P175-N179 PolarHBondContact O-N 3.36Å; F177-N179 VanDerWaalsContact C-N 3.32Å; F177-N179 PolarHBondContact O-N 2.86Å
180	T	69.8	Low	69.7	Low	31 Å²	31	63.3 Å²	63.3	19%	0.19	35%	0.349	C	S	.	.	H	α-helix	trans	-94.7	-51.5	-174.8	-59.4	0	0	0	0	113.2	T176 F177 N190 C197	T176-T180 WeakPolarHBondContact O-CB 3.35Å; T176-T180 PolarHBondContact O-N 3.45Å; T176-T180 PolarHBondContact O-OG1 2.97Å; F177-T180 PolarHBondContact O-N 3.17Å; T180-N190 HydrophobicContact CG2-CB 3.83Å; T180-N190 WeakPolarHBondContact CG2-OD1 3.46Å; T180-C197 PolarHBondContact OG1-O 2.88Å; T180-C197 VanDerWaalsContact OG1-O 3.04Å
181	S	68.8	Low	70.4	Confident	30 Å²	30	63.7 Å²	63.7	21%	0.21	35%	0.348	C	S	.	.	H	α-helix	trans	-109.5	-6.7	-172.8	62.3	0	0	0	0	114	F177 S183 A185	F177-S181 PolarHBondContact O-N 3.38Å; F177-S181 PolarHBondContact O-OG 2.84Å; S181-S183 PolarHBondContact O-N 2.88Å; S181-S183 PolarHBondContact OG-O 2.8Å; S181-S183 PolarHBondContact OG-OG 2.76Å; S181-A185 WeakPolarHBondContact CB-O 3.39Å; S181-A185 PolarHBondContact OG-O 2.97Å
182	K	68.4	Low	71.2	Confident	166 Å²	166	66.3 Å²	66.3	72%	0.722	36%	0.36	S	S	*	.	S	Bend	trans	49.1	37.5	-170.3	-59.1	-176.5	179.7	-179.6	0	112.2	F160 F177 V178	F160-K182 HydrophobicContact CE1-CB 4.49Å; F160-K182 WeakPolarHBondContact CE1-O 3.39Å; F177-K182 PolarHBondContact O-N 3.48Å; V178-K182 WeakPolarHBondContact O-CA 3.41Å; V178-K182 PolarHBondContact O-N 3.06Å
183	S	69.8	Low	71.8	Confident	13 Å²	13	60.2 Å²	60.2	9%	0.091	34%	0.338	C	S	.	.	S	Bend	trans	-154.8	176.1	169	74.5	0	0	0	0	110.1	F177 S181 A185	F177-S183 CarbonylContact C-O 3.59Å; F177-S183 WeakPolarHBondContact CB-O 3.43Å; S181-S183 PolarHBondContact O-N 2.88Å; S181-S183 PolarHBondContact OG-O 2.8Å; S181-S183 PolarHBondContact OG-OG 2.76Å; S183-A185 PolarHBondContact O-N 2.83Å; S183-A185 PolarHBondContact OG-N 2.88Å; S183-A185 VanDerWaalsContact OG-N 3.14Å; S183-A185 PolarHBondContact OG-O 2.96Å
184	C	67.6	Low	72	Confident	47 Å²	47	60.8 Å²	60.8	32%	0.318	35%	0.347	S	S	.	.	S	Bend	trans	-78.6	-3.9	170.2	-68.7	0	0	0	0	113.6	F160 C173 F177	F160-C184 WeakPolarHBondContact CA-SG 3.48Å; C173-C184 HydrophobicContact CB-CB 3.83Å; C173-C184 WeakPolarHBondContact CB-SG 3.5Å; C173-C184 WeakPolarHBondContact SG-CB 3.24Å; C173-C184 CovalentContact SG-SG 2Å; C173-C184 PolarHBondContact SG-SG 3.41Å; F177-C184 WeakPolarHBondContact CD1-O 3.04Å
185	A	72.9	Confident	72.2	Confident	50 Å²	50	59.8 Å²	59.8	41%	0.413	36%	0.356	S	S	.	.	S	Bend	trans	-104.2	132.4	179.5	0	0	0	0	0	109.8	S181 S183 S187	S181-A185 WeakPolarHBondContact CB-O 3.39Å; S181-A185 PolarHBondContact OG-O 2.97Å; S183-A185 PolarHBondContact O-N 2.83Å; S183-A185 PolarHBondContact OG-N 2.88Å; S183-A185 VanDerWaalsContact OG-N 3.14Å; S183-A185 PolarHBondContact OG-O 2.96Å; A185-S187 PolarHBondContact O-N 3.37Å
186	C	76.3	Confident	72.7	Confident	27 Å²	27	56.8 Å²	56.8	18%	0.182	34%	0.335	C	S	.	.			trans	-91.3	82.1	172.2	-164.4	0	0	0	0	108.7	F177 L192 C197	F177-C186 HydrophobicContact CD1-CB 3.93Å; F177-C186 HydrophobicContact CE1-CB 3.68Å; C186-L192 HydrophobicContact CB-CB 3.89Å; C186-L192 HydrophobicContact CB-CD1 4.08Å; C186-L192 HydrophobicContact CB-CG 4.4Å; C186-C197 VanDerWaalsContact CA-SG 3.59Å; C186-C197 HydrophobicContact CB-CB 3.73Å; C186-C197 WeakPolarHBondContact CB-SG 3.43Å; C186-C197 WeakPolarHBondContact SG-CB 3.49Å; C186-C197 CovalentContact SG-SG 2.04Å; C186-C197 PolarHBondContact SG-SG 2.82Å
187	S	77.5	Confident	73	Confident	72 Å²	72	56.6 Å²	56.6	50%	0.503	33%	0.333	S	S	.	.			trans	-80.6	147.8	-179.9	-51.9	0	0	0	0	111.6	A185 N190	A185-S187 PolarHBondContact O-N 3.37Å; S187-N190 WeakPolarHBondContact O-CB 3.34Å; S187-N190 PolarHBondContact O-N 2.74Å; S187-N190 VanDerWaalsContact O-N 3.12Å; S187-N190 PolarHBondContact O-ND2 3.3Å
188	E	69.8	Low	73.4	Confident	188 Å²	188	56.3 Å²	56.3	88%	0.879	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	138.6	174.2	-67.1	-164.5	169.7	0	0	110.8
189	P	69.2	Low	73.7	Confident	95 Å²	95	57.6 Å²	57.6	62%	0.617	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	cis	-91.9	13.3	17.9	37.2	-37.2	0	0	0	115.4	N200	P189-N200 WeakPolarHBondContact O-CB 3.27Å
190	N	78.2	Confident	73.7	Confident	30 Å²	30	55.3 Å²	55.3	16%	0.16	33%	0.33	C	S	.	.	S	Bend	trans	-77.5	154.1	-179.7	-57.5	-54.1	0	0	0	112.2	T180 S187	T180-N190 HydrophobicContact CG2-CB 3.83Å; T180-N190 WeakPolarHBondContact CG2-OD1 3.46Å; S187-N190 WeakPolarHBondContact O-CB 3.34Å; S187-N190 PolarHBondContact O-N 2.74Å; S187-N190 VanDerWaalsContact O-N 3.12Å; S187-N190 PolarHBondContact O-ND2 3.3Å
191	I	77.6	Confident	73	Confident	44 Å²	44	59.9 Å²	59.9	23%	0.226	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	113.8	-173.9	-57	172.1	0	0	0	109.8	F198 N200 L206	I191-F198 PolarHBondContact N-O 2.78Å; I191-F198 PolarHBondContact O-N 3Å; I191-N200 HydrophobicContact CD1-CB 4.42Å; I191-N200 HydrophobicContact CG1-CB 4.49Å; I191-L206 HydrophobicContact CD1-CD2 3.32Å
192	L	78.8	Confident	72.5	Confident	102 Å²	102	60.5 Å²	60.5	53%	0.534	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.5	170.2	-178.5	62	0	0	0	110.1	F177 C186 L196	F177-L192 HydrophobicContact CE1-CD1 3.72Å; F177-L192 HydrophobicContact CE2-CD1 4.31Å; F177-L192 HydrophobicContact CZ-CD1 3.31Å; C186-L192 HydrophobicContact CB-CB 3.89Å; C186-L192 HydrophobicContact CB-CD1 4.08Å; C186-L192 HydrophobicContact CB-CG 4.4Å; L192-L196 WeakPolarHBondContact CA-O 3.35Å
193	T	76.1	Confident	72	Confident	15 Å²	15	60.8 Å²	60.8	9%	0.092	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	134.7	-179.3	-174.8	0	0	0	0	111.1	G195 L196 F198 Q231 S232	T193-G195 PolarHBondContact O-N 3.01Å; T193-L196 PolarHBondContact N-O 3.5Å; T193-L196 PolarHBondContact O-N 3.11Å; T193-L196 VanDerWaalsContact O-O 3.09Å; T193-F198 HydrophobicContact CG2-CD2 3.57Å; T193-F198 HydrophobicContact CG2-CE2 3.54Å; T193-Q231 HydrophobicContact CG2-CB 4.08Å; T193-Q231 HydrophobicContact CG2-CG 3.47Å; T193-Q231 VanDerWaalsContact CG2-CG 3.47Å; T193-Q231 WeakPolarHBondContact OG1-CB 3.31Å; T193-S232 WeakPolarHBondContact O-CB 3.33Å
194	G	71.5	Confident	71.7	Confident	26 Å²	26	61.7 Å²	61.7	27%	0.268	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	23.4	-178	0	0	0	0	0	115.4	K228	G194-K228 WeakPolarHBondContact CA-O 3.45Å; G194-K228 PolarHBondContact N-O 2.85Å; G194-K228 VanDerWaalsContact N-O 3.17Å
195	G	76	Confident	71.5	Confident	51 Å²	51	60.9 Å²	60.9	53%	0.526	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	17.9	-174.4	0	0	0	0	0	114.5	F177 T193	F177-G195 VanDerWaalsContact CE2-O 3.32Å; F177-G195 WeakPolarHBondContact CE2-O 3.19Å; T193-G195 PolarHBondContact O-N 3.01Å
196	L	79.2	Confident	70.8	Confident	27 Å²	27	63.2 Å²	63.2	14%	0.141	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	150	173.5	-59.4	179.8	0	0	0	110	E174 T176 L192 T193 F198 A236	E174-L196 HydrophobicContact CG-CD2 3.74Å; E174-L196 WeakPolarHBondContact OE1-CD2 3.23Å; E174-L196 WeakPolarHBondContact OE2-CD2 3.28Å; T176-L196 HydrophobicContact CG2-CB 4.48Å; T176-L196 HydrophobicContact CG2-CD2 4.15Å; T176-L196 WeakPolarHBondContact OG1-CA 3.17Å; L192-L196 WeakPolarHBondContact CA-O 3.35Å; T193-L196 PolarHBondContact N-O 3.5Å; T193-L196 PolarHBondContact O-N 3.11Å; T193-L196 VanDerWaalsContact O-O 3.09Å; L196-F198 HydrophobicContact CB-CD2 4.43Å; L196-F198 HydrophobicContact CB-CE2 3.56Å; L196-F198 HydrophobicContact CB-CZ 3.72Å; L196-F198 HydrophobicContact CD1-CE2 4.33Å; L196-F198 HydrophobicContact CD1-CZ 3.78Å; L196-F198 HydrophobicContact CG-CZ 4.41Å; L196-A236 HydrophobicContact CD1-CB 4.02Å
197	C	78.7	Confident	69.9	Low	0 Å²	0	73 Å²	73	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	123	-179.8	-171.7	0	0	0	0	110.8	T176 F177 T180 C186	T176-C197 CarbonylContact C-O 3.6Å; T176-C197 VanDerWaalsContact CB-O 3.27Å; T176-C197 WeakPolarHBondContact CB-O 3.5Å; T176-C197 PolarHBondContact OG1-N 3.3Å; T176-C197 PolarHBondContact OG1-O 2.87Å; F177-C197 HydrophobicContact CB-CB 4.34Å; F177-C197 HydrophobicContact CD1-CB 3.8Å; F177-C197 HydrophobicContact CD2-CB 3.9Å; F177-C197 HydrophobicContact CE1-CB 4.06Å; F177-C197 HydrophobicContact CE2-CB 4.15Å; F177-C197 HydrophobicContact CG-CB 3.73Å; F177-C197 HydrophobicContact CZ-CB 4.24Å; T180-C197 PolarHBondContact OG1-O 2.88Å; T180-C197 VanDerWaalsContact OG1-O 3.04Å; C186-C197 VanDerWaalsContact CA-SG 3.59Å; C186-C197 HydrophobicContact CB-CB 3.73Å; C186-C197 WeakPolarHBondContact CB-SG 3.43Å; C186-C197 WeakPolarHBondContact SG-CB 3.49Å; C186-C197 CovalentContact SG-SG 2.04Å; C186-C197 PolarHBondContact SG-SG 2.82Å
198	F	78.4	Confident	69.2	Low	19 Å²	19	71.5 Å²	71.5	8%	0.083	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	144	-178.6	-58.7	-82.5	0	0	0	112	I191 T193 L196 A235 A236 Y240	I191-F198 PolarHBondContact N-O 2.78Å; I191-F198 PolarHBondContact O-N 3Å; T193-F198 HydrophobicContact CG2-CD2 3.57Å; T193-F198 HydrophobicContact CG2-CE2 3.54Å; L196-F198 HydrophobicContact CB-CD2 4.43Å; L196-F198 HydrophobicContact CB-CE2 3.56Å; L196-F198 HydrophobicContact CB-CZ 3.72Å; L196-F198 HydrophobicContact CD1-CE2 4.33Å; L196-F198 HydrophobicContact CD1-CZ 3.78Å; L196-F198 HydrophobicContact CG-CZ 4.41Å; F198-A235 HydrophobicContact CD1-CB 3.83Å; F198-A235 HydrophobicContact CD2-CB 4.34Å; F198-A235 HydrophobicContact CE1-CB 3.51Å; F198-A235 HydrophobicContact CE2-CB 4.05Å; F198-A235 HydrophobicContact CG-CB 4.23Å; F198-A235 HydrophobicContact CZ-CB 3.62Å; F198-A236 HydrophobicContact CZ-CB 4.41Å; F198-Y240 HydrophobicContact CE1-CE2 4.22Å
199	S	74.1	Confident	69.2	Low	56 Å²	56	65.5 Å²	65.5	39%	0.392	37%	0.37	S	S	.	.			trans	-71.4	135.2	173.6	-173.5	0	0	0	0	111.3	T201	S199-T201 PolarHBondContact O-N 3.33Å; S199-T201 PolarHBondContact OG-OG1 2.91Å; S199-T201 VanDerWaalsContact OG-OG1 3.06Å
200	N	68.6	Low	69.5	Low	72 Å²	72	62.3 Å²	62.3	39%	0.385	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-2	179.6	-167.7	27.4	0	0	0	113.6	P189 I191 L206	P189-N200 WeakPolarHBondContact O-CB 3.27Å; I191-N200 HydrophobicContact CD1-CB 4.42Å; I191-N200 HydrophobicContact CG1-CB 4.49Å; N200-L206 WeakPolarHBondContact OD1-CD2 3.48Å
201	T	56	Low	69.4	Low	127 Å²	127	62.8 Å²	62.8	78%	0.779	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	2.5	-178.7	58.5	0	0	0	0	114.4	S199	S199-T201 PolarHBondContact O-N 3.33Å; S199-T201 PolarHBondContact OG-OG1 2.91Å; S199-T201 VanDerWaalsContact OG-OG1 3.06Å
202	G	57	Low	69.3	Low	44 Å²	44	60.8 Å²	60.8	45%	0.454	34%	0.344	S	S	.	.	S	Bend	trans	-81.4	149.3	-179.5	0	0	0	0	0	113.7	F204	G202-F204 PolarHBondContact O-N 2.88Å
203	N	57.7	Low	69.3	Low	172 Å²	172	59.4 Å²	59.4	92%	0.92	33%	0.332	S	S	*	.	S	Bend	trans	-65.8	18.7	174	-79.4	-11.5	0	0	0	114.6
204	F	64.8	Low	69.3	Low	32 Å²	32	58.9 Å²	58.9	14%	0.14	33%	0.328	C	S	.	.	S	Bend	trans	-87.7	135.3	-177	-162.7	-96.3	0	0	0	110.7	G202 L206 A234 W238 L270	G202-F204 PolarHBondContact O-N 2.88Å; F204-L206 PolarHBondContact O-N 3.5Å; F204-L206 VanDerWaalsContact O-N 3.11Å; F204-A234 HydrophobicContact CE1-CB 4.35Å; F204-A234 HydrophobicContact CZ-CB 3.84Å; F204-W238 HydrophobicContact CD2-CB 4.13Å; F204-W238 AromaticContact CD2-CD1 3.5Å; F204-W238 AromaticContact CD2-CG 3.81Å; F204-W238 HydrophobicContact CD2-CG 3.81Å; F204-W238 HydrophobicContact CE2-CB 3.72Å; F204-W238 AromaticContact CE2-CD1 3.98Å; F204-W238 AromaticContact CE2-CG 3.81Å; F204-W238 HydrophobicContact CE2-CG 3.81Å; F204-L270 HydrophobicContact CE1-CD2 4.3Å; F204-L270 HydrophobicContact CZ-CD2 4.12Å
205	P	63.1	Low	69	Low	29 Å²	29	60.1 Å²	60.1	19%	0.188	34%	0.341	C	S	.	.			trans	-61.1	116.8	-177.2	17.7	-27.2	0	0	0	112.2	F265 L270	P205-F265 HydrophobicContact CB-CD1 4.11Å; P205-F265 HydrophobicContact CB-CE1 3.85Å; P205-F265 HydrophobicContact CB-CZ 4.31Å; P205-F265 HydrophobicContact CG-CD1 4.06Å; P205-F265 HydrophobicContact CG-CE1 3.51Å; P205-F265 HydrophobicContact CG-CZ 4.18Å; P205-L270 HydrophobicContact CG-CD2 4.17Å
206	L	57.3	Low	68.4	Low	100 Å²	100	63.2 Å²	63.2	52%	0.524	34%	0.342	S	S	.	.			trans	-80.9	-24.3	-177.1	-78.4	150.5	0	0	0	113.8	I191 N200 F204	I191-L206 HydrophobicContact CD1-CD2 3.32Å; N200-L206 WeakPolarHBondContact OD1-CD2 3.48Å; F204-L206 PolarHBondContact O-N 3.5Å; F204-L206 VanDerWaalsContact O-N 3.11Å
207	R	57.3	Low	67.7	Low	231 Å²	231	64.3 Å²	64.3	87%	0.872	35%	0.35	S	S	*	.			trans	-89.1	117.4	177.6	-95.5	-177.8	172.2	176.8	-1.7	110.5
208	R	64.4	Low	67.2	Low	42 Å²	42	67.6 Å²	67.6	16%	0.158	38%	0.384	C	S	.	.			trans	-129.6	150.6	175.3	-78.5	-161.5	-66.5	-74	-50.1	112.6	L270	R208-L270 HydrophobicContact CG-CD1 3.92Å; R208-L270 HydrophobicContact CG-CD2 4.49Å
209	I	69.2	Low	67.1	Low	61 Å²	61	68.4 Å²	68.4	31%	0.313	39%	0.39	S	S	.	.			trans	-102.6	107.7	171.9	-64.9	166	0	0	0	107.6	T211 T264 F265	I209-T211 HydrophobicContact CG2-CG2 4.11Å; I209-T211 WeakPolarHBondContact CG2-OG1 3.48Å; I209-T211 PolarHBondContact O-N 3.23Å; I209-T264 HydrophobicContact CD1-CG2 4.01Å; I209-F265 PolarHBondContact N-O 3Å
210	S	75.9	Confident	67.4	Low	28 Å²	28	69.5 Å²	69.5	20%	0.196	40%	0.398	C	S	.	.			trans	-85.5	16	173.5	-53.5	0	0	0	0	112.4	S223	S210-S223 PolarHBondContact O-N 2.97Å; S210-S223 VanDerWaalsContact O-N 3.14Å
211	T	76.3	Confident	68.2	Low	40 Å²	40	66.2 Å²	66.2	25%	0.245	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	127.7	179.4	62.6	0	0	0	0	110.8	I209 L221	I209-T211 HydrophobicContact CG2-CG2 4.11Å; I209-T211 WeakPolarHBondContact CG2-OG1 3.48Å; I209-T211 PolarHBondContact O-N 3.23Å; T211-L221 CarbonylContact C-O 3.44Å; T211-L221 WeakPolarHBondContact CA-O 3.38Å
212	A	75.8	Confident	69.6	Low	2 Å²	2	64 Å²	64	2%	0.017	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	127.1	164.9	0	0	0	0	0	107.9	Y214 L221 F226	A212-Y214 HydrophobicContact CB-CE2 3.73Å; A212-L221 PolarHBondContact N-O 2.9Å; A212-L221 PolarHBondContact O-N 3.48Å; A212-L221 VanDerWaalsContact O-N 3.1Å; A212-F226 HydrophobicContact CB-CD2 4.33Å; A212-F226 HydrophobicContact CB-CE2 3.82Å; A212-F226 HydrophobicContact CB-CZ 4.34Å
213	R	77.8	Confident	71.2	Confident	74 Å²	74	62 Å²	62	28%	0.279	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	126.5	177.6	-64.8	-174.3	-171.9	172.5	9.3	109.8	T264 R463	R213-T264 PolarHBondContact NH2-OG1 2.95Å; R213-R463 PolarHBondContact O-NH2 2.71Å
214	Y	77.1	Confident	72.7	Confident	3 Å²	3	56.1 Å²	56.1	1%	0.012	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	91.9	172.5	-59.2	-84.5	0	0	0	108.6	A212 E216 G218 V219 L221 S449 G450 V461 D494	A212-Y214 HydrophobicContact CB-CE2 3.73Å; Y214-E216 PolarHBondContact O-N 3.04Å; Y214-G218 PolarHBondContact O-N 3.1Å; Y214-V219 WeakPolarHBondContact CB-O 3.37Å; Y214-V219 PolarHBondContact N-O 2.92Å; Y214-V219 PolarHBondContact O-N 2.88Å; Y214-L221 HydrophobicContact CD2-CD1 4.1Å; Y214-L221 HydrophobicContact CD2-CG 4.14Å; Y214-L221 HydrophobicContact CE2-CB 4.06Å; Y214-L221 HydrophobicContact CE2-CD1 3.73Å; Y214-L221 HydrophobicContact CE2-CG 3.99Å; Y214-S449 PolarHBondContact OH-O 3.31Å; Y214-S449 PolarHBondContact OH-OG 3.04Å; Y214-G450 WeakPolarHBondContact OH-CA 3.27Å; Y214-G450 PolarHBondContact OH-N 2.69Å; Y214-V461 HydrophobicContact CD1-CB 4.16Å; Y214-V461 HydrophobicContact CD1-CG1 3.38Å; Y214-V461 HydrophobicContact CD2-CG1 4.47Å; Y214-V461 HydrophobicContact CE1-CB 4.08Å; Y214-V461 HydrophobicContact CE1-CG1 3.62Å; Y214-V461 HydrophobicContact CE2-CB 4.47Å; Y214-V461 HydrophobicContact CG-CB 4.37Å; Y214-V461 HydrophobicContact CG-CG1 3.84Å; Y214-D494 VanDerWaalsContact C-OD2 3.28Å; Y214-D494 WeakPolarHBondContact CA-OD2 3.44Å; Y214-D494 WeakPolarHBondContact CB-OD2 3.4Å; Y214-D494 HydrophobicContact CD1-CB 4.07Å
215	G	64	Low	74	Confident	53 Å²	53	55.4 Å²	55.4	55%	0.546	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-38.6	-168	0	0	0	0	0	113.3	G218 D494	G215-G218 PolarHBondContact O-N 2.64Å; G215-D494 PolarHBondContact N-OD2 3.47Å; G215-D494 VanDerWaalsContact N-OD2 3.16Å
216	E	64.3	Low	75.3	Confident	116 Å²	116	54.2 Å²	54.2	54%	0.542	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-38.5	-178.7	-67.3	-175.5	157.3	0	0	112.4	Y214 G218 S493 D494	Y214-E216 PolarHBondContact O-N 3.04Å; E216-G218 VanDerWaalsContact C-N 3.3Å; E216-S493 WeakPolarHBondContact OE2-CA 3.5Å; E216-S493 WeakPolarHBondContact OE2-CB 3.22Å; E216-D494 HydrophobicContact CB-CB 4.34Å; E216-D494 PolarHBondContact OE2-N 2.9Å
217	V	64.2	Low	76.7	Confident	50 Å²	50	51.3 Å²	51.3	30%	0.303	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-12.9	179.4	-172.1	0	0	0	0	111.2	V219 D494	V217-V219 HydrophobicContact CG1-CB 4.41Å; V217-V219 HydrophobicContact CG1-CG2 3.86Å; V217-V219 PolarHBondContact O-N 3.43Å; V217-D494 HydrophobicContact CG2-CB 3.73Å; V217-D494 WeakPolarHBondContact CG2-O 3.43Å
218	G	67.7	Low	78.1	Confident	69 Å²	69	44.7 Å²	44.7	71%	0.711	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	19.8	-179.2	0	0	0	0	0	113.8	Y214 G215 E216	Y214-G218 PolarHBondContact O-N 3.1Å; G215-G218 PolarHBondContact O-N 2.64Å; E216-G218 VanDerWaalsContact C-N 3.3Å
219	V	77.4	Confident	79.2	Confident	36 Å²	36	44.5 Å²	44.5	22%	0.218	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	137.2	-174.9	-179.4	0	0	0	0	109.8	Y214 V217 L221	Y214-V219 WeakPolarHBondContact CB-O 3.37Å; Y214-V219 PolarHBondContact N-O 2.92Å; Y214-V219 PolarHBondContact O-N 2.88Å; V217-V219 HydrophobicContact CG1-CB 4.41Å; V217-V219 HydrophobicContact CG1-CG2 3.86Å; V217-V219 PolarHBondContact O-N 3.43Å; V219-L221 HydrophobicContact CG1-CD2 3.39Å; V219-L221 HydrophobicContact CG1-CG 3.8Å
220	S	80.3	Confident	80.2	Confident	78 Å²	78	41.6 Å²	41.6	55%	0.545	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.1	166.7	-63.7	0	0	0	0	108.1
221	L	84.2	Confident	80.6	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.016	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	141.5	-179.9	-58.1	176.1	0	0	0	109.6	T211 A212 Y214 V219 S223 E452 R460 V461	T211-L221 CarbonylContact C-O 3.44Å; T211-L221 WeakPolarHBondContact CA-O 3.38Å; A212-L221 PolarHBondContact N-O 2.9Å; A212-L221 PolarHBondContact O-N 3.48Å; A212-L221 VanDerWaalsContact O-N 3.1Å; Y214-L221 HydrophobicContact CD2-CD1 4.1Å; Y214-L221 HydrophobicContact CD2-CG 4.14Å; Y214-L221 HydrophobicContact CE2-CB 4.06Å; Y214-L221 HydrophobicContact CE2-CD1 3.73Å; Y214-L221 HydrophobicContact CE2-CG 3.99Å; V219-L221 HydrophobicContact CG1-CD2 3.39Å; V219-L221 HydrophobicContact CG1-CG 3.8Å; L221-S223 PolarHBondContact O-N 2.89Å; L221-E452 HydrophobicContact CB-CG 4.46Å; L221-R460 HydrophobicContact CD1-CB 4.23Å; L221-R460 HydrophobicContact CD1-CG 4.38Å; L221-R460 VanDerWaalsContact CD2-NH1 3.27Å; L221-V461 HydrophobicContact CD1-CB 4.15Å; L221-V461 HydrophobicContact CD1-CG2 3.83Å
222	T	86.1	Confident	81.1	Confident	82 Å²	82	40.6 Å²	40.6	50%	0.503	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	104.3	169.4	-56.4	0	0	0	0	108	E224	T222-E224 PolarHBondContact O-N 2.87Å
223	S	89.6	Confident	81.7	Confident	0 Å²	0	41 Å²	41	0%	0	25%	0.246	C	C	.	.			trans	-73	125.7	-178.8	179.4	0	0	0	0	110.3	S210 L221 W225 F226 A227 S449	S210-S223 PolarHBondContact O-N 2.97Å; S210-S223 VanDerWaalsContact O-N 3.14Å; L221-S223 PolarHBondContact O-N 2.89Å; S223-W225 PolarHBondContact O-N 3.04Å; S223-W225 PolarHBondContact OG-N 3.17Å; S223-F226 PolarHBondContact O-N 3.12Å; S223-F226 PolarHBondContact OG-N 3.19Å; S223-A227 WeakPolarHBondContact O-CB 3.47Å; S223-A227 PolarHBondContact O-N 2.94Å; S223-S449 WeakPolarHBondContact CB-O 3.24Å; S223-S449 WeakPolarHBondContact OG-CA 3.39Å; S223-S449 PolarHBondContact OG-O 2.76Å
224	E	90.6	Very high	82.2	Confident	50 Å²	50	37.4 Å²	37.4	23%	0.234	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-36.1	175.2	-178.9	54.7	-149.4	0	0	111.2	T222 A227 K228 R451 L455	T222-E224 PolarHBondContact O-N 2.87Å; E224-A227 PolarHBondContact O-N 3.25Å; E224-K228 WeakPolarHBondContact O-CB 3.25Å; E224-K228 PolarHBondContact O-N 2.97Å; E224-R451 PolarHBondContact N-O 2.82Å; E224-L455 HydrophobicContact CB-CD2 4.15Å; E224-L455 HydrophobicContact CG-CD2 3.9Å; E224-L455 HydrophobicContact CG-CG 3.9Å
225	W	90.8	Very high	82.5	Confident	17 Å²	17	37.6 Å²	37.6	6%	0.064	24%	0.235	C	C	.	.	H	α-helix	trans	-62.8	-45.2	174.9	-176.9	-104.8	0	0	0	111.9	S223 K228 Y229 I339 R340 V448 L455	S223-W225 PolarHBondContact O-N 3.04Å; S223-W225 PolarHBondContact OG-N 3.17Å; W225-K228 PolarHBondContact O-N 3.06Å; W225-Y229 AromaticContact CD2-CD2 3.58Å; W225-Y229 HydrophobicContact CD2-CD2 3.58Å; W225-Y229 HydrophobicContact CD2-CE2 4.05Å; W225-Y229 AromaticContact CE2-CD2 3.84Å; W225-Y229 AromaticContact CE3-CD2 3.39Å; W225-Y229 HydrophobicContact CE3-CD2 3.39Å; W225-Y229 AromaticContact CE3-CE2 3.34Å; W225-Y229 HydrophobicContact CE3-CE2 3.34Å; W225-Y229 HydrophobicContact CG-CD2 4.33Å; W225-Y229 AromaticContact CH2-CD2 3.74Å; W225-Y229 HydrophobicContact CH2-CD2 3.74Å; W225-Y229 AromaticContact CH2-CE2 3.73Å; W225-Y229 HydrophobicContact CH2-CE2 3.73Å; W225-Y229 HydrophobicContact CH2-CG 4.3Å; W225-Y229 AromaticContact CZ2-CD2 3.92Å; W225-Y229 HydrophobicContact CZ2-CD2 3.92Å; W225-Y229 HydrophobicContact CZ2-CE2 4.38Å; W225-Y229 HydrophobicContact CZ2-CG 4.28Å; W225-Y229 AromaticContact CZ3-CD2 3.49Å; W225-Y229 HydrophobicContact CZ3-CD2 3.49Å; W225-Y229 VanDerWaalsContact CZ3-CD2 3.49Å; W225-Y229 AromaticContact CZ3-CE2 3.17Å; W225-Y229 HydrophobicContact CZ3-CE2 3.17Å; W225-Y229 HydrophobicContact CZ3-CG 4.45Å; W225-Y229 AromaticContact CZ3-CZ 3.94Å; W225-Y229 WeakPolarHBondContact O-CD2 3.21Å; W225-Y229 PolarHBondContact O-N 2.9Å; W225-I339 HydrophobicContact CD2-CD1 3.83Å; W225-I339 VanDerWaalsContact CE2-CD1 3.45Å; W225-I339 HydrophobicContact CE3-CD1 4.35Å; W225-I339 HydrophobicContact CG-CD1 4.24Å; W225-I339 HydrophobicContact CH2-CD1 4.29Å; W225-I339 HydrophobicContact CH2-CG1 4.39Å; W225-I339 HydrophobicContact CH2-CG2 3.81Å; W225-I339 HydrophobicContact CZ2-CB 4.24Å; W225-I339 HydrophobicContact CZ2-CD1 3.74Å; W225-I339 HydrophobicContact CZ2-CG1 3.62Å; W225-I339 HydrophobicContact CZ2-CG2 3.84Å; W225-R340 HydrophobicContact CH2-CG 3.92Å; W225-R340 HydrophobicContact CZ2-CG 4.36Å; W225-V448 HydrophobicContact CB-CG1 3.74Å; W225-V448 HydrophobicContact CD2-CG1 4Å; W225-V448 HydrophobicContact CE3-CG1 4.13Å; W225-V448 HydrophobicContact CG-CG1 3.8Å; W225-L455 HydrophobicContact CB-CD2 4.12Å; W225-L455 HydrophobicContact CE3-CD1 4.3Å; W225-L455 HydrophobicContact CE3-CD2 4.03Å
226	F	90.3	Very high	83.4	Confident	3 Å²	3	35.3 Å²	35.3	1%	0.013	21%	0.21	C	C	.	.	H	α-helix	trans	-69.3	-41.1	-179.8	-65.3	6.6	0	0	0	110.4	A212 S223 K228 L230 I252 M255	A212-F226 HydrophobicContact CB-CD2 4.33Å; A212-F226 HydrophobicContact CB-CE2 3.82Å; A212-F226 HydrophobicContact CB-CZ 4.34Å; S223-F226 PolarHBondContact O-N 3.12Å; S223-F226 PolarHBondContact OG-N 3.19Å; F226-K228 VanDerWaalsContact C-N 3.29Å; F226-K228 PolarHBondContact O-N 3Å; F226-L230 HydrophobicContact CB-CB 4.48Å; F226-L230 WeakPolarHBondContact O-CB 3.36Å; F226-L230 PolarHBondContact O-N 3.12Å; F226-I252 HydrophobicContact CD1-CG2 3.74Å; F226-I252 HydrophobicContact CD2-CG2 4.36Å; F226-I252 HydrophobicContact CE1-CG2 3.63Å; F226-I252 HydrophobicContact CE2-CG2 4.23Å; F226-I252 HydrophobicContact CG-CG2 4.13Å; F226-I252 HydrophobicContact CZ-CG2 3.88Å; F226-M255 HydrophobicContact CE1-CB 4.32Å; F226-M255 HydrophobicContact CE1-CE 4.08Å; F226-M255 HydrophobicContact CE1-SD 4.19Å; F226-M255 HydrophobicContact CZ-CB 4.02Å
227	A	87.1	Confident	84.4	Confident	40 Å²	40	30 Å²	30	33%	0.331	19%	0.186	S	C	.	.	H	α-helix	trans	-58	-41.7	177.6	0	0	0	0	0	112.1	S223 E224	S223-A227 WeakPolarHBondContact O-CB 3.47Å; S223-A227 PolarHBondContact O-N 2.94Å; E224-A227 PolarHBondContact O-N 3.25Å
228	K	86.8	Confident	85.4	Confident	91 Å²	91	31.9 Å²	31.9	40%	0.396	19%	0.188	S	C	.	.	H	α-helix	trans	-80.6	-38.2	-177.4	-168.7	166.1	-176.8	167	0	114.2	G194 E224 W225 F226 L455	G194-K228 WeakPolarHBondContact CA-O 3.45Å; G194-K228 PolarHBondContact N-O 2.85Å; G194-K228 VanDerWaalsContact N-O 3.17Å; E224-K228 WeakPolarHBondContact O-CB 3.25Å; E224-K228 PolarHBondContact O-N 2.97Å; W225-K228 PolarHBondContact O-N 3.06Å; F226-K228 VanDerWaalsContact C-N 3.29Å; F226-K228 PolarHBondContact O-N 3Å; K228-L455 HydrophobicContact CD-CD1 4.25Å
229	Y	88.8	Confident	85.9	Confident	38 Å²	38	32.4 Å²	32.4	15%	0.149	18%	0.177	C	C	.	.	H	α-helix	trans	-117.4	-18.1	-166.8	-60.8	-74.2	0	0	0	116	W225 Q231 S232 S233 L455	W225-Y229 AromaticContact CD2-CD2 3.58Å; W225-Y229 HydrophobicContact CD2-CD2 3.58Å; W225-Y229 HydrophobicContact CD2-CE2 4.05Å; W225-Y229 AromaticContact CE2-CD2 3.84Å; W225-Y229 AromaticContact CE3-CD2 3.39Å; W225-Y229 HydrophobicContact CE3-CD2 3.39Å; W225-Y229 AromaticContact CE3-CE2 3.34Å; W225-Y229 HydrophobicContact CE3-CE2 3.34Å; W225-Y229 HydrophobicContact CG-CD2 4.33Å; W225-Y229 AromaticContact CH2-CD2 3.74Å; W225-Y229 HydrophobicContact CH2-CD2 3.74Å; W225-Y229 AromaticContact CH2-CE2 3.73Å; W225-Y229 HydrophobicContact CH2-CE2 3.73Å; W225-Y229 HydrophobicContact CH2-CG 4.3Å; W225-Y229 AromaticContact CZ2-CD2 3.92Å; W225-Y229 HydrophobicContact CZ2-CD2 3.92Å; W225-Y229 HydrophobicContact CZ2-CE2 4.38Å; W225-Y229 HydrophobicContact CZ2-CG 4.28Å; W225-Y229 AromaticContact CZ3-CD2 3.49Å; W225-Y229 HydrophobicContact CZ3-CD2 3.49Å; W225-Y229 VanDerWaalsContact CZ3-CD2 3.49Å; W225-Y229 AromaticContact CZ3-CE2 3.17Å; W225-Y229 HydrophobicContact CZ3-CE2 3.17Å; W225-Y229 HydrophobicContact CZ3-CG 4.45Å; W225-Y229 AromaticContact CZ3-CZ 3.94Å; W225-Y229 WeakPolarHBondContact O-CD2 3.21Å; W225-Y229 PolarHBondContact O-N 2.9Å; Y229-Q231 VanDerWaalsContact C-N 3.34Å; Y229-Q231 PolarHBondContact O-N 2.83Å; Y229-S232 WeakPolarHBondContact CA-OG 3.26Å; Y229-S232 PolarHBondContact O-OG 3.3Å; Y229-S232 VanDerWaalsContact O-OG 3.13Å; Y229-S233 WeakPolarHBondContact O-CB 3.49Å; Y229-S233 PolarHBondContact O-N 3Å; Y229-S233 PolarHBondContact O-OG 3.41Å; Y229-L455 HydrophobicContact CE2-CD1 4.07Å
230	L	88.7	Confident	85.9	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-63.4	-43.3	-177.7	176.5	58	0	0	0	111.4	F226 A234 L249 I252 A267 L270	F226-L230 HydrophobicContact CB-CB 4.48Å; F226-L230 WeakPolarHBondContact O-CB 3.36Å; F226-L230 PolarHBondContact O-N 3.12Å; L230-A234 VanDerWaalsContact O-CB 3.29Å; L230-A234 WeakPolarHBondContact O-CB 3.49Å; L230-A234 PolarHBondContact O-N 2.84Å; L230-L249 HydrophobicContact CD1-CD1 3.64Å; L230-I252 HydrophobicContact CB-CD1 4.38Å; L230-I252 HydrophobicContact CD1-CD1 4.33Å; L230-I252 HydrophobicContact CD1-CG2 3.99Å; L230-A267 HydrophobicContact CD1-CB 3.69Å; L230-A267 HydrophobicContact CD2-CB 4.23Å; L230-L270 HydrophobicContact CD1-CD1 4.07Å; L230-L270 HydrophobicContact CD2-CD1 4.2Å; L230-L270 HydrophobicContact CG-CD1 4.12Å
231	Q	86	Confident	85.8	Confident	41 Å²	41	33 Å²	33	19%	0.192	17%	0.173	C	C	.	.	H	α-helix	trans	-64.9	-54.5	-179.4	176.6	159.2	0.8	0	0	112.9	T193 Y229 S233 A234 A235	T193-Q231 HydrophobicContact CG2-CB 4.08Å; T193-Q231 HydrophobicContact CG2-CG 3.47Å; T193-Q231 VanDerWaalsContact CG2-CG 3.47Å; T193-Q231 WeakPolarHBondContact OG1-CB 3.31Å; Y229-Q231 VanDerWaalsContact C-N 3.34Å; Y229-Q231 PolarHBondContact O-N 2.83Å; Q231-S233 VanDerWaalsContact C-N 3.3Å; Q231-S233 PolarHBondContact O-N 3.11Å; Q231-A234 PolarHBondContact O-N 3.02Å; Q231-A235 VanDerWaalsContact O-CB 3.3Å; Q231-A235 WeakPolarHBondContact O-CB 3.27Å; Q231-A235 PolarHBondContact O-N 3.4Å
232	S	85.3	Confident	85.7	Confident	5 Å²	5	35.1 Å²	35.1	4%	0.035	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-41.8	-177.1	51.9	0	0	0	0	110.7	T193 Y229 A236	T193-S232 WeakPolarHBondContact O-CB 3.33Å; Y229-S232 WeakPolarHBondContact CA-OG 3.26Å; Y229-S232 PolarHBondContact O-OG 3.3Å; Y229-S232 VanDerWaalsContact O-OG 3.13Å; S232-A236 WeakPolarHBondContact O-CB 3.34Å; S232-A236 PolarHBondContact O-N 3.16Å
233	S	89.2	Confident	85.7	Confident	10 Å²	10	32.6 Å²	32.6	7%	0.07	17%	0.168	C	C	.	.	H	α-helix	trans	-64.5	-44.9	177.3	-56	0	0	0	0	111.9	Y229 Q231 C237 S245	Y229-S233 WeakPolarHBondContact O-CB 3.49Å; Y229-S233 PolarHBondContact O-N 3Å; Y229-S233 PolarHBondContact O-OG 3.41Å; Q231-S233 VanDerWaalsContact C-N 3.3Å; Q231-S233 PolarHBondContact O-N 3.11Å; S233-C237 WeakPolarHBondContact O-CB 3.23Å; S233-C237 PolarHBondContact O-N 2.92Å; S233-S245 WeakPolarHBondContact O-CB 3.37Å
234	A	87.4	Confident	85.6	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-68.1	-44.2	179.4	0	0	0	0	0	112.6	F204 L230 Q231 C237 W238 L249 I274	F204-A234 HydrophobicContact CE1-CB 4.35Å; F204-A234 HydrophobicContact CZ-CB 3.84Å; L230-A234 VanDerWaalsContact O-CB 3.29Å; L230-A234 WeakPolarHBondContact O-CB 3.49Å; L230-A234 PolarHBondContact O-N 2.84Å; Q231-A234 PolarHBondContact O-N 3.02Å; A234-C237 PolarHBondContact O-N 3.48Å; A234-W238 WeakPolarHBondContact O-CB 3.5Å; A234-W238 PolarHBondContact O-N 2.98Å; A234-L249 HydrophobicContact CB-CD1 3.99Å; A234-L249 HydrophobicContact CB-CD2 4.17Å; A234-I274 HydrophobicContact CB-CD1 4.44Å; A234-I274 WeakPolarHBondContact O-CD1 3.36Å
235	A	83.6	Confident	85.5	Confident	7 Å²	7	33.7 Å²	33.7	6%	0.058	18%	0.179	C	C	.	.	H	α-helix	trans	-67.2	-42.7	178.9	0	0	0	0	0	111.6	F198 Q231 W238 V239	F198-A235 HydrophobicContact CD1-CB 3.83Å; F198-A235 HydrophobicContact CD2-CB 4.34Å; F198-A235 HydrophobicContact CE1-CB 3.51Å; F198-A235 HydrophobicContact CE2-CB 4.05Å; F198-A235 HydrophobicContact CG-CB 4.23Å; F198-A235 HydrophobicContact CZ-CB 3.62Å; Q231-A235 VanDerWaalsContact O-CB 3.3Å; Q231-A235 WeakPolarHBondContact O-CB 3.27Å; Q231-A235 PolarHBondContact O-N 3.4Å; A235-W238 PolarHBondContact O-N 2.88Å; A235-V239 WeakPolarHBondContact O-CB 3.41Å; A235-V239 WeakPolarHBondContact O-CG2 3.33Å; A235-V239 PolarHBondContact O-N 3.46Å
236	A	83.1	Confident	85.5	Confident	4 Å²	4	33 Å²	33	3%	0.033	18%	0.177	C	C	.	.	H	α-helix	trans	-67.5	-36.9	176.7	0	0	0	0	0	112.5	L196 F198 S232 Y240 A241 N242 S245	L196-A236 HydrophobicContact CD1-CB 4.02Å; F198-A236 HydrophobicContact CZ-CB 4.41Å; S232-A236 WeakPolarHBondContact O-CB 3.34Å; S232-A236 PolarHBondContact O-N 3.16Å; A236-Y240 HydrophobicContact CB-CD2 4.46Å; A236-Y240 WeakPolarHBondContact O-CB 3.2Å; A236-Y240 PolarHBondContact O-N 3.35Å; A236-Y240 VanDerWaalsContact O-N 3.07Å; A236-A241 PolarHBondContact O-N 3.39Å; A236-N242 PolarHBondContact O-N 3.45Å; A236-S245 WeakPolarHBondContact CB-OG 3.23Å
237	C	86.2	Confident	85.6	Confident	5 Å²	5	33.1 Å²	33.1	3%	0.034	18%	0.177	C	C	.	.	H	α-helix	trans	-62.6	-45.3	172.4	179.5	0	0	0	0	111.6	S233 A234 A241 C246 I274	S233-C237 WeakPolarHBondContact O-CB 3.23Å; S233-C237 PolarHBondContact O-N 2.92Å; A234-C237 PolarHBondContact O-N 3.48Å; C237-A241 WeakPolarHBondContact O-CA 3.4Å; C237-A241 PolarHBondContact O-N 3.37Å; C237-A241 VanDerWaalsContact O-N 3.13Å; C237-C246 WeakPolarHBondContact CA-SG 3.31Å; C237-C246 HydrophobicContact CB-CB 3.94Å; C237-C246 WeakPolarHBondContact CB-SG 3.5Å; C237-C246 WeakPolarHBondContact SG-CA 3.44Å; C237-C246 WeakPolarHBondContact SG-CB 3.5Å; C237-C246 CovalentContact SG-SG 2.03Å; C237-C246 PolarHBondContact SG-SG 3.25Å; C237-I274 HydrophobicContact CB-CD1 4.22Å
238	W	83.9	Confident	85.9	Confident	89 Å²	89	31.5 Å²	31.5	34%	0.337	16%	0.164	S	C	.	.	H	α-helix	trans	-70	-51	-178.7	175.5	-109.6	0	0	0	113.3	F204 A234 A235 I274 N277 T278	F204-W238 HydrophobicContact CD2-CB 4.13Å; F204-W238 AromaticContact CD2-CD1 3.5Å; F204-W238 AromaticContact CD2-CG 3.81Å; F204-W238 HydrophobicContact CD2-CG 3.81Å; F204-W238 HydrophobicContact CE2-CB 3.72Å; F204-W238 AromaticContact CE2-CD1 3.98Å; F204-W238 AromaticContact CE2-CG 3.81Å; F204-W238 HydrophobicContact CE2-CG 3.81Å; A234-W238 WeakPolarHBondContact O-CB 3.5Å; A234-W238 PolarHBondContact O-N 2.98Å; A235-W238 PolarHBondContact O-N 2.88Å; W238-I274 HydrophobicContact CB-CD1 4.01Å; W238-I274 HydrophobicContact CB-CG1 4.17Å; W238-I274 HydrophobicContact CE3-CB 4.36Å; W238-I274 HydrophobicContact CE3-CG1 4.04Å; W238-I274 HydrophobicContact CE3-CG2 4.17Å; W238-N277 HydrophobicContact CH2-CB 3.33Å; W238-N277 HydrophobicContact CZ2-CB 4.45Å; W238-N277 HydrophobicContact CZ3-CB 3.37Å; W238-T278 HydrophobicContact CE3-CG2 4.49Å; W238-T278 HydrophobicContact CZ3-CG2 4.06Å
239	V	78.2	Confident	86.3	Confident	81 Å²	81	27.1 Å²	27.1	49%	0.491	15%	0.145	S	C	.	.	H	α-helix	trans	-79.1	-38.6	-171.2	178.8	0	0	0	0	111.7	A235	A235-V239 WeakPolarHBondContact O-CB 3.41Å; A235-V239 WeakPolarHBondContact O-CG2 3.33Å; A235-V239 PolarHBondContact O-N 3.46Å
240	Y	76.9	Confident	86.5	Confident	83 Å²	83	25.3 Å²	25.3	33%	0.325	14%	0.138	S	C	.	.	H	α-helix	trans	-114	2.3	-170.9	-55.3	-65.8	0	0	0	113.6	T176 F198 A236 N242	T176-Y240 HydrophobicContact CG2-CD2 4.41Å; T176-Y240 HydrophobicContact CG2-CE2 3.58Å; F198-Y240 HydrophobicContact CE1-CE2 4.22Å; A236-Y240 HydrophobicContact CB-CD2 4.46Å; A236-Y240 WeakPolarHBondContact O-CB 3.2Å; A236-Y240 PolarHBondContact O-N 3.35Å; A236-Y240 VanDerWaalsContact O-N 3.07Å; Y240-N242 PolarHBondContact O-N 2.95Å
241	A	79	Confident	86.9	Confident	43 Å²	43	25.3 Å²	25.3	36%	0.355	14%	0.138	S	C	.	.			trans	49.7	32.2	-173.9	0	0	0	0	0	112.9	A236 C237 L243 N293	A236-A241 PolarHBondContact O-N 3.39Å; C237-A241 WeakPolarHBondContact O-CA 3.4Å; C237-A241 PolarHBondContact O-N 3.37Å; C237-A241 VanDerWaalsContact O-N 3.13Å; A241-L243 PolarHBondContact O-N 3.23Å; A241-N293 PolarHBondContact O-ND2 3.15Å
242	N	83	Confident	87.2	Confident	48 Å²	48	23.4 Å²	23.4	26%	0.257	13%	0.129	S	C	.	.			trans	-68.7	116	-174.1	-178.7	-60.2	0	0	0	110.3	A236 Y240 T244 S245 C246	A236-N242 PolarHBondContact O-N 3.45Å; Y240-N242 PolarHBondContact O-N 2.95Å; N242-T244 PolarHBondContact O-N 3.26Å; N242-T244 PolarHBondContact OD1-N 3.24Å; N242-T244 VanDerWaalsContact OD1-N 3.1Å; N242-T244 PolarHBondContact OD1-OG1 3.46Å; N242-S245 PolarHBondContact O-N 3.03Å; N242-S245 PolarHBondContact OD1-N 2.97Å; N242-S245 PolarHBondContact OD1-OG 3.24Å; N242-C246 WeakPolarHBondContact O-CB 3.4Å; N242-C246 PolarHBondContact O-N 2.96Å; N242-C246 PolarHBondContact O-SG 3.42Å
243	L	84.3	Confident	87.7	Confident	29 Å²	29	23.1 Å²	23.1	15%	0.152	13%	0.127	C	C	.	.	H	α-helix	trans	-55.7	-52.6	-175.9	175.5	61.2	0	0	0	112.6	I57 A241 S245 C246 Q247	I57-L243 HydrophobicContact CB-CD2 4.06Å; I57-L243 HydrophobicContact CG2-CD2 4.32Å; A241-L243 PolarHBondContact O-N 3.23Å; L243-S245 VanDerWaalsContact C-N 3.33Å; L243-S245 PolarHBondContact O-N 2.93Å; L243-C246 PolarHBondContact O-N 3.12Å; L243-Q247 HydrophobicContact CD1-CG 4.05Å; L243-Q247 HydrophobicContact CG-CG 4.46Å; L243-Q247 VanDerWaalsContact O-CG 3.26Å; L243-Q247 WeakPolarHBondContact O-CG 3.45Å; L243-Q247 PolarHBondContact O-N 3.05Å
244	T	88.4	Confident	87.9	Confident	54 Å²	54	22.7 Å²	22.7	33%	0.331	12%	0.124	S	C	.	.	H	α-helix	trans	-61.9	-40.4	-178.8	38.5	0	0	0	0	112.1	N242 Q247 A248 N342	N242-T244 PolarHBondContact O-N 3.26Å; N242-T244 PolarHBondContact OD1-N 3.24Å; N242-T244 VanDerWaalsContact OD1-N 3.1Å; N242-T244 PolarHBondContact OD1-OG1 3.46Å; T244-Q247 PolarHBondContact O-N 3.24Å; T244-A248 WeakPolarHBondContact O-CB 3.45Å; T244-A248 PolarHBondContact O-N 3.18Å; T244-N342 WeakPolarHBondContact CG2-OD1 3.37Å
245	S	89.2	Confident	88.2	Confident	18 Å²	18	22.7 Å²	22.7	13%	0.126	12%	0.124	C	C	.	.	H	α-helix	trans	-67	-38.2	175.8	-57.6	0	0	0	0	112.6	S233 A236 N242 L243 A248 L249	S233-S245 WeakPolarHBondContact O-CB 3.37Å; A236-S245 WeakPolarHBondContact CB-OG 3.23Å; N242-S245 PolarHBondContact O-N 3.03Å; N242-S245 PolarHBondContact OD1-N 2.97Å; N242-S245 PolarHBondContact OD1-OG 3.24Å; L243-S245 VanDerWaalsContact C-N 3.33Å; L243-S245 PolarHBondContact O-N 2.93Å; S245-A248 PolarHBondContact O-N 2.88Å; S245-L249 WeakPolarHBondContact O-CB 3.39Å; S245-L249 PolarHBondContact O-N 2.87Å
246	C	90.7	Very high	88.6	Confident	4 Å²	4	22.8 Å²	22.8	3%	0.027	12%	0.123	C	C	.	.	H	α-helix	trans	-66.3	-40.3	174	-69.7	0	0	0	0	112.3	C237 N242 L243 L249 G250 N293 L294	C237-C246 WeakPolarHBondContact CA-SG 3.31Å; C237-C246 HydrophobicContact CB-CB 3.94Å; C237-C246 WeakPolarHBondContact CB-SG 3.5Å; C237-C246 WeakPolarHBondContact SG-CA 3.44Å; C237-C246 WeakPolarHBondContact SG-CB 3.5Å; C237-C246 CovalentContact SG-SG 2.03Å; C237-C246 PolarHBondContact SG-SG 3.25Å; N242-C246 WeakPolarHBondContact O-CB 3.4Å; N242-C246 PolarHBondContact O-N 2.96Å; N242-C246 PolarHBondContact O-SG 3.42Å; L243-C246 PolarHBondContact O-N 3.12Å; C246-L249 PolarHBondContact O-N 2.84Å; C246-G250 PolarHBondContact O-N 2.95Å; C246-N293 WeakPolarHBondContact CB-O 3.3Å; C246-L294 HydrophobicContact CB-CD1 3.99Å
247	Q	92.6	Very high	89	Confident	4 Å²	4	22.9 Å²	22.9	2%	0.019	12%	0.123	C	C	.	.	H	α-helix	trans	-64.6	-42.9	173.2	-68	-69.4	-19.1	0	0	111.4	L243 T244 G250 N251 G341	L243-Q247 HydrophobicContact CD1-CG 4.05Å; L243-Q247 HydrophobicContact CG-CG 4.46Å; L243-Q247 VanDerWaalsContact O-CG 3.26Å; L243-Q247 WeakPolarHBondContact O-CG 3.45Å; L243-Q247 PolarHBondContact O-N 3.05Å; T244-Q247 PolarHBondContact O-N 3.24Å; Q247-G250 PolarHBondContact O-N 2.96Å; Q247-N251 VanDerWaalsContact O-CG 3.28Å; Q247-N251 PolarHBondContact O-N 2.98Å; Q247-N251 PolarHBondContact O-OD1 3Å; Q247-G341 VanDerWaalsContact CB-O 3.29Å; Q247-G341 WeakPolarHBondContact CB-O 3.39Å
248	A	93.5	Very high	89.3	Confident	6 Å²	6	22.8 Å²	22.8	5%	0.05	12%	0.122	C	C	.	.	H	α-helix	trans	-61.5	-44.9	175.3	0	0	0	0	0	112	T244 S245 G250 N251 I252 R340	T244-A248 WeakPolarHBondContact O-CB 3.45Å; T244-A248 PolarHBondContact O-N 3.18Å; S245-A248 PolarHBondContact O-N 2.88Å; A248-G250 VanDerWaalsContact C-N 3.29Å; A248-G250 PolarHBondContact O-N 2.91Å; A248-N251 PolarHBondContact O-N 3.49Å; A248-I252 VanDerWaalsContact O-CG1 3.29Å; A248-I252 WeakPolarHBondContact O-CG1 3.47Å; A248-I252 PolarHBondContact O-N 2.73Å; A248-R340 WeakPolarHBondContact CB-O 3.26Å
249	L	93.6	Very high	89.5	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-58.2	-44.2	174	177	64.1	0	0	0	111.2	L230 A234 S245 C246 I252 C253 L270 F271 I274	L230-L249 HydrophobicContact CD1-CD1 3.64Å; A234-L249 HydrophobicContact CB-CD1 3.99Å; A234-L249 HydrophobicContact CB-CD2 4.17Å; S245-L249 WeakPolarHBondContact O-CB 3.39Å; S245-L249 PolarHBondContact O-N 2.87Å; C246-L249 PolarHBondContact O-N 2.84Å; L249-I252 PolarHBondContact O-N 2.75Å; L249-C253 PolarHBondContact O-N 3.16Å; L249-L270 HydrophobicContact CD1-CB 4.41Å; L249-F271 HydrophobicContact CD2-CB 4.26Å; L249-F271 HydrophobicContact CD2-CD2 4.23Å; L249-F271 HydrophobicContact CG-CB 4.27Å; L249-F271 HydrophobicContact CG-CD2 4.19Å; L249-I274 HydrophobicContact CD2-CD1 3.61Å
250	G	94.2	Very high	89.9	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-60	-45.6	175.9	0	0	0	0	0	112.5	C246 Q247 A248 I252 C253 V254	C246-G250 PolarHBondContact O-N 2.95Å; Q247-G250 PolarHBondContact O-N 2.96Å; A248-G250 VanDerWaalsContact C-N 3.29Å; A248-G250 PolarHBondContact O-N 2.91Å; G250-I252 VanDerWaalsContact C-N 3.35Å; G250-I252 PolarHBondContact O-N 3.37Å; G250-C253 WeakPolarHBondContact O-CB 3.42Å; G250-C253 PolarHBondContact O-N 3.34Å; G250-C253 VanDerWaalsContact O-N 3.13Å; G250-V254 WeakPolarHBondContact O-CG2 3.26Å; G250-V254 PolarHBondContact O-N 2.97Å
251	N	95.8	Very high	90.2	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60	-42.7	176	-69.9	-7.1	0	0	0	112	Q247 A248 C253 V254 M255 D338 F394 R441	Q247-N251 VanDerWaalsContact O-CG 3.28Å; Q247-N251 PolarHBondContact O-N 2.98Å; Q247-N251 PolarHBondContact O-OD1 3Å; A248-N251 PolarHBondContact O-N 3.49Å; N251-C253 VanDerWaalsContact C-N 3.31Å; N251-C253 PolarHBondContact O-N 2.88Å; N251-V254 PolarHBondContact O-N 2.79Å; N251-V254 VanDerWaalsContact O-N 3.15Å; N251-M255 VanDerWaalsContact O-CG 3.29Å; N251-M255 WeakPolarHBondContact O-CG 3.35Å; N251-M255 PolarHBondContact O-N 3.06Å; N251-D338 PolarHBondContact ND2-O 3.22Å; N251-F394 HydrophobicContact CB-CD1 4.16Å; N251-F394 HydrophobicContact CB-CD2 4.02Å; N251-F394 HydrophobicContact CB-CE1 3.88Å; N251-F394 HydrophobicContact CB-CE2 3.77Å; N251-F394 HydrophobicContact CB-CG 4.23Å; N251-F394 HydrophobicContact CB-CZ 3.69Å; N251-F394 WeakPolarHBondContact ND2-CD2 3.48Å; N251-R441 VanDerWaalsContact OD1-CD 3.26Å; N251-R441 WeakPolarHBondContact OD1-CD 3.35Å; N251-R441 PolarHBondContact OD1-NH1 3.49Å
252	I	94.1	Very high	90.2	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-63.5	-37.6	176	-62.3	165.6	0	0	0	111.1	F226 L230 A248 L249 G250 M255 N256 A267	F226-I252 HydrophobicContact CD1-CG2 3.74Å; F226-I252 HydrophobicContact CD2-CG2 4.36Å; F226-I252 HydrophobicContact CE1-CG2 3.63Å; F226-I252 HydrophobicContact CE2-CG2 4.23Å; F226-I252 HydrophobicContact CG-CG2 4.13Å; F226-I252 HydrophobicContact CZ-CG2 3.88Å; L230-I252 HydrophobicContact CB-CD1 4.38Å; L230-I252 HydrophobicContact CD1-CD1 4.33Å; L230-I252 HydrophobicContact CD1-CG2 3.99Å; A248-I252 VanDerWaalsContact O-CG1 3.29Å; A248-I252 WeakPolarHBondContact O-CG1 3.47Å; A248-I252 PolarHBondContact O-N 2.73Å; L249-I252 PolarHBondContact O-N 2.75Å; G250-I252 VanDerWaalsContact C-N 3.35Å; G250-I252 PolarHBondContact O-N 3.37Å; I252-M255 PolarHBondContact O-N 2.88Å; I252-N256 PolarHBondContact O-N 3.12Å; I252-N256 VanDerWaalsContact O-N 3.1Å; I252-A267 HydrophobicContact CB-CB 4.39Å; I252-A267 HydrophobicContact CG2-CB 3.61Å
253	C	93.8	Very high	90	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.7	-41.8	172.7	171.8	0	0	0	0	112.2	L249 G250 N251 M255 N256 N258 C268 F271 L297	L249-C253 PolarHBondContact O-N 3.16Å; G250-C253 WeakPolarHBondContact O-CB 3.42Å; G250-C253 PolarHBondContact O-N 3.34Å; G250-C253 VanDerWaalsContact O-N 3.13Å; N251-C253 VanDerWaalsContact C-N 3.31Å; N251-C253 PolarHBondContact O-N 2.88Å; C253-M255 PolarHBondContact O-N 2.81Å; C253-N256 CarbonylContact O-C 3.5Å; C253-N256 WeakPolarHBondContact O-CA 3.49Å; C253-N256 PolarHBondContact O-N 3Å; C253-N256 VanDerWaalsContact O-N 3.08Å; C253-N258 PolarHBondContact O-N 2.82Å; C253-C268 VanDerWaalsContact C-SG 3.55Å; C253-C268 WeakPolarHBondContact CA-SG 3.13Å; C253-C268 HydrophobicContact CB-CB 4.06Å; C253-C268 WeakPolarHBondContact CB-SG 3.26Å; C253-C268 PolarHBondContact O-SG 2.82Å; C253-C268 WeakPolarHBondContact SG-CA 3.41Å; C253-C268 WeakPolarHBondContact SG-CB 3.42Å; C253-C268 CovalentContact SG-SG 2.05Å; C253-C268 PolarHBondContact SG-SG 2.68Å; C253-F271 HydrophobicContact CB-CB 4.47Å; C253-L297 HydrophobicContact CB-CD1 4.44Å
254	V	95.1	Very high	89.7	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.4	-41.5	175.3	-178.7	0	0	0	0	110.8	G250 N251 N256 M257 L297 F394 R441 F443	G250-V254 WeakPolarHBondContact O-CG2 3.26Å; G250-V254 PolarHBondContact O-N 2.97Å; N251-V254 PolarHBondContact O-N 2.79Å; N251-V254 VanDerWaalsContact O-N 3.15Å; V254-N256 PolarHBondContact O-N 2.92Å; V254-M257 WeakPolarHBondContact O-CA 3.19Å; V254-M257 WeakPolarHBondContact O-CE 3.34Å; V254-M257 PolarHBondContact O-N 2.56Å; V254-L297 HydrophobicContact CG2-CD1 4.41Å; V254-L297 HydrophobicContact CG2-CD2 4.02Å; V254-F394 HydrophobicContact CB-CD1 4.35Å; V254-F394 HydrophobicContact CB-CE1 4.18Å; V254-F394 HydrophobicContact CG1-CD1 4.26Å; V254-F394 HydrophobicContact CG1-CE1 4.28Å; V254-R441 WeakPolarHBondContact CG1-O 3.27Å; V254-R441 HydrophobicContact CG2-CB 3.83Å; V254-R441 HydrophobicContact CG2-CG 4.01Å; V254-F443 HydrophobicContact CG1-CD1 3.74Å; V254-F443 HydrophobicContact CG1-CE1 3.99Å
255	M	93.4	Very high	89.2	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-58.7	-29.8	173.6	-66.3	167.4	81.5	0	0	112	F226 N251 I252 C253 M257 I339 P392 F394 D446 R463	F226-M255 HydrophobicContact CE1-CB 4.32Å; F226-M255 HydrophobicContact CE1-CE 4.08Å; F226-M255 HydrophobicContact CE1-SD 4.19Å; F226-M255 HydrophobicContact CZ-CB 4.02Å; N251-M255 VanDerWaalsContact O-CG 3.29Å; N251-M255 WeakPolarHBondContact O-CG 3.35Å; N251-M255 PolarHBondContact O-N 3.06Å; I252-M255 PolarHBondContact O-N 2.88Å; C253-M255 PolarHBondContact O-N 2.81Å; M255-M257 PolarHBondContact O-N 3.22Å; M255-I339 HydrophobicContact CE-CD1 4.18Å; M255-I339 HydrophobicContact SD-CD1 4.44Å; M255-I339 HydrophobicContact SD-CG1 4.37Å; M255-P392 HydrophobicContact CE-CG 4.34Å; M255-F394 HydrophobicContact CG-CE1 3.91Å; M255-F394 HydrophobicContact CG-CZ 3.62Å; M255-F394 HydrophobicContact SD-CZ 3.85Å; M255-D446 VanDerWaalsContact CE-CG 3.45Å; M255-D446 VanDerWaalsContact CE-OD1 3.28Å; M255-D446 WeakPolarHBondContact CE-OD1 3.43Å; M255-D446 WeakPolarHBondContact CE-OD2 3.23Å; M255-R463 PolarHBondContact O-NH1 3.04Å
256	N	90.8	Very high	89	Confident	8 Å²	8	18.8 Å²	18.8	4%	0.043	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	27.3	171.3	-158	42.9	0	0	0	113.4	I252 C253 V254 N258 S259 D266	I252-N256 PolarHBondContact O-N 3.12Å; I252-N256 VanDerWaalsContact O-N 3.1Å; C253-N256 CarbonylContact O-C 3.5Å; C253-N256 WeakPolarHBondContact O-CA 3.49Å; C253-N256 PolarHBondContact O-N 3Å; C253-N256 VanDerWaalsContact O-N 3.08Å; V254-N256 PolarHBondContact O-N 2.92Å; N256-N258 PolarHBondContact O-N 3.44Å; N256-N258 VanDerWaalsContact O-N 3.15Å; N256-S259 WeakPolarHBondContact O-CB 3.48Å; N256-S259 PolarHBondContact O-N 3.36Å; N256-S259 PolarHBondContact O-OG 3.25Å; N256-D266 PolarHBondContact ND2-OD2 3.13Å
257	M	91.9	Very high	88.9	Confident	7 Å²	7	18.7 Å²	18.7	3%	0.034	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	25.1	177.4	-58.7	-67.3	90.4	0	0	115	V254 M255 S259 N417 N419 L420 F443 R463 Y492	V254-M257 WeakPolarHBondContact O-CA 3.19Å; V254-M257 WeakPolarHBondContact O-CE 3.34Å; V254-M257 PolarHBondContact O-N 2.56Å; M255-M257 PolarHBondContact O-N 3.22Å; M257-S259 PolarHBondContact O-N 3.26Å; M257-N417 PolarHBondContact O-ND2 3.32Å; M257-N419 HydrophobicContact CB-CB 4.27Å; M257-N419 HydrophobicContact CG-CB 3.99Å; M257-N419 HydrophobicContact SD-CB 3.77Å; M257-L420 WeakPolarHBondContact O-CA 3.45Å; M257-F443 HydrophobicContact CE-CE1 3.58Å; M257-F443 HydrophobicContact CE-CZ 3.43Å; M257-F443 VanDerWaalsContact CE-CZ 3.43Å; M257-R463 HydrophobicContact CE-CG 4.49Å; M257-Y492 HydrophobicContact CE-CD1 4.31Å; M257-Y492 HydrophobicContact CE-CD2 3.87Å; M257-Y492 HydrophobicContact CE-CE1 4.44Å; M257-Y492 HydrophobicContact CE-CE2 4.02Å; M257-Y492 HydrophobicContact CE-CG 4.01Å; M257-Y492 HydrophobicContact SD-CD2 3.44Å; M257-Y492 WeakPolarHBondContact SD-CD2 3.14Å; M257-Y492 HydrophobicContact SD-CE2 4.08Å; M257-Y492 HydrophobicContact SD-CG 3.73Å
258	N	92.1	Very high	88.8	Confident	2 Å²	2	18.5 Å²	18.5	1%	0.011	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	21.7	-173.8	-57.2	92.6	0	0	0	112.7	C253 N256 F298 L420 T439	C253-N258 PolarHBondContact O-N 2.82Å; N256-N258 PolarHBondContact O-N 3.44Å; N256-N258 VanDerWaalsContact O-N 3.15Å; N258-F298 HydrophobicContact CB-CE1 3.83Å; N258-F298 HydrophobicContact CB-CZ 4.04Å; N258-L420 HydrophobicContact CB-CD1 3.8Å; N258-L420 HydrophobicContact CB-CG 4.33Å; N258-T439 HydrophobicContact CB-CG2 3.87Å
259	S	89.2	Confident	88.5	Confident	17 Å²	17	20.3 Å²	20.3	12%	0.119	11%	0.109	C	C	.	.			trans	-74.6	141	-174.3	-68.2	0	0	0	0	110.4	N256 M257 C268 Q421	N256-S259 WeakPolarHBondContact O-CB 3.48Å; N256-S259 PolarHBondContact O-N 3.36Å; N256-S259 PolarHBondContact O-OG 3.25Å; M257-S259 PolarHBondContact O-N 3.26Å; S259-C268 WeakPolarHBondContact O-CB 3.44Å; S259-C268 PolarHBondContact O-SG 3.45Å; S259-Q421 CarbonylContact C-O 3.58Å; S259-Q421 VanDerWaalsContact CA-O 3.28Å; S259-Q421 WeakPolarHBondContact CA-O 3.36Å; S259-Q421 PolarHBondContact OG-N 2.89Å; S259-Q421 VanDerWaalsContact OG-N 3.15Å
260	Y	85.9	Confident	88.3	Confident	28 Å²	28	20.3 Å²	20.3	11%	0.11	11%	0.109	C	C	.	.	B	Isolated β-bridge	trans	-130.1	129.7	-174.6	-178.9	-89.8	0	0	0	110.4	F262 R269 Q272 Q421 H422 N423	Y260-F262 AromaticContact CE1-CD1 3.77Å; Y260-F262 HydrophobicContact CE1-CD1 3.77Å; Y260-F262 AromaticContact CE1-CD2 3.97Å; Y260-F262 HydrophobicContact CE1-CD2 3.97Å; Y260-F262 AromaticContact CE1-CE1 3.61Å; Y260-F262 HydrophobicContact CE1-CE1 3.61Å; Y260-F262 AromaticContact CE1-CE2 3.78Å; Y260-F262 HydrophobicContact CE1-CE2 3.78Å; Y260-F262 AromaticContact CE1-CG 3.94Å; Y260-F262 HydrophobicContact CE1-CG 3.94Å; Y260-F262 AromaticContact CE1-CZ 3.6Å; Y260-F262 HydrophobicContact CE1-CZ 3.6Å; Y260-F262 AromaticContact CZ-CD1 3.93Å; Y260-F262 AromaticContact CZ-CE1 3.72Å; Y260-F262 WeakPolarHBondContact OH-CD1 3.16Å; Y260-F262 WeakPolarHBondContact OH-CE1 3.49Å; Y260-R269 PolarHBondContact OH-NH1 2.94Å; Y260-Q272 HydrophobicContact CE2-CB 4Å; Y260-Q272 HydrophobicContact CE2-CG 3.9Å; Y260-Q421 PolarHBondContact N-O 3.36Å; Y260-H422 AromaticContact CD1-CE1 3.58Å; Y260-H422 AromaticContact CD1-ND1 3.66Å; Y260-H422 AromaticContact CE1-CE1 4Å; Y260-H422 CarbonylContact O-C 3.58Å; Y260-H422 WeakPolarHBondContact O-CA 3.19Å; Y260-N423 PolarHBondContact O-N 2.77Å
261	D	83.7	Confident	88.1	Confident	13 Å²	13	20.5 Å²	20.5	7%	0.07	11%	0.11	C	C	.	.			trans	-140.2	121.3	176.2	-179	-5.1	0	0	0	109.1	A263 T264 K424	D261-A263 PolarHBondContact O-N 3.46Å; D261-A263 WeakPolarHBondContact OD1-CB 3.48Å; D261-A263 PolarHBondContact OD1-N 3.31Å; D261-T264 WeakPolarHBondContact CB-OG1 3.31Å; D261-T264 PolarHBondContact O-N 3.49Å; D261-K424 WeakPolarHBondContact OD2-CE 2.82Å
262	F	78.9	Confident	87.8	Confident	122 Å²	122	21.3 Å²	21.3	54%	0.535	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.9	178.8	-72.8	-72.5	0	0	0	113.2	Y260 N423	Y260-F262 AromaticContact CE1-CD1 3.77Å; Y260-F262 HydrophobicContact CE1-CD1 3.77Å; Y260-F262 AromaticContact CE1-CD2 3.97Å; Y260-F262 HydrophobicContact CE1-CD2 3.97Å; Y260-F262 AromaticContact CE1-CE1 3.61Å; Y260-F262 HydrophobicContact CE1-CE1 3.61Å; Y260-F262 AromaticContact CE1-CE2 3.78Å; Y260-F262 HydrophobicContact CE1-CE2 3.78Å; Y260-F262 AromaticContact CE1-CG 3.94Å; Y260-F262 HydrophobicContact CE1-CG 3.94Å; Y260-F262 AromaticContact CE1-CZ 3.6Å; Y260-F262 HydrophobicContact CE1-CZ 3.6Å; Y260-F262 AromaticContact CZ-CD1 3.93Å; Y260-F262 AromaticContact CZ-CE1 3.72Å; Y260-F262 WeakPolarHBondContact OH-CD1 3.16Å; Y260-F262 WeakPolarHBondContact OH-CE1 3.49Å; F262-N423 WeakPolarHBondContact CD2-ND2 3.29Å; F262-N423 WeakPolarHBondContact CD2-OD1 3.43Å; F262-N423 WeakPolarHBondContact CE2-ND2 3.43Å; F262-N423 PolarHBondContact N-OD1 3.4Å
263	A	78.3	Confident	87.6	Confident	84 Å²	84	23.4 Å²	23.4	69%	0.694	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-16.4	-175.7	0	0	0	0	0	113.7	D261	D261-A263 PolarHBondContact O-N 3.46Å; D261-A263 WeakPolarHBondContact OD1-CB 3.48Å; D261-A263 PolarHBondContact OD1-N 3.31Å
264	T	78.3	Confident	87.3	Confident	24 Å²	24	23.6 Å²	23.6	15%	0.147	12%	0.124	C	C	.	.			trans	-123	128.6	-174.6	58	0	0	0	0	113	I209 R213 D261 D266 R269	I209-T264 HydrophobicContact CD1-CG2 4.01Å; R213-T264 PolarHBondContact NH2-OG1 2.95Å; D261-T264 WeakPolarHBondContact CB-OG1 3.31Å; D261-T264 PolarHBondContact O-N 3.49Å; T264-D266 VanDerWaalsContact C-N 3.31Å; T264-D266 PolarHBondContact O-N 2.79Å; T264-D266 VanDerWaalsContact O-N 3.08Å; T264-R269 WeakPolarHBondContact O-CB 3.42Å
265	F	79.2	Confident	87	Confident	66 Å²	66	25.3 Å²	25.3	29%	0.289	13%	0.131	S	C	.	.			trans	-83.8	74.8	173.3	-106.4	-89.8	0	0	0	110.7	P205 I209 R269 L270	P205-F265 HydrophobicContact CB-CD1 4.11Å; P205-F265 HydrophobicContact CB-CE1 3.85Å; P205-F265 HydrophobicContact CB-CZ 4.31Å; P205-F265 HydrophobicContact CG-CD1 4.06Å; P205-F265 HydrophobicContact CG-CE1 3.51Å; P205-F265 HydrophobicContact CG-CZ 4.18Å; I209-F265 PolarHBondContact N-O 3Å; F265-R269 HydrophobicContact CD1-CG 4.23Å; F265-R269 HydrophobicContact CD2-CG 4.36Å; F265-R269 HydrophobicContact CE1-CG 4.31Å; F265-R269 HydrophobicContact CE2-CG 4.46Å; F265-R269 HydrophobicContact CG-CG 4.26Å; F265-R269 HydrophobicContact CZ-CG 4.45Å; F265-L270 HydrophobicContact CD1-CD2 3.86Å; F265-L270 HydrophobicContact CD1-CG 4.25Å; F265-L270 HydrophobicContact CE1-CD2 4.15Å
266	D	84.4	Confident	86.7	Confident	7 Å²	7	29.1 Å²	29.1	4%	0.037	15%	0.149	C	C	.	.			trans	-96.9	-174.3	174.2	68.9	12.5	0	0	0	112.2	N256 T264 C268 R269 L270	N256-D266 PolarHBondContact ND2-OD2 3.13Å; T264-D266 VanDerWaalsContact C-N 3.31Å; T264-D266 PolarHBondContact O-N 2.79Å; T264-D266 VanDerWaalsContact O-N 3.08Å; D266-C268 VanDerWaalsContact C-N 3.35Å; D266-C268 PolarHBondContact O-N 2.94Å; D266-C268 PolarHBondContact OD1-N 3.1Å; D266-R269 PolarHBondContact O-N 2.89Å; D266-R269 PolarHBondContact OD1-N 3.04Å; D266-L270 WeakPolarHBondContact O-CD1 3.38Å; D266-L270 VanDerWaalsContact O-CG 3.3Å; D266-L270 WeakPolarHBondContact O-CG 3.32Å; D266-L270 PolarHBondContact O-N 2.92Å
267	A	88.4	Confident	86.4	Confident	2 Å²	2	32.9 Å²	32.9	2%	0.017	17%	0.169	C	C	.	.	H	α-helix	trans	-58	-41.5	-176.8	0	0	0	0	0	114.1	L230 I252 L270 F271	L230-A267 HydrophobicContact CD1-CB 3.69Å; L230-A267 HydrophobicContact CD2-CB 4.23Å; I252-A267 HydrophobicContact CB-CB 4.39Å; I252-A267 HydrophobicContact CG2-CB 3.61Å; A267-L270 PolarHBondContact O-N 3.19Å; A267-F271 PolarHBondContact O-N 3.11Å
268	C	90.1	Very high	85.8	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.007	17%	0.174	C	C	.	.	H	α-helix	trans	-76.6	-34.1	-178.7	-68.9	0	0	0	0	112.3	C253 S259 D266 L270 F271 Q272	C253-C268 VanDerWaalsContact C-SG 3.55Å; C253-C268 WeakPolarHBondContact CA-SG 3.13Å; C253-C268 HydrophobicContact CB-CB 4.06Å; C253-C268 WeakPolarHBondContact CB-SG 3.26Å; C253-C268 PolarHBondContact O-SG 2.82Å; C253-C268 WeakPolarHBondContact SG-CA 3.41Å; C253-C268 WeakPolarHBondContact SG-CB 3.42Å; C253-C268 CovalentContact SG-SG 2.05Å; C253-C268 PolarHBondContact SG-SG 2.68Å; S259-C268 WeakPolarHBondContact O-CB 3.44Å; S259-C268 PolarHBondContact O-SG 3.45Å; D266-C268 VanDerWaalsContact C-N 3.35Å; D266-C268 PolarHBondContact O-N 2.94Å; D266-C268 PolarHBondContact OD1-N 3.1Å; C268-L270 VanDerWaalsContact C-N 3.32Å; C268-F271 PolarHBondContact O-N 2.96Å; C268-Q272 WeakPolarHBondContact O-CB 3.44Å; C268-Q272 PolarHBondContact O-N 3.34Å
269	R	88.1	Confident	84.4	Confident	44 Å²	44	36.1 Å²	36.1	17%	0.166	20%	0.195	C	C	.	.	H	α-helix	trans	-63.7	-38.8	171.7	-177.3	62	177.6	165.7	8.5	111.8	Y260 T264 F265 D266 Q272 F273	Y260-R269 PolarHBondContact OH-NH1 2.94Å; T264-R269 WeakPolarHBondContact O-CB 3.42Å; F265-R269 HydrophobicContact CD1-CG 4.23Å; F265-R269 HydrophobicContact CD2-CG 4.36Å; F265-R269 HydrophobicContact CE1-CG 4.31Å; F265-R269 HydrophobicContact CE2-CG 4.46Å; F265-R269 HydrophobicContact CG-CG 4.26Å; F265-R269 HydrophobicContact CZ-CG 4.45Å; D266-R269 PolarHBondContact O-N 2.89Å; D266-R269 PolarHBondContact OD1-N 3.04Å; R269-Q272 PolarHBondContact O-N 3.39Å; R269-F273 VanDerWaalsContact O-CB 3.31Å; R269-F273 WeakPolarHBondContact O-CB 3.49Å; R269-F273 PolarHBondContact O-N 3.48Å
270	L	88.8	Confident	83.2	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.4	-43.6	174.4	-70.4	158.3	0	0	0	112	F204 P205 R208 L230 L249 F265 D266 A267 C268 F273 I274	F204-L270 HydrophobicContact CE1-CD2 4.3Å; F204-L270 HydrophobicContact CZ-CD2 4.12Å; P205-L270 HydrophobicContact CG-CD2 4.17Å; R208-L270 HydrophobicContact CG-CD1 3.92Å; R208-L270 HydrophobicContact CG-CD2 4.49Å; L230-L270 HydrophobicContact CD1-CD1 4.07Å; L230-L270 HydrophobicContact CD2-CD1 4.2Å; L230-L270 HydrophobicContact CG-CD1 4.12Å; L249-L270 HydrophobicContact CD1-CB 4.41Å; F265-L270 HydrophobicContact CD1-CD2 3.86Å; F265-L270 HydrophobicContact CD1-CG 4.25Å; F265-L270 HydrophobicContact CE1-CD2 4.15Å; D266-L270 WeakPolarHBondContact O-CD1 3.38Å; D266-L270 VanDerWaalsContact O-CG 3.3Å; D266-L270 WeakPolarHBondContact O-CG 3.32Å; D266-L270 PolarHBondContact O-N 2.92Å; A267-L270 PolarHBondContact O-N 3.19Å; C268-L270 VanDerWaalsContact C-N 3.32Å; L270-F273 PolarHBondContact O-N 2.91Å; L270-I274 WeakPolarHBondContact O-CG1 3.39Å; L270-I274 PolarHBondContact O-N 3.45Å
271	F	91	Very high	82.4	Confident	3 Å²	3	41.9 Å²	41.9	1%	0.013	25%	0.246	C	C	.	.	H	α-helix	trans	-57.4	-49.2	174.6	-179.1	-88.4	0	0	0	111.3	L249 C253 A267 C268 F273 I274 F275 L294 P295 L297 F298	L249-F271 HydrophobicContact CD2-CB 4.26Å; L249-F271 HydrophobicContact CD2-CD2 4.23Å; L249-F271 HydrophobicContact CG-CB 4.27Å; L249-F271 HydrophobicContact CG-CD2 4.19Å; C253-F271 HydrophobicContact CB-CB 4.47Å; A267-F271 PolarHBondContact O-N 3.11Å; C268-F271 PolarHBondContact O-N 2.96Å; F271-F273 PolarHBondContact O-N 2.96Å; F271-I274 PolarHBondContact O-N 3.07Å; F271-F275 PolarHBondContact O-N 3.48Å; F271-L294 HydrophobicContact CD2-CD1 4.15Å; F271-L294 HydrophobicContact CE2-CD1 3.58Å; F271-L294 HydrophobicContact CE2-CD2 4.29Å; F271-L294 HydrophobicContact CE2-CG 3.78Å; F271-L294 HydrophobicContact CZ-CD1 4.16Å; F271-L294 HydrophobicContact CZ-CD2 4.05Å; F271-L294 HydrophobicContact CZ-CG 3.84Å; F271-P295 HydrophobicContact CE2-CG 3.83Å; F271-P295 HydrophobicContact CZ-CG 4.31Å; F271-P295 VanDerWaalsContact CZ-O 3.31Å; F271-P295 WeakPolarHBondContact CZ-O 3.39Å; F271-L297 HydrophobicContact CD1-CD1 4.22Å; F271-L297 HydrophobicContact CD2-CD1 4.12Å; F271-L297 HydrophobicContact CE1-CB 4.29Å; F271-L297 HydrophobicContact CE1-CD1 3.92Å; F271-L297 HydrophobicContact CE1-CG 4.24Å; F271-L297 HydrophobicContact CE2-CD1 3.81Å; F271-L297 HydrophobicContact CE2-CG 4.31Å; F271-L297 HydrophobicContact CG-CD1 4.32Å; F271-L297 HydrophobicContact CZ-CB 4.35Å; F271-L297 HydrophobicContact CZ-CD1 3.71Å; F271-L297 HydrophobicContact CZ-CG 3.88Å; F271-F298 HydrophobicContact CD1-CE2 4.12Å; F271-F298 HydrophobicContact CE1-CD2 4.32Å; F271-F298 HydrophobicContact CE1-CE2 4.22Å
272	Q	89.3	Confident	82.1	Confident	18 Å²	18	45.1 Å²	45.1	8%	0.084	27%	0.27	C	S	.	.	H	α-helix	trans	-64	-41.2	178.4	-175.5	64.6	16.3	0	0	112.3	Y260 C268 R269 I274 F275 E276	Y260-Q272 HydrophobicContact CE2-CB 4Å; Y260-Q272 HydrophobicContact CE2-CG 3.9Å; C268-Q272 WeakPolarHBondContact O-CB 3.44Å; C268-Q272 PolarHBondContact O-N 3.34Å; R269-Q272 PolarHBondContact O-N 3.39Å; Q272-I274 VanDerWaalsContact C-N 3.31Å; Q272-I274 PolarHBondContact O-N 2.93Å; Q272-F275 WeakPolarHBondContact O-CB 3.28Å; Q272-F275 PolarHBondContact O-N 3.35Å; Q272-E276 HydrophobicContact CG-CG 4.39Å; Q272-E276 VanDerWaalsContact CG-OE1 3.27Å; Q272-E276 WeakPolarHBondContact CG-OE1 3.31Å; Q272-E276 PolarHBondContact NE2-OE1 3.1Å; Q272-E276 WeakPolarHBondContact O-CG 3.5Å; Q272-E276 PolarHBondContact O-N 3.5Å
273	F	88.1	Confident	82.3	Confident	45 Å²	45	42.2 Å²	42.2	20%	0.197	26%	0.262	C	S	.	.	H	α-helix	trans	-58	-43.8	175.6	175.2	-94.2	0	0	0	111.6	R269 L270 F271 N277	R269-F273 VanDerWaalsContact O-CB 3.31Å; R269-F273 WeakPolarHBondContact O-CB 3.49Å; R269-F273 PolarHBondContact O-N 3.48Å; L270-F273 PolarHBondContact O-N 2.91Å; F271-F273 PolarHBondContact O-N 2.96Å; F273-N277 WeakPolarHBondContact CD2-ND2 3.43Å; F273-N277 VanDerWaalsContact CE2-ND2 3.32Å; F273-N277 WeakPolarHBondContact CE2-ND2 3.5Å; F273-N277 WeakPolarHBondContact O-CB 3.34Å; F273-N277 PolarHBondContact O-N 3.32Å; F273-N277 VanDerWaalsContact O-N 3.14Å; F273-N277 PolarHBondContact O-ND2 3.41Å
274	I	88.9	Confident	82.6	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.015	23%	0.23	C	C	.	.	H	α-helix	trans	-66.3	-43.5	175.9	-66.9	174.1	0	0	0	110.4	A234 C237 W238 L249 L270 F271 Q272 E276 N277 T278 L294	A234-I274 HydrophobicContact CB-CD1 4.44Å; A234-I274 WeakPolarHBondContact O-CD1 3.36Å; C237-I274 HydrophobicContact CB-CD1 4.22Å; W238-I274 HydrophobicContact CB-CD1 4.01Å; W238-I274 HydrophobicContact CB-CG1 4.17Å; W238-I274 HydrophobicContact CE3-CB 4.36Å; W238-I274 HydrophobicContact CE3-CG1 4.04Å; W238-I274 HydrophobicContact CE3-CG2 4.17Å; L249-I274 HydrophobicContact CD2-CD1 3.61Å; L270-I274 WeakPolarHBondContact O-CG1 3.39Å; L270-I274 PolarHBondContact O-N 3.45Å; F271-I274 PolarHBondContact O-N 3.07Å; Q272-I274 VanDerWaalsContact C-N 3.31Å; Q272-I274 PolarHBondContact O-N 2.93Å; I274-E276 PolarHBondContact O-N 3.49Å; I274-N277 PolarHBondContact O-N 3.37Å; I274-T278 HydrophobicContact CG2-CG2 4.22Å; I274-T278 WeakPolarHBondContact O-CB 3.45Å; I274-T278 VanDerWaalsContact O-CG2 3.31Å; I274-T278 WeakPolarHBondContact O-CG2 3.36Å; I274-T278 PolarHBondContact O-N 3.07Å; I274-T278 PolarHBondContact O-OG1 3.29Å; I274-L294 HydrophobicContact CG2-CD1 4.24Å
275	F	88.5	Confident	82.9	Confident	36 Å²	36	40.5 Å²	40.5	16%	0.158	24%	0.238	C	C	.	.	H	α-helix	trans	-57.4	-46.8	177.6	-180	-90.1	0	0	0	112.6	F271 Q272 T278 F289 R291 L294	F271-F275 PolarHBondContact O-N 3.48Å; Q272-F275 WeakPolarHBondContact O-CB 3.28Å; Q272-F275 PolarHBondContact O-N 3.35Å; F275-T278 PolarHBondContact O-N 2.94Å; F275-T278 PolarHBondContact O-OG1 3.49Å; F275-F289 WeakPolarHBondContact CE2-O 3.41Å; F275-R291 HydrophobicContact CD2-CG 3.83Å; F275-R291 HydrophobicContact CE2-CG 3.62Å; F275-R291 HydrophobicContact CZ-CG 4.43Å; F275-L294 HydrophobicContact CB-CD2 3.83Å; F275-L294 HydrophobicContact CD2-CD2 3.83Å; F275-L294 HydrophobicContact CG-CD2 4.33Å
276	E	86.9	Confident	83.2	Confident	82 Å²	82	42.3 Å²	42.3	38%	0.383	26%	0.259	S	S	.	.	H	α-helix	trans	-65.9	-43.6	180	-73	169.4	-170.6	0	0	112	Q272 I274 T278 A279	Q272-E276 HydrophobicContact CG-CG 4.39Å; Q272-E276 VanDerWaalsContact CG-OE1 3.27Å; Q272-E276 WeakPolarHBondContact CG-OE1 3.31Å; Q272-E276 PolarHBondContact NE2-OE1 3.1Å; Q272-E276 WeakPolarHBondContact O-CG 3.5Å; Q272-E276 PolarHBondContact O-N 3.5Å; I274-E276 PolarHBondContact O-N 3.49Å; E276-T278 VanDerWaalsContact C-N 3.28Å; E276-T278 PolarHBondContact O-N 3.34Å; E276-A279 VanDerWaalsContact O-CB 3.26Å; E276-A279 WeakPolarHBondContact O-CB 3.48Å; E276-A279 PolarHBondContact O-N 2.98Å
277	N	84.1	Confident	83.2	Confident	87 Å²	87	42 Å²	42	47%	0.465	26%	0.257	S	S	.	.	H	α-helix	trans	-79.4	-9.9	-178.7	-71	-80.5	0	0	0	113.7	W238 F273 I274	W238-N277 HydrophobicContact CH2-CB 3.33Å; W238-N277 HydrophobicContact CZ2-CB 4.45Å; W238-N277 HydrophobicContact CZ3-CB 3.37Å; F273-N277 WeakPolarHBondContact CD2-ND2 3.43Å; F273-N277 VanDerWaalsContact CE2-ND2 3.32Å; F273-N277 WeakPolarHBondContact CE2-ND2 3.5Å; F273-N277 WeakPolarHBondContact O-CB 3.34Å; F273-N277 PolarHBondContact O-N 3.32Å; F273-N277 VanDerWaalsContact O-N 3.14Å; F273-N277 PolarHBondContact O-ND2 3.41Å; I274-N277 PolarHBondContact O-N 3.37Å
278	T	78.8	Confident	83	Confident	23 Å²	23	44 Å²	44	14%	0.141	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	14.2	171.7	53.2	0	0	0	0	113	W238 I274 F275 E276 G280 L281	W238-T278 HydrophobicContact CE3-CG2 4.49Å; W238-T278 HydrophobicContact CZ3-CG2 4.06Å; I274-T278 HydrophobicContact CG2-CG2 4.22Å; I274-T278 WeakPolarHBondContact O-CB 3.45Å; I274-T278 VanDerWaalsContact O-CG2 3.31Å; I274-T278 WeakPolarHBondContact O-CG2 3.36Å; I274-T278 PolarHBondContact O-N 3.07Å; I274-T278 PolarHBondContact O-OG1 3.29Å; F275-T278 PolarHBondContact O-N 2.94Å; F275-T278 PolarHBondContact O-OG1 3.49Å; E276-T278 VanDerWaalsContact C-N 3.28Å; E276-T278 PolarHBondContact O-N 3.34Å; T278-G280 PolarHBondContact O-N 3.1Å; T278-L281 HydrophobicContact CG2-CD1 3.94Å; T278-L281 WeakPolarHBondContact O-CB 3.36Å; T278-L281 PolarHBondContact O-N 3.28Å
279	A	63.8	Low	82.8	Confident	54 Å²	54	45.7 Å²	45.7	45%	0.446	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.7	-178.5	0	0	0	0	0	115	E276 L281 R291	E276-A279 VanDerWaalsContact O-CB 3.26Å; E276-A279 WeakPolarHBondContact O-CB 3.48Å; E276-A279 PolarHBondContact O-N 2.98Å; A279-L281 VanDerWaalsContact C-N 3.33Å; A279-R291 PolarHBondContact O-NH1 3.14Å
280	G	63.4	Low	82.8	Confident	85 Å²	85	43.9 Å²	43.9	88%	0.876	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-8.3	174.7	0	0	0	0	0	115.3	T278	T278-G280 PolarHBondContact O-N 3.1Å
281	L	70.1	Confident	82.7	Confident	81 Å²	81	45.6 Å²	45.6	42%	0.424	28%	0.278	S	S	.	.	S	Bend	trans	-77.7	150.9	172.9	-65	177.1	0	0	0	111.1	T278 A279 R291	T278-L281 HydrophobicContact CG2-CD1 3.94Å; T278-L281 WeakPolarHBondContact O-CB 3.36Å; T278-L281 PolarHBondContact O-N 3.28Å; A279-L281 VanDerWaalsContact C-N 3.33Å; L281-R291 PolarHBondContact O-NH1 3.42Å
282	S	76.9	Confident	82.3	Confident	81 Å²	81	48.1 Å²	48.1	57%	0.566	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-58.3	144.3	176.9	52.6	0	0	0	0	112	Q292	S282-Q292 PolarHBondContact O-N 3.13Å
283	T	84	Confident	81.9	Confident	60 Å²	60	49 Å²	49	37%	0.368	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	146.3	172	51.5	0	0	0	0	110.6	I287 W290	T283-I287 WeakPolarHBondContact CB-O 3.28Å; T283-W290 WeakPolarHBondContact CA-O 3.37Å
284	V	83.9	Confident	81.9	Confident	6 Å²	6	47.1 Å²	47.1	4%	0.036	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	133.2	178.3	178.3	0	0	0	0	109.2	A59 S286 I287 W290	A59-V284 HydrophobicContact CB-CG1 3.88Å; V284-S286 PolarHBondContact O-N 2.95Å; V284-I287 WeakPolarHBondContact O-CB 3.46Å; V284-I287 PolarHBondContact O-N 3.2Å; V284-W290 HydrophobicContact CB-CB 4.19Å; V284-W290 HydrophobicContact CB-CD2 3.77Å; V284-W290 HydrophobicContact CB-CE3 4.16Å; V284-W290 HydrophobicContact CB-CG 3.77Å; V284-W290 HydrophobicContact CG1-CD2 3.78Å; V284-W290 HydrophobicContact CG1-CE3 3.87Å; V284-W290 HydrophobicContact CG1-CG 4.31Å; V284-W290 HydrophobicContact CG1-CH2 4.13Å; V284-W290 HydrophobicContact CG1-CZ2 4.06Å; V284-W290 HydrophobicContact CG1-CZ3 4.05Å; V284-W290 HydrophobicContact CG2-CD2 4.46Å; V284-W290 HydrophobicContact CG2-CG 4.21Å; V284-W290 PolarHBondContact N-O 2.64Å
285	H	84.9	Confident	82	Confident	67 Å²	67	47.2 Å²	47.2	31%	0.31	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	30	-179.6	-61.9	-59.2	0	0	0	114.6	F41 A59 I287 W290	F41-H285 HydrophobicContact CB-CB 4.18Å; F41-H285 AromaticContact CD2-CD2 3.93Å; F41-H285 AromaticContact CD2-NE2 3.85Å; F41-H285 AromaticContact CG-CD2 3.83Å; A59-H285 PolarHBondContact O-NE2 3.49Å; H285-I287 HydrophobicContact CB-CD1 4.29Å; H285-I287 PolarHBondContact O-N 3.35Å; H285-W290 AromaticContact CD2-CZ3 3.76Å
286	S	83.9	Confident	82.2	Confident	104 Å²	104	45.5 Å²	45.5	73%	0.727	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	19.2	-174.5	-54.1	0	0	0	0	115.1	Q37 V284	Q37-S286 PolarHBondContact NE2-O 3.08Å; V284-S286 PolarHBondContact O-N 2.95Å
287	I	85.3	Confident	82.4	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	115	175	-62.4	166.5	0	0	0	108.8	F39 F41 T283 V284 H285 F289 W290 W296	F39-I287 HydrophobicContact CD1-CG2 4.3Å; F39-I287 HydrophobicContact CE1-CG2 4.4Å; F41-I287 HydrophobicContact CD1-CD1 4.49Å; T283-I287 WeakPolarHBondContact CB-O 3.28Å; V284-I287 WeakPolarHBondContact O-CB 3.46Å; V284-I287 PolarHBondContact O-N 3.2Å; H285-I287 HydrophobicContact CB-CD1 4.29Å; H285-I287 PolarHBondContact O-N 3.35Å; I287-F289 HydrophobicContact CG2-CB 4.4Å; I287-F289 PolarHBondContact O-N 3.1Å; I287-F289 VanDerWaalsContact O-N 3.17Å; I287-W290 HydrophobicContact CB-CB 4.12Å; I287-W290 HydrophobicContact CD1-CE3 3.97Å; I287-W290 HydrophobicContact CD1-CZ3 4.42Å; I287-W290 HydrophobicContact CG2-CB 4.04Å; I287-W290 PolarHBondContact O-N 3.36Å; I287-W290 VanDerWaalsContact O-N 3.08Å; I287-W296 HydrophobicContact CD1-CZ3 4.15Å; I287-W296 HydrophobicContact CG2-CD2 4.44Å; I287-W296 HydrophobicContact CG2-CZ2 4.39Å
288	S	83.6	Confident	82.8	Confident	42 Å²	42	39.1 Å²	39.1	29%	0.294	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	-26.6	-176.1	47.7	0	0	0	0	113.6	Q37	Q37-S288 PolarHBondContact NE2-OG 2.68Å; Q37-S288 PolarHBondContact OE1-OG 2.96Å
289	F	85.9	Confident	83.2	Confident	38 Å²	38	38.3 Å²	38.3	17%	0.167	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	0.9	-178.8	-47.3	-58.3	0	0	0	113.6	F39 F275 I287 W296 F298 G300	F39-F289 HydrophobicContact CE1-CD2 4.22Å; F39-F289 HydrophobicContact CE1-CE2 4.31Å; F39-F289 HydrophobicContact CZ-CE2 4.42Å; F275-F289 WeakPolarHBondContact CE2-O 3.41Å; I287-F289 HydrophobicContact CG2-CB 4.4Å; I287-F289 PolarHBondContact O-N 3.1Å; I287-F289 VanDerWaalsContact O-N 3.17Å; F289-W296 VanDerWaalsContact O-CD1 3.31Å; F289-F298 WeakPolarHBondContact CB-O 3.39Å; F289-G300 VanDerWaalsContact CE1-CA 3.43Å
290	W	88.6	Confident	84	Confident	5 Å²	5	36.2 Å²	36.2	2%	0.019	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	108.3	-179.2	-162.7	-5.5	0	0	0	110.6	F41 S58 L60 T283 V284 H285 I287 W296	F41-W290 HydrophobicContact CD1-CZ3 4.32Å; F41-W290 HydrophobicContact CE1-CH2 4.46Å; F41-W290 AromaticContact CE1-CZ3 3.86Å; F41-W290 HydrophobicContact CE1-CZ3 3.86Å; F41-W290 HydrophobicContact CE2-CH2 4.35Å; F41-W290 HydrophobicContact CE2-CZ3 4.42Å; F41-W290 HydrophobicContact CZ-CH2 4.04Å; F41-W290 AromaticContact CZ-CZ3 3.92Å; F41-W290 HydrophobicContact CZ-CZ3 3.92Å; S58-W290 WeakPolarHBondContact O-CZ2 3.33Å; S58-W290 PolarHBondContact O-NE1 3.41Å; S58-W290 VanDerWaalsContact O-NE1 3.09Å; L60-W290 HydrophobicContact CB-CH2 4.41Å; L60-W290 HydrophobicContact CD1-CH2 3.93Å; L60-W290 HydrophobicContact CD1-CZ2 4.3Å; L60-W290 HydrophobicContact CG-CH2 4.13Å; L60-W290 HydrophobicContact CG-CZ2 4.27Å; T283-W290 WeakPolarHBondContact CA-O 3.37Å; V284-W290 HydrophobicContact CB-CB 4.19Å; V284-W290 HydrophobicContact CB-CD2 3.77Å; V284-W290 HydrophobicContact CB-CE3 4.16Å; V284-W290 HydrophobicContact CB-CG 3.77Å; V284-W290 HydrophobicContact CG1-CD2 3.78Å; V284-W290 HydrophobicContact CG1-CE3 3.87Å; V284-W290 HydrophobicContact CG1-CG 4.31Å; V284-W290 HydrophobicContact CG1-CH2 4.13Å; V284-W290 HydrophobicContact CG1-CZ2 4.06Å; V284-W290 HydrophobicContact CG1-CZ3 4.05Å; V284-W290 HydrophobicContact CG2-CD2 4.46Å; V284-W290 HydrophobicContact CG2-CG 4.21Å; V284-W290 PolarHBondContact N-O 2.64Å; H285-W290 AromaticContact CD2-CZ3 3.76Å; I287-W290 HydrophobicContact CB-CB 4.12Å; I287-W290 HydrophobicContact CD1-CE3 3.97Å; I287-W290 HydrophobicContact CD1-CZ3 4.42Å; I287-W290 HydrophobicContact CG2-CB 4.04Å; I287-W290 PolarHBondContact O-N 3.36Å; I287-W290 VanDerWaalsContact O-N 3.08Å; W290-W296 HydrophobicContact CB-CB 3.9Å; W290-W296 HydrophobicContact CB-CG 4.25Å; W290-W296 HydrophobicContact CD2-CB 4.1Å; W290-W296 HydrophobicContact CE3-CE3 4.1Å; W290-W296 HydrophobicContact CG-CB 3.7Å; W290-W296 HydrophobicContact CG-CG 4.47Å
291	R	87.3	Confident	84.2	Confident	36 Å²	36	36.8 Å²	36.8	14%	0.136	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	148.9	178.9	-54.8	-61	178.4	166.2	-0.6	110.4	F275 A279 L281 N293 L294	F275-R291 HydrophobicContact CD2-CG 3.83Å; F275-R291 HydrophobicContact CE2-CG 3.62Å; F275-R291 HydrophobicContact CZ-CG 4.43Å; A279-R291 PolarHBondContact O-NH1 3.14Å; L281-R291 PolarHBondContact O-NH1 3.42Å; R291-N293 PolarHBondContact O-N 3.39Å; R291-L294 HydrophobicContact CB-CB 4.18Å; R291-L294 PolarHBondContact O-N 2.69Å
292	Q	81.4	Confident	84.3	Confident	56 Å²	56	39.2 Å²	39.2	26%	0.262	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	135.4	172.7	-163.7	69.8	27.7	0	0	110.2	D56 S58 S282 L294	D56-Q292 PolarHBondContact OD2-NE2 3.09Å; S58-Q292 PolarHBondContact OG-NE2 3.08Å; S282-Q292 PolarHBondContact O-N 3.13Å; Q292-L294 PolarHBondContact O-N 3.45Å
293	N	81.9	Confident	84.2	Confident	38 Å²	38	39.8 Å²	39.8	20%	0.203	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	-6.9	-178.3	-57.4	-18.4	0	0	0	117.6	A241 C246 R291	A241-N293 PolarHBondContact O-ND2 3.15Å; C246-N293 WeakPolarHBondContact CB-O 3.3Å; R291-N293 PolarHBondContact O-N 3.39Å
294	L	88.4	Confident	83.9	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.026	21%	0.211	C	C	.	.	S	Bend	trans	-111.3	130.3	177.9	-167.4	73	0	0	0	110.1	C246 F271 I274 F275 R291 Q292	C246-L294 HydrophobicContact CB-CD1 3.99Å; F271-L294 HydrophobicContact CD2-CD1 4.15Å; F271-L294 HydrophobicContact CE2-CD1 3.58Å; F271-L294 HydrophobicContact CE2-CD2 4.29Å; F271-L294 HydrophobicContact CE2-CG 3.78Å; F271-L294 HydrophobicContact CZ-CD1 4.16Å; F271-L294 HydrophobicContact CZ-CD2 4.05Å; F271-L294 HydrophobicContact CZ-CG 3.84Å; I274-L294 HydrophobicContact CG2-CD1 4.24Å; F275-L294 HydrophobicContact CB-CD2 3.83Å; F275-L294 HydrophobicContact CD2-CD2 3.83Å; F275-L294 HydrophobicContact CG-CD2 4.33Å; R291-L294 HydrophobicContact CB-CB 4.18Å; R291-L294 PolarHBondContact O-N 2.69Å; Q292-L294 PolarHBondContact O-N 3.45Å
295	P	91.3	Very high	83.9	Confident	4 Å²	4	40.2 Å²	40.2	3%	0.026	22%	0.221	C	C	.	.			trans	-63.7	145.5	-179.4	23.8	-32.4	0	0	0	112.3	F271 L297	F271-P295 HydrophobicContact CE2-CG 3.83Å; F271-P295 HydrophobicContact CZ-CG 4.31Å; F271-P295 VanDerWaalsContact CZ-O 3.31Å; F271-P295 WeakPolarHBondContact CZ-O 3.39Å; P295-L297 HydrophobicContact CB-CD2 4.35Å; P295-L297 HydrophobicContact CG-CG 4.47Å; P295-L297 PolarHBondContact O-N 2.84Å
296	W	91.4	Very high	83.9	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.207	C	C	.	.			trans	-80.3	110	169.9	174.8	29.2	0	0	0	110.4	F39 I287 F289 W290 F298 Y299 A412 R440	F39-W296 HydrophobicContact CB-CH2 4.03Å; F39-W296 AromaticContact CD1-CH2 3.53Å; F39-W296 HydrophobicContact CD1-CH2 3.53Å; F39-W296 AromaticContact CD1-CZ2 3.78Å; F39-W296 HydrophobicContact CD1-CZ2 3.78Å; F39-W296 HydrophobicContact CE1-CH2 4.31Å; F39-W296 HydrophobicContact CE1-CZ2 4.1Å; F39-W296 HydrophobicContact CG-CH2 4.01Å; I287-W296 HydrophobicContact CD1-CZ3 4.15Å; I287-W296 HydrophobicContact CG2-CD2 4.44Å; I287-W296 HydrophobicContact CG2-CZ2 4.39Å; F289-W296 VanDerWaalsContact O-CD1 3.31Å; W290-W296 HydrophobicContact CB-CB 3.9Å; W290-W296 HydrophobicContact CB-CG 4.25Å; W290-W296 HydrophobicContact CD2-CB 4.1Å; W290-W296 HydrophobicContact CE3-CE3 4.1Å; W290-W296 HydrophobicContact CG-CB 3.7Å; W290-W296 HydrophobicContact CG-CG 4.47Å; W296-F298 VanDerWaalsContact CD1-O 3.24Å; W296-F298 PolarHBondContact NE1-O 2.91Å; W296-Y299 HydrophobicContact CH2-CD1 4.19Å; W296-Y299 AromaticContact CH2-CE1 3.46Å; W296-Y299 HydrophobicContact CH2-CE1 3.46Å; W296-Y299 VanDerWaalsContact CH2-CE1 3.46Å; W296-Y299 HydrophobicContact CH2-CE2 4.43Å; W296-Y299 AromaticContact CH2-CZ 3.59Å; W296-Y299 AromaticContact CZ2-CD1 3.5Å; W296-Y299 HydrophobicContact CZ2-CD1 3.5Å; W296-Y299 HydrophobicContact CZ2-CD2 4.17Å; W296-Y299 AromaticContact CZ2-CE1 3.22Å; W296-Y299 HydrophobicContact CZ2-CE1 3.22Å; W296-Y299 AromaticContact CZ2-CE2 3.92Å; W296-Y299 HydrophobicContact CZ2-CE2 3.92Å; W296-Y299 AromaticContact CZ2-CG 3.98Å; W296-Y299 HydrophobicContact CZ2-CG 3.98Å; W296-Y299 AromaticContact CZ2-CZ 3.44Å; W296-Y299 VanDerWaalsContact CZ2-CZ 3.44Å; W296-A412 HydrophobicContact CH2-CB 3.78Å; W296-A412 HydrophobicContact CZ3-CB 3.54Å; W296-R440 VanDerWaalsContact CE3-CZ 3.49Å; W296-R440 VanDerWaalsContact CE3-NH2 3.34Å; W296-R440 WeakPolarHBondContact O-CD 3.4Å
297	L	92.2	Very high	84	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	19%	0.185	C	C	.	.			trans	-109	-29.2	-178.3	-64.8	-174.7	0	0	0	114.9	C253 V254 F271 P295 T439 R440 R441	C253-L297 HydrophobicContact CB-CD1 4.44Å; V254-L297 HydrophobicContact CG2-CD1 4.41Å; V254-L297 HydrophobicContact CG2-CD2 4.02Å; F271-L297 HydrophobicContact CD1-CD1 4.22Å; F271-L297 HydrophobicContact CD2-CD1 4.12Å; F271-L297 HydrophobicContact CE1-CB 4.29Å; F271-L297 HydrophobicContact CE1-CD1 3.92Å; F271-L297 HydrophobicContact CE1-CG 4.24Å; F271-L297 HydrophobicContact CE2-CD1 3.81Å; F271-L297 HydrophobicContact CE2-CG 4.31Å; F271-L297 HydrophobicContact CG-CD1 4.32Å; F271-L297 HydrophobicContact CZ-CB 4.35Å; F271-L297 HydrophobicContact CZ-CD1 3.71Å; F271-L297 HydrophobicContact CZ-CG 3.88Å; P295-L297 HydrophobicContact CB-CD2 4.35Å; P295-L297 HydrophobicContact CG-CG 4.47Å; P295-L297 PolarHBondContact O-N 2.84Å; L297-T439 CarbonylContact O-C 3.6Å; L297-T439 WeakPolarHBondContact O-CA 3.33Å; L297-R440 PolarHBondContact O-N 3.28Å; L297-R440 VanDerWaalsContact O-N 3.09Å; L297-R441 HydrophobicContact CD2-CB 3.77Å
298	F	91.5	Very high	84	Confident	34 Å²	34	40 Å²	40	15%	0.149	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-126.7	142.2	-171.6	-58.9	-85.7	0	0	0	111.1	N258 F271 F289 W296 G300 T439	N258-F298 HydrophobicContact CB-CE1 3.83Å; N258-F298 HydrophobicContact CB-CZ 4.04Å; F271-F298 HydrophobicContact CD1-CE2 4.12Å; F271-F298 HydrophobicContact CE1-CD2 4.32Å; F271-F298 HydrophobicContact CE1-CE2 4.22Å; F289-F298 WeakPolarHBondContact CB-O 3.39Å; W296-F298 VanDerWaalsContact CD1-O 3.24Å; W296-F298 PolarHBondContact NE1-O 2.91Å; F298-G300 PolarHBondContact O-N 2.81Å; F298-G300 VanDerWaalsContact O-N 3.16Å; F298-T439 HydrophobicContact CD1-CG2 4.09Å; F298-T439 HydrophobicContact CE1-CG2 4.19Å
299	Y	88.4	Confident	84.1	Confident	6 Å²	6	38.3 Å²	38.3	2%	0.024	20%	0.2	C	C	.	.	S	Bend	trans	-84.1	31	172.9	-72.7	-105.1	0	0	0	112.5	F39 W296 V309 A412 P414 L438 T439 R440	F39-Y299 HydrophobicContact CD1-CD1 4.43Å; F39-Y299 HydrophobicContact CD1-CE1 4.24Å; F39-Y299 HydrophobicContact CD2-CD1 4.46Å; F39-Y299 HydrophobicContact CD2-CE1 4.19Å; F39-Y299 HydrophobicContact CE1-CD1 4.18Å; F39-Y299 HydrophobicContact CE1-CE1 4.44Å; F39-Y299 HydrophobicContact CE2-CD1 4.21Å; F39-Y299 HydrophobicContact CE2-CE1 4.4Å; F39-Y299 HydrophobicContact CG-CE1 4.11Å; F39-Y299 HydrophobicContact CZ-CD1 4.06Å; W296-Y299 HydrophobicContact CH2-CD1 4.19Å; W296-Y299 AromaticContact CH2-CE1 3.46Å; W296-Y299 HydrophobicContact CH2-CE1 3.46Å; W296-Y299 VanDerWaalsContact CH2-CE1 3.46Å; W296-Y299 HydrophobicContact CH2-CE2 4.43Å; W296-Y299 AromaticContact CH2-CZ 3.59Å; W296-Y299 AromaticContact CZ2-CD1 3.5Å; W296-Y299 HydrophobicContact CZ2-CD1 3.5Å; W296-Y299 HydrophobicContact CZ2-CD2 4.17Å; W296-Y299 AromaticContact CZ2-CE1 3.22Å; W296-Y299 HydrophobicContact CZ2-CE1 3.22Å; W296-Y299 AromaticContact CZ2-CE2 3.92Å; W296-Y299 HydrophobicContact CZ2-CE2 3.92Å; W296-Y299 AromaticContact CZ2-CG 3.98Å; W296-Y299 HydrophobicContact CZ2-CG 3.98Å; W296-Y299 AromaticContact CZ2-CZ 3.44Å; W296-Y299 VanDerWaalsContact CZ2-CZ 3.44Å; Y299-V309 HydrophobicContact CD1-CB 4.37Å; Y299-V309 HydrophobicContact CD1-CG1 3.53Å; Y299-V309 HydrophobicContact CD1-CG2 3.85Å; Y299-V309 HydrophobicContact CE1-CG1 3.71Å; Y299-V309 HydrophobicContact CG-CG1 4.31Å; Y299-V309 HydrophobicContact CG-CG2 4.34Å; Y299-A412 WeakPolarHBondContact OH-CB 3.39Å; Y299-P414 HydrophobicContact CE1-CB 4.47Å; Y299-P414 HydrophobicContact CE2-CB 3.97Å; Y299-L438 HydrophobicContact CD2-CB 3.9Å; Y299-L438 HydrophobicContact CG-CB 4.2Å; Y299-L438 PolarHBondContact N-O 3.17Å; Y299-L438 VanDerWaalsContact N-O 3.09Å; Y299-T439 WeakPolarHBondContact CE2-O 3.32Å; Y299-R440 HydrophobicContact CE2-CB 4.3Å
300	G	79.9	Confident	84.2	Confident	11 Å²	11	37.9 Å²	37.9	11%	0.113	20%	0.2	C	C	.	.			trans	120.3	169.2	-174.9	0	0	0	0	0	113.6	F289 F298	F289-G300 VanDerWaalsContact CE1-CA 3.43Å; F298-G300 PolarHBondContact O-N 2.81Å; F298-G300 VanDerWaalsContact O-N 3.16Å
301	D	67.4	Low	83.8	Confident	96 Å²	96	40.6 Å²	40.6	51%	0.513	22%	0.219	S	C	.	.	S	Bend	trans	-106.6	-9.5	-177.5	59.8	-19.5	0	0	0	113.1
302	Q	71.4	Confident	82.9	Confident	133 Å²	133	41.6 Å²	41.6	62%	0.621	23%	0.232	S	C	*	.	S	Bend	trans	-100.5	138.4	-179.5	-63.9	-176.7	-4.3	0	0	112.3	L305	Q302-L305 HydrophobicContact CB-CD1 4.35Å
303	L	76.7	Confident	82.5	Confident	92 Å²	92	40.1 Å²	40.1	48%	0.482	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	141.2	167.7	-58.5	171.4	0	0	0	109.4	V427 K435 L437	L303-V427 HydrophobicContact CD2-CG1 4.35Å; L303-K435 VanDerWaalsContact CD2-O 3.29Å; L303-K435 WeakPolarHBondContact CD2-O 3.16Å; L303-L437 HydrophobicContact CD2-CD1 4.21Å; L303-L437 HydrophobicContact CD2-CD2 3.89Å; L303-L437 HydrophobicContact CD2-CG 3.84Å
304	G	76.8	Confident	82.4	Confident	31 Å²	31	41.1 Å²	41.1	32%	0.32	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	105.6	-6.6	176.4	0	0	0	0	0	115.7	P307 G434	G304-P307 WeakPolarHBondContact O-CD 3.35Å; G304-G434 WeakPolarHBondContact CA-O 3.41Å; G304-G434 PolarHBondContact N-O 3.22Å
305	L	83.6	Confident	82	Confident	44 Å²	44	41.1 Å²	41.1	23%	0.23	24%	0.237	C	C	.	.			trans	-79.5	-23.7	179.1	-70.4	169.2	0	0	0	113.5	Q302 Q308 V309	Q302-L305 HydrophobicContact CB-CD1 4.35Å; L305-Q308 WeakPolarHBondContact O-CB 3.48Å; L305-Q308 PolarHBondContact O-N 3.27Å; L305-Q308 VanDerWaalsContact O-N 3.1Å; L305-V309 PolarHBondContact O-N 3.47Å; L305-V309 VanDerWaalsContact O-N 3.12Å
306	A	86.1	Confident	81.2	Confident	3 Å²	3	43.6 Å²	43.6	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-57.8	-45.6	-174.5	0	0	0	0	0	114.4	Q308 V309 L310 W436 L438	A306-Q308 VanDerWaalsContact C-N 3.25Å; A306-Q308 PolarHBondContact O-N 2.94Å; A306-V309 PolarHBondContact O-N 3Å; A306-L310 WeakPolarHBondContact O-CB 3.34Å; A306-L310 VanDerWaalsContact O-CG 3.28Å; A306-L310 WeakPolarHBondContact O-CG 3.38Å; A306-L310 PolarHBondContact O-N 2.84Å; A306-W436 HydrophobicContact CB-CB 3.8Å; A306-L438 HydrophobicContact CB-CD1 3.74Å; A306-L438 HydrophobicContact CB-CD2 4.37Å; A306-L438 HydrophobicContact CB-CG 3.79Å
307	P	86.3	Confident	80.5	Confident	42 Å²	42	44.7 Å²	44.7	27%	0.273	26%	0.26	S	S	.	.	H	α-helix	trans	-59.3	-36.4	176.3	-24.3	35.1	0	0	0	112.9	G304 L310 S311	G304-P307 WeakPolarHBondContact O-CD 3.35Å; P307-L310 PolarHBondContact O-N 2.95Å; P307-S311 WeakPolarHBondContact O-CB 3.2Å; P307-S311 PolarHBondContact O-N 3.44Å; P307-S311 PolarHBondContact O-OG 2.96Å
308	Q	84.9	Confident	80	Confident	122 Å²	122	48.7 Å²	48.7	57%	0.57	28%	0.281	S	S	*	.	H	α-helix	trans	-67.3	-44	178.4	-61.9	179.3	-0.5	0	0	110.8	L305 A306 L310 S311 S312	L305-Q308 WeakPolarHBondContact O-CB 3.48Å; L305-Q308 PolarHBondContact O-N 3.27Å; L305-Q308 VanDerWaalsContact O-N 3.1Å; A306-Q308 VanDerWaalsContact C-N 3.25Å; A306-Q308 PolarHBondContact O-N 2.94Å; Q308-L310 VanDerWaalsContact C-N 3.33Å; Q308-L310 PolarHBondContact O-N 3.4Å; Q308-S311 PolarHBondContact O-N 3.48Å; Q308-S312 WeakPolarHBondContact O-CB 3.35Å; Q308-S312 PolarHBondContact O-N 3.22Å; Q308-S312 PolarHBondContact O-OG 2.98Å
309	V	85.6	Confident	79.7	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.042	28%	0.276	C	S	.	.	H	α-helix	trans	-61.7	-42.5	176.6	177.3	0	0	0	0	111.3	F39 Y299 L305 A306 P414 L438	F39-V309 HydrophobicContact CD2-CG1 4.33Å; F39-V309 HydrophobicContact CE2-CB 4.33Å; F39-V309 HydrophobicContact CE2-CG1 4.05Å; F39-V309 HydrophobicContact CE2-CG2 3.92Å; F39-V309 HydrophobicContact CZ-CG2 4.19Å; Y299-V309 HydrophobicContact CD1-CB 4.37Å; Y299-V309 HydrophobicContact CD1-CG1 3.53Å; Y299-V309 HydrophobicContact CD1-CG2 3.85Å; Y299-V309 HydrophobicContact CE1-CG1 3.71Å; Y299-V309 HydrophobicContact CG-CG1 4.31Å; Y299-V309 HydrophobicContact CG-CG2 4.34Å; L305-V309 PolarHBondContact O-N 3.47Å; L305-V309 VanDerWaalsContact O-N 3.12Å; A306-V309 PolarHBondContact O-N 3Å; V309-P414 HydrophobicContact CG1-CB 4.35Å; V309-P414 HydrophobicContact CG1-CG 4.36Å; V309-L438 HydrophobicContact CB-CD1 3.84Å; V309-L438 HydrophobicContact CG1-CD1 3.88Å; V309-L438 HydrophobicContact CG2-CD1 4.37Å
310	L	86.6	Confident	79.4	Confident	29 Å²	29	47.9 Å²	47.9	15%	0.152	28%	0.279	C	S	.	.	H	α-helix	trans	-80.3	-15.9	-174.6	-62.8	172.9	0	0	0	114.2	A306 P307 Q308 P414 W436 L438 Y484 L487	A306-L310 WeakPolarHBondContact O-CB 3.34Å; A306-L310 VanDerWaalsContact O-CG 3.28Å; A306-L310 WeakPolarHBondContact O-CG 3.38Å; A306-L310 PolarHBondContact O-N 2.84Å; P307-L310 PolarHBondContact O-N 2.95Å; Q308-L310 VanDerWaalsContact C-N 3.33Å; Q308-L310 PolarHBondContact O-N 3.4Å; L310-P414 HydrophobicContact CD2-CG 3.73Å; L310-W436 HydrophobicContact CD1-CE3 4.29Å; L310-W436 HydrophobicContact CD1-CZ3 4.19Å; L310-L438 HydrophobicContact CD1-CD1 4.42Å; L310-L438 HydrophobicContact CD2-CD1 4.27Å; L310-L438 HydrophobicContact CG-CD1 4.08Å; L310-Y484 WeakPolarHBondContact O-CB 3.26Å; L310-L487 HydrophobicContact CD1-CD2 4.25Å; L310-L487 HydrophobicContact CD2-CB 4.18Å; L310-L487 HydrophobicContact CD2-CD1 4.09Å; L310-L487 HydrophobicContact CD2-CD2 4.39Å; L310-L487 HydrophobicContact CD2-CG 4.46Å
311	S	81.2	Confident	79.6	Confident	62 Å²	62	47.8 Å²	47.8	43%	0.434	28%	0.276	S	S	.	.	H	α-helix	trans	-129	-7.8	-175.1	67.1	0	0	0	0	115.7	P307 Q308 Y484	P307-S311 WeakPolarHBondContact O-CB 3.2Å; P307-S311 PolarHBondContact O-N 3.44Å; P307-S311 PolarHBondContact O-OG 2.96Å; Q308-S311 PolarHBondContact O-N 3.48Å; S311-Y484 WeakPolarHBondContact O-CE1 3.43Å
312	S	68.8	Low	80	Confident	57 Å²	57	46.8 Å²	46.8	40%	0.399	27%	0.267	S	S	.	.	S	Bend	trans	-76.8	-29.2	-174.4	57.8	0	0	0	0	114.9	Q308	Q308-S312 WeakPolarHBondContact O-CB 3.35Å; Q308-S312 PolarHBondContact O-N 3.22Å; Q308-S312 PolarHBondContact O-OG 2.98Å
313	T	72.1	Confident	80.2	Confident	26 Å²	26	43 Å²	43	16%	0.16	26%	0.263	C	S	.	.			trans	-124.8	107.9	-171.4	-52.1	0	0	0	0	110.4	T38 P485	T38-T313 HydrophobicContact CG2-CG2 4.25Å; T313-P485 WeakPolarHBondContact O-CD 3.35Å
314	S	80.1	Confident	79.6	Confident	59 Å²	59	48.1 Å²	48.1	41%	0.413	29%	0.285	S	S	.	.			trans	-76.5	135.7	168.7	59.8	0	0	0	0	110.2
315	L	79.6	Confident	79.1	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.021	31%	0.307	C	S	.	.			trans	-68.3	135.6	171.6	-81.1	139.9	0	0	0	110.4	T317 L399 Y401 L411 I483	L315-T317 PolarHBondContact O-N 2.61Å; L315-L399 HydrophobicContact CD1-CD2 3.6Å; L315-L399 HydrophobicContact CD2-CD2 3.98Å; L315-L399 HydrophobicContact CG-CD2 4.45Å; L315-Y401 HydrophobicContact CD2-CD1 3.59Å; L315-Y401 HydrophobicContact CD2-CD2 4.48Å; L315-Y401 HydrophobicContact CD2-CE1 3.96Å; L315-Y401 HydrophobicContact CD2-CG 3.88Å; L315-L411 HydrophobicContact CD1-CD2 3.76Å; L315-L411 HydrophobicContact CD2-CB 4.42Å; L315-L411 HydrophobicContact CD2-CD2 3.78Å; L315-L411 HydrophobicContact CG-CD2 3.82Å; L315-I483 HydrophobicContact CB-CG1 4.25Å; L315-I483 HydrophobicContact CD1-CD1 3.9Å; L315-I483 HydrophobicContact CD1-CG1 3.64Å; L315-I483 PolarHBondContact N-O 2.8Å
316	P	74.1	Confident	78.8	Confident	56 Å²	56	57.3 Å²	57.3	36%	0.364	32%	0.323	S	S	.	.			trans	-76.4	3.2	178.2	32.3	-35.5	0	0	0	113.1	Y401	P316-Y401 HydrophobicContact CG-CD2 3.75Å; P316-Y401 HydrophobicContact CG-CE2 3.56Å
317	T	78.3	Confident	78.7	Confident	23 Å²	23	59.9 Å²	59.9	14%	0.141	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-77.8	124.2	-179.6	-53.4	0	0	0	0	111	L315 F319 Y401	L315-T317 PolarHBondContact O-N 2.61Å; T317-F319 HydrophobicContact CG2-CD2 4.37Å; T317-F319 HydrophobicContact CG2-CE1 4.14Å; T317-F319 HydrophobicContact CG2-CE2 3.84Å; T317-F319 HydrophobicContact CG2-CZ 3.7Å; T317-Y401 VanDerWaalsContact OG1-CB 3.28Å; T317-Y401 WeakPolarHBondContact OG1-CB 3.44Å
318	N	81.2	Confident	78.6	Confident	86 Å²	86	58.9 Å²	58.9	46%	0.46	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-88	122.5	174.5	-60.6	-23.2	0	0	0	110	N327 N480 N482	N318-N327 PolarHBondContact O-ND2 2.76Å; N318-N480 VanDerWaalsContact CA-O 3.24Å; N318-N480 WeakPolarHBondContact CA-O 3.35Å; N318-N480 HydrophobicContact CB-CB 4.31Å; N318-N480 VanDerWaalsContact OD1-CB 3.28Å; N318-N480 WeakPolarHBondContact OD1-CB 3.28Å; N318-N482 PolarHBondContact OD1-OD1 2.76Å
319	F	84.3	Confident	78.7	Confident	7 Å²	7	59.5 Å²	59.5	3%	0.031	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-101.6	134.8	176.7	-68.8	-79.8	0	0	0	111.1	T317 N327 L330 F370 N480 G481 I483 V596	T317-F319 HydrophobicContact CG2-CD2 4.37Å; T317-F319 HydrophobicContact CG2-CE1 4.14Å; T317-F319 HydrophobicContact CG2-CE2 3.84Å; T317-F319 HydrophobicContact CG2-CZ 3.7Å; F319-N327 WeakPolarHBondContact CD1-O 3.17Å; F319-L330 HydrophobicContact CE1-CD2 3.64Å; F319-L330 HydrophobicContact CE2-CD2 4.32Å; F319-L330 HydrophobicContact CZ-CD2 3.44Å; F319-L330 VanDerWaalsContact CZ-CD2 3.44Å; F319-F370 HydrophobicContact CB-CD1 3.42Å; F319-F370 VanDerWaalsContact CB-CD1 3.42Å; F319-F370 HydrophobicContact CB-CE1 3.43Å; F319-F370 VanDerWaalsContact CB-CE1 3.43Å; F319-F370 HydrophobicContact CB-CG 4.27Å; F319-F370 HydrophobicContact CB-CZ 4.33Å; F319-F370 HydrophobicContact CD1-CB 4.04Å; F319-F370 AromaticContact CD1-CD1 3.9Å; F319-F370 HydrophobicContact CD1-CD1 3.9Å; F319-F370 AromaticContact CD1-CG 3.9Å; F319-F370 HydrophobicContact CD1-CG 3.9Å; F319-F370 HydrophobicContact CD2-CD1 4.43Å; F319-F370 HydrophobicContact CD2-CE1 4.26Å; F319-F370 HydrophobicContact CD2-CZ 4.4Å; F319-F370 HydrophobicContact CE1-CB 4.43Å; F319-F370 HydrophobicContact CE1-CG 4.45Å; F319-F370 AromaticContact CG-CD1 3.66Å; F319-F370 HydrophobicContact CG-CD1 3.66Å; F319-F370 HydrophobicContact CG-CD2 4.5Å; F319-F370 AromaticContact CG-CE1 3.83Å; F319-F370 HydrophobicContact CG-CE1 3.83Å; F319-F370 HydrophobicContact CG-CG 4.02Å; F319-F370 HydrophobicContact CG-CZ 4.39Å; F319-N480 PolarHBondContact N-O 3.3Å; F319-G481 WeakPolarHBondContact CD2-O 3.46Å; F319-I483 HydrophobicContact CD2-CG2 4.48Å; F319-I483 HydrophobicContact CE2-CD1 3.75Å; F319-I483 HydrophobicContact CE2-CG1 3.93Å; F319-I483 HydrophobicContact CZ-CD1 4.24Å; F319-V596 HydrophobicContact CB-CG2 4.4Å; F319-V596 PolarHBondContact O-N 3.09Å
320	S	83.4	Confident	79	Confident	15 Å²	15	59.3 Å²	59.3	11%	0.105	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-141.4	130	-175.3	172.4	0	0	0	0	110.8	K322 N325 N327 T328 K594	S320-K322 PolarHBondContact OG-O 2.89Å; S320-K322 VanDerWaalsContact OG-O 3.11Å; S320-N325 WeakPolarHBondContact CB-O 3.36Å; S320-N327 PolarHBondContact N-O 2.87Å; S320-N327 VanDerWaalsContact N-O 3.11Å; S320-N327 CarbonylContact O-C 3.59Å; S320-N327 PolarHBondContact O-N 3.36Å; S320-T328 VanDerWaalsContact O-CG2 3.32Å; S320-T328 WeakPolarHBondContact O-CG2 3.25Å; S320-K594 CarbonylContact C-O 3.55Å; S320-K594 WeakPolarHBondContact CA-O 3.22Å; S320-K594 WeakPolarHBondContact CB-O 3.35Å; S320-K594 PolarHBondContact OG-O 3.29Å
321	F	82.8	Confident	79.3	Confident	10 Å²	10	63 Å²	63	4%	0.044	34%	0.344	C	S	.	.	S	Bend	trans	-85.1	-25.5	179.1	-64.6	-22.2	0	0	0	113	T328 F370 F590 K594 V596 S712	F321-T328 HydrophobicContact CD1-CG2 3.99Å; F321-F370 AromaticContact CE1-CD1 3.73Å; F321-F370 HydrophobicContact CE1-CD1 3.73Å; F321-F370 HydrophobicContact CE1-CE1 4.3Å; F321-F370 WeakPolarHBondContact CE1-O 3.48Å; F321-F370 HydrophobicContact CZ-CD1 4.34Å; F321-F590 HydrophobicContact CE2-CE2 4.21Å; F321-K594 PolarHBondContact N-O 2.8Å; F321-V596 HydrophobicContact CD1-CG2 3.62Å; F321-V596 HydrophobicContact CD2-CG2 3.92Å; F321-V596 HydrophobicContact CE1-CG2 3.39Å; F321-V596 HydrophobicContact CE2-CG1 4.3Å; F321-V596 HydrophobicContact CE2-CG2 3.69Å; F321-V596 HydrophobicContact CG-CG2 3.89Å; F321-V596 HydrophobicContact CZ-CB 4.39Å; F321-V596 HydrophobicContact CZ-CG1 4.06Å; F321-V596 HydrophobicContact CZ-CG2 3.41Å; F321-V596 VanDerWaalsContact CZ-CG2 3.41Å; F321-S712 VanDerWaalsContact CD1-CB 3.49Å
322	K	77.1	Confident	79.9	Confident	74 Å²	74	60.3 Å²	60.3	32%	0.322	33%	0.325	S	S	.	.	S	Bend	trans	-144	146.4	-172.9	-68.5	-179.2	174.1	171.4	0	112.7	S320 K591 K594 S714	S320-K322 PolarHBondContact OG-O 2.89Å; S320-K322 VanDerWaalsContact OG-O 3.11Å; K322-K591 WeakPolarHBondContact CE-O 3.44Å; K322-K591 PolarHBondContact NZ-O 2.93Å; K322-K594 HydrophobicContact CB-CG 4.47Å; K322-S714 WeakPolarHBondContact CE-OG 3.27Å; K322-S714 PolarHBondContact NZ-OG 3.29Å
323	G	74.8	Confident	81.2	Confident	53 Å²	53	58 Å²	58	55%	0.546	31%	0.308	S	S	.	.	S	Bend	trans	112.3	-177.1	174.6	0	0	0	0	0	113.1	N325 Q326	G323-N325 PolarHBondContact O-N 3.29Å; G323-Q326 PolarHBondContact O-N 2.94Å
324	E	65.1	Low	82.3	Confident	201 Å²	201	56.7 Å²	56.7	94%	0.939	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-28.1	-177.9	-66.3	-179.5	168.5	0	0	112.9
325	N	66.1	Low	83	Confident	145 Å²	145	53.9 Å²	53.9	78%	0.775	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	36.3	177.6	-62.4	-25.2	0	0	0	112.5	S320 G323 N327	S320-N325 WeakPolarHBondContact CB-O 3.36Å; G323-N325 PolarHBondContact O-N 3.29Å; N325-N327 PolarHBondContact O-N 3.08Å
326	Q	76.8	Confident	83.7	Confident	122 Å²	122	53.8 Å²	53.8	57%	0.57	28%	0.28	S	S	*	.			trans	-59.9	120.3	178.5	-177.3	-179.7	-2.8	0	0	110.3	G323 T328	G323-Q326 PolarHBondContact O-N 2.94Å; Q326-T328 HydrophobicContact CG-CG2 4.08Å
327	N	82.7	Confident	84.7	Confident	58 Å²	58	51.3 Å²	51.3	31%	0.31	26%	0.263	S	S	.	.	B	Isolated β-bridge	trans	-138	98.8	176.3	-177	21.1	0	0	0	108.8	N318 F319 S320 N325	N318-N327 PolarHBondContact O-ND2 2.76Å; F319-N327 WeakPolarHBondContact CD1-O 3.17Å; S320-N327 PolarHBondContact N-O 2.87Å; S320-N327 VanDerWaalsContact N-O 3.11Å; S320-N327 CarbonylContact O-C 3.59Å; S320-N327 PolarHBondContact O-N 3.36Å; N325-N327 PolarHBondContact O-N 3.08Å
328	T	84.7	Confident	85.5	Confident	21 Å²	21	52 Å²	52	13%	0.129	27%	0.266	C	S	.	.			trans	-117.1	7.6	179.9	64.9	0	0	0	0	112.3	S320 F321 Q326 S369 F370	S320-T328 VanDerWaalsContact O-CG2 3.32Å; S320-T328 WeakPolarHBondContact O-CG2 3.25Å; F321-T328 HydrophobicContact CD1-CG2 3.99Å; Q326-T328 HydrophobicContact CG-CG2 4.08Å; T328-S369 CarbonylContact O-C 3.53Å; T328-S369 VanDerWaalsContact O-CA 3.32Å; T328-S369 WeakPolarHBondContact O-CA 3.33Å; T328-F370 WeakPolarHBondContact O-CB 3.27Å; T328-F370 PolarHBondContact O-N 3.34Å
329	K	88.1	Confident	86.1	Confident	134 Å²	134	48.7 Å²	48.7	58%	0.583	25%	0.248	S	C	*	.	B	Isolated β-bridge	trans	-98	124.2	-175.6	-69.7	-168.4	174.8	-165.4	0	111
330	L	90.6	Very high	86.4	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.016	27%	0.273	C	S	.	.			trans	-91.7	110.5	167	-63.5	170.7	0	0	0	108.6	F319 F332 Y368 F370 L399 V472 I483 Y513	F319-L330 HydrophobicContact CE1-CD2 3.64Å; F319-L330 HydrophobicContact CE2-CD2 4.32Å; F319-L330 HydrophobicContact CZ-CD2 3.44Å; F319-L330 VanDerWaalsContact CZ-CD2 3.44Å; L330-F332 HydrophobicContact CB-CD2 3.97Å; L330-F332 HydrophobicContact CB-CE2 3.51Å; L330-F332 HydrophobicContact CB-CZ 4.36Å; L330-F332 HydrophobicContact CD1-CE2 4Å; L330-F332 HydrophobicContact CD1-CZ 4.48Å; L330-F332 HydrophobicContact CG-CE2 4.34Å; L330-F332 PolarHBondContact O-N 2.94Å; L330-Y368 PolarHBondContact N-O 3.06Å; L330-F370 HydrophobicContact CD1-CD2 4.23Å; L330-F370 HydrophobicContact CD2-CD2 4.15Å; L330-F370 HydrophobicContact CG-CB 4.21Å; L330-F370 HydrophobicContact CG-CD2 4.39Å; L330-L399 HydrophobicContact CB-CD1 4.32Å; L330-L399 HydrophobicContact CD2-CD1 4.39Å; L330-V472 HydrophobicContact CD1-CG2 4.35Å; L330-I483 HydrophobicContact CD2-CD1 4.24Å; L330-Y513 HydrophobicContact CD1-CE1 4.34Å
331	K	92.6	Very high	86.7	Confident	106 Å²	106	54.6 Å²	54.6	46%	0.461	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	90.9	-177.9	-67.6	-177.5	179.3	-178.3	0	110.6	E400	K331-E400 HydrophobicContact CB-CB 3.94Å; K331-E400 PolarHBondContact O-N 3.07Å
332	F	94.7	Very high	87.1	Confident	7 Å²	7	57.1 Å²	57.1	3%	0.031	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	132.8	173.5	-67.7	-82.6	0	0	0	111.8	L330 L349 Y368 V397 Y398 L399 V413 L470 P486	L330-F332 HydrophobicContact CB-CD2 3.97Å; L330-F332 HydrophobicContact CB-CE2 3.51Å; L330-F332 HydrophobicContact CB-CZ 4.36Å; L330-F332 HydrophobicContact CD1-CE2 4Å; L330-F332 HydrophobicContact CD1-CZ 4.48Å; L330-F332 HydrophobicContact CG-CE2 4.34Å; L330-F332 PolarHBondContact O-N 2.94Å; F332-L349 HydrophobicContact CB-CB 4.05Å; F332-L349 HydrophobicContact CB-CD1 3.56Å; F332-L349 HydrophobicContact CB-CG 3.76Å; F332-L349 HydrophobicContact CG-CD1 4.29Å; F332-L349 PolarHBondContact O-N 3.22Å; F332-Y368 AromaticContact CD2-CD1 3.51Å; F332-Y368 HydrophobicContact CD2-CD1 3.51Å; F332-Y368 AromaticContact CD2-CE1 3.99Å; F332-Y368 HydrophobicContact CD2-CE1 3.99Å; F332-Y368 HydrophobicContact CD2-CG 4.4Å; F332-Y368 HydrophobicContact CE2-CD1 4.03Å; F332-Y368 HydrophobicContact CG-CD1 4.48Å; F332-V397 HydrophobicContact CD1-CG1 4.11Å; F332-Y398 WeakPolarHBondContact CA-O 3.27Å; F332-L399 HydrophobicContact CD1-CB 4.34Å; F332-L399 HydrophobicContact CD1-CD1 4.13Å; F332-L399 HydrophobicContact CD2-CD1 4.47Å; F332-L399 HydrophobicContact CE1-CB 4.17Å; F332-L399 HydrophobicContact CE1-CD1 3.89Å; F332-L399 HydrophobicContact CE2-CD1 4.27Å; F332-L399 HydrophobicContact CG-CD1 4.41Å; F332-L399 HydrophobicContact CZ-CD1 3.97Å; F332-V413 HydrophobicContact CD1-CG2 4.17Å; F332-V413 HydrophobicContact CE1-CG2 3.91Å; F332-L470 HydrophobicContact CD2-CD2 4.44Å; F332-L470 HydrophobicContact CE1-CD1 4.29Å; F332-L470 HydrophobicContact CE1-CD2 4.41Å; F332-L470 HydrophobicContact CE2-CD2 3.55Å; F332-L470 HydrophobicContact CZ-CD1 4.01Å; F332-L470 HydrophobicContact CZ-CD2 3.54Å; F332-L470 HydrophobicContact CZ-CG 4.35Å; F332-P486 HydrophobicContact CE1-CB 4.29Å; F332-P486 HydrophobicContact CE1-CG 4.2Å; F332-P486 HydrophobicContact CZ-CB 4.21Å; F332-P486 HydrophobicContact CZ-CG 4.07Å
333	V	95.4	Very high	87.8	Confident	7 Å²	7	55.1 Å²	55.1	4%	0.042	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	146.1	175.3	-62.5	0	0	0	0	109.6	F43 W346 Q347 Y398 I410	F43-V333 HydrophobicContact CE2-CG2 4.33Å; F43-V333 HydrophobicContact CZ-CG2 4.46Å; V333-W346 HydrophobicContact CB-CE3 4.48Å; V333-W346 HydrophobicContact CG2-CE3 4.39Å; V333-W346 HydrophobicContact CG2-CZ3 4.18Å; V333-Q347 CarbonylContact C-O 3.46Å; V333-Q347 WeakPolarHBondContact CA-O 3.25Å; V333-Y398 PolarHBondContact N-O 2.83Å; V333-Y398 PolarHBondContact O-N 2.79Å; V333-I410 HydrophobicContact CG2-CG2 3.95Å
334	A	95.6	Very high	88.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	136.8	177.2	0	0	0	0	0	111.6	Q347 L349 Y395 D396 V397	A334-Q347 HydrophobicContact CB-CG 4.47Å; A334-Q347 PolarHBondContact N-O 3.18Å; A334-Q347 PolarHBondContact O-N 3.06Å; A334-L349 HydrophobicContact CB-CD2 3.73Å; A334-Y395 HydrophobicContact CB-CD1 4.33Å; A334-D396 CarbonylContact C-O 3.57Å; A334-D396 VanDerWaalsContact CA-O 3.23Å; A334-D396 WeakPolarHBondContact CA-O 3.35Å; A334-V397 HydrophobicContact CB-CG2 4.4Å
335	A	94.6	Very high	89.8	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	122.8	163.8	0	0	0	0	0	108	Y337 F343 W346 Y395 D396 Y398	A335-Y337 HydrophobicContact CB-CE2 3.82Å; A335-F343 HydrophobicContact CB-CE2 3.97Å; A335-W346 HydrophobicContact CB-CD2 4.49Å; A335-W346 HydrophobicContact CB-CE3 4.06Å; A335-W346 HydrophobicContact CB-CH2 3.93Å; A335-W346 HydrophobicContact CB-CZ2 4.36Å; A335-W346 HydrophobicContact CB-CZ3 3.77Å; A335-Y395 WeakPolarHBondContact O-CA 3.46Å; A335-D396 HydrophobicContact CB-CB 4.39Å; A335-D396 PolarHBondContact N-O 3.42Å; A335-D396 PolarHBondContact O-N 3.45Å; A335-Y398 HydrophobicContact CB-CE2 4.15Å
336	S	95	Very high	91	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	137.4	-175.7	56.5	0	0	0	0	111.9	L344 K345 F394	S336-L344 PolarHBondContact O-N 2.94Å; S336-K345 PolarHBondContact N-O 3.38Å; S336-K345 WeakPolarHBondContact OG-CG 3.43Å; S336-K345 PolarHBondContact OG-N 3.32Å; S336-K345 PolarHBondContact OG-O 2.87Å; S336-F394 CarbonylContact C-O 3.45Å; S336-F394 VanDerWaalsContact CA-O 3.32Å; S336-F394 WeakPolarHBondContact CA-O 3.36Å
337	Y	94.8	Very high	91.8	Very high	4 Å²	4	43 Å²	43	2%	0.016	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	144.3	-178.6	-56.4	-94.4	0	0	0	111.3	I57 A335 N342 F343 F394 R441	I57-Y337 HydrophobicContact CG2-CE1 4.04Å; A335-Y337 HydrophobicContact CB-CE2 3.82Å; Y337-N342 CarbonylContact C-O 3.59Å; Y337-N342 VanDerWaalsContact CA-O 3.25Å; Y337-N342 WeakPolarHBondContact CA-O 3.28Å; Y337-F343 HydrophobicContact CD1-CB 4.21Å; Y337-F343 HydrophobicContact CD1-CD2 4.32Å; Y337-F343 HydrophobicContact CE1-CB 4.08Å; Y337-F343 AromaticContact CE1-CD2 3.79Å; Y337-F343 HydrophobicContact CE1-CD2 3.79Å; Y337-F343 HydrophobicContact CE1-CG 4.44Å; Y337-F343 AromaticContact CZ-CD2 3.97Å; Y337-F394 PolarHBondContact N-O 3.06Å; Y337-F394 PolarHBondContact O-N 3.29Å; Y337-R441 VanDerWaalsContact CE2-NH2 3.32Å
338	D	95.1	Very high	92.3	Very high	39 Å²	39	43.9 Å²	43.9	21%	0.209	21%	0.206	C	C	.	.			trans	-79.7	171.7	172.2	77.9	8.6	0	0	0	112.2	N251 R340 G341 N342 L344	N251-D338 PolarHBondContact ND2-O 3.22Å; D338-R340 PolarHBondContact O-N 3.33Å; D338-R340 VanDerWaalsContact O-N 3.16Å; D338-R340 VanDerWaalsContact OD1-C 3.25Å; D338-R340 VanDerWaalsContact OD1-CA 3.3Å; D338-R340 WeakPolarHBondContact OD1-CA 3.4Å; D338-R340 WeakPolarHBondContact OD1-CB 3.37Å; D338-R340 PolarHBondContact OD1-N 3.39Å; D338-G341 PolarHBondContact O-N 3.37Å; D338-G341 PolarHBondContact OD1-N 2.99Å; D338-N342 PolarHBondContact N-O 2.69Å; D338-N342 PolarHBondContact OD1-N 3.47Å; D338-N342 PolarHBondContact OD1-ND2 3.24Å; D338-N342 WeakPolarHBondContact OD2-CB 3.01Å; D338-N342 PolarHBondContact OD2-ND2 2.94Å; D338-L344 HydrophobicContact CB-CD1 4.35Å; D338-L344 HydrophobicContact CB-CD2 4.1Å; D338-L344 HydrophobicContact CB-CG 4.34Å
339	I	93.8	Very high	92.7	Very high	16 Å²	16	43.1 Å²	43.1	8%	0.082	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.1	178.9	-162.4	178.9	0	0	0	113.9	W225 M255 G341 P392 F394 V448	W225-I339 HydrophobicContact CD2-CD1 3.83Å; W225-I339 VanDerWaalsContact CE2-CD1 3.45Å; W225-I339 HydrophobicContact CE3-CD1 4.35Å; W225-I339 HydrophobicContact CG-CD1 4.24Å; W225-I339 HydrophobicContact CH2-CD1 4.29Å; W225-I339 HydrophobicContact CH2-CG1 4.39Å; W225-I339 HydrophobicContact CH2-CG2 3.81Å; W225-I339 HydrophobicContact CZ2-CB 4.24Å; W225-I339 HydrophobicContact CZ2-CD1 3.74Å; W225-I339 HydrophobicContact CZ2-CG1 3.62Å; W225-I339 HydrophobicContact CZ2-CG2 3.84Å; M255-I339 HydrophobicContact CE-CD1 4.18Å; M255-I339 HydrophobicContact SD-CD1 4.44Å; M255-I339 HydrophobicContact SD-CG1 4.37Å; I339-G341 VanDerWaalsContact C-N 3.33Å; I339-P392 HydrophobicContact CB-CG 4.19Å; I339-P392 HydrophobicContact CD1-CG 3.73Å; I339-P392 HydrophobicContact CG1-CG 3.93Å; I339-F394 HydrophobicContact CB-CE2 4.42Å; I339-F394 HydrophobicContact CG1-CE2 4.39Å; I339-V448 HydrophobicContact CD1-CB 3.95Å; I339-V448 HydrophobicContact CD1-CG1 3.66Å; I339-V448 HydrophobicContact CD1-CG2 4.16Å
340	R	91.4	Very high	92.8	Very high	143 Å²	143	40.4 Å²	40.4	54%	0.54	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	2.9	178.3	-66.1	-174.1	179.9	-158.6	1.3	113	W225 A248 D338	W225-R340 HydrophobicContact CH2-CG 3.92Å; W225-R340 HydrophobicContact CZ2-CG 4.36Å; A248-R340 WeakPolarHBondContact CB-O 3.26Å; D338-R340 PolarHBondContact O-N 3.33Å; D338-R340 VanDerWaalsContact O-N 3.16Å; D338-R340 VanDerWaalsContact OD1-C 3.25Å; D338-R340 VanDerWaalsContact OD1-CA 3.3Å; D338-R340 WeakPolarHBondContact OD1-CA 3.4Å; D338-R340 WeakPolarHBondContact OD1-CB 3.37Å; D338-R340 PolarHBondContact OD1-N 3.39Å
341	G	89.7	Confident	92.8	Very high	2 Å²	2	42.2 Å²	42.2	2%	0.021	21%	0.209	C	C	.	.	S	Bend	trans	83.5	12	178	0	0	0	0	0	114.7	Q247 D338 I339	Q247-G341 VanDerWaalsContact CB-O 3.29Å; Q247-G341 WeakPolarHBondContact CB-O 3.39Å; D338-G341 PolarHBondContact O-N 3.37Å; D338-G341 PolarHBondContact OD1-N 2.99Å; I339-G341 VanDerWaalsContact C-N 3.33Å
342	N	90.8	Very high	92.6	Very high	64 Å²	64	37.7 Å²	37.7	34%	0.342	19%	0.193	S	C	.	.			trans	-76.7	137.5	172.7	-56.4	-62.8	0	0	0	110.1	T244 Y337 D338	T244-N342 WeakPolarHBondContact CG2-OD1 3.37Å; Y337-N342 CarbonylContact C-O 3.59Å; Y337-N342 VanDerWaalsContact CA-O 3.25Å; Y337-N342 WeakPolarHBondContact CA-O 3.28Å; D338-N342 PolarHBondContact N-O 2.69Å; D338-N342 PolarHBondContact OD1-N 3.47Å; D338-N342 PolarHBondContact OD1-ND2 3.24Å; D338-N342 WeakPolarHBondContact OD2-CB 3.01Å; D338-N342 PolarHBondContact OD2-ND2 2.94Å
343	F	90.9	Very high	92.6	Very high	31 Å²	31	39.1 Å²	39.1	14%	0.136	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	129.5	169.3	179	-102.5	0	0	0	110	P46 F55 I57 A335 Y337 K345 W346	P46-F343 HydrophobicContact CG-CE1 4.31Å; F55-F343 HydrophobicContact CE1-CE1 4.34Å; F55-F343 HydrophobicContact CE1-CZ 4.26Å; I57-F343 HydrophobicContact CB-CB 4.43Å; I57-F343 HydrophobicContact CD1-CB 3.69Å; I57-F343 HydrophobicContact CD1-CG 4.4Å; I57-F343 HydrophobicContact CG1-CB 3.85Å; I57-F343 HydrophobicContact CG1-CD1 4.25Å; I57-F343 HydrophobicContact CG1-CG 4.11Å; I57-F343 HydrophobicContact CG2-CB 3.68Å; I57-F343 HydrophobicContact CG2-CD2 4.41Å; I57-F343 HydrophobicContact CG2-CG 4.2Å; A335-F343 HydrophobicContact CB-CE2 3.97Å; Y337-F343 HydrophobicContact CD1-CB 4.21Å; Y337-F343 HydrophobicContact CD1-CD2 4.32Å; Y337-F343 HydrophobicContact CE1-CB 4.08Å; Y337-F343 AromaticContact CE1-CD2 3.79Å; Y337-F343 HydrophobicContact CE1-CD2 3.79Å; Y337-F343 HydrophobicContact CE1-CG 4.44Å; Y337-F343 AromaticContact CZ-CD2 3.97Å; F343-K345 VanDerWaalsContact CZ-C 3.42Å; F343-W346 AromaticContact CZ-CD1 3.87Å; F343-W346 HydrophobicContact CZ-CG 4.24Å
344	L	91.3	Very high	92.5	Very high	87 Å²	87	39.1 Å²	39.1	46%	0.455	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-62.3	179.9	-63.6	177.3	0	0	0	110.4	S336 D338 I393	S336-L344 PolarHBondContact O-N 2.94Å; D338-L344 HydrophobicContact CB-CD1 4.35Å; D338-L344 HydrophobicContact CB-CD2 4.1Å; D338-L344 HydrophobicContact CB-CG 4.34Å; L344-I393 HydrophobicContact CD1-CG2 4.15Å
345	K	91.1	Very high	92.5	Very high	117 Å²	117	39.7 Å²	39.7	51%	0.509	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.3	165.4	-179.2	59.3	-177.3	-179.3	-179.9	0	112.5	S336 F343	S336-K345 PolarHBondContact N-O 3.38Å; S336-K345 WeakPolarHBondContact OG-CG 3.43Å; S336-K345 PolarHBondContact OG-N 3.32Å; S336-K345 PolarHBondContact OG-O 2.87Å; F343-K345 VanDerWaalsContact CZ-C 3.42Å
346	W	91.8	Very high	92.4	Very high	28 Å²	28	40.8 Å²	40.8	11%	0.106	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	135	154.4	-75.6	110.8	0	0	0	109.9	F43 Q44 F55 L60 V333 A335 F343 Y398 I410	F43-W346 HydrophobicContact CE2-CD2 4.1Å; F43-W346 HydrophobicContact CE2-CE3 4.23Å; F43-W346 HydrophobicContact CE2-CZ2 4.42Å; F43-W346 HydrophobicContact CE2-CZ3 4.45Å; Q44-W346 PolarHBondContact O-NE1 3.06Å; F55-W346 AromaticContact CZ-NE1 3.45Å; L60-W346 HydrophobicContact CB-CZ2 4.28Å; L60-W346 HydrophobicContact CD1-CH2 4Å; L60-W346 HydrophobicContact CD1-CZ2 3.94Å; L60-W346 HydrophobicContact CD2-CZ2 4.03Å; L60-W346 HydrophobicContact CG-CZ2 4.32Å; V333-W346 HydrophobicContact CB-CE3 4.48Å; V333-W346 HydrophobicContact CG2-CE3 4.39Å; V333-W346 HydrophobicContact CG2-CZ3 4.18Å; A335-W346 HydrophobicContact CB-CD2 4.49Å; A335-W346 HydrophobicContact CB-CE3 4.06Å; A335-W346 HydrophobicContact CB-CH2 3.93Å; A335-W346 HydrophobicContact CB-CZ2 4.36Å; A335-W346 HydrophobicContact CB-CZ3 3.77Å; F343-W346 AromaticContact CZ-CD1 3.87Å; F343-W346 HydrophobicContact CZ-CG 4.24Å; W346-Y398 AromaticContact CH2-CD2 3.81Å; W346-Y398 HydrophobicContact CH2-CD2 3.81Å; W346-Y398 AromaticContact CH2-CE2 3.58Å; W346-Y398 HydrophobicContact CH2-CE2 3.58Å; W346-Y398 AromaticContact CZ3-CD2 3.56Å; W346-Y398 HydrophobicContact CZ3-CD2 3.56Å; W346-Y398 AromaticContact CZ3-CE2 3.65Å; W346-Y398 HydrophobicContact CZ3-CE2 3.65Å; W346-I410 HydrophobicContact CH2-CD1 3.81Å; W346-I410 HydrophobicContact CZ2-CD1 4.32Å
347	Q	92.9	Very high	92.4	Very high	34 Å²	34	41 Å²	41	16%	0.159	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	143.5	175	63.8	-176.8	24.3	0	0	111.7	V333 A334	V333-Q347 CarbonylContact C-O 3.46Å; V333-Q347 WeakPolarHBondContact CA-O 3.25Å; A334-Q347 HydrophobicContact CB-CG 4.47Å; A334-Q347 PolarHBondContact N-O 3.18Å; A334-Q347 PolarHBondContact O-N 3.06Å
348	T	93.8	Very high	92.2	Very high	78 Å²	78	45.7 Å²	45.7	48%	0.479	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	149	169.7	53.8	0	0	0	0	109.6	E350 V353	T348-E350 VanDerWaalsContact C-N 3.28Å; T348-V353 WeakPolarHBondContact O-CG2 3.33Å
349	L	93.6	Very high	92.1	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.021	25%	0.246	C	C	.	.	S	Bend	trans	-80.5	-11.7	172.6	-60.6	-166.7	0	0	0	113.6	F332 A334 V353 L354 Y368 V397	F332-L349 HydrophobicContact CB-CB 4.05Å; F332-L349 HydrophobicContact CB-CD1 3.56Å; F332-L349 HydrophobicContact CB-CG 3.76Å; F332-L349 HydrophobicContact CG-CD1 4.29Å; F332-L349 PolarHBondContact O-N 3.22Å; A334-L349 HydrophobicContact CB-CD2 3.73Å; L349-V353 HydrophobicContact CD2-CB 4.17Å; L349-V353 HydrophobicContact CD2-CG1 3.98Å; L349-V353 PolarHBondContact O-N 3.42Å; L349-L354 HydrophobicContact CD1-CD1 3.6Å; L349-L354 HydrophobicContact CD1-CG 4.12Å; L349-L354 HydrophobicContact CD2-CD1 4.36Å; L349-L354 HydrophobicContact CD2-CG 4.09Å; L349-Y368 HydrophobicContact CB-CE1 4.13Å; L349-Y368 HydrophobicContact CB-CE2 4.06Å; L349-Y368 WeakPolarHBondContact CB-OH 3.48Å; L349-Y368 HydrophobicContact CD1-CE1 4.45Å; L349-Y368 VanDerWaalsContact O-CE2 3.24Å; L349-Y368 WeakPolarHBondContact O-CE2 3.47Å; L349-Y368 PolarHBondContact O-OH 3.37Å; L349-V397 HydrophobicContact CD1-CG1 3.85Å
350	E	90.4	Very high	92.1	Very high	77 Å²	77	49 Å²	49	36%	0.36	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	146.9	168.5	-64.1	-174	166.5	0	0	110.8	T348 N365 Y368	T348-E350 VanDerWaalsContact C-N 3.28Å; E350-N365 VanDerWaalsContact CA-OD1 3.31Å; E350-N365 WeakPolarHBondContact CA-OD1 3.47Å; E350-N365 WeakPolarHBondContact CB-OD1 3.35Å; E350-Y368 HydrophobicContact CG-CD2 4.39Å
351	G	88.9	Confident	92.1	Very high	41 Å²	41	48.2 Å²	48.2	42%	0.423	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	7	-177.2	0	0	0	0	0	115.2	N365	G351-N365 PolarHBondContact N-OD1 3.05Å
352	G	90.2	Very high	92.2	Very high	12 Å²	12	52.2 Å²	52.2	12%	0.124	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.8	24.8	171.2	0	0	0	0	0	115.4	L354 Q355	G352-L354 VanDerWaalsContact C-N 3.31Å; G352-L354 PolarHBondContact O-N 3.48Å; G352-Q355 PolarHBondContact O-N 2.99Å; G352-Q355 VanDerWaalsContact O-N 3.11Å; G352-Q355 VanDerWaalsContact O-O 3.13Å; G352-Q355 PolarHBondContact O-OE1 3.1Å
353	V	93.2	Very high	92.3	Very high	37 Å²	37	53.6 Å²	53.6	22%	0.224	29%	0.291	C	S	.	.	S	Bend	trans	-59.9	-37.9	-171.6	170.6	0	0	0	0	113.4	T348 L349 Y395 L444	T348-V353 WeakPolarHBondContact O-CG2 3.33Å; L349-V353 HydrophobicContact CD2-CB 4.17Å; L349-V353 HydrophobicContact CD2-CG1 3.98Å; L349-V353 PolarHBondContact O-N 3.42Å; V353-Y395 HydrophobicContact CG1-CE1 4.35Å; V353-L444 WeakPolarHBondContact O-CD1 3.4Å
354	L	93.9	Very high	92.4	Very high	6 Å²	6	52.7 Å²	52.7	3%	0.031	29%	0.287	C	S	.	.	S	Bend	trans	-97	-7.7	177.6	-61.3	-174.2	0	0	0	112.6	L349 G352 Y395 V397 I442 L444 F509	L349-L354 HydrophobicContact CD1-CD1 3.6Å; L349-L354 HydrophobicContact CD1-CG 4.12Å; L349-L354 HydrophobicContact CD2-CD1 4.36Å; L349-L354 HydrophobicContact CD2-CG 4.09Å; G352-L354 VanDerWaalsContact C-N 3.31Å; G352-L354 PolarHBondContact O-N 3.48Å; L354-Y395 HydrophobicContact CD2-CD2 4Å; L354-Y395 HydrophobicContact CD2-CE2 4.41Å; L354-Y395 HydrophobicContact CD2-CG 4.38Å; L354-V397 HydrophobicContact CD1-CG2 4.34Å; L354-I442 HydrophobicContact CD1-CD1 4.31Å; L354-I442 HydrophobicContact CD2-CD1 4.19Å; L354-L444 HydrophobicContact CD2-CD2 4.25Å; L354-F509 HydrophobicContact CB-CE2 3.92Å
355	Q	94.6	Very high	92.5	Very high	13 Å²	13	50.4 Å²	50.4	6%	0.061	28%	0.275	C	S	.	.			trans	-91.2	105.4	-178.5	-66.4	83.9	-12.3	0	0	109.5	G352 C357 L364 Y368 F509	G352-Q355 PolarHBondContact O-N 2.99Å; G352-Q355 VanDerWaalsContact O-N 3.11Å; G352-Q355 VanDerWaalsContact O-O 3.13Å; G352-Q355 PolarHBondContact O-OE1 3.1Å; Q355-C357 PolarHBondContact O-N 3.38Å; Q355-L364 HydrophobicContact CB-CD2 3.98Å; Q355-L364 HydrophobicContact CG-CD2 4.19Å; Q355-Y368 PolarHBondContact NE2-OH 3.46Å; Q355-Y368 PolarHBondContact OE1-OH 2.99Å; Q355-F509 HydrophobicContact CG-CB 4.23Å; Q355-F509 HydrophobicContact CG-CD1 3.78Å; Q355-F509 HydrophobicContact CG-CD2 4.01Å; Q355-F509 HydrophobicContact CG-CE1 4.1Å; Q355-F509 HydrophobicContact CG-CE2 4.33Å; Q355-F509 HydrophobicContact CG-CG 3.73Å; Q355-F509 HydrophobicContact CG-CZ 4.37Å
356	L	93.9	Very high	92.6	Very high	23 Å²	23	45.6 Å²	45.6	12%	0.12	26%	0.257	C	S	.	.			trans	-66.7	-23.9	175.7	-70.8	175.8	0	0	0	113.1	I380 F389 L444 V445 V464 V507	L356-I380 HydrophobicContact CB-CD1 3.81Å; L356-I380 VanDerWaalsContact O-CD1 3.32Å; L356-I380 WeakPolarHBondContact O-CD1 3.36Å; L356-F389 HydrophobicContact CD2-CE1 4.27Å; L356-F389 HydrophobicContact CD2-CE2 3.88Å; L356-F389 HydrophobicContact CD2-CZ 3.6Å; L356-L444 HydrophobicContact CD2-CB 4.12Å; L356-L444 HydrophobicContact CD2-CD1 4.1Å; L356-V445 HydrophobicContact CD2-CG2 4.41Å; L356-V464 HydrophobicContact CD1-CG1 3.95Å; L356-V507 HydrophobicContact CB-CB 4.48Å; L356-V507 HydrophobicContact CB-CG2 3.97Å; L356-V507 HydrophobicContact CD1-CB 4.35Å; L356-V507 HydrophobicContact CD1-CG1 3.94Å
357	C	94.3	Very high	92.7	Very high	6 Å²	6	44.3 Å²	44.3	4%	0.041	25%	0.252	C	S	.	.	S	Bend	trans	-79.8	123.3	178.5	-67.3	0	0	0	0	111.4	Q355 Q376 C378 V507	Q355-C357 PolarHBondContact O-N 3.38Å; C357-Q376 HydrophobicContact CB-CG 3.72Å; C357-Q376 PolarHBondContact O-NE2 2.84Å; C357-C378 WeakPolarHBondContact CA-SG 3.42Å; C357-C378 HydrophobicContact CB-CB 3.96Å; C357-C378 WeakPolarHBondContact CB-SG 3.26Å; C357-C378 WeakPolarHBondContact SG-CB 3.49Å; C357-C378 PolarHBondContact SG-N 3.37Å; C357-C378 CovalentContact SG-SG 2.03Å; C357-C378 PolarHBondContact SG-SG 3.36Å; C357-V507 VanDerWaalsContact SG-CG2 3.53Å
358	P	91.6	Very high	92.7	Very high	102 Å²	102	43.1 Å²	43.1	66%	0.662	25%	0.246	S	C	*	.			trans	-71	136.5	177.2	29.6	-34	0	0	0	111
359	D	92.4	Very high	92.6	Very high	51 Å²	51	40.7 Å²	40.7	27%	0.273	23%	0.233	S	C	.	.			trans	-154.7	179.8	170.3	-152.9	-28	0	0	0	109	R363 L364	D359-R363 WeakPolarHBondContact OD1-CD 3.43Å; D359-R363 IonicContact OD1-CZ 3.99Å; D359-R363 IonicContact OD1-NE 3.57Å; D359-R363 IonicContact OD1-NH1 3.06Å; D359-R363 PolarHBondContact OD1-NH1 2.99Å; D359-R363 IonicContact OD2-CZ 2.61Å; D359-R363 IonicContact OD2-NE 3.87Å; D359-R363 PolarHBondContact OD2-NE 3.4Å; D359-R363 IonicContact OD2-NH1 3.07Å; D359-R363 PolarHBondContact OD2-NH1 3Å; D359-R363 IonicContact OD2-NH2 3.1Å; D359-L364 HydrophobicContact CB-CD2 3.9Å; D359-L364 HydrophobicContact CB-CG 3.99Å; D359-L364 WeakPolarHBondContact O-CD1 3.26Å
360	T	92.8	Very high	92.5	Very high	72 Å²	72	40.5 Å²	40.5	44%	0.442	23%	0.232	S	C	.	.			trans	-66.8	145.2	171.8	55.3	0	0	0	0	111.5	T362 R363 L364	T360-T362 PolarHBondContact O-N 2.61Å; T360-T362 PolarHBondContact OG1-OG1 3.07Å; T360-R363 PolarHBondContact O-N 3.1Å; T360-R363 WeakPolarHBondContact OG1-CD 3.41Å; T360-R363 VanDerWaalsContact OG1-CG 3.27Å; T360-R363 WeakPolarHBondContact OG1-CG 3.31Å; T360-L364 WeakPolarHBondContact O-CG 3.44Å; T360-L364 PolarHBondContact O-N 3.08Å
361	E	92.4	Very high	92.3	Very high	127 Å²	127	37 Å²	37	59%	0.593	22%	0.216	S	C	*	.	H	α-helix	trans	-54.6	-39.3	-179.7	-176.2	177.4	178.6	0	0	112.6	R363 L364 N365	E361-R363 VanDerWaalsContact C-N 3.28Å; E361-R363 PolarHBondContact O-N 3.02Å; E361-L364 PolarHBondContact O-N 2.86Å; E361-N365 WeakPolarHBondContact CG-ND2 3.38Å; E361-N365 VanDerWaalsContact O-CB 3.24Å; E361-N365 WeakPolarHBondContact O-CB 2.97Å; E361-N365 PolarHBondContact O-N 3.43Å; E361-N365 PolarHBondContact O-ND2 3.44Å
362	T	91.1	Very high	92.5	Very high	86 Å²	86	35.5 Å²	35.5	53%	0.528	20%	0.199	S	C	.	.	H	α-helix	trans	-61.3	-35.4	176.5	51.4	0	0	0	0	113	T360 S721	T360-T362 PolarHBondContact O-N 2.61Å; T360-T362 PolarHBondContact OG1-OG1 3.07Å; T362-S721 PolarHBondContact OG1-O 2.96Å
363	R	92.6	Very high	92.6	Very high	94 Å²	94	36.4 Å²	36.4	36%	0.355	20%	0.202	S	C	.	.	H	α-helix	trans	-78.8	-43	178.3	-69	-179.5	68.6	-159.5	9	111.1	D359 T360 E361 N365 A366 Y374	D359-R363 WeakPolarHBondContact OD1-CD 3.43Å; D359-R363 IonicContact OD1-CZ 3.99Å; D359-R363 IonicContact OD1-NE 3.57Å; D359-R363 IonicContact OD1-NH1 3.06Å; D359-R363 PolarHBondContact OD1-NH1 2.99Å; D359-R363 IonicContact OD2-CZ 2.61Å; D359-R363 IonicContact OD2-NE 3.87Å; D359-R363 PolarHBondContact OD2-NE 3.4Å; D359-R363 IonicContact OD2-NH1 3.07Å; D359-R363 PolarHBondContact OD2-NH1 3Å; D359-R363 IonicContact OD2-NH2 3.1Å; T360-R363 PolarHBondContact O-N 3.1Å; T360-R363 WeakPolarHBondContact OG1-CD 3.41Å; T360-R363 VanDerWaalsContact OG1-CG 3.27Å; T360-R363 WeakPolarHBondContact OG1-CG 3.31Å; E361-R363 VanDerWaalsContact C-N 3.28Å; E361-R363 PolarHBondContact O-N 3.02Å; R363-N365 VanDerWaalsContact C-N 3.31Å; R363-N365 PolarHBondContact O-N 3.47Å; R363-A366 VanDerWaalsContact O-CB 3.25Å; R363-A366 WeakPolarHBondContact O-CB 3.33Å; R363-A366 PolarHBondContact O-N 3.34Å; R363-A366 VanDerWaalsContact O-N 3.15Å; R363-Y374 VanDerWaalsContact O-CE2 3.24Å; R363-Y374 WeakPolarHBondContact O-CE2 3.39Å
364	L	94	Very high	92.7	Very high	12 Å²	12	34.8 Å²	34.8	6%	0.063	19%	0.192	C	C	.	.	H	α-helix	trans	-60.3	-41.9	176	-64.3	168.3	0	0	0	111.5	Q355 D359 T360 E361 A366 A367	Q355-L364 HydrophobicContact CB-CD2 3.98Å; Q355-L364 HydrophobicContact CG-CD2 4.19Å; D359-L364 HydrophobicContact CB-CD2 3.9Å; D359-L364 HydrophobicContact CB-CG 3.99Å; D359-L364 WeakPolarHBondContact O-CD1 3.26Å; T360-L364 WeakPolarHBondContact O-CG 3.44Å; T360-L364 PolarHBondContact O-N 3.08Å; E361-L364 PolarHBondContact O-N 2.86Å; L364-A366 PolarHBondContact O-N 3.31Å; L364-A367 VanDerWaalsContact O-CB 3.3Å; L364-A367 WeakPolarHBondContact O-CB 3.35Å; L364-A367 PolarHBondContact O-N 3.44Å
365	N	93.8	Very high	92.7	Very high	39 Å²	39	39.5 Å²	39.5	21%	0.209	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-69.7	-17.3	179.7	-69.5	-9	0	0	0	113.4	E350 G351 E361 R363 A367 Y368	E350-N365 VanDerWaalsContact CA-OD1 3.31Å; E350-N365 WeakPolarHBondContact CA-OD1 3.47Å; E350-N365 WeakPolarHBondContact CB-OD1 3.35Å; G351-N365 PolarHBondContact N-OD1 3.05Å; E361-N365 WeakPolarHBondContact CG-ND2 3.38Å; E361-N365 VanDerWaalsContact O-CB 3.24Å; E361-N365 WeakPolarHBondContact O-CB 2.97Å; E361-N365 PolarHBondContact O-N 3.43Å; E361-N365 PolarHBondContact O-ND2 3.44Å; R363-N365 VanDerWaalsContact C-N 3.31Å; R363-N365 PolarHBondContact O-N 3.47Å; N365-A367 PolarHBondContact O-N 3.31Å; N365-Y368 PolarHBondContact O-N 3.09Å; N365-Y368 VanDerWaalsContact O-N 3.11Å
366	A	92.8	Very high	92.7	Very high	16 Å²	16	39.7 Å²	39.7	13%	0.132	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-62.9	-23.8	174.9	0	0	0	0	0	112.5	R363 L364 Y368 S369 Y374 Y723	R363-A366 VanDerWaalsContact O-CB 3.25Å; R363-A366 WeakPolarHBondContact O-CB 3.33Å; R363-A366 PolarHBondContact O-N 3.34Å; R363-A366 VanDerWaalsContact O-N 3.15Å; L364-A366 PolarHBondContact O-N 3.31Å; A366-Y368 PolarHBondContact O-N 3.48Å; A366-S369 WeakPolarHBondContact O-CB 3.44Å; A366-S369 PolarHBondContact O-N 2.96Å; A366-Y374 HydrophobicContact CB-CD2 4.3Å; A366-Y723 HydrophobicContact CB-CD1 3.91Å; A366-Y723 HydrophobicContact CB-CG 3.92Å
367	A	93.6	Very high	92.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-57.2	-31.1	173.2	0	0	0	0	0	113.3	L364 N365 Y374 F509 V511	L364-A367 VanDerWaalsContact O-CB 3.3Å; L364-A367 WeakPolarHBondContact O-CB 3.35Å; L364-A367 PolarHBondContact O-N 3.44Å; N365-A367 PolarHBondContact O-N 3.31Å; A367-Y374 HydrophobicContact CB-CD1 3.79Å; A367-Y374 HydrophobicContact CB-CD2 4.01Å; A367-Y374 HydrophobicContact CB-CE1 4.1Å; A367-Y374 HydrophobicContact CB-CE2 4.32Å; A367-Y374 HydrophobicContact CB-CG 3.72Å; A367-F509 HydrophobicContact CB-CE1 3.89Å; A367-V511 HydrophobicContact CB-CG2 3.95Å; A367-V511 WeakPolarHBondContact O-CG2 3.5Å
368	Y	93.6	Very high	92.9	Very high	9 Å²	9	44.7 Å²	44.7	4%	0.035	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-99.1	14.4	-176.3	-51.3	-59.3	0	0	0	112.8	L330 F332 L349 E350 Q355 N365 A366	L330-Y368 PolarHBondContact N-O 3.06Å; F332-Y368 AromaticContact CD2-CD1 3.51Å; F332-Y368 HydrophobicContact CD2-CD1 3.51Å; F332-Y368 AromaticContact CD2-CE1 3.99Å; F332-Y368 HydrophobicContact CD2-CE1 3.99Å; F332-Y368 HydrophobicContact CD2-CG 4.4Å; F332-Y368 HydrophobicContact CE2-CD1 4.03Å; F332-Y368 HydrophobicContact CG-CD1 4.48Å; L349-Y368 HydrophobicContact CB-CE1 4.13Å; L349-Y368 HydrophobicContact CB-CE2 4.06Å; L349-Y368 WeakPolarHBondContact CB-OH 3.48Å; L349-Y368 HydrophobicContact CD1-CE1 4.45Å; L349-Y368 VanDerWaalsContact O-CE2 3.24Å; L349-Y368 WeakPolarHBondContact O-CE2 3.47Å; L349-Y368 PolarHBondContact O-OH 3.37Å; E350-Y368 HydrophobicContact CG-CD2 4.39Å; Q355-Y368 PolarHBondContact NE2-OH 3.46Å; Q355-Y368 PolarHBondContact OE1-OH 2.99Å; N365-Y368 PolarHBondContact O-N 3.09Å; N365-Y368 VanDerWaalsContact O-N 3.11Å; A366-Y368 PolarHBondContact O-N 3.48Å
369	S	91.7	Very high	93	Very high	28 Å²	28	45.3 Å²	45.3	20%	0.196	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-91.9	111.1	172.5	-175.3	0	0	0	0	110.6	T328 A366 G371 T372 Y513	T328-S369 CarbonylContact O-C 3.53Å; T328-S369 VanDerWaalsContact O-CA 3.32Å; T328-S369 WeakPolarHBondContact O-CA 3.33Å; A366-S369 WeakPolarHBondContact O-CB 3.44Å; A366-S369 PolarHBondContact O-N 2.96Å; S369-G371 PolarHBondContact O-N 3.38Å; S369-T372 VanDerWaalsContact O-CB 3.3Å; S369-T372 WeakPolarHBondContact O-CB 3.45Å; S369-T372 PolarHBondContact O-N 3.18Å; S369-T372 PolarHBondContact O-OG1 2.92Å; S369-T372 PolarHBondContact OG-OG1 3.24Å; S369-Y513 PolarHBondContact O-OH 3.45Å
370	F	89.8	Confident	93.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	132.4	178.5	-170.7	-114.8	0	0	0	111.7	F319 F321 T328 L330 T372 V472 L474 I483 Y513 V596	F319-F370 HydrophobicContact CB-CD1 3.42Å; F319-F370 VanDerWaalsContact CB-CD1 3.42Å; F319-F370 HydrophobicContact CB-CE1 3.43Å; F319-F370 VanDerWaalsContact CB-CE1 3.43Å; F319-F370 HydrophobicContact CB-CG 4.27Å; F319-F370 HydrophobicContact CB-CZ 4.33Å; F319-F370 HydrophobicContact CD1-CB 4.04Å; F319-F370 AromaticContact CD1-CD1 3.9Å; F319-F370 HydrophobicContact CD1-CD1 3.9Å; F319-F370 AromaticContact CD1-CG 3.9Å; F319-F370 HydrophobicContact CD1-CG 3.9Å; F319-F370 HydrophobicContact CD2-CD1 4.43Å; F319-F370 HydrophobicContact CD2-CE1 4.26Å; F319-F370 HydrophobicContact CD2-CZ 4.4Å; F319-F370 HydrophobicContact CE1-CB 4.43Å; F319-F370 HydrophobicContact CE1-CG 4.45Å; F319-F370 AromaticContact CG-CD1 3.66Å; F319-F370 HydrophobicContact CG-CD1 3.66Å; F319-F370 HydrophobicContact CG-CD2 4.5Å; F319-F370 AromaticContact CG-CE1 3.83Å; F319-F370 HydrophobicContact CG-CE1 3.83Å; F319-F370 HydrophobicContact CG-CG 4.02Å; F319-F370 HydrophobicContact CG-CZ 4.39Å; F321-F370 AromaticContact CE1-CD1 3.73Å; F321-F370 HydrophobicContact CE1-CD1 3.73Å; F321-F370 HydrophobicContact CE1-CE1 4.3Å; F321-F370 WeakPolarHBondContact CE1-O 3.48Å; F321-F370 HydrophobicContact CZ-CD1 4.34Å; T328-F370 WeakPolarHBondContact O-CB 3.27Å; T328-F370 PolarHBondContact O-N 3.34Å; L330-F370 HydrophobicContact CD1-CD2 4.23Å; L330-F370 HydrophobicContact CD2-CD2 4.15Å; L330-F370 HydrophobicContact CG-CB 4.21Å; L330-F370 HydrophobicContact CG-CD2 4.39Å; F370-T372 VanDerWaalsContact C-N 3.3Å; F370-T372 PolarHBondContact O-N 3.34Å; F370-V472 HydrophobicContact CE2-CG1 3.98Å; F370-L474 HydrophobicContact CZ-CD1 4.45Å; F370-I483 HydrophobicContact CE2-CG2 3.66Å; F370-I483 HydrophobicContact CZ-CG2 3.67Å; F370-Y513 WeakPolarHBondContact CA-OH 3.18Å; F370-Y513 HydrophobicContact CD2-CD1 4.01Å; F370-Y513 AromaticContact CD2-CE1 3.43Å; F370-Y513 HydrophobicContact CD2-CE1 3.43Å; F370-Y513 VanDerWaalsContact CD2-CE1 3.43Å; F370-Y513 AromaticContact CE2-CD1 3.82Å; F370-Y513 HydrophobicContact CE2-CD1 3.82Å; F370-Y513 AromaticContact CE2-CE1 3.71Å; F370-Y513 HydrophobicContact CE2-CE1 3.71Å; F370-Y513 HydrophobicContact CG-CE1 4.33Å; F370-V596 HydrophobicContact CD1-CG2 4.08Å; F370-V596 HydrophobicContact CE1-CB 3.86Å; F370-V596 HydrophobicContact CE1-CG1 3.78Å; F370-V596 HydrophobicContact CE1-CG2 3.68Å; F370-V596 HydrophobicContact CZ-CG1 4.29Å
371	G	87.6	Confident	93.2	Very high	2 Å²	2	43.1 Å²	43.1	2%	0.021	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.4	6	-177.1	0	0	0	0	0	115.6	S369 Y513 D711	S369-G371 PolarHBondContact O-N 3.38Å; G371-Y513 VanDerWaalsContact N-CZ 3.31Å; G371-D711 WeakPolarHBondContact O-CA 3.21Å
372	T	91.7	Very high	93.2	Very high	11 Å²	11	37 Å²	37	7%	0.067	20%	0.198	C	C	.	.			trans	-107.4	106.5	176.5	-55.2	0	0	0	0	111	S369 F370 Y374 Y513 D711 Y723	S369-T372 VanDerWaalsContact O-CB 3.3Å; S369-T372 WeakPolarHBondContact O-CB 3.45Å; S369-T372 PolarHBondContact O-N 3.18Å; S369-T372 PolarHBondContact O-OG1 2.92Å; S369-T372 PolarHBondContact OG-OG1 3.24Å; F370-T372 VanDerWaalsContact C-N 3.3Å; F370-T372 PolarHBondContact O-N 3.34Å; T372-Y374 PolarHBondContact O-N 2.95Å; T372-Y513 WeakPolarHBondContact O-CE2 3.35Å; T372-D711 HydrophobicContact CG2-CB 3.87Å; T372-Y723 HydrophobicContact CG2-CD1 4.45Å
373	T	93.8	Very high	93.2	Very high	31 Å²	31	34.9 Å²	34.9	19%	0.19	19%	0.186	C	C	.	.			trans	-64.8	119.8	176.7	-59.1	0	0	0	0	109.9	M710 Y723 P726	T373-M710 HydrophobicContact CG2-SD 4.24Å; T373-M710 PolarHBondContact N-O 3Å; T373-Y723 WeakPolarHBondContact O-CE1 3.43Å; T373-Y723 PolarHBondContact O-OH 3.11Å; T373-P726 HydrophobicContact CG2-CG 4Å
374	Y	94.8	Very high	93.1	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.008	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	136.4	-178.5	-174.7	-92.4	0	0	0	110.5	R363 A366 A367 T372 Q376 F509 S510 V511 Y723	R363-Y374 VanDerWaalsContact O-CE2 3.24Å; R363-Y374 WeakPolarHBondContact O-CE2 3.39Å; A366-Y374 HydrophobicContact CB-CD2 4.3Å; A367-Y374 HydrophobicContact CB-CD1 3.79Å; A367-Y374 HydrophobicContact CB-CD2 4.01Å; A367-Y374 HydrophobicContact CB-CE1 4.1Å; A367-Y374 HydrophobicContact CB-CE2 4.32Å; A367-Y374 HydrophobicContact CB-CG 3.72Å; T372-Y374 PolarHBondContact O-N 2.95Å; Y374-Q376 HydrophobicContact CE1-CB 3.59Å; Y374-Q376 VanDerWaalsContact OH-CD 3.22Å; Y374-Q376 PolarHBondContact OH-OE1 3.31Å; Y374-F509 AromaticContact CD1-CD1 3.71Å; Y374-F509 HydrophobicContact CD1-CD1 3.71Å; Y374-F509 HydrophobicContact CD1-CE1 4.07Å; Y374-F509 AromaticContact CE1-CD1 3.63Å; Y374-F509 HydrophobicContact CE1-CD1 3.63Å; Y374-F509 HydrophobicContact CE1-CE1 4.21Å; Y374-S510 CarbonylContact O-C 3.49Å; Y374-S510 WeakPolarHBondContact O-CA 3.44Å; Y374-S510 WeakPolarHBondContact O-CB 3.45Å; Y374-V511 PolarHBondContact N-O 3.11Å; Y374-V511 VanDerWaalsContact N-O 3.12Å; Y374-V511 PolarHBondContact O-N 2.91Å; Y374-Y723 WeakPolarHBondContact CA-OH 3.3Å; Y374-Y723 HydrophobicContact CD2-CD1 4.07Å; Y374-Y723 HydrophobicContact CD2-CD2 4.04Å; Y374-Y723 AromaticContact CD2-CE1 3.81Å; Y374-Y723 HydrophobicContact CD2-CE1 3.81Å; Y374-Y723 AromaticContact CD2-CE2 3.79Å; Y374-Y723 HydrophobicContact CD2-CE2 3.79Å; Y374-Y723 HydrophobicContact CD2-CG 4.19Å; Y374-Y723 AromaticContact CD2-CZ 3.68Å; Y374-Y723 AromaticContact CE2-CD2 3.78Å; Y374-Y723 HydrophobicContact CE2-CD2 3.78Å; Y374-Y723 AromaticContact CE2-CE2 3.75Å; Y374-Y723 HydrophobicContact CE2-CE2 3.75Å; Y374-Y723 HydrophobicContact CE2-CG 4.21Å
375	Q	94.6	Very high	93.1	Very high	105 Å²	105	34.3 Å²	34.3	49%	0.491	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	129.2	173.7	-170.8	177.1	18.1	0	0	109.5	N377 Y723	Q375-N377 PolarHBondContact NE2-ND2 3.48Å; Q375-Y723 PolarHBondContact N-OH 2.8Å; Q375-Y723 PolarHBondContact O-OH 2.96Å
376	Q	94.8	Very high	93	Very high	18 Å²	18	34.5 Å²	34.5	8%	0.084	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	123.3	178.3	-172.2	-175.6	21.1	0	0	109	C357 Y374 S508 F509	C357-Q376 HydrophobicContact CB-CG 3.72Å; C357-Q376 PolarHBondContact O-NE2 2.84Å; Y374-Q376 HydrophobicContact CE1-CB 3.59Å; Y374-Q376 VanDerWaalsContact OH-CD 3.22Å; Y374-Q376 PolarHBondContact OH-OE1 3.31Å; Q376-S508 CarbonylContact O-C 3.54Å; Q376-S508 VanDerWaalsContact O-CA 3.32Å; Q376-S508 WeakPolarHBondContact O-CA 3.46Å; Q376-F509 PolarHBondContact N-O 2.67Å; Q376-F509 PolarHBondContact O-N 3.39Å
377	N	95.4	Very high	92.9	Very high	98 Å²	98	40 Å²	40	52%	0.524	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136	178.9	-55	-30.5	0	0	0	108.9	Q375 V507 S508	Q375-N377 PolarHBondContact NE2-ND2 3.48Å; N377-V507 WeakPolarHBondContact CA-O 3.29Å; N377-S508 WeakPolarHBondContact OD1-CB 3.22Å
378	C	95.4	Very high	92.8	Very high	36 Å²	36	44.1 Å²	44.1	24%	0.243	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	166.9	174.5	68.9	0	0	0	0	111.4	C357 V507	C357-C378 WeakPolarHBondContact CA-SG 3.42Å; C357-C378 HydrophobicContact CB-CB 3.96Å; C357-C378 WeakPolarHBondContact CB-SG 3.26Å; C357-C378 WeakPolarHBondContact SG-CB 3.49Å; C357-C378 PolarHBondContact SG-N 3.37Å; C357-C378 CovalentContact SG-SG 2.03Å; C357-C378 PolarHBondContact SG-SG 3.36Å; C378-V507 PolarHBondContact N-O 3.44Å; C378-V507 VanDerWaalsContact N-O 3.1Å; C378-V507 PolarHBondContact O-N 3.37Å
379	E	95.2	Very high	92.8	Very high	114 Å²	114	46.8 Å²	46.8	53%	0.533	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.4	171.6	-73.2	-177.2	-167.3	0	0	109.8	S504 V505 K506	E379-S504 PolarHBondContact OE2-OG 3.15Å; E379-V505 WeakPolarHBondContact CA-O 3.33Å; E379-K506 HydrophobicContact CG-CG 3.58Å; E379-K506 WeakPolarHBondContact OE1-CE 3.18Å; E379-K506 IonicContact OE1-NZ 3.05Å
380	I	93.8	Very high	92.7	Very high	15 Å²	15	48.6 Å²	48.6	8%	0.077	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.7	-179.5	-51.5	179.6	0	0	0	108.9	L356 K384 I385 S504 V505 V507	L356-I380 HydrophobicContact CB-CD1 3.81Å; L356-I380 VanDerWaalsContact O-CD1 3.32Å; L356-I380 WeakPolarHBondContact O-CD1 3.36Å; I380-K384 HydrophobicContact CG2-CB 4.48Å; I380-K384 HydrophobicContact CG2-CD 4.46Å; I380-I385 HydrophobicContact CB-CD1 4.17Å; I380-I385 HydrophobicContact CB-CG1 4.32Å; I380-I385 HydrophobicContact CG2-CD1 4.03Å; I380-I385 HydrophobicContact CG2-CG1 3.63Å; I380-S504 CarbonylContact O-C 3.49Å; I380-S504 WeakPolarHBondContact O-CA 3.47Å; I380-V505 HydrophobicContact CB-CG1 4.39Å; I380-V505 PolarHBondContact N-O 3.46Å; I380-V505 PolarHBondContact O-N 3.07Å; I380-V507 HydrophobicContact CD1-CG2 3.64Å; I380-V507 HydrophobicContact CG1-CG2 4.06Å
381	P	93.9	Very high	92.8	Very high	62 Å²	62	52.4 Å²	52.4	40%	0.403	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	138.5	172.6	-23	33.6	0	0	0	112	S383 K384 I385	P381-S383 VanDerWaalsContact C-N 3.29Å; P381-S383 PolarHBondContact O-N 2.83Å; P381-K384 HydrophobicContact CB-CB 4.4Å; P381-K384 WeakPolarHBondContact O-CB 3.49Å; P381-K384 PolarHBondContact O-N 3.31Å; P381-K384 VanDerWaalsContact O-N 3.11Å; P381-I385 PolarHBondContact O-N 2.71Å
382	I	92.4	Very high	93.1	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-38	-179.7	-58.9	-55.3	0	0	0	111.7	K384 I385 L386 I462 I495 A500 Q503 V505	I382-K384 VanDerWaalsContact C-N 3.25Å; I382-K384 PolarHBondContact O-N 2.93Å; I382-I385 HydrophobicContact CD1-CD1 4.35Å; I382-I385 PolarHBondContact O-N 3.29Å; I382-I385 VanDerWaalsContact O-N 3.13Å; I382-L386 HydrophobicContact CG2-CD1 4.24Å; I382-L386 HydrophobicContact CG2-CG 4.43Å; I382-L386 WeakPolarHBondContact O-CG 3.36Å; I382-L386 PolarHBondContact O-N 3.46Å; I382-I462 HydrophobicContact CD1-CD1 4.31Å; I382-I462 HydrophobicContact CG2-CD1 3.86Å; I382-I495 HydrophobicContact CD1-CD1 3.84Å; I382-I495 HydrophobicContact CD1-CG2 4.03Å; I382-I495 HydrophobicContact CG1-CG2 4.38Å; I382-A500 HydrophobicContact CB-CB 4.35Å; I382-A500 HydrophobicContact CG2-CB 3.97Å; I382-Q503 HydrophobicContact CG1-CB 3.99Å; I382-Q503 PolarHBondContact N-O 3.42Å; I382-V505 HydrophobicContact CD1-CB 3.99Å; I382-V505 HydrophobicContact CD1-CG1 3.95Å
383	S	91.2	Very high	93.4	Very high	40 Å²	40	55.1 Å²	55.1	28%	0.28	29%	0.294	S	S	.	.	H	α-helix	trans	-55.2	-39.6	174.6	58.8	0	0	0	0	113	P381 I387 A500	P381-S383 VanDerWaalsContact C-N 3.29Å; P381-S383 PolarHBondContact O-N 2.83Å; S383-I387 WeakPolarHBondContact O-CD1 3.5Å; S383-I387 WeakPolarHBondContact O-CG1 3.25Å; S383-I387 PolarHBondContact O-N 2.89Å; S383-A500 PolarHBondContact N-O 2.84Å
384	K	92.3	Very high	93.5	Very high	92 Å²	92	53.7 Å²	53.7	40%	0.4	29%	0.285	S	S	.	.	H	α-helix	trans	-69.2	-42.7	176.4	-177.4	173.5	178.1	179.3	0	111.6	I380 P381 I382 L386 I387 D388	I380-K384 HydrophobicContact CG2-CB 4.48Å; I380-K384 HydrophobicContact CG2-CD 4.46Å; P381-K384 HydrophobicContact CB-CB 4.4Å; P381-K384 WeakPolarHBondContact O-CB 3.49Å; P381-K384 PolarHBondContact O-N 3.31Å; P381-K384 VanDerWaalsContact O-N 3.11Å; I382-K384 VanDerWaalsContact C-N 3.25Å; I382-K384 PolarHBondContact O-N 2.93Å; K384-L386 VanDerWaalsContact C-N 3.3Å; K384-L386 PolarHBondContact O-N 2.95Å; K384-I387 PolarHBondContact O-N 3.21Å; K384-I387 VanDerWaalsContact O-N 3.14Å; K384-D388 WeakPolarHBondContact CE-OD2 3.3Å; K384-D388 VanDerWaalsContact CG-OD2 3.25Å; K384-D388 WeakPolarHBondContact CG-OD2 3.26Å; K384-D388 WeakPolarHBondContact O-CB 3.36Å; K384-D388 PolarHBondContact O-N 3.21Å
385	I	92.6	Very high	93.6	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.015	29%	0.288	C	S	.	.	H	α-helix	trans	-58.4	-42.8	177.4	-69.4	176.6	0	0	0	111.5	I380 P381 I382 I387 D388 F389 V445 I462 V464 V505	I380-I385 HydrophobicContact CB-CD1 4.17Å; I380-I385 HydrophobicContact CB-CG1 4.32Å; I380-I385 HydrophobicContact CG2-CD1 4.03Å; I380-I385 HydrophobicContact CG2-CG1 3.63Å; P381-I385 PolarHBondContact O-N 2.71Å; I382-I385 HydrophobicContact CD1-CD1 4.35Å; I382-I385 PolarHBondContact O-N 3.29Å; I382-I385 VanDerWaalsContact O-N 3.13Å; I385-I387 VanDerWaalsContact C-N 3.27Å; I385-I387 PolarHBondContact O-N 2.93Å; I385-D388 PolarHBondContact O-N 3.02Å; I385-F389 HydrophobicContact CG2-CD2 4.41Å; I385-F389 WeakPolarHBondContact O-CA 3.48Å; I385-F389 WeakPolarHBondContact O-CB 3.4Å; I385-F389 PolarHBondContact O-N 3.28Å; I385-V445 HydrophobicContact CG2-CB 4.44Å; I385-V445 HydrophobicContact CG2-CG1 3.59Å; I385-V445 HydrophobicContact CG2-CG2 3.99Å; I385-I462 HydrophobicContact CG2-CD1 4.13Å; I385-V464 HydrophobicContact CD1-CG2 4.37Å; I385-V464 HydrophobicContact CG2-CG2 4.46Å; I385-V505 HydrophobicContact CD1-CG1 3.26Å
386	L	91.3	Very high	93.7	Very high	42 Å²	42	49.5 Å²	49.5	22%	0.22	27%	0.265	C	S	.	.	H	α-helix	trans	-65.2	-30.3	179.3	-69.6	172.1	0	0	0	113.2	I382 K384 A447 P459 I462 A500	I382-L386 HydrophobicContact CG2-CD1 4.24Å; I382-L386 HydrophobicContact CG2-CG 4.43Å; I382-L386 WeakPolarHBondContact O-CG 3.36Å; I382-L386 PolarHBondContact O-N 3.46Å; K384-L386 VanDerWaalsContact C-N 3.3Å; K384-L386 PolarHBondContact O-N 2.95Å; L386-A447 HydrophobicContact CD2-CB 4.08Å; L386-P459 HydrophobicContact CD2-CG 3.69Å; L386-I462 HydrophobicContact CD2-CG2 3.8Å; L386-A500 HydrophobicContact CD1-CB 4.44Å
387	I	91.3	Very high	93.7	Very high	132 Å²	132	48.6 Å²	48.6	68%	0.677	26%	0.261	S	S	*	.	H	α-helix	trans	-79.9	-47.3	177.6	-66.2	166.1	0	0	0	110.7	S383 K384 I385	S383-I387 WeakPolarHBondContact O-CD1 3.5Å; S383-I387 WeakPolarHBondContact O-CG1 3.25Å; S383-I387 PolarHBondContact O-N 2.89Å; K384-I387 PolarHBondContact O-N 3.21Å; K384-I387 VanDerWaalsContact O-N 3.14Å; I385-I387 VanDerWaalsContact C-N 3.27Å; I385-I387 PolarHBondContact O-N 2.93Å
388	D	91.8	Very high	93.7	Very high	86 Å²	86	44 Å²	44	46%	0.46	24%	0.236	S	C	.	.	H	α-helix	trans	-75.7	-28.6	-174.1	-67.4	-9.1	0	0	0	111.9	K384 I385 P390	K384-D388 WeakPolarHBondContact CE-OD2 3.3Å; K384-D388 VanDerWaalsContact CG-OD2 3.25Å; K384-D388 WeakPolarHBondContact CG-OD2 3.26Å; K384-D388 WeakPolarHBondContact O-CB 3.36Å; K384-D388 PolarHBondContact O-N 3.21Å; I385-D388 PolarHBondContact O-N 3.02Å; D388-P390 VanDerWaalsContact C-CD 3.5Å
389	F	92.8	Very high	93.6	Very high	66 Å²	66	42.4 Å²	42.4	29%	0.289	23%	0.225	S	C	.	.			trans	-129.1	65.1	-176.6	-55.2	-83.5	0	0	0	112.9	L356 I385 T391 V445	L356-F389 HydrophobicContact CD2-CE1 4.27Å; L356-F389 HydrophobicContact CD2-CE2 3.88Å; L356-F389 HydrophobicContact CD2-CZ 3.6Å; I385-F389 HydrophobicContact CG2-CD2 4.41Å; I385-F389 WeakPolarHBondContact O-CA 3.48Å; I385-F389 WeakPolarHBondContact O-CB 3.4Å; I385-F389 PolarHBondContact O-N 3.28Å; F389-T391 VanDerWaalsContact C-N 3.29Å; F389-T391 PolarHBondContact O-N 3.41Å; F389-V445 HydrophobicContact CB-CB 3.77Å; F389-V445 HydrophobicContact CB-CG1 3.93Å; F389-V445 HydrophobicContact CB-CG2 4.09Å; F389-V445 HydrophobicContact CD1-CG2 4.45Å; F389-V445 HydrophobicContact CD2-CG2 4Å; F389-V445 HydrophobicContact CG-CB 4.11Å; F389-V445 HydrophobicContact CG-CG2 3.92Å
390	P	89.9	Confident	93.5	Very high	65 Å²	65	38.6 Å²	38.6	42%	0.422	21%	0.207	S	C	.	.	S	Bend	trans	-69.8	-26.1	-176.8	28.6	-35.6	0	0	0	113.3	D388 R451	D388-P390 VanDerWaalsContact C-CD 3.5Å; P390-R451 PolarHBondContact O-NH2 3.33Å
391	T	92.1	Very high	93.3	Very high	81 Å²	81	39.2 Å²	39.2	50%	0.497	21%	0.209	S	C	.	.	S	Bend	trans	-137.6	139	178.4	54.1	0	0	0	0	110.7	F389 V448	F389-T391 VanDerWaalsContact C-N 3.29Å; F389-T391 PolarHBondContact O-N 3.41Å; T391-V448 HydrophobicContact CG2-CG2 4.4Å
392	P	94.9	Very high	92.9	Very high	3 Å²	3	38.9 Å²	38.9	2%	0.019	21%	0.211	C	C	.	.			trans	-67.2	138.6	179.7	27.3	-34.2	0	0	0	111.8	M255 I339 F394 V445	M255-P392 HydrophobicContact CE-CG 4.34Å; I339-P392 HydrophobicContact CB-CG 4.19Å; I339-P392 HydrophobicContact CD1-CG 3.73Å; I339-P392 HydrophobicContact CG1-CG 3.93Å; P392-F394 HydrophobicContact CB-CE2 3.95Å; P392-F394 HydrophobicContact CB-CZ 4.06Å; P392-F394 HydrophobicContact CG-CE2 3.99Å; P392-F394 HydrophobicContact CG-CZ 4.15Å; P392-V445 WeakPolarHBondContact CA-O 3.47Å; P392-V445 WeakPolarHBondContact CB-O 3.34Å
393	I	96.5	Very high	92.3	Very high	67 Å²	67	41.4 Å²	41.4	34%	0.344	23%	0.225	S	C	.	.			trans	-109.5	136.4	166.3	-58.3	174.5	0	0	0	107.4	L344 Y395 F443	L344-I393 HydrophobicContact CD1-CG2 4.15Å; I393-Y395 HydrophobicContact CB-CE1 4.4Å; I393-Y395 HydrophobicContact CB-CE2 4.39Å; I393-Y395 HydrophobicContact CG2-CD1 4.3Å; I393-Y395 HydrophobicContact CG2-CE1 3.51Å; I393-Y395 HydrophobicContact CG2-CE2 4.29Å; I393-F443 WeakPolarHBondContact O-CB 3.23Å
394	F	97.3	Very high	91.6	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	140.6	-178.5	-60.6	-96.3	0	0	0	110.8	N251 V254 M255 S336 Y337 I339 P392 R441 I442 F443	N251-F394 HydrophobicContact CB-CD1 4.16Å; N251-F394 HydrophobicContact CB-CD2 4.02Å; N251-F394 HydrophobicContact CB-CE1 3.88Å; N251-F394 HydrophobicContact CB-CE2 3.77Å; N251-F394 HydrophobicContact CB-CG 4.23Å; N251-F394 HydrophobicContact CB-CZ 3.69Å; N251-F394 WeakPolarHBondContact ND2-CD2 3.48Å; V254-F394 HydrophobicContact CB-CD1 4.35Å; V254-F394 HydrophobicContact CB-CE1 4.18Å; V254-F394 HydrophobicContact CG1-CD1 4.26Å; V254-F394 HydrophobicContact CG1-CE1 4.28Å; M255-F394 HydrophobicContact CG-CE1 3.91Å; M255-F394 HydrophobicContact CG-CZ 3.62Å; M255-F394 HydrophobicContact SD-CZ 3.85Å; S336-F394 CarbonylContact C-O 3.45Å; S336-F394 VanDerWaalsContact CA-O 3.32Å; S336-F394 WeakPolarHBondContact CA-O 3.36Å; Y337-F394 PolarHBondContact N-O 3.06Å; Y337-F394 PolarHBondContact O-N 3.29Å; I339-F394 HydrophobicContact CB-CE2 4.42Å; I339-F394 HydrophobicContact CG1-CE2 4.39Å; P392-F394 HydrophobicContact CB-CE2 3.95Å; P392-F394 HydrophobicContact CB-CZ 4.06Å; P392-F394 HydrophobicContact CG-CE2 3.99Å; P392-F394 HydrophobicContact CG-CZ 4.15Å; F394-R441 HydrophobicContact CB-CG 3.94Å; F394-R441 HydrophobicContact CD1-CG 4.23Å; F394-I442 CarbonylContact C-O 3.45Å; F394-I442 VanDerWaalsContact CA-O 3.3Å; F394-I442 WeakPolarHBondContact CA-O 3.24Å; F394-F443 HydrophobicContact CD1-CB 4.06Å; F394-F443 HydrophobicContact CD1-CD1 4.25Å; F394-F443 HydrophobicContact CE1-CB 4.16Å; F394-F443 AromaticContact CE1-CD1 3.84Å; F394-F443 HydrophobicContact CE1-CD1 3.84Å; F394-F443 HydrophobicContact CE1-CG 4.27Å
395	Y	96.9	Very high	90.8	Very high	19 Å²	19	49.3 Å²	49.3	8%	0.075	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	125.4	-175.7	-54.4	-68.7	0	0	0	110.8	A334 A335 V353 L354 I393 R441 I442 L444	A334-Y395 HydrophobicContact CB-CD1 4.33Å; A335-Y395 WeakPolarHBondContact O-CA 3.46Å; V353-Y395 HydrophobicContact CG1-CE1 4.35Å; L354-Y395 HydrophobicContact CD2-CD2 4Å; L354-Y395 HydrophobicContact CD2-CE2 4.41Å; L354-Y395 HydrophobicContact CD2-CG 4.38Å; I393-Y395 HydrophobicContact CB-CE1 4.4Å; I393-Y395 HydrophobicContact CB-CE2 4.39Å; I393-Y395 HydrophobicContact CG2-CD1 4.3Å; I393-Y395 HydrophobicContact CG2-CE1 3.51Å; I393-Y395 HydrophobicContact CG2-CE2 4.29Å; Y395-R441 WeakPolarHBondContact O-CA 3.35Å; Y395-I442 PolarHBondContact N-O 3.01Å; Y395-I442 PolarHBondContact O-N 3.39Å; Y395-L444 HydrophobicContact CE2-CD1 4.28Å; Y395-L444 HydrophobicContact CE2-CG 4.15Å
396	D	95.8	Very high	90.1	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	116	161.1	-68.4	-13.8	0	0	0	107.3	A334 A335 Y398 R440 R441	A334-D396 CarbonylContact C-O 3.57Å; A334-D396 VanDerWaalsContact CA-O 3.23Å; A334-D396 WeakPolarHBondContact CA-O 3.35Å; A335-D396 HydrophobicContact CB-CB 4.39Å; A335-D396 PolarHBondContact N-O 3.42Å; A335-D396 PolarHBondContact O-N 3.45Å; D396-Y398 HydrophobicContact CB-CE2 3.81Å; D396-Y398 VanDerWaalsContact O-CD2 3.29Å; D396-Y398 WeakPolarHBondContact O-CD2 3.39Å; D396-Y398 WeakPolarHBondContact O-CE2 2.99Å; D396-R440 IonicContact OD2-CZ 2.74Å; D396-R440 IonicContact OD2-NH1 3.92Å; D396-R440 PolarHBondContact OD2-NH1 3.24Å; D396-R441 WeakPolarHBondContact OD1-CA 3.42Å; D396-R441 WeakPolarHBondContact OD1-CB 3.49Å; D396-R441 WeakPolarHBondContact OD1-CG 3.43Å; D396-R441 IonicContact OD1-CZ 3.71Å; D396-R441 IonicContact OD1-NE 3.61Å; D396-R441 PolarHBondContact OD1-NE 2.94Å; D396-R441 IonicContact OD1-NH2 3.31Å; D396-R441 IonicContact OD2-CZ 3.67Å; D396-R441 IonicContact OD2-NE 2.72Å; D396-R441 IonicContact OD2-NH2 2.86Å; D396-R441 PolarHBondContact OD2-NH2 3.28Å
397	V	96.1	Very high	89.7	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	139	-172.7	-177	0	0	0	0	111.5	F332 A334 L349 L354 V413 I442 I488	F332-V397 HydrophobicContact CD1-CG1 4.11Å; A334-V397 HydrophobicContact CB-CG2 4.4Å; L349-V397 HydrophobicContact CD1-CG1 3.85Å; L354-V397 HydrophobicContact CD1-CG2 4.34Å; V397-V413 HydrophobicContact CB-CB 4.36Å; V397-V413 HydrophobicContact CG1-CB 4.23Å; V397-V413 HydrophobicContact CG1-CG2 4.17Å; V397-V413 WeakPolarHBondContact O-CB 3.21Å; V397-V413 PolarHBondContact O-N 2.97Å; V397-I442 HydrophobicContact CG2-CD1 4.3Å; V397-I488 HydrophobicContact CB-CD1 3.9Å; V397-I488 HydrophobicContact CG1-CD1 3.89Å; V397-I488 HydrophobicContact CG2-CD1 4.02Å
398	Y	95	Very high	89.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	153	178.9	-50.6	-96.8	0	0	0	111.6	F41 L60 F332 V333 A335 W346 D396 I410 L411 A412 R440	F41-Y398 HydrophobicContact CE1-CD1 4.3Å; F41-Y398 AromaticContact CE1-CE1 3.87Å; F41-Y398 HydrophobicContact CE1-CE1 3.87Å; F41-Y398 HydrophobicContact CZ-CD1 4.04Å; F41-Y398 AromaticContact CZ-CE1 3.48Å; F41-Y398 HydrophobicContact CZ-CE1 3.48Å; F41-Y398 VanDerWaalsContact CZ-CE1 3.48Å; L60-Y398 VanDerWaalsContact CD1-OH 3.23Å; L60-Y398 WeakPolarHBondContact CD1-OH 3.36Å; F332-Y398 WeakPolarHBondContact CA-O 3.27Å; V333-Y398 PolarHBondContact N-O 2.83Å; V333-Y398 PolarHBondContact O-N 2.79Å; A335-Y398 HydrophobicContact CB-CE2 4.15Å; W346-Y398 AromaticContact CH2-CD2 3.81Å; W346-Y398 HydrophobicContact CH2-CD2 3.81Å; W346-Y398 AromaticContact CH2-CE2 3.58Å; W346-Y398 HydrophobicContact CH2-CE2 3.58Å; W346-Y398 AromaticContact CZ3-CD2 3.56Å; W346-Y398 HydrophobicContact CZ3-CD2 3.56Å; W346-Y398 AromaticContact CZ3-CE2 3.65Å; W346-Y398 HydrophobicContact CZ3-CE2 3.65Å; D396-Y398 HydrophobicContact CB-CE2 3.81Å; D396-Y398 VanDerWaalsContact O-CD2 3.29Å; D396-Y398 WeakPolarHBondContact O-CD2 3.39Å; D396-Y398 WeakPolarHBondContact O-CE2 2.99Å; Y398-I410 HydrophobicContact CD1-CB 4.42Å; Y398-I410 HydrophobicContact CD1-CD1 4.04Å; Y398-I410 HydrophobicContact CE1-CD1 4.42Å; Y398-I410 HydrophobicContact CG-CB 4.4Å; Y398-I410 HydrophobicContact CG-CD1 4.16Å; Y398-L411 CarbonylContact C-O 3.56Å; Y398-L411 WeakPolarHBondContact CA-O 3.31Å; Y398-L411 WeakPolarHBondContact CB-O 3.37Å; Y398-A412 HydrophobicContact CD1-CB 4Å; Y398-A412 HydrophobicContact CE1-CB 4.01Å; Y398-R440 VanDerWaalsContact CE1-NH2 3.28Å; Y398-R440 PolarHBondContact OH-NH1 2.89Å; Y398-R440 VanDerWaalsContact OH-NH1 3.14Å; Y398-R440 PolarHBondContact OH-NH2 3.31Å
399	L	93.8	Very high	89.6	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.021	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	119.8	168.7	-178.9	69.9	0	0	0	109.2	L315 L330 F332 I410 L411 V413 I483 P486	L315-L399 HydrophobicContact CD1-CD2 3.6Å; L315-L399 HydrophobicContact CD2-CD2 3.98Å; L315-L399 HydrophobicContact CG-CD2 4.45Å; L330-L399 HydrophobicContact CB-CD1 4.32Å; L330-L399 HydrophobicContact CD2-CD1 4.39Å; F332-L399 HydrophobicContact CD1-CB 4.34Å; F332-L399 HydrophobicContact CD1-CD1 4.13Å; F332-L399 HydrophobicContact CD2-CD1 4.47Å; F332-L399 HydrophobicContact CE1-CB 4.17Å; F332-L399 HydrophobicContact CE1-CD1 3.89Å; F332-L399 HydrophobicContact CE2-CD1 4.27Å; F332-L399 HydrophobicContact CG-CD1 4.41Å; F332-L399 HydrophobicContact CZ-CD1 3.97Å; L399-I410 CarbonylContact O-C 3.55Å; L399-I410 WeakPolarHBondContact O-CA 3.35Å; L399-L411 PolarHBondContact N-O 2.72Å; L399-L411 PolarHBondContact O-N 3.24Å; L399-V413 HydrophobicContact CB-CG2 4.28Å; L399-I483 HydrophobicContact CD2-CD1 4.41Å; L399-P486 HydrophobicContact CD2-CG 4.09Å
400	E	92.3	Very high	89.5	Confident	33 Å²	33	54.1 Å²	54.1	15%	0.154	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	131.2	173.5	-173.6	-161.1	155.5	0	0	110.1	F43 K331 Q408 Y409 I410	F43-E400 HydrophobicContact CD1-CG 4.29Å; K331-E400 HydrophobicContact CB-CB 3.94Å; K331-E400 PolarHBondContact O-N 3.07Å; E400-Q408 PolarHBondContact OE1-NE2 3.07Å; E400-Y409 WeakPolarHBondContact CA-O 3.25Å; E400-I410 HydrophobicContact CB-CG2 4.18Å
401	Y	89.4	Confident	89.6	Confident	28 Å²	28	51.2 Å²	51.2	11%	0.11	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	158.1	172.3	70.3	-83.2	0	0	0	111.7	S40 L315 P316 T317 Y409 L411	S40-Y401 WeakPolarHBondContact CB-OH 3.36Å; S40-Y401 PolarHBondContact OG-OH 2.96Å; S40-Y401 VanDerWaalsContact OG-OH 3.13Å; L315-Y401 HydrophobicContact CD2-CD1 3.59Å; L315-Y401 HydrophobicContact CD2-CD2 4.48Å; L315-Y401 HydrophobicContact CD2-CE1 3.96Å; L315-Y401 HydrophobicContact CD2-CG 3.88Å; P316-Y401 HydrophobicContact CG-CD2 3.75Å; P316-Y401 HydrophobicContact CG-CE2 3.56Å; T317-Y401 VanDerWaalsContact OG1-CB 3.28Å; T317-Y401 WeakPolarHBondContact OG1-CB 3.44Å; Y401-Y409 PolarHBondContact N-O 2.9Å; Y401-Y409 PolarHBondContact O-N 3.26Å; Y401-Y409 VanDerWaalsContact O-O 3.06Å; Y401-L411 HydrophobicContact CD1-CB 4.35Å; Y401-L411 HydrophobicContact CE1-CB 3.99Å
402	A	86.1	Confident	89.6	Confident	55 Å²	55	47.4 Å²	47.4	46%	0.455	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	136	173.1	0	0	0	0	0	109.7	H407	A402-H407 WeakPolarHBondContact CA-O 3.28Å
403	D	79.6	Confident	89.6	Confident	54 Å²	54	47.3 Å²	47.3	29%	0.289	23%	0.234	S	C	.	.			trans	-74.9	171	171	-171.8	30	0	0	0	111.4	N405 Q406 H407 Y409	D403-N405 PolarHBondContact O-N 3.44Å; D403-N405 VanDerWaalsContact O-N 3.09Å; D403-Q406 WeakPolarHBondContact O-CA 3.49Å; D403-Q406 PolarHBondContact O-N 3Å; D403-H407 PolarHBondContact N-O 3.03Å; D403-Y409 HydrophobicContact CB-CD2 4.03Å; D403-Y409 HydrophobicContact CB-CE2 4.06Å
404	E	75	Confident	89.5	Confident	178 Å²	178	44.1 Å²	44.1	83%	0.832	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-32.1	178.1	-65.8	-172.6	170.6	0	0	112.5	Q406	E404-Q406 VanDerWaalsContact C-N 3.26Å; E404-Q406 PolarHBondContact O-N 2.88Å
405	N	77.1	Confident	89.5	Confident	119 Å²	119	44.1 Å²	44.1	64%	0.636	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	13.7	176.9	-63.2	-54	0	0	0	114	D403 H407	D403-N405 PolarHBondContact O-N 3.44Å; D403-N405 VanDerWaalsContact O-N 3.09Å; N405-H407 VanDerWaalsContact CB-ND1 3.33Å; N405-H407 WeakPolarHBondContact CB-ND1 3.37Å; N405-H407 PolarHBondContact O-N 3.24Å; N405-H407 VanDerWaalsContact O-N 3.16Å; N405-H407 PolarHBondContact O-ND1 3.22Å; N405-H407 VanDerWaalsContact O-ND1 3.13Å
406	Q	77.5	Confident	89.4	Confident	172 Å²	172	43.6 Å²	43.6	80%	0.804	22%	0.216	S	C	*	.			trans	59.1	17.9	-176	-60.7	-163.9	-20.5	0	0	116.2	D403 E404	D403-Q406 WeakPolarHBondContact O-CA 3.49Å; D403-Q406 PolarHBondContact O-N 3Å; E404-Q406 VanDerWaalsContact C-N 3.26Å; E404-Q406 PolarHBondContact O-N 2.88Å
407	H	82.6	Confident	89.4	Confident	115 Å²	115	43.8 Å²	43.8	53%	0.532	22%	0.217	S	C	.	.			trans	-77.1	135.2	172.6	-67	87.4	0	0	0	110	A402 D403 N405 Y409	A402-H407 WeakPolarHBondContact CA-O 3.28Å; D403-H407 PolarHBondContact N-O 3.03Å; N405-H407 VanDerWaalsContact CB-ND1 3.33Å; N405-H407 WeakPolarHBondContact CB-ND1 3.37Å; N405-H407 PolarHBondContact O-N 3.24Å; N405-H407 VanDerWaalsContact O-N 3.16Å; N405-H407 PolarHBondContact O-ND1 3.22Å; N405-H407 VanDerWaalsContact O-ND1 3.13Å; H407-Y409 HydrophobicContact CB-CD2 4.26Å; H407-Y409 HydrophobicContact CB-CE2 3.75Å; H407-Y409 WeakPolarHBondContact O-CD2 3.46Å
408	Q	89.1	Confident	89.4	Confident	76 Å²	76	45.6 Å²	45.6	36%	0.355	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	123.7	178.6	-63.3	-173.1	-57.4	0	0	110.6	F43 E400	F43-Q408 HydrophobicContact CB-CB 4.11Å; F43-Q408 PolarHBondContact N-O 3.25Å; E400-Q408 PolarHBondContact OE1-NE2 3.07Å
409	Y	91	Very high	89.3	Confident	66 Å²	66	46.7 Å²	46.7	26%	0.259	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	155.6	174.2	-77.8	-95	0	0	0	110.1	F41 P42 E400 Y401 D403 H407	F41-Y409 VanDerWaalsContact C-CD1 3.45Å; F41-Y409 WeakPolarHBondContact O-CA 3.41Å; P42-Y409 HydrophobicContact CG-CD1 4.47Å; P42-Y409 HydrophobicContact CG-CE1 3.9Å; E400-Y409 WeakPolarHBondContact CA-O 3.25Å; Y401-Y409 PolarHBondContact N-O 2.9Å; Y401-Y409 PolarHBondContact O-N 3.26Å; Y401-Y409 VanDerWaalsContact O-O 3.06Å; D403-Y409 HydrophobicContact CB-CD2 4.03Å; D403-Y409 HydrophobicContact CB-CE2 4.06Å; H407-Y409 HydrophobicContact CB-CD2 4.26Å; H407-Y409 HydrophobicContact CB-CE2 3.75Å; H407-Y409 WeakPolarHBondContact O-CD2 3.46Å
410	I	92.1	Very high	89.2	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	137.3	169.3	44.1	166.3	0	0	0	109.9	S40 F41 F43 V333 W346 Y398 L399 E400	S40-I410 VanDerWaalsContact CA-O 3.27Å; S40-I410 WeakPolarHBondContact CA-O 3.3Å; F41-I410 HydrophobicContact CD2-CD1 3.99Å; F41-I410 HydrophobicContact CD2-CG1 3.99Å; F41-I410 HydrophobicContact CE2-CD1 3.29Å; F41-I410 HydrophobicContact CE2-CG1 3.78Å; F41-I410 HydrophobicContact CZ-CD1 3.59Å; F41-I410 HydrophobicContact CZ-CG1 4.09Å; F41-I410 PolarHBondContact N-O 3.19Å; F41-I410 WeakPolarHBondContact O-CG1 3.49Å; F41-I410 PolarHBondContact O-N 3.45Å; F43-I410 HydrophobicContact CB-CG1 4.2Å; F43-I410 HydrophobicContact CB-CG2 3.9Å; F43-I410 HydrophobicContact CD2-CD1 3.92Å; F43-I410 HydrophobicContact CD2-CG1 4.19Å; F43-I410 HydrophobicContact CD2-CG2 3.64Å; F43-I410 HydrophobicContact CE2-CG2 4.32Å; F43-I410 HydrophobicContact CG-CG2 3.78Å; V333-I410 HydrophobicContact CG2-CG2 3.95Å; W346-I410 HydrophobicContact CH2-CD1 3.81Å; W346-I410 HydrophobicContact CZ2-CD1 4.32Å; Y398-I410 HydrophobicContact CD1-CB 4.42Å; Y398-I410 HydrophobicContact CD1-CD1 4.04Å; Y398-I410 HydrophobicContact CE1-CD1 4.42Å; Y398-I410 HydrophobicContact CG-CB 4.4Å; Y398-I410 HydrophobicContact CG-CD1 4.16Å; L399-I410 CarbonylContact O-C 3.55Å; L399-I410 WeakPolarHBondContact O-CA 3.35Å; E400-I410 HydrophobicContact CB-CG2 4.18Å
411	L	91.9	Very high	89.1	Confident	4 Å²	4	47 Å²	47	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.2	173.4	178.1	67.8	0	0	0	109	F39 L315 Y398 L399 Y401 V413 P485	F39-L411 HydrophobicContact CB-CD1 4.28Å; L315-L411 HydrophobicContact CD1-CD2 3.76Å; L315-L411 HydrophobicContact CD2-CB 4.42Å; L315-L411 HydrophobicContact CD2-CD2 3.78Å; L315-L411 HydrophobicContact CG-CD2 3.82Å; Y398-L411 CarbonylContact C-O 3.56Å; Y398-L411 WeakPolarHBondContact CA-O 3.31Å; Y398-L411 WeakPolarHBondContact CB-O 3.37Å; L399-L411 PolarHBondContact N-O 2.72Å; L399-L411 PolarHBondContact O-N 3.24Å; Y401-L411 HydrophobicContact CD1-CB 4.35Å; Y401-L411 HydrophobicContact CE1-CB 3.99Å; L411-V413 PolarHBondContact O-N 3.35Å; L411-P485 HydrophobicContact CD2-CB 3.89Å; L411-P485 HydrophobicContact CD2-CG 4.06Å
412	A	92.4	Very high	89	Confident	2 Å²	2	47.3 Å²	47.3	2%	0.017	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	130.1	174.5	0	0	0	0	0	110.8	F39 W296 Y299 Y398 P414	F39-A412 PolarHBondContact O-N 2.84Å; W296-A412 HydrophobicContact CH2-CB 3.78Å; W296-A412 HydrophobicContact CZ3-CB 3.54Å; Y299-A412 WeakPolarHBondContact OH-CB 3.39Å; Y398-A412 HydrophobicContact CD1-CB 4Å; Y398-A412 HydrophobicContact CE1-CB 4.01Å; A412-P414 WeakPolarHBondContact O-CD 3.42Å
413	V	94.4	Very high	89	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.229	C	C	.	.			trans	-89.7	115.8	179.6	179	0	0	0	0	108.4	F332 V397 L399 L411 P486 I488	F332-V413 HydrophobicContact CD1-CG2 4.17Å; F332-V413 HydrophobicContact CE1-CG2 3.91Å; V397-V413 HydrophobicContact CB-CB 4.36Å; V397-V413 HydrophobicContact CG1-CB 4.23Å; V397-V413 HydrophobicContact CG1-CG2 4.17Å; V397-V413 WeakPolarHBondContact O-CB 3.21Å; V397-V413 PolarHBondContact O-N 2.97Å; L399-V413 HydrophobicContact CB-CG2 4.28Å; L411-V413 PolarHBondContact O-N 3.35Å; V413-P486 HydrophobicContact CG1-CB 4.38Å; V413-P486 WeakPolarHBondContact CG1-O 3.43Å; V413-I488 HydrophobicContact CB-CD1 4.38Å; V413-I488 HydrophobicContact CG1-CD1 3.62Å; V413-I488 HydrophobicContact CG1-CG1 3.69Å
414	P	94.9	Very high	89.3	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	24%	0.244	C	C	.	.			trans	-65.4	150.6	176	25.6	-34.9	0	0	0	112.2	Y299 V309 L310 A412 L438 P486 L487 I488	Y299-P414 HydrophobicContact CE1-CB 4.47Å; Y299-P414 HydrophobicContact CE2-CB 3.97Å; V309-P414 HydrophobicContact CG1-CB 4.35Å; V309-P414 HydrophobicContact CG1-CG 4.36Å; L310-P414 HydrophobicContact CD2-CG 3.73Å; A412-P414 WeakPolarHBondContact O-CD 3.42Å; P414-L438 HydrophobicContact CB-CB 4.29Å; P414-L438 HydrophobicContact CB-CD1 4.01Å; P414-L438 HydrophobicContact CB-CD2 4.49Å; P414-L438 HydrophobicContact CB-CG 4.5Å; P414-P486 VanDerWaalsContact CD-O 3.29Å; P414-P486 WeakPolarHBondContact CD-O 3.38Å; P414-L487 HydrophobicContact CB-CD1 4.28Å; P414-L487 HydrophobicContact CG-CD1 4.24Å; P414-L487 WeakPolarHBondContact O-CD1 3.4Å; P414-I488 PolarHBondContact O-N 3.47Å
415	V	96.3	Very high	89.9	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.8	-178.5	179.9	0	0	0	0	110.9	T439 R440 I442 I488 I490	V415-T439 WeakPolarHBondContact CB-O 3.41Å; V415-T439 PolarHBondContact N-O 3.2Å; V415-T439 PolarHBondContact O-N 3.2Å; V415-T439 PolarHBondContact O-OG1 3.48Å; V415-R440 WeakPolarHBondContact CG2-O 3.16Å; V415-I442 HydrophobicContact CB-CG2 4.26Å; V415-I442 HydrophobicContact CG1-CG2 3.52Å; V415-I442 HydrophobicContact CG2-CG2 3.86Å; V415-I488 CarbonylContact C-O 3.57Å; V415-I488 WeakPolarHBondContact CA-O 3.19Å; V415-I488 HydrophobicContact CG1-CG2 4.44Å; V415-I488 HydrophobicContact CG2-CB 4.2Å; V415-I488 HydrophobicContact CG2-CG2 4.49Å; V415-I490 HydrophobicContact CG1-CG2 3.66Å
416	L	95.9	Very high	90.5	Very high	8 Å²	8	46.5 Å²	46.5	4%	0.042	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	95.6	169.3	-171.3	72.3	0	0	0	109.7	L418 N428 W436 L438 L487 I488 T489 I490	L416-L418 HydrophobicContact CD2-CD2 4.17Å; L416-L418 HydrophobicContact CG-CD2 4.29Å; L416-L418 PolarHBondContact O-N 3.25Å; L416-N428 HydrophobicContact CD1-CB 3.7Å; L416-N428 VanDerWaalsContact CD1-CG 3.44Å; L416-N428 HydrophobicContact CG-CB 4.14Å; L416-W436 HydrophobicContact CD1-CB 3.83Å; L416-W436 HydrophobicContact CD1-CD2 3.8Å; L416-W436 HydrophobicContact CD1-CE3 4.03Å; L416-W436 HydrophobicContact CD1-CG 3.74Å; L416-W436 HydrophobicContact CD2-CD2 4.27Å; L416-W436 HydrophobicContact CD2-CE3 4.29Å; L416-W436 HydrophobicContact CD2-CZ3 4.41Å; L416-L438 HydrophobicContact CB-CD2 4.43Å; L416-L438 HydrophobicContact CD1-CD2 4.15Å; L416-L487 HydrophobicContact CB-CD1 4.02Å; L416-L487 HydrophobicContact CB-CD2 4.47Å; L416-L487 HydrophobicContact CB-CG 4.46Å; L416-I488 PolarHBondContact N-O 2.98Å; L416-T489 HydrophobicContact CD2-CG2 4.22Å; L416-T489 WeakPolarHBondContact O-CA 3.29Å; L416-I490 PolarHBondContact O-N 2.99Å
417	N	95.8	Very high	91	Very high	3 Å²	3	39 Å²	39	2%	0.016	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	110.8	175	-179.6	-2.9	0	0	0	110.1	M257 N419 L420 N428 I490	M257-N417 PolarHBondContact O-ND2 3.32Å; N417-N419 PolarHBondContact O-N 3Å; N417-N419 PolarHBondContact OD1-N 3.11Å; N417-L420 HydrophobicContact CB-CB 4.2Å; N417-L420 VanDerWaalsContact O-CB 3.32Å; N417-L420 WeakPolarHBondContact O-CB 3.37Å; N417-L420 PolarHBondContact O-N 3.35Å; N417-N428 VanDerWaalsContact O-CB 3.27Å; N417-N428 WeakPolarHBondContact O-CB 3.5Å; N417-N428 PolarHBondContact O-ND2 2.97Å; N417-I490 HydrophobicContact CB-CG2 4.14Å
418	L	95	Very high	91.5	Very high	39 Å²	39	33.7 Å²	33.7	20%	0.204	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-18.8	-177.4	-61.2	-173.6	0	0	0	113.5	L416 N428 Q429 T489 I490 A491	L416-L418 HydrophobicContact CD2-CD2 4.17Å; L416-L418 HydrophobicContact CG-CD2 4.29Å; L416-L418 PolarHBondContact O-N 3.25Å; L418-N428 VanDerWaalsContact CD2-O 3.27Å; L418-N428 WeakPolarHBondContact CD2-O 3.09Å; L418-Q429 PolarHBondContact O-NE2 3.45Å; L418-T489 HydrophobicContact CD1-CG2 3.97Å; L418-T489 HydrophobicContact CD2-CG2 3.88Å; L418-T489 HydrophobicContact CG-CG2 3.87Å; L418-I490 PolarHBondContact N-O 3.44Å; L418-A491 HydrophobicContact CB-CB 4.46Å; L418-A491 HydrophobicContact CD1-CB 4.05Å
419	N	93.8	Very high	91.5	Very high	23 Å²	23	35.7 Å²	35.7	12%	0.123	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-1.9	178.5	-57.6	80.9	0	0	0	112.8	M257 N417 Q421 Y492	M257-N419 HydrophobicContact CB-CB 4.27Å; M257-N419 HydrophobicContact CG-CB 3.99Å; M257-N419 HydrophobicContact SD-CB 3.77Å; N417-N419 PolarHBondContact O-N 3Å; N417-N419 PolarHBondContact OD1-N 3.11Å; N419-Q421 PolarHBondContact O-N 2.82Å; N419-Y492 PolarHBondContact ND2-O 2.77Å; N419-Y492 PolarHBondContact OD1-N 3.12Å; N419-Y492 PolarHBondContact OD1-O 2.95Å
420	L	91.8	Very high	91.2	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	17%	0.171	C	C	.	.			trans	-67.7	123	179.6	-172.3	158.2	0	0	0	110.7	M257 N258 N417 V427 L437 T439	M257-L420 WeakPolarHBondContact O-CA 3.45Å; N258-L420 HydrophobicContact CB-CD1 3.8Å; N258-L420 HydrophobicContact CB-CG 4.33Å; N417-L420 HydrophobicContact CB-CB 4.2Å; N417-L420 VanDerWaalsContact O-CB 3.32Å; N417-L420 WeakPolarHBondContact O-CB 3.37Å; N417-L420 PolarHBondContact O-N 3.35Å; L420-V427 HydrophobicContact CD2-CG2 3.62Å; L420-L437 HydrophobicContact CD1-CB 4.45Å; L420-L437 HydrophobicContact CD2-CB 4.33Å; L420-L437 HydrophobicContact CD2-CD1 4.15Å; L420-T439 HydrophobicContact CD1-CG2 3.53Å
421	Q	89.4	Confident	90.7	Very high	41 Å²	41	40.9 Å²	40.9	19%	0.192	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130.7	172.7	-63.4	179.2	12	0	0	111	S259 Y260 N419 I425 F426	S259-Q421 CarbonylContact C-O 3.58Å; S259-Q421 VanDerWaalsContact CA-O 3.28Å; S259-Q421 WeakPolarHBondContact CA-O 3.36Å; S259-Q421 PolarHBondContact OG-N 2.89Å; S259-Q421 VanDerWaalsContact OG-N 3.15Å; Y260-Q421 PolarHBondContact N-O 3.36Å; N419-Q421 PolarHBondContact O-N 2.82Å; Q421-I425 CarbonylContact C-O 3.49Å; Q421-I425 VanDerWaalsContact CA-O 3.32Å; Q421-I425 WeakPolarHBondContact CA-O 3.46Å; Q421-F426 HydrophobicContact CG-CD1 3.64Å; Q421-F426 HydrophobicContact CG-CE1 3.51Å; Q421-F426 HydrophobicContact CG-CE2 4.48Å; Q421-F426 HydrophobicContact CG-CG 4.21Å; Q421-F426 HydrophobicContact CG-CZ 3.99Å; Q421-F426 VanDerWaalsContact NE2-CE1 3.3Å
422	H	87.9	Confident	90.4	Very high	35 Å²	35	44.9 Å²	44.9	16%	0.162	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	115.3	168.1	-171.7	81.9	0	0	0	108.4	Y260 K424 I425 V427 L437	Y260-H422 AromaticContact CD1-CE1 3.58Å; Y260-H422 AromaticContact CD1-ND1 3.66Å; Y260-H422 AromaticContact CE1-CE1 4Å; Y260-H422 CarbonylContact O-C 3.58Å; Y260-H422 WeakPolarHBondContact O-CA 3.19Å; H422-K424 VanDerWaalsContact C-N 3.27Å; H422-K424 PolarHBondContact O-N 3.39Å; H422-I425 PolarHBondContact N-O 3.37Å; H422-I425 PolarHBondContact O-N 2.97Å; H422-I425 VanDerWaalsContact O-N 3.1Å; H422-V427 HydrophobicContact CB-CG1 3.76Å; H422-V427 HydrophobicContact CB-CG2 4.17Å; H422-L437 HydrophobicContact CB-CD1 3.94Å
423	N	86.3	Confident	90.1	Very high	57 Å²	57	46.7 Å²	46.7	31%	0.305	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.5	45.8	-172.8	-58.6	-42.5	0	0	0	112.9	Y260 F262 I425	Y260-N423 PolarHBondContact O-N 2.77Å; F262-N423 WeakPolarHBondContact CD2-ND2 3.29Å; F262-N423 WeakPolarHBondContact CD2-OD1 3.43Å; F262-N423 WeakPolarHBondContact CE2-ND2 3.43Å; F262-N423 PolarHBondContact N-OD1 3.4Å; N423-I425 PolarHBondContact O-N 3.26Å
424	K	84.1	Confident	89.7	Confident	139 Å²	139	47.8 Å²	47.8	60%	0.604	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	10.6	-179.7	-50.8	174.4	-177.8	174.1	0	115.5	D261 H422	D261-K424 WeakPolarHBondContact OD2-CE 2.82Å; H422-K424 VanDerWaalsContact C-N 3.27Å; H422-K424 PolarHBondContact O-N 3.39Å
425	I	87.6	Confident	89.3	Confident	113 Å²	113	52.3 Å²	52.3	58%	0.579	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.9	175.3	-58.7	172.1	0	0	0	109	Q421 H422 N423 V427	Q421-I425 CarbonylContact C-O 3.49Å; Q421-I425 VanDerWaalsContact CA-O 3.32Å; Q421-I425 WeakPolarHBondContact CA-O 3.46Å; H422-I425 PolarHBondContact N-O 3.37Å; H422-I425 PolarHBondContact O-N 2.97Å; H422-I425 VanDerWaalsContact O-N 3.1Å; N423-I425 PolarHBondContact O-N 3.26Å; I425-V427 HydrophobicContact CG2-CG1 4.46Å; I425-V427 PolarHBondContact O-N 3.22Å
426	F	89.9	Confident	89	Confident	80 Å²	80	54.5 Å²	54.5	35%	0.351	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	90.5	172.2	-66.8	-78.6	0	0	0	110.5	Q421 N428 Q429	Q421-F426 HydrophobicContact CG-CD1 3.64Å; Q421-F426 HydrophobicContact CG-CE1 3.51Å; Q421-F426 HydrophobicContact CG-CE2 4.48Å; Q421-F426 HydrophobicContact CG-CG 4.21Å; Q421-F426 HydrophobicContact CG-CZ 3.99Å; Q421-F426 VanDerWaalsContact NE2-CE1 3.3Å; F426-N428 VanDerWaalsContact C-N 3.32Å; F426-N428 PolarHBondContact O-N 3.49Å; F426-Q429 HydrophobicContact CB-CB 4.42Å; F426-Q429 HydrophobicContact CB-CG 4.06Å
427	V	89.6	Confident	88.9	Confident	14 Å²	14	54.8 Å²	54.8	9%	0.085	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-72.5	-25.5	-173.2	-68.8	0	0	0	0	113.7	L303 L420 H422 I425 L437	L303-V427 HydrophobicContact CD2-CG1 4.35Å; L420-V427 HydrophobicContact CD2-CG2 3.62Å; H422-V427 HydrophobicContact CB-CG1 3.76Å; H422-V427 HydrophobicContact CB-CG2 4.17Å; I425-V427 HydrophobicContact CG2-CG1 4.46Å; I425-V427 PolarHBondContact O-N 3.22Å; V427-L437 HydrophobicContact CG2-CB 4.27Å; V427-L437 HydrophobicContact CG2-CD1 4.04Å; V427-L437 HydrophobicContact CG2-CG 4.11Å
428	N	91.3	Very high	88.7	Confident	3 Å²	3	55 Å²	55	2%	0.016	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-90.6	3	-175.4	-71.7	-13.1	0	0	0	114.1	L416 N417 L418 F426 W436 L437	L416-N428 HydrophobicContact CD1-CB 3.7Å; L416-N428 VanDerWaalsContact CD1-CG 3.44Å; L416-N428 HydrophobicContact CG-CB 4.14Å; N417-N428 VanDerWaalsContact O-CB 3.27Å; N417-N428 WeakPolarHBondContact O-CB 3.5Å; N417-N428 PolarHBondContact O-ND2 2.97Å; L418-N428 VanDerWaalsContact CD2-O 3.27Å; L418-N428 WeakPolarHBondContact CD2-O 3.09Å; F426-N428 VanDerWaalsContact C-N 3.32Å; F426-N428 PolarHBondContact O-N 3.49Å; N428-W436 WeakPolarHBondContact OD1-CA 3.39Å; N428-L437 PolarHBondContact ND2-O 3.14Å; N428-L437 PolarHBondContact OD1-N 2.6Å; N428-L437 PolarHBondContact OD1-O 3.18Å
429	Q	90.3	Very high	88.7	Confident	118 Å²	118	53.2 Å²	53.2	55%	0.551	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-97.9	-8.1	175.4	-64.1	-179.7	12.9	0	0	113	L418 F426	L418-Q429 PolarHBondContact O-NE2 3.45Å; F426-Q429 HydrophobicContact CB-CB 4.42Å; F426-Q429 HydrophobicContact CB-CG 4.06Å
430	D	84.4	Confident	88.7	Confident	55 Å²	55	52.3 Å²	52.3	29%	0.294	27%	0.272	S	S	.	.	S	Bend	trans	-73.4	145.5	177.3	-163.2	-60.3	0	0	0	110.2	N432 K435 W436	D430-N432 PolarHBondContact O-N 3.28Å; D430-N432 WeakPolarHBondContact OD1-CB 2.89Å; D430-N432 PolarHBondContact OD1-N 3.24Å; D430-K435 HydrophobicContact CB-CD 4.28Å; D430-K435 WeakPolarHBondContact OD2-CD 3.39Å; D430-K435 IonicContact OD2-NZ 2.93Å; D430-K435 PolarHBondContact OD2-NZ 3.13Å; D430-W436 PolarHBondContact O-NE1 2.87Å
431	S	81.9	Confident	88.9	Confident	122 Å²	122	52.3 Å²	52.3	85%	0.853	27%	0.272	S	S	*	.	S	Bend	trans	-71.1	-20.2	177.8	56.1	0	0	0	0	113	S433	S431-S433 PolarHBondContact O-N 2.75Å
432	N	85.9	Confident	89.2	Confident	87 Å²	87	50.4 Å²	50.4	47%	0.465	26%	0.263	S	S	.	.			trans	-84.7	112.1	178.3	-175.2	-6.4	0	0	0	111.6	D430 G434 K435	D430-N432 PolarHBondContact O-N 3.28Å; D430-N432 WeakPolarHBondContact OD1-CB 2.89Å; D430-N432 PolarHBondContact OD1-N 3.24Å; N432-G434 PolarHBondContact O-N 3.34Å; N432-G434 VanDerWaalsContact O-N 3.12Å; N432-G434 PolarHBondContact OD1-N 3.11Å; N432-K435 PolarHBondContact O-N 2.73Å
433	S	85.2	Confident	89.6	Confident	41 Å²	41	48.7 Å²	48.7	29%	0.287	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-61.4	-20.3	178.2	60.7	0	0	0	0	114.8	S431 K435 W436	S431-S433 PolarHBondContact O-N 2.75Å; S433-K435 PolarHBondContact O-N 3.3Å; S433-W436 VanDerWaalsContact CA-CD2 3.45Å; S433-W436 PolarHBondContact O-N 2.84Å
434	G	85.9	Confident	90.1	Very high	23 Å²	23	46.4 Å²	46.4	24%	0.237	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-65.6	-14.7	173.6	0	0	0	0	0	114.3	G304 N432	G304-G434 WeakPolarHBondContact CA-O 3.41Å; G304-G434 PolarHBondContact N-O 3.22Å; N432-G434 PolarHBondContact O-N 3.34Å; N432-G434 VanDerWaalsContact O-N 3.12Å; N432-G434 PolarHBondContact OD1-N 3.11Å
435	K	86.4	Confident	90.7	Very high	95 Å²	95	40 Å²	40	41%	0.413	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-98.5	-4.3	175.4	-64.6	-178.8	-172.3	170.3	0	113.4	L303 D430 N432 S433	L303-K435 VanDerWaalsContact CD2-O 3.29Å; L303-K435 WeakPolarHBondContact CD2-O 3.16Å; D430-K435 HydrophobicContact CB-CD 4.28Å; D430-K435 WeakPolarHBondContact OD2-CD 3.39Å; D430-K435 IonicContact OD2-NZ 2.93Å; D430-K435 PolarHBondContact OD2-NZ 3.13Å; N432-K435 PolarHBondContact O-N 2.73Å; S433-K435 PolarHBondContact O-N 3.3Å
436	W	91.5	Very high	91	Very high	46 Å²	46	34.6 Å²	34.6	17%	0.174	19%	0.188	C	C	.	.			trans	-74.5	144.1	-175.4	-61.4	-11.2	0	0	0	112	A306 L310 L416 N428 D430 S433 L487	A306-W436 HydrophobicContact CB-CB 3.8Å; L310-W436 HydrophobicContact CD1-CE3 4.29Å; L310-W436 HydrophobicContact CD1-CZ3 4.19Å; L416-W436 HydrophobicContact CD1-CB 3.83Å; L416-W436 HydrophobicContact CD1-CD2 3.8Å; L416-W436 HydrophobicContact CD1-CE3 4.03Å; L416-W436 HydrophobicContact CD1-CG 3.74Å; L416-W436 HydrophobicContact CD2-CD2 4.27Å; L416-W436 HydrophobicContact CD2-CE3 4.29Å; L416-W436 HydrophobicContact CD2-CZ3 4.41Å; N428-W436 WeakPolarHBondContact OD1-CA 3.39Å; D430-W436 PolarHBondContact O-NE1 2.87Å; S433-W436 VanDerWaalsContact CA-CD2 3.45Å; S433-W436 PolarHBondContact O-N 2.84Å; W436-L487 HydrophobicContact CZ3-CD2 4.34Å
437	L	92.1	Very high	91.2	Very high	15 Å²	15	30.8 Å²	30.8	8%	0.079	17%	0.171	C	C	.	.			trans	-112.6	112.6	168.4	-68	180	0	0	0	108.6	L303 L420 H422 V427 N428	L303-L437 HydrophobicContact CD2-CD1 4.21Å; L303-L437 HydrophobicContact CD2-CD2 3.89Å; L303-L437 HydrophobicContact CD2-CG 3.84Å; L420-L437 HydrophobicContact CD1-CB 4.45Å; L420-L437 HydrophobicContact CD2-CB 4.33Å; L420-L437 HydrophobicContact CD2-CD1 4.15Å; H422-L437 HydrophobicContact CB-CD1 3.94Å; V427-L437 HydrophobicContact CG2-CB 4.27Å; V427-L437 HydrophobicContact CG2-CD1 4.04Å; V427-L437 HydrophobicContact CG2-CG 4.11Å; N428-L437 PolarHBondContact ND2-O 3.14Å; N428-L437 PolarHBondContact OD1-N 2.6Å; N428-L437 PolarHBondContact OD1-O 3.18Å
438	L	93.4	Very high	91.3	Very high	8 Å²	8	30.5 Å²	30.5	4%	0.042	17%	0.17	C	C	.	.			trans	-86.8	137.8	-179.2	-57.6	171.7	0	0	0	110.6	Y299 A306 V309 L310 P414 L416 L487	Y299-L438 HydrophobicContact CD2-CB 3.9Å; Y299-L438 HydrophobicContact CG-CB 4.2Å; Y299-L438 PolarHBondContact N-O 3.17Å; Y299-L438 VanDerWaalsContact N-O 3.09Å; A306-L438 HydrophobicContact CB-CD1 3.74Å; A306-L438 HydrophobicContact CB-CD2 4.37Å; A306-L438 HydrophobicContact CB-CG 3.79Å; V309-L438 HydrophobicContact CB-CD1 3.84Å; V309-L438 HydrophobicContact CG1-CD1 3.88Å; V309-L438 HydrophobicContact CG2-CD1 4.37Å; L310-L438 HydrophobicContact CD1-CD1 4.42Å; L310-L438 HydrophobicContact CD2-CD1 4.27Å; L310-L438 HydrophobicContact CG-CD1 4.08Å; P414-L438 HydrophobicContact CB-CB 4.29Å; P414-L438 HydrophobicContact CB-CD1 4.01Å; P414-L438 HydrophobicContact CB-CD2 4.49Å; P414-L438 HydrophobicContact CB-CG 4.5Å; L416-L438 HydrophobicContact CB-CD2 4.43Å; L416-L438 HydrophobicContact CD1-CD2 4.15Å; L438-L487 HydrophobicContact CD2-CD1 3.96Å
439	T	94.6	Very high	91.4	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.006	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-116.5	-178.7	177.9	59.7	0	0	0	0	110.3	N258 L297 F298 Y299 V415 L420	N258-T439 HydrophobicContact CB-CG2 3.87Å; L297-T439 CarbonylContact O-C 3.6Å; L297-T439 WeakPolarHBondContact O-CA 3.33Å; F298-T439 HydrophobicContact CD1-CG2 4.09Å; F298-T439 HydrophobicContact CE1-CG2 4.19Å; Y299-T439 WeakPolarHBondContact CE2-O 3.32Å; V415-T439 WeakPolarHBondContact CB-O 3.41Å; V415-T439 PolarHBondContact N-O 3.2Å; V415-T439 PolarHBondContact O-N 3.2Å; V415-T439 PolarHBondContact O-OG1 3.48Å; L420-T439 HydrophobicContact CD1-CG2 3.53Å
440	R	92.6	Very high	91.3	Very high	3 Å²	3	24.8 Å²	24.8	1%	0.011	14%	0.143	C	C	.	.			trans	-127	-47	-176.7	-166.9	-166.6	-168.5	-154	25.9	114.3	W296 L297 Y299 D396 Y398 V415	W296-R440 VanDerWaalsContact CE3-CZ 3.49Å; W296-R440 VanDerWaalsContact CE3-NH2 3.34Å; W296-R440 WeakPolarHBondContact O-CD 3.4Å; L297-R440 PolarHBondContact O-N 3.28Å; L297-R440 VanDerWaalsContact O-N 3.09Å; Y299-R440 HydrophobicContact CE2-CB 4.3Å; D396-R440 IonicContact OD2-CZ 2.74Å; D396-R440 IonicContact OD2-NH1 3.92Å; D396-R440 PolarHBondContact OD2-NH1 3.24Å; Y398-R440 VanDerWaalsContact CE1-NH2 3.28Å; Y398-R440 PolarHBondContact OH-NH1 2.89Å; Y398-R440 VanDerWaalsContact OH-NH1 3.14Å; Y398-R440 PolarHBondContact OH-NH2 3.31Å; V415-R440 WeakPolarHBondContact CG2-O 3.16Å
441	R	95.6	Very high	91.6	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.008	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	133.6	-171.6	-173.7	164.3	-71.3	-177.9	2.5	111.5	N251 V254 L297 Y337 F394 Y395 D396	N251-R441 VanDerWaalsContact OD1-CD 3.26Å; N251-R441 WeakPolarHBondContact OD1-CD 3.35Å; N251-R441 PolarHBondContact OD1-NH1 3.49Å; V254-R441 WeakPolarHBondContact CG1-O 3.27Å; V254-R441 HydrophobicContact CG2-CB 3.83Å; V254-R441 HydrophobicContact CG2-CG 4.01Å; L297-R441 HydrophobicContact CD2-CB 3.77Å; Y337-R441 VanDerWaalsContact CE2-NH2 3.32Å; F394-R441 HydrophobicContact CB-CG 3.94Å; F394-R441 HydrophobicContact CD1-CG 4.23Å; Y395-R441 WeakPolarHBondContact O-CA 3.35Å; D396-R441 WeakPolarHBondContact OD1-CA 3.42Å; D396-R441 WeakPolarHBondContact OD1-CB 3.49Å; D396-R441 WeakPolarHBondContact OD1-CG 3.43Å; D396-R441 IonicContact OD1-CZ 3.71Å; D396-R441 IonicContact OD1-NE 3.61Å; D396-R441 PolarHBondContact OD1-NE 2.94Å; D396-R441 IonicContact OD1-NH2 3.31Å; D396-R441 IonicContact OD2-CZ 3.67Å; D396-R441 IonicContact OD2-NE 2.72Å; D396-R441 IonicContact OD2-NH2 2.86Å; D396-R441 PolarHBondContact OD2-NH2 3.28Å
442	I	96.8	Very high	91.9	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	164.5	177.2	60.4	174.9	0	0	0	111.9	L354 F394 Y395 V397 V415 I490	L354-I442 HydrophobicContact CD1-CD1 4.31Å; L354-I442 HydrophobicContact CD2-CD1 4.19Å; F394-I442 CarbonylContact C-O 3.45Å; F394-I442 VanDerWaalsContact CA-O 3.3Å; F394-I442 WeakPolarHBondContact CA-O 3.24Å; Y395-I442 PolarHBondContact N-O 3.01Å; Y395-I442 PolarHBondContact O-N 3.39Å; V397-I442 HydrophobicContact CG2-CD1 4.3Å; V415-I442 HydrophobicContact CB-CG2 4.26Å; V415-I442 HydrophobicContact CG1-CG2 3.52Å; V415-I442 HydrophobicContact CG2-CG2 3.86Å; I442-I490 HydrophobicContact CB-CD1 4.18Å; I442-I490 HydrophobicContact CG2-CD1 4.17Å; I442-I490 HydrophobicContact CG2-CG2 4.32Å
443	F	96.9	Very high	91.9	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	165.5	165.7	63.8	-89.3	0	0	0	108.9	V254 M257 I393 F394 D446 R463 Y492	V254-F443 HydrophobicContact CG1-CD1 3.74Å; V254-F443 HydrophobicContact CG1-CE1 3.99Å; M257-F443 HydrophobicContact CE-CE1 3.58Å; M257-F443 HydrophobicContact CE-CZ 3.43Å; M257-F443 VanDerWaalsContact CE-CZ 3.43Å; I393-F443 WeakPolarHBondContact O-CB 3.23Å; F394-F443 HydrophobicContact CD1-CB 4.06Å; F394-F443 HydrophobicContact CD1-CD1 4.25Å; F394-F443 HydrophobicContact CE1-CB 4.16Å; F394-F443 AromaticContact CE1-CD1 3.84Å; F394-F443 HydrophobicContact CE1-CD1 3.84Å; F394-F443 HydrophobicContact CE1-CG 4.27Å; F443-D446 HydrophobicContact CD2-CB 4.01Å; F443-D446 HydrophobicContact CE2-CB 3.43Å; F443-D446 VanDerWaalsContact CE2-CB 3.43Å; F443-D446 HydrophobicContact CZ-CB 4.02Å; F443-R463 HydrophobicContact CE2-CG 4.27Å; F443-R463 HydrophobicContact CZ-CG 4.27Å; F443-Y492 HydrophobicContact CD1-CE1 4.33Å; F443-Y492 AromaticContact CD2-CE1 3.92Å; F443-Y492 HydrophobicContact CD2-CE1 3.92Å; F443-Y492 HydrophobicContact CE1-CE1 4.05Å; F443-Y492 HydrophobicContact CE2-CD1 4.04Å; F443-Y492 AromaticContact CE2-CE1 3.61Å; F443-Y492 HydrophobicContact CE2-CE1 3.61Å; F443-Y492 HydrophobicContact CG-CE1 4.28Å; F443-Y492 HydrophobicContact CZ-CD1 4.11Å; F443-Y492 AromaticContact CZ-CE1 3.7Å; F443-Y492 HydrophobicContact CZ-CE1 3.7Å; F443-Y492 PolarHBondContact N-OH 2.98Å; F443-Y492 VanDerWaalsContact O-CE1 3.24Å; F443-Y492 WeakPolarHBondContact O-CE1 2.98Å; F443-Y492 PolarHBondContact O-OH 3.1Å; F443-Y492 VanDerWaalsContact O-OH 3.04Å
444	L	96.4	Very high	91.9	Very high	8 Å²	8	26.6 Å²	26.6	4%	0.042	13%	0.134	C	C	.	.	S	Bend	trans	-98.3	-43.5	180	-60.8	178.3	0	0	0	112.8	V353 L354 L356 Y395 A465 I468	V353-L444 WeakPolarHBondContact O-CD1 3.4Å; L354-L444 HydrophobicContact CD2-CD2 4.25Å; L356-L444 HydrophobicContact CD2-CB 4.12Å; L356-L444 HydrophobicContact CD2-CD1 4.1Å; Y395-L444 HydrophobicContact CE2-CD1 4.28Å; Y395-L444 HydrophobicContact CE2-CG 4.15Å; L444-A465 HydrophobicContact CD2-CB 4.44Å; L444-A465 WeakPolarHBondContact O-CB 3.17Å; L444-A465 PolarHBondContact O-N 3.35Å; L444-I468 HydrophobicContact CD2-CD1 3.49Å; L444-I468 VanDerWaalsContact CD2-CD1 3.49Å
445	V	96.3	Very high	91.8	Very high	4 Å²	4	27.4 Å²	27.4	2%	0.024	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	131.4	-177.8	179.9	0	0	0	0	109.3	L356 I385 F389 P392 R463 V464	L356-V445 HydrophobicContact CD2-CG2 4.41Å; I385-V445 HydrophobicContact CG2-CB 4.44Å; I385-V445 HydrophobicContact CG2-CG1 3.59Å; I385-V445 HydrophobicContact CG2-CG2 3.99Å; F389-V445 HydrophobicContact CB-CB 3.77Å; F389-V445 HydrophobicContact CB-CG1 3.93Å; F389-V445 HydrophobicContact CB-CG2 4.09Å; F389-V445 HydrophobicContact CD1-CG2 4.45Å; F389-V445 HydrophobicContact CD2-CG2 4Å; F389-V445 HydrophobicContact CG-CB 4.11Å; F389-V445 HydrophobicContact CG-CG2 3.92Å; P392-V445 WeakPolarHBondContact CA-O 3.47Å; P392-V445 WeakPolarHBondContact CB-O 3.34Å; V445-R463 CarbonylContact C-O 3.55Å; V445-R463 WeakPolarHBondContact CA-O 3.49Å; V445-V464 HydrophobicContact CG1-CG2 4.44Å; V445-V464 HydrophobicContact CG2-CG1 4.32Å; V445-V464 HydrophobicContact CG2-CG2 4.5Å
446	D	94.8	Very high	91.6	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	105.8	168.7	176.6	11.2	0	0	0	109.8	M255 F443 V448 S449 I462 R463	M255-D446 VanDerWaalsContact CE-CG 3.45Å; M255-D446 VanDerWaalsContact CE-OD1 3.28Å; M255-D446 WeakPolarHBondContact CE-OD1 3.43Å; M255-D446 WeakPolarHBondContact CE-OD2 3.23Å; F443-D446 HydrophobicContact CD2-CB 4.01Å; F443-D446 HydrophobicContact CE2-CB 3.43Å; F443-D446 VanDerWaalsContact CE2-CB 3.43Å; F443-D446 HydrophobicContact CZ-CB 4.02Å; D446-V448 PolarHBondContact OD1-N 3.49Å; D446-S449 PolarHBondContact OD1-N 3.21Å; D446-S449 PolarHBondContact OD1-OG 2.93Å; D446-S449 WeakPolarHBondContact OD2-CB 3.38Å; D446-S449 PolarHBondContact OD2-OG 2.83Å; D446-I462 WeakPolarHBondContact O-CA 3.4Å; D446-R463 HydrophobicContact CB-CB 4.32Å; D446-R463 PolarHBondContact N-O 3.46Å; D446-R463 PolarHBondContact O-N 3.43Å
447	A	92.5	Very high	91.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.149	C	C	.	.			trans	-107.1	12.8	175	0	0	0	0	0	112.6	L386 R451 P459 I462	L386-A447 HydrophobicContact CD2-CB 4.08Å; A447-R451 PolarHBondContact O-NE 2.9Å; A447-R451 PolarHBondContact O-NH2 3.02Å; A447-P459 HydrophobicContact CB-CG 4.37Å; A447-P459 WeakPolarHBondContact O-CB 3.24Å; A447-I462 HydrophobicContact CB-CG2 4.03Å
448	V	93.5	Very high	91	Very high	9 Å²	9	32.9 Å²	32.9	6%	0.055	18%	0.183	C	C	.	.	S	Bend	trans	-112.1	-42.1	-173.8	176.7	0	0	0	0	111.5	W225 I339 T391 D446 G450 R451	W225-V448 HydrophobicContact CB-CG1 3.74Å; W225-V448 HydrophobicContact CD2-CG1 4Å; W225-V448 HydrophobicContact CE3-CG1 4.13Å; W225-V448 HydrophobicContact CG-CG1 3.8Å; I339-V448 HydrophobicContact CD1-CB 3.95Å; I339-V448 HydrophobicContact CD1-CG1 3.66Å; I339-V448 HydrophobicContact CD1-CG2 4.16Å; T391-V448 HydrophobicContact CG2-CG2 4.4Å; D446-V448 PolarHBondContact OD1-N 3.49Å; V448-G450 PolarHBondContact O-N 3.49Å; V448-R451 PolarHBondContact O-N 2.92Å
449	S	91.4	Very high	90.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.2	-179	58.5	0	0	0	0	113.3	Y214 S223 D446 R451	Y214-S449 PolarHBondContact OH-O 3.31Å; Y214-S449 PolarHBondContact OH-OG 3.04Å; S223-S449 WeakPolarHBondContact CB-O 3.24Å; S223-S449 WeakPolarHBondContact OG-CA 3.39Å; S223-S449 PolarHBondContact OG-O 2.76Å; D446-S449 PolarHBondContact OD1-N 3.21Å; D446-S449 PolarHBondContact OD1-OG 2.93Å; D446-S449 WeakPolarHBondContact OD2-CB 3.38Å; D446-S449 PolarHBondContact OD2-OG 2.83Å; S449-R451 VanDerWaalsContact C-N 3.33Å; S449-R451 PolarHBondContact O-N 3.26Å
450	G	89.2	Confident	90.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	6.9	-179.6	0	0	0	0	0	115.6	Y214 V448 R460 V461	Y214-G450 WeakPolarHBondContact OH-CA 3.27Å; Y214-G450 PolarHBondContact OH-N 2.69Å; V448-G450 PolarHBondContact O-N 3.49Å; G450-R460 PolarHBondContact O-N 2.97Å; G450-V461 WeakPolarHBondContact CA-O 3.35Å
451	R	90.9	Very high	90.6	Very high	46 Å²	46	37.1 Å²	37.1	17%	0.174	20%	0.199	C	C	.	.			trans	-83.4	129	174.3	-61.2	-178.4	-168.9	-163.8	0.6	110.1	E224 P390 A447 V448 S449 L455 S457 P459	E224-R451 PolarHBondContact N-O 2.82Å; P390-R451 PolarHBondContact O-NH2 3.33Å; A447-R451 PolarHBondContact O-NE 2.9Å; A447-R451 PolarHBondContact O-NH2 3.02Å; V448-R451 PolarHBondContact O-N 2.92Å; S449-R451 VanDerWaalsContact C-N 3.33Å; S449-R451 PolarHBondContact O-N 3.26Å; R451-L455 WeakPolarHBondContact CD-O 3.48Å; R451-L455 PolarHBondContact NH1-O 2.94Å; R451-S457 VanDerWaalsContact CD-O 3.3Å; R451-S457 WeakPolarHBondContact CD-O 3.28Å; R451-P459 HydrophobicContact CG-CB 3.87Å
452	E	88.4	Confident	90.5	Very high	57 Å²	57	37 Å²	37	27%	0.266	20%	0.199	S	C	.	.			trans	-107.1	145.6	178.4	-59.5	-172.1	96.2	0	0	109.6	L221 D454 S457 R460	L221-E452 HydrophobicContact CB-CG 4.46Å; E452-D454 PolarHBondContact O-N 3.37Å; E452-S457 PolarHBondContact O-OG 3.47Å; E452-R460 WeakPolarHBondContact OE2-CD 3.37Å; E452-R460 IonicContact OE2-NH1 3.76Å; E452-R460 PolarHBondContact OE2-NH1 2.9Å; E452-R460 VanDerWaalsContact OE2-NH1 3.15Å
453	N	85.3	Confident	90.4	Very high	146 Å²	146	37.2 Å²	37.2	78%	0.781	20%	0.2	S	C	*	.	S	Bend	trans	65.5	-47.5	175.9	-46.3	-56.9	0	0	0	117
454	D	86.1	Confident	90.3	Very high	94 Å²	94	37.2 Å²	37.2	50%	0.503	20%	0.2	S	C	.	.			trans	-136.9	141.7	-179.4	-180	46.2	0	0	0	112.1	E452 G456 S457	E452-D454 PolarHBondContact O-N 3.37Å; D454-G456 VanDerWaalsContact C-N 3.27Å; D454-G456 PolarHBondContact O-N 2.73Å; D454-G456 VanDerWaalsContact OD2-CA 3.25Å; D454-G456 WeakPolarHBondContact OD2-CA 3.32Å; D454-G456 PolarHBondContact OD2-N 3.29Å; D454-S457 WeakPolarHBondContact O-CB 3.34Å; D454-S457 PolarHBondContact O-N 2.76Å; D454-S457 PolarHBondContact O-OG 3.33Å
455	L	84	Confident	90.3	Very high	41 Å²	41	37 Å²	37	22%	0.215	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-22.3	178.5	-67.5	175.8	0	0	0	112.6	E224 W225 K228 Y229 R451 S457	E224-L455 HydrophobicContact CB-CD2 4.15Å; E224-L455 HydrophobicContact CG-CD2 3.9Å; E224-L455 HydrophobicContact CG-CG 3.9Å; W225-L455 HydrophobicContact CB-CD2 4.12Å; W225-L455 HydrophobicContact CE3-CD1 4.3Å; W225-L455 HydrophobicContact CE3-CD2 4.03Å; K228-L455 HydrophobicContact CD-CD1 4.25Å; Y229-L455 HydrophobicContact CE2-CD1 4.07Å; R451-L455 WeakPolarHBondContact CD-O 3.48Å; R451-L455 PolarHBondContact NH1-O 2.94Å; L455-S457 VanDerWaalsContact C-N 3.33Å
456	G	81.8	Confident	90.3	Very high	64 Å²	64	37.6 Å²	37.6	66%	0.66	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-11.3	174	0	0	0	0	0	114	D454	D454-G456 VanDerWaalsContact C-N 3.27Å; D454-G456 PolarHBondContact O-N 2.73Å; D454-G456 VanDerWaalsContact OD2-CA 3.25Å; D454-G456 WeakPolarHBondContact OD2-CA 3.32Å; D454-G456 PolarHBondContact OD2-N 3.29Å
457	S	85.7	Confident	90.4	Very high	37 Å²	37	41.7 Å²	41.7	26%	0.259	22%	0.222	S	C	.	.	S	Bend	trans	-68.5	156.4	178.2	72.3	0	0	0	0	112.5	R451 E452 D454 L455	R451-S457 VanDerWaalsContact CD-O 3.3Å; R451-S457 WeakPolarHBondContact CD-O 3.28Å; E452-S457 PolarHBondContact O-OG 3.47Å; D454-S457 WeakPolarHBondContact O-CB 3.34Å; D454-S457 PolarHBondContact O-N 2.76Å; D454-S457 PolarHBondContact O-OG 3.33Å; L455-S457 VanDerWaalsContact C-N 3.33Å
458	Q	85.7	Confident	90.7	Very high	170 Å²	170	42 Å²	42	79%	0.794	22%	0.223	S	C	*	.	P	Polyproline II helix	trans	-68.6	137.8	169.3	-71.9	-172.8	-14.1	0	0	109.7
459	P	90.8	Very high	90.9	Very high	7 Å²	7	42.3 Å²	42.3	5%	0.045	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-65	138.4	177.1	27.5	-33.2	0	0	0	109.8	L386 A447 R451 I462 T497	L386-P459 HydrophobicContact CD2-CG 3.69Å; A447-P459 HydrophobicContact CB-CG 4.37Å; A447-P459 WeakPolarHBondContact O-CB 3.24Å; R451-P459 HydrophobicContact CG-CB 3.87Å; P459-I462 HydrophobicContact CB-CG2 4.01Å; P459-I462 HydrophobicContact CG-CG2 3.68Å; P459-T497 WeakPolarHBondContact O-CB 3.31Å; P459-T497 WeakPolarHBondContact O-CG2 3.42Å; P459-T497 PolarHBondContact O-OG1 3.22Å
460	R	90.1	Very high	91.1	Very high	92 Å²	92	42.7 Å²	42.7	35%	0.347	23%	0.228	S	C	.	.	S	Bend	trans	-76.2	-34.7	173.5	178.2	-179	167.3	-178.9	-2.5	112.2	L221 G450 E452 T497	L221-R460 HydrophobicContact CD1-CB 4.23Å; L221-R460 HydrophobicContact CD1-CG 4.38Å; L221-R460 VanDerWaalsContact CD2-NH1 3.27Å; G450-R460 PolarHBondContact O-N 2.97Å; E452-R460 WeakPolarHBondContact OE2-CD 3.37Å; E452-R460 IonicContact OE2-NH1 3.76Å; E452-R460 PolarHBondContact OE2-NH1 2.9Å; E452-R460 VanDerWaalsContact OE2-NH1 3.15Å; R460-T497 VanDerWaalsContact C-OG1 3.31Å; R460-T497 WeakPolarHBondContact CA-OG1 3.49Å; R460-T497 PolarHBondContact O-N 3.12Å; R460-T497 PolarHBondContact O-OG1 2.92Å
461	V	91.3	Very high	91.3	Very high	1 Å²	1	43 Å²	43	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.6	176.1	-179.5	0	0	0	0	108	Y214 L221 G450 D494 I495	Y214-V461 HydrophobicContact CD1-CB 4.16Å; Y214-V461 HydrophobicContact CD1-CG1 3.38Å; Y214-V461 HydrophobicContact CD2-CG1 4.47Å; Y214-V461 HydrophobicContact CE1-CB 4.08Å; Y214-V461 HydrophobicContact CE1-CG1 3.62Å; Y214-V461 HydrophobicContact CE2-CB 4.47Å; Y214-V461 HydrophobicContact CG-CB 4.37Å; Y214-V461 HydrophobicContact CG-CG1 3.84Å; L221-V461 HydrophobicContact CD1-CB 4.15Å; L221-V461 HydrophobicContact CD1-CG2 3.83Å; G450-V461 WeakPolarHBondContact CA-O 3.35Å; V461-D494 HydrophobicContact CG1-CB 4.21Å; V461-I495 CarbonylContact C-O 3.59Å; V461-I495 VanDerWaalsContact CA-O 3.26Å; V461-I495 WeakPolarHBondContact CA-O 3.47Å; V461-I495 WeakPolarHBondContact CG1-O 3.5Å
462	I	92.9	Very high	91.4	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	154	168.1	63.2	172	0	0	0	109.9	I382 I385 L386 D446 A447 P459 V464 I495 T497	I382-I462 HydrophobicContact CD1-CD1 4.31Å; I382-I462 HydrophobicContact CG2-CD1 3.86Å; I385-I462 HydrophobicContact CG2-CD1 4.13Å; L386-I462 HydrophobicContact CD2-CG2 3.8Å; D446-I462 WeakPolarHBondContact O-CA 3.4Å; A447-I462 HydrophobicContact CB-CG2 4.03Å; P459-I462 HydrophobicContact CB-CG2 4.01Å; P459-I462 HydrophobicContact CG-CG2 3.68Å; I462-V464 HydrophobicContact CD1-CG2 3.91Å; I462-V464 HydrophobicContact CG1-CG2 4.22Å; I462-I495 HydrophobicContact CG1-CB 4.01Å; I462-I495 PolarHBondContact N-O 3.23Å; I462-I495 PolarHBondContact O-N 3.09Å; I462-T497 HydrophobicContact CG1-CG2 4.33Å; I462-T497 HydrophobicContact CG2-CG2 3.86Å
463	R	94.1	Very high	91.6	Very high	6 Å²	6	41 Å²	41	2%	0.023	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126.1	174.3	177.4	170.7	-71.6	155	-1	109.8	R213 M255 M257 F443 V445 D446 Y492 S493 D494	R213-R463 PolarHBondContact O-NH2 2.71Å; M255-R463 PolarHBondContact O-NH1 3.04Å; M257-R463 HydrophobicContact CE-CG 4.49Å; F443-R463 HydrophobicContact CE2-CG 4.27Å; F443-R463 HydrophobicContact CZ-CG 4.27Å; V445-R463 CarbonylContact C-O 3.55Å; V445-R463 WeakPolarHBondContact CA-O 3.49Å; D446-R463 HydrophobicContact CB-CB 4.32Å; D446-R463 PolarHBondContact N-O 3.46Å; D446-R463 PolarHBondContact O-N 3.43Å; R463-Y492 HydrophobicContact CG-CD1 3.94Å; R463-Y492 HydrophobicContact CG-CG 4.22Å; R463-S493 WeakPolarHBondContact CA-O 3.48Å; R463-D494 IonicContact CZ-OD1 2.68Å; R463-D494 IonicContact NE-OD1 3.15Å; R463-D494 PolarHBondContact NE-OD1 2.96Å; R463-D494 IonicContact NH2-OD1 2.77Å; R463-D494 PolarHBondContact NH2-OD1 3.36Å; R463-D494 IonicContact NH2-OD2 2.88Å; R463-D494 PolarHBondContact NH2-OD2 3.37Å
464	V	95.8	Very high	91.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	135.6	-174.9	-177.8	0	0	0	0	109.5	L356 I385 V445 I462 T466 Y492 S493 I495 V507	L356-V464 HydrophobicContact CD1-CG1 3.95Å; I385-V464 HydrophobicContact CD1-CG2 4.37Å; I385-V464 HydrophobicContact CG2-CG2 4.46Å; V445-V464 HydrophobicContact CG1-CG2 4.44Å; V445-V464 HydrophobicContact CG2-CG1 4.32Å; V445-V464 HydrophobicContact CG2-CG2 4.5Å; I462-V464 HydrophobicContact CD1-CG2 3.91Å; I462-V464 HydrophobicContact CG1-CG2 4.22Å; V464-T466 HydrophobicContact CB-CG2 4.47Å; V464-T466 HydrophobicContact CG1-CG2 4.49Å; V464-T466 PolarHBondContact O-N 3.39Å; V464-Y492 CarbonylContact O-C 3.55Å; V464-Y492 VanDerWaalsContact O-CA 3.28Å; V464-Y492 WeakPolarHBondContact O-CA 2.91Å; V464-S493 PolarHBondContact N-O 3.33Å; V464-S493 PolarHBondContact O-N 2.97Å; V464-I495 HydrophobicContact CB-CD1 4.47Å; V464-I495 HydrophobicContact CG2-CD1 4.11Å; V464-V507 HydrophobicContact CG1-CG1 4.23Å
465	A	96.6	Very high	91.9	Very high	2 Å²	2	31.1 Å²	31.1	2%	0.017	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	93	169.9	0	0	0	0	0	109.4	L444 I468 I490 A491 Y492	L444-A465 HydrophobicContact CD2-CB 4.44Å; L444-A465 WeakPolarHBondContact O-CB 3.17Å; L444-A465 PolarHBondContact O-N 3.35Å; A465-I468 HydrophobicContact CB-CD1 4.07Å; A465-I468 HydrophobicContact CB-CG1 4.24Å; A465-I490 HydrophobicContact CB-CD1 3.85Å; A465-I490 HydrophobicContact CB-CG1 4.21Å; A465-A491 CarbonylContact C-O 3.45Å; A465-A491 WeakPolarHBondContact CA-O 3.38Å; A465-Y492 HydrophobicContact CB-CD1 4.03Å; A465-Y492 HydrophobicContact CB-CE1 3.88Å
466	T	96.2	Very high	91.9	Very high	18 Å²	18	32.3 Å²	32.3	11%	0.11	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-23.8	-174.7	48.8	0	0	0	0	112.8	V464 A491 S493 V505 V507 S508	V464-T466 HydrophobicContact CB-CG2 4.47Å; V464-T466 HydrophobicContact CG1-CG2 4.49Å; V464-T466 PolarHBondContact O-N 3.39Å; T466-A491 PolarHBondContact N-O 3.47Å; T466-A491 PolarHBondContact OG1-O 3.01Å; T466-S493 WeakPolarHBondContact CG2-OG 3.45Å; T466-S493 PolarHBondContact OG1-OG 3.39Å; T466-V505 HydrophobicContact CG2-CG2 3.59Å; T466-V507 CarbonylContact O-C 3.53Å; T466-V507 WeakPolarHBondContact O-CA 3.38Å; T466-S508 PolarHBondContact O-N 3.18Å; T466-S508 PolarHBondContact O-OG 2.96Å
467	Q	97.3	Very high	91.7	Very high	86 Å²	86	36.2 Å²	36.2	40%	0.402	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	123.4	175.9	-175.1	177.4	-5.7	0	0	110.2	I490 A491 S508	Q467-I490 CarbonylContact O-C 3.56Å; Q467-I490 WeakPolarHBondContact O-CA 3.3Å; Q467-A491 HydrophobicContact CB-CB 3.9Å; Q467-A491 PolarHBondContact N-O 3.25Å; Q467-A491 PolarHBondContact O-N 2.99Å; Q467-S508 WeakPolarHBondContact CA-O 3.32Å
468	I	97.6	Very high	91.3	Very high	5 Å²	5	35.2 Å²	35.2	3%	0.026	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	121	170.5	-59.4	176.3	0	0	0	107.6	L444 A465 I488 T489 I490 S508 F509 S510	L444-I468 HydrophobicContact CD2-CD1 3.49Å; L444-I468 VanDerWaalsContact CD2-CD1 3.49Å; A465-I468 HydrophobicContact CB-CD1 4.07Å; A465-I468 HydrophobicContact CB-CG1 4.24Å; I468-I488 HydrophobicContact CG2-CG2 4.25Å; I468-T489 WeakPolarHBondContact CA-O 3.19Å; I468-I490 HydrophobicContact CD1-CD1 4.22Å; I468-I490 HydrophobicContact CG1-CD1 4.01Å; I468-I490 HydrophobicContact CG1-CG1 4.06Å; I468-S508 PolarHBondContact N-O 3.18Å; I468-F509 HydrophobicContact CB-CD2 3.83Å; I468-F509 HydrophobicContact CB-CE2 4.3Å; I468-F509 HydrophobicContact CG2-CD2 3.81Å; I468-F509 HydrophobicContact CG2-CE2 3.74Å; I468-F509 CarbonylContact O-C 3.52Å; I468-F509 VanDerWaalsContact O-CA 3.28Å; I468-F509 WeakPolarHBondContact O-CA 3.24Å; I468-S510 PolarHBondContact O-N 3.09Å
469	S	97.1	Very high	90.7	Very high	17 Å²	17	33.5 Å²	33.5	12%	0.119	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126.6	176	-168.5	0	0	0	0	110.3	I488 T489 S510	S469-I488 CarbonylContact O-C 3.6Å; S469-I488 WeakPolarHBondContact O-CA 3.27Å; S469-T489 PolarHBondContact N-O 3.17Å; S469-T489 PolarHBondContact O-N 3.37Å; S469-S510 CarbonylContact C-O 3.54Å; S469-S510 VanDerWaalsContact CA-O 3.3Å; S469-S510 WeakPolarHBondContact CA-O 3.49Å; S469-S510 WeakPolarHBondContact CB-OG 3.33Å; S469-S510 PolarHBondContact OG-OG 3.02Å; S469-S510 VanDerWaalsContact OG-OG 3.04Å
470	L	96.1	Very high	89.9	Confident	7 Å²	7	36.6 Å²	36.6	4%	0.037	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	113.3	170.7	177.2	68.5	0	0	0	108.6	F332 P486 L487 I488 S510 V511 T512	F332-L470 HydrophobicContact CD2-CD2 4.44Å; F332-L470 HydrophobicContact CE1-CD1 4.29Å; F332-L470 HydrophobicContact CE1-CD2 4.41Å; F332-L470 HydrophobicContact CE2-CD2 3.55Å; F332-L470 HydrophobicContact CZ-CD1 4.01Å; F332-L470 HydrophobicContact CZ-CD2 3.54Å; F332-L470 HydrophobicContact CZ-CG 4.35Å; L470-P486 HydrophobicContact CD1-CB 3.77Å; L470-L487 CarbonylContact C-O 3.35Å; L470-L487 WeakPolarHBondContact CA-O 3.34Å; L470-I488 HydrophobicContact CD1-CG1 3.83Å; L470-S510 PolarHBondContact N-O 3.17Å; L470-V511 HydrophobicContact CB-CG1 4.24Å; L470-V511 HydrophobicContact CB-CG2 4.13Å; L470-V511 HydrophobicContact CD2-CG1 4Å; L470-V511 HydrophobicContact CD2-CG2 4.29Å; L470-V511 HydrophobicContact CG-CG1 4.25Å; L470-V511 CarbonylContact O-C 3.52Å; L470-V511 VanDerWaalsContact O-CA 3.27Å; L470-V511 WeakPolarHBondContact O-CA 3.32Å; L470-T512 PolarHBondContact O-N 3.32Å
471	S	94.5	Very high	89.4	Confident	8 Å²	8	32.2 Å²	32.2	6%	0.056	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	138	173	66.2	0	0	0	0	111	P486 L487 T512	S471-P486 WeakPolarHBondContact O-CA 3.5Å; S471-L487 PolarHBondContact N-O 2.98Å; S471-L487 PolarHBondContact O-N 2.94Å; S471-T512 WeakPolarHBondContact CA-O 3.38Å
472	V	93.3	Very high	89.2	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	120.1	176.6	-176.4	0	0	0	0	108.8	L330 F370 I483 P486 T512 Y513 E514	L330-V472 HydrophobicContact CD1-CG2 4.35Å; F370-V472 HydrophobicContact CE2-CG1 3.98Å; V472-I483 HydrophobicContact CG1-CB 3.93Å; V472-I483 HydrophobicContact CG1-CD1 3.71Å; V472-I483 HydrophobicContact CG1-CG1 4.41Å; V472-I483 HydrophobicContact CG1-CG2 3.77Å; V472-P486 HydrophobicContact CG2-CB 4.18Å; V472-P486 HydrophobicContact CG2-CG 4.32Å; V472-T512 PolarHBondContact N-O 2.87Å; V472-Y513 HydrophobicContact CB-CD1 3.77Å; V472-Y513 HydrophobicContact CB-CE1 3.9Å; V472-Y513 HydrophobicContact CG1-CD1 4.28Å; V472-Y513 HydrophobicContact CG1-CE1 4.36Å; V472-Y513 HydrophobicContact CG2-CD1 4.34Å; V472-Y513 HydrophobicContact CG2-CE1 3.99Å; V472-Y513 WeakPolarHBondContact O-CA 3.32Å; V472-E514 PolarHBondContact O-N 3.27Å
473	H	91.6	Very high	89	Confident	59 Å²	59	33.8 Å²	33.8	27%	0.273	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128.1	-179.7	-64.3	-92.9	0	0	0	110.9	I483 Y484 E514	H473-I483 WeakPolarHBondContact O-CA 3.3Å; H473-Y484 HydrophobicContact CB-CD2 4.17Å; H473-Y484 PolarHBondContact O-N 3.43Å; H473-E514 WeakPolarHBondContact CA-O 3.46Å; H473-E514 IonicContact CE1-OE2 3.68Å; H473-E514 PolarHBondContact CE1-OE2 2.9Å; H473-E514 IonicContact ND1-OE2 3.71Å
474	L	90.1	Very high	88.9	Confident	9 Å²	9	36 Å²	36	5%	0.047	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-76.7	138.5	173.4	-166.1	74	0	0	0	110.5	F370 T478 N482 I483 E514 M515 V596 S597 L599	F370-L474 HydrophobicContact CZ-CD1 4.45Å; L474-T478 HydrophobicContact CD1-CG2 3.77Å; L474-T478 HydrophobicContact CD2-CG2 3.97Å; L474-T478 HydrophobicContact CG-CG2 3.69Å; L474-N482 WeakPolarHBondContact CD1-O 3.34Å; L474-I483 HydrophobicContact CD1-CG2 4.14Å; L474-E514 PolarHBondContact N-O 2.98Å; L474-M515 HydrophobicContact CB-CB 4.2Å; L474-V596 HydrophobicContact CD1-CG1 4.35Å; L474-S597 WeakPolarHBondContact CD2-O 3.41Å; L474-L599 HydrophobicContact CB-CD1 3.72Å; L474-L599 HydrophobicContact CB-CG 4.49Å; L474-L599 HydrophobicContact CD2-CD1 4.46Å; L474-L599 HydrophobicContact CD2-CG 4.36Å
475	V	88.3	Confident	88.6	Confident	25 Å²	25	36.3 Å²	36.3	15%	0.152	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-66.9	129	173.9	178.7	0	0	0	0	109.1	N477 T478 N482 Y484	V475-N477 PolarHBondContact O-N 3.47Å; V475-T478 WeakPolarHBondContact O-CB 3.46Å; V475-T478 VanDerWaalsContact O-CG2 3.27Å; V475-T478 WeakPolarHBondContact O-CG2 3.36Å; V475-T478 PolarHBondContact O-N 3.34Å; V475-N482 HydrophobicContact CB-CB 4.35Å; V475-N482 WeakPolarHBondContact CB-O 3.4Å; V475-N482 HydrophobicContact CG2-CB 4.1Å; V475-N482 WeakPolarHBondContact CG2-O 3.45Å; V475-N482 PolarHBondContact N-O 3.49Å; V475-Y484 HydrophobicContact CB-CE2 4.4Å; V475-Y484 HydrophobicContact CG2-CD1 3.99Å; V475-Y484 HydrophobicContact CG2-CD2 4.15Å; V475-Y484 HydrophobicContact CG2-CE1 3.88Å; V475-Y484 HydrophobicContact CG2-CE2 4.09Å; V475-Y484 HydrophobicContact CG2-CG 4.11Å
476	P	82.8	Confident	88.5	Confident	66 Å²	66	36.3 Å²	36.3	43%	0.429	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	139.9	178.7	-26.2	33.6	0	0	0	112.2	T478	P476-T478 PolarHBondContact O-N 2.94Å; P476-T478 VanDerWaalsContact O-N 3.15Å
477	N	77.6	Confident	88.5	Confident	145 Å²	145	35.7 Å²	35.7	78%	0.775	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	21.7	178.3	-56.6	-40.2	0	0	0	115.2	V475	V475-N477 PolarHBondContact O-N 3.47Å
478	T	77.9	Confident	88.4	Confident	17 Å²	17	31.9 Å²	31.9	10%	0.104	17%	0.171	C	C	.	.			trans	-69.9	138.8	174.8	-167.9	0	0	0	0	111.9	L474 V475 P476 N480 G481 N482	L474-T478 HydrophobicContact CD1-CG2 3.77Å; L474-T478 HydrophobicContact CD2-CG2 3.97Å; L474-T478 HydrophobicContact CG-CG2 3.69Å; V475-T478 WeakPolarHBondContact O-CB 3.46Å; V475-T478 VanDerWaalsContact O-CG2 3.27Å; V475-T478 WeakPolarHBondContact O-CG2 3.36Å; V475-T478 PolarHBondContact O-N 3.34Å; P476-T478 PolarHBondContact O-N 2.94Å; P476-T478 VanDerWaalsContact O-N 3.15Å; T478-N480 PolarHBondContact OG1-N 3.44Å; T478-G481 PolarHBondContact OG1-N 2.88Å; T478-N482 PolarHBondContact OG1-N 3.37Å; T478-N482 VanDerWaalsContact OG1-N 3.14Å
479	I	72.1	Confident	88.4	Confident	133 Å²	133	32.9 Å²	32.9	68%	0.682	18%	0.177	S	C	*	.	S	Bend	trans	-96.8	-24	175.1	-55.9	174	0	0	0	110.5	S595	I479-S595 WeakPolarHBondContact O-CB 3.3Å
480	N	75.7	Confident	88.4	Confident	73 Å²	73	32.1 Å²	32.1	39%	0.39	17%	0.172	S	C	.	.	S	Bend	trans	-108.5	5.8	-170	-62.2	-21.9	0	0	0	113.9	N318 F319 T478	N318-N480 VanDerWaalsContact CA-O 3.24Å; N318-N480 WeakPolarHBondContact CA-O 3.35Å; N318-N480 HydrophobicContact CB-CB 4.31Å; N318-N480 VanDerWaalsContact OD1-CB 3.28Å; N318-N480 WeakPolarHBondContact OD1-CB 3.28Å; F319-N480 PolarHBondContact N-O 3.3Å; T478-N480 PolarHBondContact OG1-N 3.44Å
481	G	79.1	Confident	88.4	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.176	C	C	.	.			trans	77.9	26.6	179.8	0	0	0	0	0	114.4	F319 T478 I483 V596	F319-G481 WeakPolarHBondContact CD2-O 3.46Å; T478-G481 PolarHBondContact OG1-N 2.88Å; G481-I483 PolarHBondContact O-N 2.91Å; G481-V596 WeakPolarHBondContact CA-O 3.48Å; G481-V596 PolarHBondContact N-O 3.44Å
482	N	86.6	Confident	88.5	Confident	33 Å²	33	32.2 Å²	32.2	18%	0.176	17%	0.174	C	C	.	.			trans	-64.6	136.2	179.3	-60.5	-4.4	0	0	0	110.1	N318 L474 V475 T478	N318-N482 PolarHBondContact OD1-OD1 2.76Å; L474-N482 WeakPolarHBondContact CD1-O 3.34Å; V475-N482 HydrophobicContact CB-CB 4.35Å; V475-N482 WeakPolarHBondContact CB-O 3.4Å; V475-N482 HydrophobicContact CG2-CB 4.1Å; V475-N482 WeakPolarHBondContact CG2-O 3.45Å; V475-N482 PolarHBondContact N-O 3.49Å; T478-N482 PolarHBondContact OG1-N 3.37Å; T478-N482 VanDerWaalsContact OG1-N 3.14Å
483	I	89.5	Confident	88.5	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-114.1	152.9	178.3	59.8	170.4	0	0	0	110.5	L315 F319 L330 F370 L399 V472 H473 L474 G481 P486	L315-I483 HydrophobicContact CB-CG1 4.25Å; L315-I483 HydrophobicContact CD1-CD1 3.9Å; L315-I483 HydrophobicContact CD1-CG1 3.64Å; L315-I483 PolarHBondContact N-O 2.8Å; F319-I483 HydrophobicContact CD2-CG2 4.48Å; F319-I483 HydrophobicContact CE2-CD1 3.75Å; F319-I483 HydrophobicContact CE2-CG1 3.93Å; F319-I483 HydrophobicContact CZ-CD1 4.24Å; L330-I483 HydrophobicContact CD2-CD1 4.24Å; F370-I483 HydrophobicContact CE2-CG2 3.66Å; F370-I483 HydrophobicContact CZ-CG2 3.67Å; L399-I483 HydrophobicContact CD2-CD1 4.41Å; V472-I483 HydrophobicContact CG1-CB 3.93Å; V472-I483 HydrophobicContact CG1-CD1 3.71Å; V472-I483 HydrophobicContact CG1-CG1 4.41Å; V472-I483 HydrophobicContact CG1-CG2 3.77Å; H473-I483 WeakPolarHBondContact O-CA 3.3Å; L474-I483 HydrophobicContact CD1-CG2 4.14Å; G481-I483 PolarHBondContact O-N 2.91Å; I483-P486 HydrophobicContact CD1-CG 4.47Å
484	Y	90.8	Very high	88.6	Confident	52 Å²	52	31.3 Å²	31.3	20%	0.204	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-73.6	166.9	163.1	-72.9	-55.1	0	0	0	110.8	L310 S311 H473 V475 P486	L310-Y484 WeakPolarHBondContact O-CB 3.26Å; S311-Y484 WeakPolarHBondContact O-CE1 3.43Å; H473-Y484 HydrophobicContact CB-CD2 4.17Å; H473-Y484 PolarHBondContact O-N 3.43Å; V475-Y484 HydrophobicContact CB-CE2 4.4Å; V475-Y484 HydrophobicContact CG2-CD1 3.99Å; V475-Y484 HydrophobicContact CG2-CD2 4.15Å; V475-Y484 HydrophobicContact CG2-CE1 3.88Å; V475-Y484 HydrophobicContact CG2-CE2 4.09Å; V475-Y484 HydrophobicContact CG2-CG 4.11Å; Y484-P486 WeakPolarHBondContact O-CD 3.37Å
485	P	90.4	Very high	88.6	Confident	8 Å²	8	32 Å²	32	5%	0.052	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-54.5	126.9	175.8	-24.7	37.1	0	0	0	109.8	T313 L411	T313-P485 WeakPolarHBondContact O-CD 3.35Å; L411-P485 HydrophobicContact CD2-CB 3.89Å; L411-P485 HydrophobicContact CD2-CG 4.06Å
486	P	94.2	Very high	88.7	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.006	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-57.3	151.2	174.6	-25.2	34.7	0	0	0	111.3	F332 L399 V413 P414 L470 S471 V472 I483 Y484	F332-P486 HydrophobicContact CE1-CB 4.29Å; F332-P486 HydrophobicContact CE1-CG 4.2Å; F332-P486 HydrophobicContact CZ-CB 4.21Å; F332-P486 HydrophobicContact CZ-CG 4.07Å; L399-P486 HydrophobicContact CD2-CG 4.09Å; V413-P486 HydrophobicContact CG1-CB 4.38Å; V413-P486 WeakPolarHBondContact CG1-O 3.43Å; P414-P486 VanDerWaalsContact CD-O 3.29Å; P414-P486 WeakPolarHBondContact CD-O 3.38Å; L470-P486 HydrophobicContact CD1-CB 3.77Å; S471-P486 WeakPolarHBondContact O-CA 3.5Å; V472-P486 HydrophobicContact CG2-CB 4.18Å; V472-P486 HydrophobicContact CG2-CG 4.32Å; I483-P486 HydrophobicContact CD1-CG 4.47Å; Y484-P486 WeakPolarHBondContact O-CD 3.37Å
487	L	95.1	Very high	88.9	Confident	6 Å²	6	30.4 Å²	30.4	3%	0.031	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.3	177.5	175.5	62	0	0	0	109.5	L310 P414 L416 W436 L438 L470 S471	L310-L487 HydrophobicContact CD1-CD2 4.25Å; L310-L487 HydrophobicContact CD2-CB 4.18Å; L310-L487 HydrophobicContact CD2-CD1 4.09Å; L310-L487 HydrophobicContact CD2-CD2 4.39Å; L310-L487 HydrophobicContact CD2-CG 4.46Å; P414-L487 HydrophobicContact CB-CD1 4.28Å; P414-L487 HydrophobicContact CG-CD1 4.24Å; P414-L487 WeakPolarHBondContact O-CD1 3.4Å; L416-L487 HydrophobicContact CB-CD1 4.02Å; L416-L487 HydrophobicContact CB-CD2 4.47Å; L416-L487 HydrophobicContact CB-CG 4.46Å; W436-L487 HydrophobicContact CZ3-CD2 4.34Å; L438-L487 HydrophobicContact CD2-CD1 3.96Å; L470-L487 CarbonylContact C-O 3.35Å; L470-L487 WeakPolarHBondContact CA-O 3.34Å; S471-L487 PolarHBondContact N-O 2.98Å; S471-L487 PolarHBondContact O-N 2.94Å
488	I	97.2	Very high	89.1	Confident	5 Å²	5	30.5 Å²	30.5	3%	0.026	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	116.2	169.8	-67.2	168.1	0	0	0	108.3	V397 V413 P414 V415 L416 I468 S469 L470	V397-I488 HydrophobicContact CB-CD1 3.9Å; V397-I488 HydrophobicContact CG1-CD1 3.89Å; V397-I488 HydrophobicContact CG2-CD1 4.02Å; V413-I488 HydrophobicContact CB-CD1 4.38Å; V413-I488 HydrophobicContact CG1-CD1 3.62Å; V413-I488 HydrophobicContact CG1-CG1 3.69Å; P414-I488 PolarHBondContact O-N 3.47Å; V415-I488 CarbonylContact C-O 3.57Å; V415-I488 WeakPolarHBondContact CA-O 3.19Å; V415-I488 HydrophobicContact CG1-CG2 4.44Å; V415-I488 HydrophobicContact CG2-CB 4.2Å; V415-I488 HydrophobicContact CG2-CG2 4.49Å; L416-I488 PolarHBondContact N-O 2.98Å; I468-I488 HydrophobicContact CG2-CG2 4.25Å; S469-I488 CarbonylContact O-C 3.6Å; S469-I488 WeakPolarHBondContact O-CA 3.27Å; L470-I488 HydrophobicContact CD1-CG1 3.83Å
489	T	97	Very high	89.1	Confident	27 Å²	27	34.3 Å²	34.3	17%	0.166	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	127.2	168.9	-59.7	0	0	0	0	108.9	L416 L418 I468 S469	L416-T489 HydrophobicContact CD2-CG2 4.22Å; L416-T489 WeakPolarHBondContact O-CA 3.29Å; L418-T489 HydrophobicContact CD1-CG2 3.97Å; L418-T489 HydrophobicContact CD2-CG2 3.88Å; L418-T489 HydrophobicContact CG-CG2 3.87Å; I468-T489 WeakPolarHBondContact CA-O 3.19Å; S469-T489 PolarHBondContact N-O 3.17Å; S469-T489 PolarHBondContact O-N 3.37Å
490	I	97.3	Very high	89.4	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.8	-178.4	-170.6	159.7	0	0	0	111.1	V415 L416 N417 L418 I442 A465 Q467 I468 Y492	V415-I490 HydrophobicContact CG1-CG2 3.66Å; L416-I490 PolarHBondContact O-N 2.99Å; N417-I490 HydrophobicContact CB-CG2 4.14Å; L418-I490 PolarHBondContact N-O 3.44Å; I442-I490 HydrophobicContact CB-CD1 4.18Å; I442-I490 HydrophobicContact CG2-CD1 4.17Å; I442-I490 HydrophobicContact CG2-CG2 4.32Å; A465-I490 HydrophobicContact CB-CD1 3.85Å; A465-I490 HydrophobicContact CB-CG1 4.21Å; Q467-I490 CarbonylContact O-C 3.56Å; Q467-I490 WeakPolarHBondContact O-CA 3.3Å; I468-I490 HydrophobicContact CD1-CD1 4.22Å; I468-I490 HydrophobicContact CG1-CD1 4.01Å; I468-I490 HydrophobicContact CG1-CG1 4.06Å; I490-Y492 HydrophobicContact CB-CE2 4.44Å; I490-Y492 HydrophobicContact CD1-CE1 4.07Å; I490-Y492 HydrophobicContact CD1-CE2 3.81Å; I490-Y492 VanDerWaalsContact CD1-CZ 3.47Å; I490-Y492 WeakPolarHBondContact CD1-OH 3.39Å; I490-Y492 HydrophobicContact CG1-CD2 4.22Å; I490-Y492 HydrophobicContact CG1-CE2 3.73Å; I490-Y492 HydrophobicContact CG2-CE2 3.88Å
491	A	96.6	Very high	89.5	Confident	15 Å²	15	32.6 Å²	32.6	12%	0.124	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	132.9	169.4	0	0	0	0	0	109.3	L418 A465 T466 Q467	L418-A491 HydrophobicContact CB-CB 4.46Å; L418-A491 HydrophobicContact CD1-CB 4.05Å; A465-A491 CarbonylContact C-O 3.45Å; A465-A491 WeakPolarHBondContact CA-O 3.38Å; T466-A491 PolarHBondContact N-O 3.47Å; T466-A491 PolarHBondContact OG1-O 3.01Å; Q467-A491 HydrophobicContact CB-CB 3.9Å; Q467-A491 PolarHBondContact N-O 3.25Å; Q467-A491 PolarHBondContact O-N 2.99Å
492	Y	95.3	Very high	89.6	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.008	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	142.2	173.8	-64.8	-88.7	0	0	0	109.7	M257 N419 F443 R463 V464 A465 I490	M257-Y492 HydrophobicContact CE-CD1 4.31Å; M257-Y492 HydrophobicContact CE-CD2 3.87Å; M257-Y492 HydrophobicContact CE-CE1 4.44Å; M257-Y492 HydrophobicContact CE-CE2 4.02Å; M257-Y492 HydrophobicContact CE-CG 4.01Å; M257-Y492 HydrophobicContact SD-CD2 3.44Å; M257-Y492 WeakPolarHBondContact SD-CD2 3.14Å; M257-Y492 HydrophobicContact SD-CE2 4.08Å; M257-Y492 HydrophobicContact SD-CG 3.73Å; N419-Y492 PolarHBondContact ND2-O 2.77Å; N419-Y492 PolarHBondContact OD1-N 3.12Å; N419-Y492 PolarHBondContact OD1-O 2.95Å; F443-Y492 HydrophobicContact CD1-CE1 4.33Å; F443-Y492 AromaticContact CD2-CE1 3.92Å; F443-Y492 HydrophobicContact CD2-CE1 3.92Å; F443-Y492 HydrophobicContact CE1-CE1 4.05Å; F443-Y492 HydrophobicContact CE2-CD1 4.04Å; F443-Y492 AromaticContact CE2-CE1 3.61Å; F443-Y492 HydrophobicContact CE2-CE1 3.61Å; F443-Y492 HydrophobicContact CG-CE1 4.28Å; F443-Y492 HydrophobicContact CZ-CD1 4.11Å; F443-Y492 AromaticContact CZ-CE1 3.7Å; F443-Y492 HydrophobicContact CZ-CE1 3.7Å; F443-Y492 PolarHBondContact N-OH 2.98Å; F443-Y492 VanDerWaalsContact O-CE1 3.24Å; F443-Y492 WeakPolarHBondContact O-CE1 2.98Å; F443-Y492 PolarHBondContact O-OH 3.1Å; F443-Y492 VanDerWaalsContact O-OH 3.04Å; R463-Y492 HydrophobicContact CG-CD1 3.94Å; R463-Y492 HydrophobicContact CG-CG 4.22Å; V464-Y492 CarbonylContact O-C 3.55Å; V464-Y492 VanDerWaalsContact O-CA 3.28Å; V464-Y492 WeakPolarHBondContact O-CA 2.91Å; A465-Y492 HydrophobicContact CB-CD1 4.03Å; A465-Y492 HydrophobicContact CB-CE1 3.88Å; I490-Y492 HydrophobicContact CB-CE2 4.44Å; I490-Y492 HydrophobicContact CD1-CE1 4.07Å; I490-Y492 HydrophobicContact CD1-CE2 3.81Å; I490-Y492 VanDerWaalsContact CD1-CZ 3.47Å; I490-Y492 WeakPolarHBondContact CD1-OH 3.39Å; I490-Y492 HydrophobicContact CG1-CD2 4.22Å; I490-Y492 HydrophobicContact CG1-CE2 3.73Å; I490-Y492 HydrophobicContact CG2-CE2 3.88Å
493	S	94.3	Very high	89.7	Confident	27 Å²	27	39 Å²	39	19%	0.189	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	143.5	170.5	-56.9	0	0	0	0	111.1	E216 R463 V464 T466	E216-S493 WeakPolarHBondContact OE2-CA 3.5Å; E216-S493 WeakPolarHBondContact OE2-CB 3.22Å; R463-S493 WeakPolarHBondContact CA-O 3.48Å; V464-S493 PolarHBondContact N-O 3.33Å; V464-S493 PolarHBondContact O-N 2.97Å; T466-S493 WeakPolarHBondContact CG2-OG 3.45Å; T466-S493 PolarHBondContact OG1-OG 3.39Å
494	D	92.8	Very high	89.8	Confident	14 Å²	14	42 Å²	42	8%	0.075	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	124.7	-179.5	-63.8	-31.7	0	0	0	109.6	Y214 G215 E216 V217 V461 R463	Y214-D494 VanDerWaalsContact C-OD2 3.28Å; Y214-D494 WeakPolarHBondContact CA-OD2 3.44Å; Y214-D494 WeakPolarHBondContact CB-OD2 3.4Å; Y214-D494 HydrophobicContact CD1-CB 4.07Å; G215-D494 PolarHBondContact N-OD2 3.47Å; G215-D494 VanDerWaalsContact N-OD2 3.16Å; E216-D494 HydrophobicContact CB-CB 4.34Å; E216-D494 PolarHBondContact OE2-N 2.9Å; V217-D494 HydrophobicContact CG2-CB 3.73Å; V217-D494 WeakPolarHBondContact CG2-O 3.43Å; V461-D494 HydrophobicContact CG1-CB 4.21Å; R463-D494 IonicContact CZ-OD1 2.68Å; R463-D494 IonicContact NE-OD1 3.15Å; R463-D494 PolarHBondContact NE-OD1 2.96Å; R463-D494 IonicContact NH2-OD1 2.77Å; R463-D494 PolarHBondContact NH2-OD1 3.36Å; R463-D494 IonicContact NH2-OD2 2.88Å; R463-D494 PolarHBondContact NH2-OD2 3.37Å
495	I	90.9	Very high	89.9	Confident	24 Å²	24	40 Å²	40	12%	0.123	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	122	-170.7	-51.1	175.2	0	0	0	110.2	I382 V461 I462 V464 V505	I382-I495 HydrophobicContact CD1-CD1 3.84Å; I382-I495 HydrophobicContact CD1-CG2 4.03Å; I382-I495 HydrophobicContact CG1-CG2 4.38Å; V461-I495 CarbonylContact C-O 3.59Å; V461-I495 VanDerWaalsContact CA-O 3.26Å; V461-I495 WeakPolarHBondContact CA-O 3.47Å; V461-I495 WeakPolarHBondContact CG1-O 3.5Å; I462-I495 HydrophobicContact CG1-CB 4.01Å; I462-I495 PolarHBondContact N-O 3.23Å; I462-I495 PolarHBondContact O-N 3.09Å; V464-I495 HydrophobicContact CB-CD1 4.47Å; V464-I495 HydrophobicContact CG2-CD1 4.11Å; I495-V505 HydrophobicContact CD1-CB 3.71Å; I495-V505 HydrophobicContact CD1-CG1 4.37Å; I495-V505 HydrophobicContact CD1-CG2 3.6Å
496	D	89.3	Confident	90.1	Very high	37 Å²	37	46.8 Å²	46.8	20%	0.198	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	129.4	173.1	-170.6	-22.5	0	0	0	110.1	K498 Q503	D496-K498 VanDerWaalsContact OD1-CG 3.27Å; D496-K498 WeakPolarHBondContact OD1-CG 3.46Å; D496-K498 PolarHBondContact OD1-N 2.85Å; D496-K498 WeakPolarHBondContact OD2-CE 3.46Å; D496-K498 IonicContact OD2-NZ 3.3Å; D496-K498 PolarHBondContact OD2-NZ 3.41Å; D496-Q503 PolarHBondContact O-OE1 2.95Å; D496-Q503 VanDerWaalsContact O-OE1 3.13Å
497	T	86.7	Confident	90.2	Very high	20 Å²	20	47 Å²	47	12%	0.123	26%	0.257	C	S	.	.			trans	-91.5	3.4	-170.6	60.3	0	0	0	0	114.6	P459 R460 I462 D499 A500	P459-T497 WeakPolarHBondContact O-CB 3.31Å; P459-T497 WeakPolarHBondContact O-CG2 3.42Å; P459-T497 PolarHBondContact O-OG1 3.22Å; R460-T497 VanDerWaalsContact C-OG1 3.31Å; R460-T497 WeakPolarHBondContact CA-OG1 3.49Å; R460-T497 PolarHBondContact O-N 3.12Å; R460-T497 PolarHBondContact O-OG1 2.92Å; I462-T497 HydrophobicContact CG1-CG2 4.33Å; I462-T497 HydrophobicContact CG2-CG2 3.86Å; T497-D499 PolarHBondContact O-N 2.96Å; T497-A500 WeakPolarHBondContact O-CB 3.13Å; T497-A500 PolarHBondContact O-N 3.47Å; T497-A500 VanDerWaalsContact O-N 3.12Å
498	K	83.2	Confident	90.3	Very high	147 Å²	147	48.5 Å²	48.5	64%	0.639	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-36.7	-178.5	-77.3	165.7	-170.2	147.8	0	114.5	D496	D496-K498 VanDerWaalsContact OD1-CG 3.27Å; D496-K498 WeakPolarHBondContact OD1-CG 3.46Å; D496-K498 PolarHBondContact OD1-N 2.85Å; D496-K498 WeakPolarHBondContact OD2-CE 3.46Å; D496-K498 IonicContact OD2-NZ 3.3Å; D496-K498 PolarHBondContact OD2-NZ 3.41Å
499	D	78.3	Confident	90.3	Very high	96 Å²	96	48.7 Å²	48.7	51%	0.513	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	43.3	179.9	-62.3	-46.5	0	0	0	112.4	T497 N501 S502 Q503	T497-D499 PolarHBondContact O-N 2.96Å; D499-N501 PolarHBondContact O-N 2.9Å; D499-S502 PolarHBondContact O-N 3.46Å; D499-S502 PolarHBondContact O-OG 3.26Å; D499-Q503 HydrophobicContact CB-CG 4.19Å; D499-Q503 WeakPolarHBondContact O-CG 3.34Å; D499-Q503 PolarHBondContact O-N 2.93Å
500	A	76.7	Confident	90.3	Very high	18 Å²	18	48.4 Å²	48.4	15%	0.149	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-21	-173.6	0	0	0	0	0	116	I382 S383 L386 T497	I382-A500 HydrophobicContact CB-CB 4.35Å; I382-A500 HydrophobicContact CG2-CB 3.97Å; S383-A500 PolarHBondContact N-O 2.84Å; L386-A500 HydrophobicContact CD1-CB 4.44Å; T497-A500 WeakPolarHBondContact O-CB 3.13Å; T497-A500 PolarHBondContact O-N 3.47Å; T497-A500 VanDerWaalsContact O-N 3.12Å
501	N	77.8	Confident	90.2	Very high	153 Å²	153	48.4 Å²	48.4	82%	0.818	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-19.7	-179.2	-70	-26.3	0	0	0	114.2	D499	D499-N501 PolarHBondContact O-N 2.9Å
502	S	82	Confident	90.1	Very high	101 Å²	101	49.6 Å²	49.6	71%	0.706	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109	-12.1	179.8	60	0	0	0	0	113.4	D499	D499-S502 PolarHBondContact O-N 3.46Å; D499-S502 PolarHBondContact O-OG 3.26Å
503	Q	88.3	Confident	89.9	Confident	67 Å²	67	50.2 Å²	50.2	31%	0.313	28%	0.275	S	S	.	.			trans	-93.8	142.1	-179	-66.4	-178.2	-1.1	0	0	112.3	I382 D496 D499	I382-Q503 HydrophobicContact CG1-CB 3.99Å; I382-Q503 PolarHBondContact N-O 3.42Å; D496-Q503 PolarHBondContact O-OE1 2.95Å; D496-Q503 VanDerWaalsContact O-OE1 3.13Å; D499-Q503 HydrophobicContact CB-CG 4.19Å; D499-Q503 WeakPolarHBondContact O-CG 3.34Å; D499-Q503 PolarHBondContact O-N 2.93Å
504	S	91.7	Very high	89.7	Confident	62 Å²	62	51.1 Å²	51.1	43%	0.434	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	153.9	168.5	62.1	0	0	0	0	110	E379 I380	E379-S504 PolarHBondContact OE2-OG 3.15Å; I380-S504 CarbonylContact O-C 3.49Å; I380-S504 WeakPolarHBondContact O-CA 3.47Å
505	V	92.9	Very high	89.5	Confident	10 Å²	10	52.4 Å²	52.4	6%	0.061	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	133.9	174	59.6	0	0	0	0	109.9	E379 I380 I382 I385 T466 I495 V507	E379-V505 WeakPolarHBondContact CA-O 3.33Å; I380-V505 HydrophobicContact CB-CG1 4.39Å; I380-V505 PolarHBondContact N-O 3.46Å; I380-V505 PolarHBondContact O-N 3.07Å; I382-V505 HydrophobicContact CD1-CB 3.99Å; I382-V505 HydrophobicContact CD1-CG1 3.95Å; I385-V505 HydrophobicContact CD1-CG1 3.26Å; T466-V505 HydrophobicContact CG2-CG2 3.59Å; I495-V505 HydrophobicContact CD1-CB 3.71Å; I495-V505 HydrophobicContact CD1-CG1 4.37Å; I495-V505 HydrophobicContact CD1-CG2 3.6Å; V505-V507 HydrophobicContact CG1-CG1 4.14Å; V505-V507 HydrophobicContact CG2-CG1 4.21Å
506	K	95.5	Very high	89.2	Confident	150 Å²	150	56.9 Å²	56.9	65%	0.652	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	122.5	170.2	-74.6	176	177.3	177.8	0	109	E379	E379-K506 HydrophobicContact CG-CG 3.58Å; E379-K506 WeakPolarHBondContact OE1-CE 3.18Å; E379-K506 IonicContact OE1-NZ 3.05Å
507	V	96.4	Very high	88.8	Confident	7 Å²	7	56.2 Å²	56.2	4%	0.042	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	145.6	175.1	-57.3	0	0	0	0	109.9	L356 C357 N377 C378 I380 V464 T466 V505	L356-V507 HydrophobicContact CB-CB 4.48Å; L356-V507 HydrophobicContact CB-CG2 3.97Å; L356-V507 HydrophobicContact CD1-CB 4.35Å; L356-V507 HydrophobicContact CD1-CG1 3.94Å; C357-V507 VanDerWaalsContact SG-CG2 3.53Å; N377-V507 WeakPolarHBondContact CA-O 3.29Å; C378-V507 PolarHBondContact N-O 3.44Å; C378-V507 VanDerWaalsContact N-O 3.1Å; C378-V507 PolarHBondContact O-N 3.37Å; I380-V507 HydrophobicContact CD1-CG2 3.64Å; I380-V507 HydrophobicContact CG1-CG2 4.06Å; V464-V507 HydrophobicContact CG1-CG1 4.23Å; T466-V507 CarbonylContact O-C 3.53Å; T466-V507 WeakPolarHBondContact O-CA 3.38Å; V505-V507 HydrophobicContact CG1-CG1 4.14Å; V505-V507 HydrophobicContact CG2-CG1 4.21Å
508	S	97.1	Very high	88.6	Confident	36 Å²	36	56.9 Å²	56.9	25%	0.252	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	136.3	-177.6	59.7	0	0	0	0	111.3	Q376 N377 T466 Q467 I468	Q376-S508 CarbonylContact O-C 3.54Å; Q376-S508 VanDerWaalsContact O-CA 3.32Å; Q376-S508 WeakPolarHBondContact O-CA 3.46Å; N377-S508 WeakPolarHBondContact OD1-CB 3.22Å; T466-S508 PolarHBondContact O-N 3.18Å; T466-S508 PolarHBondContact O-OG 2.96Å; Q467-S508 WeakPolarHBondContact CA-O 3.32Å; I468-S508 PolarHBondContact N-O 3.18Å
509	F	97	Very high	88.6	Confident	9 Å²	9	55.8 Å²	55.8	4%	0.039	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.6	171.9	-175.4	-82.6	0	0	0	109.2	L354 Q355 A367 Y374 Q376 I468 V511	L354-F509 HydrophobicContact CB-CE2 3.92Å; Q355-F509 HydrophobicContact CG-CB 4.23Å; Q355-F509 HydrophobicContact CG-CD1 3.78Å; Q355-F509 HydrophobicContact CG-CD2 4.01Å; Q355-F509 HydrophobicContact CG-CE1 4.1Å; Q355-F509 HydrophobicContact CG-CE2 4.33Å; Q355-F509 HydrophobicContact CG-CG 3.73Å; Q355-F509 HydrophobicContact CG-CZ 4.37Å; A367-F509 HydrophobicContact CB-CE1 3.89Å; Y374-F509 AromaticContact CD1-CD1 3.71Å; Y374-F509 HydrophobicContact CD1-CD1 3.71Å; Y374-F509 HydrophobicContact CD1-CE1 4.07Å; Y374-F509 AromaticContact CE1-CD1 3.63Å; Y374-F509 HydrophobicContact CE1-CD1 3.63Å; Y374-F509 HydrophobicContact CE1-CE1 4.21Å; Q376-F509 PolarHBondContact N-O 2.67Å; Q376-F509 PolarHBondContact O-N 3.39Å; I468-F509 HydrophobicContact CB-CD2 3.83Å; I468-F509 HydrophobicContact CB-CE2 4.3Å; I468-F509 HydrophobicContact CG2-CD2 3.81Å; I468-F509 HydrophobicContact CG2-CE2 3.74Å; I468-F509 CarbonylContact O-C 3.52Å; I468-F509 VanDerWaalsContact O-CA 3.28Å; I468-F509 WeakPolarHBondContact O-CA 3.24Å; F509-V511 HydrophobicContact CE1-CG2 3.68Å; F509-V511 HydrophobicContact CZ-CG2 4.29Å
510	S	96.6	Very high	88.7	Confident	22 Å²	22	52.8 Å²	52.8	15%	0.154	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	150.9	179.9	55.1	0	0	0	0	113.3	Y374 I468 S469 L470	Y374-S510 CarbonylContact O-C 3.49Å; Y374-S510 WeakPolarHBondContact O-CA 3.44Å; Y374-S510 WeakPolarHBondContact O-CB 3.45Å; I468-S510 PolarHBondContact O-N 3.09Å; S469-S510 CarbonylContact C-O 3.54Å; S469-S510 VanDerWaalsContact CA-O 3.3Å; S469-S510 WeakPolarHBondContact CA-O 3.49Å; S469-S510 WeakPolarHBondContact CB-OG 3.33Å; S469-S510 PolarHBondContact OG-OG 3.02Å; S469-S510 VanDerWaalsContact OG-OG 3.04Å; L470-S510 PolarHBondContact N-O 3.17Å
511	V	95.7	Very high	89	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	121.1	170.4	-172.9	0	0	0	0	108.7	A367 Y374 L470 F509 Y513	A367-V511 HydrophobicContact CB-CG2 3.95Å; A367-V511 WeakPolarHBondContact O-CG2 3.5Å; Y374-V511 PolarHBondContact N-O 3.11Å; Y374-V511 VanDerWaalsContact N-O 3.12Å; Y374-V511 PolarHBondContact O-N 2.91Å; L470-V511 HydrophobicContact CB-CG1 4.24Å; L470-V511 HydrophobicContact CB-CG2 4.13Å; L470-V511 HydrophobicContact CD2-CG1 4Å; L470-V511 HydrophobicContact CD2-CG2 4.29Å; L470-V511 HydrophobicContact CG-CG1 4.25Å; L470-V511 CarbonylContact O-C 3.52Å; L470-V511 VanDerWaalsContact O-CA 3.27Å; L470-V511 WeakPolarHBondContact O-CA 3.32Å; F509-V511 HydrophobicContact CE1-CG2 3.68Å; F509-V511 HydrophobicContact CZ-CG2 4.29Å; V511-Y513 HydrophobicContact CG1-CE2 4.03Å
512	T	94.1	Very high	89.5	Confident	39 Å²	39	51.9 Å²	51.9	24%	0.239	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	147.8	-177	58.2	0	0	0	0	111.2	L470 S471 V472	L470-T512 PolarHBondContact O-N 3.32Å; S471-T512 WeakPolarHBondContact CA-O 3.38Å; V472-T512 PolarHBondContact N-O 2.87Å
513	Y	91.8	Very high	89.8	Confident	15 Å²	15	52.3 Å²	52.3	6%	0.059	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	128.4	179	-63.7	-83.8	0	0	0	108.3	L330 S369 F370 G371 T372 V472 V511	L330-Y513 HydrophobicContact CD1-CE1 4.34Å; S369-Y513 PolarHBondContact O-OH 3.45Å; F370-Y513 WeakPolarHBondContact CA-OH 3.18Å; F370-Y513 HydrophobicContact CD2-CD1 4.01Å; F370-Y513 AromaticContact CD2-CE1 3.43Å; F370-Y513 HydrophobicContact CD2-CE1 3.43Å; F370-Y513 VanDerWaalsContact CD2-CE1 3.43Å; F370-Y513 AromaticContact CE2-CD1 3.82Å; F370-Y513 HydrophobicContact CE2-CD1 3.82Å; F370-Y513 AromaticContact CE2-CE1 3.71Å; F370-Y513 HydrophobicContact CE2-CE1 3.71Å; F370-Y513 HydrophobicContact CG-CE1 4.33Å; G371-Y513 VanDerWaalsContact N-CZ 3.31Å; T372-Y513 WeakPolarHBondContact O-CE2 3.35Å; V472-Y513 HydrophobicContact CB-CD1 3.77Å; V472-Y513 HydrophobicContact CB-CE1 3.9Å; V472-Y513 HydrophobicContact CG1-CD1 4.28Å; V472-Y513 HydrophobicContact CG1-CE1 4.36Å; V472-Y513 HydrophobicContact CG2-CD1 4.34Å; V472-Y513 HydrophobicContact CG2-CE1 3.99Å; V472-Y513 WeakPolarHBondContact O-CA 3.32Å; V511-Y513 HydrophobicContact CG1-CE2 4.03Å
514	E	90.1	Very high	89.8	Confident	46 Å²	46	50.5 Å²	50.5	22%	0.215	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	146.1	-172.5	-67.8	-176.9	-145.8	0	0	110.9	V472 H473 L474 L599 M602	V472-E514 PolarHBondContact O-N 3.27Å; H473-E514 WeakPolarHBondContact CA-O 3.46Å; H473-E514 IonicContact CE1-OE2 3.68Å; H473-E514 PolarHBondContact CE1-OE2 2.9Å; H473-E514 IonicContact ND1-OE2 3.71Å; L474-E514 PolarHBondContact N-O 2.98Å; E514-L599 WeakPolarHBondContact O-CD1 3.45Å; E514-M602 VanDerWaalsContact CD-SD 3.54Å; E514-M602 HydrophobicContact CG-CE 4.16Å; E514-M602 HydrophobicContact CG-CG 4.18Å; E514-M602 HydrophobicContact CG-SD 3.72Å
515	M	88	Confident	89.6	Confident	41 Å²	41	50.8 Å²	50.8	20%	0.202	27%	0.273	C	S	.	.			trans	-142.2	159.6	169.5	68.1	173.5	-69.3	0	0	110.2	L474 H517 W586 V598 L599	L474-M515 HydrophobicContact CB-CB 4.2Å; M515-H517 WeakPolarHBondContact CG-CE1 3.18Å; M515-H517 VanDerWaalsContact CG-NE2 3.3Å; M515-H517 WeakPolarHBondContact CG-NE2 3.4Å; M515-H517 PolarHBondContact O-CD2 2.94Å; M515-H517 VanDerWaalsContact O-CD2 3.25Å; M515-H517 PolarHBondContact O-N 3.35Å; M515-H517 PolarHBondContact SD-CE1 3.41Å; M515-W586 HydrophobicContact SD-CH2 4.07Å; M515-V598 HydrophobicContact CE-CG1 3.86Å; M515-V598 HydrophobicContact SD-CB 4.39Å; M515-V598 HydrophobicContact SD-CG1 3.59Å; M515-V598 VanDerWaalsContact SD-CG1 3.59Å; M515-L599 HydrophobicContact CB-CB 4.41Å; M515-L599 HydrophobicContact CB-CD1 4.4Å; M515-L599 HydrophobicContact CG-CB 4.12Å; M515-L599 HydrophobicContact SD-CB 4.04Å; M515-L599 PolarHBondContact SD-N 3.14Å; M515-L599 VanDerWaalsContact SD-O 3.34Å
516	D	84.1	Confident	89.6	Confident	118 Å²	118	55.3 Å²	55.3	63%	0.631	30%	0.296	S	S	*	.			trans	-72.2	121.9	170.3	-175.5	14	0	0	0	110.2	G518	D516-G518 PolarHBondContact OD1-N 3.49Å
517	H	81	Confident	89.4	Confident	24 Å²	24	50 Å²	50	11%	0.111	28%	0.28	C	S	.	.			trans	-107.3	10.4	178.3	-63.3	-71	0	0	0	112.8	M515 E519 A520 H521 W586 L599 Q605	M515-H517 WeakPolarHBondContact CG-CE1 3.18Å; M515-H517 VanDerWaalsContact CG-NE2 3.3Å; M515-H517 WeakPolarHBondContact CG-NE2 3.4Å; M515-H517 PolarHBondContact O-CD2 2.94Å; M515-H517 VanDerWaalsContact O-CD2 3.25Å; M515-H517 PolarHBondContact O-N 3.35Å; M515-H517 PolarHBondContact SD-CE1 3.41Å; H517-E519 VanDerWaalsContact C-N 3.3Å; H517-E519 PolarHBondContact O-N 3.34Å; H517-A520 PolarHBondContact O-N 3.18Å; H517-H521 PolarHBondContact O-N 3.36Å; H517-W586 AromaticContact CE1-CH2 3.4Å; H517-W586 WeakPolarHBondContact CE1-CH2 3.43Å; H517-W586 AromaticContact CE1-CZ2 3.69Å; H517-W586 AromaticContact ND1-CH2 3.62Å; H517-W586 AromaticContact ND1-CZ2 3.62Å; H517-L599 PolarHBondContact CE1-O 3.36Å; H517-Q605 PolarHBondContact CD2-OE1 3.2Å; H517-Q605 VanDerWaalsContact CD2-OE1 3.25Å
518	G	82.2	Confident	89.2	Confident	34 Å²	34	51.6 Å²	51.6	35%	0.351	29%	0.288	S	S	.	.	H	α-helix	trans	-53.4	-45.6	-177.5	0	0	0	0	0	113	D516 H521 V522	D516-G518 PolarHBondContact OD1-N 3.49Å; G518-H521 PolarHBondContact O-N 3.26Å; G518-V522 WeakPolarHBondContact O-CG2 3.22Å; G518-V522 PolarHBondContact O-N 3.33Å
519	E	82.8	Confident	89	Confident	123 Å²	123	52.4 Å²	52.4	58%	0.575	30%	0.302	S	S	*	.	H	α-helix	trans	-65	-47	179.3	-170.2	-179.8	171.8	0	0	112.4	H517 H521 V522 Q523	H517-E519 VanDerWaalsContact C-N 3.3Å; H517-E519 PolarHBondContact O-N 3.34Å; E519-H521 PolarHBondContact O-N 3.49Å; E519-V522 PolarHBondContact O-N 3.5Å; E519-Q523 WeakPolarHBondContact O-CG 3.42Å; E519-Q523 PolarHBondContact O-N 3.37Å; E519-Q523 PolarHBondContact OE1-NE2 2.87Å
520	A	82	Confident	88.9	Confident	34 Å²	34	56.1 Å²	56.1	28%	0.281	33%	0.325	S	S	.	.	H	α-helix	trans	-61.3	-34.9	178.2	0	0	0	0	0	111.9	H517 T524	H517-A520 PolarHBondContact O-N 3.18Å; A520-T524 PolarHBondContact O-N 2.83Å; A520-T524 PolarHBondContact O-OG1 2.87Å
521	H	82.8	Confident	88.9	Confident	68 Å²	68	57.9 Å²	57.9	32%	0.315	33%	0.333	S	S	.	.	H	α-helix	trans	-67.3	-48.1	176	-171	28.5	0	0	0	111.7	H517 G518 E519 Q523 T524 D525 R608	H517-H521 PolarHBondContact O-N 3.36Å; G518-H521 PolarHBondContact O-N 3.26Å; E519-H521 PolarHBondContact O-N 3.49Å; H521-Q523 VanDerWaalsContact C-N 3.3Å; H521-Q523 PolarHBondContact O-N 2.97Å; H521-T524 WeakPolarHBondContact O-CB 3.48Å; H521-T524 PolarHBondContact O-N 3.45Å; H521-T524 VanDerWaalsContact O-N 3.13Å; H521-D525 IonicContact CE1-OD1 3.12Å; H521-D525 PolarHBondContact CE1-OD1 2.81Å; H521-D525 IonicContact CE1-OD2 3.65Å; H521-D525 PolarHBondContact CE1-OD2 3.05Å; H521-D525 IonicContact ND1-OD1 3.32Å; H521-D525 IonicContact ND1-OD2 2.86Å; H521-D525 IonicContact NE2-OD2 3.76Å; H521-D525 PolarHBondContact O-N 2.97Å; H521-R608 PolarHBondContact NE2-NH1 3.46Å
522	V	88.1	Confident	88.8	Confident	83 Å²	83	58.3 Å²	58.3	50%	0.503	34%	0.337	S	S	.	.	H	α-helix	trans	-58.5	-42.8	176.3	171.5	0	0	0	0	111.1	G518 E519 T524 D525 I526	G518-V522 WeakPolarHBondContact O-CG2 3.22Å; G518-V522 PolarHBondContact O-N 3.33Å; E519-V522 PolarHBondContact O-N 3.5Å; V522-T524 VanDerWaalsContact C-N 3.34Å; V522-T524 PolarHBondContact O-N 3.01Å; V522-D525 PolarHBondContact O-N 3.48Å; V522-I526 HydrophobicContact CG1-CD1 3.78Å; V522-I526 HydrophobicContact CG1-CG1 4.41Å; V522-I526 VanDerWaalsContact O-CG1 3.25Å; V522-I526 WeakPolarHBondContact O-CG1 3.36Å; V522-I526 PolarHBondContact O-N 3.15Å
523	Q	88.1	Confident	88.9	Confident	111 Å²	111	58.2 Å²	58.2	52%	0.519	34%	0.343	S	S	.	.	H	α-helix	trans	-62.6	-40.1	176.8	-70.6	177.8	5.7	0	0	112.3	E519 H521 I526 A527	E519-Q523 WeakPolarHBondContact O-CG 3.42Å; E519-Q523 PolarHBondContact O-N 3.37Å; E519-Q523 PolarHBondContact OE1-NE2 2.87Å; H521-Q523 VanDerWaalsContact C-N 3.3Å; H521-Q523 PolarHBondContact O-N 2.97Å; Q523-I526 PolarHBondContact O-N 3.41Å; Q523-A527 WeakPolarHBondContact O-CB 3.29Å; Q523-A527 PolarHBondContact O-N 3.42Å
524	T	87.2	Confident	89	Confident	28 Å²	28	62.1 Å²	62.1	17%	0.172	37%	0.365	C	S	.	.	H	α-helix	trans	-65	-42.5	176.5	-56.5	0	0	0	0	111.4	A520 H521 V522 A527 L528 I578	A520-T524 PolarHBondContact O-N 2.83Å; A520-T524 PolarHBondContact O-OG1 2.87Å; H521-T524 WeakPolarHBondContact O-CB 3.48Å; H521-T524 PolarHBondContact O-N 3.45Å; H521-T524 VanDerWaalsContact O-N 3.13Å; V522-T524 VanDerWaalsContact C-N 3.34Å; V522-T524 PolarHBondContact O-N 3.01Å; T524-A527 PolarHBondContact O-N 3.18Å; T524-L528 WeakPolarHBondContact O-CB 3.36Å; T524-L528 PolarHBondContact O-N 3.37Å; T524-I578 HydrophobicContact CG2-CG2 3.82Å
525	D	88.4	Confident	89.3	Confident	69 Å²	69	60.2 Å²	60.2	37%	0.369	36%	0.357	S	S	.	.	H	α-helix	trans	-66.3	-40.5	178.6	-72.2	-9.2	0	0	0	111.9	H521 V522 L528 G529	H521-D525 IonicContact CE1-OD1 3.12Å; H521-D525 PolarHBondContact CE1-OD1 2.81Å; H521-D525 IonicContact CE1-OD2 3.65Å; H521-D525 PolarHBondContact CE1-OD2 3.05Å; H521-D525 IonicContact ND1-OD1 3.32Å; H521-D525 IonicContact ND1-OD2 2.86Å; H521-D525 IonicContact NE2-OD2 3.76Å; H521-D525 PolarHBondContact O-N 2.97Å; V522-D525 PolarHBondContact O-N 3.48Å; D525-L528 PolarHBondContact O-N 3.45Å; D525-G529 PolarHBondContact O-N 2.93Å
526	I	92.2	Very high	89.6	Confident	105 Å²	105	60.5 Å²	60.5	54%	0.538	36%	0.361	S	S	.	.	H	α-helix	trans	-60.8	-46.9	173.4	-68.6	166.3	0	0	0	110.2	V522 Q523 L528 G529 V530	V522-I526 HydrophobicContact CG1-CD1 3.78Å; V522-I526 HydrophobicContact CG1-CG1 4.41Å; V522-I526 VanDerWaalsContact O-CG1 3.25Å; V522-I526 WeakPolarHBondContact O-CG1 3.36Å; V522-I526 PolarHBondContact O-N 3.15Å; Q523-I526 PolarHBondContact O-N 3.41Å; I526-L528 VanDerWaalsContact C-N 3.32Å; I526-L528 PolarHBondContact O-N 3.16Å; I526-G529 PolarHBondContact O-N 2.85Å; I526-V530 HydrophobicContact CG2-CG2 4.36Å; I526-V530 WeakPolarHBondContact O-CG2 3.33Å; I526-V530 PolarHBondContact O-N 3.17Å
527	A	92.3	Very high	90.1	Very high	37 Å²	37	60 Å²	60	31%	0.306	36%	0.358	S	S	.	.	H	α-helix	trans	-60.6	-41.9	178.2	0	0	0	0	0	111.8	Q523 T524 L531	Q523-A527 WeakPolarHBondContact O-CB 3.29Å; Q523-A527 PolarHBondContact O-N 3.42Å; T524-A527 PolarHBondContact O-N 3.18Å; A527-L531 VanDerWaalsContact O-CB 3.28Å; A527-L531 WeakPolarHBondContact O-CB 3.44Å; A527-L531 WeakPolarHBondContact O-CG 3.41Å; A527-L531 PolarHBondContact O-N 3.05Å
528	L	91.8	Very high	90.6	Very high	41 Å²	41	60.6 Å²	60.6	22%	0.215	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-43.1	176.2	-171.2	69.8	0	0	0	111.9	T524 D525 I526 G532 V574 F575 I578	T524-L528 WeakPolarHBondContact O-CB 3.36Å; T524-L528 PolarHBondContact O-N 3.37Å; D525-L528 PolarHBondContact O-N 3.45Å; I526-L528 VanDerWaalsContact C-N 3.32Å; I526-L528 PolarHBondContact O-N 3.16Å; L528-G532 WeakPolarHBondContact O-CA 3.43Å; L528-G532 PolarHBondContact O-N 2.92Å; L528-V574 HydrophobicContact CD1-CG1 4.14Å; L528-F575 HydrophobicContact CD1-CD1 3.81Å; L528-F575 HydrophobicContact CD1-CE1 3.53Å; L528-F575 HydrophobicContact CD1-CZ 4.17Å; L528-F575 HydrophobicContact CD2-CE1 4.15Å; L528-F575 HydrophobicContact CG-CE1 4.49Å; L528-I578 HydrophobicContact CB-CD1 3.94Å; L528-I578 HydrophobicContact CD1-CD1 3.65Å; L528-I578 HydrophobicContact CG-CD1 4.43Å
529	G	92.8	Very high	91.2	Very high	53 Å²	53	59 Å²	59	55%	0.546	35%	0.35	S	S	.	.	H	α-helix	trans	-63.3	-47.5	177.3	0	0	0	0	0	112.9	D525 I526 G533	D525-G529 PolarHBondContact O-N 2.93Å; I526-G529 PolarHBondContact O-N 2.85Å; G529-G533 PolarHBondContact O-N 3.11Å
530	V	95.5	Very high	91.7	Very high	88 Å²	88	57.3 Å²	57.3	53%	0.533	35%	0.345	S	S	.	.	H	α-helix	trans	-67.5	-52	-179.1	173.8	0	0	0	0	111.4	I526 G532 G533 L534	I526-V530 HydrophobicContact CG2-CG2 4.36Å; I526-V530 WeakPolarHBondContact O-CG2 3.33Å; I526-V530 PolarHBondContact O-N 3.17Å; V530-G532 VanDerWaalsContact C-N 3.33Å; V530-G532 PolarHBondContact O-N 3.07Å; V530-G533 PolarHBondContact O-N 3.44Å; V530-L534 PolarHBondContact O-N 2.87Å; V530-L534 VanDerWaalsContact O-N 3.07Å
531	L	95.3	Very high	92.2	Very high	59 Å²	59	59 Å²	59	31%	0.309	35%	0.348	S	S	.	.	H	α-helix	trans	-68.2	-34	-179.5	-66.7	178.6	0	0	0	111.8	A527 L534 A535 V574 I578	A527-L531 VanDerWaalsContact O-CB 3.28Å; A527-L531 WeakPolarHBondContact O-CB 3.44Å; A527-L531 WeakPolarHBondContact O-CG 3.41Å; A527-L531 PolarHBondContact O-N 3.05Å; L531-L534 HydrophobicContact CD2-CD1 4.33Å; L531-L534 PolarHBondContact O-N 3.5Å; L531-A535 WeakPolarHBondContact O-CB 3.33Å; L531-A535 PolarHBondContact O-N 3.36Å; L531-V574 HydrophobicContact CB-CB 4.38Å; L531-V574 HydrophobicContact CB-CG1 3.54Å; L531-V574 HydrophobicContact CB-CG2 3.96Å; L531-V574 HydrophobicContact CD1-CG1 4.39Å; L531-I578 HydrophobicContact CD1-CD1 4.3Å; L531-I578 HydrophobicContact CD1-CG1 4.11Å
532	G	94.8	Very high	92.6	Very high	8 Å²	8	60 Å²	60	8%	0.082	35%	0.352	C	S	.	.	H	α-helix	trans	-61.9	-43.5	171.9	0	0	0	0	0	112.3	L528 V530 L534 A535 V536	L528-G532 WeakPolarHBondContact O-CA 3.43Å; L528-G532 PolarHBondContact O-N 2.92Å; V530-G532 VanDerWaalsContact C-N 3.33Å; V530-G532 PolarHBondContact O-N 3.07Å; G532-L534 PolarHBondContact O-N 2.84Å; G532-A535 WeakPolarHBondContact O-CB 3.43Å; G532-A535 PolarHBondContact O-N 3.13Å; G532-A535 VanDerWaalsContact O-N 3.16Å; G532-V536 PolarHBondContact O-N 3.42Å
533	G	94.9	Very high	92.8	Very high	37 Å²	37	56.6 Å²	56.6	38%	0.381	33%	0.332	S	S	.	.	H	α-helix	trans	-60.1	-43.6	173.2	0	0	0	0	0	112.8	G529 V530 A535 V536 L537	G529-G533 PolarHBondContact O-N 3.11Å; V530-G533 PolarHBondContact O-N 3.44Å; G533-A535 VanDerWaalsContact C-N 3.32Å; G533-A535 PolarHBondContact O-N 2.7Å; G533-V536 WeakPolarHBondContact O-CB 3.36Å; G533-V536 PolarHBondContact O-N 2.88Å; G533-L537 PolarHBondContact O-N 3.25Å
534	L	95.1	Very high	92.9	Very high	98 Å²	98	53.4 Å²	53.4	51%	0.513	32%	0.324	S	S	.	.	H	α-helix	trans	-63.6	-36	173.8	-68	176.4	0	0	0	112.3	V530 L531 G532 V536 L537 A538	V530-L534 PolarHBondContact O-N 2.87Å; V530-L534 VanDerWaalsContact O-N 3.07Å; L531-L534 HydrophobicContact CD2-CD1 4.33Å; L531-L534 PolarHBondContact O-N 3.5Å; G532-L534 PolarHBondContact O-N 2.84Å; L534-V536 VanDerWaalsContact C-N 3.33Å; L534-V536 PolarHBondContact O-N 2.88Å; L534-L537 PolarHBondContact O-N 3.47Å; L534-A538 WeakPolarHBondContact O-CB 3.28Å; L534-A538 PolarHBondContact O-N 2.94Å
535	A	95.5	Very high	92.9	Very high	5 Å²	5	52.1 Å²	52.1	4%	0.041	32%	0.316	C	S	.	.	H	α-helix	trans	-65.5	-33.1	175.2	0	0	0	0	0	112.7	L531 G532 G533 S539 Y567 D570 V574	L531-A535 WeakPolarHBondContact O-CB 3.33Å; L531-A535 PolarHBondContact O-N 3.36Å; G532-A535 WeakPolarHBondContact O-CB 3.43Å; G532-A535 PolarHBondContact O-N 3.13Å; G532-A535 VanDerWaalsContact O-N 3.16Å; G533-A535 VanDerWaalsContact C-N 3.32Å; G533-A535 PolarHBondContact O-N 2.7Å; A535-S539 VanDerWaalsContact O-CB 3.26Å; A535-S539 WeakPolarHBondContact O-CB 3.13Å; A535-S539 PolarHBondContact O-N 3.24Å; A535-S539 PolarHBondContact O-OG 3.49Å; A535-Y567 HydrophobicContact CB-CE2 4.31Å; A535-D570 HydrophobicContact CB-CB 3.92Å; A535-V574 HydrophobicContact CB-CG2 3.9Å
536	V	95.8	Very high	93.1	Very high	48 Å²	48	49.2 Å²	49.2	29%	0.291	30%	0.3	S	S	.	.	H	α-helix	trans	-64.3	-48.2	171.6	175.8	0	0	0	0	110.4	G532 G533 L534 A538 S539 L540 F563 Y567	G532-V536 PolarHBondContact O-N 3.42Å; G533-V536 WeakPolarHBondContact O-CB 3.36Å; G533-V536 PolarHBondContact O-N 2.88Å; L534-V536 VanDerWaalsContact C-N 3.33Å; L534-V536 PolarHBondContact O-N 2.88Å; V536-A538 PolarHBondContact O-N 3.01Å; V536-S539 WeakPolarHBondContact CA-OG 3.48Å; V536-S539 PolarHBondContact O-N 3.43Å; V536-S539 PolarHBondContact O-OG 3.27Å; V536-L540 HydrophobicContact CG1-CD1 4.14Å; V536-L540 HydrophobicContact CG1-CG 4.46Å; V536-L540 WeakPolarHBondContact O-CB 3.45Å; V536-L540 WeakPolarHBondContact O-CG 2.86Å; V536-L540 PolarHBondContact O-N 3.44Å; V536-F563 HydrophobicContact CG1-CZ 4.41Å; V536-Y567 HydrophobicContact CB-CE2 4.37Å; V536-Y567 HydrophobicContact CG2-CD2 4.05Å; V536-Y567 HydrophobicContact CG2-CE2 3.39Å
537	L	93.6	Very high	92.9	Very high	107 Å²	107	45.4 Å²	45.4	56%	0.56	28%	0.28	S	S	*	.	H	α-helix	trans	-62.3	-43.9	178.9	-65.5	175.6	0	0	0	111.8	G533 L534 S539 L540 L541	G533-L537 PolarHBondContact O-N 3.25Å; L534-L537 PolarHBondContact O-N 3.47Å; L537-S539 PolarHBondContact O-N 2.92Å; L537-L540 PolarHBondContact O-N 3.44Å; L537-L541 WeakPolarHBondContact O-CG 3.44Å; L537-L541 PolarHBondContact O-N 3.45Å
538	A	92.3	Very high	92.6	Very high	37 Å²	37	47.9 Å²	47.9	31%	0.306	28%	0.281	S	S	.	.	H	α-helix	trans	-62.4	-42.3	176.9	0	0	0	0	0	112.2	L534 V536 L541 K542	L534-A538 WeakPolarHBondContact O-CB 3.28Å; L534-A538 PolarHBondContact O-N 2.94Å; V536-A538 PolarHBondContact O-N 3.01Å; A538-L541 PolarHBondContact O-N 3.49Å; A538-K542 WeakPolarHBondContact O-CG 3.43Å; A538-K542 PolarHBondContact O-N 2.91Å
539	S	94.9	Very high	92.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-71.8	-32.6	179.3	59.7	0	0	0	0	112.6	A535 V536 L537 K542 T543 F563	A535-S539 VanDerWaalsContact O-CB 3.26Å; A535-S539 WeakPolarHBondContact O-CB 3.13Å; A535-S539 PolarHBondContact O-N 3.24Å; A535-S539 PolarHBondContact O-OG 3.49Å; V536-S539 WeakPolarHBondContact CA-OG 3.48Å; V536-S539 PolarHBondContact O-N 3.43Å; V536-S539 PolarHBondContact O-OG 3.27Å; L537-S539 PolarHBondContact O-N 2.92Å; S539-K542 PolarHBondContact O-N 3.21Å; S539-T543 WeakPolarHBondContact O-CB 3.4Å; S539-T543 PolarHBondContact O-N 2.77Å; S539-T543 PolarHBondContact O-OG1 3.33Å; S539-F563 VanDerWaalsContact OG-CE2 3.3Å; S539-F563 WeakPolarHBondContact OG-CE2 3.28Å
540	L	93.2	Very high	92.1	Very high	87 Å²	87	46.9 Å²	46.9	46%	0.455	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-46.2	169.1	-75.6	172.7	0	0	0	111.6	V536 L537 K542 T543 A544 F563	V536-L540 HydrophobicContact CG1-CD1 4.14Å; V536-L540 HydrophobicContact CG1-CG 4.46Å; V536-L540 WeakPolarHBondContact O-CB 3.45Å; V536-L540 WeakPolarHBondContact O-CG 2.86Å; V536-L540 PolarHBondContact O-N 3.44Å; L537-L540 PolarHBondContact O-N 3.44Å; L540-K542 PolarHBondContact O-N 3.11Å; L540-T543 PolarHBondContact O-N 3.32Å; L540-A544 WeakPolarHBondContact O-CB 3.4Å; L540-A544 PolarHBondContact O-N 3.15Å; L540-F563 HydrophobicContact CD2-CD2 3.91Å; L540-F563 HydrophobicContact CD2-CE2 3.6Å; L540-F563 HydrophobicContact CD2-CZ 4.28Å; L540-F563 HydrophobicContact CG-CD2 4.38Å; L540-F563 HydrophobicContact CG-CE2 3.73Å; L540-F563 HydrophobicContact CG-CZ 4.47Å
541	L	91.3	Very high	91.4	Very high	69 Å²	69	44.1 Å²	44.1	36%	0.361	25%	0.249	S	C	.	.	H	α-helix	trans	-61.7	-44.1	177.3	-71.4	169.2	0	0	0	111.9	L537 A538 T543 A544 G545 L906 M908	L537-L541 WeakPolarHBondContact O-CG 3.44Å; L537-L541 PolarHBondContact O-N 3.45Å; A538-L541 PolarHBondContact O-N 3.49Å; L541-T543 VanDerWaalsContact C-N 3.31Å; L541-T543 PolarHBondContact O-N 3.36Å; L541-A544 PolarHBondContact O-N 2.86Å; L541-G545 PolarHBondContact O-N 3.34Å; L541-L906 HydrophobicContact CD1-CD2 4.28Å; L541-M908 HydrophobicContact CD2-CE 4.37Å
542	K	91.5	Very high	90.5	Very high	91 Å²	91	43.2 Å²	43.2	40%	0.396	25%	0.248	S	C	.	.	H	α-helix	trans	-62.5	-38.2	174.7	-72.3	172.2	-174.6	165.8	0	112.4	A538 S539 L540 W546 Y566 D570	A538-K542 WeakPolarHBondContact O-CG 3.43Å; A538-K542 PolarHBondContact O-N 2.91Å; S539-K542 PolarHBondContact O-N 3.21Å; L540-K542 PolarHBondContact O-N 3.11Å; K542-W546 WeakPolarHBondContact O-CB 3.4Å; K542-W546 PolarHBondContact O-N 3.47Å; K542-Y566 HydrophobicContact CB-CD2 3.95Å; K542-Y566 HydrophobicContact CB-CE2 4.26Å; K542-Y566 HydrophobicContact CB-CG 4.32Å; K542-D570 IonicContact NZ-OD1 3.3Å; K542-D570 PolarHBondContact NZ-OD1 2.97Å; K542-D570 IonicContact NZ-OD2 3.62Å; K542-D570 PolarHBondContact NZ-OD2 3.47Å
543	T	92.5	Very high	89.5	Confident	11 Å²	11	48.9 Å²	48.9	7%	0.067	28%	0.283	C	S	.	.	H	α-helix	trans	-68.3	-42.7	177.1	-54.4	0	0	0	0	110.9	S539 L540 L541 W546 K547 T559 F563	S539-T543 WeakPolarHBondContact O-CB 3.4Å; S539-T543 PolarHBondContact O-N 2.77Å; S539-T543 PolarHBondContact O-OG1 3.33Å; L540-T543 PolarHBondContact O-N 3.32Å; L541-T543 VanDerWaalsContact C-N 3.31Å; L541-T543 PolarHBondContact O-N 3.36Å; T543-W546 PolarHBondContact O-N 2.8Å; T543-K547 WeakPolarHBondContact O-CB 3.33Å; T543-K547 PolarHBondContact O-N 2.98Å; T543-T559 HydrophobicContact CG2-CG2 3.85Å; T543-F563 HydrophobicContact CG2-CB 4Å; T543-F563 WeakPolarHBondContact OG1-CA 3.36Å
544	A	89.1	Confident	88.8	Confident	43 Å²	43	54 Å²	54	36%	0.355	30%	0.298	S	S	.	.	H	α-helix	trans	-60.7	-47.1	175.4	0	0	0	0	0	111.3	L540 L541 K547 R548 M908	L540-A544 WeakPolarHBondContact O-CB 3.4Å; L540-A544 PolarHBondContact O-N 3.15Å; L541-A544 PolarHBondContact O-N 2.86Å; A544-K547 PolarHBondContact O-N 2.78Å; A544-R548 WeakPolarHBondContact O-CG 3.27Å; A544-R548 PolarHBondContact O-N 3.42Å; A544-M908 HydrophobicContact CB-SD 4.04Å
545	G	89.1	Confident	88.3	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-59.6	-46.5	174.1	0	0	0	0	0	112.5	L541 K547 R548 R549	L541-G545 PolarHBondContact O-N 3.34Å; G545-K547 VanDerWaalsContact C-N 3.35Å; G545-K547 PolarHBondContact O-N 2.95Å; G545-R548 PolarHBondContact O-N 3.17Å; G545-R549 VanDerWaalsContact O-CG 3.26Å; G545-R549 WeakPolarHBondContact O-CG 3.49Å; G545-R549 PolarHBondContact O-N 3.05Å
546	W	90.7	Very high	88	Confident	8 Å²	8	58.6 Å²	58.6	3%	0.03	32%	0.322	C	S	.	.	H	α-helix	trans	-61.4	-40.6	175.5	172.3	77.9	0	0	0	113	K542 T543 R549 I550 Q558 T559 K562 Y566 H782	K542-W546 WeakPolarHBondContact O-CB 3.4Å; K542-W546 PolarHBondContact O-N 3.47Å; T543-W546 PolarHBondContact O-N 2.8Å; W546-R549 WeakPolarHBondContact O-CB 3.3Å; W546-R549 PolarHBondContact O-N 3.21Å; W546-I550 HydrophobicContact CD2-CD1 3.91Å; W546-I550 HydrophobicContact CE3-CD1 4.3Å; W546-I550 HydrophobicContact CH2-CD1 3.53Å; W546-I550 HydrophobicContact CZ2-CD1 3.05Å; W546-I550 HydrophobicContact CZ2-CG1 4.38Å; W546-I550 HydrophobicContact CZ3-CD1 4.11Å; W546-I550 PolarHBondContact O-N 3Å; W546-I550 VanDerWaalsContact O-N 3.14Å; W546-Q558 HydrophobicContact CH2-CG 4.18Å; W546-T559 HydrophobicContact CZ3-CG2 4.29Å; W546-K562 HydrophobicContact CD2-CB 4.44Å; W546-K562 HydrophobicContact CD2-CD 4.14Å; W546-K562 HydrophobicContact CD2-CG 3.65Å; W546-K562 HydrophobicContact CE3-CB 4.1Å; W546-K562 HydrophobicContact CE3-CG 3.77Å; W546-K562 HydrophobicContact CG-CG 4.24Å; W546-K562 HydrophobicContact CH2-CB 3.85Å; W546-K562 HydrophobicContact CH2-CD 4.35Å; W546-K562 HydrophobicContact CH2-CG 4Å; W546-K562 HydrophobicContact CZ2-CB 4.18Å; W546-K562 HydrophobicContact CZ2-CD 3.79Å; W546-K562 HydrophobicContact CZ2-CG 3.87Å; W546-K562 HydrophobicContact CZ3-CB 3.83Å; W546-K562 HydrophobicContact CZ3-CG 3.96Å; W546-Y566 HydrophobicContact CB-CE2 3.86Å; W546-Y566 HydrophobicContact CG-CE2 4.21Å; W546-H782 AromaticContact CD1-CE1 3.84Å; W546-H782 AromaticContact CD1-NE2 3.97Å
547	K	88.8	Confident	87.7	Confident	26 Å²	26	62.7 Å²	62.7	11%	0.113	34%	0.341	C	S	.	.	H	α-helix	trans	-65.2	-41.4	-179.8	-170.2	56.7	166	-177.4	0	111.3	T543 A544 G545 R549 I550 G551 S552 M554 D556 T559	T543-K547 WeakPolarHBondContact O-CB 3.33Å; T543-K547 PolarHBondContact O-N 2.98Å; A544-K547 PolarHBondContact O-N 2.78Å; G545-K547 VanDerWaalsContact C-N 3.35Å; G545-K547 PolarHBondContact O-N 2.95Å; K547-R549 VanDerWaalsContact C-N 3.34Å; K547-R549 PolarHBondContact O-N 3.24Å; K547-I550 PolarHBondContact O-N 2.96Å; K547-G551 PolarHBondContact O-N 3.22Å; K547-S552 WeakPolarHBondContact CE-O 3.48Å; K547-M554 WeakPolarHBondContact CE-O 3.48Å; K547-M554 PolarHBondContact NZ-O 2.98Å; K547-D556 IonicContact NZ-OD1 3.67Å; K547-D556 PolarHBondContact NZ-OD1 3.32Å; K547-D556 IonicContact NZ-OD2 2.56Å; K547-T559 HydrophobicContact CD-CG2 4.39Å; K547-T559 WeakPolarHBondContact CE-OG1 3.42Å; K547-T559 PolarHBondContact NZ-OG1 3.16Å
548	R	85.9	Confident	87.5	Confident	88 Å²	88	63.3 Å²	63.3	33%	0.332	34%	0.341	S	S	.	.	H	α-helix	trans	-58.3	-44.7	171.5	-74.5	-177.8	167.9	177.8	3	112	A544 G545 I550 G551 E909 E912	A544-R548 WeakPolarHBondContact O-CG 3.27Å; A544-R548 PolarHBondContact O-N 3.42Å; G545-R548 PolarHBondContact O-N 3.17Å; R548-I550 PolarHBondContact O-N 3.31Å; R548-G551 PolarHBondContact O-N 3.27Å; R548-E909 PolarHBondContact NH1-O 3.4Å; R548-E912 HydrophobicContact CG-CG 4.48Å; R548-E912 IonicContact NE-OE1 3.9Å; R548-E912 PolarHBondContact NE-OE1 3.49Å
549	R	87.9	Confident	87.5	Confident	46 Å²	46	62 Å²	62	17%	0.174	33%	0.329	C	S	.	.	H	α-helix	trans	-66.3	-16.1	178.1	-69.9	175.4	-169.9	160	-2.4	114.8	G545 W546 K547 H782 C784 F785 G907 E909	G545-R549 VanDerWaalsContact O-CG 3.26Å; G545-R549 WeakPolarHBondContact O-CG 3.49Å; G545-R549 PolarHBondContact O-N 3.05Å; W546-R549 WeakPolarHBondContact O-CB 3.3Å; W546-R549 PolarHBondContact O-N 3.21Å; K547-R549 VanDerWaalsContact C-N 3.34Å; K547-R549 PolarHBondContact O-N 3.24Å; R549-H782 HydrophobicContact CB-CB 4.21Å; R549-C784 CarbonylContact O-C 3.53Å; R549-C784 WeakPolarHBondContact O-CA 3.25Å; R549-C784 PolarHBondContact O-N 2.92Å; R549-F785 HydrophobicContact CB-CB 3.59Å; R549-F785 HydrophobicContact CB-CG 4.12Å; R549-F785 HydrophobicContact CG-CB 3.61Å; R549-F785 HydrophobicContact CG-CD1 4.12Å; R549-F785 HydrophobicContact CG-CD2 3.87Å; R549-F785 HydrophobicContact CG-CG 3.59Å; R549-G907 PolarHBondContact NH2-O 3.17Å; R549-E909 IonicContact CZ-OE1 2.84Å; R549-E909 IonicContact CZ-OE2 2.83Å; R549-E909 IonicContact NE-OE1 3.3Å; R549-E909 IonicContact NE-OE2 2.69Å; R549-E909 PolarHBondContact NE-OE2 3.2Å; R549-E909 IonicContact NH2-OE1 3.88Å; R549-E909 PolarHBondContact NH2-OE1 3.47Å; R549-E909 IonicContact NH2-OE2 3.64Å; R549-E909 PolarHBondContact NH2-OE2 3.49Å
550	I	87.3	Confident	87.3	Confident	28 Å²	28	65.3 Å²	65.3	14%	0.144	35%	0.349	C	S	.	.	H	α-helix	trans	-87.4	-21.1	171.4	-73.7	-177.2	0	0	0	112.4	W546 K547 R548 S552	W546-I550 HydrophobicContact CD2-CD1 3.91Å; W546-I550 HydrophobicContact CE3-CD1 4.3Å; W546-I550 HydrophobicContact CH2-CD1 3.53Å; W546-I550 HydrophobicContact CZ2-CD1 3.05Å; W546-I550 HydrophobicContact CZ2-CG1 4.38Å; W546-I550 HydrophobicContact CZ3-CD1 4.11Å; W546-I550 PolarHBondContact O-N 3Å; W546-I550 VanDerWaalsContact O-N 3.14Å; K547-I550 PolarHBondContact O-N 2.96Å; R548-I550 PolarHBondContact O-N 3.31Å; I550-S552 VanDerWaalsContact C-N 3.32Å
551	G	79.4	Confident	87.3	Confident	29 Å²	29	66.5 Å²	66.5	30%	0.299	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.6	25.1	-178.1	0	0	0	0	0	114	K547 R548 N837	K547-G551 PolarHBondContact O-N 3.22Å; R548-G551 PolarHBondContact O-N 3.27Å; G551-N837 PolarHBondContact O-ND2 2.71Å; G551-N837 VanDerWaalsContact O-ND2 3.1Å
552	S	78	Confident	87.3	Confident	41 Å²	41	64.1 Å²	64.1	29%	0.287	34%	0.341	S	S	.	.			trans	-112	125.9	177.4	174.9	0	0	0	0	110.7	K547 I550	K547-S552 WeakPolarHBondContact CE-O 3.48Å; I550-S552 VanDerWaalsContact C-N 3.32Å
553	P	72.6	Confident	87.5	Confident	126 Å²	126	62 Å²	62	82%	0.818	33%	0.331	S	S	*	.			trans	-82.6	-14	-178.8	32	-35	0	0	0	113.9
554	M	81.2	Confident	87.6	Confident	144 Å²	144	65.5 Å²	65.5	71%	0.709	35%	0.349	S	S	*	.	S	Bend	trans	-92.6	130.4	-172.5	-67.7	-152.4	150.5	0	0	112.8	K547 D556	K547-M554 WeakPolarHBondContact CE-O 3.48Å; K547-M554 PolarHBondContact NZ-O 2.98Å; M554-D556 PolarHBondContact O-N 2.85Å
555	I	84.8	Confident	87.9	Confident	144 Å²	144	64.7 Å²	64.7	74%	0.738	34%	0.34	S	S	*	.			trans	-75.8	107	171.7	-55.9	176	0	0	0	108.3	T559	I555-T559 HydrophobicContact CG2-CG2 4.27Å
556	D	88.2	Confident	88.2	Confident	57 Å²	57	66.6 Å²	66.6	31%	0.305	35%	0.347	S	S	.	.			trans	-103.9	169.8	177.7	51.4	18.2	0	0	0	111.2	K547 M554 Q558 T559 V560	K547-D556 IonicContact NZ-OD1 3.67Å; K547-D556 PolarHBondContact NZ-OD1 3.32Å; K547-D556 IonicContact NZ-OD2 2.56Å; M554-D556 PolarHBondContact O-N 2.85Å; D556-Q558 PolarHBondContact O-N 3.47Å; D556-Q558 VanDerWaalsContact O-N 3.16Å; D556-T559 WeakPolarHBondContact O-CB 3.42Å; D556-T559 PolarHBondContact O-N 2.89Å; D556-T559 VanDerWaalsContact OD1-CB 3.29Å; D556-T559 WeakPolarHBondContact OD1-CB 3.45Å; D556-T559 PolarHBondContact OD1-N 3.05Å; D556-T559 PolarHBondContact OD1-OG1 3.45Å; D556-V560 PolarHBondContact O-N 3.49Å
557	L	89.1	Confident	88.5	Confident	133 Å²	133	69.3 Å²	69.3	70%	0.696	36%	0.358	S	S	*	.	H	α-helix	trans	-55.3	-32.4	174	-179.7	61.6	0	0	0	111.8	T559 V560 M561	L557-T559 VanDerWaalsContact C-N 3.33Å; L557-T559 PolarHBondContact O-N 3.23Å; L557-V560 PolarHBondContact O-N 2.92Å; L557-M561 WeakPolarHBondContact O-CG 3.47Å; L557-M561 PolarHBondContact O-N 2.79Å
558	Q	89.9	Confident	88.8	Confident	120 Å²	120	68.4 Å²	68.4	56%	0.561	36%	0.355	S	S	*	.	H	α-helix	trans	-62.7	-39.4	175.8	-170.1	-177.2	-3.6	0	0	111.9	W546 D556 M561 K562	W546-Q558 HydrophobicContact CH2-CG 4.18Å; D556-Q558 PolarHBondContact O-N 3.47Å; D556-Q558 VanDerWaalsContact O-N 3.16Å; Q558-M561 PolarHBondContact O-N 3.34Å; Q558-K562 WeakPolarHBondContact O-CB 3.48Å; Q558-K562 PolarHBondContact O-N 2.91Å
559	T	91.5	Very high	89.3	Confident	11 Å²	11	64.2 Å²	64.2	7%	0.067	34%	0.339	C	S	.	.	H	α-helix	trans	-64.9	-42.4	176	-56	0	0	0	0	111.1	T543 W546 K547 I555 D556 L557 K562 F563	T543-T559 HydrophobicContact CG2-CG2 3.85Å; W546-T559 HydrophobicContact CZ3-CG2 4.29Å; K547-T559 HydrophobicContact CD-CG2 4.39Å; K547-T559 WeakPolarHBondContact CE-OG1 3.42Å; K547-T559 PolarHBondContact NZ-OG1 3.16Å; I555-T559 HydrophobicContact CG2-CG2 4.27Å; D556-T559 WeakPolarHBondContact O-CB 3.42Å; D556-T559 PolarHBondContact O-N 2.89Å; D556-T559 VanDerWaalsContact OD1-CB 3.29Å; D556-T559 WeakPolarHBondContact OD1-CB 3.45Å; D556-T559 PolarHBondContact OD1-N 3.05Å; D556-T559 PolarHBondContact OD1-OG1 3.45Å; L557-T559 VanDerWaalsContact C-N 3.33Å; L557-T559 PolarHBondContact O-N 3.23Å; T559-K562 PolarHBondContact O-N 3.39Å; T559-F563 PolarHBondContact O-N 2.68Å
560	V	92.4	Very high	89.7	Confident	69 Å²	69	62.6 Å²	62.6	42%	0.418	33%	0.334	S	S	.	.	H	α-helix	trans	-62.9	-46.8	175.5	179.7	0	0	0	0	110.8	D556 L557 K562 F563 L564	D556-V560 PolarHBondContact O-N 3.49Å; L557-V560 PolarHBondContact O-N 2.92Å; V560-K562 VanDerWaalsContact C-N 3.3Å; V560-K562 PolarHBondContact O-N 3Å; V560-F563 WeakPolarHBondContact O-CB 3.46Å; V560-F563 PolarHBondContact O-N 2.96Å; V560-L564 WeakPolarHBondContact O-CG 3.11Å; V560-L564 PolarHBondContact O-N 3.27Å
561	M	92.2	Very high	90.1	Very high	111 Å²	111	62.7 Å²	62.7	55%	0.547	34%	0.335	S	S	.	.	H	α-helix	trans	-61.4	-39.3	176.6	-73.1	-60.6	-142.3	0	0	112.2	L557 Q558 L564 V565	L557-M561 WeakPolarHBondContact O-CG 3.47Å; L557-M561 PolarHBondContact O-N 2.79Å; Q558-M561 PolarHBondContact O-N 3.34Å; M561-L564 PolarHBondContact O-N 2.99Å; M561-L564 HydrophobicContact SD-CD1 4.24Å; M561-V565 WeakPolarHBondContact O-CG2 3.3Å; M561-V565 PolarHBondContact O-N 3.23Å; M561-V565 VanDerWaalsContact O-N 3.1Å
562	K	92.1	Very high	90.9	Very high	20 Å²	20	61.3 Å²	61.3	9%	0.087	32%	0.32	C	S	.	.	H	α-helix	trans	-64.7	-43	176.7	-166.5	79.1	175.6	-167.7	0	111.7	W546 Q558 T559 V560 L564 V565 Y566 H626	W546-K562 HydrophobicContact CD2-CB 4.44Å; W546-K562 HydrophobicContact CD2-CD 4.14Å; W546-K562 HydrophobicContact CD2-CG 3.65Å; W546-K562 HydrophobicContact CE3-CB 4.1Å; W546-K562 HydrophobicContact CE3-CG 3.77Å; W546-K562 HydrophobicContact CG-CG 4.24Å; W546-K562 HydrophobicContact CH2-CB 3.85Å; W546-K562 HydrophobicContact CH2-CD 4.35Å; W546-K562 HydrophobicContact CH2-CG 4Å; W546-K562 HydrophobicContact CZ2-CB 4.18Å; W546-K562 HydrophobicContact CZ2-CD 3.79Å; W546-K562 HydrophobicContact CZ2-CG 3.87Å; W546-K562 HydrophobicContact CZ3-CB 3.83Å; W546-K562 HydrophobicContact CZ3-CG 3.96Å; Q558-K562 WeakPolarHBondContact O-CB 3.48Å; Q558-K562 PolarHBondContact O-N 2.91Å; T559-K562 PolarHBondContact O-N 3.39Å; V560-K562 VanDerWaalsContact C-N 3.3Å; V560-K562 PolarHBondContact O-N 3Å; K562-L564 VanDerWaalsContact C-N 3.34Å; K562-L564 PolarHBondContact O-N 2.54Å; K562-V565 PolarHBondContact O-N 3.5Å; K562-Y566 HydrophobicContact CD-CE2 4.36Å; K562-Y566 WeakPolarHBondContact CE-OH 3.33Å; K562-Y566 HydrophobicContact CG-CD2 4.1Å; K562-Y566 HydrophobicContact CG-CE2 3.7Å; K562-Y566 PolarHBondContact O-N 3.03Å; K562-H626 VanDerWaalsContact CE-NE2 3.34Å; K562-H626 WeakPolarHBondContact CE-NE2 3.13Å; K562-H626 PolarHBondContact NZ-CE1 2.97Å; K562-H626 VanDerWaalsContact NZ-CE1 3.32Å; K562-H626 PolarHBondContact NZ-NE2 3.16Å
563	F	94.8	Very high	91.8	Very high	45 Å²	45	61.3 Å²	61.3	20%	0.197	32%	0.317	C	S	.	.	H	α-helix	trans	-56.7	-48	173.1	167.8	-102.4	0	0	0	111.2	V536 S539 L540 T543 T559 V560 V565 Y566 Y567	V536-F563 HydrophobicContact CG1-CZ 4.41Å; S539-F563 VanDerWaalsContact OG-CE2 3.3Å; S539-F563 WeakPolarHBondContact OG-CE2 3.28Å; L540-F563 HydrophobicContact CD2-CD2 3.91Å; L540-F563 HydrophobicContact CD2-CE2 3.6Å; L540-F563 HydrophobicContact CD2-CZ 4.28Å; L540-F563 HydrophobicContact CG-CD2 4.38Å; L540-F563 HydrophobicContact CG-CE2 3.73Å; L540-F563 HydrophobicContact CG-CZ 4.47Å; T543-F563 HydrophobicContact CG2-CB 4Å; T543-F563 WeakPolarHBondContact OG1-CA 3.36Å; T559-F563 PolarHBondContact O-N 2.68Å; V560-F563 WeakPolarHBondContact O-CB 3.46Å; V560-F563 PolarHBondContact O-N 2.96Å; F563-V565 VanDerWaalsContact C-N 3.3Å; F563-V565 PolarHBondContact O-N 3.07Å; F563-Y566 PolarHBondContact O-N 3.09Å; F563-Y567 VanDerWaalsContact O-CB 3.27Å; F563-Y567 WeakPolarHBondContact O-CB 3.5Å; F563-Y567 PolarHBondContact O-N 3.12Å
564	L	95.2	Very high	93	Very high	85 Å²	85	55.9 Å²	55.9	45%	0.445	28%	0.282	S	S	.	.	H	α-helix	trans	-59.5	-39	179	-68.6	175.5	0	0	0	112.5	V560 M561 K562 A568	V560-L564 WeakPolarHBondContact O-CG 3.11Å; V560-L564 PolarHBondContact O-N 3.27Å; M561-L564 PolarHBondContact O-N 2.99Å; M561-L564 HydrophobicContact SD-CD1 4.24Å; K562-L564 VanDerWaalsContact C-N 3.34Å; K562-L564 PolarHBondContact O-N 2.54Å; L564-A568 VanDerWaalsContact O-CB 3.3Å; L564-A568 WeakPolarHBondContact O-CB 3.45Å; L564-A568 PolarHBondContact O-N 2.75Å
565	V	95.3	Very high	93.7	Very high	26 Å²	26	50.2 Å²	50.2	16%	0.158	25%	0.253	C	S	.	.	H	α-helix	trans	-70.5	-40.9	177.3	175	0	0	0	0	112.1	M561 K562 F563 A568 G569 H626	M561-V565 WeakPolarHBondContact O-CG2 3.3Å; M561-V565 PolarHBondContact O-N 3.23Å; M561-V565 VanDerWaalsContact O-N 3.1Å; K562-V565 PolarHBondContact O-N 3.5Å; F563-V565 VanDerWaalsContact C-N 3.3Å; F563-V565 PolarHBondContact O-N 3.07Å; V565-A568 PolarHBondContact O-N 3.21Å; V565-G569 PolarHBondContact O-N 2.66Å; V565-G569 VanDerWaalsContact O-N 3.11Å; V565-H626 HydrophobicContact CG1-CB 3.64Å; V565-H626 VanDerWaalsContact CG1-CG 3.49Å
566	Y	95.1	Very high	94.3	Very high	42 Å²	42	44.1 Å²	44.1	17%	0.165	22%	0.222	C	C	.	.	H	α-helix	trans	-65.2	-42.2	173.9	-71.3	-30.2	0	0	0	111.9	K542 W546 K562 F563 G569 D570	K542-Y566 HydrophobicContact CB-CD2 3.95Å; K542-Y566 HydrophobicContact CB-CE2 4.26Å; K542-Y566 HydrophobicContact CB-CG 4.32Å; W546-Y566 HydrophobicContact CB-CE2 3.86Å; W546-Y566 HydrophobicContact CG-CE2 4.21Å; K562-Y566 HydrophobicContact CD-CE2 4.36Å; K562-Y566 WeakPolarHBondContact CE-OH 3.33Å; K562-Y566 HydrophobicContact CG-CD2 4.1Å; K562-Y566 HydrophobicContact CG-CE2 3.7Å; K562-Y566 PolarHBondContact O-N 3.03Å; F563-Y566 PolarHBondContact O-N 3.09Å; Y566-G569 PolarHBondContact O-N 2.99Å; Y566-D570 PolarHBondContact O-N 3.08Å
567	Y	96	Very high	94.6	Very high	65 Å²	65	46.3 Å²	46.3	26%	0.255	23%	0.232	S	C	.	.	H	α-helix	trans	-62.6	-43.7	175.8	179.2	-124.1	0	0	0	111.5	A535 V536 F563 G569 D570 L571	A535-Y567 HydrophobicContact CB-CE2 4.31Å; V536-Y567 HydrophobicContact CB-CE2 4.37Å; V536-Y567 HydrophobicContact CG2-CD2 4.05Å; V536-Y567 HydrophobicContact CG2-CE2 3.39Å; F563-Y567 VanDerWaalsContact O-CB 3.27Å; F563-Y567 WeakPolarHBondContact O-CB 3.5Å; F563-Y567 PolarHBondContact O-N 3.12Å; Y567-G569 VanDerWaalsContact C-N 3.29Å; Y567-G569 PolarHBondContact O-N 3.29Å; Y567-D570 PolarHBondContact O-N 3.49Å; Y567-L571 HydrophobicContact CE1-CD2 4.21Å; Y567-L571 HydrophobicContact CE2-CB 4.39Å; Y567-L571 WeakPolarHBondContact O-CB 3.45Å; Y567-L571 PolarHBondContact O-N 2.89Å
568	A	96.4	Very high	94.9	Very high	7 Å²	7	40.8 Å²	40.8	6%	0.058	20%	0.203	C	C	.	.	H	α-helix	trans	-55.2	-45.4	173.1	0	0	0	0	0	111.6	L564 V565 A572 L619 L622	L564-A568 VanDerWaalsContact O-CB 3.3Å; L564-A568 WeakPolarHBondContact O-CB 3.45Å; L564-A568 PolarHBondContact O-N 2.75Å; V565-A568 PolarHBondContact O-N 3.21Å; A568-A572 WeakPolarHBondContact O-CB 3.37Å; A568-A572 PolarHBondContact O-N 3.06Å; A568-L619 HydrophobicContact CB-CB 4.44Å; A568-L619 HydrophobicContact CB-CD2 3.8Å; A568-L619 WeakPolarHBondContact O-CB 3.46Å; A568-L622 HydrophobicContact CB-CD2 3.97Å
569	G	95.7	Very high	95.2	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.3	-40.1	177.4	0	0	0	0	0	114.5	V565 Y566 Y567 A572 N573	V565-G569 PolarHBondContact O-N 2.66Å; V565-G569 VanDerWaalsContact O-N 3.11Å; Y566-G569 PolarHBondContact O-N 2.99Å; Y567-G569 VanDerWaalsContact C-N 3.29Å; Y567-G569 PolarHBondContact O-N 3.29Å; G569-A572 WeakPolarHBondContact O-CB 3.43Å; G569-N573 PolarHBondContact O-N 2.66Å; G569-N573 PolarHBondContact O-ND2 3.46Å
570	D	95.9	Very high	95.4	Very high	11 Å²	11	35.4 Å²	35.4	6%	0.059	18%	0.178	C	C	.	.	H	α-helix	trans	-73.1	-40.1	178.2	-71.7	-19.8	0	0	0	111.6	A535 K542 Y566 Y567 A572 N573 V574	A535-D570 HydrophobicContact CB-CB 3.92Å; K542-D570 IonicContact NZ-OD1 3.3Å; K542-D570 PolarHBondContact NZ-OD1 2.97Å; K542-D570 IonicContact NZ-OD2 3.62Å; K542-D570 PolarHBondContact NZ-OD2 3.47Å; Y566-D570 PolarHBondContact O-N 3.08Å; Y567-D570 PolarHBondContact O-N 3.49Å; D570-A572 VanDerWaalsContact C-N 3.32Å; D570-A572 PolarHBondContact O-N 3.37Å; D570-N573 WeakPolarHBondContact O-CB 3.36Å; D570-N573 PolarHBondContact O-N 2.96Å; D570-N573 VanDerWaalsContact O-N 3.15Å; D570-V574 WeakPolarHBondContact O-CG2 3.48Å; D570-V574 PolarHBondContact O-N 2.89Å
571	L	96.3	Very high	95.5	Very high	30 Å²	30	34 Å²	34	16%	0.157	18%	0.177	C	C	.	.	H	α-helix	trans	-64	-36.5	173.5	-172.1	64.1	0	0	0	111.8	Y567 N573 V574 F575 L619	Y567-L571 HydrophobicContact CE1-CD2 4.21Å; Y567-L571 HydrophobicContact CE2-CB 4.39Å; Y567-L571 WeakPolarHBondContact O-CB 3.45Å; Y567-L571 PolarHBondContact O-N 2.89Å; L571-N573 VanDerWaalsContact C-N 3.31Å; L571-N573 PolarHBondContact O-N 3Å; L571-V574 WeakPolarHBondContact O-CB 3.42Å; L571-V574 PolarHBondContact O-N 2.71Å; L571-F575 HydrophobicContact CD1-CD2 4.42Å; L571-F575 HydrophobicContact CD1-CE2 4.04Å; L571-F575 HydrophobicContact CD2-CE2 3.96Å; L571-F575 HydrophobicContact CG-CD2 3.96Å; L571-F575 HydrophobicContact CG-CE2 3.64Å; L571-F575 VanDerWaalsContact O-CD2 3.3Å; L571-F575 WeakPolarHBondContact O-CD2 3.26Å; L571-F575 PolarHBondContact O-N 2.95Å; L571-L619 HydrophobicContact CB-CD1 4.27Å; L571-L619 HydrophobicContact CD2-CD1 3.87Å; L571-L619 HydrophobicContact CG-CD1 4.04Å
572	A	97.3	Very high	95.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.3	-42.1	172.3	0	0	0	0	0	112	A568 G569 D570 V574 F575 F576 L619 K620	A568-A572 WeakPolarHBondContact O-CB 3.37Å; A568-A572 PolarHBondContact O-N 3.06Å; G569-A572 WeakPolarHBondContact O-CB 3.43Å; D570-A572 VanDerWaalsContact C-N 3.32Å; D570-A572 PolarHBondContact O-N 3.37Å; A572-V574 VanDerWaalsContact C-N 3.32Å; A572-F575 PolarHBondContact O-N 3.42Å; A572-F576 VanDerWaalsContact O-CB 3.24Å; A572-F576 WeakPolarHBondContact O-CB 3.36Å; A572-F576 PolarHBondContact O-N 2.66Å; A572-L619 HydrophobicContact CB-CB 3.71Å; A572-K620 HydrophobicContact CB-CB 3.99Å; A572-K620 HydrophobicContact CB-CD 4.17Å
573	N	96.1	Very high	95.6	Very high	41 Å²	41	29.1 Å²	29.1	22%	0.219	16%	0.156	C	C	.	.	H	α-helix	trans	-66	-36.5	176.1	-62.4	-33.6	0	0	0	111.5	G569 D570 L571 F576 I577 K620	G569-N573 PolarHBondContact O-N 2.66Å; G569-N573 PolarHBondContact O-ND2 3.46Å; D570-N573 WeakPolarHBondContact O-CB 3.36Å; D570-N573 PolarHBondContact O-N 2.96Å; D570-N573 VanDerWaalsContact O-N 3.15Å; L571-N573 VanDerWaalsContact C-N 3.31Å; L571-N573 PolarHBondContact O-N 3Å; N573-F576 PolarHBondContact O-N 2.84Å; N573-I577 VanDerWaalsContact O-CG1 3.26Å; N573-I577 WeakPolarHBondContact O-CG1 3.3Å; N573-I577 PolarHBondContact O-N 2.78Å; N573-K620 PolarHBondContact OD1-NZ 3.04Å
574	V	96.8	Very high	95.6	Very high	13 Å²	13	29.7 Å²	29.7	8%	0.079	16%	0.161	C	C	.	.	H	α-helix	trans	-62.6	-52.9	174.7	172.6	0	0	0	0	110.9	L528 L531 A535 D570 L571 A572 F576 I577 I578	L528-V574 HydrophobicContact CD1-CG1 4.14Å; L531-V574 HydrophobicContact CB-CB 4.38Å; L531-V574 HydrophobicContact CB-CG1 3.54Å; L531-V574 HydrophobicContact CB-CG2 3.96Å; L531-V574 HydrophobicContact CD1-CG1 4.39Å; A535-V574 HydrophobicContact CB-CG2 3.9Å; D570-V574 WeakPolarHBondContact O-CG2 3.48Å; D570-V574 PolarHBondContact O-N 2.89Å; L571-V574 WeakPolarHBondContact O-CB 3.42Å; L571-V574 PolarHBondContact O-N 2.71Å; A572-V574 VanDerWaalsContact C-N 3.32Å; V574-F576 VanDerWaalsContact C-N 3.26Å; V574-F576 PolarHBondContact O-N 2.97Å; V574-I577 PolarHBondContact O-N 2.81Å; V574-I578 HydrophobicContact CG1-CD1 3.7Å; V574-I578 HydrophobicContact CG1-CG1 4.5Å; V574-I578 WeakPolarHBondContact O-CG1 3.1Å; V574-I578 PolarHBondContact O-N 2.94Å
575	F	96.5	Very high	95.4	Very high	24 Å²	24	30 Å²	30	11%	0.105	16%	0.157	C	C	.	.	H	α-helix	trans	-58.4	-40.9	176.7	-77.1	-63	0	0	0	111.7	L528 L571 A572 I578 T579 Y612 C615 A616 L619	L528-F575 HydrophobicContact CD1-CD1 3.81Å; L528-F575 HydrophobicContact CD1-CE1 3.53Å; L528-F575 HydrophobicContact CD1-CZ 4.17Å; L528-F575 HydrophobicContact CD2-CE1 4.15Å; L528-F575 HydrophobicContact CG-CE1 4.49Å; L571-F575 HydrophobicContact CD1-CD2 4.42Å; L571-F575 HydrophobicContact CD1-CE2 4.04Å; L571-F575 HydrophobicContact CD2-CE2 3.96Å; L571-F575 HydrophobicContact CG-CD2 3.96Å; L571-F575 HydrophobicContact CG-CE2 3.64Å; L571-F575 VanDerWaalsContact O-CD2 3.3Å; L571-F575 WeakPolarHBondContact O-CD2 3.26Å; L571-F575 PolarHBondContact O-N 2.95Å; A572-F575 PolarHBondContact O-N 3.42Å; F575-I578 PolarHBondContact O-N 3.4Å; F575-T579 WeakPolarHBondContact O-CB 3.48Å; F575-T579 VanDerWaalsContact O-CG2 3.27Å; F575-T579 WeakPolarHBondContact O-CG2 3.49Å; F575-T579 PolarHBondContact O-N 3.44Å; F575-T579 PolarHBondContact O-OG1 3.05Å; F575-Y612 HydrophobicContact CD1-CD1 4.16Å; F575-Y612 HydrophobicContact CD1-CG 4.31Å; F575-Y612 AromaticContact CE1-CD1 3.73Å; F575-Y612 HydrophobicContact CE1-CD1 3.73Å; F575-Y612 HydrophobicContact CE1-CE1 4.28Å; F575-Y612 HydrophobicContact CE1-CG 4.32Å; F575-C615 HydrophobicContact CD2-CB 4.33Å; F575-C615 HydrophobicContact CE2-CB 4.21Å; F575-C615 HydrophobicContact CZ-CB 4.49Å; F575-A616 HydrophobicContact CB-CB 3.64Å; F575-L619 HydrophobicContact CD2-CD1 4.14Å; F575-L619 HydrophobicContact CE2-CD1 4.07Å
576	F	96.8	Very high	95.2	Very high	17 Å²	17	29.3 Å²	29.3	8%	0.075	15%	0.151	C	C	.	.	H	α-helix	trans	-60	-49.9	176	170.2	-110.8	0	0	0	112.5	A572 N573 V574 I578 T579 V580 L741 I941 L944 L945	A572-F576 VanDerWaalsContact O-CB 3.24Å; A572-F576 WeakPolarHBondContact O-CB 3.36Å; A572-F576 PolarHBondContact O-N 2.66Å; N573-F576 PolarHBondContact O-N 2.84Å; V574-F576 VanDerWaalsContact C-N 3.26Å; V574-F576 PolarHBondContact O-N 2.97Å; F576-I578 VanDerWaalsContact C-N 3.35Å; F576-I578 PolarHBondContact O-N 2.96Å; F576-T579 PolarHBondContact O-N 3.32Å; F576-T579 PolarHBondContact O-OG1 3.32Å; F576-T579 VanDerWaalsContact O-OG1 3.13Å; F576-V580 HydrophobicContact CD2-CG2 3.78Å; F576-V580 HydrophobicContact CE2-CG2 3.32Å; F576-V580 HydrophobicContact CZ-CG2 3.84Å; F576-V580 WeakPolarHBondContact O-CB 3.15Å; F576-V580 WeakPolarHBondContact O-CG2 3.38Å; F576-V580 PolarHBondContact O-N 3.38Å; F576-L741 HydrophobicContact CZ-CD1 3.99Å; F576-L741 HydrophobicContact CZ-CD2 4.11Å; F576-I941 HydrophobicContact CD1-CD1 4.16Å; F576-I941 HydrophobicContact CD1-CG1 4.35Å; F576-I941 HydrophobicContact CD1-CG2 4.12Å; F576-I941 HydrophobicContact CD2-CG2 4.22Å; F576-I941 HydrophobicContact CE1-CD1 4Å; F576-I941 HydrophobicContact CE1-CG1 3.92Å; F576-I941 HydrophobicContact CE1-CG2 4.36Å; F576-I941 HydrophobicContact CE2-CG2 4.49Å; F576-I941 HydrophobicContact CG-CG2 4.03Å; F576-I941 HydrophobicContact CZ-CG1 4.23Å; F576-L944 HydrophobicContact CD2-CD2 4Å; F576-L944 HydrophobicContact CE2-CD2 3.32Å; F576-L944 HydrophobicContact CZ-CD2 4.2Å; F576-L945 HydrophobicContact CD2-CD2 4.04Å; F576-L945 HydrophobicContact CD2-CG 4.36Å
577	I	95.9	Very high	95.1	Very high	102 Å²	102	28.5 Å²	28.5	52%	0.523	15%	0.15	S	C	.	.	H	α-helix	trans	-61.8	-44.3	179.8	-70.7	165.1	0	0	0	110.9	N573 V574 G581	N573-I577 VanDerWaalsContact O-CG1 3.26Å; N573-I577 WeakPolarHBondContact O-CG1 3.3Å; N573-I577 PolarHBondContact O-N 2.78Å; V574-I577 PolarHBondContact O-N 2.81Å; I577-G581 PolarHBondContact O-N 3.44Å
578	I	94.8	Very high	94.9	Very high	18 Å²	18	30 Å²	30	9%	0.092	16%	0.161	C	C	.	.	H	α-helix	trans	-64.9	-49	179.8	-67.2	170	0	0	0	110.4	T524 L528 L531 V574 F575 F576 V580 G581 T582	T524-I578 HydrophobicContact CG2-CG2 3.82Å; L528-I578 HydrophobicContact CB-CD1 3.94Å; L528-I578 HydrophobicContact CD1-CD1 3.65Å; L528-I578 HydrophobicContact CG-CD1 4.43Å; L531-I578 HydrophobicContact CD1-CD1 4.3Å; L531-I578 HydrophobicContact CD1-CG1 4.11Å; V574-I578 HydrophobicContact CG1-CD1 3.7Å; V574-I578 HydrophobicContact CG1-CG1 4.5Å; V574-I578 WeakPolarHBondContact O-CG1 3.1Å; V574-I578 PolarHBondContact O-N 2.94Å; F575-I578 PolarHBondContact O-N 3.4Å; F576-I578 VanDerWaalsContact C-N 3.35Å; F576-I578 PolarHBondContact O-N 2.96Å; I578-V580 PolarHBondContact O-N 2.72Å; I578-G581 PolarHBondContact O-N 3.5Å; I578-T582 WeakPolarHBondContact O-CB 3.34Å; I578-T582 PolarHBondContact O-N 3.48Å; I578-T582 PolarHBondContact O-OG1 2.71Å; I578-T582 VanDerWaalsContact O-OG1 3.07Å
579	T	95.3	Very high	94.6	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-65.4	-40.2	-178.1	50.2	0	0	0	0	112.3	F575 F576 G583 F609 V613 Y733	F575-T579 WeakPolarHBondContact O-CB 3.48Å; F575-T579 VanDerWaalsContact O-CG2 3.27Å; F575-T579 WeakPolarHBondContact O-CG2 3.49Å; F575-T579 PolarHBondContact O-N 3.44Å; F575-T579 PolarHBondContact O-OG1 3.05Å; F576-T579 PolarHBondContact O-N 3.32Å; F576-T579 PolarHBondContact O-OG1 3.32Å; F576-T579 VanDerWaalsContact O-OG1 3.13Å; T579-G583 PolarHBondContact O-N 2.88Å; T579-F609 HydrophobicContact CG2-CD2 4.49Å; T579-F609 HydrophobicContact CG2-CE2 4.14Å; T579-F609 HydrophobicContact CG2-CZ 4.49Å; T579-F609 WeakPolarHBondContact O-CE2 3.44Å; T579-F609 WeakPolarHBondContact O-CZ 3.41Å; T579-V613 HydrophobicContact CG2-CG2 3.73Å; T579-Y733 PolarHBondContact OG1-OH 3.18Å
580	V	96.2	Very high	94.3	Very high	16 Å²	16	34.5 Å²	34.5	10%	0.097	18%	0.179	C	C	.	.	H	α-helix	trans	-64	-45.5	172.3	172.8	0	0	0	0	111.2	F576 I578 G583 L584 Y733 A737 L741	F576-V580 HydrophobicContact CD2-CG2 3.78Å; F576-V580 HydrophobicContact CE2-CG2 3.32Å; F576-V580 HydrophobicContact CZ-CG2 3.84Å; F576-V580 WeakPolarHBondContact O-CB 3.15Å; F576-V580 WeakPolarHBondContact O-CG2 3.38Å; F576-V580 PolarHBondContact O-N 3.38Å; I578-V580 PolarHBondContact O-N 2.72Å; V580-G583 PolarHBondContact O-N 2.8Å; V580-L584 HydrophobicContact CG1-CD1 3.78Å; V580-L584 HydrophobicContact CG1-CG 4.24Å; V580-L584 WeakPolarHBondContact O-CB 3.4Å; V580-L584 VanDerWaalsContact O-CG 3.28Å; V580-L584 WeakPolarHBondContact O-CG 3.37Å; V580-L584 PolarHBondContact O-N 2.95Å; V580-Y733 HydrophobicContact CG2-CE1 4.01Å; V580-Y733 WeakPolarHBondContact CG2-OH 2.98Å; V580-A737 HydrophobicContact CG2-CB 4.08Å; V580-L741 HydrophobicContact CG1-CD1 4.27Å
581	G	94.4	Very high	94	Very high	39 Å²	39	34.4 Å²	34.4	40%	0.402	18%	0.178	S	C	.	.	H	α-helix	trans	-59.7	-50.2	178.2	0	0	0	0	0	112.7	I577 I578 G583 L584 Y585	I577-G581 PolarHBondContact O-N 3.44Å; I578-G581 PolarHBondContact O-N 3.5Å; G581-G583 PolarHBondContact O-N 3.49Å; G581-L584 PolarHBondContact O-N 3.02Å; G581-Y585 WeakPolarHBondContact O-CB 3.42Å; G581-Y585 PolarHBondContact O-N 2.84Å
582	T	92.3	Very high	93.4	Very high	30 Å²	30	35.9 Å²	35.9	18%	0.184	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-40.3	177.1	-58.3	0	0	0	0	111.7	I578 Y585 W586 F609	I578-T582 WeakPolarHBondContact O-CB 3.34Å; I578-T582 PolarHBondContact O-N 3.48Å; I578-T582 PolarHBondContact O-OG1 2.71Å; I578-T582 VanDerWaalsContact O-OG1 3.07Å; T582-Y585 WeakPolarHBondContact O-CB 3.42Å; T582-Y585 PolarHBondContact O-N 2.92Å; T582-W586 PolarHBondContact O-N 3.47Å; T582-W586 VanDerWaalsContact O-N 3.11Å; T582-F609 HydrophobicContact CG2-CD2 4.29Å; T582-F609 HydrophobicContact CG2-CE2 4.21Å
583	G	94.1	Very high	92.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.6	-48.2	175	0	0	0	0	0	112.4	T579 V580 G581 Y585 W586 L587 A734	T579-G583 PolarHBondContact O-N 2.88Å; V580-G583 PolarHBondContact O-N 2.8Å; G581-G583 PolarHBondContact O-N 3.49Å; G583-Y585 VanDerWaalsContact C-N 3.35Å; G583-Y585 PolarHBondContact O-N 3.46Å; G583-W586 PolarHBondContact O-N 2.97Å; G583-L587 WeakPolarHBondContact O-CB 3.49Å; G583-L587 PolarHBondContact O-N 3.2Å; G583-A734 WeakPolarHBondContact O-CB 3.39Å
584	L	94.2	Very high	92	Very high	56 Å²	56	41.8 Å²	41.8	29%	0.293	22%	0.219	S	C	.	.	H	α-helix	trans	-64.2	-38.7	177.5	-73.4	175.8	0	0	0	112.2	V580 G581 L587 I588 A738	V580-L584 HydrophobicContact CG1-CD1 3.78Å; V580-L584 HydrophobicContact CG1-CG 4.24Å; V580-L584 WeakPolarHBondContact O-CB 3.4Å; V580-L584 VanDerWaalsContact O-CG 3.28Å; V580-L584 WeakPolarHBondContact O-CG 3.37Å; V580-L584 PolarHBondContact O-N 2.95Å; G581-L584 PolarHBondContact O-N 3.02Å; L584-L587 PolarHBondContact O-N 3.37Å; L584-I588 WeakPolarHBondContact O-CB 3.24Å; L584-I588 VanDerWaalsContact O-CG1 3.26Å; L584-I588 WeakPolarHBondContact O-CG1 3.46Å; L584-I588 PolarHBondContact O-N 3.43Å; L584-A738 HydrophobicContact CD2-CB 3.86Å
585	Y	92.4	Very high	91.4	Very high	92 Å²	92	43.7 Å²	43.7	36%	0.361	23%	0.232	S	C	.	.	H	α-helix	trans	-54.6	-55.1	173.1	171.3	-91.5	0	0	0	110.3	G581 T582 G583 L587 I588 F589 V598	G581-Y585 WeakPolarHBondContact O-CB 3.42Å; G581-Y585 PolarHBondContact O-N 2.84Å; T582-Y585 WeakPolarHBondContact O-CB 3.42Å; T582-Y585 PolarHBondContact O-N 2.92Å; G583-Y585 VanDerWaalsContact C-N 3.35Å; G583-Y585 PolarHBondContact O-N 3.46Å; Y585-L587 PolarHBondContact O-N 2.59Å; Y585-I588 PolarHBondContact O-N 3.3Å; Y585-F589 AromaticContact CD2-CD2 3.23Å; Y585-F589 HydrophobicContact CD2-CD2 3.23Å; Y585-F589 AromaticContact CD2-CE2 3.38Å; Y585-F589 HydrophobicContact CD2-CE2 3.38Å; Y585-F589 HydrophobicContact CD2-CG 4.29Å; Y585-F589 AromaticContact CE2-CD2 3.33Å; Y585-F589 HydrophobicContact CE2-CD2 3.33Å; Y585-F589 AromaticContact CE2-CE2 3.54Å; Y585-F589 HydrophobicContact CE2-CE2 3.54Å; Y585-F589 HydrophobicContact CE2-CG 4.02Å; Y585-F589 HydrophobicContact CE2-CZ 4.35Å; Y585-F589 AromaticContact CG-CD2 3.87Å; Y585-F589 HydrophobicContact CG-CD2 3.87Å; Y585-F589 HydrophobicContact CG-CE2 4.35Å; Y585-F589 WeakPolarHBondContact O-CB 3.43Å; Y585-F589 VanDerWaalsContact O-CD2 3.26Å; Y585-F589 WeakPolarHBondContact O-CD2 3.41Å; Y585-F589 PolarHBondContact O-N 3.5Å; Y585-V598 HydrophobicContact CE1-CG1 4.45Å
586	W	91.7	Very high	90.7	Very high	12 Å²	12	42.5 Å²	42.5	5%	0.045	23%	0.227	C	C	.	.	H	α-helix	trans	-62.8	-41.9	180	-76.4	117.4	0	0	0	112.7	M515 H517 T582 G583 I588 F590 V598 L599 L600 P601 I730 L731	M515-W586 HydrophobicContact SD-CH2 4.07Å; H517-W586 AromaticContact CE1-CH2 3.4Å; H517-W586 WeakPolarHBondContact CE1-CH2 3.43Å; H517-W586 AromaticContact CE1-CZ2 3.69Å; H517-W586 AromaticContact ND1-CH2 3.62Å; H517-W586 AromaticContact ND1-CZ2 3.62Å; T582-W586 PolarHBondContact O-N 3.47Å; T582-W586 VanDerWaalsContact O-N 3.11Å; G583-W586 PolarHBondContact O-N 2.97Å; W586-I588 PolarHBondContact O-N 3.36Å; W586-F590 WeakPolarHBondContact O-CB 3.32Å; W586-F590 PolarHBondContact O-N 3Å; W586-V598 HydrophobicContact CE3-CG1 4.14Å; W586-V598 HydrophobicContact CH2-CB 4.44Å; W586-V598 HydrophobicContact CH2-CG1 3.16Å; W586-V598 HydrophobicContact CZ2-CG1 4.36Å; W586-V598 HydrophobicContact CZ3-CB 3.92Å; W586-V598 HydrophobicContact CZ3-CG1 3.03Å; W586-L599 WeakPolarHBondContact CH2-O 3.38Å; W586-L599 WeakPolarHBondContact CZ3-O 3.34Å; W586-L600 HydrophobicContact CB-CD2 4.46Å; W586-L600 HydrophobicContact CE3-CD2 4.3Å; W586-P601 HydrophobicContact CD2-CG 4.41Å; W586-P601 HydrophobicContact CZ2-CG 3.9Å; W586-I730 HydrophobicContact CB-CG2 3.93Å; W586-I730 HydrophobicContact CG-CG2 4.13Å; W586-L731 HydrophobicContact CB-CD2 4.08Å
587	L	92.9	Very high	90.2	Very high	25 Å²	25	44 Å²	44	13%	0.131	24%	0.24	C	C	.	.	H	α-helix	trans	-59.9	-47.9	177.7	-176.7	64.8	0	0	0	112.2	G583 L584 Y585 K591 L707 L731 A734 V735	G583-L587 WeakPolarHBondContact O-CB 3.49Å; G583-L587 PolarHBondContact O-N 3.2Å; L584-L587 PolarHBondContact O-N 3.37Å; Y585-L587 PolarHBondContact O-N 2.59Å; L587-K591 HydrophobicContact CD1-CG 4.38Å; L587-K591 VanDerWaalsContact O-CB 3.25Å; L587-K591 WeakPolarHBondContact O-CB 3.24Å; L587-K591 PolarHBondContact O-N 3.17Å; L587-L707 HydrophobicContact CD1-CB 4.35Å; L587-L731 HydrophobicContact CB-CD2 4.1Å; L587-L731 HydrophobicContact CD1-CD2 4.19Å; L587-A734 HydrophobicContact CB-CB 3.95Å; L587-A734 HydrophobicContact CD2-CB 4.07Å; L587-V735 HydrophobicContact CD1-CG2 3.61Å; L587-V735 HydrophobicContact CD2-CG2 3.79Å; L587-V735 HydrophobicContact CG-CG2 4.37Å
588	I	90.9	Very high	89.8	Confident	95 Å²	95	39.7 Å²	39.7	49%	0.487	22%	0.218	S	C	.	.	H	α-helix	trans	-73.2	-54.1	-176.9	-65.3	167.1	0	0	0	110	L584 Y585 W586 A592	L584-I588 WeakPolarHBondContact O-CB 3.24Å; L584-I588 VanDerWaalsContact O-CG1 3.26Å; L584-I588 WeakPolarHBondContact O-CG1 3.46Å; L584-I588 PolarHBondContact O-N 3.43Å; Y585-I588 PolarHBondContact O-N 3.3Å; W586-I588 PolarHBondContact O-N 3.36Å; I588-A592 WeakPolarHBondContact O-CA 3.47Å; I588-A592 WeakPolarHBondContact O-CB 3.31Å; I588-A592 PolarHBondContact O-N 2.95Å
589	F	89.3	Confident	89.5	Confident	98 Å²	98	38.9 Å²	38.9	43%	0.43	21%	0.214	S	C	.	.	H	α-helix	trans	-67.6	-46.2	-173.3	-73.8	-78.2	0	0	0	110.9	Y585 Q593	Y585-F589 AromaticContact CD2-CD2 3.23Å; Y585-F589 HydrophobicContact CD2-CD2 3.23Å; Y585-F589 AromaticContact CD2-CE2 3.38Å; Y585-F589 HydrophobicContact CD2-CE2 3.38Å; Y585-F589 HydrophobicContact CD2-CG 4.29Å; Y585-F589 AromaticContact CE2-CD2 3.33Å; Y585-F589 HydrophobicContact CE2-CD2 3.33Å; Y585-F589 AromaticContact CE2-CE2 3.54Å; Y585-F589 HydrophobicContact CE2-CE2 3.54Å; Y585-F589 HydrophobicContact CE2-CG 4.02Å; Y585-F589 HydrophobicContact CE2-CZ 4.35Å; Y585-F589 AromaticContact CG-CD2 3.87Å; Y585-F589 HydrophobicContact CG-CD2 3.87Å; Y585-F589 HydrophobicContact CG-CE2 4.35Å; Y585-F589 WeakPolarHBondContact O-CB 3.43Å; Y585-F589 VanDerWaalsContact O-CD2 3.26Å; Y585-F589 WeakPolarHBondContact O-CD2 3.41Å; Y585-F589 PolarHBondContact O-N 3.5Å; F589-Q593 VanDerWaalsContact C-NE2 3.27Å; F589-Q593 VanDerWaalsContact O-CB 3.29Å; F589-Q593 WeakPolarHBondContact O-CB 3.24Å; F589-Q593 WeakPolarHBondContact O-CG 3.27Å; F589-Q593 PolarHBondContact O-N 3.43Å; F589-Q593 PolarHBondContact O-NE2 3.28Å
590	F	89.7	Confident	89.2	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.018	22%	0.218	C	C	.	.	H	α-helix	trans	-65.9	-47.4	179.5	-179.2	-108.5	0	0	0	112.9	F321 W586 L600 D711 L731	F321-F590 HydrophobicContact CE2-CE2 4.21Å; W586-F590 WeakPolarHBondContact O-CB 3.32Å; W586-F590 PolarHBondContact O-N 3Å; F590-L600 HydrophobicContact CB-CD2 3.91Å; F590-L600 HydrophobicContact CB-CG 4.44Å; F590-L600 HydrophobicContact CD1-CD1 3.79Å; F590-L600 HydrophobicContact CD1-CD2 3.8Å; F590-L600 HydrophobicContact CD1-CG 3.73Å; F590-L600 HydrophobicContact CD2-CD2 4.24Å; F590-L600 HydrophobicContact CD2-CG 3.84Å; F590-L600 HydrophobicContact CE1-CD1 3.5Å; F590-L600 VanDerWaalsContact CE1-CD1 3.5Å; F590-L600 HydrophobicContact CE1-CD2 4.36Å; F590-L600 HydrophobicContact CE1-CG 3.82Å; F590-L600 HydrophobicContact CE2-CD1 4.32Å; F590-L600 HydrophobicContact CE2-CG 3.92Å; F590-L600 HydrophobicContact CG-CD1 4.32Å; F590-L600 HydrophobicContact CG-CD2 3.72Å; F590-L600 HydrophobicContact CG-CG 3.74Å; F590-L600 HydrophobicContact CZ-CD1 3.79Å; F590-L600 HydrophobicContact CZ-CG 3.91Å; F590-D711 WeakPolarHBondContact CE1-O 3.4Å; F590-L731 HydrophobicContact CD1-CD1 4.23Å
591	K	89.6	Confident	88.8	Confident	10 Å²	10	39.3 Å²	39.3	4%	0.043	22%	0.216	C	C	.	.	H	α-helix	trans	-80.7	-27.6	-176	-63.7	-65.8	-166.6	173.5	0	113.7	K322 L587 L707 L709 D711 S713 S714	K322-K591 WeakPolarHBondContact CE-O 3.44Å; K322-K591 PolarHBondContact NZ-O 2.93Å; L587-K591 HydrophobicContact CD1-CG 4.38Å; L587-K591 VanDerWaalsContact O-CB 3.25Å; L587-K591 WeakPolarHBondContact O-CB 3.24Å; L587-K591 PolarHBondContact O-N 3.17Å; K591-L707 WeakPolarHBondContact CE-O 3.24Å; K591-L709 WeakPolarHBondContact CE-O 3.25Å; K591-L709 PolarHBondContact NZ-O 3.48Å; K591-D711 PolarHBondContact NZ-O 3.18Å; K591-D711 IonicContact NZ-OD1 3.09Å; K591-D711 PolarHBondContact NZ-OD1 3.24Å; K591-S713 PolarHBondContact NZ-O 3.11Å; K591-S714 PolarHBondContact O-OG 3.47Å
592	A	85.1	Confident	88.4	Confident	60 Å²	60	40.3 Å²	40.3	50%	0.496	21%	0.211	S	C	.	.	H	α-helix	trans	-98	0.5	-176.6	0	0	0	0	0	114.4	I588	I588-A592 WeakPolarHBondContact O-CA 3.47Å; I588-A592 WeakPolarHBondContact O-CB 3.31Å; I588-A592 PolarHBondContact O-N 2.95Å
593	Q	83.1	Confident	88	Confident	13 Å²	13	42.6 Å²	42.6	6%	0.061	23%	0.226	C	C	.	.			trans	-61.6	137	178.2	-95.7	160.4	37.2	0	0	113	F589 S597 V598	F589-Q593 VanDerWaalsContact C-NE2 3.27Å; F589-Q593 VanDerWaalsContact O-CB 3.29Å; F589-Q593 WeakPolarHBondContact O-CB 3.24Å; F589-Q593 WeakPolarHBondContact O-CG 3.27Å; F589-Q593 PolarHBondContact O-N 3.43Å; F589-Q593 PolarHBondContact O-NE2 3.28Å; Q593-S597 PolarHBondContact NE2-OG 3.06Å; Q593-S597 VanDerWaalsContact OE1-N 3.17Å; Q593-V598 VanDerWaalsContact NE2-CB 3.27Å; Q593-V598 VanDerWaalsContact NE2-CG2 3.27Å; Q593-V598 PolarHBondContact OE1-O 3.38Å
594	K	80.9	Confident	87.6	Confident	152 Å²	152	47.9 Å²	47.9	66%	0.661	26%	0.258	S	S	*	.	S	Bend	trans	-85.3	-73.1	166	-69.1	-176.6	179.3	-178.3	0	108.5	S320 F321 K322	S320-K594 CarbonylContact C-O 3.55Å; S320-K594 WeakPolarHBondContact CA-O 3.22Å; S320-K594 WeakPolarHBondContact CB-O 3.35Å; S320-K594 PolarHBondContact OG-O 3.29Å; F321-K594 PolarHBondContact N-O 2.8Å; K322-K594 HydrophobicContact CB-CG 4.47Å
595	S	82.3	Confident	87.1	Confident	53 Å²	53	48.7 Å²	48.7	37%	0.371	26%	0.261	S	S	.	.	B	Isolated β-bridge	trans	-80.3	143.1	166.2	-51.6	0	0	0	0	110.2	I479 S597	I479-S595 WeakPolarHBondContact O-CB 3.3Å; S595-S597 PolarHBondContact O-N 3.32Å
596	V	83.8	Confident	86.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.244	C	C	.	.			trans	-76.5	119.2	-178.9	-176.6	0	0	0	0	109.6	F319 F321 F370 L474 G481 L599	F319-V596 HydrophobicContact CB-CG2 4.4Å; F319-V596 PolarHBondContact O-N 3.09Å; F321-V596 HydrophobicContact CD1-CG2 3.62Å; F321-V596 HydrophobicContact CD2-CG2 3.92Å; F321-V596 HydrophobicContact CE1-CG2 3.39Å; F321-V596 HydrophobicContact CE2-CG1 4.3Å; F321-V596 HydrophobicContact CE2-CG2 3.69Å; F321-V596 HydrophobicContact CG-CG2 3.89Å; F321-V596 HydrophobicContact CZ-CB 4.39Å; F321-V596 HydrophobicContact CZ-CG1 4.06Å; F321-V596 HydrophobicContact CZ-CG2 3.41Å; F321-V596 VanDerWaalsContact CZ-CG2 3.41Å; F370-V596 HydrophobicContact CD1-CG2 4.08Å; F370-V596 HydrophobicContact CE1-CB 3.86Å; F370-V596 HydrophobicContact CE1-CG1 3.78Å; F370-V596 HydrophobicContact CE1-CG2 3.68Å; F370-V596 HydrophobicContact CZ-CG1 4.29Å; L474-V596 HydrophobicContact CD1-CG1 4.35Å; G481-V596 WeakPolarHBondContact CA-O 3.48Å; G481-V596 PolarHBondContact N-O 3.44Å; V596-L599 HydrophobicContact CG1-CD2 4.15Å
597	S	84.8	Confident	86.8	Confident	47 Å²	47	49.2 Å²	49.2	33%	0.329	27%	0.267	S	S	.	.			trans	-126.7	-19.1	176.4	57.5	0	0	0	0	112.7	L474 Q593 S595	L474-S597 WeakPolarHBondContact CD2-O 3.41Å; Q593-S597 PolarHBondContact NE2-OG 3.06Å; Q593-S597 VanDerWaalsContact OE1-N 3.17Å; S595-S597 PolarHBondContact O-N 3.32Å
598	V	87.6	Confident	86.5	Confident	12 Å²	12	55.1 Å²	55.1	7%	0.073	29%	0.288	C	S	.	.			trans	-142.6	129.3	-177.1	-149.9	0	0	0	0	110.3	M515 Y585 W586 Q593	M515-V598 HydrophobicContact CE-CG1 3.86Å; M515-V598 HydrophobicContact SD-CB 4.39Å; M515-V598 HydrophobicContact SD-CG1 3.59Å; M515-V598 VanDerWaalsContact SD-CG1 3.59Å; Y585-V598 HydrophobicContact CE1-CG1 4.45Å; W586-V598 HydrophobicContact CE3-CG1 4.14Å; W586-V598 HydrophobicContact CH2-CB 4.44Å; W586-V598 HydrophobicContact CH2-CG1 3.16Å; W586-V598 HydrophobicContact CZ2-CG1 4.36Å; W586-V598 HydrophobicContact CZ3-CB 3.92Å; W586-V598 HydrophobicContact CZ3-CG1 3.03Å; Q593-V598 VanDerWaalsContact NE2-CB 3.27Å; Q593-V598 VanDerWaalsContact NE2-CG2 3.27Å; Q593-V598 PolarHBondContact OE1-O 3.38Å
599	L	88.7	Confident	86.5	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	27%	0.268	C	S	.	.			trans	-107.1	155.9	176.7	-67.4	170.7	0	0	0	111.1	L474 E514 M515 H517 W586 V596	L474-L599 HydrophobicContact CB-CD1 3.72Å; L474-L599 HydrophobicContact CB-CG 4.49Å; L474-L599 HydrophobicContact CD2-CD1 4.46Å; L474-L599 HydrophobicContact CD2-CG 4.36Å; E514-L599 WeakPolarHBondContact O-CD1 3.45Å; M515-L599 HydrophobicContact CB-CB 4.41Å; M515-L599 HydrophobicContact CB-CD1 4.4Å; M515-L599 HydrophobicContact CG-CB 4.12Å; M515-L599 HydrophobicContact SD-CB 4.04Å; M515-L599 PolarHBondContact SD-N 3.14Å; M515-L599 VanDerWaalsContact SD-O 3.34Å; H517-L599 PolarHBondContact CE1-O 3.36Å; W586-L599 WeakPolarHBondContact CH2-O 3.38Å; W586-L599 WeakPolarHBondContact CZ3-O 3.34Å; V596-L599 HydrophobicContact CG1-CD2 4.15Å
600	L	89.7	Confident	86.7	Confident	15 Å²	15	48.6 Å²	48.6	8%	0.079	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-67.7	145.8	-179.8	-64.7	173	0	0	0	112.4	W586 F590 M710 L731	W586-L600 HydrophobicContact CB-CD2 4.46Å; W586-L600 HydrophobicContact CE3-CD2 4.3Å; F590-L600 HydrophobicContact CB-CD2 3.91Å; F590-L600 HydrophobicContact CB-CG 4.44Å; F590-L600 HydrophobicContact CD1-CD1 3.79Å; F590-L600 HydrophobicContact CD1-CD2 3.8Å; F590-L600 HydrophobicContact CD1-CG 3.73Å; F590-L600 HydrophobicContact CD2-CD2 4.24Å; F590-L600 HydrophobicContact CD2-CG 3.84Å; F590-L600 HydrophobicContact CE1-CD1 3.5Å; F590-L600 VanDerWaalsContact CE1-CD1 3.5Å; F590-L600 HydrophobicContact CE1-CD2 4.36Å; F590-L600 HydrophobicContact CE1-CG 3.82Å; F590-L600 HydrophobicContact CE2-CD1 4.32Å; F590-L600 HydrophobicContact CE2-CG 3.92Å; F590-L600 HydrophobicContact CG-CD1 4.32Å; F590-L600 HydrophobicContact CG-CD2 3.72Å; F590-L600 HydrophobicContact CG-CG 3.74Å; F590-L600 HydrophobicContact CZ-CD1 3.79Å; F590-L600 HydrophobicContact CZ-CG 3.91Å; L600-M710 HydrophobicContact CD1-CB 4.1Å; L600-M710 HydrophobicContact CD1-CG 3.87Å; L600-L731 HydrophobicContact CD1-CD1 3.73Å; L600-L731 HydrophobicContact CD1-CG 4.4Å; L600-L731 HydrophobicContact CD2-CD1 3.88Å; L600-L731 HydrophobicContact CD2-CD2 3.88Å; L600-L731 HydrophobicContact CD2-CG 3.88Å; L600-L731 HydrophobicContact CG-CD1 4.46Å
601	P	88.2	Confident	86.9	Confident	11 Å²	11	52.5 Å²	52.5	7%	0.071	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-60.4	147.5	171	-23.4	34.6	0	0	0	112.7	W586 Q605 E606 I730	W586-P601 HydrophobicContact CD2-CG 4.41Å; W586-P601 HydrophobicContact CZ2-CG 3.9Å; P601-Q605 HydrophobicContact CB-CB 4.05Å; P601-E606 HydrophobicContact CB-CG 4.39Å; P601-I730 HydrophobicContact CB-CD1 4.24Å; P601-I730 HydrophobicContact CG-CD1 3.83Å
602	M	85.1	Confident	87.1	Confident	60 Å²	60	54.7 Å²	54.7	30%	0.296	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-67.5	155.1	174.8	-71.2	-171.9	-79.6	0	0	111.7	E514 V604 Q605 E606	E514-M602 VanDerWaalsContact CD-SD 3.54Å; E514-M602 HydrophobicContact CG-CE 4.16Å; E514-M602 HydrophobicContact CG-CG 4.18Å; E514-M602 HydrophobicContact CG-SD 3.72Å; M602-V604 PolarHBondContact O-N 3.13Å; M602-Q605 HydrophobicContact CB-CG 4.48Å; M602-Q605 WeakPolarHBondContact O-CA 3.27Å; M602-Q605 WeakPolarHBondContact O-CB 3.5Å; M602-Q605 PolarHBondContact O-N 3.09Å; M602-E606 PolarHBondContact O-N 3.46Å
603	P	84.6	Confident	87.6	Confident	77 Å²	77	51.8 Å²	51.8	50%	0.5	27%	0.268	S	S	.	.	H	α-helix	trans	-51.5	-36.8	179.8	-29.8	35.8	0	0	0	114.8	Q605 E606 E607	P603-Q605 VanDerWaalsContact C-N 3.33Å; P603-Q605 PolarHBondContact O-N 3.16Å; P603-E606 PolarHBondContact O-N 3.36Å; P603-E607 PolarHBondContact O-N 2.84Å
604	V	84.6	Confident	88.3	Confident	111 Å²	111	52.7 Å²	52.7	67%	0.673	28%	0.28	S	S	*	.	H	α-helix	trans	-65.3	-36.5	176.4	-179.7	0	0	0	0	111.7	M602 E607	M602-V604 PolarHBondContact O-N 3.13Å; V604-E607 PolarHBondContact O-N 2.91Å
605	Q	83.4	Confident	89	Confident	74 Å²	74	47.8 Å²	47.8	35%	0.346	26%	0.264	S	S	.	.	H	α-helix	trans	-74.6	-31.6	176.5	-63.8	169.3	-22.4	0	0	111.3	H517 P601 M602 P603 E607	H517-Q605 PolarHBondContact CD2-OE1 3.2Å; H517-Q605 VanDerWaalsContact CD2-OE1 3.25Å; P601-Q605 HydrophobicContact CB-CB 4.05Å; M602-Q605 HydrophobicContact CB-CG 4.48Å; M602-Q605 WeakPolarHBondContact O-CA 3.27Å; M602-Q605 WeakPolarHBondContact O-CB 3.5Å; M602-Q605 PolarHBondContact O-N 3.09Å; P603-Q605 VanDerWaalsContact C-N 3.33Å; P603-Q605 PolarHBondContact O-N 3.16Å; Q605-E607 PolarHBondContact O-N 2.96Å
606	E	88.8	Confident	89.7	Confident	3 Å²	3	45.2 Å²	45.2	1%	0.014	25%	0.247	C	C	.	.	H	α-helix	trans	-64.6	-22.2	174.5	-60.1	-165.7	144.3	0	0	112.9	P601 M602 P603 R608 F609 V610 S728 R729 I730	P601-E606 HydrophobicContact CB-CG 4.39Å; M602-E606 PolarHBondContact O-N 3.46Å; P603-E606 PolarHBondContact O-N 3.36Å; E606-R608 VanDerWaalsContact C-N 3.32Å; E606-R608 PolarHBondContact O-N 3.48Å; E606-F609 WeakPolarHBondContact O-CB 3.19Å; E606-F609 PolarHBondContact O-N 3.12Å; E606-F609 VanDerWaalsContact O-N 3.11Å; E606-V610 WeakPolarHBondContact O-CG2 3.43Å; E606-V610 PolarHBondContact O-N 3.35Å; E606-S728 WeakPolarHBondContact OE1-CB 3.33Å; E606-S728 PolarHBondContact OE1-OG 2.81Å; E606-R729 PolarHBondContact OE1-N 3.45Å; E606-R729 VanDerWaalsContact OE2-CB 3.26Å; E606-R729 WeakPolarHBondContact OE2-CB 3.48Å; E606-R729 WeakPolarHBondContact OE2-CG 3.48Å; E606-R729 PolarHBondContact OE2-N 2.86Å; E606-I730 HydrophobicContact CB-CD1 4.42Å; E606-I730 HydrophobicContact CB-CG1 4.38Å; E606-I730 HydrophobicContact CG-CD1 3.79Å; E606-I730 HydrophobicContact CG-CG1 3.95Å; E606-I730 PolarHBondContact OE1-N 3.45Å
607	E	89.1	Confident	90.4	Very high	111 Å²	111	47.4 Å²	47.4	52%	0.519	26%	0.256	S	S	.	.	H	α-helix	trans	-60	-39.5	-179.3	-66.2	-167.9	159.3	0	0	113.2	P603 V604 Q605 F609 V610 T611	P603-E607 PolarHBondContact O-N 2.84Å; V604-E607 PolarHBondContact O-N 2.91Å; Q605-E607 PolarHBondContact O-N 2.96Å; E607-F609 VanDerWaalsContact C-N 3.33Å; E607-F609 PolarHBondContact O-N 3.08Å; E607-V610 PolarHBondContact O-N 3.4Å; E607-T611 PolarHBondContact O-N 3.43Å; E607-T611 PolarHBondContact O-OG1 2.83Å
608	R	87.1	Confident	91	Very high	150 Å²	150	47.9 Å²	47.9	57%	0.566	26%	0.263	S	S	*	.	H	α-helix	trans	-62.6	-42.5	175.3	-67.1	-174.7	-176.1	-178.6	1.7	111.3	H521 E606 T611 Y612	H521-R608 PolarHBondContact NE2-NH1 3.46Å; E606-R608 VanDerWaalsContact C-N 3.32Å; E606-R608 PolarHBondContact O-N 3.48Å; R608-T611 WeakPolarHBondContact O-CB 3.43Å; R608-T611 PolarHBondContact O-N 3.29Å; R608-Y612 PolarHBondContact O-N 2.85Å
609	F	91.3	Very high	91.4	Very high	16 Å²	16	49.4 Å²	49.4	7%	0.07	27%	0.271	C	S	.	.	H	α-helix	trans	-61.2	-45.9	176.3	178.5	-90.4	0	0	0	111.4	T579 T582 E606 E607 T611 Y612 V613 I730 Y733	T579-F609 HydrophobicContact CG2-CD2 4.49Å; T579-F609 HydrophobicContact CG2-CE2 4.14Å; T579-F609 HydrophobicContact CG2-CZ 4.49Å; T579-F609 WeakPolarHBondContact O-CE2 3.44Å; T579-F609 WeakPolarHBondContact O-CZ 3.41Å; T582-F609 HydrophobicContact CG2-CD2 4.29Å; T582-F609 HydrophobicContact CG2-CE2 4.21Å; E606-F609 WeakPolarHBondContact O-CB 3.19Å; E606-F609 PolarHBondContact O-N 3.12Å; E606-F609 VanDerWaalsContact O-N 3.11Å; E607-F609 VanDerWaalsContact C-N 3.33Å; E607-F609 PolarHBondContact O-N 3.08Å; F609-T611 VanDerWaalsContact C-N 3.27Å; F609-T611 PolarHBondContact O-N 3.49Å; F609-Y612 PolarHBondContact O-N 3.1Å; F609-Y612 VanDerWaalsContact O-N 3.14Å; F609-V613 HydrophobicContact CD1-CG2 4.25Å; F609-V613 HydrophobicContact CE1-CG2 3.84Å; F609-V613 HydrophobicContact CZ-CG2 4.19Å; F609-V613 PolarHBondContact O-N 3.32Å; F609-V613 VanDerWaalsContact O-N 3.08Å; F609-I730 HydrophobicContact CB-CD1 4.39Å; F609-I730 HydrophobicContact CB-CG1 4.28Å; F609-I730 HydrophobicContact CD1-CG1 3.71Å; F609-I730 HydrophobicContact CD2-CG1 4.38Å; F609-I730 HydrophobicContact CE1-CB 4.47Å; F609-I730 HydrophobicContact CE1-CG1 4.09Å; F609-I730 HydrophobicContact CG-CD1 4.31Å; F609-I730 HydrophobicContact CG-CG1 3.86Å; F609-I730 HydrophobicContact CZ-CG2 4.44Å; F609-Y733 AromaticContact CE1-CD1 3.94Å; F609-Y733 HydrophobicContact CE1-CD1 3.94Å; F609-Y733 HydrophobicContact CE1-CG 4.02Å; F609-Y733 AromaticContact CZ-CD1 3.58Å; F609-Y733 HydrophobicContact CZ-CD1 3.58Å; F609-Y733 HydrophobicContact CZ-CE1 4.03Å; F609-Y733 HydrophobicContact CZ-CG 4.14Å
610	V	93.8	Very high	91.9	Very high	40 Å²	40	49.5 Å²	49.5	24%	0.242	27%	0.271	C	S	.	.	H	α-helix	trans	-60.8	-38.2	176.4	175.8	0	0	0	0	111.3	E606 E607 V613 G614 R729	E606-V610 WeakPolarHBondContact O-CG2 3.43Å; E606-V610 PolarHBondContact O-N 3.35Å; E607-V610 PolarHBondContact O-N 3.4Å; V610-V613 PolarHBondContact O-N 3.07Å; V610-G614 PolarHBondContact O-N 3.14Å; V610-R729 HydrophobicContact CG2-CB 4.24Å
611	T	93	Very high	92.2	Very high	85 Å²	85	50 Å²	50	52%	0.521	28%	0.277	S	S	.	.	H	α-helix	trans	-62.7	-42.6	175.3	-58.8	0	0	0	0	111.5	E607 R608 F609 V613 G614 C615	E607-T611 PolarHBondContact O-N 3.43Å; E607-T611 PolarHBondContact O-OG1 2.83Å; R608-T611 WeakPolarHBondContact O-CB 3.43Å; R608-T611 PolarHBondContact O-N 3.29Å; F609-T611 VanDerWaalsContact C-N 3.27Å; F609-T611 PolarHBondContact O-N 3.49Å; T611-V613 PolarHBondContact O-N 2.88Å; T611-G614 PolarHBondContact O-N 3.42Å; T611-C615 PolarHBondContact O-N 3.15Å; T611-C615 PolarHBondContact O-SG 3.3Å; T611-C615 VanDerWaalsContact O-SG 3.37Å
612	Y	93.8	Very high	92.6	Very high	56 Å²	56	53.3 Å²	53.3	22%	0.22	29%	0.294	C	S	.	.	H	α-helix	trans	-62.8	-39.7	175.5	-63.1	-33.1	0	0	0	113	F575 R608 F609 C615 A616	F575-Y612 HydrophobicContact CD1-CD1 4.16Å; F575-Y612 HydrophobicContact CD1-CG 4.31Å; F575-Y612 AromaticContact CE1-CD1 3.73Å; F575-Y612 HydrophobicContact CE1-CD1 3.73Å; F575-Y612 HydrophobicContact CE1-CE1 4.28Å; F575-Y612 HydrophobicContact CE1-CG 4.32Å; R608-Y612 PolarHBondContact O-N 2.85Å; F609-Y612 PolarHBondContact O-N 3.1Å; F609-Y612 VanDerWaalsContact O-N 3.14Å; Y612-C615 PolarHBondContact O-N 2.99Å; Y612-A616 WeakPolarHBondContact O-CB 3.27Å; Y612-A616 PolarHBondContact O-N 3.34Å
613	V	96.5	Very high	93.1	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.5	-42.7	174.1	177.1	0	0	0	0	110.9	T579 F609 V610 T611 A616 F617 Y733 V949 L952	T579-V613 HydrophobicContact CG2-CG2 3.73Å; F609-V613 HydrophobicContact CD1-CG2 4.25Å; F609-V613 HydrophobicContact CE1-CG2 3.84Å; F609-V613 HydrophobicContact CZ-CG2 4.19Å; F609-V613 PolarHBondContact O-N 3.32Å; F609-V613 VanDerWaalsContact O-N 3.08Å; V610-V613 PolarHBondContact O-N 3.07Å; T611-V613 PolarHBondContact O-N 2.88Å; V613-A616 WeakPolarHBondContact O-CB 3.47Å; V613-A616 PolarHBondContact O-N 3.39Å; V613-F617 PolarHBondContact O-N 3.31Å; V613-Y733 HydrophobicContact CB-CE2 4.44Å; V613-Y733 HydrophobicContact CG1-CD2 4.05Å; V613-Y733 HydrophobicContact CG1-CE2 3.66Å; V613-Y733 HydrophobicContact CG2-CD2 4.03Å; V613-Y733 HydrophobicContact CG2-CE2 3.81Å; V613-Y733 HydrophobicContact CG2-CG 4.48Å; V613-V949 HydrophobicContact CG1-CG2 4.12Å; V613-L952 HydrophobicContact CB-CD1 4.33Å; V613-L952 HydrophobicContact CG1-CD1 3.96Å
614	G	96.6	Very high	93.6	Very high	31 Å²	31	48.5 Å²	48.5	32%	0.32	26%	0.264	S	S	.	.	H	α-helix	trans	-61.1	-44.4	175.2	0	0	0	0	0	112.9	V610 T611 F617 A618	V610-G614 PolarHBondContact O-N 3.14Å; T611-G614 PolarHBondContact O-N 3.42Å; G614-F617 PolarHBondContact O-N 2.95Å; G614-A618 PolarHBondContact O-N 3.23Å
615	C	95.9	Very high	94.1	Very high	49 Å²	49	47.2 Å²	47.2	33%	0.331	25%	0.253	S	S	.	.	H	α-helix	trans	-61.3	-43.5	173.7	-72.5	0	0	0	0	112	F575 T611 Y612 F617 A618 L619	F575-C615 HydrophobicContact CD2-CB 4.33Å; F575-C615 HydrophobicContact CE2-CB 4.21Å; F575-C615 HydrophobicContact CZ-CB 4.49Å; T611-C615 PolarHBondContact O-N 3.15Å; T611-C615 PolarHBondContact O-SG 3.3Å; T611-C615 VanDerWaalsContact O-SG 3.37Å; Y612-C615 PolarHBondContact O-N 2.99Å; C615-F617 VanDerWaalsContact C-N 3.33Å; C615-F617 PolarHBondContact O-N 3.06Å; C615-A618 PolarHBondContact O-N 3.32Å; C615-L619 WeakPolarHBondContact O-CB 3.39Å; C615-L619 VanDerWaalsContact O-CG 3.28Å; C615-L619 WeakPolarHBondContact O-CG 3.37Å; C615-L619 PolarHBondContact O-N 2.96Å
616	A	97.3	Very high	94.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-56.6	-48.5	175.5	0	0	0	0	0	110.9	F575 Y612 V613 K620 L945	F575-A616 HydrophobicContact CB-CB 3.64Å; Y612-A616 WeakPolarHBondContact O-CB 3.27Å; Y612-A616 PolarHBondContact O-N 3.34Å; V613-A616 WeakPolarHBondContact O-CB 3.47Å; V613-A616 PolarHBondContact O-N 3.39Å; A616-K620 WeakPolarHBondContact O-CB 3.41Å; A616-K620 PolarHBondContact O-N 3.45Å; A616-L945 HydrophobicContact CB-CD1 4.13Å; A616-L945 HydrophobicContact CB-CD2 4.04Å
617	F	97.9	Very high	94.8	Very high	46 Å²	46	48.9 Å²	48.9	20%	0.202	26%	0.26	C	S	.	.	H	α-helix	trans	-62.5	-50.9	178.9	172	-110	0	0	0	112.4	V613 G614 C615 L619 K620 A621 F942 L945 F946 V949	V613-F617 PolarHBondContact O-N 3.31Å; G614-F617 PolarHBondContact O-N 2.95Å; C615-F617 VanDerWaalsContact C-N 3.33Å; C615-F617 PolarHBondContact O-N 3.06Å; F617-L619 VanDerWaalsContact C-N 3.35Å; F617-L619 PolarHBondContact O-N 3.24Å; F617-K620 PolarHBondContact O-N 3.13Å; F617-K620 VanDerWaalsContact O-N 3.17Å; F617-A621 HydrophobicContact CZ-CB 4.49Å; F617-A621 WeakPolarHBondContact O-CB 3.37Å; F617-A621 PolarHBondContact O-N 2.94Å; F617-F942 HydrophobicContact CE2-CD2 4.33Å; F617-F942 AromaticContact CE2-CE2 3.8Å; F617-F942 HydrophobicContact CE2-CE2 3.8Å; F617-L945 HydrophobicContact CB-CB 4.13Å; F617-L945 HydrophobicContact CD2-CB 3.99Å; F617-F946 HydrophobicContact CD2-CB 4.39Å; F617-F946 HydrophobicContact CE2-CB 3.83Å; F617-F946 AromaticContact CE2-CD2 3.74Å; F617-F946 HydrophobicContact CE2-CD2 3.74Å; F617-F946 HydrophobicContact CE2-CG 4.29Å; F617-F946 AromaticContact CZ-CD2 3.66Å; F617-F946 HydrophobicContact CZ-CD2 3.66Å; F617-F946 HydrophobicContact CZ-CE2 4.43Å; F617-V949 HydrophobicContact CB-CG2 3.73Å; F617-V949 HydrophobicContact CD1-CG2 4.3Å; F617-V949 HydrophobicContact CG-CG2 4.01Å
618	A	97.6	Very high	95	Very high	57 Å²	57	43.9 Å²	43.9	47%	0.471	24%	0.236	S	C	.	.	H	α-helix	trans	-59.5	-45.3	-177	0	0	0	0	0	112.1	G614 C615 A621 L622	G614-A618 PolarHBondContact O-N 3.23Å; C615-A618 PolarHBondContact O-N 3.32Å; A618-A621 PolarHBondContact O-N 3.34Å; A618-L622 PolarHBondContact O-N 2.93Å; A618-L622 VanDerWaalsContact O-N 3.14Å
619	L	97.4	Very high	95.2	Very high	44 Å²	44	40.7 Å²	40.7	23%	0.23	23%	0.229	C	C	.	.	H	α-helix	trans	-69.4	-36.8	177.7	-64.8	174.6	0	0	0	111.9	A568 L571 A572 F575 C615 F617 L622 Q623	A568-L619 HydrophobicContact CB-CB 4.44Å; A568-L619 HydrophobicContact CB-CD2 3.8Å; A568-L619 WeakPolarHBondContact O-CB 3.46Å; L571-L619 HydrophobicContact CB-CD1 4.27Å; L571-L619 HydrophobicContact CD2-CD1 3.87Å; L571-L619 HydrophobicContact CG-CD1 4.04Å; A572-L619 HydrophobicContact CB-CB 3.71Å; F575-L619 HydrophobicContact CD2-CD1 4.14Å; F575-L619 HydrophobicContact CE2-CD1 4.07Å; C615-L619 WeakPolarHBondContact O-CB 3.39Å; C615-L619 VanDerWaalsContact O-CG 3.28Å; C615-L619 WeakPolarHBondContact O-CG 3.37Å; C615-L619 PolarHBondContact O-N 2.96Å; F617-L619 VanDerWaalsContact C-N 3.35Å; F617-L619 PolarHBondContact O-N 3.24Å; L619-L622 PolarHBondContact O-N 3.42Å; L619-Q623 PolarHBondContact O-N 2.92Å
620	K	97.5	Very high	95.2	Very high	3 Å²	3	41.5 Å²	41.5	1%	0.013	24%	0.237	C	C	.	.	H	α-helix	trans	-66.9	-39.1	175.7	-165.2	65.9	171.7	-179.6	0	112.1	A572 N573 A616 F617 L622 Q623 F624 I941 F942 L945	A572-K620 HydrophobicContact CB-CB 3.99Å; A572-K620 HydrophobicContact CB-CD 4.17Å; N573-K620 PolarHBondContact OD1-NZ 3.04Å; A616-K620 WeakPolarHBondContact O-CB 3.41Å; A616-K620 PolarHBondContact O-N 3.45Å; F617-K620 PolarHBondContact O-N 3.13Å; F617-K620 VanDerWaalsContact O-N 3.17Å; K620-L622 VanDerWaalsContact C-N 3.33Å; K620-L622 PolarHBondContact O-N 3.38Å; K620-Q623 PolarHBondContact O-N 2.95Å; K620-F624 WeakPolarHBondContact O-CB 2.96Å; K620-F624 PolarHBondContact O-N 3.25Å; K620-I941 HydrophobicContact CD-CG2 4.18Å; K620-I941 HydrophobicContact CG-CG2 4.27Å; K620-F942 HydrophobicContact CG-CB 4.25Å; K620-L945 HydrophobicContact CB-CD1 3.85Å; K620-L945 HydrophobicContact CG-CD1 4.07Å
621	A	96.8	Very high	95	Very high	26 Å²	26	40.1 Å²	40.1	22%	0.215	23%	0.228	C	C	.	.	H	α-helix	trans	-61.1	-42.3	175	0	0	0	0	0	111.2	F617 A618 F624 L625 F942	F617-A621 HydrophobicContact CZ-CB 4.49Å; F617-A621 WeakPolarHBondContact O-CB 3.37Å; F617-A621 PolarHBondContact O-N 2.94Å; A618-A621 PolarHBondContact O-N 3.34Å; A621-F624 PolarHBondContact O-N 2.92Å; A621-L625 WeakPolarHBondContact O-CB 3.32Å; A621-L625 PolarHBondContact O-N 3.3Å; A621-F942 HydrophobicContact CB-CD2 4.48Å; A621-F942 HydrophobicContact CB-CE2 3.83Å
622	L	96.6	Very high	94.9	Very high	80 Å²	80	37.4 Å²	37.4	42%	0.419	21%	0.21	S	C	.	.	H	α-helix	trans	-60.9	-46.3	174	-178.6	64.3	0	0	0	111.7	A568 A618 L619 K620 H626	A568-L622 HydrophobicContact CB-CD2 3.97Å; A618-L622 PolarHBondContact O-N 2.93Å; A618-L622 VanDerWaalsContact O-N 3.14Å; L619-L622 PolarHBondContact O-N 3.42Å; K620-L622 VanDerWaalsContact C-N 3.33Å; K620-L622 PolarHBondContact O-N 3.38Å; L622-H626 WeakPolarHBondContact O-CB 3.33Å; L622-H626 PolarHBondContact O-N 3.25Å
623	Q	95.7	Very high	94.7	Very high	29 Å²	29	38.7 Å²	38.7	14%	0.136	22%	0.224	C	C	.	.	H	α-helix	trans	-60.8	-46.8	176	-177.7	-175.4	44.4	0	0	111.6	L619 K620 H626 K627	L619-Q623 PolarHBondContact O-N 2.92Å; K620-Q623 PolarHBondContact O-N 2.95Å; Q623-H626 PolarHBondContact O-N 3.47Å; Q623-K627 WeakPolarHBondContact O-CB 3.38Å; Q623-K627 PolarHBondContact O-N 3.2Å
624	F	95.7	Very high	94.4	Very high	7 Å²	7	39.1 Å²	39.1	3%	0.031	23%	0.226	C	C	.	.	H	α-helix	trans	-62.4	-47.8	-179.8	169.8	-113.2	0	0	0	111.3	K620 A621 H626 K627 L628 L939 F942 F971	K620-F624 WeakPolarHBondContact O-CB 2.96Å; K620-F624 PolarHBondContact O-N 3.25Å; A621-F624 PolarHBondContact O-N 2.92Å; F624-H626 VanDerWaalsContact C-N 3.34Å; F624-H626 PolarHBondContact O-N 2.79Å; F624-K627 WeakPolarHBondContact O-CB 3.36Å; F624-K627 PolarHBondContact O-N 3.48Å; F624-K627 VanDerWaalsContact O-N 3.15Å; F624-L628 HydrophobicContact CZ-CD2 4.39Å; F624-L628 WeakPolarHBondContact O-CB 3.39Å; F624-L628 PolarHBondContact O-N 3.33Å; F624-L939 HydrophobicContact CD2-CD2 3.91Å; F624-L939 HydrophobicContact CE2-CD2 3.34Å; F624-L939 HydrophobicContact CZ-CD2 4.21Å; F624-F942 HydrophobicContact CB-CD2 4.23Å; F624-F942 HydrophobicContact CB-CG 4.28Å; F624-F942 AromaticContact CD1-CD1 3.87Å; F624-F942 HydrophobicContact CD1-CD1 3.87Å; F624-F942 HydrophobicContact CD1-CD2 4.34Å; F624-F942 AromaticContact CD1-CE1 3.62Å; F624-F942 HydrophobicContact CD1-CE1 3.62Å; F624-F942 HydrophobicContact CD1-CE2 4.15Å; F624-F942 HydrophobicContact CD1-CG 4.21Å; F624-F942 AromaticContact CD1-CZ 3.79Å; F624-F942 HydrophobicContact CD1-CZ 3.79Å; F624-F942 HydrophobicContact CE1-CD1 4.12Å; F624-F942 AromaticContact CE1-CE1 3.71Å; F624-F942 HydrophobicContact CE1-CE1 3.71Å; F624-F942 HydrophobicContact CE1-CZ 4.18Å; F624-F942 HydrophobicContact CG-CD1 4.15Å; F624-F942 HydrophobicContact CG-CD2 4.45Å; F624-F942 HydrophobicContact CG-CE1 4.35Å; F624-F942 HydrophobicContact CG-CG 4.18Å; F624-F971 HydrophobicContact CE1-CB 4.44Å; F624-F971 AromaticContact CE1-CD1 3.7Å; F624-F971 HydrophobicContact CE1-CD1 3.7Å; F624-F971 AromaticContact CE1-CD2 3.81Å; F624-F971 HydrophobicContact CE1-CD2 3.81Å; F624-F971 AromaticContact CE1-CE1 3.79Å; F624-F971 HydrophobicContact CE1-CE1 3.79Å; F624-F971 AromaticContact CE1-CE2 3.9Å; F624-F971 HydrophobicContact CE1-CE2 3.9Å; F624-F971 AromaticContact CE1-CG 3.72Å; F624-F971 HydrophobicContact CE1-CG 3.72Å; F624-F971 AromaticContact CE1-CZ 3.9Å; F624-F971 HydrophobicContact CE1-CZ 3.9Å; F624-F971 HydrophobicContact CZ-CB 4.15Å; F624-F971 HydrophobicContact CZ-CD1 4.07Å; F624-F971 HydrophobicContact CZ-CD2 4.31Å; F624-F971 AromaticContact CZ-CG 3.93Å; F624-F971 HydrophobicContact CZ-CG 3.93Å
625	L	94.8	Very high	94.1	Very high	85 Å²	85	38.6 Å²	38.6	45%	0.445	22%	0.216	S	C	.	.	H	α-helix	trans	-61.3	-43.7	178.6	-177.8	61.4	0	0	0	111.5	A621 K627 L628 I629	A621-L625 WeakPolarHBondContact O-CB 3.32Å; A621-L625 PolarHBondContact O-N 3.3Å; L625-K627 VanDerWaalsContact C-N 3.3Å; L625-K627 PolarHBondContact O-N 3.42Å; L625-L628 PolarHBondContact O-N 2.87Å; L625-I629 HydrophobicContact CD1-CD1 4.3Å; L625-I629 HydrophobicContact CD1-CG1 4.5Å; L625-I629 HydrophobicContact CG-CD1 4.06Å; L625-I629 VanDerWaalsContact O-CG1 3.27Å; L625-I629 WeakPolarHBondContact O-CG1 3.45Å; L625-I629 PolarHBondContact O-N 3.11Å
626	H	93.8	Very high	93.8	Very high	52 Å²	52	36.4 Å²	36.4	24%	0.241	20%	0.201	C	C	.	.	H	α-helix	trans	-59.8	-42.2	175.5	-179.4	69.2	0	0	0	112.4	K562 V565 L622 Q623 F624 I629 S630	K562-H626 VanDerWaalsContact CE-NE2 3.34Å; K562-H626 WeakPolarHBondContact CE-NE2 3.13Å; K562-H626 PolarHBondContact NZ-CE1 2.97Å; K562-H626 VanDerWaalsContact NZ-CE1 3.32Å; K562-H626 PolarHBondContact NZ-NE2 3.16Å; V565-H626 HydrophobicContact CG1-CB 3.64Å; V565-H626 VanDerWaalsContact CG1-CG 3.49Å; L622-H626 WeakPolarHBondContact O-CB 3.33Å; L622-H626 PolarHBondContact O-N 3.25Å; Q623-H626 PolarHBondContact O-N 3.47Å; F624-H626 VanDerWaalsContact C-N 3.34Å; F624-H626 PolarHBondContact O-N 2.79Å; H626-I629 PolarHBondContact O-N 3.23Å; H626-S630 PolarHBondContact O-N 3.19Å
627	K	92.2	Very high	93.6	Very high	60 Å²	60	36.4 Å²	36.4	26%	0.261	20%	0.201	S	C	.	.	H	α-helix	trans	-67.3	-42.9	178.1	-166.4	163.9	-172.4	170.4	0	111.8	Q623 F624 L625 I629 S630 Q631 N935 T938	Q623-K627 WeakPolarHBondContact O-CB 3.38Å; Q623-K627 PolarHBondContact O-N 3.2Å; F624-K627 WeakPolarHBondContact O-CB 3.36Å; F624-K627 PolarHBondContact O-N 3.48Å; F624-K627 VanDerWaalsContact O-N 3.15Å; L625-K627 VanDerWaalsContact C-N 3.3Å; L625-K627 PolarHBondContact O-N 3.42Å; K627-I629 PolarHBondContact O-N 3.2Å; K627-S630 PolarHBondContact O-N 2.94Å; K627-Q631 WeakPolarHBondContact O-CG 3.33Å; K627-Q631 PolarHBondContact O-N 3.26Å; K627-N935 WeakPolarHBondContact CE-OD1 3.41Å; K627-N935 PolarHBondContact NZ-OD1 3.2Å; K627-T938 HydrophobicContact CD-CG2 4.38Å; K627-T938 PolarHBondContact NZ-OG1 3.49Å
628	L	93.6	Very high	93.4	Very high	6 Å²	6	34.2 Å²	34.2	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-57.6	-48.8	174.6	-179.1	63.3	0	0	0	110.7	F624 L625 S630 Q631 I632 Y932 F971 R975	F624-L628 HydrophobicContact CZ-CD2 4.39Å; F624-L628 WeakPolarHBondContact O-CB 3.39Å; F624-L628 PolarHBondContact O-N 3.33Å; L625-L628 PolarHBondContact O-N 2.87Å; L628-S630 PolarHBondContact O-N 3.24Å; L628-Q631 PolarHBondContact O-N 3.29Å; L628-I632 WeakPolarHBondContact O-CG1 3.46Å; L628-I632 PolarHBondContact O-N 2.91Å; L628-I632 VanDerWaalsContact O-N 3.07Å; L628-Y932 HydrophobicContact CD1-CE1 4.11Å; L628-F971 HydrophobicContact CD2-CD1 3.73Å; L628-F971 HydrophobicContact CD2-CE1 4.13Å; L628-R975 HydrophobicContact CD1-CB 4.07Å; L628-R975 HydrophobicContact CD1-CG 4.41Å
629	I	92.3	Very high	93.2	Very high	82 Å²	82	31.6 Å²	31.6	42%	0.421	17%	0.17	S	C	.	.	H	α-helix	trans	-57.7	-48.3	175.9	-67.9	165.7	0	0	0	110.3	L625 H626 K627 Q631 I632 T633	L625-I629 HydrophobicContact CD1-CD1 4.3Å; L625-I629 HydrophobicContact CD1-CG1 4.5Å; L625-I629 HydrophobicContact CG-CD1 4.06Å; L625-I629 VanDerWaalsContact O-CG1 3.27Å; L625-I629 WeakPolarHBondContact O-CG1 3.45Å; L625-I629 PolarHBondContact O-N 3.11Å; H626-I629 PolarHBondContact O-N 3.23Å; K627-I629 PolarHBondContact O-N 3.2Å; I629-Q631 PolarHBondContact O-N 2.97Å; I629-I632 WeakPolarHBondContact O-CG1 3.37Å; I629-I632 PolarHBondContact O-N 3.36Å; I629-T633 HydrophobicContact CG2-CG2 4.36Å; I629-T633 WeakPolarHBondContact O-CG2 3.39Å; I629-T633 PolarHBondContact O-N 3.05Å; I629-T633 PolarHBondContact O-OG1 3.09Å; I629-T633 VanDerWaalsContact O-OG1 3.05Å
630	S	90	Very high	92.9	Very high	34 Å²	34	30.5 Å²	30.5	24%	0.238	16%	0.164	C	C	.	.	H	α-helix	trans	-61	-32.2	179.3	-168.1	0	0	0	0	113.3	H626 K627 L628 T633 I634	H626-S630 PolarHBondContact O-N 3.19Å; K627-S630 PolarHBondContact O-N 2.94Å; L628-S630 PolarHBondContact O-N 3.24Å; S630-T633 PolarHBondContact O-OG1 3.25Å; S630-I634 WeakPolarHBondContact O-CG2 3.43Å
631	Q	91	Very high	92.6	Very high	10 Å²	10	31.7 Å²	31.7	5%	0.047	17%	0.168	C	C	.	.	H	α-helix	trans	-77.6	-33	179.1	-73.2	-179.5	-26.3	0	0	113.1	K627 L628 I629 T633 S929 V930 L931 N935 R975	K627-Q631 WeakPolarHBondContact O-CG 3.33Å; K627-Q631 PolarHBondContact O-N 3.26Å; L628-Q631 PolarHBondContact O-N 3.29Å; I629-Q631 PolarHBondContact O-N 2.97Å; Q631-T633 VanDerWaalsContact C-N 3.35Å; Q631-S929 PolarHBondContact NE2-O 2.72Å; Q631-V930 WeakPolarHBondContact CG-O 3.09Å; Q631-L931 PolarHBondContact NE2-O 2.8Å; Q631-N935 PolarHBondContact NE2-ND2 3.49Å; Q631-R975 PolarHBondContact O-NH2 3.35Å
632	I	90	Very high	92.3	Very high	28 Å²	28	31.2 Å²	31.2	14%	0.144	16%	0.162	C	C	.	.	H	α-helix	trans	-82.7	-12.1	178.5	61.7	174	0	0	0	113.2	L628 I629 V978 N982	L628-I632 WeakPolarHBondContact O-CG1 3.46Å; L628-I632 PolarHBondContact O-N 2.91Å; L628-I632 VanDerWaalsContact O-N 3.07Å; I629-I632 WeakPolarHBondContact O-CG1 3.37Å; I629-I632 PolarHBondContact O-N 3.36Å; I632-V978 HydrophobicContact CB-CG1 4.14Å; I632-V978 HydrophobicContact CD1-CB 4.47Å; I632-V978 HydrophobicContact CD1-CG1 3.82Å; I632-V978 HydrophobicContact CG1-CG1 4.43Å; I632-V978 HydrophobicContact CG2-CB 4.45Å; I632-N982 WeakPolarHBondContact O-CB 3.36Å; I632-N982 PolarHBondContact O-ND2 3.34Å
633	T	89.5	Confident	91.8	Very high	84 Å²	84	35.6 Å²	35.6	52%	0.515	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	12.5	-179.9	60.7	0	0	0	0	114.2	I629 S630 Q631	I629-T633 HydrophobicContact CG2-CG2 4.36Å; I629-T633 WeakPolarHBondContact O-CG2 3.39Å; I629-T633 PolarHBondContact O-N 3.05Å; I629-T633 PolarHBondContact O-OG1 3.09Å; I629-T633 VanDerWaalsContact O-OG1 3.05Å; S630-T633 PolarHBondContact O-OG1 3.25Å; Q631-T633 VanDerWaalsContact C-N 3.35Å
634	I	90.9	Very high	91.1	Very high	8 Å²	8	37.1 Å²	37.1	4%	0.041	19%	0.185	C	C	.	.			trans	-62.6	146.9	179.7	59.7	172.1	0	0	0	111.9	S630 V636 W677 V930 N982	S630-I634 WeakPolarHBondContact O-CG2 3.43Å; I634-V636 HydrophobicContact CD1-CG2 3.41Å; I634-V636 VanDerWaalsContact CD1-CG2 3.41Å; I634-V636 HydrophobicContact CG1-CG2 3.7Å; I634-W677 HydrophobicContact CD1-CZ2 3.95Å; I634-V930 HydrophobicContact CB-CG1 4.3Å; I634-V930 HydrophobicContact CD1-CG1 3.31Å; I634-V930 HydrophobicContact CG1-CG1 4.25Å; I634-V930 HydrophobicContact CG2-CG1 3.57Å; I634-N982 PolarHBondContact O-ND2 3.28Å
635	D	88.8	Confident	90	Very high	21 Å²	21	42.3 Å²	42.3	11%	0.112	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	121.5	168	-74.1	-41.5	0	0	0	108.1	L779 L780 R840 H847 K986	D635-L779 WeakPolarHBondContact O-CA 3.36Å; D635-L780 HydrophobicContact CB-CB 4.13Å; D635-L780 PolarHBondContact N-O 3.21Å; D635-L780 VanDerWaalsContact N-O 3.09Å; D635-L780 PolarHBondContact O-N 3.04Å; D635-R840 IonicContact OD2-CZ 3.71Å; D635-R840 IonicContact OD2-NH1 3.39Å; D635-R840 IonicContact OD2-NH2 3.7Å; D635-R840 PolarHBondContact OD2-NH2 3.24Å; D635-H847 IonicContact OD1-NE2 2.99Å; D635-H847 PolarHBondContact OD1-NE2 2.8Å; D635-K986 WeakPolarHBondContact OD1-CE 3.06Å; D635-K986 IonicContact OD1-NZ 3.64Å; D635-K986 PolarHBondContact OD1-NZ 2.87Å
636	V	90.9	Very high	88.9	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.012	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.8	178.2	-177.6	0	0	0	0	108.8	I634 F638 W677 V777 L779 L983 T987	I634-V636 HydrophobicContact CD1-CG2 3.41Å; I634-V636 VanDerWaalsContact CD1-CG2 3.41Å; I634-V636 HydrophobicContact CG1-CG2 3.7Å; V636-F638 HydrophobicContact CG1-CE1 3.99Å; V636-F638 HydrophobicContact CG1-CZ 4.13Å; V636-W677 HydrophobicContact CG2-CZ2 4.33Å; V636-V777 HydrophobicContact CG1-CG1 4.24Å; V636-L779 HydrophobicContact CB-CD2 3.96Å; V636-L779 HydrophobicContact CG1-CD2 3.65Å; V636-L779 HydrophobicContact CG2-CD2 3.52Å; V636-L983 HydrophobicContact CB-CD1 4.44Å; V636-L983 HydrophobicContact CG1-CD1 4.15Å; V636-T987 HydrophobicContact CG1-CG2 4.33Å; V636-T987 WeakPolarHBondContact O-CG2 3.19Å
637	F	92.1	Very high	87.9	Confident	1 Å²	1	45.3 Å²	45.3	0%	0.004	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.2	173.7	-170	-91.5	0	0	0	111.1	I639 F778 Y874 M877 N878 L881	F637-I639 HydrophobicContact CD1-CG1 3.9Å; F637-I639 HydrophobicContact CE1-CG1 4.12Å; F637-F778 PolarHBondContact N-O 2.98Å; F637-F778 PolarHBondContact O-N 3.42Å; F637-Y874 AromaticContact CE2-CD2 3.62Å; F637-Y874 HydrophobicContact CE2-CD2 3.62Å; F637-Y874 AromaticContact CE2-CE2 3.57Å; F637-Y874 HydrophobicContact CE2-CE2 3.57Å; F637-Y874 AromaticContact CZ-CD2 3.84Å; F637-Y874 HydrophobicContact CZ-CD2 3.84Å; F637-Y874 AromaticContact CZ-CE2 3.59Å; F637-Y874 HydrophobicContact CZ-CE2 3.59Å; F637-M877 HydrophobicContact CD1-CG 4.21Å; F637-M877 HydrophobicContact CD2-CG 3.83Å; F637-M877 HydrophobicContact CE1-CB 4.42Å; F637-M877 HydrophobicContact CE1-CG 3.86Å; F637-M877 HydrophobicContact CE2-CB 3.78Å; F637-M877 HydrophobicContact CE2-CG 3.44Å; F637-M877 VanDerWaalsContact CE2-CG 3.44Å; F637-M877 HydrophobicContact CG-CG 4.19Å; F637-M877 HydrophobicContact CZ-CB 3.67Å; F637-M877 HydrophobicContact CZ-CG 3.47Å; F637-M877 VanDerWaalsContact CZ-CG 3.47Å; F637-N878 HydrophobicContact CE1-CB 4.4Å; F637-N878 HydrophobicContact CZ-CB 4.3Å; F637-L881 HydrophobicContact CB-CD1 4.4Å; F637-L881 HydrophobicContact CD1-CD1 3.29Å; F637-L881 HydrophobicContact CE1-CD1 3.72Å; F637-L881 HydrophobicContact CG-CD1 3.96Å
638	F	93.8	Very high	86.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	119.8	175.8	-59.9	-47.5	0	0	0	110	V636 T670 V673 A674 W677 I775 V777 Y874 L983 T987	V636-F638 HydrophobicContact CG1-CE1 3.99Å; V636-F638 HydrophobicContact CG1-CZ 4.13Å; F638-T670 HydrophobicContact CB-CG2 4.01Å; F638-T670 HydrophobicContact CD2-CG2 3.9Å; F638-T670 HydrophobicContact CG-CG2 4.35Å; F638-V673 HydrophobicContact CD1-CG1 4.27Å; F638-V673 HydrophobicContact CE1-CG1 4.05Å; F638-A674 HydrophobicContact CD2-CB 4.31Å; F638-A674 HydrophobicContact CE2-CB 3.5Å; F638-A674 HydrophobicContact CZ-CB 4.16Å; F638-W677 HydrophobicContact CZ-CB 4.24Å; F638-W677 HydrophobicContact CZ-CG 4.42Å; F638-I775 HydrophobicContact CB-CG2 4.01Å; F638-V777 HydrophobicContact CD1-CB 4.37Å; F638-V777 HydrophobicContact CD1-CG1 3.97Å; F638-V777 HydrophobicContact CD1-CG2 3.95Å; F638-V777 HydrophobicContact CE1-CB 4.48Å; F638-V777 HydrophobicContact CE1-CG1 3.79Å; F638-V777 HydrophobicContact CE1-CG2 3.99Å; F638-Y874 PolarHBondContact O-OH 2.86Å; F638-Y874 VanDerWaalsContact O-OH 3.12Å; F638-L983 HydrophobicContact CE2-CD1 4.04Å; F638-L983 HydrophobicContact CZ-CD1 3.95Å; F638-T987 HydrophobicContact CD2-CG2 3.71Å; F638-T987 HydrophobicContact CE2-CG2 3.66Å; F638-T987 HydrophobicContact CG-CG2 4.47Å; F638-T987 HydrophobicContact CZ-CG2 4.41Å
639	I	93.2	Very high	85.1	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	114.7	178.4	-55.7	168.5	0	0	0	107.9	F637 W641 I775 S776 F778 Y788 N878 L881	F637-I639 HydrophobicContact CD1-CG1 3.9Å; F637-I639 HydrophobicContact CE1-CG1 4.12Å; I639-W641 HydrophobicContact CG2-CD2 4.37Å; I639-W641 HydrophobicContact CG2-CZ2 4.1Å; I639-I775 CarbonylContact O-C 3.57Å; I639-I775 VanDerWaalsContact O-CA 3.29Å; I639-I775 WeakPolarHBondContact O-CA 3.42Å; I639-S776 PolarHBondContact N-O 2.84Å; I639-S776 PolarHBondContact O-N 2.58Å; I639-F778 HydrophobicContact CD1-CB 4.14Å; I639-Y788 HydrophobicContact CD1-CE2 4.14Å; I639-N878 VanDerWaalsContact CA-OD1 3.22Å; I639-N878 WeakPolarHBondContact CA-OD1 3.28Å; I639-N878 WeakPolarHBondContact CG2-OD1 3.32Å; I639-L881 HydrophobicContact CD1-CB 3.67Å; I639-L881 HydrophobicContact CD1-CD1 4.15Å; I639-L881 HydrophobicContact CD1-CG 4.47Å; I639-L881 HydrophobicContact CG1-CB 3.97Å; I639-L881 HydrophobicContact CG1-CD1 3.99Å
640	D	92.3	Very high	83.3	Confident	22 Å²	22	55.3 Å²	55.3	12%	0.118	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	118.2	176.6	-172.1	1.6	0	0	0	110.3	E642 R669 N878	D640-E642 WeakPolarHBondContact OD1-CB 3.45Å; D640-E642 PolarHBondContact OD1-N 3.21Å; D640-R669 VanDerWaalsContact CG-NH2 3.26Å; D640-R669 IonicContact OD1-CZ 2.92Å; D640-R669 VanDerWaalsContact OD1-CZ 3.29Å; D640-R669 IonicContact OD1-NH1 2.97Å; D640-R669 PolarHBondContact OD1-NH1 3.3Å; D640-R669 IonicContact OD1-NH2 3.5Å; D640-R669 PolarHBondContact OD1-NH2 3.03Å; D640-R669 IonicContact OD2-CZ 3.22Å; D640-R669 IonicContact OD2-NH1 3.93Å; D640-R669 IonicContact OD2-NH2 3.91Å; D640-R669 PolarHBondContact OD2-NH2 3.14Å; D640-N878 PolarHBondContact N-OD1 3.05Å; D640-N878 PolarHBondContact O-ND2 2.93Å
641	W	91.7	Very high	81.5	Confident	27 Å²	27	58.3 Å²	58.3	10%	0.102	31%	0.309	C	S	.	.			trans	-90	-4.9	-178.1	-66	102.4	0	0	0	113.8	I639 N774 S776 R792 I885	I639-W641 HydrophobicContact CG2-CD2 4.37Å; I639-W641 HydrophobicContact CG2-CZ2 4.1Å; W641-N774 WeakPolarHBondContact CB-OD1 3.38Å; W641-N774 PolarHBondContact N-O 2.97Å; W641-S776 PolarHBondContact NE1-OG 2.97Å; W641-R792 HydrophobicContact CB-CG 4.4Å; W641-R792 HydrophobicContact CD2-CB 4.34Å; W641-R792 HydrophobicContact CD2-CG 4.15Å; W641-R792 HydrophobicContact CG-CB 4.2Å; W641-R792 HydrophobicContact CG-CG 4.06Å; W641-I885 HydrophobicContact CH2-CB 3.94Å; W641-I885 HydrophobicContact CH2-CG2 3.92Å; W641-I885 HydrophobicContact CZ2-CB 4.28Å; W641-I885 HydrophobicContact CZ2-CG2 4.07Å
642	E	89.9	Confident	79.6	Confident	17 Å²	17	61.5 Å²	61.5	8%	0.079	33%	0.329	C	S	.	.			trans	-69.1	138.3	-176.9	-166.9	70.5	-153.5	0	0	111.7	D640 V665 R669 N774 H797 A798	D640-E642 WeakPolarHBondContact OD1-CB 3.45Å; D640-E642 PolarHBondContact OD1-N 3.21Å; E642-V665 HydrophobicContact CB-CG1 3.71Å; E642-V665 HydrophobicContact CG-CG1 3.8Å; E642-R669 VanDerWaalsContact CB-CZ 3.45Å; E642-N774 PolarHBondContact N-ND2 3.09Å; E642-N774 PolarHBondContact OE2-ND2 3.06Å; E642-H797 WeakPolarHBondContact OE1-CB 3.4Å; E642-H797 WeakPolarHBondContact OE2-CA 3.31Å; E642-A798 PolarHBondContact OE2-N 3.24Å
643	R	84.8	Confident	77.8	Confident	171 Å²	171	69.8 Å²	69.8	65%	0.645	37%	0.367	S	S	*	.			trans	-105.5	144.4	-177.7	-64	-178.9	-179	-176.9	-0.7	110.4	K645	R643-K645 PolarHBondContact O-N 3.36Å
644	P	81.6	Confident	76.2	Confident	62 Å²	62	69.6 Å²	69.6	40%	0.403	38%	0.382	S	S	.	.			trans	-61.5	122.7	177.1	25.3	-34.2	0	0	0	111.1	G646 V663 V665	P644-G646 VanDerWaalsContact C-N 3.33Å; P644-G646 PolarHBondContact O-N 2.77Å; P644-V663 WeakPolarHBondContact CB-O 3.41Å; P644-V665 HydrophobicContact CB-CG2 4.31Å
645	K	72	Confident	74.3	Confident	115 Å²	115	76.9 Å²	76.9	50%	0.5	42%	0.415	S	S	.	.			trans	-78.3	77.2	-179.1	-66.4	-174.5	178.9	-176.6	0	111	R643 V663 D799	R643-K645 PolarHBondContact O-N 3.36Å; K645-V663 WeakPolarHBondContact O-CG2 3.3Å; K645-D799 PolarHBondContact NZ-O 3.42Å
646	G	72.2	Confident	72.4	Confident	46 Å²	46	80.6 Å²	80.6	47%	0.474	46%	0.459	S	S	.	.	S	Bend	trans	88.8	-170.7	173.5	0	0	0	0	0	115.2	P644 V663	P644-G646 VanDerWaalsContact C-N 3.33Å; P644-G646 PolarHBondContact O-N 2.77Å; G646-V663 PolarHBondContact O-N 3.34Å
647	K	73.2	Confident	70.6	Confident	155 Å²	155	82.5 Å²	82.5	67%	0.674	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123	130.5	-176.7	-69.2	176.1	176.5	-175.1	0	110	S660 A661 T662	K647-S660 VanDerWaalsContact CB-OG 3.3Å; K647-S660 WeakPolarHBondContact CB-OG 3.41Å; K647-S660 WeakPolarHBondContact CD-OG 3.23Å; K647-A661 CarbonylContact C-O 3.56Å; K647-A661 WeakPolarHBondContact CA-O 3.46Å; K647-T662 HydrophobicContact CG-CG2 4.21Å
648	V	67.7	Low	68.7	Low	85 Å²	85	87.5 Å²	87.5	52%	0.515	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	139.1	174.5	179.3	0	0	0	0	108.7	K650 A661 V663	V648-K650 PolarHBondContact O-N 2.96Å; V648-A661 PolarHBondContact N-O 3.11Å; V648-A661 PolarHBondContact O-N 2.82Å; V648-V663 HydrophobicContact CG2-CG2 3.46Å; V648-V663 VanDerWaalsContact CG2-CG2 3.46Å
649	L	59.1	Low	67	Low	124 Å²	124	96.9 Å²	96.9	65%	0.649	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	113.4	174.8	-62.7	167.7	0	0	0	108	V658	L649-V658 HydrophobicContact CB-CG1 3.89Å; L649-V658 HydrophobicContact CD2-CG1 3.53Å; L649-V658 HydrophobicContact CG-CG1 4.16Å
650	K	55.5	Low	65.3	Low	149 Å²	149	100 Å²	100	65%	0.648	57%	0.567	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-98.3	120.8	175.2	-133.5	-179.2	-177.9	-175.6	0	108	V648 R659 A661	V648-K650 PolarHBondContact O-N 2.96Å; K650-R659 PolarHBondContact N-O 3.3Å; K650-A661 HydrophobicContact CB-CB 4.4Å
651	A	51	Low	63.9	Low	96 Å²	96	100.9 Å²	100.9	79%	0.793	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-71.2	126.5	169	0	0	0	0	0	108.3
652	V	51.5	Low	62.9	Low	78 Å²	78	103.8 Å²	103.8	47%	0.473	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-90	120.9	174.6	-179.3	0	0	0	0	107.1	G654	V652-G654 PolarHBondContact O-N 2.93Å
653	E	51.6	Low	62.1	Low	201 Å²	201	105.1 Å²	105.1	94%	0.939	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	115.1	167.9	-78.8	-177.4	156.5	0	0	108.7
654	G	56.1	Low	61.7	Low	80 Å²	80	102.5 Å²	102.5	83%	0.825	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	122.9	-22.4	166.8	0	0	0	0	0	117.2	V652	V652-G654 PolarHBondContact O-N 2.93Å
655	E	51.5	Low	61.8	Low	161 Å²	161	102.2 Å²	102.2	75%	0.752	61%	0.609	S	S	*	*	S	Bend	trans	-142.3	128.1	172.7	-75.2	-174	159.9	0	0	109.3	G657	E655-G657 PolarHBondContact O-N 3.32Å
656	G	49.8	Very low	62.4	Low	99 Å²	99	98.6 Å²	98.6	100%	1.021	60%	0.598	S	S	*	*	S	Bend	trans	-67.9	42	-171.6	0	0	0	0	0	116.6
657	G	52.2	Low	63.1	Low	43 Å²	43	100.5 Å²	100.5	44%	0.443	60%	0.597	S	S	.	*			trans	-110.2	119.5	173.6	0	0	0	0	0	111.9	E655 R659	E655-G657 PolarHBondContact O-N 3.32Å; G657-R659 PolarHBondContact O-N 3.23Å
658	V	51.8	Low	63.8	Low	105 Å²	105	100.7 Å²	100.7	64%	0.636	59%	0.593	S	S	*	*			trans	-73.7	109.1	170.7	-175.5	0	0	0	0	108.8	L649	L649-V658 HydrophobicContact CB-CG1 3.89Å; L649-V658 HydrophobicContact CD2-CG1 3.53Å; L649-V658 HydrophobicContact CG-CG1 4.16Å
659	R	58.2	Low	64.9	Low	197 Å²	197	97.6 Å²	97.6	74%	0.743	57%	0.572	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.6	127.4	171.2	-76	-173.6	177.5	174.1	2.9	109.9	K650 G657 A661	K650-R659 PolarHBondContact N-O 3.3Å; G657-R659 PolarHBondContact O-N 3.23Å; R659-A661 PolarHBondContact O-N 2.92Å
660	S	57	Low	66.4	Low	67 Å²	67	91.9 Å²	91.9	47%	0.469	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	111.8	173.6	-171.5	0	0	0	0	108.9	K647	K647-S660 VanDerWaalsContact CB-OG 3.3Å; K647-S660 WeakPolarHBondContact CB-OG 3.41Å; K647-S660 WeakPolarHBondContact CD-OG 3.23Å
661	A	63.7	Low	68.1	Low	40 Å²	40	86.3 Å²	86.3	33%	0.331	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.4	178.1	0	0	0	0	0	109.2	K647 V648 K650 R659	K647-A661 CarbonylContact C-O 3.56Å; K647-A661 WeakPolarHBondContact CA-O 3.46Å; V648-A661 PolarHBondContact N-O 3.11Å; V648-A661 PolarHBondContact O-N 2.82Å; K650-A661 HydrophobicContact CB-CB 4.4Å; R659-A661 PolarHBondContact O-N 2.92Å
662	T	71.4	Confident	70	Confident	88 Å²	88	86.7 Å²	86.7	54%	0.54	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	143.3	175.3	47.2	0	0	0	0	110.7	K647	K647-T662 HydrophobicContact CG-CG2 4.21Å
663	V	73.2	Confident	71.9	Confident	45 Å²	45	83 Å²	83	27%	0.273	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-58.4	129.1	173.3	176.5	0	0	0	0	109	P644 K645 G646 V648	P644-V663 WeakPolarHBondContact CB-O 3.41Å; K645-V663 WeakPolarHBondContact O-CG2 3.3Å; G646-V663 PolarHBondContact O-N 3.34Å; V648-V663 HydrophobicContact CG2-CG2 3.46Å; V648-V663 VanDerWaalsContact CG2-CG2 3.46Å
664	P	76.4	Confident	73.9	Confident	116 Å²	116	73.4 Å²	73.4	75%	0.753	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-66.5	143	178.3	27.8	-34	0	0	0	111
665	V	83.1	Confident	75.6	Confident	57 Å²	57	71 Å²	71	35%	0.345	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-79.2	142.1	175.5	174.6	0	0	0	0	109.7	E642 P644	E642-V665 HydrophobicContact CB-CG1 3.71Å; E642-V665 HydrophobicContact CG-CG1 3.8Å; P644-V665 HydrophobicContact CB-CG2 4.31Å
666	S	84.6	Confident	77.6	Confident	38 Å²	38	65.6 Å²	65.6	27%	0.266	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-69.7	130.9	177	-177.6	0	0	0	0	111.5	W668 R669 D799	S666-W668 PolarHBondContact OG-N 2.93Å; S666-R669 PolarHBondContact O-NH2 2.88Å; S666-D799 VanDerWaalsContact CB-OD2 3.26Å; S666-D799 WeakPolarHBondContact CB-OD2 3.49Å
667	I	86.3	Confident	79.6	Confident	86 Å²	86	60.9 Å²	60.9	44%	0.441	33%	0.329	S	S	.	.	S	Bend	trans	-84.8	-13.5	176.9	-167.8	164.1	0	0	0	113.4	R669 T670 Y671	I667-R669 VanDerWaalsContact C-N 3.25Å; I667-R669 PolarHBondContact O-N 3.38Å; I667-R669 VanDerWaalsContact O-N 3.17Å; I667-T670 WeakPolarHBondContact O-CB 3.46Å; I667-T670 PolarHBondContact O-N 3.05Å; I667-Y671 HydrophobicContact CB-CE2 4.38Å; I667-Y671 HydrophobicContact CD1-CE2 4.18Å; I667-Y671 HydrophobicContact CG1-CD2 4.34Å; I667-Y671 HydrophobicContact CG1-CE2 4.01Å; I667-Y671 HydrophobicContact CG2-CD2 4Å; I667-Y671 HydrophobicContact CG2-CE2 3.55Å; I667-Y671 PolarHBondContact O-N 3.22Å
668	W	87.8	Confident	81.5	Confident	160 Å²	160	59 Å²	59	61%	0.606	31%	0.309	S	S	*	.	H	α-helix	trans	-59.1	-33.5	-171.2	-71.5	112	0	0	0	113.8	S666 T670 Y671 F672 F993	S666-W668 PolarHBondContact OG-N 2.93Å; W668-T670 VanDerWaalsContact C-N 3.31Å; W668-T670 PolarHBondContact O-N 3.36Å; W668-Y671 AromaticContact CE3-CD2 3.93Å; W668-Y671 HydrophobicContact CE3-CD2 3.93Å; W668-Y671 HydrophobicContact CZ3-CD2 4.26Å; W668-Y671 PolarHBondContact O-N 2.95Å; W668-F672 PolarHBondContact O-N 3.49Å; W668-F993 HydrophobicContact CH2-CD1 4.36Å; W668-F993 AromaticContact CH2-CE1 3.61Å; W668-F993 HydrophobicContact CH2-CE1 3.61Å; W668-F993 HydrophobicContact CH2-CZ 4.18Å; W668-F993 AromaticContact CZ3-CD1 3.88Å; W668-F993 HydrophobicContact CZ3-CD1 3.88Å; W668-F993 AromaticContact CZ3-CE1 3.6Å; W668-F993 HydrophobicContact CZ3-CE1 3.6Å; W668-F993 HydrophobicContact CZ3-CZ 4.42Å
669	R	90.8	Very high	83.4	Confident	19 Å²	19	58.3 Å²	58.3	7%	0.072	30%	0.298	C	S	.	.	H	α-helix	trans	-60.6	-42.2	175.3	-65	177.6	-67.6	103.2	16.1	111.3	D640 E642 S666 I667 F672 V673 S773 I775 D799	D640-R669 VanDerWaalsContact CG-NH2 3.26Å; D640-R669 IonicContact OD1-CZ 2.92Å; D640-R669 VanDerWaalsContact OD1-CZ 3.29Å; D640-R669 IonicContact OD1-NH1 2.97Å; D640-R669 PolarHBondContact OD1-NH1 3.3Å; D640-R669 IonicContact OD1-NH2 3.5Å; D640-R669 PolarHBondContact OD1-NH2 3.03Å; D640-R669 IonicContact OD2-CZ 3.22Å; D640-R669 IonicContact OD2-NH1 3.93Å; D640-R669 IonicContact OD2-NH2 3.91Å; D640-R669 PolarHBondContact OD2-NH2 3.14Å; E642-R669 VanDerWaalsContact CB-CZ 3.45Å; S666-R669 PolarHBondContact O-NH2 2.88Å; I667-R669 VanDerWaalsContact C-N 3.25Å; I667-R669 PolarHBondContact O-N 3.38Å; I667-R669 VanDerWaalsContact O-N 3.17Å; R669-F672 PolarHBondContact O-N 3.37Å; R669-V673 WeakPolarHBondContact O-CG2 3.23Å; R669-V673 PolarHBondContact O-N 2.97Å; R669-S773 WeakPolarHBondContact CD-O 3.12Å; R669-S773 PolarHBondContact NH1-O 2.91Å; R669-I775 HydrophobicContact CB-CD1 3.54Å; R669-I775 WeakPolarHBondContact O-CD1 3.41Å; R669-D799 WeakPolarHBondContact CD-OD1 3.49Å; R669-D799 IonicContact NE-OD1 2.6Å; R669-D799 PolarHBondContact NE-OD1 3.31Å; R669-D799 IonicContact NE-OD2 3.59Å
670	T	90.3	Very high	85	Confident	4 Å²	4	49.1 Å²	49.1	3%	0.025	26%	0.264	C	S	.	.	H	α-helix	trans	-66.3	-39.8	177	-53.1	0	0	0	0	111.5	F638 I667 W668 F672 A674 I775 V989	F638-T670 HydrophobicContact CB-CG2 4.01Å; F638-T670 HydrophobicContact CD2-CG2 3.9Å; F638-T670 HydrophobicContact CG-CG2 4.35Å; I667-T670 WeakPolarHBondContact O-CB 3.46Å; I667-T670 PolarHBondContact O-N 3.05Å; W668-T670 VanDerWaalsContact C-N 3.31Å; W668-T670 PolarHBondContact O-N 3.36Å; T670-F672 VanDerWaalsContact C-N 3.34Å; T670-A674 WeakPolarHBondContact O-CB 3.11Å; T670-A674 PolarHBondContact O-N 2.93Å; T670-I775 VanDerWaalsContact N-CD1 3.27Å; T670-V989 HydrophobicContact CG2-CG2 4.27Å
671	Y	91.1	Very high	86.6	Confident	33 Å²	33	46.1 Å²	46.1	13%	0.129	24%	0.242	C	C	.	.	H	α-helix	trans	-62.9	-41.1	172.8	-71.2	-45	0	0	0	112.4	I667 W668 A674 N675 V989 F993	I667-Y671 HydrophobicContact CB-CE2 4.38Å; I667-Y671 HydrophobicContact CD1-CE2 4.18Å; I667-Y671 HydrophobicContact CG1-CD2 4.34Å; I667-Y671 HydrophobicContact CG1-CE2 4.01Å; I667-Y671 HydrophobicContact CG2-CD2 4Å; I667-Y671 HydrophobicContact CG2-CE2 3.55Å; I667-Y671 PolarHBondContact O-N 3.22Å; W668-Y671 AromaticContact CE3-CD2 3.93Å; W668-Y671 HydrophobicContact CE3-CD2 3.93Å; W668-Y671 HydrophobicContact CZ3-CD2 4.26Å; W668-Y671 PolarHBondContact O-N 2.95Å; Y671-A674 PolarHBondContact O-N 3.25Å; Y671-N675 WeakPolarHBondContact O-CB 3.34Å; Y671-N675 PolarHBondContact O-N 2.92Å; Y671-V989 HydrophobicContact CD1-CB 4.15Å; Y671-V989 HydrophobicContact CD1-CG1 3.54Å; Y671-V989 HydrophobicContact CD1-CG2 3.92Å; Y671-V989 HydrophobicContact CE1-CB 3.99Å; Y671-V989 HydrophobicContact CE1-CG1 3.66Å; Y671-V989 HydrophobicContact CE1-CG2 4Å; Y671-F993 HydrophobicContact CD1-CB 3.92Å; Y671-F993 HydrophobicContact CD1-CD2 4.29Å; Y671-F993 HydrophobicContact CD1-CG 4.26Å; Y671-F993 HydrophobicContact CD2-CD2 4.41Å; Y671-F993 HydrophobicContact CD2-CG 4.34Å; Y671-F993 HydrophobicContact CE1-CB 4.3Å; Y671-F993 AromaticContact CE1-CD2 3.9Å; Y671-F993 HydrophobicContact CE1-CD2 3.9Å; Y671-F993 HydrophobicContact CE1-CG 4.33Å; Y671-F993 HydrophobicContact CE2-CD2 4.01Å; Y671-F993 HydrophobicContact CE2-CE2 4.13Å; Y671-F993 HydrophobicContact CE2-CG 4.39Å; Y671-F993 HydrophobicContact CG-CB 4.15Å; Y671-F993 HydrophobicContact CG-CG 4.29Å; Y671-F993 AromaticContact CZ-CD2 3.75Å
672	F	90.6	Very high	87.9	Confident	104 Å²	104	45.6 Å²	45.6	46%	0.456	24%	0.235	S	C	.	.	H	α-helix	trans	-62.5	-50.2	178.8	-167.3	-97.6	0	0	0	111.8	W668 R669 T670 A674 N675 E676 L769	W668-F672 PolarHBondContact O-N 3.49Å; R669-F672 PolarHBondContact O-N 3.37Å; T670-F672 VanDerWaalsContact C-N 3.34Å; F672-A674 VanDerWaalsContact C-N 3.32Å; F672-A674 PolarHBondContact O-N 2.87Å; F672-N675 PolarHBondContact O-N 3.13Å; F672-E676 HydrophobicContact CD1-CG 4.5Å; F672-E676 HydrophobicContact CE1-CG 4.15Å; F672-E676 HydrophobicContact CZ-CG 4.45Å; F672-E676 WeakPolarHBondContact O-CG 3.18Å; F672-E676 PolarHBondContact O-N 2.9Å; F672-E676 VanDerWaalsContact O-N 3.08Å; F672-L769 HydrophobicContact CD1-CD1 3.65Å; F672-L769 HydrophobicContact CD1-CD2 3.71Å; F672-L769 HydrophobicContact CD1-CG 4.12Å; F672-L769 HydrophobicContact CE1-CD1 3.33Å; F672-L769 HydrophobicContact CE1-CD2 3.45Å; F672-L769 VanDerWaalsContact CE1-CD2 3.45Å; F672-L769 HydrophobicContact CE1-CG 3.95Å
673	V	93.3	Very high	88.9	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.1	-38.4	176.5	175.2	0	0	0	0	111.6	F638 R669 N675 W677 F766 I775 V777	F638-V673 HydrophobicContact CD1-CG1 4.27Å; F638-V673 HydrophobicContact CE1-CG1 4.05Å; R669-V673 WeakPolarHBondContact O-CG2 3.23Å; R669-V673 PolarHBondContact O-N 2.97Å; V673-N675 VanDerWaalsContact C-N 3.35Å; V673-W677 WeakPolarHBondContact O-CB 3.49Å; V673-W677 PolarHBondContact O-N 3.1Å; V673-F766 HydrophobicContact CG1-CE2 4.03Å; V673-F766 HydrophobicContact CG1-CZ 4.01Å; V673-I775 HydrophobicContact CB-CD1 4.46Å; V673-I775 HydrophobicContact CG1-CG2 4.33Å; V673-I775 HydrophobicContact CG2-CB 4.28Å; V673-I775 HydrophobicContact CG2-CD1 3.94Å; V673-I775 HydrophobicContact CG2-CG2 4.43Å; V673-V777 HydrophobicContact CG1-CG2 4.37Å
674	A	93.1	Very high	89.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.9	-38.4	176.7	0	0	0	0	0	112.6	F638 T670 Y671 F672 W677 N678 L983 V989 L994	F638-A674 HydrophobicContact CD2-CB 4.31Å; F638-A674 HydrophobicContact CE2-CB 3.5Å; F638-A674 HydrophobicContact CZ-CB 4.16Å; T670-A674 WeakPolarHBondContact O-CB 3.11Å; T670-A674 PolarHBondContact O-N 2.93Å; Y671-A674 PolarHBondContact O-N 3.25Å; F672-A674 VanDerWaalsContact C-N 3.32Å; F672-A674 PolarHBondContact O-N 2.87Å; A674-W677 PolarHBondContact O-N 3.39Å; A674-N678 PolarHBondContact O-N 3.38Å; A674-L983 HydrophobicContact CB-CD2 4.37Å; A674-L983 WeakPolarHBondContact O-CD2 3.37Å; A674-V989 HydrophobicContact CB-CG1 4.18Å; A674-V989 HydrophobicContact CB-CG2 3.94Å; A674-L994 HydrophobicContact CB-CD2 3.85Å
675	N	92.1	Very high	90.4	Very high	28 Å²	28	39.3 Å²	39.3	15%	0.15	19%	0.187	C	C	.	.	H	α-helix	trans	-65.4	-47.9	177.5	-167.9	56.1	0	0	0	111.2	Y671 F672 V673 W677 N678 E679 I995	Y671-N675 WeakPolarHBondContact O-CB 3.34Å; Y671-N675 PolarHBondContact O-N 2.92Å; F672-N675 PolarHBondContact O-N 3.13Å; V673-N675 VanDerWaalsContact C-N 3.35Å; N675-W677 VanDerWaalsContact C-N 3.31Å; N675-W677 PolarHBondContact O-N 3.29Å; N675-N678 WeakPolarHBondContact O-CA 3.12Å; N675-N678 VanDerWaalsContact O-CB 3.28Å; N675-N678 WeakPolarHBondContact O-CB 3.29Å; N675-N678 PolarHBondContact O-N 3.05Å; N675-E679 PolarHBondContact O-N 3.43Å; N675-I995 PolarHBondContact OD1-N 3.47Å
676	E	92.4	Very high	90.8	Very high	48 Å²	48	36.9 Å²	36.9	22%	0.224	17%	0.172	C	C	.	.	H	α-helix	trans	-64	-37.4	176.8	-66.5	-64.7	143	0	0	111.7	F672 N678 E679 I680 F766 L769	F672-E676 HydrophobicContact CD1-CG 4.5Å; F672-E676 HydrophobicContact CE1-CG 4.15Å; F672-E676 HydrophobicContact CZ-CG 4.45Å; F672-E676 WeakPolarHBondContact O-CG 3.18Å; F672-E676 PolarHBondContact O-N 2.9Å; F672-E676 VanDerWaalsContact O-N 3.08Å; E676-N678 VanDerWaalsContact C-N 3.29Å; E676-N678 PolarHBondContact O-N 3.39Å; E676-E679 PolarHBondContact O-N 3.3Å; E676-I680 WeakPolarHBondContact O-CG1 3.45Å; E676-I680 PolarHBondContact O-N 3.46Å; E676-I680 VanDerWaalsContact O-N 3.11Å; E676-F766 HydrophobicContact CB-CD2 4.03Å; E676-F766 HydrophobicContact CB-CE2 4.24Å; E676-L769 HydrophobicContact CB-CD2 3.87Å; E676-L769 HydrophobicContact CG-CD2 3.5Å
677	W	92.4	Very high	91.2	Very high	1 Å²	1	39.6 Å²	39.6	0%	0.004	18%	0.183	C	C	.	.	H	α-helix	trans	-61.6	-37.8	171.6	179.4	-93.8	0	0	0	112.1	I634 V636 F638 V673 A674 N675 I680 Q681 F766 L779 F927 L931	I634-W677 HydrophobicContact CD1-CZ2 3.95Å; V636-W677 HydrophobicContact CG2-CZ2 4.33Å; F638-W677 HydrophobicContact CZ-CB 4.24Å; F638-W677 HydrophobicContact CZ-CG 4.42Å; V673-W677 WeakPolarHBondContact O-CB 3.49Å; V673-W677 PolarHBondContact O-N 3.1Å; A674-W677 PolarHBondContact O-N 3.39Å; N675-W677 VanDerWaalsContact C-N 3.31Å; N675-W677 PolarHBondContact O-N 3.29Å; W677-I680 HydrophobicContact CE3-CD1 3.95Å; W677-I680 HydrophobicContact CZ3-CD1 4.4Å; W677-I680 WeakPolarHBondContact O-CG1 3.38Å; W677-Q681 VanDerWaalsContact CD1-NE2 3.29Å; W677-Q681 WeakPolarHBondContact O-CG 3.43Å; W677-F766 HydrophobicContact CB-CE2 3.93Å; W677-F766 HydrophobicContact CB-CZ 4.06Å; W677-F766 HydrophobicContact CD2-CZ 4.37Å; W677-F766 HydrophobicContact CE3-CD1 4.44Å; W677-F766 AromaticContact CE3-CE1 3.61Å; W677-F766 HydrophobicContact CE3-CE1 3.61Å; W677-F766 HydrophobicContact CE3-CE2 4.28Å; W677-F766 AromaticContact CE3-CZ 3.53Å; W677-F766 HydrophobicContact CE3-CZ 3.53Å; W677-F766 HydrophobicContact CZ3-CE1 4Å; W677-F766 HydrophobicContact CZ3-CZ 4.36Å; W677-L779 HydrophobicContact CH2-CD1 3.54Å; W677-L779 HydrophobicContact CH2-CD2 3.62Å; W677-L779 HydrophobicContact CH2-CG 4.25Å; W677-L779 HydrophobicContact CZ2-CD1 4.46Å; W677-L779 HydrophobicContact CZ2-CD2 3.75Å; W677-L779 HydrophobicContact CZ3-CD1 3.96Å; W677-L779 HydrophobicContact CZ3-CD2 4.34Å; W677-F927 HydrophobicContact CH2-CD2 4.42Å; W677-F927 HydrophobicContact CZ3-CD2 4.12Å; W677-F927 HydrophobicContact CZ3-CE2 4.14Å; W677-L931 HydrophobicContact CH2-CD2 4.14Å; W677-L931 HydrophobicContact CZ2-CD2 4.09Å
678	N	92	Very high	91.4	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-65.2	-42.3	176.8	-166.9	58.5	0	0	0	111.4	A674 N675 E676 Q681 L983 L994 I995	A674-N678 PolarHBondContact O-N 3.38Å; N675-N678 WeakPolarHBondContact O-CA 3.12Å; N675-N678 VanDerWaalsContact O-CB 3.28Å; N675-N678 WeakPolarHBondContact O-CB 3.29Å; N675-N678 PolarHBondContact O-N 3.05Å; E676-N678 VanDerWaalsContact C-N 3.29Å; E676-N678 PolarHBondContact O-N 3.39Å; N678-Q681 WeakPolarHBondContact O-CG 3.45Å; N678-Q681 PolarHBondContact O-N 2.89Å; N678-L983 HydrophobicContact CB-CD2 4.28Å; N678-L994 HydrophobicContact CB-CD2 4.46Å; N678-I995 PolarHBondContact ND2-O 3.12Å
679	E	90.8	Very high	91.7	Very high	91 Å²	91	32.8 Å²	32.8	43%	0.425	16%	0.161	S	C	.	.	H	α-helix	trans	-62.1	-47.7	178.6	-170.8	177	151.7	0	0	111.9	N675 E676 Q681 K762	N675-E679 PolarHBondContact O-N 3.43Å; E676-E679 PolarHBondContact O-N 3.3Å; E679-Q681 PolarHBondContact O-N 3.47Å; E679-Q681 VanDerWaalsContact O-N 3.16Å; E679-K762 IonicContact OE1-NZ 3.82Å
680	I	92	Very high	91.9	Very high	3 Å²	3	37.2 Å²	37.2	2%	0.015	18%	0.181	C	C	.	.	H	α-helix	trans	-70.9	-11.2	-175.5	66.9	177.1	0	0	0	114.5	E676 W677 T682 V683 F766 L931	E676-I680 WeakPolarHBondContact O-CG1 3.45Å; E676-I680 PolarHBondContact O-N 3.46Å; E676-I680 VanDerWaalsContact O-N 3.11Å; W677-I680 HydrophobicContact CE3-CD1 3.95Å; W677-I680 HydrophobicContact CZ3-CD1 4.4Å; W677-I680 WeakPolarHBondContact O-CG1 3.38Å; I680-T682 VanDerWaalsContact C-N 3.27Å; I680-T682 PolarHBondContact O-N 2.99Å; I680-V683 PolarHBondContact O-N 2.92Å; I680-F766 HydrophobicContact CD1-CB 4.17Å; I680-F766 HydrophobicContact CD1-CD1 4.01Å; I680-F766 HydrophobicContact CD1-CD2 3.96Å; I680-F766 HydrophobicContact CD1-CE1 4.45Å; I680-F766 HydrophobicContact CD1-CE2 4.41Å; I680-F766 HydrophobicContact CD1-CG 3.75Å; I680-L931 HydrophobicContact CB-CD1 4.42Å; I680-L931 HydrophobicContact CD1-CD1 3.9Å; I680-L931 HydrophobicContact CG1-CD1 4.01Å
681	Q	90.9	Very high	92.2	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.019	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-35	-174.9	-58.5	-166	4.7	0	0	113.9	W677 N678 E679 Y932	W677-Q681 VanDerWaalsContact CD1-NE2 3.29Å; W677-Q681 WeakPolarHBondContact O-CG 3.43Å; N678-Q681 WeakPolarHBondContact O-CG 3.45Å; N678-Q681 PolarHBondContact O-N 2.89Å; E679-Q681 PolarHBondContact O-N 3.47Å; E679-Q681 VanDerWaalsContact O-N 3.16Å; Q681-Y932 PolarHBondContact O-N 2.79Å
682	T	91.7	Very high	92.4	Very high	29 Å²	29	35.9 Å²	35.9	18%	0.178	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	4.6	-173.9	63.6	0	0	0	0	113.8	I680 R684 R972 R975 N976	I680-T682 VanDerWaalsContact C-N 3.27Å; I680-T682 PolarHBondContact O-N 2.99Å; T682-R684 PolarHBondContact O-N 3.37Å; T682-R972 HydrophobicContact CG2-CG 4.38Å; T682-R975 HydrophobicContact CG2-CB 4.15Å; T682-R975 HydrophobicContact CG2-CG 3.84Å; T682-N976 HydrophobicContact CG2-CB 4.01Å
683	V	91.1	Very high	92.7	Very high	35 Å²	35	35.7 Å²	35.7	21%	0.212	18%	0.179	C	C	.	.			trans	-63.6	127.2	175.7	176.8	0	0	0	0	109.5	I680 Y933	I680-V683 PolarHBondContact O-N 2.92Å; V683-Y933 HydrophobicContact CG1-CD2 4.19Å; V683-Y933 WeakPolarHBondContact O-CA 3.44Å; V683-Y933 PolarHBondContact O-N 2.87Å; V683-Y933 VanDerWaalsContact O-N 3.1Å
684	R	91.9	Very high	92.9	Very high	38 Å²	38	36.8 Å²	36.8	14%	0.143	19%	0.186	C	C	.	.			trans	-114.6	155.1	176.1	-72.4	-173.7	70.8	170.4	0.3	109.5	T682 I686 Y932 E936 L939 D943	T682-R684 PolarHBondContact O-N 3.37Å; R684-I686 VanDerWaalsContact C-N 3.29Å; R684-I686 WeakPolarHBondContact CB-O 3.4Å; R684-Y932 HydrophobicContact CG-CD2 4.22Å; R684-E936 WeakPolarHBondContact CB-OE2 3.29Å; R684-E936 IonicContact CZ-OE1 2.92Å; R684-E936 VanDerWaalsContact CZ-OE1 3.3Å; R684-E936 IonicContact NE-OE1 3.98Å; R684-E936 PolarHBondContact NE-OE1 2.97Å; R684-E936 VanDerWaalsContact NE-OE1 3.07Å; R684-E936 IonicContact NE-OE2 2.77Å; R684-E936 IonicContact NH2-OE1 3.74Å; R684-E936 PolarHBondContact NH2-OE1 3.15Å; R684-L939 HydrophobicContact CG-CD1 4.28Å; R684-L939 VanDerWaalsContact NH2-CB 3.3Å; R684-D943 IonicContact CZ-OD2 3.47Å; R684-D943 IonicContact NH1-OD2 3.93Å; R684-D943 PolarHBondContact NH1-OD2 2.85Å; R684-D943 IonicContact NH2-OD2 3.72Å; R684-D943 PolarHBondContact NH2-OD2 3.3Å
685	K	90	Very high	93.1	Very high	44 Å²	44	36.8 Å²	36.8	19%	0.191	19%	0.186	C	C	.	.	S	Bend	trans	-76.2	-23.5	173.2	-58.9	-169.1	178.1	-129.8	0	111.9	F751 E756 Y933 E936	K685-F751 HydrophobicContact CB-CB 4.41Å; K685-F751 HydrophobicContact CB-CD1 3.77Å; K685-F751 HydrophobicContact CB-CE1 4.29Å; K685-F751 HydrophobicContact CB-CG 4.1Å; K685-F751 HydrophobicContact CD-CD1 4.13Å; K685-F751 HydrophobicContact CG-CD1 3.76Å; K685-F751 HydrophobicContact CG-CE1 3.96Å; K685-E756 IonicContact NZ-OE1 2.71Å; K685-E756 PolarHBondContact NZ-OE1 2.86Å; K685-E756 IonicContact NZ-OE2 4Å; K685-Y933 HydrophobicContact CG-CD2 4.19Å; K685-Y933 HydrophobicContact CG-CE2 4.06Å; K685-E936 HydrophobicContact CB-CG 4.26Å; K685-E936 PolarHBondContact N-OE2 3.42Å
686	I	92.1	Very high	93.3	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.036	19%	0.188	C	C	.	.	S	Bend	trans	-105.4	136.4	-178.8	-60.1	-179.6	0	0	0	109.3	R684 S688 Q691 Q747 I748 E936 L940	R684-I686 VanDerWaalsContact C-N 3.29Å; R684-I686 WeakPolarHBondContact CB-O 3.4Å; I686-S688 PolarHBondContact O-N 3.41Å; I686-Q691 HydrophobicContact CG2-CB 4.07Å; I686-Q691 HydrophobicContact CG2-CG 4.44Å; I686-Q747 HydrophobicContact CG1-CB 4.21Å; I686-Q747 HydrophobicContact CG2-CB 4.46Å; I686-I748 HydrophobicContact CD1-CD1 3.87Å; I686-I748 HydrophobicContact CD1-CG1 3.8Å; I686-I748 HydrophobicContact CG1-CD1 4.4Å; I686-I748 HydrophobicContact CG1-CG1 3.78Å; I686-E936 HydrophobicContact CD1-CG 3.85Å; I686-E936 WeakPolarHBondContact CD1-OE1 3.15Å; I686-E936 HydrophobicContact CG1-CG 3.93Å; I686-L940 HydrophobicContact CD1-CD1 3.78Å; I686-L940 HydrophobicContact CD1-CD2 4.23Å; I686-L940 HydrophobicContact CD1-CG 4.4Å
687	N	93.2	Very high	93.5	Very high	94 Å²	94	39.4 Å²	39.4	50%	0.503	20%	0.197	S	C	.	.			trans	-81.3	111.6	169.2	-176.6	-52.9	0	0	0	109.7	L689 F690 Q691	N687-L689 PolarHBondContact O-N 3.3Å; N687-L689 PolarHBondContact OD1-N 3.25Å; N687-L689 VanDerWaalsContact OD1-N 3.1Å; N687-F690 HydrophobicContact CB-CB 3.91Å; N687-F690 PolarHBondContact O-N 2.9Å; N687-F690 PolarHBondContact OD1-N 3.47Å; N687-Q691 WeakPolarHBondContact O-CB 3.28Å; N687-Q691 PolarHBondContact O-N 3.46Å
688	S	90.5	Very high	93.7	Very high	22 Å²	22	42.7 Å²	42.7	15%	0.154	21%	0.212	C	C	.	.	H	α-helix	trans	-55.4	-45.8	-178.2	-75.9	0	0	0	0	114	I686 Q691 V692 Q968	I686-S688 PolarHBondContact O-N 3.41Å; S688-Q691 PolarHBondContact O-N 3.34Å; S688-V692 WeakPolarHBondContact O-CG2 3.01Å; S688-V692 PolarHBondContact O-N 2.92Å; S688-Q968 PolarHBondContact OG-OE1 2.92Å
689	L	94	Very high	93.9	Very high	82 Å²	82	42.6 Å²	42.6	43%	0.429	21%	0.211	S	C	.	.	H	α-helix	trans	-66.9	-46.3	-179.5	-179.9	65.5	0	0	0	111	N687 Q691 V692 L693 Y965	N687-L689 PolarHBondContact O-N 3.3Å; N687-L689 PolarHBondContact OD1-N 3.25Å; N687-L689 VanDerWaalsContact OD1-N 3.1Å; L689-Q691 VanDerWaalsContact C-N 3.33Å; L689-Q691 PolarHBondContact O-N 2.97Å; L689-V692 PolarHBondContact O-N 3.12Å; L689-L693 HydrophobicContact CD1-CD1 3.88Å; L689-L693 HydrophobicContact CD1-CG 4.1Å; L689-L693 HydrophobicContact CD2-CD1 4.49Å; L689-L693 HydrophobicContact CG-CD1 3.85Å; L689-L693 HydrophobicContact CG-CG 4.39Å; L689-L693 WeakPolarHBondContact O-CB 3.39Å; L689-L693 WeakPolarHBondContact O-CG 3.32Å; L689-L693 PolarHBondContact O-N 2.86Å; L689-Y965 HydrophobicContact CB-CE2 4.16Å; L689-Y965 HydrophobicContact CD1-CD2 4.35Å; L689-Y965 HydrophobicContact CD1-CE2 4.02Å
690	F	95.4	Very high	94.1	Very high	111 Å²	111	40.7 Å²	40.7	49%	0.487	20%	0.202	S	C	.	.	H	α-helix	trans	-62.4	-40.4	178.5	-178.4	-102.9	0	0	0	111.8	N687 T694 Q747	N687-F690 HydrophobicContact CB-CB 3.91Å; N687-F690 PolarHBondContact O-N 2.9Å; N687-F690 PolarHBondContact OD1-N 3.47Å; F690-T694 WeakPolarHBondContact O-CB 3.03Å; F690-T694 PolarHBondContact O-N 3.34Å; F690-T694 PolarHBondContact O-OG1 2.86Å; F690-Q747 HydrophobicContact CD1-CG 4.29Å; F690-Q747 HydrophobicContact CE1-CG 4.32Å
691	Q	95.6	Very high	94.2	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.009	23%	0.232	C	C	.	.	H	α-helix	trans	-56.6	-54.4	175.3	180	70.9	14.7	0	0	111.3	I686 N687 S688 L689 V695 W740	I686-Q691 HydrophobicContact CG2-CB 4.07Å; I686-Q691 HydrophobicContact CG2-CG 4.44Å; N687-Q691 WeakPolarHBondContact O-CB 3.28Å; N687-Q691 PolarHBondContact O-N 3.46Å; S688-Q691 PolarHBondContact O-N 3.34Å; L689-Q691 VanDerWaalsContact C-N 3.33Å; L689-Q691 PolarHBondContact O-N 2.97Å; Q691-V695 VanDerWaalsContact O-CG2 3.28Å; Q691-V695 WeakPolarHBondContact O-CG2 3.49Å; Q691-V695 PolarHBondContact O-N 2.89Å; Q691-W740 HydrophobicContact CG-CD2 4.49Å; Q691-W740 HydrophobicContact CG-CH2 4.34Å; Q691-W740 HydrophobicContact CG-CZ2 3.94Å; Q691-W740 PolarHBondContact NE2-O 3.17Å
692	V	96.3	Very high	94.4	Very high	8 Å²	8	48.8 Å²	48.8	5%	0.048	25%	0.246	C	C	.	.	H	α-helix	trans	-65.1	-46.6	-176.7	174.5	0	0	0	0	111.4	S688 L689 T694 V695 L696 W740	S688-V692 WeakPolarHBondContact O-CG2 3.01Å; S688-V692 PolarHBondContact O-N 2.92Å; L689-V692 PolarHBondContact O-N 3.12Å; V692-T694 PolarHBondContact O-N 2.83Å; V692-V695 PolarHBondContact O-N 2.94Å; V692-L696 WeakPolarHBondContact O-CB 3.49Å; V692-L696 PolarHBondContact O-N 3.07Å; V692-W740 HydrophobicContact CG2-CH2 3.87Å; V692-W740 HydrophobicContact CG2-CZ3 4.34Å
693	L	96.6	Very high	94.4	Very high	100 Å²	100	47.6 Å²	47.6	52%	0.524	24%	0.24	S	C	.	.	H	α-helix	trans	-64.4	-40	-179.5	-70.4	178.6	0	0	0	112.4	L689 L696 F697	L689-L693 HydrophobicContact CD1-CD1 3.88Å; L689-L693 HydrophobicContact CD1-CG 4.1Å; L689-L693 HydrophobicContact CD2-CD1 4.49Å; L689-L693 HydrophobicContact CG-CD1 3.85Å; L689-L693 HydrophobicContact CG-CG 4.39Å; L689-L693 WeakPolarHBondContact O-CB 3.39Å; L689-L693 WeakPolarHBondContact O-CG 3.32Å; L689-L693 PolarHBondContact O-N 2.86Å; L693-L696 PolarHBondContact O-N 3.37Å; L693-F697 VanDerWaalsContact O-CB 3.31Å; L693-F697 WeakPolarHBondContact O-CB 3.45Å; L693-F697 PolarHBondContact O-N 3.47Å
694	T	96.9	Very high	94.6	Very high	23 Å²	23	48.6 Å²	48.6	14%	0.141	24%	0.241	C	C	.	.	H	α-helix	trans	-68.6	-43.3	179.5	-55	0	0	0	0	111	F690 V692 L696 F697 F698 I743	F690-T694 WeakPolarHBondContact O-CB 3.03Å; F690-T694 PolarHBondContact O-N 3.34Å; F690-T694 PolarHBondContact O-OG1 2.86Å; V692-T694 PolarHBondContact O-N 2.83Å; T694-L696 VanDerWaalsContact C-N 3.35Å; T694-L696 PolarHBondContact O-N 3.39Å; T694-F697 WeakPolarHBondContact O-CB 3.33Å; T694-F697 PolarHBondContact O-N 3.27Å; T694-F698 HydrophobicContact CG2-CD2 3.9Å; T694-F698 HydrophobicContact CG2-CE2 3.65Å; T694-F698 VanDerWaalsContact O-CD2 3.23Å; T694-F698 WeakPolarHBondContact O-CD2 3.46Å; T694-F698 PolarHBondContact O-N 2.9Å; T694-F698 VanDerWaalsContact O-N 3.09Å; T694-I743 HydrophobicContact CG2-CD1 3.73Å; T694-I743 HydrophobicContact CG2-CG1 4.21Å; T694-I743 HydrophobicContact CG2-CG2 4.18Å
695	V	96.8	Very high	94.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.4	-47.3	174.3	170.5	0	0	0	0	110.6	Q691 V692 F697 F698 L699 W740 I743 F947	Q691-V695 VanDerWaalsContact O-CG2 3.28Å; Q691-V695 WeakPolarHBondContact O-CG2 3.49Å; Q691-V695 PolarHBondContact O-N 2.89Å; V692-V695 PolarHBondContact O-N 2.94Å; V695-F697 VanDerWaalsContact C-N 3.34Å; V695-F697 PolarHBondContact O-N 3.49Å; V695-F698 PolarHBondContact O-N 2.87Å; V695-L699 HydrophobicContact CG1-CD1 3.62Å; V695-L699 HydrophobicContact CG1-CG 4.31Å; V695-L699 WeakPolarHBondContact O-CB 3.39Å; V695-L699 WeakPolarHBondContact O-CG 3.4Å; V695-L699 PolarHBondContact O-N 2.92Å; V695-W740 HydrophobicContact CB-CE3 4.26Å; V695-W740 HydrophobicContact CG1-CE3 4.06Å; V695-W740 HydrophobicContact CG2-CB 4.17Å; V695-W740 HydrophobicContact CG2-CD2 4.28Å; V695-W740 HydrophobicContact CG2-CE3 3.83Å; V695-W740 HydrophobicContact CG2-CG 4.48Å; V695-I743 HydrophobicContact CB-CD1 4.41Å; V695-I743 HydrophobicContact CG2-CD1 3.6Å; V695-F947 HydrophobicContact CG1-CZ 4.34Å
696	L	96.6	Very high	94.9	Very high	37 Å²	37	48.2 Å²	48.2	19%	0.194	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-39.6	178.9	-175.3	61.2	0	0	0	112.1	V692 L693 T694 L699 E700 F957 I958	V692-L696 WeakPolarHBondContact O-CB 3.49Å; V692-L696 PolarHBondContact O-N 3.07Å; L693-L696 PolarHBondContact O-N 3.37Å; T694-L696 VanDerWaalsContact C-N 3.35Å; T694-L696 PolarHBondContact O-N 3.39Å; L696-L699 PolarHBondContact O-N 3.09Å; L696-E700 HydrophobicContact CD1-CB 4.35Å; L696-E700 HydrophobicContact CD1-CG 3.65Å; L696-E700 WeakPolarHBondContact O-CB 3.43Å; L696-E700 PolarHBondContact O-N 3.25Å; L696-F957 HydrophobicContact CD1-CB 4.27Å; L696-I958 HydrophobicContact CD1-CG1 4.04Å
697	F	97	Very high	94.9	Very high	94 Å²	94	49.3 Å²	49.3	41%	0.412	25%	0.247	S	C	.	.	I	π-helix	trans	-58.2	-48.9	175.2	173.3	-92.5	0	0	0	111.6	L693 T694 V695 I701 V702	L693-F697 VanDerWaalsContact O-CB 3.31Å; L693-F697 WeakPolarHBondContact O-CB 3.45Å; L693-F697 PolarHBondContact O-N 3.47Å; T694-F697 WeakPolarHBondContact O-CB 3.33Å; T694-F697 PolarHBondContact O-N 3.27Å; V695-F697 VanDerWaalsContact C-N 3.34Å; V695-F697 PolarHBondContact O-N 3.49Å; F697-I701 HydrophobicContact CB-CD1 4.49Å; F697-I701 HydrophobicContact CD2-CB 3.93Å; F697-I701 HydrophobicContact CD2-CD1 3.54Å; F697-I701 HydrophobicContact CD2-CG1 4.3Å; F697-I701 HydrophobicContact CD2-CG2 4.04Å; F697-I701 HydrophobicContact CE2-CB 4.13Å; F697-I701 HydrophobicContact CE2-CD1 4.18Å; F697-I701 HydrophobicContact CE2-CG2 3.73Å; F697-I701 HydrophobicContact CG-CB 4.48Å; F697-I701 HydrophobicContact CG-CD1 4.39Å; F697-I701 HydrophobicContact CZ-CG2 4.39Å; F697-I701 WeakPolarHBondContact O-CA 3.46Å; F697-I701 VanDerWaalsContact O-CB 3.28Å; F697-I701 WeakPolarHBondContact O-CB 3.32Å; F697-I701 PolarHBondContact O-N 2.83Å; F697-V702 HydrophobicContact CD1-CG2 3.85Å; F697-V702 HydrophobicContact CE1-CG2 3.4Å; F697-V702 HydrophobicContact CZ-CG2 3.92Å; F697-V702 PolarHBondContact O-N 3Å
698	F	96.8	Very high	95	Very high	70 Å²	70	44.8 Å²	44.8	31%	0.307	22%	0.223	S	C	.	.	I	π-helix	trans	-67.2	-40.5	178.7	-77.6	-71	0	0	0	112.7	T694 V695 V702 G703 F704 L739 I743	T694-F698 HydrophobicContact CG2-CD2 3.9Å; T694-F698 HydrophobicContact CG2-CE2 3.65Å; T694-F698 VanDerWaalsContact O-CD2 3.23Å; T694-F698 WeakPolarHBondContact O-CD2 3.46Å; T694-F698 PolarHBondContact O-N 2.9Å; T694-F698 VanDerWaalsContact O-N 3.09Å; V695-F698 PolarHBondContact O-N 2.87Å; F698-V702 HydrophobicContact CD1-CB 4.21Å; F698-V702 HydrophobicContact CD1-CG1 4.45Å; F698-V702 HydrophobicContact CD1-CG2 3.79Å; F698-V702 HydrophobicContact CE1-CG2 4.27Å; F698-V702 WeakPolarHBondContact O-CB 3.46Å; F698-G703 PolarHBondContact O-N 3.47Å; F698-F704 HydrophobicContact CD1-CE2 4.26Å; F698-F704 WeakPolarHBondContact O-CB 3.12Å; F698-F704 WeakPolarHBondContact O-CD2 3.3Å; F698-F704 PolarHBondContact O-N 3.07Å; F698-F704 VanDerWaalsContact O-N 3.08Å; F698-L739 HydrophobicContact CB-CD1 3.97Å; F698-L739 HydrophobicContact CB-CD2 4.15Å; F698-L739 HydrophobicContact CG-CD2 4.44Å; F698-I743 HydrophobicContact CD2-CD1 4.1Å
699	L	95.6	Very high	95.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.216	C	C	.	.	I	π-helix	trans	-66.6	-51.6	-179.4	-73.2	172.4	0	0	0	112.6	V695 L696 G703 F704 K705 V735 L739 F947 F957	V695-L699 HydrophobicContact CG1-CD1 3.62Å; V695-L699 HydrophobicContact CG1-CG 4.31Å; V695-L699 WeakPolarHBondContact O-CB 3.39Å; V695-L699 WeakPolarHBondContact O-CG 3.4Å; V695-L699 PolarHBondContact O-N 2.92Å; L696-L699 PolarHBondContact O-N 3.09Å; L699-G703 CarbonylContact O-C 3.6Å; L699-F704 HydrophobicContact CD2-CB 4.45Å; L699-F704 PolarHBondContact O-N 2.85Å; L699-K705 WeakPolarHBondContact O-CB 3.45Å; L699-K705 WeakPolarHBondContact O-CG 3.45Å; L699-K705 PolarHBondContact O-N 2.9Å; L699-K705 VanDerWaalsContact O-N 3.09Å; L699-V735 HydrophobicContact CD2-CG1 3.74Å; L699-L739 HydrophobicContact CD2-CD1 3.64Å; L699-L739 HydrophobicContact CG-CD1 3.88Å; L699-F947 HydrophobicContact CD1-CE1 4.27Å; L699-F947 HydrophobicContact CD1-CZ 3.88Å; L699-F957 HydrophobicContact CB-CD2 4.31Å; L699-F957 HydrophobicContact CB-CG 4.44Å; L699-F957 HydrophobicContact CD1-CB 4.36Å; L699-F957 HydrophobicContact CD1-CD1 3.76Å; L699-F957 HydrophobicContact CD1-CE1 4.08Å; L699-F957 HydrophobicContact CD1-CG 3.97Å; L699-F957 HydrophobicContact CD2-CE1 4.41Å; L699-F957 HydrophobicContact CD2-CE2 4.4Å; L699-F957 HydrophobicContact CD2-CZ 4.18Å
700	E	94.4	Very high	95	Very high	52 Å²	52	40.5 Å²	40.5	24%	0.243	20%	0.199	C	C	.	.	I	π-helix	trans	-95	-45.1	-171.4	-71.1	-66.3	164.9	0	0	113.6	L696 K705 F957 I958	L696-E700 HydrophobicContact CD1-CB 4.35Å; L696-E700 HydrophobicContact CD1-CG 3.65Å; L696-E700 WeakPolarHBondContact O-CB 3.43Å; L696-E700 PolarHBondContact O-N 3.25Å; E700-K705 WeakPolarHBondContact OE2-CD 3.46Å; E700-K705 WeakPolarHBondContact OE2-CE 3.26Å; E700-K705 IonicContact OE2-NZ 3.62Å; E700-K705 PolarHBondContact OE2-NZ 2.93Å; E700-F957 HydrophobicContact CG-CB 4.45Å; E700-F957 WeakPolarHBondContact OE1-CD2 3.38Å; E700-I958 HydrophobicContact CG-CG1 4.3Å
701	I	94.1	Very high	94.7	Very high	124 Å²	124	35.5 Å²	35.5	64%	0.636	18%	0.177	S	C	*	.	I	π-helix	trans	-83.9	-47.7	-173	-63.1	167.7	0	0	0	110.9	F697 G703	F697-I701 HydrophobicContact CB-CD1 4.49Å; F697-I701 HydrophobicContact CD2-CB 3.93Å; F697-I701 HydrophobicContact CD2-CD1 3.54Å; F697-I701 HydrophobicContact CD2-CG1 4.3Å; F697-I701 HydrophobicContact CD2-CG2 4.04Å; F697-I701 HydrophobicContact CE2-CB 4.13Å; F697-I701 HydrophobicContact CE2-CD1 4.18Å; F697-I701 HydrophobicContact CE2-CG2 3.73Å; F697-I701 HydrophobicContact CG-CB 4.48Å; F697-I701 HydrophobicContact CG-CD1 4.39Å; F697-I701 HydrophobicContact CZ-CG2 4.39Å; F697-I701 WeakPolarHBondContact O-CA 3.46Å; F697-I701 VanDerWaalsContact O-CB 3.28Å; F697-I701 WeakPolarHBondContact O-CB 3.32Å; F697-I701 PolarHBondContact O-N 2.83Å; I701-G703 VanDerWaalsContact C-N 3.28Å
702	V	95.1	Very high	94.3	Very high	52 Å²	52	36.2 Å²	36.2	32%	0.315	18%	0.182	S	C	.	.	S	Bend	trans	-74.8	-23.6	176.2	-173.3	0	0	0	0	111.3	F697 F698 F704 L716	F697-V702 HydrophobicContact CD1-CG2 3.85Å; F697-V702 HydrophobicContact CE1-CG2 3.4Å; F697-V702 HydrophobicContact CZ-CG2 3.92Å; F697-V702 PolarHBondContact O-N 3Å; F698-V702 HydrophobicContact CD1-CB 4.21Å; F698-V702 HydrophobicContact CD1-CG1 4.45Å; F698-V702 HydrophobicContact CD1-CG2 3.79Å; F698-V702 HydrophobicContact CE1-CG2 4.27Å; F698-V702 WeakPolarHBondContact O-CB 3.46Å; V702-F704 HydrophobicContact CB-CD2 4.09Å; V702-F704 HydrophobicContact CB-CE2 4.32Å; V702-F704 HydrophobicContact CG1-CD2 3.8Å; V702-F704 HydrophobicContact CG1-CE2 3.61Å; V702-L716 HydrophobicContact CG1-CD1 4.29Å
703	G	93.3	Very high	93.7	Very high	5 Å²	5	37.8 Å²	37.8	5%	0.052	19%	0.194	C	C	.	.			trans	91.2	22.1	173.5	0	0	0	0	0	114.8	F698 L699 I701 K705 N706	F698-G703 PolarHBondContact O-N 3.47Å; L699-G703 CarbonylContact O-C 3.6Å; I701-G703 VanDerWaalsContact C-N 3.28Å; G703-K705 PolarHBondContact O-N 2.98Å; G703-K705 VanDerWaalsContact O-N 3.12Å; G703-N706 WeakPolarHBondContact O-CB 3.35Å; G703-N706 PolarHBondContact O-N 3.3Å; G703-N706 PolarHBondContact O-ND2 3.16Å
704	F	94.9	Very high	93.2	Very high	56 Å²	56	34.9 Å²	34.9	25%	0.246	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-59.7	-22.2	175.9	-84.7	-119.9	0	0	0	112.7	F698 L699 V702 N706 L707 L716 V735 L739	F698-F704 HydrophobicContact CD1-CE2 4.26Å; F698-F704 WeakPolarHBondContact O-CB 3.12Å; F698-F704 WeakPolarHBondContact O-CD2 3.3Å; F698-F704 PolarHBondContact O-N 3.07Å; F698-F704 VanDerWaalsContact O-N 3.08Å; L699-F704 HydrophobicContact CD2-CB 4.45Å; L699-F704 PolarHBondContact O-N 2.85Å; V702-F704 HydrophobicContact CB-CD2 4.09Å; V702-F704 HydrophobicContact CB-CE2 4.32Å; V702-F704 HydrophobicContact CG1-CD2 3.8Å; V702-F704 HydrophobicContact CG1-CE2 3.61Å; F704-N706 PolarHBondContact O-N 2.6Å; F704-N706 VanDerWaalsContact O-N 3.12Å; F704-L707 HydrophobicContact CD1-CD1 4Å; F704-L707 HydrophobicContact CE1-CD1 4.46Å; F704-L707 HydrophobicContact CG-CD1 4.49Å; F704-L707 WeakPolarHBondContact O-CB 3.31Å; F704-L707 PolarHBondContact O-N 3.09Å; F704-L716 HydrophobicContact CD2-CD1 4.18Å; F704-L716 HydrophobicContact CD2-CD2 3.78Å; F704-L716 HydrophobicContact CE2-CD1 3.76Å; F704-L716 HydrophobicContact CE2-CD2 4.06Å; F704-L716 HydrophobicContact CG-CD2 4.07Å; F704-L716 HydrophobicContact CZ-CD1 4.41Å; F704-V735 HydrophobicContact CB-CG1 4Å; F704-V735 HydrophobicContact CD1-CG1 4.49Å; F704-L739 HydrophobicContact CB-CD1 4.04Å; F704-L739 HydrophobicContact CD1-CD1 4.06Å; F704-L739 HydrophobicContact CD1-CD2 4.08Å; F704-L739 HydrophobicContact CD1-CG 4.39Å; F704-L739 HydrophobicContact CE1-CD2 4.17Å; F704-L739 HydrophobicContact CG-CD1 4.22Å
705	K	93.8	Very high	92.8	Very high	53 Å²	53	36 Å²	36	23%	0.23	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-53.6	-30.2	170.3	69.4	-179.9	-177.5	-174.5	0	113.5	L699 E700 G703 L707 A708 Y727 F957	L699-K705 WeakPolarHBondContact O-CB 3.45Å; L699-K705 WeakPolarHBondContact O-CG 3.45Å; L699-K705 PolarHBondContact O-N 2.9Å; L699-K705 VanDerWaalsContact O-N 3.09Å; E700-K705 WeakPolarHBondContact OE2-CD 3.46Å; E700-K705 WeakPolarHBondContact OE2-CE 3.26Å; E700-K705 IonicContact OE2-NZ 3.62Å; E700-K705 PolarHBondContact OE2-NZ 2.93Å; G703-K705 PolarHBondContact O-N 2.98Å; G703-K705 VanDerWaalsContact O-N 3.12Å; K705-L707 PolarHBondContact O-N 2.72Å; K705-A708 WeakPolarHBondContact O-CB 3.1Å; K705-A708 PolarHBondContact O-N 3.39Å; K705-Y727 WeakPolarHBondContact O-CE1 3.43Å; K705-F957 HydrophobicContact CB-CD2 4.18Å; K705-F957 HydrophobicContact CB-CE2 3.58Å
706	N	93.4	Very high	92.4	Very high	20 Å²	20	38.9 Å²	38.9	11%	0.107	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-69.8	-16.6	-179.3	-66.2	-37.5	0	0	0	112.8	G703 F704 A708 L709 L716 R718	G703-N706 WeakPolarHBondContact O-CB 3.35Å; G703-N706 PolarHBondContact O-N 3.3Å; G703-N706 PolarHBondContact O-ND2 3.16Å; F704-N706 PolarHBondContact O-N 2.6Å; F704-N706 VanDerWaalsContact O-N 3.12Å; N706-A708 PolarHBondContact O-N 3.03Å; N706-L709 HydrophobicContact CB-CD1 4.07Å; N706-L709 WeakPolarHBondContact O-CB 3.35Å; N706-L709 WeakPolarHBondContact O-CD1 3.01Å; N706-L709 WeakPolarHBondContact O-CG 3.39Å; N706-L709 PolarHBondContact O-N 3.49Å; N706-L716 PolarHBondContact ND2-O 3.49Å; N706-R718 HydrophobicContact CB-CG 4.44Å
707	L	93.8	Very high	92	Very high	30 Å²	30	41.4 Å²	41.4	16%	0.157	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-73.2	-16	170.1	-61	176.5	0	0	0	112.5	L587 K591 F704 K705 L709 L716 V735	L587-L707 HydrophobicContact CD1-CB 4.35Å; K591-L707 WeakPolarHBondContact CE-O 3.24Å; F704-L707 HydrophobicContact CD1-CD1 4Å; F704-L707 HydrophobicContact CE1-CD1 4.46Å; F704-L707 HydrophobicContact CG-CD1 4.49Å; F704-L707 WeakPolarHBondContact O-CB 3.31Å; F704-L707 PolarHBondContact O-N 3.09Å; K705-L707 PolarHBondContact O-N 2.72Å; L707-L709 VanDerWaalsContact C-N 3.32Å; L707-L716 HydrophobicContact CD1-CD2 3.95Å; L707-L716 HydrophobicContact CD2-CD2 4.25Å; L707-L716 HydrophobicContact CG-CD2 3.89Å; L707-V735 HydrophobicContact CB-CG2 3.98Å
708	A	94	Very high	91.4	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-85.3	-3.3	175.8	0	0	0	0	0	113.9	K705 N706 Y727 S728 L731 R732	K705-A708 WeakPolarHBondContact O-CB 3.1Å; K705-A708 PolarHBondContact O-N 3.39Å; N706-A708 PolarHBondContact O-N 3.03Å; A708-Y727 HydrophobicContact CB-CD1 3.92Å; A708-Y727 WeakPolarHBondContact O-CA 3.08Å; A708-S728 PolarHBondContact O-N 3.03Å; A708-L731 HydrophobicContact CB-CB 4.24Å; A708-R732 HydrophobicContact CB-CB 3.89Å; A708-R732 HydrophobicContact CB-CG 4.15Å
709	L	93.4	Very high	90.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-72.1	141.1	177	-61	170.6	0	0	0	110.9	K591 N706 L707 D711 V724 A725 Y727	K591-L709 WeakPolarHBondContact CE-O 3.25Å; K591-L709 PolarHBondContact NZ-O 3.48Å; N706-L709 HydrophobicContact CB-CD1 4.07Å; N706-L709 WeakPolarHBondContact O-CB 3.35Å; N706-L709 WeakPolarHBondContact O-CD1 3.01Å; N706-L709 WeakPolarHBondContact O-CG 3.39Å; N706-L709 PolarHBondContact O-N 3.49Å; L707-L709 VanDerWaalsContact C-N 3.32Å; L709-D711 PolarHBondContact O-N 2.69Å; L709-V724 HydrophobicContact CD1-CG1 4.33Å; L709-V724 HydrophobicContact CD2-CG1 3.74Å; L709-A725 WeakPolarHBondContact CD2-O 3.12Å; L709-Y727 HydrophobicContact CD2-CD1 3.74Å; L709-Y727 HydrophobicContact CD2-CE1 3.47Å; L709-Y727 VanDerWaalsContact CD2-CE1 3.47Å; L709-Y727 HydrophobicContact CD2-CE2 4.41Å; L709-Y727 HydrophobicContact CD2-CG 4.33Å; L709-Y727 HydrophobicContact CG-CD1 4.37Å; L709-Y727 HydrophobicContact CG-CE1 4.08Å
710	M	91.7	Very high	90.4	Very high	13 Å²	13	46.2 Å²	46.2	6%	0.064	27%	0.267	C	S	.	.	S	Bend	trans	-76	58	176.2	-65	-176.5	178.4	0	0	112.5	T373 L600 A725 P726 S728	T373-M710 HydrophobicContact CG2-SD 4.24Å; T373-M710 PolarHBondContact N-O 3Å; L600-M710 HydrophobicContact CD1-CB 4.1Å; L600-M710 HydrophobicContact CD1-CG 3.87Å; M710-A725 HydrophobicContact CB-CB 4.48Å; M710-P726 WeakPolarHBondContact CB-O 3.17Å; M710-P726 WeakPolarHBondContact CG-O 3.23Å; M710-P726 PolarHBondContact N-O 3.04Å; M710-P726 HydrophobicContact SD-CG 4.16Å; M710-S728 VanDerWaalsContact CE-CA 3.48Å
711	D	89.6	Confident	89.9	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.037	28%	0.28	C	S	.	.	S	Bend	trans	-137.5	165.7	176.8	70.8	0.7	0	0	0	113.2	G371 T372 F590 K591 L709 S713 R718 A725	G371-D711 WeakPolarHBondContact O-CA 3.21Å; T372-D711 HydrophobicContact CG2-CB 3.87Å; F590-D711 WeakPolarHBondContact CE1-O 3.4Å; K591-D711 PolarHBondContact NZ-O 3.18Å; K591-D711 IonicContact NZ-OD1 3.09Å; K591-D711 PolarHBondContact NZ-OD1 3.24Å; L709-D711 PolarHBondContact O-N 2.69Å; D711-S713 PolarHBondContact O-N 3.2Å; D711-R718 IonicContact OD1-CZ 2.69Å; D711-R718 IonicContact OD1-NH2 3.15Å; D711-R718 PolarHBondContact OD1-NH2 3Å; D711-R718 IonicContact OD2-CZ 3.07Å; D711-R718 IonicContact OD2-NH1 2.94Å; D711-R718 PolarHBondContact OD2-NH1 3.35Å; D711-R718 IonicContact OD2-NH2 3.87Å; D711-R718 PolarHBondContact OD2-NH2 2.87Å; D711-A725 HydrophobicContact CB-CB 4.18Å
712	S	85.6	Confident	89.6	Confident	17 Å²	17	42.9 Å²	42.9	12%	0.119	26%	0.26	C	S	.	.	S	Bend	trans	-74.2	-14.6	-179	56.4	0	0	0	0	113.6	F321	F321-S712 VanDerWaalsContact CD1-CB 3.49Å
713	S	85.5	Confident	89.4	Confident	41 Å²	41	41.6 Å²	41.6	29%	0.287	25%	0.25	S	C	.	.			trans	-74.9	135.9	-176.9	178.9	0	0	0	0	112.2	K591 D711 S715	K591-S713 PolarHBondContact NZ-O 3.11Å; D711-S713 PolarHBondContact O-N 3.2Å; S713-S715 WeakPolarHBondContact OG-CB 3.45Å; S713-S715 PolarHBondContact OG-N 2.88Å
714	S	85.9	Confident	89.3	Confident	39 Å²	39	45 Å²	45	27%	0.273	27%	0.27	S	S	.	.			trans	-101.8	12.3	170.6	-49.7	0	0	0	0	112.8	K322 K591 L716	K322-S714 WeakPolarHBondContact CE-OG 3.27Å; K322-S714 PolarHBondContact NZ-OG 3.29Å; K591-S714 PolarHBondContact O-OG 3.47Å; S714-L716 PolarHBondContact O-N 3.36Å
715	S	86.8	Confident	89.2	Confident	46 Å²	46	42.5 Å²	42.5	32%	0.322	26%	0.259	S	S	.	.			trans	-70	130.6	179.6	-175	0	0	0	0	111	S713 S717	S713-S715 WeakPolarHBondContact OG-CB 3.45Å; S713-S715 PolarHBondContact OG-N 2.88Å; S715-S717 VanDerWaalsContact C-N 3.29Å; S715-S717 WeakPolarHBondContact CB-O 3.36Å; S715-S717 PolarHBondContact OG-N 2.92Å; S715-S717 PolarHBondContact OG-O 3.02Å
716	L	89.3	Confident	89.1	Confident	60 Å²	60	42 Å²	42	31%	0.314	26%	0.261	S	S	.	.	S	Bend	trans	-74.7	-21.4	173.4	-62.9	176.3	0	0	0	112.4	V702 F704 N706 L707 S714	V702-L716 HydrophobicContact CG1-CD1 4.29Å; F704-L716 HydrophobicContact CD2-CD1 4.18Å; F704-L716 HydrophobicContact CD2-CD2 3.78Å; F704-L716 HydrophobicContact CE2-CD1 3.76Å; F704-L716 HydrophobicContact CE2-CD2 4.06Å; F704-L716 HydrophobicContact CG-CD2 4.07Å; F704-L716 HydrophobicContact CZ-CD1 4.41Å; N706-L716 PolarHBondContact ND2-O 3.49Å; L707-L716 HydrophobicContact CD1-CD2 3.95Å; L707-L716 HydrophobicContact CD2-CD2 4.25Å; L707-L716 HydrophobicContact CG-CD2 3.89Å; S714-L716 PolarHBondContact O-N 3.36Å
717	S	88.3	Confident	89	Confident	91 Å²	91	44.1 Å²	44.1	64%	0.636	27%	0.269	S	S	*	.			trans	-110.4	146.4	176.9	64	0	0	0	0	111	S715	S715-S717 VanDerWaalsContact C-N 3.29Å; S715-S717 WeakPolarHBondContact CB-O 3.36Å; S715-S717 PolarHBondContact OG-N 2.92Å; S715-S717 PolarHBondContact OG-O 3.02Å
718	R	85.1	Confident	89	Confident	65 Å²	65	42.7 Å²	42.7	25%	0.245	26%	0.261	C	S	.	.			trans	-128.1	137.2	179.2	-64.1	-63	177	142.9	7.5	110.4	N706 D711	N706-R718 HydrophobicContact CB-CG 4.44Å; D711-R718 IonicContact OD1-CZ 2.69Å; D711-R718 IonicContact OD1-NH2 3.15Å; D711-R718 PolarHBondContact OD1-NH2 3Å; D711-R718 IonicContact OD2-CZ 3.07Å; D711-R718 IonicContact OD2-NH1 2.94Å; D711-R718 PolarHBondContact OD2-NH1 3.35Å; D711-R718 IonicContact OD2-NH2 3.87Å; D711-R718 PolarHBondContact OD2-NH2 2.87Å
719	S	85.8	Confident	89	Confident	60 Å²	60	46.7 Å²	46.7	42%	0.42	28%	0.276	S	S	.	.			trans	-71.7	140.8	171.6	49.8	0	0	0	0	110.1	S721 S722	S719-S721 PolarHBondContact O-N 2.8Å; S719-S721 VanDerWaalsContact O-N 3.12Å; S719-S722 PolarHBondContact O-N 3.19Å; S719-S722 VanDerWaalsContact O-N 3.09Å; S719-S722 PolarHBondContact O-OG 2.87Å; S719-S722 WeakPolarHBondContact OG-CB 3.47Å; S719-S722 PolarHBondContact OG-OG 3.45Å
720	P	84.3	Confident	89.1	Confident	140 Å²	140	47 Å²	47	91%	0.909	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-24.7	176.9	-25.7	34.7	0	0	0	114.4
721	S	84.3	Confident	89.2	Confident	73 Å²	73	46.3 Å²	46.3	51%	0.51	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-10.1	179.5	53.3	0	0	0	0	114.5	T362 S719	T362-S721 PolarHBondContact OG1-O 2.96Å; S719-S721 PolarHBondContact O-N 2.8Å; S719-S721 VanDerWaalsContact O-N 3.12Å
722	S	87.3	Confident	89.5	Confident	32 Å²	32	46.5 Å²	46.5	22%	0.224	27%	0.274	C	S	.	.	S	Bend	trans	-83.8	145.1	178.7	57.3	0	0	0	0	111.3	S719	S719-S722 PolarHBondContact O-N 3.19Å; S719-S722 VanDerWaalsContact O-N 3.09Å; S719-S722 PolarHBondContact O-OG 2.87Å; S719-S722 WeakPolarHBondContact OG-CB 3.47Å; S719-S722 PolarHBondContact OG-OG 3.45Å
723	Y	90.9	Very high	90	Very high	25 Å²	25	45.7 Å²	45.7	10%	0.098	27%	0.269	C	S	.	.			trans	-61.7	138.2	170.5	174.5	-99.8	0	0	0	111	A366 T372 T373 Y374 Q375 A725	A366-Y723 HydrophobicContact CB-CD1 3.91Å; A366-Y723 HydrophobicContact CB-CG 3.92Å; T372-Y723 HydrophobicContact CG2-CD1 4.45Å; T373-Y723 WeakPolarHBondContact O-CE1 3.43Å; T373-Y723 PolarHBondContact O-OH 3.11Å; Y374-Y723 WeakPolarHBondContact CA-OH 3.3Å; Y374-Y723 HydrophobicContact CD2-CD1 4.07Å; Y374-Y723 HydrophobicContact CD2-CD2 4.04Å; Y374-Y723 AromaticContact CD2-CE1 3.81Å; Y374-Y723 HydrophobicContact CD2-CE1 3.81Å; Y374-Y723 AromaticContact CD2-CE2 3.79Å; Y374-Y723 HydrophobicContact CD2-CE2 3.79Å; Y374-Y723 HydrophobicContact CD2-CG 4.19Å; Y374-Y723 AromaticContact CD2-CZ 3.68Å; Y374-Y723 AromaticContact CE2-CD2 3.78Å; Y374-Y723 HydrophobicContact CE2-CD2 3.78Å; Y374-Y723 AromaticContact CE2-CE2 3.75Å; Y374-Y723 HydrophobicContact CE2-CE2 3.75Å; Y374-Y723 HydrophobicContact CE2-CG 4.21Å; Q375-Y723 PolarHBondContact N-OH 2.8Å; Q375-Y723 PolarHBondContact O-OH 2.96Å; Y723-A725 HydrophobicContact CE1-CB 4.07Å
724	V	91.8	Very high	90.5	Very high	78 Å²	78	43.8 Å²	43.8	47%	0.473	26%	0.255	S	S	.	.			trans	-107.1	109.6	176.8	-178.8	0	0	0	0	107.6	L709	L709-V724 HydrophobicContact CD1-CG1 4.33Å; L709-V724 HydrophobicContact CD2-CG1 3.74Å
725	A	91.9	Very high	91	Very high	2 Å²	2	42.1 Å²	42.1	2%	0.017	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-63.2	156.1	176.1	0	0	0	0	0	111.5	L709 M710 D711 Y723	L709-A725 WeakPolarHBondContact CD2-O 3.12Å; M710-A725 HydrophobicContact CB-CB 4.48Å; D711-A725 HydrophobicContact CB-CB 4.18Å; Y723-A725 HydrophobicContact CE1-CB 4.07Å
726	P	92.4	Very high	91.5	Very high	43 Å²	43	39.9 Å²	39.9	28%	0.279	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-61	154.8	172	25.8	-33.6	0	0	0	111.5	T373 M710	T373-P726 HydrophobicContact CG2-CG 4Å; M710-P726 WeakPolarHBondContact CB-O 3.17Å; M710-P726 WeakPolarHBondContact CG-O 3.23Å; M710-P726 PolarHBondContact N-O 3.04Å; M710-P726 HydrophobicContact SD-CG 4.16Å
727	Y	92.2	Very high	91.9	Very high	65 Å²	65	37 Å²	37	26%	0.255	21%	0.213	S	C	.	.	B	Isolated β-bridge	trans	-76.9	136.7	175.4	-68.5	-75.4	0	0	0	111.1	K705 A708 L709	K705-Y727 WeakPolarHBondContact O-CE1 3.43Å; A708-Y727 HydrophobicContact CB-CD1 3.92Å; A708-Y727 WeakPolarHBondContact O-CA 3.08Å; L709-Y727 HydrophobicContact CD2-CD1 3.74Å; L709-Y727 HydrophobicContact CD2-CE1 3.47Å; L709-Y727 VanDerWaalsContact CD2-CE1 3.47Å; L709-Y727 HydrophobicContact CD2-CE2 4.41Å; L709-Y727 HydrophobicContact CD2-CG 4.33Å; L709-Y727 HydrophobicContact CG-CD1 4.37Å; L709-Y727 HydrophobicContact CG-CE1 4.08Å
728	S	93.9	Very high	92.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-81.8	132.4	165.2	160.7	0	0	0	0	110.1	E606 A708 M710 I730 L731 R732	E606-S728 WeakPolarHBondContact OE1-CB 3.33Å; E606-S728 PolarHBondContact OE1-OG 2.81Å; A708-S728 PolarHBondContact O-N 3.03Å; M710-S728 VanDerWaalsContact CE-CA 3.48Å; S728-I730 VanDerWaalsContact C-N 3.29Å; S728-I730 PolarHBondContact O-N 2.86Å; S728-I730 PolarHBondContact OG-N 2.04Å; S728-L731 PolarHBondContact O-N 2.93Å; S728-L731 PolarHBondContact OG-N 2.8Å; S728-R732 WeakPolarHBondContact O-CB 3.21Å; S728-R732 PolarHBondContact O-N 2.86Å
729	R	93.8	Very high	92.8	Very high	84 Å²	84	32.2 Å²	32.2	32%	0.317	19%	0.189	S	C	.	.	H	α-helix	trans	-66.1	-36.9	178.1	-63.2	-179.9	-179.4	169.5	-2.1	111	E606 V610 Y733 L952	E606-R729 PolarHBondContact OE1-N 3.45Å; E606-R729 VanDerWaalsContact OE2-CB 3.26Å; E606-R729 WeakPolarHBondContact OE2-CB 3.48Å; E606-R729 WeakPolarHBondContact OE2-CG 3.48Å; E606-R729 PolarHBondContact OE2-N 2.86Å; V610-R729 HydrophobicContact CG2-CB 4.24Å; R729-Y733 WeakPolarHBondContact O-CB 3.48Å; R729-Y733 PolarHBondContact O-N 3.41Å; R729-L952 HydrophobicContact CB-CD2 3.82Å; R729-L952 HydrophobicContact CG-CD2 4.38Å
730	I	94.4	Very high	93.3	Very high	5 Å²	5	29.4 Å²	29.4	3%	0.026	17%	0.17	C	C	.	.	H	α-helix	trans	-65.5	-50.4	178.1	-64.5	176.9	0	0	0	110.6	W586 P601 E606 F609 S728 R732 Y733 A734	W586-I730 HydrophobicContact CB-CG2 3.93Å; W586-I730 HydrophobicContact CG-CG2 4.13Å; P601-I730 HydrophobicContact CB-CD1 4.24Å; P601-I730 HydrophobicContact CG-CD1 3.83Å; E606-I730 HydrophobicContact CB-CD1 4.42Å; E606-I730 HydrophobicContact CB-CG1 4.38Å; E606-I730 HydrophobicContact CG-CD1 3.79Å; E606-I730 HydrophobicContact CG-CG1 3.95Å; E606-I730 PolarHBondContact OE1-N 3.45Å; F609-I730 HydrophobicContact CB-CD1 4.39Å; F609-I730 HydrophobicContact CB-CG1 4.28Å; F609-I730 HydrophobicContact CD1-CG1 3.71Å; F609-I730 HydrophobicContact CD2-CG1 4.38Å; F609-I730 HydrophobicContact CE1-CB 4.47Å; F609-I730 HydrophobicContact CE1-CG1 4.09Å; F609-I730 HydrophobicContact CG-CD1 4.31Å; F609-I730 HydrophobicContact CG-CG1 3.86Å; F609-I730 HydrophobicContact CZ-CG2 4.44Å; S728-I730 VanDerWaalsContact C-N 3.29Å; S728-I730 PolarHBondContact O-N 2.86Å; S728-I730 PolarHBondContact OG-N 2.04Å; I730-R732 VanDerWaalsContact C-N 3.31Å; I730-R732 PolarHBondContact O-N 2.97Å; I730-Y733 PolarHBondContact O-N 3.29Å; I730-A734 WeakPolarHBondContact O-CB 3.25Å; I730-A734 PolarHBondContact O-N 3.1Å
731	L	94.8	Very high	93.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.8	-38.6	-179.8	-63	-172.5	0	0	0	111.8	W586 L587 F590 L600 A708 S728 A734 V735	W586-L731 HydrophobicContact CB-CD2 4.08Å; L587-L731 HydrophobicContact CB-CD2 4.1Å; L587-L731 HydrophobicContact CD1-CD2 4.19Å; F590-L731 HydrophobicContact CD1-CD1 4.23Å; L600-L731 HydrophobicContact CD1-CD1 3.73Å; L600-L731 HydrophobicContact CD1-CG 4.4Å; L600-L731 HydrophobicContact CD2-CD1 3.88Å; L600-L731 HydrophobicContact CD2-CD2 3.88Å; L600-L731 HydrophobicContact CD2-CG 3.88Å; L600-L731 HydrophobicContact CG-CD1 4.46Å; A708-L731 HydrophobicContact CB-CB 4.24Å; S728-L731 PolarHBondContact O-N 2.93Å; S728-L731 PolarHBondContact OG-N 2.8Å; L731-A734 WeakPolarHBondContact O-CB 3.41Å; L731-A734 PolarHBondContact O-N 2.65Å; L731-V735 WeakPolarHBondContact O-CG2 3.44Å; L731-V735 PolarHBondContact O-N 3.45Å
732	R	95.1	Very high	94.5	Very high	10 Å²	10	23.4 Å²	23.4	4%	0.038	13%	0.13	C	C	.	.	H	α-helix	trans	-63.2	-43.9	178.1	-159.3	178.5	174.5	115.1	-0.5	112	A708 S728 I730 S736 D951 Q955 F957	A708-R732 HydrophobicContact CB-CB 3.89Å; A708-R732 HydrophobicContact CB-CG 4.15Å; S728-R732 WeakPolarHBondContact O-CB 3.21Å; S728-R732 PolarHBondContact O-N 2.86Å; I730-R732 VanDerWaalsContact C-N 3.31Å; I730-R732 PolarHBondContact O-N 2.97Å; R732-S736 WeakPolarHBondContact O-CB 3.46Å; R732-S736 PolarHBondContact O-N 2.99Å; R732-S736 PolarHBondContact O-OG 3.27Å; R732-D951 VanDerWaalsContact CD-OD2 3.22Å; R732-D951 WeakPolarHBondContact CD-OD2 3.44Å; R732-D951 WeakPolarHBondContact CG-OD2 3.35Å; R732-D951 IonicContact CZ-OD1 3.53Å; R732-D951 VanDerWaalsContact CZ-OD1 3.3Å; R732-D951 IonicContact CZ-OD2 2.83Å; R732-D951 VanDerWaalsContact NE-CG 3.26Å; R732-D951 IonicContact NE-OD1 3.38Å; R732-D951 PolarHBondContact NE-OD1 2.87Å; R732-D951 IonicContact NE-OD2 2.94Å; R732-D951 PolarHBondContact NE-OD2 2.77Å; R732-D951 IonicContact NH2-OD1 3.24Å; R732-D951 PolarHBondContact NH2-OD1 3.44Å; R732-Q955 PolarHBondContact NH2-O 3.28Å; R732-F957 HydrophobicContact CG-CE1 3.94Å; R732-F957 HydrophobicContact CG-CE2 4.45Å; R732-F957 HydrophobicContact CG-CZ 3.48Å; R732-F957 VanDerWaalsContact CG-CZ 3.48Å
733	Y	96.4	Very high	95	Very high	1 Å²	1	22.7 Å²	22.7	0%	0.004	12%	0.124	C	C	.	.	H	α-helix	trans	-60.4	-46.1	171.1	175.8	-93.5	0	0	0	111.6	T579 V580 F609 V613 R729 I730 S736 A737 C948 L952	T579-Y733 PolarHBondContact OG1-OH 3.18Å; V580-Y733 HydrophobicContact CG2-CE1 4.01Å; V580-Y733 WeakPolarHBondContact CG2-OH 2.98Å; F609-Y733 AromaticContact CE1-CD1 3.94Å; F609-Y733 HydrophobicContact CE1-CD1 3.94Å; F609-Y733 HydrophobicContact CE1-CG 4.02Å; F609-Y733 AromaticContact CZ-CD1 3.58Å; F609-Y733 HydrophobicContact CZ-CD1 3.58Å; F609-Y733 HydrophobicContact CZ-CE1 4.03Å; F609-Y733 HydrophobicContact CZ-CG 4.14Å; V613-Y733 HydrophobicContact CB-CE2 4.44Å; V613-Y733 HydrophobicContact CG1-CD2 4.05Å; V613-Y733 HydrophobicContact CG1-CE2 3.66Å; V613-Y733 HydrophobicContact CG2-CD2 4.03Å; V613-Y733 HydrophobicContact CG2-CE2 3.81Å; V613-Y733 HydrophobicContact CG2-CG 4.48Å; R729-Y733 WeakPolarHBondContact O-CB 3.48Å; R729-Y733 PolarHBondContact O-N 3.41Å; I730-Y733 PolarHBondContact O-N 3.29Å; Y733-S736 PolarHBondContact O-N 3.12Å; Y733-A737 HydrophobicContact CE1-CB 4.29Å; Y733-A737 VanDerWaalsContact O-CB 3.28Å; Y733-A737 WeakPolarHBondContact O-CB 3.39Å; Y733-A737 PolarHBondContact O-N 2.99Å; Y733-C948 HydrophobicContact CD2-CB 3.68Å; Y733-C948 HydrophobicContact CE2-CB 3.73Å; Y733-L952 HydrophobicContact CD2-CD1 4.34Å
734	A	96.4	Very high	95.2	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.5	-48.8	-177.1	0	0	0	0	0	113	G583 L587 I730 L731 S736 A737 A738	G583-A734 WeakPolarHBondContact O-CB 3.39Å; L587-A734 HydrophobicContact CB-CB 3.95Å; L587-A734 HydrophobicContact CD2-CB 4.07Å; I730-A734 WeakPolarHBondContact O-CB 3.25Å; I730-A734 PolarHBondContact O-N 3.1Å; L731-A734 WeakPolarHBondContact O-CB 3.41Å; L731-A734 PolarHBondContact O-N 2.65Å; A734-S736 VanDerWaalsContact C-N 3.33Å; A734-S736 PolarHBondContact O-N 3.21Å; A734-A737 PolarHBondContact O-N 3.44Å; A734-A738 WeakPolarHBondContact O-CB 3.48Å; A734-A738 PolarHBondContact O-N 3.1Å
735	V	96.4	Very high	95.4	Very high	4 Å²	4	22.3 Å²	22.3	2%	0.024	12%	0.12	C	C	.	.	H	α-helix	trans	-61.8	-44.3	178.9	175.7	0	0	0	0	110.4	L587 L699 F704 L707 L731 L739	L587-V735 HydrophobicContact CD1-CG2 3.61Å; L587-V735 HydrophobicContact CD2-CG2 3.79Å; L587-V735 HydrophobicContact CG-CG2 4.37Å; L699-V735 HydrophobicContact CD2-CG1 3.74Å; F704-V735 HydrophobicContact CB-CG1 4Å; F704-V735 HydrophobicContact CD1-CG1 4.49Å; L707-V735 HydrophobicContact CB-CG2 3.98Å; L731-V735 WeakPolarHBondContact O-CG2 3.44Å; L731-V735 PolarHBondContact O-N 3.45Å; V735-L739 HydrophobicContact CG1-CD1 4.01Å; V735-L739 WeakPolarHBondContact O-CB 3.35Å; V735-L739 WeakPolarHBondContact O-CG 2.78Å; V735-L739 PolarHBondContact O-N 3.11Å; V735-L739 VanDerWaalsContact O-N 3.07Å
736	S	96.3	Very high	95.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.5	-50.4	178.9	-59.1	0	0	0	0	112.1	R732 Y733 A734 W740 F957	R732-S736 WeakPolarHBondContact O-CB 3.46Å; R732-S736 PolarHBondContact O-N 2.99Å; R732-S736 PolarHBondContact O-OG 3.27Å; Y733-S736 PolarHBondContact O-N 3.12Å; A734-S736 VanDerWaalsContact C-N 3.33Å; A734-S736 PolarHBondContact O-N 3.21Å; S736-W740 VanDerWaalsContact O-CB 3.27Å; S736-W740 WeakPolarHBondContact O-CB 3.47Å; S736-W740 PolarHBondContact O-N 2.97Å; S736-F957 VanDerWaalsContact OG-CE1 3.23Å; S736-F957 WeakPolarHBondContact OG-CE1 3.42Å
737	A	97.1	Very high	95.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.7	-41.7	-179.5	0	0	0	0	0	111.7	V580 Y733 A734 L741 L944	V580-A737 HydrophobicContact CG2-CB 4.08Å; Y733-A737 HydrophobicContact CE1-CB 4.29Å; Y733-A737 VanDerWaalsContact O-CB 3.28Å; Y733-A737 WeakPolarHBondContact O-CB 3.39Å; Y733-A737 PolarHBondContact O-N 2.99Å; A734-A737 PolarHBondContact O-N 3.44Å; A737-L741 WeakPolarHBondContact O-CB 3.32Å; A737-L741 VanDerWaalsContact O-CG 3.25Å; A737-L741 WeakPolarHBondContact O-CG 3.38Å; A737-L741 PolarHBondContact O-N 3.32Å; A737-L944 HydrophobicContact CB-CD1 4.12Å
738	A	96.7	Very high	95.7	Very high	32 Å²	32	25.8 Å²	25.8	26%	0.264	14%	0.138	S	C	.	.	H	α-helix	trans	-60.7	-50.7	178.1	0	0	0	0	0	112	L584 A734 A742	L584-A738 HydrophobicContact CD2-CB 3.86Å; A734-A738 WeakPolarHBondContact O-CB 3.48Å; A734-A738 PolarHBondContact O-N 3.1Å; A738-A742 VanDerWaalsContact O-CB 3.23Å; A738-A742 WeakPolarHBondContact O-CB 3.5Å; A738-A742 PolarHBondContact O-N 3.19Å
739	L	96.8	Very high	95.7	Very high	23 Å²	23	29.5 Å²	29.5	12%	0.12	16%	0.16	C	C	.	.	H	α-helix	trans	-63.5	-46.9	-179.6	-74.6	172.9	0	0	0	111.5	F698 L699 F704 V735 L741 A742 I743	F698-L739 HydrophobicContact CB-CD1 3.97Å; F698-L739 HydrophobicContact CB-CD2 4.15Å; F698-L739 HydrophobicContact CG-CD2 4.44Å; L699-L739 HydrophobicContact CD2-CD1 3.64Å; L699-L739 HydrophobicContact CG-CD1 3.88Å; F704-L739 HydrophobicContact CB-CD1 4.04Å; F704-L739 HydrophobicContact CD1-CD1 4.06Å; F704-L739 HydrophobicContact CD1-CD2 4.08Å; F704-L739 HydrophobicContact CD1-CG 4.39Å; F704-L739 HydrophobicContact CE1-CD2 4.17Å; F704-L739 HydrophobicContact CG-CD1 4.22Å; V735-L739 HydrophobicContact CG1-CD1 4.01Å; V735-L739 WeakPolarHBondContact O-CB 3.35Å; V735-L739 WeakPolarHBondContact O-CG 2.78Å; V735-L739 PolarHBondContact O-N 3.11Å; V735-L739 VanDerWaalsContact O-N 3.07Å; L739-L741 PolarHBondContact O-N 3.32Å; L739-A742 PolarHBondContact O-N 2.03Å; L739-I743 WeakPolarHBondContact O-CB 3.4Å; L739-I743 WeakPolarHBondContact O-CD1 3.49Å; L739-I743 VanDerWaalsContact O-CG1 3.23Å; L739-I743 WeakPolarHBondContact O-CG1 3.33Å; L739-I743 PolarHBondContact O-N 3.44Å
740	W	97.1	Very high	95.6	Very high	1 Å²	1	31 Å²	31	0%	0.004	17%	0.17	C	C	.	.	H	α-helix	trans	-63.3	-43.5	-179	-173.3	-68.2	0	0	0	112.1	Q691 V692 V695 S736 G744 L940 D943 L944 F947 T964	Q691-W740 HydrophobicContact CG-CD2 4.49Å; Q691-W740 HydrophobicContact CG-CH2 4.34Å; Q691-W740 HydrophobicContact CG-CZ2 3.94Å; Q691-W740 PolarHBondContact NE2-O 3.17Å; V692-W740 HydrophobicContact CG2-CH2 3.87Å; V692-W740 HydrophobicContact CG2-CZ3 4.34Å; V695-W740 HydrophobicContact CB-CE3 4.26Å; V695-W740 HydrophobicContact CG1-CE3 4.06Å; V695-W740 HydrophobicContact CG2-CB 4.17Å; V695-W740 HydrophobicContact CG2-CD2 4.28Å; V695-W740 HydrophobicContact CG2-CE3 3.83Å; V695-W740 HydrophobicContact CG2-CG 4.48Å; S736-W740 VanDerWaalsContact O-CB 3.27Å; S736-W740 WeakPolarHBondContact O-CB 3.47Å; S736-W740 PolarHBondContact O-N 2.97Å; W740-G744 PolarHBondContact O-N 2.75Å; W740-L940 VanDerWaalsContact NE1-CD1 3.32Å; W740-D943 HydrophobicContact CZ2-CB 3.74Å; W740-L944 HydrophobicContact CB-CD1 3.84Å; W740-L944 HydrophobicContact CD2-CB 4.4Å; W740-L944 HydrophobicContact CG-CB 4.1Å; W740-L944 HydrophobicContact CG-CD1 3.83Å; W740-L944 HydrophobicContact CG-CG 4.34Å; W740-F947 HydrophobicContact CE3-CB 4.37Å; W740-F947 HydrophobicContact CE3-CD1 4.37Å; W740-F947 HydrophobicContact CE3-CD2 4.34Å; W740-F947 HydrophobicContact CE3-CG 4.1Å; W740-F947 HydrophobicContact CH2-CB 4.49Å; W740-F947 HydrophobicContact CZ3-CB 4.06Å; W740-F947 AromaticContact CZ3-CD2 3.79Å; W740-F947 HydrophobicContact CZ3-CD2 3.79Å; W740-F947 HydrophobicContact CZ3-CE2 4.4Å; W740-F947 AromaticContact CZ3-CG 3.88Å; W740-F947 HydrophobicContact CZ3-CG 3.88Å; W740-T964 HydrophobicContact CH2-CG2 3.68Å; W740-T964 HydrophobicContact CZ2-CG2 4.34Å; W740-T964 HydrophobicContact CZ3-CG2 4.47Å
741	L	96.9	Very high	95.4	Very high	38 Å²	38	32.1 Å²	32.1	20%	0.199	17%	0.174	C	C	.	.	H	α-helix	trans	-66.2	-44.7	175.2	-71	173.2	0	0	0	111.9	F576 V580 A737 L739 I743 G744 I745 L940 L944	F576-L741 HydrophobicContact CZ-CD1 3.99Å; F576-L741 HydrophobicContact CZ-CD2 4.11Å; V580-L741 HydrophobicContact CG1-CD1 4.27Å; A737-L741 WeakPolarHBondContact O-CB 3.32Å; A737-L741 VanDerWaalsContact O-CG 3.25Å; A737-L741 WeakPolarHBondContact O-CG 3.38Å; A737-L741 PolarHBondContact O-N 3.32Å; L739-L741 PolarHBondContact O-N 3.32Å; L741-I743 PolarHBondContact O-N 2.95Å; L741-G744 PolarHBondContact O-N 2.8Å; L741-I745 WeakPolarHBondContact O-CB 3.3Å; L741-I745 WeakPolarHBondContact O-CD1 3.23Å; L741-I745 WeakPolarHBondContact O-CG1 2.92Å; L741-I745 PolarHBondContact O-N 3.1Å; L741-L940 HydrophobicContact CD2-CD2 4.44Å; L741-L944 HydrophobicContact CD2-CD1 4.17Å; L741-L944 HydrophobicContact CG-CD1 3.88Å
742	A	96.6	Very high	95.1	Very high	48 Å²	48	34 Å²	34	40%	0.397	19%	0.19	S	C	.	.	H	α-helix	trans	-59.3	-49.6	179.1	0	0	0	0	0	111.3	A738 L739 G744 I745 I746	A738-A742 VanDerWaalsContact O-CB 3.23Å; A738-A742 WeakPolarHBondContact O-CB 3.5Å; A738-A742 PolarHBondContact O-N 3.19Å; L739-A742 PolarHBondContact O-N 2.03Å; A742-G744 PolarHBondContact O-N 3.07Å; A742-I745 PolarHBondContact O-N 3.08Å; A742-I746 WeakPolarHBondContact O-CB 3.39Å; A742-I746 WeakPolarHBondContact O-CD1 3.24Å; A742-I746 WeakPolarHBondContact O-CG1 3.33Å; A742-I746 PolarHBondContact O-N 2.83Å
743	I	97	Very high	94.9	Very high	17 Å²	17	37.1 Å²	37.1	9%	0.087	21%	0.21	C	C	.	.	H	α-helix	trans	-64.9	-42.2	178.9	-62.8	161.1	0	0	0	110.5	T694 V695 F698 L739 L741 I746 Q747	T694-I743 HydrophobicContact CG2-CD1 3.73Å; T694-I743 HydrophobicContact CG2-CG1 4.21Å; T694-I743 HydrophobicContact CG2-CG2 4.18Å; V695-I743 HydrophobicContact CB-CD1 4.41Å; V695-I743 HydrophobicContact CG2-CD1 3.6Å; F698-I743 HydrophobicContact CD2-CD1 4.1Å; L739-I743 WeakPolarHBondContact O-CB 3.4Å; L739-I743 WeakPolarHBondContact O-CD1 3.49Å; L739-I743 VanDerWaalsContact O-CG1 3.23Å; L739-I743 WeakPolarHBondContact O-CG1 3.33Å; L739-I743 PolarHBondContact O-N 3.44Å; L741-I743 PolarHBondContact O-N 2.95Å; I743-I746 PolarHBondContact O-N 3.26Å; I743-Q747 WeakPolarHBondContact O-CG 3.46Å; I743-Q747 PolarHBondContact O-N 2.85Å
744	G	95.9	Very high	94.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.1	-42.5	178.9	0	0	0	0	0	112.8	W740 L741 A742 Q747 I748	W740-G744 PolarHBondContact O-N 2.75Å; L741-G744 PolarHBondContact O-N 2.8Å; A742-G744 PolarHBondContact O-N 3.07Å; G744-Q747 PolarHBondContact O-N 3.01Å; G744-I748 WeakPolarHBondContact O-CG1 3.25Å; G744-I748 PolarHBondContact O-N 2.85Å
745	I	95	Very high	94.2	Very high	96 Å²	96	45.6 Å²	45.6	49%	0.492	25%	0.245	S	C	.	.	H	α-helix	trans	-65	-44.5	175.9	-69.5	165.7	0	0	0	110.4	L741 A742 Q747 I748 V749	L741-I745 WeakPolarHBondContact O-CB 3.3Å; L741-I745 WeakPolarHBondContact O-CD1 3.23Å; L741-I745 WeakPolarHBondContact O-CG1 2.92Å; L741-I745 PolarHBondContact O-N 3.1Å; A742-I745 PolarHBondContact O-N 3.08Å; I745-Q747 VanDerWaalsContact C-N 3.29Å; I745-Q747 PolarHBondContact O-N 2.69Å; I745-I748 PolarHBondContact O-N 3Å; I745-V749 HydrophobicContact CG2-CG2 4.22Å; I745-V749 WeakPolarHBondContact O-CB 3.34Å; I745-V749 VanDerWaalsContact O-CG2 3.31Å; I745-V749 WeakPolarHBondContact O-CG2 3.22Å; I745-V749 PolarHBondContact O-N 3.01Å
746	I	95.6	Very high	93.8	Very high	115 Å²	115	47.4 Å²	47.4	59%	0.59	25%	0.254	S	S	*	.	H	α-helix	trans	-58.7	-43.6	176.7	-70.6	165.1	0	0	0	110.5	A742 I743 V749 F750	A742-I746 WeakPolarHBondContact O-CB 3.39Å; A742-I746 WeakPolarHBondContact O-CD1 3.24Å; A742-I746 WeakPolarHBondContact O-CG1 3.33Å; A742-I746 PolarHBondContact O-N 2.83Å; I743-I746 PolarHBondContact O-N 3.26Å; I746-V749 PolarHBondContact O-N 2.83Å; I746-F750 VanDerWaalsContact O-CB 3.27Å; I746-F750 WeakPolarHBondContact O-CB 3.26Å; I746-F750 PolarHBondContact O-N 2.95Å
747	Q	94.8	Very high	93.4	Very high	20 Å²	20	57 Å²	57	9%	0.093	29%	0.29	C	S	.	.	H	α-helix	trans	-63.3	-45.5	176.2	-74.9	-168.1	66.4	0	0	112.4	I686 F690 I743 G744 I745 V749 F750 F751	I686-Q747 HydrophobicContact CG1-CB 4.21Å; I686-Q747 HydrophobicContact CG2-CB 4.46Å; F690-Q747 HydrophobicContact CD1-CG 4.29Å; F690-Q747 HydrophobicContact CE1-CG 4.32Å; I743-Q747 WeakPolarHBondContact O-CG 3.46Å; I743-Q747 PolarHBondContact O-N 2.85Å; G744-Q747 PolarHBondContact O-N 3.01Å; I745-Q747 VanDerWaalsContact C-N 3.29Å; I745-Q747 PolarHBondContact O-N 2.69Å; Q747-V749 PolarHBondContact O-N 3.3Å; Q747-F750 PolarHBondContact O-N 2.98Å; Q747-F751 VanDerWaalsContact O-CB 3.3Å; Q747-F751 WeakPolarHBondContact O-CB 3.03Å; Q747-F751 PolarHBondContact O-N 3.33Å
748	I	92.9	Very high	93	Very high	47 Å²	47	64.1 Å²	64.1	24%	0.241	32%	0.321	C	S	.	.	H	α-helix	trans	-61.3	-45	177.7	-70	162.5	0	0	0	110.9	I686 G744 I745 F751 A752 E936 L940	I686-I748 HydrophobicContact CD1-CD1 3.87Å; I686-I748 HydrophobicContact CD1-CG1 3.8Å; I686-I748 HydrophobicContact CG1-CD1 4.4Å; I686-I748 HydrophobicContact CG1-CG1 3.78Å; G744-I748 WeakPolarHBondContact O-CG1 3.25Å; G744-I748 PolarHBondContact O-N 2.85Å; I745-I748 PolarHBondContact O-N 3Å; I748-F751 PolarHBondContact O-N 3.39Å; I748-A752 VanDerWaalsContact O-CB 3.3Å; I748-A752 WeakPolarHBondContact O-CB 3.48Å; I748-A752 PolarHBondContact O-N 2.04Å; I748-E936 HydrophobicContact CD1-CG 4.04Å; I748-E936 HydrophobicContact CG1-CG 4.13Å; I748-L940 HydrophobicContact CD1-CD2 4.39Å
749	V	93.2	Very high	92.7	Very high	78 Å²	78	68 Å²	68	47%	0.473	34%	0.336	S	S	.	.	H	α-helix	trans	-64.8	-44.2	178.8	171.9	0	0	0	0	110.5	I745 I746 Q747 F751 V753	I745-V749 HydrophobicContact CG2-CG2 4.22Å; I745-V749 WeakPolarHBondContact O-CB 3.34Å; I745-V749 VanDerWaalsContact O-CG2 3.31Å; I745-V749 WeakPolarHBondContact O-CG2 3.22Å; I745-V749 PolarHBondContact O-N 3.01Å; I746-V749 PolarHBondContact O-N 2.83Å; Q747-V749 PolarHBondContact O-N 3.3Å; V749-F751 VanDerWaalsContact C-N 3.34Å; V749-F751 PolarHBondContact O-N 3.34Å; V749-V753 HydrophobicContact CG1-CG2 4.12Å; V749-V753 VanDerWaalsContact O-CB 3.24Å; V749-V753 WeakPolarHBondContact O-CB 3.26Å; V749-V753 WeakPolarHBondContact O-CG2 3.35Å; V749-V753 PolarHBondContact O-N 2.82Å
750	F	92.8	Very high	92.3	Very high	116 Å²	116	69.1 Å²	69.1	51%	0.509	34%	0.341	S	S	.	.	H	α-helix	trans	-59.3	-46.8	175.4	176.1	-97.1	0	0	0	111.4	I746 Q747 F754 Y755	I746-F750 VanDerWaalsContact O-CB 3.27Å; I746-F750 WeakPolarHBondContact O-CB 3.26Å; I746-F750 PolarHBondContact O-N 2.95Å; Q747-F750 PolarHBondContact O-N 2.98Å; F750-F754 HydrophobicContact CD2-CB 4.25Å; F750-F754 HydrophobicContact CD2-CD2 4.1Å; F750-F754 HydrophobicContact CD2-CG 4.42Å; F750-F754 HydrophobicContact CE2-CB 4.19Å; F750-F754 WeakPolarHBondContact O-CA 3.14Å; F750-F754 WeakPolarHBondContact O-CB 3.37Å; F750-F754 PolarHBondContact O-N 3.22Å; F750-Y755 PolarHBondContact O-N 3.24Å; F750-Y755 VanDerWaalsContact O-N 3.15Å
751	F	90.2	Very high	91.8	Very high	28 Å²	28	70.6 Å²	70.6	12%	0.123	35%	0.349	C	S	.	.	I	π-helix	trans	-64.2	-49.7	-179.4	-169	-91.2	0	0	0	111.5	K685 Q747 I748 V749 Y755 E756 Y933	K685-F751 HydrophobicContact CB-CB 4.41Å; K685-F751 HydrophobicContact CB-CD1 3.77Å; K685-F751 HydrophobicContact CB-CE1 4.29Å; K685-F751 HydrophobicContact CB-CG 4.1Å; K685-F751 HydrophobicContact CD-CD1 4.13Å; K685-F751 HydrophobicContact CG-CD1 3.76Å; K685-F751 HydrophobicContact CG-CE1 3.96Å; Q747-F751 VanDerWaalsContact O-CB 3.3Å; Q747-F751 WeakPolarHBondContact O-CB 3.03Å; Q747-F751 PolarHBondContact O-N 3.33Å; I748-F751 PolarHBondContact O-N 3.39Å; V749-F751 VanDerWaalsContact C-N 3.34Å; V749-F751 PolarHBondContact O-N 3.34Å; F751-Y755 AromaticContact CD2-CD1 3.8Å; F751-Y755 HydrophobicContact CD2-CD1 3.8Å; F751-Y755 AromaticContact CD2-CG 3.84Å; F751-Y755 HydrophobicContact CD2-CG 3.84Å; F751-Y755 AromaticContact CE2-CD1 3.3Å; F751-Y755 HydrophobicContact CE2-CD1 3.3Å; F751-Y755 AromaticContact CE2-CE1 3.72Å; F751-Y755 HydrophobicContact CE2-CE1 3.72Å; F751-Y755 AromaticContact CE2-CG 3.81Å; F751-Y755 HydrophobicContact CE2-CG 3.81Å; F751-Y755 AromaticContact CZ-CD1 3.77Å; F751-Y755 HydrophobicContact CZ-CD1 3.77Å; F751-Y755 HydrophobicContact CZ-CE1 4.16Å; F751-Y755 WeakPolarHBondContact O-CB 3.38Å; F751-Y755 PolarHBondContact O-N 2.74Å; F751-Y755 VanDerWaalsContact O-N 3.16Å; F751-E756 HydrophobicContact CD1-CG 3.75Å; F751-E756 WeakPolarHBondContact CD1-OE1 3.27Å; F751-E756 HydrophobicContact CE1-CG 3.5Å; F751-E756 VanDerWaalsContact CE1-CG 3.5Å; F751-E756 WeakPolarHBondContact CE1-OE1 3.42Å; F751-E756 HydrophobicContact CZ-CG 4.29Å; F751-E756 WeakPolarHBondContact O-CG 3.06Å; F751-E756 PolarHBondContact O-N 3.38Å; F751-Y933 AromaticContact CE1-CE2 3.65Å; F751-Y933 HydrophobicContact CE1-CE2 3.65Å; F751-Y933 HydrophobicContact CZ-CE2 4.14Å
752	A	87.6	Confident	91.5	Very high	40 Å²	40	71.4 Å²	71.4	33%	0.331	35%	0.351	S	S	.	.	I	π-helix	trans	-69.5	-39.5	-177.8	0	0	0	0	0	113.8	I748	I748-A752 VanDerWaalsContact O-CB 3.3Å; I748-A752 WeakPolarHBondContact O-CB 3.48Å; I748-A752 PolarHBondContact O-N 2.04Å
753	V	90.4	Very high	91.2	Very high	75 Å²	75	69.2 Å²	69.2	46%	0.455	33%	0.333	S	S	.	.	I	π-helix	trans	-86.9	-38.9	-174.6	177.9	0	0	0	0	112	V749 R757	V749-V753 HydrophobicContact CG1-CG2 4.12Å; V749-V753 VanDerWaalsContact O-CB 3.24Å; V749-V753 WeakPolarHBondContact O-CB 3.26Å; V749-V753 WeakPolarHBondContact O-CG2 3.35Å; V749-V753 PolarHBondContact O-N 2.82Å; V753-R757 WeakPolarHBondContact O-CB 3.2Å
754	F	90.8	Very high	90.9	Very high	111 Å²	111	75 Å²	75	49%	0.487	35%	0.353	S	S	.	.	I	π-helix	trans	-105.7	-54.3	-174.3	-65.7	-85.9	0	0	0	112.8	F750 F758	F750-F754 HydrophobicContact CD2-CB 4.25Å; F750-F754 HydrophobicContact CD2-CD2 4.1Å; F750-F754 HydrophobicContact CD2-CG 4.42Å; F750-F754 HydrophobicContact CE2-CB 4.19Å; F750-F754 WeakPolarHBondContact O-CA 3.14Å; F750-F754 WeakPolarHBondContact O-CB 3.37Å; F750-F754 PolarHBondContact O-N 3.22Å; F754-F758 HydrophobicContact CD1-CD2 4.41Å; F754-F758 HydrophobicContact CD1-CE2 4.35Å; F754-F758 WeakPolarHBondContact O-CB 3.32Å; F754-F758 WeakPolarHBondContact O-CD2 3.27Å; F754-F758 PolarHBondContact O-N 2.99Å
755	Y	89.1	Confident	90.7	Very high	68 Å²	68	79 Å²	79	27%	0.267	37%	0.372	S	S	.	.	I	π-helix	trans	-66.8	-53.9	-172.2	-168.3	-84	0	0	0	112.3	F750 F751 R757 I759 E760	F750-Y755 PolarHBondContact O-N 3.24Å; F750-Y755 VanDerWaalsContact O-N 3.15Å; F751-Y755 AromaticContact CD2-CD1 3.8Å; F751-Y755 HydrophobicContact CD2-CD1 3.8Å; F751-Y755 AromaticContact CD2-CG 3.84Å; F751-Y755 HydrophobicContact CD2-CG 3.84Å; F751-Y755 AromaticContact CE2-CD1 3.3Å; F751-Y755 HydrophobicContact CE2-CD1 3.3Å; F751-Y755 AromaticContact CE2-CE1 3.72Å; F751-Y755 HydrophobicContact CE2-CE1 3.72Å; F751-Y755 AromaticContact CE2-CG 3.81Å; F751-Y755 HydrophobicContact CE2-CG 3.81Å; F751-Y755 AromaticContact CZ-CD1 3.77Å; F751-Y755 HydrophobicContact CZ-CD1 3.77Å; F751-Y755 HydrophobicContact CZ-CE1 4.16Å; F751-Y755 WeakPolarHBondContact O-CB 3.38Å; F751-Y755 PolarHBondContact O-N 2.74Å; F751-Y755 VanDerWaalsContact O-N 3.16Å; Y755-R757 VanDerWaalsContact C-N 3.25Å; Y755-R757 PolarHBondContact O-N 3.06Å; Y755-I759 HydrophobicContact CD2-CB 4.18Å; Y755-I759 HydrophobicContact CD2-CD1 3.66Å; Y755-I759 HydrophobicContact CD2-CG1 4.49Å; Y755-I759 HydrophobicContact CD2-CG2 4.25Å; Y755-I759 HydrophobicContact CE2-CB 4.27Å; Y755-I759 HydrophobicContact CE2-CD1 4.11Å; Y755-I759 HydrophobicContact CE2-CG2 3.84Å; Y755-I759 HydrophobicContact CG-CB 4.37Å; Y755-I759 HydrophobicContact CG-CD1 4.36Å; Y755-I759 WeakPolarHBondContact O-CA 3.27Å; Y755-I759 WeakPolarHBondContact O-CB 3.48Å; Y755-I759 PolarHBondContact O-N 2.95Å; Y755-E760 WeakPolarHBondContact CD1-O 3.49Å; Y755-E760 HydrophobicContact CE1-CB 3.87Å; Y755-E760 WeakPolarHBondContact CE1-O 3.31Å; Y755-E760 PolarHBondContact O-N 2.83Å; Y755-E760 PolarHBondContact OH-OE2 3.28Å
756	E	88.3	Confident	90.6	Very high	43 Å²	43	74.7 Å²	74.7	20%	0.201	35%	0.35	C	S	.	.	H	α-helix	trans	-60.7	-35.6	-179.7	-70.2	173.4	-159.9	0	0	111.6	K685 F751 Y933	K685-E756 IonicContact NZ-OE1 2.71Å; K685-E756 PolarHBondContact NZ-OE1 2.86Å; K685-E756 IonicContact NZ-OE2 4Å; F751-E756 HydrophobicContact CD1-CG 3.75Å; F751-E756 WeakPolarHBondContact CD1-OE1 3.27Å; F751-E756 HydrophobicContact CE1-CG 3.5Å; F751-E756 VanDerWaalsContact CE1-CG 3.5Å; F751-E756 WeakPolarHBondContact CE1-OE1 3.42Å; F751-E756 HydrophobicContact CZ-CG 4.29Å; F751-E756 WeakPolarHBondContact O-CG 3.06Å; F751-E756 PolarHBondContact O-N 3.38Å; E756-Y933 PolarHBondContact OE1-OH 2.72Å
757	R	86.9	Confident	90.5	Very high	201 Å²	201	69.3 Å²	69.3	76%	0.758	32%	0.322	S	S	*	.	H	α-helix	trans	-84.6	-34.8	-174.2	-170.2	168.9	-178.2	166.9	1.2	114.5	V753 Y755	V753-R757 WeakPolarHBondContact O-CB 3.2Å; Y755-R757 VanDerWaalsContact C-N 3.25Å; Y755-R757 PolarHBondContact O-N 3.06Å
758	F	89.3	Confident	90.3	Very high	150 Å²	150	70.5 Å²	70.5	66%	0.658	33%	0.329	S	S	*	.	H	α-helix	trans	-116.5	-19.1	-171.3	-61	-75.2	0	0	0	114.5	F754	F754-F758 HydrophobicContact CD1-CD2 4.41Å; F754-F758 HydrophobicContact CD1-CE2 4.35Å; F754-F758 WeakPolarHBondContact O-CB 3.32Å; F754-F758 WeakPolarHBondContact O-CD2 3.27Å; F754-F758 PolarHBondContact O-N 2.99Å
759	I	89.6	Confident	90.2	Very high	113 Å²	113	69.7 Å²	69.7	58%	0.579	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.3	-68.6	-175.5	-59.6	171.4	0	0	0	109.8	Y755	Y755-I759 HydrophobicContact CD2-CB 4.18Å; Y755-I759 HydrophobicContact CD2-CD1 3.66Å; Y755-I759 HydrophobicContact CD2-CG1 4.49Å; Y755-I759 HydrophobicContact CD2-CG2 4.25Å; Y755-I759 HydrophobicContact CE2-CB 4.27Å; Y755-I759 HydrophobicContact CE2-CD1 4.11Å; Y755-I759 HydrophobicContact CE2-CG2 3.84Å; Y755-I759 HydrophobicContact CG-CB 4.37Å; Y755-I759 HydrophobicContact CG-CD1 4.36Å; Y755-I759 WeakPolarHBondContact O-CA 3.27Å; Y755-I759 WeakPolarHBondContact O-CB 3.48Å; Y755-I759 PolarHBondContact O-N 2.95Å
760	E	87.4	Confident	90.2	Very high	47 Å²	47	66 Å²	66	22%	0.22	30%	0.303	C	S	.	.			trans	-159.3	127.4	-170.6	-160.8	-176.9	-160.4	0	0	111.8	Y755 K762 Q765	Y755-E760 WeakPolarHBondContact CD1-O 3.49Å; Y755-E760 HydrophobicContact CE1-CB 3.87Å; Y755-E760 WeakPolarHBondContact CE1-O 3.31Å; Y755-E760 PolarHBondContact O-N 2.83Å; Y755-E760 PolarHBondContact OH-OE2 3.28Å; E760-K762 HydrophobicContact CG-CD 4.26Å; E760-K762 WeakPolarHBondContact OE1-CD 3.34Å; E760-K762 WeakPolarHBondContact OE1-CE 3.29Å; E760-K762 IonicContact OE1-NZ 3.29Å; E760-K762 PolarHBondContact OE1-NZ 2.78Å; E760-K762 VanDerWaalsContact OE2-CE 3.27Å; E760-K762 WeakPolarHBondContact OE2-CE 3.11Å; E760-K762 IonicContact OE2-NZ 3.07Å; E760-Q765 PolarHBondContact OE1-OE1 3.14Å
761	D	88.5	Confident	90.1	Very high	32 Å²	32	60.7 Å²	60.7	17%	0.171	28%	0.28	C	S	.	.			trans	-111.6	93.6	167.9	-177	-12.3	0	0	0	109.4	I763 R764 Q765	D761-I763 PolarHBondContact O-N 2.66Å; D761-I763 PolarHBondContact OD1-N 2.64Å; D761-R764 HydrophobicContact CB-CB 4Å; D761-R764 VanDerWaalsContact CG-CB 3.44Å; D761-R764 PolarHBondContact O-N 3.15Å; D761-R764 PolarHBondContact OD1-N 2.87Å; D761-R764 VanDerWaalsContact OD2-CB 3.31Å; D761-R764 WeakPolarHBondContact OD2-CB 3.35Å; D761-Q765 WeakPolarHBondContact O-CB 3.4Å; D761-Q765 WeakPolarHBondContact O-CG 3.48Å; D761-Q765 PolarHBondContact O-N 3.4Å
762	K	89.1	Confident	90	Very high	54 Å²	54	62.6 Å²	62.6	24%	0.235	29%	0.29	C	S	.	.	H	α-helix	trans	-58.7	-32.8	-179.6	-71.1	-65.5	-162.3	-173.2	0	113	E679 E760 F766	E679-K762 IonicContact OE1-NZ 3.82Å; E760-K762 HydrophobicContact CG-CD 4.26Å; E760-K762 WeakPolarHBondContact OE1-CD 3.34Å; E760-K762 WeakPolarHBondContact OE1-CE 3.29Å; E760-K762 IonicContact OE1-NZ 3.29Å; E760-K762 PolarHBondContact OE1-NZ 2.78Å; E760-K762 VanDerWaalsContact OE2-CE 3.27Å; E760-K762 WeakPolarHBondContact OE2-CE 3.11Å; E760-K762 IonicContact OE2-NZ 3.07Å; K762-F766 WeakPolarHBondContact O-CB 3.32Å; K762-F766 PolarHBondContact O-N 2.79Å; K762-F766 VanDerWaalsContact O-N 3.16Å
763	I	91.2	Very high	90.2	Very high	3 Å²	3	61.3 Å²	61.3	2%	0.015	28%	0.279	C	S	.	.	H	α-helix	trans	-74.3	-45.4	-177.4	-61.4	-57.7	0	0	0	109.9	D761 F766 V767 Y925 F927 L931 Y933	D761-I763 PolarHBondContact O-N 2.66Å; D761-I763 PolarHBondContact OD1-N 2.64Å; I763-F766 PolarHBondContact O-N 2.75Å; I763-V767 PolarHBondContact O-N 2.81Å; I763-Y925 HydrophobicContact CG2-CD1 4.41Å; I763-Y925 HydrophobicContact CG2-CD2 4.33Å; I763-Y925 HydrophobicContact CG2-CG 3.87Å; I763-F927 HydrophobicContact CG2-CE1 3.8Å; I763-F927 HydrophobicContact CG2-CE2 4.34Å; I763-F927 HydrophobicContact CG2-CZ 3.51Å; I763-L931 HydrophobicContact CD1-CD1 3.88Å; I763-Y933 HydrophobicContact CD1-CD1 4.17Å; I763-Y933 HydrophobicContact CD1-CD2 4.45Å; I763-Y933 HydrophobicContact CD1-CG 4.1Å; I763-Y933 HydrophobicContact CG1-CD1 3.75Å; I763-Y933 HydrophobicContact CG1-CD2 4.25Å; I763-Y933 HydrophobicContact CG1-CE1 3.61Å; I763-Y933 HydrophobicContact CG1-CE2 4.13Å; I763-Y933 HydrophobicContact CG1-CG 4.03Å
764	R	90.1	Very high	90.3	Very high	137 Å²	137	57.8 Å²	57.8	52%	0.517	26%	0.257	S	S	.	.	H	α-helix	trans	-65.4	-43.3	174.9	-180	172.5	179.8	175.3	4.8	112.4	D761 F766 V767 D768 Y925	D761-R764 HydrophobicContact CB-CB 4Å; D761-R764 VanDerWaalsContact CG-CB 3.44Å; D761-R764 PolarHBondContact O-N 3.15Å; D761-R764 PolarHBondContact OD1-N 2.87Å; D761-R764 VanDerWaalsContact OD2-CB 3.31Å; D761-R764 WeakPolarHBondContact OD2-CB 3.35Å; R764-F766 PolarHBondContact O-N 2.9Å; R764-V767 WeakPolarHBondContact O-CB 3.46Å; R764-V767 PolarHBondContact O-N 3.09Å; R764-D768 PolarHBondContact O-N 3.49Å; R764-Y925 HydrophobicContact CB-CE2 4.24Å; R764-Y925 WeakPolarHBondContact CG-OH 3.44Å
765	Q	91.4	Very high	90.4	Very high	85 Å²	85	52.5 Å²	52.5	40%	0.397	23%	0.234	S	C	.	.	H	α-helix	trans	-58	-37.7	176.7	-75.9	172.3	-4	0	0	112.5	E760 D761 D768 L769	E760-Q765 PolarHBondContact OE1-OE1 3.14Å; D761-Q765 WeakPolarHBondContact O-CB 3.4Å; D761-Q765 WeakPolarHBondContact O-CG 3.48Å; D761-Q765 PolarHBondContact O-N 3.4Å; Q765-D768 PolarHBondContact O-N 3.17Å; Q765-L769 VanDerWaalsContact O-CB 3.29Å; Q765-L769 WeakPolarHBondContact O-CB 3.35Å; Q765-L769 PolarHBondContact O-N 2.76Å
766	F	93.9	Very high	90.7	Very high	5 Å²	5	49.2 Å²	49.2	2%	0.022	22%	0.221	C	C	.	.	H	α-helix	trans	-63.5	-40.7	174.9	179.8	-100.6	0	0	0	112.4	V673 E676 W677 I680 K762 I763 R764 L769 C770 V777 I789 F927	V673-F766 HydrophobicContact CG1-CE2 4.03Å; V673-F766 HydrophobicContact CG1-CZ 4.01Å; E676-F766 HydrophobicContact CB-CD2 4.03Å; E676-F766 HydrophobicContact CB-CE2 4.24Å; W677-F766 HydrophobicContact CB-CE2 3.93Å; W677-F766 HydrophobicContact CB-CZ 4.06Å; W677-F766 HydrophobicContact CD2-CZ 4.37Å; W677-F766 HydrophobicContact CE3-CD1 4.44Å; W677-F766 AromaticContact CE3-CE1 3.61Å; W677-F766 HydrophobicContact CE3-CE1 3.61Å; W677-F766 HydrophobicContact CE3-CE2 4.28Å; W677-F766 AromaticContact CE3-CZ 3.53Å; W677-F766 HydrophobicContact CE3-CZ 3.53Å; W677-F766 HydrophobicContact CZ3-CE1 4Å; W677-F766 HydrophobicContact CZ3-CZ 4.36Å; I680-F766 HydrophobicContact CD1-CB 4.17Å; I680-F766 HydrophobicContact CD1-CD1 4.01Å; I680-F766 HydrophobicContact CD1-CD2 3.96Å; I680-F766 HydrophobicContact CD1-CE1 4.45Å; I680-F766 HydrophobicContact CD1-CE2 4.41Å; I680-F766 HydrophobicContact CD1-CG 3.75Å; K762-F766 WeakPolarHBondContact O-CB 3.32Å; K762-F766 PolarHBondContact O-N 2.79Å; K762-F766 VanDerWaalsContact O-N 3.16Å; I763-F766 PolarHBondContact O-N 2.75Å; R764-F766 PolarHBondContact O-N 2.9Å; F766-L769 PolarHBondContact O-N 2.93Å; F766-C770 PolarHBondContact O-N 3.17Å; F766-C770 PolarHBondContact O-SG 3.02Å; F766-V777 HydrophobicContact CE1-CG2 4.14Å; F766-V777 HydrophobicContact CZ-CG2 4.05Å; F766-I789 HydrophobicContact CD1-CD1 4.21Å; F766-I789 HydrophobicContact CE1-CD1 3.81Å; F766-F927 HydrophobicContact CD1-CE2 4.35Å; F766-F927 HydrophobicContact CD1-CZ 4.28Å
767	V	92.9	Very high	91	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.012	21%	0.212	C	C	.	.	H	α-helix	trans	-65.1	-45.3	175.8	177	0	0	0	0	110.9	I763 R764 L769 C770 S771 I789 Q829 T830 Y925 F927	I763-V767 PolarHBondContact O-N 2.81Å; R764-V767 WeakPolarHBondContact O-CB 3.46Å; R764-V767 PolarHBondContact O-N 3.09Å; V767-L769 VanDerWaalsContact C-N 3.3Å; V767-L769 PolarHBondContact O-N 3.12Å; V767-C770 WeakPolarHBondContact O-CB 3.48Å; V767-C770 PolarHBondContact O-N 2.89Å; V767-S771 PolarHBondContact O-N 3.28Å; V767-I789 HydrophobicContact CB-CG2 4.4Å; V767-I789 HydrophobicContact CG1-CG2 4.07Å; V767-I789 HydrophobicContact CG2-CG2 4.11Å; V767-Q829 HydrophobicContact CG1-CB 3.71Å; V767-Q829 HydrophobicContact CG1-CG 4.48Å; V767-T830 HydrophobicContact CG1-CG2 4.27Å; V767-T830 HydrophobicContact CG2-CG2 3.81Å; V767-Y925 HydrophobicContact CG2-CD1 4.05Å; V767-Y925 HydrophobicContact CG2-CE1 4.04Å; V767-F927 HydrophobicContact CG2-CE1 3.85Å; V767-F927 HydrophobicContact CG2-CZ 4.09Å
768	D	90	Very high	91.4	Very high	45 Å²	45	37.6 Å²	37.6	24%	0.241	18%	0.176	C	C	.	.	H	α-helix	trans	-59.3	-43.4	175.6	-76.8	-38.8	0	0	0	111.2	R764 Q765 C770 S771 M772 R820	R764-D768 PolarHBondContact O-N 3.49Å; Q765-D768 PolarHBondContact O-N 3.17Å; D768-C770 VanDerWaalsContact C-N 3.34Å; D768-C770 PolarHBondContact O-N 3.45Å; D768-S771 PolarHBondContact O-N 2.96Å; D768-S771 VanDerWaalsContact O-N 3.16Å; D768-S771 PolarHBondContact O-OG 2.9Å; D768-M772 PolarHBondContact O-N 3.42Å; D768-R820 IonicContact OD1-NH1 3.76Å; D768-R820 PolarHBondContact OD1-NH1 2.83Å
769	L	92.1	Very high	91.6	Very high	31 Å²	31	30.6 Å²	30.6	16%	0.162	15%	0.145	C	C	.	.	H	α-helix	trans	-61.4	-41.3	177.9	175.3	62.1	0	0	0	112.9	F672 E676 Q765 F766 V767 S771 M772 S773	F672-L769 HydrophobicContact CD1-CD1 3.65Å; F672-L769 HydrophobicContact CD1-CD2 3.71Å; F672-L769 HydrophobicContact CD1-CG 4.12Å; F672-L769 HydrophobicContact CE1-CD1 3.33Å; F672-L769 HydrophobicContact CE1-CD2 3.45Å; F672-L769 VanDerWaalsContact CE1-CD2 3.45Å; F672-L769 HydrophobicContact CE1-CG 3.95Å; E676-L769 HydrophobicContact CB-CD2 3.87Å; E676-L769 HydrophobicContact CG-CD2 3.5Å; Q765-L769 VanDerWaalsContact O-CB 3.29Å; Q765-L769 WeakPolarHBondContact O-CB 3.35Å; Q765-L769 PolarHBondContact O-N 2.76Å; F766-L769 PolarHBondContact O-N 2.93Å; V767-L769 VanDerWaalsContact C-N 3.3Å; V767-L769 PolarHBondContact O-N 3.12Å; L769-S771 PolarHBondContact O-N 2.89Å; L769-M772 PolarHBondContact O-N 3.49Å; L769-S773 WeakPolarHBondContact CD1-OG 3.33Å; L769-S773 VanDerWaalsContact O-CB 3.28Å; L769-S773 WeakPolarHBondContact O-CB 3.05Å; L769-S773 PolarHBondContact O-N 3.21Å; L769-S773 PolarHBondContact O-OG 2.81Å
770	C	92.9	Very high	91.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-56	-44	176.4	-70.5	0	0	0	0	110.5	F766 V767 D768 S773 N774 I775 I789	F766-C770 PolarHBondContact O-N 3.17Å; F766-C770 PolarHBondContact O-SG 3.02Å; V767-C770 WeakPolarHBondContact O-CB 3.48Å; V767-C770 PolarHBondContact O-N 2.89Å; D768-C770 VanDerWaalsContact C-N 3.34Å; D768-C770 PolarHBondContact O-N 3.45Å; C770-S773 PolarHBondContact O-N 3.12Å; C770-N774 PolarHBondContact O-N 3.18Å; C770-I775 CarbonylContact C-O 3.53Å; C770-I775 VanDerWaalsContact CB-O 3.31Å; C770-I775 WeakPolarHBondContact CB-O 3.44Å; C770-I775 PolarHBondContact O-N 3.4Å; C770-I775 VanDerWaalsContact O-O 3.11Å; C770-I789 HydrophobicContact CB-CG2 4.31Å
771	S	89.8	Confident	91.9	Very high	4 Å²	4	24.1 Å²	24.1	3%	0.028	12%	0.115	C	C	.	.	H	α-helix	trans	-69.1	-39.5	178.5	69.2	0	0	0	0	114.6	V767 D768 L769 S773 N774 S793 Q829	V767-S771 PolarHBondContact O-N 3.28Å; D768-S771 PolarHBondContact O-N 2.96Å; D768-S771 VanDerWaalsContact O-N 3.16Å; D768-S771 PolarHBondContact O-OG 2.9Å; L769-S771 PolarHBondContact O-N 2.89Å; S771-S773 VanDerWaalsContact C-N 3.31Å; S771-S773 PolarHBondContact O-N 2.99Å; S771-N774 PolarHBondContact O-N 2.87Å; S771-S793 WeakPolarHBondContact O-CB 3.43Å; S771-Q829 PolarHBondContact OG-NE2 2.86Å
772	M	88.9	Confident	92	Very high	68 Å²	68	24.3 Å²	24.3	34%	0.335	11%	0.114	S	C	.	.	H	α-helix	trans	-68.1	-33	174.9	-69.1	-169.2	175.1	0	0	112.3	D768 L769 N774 A798 M805 L809	D768-M772 PolarHBondContact O-N 3.42Å; L769-M772 PolarHBondContact O-N 3.49Å; M772-N774 VanDerWaalsContact C-N 3.3Å; M772-N774 PolarHBondContact O-N 3.44Å; M772-A798 WeakPolarHBondContact O-CB 3.29Å; M772-M805 HydrophobicContact SD-CE 4.29Å; M772-L809 HydrophobicContact CE-CD2 3.67Å
773	S	90.8	Very high	92	Very high	13 Å²	13	26.6 Å²	26.6	9%	0.091	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-2.4	-179.1	-55.8	0	0	0	0	113.6	R669 L769 C770 S771 I775	R669-S773 WeakPolarHBondContact CD-O 3.12Å; R669-S773 PolarHBondContact NH1-O 2.91Å; L769-S773 WeakPolarHBondContact CD1-OG 3.33Å; L769-S773 VanDerWaalsContact O-CB 3.28Å; L769-S773 WeakPolarHBondContact O-CB 3.05Å; L769-S773 PolarHBondContact O-N 3.21Å; L769-S773 PolarHBondContact O-OG 2.81Å; C770-S773 PolarHBondContact O-N 3.12Å; S771-S773 VanDerWaalsContact C-N 3.31Å; S771-S773 PolarHBondContact O-N 2.99Å; S773-I775 VanDerWaalsContact C-N 3.27Å; S773-I775 PolarHBondContact O-N 2.89Å
774	N	92.8	Very high	91.9	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	38.2	-175.4	-161.2	31.4	0	0	0	112.9	W641 E642 C770 S771 M772 G791 S793 A798	W641-N774 WeakPolarHBondContact CB-OD1 3.38Å; W641-N774 PolarHBondContact N-O 2.97Å; E642-N774 PolarHBondContact N-ND2 3.09Å; E642-N774 PolarHBondContact OE2-ND2 3.06Å; C770-N774 PolarHBondContact O-N 3.18Å; S771-N774 PolarHBondContact O-N 2.87Å; M772-N774 VanDerWaalsContact C-N 3.3Å; M772-N774 PolarHBondContact O-N 3.44Å; N774-G791 CarbonylContact C-O 3.52Å; N774-G791 WeakPolarHBondContact CA-O 3.36Å; N774-S793 PolarHBondContact OD1-N 3.01Å; N774-A798 HydrophobicContact CB-CB 3.58Å
775	I	93.8	Very high	92	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	123.2	-177.6	-68.7	165.2	0	0	0	110.1	F638 I639 R669 T670 V673 C770 S773 G791	F638-I775 HydrophobicContact CB-CG2 4.01Å; I639-I775 CarbonylContact O-C 3.57Å; I639-I775 VanDerWaalsContact O-CA 3.29Å; I639-I775 WeakPolarHBondContact O-CA 3.42Å; R669-I775 HydrophobicContact CB-CD1 3.54Å; R669-I775 WeakPolarHBondContact O-CD1 3.41Å; T670-I775 VanDerWaalsContact N-CD1 3.27Å; V673-I775 HydrophobicContact CB-CD1 4.46Å; V673-I775 HydrophobicContact CG1-CG2 4.33Å; V673-I775 HydrophobicContact CG2-CB 4.28Å; V673-I775 HydrophobicContact CG2-CD1 3.94Å; V673-I775 HydrophobicContact CG2-CG2 4.43Å; C770-I775 CarbonylContact C-O 3.53Å; C770-I775 VanDerWaalsContact CB-O 3.31Å; C770-I775 WeakPolarHBondContact CB-O 3.44Å; C770-I775 PolarHBondContact O-N 3.4Å; C770-I775 VanDerWaalsContact O-O 3.11Å; S773-I775 VanDerWaalsContact C-N 3.27Å; S773-I775 PolarHBondContact O-N 2.89Å; I775-G791 PolarHBondContact N-O 3.32Å; I775-G791 WeakPolarHBondContact O-CA 3.43Å
776	S	95.1	Very high	92.1	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	149.7	169.6	-66.6	0	0	0	0	111.3	I639 W641 Y788 I789 G791	I639-S776 PolarHBondContact N-O 2.84Å; I639-S776 PolarHBondContact O-N 2.58Å; W641-S776 PolarHBondContact NE1-OG 2.97Å; S776-Y788 PolarHBondContact OG-OH 2.88Å; S776-I789 CarbonylContact C-O 3.48Å; S776-I789 VanDerWaalsContact CA-O 3.28Å; S776-I789 WeakPolarHBondContact CA-O 3.4Å; S776-I789 VanDerWaalsContact CB-O 3.23Å; S776-I789 WeakPolarHBondContact CB-O 3.43Å; S776-G791 PolarHBondContact OG-N 2.86Å
777	V	95.1	Very high	92.2	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.2	175.9	-168	0	0	0	0	109.4	V636 F638 V673 F766 L779 Y788 I789	V636-V777 HydrophobicContact CG1-CG1 4.24Å; F638-V777 HydrophobicContact CD1-CB 4.37Å; F638-V777 HydrophobicContact CD1-CG1 3.97Å; F638-V777 HydrophobicContact CD1-CG2 3.95Å; F638-V777 HydrophobicContact CE1-CB 4.48Å; F638-V777 HydrophobicContact CE1-CG1 3.79Å; F638-V777 HydrophobicContact CE1-CG2 3.99Å; V673-V777 HydrophobicContact CG1-CG2 4.37Å; F766-V777 HydrophobicContact CE1-CG2 4.14Å; F766-V777 HydrophobicContact CZ-CG2 4.05Å; V777-L779 HydrophobicContact CG1-CD1 4.28Å; V777-L779 HydrophobicContact CG1-CD2 3.81Å; V777-L779 HydrophobicContact CG1-CG 3.84Å; V777-Y788 WeakPolarHBondContact O-CA 3.13Å; V777-I789 HydrophobicContact CB-CB 4.06Å; V777-I789 HydrophobicContact CB-CD1 4.19Å; V777-I789 HydrophobicContact CB-CG1 4.34Å; V777-I789 HydrophobicContact CG2-CB 4.42Å; V777-I789 HydrophobicContact CG2-CD1 4.46Å; V777-I789 PolarHBondContact N-O 2.92Å; V777-I789 PolarHBondContact O-N 2.99Å
778	F	94.8	Very high	92.3	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	116.7	175.6	-168.7	-91.4	0	0	0	109.2	F637 I639 L780 Y788 I833 I835 Y843 L881	F637-F778 PolarHBondContact N-O 2.98Å; F637-F778 PolarHBondContact O-N 3.42Å; I639-F778 HydrophobicContact CD1-CB 4.14Å; F778-L780 HydrophobicContact CD1-CG 4.32Å; F778-L780 HydrophobicContact CE1-CD1 3.88Å; F778-L780 HydrophobicContact CE1-CD2 3.89Å; F778-L780 HydrophobicContact CE1-CG 3.72Å; F778-L780 HydrophobicContact CZ-CD2 4.18Å; F778-L780 HydrophobicContact CZ-CG 4.5Å; F778-Y788 HydrophobicContact CB-CD2 4.49Å; F778-Y788 AromaticContact CD2-CD2 3.86Å; F778-Y788 HydrophobicContact CD2-CD2 3.86Å; F778-I833 HydrophobicContact CD2-CD1 3.91Å; F778-I833 HydrophobicContact CE1-CD1 4.18Å; F778-I833 HydrophobicContact CE2-CD1 3.26Å; F778-I833 HydrophobicContact CZ-CD1 3.42Å; F778-I833 VanDerWaalsContact CZ-CD1 3.42Å; F778-I835 HydrophobicContact CZ-CG2 4.27Å; F778-Y843 HydrophobicContact CD1-CE2 4.37Å; F778-Y843 HydrophobicContact CE1-CE2 4.33Å; F778-L881 HydrophobicContact CD1-CD2 4.39Å; F778-L881 HydrophobicContact CD2-CD2 4.49Å; F778-L881 HydrophobicContact CE1-CD2 4.35Å; F778-L881 HydrophobicContact CE2-CD2 4.47Å; F778-L881 HydrophobicContact CG-CD2 4.46Å; F778-L881 HydrophobicContact CZ-CD2 4.39Å
779	L	94.3	Very high	92.6	Very high	2 Å²	2	14.8 Å²	14.8	1%	0.01	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.1	-173	-59.3	165.3	0	0	0	109.3	D635 V636 W677 V777 G786 Y787 I789 F927	D635-L779 WeakPolarHBondContact O-CA 3.36Å; V636-L779 HydrophobicContact CB-CD2 3.96Å; V636-L779 HydrophobicContact CG1-CD2 3.65Å; V636-L779 HydrophobicContact CG2-CD2 3.52Å; W677-L779 HydrophobicContact CH2-CD1 3.54Å; W677-L779 HydrophobicContact CH2-CD2 3.62Å; W677-L779 HydrophobicContact CH2-CG 4.25Å; W677-L779 HydrophobicContact CZ2-CD1 4.46Å; W677-L779 HydrophobicContact CZ2-CD2 3.75Å; W677-L779 HydrophobicContact CZ3-CD1 3.96Å; W677-L779 HydrophobicContact CZ3-CD2 4.34Å; V777-L779 HydrophobicContact CG1-CD1 4.28Å; V777-L779 HydrophobicContact CG1-CD2 3.81Å; V777-L779 HydrophobicContact CG1-CG 3.84Å; L779-G786 CarbonylContact O-C 3.2Å; L779-G786 VanDerWaalsContact O-CA 3.25Å; L779-G786 WeakPolarHBondContact O-CA 3.45Å; L779-Y787 WeakPolarHBondContact CA-O 3.4Å; L779-Y787 WeakPolarHBondContact CB-O 3.39Å; L779-Y787 PolarHBondContact N-O 2.82Å; L779-Y787 PolarHBondContact O-N 2.82Å; L779-I789 HydrophobicContact CD1-CD1 4.41Å; L779-F927 HydrophobicContact CD1-CB 4.27Å
780	L	92.6	Very high	92.7	Very high	3 Å²	3	13.9 Å²	13.9	2%	0.016	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	109	168.1	-63.3	177.8	0	0	0	109.1	D635 F778 I833 I835 Y843	D635-L780 HydrophobicContact CB-CB 4.13Å; D635-L780 PolarHBondContact N-O 3.21Å; D635-L780 VanDerWaalsContact N-O 3.09Å; D635-L780 PolarHBondContact O-N 3.04Å; F778-L780 HydrophobicContact CD1-CG 4.32Å; F778-L780 HydrophobicContact CE1-CD1 3.88Å; F778-L780 HydrophobicContact CE1-CD2 3.89Å; F778-L780 HydrophobicContact CE1-CG 3.72Å; F778-L780 HydrophobicContact CZ-CD2 4.18Å; F778-L780 HydrophobicContact CZ-CG 4.5Å; L780-I833 HydrophobicContact CD2-CD1 4.03Å; L780-I835 HydrophobicContact CD1-CD1 3.94Å; L780-I835 HydrophobicContact CD2-CD1 3.94Å; L780-I835 HydrophobicContact CD2-CG1 4.5Å; L780-Y843 HydrophobicContact CD1-CD1 4.42Å; L780-Y843 HydrophobicContact CD1-CE1 4.27Å
781	S	91.1	Very high	92.7	Very high	21 Å²	21	13.9 Å²	13.9	15%	0.147	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-27.6	175.9	61.2	0	0	0	0	111.6	F785	S781-F785 PolarHBondContact N-O 3.45Å; S781-F785 VanDerWaalsContact N-O 3.08Å; S781-F785 PolarHBondContact OG-O 2.85Å
782	H	89.5	Confident	92.8	Very high	36 Å²	36	17.5 Å²	17.5	17%	0.167	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	176.8	171.5	-58.6	-40.4	0	0	0	109.9	W546 R549 C784 F785	W546-H782 AromaticContact CD1-CE1 3.84Å; W546-H782 AromaticContact CD1-NE2 3.97Å; R549-H782 HydrophobicContact CB-CB 4.21Å; H782-C784 PolarHBondContact O-N 2.96Å; H782-F785 HydrophobicContact CB-CB 4.31Å; H782-F785 PolarHBondContact N-O 3.03Å; H782-F785 VanDerWaalsContact O-O 3.07Å
783	K	88.5	Confident	92.8	Very high	102 Å²	102	14.9 Å²	14.9	44%	0.443	7%	0.07	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-48.8	-174.7	-174	179.8	176.5	-177.1	0	112.8	R840	K783-R840 HydrophobicContact CG-CG 3.98Å; K783-R840 WeakPolarHBondContact O-CD 3.29Å; K783-R840 PolarHBondContact O-NE 3.41Å; K783-R840 PolarHBondContact O-NH1 3.23Å
784	C	90.4	Very high	92.6	Very high	4 Å²	4	16 Å²	16	3%	0.027	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	18.2	-176.7	-60.5	0	0	0	0	112.6	R549 H782 A834 I835 N837	R549-C784 CarbonylContact O-C 3.53Å; R549-C784 WeakPolarHBondContact O-CA 3.25Å; R549-C784 PolarHBondContact O-N 2.92Å; H782-C784 PolarHBondContact O-N 2.96Å; C784-A834 CarbonylContact O-C 3.59Å; C784-A834 WeakPolarHBondContact O-CA 3.25Å; C784-I835 HydrophobicContact CB-CG1 4.07Å; C784-I835 WeakPolarHBondContact O-CG1 3.45Å; C784-I835 PolarHBondContact O-N 2.83Å; C784-N837 PolarHBondContact SG-OD1 3.27Å; C784-N837 VanDerWaalsContact SG-OD1 3.32Å
785	F	92.4	Very high	92.2	Very high	3 Å²	3	17.7 Å²	17.7	1%	0.013	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	144.7	-177.9	-179.6	-90.1	0	0	0	111.9	R549 S781 H782 Y787 E832 I833 A834	R549-F785 HydrophobicContact CB-CB 3.59Å; R549-F785 HydrophobicContact CB-CG 4.12Å; R549-F785 HydrophobicContact CG-CB 3.61Å; R549-F785 HydrophobicContact CG-CD1 4.12Å; R549-F785 HydrophobicContact CG-CD2 3.87Å; R549-F785 HydrophobicContact CG-CG 3.59Å; S781-F785 PolarHBondContact N-O 3.45Å; S781-F785 VanDerWaalsContact N-O 3.08Å; S781-F785 PolarHBondContact OG-O 2.85Å; H782-F785 HydrophobicContact CB-CB 4.31Å; H782-F785 PolarHBondContact N-O 3.03Å; H782-F785 VanDerWaalsContact O-O 3.07Å; F785-Y787 HydrophobicContact CE1-CE1 4.47Å; F785-E832 HydrophobicContact CE2-CB 4.41Å; F785-E832 HydrophobicContact CZ-CB 4.28Å; F785-E832 WeakPolarHBondContact CZ-OE2 3.04Å; F785-I833 CarbonylContact C-O 3.58Å; F785-I833 VanDerWaalsContact CA-O 3.27Å; F785-I833 WeakPolarHBondContact CA-O 3.46Å; F785-I833 VanDerWaalsContact CD2-O 3.31Å; F785-I833 WeakPolarHBondContact CD2-O 3.16Å; F785-A834 HydrophobicContact CD2-CB 4.39Å
786	G	93.3	Very high	91.6	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.1	-138.2	171.9	0	0	0	0	0	111.8	L779 I833	L779-G786 CarbonylContact O-C 3.2Å; L779-G786 VanDerWaalsContact O-CA 3.25Å; L779-G786 WeakPolarHBondContact O-CA 3.45Å; G786-I833 VanDerWaalsContact C-CG1 3.46Å; G786-I833 PolarHBondContact N-O 2.9Å; G786-I833 PolarHBondContact O-N 2.87Å
787	Y	95.3	Very high	91.2	Very high	21 Å²	21	22.2 Å²	22.2	8%	0.082	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	145.9	-171.4	-50.8	-79.2	0	0	0	111	L779 F785 F831 E832 S926 F927 S929 V930	L779-Y787 WeakPolarHBondContact CA-O 3.4Å; L779-Y787 WeakPolarHBondContact CB-O 3.39Å; L779-Y787 PolarHBondContact N-O 2.82Å; L779-Y787 PolarHBondContact O-N 2.82Å; F785-Y787 HydrophobicContact CE1-CE1 4.47Å; Y787-F831 CarbonylContact C-O 3.48Å; Y787-F831 WeakPolarHBondContact CA-O 3.5Å; Y787-E832 HydrophobicContact CD1-CB 4.36Å; Y787-E832 HydrophobicContact CD1-CG 3.9Å; Y787-E832 HydrophobicContact CE1-CB 4.46Å; Y787-E832 HydrophobicContact CE1-CG 3.82Å; Y787-S926 VanDerWaalsContact CE1-OG 3.28Å; Y787-S926 WeakPolarHBondContact CE1-OG 3.5Å; Y787-F927 HydrophobicContact CD1-CB 4.01Å; Y787-F927 HydrophobicContact CD2-CB 4Å; Y787-F927 HydrophobicContact CG-CB 3.62Å; Y787-S929 PolarHBondContact OH-OG 3.12Å; Y787-V930 HydrophobicContact CD2-CG2 3.95Å; Y787-V930 HydrophobicContact CE2-CG2 3.58Å
788	Y	95.6	Very high	90.7	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	126.6	172.6	176.8	-109.7	0	0	0	109.5	I639 S776 V777 F778 H790 L822 F831 I885 F919	I639-Y788 HydrophobicContact CD1-CE2 4.14Å; S776-Y788 PolarHBondContact OG-OH 2.88Å; V777-Y788 WeakPolarHBondContact O-CA 3.13Å; F778-Y788 HydrophobicContact CB-CD2 4.49Å; F778-Y788 AromaticContact CD2-CD2 3.86Å; F778-Y788 HydrophobicContact CD2-CD2 3.86Å; Y788-H790 HydrophobicContact CD1-CB 4.46Å; Y788-H790 HydrophobicContact CE1-CB 3.76Å; Y788-H790 AromaticContact CE1-ND1 3.83Å; Y788-H790 AromaticContact CZ-ND1 3.93Å; Y788-H790 PolarHBondContact OH-ND1 2.8Å; Y788-L822 HydrophobicContact CE1-CD1 4.41Å; Y788-L822 HydrophobicContact CE1-CD2 4.21Å; Y788-F831 AromaticContact CD1-CD2 3.9Å; Y788-F831 HydrophobicContact CD1-CD2 3.9Å; Y788-F831 PolarHBondContact N-O 2.85Å; Y788-F831 PolarHBondContact O-N 2.02Å; Y788-I885 HydrophobicContact CD2-CD1 4.42Å; Y788-I885 HydrophobicContact CE1-CD1 4.13Å; Y788-I885 HydrophobicContact CE2-CD1 3.95Å; Y788-I885 HydrophobicContact CE2-CG1 4.24Å; Y788-F919 HydrophobicContact CD1-CD2 4.3Å; Y788-F919 AromaticContact CD1-CE2 3.66Å; Y788-F919 HydrophobicContact CD1-CE2 3.66Å; Y788-F919 HydrophobicContact CE1-CE2 4.33Å; Y788-F919 AromaticContact CG-CE2 3.96Å; Y788-F919 HydrophobicContact CG-CE2 3.96Å
789	I	95.8	Very high	90.2	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	114.3	174	-52.4	176.3	0	0	0	106.6	F766 V767 C770 S776 V777 L779 G791 T830 F927	F766-I789 HydrophobicContact CD1-CD1 4.21Å; F766-I789 HydrophobicContact CE1-CD1 3.81Å; V767-I789 HydrophobicContact CB-CG2 4.4Å; V767-I789 HydrophobicContact CG1-CG2 4.07Å; V767-I789 HydrophobicContact CG2-CG2 4.11Å; C770-I789 HydrophobicContact CB-CG2 4.31Å; S776-I789 CarbonylContact C-O 3.48Å; S776-I789 VanDerWaalsContact CA-O 3.28Å; S776-I789 WeakPolarHBondContact CA-O 3.4Å; S776-I789 VanDerWaalsContact CB-O 3.23Å; S776-I789 WeakPolarHBondContact CB-O 3.43Å; V777-I789 HydrophobicContact CB-CB 4.06Å; V777-I789 HydrophobicContact CB-CD1 4.19Å; V777-I789 HydrophobicContact CB-CG1 4.34Å; V777-I789 HydrophobicContact CG2-CB 4.42Å; V777-I789 HydrophobicContact CG2-CD1 4.46Å; V777-I789 PolarHBondContact N-O 2.92Å; V777-I789 PolarHBondContact O-N 2.99Å; L779-I789 HydrophobicContact CD1-CD1 4.41Å; I789-G791 PolarHBondContact O-N 2.93Å; I789-T830 HydrophobicContact CG1-CG2 4.28Å; I789-T830 HydrophobicContact CG2-CG2 4.37Å; I789-F927 HydrophobicContact CD1-CD1 4.11Å; I789-F927 HydrophobicContact CD1-CD2 4.04Å; I789-F927 HydrophobicContact CD1-CE1 4.05Å; I789-F927 HydrophobicContact CD1-CE2 3.99Å; I789-F927 HydrophobicContact CD1-CG 4.09Å; I789-F927 HydrophobicContact CD1-CZ 3.98Å; I789-F927 HydrophobicContact CG1-CD1 4.46Å
790	H	93.8	Very high	89.7	Confident	13 Å²	13	27.2 Å²	27.2	6%	0.06	15%	0.147	C	C	.	.			trans	-79.6	113.6	178.3	-171.6	67	0	0	0	110.3	Y788 R792 R820 L822 Q829 F831	Y788-H790 HydrophobicContact CD1-CB 4.46Å; Y788-H790 HydrophobicContact CE1-CB 3.76Å; Y788-H790 AromaticContact CE1-ND1 3.83Å; Y788-H790 AromaticContact CZ-ND1 3.93Å; Y788-H790 PolarHBondContact OH-ND1 2.8Å; H790-R792 VanDerWaalsContact CE1-CB 3.43Å; H790-R792 WeakPolarHBondContact CE1-CB 3.4Å; H790-R820 PolarHBondContact CD2-O 3.41Å; H790-L822 HydrophobicContact CB-CB 4.28Å; H790-L822 WeakPolarHBondContact ND1-CD1 3.01Å; H790-Q829 WeakPolarHBondContact CB-O 3.22Å; H790-Q829 PolarHBondContact N-O 3.05Å; H790-Q829 PolarHBondContact O-NE2 3.16Å; H790-F831 HydrophobicContact CB-CE2 4.26Å
791	G	92.9	Very high	89.4	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.17	C	C	.	.			trans	-126.2	27.3	178.3	0	0	0	0	0	113.3	N774 I775 S776 I789 S793	N774-G791 CarbonylContact C-O 3.52Å; N774-G791 WeakPolarHBondContact CA-O 3.36Å; I775-G791 PolarHBondContact N-O 3.32Å; I775-G791 WeakPolarHBondContact O-CA 3.43Å; S776-G791 PolarHBondContact OG-N 2.86Å; I789-G791 PolarHBondContact O-N 2.93Å; G791-S793 PolarHBondContact O-N 2.98Å
792	R	91.4	Very high	89.2	Confident	79 Å²	79	38.8 Å²	38.8	30%	0.298	20%	0.204	S	C	.	.			trans	-71.4	123.1	171.5	-172.1	175.8	178.1	165.6	-2.6	108.4	W641 H790 D886	W641-R792 HydrophobicContact CB-CG 4.4Å; W641-R792 HydrophobicContact CD2-CB 4.34Å; W641-R792 HydrophobicContact CD2-CG 4.15Å; W641-R792 HydrophobicContact CG-CB 4.2Å; W641-R792 HydrophobicContact CG-CG 4.06Å; H790-R792 VanDerWaalsContact CE1-CB 3.43Å; H790-R792 WeakPolarHBondContact CE1-CB 3.4Å; R792-D886 IonicContact CZ-OD1 3.65Å; R792-D886 IonicContact NH1-OD1 2.66Å; R792-D886 PolarHBondContact NH1-OD1 2.81Å; R792-D886 IonicContact NH1-OD2 3.21Å
793	S	89.2	Confident	89.3	Confident	14 Å²	14	44.7 Å²	44.7	10%	0.098	23%	0.231	C	C	.	.			trans	-66.8	138.6	-179.8	174.8	0	0	0	0	110.5	S771 N774 G791 H795 G796	S771-S793 WeakPolarHBondContact O-CB 3.43Å; N774-S793 PolarHBondContact OD1-N 3.01Å; G791-S793 PolarHBondContact O-N 2.98Å; S793-H795 PolarHBondContact O-N 3.09Å; S793-H795 PolarHBondContact OG-N 3.38Å; S793-G796 PolarHBondContact O-N 2.81Å
794	V	86.5	Confident	89.2	Confident	35 Å²	35	42.6 Å²	42.6	21%	0.212	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-21.6	175.5	-59.9	0	0	0	0	112.2	E812 C817 S818 Q819 R820	V794-E812 HydrophobicContact CG2-CG 4.16Å; V794-C817 HydrophobicContact CG2-CB 4.4Å; V794-S818 VanDerWaalsContact CG1-O 3.29Å; V794-S818 WeakPolarHBondContact CG1-O 3.34Å; V794-Q819 WeakPolarHBondContact CG1-O 3.4Å; V794-R820 HydrophobicContact CG1-CB 4.4Å; V794-R820 HydrophobicContact CG1-CG 4.03Å
795	H	85.7	Confident	89	Confident	38 Å²	38	45.3 Å²	45.3	18%	0.176	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-14.2	176.3	-59.7	-64.8	0	0	0	112.9	S793 H797 N808 E812	S793-H795 PolarHBondContact O-N 3.09Å; S793-H795 PolarHBondContact OG-N 3.38Å; H795-H797 VanDerWaalsContact C-N 3.25Å; H795-H797 PolarHBondContact O-N 3.46Å; H795-H797 PolarHBondContact O-ND1 2.98Å; H795-H797 VanDerWaalsContact O-ND1 3.17Å; H795-N808 PolarHBondContact ND1-OD1 3.14Å; H795-N808 WeakPolarHBondContact NE2-CB 3.42Å; H795-N808 PolarHBondContact NE2-O 3.5Å; H795-E812 IonicContact CD2-OE1 2.87Å; H795-E812 IonicContact NE2-OE1 2.73Å; H795-E812 PolarHBondContact NE2-OE1 3.44Å
796	G	81.5	Confident	88.9	Confident	43 Å²	43	50.6 Å²	50.6	44%	0.443	26%	0.264	S	S	.	.	S	Bend	trans	81.5	-5.3	178.8	0	0	0	0	0	115.3	S793	S793-G796 PolarHBondContact O-N 2.81Å
797	H	84.8	Confident	88.6	Confident	51 Å²	51	55.6 Å²	55.6	24%	0.236	29%	0.289	C	S	.	.			trans	-150.5	151.6	175.5	58.4	-83.6	0	0	0	110.3	E642 H795 T800 E804	E642-H797 WeakPolarHBondContact OE1-CB 3.4Å; E642-H797 WeakPolarHBondContact OE2-CA 3.31Å; H795-H797 VanDerWaalsContact C-N 3.25Å; H795-H797 PolarHBondContact O-N 3.46Å; H795-H797 PolarHBondContact O-ND1 2.98Å; H795-H797 VanDerWaalsContact O-ND1 3.17Å; H797-T800 WeakPolarHBondContact CD2-CG2 3.3Å; H797-E804 IonicContact CD2-OE1 2.75Å; H797-E804 IonicContact CE1-OE1 3.24Å; H797-E804 IonicContact NE2-OE1 4Å; H797-E804 PolarHBondContact NE2-OE1 2.84Å
798	A	86.5	Confident	88.3	Confident	17 Å²	17	55.1 Å²	55.1	14%	0.14	29%	0.288	C	S	.	.			trans	-117.8	-27.6	177	0	0	0	0	0	113.5	E642 M772 N774 T800	E642-A798 PolarHBondContact OE2-N 3.24Å; M772-A798 WeakPolarHBondContact O-CB 3.29Å; N774-A798 HydrophobicContact CB-CB 3.58Å; A798-T800 VanDerWaalsContact C-N 3.31Å; A798-T800 PolarHBondContact O-N 2.86Å; A798-T800 PolarHBondContact O-OG1 3.38Å
799	D	82.9	Confident	87.9	Confident	53 Å²	53	58 Å²	58	28%	0.283	30%	0.303	S	S	.	.			trans	-73.3	83.8	179.6	-74.5	-21.7	0	0	0	110.5	K645 S666 R669	K645-D799 PolarHBondContact NZ-O 3.42Å; S666-D799 VanDerWaalsContact CB-OD2 3.26Å; S666-D799 WeakPolarHBondContact CB-OD2 3.49Å; R669-D799 WeakPolarHBondContact CD-OD1 3.49Å; R669-D799 IonicContact NE-OD1 2.6Å; R669-D799 PolarHBondContact NE-OD1 3.31Å; R669-D799 IonicContact NE-OD2 3.59Å
800	T	83.9	Confident	87.6	Confident	38 Å²	38	64 Å²	64	23%	0.233	33%	0.329	C	S	.	.			trans	-125.1	163	-175.8	58	0	0	0	0	111.6	H797 A798 E804	H797-T800 WeakPolarHBondContact CD2-CG2 3.3Å; A798-T800 VanDerWaalsContact C-N 3.31Å; A798-T800 PolarHBondContact O-N 2.86Å; A798-T800 PolarHBondContact O-OG1 3.38Å; T800-E804 WeakPolarHBondContact CB-OE2 3.18Å; T800-E804 HydrophobicContact CG2-CB 4.45Å; T800-E804 HydrophobicContact CG2-CG 3.84Å; T800-E804 WeakPolarHBondContact CG2-OE2 3.42Å
801	N	87.3	Confident	87.3	Confident	95 Å²	95	68.7 Å²	68.7	51%	0.508	35%	0.346	S	S	.	.			trans	-81.7	170.6	171	69.1	25.1	0	0	0	110.7	E803 E804 M805	N801-E803 VanDerWaalsContact C-N 3.27Å; N801-E803 PolarHBondContact O-N 3.37Å; N801-E803 PolarHBondContact OD1-N 3.08Å; N801-E804 PolarHBondContact O-N 3.16Å; N801-E804 WeakPolarHBondContact OD1-CB 3.28Å; N801-E804 PolarHBondContact OD1-N 3.35Å; N801-M805 WeakPolarHBondContact O-CB 3.26Å; N801-M805 PolarHBondContact O-N 2.82Å
802	M	86.9	Confident	87.1	Confident	172 Å²	172	70.5 Å²	70.5	85%	0.847	35%	0.354	S	S	*	.	H	α-helix	trans	-58.3	-36.9	-176.9	-176.5	-179.8	-70.7	0	0	113.5	N806	M802-N806 WeakPolarHBondContact O-CB 3.36Å; M802-N806 PolarHBondContact O-N 3.45Å; M802-N806 VanDerWaalsContact O-N 3.13Å
803	E	90.4	Very high	86.8	Confident	160 Å²	160	70.7 Å²	70.7	75%	0.748	37%	0.373	S	S	*	.	H	α-helix	trans	-68.1	-47.9	-179.1	-177.3	176.9	-164.9	0	0	111.3	N801 N806 M807	N801-E803 VanDerWaalsContact C-N 3.27Å; N801-E803 PolarHBondContact O-N 3.37Å; N801-E803 PolarHBondContact OD1-N 3.08Å; E803-N806 PolarHBondContact O-N 3.39Å; E803-M807 WeakPolarHBondContact O-CB 3.47Å; E803-M807 PolarHBondContact O-N 3.09Å
804	E	87.2	Confident	86.8	Confident	57 Å²	57	74.9 Å²	74.9	27%	0.266	39%	0.391	S	S	.	.	H	α-helix	trans	-65.9	-40.1	178.9	-176.1	179.7	-171.2	0	0	111.6	H797 T800 N801 N806 M807 N808	H797-E804 IonicContact CD2-OE1 2.75Å; H797-E804 IonicContact CE1-OE1 3.24Å; H797-E804 IonicContact NE2-OE1 4Å; H797-E804 PolarHBondContact NE2-OE1 2.84Å; T800-E804 WeakPolarHBondContact CB-OE2 3.18Å; T800-E804 HydrophobicContact CG2-CB 4.45Å; T800-E804 HydrophobicContact CG2-CG 3.84Å; T800-E804 WeakPolarHBondContact CG2-OE2 3.42Å; N801-E804 PolarHBondContact O-N 3.16Å; N801-E804 WeakPolarHBondContact OD1-CB 3.28Å; N801-E804 PolarHBondContact OD1-N 3.35Å; E804-N806 PolarHBondContact O-N 3.4Å; E804-M807 PolarHBondContact O-N 3.07Å; E804-N808 WeakPolarHBondContact O-CB 3.38Å; E804-N808 VanDerWaalsContact O-CG 3.22Å; E804-N808 PolarHBondContact O-N 2.72Å; E804-N808 PolarHBondContact O-ND2 2.95Å
805	M	87	Confident	86.7	Confident	62 Å²	62	79.6 Å²	79.6	31%	0.305	42%	0.415	S	S	.	.	H	α-helix	trans	-60.4	-45.2	174.8	-173.7	64.1	-178.9	0	0	111.7	M772 N801 M807 N808 L809	M772-M805 HydrophobicContact SD-CE 4.29Å; N801-M805 WeakPolarHBondContact O-CB 3.26Å; N801-M805 PolarHBondContact O-N 2.82Å; M805-M807 VanDerWaalsContact C-N 3.35Å; M805-M807 PolarHBondContact O-N 2.89Å; M805-N808 WeakPolarHBondContact O-CB 3.38Å; M805-N808 PolarHBondContact O-N 2.89Å; M805-L809 HydrophobicContact CE-CD1 4.35Å; M805-L809 HydrophobicContact CE-CD2 4.33Å; M805-L809 HydrophobicContact CE-CG 4.35Å; M805-L809 HydrophobicContact CG-CD1 4.44Å; M805-L809 WeakPolarHBondContact O-CG 3.4Å; M805-L809 PolarHBondContact O-N 3.38Å
806	N	88.4	Confident	86.6	Confident	113 Å²	113	82.7 Å²	82.7	60%	0.604	43%	0.433	S	S	*	.	H	α-helix	trans	-67.4	-37.2	178.7	-165.2	25.6	0	0	0	111.9	M802 E803 E804 K810	M802-N806 WeakPolarHBondContact O-CB 3.36Å; M802-N806 PolarHBondContact O-N 3.45Å; M802-N806 VanDerWaalsContact O-N 3.13Å; E803-N806 PolarHBondContact O-N 3.39Å; E804-N806 PolarHBondContact O-N 3.4Å; N806-K810 WeakPolarHBondContact O-CB 3.44Å; N806-K810 PolarHBondContact O-N 3.39Å
807	M	88.8	Confident	86.7	Confident	105 Å²	105	82.4 Å²	82.4	52%	0.517	42%	0.423	S	S	.	.	H	α-helix	trans	-63.6	-41.2	173.5	-176.1	175.4	59.1	0	0	111.8	E803 E804 M805 K810 R811	E803-M807 WeakPolarHBondContact O-CB 3.47Å; E803-M807 PolarHBondContact O-N 3.09Å; E804-M807 PolarHBondContact O-N 3.07Å; M805-M807 VanDerWaalsContact C-N 3.35Å; M805-M807 PolarHBondContact O-N 2.89Å; M807-K810 PolarHBondContact O-N 3.37Å; M807-R811 VanDerWaalsContact O-CG 3.3Å; M807-R811 WeakPolarHBondContact O-CG 3.36Å; M807-R811 PolarHBondContact O-N 3.06Å
808	N	88	Confident	86.6	Confident	11 Å²	11	83.2 Å²	83.2	6%	0.059	44%	0.435	C	S	.	.	H	α-helix	trans	-61.8	-49.8	176.1	-77.7	-12.6	0	0	0	111.6	H795 E804 M805 K810 R811 E812	H795-N808 PolarHBondContact ND1-OD1 3.14Å; H795-N808 WeakPolarHBondContact NE2-CB 3.42Å; H795-N808 PolarHBondContact NE2-O 3.5Å; E804-N808 WeakPolarHBondContact O-CB 3.38Å; E804-N808 VanDerWaalsContact O-CG 3.22Å; E804-N808 PolarHBondContact O-N 2.72Å; E804-N808 PolarHBondContact O-ND2 2.95Å; M805-N808 WeakPolarHBondContact O-CB 3.38Å; M805-N808 PolarHBondContact O-N 2.89Å; N808-K810 VanDerWaalsContact C-N 3.3Å; N808-K810 PolarHBondContact O-N 3.05Å; N808-R811 WeakPolarHBondContact O-CB 3.38Å; N808-R811 PolarHBondContact O-N 3.23Å; N808-R811 VanDerWaalsContact O-N 3.09Å; N808-E812 PolarHBondContact O-N 3.35Å
809	L	86.9	Confident	86.6	Confident	62 Å²	62	85.9 Å²	85.9	33%	0.325	44%	0.444	S	S	.	.	H	α-helix	trans	-59.3	-39.3	175.6	-68.6	173.3	0	0	0	112.6	M772 M805 E812 A813	M772-L809 HydrophobicContact CE-CD2 3.67Å; M805-L809 HydrophobicContact CE-CD1 4.35Å; M805-L809 HydrophobicContact CE-CD2 4.33Å; M805-L809 HydrophobicContact CE-CG 4.35Å; M805-L809 HydrophobicContact CG-CD1 4.44Å; M805-L809 WeakPolarHBondContact O-CG 3.4Å; M805-L809 PolarHBondContact O-N 3.38Å; L809-E812 PolarHBondContact O-N 3.3Å; L809-A813 WeakPolarHBondContact O-CB 3.08Å; L809-A813 PolarHBondContact O-N 2.89Å
810	K	89.6	Confident	86.8	Confident	126 Å²	126	85.6 Å²	85.6	55%	0.548	44%	0.439	S	S	.	.	H	α-helix	trans	-64.5	-41	175.6	-174.4	175.3	176.4	-179.9	0	111.8	N806 M807 N808 E812 A813 E814	N806-K810 WeakPolarHBondContact O-CB 3.44Å; N806-K810 PolarHBondContact O-N 3.39Å; M807-K810 PolarHBondContact O-N 3.37Å; N808-K810 VanDerWaalsContact C-N 3.3Å; N808-K810 PolarHBondContact O-N 3.05Å; K810-E812 VanDerWaalsContact C-N 3.34Å; K810-A813 PolarHBondContact O-N 3.13Å; K810-E814 WeakPolarHBondContact CE-OE1 3.47Å; K810-E814 IonicContact NZ-OE1 3.28Å; K810-E814 WeakPolarHBondContact O-CB 3.05Å; K810-E814 WeakPolarHBondContact O-CG 3.46Å; K810-E814 PolarHBondContact O-N 2.87Å
811	R	88.3	Confident	86.9	Confident	111 Å²	111	84.3 Å²	84.3	42%	0.419	43%	0.433	S	S	.	.	H	α-helix	trans	-66	-36.2	176.3	-70.9	176.5	76.4	177.2	4.9	112.1	M807 N808 N815 L816	M807-R811 VanDerWaalsContact O-CG 3.3Å; M807-R811 WeakPolarHBondContact O-CG 3.36Å; M807-R811 PolarHBondContact O-N 3.06Å; N808-R811 WeakPolarHBondContact O-CB 3.38Å; N808-R811 PolarHBondContact O-N 3.23Å; N808-R811 VanDerWaalsContact O-N 3.09Å; R811-N815 PolarHBondContact O-N 3.29Å; R811-L816 HydrophobicContact CB-CB 4.21Å; R811-L816 HydrophobicContact CG-CB 4.48Å; R811-L816 HydrophobicContact CG-CD1 4.49Å; R811-L816 PolarHBondContact O-N 3.11Å
812	E	87.7	Confident	87	Confident	38 Å²	38	81.2 Å²	81.2	18%	0.178	42%	0.417	C	S	.	.	H	α-helix	trans	-63.8	-47.4	171.3	-71.6	-174.3	-145.8	0	0	111.4	V794 H795 N808 L809 K810 E814 N815 C817 R820	V794-E812 HydrophobicContact CG2-CG 4.16Å; H795-E812 IonicContact CD2-OE1 2.87Å; H795-E812 IonicContact NE2-OE1 2.73Å; H795-E812 PolarHBondContact NE2-OE1 3.44Å; N808-E812 PolarHBondContact O-N 3.35Å; L809-E812 PolarHBondContact O-N 3.3Å; K810-E812 VanDerWaalsContact C-N 3.34Å; E812-E814 VanDerWaalsContact C-N 3.28Å; E812-E814 PolarHBondContact O-N 2.02Å; E812-N815 PolarHBondContact O-N 3.18Å; E812-C817 VanDerWaalsContact CA-SG 3.59Å; E812-C817 VanDerWaalsContact CG-SG 3.52Å; E812-R820 IonicContact OE2-CZ 3.89Å; E812-R820 IonicContact OE2-NE 3.92Å; E812-R820 PolarHBondContact OE2-NE 3.37Å; E812-R820 IonicContact OE2-NH2 2.75Å; E812-R820 PolarHBondContact OE2-NH2 3Å
813	A	85.7	Confident	87	Confident	83 Å²	83	75.4 Å²	75.4	69%	0.686	39%	0.391	S	S	*	.	H	α-helix	trans	-62.4	-33.7	178.7	0	0	0	0	0	113.4	L809 K810 N815	L809-A813 WeakPolarHBondContact O-CB 3.08Å; L809-A813 PolarHBondContact O-N 2.89Å; K810-A813 PolarHBondContact O-N 3.13Å; A813-N815 VanDerWaalsContact C-N 3.31Å
814	E	89.7	Confident	86.6	Confident	103 Å²	103	73 Å²	73	48%	0.481	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	4.3	177.2	-67.7	175.4	177.1	0	0	113.2	K810 E812 L816	K810-E814 WeakPolarHBondContact CE-OE1 3.47Å; K810-E814 IonicContact NZ-OE1 3.28Å; K810-E814 WeakPolarHBondContact O-CB 3.05Å; K810-E814 WeakPolarHBondContact O-CG 3.46Å; K810-E814 PolarHBondContact O-N 2.87Å; E812-E814 VanDerWaalsContact C-N 3.28Å; E812-E814 PolarHBondContact O-N 2.02Å; E814-L816 HydrophobicContact CB-CD1 3.9Å; E814-L816 HydrophobicContact CB-CG 3.87Å; E814-L816 PolarHBondContact O-N 3.01Å; E814-L816 VanDerWaalsContact OE2-CD1 3.31Å; E814-L816 WeakPolarHBondContact OE2-CD1 3.37Å
815	N	83.3	Confident	86.3	Confident	133 Å²	133	76.5 Å²	76.5	71%	0.711	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	34.4	-174.9	-65.3	-55.3	0	0	0	113.9	R811 E812 A813 C817	R811-N815 PolarHBondContact O-N 3.29Å; E812-N815 PolarHBondContact O-N 3.18Å; A813-N815 VanDerWaalsContact C-N 3.31Å; N815-C817 VanDerWaalsContact C-N 3.3Å
816	L	85.1	Confident	86.2	Confident	104 Å²	104	76 Å²	76	55%	0.545	41%	0.41	S	S	.	.			trans	-89.2	9.2	178.9	-65.2	175	0	0	0	113.3	R811 E814	R811-L816 HydrophobicContact CB-CB 4.21Å; R811-L816 HydrophobicContact CG-CB 4.48Å; R811-L816 HydrophobicContact CG-CD1 4.49Å; R811-L816 PolarHBondContact O-N 3.11Å; E814-L816 HydrophobicContact CB-CD1 3.9Å; E814-L816 HydrophobicContact CB-CG 3.87Å; E814-L816 PolarHBondContact O-N 3.01Å; E814-L816 VanDerWaalsContact OE2-CD1 3.31Å; E814-L816 WeakPolarHBondContact OE2-CD1 3.37Å
817	C	82.2	Confident	86	Confident	37 Å²	37	75.5 Å²	75.5	25%	0.25	41%	0.408	C	S	.	.	S	Bend	trans	-136.3	168	176.2	59.4	0	0	0	0	110.7	V794 E812 N815	V794-C817 HydrophobicContact CG2-CB 4.4Å; E812-C817 VanDerWaalsContact CA-SG 3.59Å; E812-C817 VanDerWaalsContact CG-SG 3.52Å; N815-C817 VanDerWaalsContact C-N 3.3Å
818	S	83	Confident	85.8	Confident	68 Å²	68	72 Å²	72	48%	0.476	40%	0.398	S	S	.	.			trans	-62.4	154	172.8	54.5	0	0	0	0	111.1	V794	V794-S818 VanDerWaalsContact CG1-O 3.29Å; V794-S818 WeakPolarHBondContact CG1-O 3.34Å
819	Q	86.3	Confident	86	Confident	73 Å²	73	72.4 Å²	72.4	34%	0.341	40%	0.4	S	S	.	.			trans	-65	160	172.1	-69	-166.1	-34.9	0	0	112.2	V794 G821 N825 T826 D827	V794-Q819 WeakPolarHBondContact CG1-O 3.4Å; Q819-G821 VanDerWaalsContact C-N 3.32Å; Q819-G821 PolarHBondContact O-N 2.89Å; Q819-N825 PolarHBondContact OE1-O 2.79Å; Q819-N825 VanDerWaalsContact OE1-O 3.09Å; Q819-T826 WeakPolarHBondContact CB-O 3.26Å; Q819-D827 WeakPolarHBondContact CB-OD1 3.45Å; Q819-D827 VanDerWaalsContact CD-CG 3.49Å; Q819-D827 WeakPolarHBondContact CG-OD1 3.45Å; Q819-D827 PolarHBondContact NE2-OD1 2.74Å; Q819-D827 PolarHBondContact NE2-OD2 2.81Å
820	R	86.6	Confident	86.3	Confident	46 Å²	46	69.9 Å²	69.9	17%	0.174	39%	0.387	C	S	.	.	S	Bend	trans	-78.4	-6.4	-171.6	-65.5	-178	178.2	177.3	-0.4	115	D768 H790 V794 E812 Q829	D768-R820 IonicContact OD1-NH1 3.76Å; D768-R820 PolarHBondContact OD1-NH1 2.83Å; H790-R820 PolarHBondContact CD2-O 3.41Å; V794-R820 HydrophobicContact CG1-CB 4.4Å; V794-R820 HydrophobicContact CG1-CG 4.03Å; E812-R820 IonicContact OE2-CZ 3.89Å; E812-R820 IonicContact OE2-NE 3.92Å; E812-R820 PolarHBondContact OE2-NE 3.37Å; E812-R820 IonicContact OE2-NH2 2.75Å; E812-R820 PolarHBondContact OE2-NH2 3Å; R820-Q829 HydrophobicContact CB-CG 4.3Å
821	G	87.3	Confident	86.5	Confident	11 Å²	11	64 Å²	64	11%	0.113	36%	0.361	C	S	.	.	S	Bend	trans	-74	164	-175.8	0	0	0	0	0	114.3	Q819 V823 T826 G828	Q819-G821 VanDerWaalsContact C-N 3.32Å; Q819-G821 PolarHBondContact O-N 2.89Å; G821-V823 VanDerWaalsContact C-N 3.32Å; G821-T826 WeakPolarHBondContact CA-O 3.06Å; G821-T826 PolarHBondContact N-O 2.81Å; G821-G828 WeakPolarHBondContact CA-O 3.43Å
822	L	87.8	Confident	86.8	Confident	30 Å²	30	60 Å²	60	16%	0.157	35%	0.347	C	S	.	.	S	Bend	trans	-67.4	-34.3	177.8	179	65.8	0	0	0	112.1	Y788 H790 G828 F831 I885 Y894 I896 F919	Y788-L822 HydrophobicContact CE1-CD1 4.41Å; Y788-L822 HydrophobicContact CE1-CD2 4.21Å; H790-L822 HydrophobicContact CB-CB 4.28Å; H790-L822 WeakPolarHBondContact ND1-CD1 3.01Å; L822-G828 PolarHBondContact N-O 2.9Å; L822-F831 HydrophobicContact CB-CE2 3.6Å; L822-F831 HydrophobicContact CB-CZ 3.54Å; L822-F831 HydrophobicContact CD2-CD2 4.33Å; L822-F831 HydrophobicContact CD2-CE1 4.36Å; L822-F831 HydrophobicContact CD2-CE2 3.9Å; L822-F831 HydrophobicContact CD2-CZ 3.93Å; L822-F831 HydrophobicContact CG-CE2 4.42Å; L822-F831 HydrophobicContact CG-CZ 4.37Å; L822-I885 HydrophobicContact CD1-CG2 3.87Å; L822-Y894 HydrophobicContact CD2-CE2 4.17Å; L822-I896 HydrophobicContact CD2-CD1 4.04Å; L822-I896 HydrophobicContact CG-CD1 4.49Å; L822-F919 HydrophobicContact CD2-CD2 4.13Å; L822-F919 HydrophobicContact CD2-CE2 4.37Å
823	V	86.9	Confident	87	Confident	50 Å²	50	58.1 Å²	58.1	30%	0.303	34%	0.339	S	S	.	.	S	Bend	trans	-88.6	138.2	177.4	-178.2	0	0	0	0	108.8	G821 N825 T826 I896	G821-V823 VanDerWaalsContact C-N 3.32Å; V823-N825 PolarHBondContact O-N 2.86Å; V823-T826 HydrophobicContact CB-CG2 3.97Å; V823-T826 HydrophobicContact CG1-CG2 4.07Å; V823-T826 PolarHBondContact O-N 2.02Å; V823-T826 PolarHBondContact O-OG1 3.25Å; V823-T826 VanDerWaalsContact O-OG1 3.08Å; V823-I896 HydrophobicContact CG2-CD1 3.31Å
824	P	82.4	Confident	87.3	Confident	109 Å²	109	54.6 Å²	54.6	71%	0.708	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	132.1	177.1	-24.9	33.4	0	0	0	111.9	T826	P824-T826 VanDerWaalsContact C-N 3.35Å; P824-T826 PolarHBondContact O-N 2.74Å
825	N	81.3	Confident	87.4	Confident	131 Å²	131	49.8 Å²	49.8	70%	0.701	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	33.5	-179.5	-51.3	-38.5	0	0	0	114.8	Q819 V823	Q819-N825 PolarHBondContact OE1-O 2.79Å; Q819-N825 VanDerWaalsContact OE1-O 3.09Å; V823-N825 PolarHBondContact O-N 2.86Å
826	T	85.4	Confident	87.8	Confident	52 Å²	52	43.4 Å²	43.4	32%	0.319	25%	0.253	S	S	.	.			trans	-125.9	156.5	166.8	73.3	0	0	0	0	111.2	Q819 G821 V823 P824	Q819-T826 WeakPolarHBondContact CB-O 3.26Å; G821-T826 WeakPolarHBondContact CA-O 3.06Å; G821-T826 PolarHBondContact N-O 2.81Å; V823-T826 HydrophobicContact CB-CG2 3.97Å; V823-T826 HydrophobicContact CG1-CG2 4.07Å; V823-T826 PolarHBondContact O-N 2.02Å; V823-T826 PolarHBondContact O-OG1 3.25Å; V823-T826 VanDerWaalsContact O-OG1 3.08Å; P824-T826 VanDerWaalsContact C-N 3.35Å; P824-T826 PolarHBondContact O-N 2.74Å
827	D	84.2	Confident	87.9	Confident	103 Å²	103	41.8 Å²	41.8	55%	0.551	25%	0.245	S	C	*	.			trans	-95	3.4	173.7	-66.2	-45.7	0	0	0	112.6	Q819 Q829	Q819-D827 WeakPolarHBondContact CB-OD1 3.45Å; Q819-D827 VanDerWaalsContact CD-CG 3.49Å; Q819-D827 WeakPolarHBondContact CG-OD1 3.45Å; Q819-D827 PolarHBondContact NE2-OD1 2.74Å; Q819-D827 PolarHBondContact NE2-OD2 2.81Å; D827-Q829 PolarHBondContact O-N 2.82Å; D827-Q829 VanDerWaalsContact O-N 3.17Å
828	G	85.3	Confident	88.1	Confident	31 Å²	31	44.8 Å²	44.8	32%	0.32	26%	0.255	S	S	.	.			trans	-71.3	107.7	-176.9	0	0	0	0	0	112.2	G821 L822 F831	G821-G828 WeakPolarHBondContact CA-O 3.43Å; L822-G828 PolarHBondContact N-O 2.9Å; G828-F831 WeakPolarHBondContact O-CE2 3.5Å; G828-F831 VanDerWaalsContact O-CZ 3.29Å; G828-F831 WeakPolarHBondContact O-CZ 3.35Å
829	Q	90.8	Very high	88.4	Confident	20 Å²	20	41.5 Å²	41.5	9%	0.093	23%	0.232	C	C	.	.			trans	-105.8	-21.6	-177.9	-65.9	179.2	-78.5	0	0	113.8	V767 S771 H790 R820 D827	V767-Q829 HydrophobicContact CG1-CB 3.71Å; V767-Q829 HydrophobicContact CG1-CG 4.48Å; S771-Q829 PolarHBondContact OG-NE2 2.86Å; H790-Q829 WeakPolarHBondContact CB-O 3.22Å; H790-Q829 PolarHBondContact N-O 3.05Å; H790-Q829 PolarHBondContact O-NE2 3.16Å; R820-Q829 HydrophobicContact CB-CG 4.3Å; D827-Q829 PolarHBondContact O-N 2.82Å; D827-Q829 VanDerWaalsContact O-N 3.17Å
830	T	94	Very high	88.6	Confident	9 Å²	9	39 Å²	39	6%	0.055	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	135.8	-176.9	38.3	0	0	0	0	111.9	V767 I789 D922 Y925 F927	V767-T830 HydrophobicContact CG1-CG2 4.27Å; V767-T830 HydrophobicContact CG2-CG2 3.81Å; I789-T830 HydrophobicContact CG1-CG2 4.28Å; I789-T830 HydrophobicContact CG2-CG2 4.37Å; T830-D922 PolarHBondContact O-N 3.41Å; T830-D922 PolarHBondContact OG1-O 2.83Å; T830-Y925 HydrophobicContact CG2-CD1 3.98Å; T830-Y925 HydrophobicContact CG2-CE1 4.43Å; T830-F927 HydrophobicContact CG2-CD1 4.16Å; T830-F927 HydrophobicContact CG2-CE1 4.11Å
831	F	94.3	Very high	88.7	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.009	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	139.5	-177	-57.7	-91.5	0	0	0	111	Y787 Y788 H790 L822 G828 I833 I896 F919 Y920 N921	Y787-F831 CarbonylContact C-O 3.48Å; Y787-F831 WeakPolarHBondContact CA-O 3.5Å; Y788-F831 AromaticContact CD1-CD2 3.9Å; Y788-F831 HydrophobicContact CD1-CD2 3.9Å; Y788-F831 PolarHBondContact N-O 2.85Å; Y788-F831 PolarHBondContact O-N 2.02Å; H790-F831 HydrophobicContact CB-CE2 4.26Å; L822-F831 HydrophobicContact CB-CE2 3.6Å; L822-F831 HydrophobicContact CB-CZ 3.54Å; L822-F831 HydrophobicContact CD2-CD2 4.33Å; L822-F831 HydrophobicContact CD2-CE1 4.36Å; L822-F831 HydrophobicContact CD2-CE2 3.9Å; L822-F831 HydrophobicContact CD2-CZ 3.93Å; L822-F831 HydrophobicContact CG-CE2 4.42Å; L822-F831 HydrophobicContact CG-CZ 4.37Å; G828-F831 WeakPolarHBondContact O-CE2 3.5Å; G828-F831 VanDerWaalsContact O-CZ 3.29Å; G828-F831 WeakPolarHBondContact O-CZ 3.35Å; F831-I833 HydrophobicContact CB-CG2 4.38Å; F831-I896 HydrophobicContact CE1-CD1 4.47Å; F831-I896 HydrophobicContact CE1-CG2 4.27Å; F831-F919 HydrophobicContact CB-CD2 4.03Å; F831-F919 HydrophobicContact CD1-CB 4.28Å; F831-F919 HydrophobicContact CD1-CD2 4.39Å; F831-F919 HydrophobicContact CG-CD2 4.11Å; F831-Y920 CarbonylContact C-O 3.57Å; F831-Y920 WeakPolarHBondContact CA-O 3.4Å; F831-N921 VanDerWaalsContact CE1-OD1 3.25Å; F831-N921 WeakPolarHBondContact CE1-OD1 3.32Å
832	E	93.4	Very high	88.8	Confident	26 Å²	26	44.7 Å²	44.7	12%	0.121	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	130.4	161.6	-53	-170.9	-170.9	0	0	109.2	F785 Y787 K899 Y920 D922 S926	F785-E832 HydrophobicContact CE2-CB 4.41Å; F785-E832 HydrophobicContact CZ-CB 4.28Å; F785-E832 WeakPolarHBondContact CZ-OE2 3.04Å; Y787-E832 HydrophobicContact CD1-CB 4.36Å; Y787-E832 HydrophobicContact CD1-CG 3.9Å; Y787-E832 HydrophobicContact CE1-CB 4.46Å; Y787-E832 HydrophobicContact CE1-CG 3.82Å; E832-K899 IonicContact OE1-NZ 2.95Å; E832-K899 WeakPolarHBondContact OE2-CE 3.41Å; E832-K899 IonicContact OE2-NZ 3.57Å; E832-K899 PolarHBondContact OE2-NZ 2.93Å; E832-Y920 PolarHBondContact N-O 2.77Å; E832-Y920 PolarHBondContact O-N 3.32Å; E832-D922 HydrophobicContact CG-CB 4.18Å; E832-S926 WeakPolarHBondContact CG-OG 3.46Å; E832-S926 VanDerWaalsContact OE1-CB 3.23Å; E832-S926 WeakPolarHBondContact OE1-CB 3.11Å; E832-S926 PolarHBondContact OE1-OG 3.23Å
833	I	92.8	Very high	88.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	132.3	-173.5	59.2	169.4	0	0	0	110.8	F778 L780 F785 G786 F831 I835 I918 F919	F778-I833 HydrophobicContact CD2-CD1 3.91Å; F778-I833 HydrophobicContact CE1-CD1 4.18Å; F778-I833 HydrophobicContact CE2-CD1 3.26Å; F778-I833 HydrophobicContact CZ-CD1 3.42Å; F778-I833 VanDerWaalsContact CZ-CD1 3.42Å; L780-I833 HydrophobicContact CD2-CD1 4.03Å; F785-I833 CarbonylContact C-O 3.58Å; F785-I833 VanDerWaalsContact CA-O 3.27Å; F785-I833 WeakPolarHBondContact CA-O 3.46Å; F785-I833 VanDerWaalsContact CD2-O 3.31Å; F785-I833 WeakPolarHBondContact CD2-O 3.16Å; G786-I833 VanDerWaalsContact C-CG1 3.46Å; G786-I833 PolarHBondContact N-O 2.9Å; G786-I833 PolarHBondContact O-N 2.87Å; F831-I833 HydrophobicContact CB-CG2 4.38Å; I833-I835 HydrophobicContact CD1-CG2 4.28Å; I833-I918 WeakPolarHBondContact CA-O 3.37Å; I833-F919 HydrophobicContact CB-CD1 4.42Å; I833-F919 HydrophobicContact CB-CE1 4.26Å; I833-F919 HydrophobicContact CG2-CD1 3.79Å; I833-F919 HydrophobicContact CG2-CD2 3.73Å; I833-F919 HydrophobicContact CG2-CE1 3.69Å; I833-F919 HydrophobicContact CG2-CE2 3.64Å; I833-F919 HydrophobicContact CG2-CG 3.8Å; I833-F919 HydrophobicContact CG2-CZ 3.61Å
834	A	92.1	Very high	88.9	Confident	8 Å²	8	42.7 Å²	42.7	7%	0.066	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	106.1	166.6	0	0	0	0	0	107.9	C784 F785 P913 S917 I918 Y920	C784-A834 CarbonylContact O-C 3.59Å; C784-A834 WeakPolarHBondContact O-CA 3.25Å; F785-A834 HydrophobicContact CD2-CB 4.39Å; A834-P913 HydrophobicContact CB-CG 4.11Å; A834-S917 CarbonylContact O-C 3.57Å; A834-S917 WeakPolarHBondContact O-CA 3.33Å; A834-I918 HydrophobicContact CB-CB 4.43Å; A834-I918 PolarHBondContact N-O 2.78Å; A834-I918 PolarHBondContact O-N 3.38Å; A834-Y920 HydrophobicContact CB-CE2 4.34Å
835	I	91.9	Very high	89.2	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	23%	0.225	C	C	.	.			trans	-91.6	147.8	-173	59.2	171.1	0	0	0	111.9	F778 L780 C784 I833 M839 R840 P913 S917	F778-I835 HydrophobicContact CZ-CG2 4.27Å; L780-I835 HydrophobicContact CD1-CD1 3.94Å; L780-I835 HydrophobicContact CD2-CD1 3.94Å; L780-I835 HydrophobicContact CD2-CG1 4.5Å; C784-I835 HydrophobicContact CB-CG1 4.07Å; C784-I835 WeakPolarHBondContact O-CG1 3.45Å; C784-I835 PolarHBondContact O-N 2.83Å; I833-I835 HydrophobicContact CD1-CG2 4.28Å; I835-M839 HydrophobicContact CB-CG 4.37Å; I835-R840 HydrophobicContact CD1-CB 3.86Å; I835-R840 HydrophobicContact CD1-CG 4.43Å; I835-R840 HydrophobicContact CG1-CB 4.49Å; I835-P913 WeakPolarHBondContact O-CG 3.21Å; I835-S917 WeakPolarHBondContact CA-OG 3.35Å
836	S	90.6	Very high	89.4	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.			trans	-68.6	153.6	175.2	75	0	0	0	0	111.6	Q838 M839 R840 S917	S836-Q838 PolarHBondContact O-N 3.22Å; S836-M839 PolarHBondContact O-N 3.48Å; S836-M839 PolarHBondContact OG-N 3.1Å; S836-R840 PolarHBondContact O-N 3.21Å; S836-S917 PolarHBondContact N-OG 2.82Å
837	N	86.7	Confident	89.2	Confident	70 Å²	70	37 Å²	37	37%	0.374	18%	0.183	S	C	.	.	H	α-helix	trans	-60.6	-31.7	178.1	-86.3	-26.4	0	0	0	112.5	G551 C784 Q841	G551-N837 PolarHBondContact O-ND2 2.71Å; G551-N837 VanDerWaalsContact O-ND2 3.1Å; C784-N837 PolarHBondContact SG-OD1 3.27Å; C784-N837 VanDerWaalsContact SG-OD1 3.32Å; N837-Q841 VanDerWaalsContact O-CG 3.32Å; N837-Q841 WeakPolarHBondContact O-CG 3.11Å; N837-Q841 PolarHBondContact O-N 3.02Å
838	Q	87.1	Confident	89.1	Confident	99 Å²	99	38.6 Å²	38.6	46%	0.463	19%	0.188	S	C	.	.	H	α-helix	trans	-65.4	-49.3	176	-65.7	-177	3.7	0	0	111.2	S836 R840 Q841 H842 M892	S836-Q838 PolarHBondContact O-N 3.22Å; Q838-R840 VanDerWaalsContact C-N 3.31Å; Q838-R840 PolarHBondContact O-N 3.42Å; Q838-Q841 PolarHBondContact O-N 3.21Å; Q838-H842 PolarHBondContact O-CD2 2.88Å; Q838-H842 PolarHBondContact O-N 3.15Å; Q838-M892 HydrophobicContact CB-CG 4.06Å; Q838-M892 HydrophobicContact CB-SD 4.27Å
839	M	89.1	Confident	88.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-57.5	-44.8	176.2	174.6	50.8	-174.8	0	0	111.4	I835 S836 Q841 H842 Y843 F880 L881 F884 M892	I835-M839 HydrophobicContact CB-CG 4.37Å; S836-M839 PolarHBondContact O-N 3.48Å; S836-M839 PolarHBondContact OG-N 3.1Å; M839-Q841 PolarHBondContact O-N 3.44Å; M839-H842 PolarHBondContact O-N 2.84Å; M839-Y843 PolarHBondContact O-N 3.43Å; M839-F880 HydrophobicContact CE-CD1 4.21Å; M839-F880 HydrophobicContact CE-CE1 3.34Å; M839-F880 HydrophobicContact CE-CZ 3.68Å; M839-F880 HydrophobicContact SD-CE1 3.53Å; M839-F880 VanDerWaalsContact SD-CE1 3.53Å; M839-F880 HydrophobicContact SD-CE2 4.23Å; M839-F880 HydrophobicContact SD-CZ 3.21Å; M839-F880 WeakPolarHBondContact SD-CZ 3.08Å; M839-L881 HydrophobicContact CE-CD2 3.63Å; M839-F884 HydrophobicContact CB-CE2 4.36Å; M839-F884 HydrophobicContact CE-CB 4.25Å; M839-F884 HydrophobicContact CE-CD1 4.02Å; M839-F884 HydrophobicContact CE-CD2 3.92Å; M839-F884 HydrophobicContact CE-CE1 4.34Å; M839-F884 HydrophobicContact CE-CE2 4.22Å; M839-F884 HydrophobicContact CE-CG 3.8Å; M839-F884 HydrophobicContact CE-CZ 4.45Å; M839-F884 HydrophobicContact CG-CD2 4.19Å; M839-F884 HydrophobicContact CG-CE2 3.73Å; M839-F884 HydrophobicContact CG-CZ 4.12Å; M839-F884 HydrophobicContact SD-CD2 3.69Å; M839-F884 HydrophobicContact SD-CE2 3.88Å; M839-F884 HydrophobicContact SD-CG 4.18Å; M839-M892 HydrophobicContact CB-SD 4.48Å
840	R	90.3	Very high	87.7	Confident	19 Å²	19	40.8 Å²	40.8	7%	0.072	20%	0.195	C	C	.	.	H	α-helix	trans	-62.3	-40.9	178.2	179.8	56.7	-170.7	-145.4	25.6	112.9	D635 K783 I835 S836 Q838 H842 Y843 D844	D635-R840 IonicContact OD2-CZ 3.71Å; D635-R840 IonicContact OD2-NH1 3.39Å; D635-R840 IonicContact OD2-NH2 3.7Å; D635-R840 PolarHBondContact OD2-NH2 3.24Å; K783-R840 HydrophobicContact CG-CG 3.98Å; K783-R840 WeakPolarHBondContact O-CD 3.29Å; K783-R840 PolarHBondContact O-NE 3.41Å; K783-R840 PolarHBondContact O-NH1 3.23Å; I835-R840 HydrophobicContact CD1-CB 3.86Å; I835-R840 HydrophobicContact CD1-CG 4.43Å; I835-R840 HydrophobicContact CG1-CB 4.49Å; S836-R840 PolarHBondContact O-N 3.21Å; Q838-R840 VanDerWaalsContact C-N 3.31Å; Q838-R840 PolarHBondContact O-N 3.42Å; R840-H842 VanDerWaalsContact C-N 3.32Å; R840-H842 PolarHBondContact O-N 3.37Å; R840-Y843 WeakPolarHBondContact O-CB 3.28Å; R840-Y843 PolarHBondContact O-N 2.87Å; R840-D844 IonicContact CZ-OD1 3.66Å; R840-D844 IonicContact CZ-OD2 2.85Å; R840-D844 IonicContact NE-OD1 3.63Å; R840-D844 PolarHBondContact NE-OD1 3.41Å; R840-D844 IonicContact NE-OD2 2.69Å; R840-D844 PolarHBondContact NE-OD2 2.89Å; R840-D844 IonicContact NH2-OD1 2.92Å; R840-D844 PolarHBondContact NH2-OD1 3.43Å; R840-D844 IonicContact NH2-OD2 3.02Å; R840-D844 PolarHBondContact O-N 3.21Å
841	Q	88.8	Confident	86.4	Confident	106 Å²	106	43.6 Å²	43.6	50%	0.495	21%	0.209	S	C	.	.	H	α-helix	trans	-63.1	-39	177.2	-74.7	176.5	18.5	0	0	112.4	N837 Q838 M839 R845	N837-Q841 VanDerWaalsContact O-CG 3.32Å; N837-Q841 WeakPolarHBondContact O-CG 3.11Å; N837-Q841 PolarHBondContact O-N 3.02Å; Q838-Q841 PolarHBondContact O-N 3.21Å; M839-Q841 PolarHBondContact O-N 3.44Å; Q841-R845 VanDerWaalsContact O-CG 3.31Å; Q841-R845 WeakPolarHBondContact O-CG 3.43Å; Q841-R845 PolarHBondContact O-N 2.86Å; Q841-R845 VanDerWaalsContact O-N 3.13Å
842	H	89.1	Confident	84.9	Confident	71 Å²	71	53.8 Å²	53.8	33%	0.329	25%	0.248	S	C	.	.	H	α-helix	trans	-66.1	-42.9	175.1	-83.3	-82.4	0	0	0	111.8	Q838 M839 R840 R845 I846 F880 M892	Q838-H842 PolarHBondContact O-CD2 2.88Å; Q838-H842 PolarHBondContact O-N 3.15Å; M839-H842 PolarHBondContact O-N 2.84Å; R840-H842 VanDerWaalsContact C-N 3.32Å; R840-H842 PolarHBondContact O-N 3.37Å; H842-R845 PolarHBondContact O-N 2.97Å; H842-I846 WeakPolarHBondContact O-CG1 3.26Å; H842-I846 PolarHBondContact O-N 3.21Å; H842-F880 HydrophobicContact CB-CE1 4.1Å; H842-F880 HydrophobicContact CB-CE2 4.04Å; H842-F880 HydrophobicContact CB-CZ 3.44Å; H842-F880 VanDerWaalsContact CB-CZ 3.44Å; H842-M892 VanDerWaalsContact CD2-SD 3.53Å
843	Y	89.6	Confident	83	Confident	1 Å²	1	60 Å²	60	0%	0.004	28%	0.275	C	S	.	.	H	α-helix	trans	-56.8	-51.2	172.8	-177.7	-86.6	0	0	0	111.6	F778 L780 M839 R840 R845 I846 H847 M877 L881	F778-Y843 HydrophobicContact CD1-CE2 4.37Å; F778-Y843 HydrophobicContact CE1-CE2 4.33Å; L780-Y843 HydrophobicContact CD1-CD1 4.42Å; L780-Y843 HydrophobicContact CD1-CE1 4.27Å; M839-Y843 PolarHBondContact O-N 3.43Å; R840-Y843 WeakPolarHBondContact O-CB 3.28Å; R840-Y843 PolarHBondContact O-N 2.87Å; Y843-R845 PolarHBondContact O-N 3.13Å; Y843-I846 PolarHBondContact O-N 3Å; Y843-H847 HydrophobicContact CD1-CB 4.38Å; Y843-H847 HydrophobicContact CE1-CB 4.18Å; Y843-H847 VanDerWaalsContact O-CB 3.31Å; Y843-H847 WeakPolarHBondContact O-CB 3.44Å; Y843-H847 PolarHBondContact O-N 3.43Å; Y843-M877 HydrophobicContact CD2-CE 3.72Å; Y843-M877 HydrophobicContact CD2-SD 3.68Å; Y843-M877 HydrophobicContact CE2-CE 3.76Å; Y843-M877 HydrophobicContact CE2-SD 3.84Å; Y843-M877 HydrophobicContact CG-CE 4.13Å; Y843-M877 WeakPolarHBondContact O-CE 3.4Å; Y843-L881 HydrophobicContact CD2-CD2 4.31Å; Y843-L881 HydrophobicContact CE2-CD1 4.4Å
844	D	88.6	Confident	80.5	Confident	38 Å²	38	67.5 Å²	67.5	20%	0.203	32%	0.315	C	S	.	.	H	α-helix	trans	-60.8	-41.1	-177.8	-74.1	-28.5	0	0	0	112.4	R840 I846 H847 E848	R840-D844 IonicContact CZ-OD1 3.66Å; R840-D844 IonicContact CZ-OD2 2.85Å; R840-D844 IonicContact NE-OD1 3.63Å; R840-D844 PolarHBondContact NE-OD1 3.41Å; R840-D844 IonicContact NE-OD2 2.69Å; R840-D844 PolarHBondContact NE-OD2 2.89Å; R840-D844 IonicContact NH2-OD1 2.92Å; R840-D844 PolarHBondContact NH2-OD1 3.43Å; R840-D844 IonicContact NH2-OD2 3.02Å; R840-D844 PolarHBondContact O-N 3.21Å; D844-I846 VanDerWaalsContact C-N 3.34Å; D844-I846 PolarHBondContact O-N 3.27Å; D844-H847 PolarHBondContact O-N 3.46Å; D844-E848 WeakPolarHBondContact O-CB 3.35Å; D844-E848 WeakPolarHBondContact O-CG 3.36Å; D844-E848 PolarHBondContact O-N 3.22Å
845	R	88.1	Confident	78.2	Confident	143 Å²	143	69.4 Å²	69.4	54%	0.54	34%	0.335	S	S	.	.	H	α-helix	trans	-60.3	-41.7	177.3	-72.3	176.8	-150.5	166.2	9	112.7	Q841 H842 Y843 T849	Q841-R845 VanDerWaalsContact O-CG 3.31Å; Q841-R845 WeakPolarHBondContact O-CG 3.43Å; Q841-R845 PolarHBondContact O-N 2.86Å; Q841-R845 VanDerWaalsContact O-N 3.13Å; H842-R845 PolarHBondContact O-N 2.97Å; Y843-R845 PolarHBondContact O-N 3.13Å; R845-T849 PolarHBondContact O-OG1 3.22Å; R845-T849 VanDerWaalsContact O-OG1 3.11Å
846	I	85.6	Confident	75.7	Confident	19 Å²	19	75.6 Å²	75.6	10%	0.097	38%	0.375	C	S	.	.	H	α-helix	trans	-73.1	-42.1	179	-58.4	168.9	0	0	0	109.6	H842 Y843 D844 T849 L850 M876 M877 F880	H842-I846 WeakPolarHBondContact O-CG1 3.26Å; H842-I846 PolarHBondContact O-N 3.21Å; Y843-I846 PolarHBondContact O-N 3Å; D844-I846 VanDerWaalsContact C-N 3.34Å; D844-I846 PolarHBondContact O-N 3.27Å; I846-T849 WeakPolarHBondContact O-CB 3.49Å; I846-T849 PolarHBondContact O-N 3.38Å; I846-L850 PolarHBondContact O-N 3.06Å; I846-M876 HydrophobicContact CD1-CG 4.27Å; I846-M876 HydrophobicContact CG1-CG 4.44Å; I846-M876 HydrophobicContact CG1-SD 4.16Å; I846-M876 HydrophobicContact CG2-CB 4.33Å; I846-M876 HydrophobicContact CG2-CG 4.26Å; I846-M876 HydrophobicContact CG2-SD 4.36Å; I846-M877 HydrophobicContact CB-CE 3.68Å; I846-M877 HydrophobicContact CB-SD 4.35Å; I846-M877 HydrophobicContact CG2-CB 3.82Å; I846-M877 HydrophobicContact CG2-CE 3.74Å; I846-M877 HydrophobicContact CG2-SD 4.2Å; I846-F880 HydrophobicContact CD1-CB 3.95Å; I846-F880 HydrophobicContact CD1-CD1 3.82Å; I846-F880 HydrophobicContact CD1-CE1 4.45Å; I846-F880 HydrophobicContact CD1-CG 3.86Å
847	H	81.8	Confident	73.3	Confident	10 Å²	10	80.6 Å²	80.6	5%	0.046	42%	0.417	C	S	.	.	H	α-helix	trans	-65.5	-39.8	-179.3	-167.5	52.9	0	0	0	113.5	D635 Y843 D844 T849 L850 I851 M877 K986	D635-H847 IonicContact OD1-NE2 2.99Å; D635-H847 PolarHBondContact OD1-NE2 2.8Å; Y843-H847 HydrophobicContact CD1-CB 4.38Å; Y843-H847 HydrophobicContact CE1-CB 4.18Å; Y843-H847 VanDerWaalsContact O-CB 3.31Å; Y843-H847 WeakPolarHBondContact O-CB 3.44Å; Y843-H847 PolarHBondContact O-N 3.43Å; D844-H847 PolarHBondContact O-N 3.46Å; H847-T849 VanDerWaalsContact C-N 3.26Å; H847-T849 PolarHBondContact O-N 3.18Å; H847-L850 WeakPolarHBondContact O-CA 3.25Å; H847-L850 WeakPolarHBondContact O-CB 2.89Å; H847-L850 PolarHBondContact O-N 3Å; H847-I851 WeakPolarHBondContact NE2-CD1 3.18Å; H847-I851 PolarHBondContact O-N 2.99Å; H847-M877 HydrophobicContact CB-CE 3.99Å; H847-K986 PolarHBondContact NE2-NZ 3.35Å
848	E	80.5	Confident	71.1	Confident	137 Å²	137	88.4 Å²	88.4	64%	0.64	44%	0.441	S	S	*	.	H	α-helix	trans	-59.5	-38.6	175.3	-80.2	-179.3	-178.5	0	0	111.8	D844 L850 I851 R852	D844-E848 WeakPolarHBondContact O-CB 3.35Å; D844-E848 WeakPolarHBondContact O-CG 3.36Å; D844-E848 PolarHBondContact O-N 3.22Å; E848-L850 PolarHBondContact O-N 3.15Å; E848-I851 PolarHBondContact O-N 3.35Å; E848-R852 WeakPolarHBondContact O-CB 3.29Å; E848-R852 PolarHBondContact O-N 2.99Å; E848-R852 VanDerWaalsContact O-N 3.09Å
849	T	77.8	Confident	69.1	Low	86 Å²	86	91.7 Å²	91.7	53%	0.528	46%	0.461	S	S	.	.	H	α-helix	trans	-64.8	-29.2	175.3	-52.2	0	0	0	0	111.7	R845 I846 H847 A873	R845-T849 PolarHBondContact O-OG1 3.22Å; R845-T849 VanDerWaalsContact O-OG1 3.11Å; I846-T849 WeakPolarHBondContact O-CB 3.49Å; I846-T849 PolarHBondContact O-N 3.38Å; H847-T849 VanDerWaalsContact C-N 3.26Å; H847-T849 PolarHBondContact O-N 3.18Å; T849-A873 HydrophobicContact CG2-CB 4.2Å
850	L	69.8	Low	66.7	Low	10 Å²	10	99.8 Å²	99.8	5%	0.052	50%	0.503	C	S	.	.	H	α-helix	trans	-77.7	-35.9	179.5	-140.8	141.9	0	0	0	112	I846 H847 E848 A873 L988	I846-L850 PolarHBondContact O-N 3.06Å; H847-L850 WeakPolarHBondContact O-CA 3.25Å; H847-L850 WeakPolarHBondContact O-CB 2.89Å; H847-L850 PolarHBondContact O-N 3Å; E848-L850 PolarHBondContact O-N 3.15Å; L850-A873 HydrophobicContact CB-CB 4.17Å; L850-A873 HydrophobicContact CD1-CB 3.99Å; L850-A873 HydrophobicContact CG-CB 4.03Å; L850-L988 HydrophobicContact CD2-CD1 3.63Å; L850-L988 HydrophobicContact CD2-CD2 4.1Å; L850-L988 HydrophobicContact CD2-CG 3.68Å; L850-L988 HydrophobicContact CG-CD1 4.12Å
851	I	67	Low	64.1	Low	68 Å²	68	103.8 Å²	103.8	35%	0.349	53%	0.534	S	S	.	.	H	α-helix	trans	-89.9	-21.2	-175.4	-69.5	174.8	0	0	0	113.9	H847 E848 K853 K986	H847-I851 WeakPolarHBondContact NE2-CD1 3.18Å; H847-I851 PolarHBondContact O-N 2.99Å; E848-I851 PolarHBondContact O-N 3.35Å; I851-K853 PolarHBondContact O-N 3.05Å; I851-K986 HydrophobicContact CD1-CD 4.19Å
852	R	62.3	Low	61.9	Low	217 Å²	217	101.7 Å²	101.7	82%	0.819	53%	0.531	S	S	*	.			trans	-67.9	68.2	-173.2	-158	177.4	-177.5	-170.3	0.7	113.4	E848	E848-R852 WeakPolarHBondContact O-CB 3.29Å; E848-R852 PolarHBondContact O-N 2.99Å; E848-R852 VanDerWaalsContact O-N 3.09Å
853	K	52.7	Low	60.1	Low	156 Å²	156	103.4 Å²	103.4	68%	0.678	55%	0.551	S	S	*	*			trans	-92.4	-19.3	170.5	-95.7	-179.9	171.4	174.4	0	113.2	I851	I851-K853 PolarHBondContact O-N 3.05Å
854	N	41.8	Very low	58.2	Low	158 Å²	158	111.2 Å²	111.2	85%	0.845	59%	0.587	S	S	*	*			trans	-131.2	56.1	-166.2	-65.6	-15.4	0	0	0	114.5
855	G	43.4	Very low	56.9	Low	47 Å²	47	113.4 Å²	113.4	49%	0.485	60%	0.599	S	S	.	*	S	Bend	trans	-83.1	158.7	159.9	0	0	0	0	0	111	A857	G855-A857 PolarHBondContact O-N 2.93Å; G855-A857 VanDerWaalsContact O-N 3.09Å
856	P	38.6	Very low	55.7	Low	133 Å²	133	109.7 Å²	109.7	86%	0.864	59%	0.593	S	S	*	*			trans	-56.5	120.4	178.7	-15.2	26.3	0	0	0	110.1	R858	P856-R858 PolarHBondContact O-N 3.33Å
857	A	40.3	Very low	54.8	Low	105 Å²	105	115.2 Å²	115.2	87%	0.868	62%	0.616	S	S	*	*	S	Bend	trans	-71.4	64.9	-171.9	0	0	0	0	0	113.2	G855	G855-A857 PolarHBondContact O-N 2.93Å; G855-A857 VanDerWaalsContact O-N 3.09Å
858	R	41	Very low	54.4	Low	234 Å²	234	119.2 Å²	119.2	88%	0.883	64%	0.635	S	S	*	*	S	Bend	trans	-115.9	-5.3	174.9	-87.4	-172	176.4	171.8	-0.2	117	P856	P856-R858 PolarHBondContact O-N 3.33Å
859	L	44.1	Very low	54.2	Low	168 Å²	168	118.2 Å²	118.2	88%	0.88	63%	0.63	S	S	*	*	S	Bend	trans	-149.6	25.7	-174.1	-93.2	170.7	0	0	0	118
860	L	40.5	Very low	54	Low	169 Å²	169	114.5 Å²	114.5	89%	0.885	61%	0.608	S	S	*	*			trans	-135.6	120	172	-76.1	167.7	0	0	0	112.7
861	S	35.2	Very low	54.5	Low	103 Å²	103	117.1 Å²	117.1	72%	0.72	62%	0.621	S	S	*	*			trans	-75.1	149.5	170.9	48.8	0	0	0	0	111.5
862	S	42.2	Very low	55.2	Low	63 Å²	63	119.6 Å²	119.6	44%	0.441	63%	0.629	S	S	.	*			trans	71.1	119.4	169.6	72.2	0	0	0	0	118.3	E864 N865	S862-E864 PolarHBondContact O-N 3.03Å; S862-N865 PolarHBondContact OG-ND2 3.16Å
863	S	50.8	Low	56.2	Low	106 Å²	106	109.5 Å²	109.5	74%	0.741	59%	0.592	S	S	*	*	H	α-helix	trans	-65.9	-17	171.2	175.1	0	0	0	0	114.1	T866	S863-T866 PolarHBondContact O-OG1 2.66Å
864	E	50.1	Low	57.7	Low	165 Å²	165	103.7 Å²	103.7	77%	0.771	57%	0.566	S	S	*	*	H	α-helix	trans	-79.3	-34.3	-177.4	-70.4	-179.1	153.3	0	0	112.1	S862 T866 E868	S862-E864 PolarHBondContact O-N 3.03Å; E864-T866 PolarHBondContact O-N 3.42Å; E864-E868 PolarHBondContact O-N 2.93Å
865	N	60.3	Low	59.8	Low	85 Å²	85	101.6 Å²	101.6	46%	0.455	55%	0.551	S	S	.	*	H	α-helix	trans	-70.4	-29.1	-178.6	-82.9	-31.5	0	0	0	113.6	S862 Q869	S862-N865 PolarHBondContact OG-ND2 3.16Å; N865-Q869 WeakPolarHBondContact O-CB 3.44Å; N865-Q869 WeakPolarHBondContact O-CG 3.17Å; N865-Q869 PolarHBondContact O-N 2.93Å; N865-Q869 VanDerWaalsContact O-N 3.15Å
866	T	63.3	Low	62	Low	65 Å²	65	104.8 Å²	104.8	40%	0.399	56%	0.555	S	S	.	*	H	α-helix	trans	-75.2	-36.2	179.9	39.8	0	0	0	0	112.7	S863 E864 S870	S863-T866 PolarHBondContact O-OG1 2.66Å; E864-T866 PolarHBondContact O-N 3.42Å; T866-S870 PolarHBondContact O-N 3.25Å; T866-S870 VanDerWaalsContact O-N 3.13Å
867	F	67.8	Low	64.4	Low	135 Å²	135	98.4 Å²	98.4	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-68.1	-44.2	175.5	-176.3	-109.2	0	0	0	111.3	Q869 S870 I871	F867-Q869 VanDerWaalsContact C-N 3.32Å; F867-Q869 PolarHBondContact O-N 3.06Å; F867-S870 PolarHBondContact O-N 3.29Å; F867-S870 VanDerWaalsContact O-N 3.14Å; F867-S870 PolarHBondContact O-OG 2.87Å; F867-I871 HydrophobicContact CD1-CD1 3.73Å; F867-I871 HydrophobicContact CE1-CD1 3.29Å; F867-I871 HydrophobicContact CE1-CG1 4.36Å; F867-I871 HydrophobicContact CE2-CD1 4.39Å; F867-I871 HydrophobicContact CG-CD1 4.45Å; F867-I871 HydrophobicContact CZ-CD1 3.67Å; F867-I871 HydrophobicContact CZ-CG1 4.4Å; F867-I871 PolarHBondContact O-N 3.13Å; F867-I871 VanDerWaalsContact O-N 3.1Å
868	E	73.6	Confident	66.8	Low	94 Å²	94	94.8 Å²	94.8	44%	0.439	48%	0.48	S	S	.	.	H	α-helix	trans	-64	-36.2	177.6	-154.5	-169	148.6	0	0	112.4	E864 K872	E864-E868 PolarHBondContact O-N 2.93Å; E868-K872 WeakPolarHBondContact O-CG 3.47Å; E868-K872 PolarHBondContact O-N 2.9Å; E868-K872 VanDerWaalsContact O-N 3.08Å; E868-K872 VanDerWaalsContact OE1-CE 3.26Å; E868-K872 WeakPolarHBondContact OE1-CE 3.47Å; E868-K872 IonicContact OE1-NZ 2.91Å; E868-K872 PolarHBondContact OE1-NZ 2.91Å
869	Q	75.1	Confident	69.2	Low	115 Å²	115	91.6 Å²	91.6	54%	0.537	47%	0.472	S	S	.	.	H	α-helix	trans	-63.3	-41.4	172.1	-78.9	173.9	1.5	0	0	112.4	N865 F867 K872 A873	N865-Q869 WeakPolarHBondContact O-CB 3.44Å; N865-Q869 WeakPolarHBondContact O-CG 3.17Å; N865-Q869 PolarHBondContact O-N 2.93Å; N865-Q869 VanDerWaalsContact O-N 3.15Å; F867-Q869 VanDerWaalsContact C-N 3.32Å; F867-Q869 PolarHBondContact O-N 3.06Å; Q869-K872 PolarHBondContact O-N 3.36Å; Q869-A873 WeakPolarHBondContact O-CB 3.45Å; Q869-A873 PolarHBondContact O-N 3.39Å
870	S	74.4	Confident	71.5	Confident	8 Å²	8	84.6 Å²	84.6	6%	0.056	44%	0.435	C	S	.	.	H	α-helix	trans	-65.6	-38.5	178.4	70.2	0	0	0	0	112.9	T866 F867 A873 Y874 L988	T866-S870 PolarHBondContact O-N 3.25Å; T866-S870 VanDerWaalsContact O-N 3.13Å; F867-S870 PolarHBondContact O-N 3.29Å; F867-S870 VanDerWaalsContact O-N 3.14Å; F867-S870 PolarHBondContact O-OG 2.87Å; S870-A873 PolarHBondContact O-N 3.37Å; S870-Y874 PolarHBondContact O-N 3.38Å; S870-L988 WeakPolarHBondContact O-CD1 3.4Å
871	I	79.8	Confident	73.9	Confident	66 Å²	66	76.6 Å²	76.6	34%	0.338	39%	0.393	S	S	.	.	H	α-helix	trans	-66.1	-42.9	174.9	-68.6	169.8	0	0	0	111	F867 A873 Y874 H875	F867-I871 HydrophobicContact CD1-CD1 3.73Å; F867-I871 HydrophobicContact CE1-CD1 3.29Å; F867-I871 HydrophobicContact CE1-CG1 4.36Å; F867-I871 HydrophobicContact CE2-CD1 4.39Å; F867-I871 HydrophobicContact CG-CD1 4.45Å; F867-I871 HydrophobicContact CZ-CD1 3.67Å; F867-I871 HydrophobicContact CZ-CG1 4.4Å; F867-I871 PolarHBondContact O-N 3.13Å; F867-I871 VanDerWaalsContact O-N 3.1Å; I871-A873 VanDerWaalsContact C-N 3.32Å; I871-A873 PolarHBondContact O-N 2.8Å; I871-Y874 WeakPolarHBondContact O-CB 3.44Å; I871-Y874 PolarHBondContact O-N 2.9Å; I871-H875 PolarHBondContact O-CD2 3.09Å; I871-H875 VanDerWaalsContact O-CD2 3.26Å; I871-H875 PolarHBondContact O-N 3.18Å
872	K	82.7	Confident	76.6	Confident	120 Å²	120	72.1 Å²	72.1	52%	0.522	36%	0.363	S	S	.	.	H	α-helix	trans	-61.4	-41.6	175.6	-74.3	171.3	-174.5	164.1	0	111.4	E868 Q869 H875 M876	E868-K872 WeakPolarHBondContact O-CG 3.47Å; E868-K872 PolarHBondContact O-N 2.9Å; E868-K872 VanDerWaalsContact O-N 3.08Å; E868-K872 VanDerWaalsContact OE1-CE 3.26Å; E868-K872 WeakPolarHBondContact OE1-CE 3.47Å; E868-K872 IonicContact OE1-NZ 2.91Å; E868-K872 PolarHBondContact OE1-NZ 2.91Å; Q869-K872 PolarHBondContact O-N 3.36Å; K872-H875 PolarHBondContact O-N 2.82Å; K872-M876 WeakPolarHBondContact O-CB 3.1Å; K872-M876 PolarHBondContact O-N 3.36Å
873	A	81.7	Confident	79	Confident	5 Å²	5	70.2 Å²	70.2	4%	0.041	35%	0.35	C	S	.	.	H	α-helix	trans	-64.2	-39.2	175.6	0	0	0	0	0	112.1	T849 L850 Q869 S870 I871 M876 M877	T849-A873 HydrophobicContact CG2-CB 4.2Å; L850-A873 HydrophobicContact CB-CB 4.17Å; L850-A873 HydrophobicContact CD1-CB 3.99Å; L850-A873 HydrophobicContact CG-CB 4.03Å; Q869-A873 WeakPolarHBondContact O-CB 3.45Å; Q869-A873 PolarHBondContact O-N 3.39Å; S870-A873 PolarHBondContact O-N 3.37Å; I871-A873 VanDerWaalsContact C-N 3.32Å; I871-A873 PolarHBondContact O-N 2.8Å; A873-M876 WeakPolarHBondContact O-CB 3.29Å; A873-M876 PolarHBondContact O-N 3.44Å; A873-M877 WeakPolarHBondContact O-CB 3.41Å; A873-M877 PolarHBondContact O-N 2.92Å
874	Y	84.6	Confident	81	Confident	33 Å²	33	65.3 Å²	65.3	13%	0.129	32%	0.315	C	S	.	.	H	α-helix	trans	-61.1	-50.2	174.6	-176.5	-99.1	0	0	0	112.8	F637 F638 S870 I871 M876 M877 N878 L988	F637-Y874 AromaticContact CE2-CD2 3.62Å; F637-Y874 HydrophobicContact CE2-CD2 3.62Å; F637-Y874 AromaticContact CE2-CE2 3.57Å; F637-Y874 HydrophobicContact CE2-CE2 3.57Å; F637-Y874 AromaticContact CZ-CD2 3.84Å; F637-Y874 HydrophobicContact CZ-CD2 3.84Å; F637-Y874 AromaticContact CZ-CE2 3.59Å; F637-Y874 HydrophobicContact CZ-CE2 3.59Å; F638-Y874 PolarHBondContact O-OH 2.86Å; F638-Y874 VanDerWaalsContact O-OH 3.12Å; S870-Y874 PolarHBondContact O-N 3.38Å; I871-Y874 WeakPolarHBondContact O-CB 3.44Å; I871-Y874 PolarHBondContact O-N 2.9Å; Y874-M876 VanDerWaalsContact C-N 3.27Å; Y874-M876 PolarHBondContact O-N 2.98Å; Y874-M877 PolarHBondContact O-N 2.92Å; Y874-M877 VanDerWaalsContact O-N 3.16Å; Y874-N878 WeakPolarHBondContact O-CB 3.01Å; Y874-N878 PolarHBondContact O-N 2.54Å; Y874-L988 HydrophobicContact CD2-CD1 4Å; Y874-L988 HydrophobicContact CG-CD1 4.09Å
875	H	86.2	Confident	83	Confident	115 Å²	115	57.7 Å²	57.7	53%	0.532	28%	0.28	S	S	.	.	H	α-helix	trans	-63.7	-34.9	177.3	-71.3	-55.3	0	0	0	112.3	I871 K872 K879	I871-H875 PolarHBondContact O-CD2 3.09Å; I871-H875 VanDerWaalsContact O-CD2 3.26Å; I871-H875 PolarHBondContact O-N 3.18Å; K872-H875 PolarHBondContact O-N 2.82Å; H875-K879 VanDerWaalsContact O-CB 3.3Å; H875-K879 WeakPolarHBondContact O-CB 3.2Å; H875-K879 PolarHBondContact O-N 3.11Å
876	M	88.9	Confident	84.5	Confident	113 Å²	113	57.1 Å²	57.1	56%	0.557	28%	0.277	S	S	*	.	H	α-helix	trans	-63.2	-44.9	173.1	-173.1	-179.1	-63.6	0	0	111.4	I846 K872 A873 Y874 F880	I846-M876 HydrophobicContact CD1-CG 4.27Å; I846-M876 HydrophobicContact CG1-CG 4.44Å; I846-M876 HydrophobicContact CG1-SD 4.16Å; I846-M876 HydrophobicContact CG2-CB 4.33Å; I846-M876 HydrophobicContact CG2-CG 4.26Å; I846-M876 HydrophobicContact CG2-SD 4.36Å; K872-M876 WeakPolarHBondContact O-CB 3.1Å; K872-M876 PolarHBondContact O-N 3.36Å; A873-M876 WeakPolarHBondContact O-CB 3.29Å; A873-M876 PolarHBondContact O-N 3.44Å; Y874-M876 VanDerWaalsContact C-N 3.27Å; Y874-M876 PolarHBondContact O-N 2.98Å; M876-F880 VanDerWaalsContact O-CB 3.26Å; M876-F880 WeakPolarHBondContact O-CB 3.14Å; M876-F880 PolarHBondContact O-N 2.91Å
877	M	89.1	Confident	85.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-63.9	-46.4	176.5	-173.2	62.3	85.8	0	0	111.7	F637 Y843 I846 H847 A873 Y874 K879 F880 L881	F637-M877 HydrophobicContact CD1-CG 4.21Å; F637-M877 HydrophobicContact CD2-CG 3.83Å; F637-M877 HydrophobicContact CE1-CB 4.42Å; F637-M877 HydrophobicContact CE1-CG 3.86Å; F637-M877 HydrophobicContact CE2-CB 3.78Å; F637-M877 HydrophobicContact CE2-CG 3.44Å; F637-M877 VanDerWaalsContact CE2-CG 3.44Å; F637-M877 HydrophobicContact CG-CG 4.19Å; F637-M877 HydrophobicContact CZ-CB 3.67Å; F637-M877 HydrophobicContact CZ-CG 3.47Å; F637-M877 VanDerWaalsContact CZ-CG 3.47Å; Y843-M877 HydrophobicContact CD2-CE 3.72Å; Y843-M877 HydrophobicContact CD2-SD 3.68Å; Y843-M877 HydrophobicContact CE2-CE 3.76Å; Y843-M877 HydrophobicContact CE2-SD 3.84Å; Y843-M877 HydrophobicContact CG-CE 4.13Å; Y843-M877 WeakPolarHBondContact O-CE 3.4Å; I846-M877 HydrophobicContact CB-CE 3.68Å; I846-M877 HydrophobicContact CB-SD 4.35Å; I846-M877 HydrophobicContact CG2-CB 3.82Å; I846-M877 HydrophobicContact CG2-CE 3.74Å; I846-M877 HydrophobicContact CG2-SD 4.2Å; H847-M877 HydrophobicContact CB-CE 3.99Å; A873-M877 WeakPolarHBondContact O-CB 3.41Å; A873-M877 PolarHBondContact O-N 2.92Å; Y874-M877 PolarHBondContact O-N 2.92Å; Y874-M877 VanDerWaalsContact O-N 3.16Å; M877-K879 VanDerWaalsContact C-N 3.35Å; M877-K879 PolarHBondContact O-N 3Å; M877-F880 PolarHBondContact O-N 3.05Å; M877-F880 HydrophobicContact SD-CD1 4.22Å; M877-L881 HydrophobicContact CG-CD1 3.88Å; M877-L881 HydrophobicContact CG-CG 4.39Å; M877-L881 PolarHBondContact O-N 2.68Å; M877-L881 HydrophobicContact SD-CD1 4.01Å; M877-L881 HydrophobicContact SD-CG 4.09Å
878	N	91.1	Very high	86.9	Confident	29 Å²	29	56.3 Å²	56.3	16%	0.155	28%	0.276	C	S	.	.	H	α-helix	trans	-59.6	-45.9	178.4	-168.1	54.6	0	0	0	111.5	F637 I639 D640 Y874 F880 G882	F637-N878 HydrophobicContact CE1-CB 4.4Å; F637-N878 HydrophobicContact CZ-CB 4.3Å; I639-N878 VanDerWaalsContact CA-OD1 3.22Å; I639-N878 WeakPolarHBondContact CA-OD1 3.28Å; I639-N878 WeakPolarHBondContact CG2-OD1 3.32Å; D640-N878 PolarHBondContact N-OD1 3.05Å; D640-N878 PolarHBondContact O-ND2 2.93Å; Y874-N878 WeakPolarHBondContact O-CB 3.01Å; Y874-N878 PolarHBondContact O-N 2.54Å; N878-F880 PolarHBondContact O-N 3.16Å; N878-G882 PolarHBondContact O-N 2.64Å
879	K	91.1	Very high	87.5	Confident	166 Å²	166	54.8 Å²	54.8	72%	0.722	27%	0.269	S	S	*	.	H	α-helix	trans	-63.1	-42.8	177.1	-174.1	179.7	-179.7	-177.5	0	111.8	H875 M877 S883	H875-K879 VanDerWaalsContact O-CB 3.3Å; H875-K879 WeakPolarHBondContact O-CB 3.2Å; H875-K879 PolarHBondContact O-N 3.11Å; M877-K879 VanDerWaalsContact C-N 3.35Å; M877-K879 PolarHBondContact O-N 3Å; K879-S883 WeakPolarHBondContact O-CB 3.37Å; K879-S883 PolarHBondContact O-N 2.91Å; K879-S883 PolarHBondContact O-OG 2.51Å; K879-S883 VanDerWaalsContact O-OG 3.04Å
880	F	92.4	Very high	87.8	Confident	21 Å²	21	58 Å²	58	9%	0.092	28%	0.281	C	S	.	.	H	α-helix	trans	-65.3	-47.8	180	171.5	-114	0	0	0	112.5	M839 H842 I846 M876 M877 N878 S883 F884 M892	M839-F880 HydrophobicContact CE-CD1 4.21Å; M839-F880 HydrophobicContact CE-CE1 3.34Å; M839-F880 HydrophobicContact CE-CZ 3.68Å; M839-F880 HydrophobicContact SD-CE1 3.53Å; M839-F880 VanDerWaalsContact SD-CE1 3.53Å; M839-F880 HydrophobicContact SD-CE2 4.23Å; M839-F880 HydrophobicContact SD-CZ 3.21Å; M839-F880 WeakPolarHBondContact SD-CZ 3.08Å; H842-F880 HydrophobicContact CB-CE1 4.1Å; H842-F880 HydrophobicContact CB-CE2 4.04Å; H842-F880 HydrophobicContact CB-CZ 3.44Å; H842-F880 VanDerWaalsContact CB-CZ 3.44Å; I846-F880 HydrophobicContact CD1-CB 3.95Å; I846-F880 HydrophobicContact CD1-CD1 3.82Å; I846-F880 HydrophobicContact CD1-CE1 4.45Å; I846-F880 HydrophobicContact CD1-CG 3.86Å; M876-F880 VanDerWaalsContact O-CB 3.26Å; M876-F880 WeakPolarHBondContact O-CB 3.14Å; M876-F880 PolarHBondContact O-N 2.91Å; M877-F880 PolarHBondContact O-N 3.05Å; M877-F880 HydrophobicContact SD-CD1 4.22Å; N878-F880 PolarHBondContact O-N 3.16Å; F880-S883 PolarHBondContact O-N 3.32Å; F880-S883 PolarHBondContact O-OG 2.88Å; F880-F884 WeakPolarHBondContact O-CB 3.28Å; F880-F884 PolarHBondContact O-N 3Å; F880-M892 HydrophobicContact CE2-CE 4.34Å
881	L	92	Very high	88.1	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-67.4	-39.1	177.4	-69.9	172.3	0	0	0	111.4	F637 I639 F778 M839 Y843 M877 F884 I885	F637-L881 HydrophobicContact CB-CD1 4.4Å; F637-L881 HydrophobicContact CD1-CD1 3.29Å; F637-L881 HydrophobicContact CE1-CD1 3.72Å; F637-L881 HydrophobicContact CG-CD1 3.96Å; I639-L881 HydrophobicContact CD1-CB 3.67Å; I639-L881 HydrophobicContact CD1-CD1 4.15Å; I639-L881 HydrophobicContact CD1-CG 4.47Å; I639-L881 HydrophobicContact CG1-CB 3.97Å; I639-L881 HydrophobicContact CG1-CD1 3.99Å; F778-L881 HydrophobicContact CD1-CD2 4.39Å; F778-L881 HydrophobicContact CD2-CD2 4.49Å; F778-L881 HydrophobicContact CE1-CD2 4.35Å; F778-L881 HydrophobicContact CE2-CD2 4.47Å; F778-L881 HydrophobicContact CG-CD2 4.46Å; F778-L881 HydrophobicContact CZ-CD2 4.39Å; M839-L881 HydrophobicContact CE-CD2 3.63Å; Y843-L881 HydrophobicContact CD2-CD2 4.31Å; Y843-L881 HydrophobicContact CE2-CD1 4.4Å; M877-L881 HydrophobicContact CG-CD1 3.88Å; M877-L881 HydrophobicContact CG-CG 4.39Å; M877-L881 PolarHBondContact O-N 2.68Å; M877-L881 HydrophobicContact SD-CD1 4.01Å; M877-L881 HydrophobicContact SD-CG 4.09Å; L881-F884 PolarHBondContact O-N 2.82Å; L881-I885 WeakPolarHBondContact O-CG1 3.33Å; L881-I885 PolarHBondContact O-N 3Å
882	G	91.6	Very high	88.4	Confident	10 Å²	10	62.8 Å²	62.8	10%	0.103	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-47	172.9	0	0	0	0	0	112.4	N878 F884 I885 D886	N878-G882 PolarHBondContact O-N 2.64Å; G882-F884 VanDerWaalsContact C-N 3.34Å; G882-F884 PolarHBondContact O-N 3.2Å; G882-I885 PolarHBondContact O-N 2.94Å; G882-D886 WeakPolarHBondContact O-CB 3.05Å; G882-D886 PolarHBondContact O-N 3.27Å
883	S	92.2	Very high	88.7	Confident	23 Å²	23	58.3 Å²	58.3	16%	0.161	28%	0.283	C	S	.	.	H	α-helix	trans	-69.2	-29.7	177.8	62.5	0	0	0	0	113.5	K879 F880 V888 H889	K879-S883 WeakPolarHBondContact O-CB 3.37Å; K879-S883 PolarHBondContact O-N 2.91Å; K879-S883 PolarHBondContact O-OG 2.51Å; K879-S883 VanDerWaalsContact O-OG 3.04Å; F880-S883 PolarHBondContact O-N 3.32Å; F880-S883 PolarHBondContact O-OG 2.88Å; S883-V888 VanDerWaalsContact O-CB 3.26Å; S883-V888 WeakPolarHBondContact O-CB 3.12Å; S883-V888 WeakPolarHBondContact O-CG2 3.41Å; S883-V888 PolarHBondContact O-N 2.94Å; S883-H889 PolarHBondContact OG-CD2 3.5Å; S883-H889 PolarHBondContact OG-NE2 3.06Å
884	F	92.6	Very high	89.2	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.009	28%	0.282	C	S	.	.	H	α-helix	trans	-65.2	-47.7	171.8	170.6	-98.9	0	0	0	111.6	M839 F880 L881 G882 D886 H887 M892 Y894 F919	M839-F884 HydrophobicContact CB-CE2 4.36Å; M839-F884 HydrophobicContact CE-CB 4.25Å; M839-F884 HydrophobicContact CE-CD1 4.02Å; M839-F884 HydrophobicContact CE-CD2 3.92Å; M839-F884 HydrophobicContact CE-CE1 4.34Å; M839-F884 HydrophobicContact CE-CE2 4.22Å; M839-F884 HydrophobicContact CE-CG 3.8Å; M839-F884 HydrophobicContact CE-CZ 4.45Å; M839-F884 HydrophobicContact CG-CD2 4.19Å; M839-F884 HydrophobicContact CG-CE2 3.73Å; M839-F884 HydrophobicContact CG-CZ 4.12Å; M839-F884 HydrophobicContact SD-CD2 3.69Å; M839-F884 HydrophobicContact SD-CE2 3.88Å; M839-F884 HydrophobicContact SD-CG 4.18Å; F880-F884 WeakPolarHBondContact O-CB 3.28Å; F880-F884 PolarHBondContact O-N 3Å; L881-F884 PolarHBondContact O-N 2.82Å; G882-F884 VanDerWaalsContact C-N 3.34Å; G882-F884 PolarHBondContact O-N 3.2Å; F884-D886 VanDerWaalsContact C-N 3.34Å; F884-D886 PolarHBondContact O-N 3.49Å; F884-H887 PolarHBondContact O-N 3.42Å; F884-M892 WeakPolarHBondContact CE2-O 3.4Å; F884-Y894 HydrophobicContact CE1-CD1 4.38Å; F884-Y894 HydrophobicContact CZ-CD1 4.34Å; F884-F919 HydrophobicContact CE1-CE1 4.09Å; F884-F919 AromaticContact CE1-CZ 3.99Å; F884-F919 HydrophobicContact CE1-CZ 3.99Å; F884-F919 HydrophobicContact CZ-CE1 4.28Å
885	I	93	Very high	89.5	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-66.3	-35.6	178.3	-63.6	-62.9	0	0	0	111.8	W641 Y788 L822 L881 G882 H887 Y894 F919	W641-I885 HydrophobicContact CH2-CB 3.94Å; W641-I885 HydrophobicContact CH2-CG2 3.92Å; W641-I885 HydrophobicContact CZ2-CB 4.28Å; W641-I885 HydrophobicContact CZ2-CG2 4.07Å; Y788-I885 HydrophobicContact CD2-CD1 4.42Å; Y788-I885 HydrophobicContact CE1-CD1 4.13Å; Y788-I885 HydrophobicContact CE2-CD1 3.95Å; Y788-I885 HydrophobicContact CE2-CG1 4.24Å; L822-I885 HydrophobicContact CD1-CG2 3.87Å; L881-I885 WeakPolarHBondContact O-CG1 3.33Å; L881-I885 PolarHBondContact O-N 3Å; G882-I885 PolarHBondContact O-N 2.94Å; I885-H887 PolarHBondContact O-N 3.5Å; I885-Y894 WeakPolarHBondContact O-CE1 3.38Å; I885-Y894 PolarHBondContact O-OH 2.89Å; I885-F919 HydrophobicContact CD1-CE2 3.98Å; I885-F919 HydrophobicContact CD1-CZ 3.83Å
886	D	90.9	Very high	89.8	Confident	74 Å²	74	57.6 Å²	57.6	40%	0.396	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	11.8	175.8	-78.7	-22.3	0	0	0	113.8	R792 G882 F884 V888	R792-D886 IonicContact CZ-OD1 3.65Å; R792-D886 IonicContact NH1-OD1 2.66Å; R792-D886 PolarHBondContact NH1-OD1 2.81Å; R792-D886 IonicContact NH1-OD2 3.21Å; G882-D886 WeakPolarHBondContact O-CB 3.05Å; G882-D886 PolarHBondContact O-N 3.27Å; F884-D886 VanDerWaalsContact C-N 3.34Å; F884-D886 PolarHBondContact O-N 3.49Å; D886-V888 HydrophobicContact CB-CG2 4.03Å; D886-V888 PolarHBondContact O-N 3.37Å
887	H	91	Very high	89.9	Confident	89 Å²	89	55 Å²	55	41%	0.412	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	26.1	179.6	-60.4	-81.2	0	0	0	115	F884 I885 H889 D893 Y894	F884-H887 PolarHBondContact O-N 3.42Å; I885-H887 PolarHBondContact O-N 3.5Å; H887-H889 VanDerWaalsContact C-N 3.35Å; H887-H889 PolarHBondContact O-N 3.08Å; H887-D893 IonicContact CE1-OD1 3.51Å; H887-D893 IonicContact CG-OD1 3.05Å; H887-D893 IonicContact ND1-OD1 2.66Å; H887-D893 PolarHBondContact ND1-OD1 3.26Å; H887-Y894 AromaticContact CE1-CD1 3.66Å; H887-Y894 AromaticContact CE1-CE1 3.25Å; H887-Y894 WeakPolarHBondContact CE1-CE1 3.31Å; H887-Y894 AromaticContact CE1-CE2 3.8Å; H887-Y894 AromaticContact CE1-CZ 3.33Å; H887-Y894 PolarHBondContact CE1-O 3.18Å; H887-Y894 AromaticContact ND1-CD1 3.88Å; H887-Y894 AromaticContact ND1-CE1 3.64Å; H887-Y894 AromaticContact NE2-CE1 3.63Å; H887-Y894 AromaticContact NE2-CZ 3.4Å; H887-Y894 PolarHBondContact NE2-OH 3.46Å
888	V	90.6	Very high	89.9	Confident	93 Å²	93	59.3 Å²	59.3	56%	0.564	29%	0.289	S	S	*	.			trans	-70.1	-33.5	-178.1	-179.2	0	0	0	0	111.6	S883 D886 K890	S883-V888 VanDerWaalsContact O-CB 3.26Å; S883-V888 WeakPolarHBondContact O-CB 3.12Å; S883-V888 WeakPolarHBondContact O-CG2 3.41Å; S883-V888 PolarHBondContact O-N 2.94Å; D886-V888 HydrophobicContact CB-CG2 4.03Å; D886-V888 PolarHBondContact O-N 3.37Å; V888-K890 PolarHBondContact O-N 3.06Å
889	H	86.3	Confident	89.7	Confident	63 Å²	63	58.9 Å²	58.9	29%	0.292	29%	0.286	S	S	.	.			trans	-95.7	87	-176.9	-61.9	-64.4	0	0	0	111.7	S883 H887 E891 M892 D893	S883-H889 PolarHBondContact OG-CD2 3.5Å; S883-H889 PolarHBondContact OG-NE2 3.06Å; H887-H889 VanDerWaalsContact C-N 3.35Å; H887-H889 PolarHBondContact O-N 3.08Å; H889-E891 PolarHBondContact O-N 3.1Å; H889-E891 VanDerWaalsContact O-N 3.12Å; H889-M892 HydrophobicContact CB-CB 4.49Å; H889-M892 HydrophobicContact CB-CE 4.2Å; H889-M892 CarbonylContact O-C 3.5Å; H889-M892 PolarHBondContact O-N 3.33Å; H889-D893 PolarHBondContact O-N 2.81Å; H889-D893 VanDerWaalsContact O-N 3.17Å
890	K	82.5	Confident	89.6	Confident	181 Å²	181	55.4 Å²	55.4	79%	0.787	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-55.7	-30.6	-177.5	-66.8	-173.9	178.9	-178.3	0	115.1	V888 D893	V888-K890 PolarHBondContact O-N 3.06Å; K890-D893 WeakPolarHBondContact O-CB 3.43Å
891	E	80.4	Confident	89.2	Confident	162 Å²	162	60.8 Å²	60.8	76%	0.757	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-76.3	-25.2	-179.4	-64.1	178	178.9	0	0	113.2	H889	H889-E891 PolarHBondContact O-N 3.1Å; H889-E891 VanDerWaalsContact O-N 3.12Å
892	M	85.2	Confident	88.9	Confident	14 Å²	14	65.2 Å²	65.2	7%	0.069	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-116.6	25.3	-179.6	-64.7	-179.9	-76.8	0	0	111.2	Q838 M839 H842 F880 F884 H889	Q838-M892 HydrophobicContact CB-CG 4.06Å; Q838-M892 HydrophobicContact CB-SD 4.27Å; M839-M892 HydrophobicContact CB-SD 4.48Å; H842-M892 VanDerWaalsContact CD2-SD 3.53Å; F880-M892 HydrophobicContact CE2-CE 4.34Å; F884-M892 WeakPolarHBondContact CE2-O 3.4Å; H889-M892 HydrophobicContact CB-CB 4.49Å; H889-M892 HydrophobicContact CB-CE 4.2Å; H889-M892 CarbonylContact O-C 3.5Å; H889-M892 PolarHBondContact O-N 3.33Å
893	D	88.3	Confident	88.6	Confident	25 Å²	25	64.8 Å²	64.8	13%	0.134	32%	0.322	C	S	.	.			trans	-65.1	164.7	-171.8	-169.8	27.2	0	0	0	112.7	H887 H889 K890 K916 S917	H887-D893 IonicContact CE1-OD1 3.51Å; H887-D893 IonicContact CG-OD1 3.05Å; H887-D893 IonicContact ND1-OD1 2.66Å; H887-D893 PolarHBondContact ND1-OD1 3.26Å; H889-D893 PolarHBondContact O-N 2.81Å; H889-D893 VanDerWaalsContact O-N 3.17Å; K890-D893 WeakPolarHBondContact O-CB 3.43Å; D893-K916 HydrophobicContact CB-CD 4.21Å; D893-K916 HydrophobicContact CB-CG 4.47Å; D893-K916 CarbonylContact O-C 3.54Å; D893-K916 VanDerWaalsContact O-CA 3.23Å; D893-K916 WeakPolarHBondContact O-CA 3.43Å; D893-K916 VanDerWaalsContact O-CB 3.24Å; D893-K916 WeakPolarHBondContact O-CB 3.3Å; D893-K916 IonicContact OD2-NZ 2.76Å; D893-K916 PolarHBondContact OD2-NZ 3.35Å; D893-S917 PolarHBondContact O-N 3.36Å
894	Y	92.5	Very high	88.2	Confident	8 Å²	8	70.2 Å²	70.2	3%	0.031	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	158.4	176.5	74.5	-83.6	0	0	0	112.6	L822 F884 I885 H887 I896 S917 F919	L822-Y894 HydrophobicContact CD2-CE2 4.17Å; F884-Y894 HydrophobicContact CE1-CD1 4.38Å; F884-Y894 HydrophobicContact CZ-CD1 4.34Å; I885-Y894 WeakPolarHBondContact O-CE1 3.38Å; I885-Y894 PolarHBondContact O-OH 2.89Å; H887-Y894 AromaticContact CE1-CD1 3.66Å; H887-Y894 AromaticContact CE1-CE1 3.25Å; H887-Y894 WeakPolarHBondContact CE1-CE1 3.31Å; H887-Y894 AromaticContact CE1-CE2 3.8Å; H887-Y894 AromaticContact CE1-CZ 3.33Å; H887-Y894 PolarHBondContact CE1-O 3.18Å; H887-Y894 AromaticContact ND1-CD1 3.88Å; H887-Y894 AromaticContact ND1-CE1 3.64Å; H887-Y894 AromaticContact NE2-CE1 3.63Å; H887-Y894 AromaticContact NE2-CZ 3.4Å; H887-Y894 PolarHBondContact NE2-OH 3.46Å; Y894-I896 HydrophobicContact CD2-CG1 4.31Å; Y894-I896 HydrophobicContact CE2-CD1 4.23Å; Y894-I896 HydrophobicContact CE2-CG1 4.04Å; Y894-S917 WeakPolarHBondContact CA-O 3.46Å; Y894-S917 WeakPolarHBondContact CB-O 3.32Å; Y894-F919 HydrophobicContact CD1-CE1 4.41Å; Y894-F919 HydrophobicContact CD2-CB 4.13Å; Y894-F919 AromaticContact CD2-CD1 3.45Å; Y894-F919 HydrophobicContact CD2-CD1 3.45Å; Y894-F919 VanDerWaalsContact CD2-CD1 3.45Å; Y894-F919 HydrophobicContact CD2-CD2 4.05Å; Y894-F919 AromaticContact CD2-CE1 3.79Å; Y894-F919 HydrophobicContact CD2-CE1 3.79Å; Y894-F919 HydrophobicContact CD2-CE2 4.33Å; Y894-F919 AromaticContact CD2-CG 3.61Å; Y894-F919 HydrophobicContact CD2-CG 3.61Å; Y894-F919 HydrophobicContact CD2-CZ 4.21Å; Y894-F919 HydrophobicContact CE2-CD1 4.21Å; Y894-F919 AromaticContact CE2-CD2 3.98Å; Y894-F919 HydrophobicContact CE2-CD2 3.98Å; Y894-F919 HydrophobicContact CE2-CE1 4.41Å; Y894-F919 HydrophobicContact CE2-CE2 4.18Å; Y894-F919 HydrophobicContact CE2-CG 4Å; Y894-F919 HydrophobicContact CE2-CZ 4.4Å; Y894-F919 AromaticContact CG-CD1 3.81Å; Y894-F919 HydrophobicContact CG-CD1 3.81Å; Y894-F919 AromaticContact CG-CE1 3.78Å; Y894-F919 HydrophobicContact CG-CE1 3.78Å; Y894-F919 HydrophobicContact CG-CG 4.42Å; Y894-F919 HydrophobicContact CG-CZ 4.34Å
895	F	91.7	Very high	87.8	Confident	74 Å²	74	76 Å²	76	33%	0.325	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	154.6	169.6	67.8	-88.4	0	0	0	110.7	K897 M911 K916 S917 I918 F919	F895-K897 HydrophobicContact CD2-CB 4.23Å; F895-K897 HydrophobicContact CE2-CB 4.04Å; F895-K897 HydrophobicContact CE2-CD 4.32Å; F895-M911 HydrophobicContact CZ-CE 4.33Å; F895-K916 HydrophobicContact CD1-CB 4.05Å; F895-K916 HydrophobicContact CD1-CD 4.48Å; F895-K916 HydrophobicContact CE1-CB 4.27Å; F895-S917 PolarHBondContact N-O 3.5Å; F895-S917 VanDerWaalsContact N-O 3.09Å; F895-I918 HydrophobicContact CE1-CD1 4.38Å; F895-I918 HydrophobicContact CE1-CG1 3.76Å; F895-I918 HydrophobicContact CE2-CG1 4.39Å; F895-I918 HydrophobicContact CE2-CG2 3.97Å; F895-I918 HydrophobicContact CZ-CB 4.35Å; F895-I918 HydrophobicContact CZ-CD1 3.89Å; F895-I918 HydrophobicContact CZ-CG1 3.62Å; F895-I918 HydrophobicContact CZ-CG2 4.06Å; F895-F919 PolarHBondContact O-N 3.13Å
896	I	91.9	Very high	87.3	Confident	57 Å²	57	78.8 Å²	78.8	29%	0.292	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	136.2	-177.8	-60.4	167.6	0	0	0	109.2	L822 V823 F831 Y894 F919 N921	L822-I896 HydrophobicContact CD2-CD1 4.04Å; L822-I896 HydrophobicContact CG-CD1 4.49Å; V823-I896 HydrophobicContact CG2-CD1 3.31Å; F831-I896 HydrophobicContact CE1-CD1 4.47Å; F831-I896 HydrophobicContact CE1-CG2 4.27Å; Y894-I896 HydrophobicContact CD2-CG1 4.31Å; Y894-I896 HydrophobicContact CE2-CD1 4.23Å; Y894-I896 HydrophobicContact CE2-CG1 4.04Å; I896-F919 CarbonylContact C-O 3.52Å; I896-F919 VanDerWaalsContact CA-O 3.26Å; I896-F919 WeakPolarHBondContact CA-O 3.27Å; I896-F919 HydrophobicContact CG1-CB 3.92Å; I896-N921 WeakPolarHBondContact CG2-OD1 3.29Å
897	K	90.9	Very high	86.7	Confident	57 Å²	57	77 Å²	77	25%	0.248	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	149.4	-176.9	176.5	-179.4	173.9	-161.4	0	111.4	F895 M911 I918 F919 Y920 N921	F895-K897 HydrophobicContact CD2-CB 4.23Å; F895-K897 HydrophobicContact CE2-CB 4.04Å; F895-K897 HydrophobicContact CE2-CD 4.32Å; K897-M911 HydrophobicContact CD-SD 4.2Å; K897-M911 PolarHBondContact NZ-SD 3.46Å; K897-I918 HydrophobicContact CB-CG2 4.49Å; K897-F919 PolarHBondContact N-O 2.88Å; K897-Y920 WeakPolarHBondContact O-CA 3.49Å; K897-N921 PolarHBondContact O-N 3.1Å
898	D	89.1	Confident	86.4	Confident	91 Å²	91	73.7 Å²	73.7	49%	0.487	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-82.4	140.3	168.7	-62.7	-45.7	0	0	0	112.6	N921	D898-N921 WeakPolarHBondContact OD1-CB 3.27Å; D898-N921 PolarHBondContact OD1-ND2 2.97Å
899	K	87.6	Confident	86.1	Confident	20 Å²	20	69.6 Å²	69.6	9%	0.087	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-65.3	136	169.2	-73.6	-165	-180	-167.4	0	110.8	E832 E903 R904 E909 Y920	E832-K899 IonicContact OE1-NZ 2.95Å; E832-K899 WeakPolarHBondContact OE2-CE 3.41Å; E832-K899 IonicContact OE2-NZ 3.57Å; E832-K899 PolarHBondContact OE2-NZ 2.93Å; K899-E903 HydrophobicContact CB-CB 4.3Å; K899-R904 HydrophobicContact CB-CG 3.71Å; K899-R904 HydrophobicContact CD-CG 4.44Å; K899-R904 PolarHBondContact O-NE 3.03Å; K899-E909 IonicContact NZ-OE1 2.66Å; K899-E909 PolarHBondContact NZ-OE1 2.91Å; K899-Y920 HydrophobicContact CB-CD1 4.41Å; K899-Y920 HydrophobicContact CD-CG 4.48Å; K899-Y920 HydrophobicContact CG-CD1 3.42Å; K899-Y920 VanDerWaalsContact CG-CD1 3.42Å; K899-Y920 HydrophobicContact CG-CE1 4.03Å; K899-Y920 HydrophobicContact CG-CG 3.74Å
900	L	88.8	Confident	85.9	Confident	94 Å²	94	70.2 Å²	70.2	49%	0.492	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-63.4	152.8	169.2	-62.9	167.6	0	0	0	110.1	L902 E903 R904 F910	L900-L902 PolarHBondContact O-N 3.48Å; L900-E903 HydrophobicContact CB-CB 4.38Å; L900-E903 HydrophobicContact CB-CG 4.02Å; L900-E903 WeakPolarHBondContact CB-OE2 3.45Å; L900-E903 HydrophobicContact CD1-CG 4.49Å; L900-E903 PolarHBondContact N-OE2 3.07Å; L900-E903 WeakPolarHBondContact O-CB 3.27Å; L900-E903 PolarHBondContact O-N 3.23Å; L900-R904 PolarHBondContact O-N 3.49Å; L900-F910 HydrophobicContact CD1-CD2 4.18Å
901	L	85.1	Confident	85.8	Confident	134 Å²	134	65.6 Å²	65.6	70%	0.702	33%	0.326	S	S	*	.	H	α-helix	trans	-52.8	-42.9	177.9	-173.1	76.7	0	0	0	111.9	R904 I905	L901-R904 WeakPolarHBondContact O-CB 3.09Å; L901-R904 PolarHBondContact O-N 2.03Å; L901-I905 HydrophobicContact CD2-CD1 4.3Å; L901-I905 HydrophobicContact CG-CD1 3.94Å; L901-I905 WeakPolarHBondContact O-CG1 3.15Å; L901-I905 PolarHBondContact O-N 2.05Å
902	L	85.4	Confident	85.7	Confident	94 Å²	94	62.6 Å²	62.6	49%	0.492	31%	0.312	S	S	.	.	H	α-helix	trans	-69.4	-32.8	-180	-164.7	71.1	0	0	0	112.4	L900 I905 L906 F910	L900-L902 PolarHBondContact O-N 3.48Å; L902-I905 PolarHBondContact O-N 3.06Å; L902-L906 HydrophobicContact CD1-CD1 4.2Å; L902-L906 HydrophobicContact CD1-CG 4.33Å; L902-L906 HydrophobicContact CD2-CD1 4.31Å; L902-L906 HydrophobicContact CG-CD1 3.83Å; L902-L906 HydrophobicContact CG-CG 4.26Å; L902-L906 VanDerWaalsContact O-CB 3.31Å; L902-L906 WeakPolarHBondContact O-CB 3.45Å; L902-L906 WeakPolarHBondContact O-CG 3.41Å; L902-L906 PolarHBondContact O-N 3.15Å; L902-F910 HydrophobicContact CB-CE2 3.98Å; L902-F910 HydrophobicContact CB-CZ 4.1Å; L902-F910 HydrophobicContact CD2-CE2 3.83Å; L902-F910 HydrophobicContact CD2-CZ 3.56Å; L902-F910 HydrophobicContact CG-CE2 4.12Å; L902-F910 HydrophobicContact CG-CZ 3.77Å
903	E	85.4	Confident	85.3	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-67.2	-37.6	172.7	-65.4	176.1	136	0	0	111.1	K899 L900 G907 M908 F910	K899-E903 HydrophobicContact CB-CB 4.3Å; L900-E903 HydrophobicContact CB-CB 4.38Å; L900-E903 HydrophobicContact CB-CG 4.02Å; L900-E903 WeakPolarHBondContact CB-OE2 3.45Å; L900-E903 HydrophobicContact CD1-CG 4.49Å; L900-E903 PolarHBondContact N-OE2 3.07Å; L900-E903 WeakPolarHBondContact O-CB 3.27Å; L900-E903 PolarHBondContact O-N 3.23Å; E903-G907 WeakPolarHBondContact O-CA 3.26Å; E903-G907 PolarHBondContact O-N 2.94Å; E903-M908 WeakPolarHBondContact CA-O 3.25Å; E903-M908 WeakPolarHBondContact CB-O 3.41Å; E903-M908 WeakPolarHBondContact CG-O 2.98Å; E903-M908 PolarHBondContact O-N 3.28Å; E903-F910 HydrophobicContact CG-CB 4.39Å; E903-F910 HydrophobicContact CG-CD1 4.41Å; E903-F910 HydrophobicContact CG-CD2 3.39Å; E903-F910 HydrophobicContact CG-CE2 3.61Å; E903-F910 HydrophobicContact CG-CG 3.82Å; E903-F910 HydrophobicContact CG-CZ 4.21Å; E903-F910 WeakPolarHBondContact OE1-CB 3.39Å; E903-F910 PolarHBondContact OE1-N 3.37Å
904	R	83.3	Confident	84.5	Confident	138 Å²	138	69.2 Å²	69.2	52%	0.521	35%	0.346	S	S	.	.	H	α-helix	trans	-66	-44.7	174.2	-65.7	-178.8	-177.4	-166.8	-4.6	111.9	K899 L900 L901	K899-R904 HydrophobicContact CB-CG 3.71Å; K899-R904 HydrophobicContact CD-CG 4.44Å; K899-R904 PolarHBondContact O-NE 3.03Å; L900-R904 PolarHBondContact O-N 3.49Å; L901-R904 WeakPolarHBondContact O-CB 3.09Å; L901-R904 PolarHBondContact O-N 2.03Å
905	I	84.4	Confident	83.6	Confident	122 Å²	122	76.4 Å²	76.4	63%	0.626	38%	0.38	S	S	*	.	H	α-helix	trans	-69.6	-47.5	-179	-68.4	168.1	0	0	0	111.6	L901 L902 G907	L901-I905 HydrophobicContact CD2-CD1 4.3Å; L901-I905 HydrophobicContact CG-CD1 3.94Å; L901-I905 WeakPolarHBondContact O-CG1 3.15Å; L901-I905 PolarHBondContact O-N 2.05Å; L902-I905 PolarHBondContact O-N 3.06Å; I905-G907 VanDerWaalsContact C-N 3.27Å; I905-G907 PolarHBondContact O-N 3.45Å
906	L	81.5	Confident	83.4	Confident	65 Å²	65	77 Å²	77	34%	0.34	38%	0.383	S	S	.	.	H	α-helix	trans	-77	-16.7	-178.1	-64.2	178.5	0	0	0	112.6	L541 L902 M908 F910	L541-L906 HydrophobicContact CD1-CD2 4.28Å; L902-L906 HydrophobicContact CD1-CD1 4.2Å; L902-L906 HydrophobicContact CD1-CG 4.33Å; L902-L906 HydrophobicContact CD2-CD1 4.31Å; L902-L906 HydrophobicContact CG-CD1 3.83Å; L902-L906 HydrophobicContact CG-CG 4.26Å; L902-L906 VanDerWaalsContact O-CB 3.31Å; L902-L906 WeakPolarHBondContact O-CB 3.45Å; L902-L906 WeakPolarHBondContact O-CG 3.41Å; L902-L906 PolarHBondContact O-N 3.15Å; L906-M908 HydrophobicContact CB-CB 4.39Å; L906-M908 PolarHBondContact O-N 3.04Å; L906-F910 HydrophobicContact CD1-CE1 4.21Å; L906-F910 HydrophobicContact CD1-CZ 4.03Å
907	G	79.5	Confident	83.3	Confident	36 Å²	36	74.3 Å²	74.3	37%	0.371	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	39.1	-172.9	0	0	0	0	0	111.4	R549 E903 I905	R549-G907 PolarHBondContact NH2-O 3.17Å; E903-G907 WeakPolarHBondContact O-CA 3.26Å; E903-G907 PolarHBondContact O-N 2.94Å; I905-G907 VanDerWaalsContact C-N 3.27Å; I905-G907 PolarHBondContact O-N 3.45Å
908	M	83.1	Confident	83.4	Confident	19 Å²	19	71.7 Å²	71.7	9%	0.094	36%	0.358	C	S	.	.			trans	-138.8	132	-179.9	178.7	173.9	72.9	0	0	109.5	L541 A544 E903 L906 F910	L541-M908 HydrophobicContact CD2-CE 4.37Å; A544-M908 HydrophobicContact CB-SD 4.04Å; E903-M908 WeakPolarHBondContact CA-O 3.25Å; E903-M908 WeakPolarHBondContact CB-O 3.41Å; E903-M908 WeakPolarHBondContact CG-O 2.98Å; E903-M908 PolarHBondContact O-N 3.28Å; L906-M908 HydrophobicContact CB-CB 4.39Å; L906-M908 PolarHBondContact O-N 3.04Å; M908-F910 HydrophobicContact CE-CD1 4.02Å; M908-F910 HydrophobicContact CE-CE1 3.68Å
909	E	84.8	Confident	83.6	Confident	8 Å²	8	67.4 Å²	67.4	4%	0.037	34%	0.335	C	S	.	.			trans	-82.7	130.8	176.8	-58.5	69.7	-142.3	0	0	109.9	R548 R549 K899 Y920	R548-E909 PolarHBondContact NH1-O 3.4Å; R549-E909 IonicContact CZ-OE1 2.84Å; R549-E909 IonicContact CZ-OE2 2.83Å; R549-E909 IonicContact NE-OE1 3.3Å; R549-E909 IonicContact NE-OE2 2.69Å; R549-E909 PolarHBondContact NE-OE2 3.2Å; R549-E909 IonicContact NH2-OE1 3.88Å; R549-E909 PolarHBondContact NH2-OE1 3.47Å; R549-E909 IonicContact NH2-OE2 3.64Å; R549-E909 PolarHBondContact NH2-OE2 3.49Å; K899-E909 IonicContact NZ-OE1 2.66Å; K899-E909 PolarHBondContact NZ-OE1 2.91Å; E909-Y920 HydrophobicContact CG-CE2 3.95Å
910	F	82.7	Confident	83.9	Confident	75 Å²	75	66.4 Å²	66.4	33%	0.329	33%	0.33	S	S	.	.	S	Bend	trans	-84.4	-24.9	179.8	-62.1	-34.5	0	0	0	113.4	L900 L902 E903 L906 M908	L900-F910 HydrophobicContact CD1-CD2 4.18Å; L902-F910 HydrophobicContact CB-CE2 3.98Å; L902-F910 HydrophobicContact CB-CZ 4.1Å; L902-F910 HydrophobicContact CD2-CE2 3.83Å; L902-F910 HydrophobicContact CD2-CZ 3.56Å; L902-F910 HydrophobicContact CG-CE2 4.12Å; L902-F910 HydrophobicContact CG-CZ 3.77Å; E903-F910 HydrophobicContact CG-CB 4.39Å; E903-F910 HydrophobicContact CG-CD1 4.41Å; E903-F910 HydrophobicContact CG-CD2 3.39Å; E903-F910 HydrophobicContact CG-CE2 3.61Å; E903-F910 HydrophobicContact CG-CG 3.82Å; E903-F910 HydrophobicContact CG-CZ 4.21Å; E903-F910 WeakPolarHBondContact OE1-CB 3.39Å; E903-F910 PolarHBondContact OE1-N 3.37Å; L906-F910 HydrophobicContact CD1-CE1 4.21Å; L906-F910 HydrophobicContact CD1-CZ 4.03Å; M908-F910 HydrophobicContact CE-CD1 4.02Å; M908-F910 HydrophobicContact CE-CE1 3.68Å
911	M	81.1	Confident	84	Confident	84 Å²	84	64.2 Å²	64.2	41%	0.414	32%	0.319	S	S	.	.	S	Bend	trans	-95.6	133.4	176.8	-66.4	-175.2	67.5	0	0	111.4	F895 K897 I918	F895-M911 HydrophobicContact CZ-CE 4.33Å; K897-M911 HydrophobicContact CD-SD 4.2Å; K897-M911 PolarHBondContact NZ-SD 3.46Å; M911-I918 HydrophobicContact CB-CD1 4.01Å
912	E	76.8	Confident	84.1	Confident	99 Å²	99	58.6 Å²	58.6	46%	0.463	29%	0.29	S	S	.	.			trans	-94.8	135.3	173.9	-68.6	179.7	-176.5	0	0	110.7	R548 M914	R548-E912 HydrophobicContact CG-CG 4.48Å; R548-E912 IonicContact NE-OE1 3.9Å; R548-E912 PolarHBondContact NE-OE1 3.49Å; E912-M914 VanDerWaalsContact C-N 3.28Å; E912-M914 PolarHBondContact O-N 3.49Å
913	P	76.6	Confident	83.7	Confident	29 Å²	29	62.4 Å²	62.4	19%	0.188	31%	0.305	C	S	.	.			trans	-76.8	76.9	179.1	32.5	-35.2	0	0	0	110.7	A834 I835 K916 I918	A834-P913 HydrophobicContact CB-CG 4.11Å; I835-P913 WeakPolarHBondContact O-CG 3.21Å; P913-K916 WeakPolarHBondContact CA-O 3.36Å; P913-K916 WeakPolarHBondContact CB-O 3.42Å; P913-I918 HydrophobicContact CB-CG1 4.31Å
914	M	72.2	Confident	83.5	Confident	149 Å²	149	65.2 Å²	65.2	73%	0.734	33%	0.334	S	S	*	.	S	Bend	trans	-70.4	-63.3	-179	-71.4	-81.5	-156.4	0	0	111.8	E912	E912-M914 VanDerWaalsContact C-N 3.28Å; E912-M914 PolarHBondContact O-N 3.49Å
915	E	74.6	Confident	83.8	Confident	159 Å²	159	61.5 Å²	61.5	74%	0.743	32%	0.32	S	S	*	.	S	Bend	trans	-101.8	-44.7	-176	-65.7	-178.5	171.4	0	0	112.1
916	K	85.9	Confident	84	Confident	87 Å²	87	56.9 Å²	56.9	38%	0.378	30%	0.299	S	S	.	.	S	Bend	trans	-112.6	149.2	179.7	-68	-165.4	177.6	-157.1	0	111.7	D893 F895 P913	D893-K916 HydrophobicContact CB-CD 4.21Å; D893-K916 HydrophobicContact CB-CG 4.47Å; D893-K916 CarbonylContact O-C 3.54Å; D893-K916 VanDerWaalsContact O-CA 3.23Å; D893-K916 WeakPolarHBondContact O-CA 3.43Å; D893-K916 VanDerWaalsContact O-CB 3.24Å; D893-K916 WeakPolarHBondContact O-CB 3.3Å; D893-K916 IonicContact OD2-NZ 2.76Å; D893-K916 PolarHBondContact OD2-NZ 3.35Å; F895-K916 HydrophobicContact CD1-CB 4.05Å; F895-K916 HydrophobicContact CD1-CD 4.48Å; F895-K916 HydrophobicContact CE1-CB 4.27Å; P913-K916 WeakPolarHBondContact CA-O 3.36Å; P913-K916 WeakPolarHBondContact CB-O 3.42Å
917	S	91.4	Very high	84.5	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	154.1	170.5	-55.9	0	0	0	0	110.3	A834 I835 S836 D893 Y894 F895	A834-S917 CarbonylContact O-C 3.57Å; A834-S917 WeakPolarHBondContact O-CA 3.33Å; I835-S917 WeakPolarHBondContact CA-OG 3.35Å; S836-S917 PolarHBondContact N-OG 2.82Å; D893-S917 PolarHBondContact O-N 3.36Å; Y894-S917 WeakPolarHBondContact CA-O 3.46Å; Y894-S917 WeakPolarHBondContact CB-O 3.32Å; F895-S917 PolarHBondContact N-O 3.5Å; F895-S917 VanDerWaalsContact N-O 3.09Å
918	I	92.6	Very high	85.1	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.015	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.9	-176.8	-47.8	178.8	0	0	0	109	I833 A834 F895 K897 M911 P913 Y920	I833-I918 WeakPolarHBondContact CA-O 3.37Å; A834-I918 HydrophobicContact CB-CB 4.43Å; A834-I918 PolarHBondContact N-O 2.78Å; A834-I918 PolarHBondContact O-N 3.38Å; F895-I918 HydrophobicContact CE1-CD1 4.38Å; F895-I918 HydrophobicContact CE1-CG1 3.76Å; F895-I918 HydrophobicContact CE2-CG1 4.39Å; F895-I918 HydrophobicContact CE2-CG2 3.97Å; F895-I918 HydrophobicContact CZ-CB 4.35Å; F895-I918 HydrophobicContact CZ-CD1 3.89Å; F895-I918 HydrophobicContact CZ-CG1 3.62Å; F895-I918 HydrophobicContact CZ-CG2 4.06Å; K897-I918 HydrophobicContact CB-CG2 4.49Å; M911-I918 HydrophobicContact CB-CD1 4.01Å; P913-I918 HydrophobicContact CB-CG1 4.31Å; I918-Y920 HydrophobicContact CB-CE2 4.08Å; I918-Y920 HydrophobicContact CG2-CD1 4.32Å; I918-Y920 HydrophobicContact CG2-CD2 4.16Å; I918-Y920 HydrophobicContact CG2-CE1 3.87Å; I918-Y920 HydrophobicContact CG2-CE2 3.67Å; I918-Y920 HydrophobicContact CG2-CG 4.47Å
919	F	93.5	Very high	85.4	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	116.4	174.3	-82.2	48.8	0	0	0	107.9	Y788 L822 F831 I833 F884 I885 Y894 F895 I896 K897	Y788-F919 HydrophobicContact CD1-CD2 4.3Å; Y788-F919 AromaticContact CD1-CE2 3.66Å; Y788-F919 HydrophobicContact CD1-CE2 3.66Å; Y788-F919 HydrophobicContact CE1-CE2 4.33Å; Y788-F919 AromaticContact CG-CE2 3.96Å; Y788-F919 HydrophobicContact CG-CE2 3.96Å; L822-F919 HydrophobicContact CD2-CD2 4.13Å; L822-F919 HydrophobicContact CD2-CE2 4.37Å; F831-F919 HydrophobicContact CB-CD2 4.03Å; F831-F919 HydrophobicContact CD1-CB 4.28Å; F831-F919 HydrophobicContact CD1-CD2 4.39Å; F831-F919 HydrophobicContact CG-CD2 4.11Å; I833-F919 HydrophobicContact CB-CD1 4.42Å; I833-F919 HydrophobicContact CB-CE1 4.26Å; I833-F919 HydrophobicContact CG2-CD1 3.79Å; I833-F919 HydrophobicContact CG2-CD2 3.73Å; I833-F919 HydrophobicContact CG2-CE1 3.69Å; I833-F919 HydrophobicContact CG2-CE2 3.64Å; I833-F919 HydrophobicContact CG2-CG 3.8Å; I833-F919 HydrophobicContact CG2-CZ 3.61Å; F884-F919 HydrophobicContact CE1-CE1 4.09Å; F884-F919 AromaticContact CE1-CZ 3.99Å; F884-F919 HydrophobicContact CE1-CZ 3.99Å; F884-F919 HydrophobicContact CZ-CE1 4.28Å; I885-F919 HydrophobicContact CD1-CE2 3.98Å; I885-F919 HydrophobicContact CD1-CZ 3.83Å; Y894-F919 HydrophobicContact CD1-CE1 4.41Å; Y894-F919 HydrophobicContact CD2-CB 4.13Å; Y894-F919 AromaticContact CD2-CD1 3.45Å; Y894-F919 HydrophobicContact CD2-CD1 3.45Å; Y894-F919 VanDerWaalsContact CD2-CD1 3.45Å; Y894-F919 HydrophobicContact CD2-CD2 4.05Å; Y894-F919 AromaticContact CD2-CE1 3.79Å; Y894-F919 HydrophobicContact CD2-CE1 3.79Å; Y894-F919 HydrophobicContact CD2-CE2 4.33Å; Y894-F919 AromaticContact CD2-CG 3.61Å; Y894-F919 HydrophobicContact CD2-CG 3.61Å; Y894-F919 HydrophobicContact CD2-CZ 4.21Å; Y894-F919 HydrophobicContact CE2-CD1 4.21Å; Y894-F919 AromaticContact CE2-CD2 3.98Å; Y894-F919 HydrophobicContact CE2-CD2 3.98Å; Y894-F919 HydrophobicContact CE2-CE1 4.41Å; Y894-F919 HydrophobicContact CE2-CE2 4.18Å; Y894-F919 HydrophobicContact CE2-CG 4Å; Y894-F919 HydrophobicContact CE2-CZ 4.4Å; Y894-F919 AromaticContact CG-CD1 3.81Å; Y894-F919 HydrophobicContact CG-CD1 3.81Å; Y894-F919 AromaticContact CG-CE1 3.78Å; Y894-F919 HydrophobicContact CG-CE1 3.78Å; Y894-F919 HydrophobicContact CG-CG 4.42Å; Y894-F919 HydrophobicContact CG-CZ 4.34Å; F895-F919 PolarHBondContact O-N 3.13Å; I896-F919 CarbonylContact C-O 3.52Å; I896-F919 VanDerWaalsContact CA-O 3.26Å; I896-F919 WeakPolarHBondContact CA-O 3.27Å; I896-F919 HydrophobicContact CG1-CB 3.92Å; K897-F919 PolarHBondContact N-O 2.88Å
920	Y	92.1	Very high	85.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	127.1	176.4	-61.6	-81.8	0	0	0	110.4	F831 E832 A834 K897 K899 E909 I918 D922	F831-Y920 CarbonylContact C-O 3.57Å; F831-Y920 WeakPolarHBondContact CA-O 3.4Å; E832-Y920 PolarHBondContact N-O 2.77Å; E832-Y920 PolarHBondContact O-N 3.32Å; A834-Y920 HydrophobicContact CB-CE2 4.34Å; K897-Y920 WeakPolarHBondContact O-CA 3.49Å; K899-Y920 HydrophobicContact CB-CD1 4.41Å; K899-Y920 HydrophobicContact CD-CG 4.48Å; K899-Y920 HydrophobicContact CG-CD1 3.42Å; K899-Y920 VanDerWaalsContact CG-CD1 3.42Å; K899-Y920 HydrophobicContact CG-CE1 4.03Å; K899-Y920 HydrophobicContact CG-CG 3.74Å; E909-Y920 HydrophobicContact CG-CE2 3.95Å; I918-Y920 HydrophobicContact CB-CE2 4.08Å; I918-Y920 HydrophobicContact CG2-CD1 4.32Å; I918-Y920 HydrophobicContact CG2-CD2 4.16Å; I918-Y920 HydrophobicContact CG2-CE1 3.87Å; I918-Y920 HydrophobicContact CG2-CE2 3.67Å; I918-Y920 HydrophobicContact CG2-CG 4.47Å; Y920-D922 PolarHBondContact O-N 3.41Å
921	N	90.9	Very high	86.2	Confident	48 Å²	48	50.3 Å²	50.3	26%	0.257	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	129.1	173	-68.2	-44.6	0	0	0	109.8	F831 I896 K897 D898	F831-N921 VanDerWaalsContact CE1-OD1 3.25Å; F831-N921 WeakPolarHBondContact CE1-OD1 3.32Å; I896-N921 WeakPolarHBondContact CG2-OD1 3.29Å; K897-N921 PolarHBondContact O-N 3.1Å; D898-N921 WeakPolarHBondContact OD1-CB 3.27Å; D898-N921 PolarHBondContact OD1-ND2 2.97Å
922	D	87.2	Confident	86.8	Confident	15 Å²	15	46.8 Å²	46.8	8%	0.08	25%	0.247	C	C	.	.			trans	-122.9	96.8	-179.1	173.1	31.9	0	0	0	110.6	T830 E832 Y920 G924 Y925 S926	T830-D922 PolarHBondContact O-N 3.41Å; T830-D922 PolarHBondContact OG1-O 2.83Å; E832-D922 HydrophobicContact CG-CB 4.18Å; Y920-D922 PolarHBondContact O-N 3.41Å; D922-G924 VanDerWaalsContact C-N 3.3Å; D922-G924 PolarHBondContact OD1-N 3.14Å; D922-Y925 PolarHBondContact OD1-N 3.45Å; D922-Y925 WeakPolarHBondContact OD2-CA 3.41Å; D922-Y925 PolarHBondContact OD2-N 2.89Å; D922-S926 PolarHBondContact OD1-N 3.4Å; D922-S926 PolarHBondContact OD2-N 2.03Å; D922-S926 PolarHBondContact OD2-OG 2.95Å; D922-S926 VanDerWaalsContact OD2-OG 3.1Å
923	E	78.7	Confident	87.4	Confident	175 Å²	175	42.9 Å²	42.9	82%	0.818	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-10.9	174.8	-62.8	-177.7	166.3	0	0	112.8
924	G	80.3	Confident	88	Confident	59 Å²	59	43.3 Å²	43.3	61%	0.608	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.7	7	-171.1	0	0	0	0	0	115	D922 S926	D922-G924 VanDerWaalsContact C-N 3.3Å; D922-G924 PolarHBondContact OD1-N 3.14Å; G924-S926 VanDerWaalsContact C-N 3.32Å; G924-S926 PolarHBondContact O-N 2.8Å
925	Y	88.9	Confident	89	Confident	59 Å²	59	37 Å²	37	23%	0.231	21%	0.207	C	C	.	.			trans	50.6	48.9	-175.2	-50.9	-67.6	0	0	0	112.6	I763 R764 V767 T830 D922 F927 S928	I763-Y925 HydrophobicContact CG2-CD1 4.41Å; I763-Y925 HydrophobicContact CG2-CD2 4.33Å; I763-Y925 HydrophobicContact CG2-CG 3.87Å; R764-Y925 HydrophobicContact CB-CE2 4.24Å; R764-Y925 WeakPolarHBondContact CG-OH 3.44Å; V767-Y925 HydrophobicContact CG2-CD1 4.05Å; V767-Y925 HydrophobicContact CG2-CE1 4.04Å; T830-Y925 HydrophobicContact CG2-CD1 3.98Å; T830-Y925 HydrophobicContact CG2-CE1 4.43Å; D922-Y925 PolarHBondContact OD1-N 3.45Å; D922-Y925 WeakPolarHBondContact OD2-CA 3.41Å; D922-Y925 PolarHBondContact OD2-N 2.89Å; Y925-F927 HydrophobicContact CD1-CE1 4.1Å; Y925-F927 HydrophobicContact CG-CE1 4.42Å; Y925-F927 PolarHBondContact O-N 2.78Å; Y925-F927 VanDerWaalsContact O-N 3.11Å; Y925-S928 VanDerWaalsContact O-CB 3.27Å; Y925-S928 WeakPolarHBondContact O-CB 3.38Å; Y925-S928 PolarHBondContact O-N 2.71Å; Y925-S928 PolarHBondContact O-OG 3.25Å
926	S	89.4	Confident	89.9	Confident	26 Å²	26	29.9 Å²	29.9	18%	0.182	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-65.2	-14.8	-174.2	74.5	0	0	0	0	114	Y787 E832 D922 G924 S928 S929	Y787-S926 VanDerWaalsContact CE1-OG 3.28Å; Y787-S926 WeakPolarHBondContact CE1-OG 3.5Å; E832-S926 WeakPolarHBondContact CG-OG 3.46Å; E832-S926 VanDerWaalsContact OE1-CB 3.23Å; E832-S926 WeakPolarHBondContact OE1-CB 3.11Å; E832-S926 PolarHBondContact OE1-OG 3.23Å; D922-S926 PolarHBondContact OD1-N 3.4Å; D922-S926 PolarHBondContact OD2-N 2.03Å; D922-S926 PolarHBondContact OD2-OG 2.95Å; D922-S926 VanDerWaalsContact OD2-OG 3.1Å; G924-S926 VanDerWaalsContact C-N 3.32Å; G924-S926 PolarHBondContact O-N 2.8Å; S926-S928 PolarHBondContact O-N 3.02Å; S926-S928 VanDerWaalsContact O-N 3.12Å; S926-S929 VanDerWaalsContact O-CB 3.24Å; S926-S929 WeakPolarHBondContact O-CB 3.36Å; S926-S929 PolarHBondContact O-N 3.38Å; S926-S929 PolarHBondContact O-OG 3.07Å
927	F	91.8	Very high	90.2	Very high	1 Å²	1	28.9 Å²	28.9	0%	0.004	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-56.8	-23.7	168.2	80.2	-93.4	0	0	0	112.8	W677 I763 F766 V767 L779 Y787 I789 T830 Y925 S929 V930 L931	W677-F927 HydrophobicContact CH2-CD2 4.42Å; W677-F927 HydrophobicContact CZ3-CD2 4.12Å; W677-F927 HydrophobicContact CZ3-CE2 4.14Å; I763-F927 HydrophobicContact CG2-CE1 3.8Å; I763-F927 HydrophobicContact CG2-CE2 4.34Å; I763-F927 HydrophobicContact CG2-CZ 3.51Å; F766-F927 HydrophobicContact CD1-CE2 4.35Å; F766-F927 HydrophobicContact CD1-CZ 4.28Å; V767-F927 HydrophobicContact CG2-CE1 3.85Å; V767-F927 HydrophobicContact CG2-CZ 4.09Å; L779-F927 HydrophobicContact CD1-CB 4.27Å; Y787-F927 HydrophobicContact CD1-CB 4.01Å; Y787-F927 HydrophobicContact CD2-CB 4Å; Y787-F927 HydrophobicContact CG-CB 3.62Å; I789-F927 HydrophobicContact CD1-CD1 4.11Å; I789-F927 HydrophobicContact CD1-CD2 4.04Å; I789-F927 HydrophobicContact CD1-CE1 4.05Å; I789-F927 HydrophobicContact CD1-CE2 3.99Å; I789-F927 HydrophobicContact CD1-CG 4.09Å; I789-F927 HydrophobicContact CD1-CZ 3.98Å; I789-F927 HydrophobicContact CG1-CD1 4.46Å; T830-F927 HydrophobicContact CG2-CD1 4.16Å; T830-F927 HydrophobicContact CG2-CE1 4.11Å; Y925-F927 HydrophobicContact CD1-CE1 4.1Å; Y925-F927 HydrophobicContact CG-CE1 4.42Å; Y925-F927 PolarHBondContact O-N 2.78Å; Y925-F927 VanDerWaalsContact O-N 3.11Å; F927-S929 PolarHBondContact O-N 3.15Å; F927-V930 WeakPolarHBondContact O-CB 3.45Å; F927-V930 PolarHBondContact O-N 2.65Å; F927-L931 HydrophobicContact CE2-CD1 4.33Å
928	S	91.6	Very high	90.3	Very high	15 Å²	15	29.7 Å²	29.7	11%	0.105	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-57.3	-18.9	172.6	62.8	0	0	0	0	113.8	Y925 S926 V930 L931 G934	Y925-S928 VanDerWaalsContact O-CB 3.27Å; Y925-S928 WeakPolarHBondContact O-CB 3.38Å; Y925-S928 PolarHBondContact O-N 2.71Å; Y925-S928 PolarHBondContact O-OG 3.25Å; S926-S928 PolarHBondContact O-N 3.02Å; S926-S928 VanDerWaalsContact O-N 3.12Å; S928-V930 PolarHBondContact O-N 2.96Å; S928-L931 WeakPolarHBondContact O-CA 3.05Å; S928-L931 WeakPolarHBondContact O-CB 3.44Å; S928-L931 PolarHBondContact O-N 2.98Å; S928-G934 WeakPolarHBondContact O-CA 3.26Å; S928-G934 PolarHBondContact O-N 3.03Å
929	S	89.9	Confident	90.4	Very high	43 Å²	43	30 Å²	30	30%	0.301	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-60.5	-18.9	171.2	63.3	0	0	0	0	114.1	Q631 Y787 S926 F927 N935	Q631-S929 PolarHBondContact NE2-O 2.72Å; Y787-S929 PolarHBondContact OH-OG 3.12Å; S926-S929 VanDerWaalsContact O-CB 3.24Å; S926-S929 WeakPolarHBondContact O-CB 3.36Å; S926-S929 PolarHBondContact O-N 3.38Å; S926-S929 PolarHBondContact O-OG 3.07Å; F927-S929 PolarHBondContact O-N 3.15Å; S929-N935 PolarHBondContact O-ND2 2.89Å
930	V	91.9	Very high	90.5	Very high	6 Å²	6	30.4 Å²	30.4	4%	0.036	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-85.2	-15.3	174.9	178.4	0	0	0	0	112.2	Q631 I634 Y787 F927 S928 R975	Q631-V930 WeakPolarHBondContact CG-O 3.09Å; I634-V930 HydrophobicContact CB-CG1 4.3Å; I634-V930 HydrophobicContact CD1-CG1 3.31Å; I634-V930 HydrophobicContact CG1-CG1 4.25Å; I634-V930 HydrophobicContact CG2-CG1 3.57Å; Y787-V930 HydrophobicContact CD2-CG2 3.95Å; Y787-V930 HydrophobicContact CE2-CG2 3.58Å; F927-V930 WeakPolarHBondContact O-CB 3.45Å; F927-V930 PolarHBondContact O-N 2.65Å; S928-V930 PolarHBondContact O-N 2.96Å; V930-R975 PolarHBondContact O-NH2 3.46Å
931	L	92.8	Very high	90.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	20%	0.197	C	C	.	.	S	Bend	trans	-102.2	171.4	179.7	-47.5	175.9	0	0	0	110.3	Q631 W677 I680 I763 F927 S928 Y933 N935	Q631-L931 PolarHBondContact NE2-O 2.8Å; W677-L931 HydrophobicContact CH2-CD2 4.14Å; W677-L931 HydrophobicContact CZ2-CD2 4.09Å; I680-L931 HydrophobicContact CB-CD1 4.42Å; I680-L931 HydrophobicContact CD1-CD1 3.9Å; I680-L931 HydrophobicContact CG1-CD1 4.01Å; I763-L931 HydrophobicContact CD1-CD1 3.88Å; F927-L931 HydrophobicContact CE2-CD1 4.33Å; S928-L931 WeakPolarHBondContact O-CA 3.05Å; S928-L931 WeakPolarHBondContact O-CB 3.44Å; S928-L931 PolarHBondContact O-N 2.98Å; L931-Y933 PolarHBondContact O-N 3.27Å; L931-N935 PolarHBondContact O-ND2 2.73Å
932	Y	92.8	Very high	91	Very high	9 Å²	9	29.8 Å²	29.8	4%	0.035	19%	0.186	C	C	.	.	S	Bend	trans	-62.9	-35.5	170	-82.1	6.4	0	0	0	112.1	L628 Q681 R684 G934 N935 L939 F971 R975	L628-Y932 HydrophobicContact CD1-CE1 4.11Å; Q681-Y932 PolarHBondContact O-N 2.79Å; R684-Y932 HydrophobicContact CG-CD2 4.22Å; Y932-G934 VanDerWaalsContact C-N 3.35Å; Y932-G934 PolarHBondContact O-N 2.54Å; Y932-N935 PolarHBondContact O-N 3.28Å; Y932-L939 HydrophobicContact CD1-CD1 4.44Å; Y932-L939 HydrophobicContact CD2-CD1 4.27Å; Y932-L939 HydrophobicContact CG-CD1 4.03Å; Y932-F971 PolarHBondContact OH-O 2.73Å; Y932-R975 HydrophobicContact CD1-CG 4.25Å; Y932-R975 HydrophobicContact CE1-CB 4.12Å; Y932-R975 HydrophobicContact CE1-CG 3.66Å; Y932-R975 HydrophobicContact CE2-CB 4.23Å; Y932-R975 HydrophobicContact CE2-CG 4.25Å; Y932-R975 WeakPolarHBondContact OH-CB 3.35Å
933	Y	90.6	Very high	91.5	Very high	17 Å²	17	29.3 Å²	29.3	7%	0.067	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-48.2	-47.7	-179.5	-166.4	-93	0	0	0	114.7	V683 K685 F751 E756 I763 L931 N935	V683-Y933 HydrophobicContact CG1-CD2 4.19Å; V683-Y933 WeakPolarHBondContact O-CA 3.44Å; V683-Y933 PolarHBondContact O-N 2.87Å; V683-Y933 VanDerWaalsContact O-N 3.1Å; K685-Y933 HydrophobicContact CG-CD2 4.19Å; K685-Y933 HydrophobicContact CG-CE2 4.06Å; F751-Y933 AromaticContact CE1-CE2 3.65Å; F751-Y933 HydrophobicContact CE1-CE2 3.65Å; F751-Y933 HydrophobicContact CZ-CE2 4.14Å; E756-Y933 PolarHBondContact OE1-OH 2.72Å; I763-Y933 HydrophobicContact CD1-CD1 4.17Å; I763-Y933 HydrophobicContact CD1-CD2 4.45Å; I763-Y933 HydrophobicContact CD1-CG 4.1Å; I763-Y933 HydrophobicContact CG1-CD1 3.75Å; I763-Y933 HydrophobicContact CG1-CD2 4.25Å; I763-Y933 HydrophobicContact CG1-CE1 3.61Å; I763-Y933 HydrophobicContact CG1-CE2 4.13Å; I763-Y933 HydrophobicContact CG1-CG 4.03Å; L931-Y933 PolarHBondContact O-N 3.27Å; Y933-N935 PolarHBondContact O-N 2.82Å
934	G	89.3	Confident	92.4	Very high	38 Å²	38	21 Å²	21	39%	0.392	15%	0.145	S	C	.	.	G	3₁₀ helix	trans	-77.3	0.3	-178.9	0	0	0	0	0	114.7	S928 Y932	S928-G934 WeakPolarHBondContact O-CA 3.26Å; S928-G934 PolarHBondContact O-N 3.03Å; Y932-G934 VanDerWaalsContact C-N 3.35Å; Y932-G934 PolarHBondContact O-N 2.54Å
935	N	93	Very high	93.2	Very high	18 Å²	18	18.1 Å²	18.1	10%	0.096	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-130.2	20.5	-167.5	-62.2	-65.7	0	0	0	114.3	K627 Q631 S929 L931 Y932 Y933 A937 T938 L939	K627-N935 WeakPolarHBondContact CE-OD1 3.41Å; K627-N935 PolarHBondContact NZ-OD1 3.2Å; Q631-N935 PolarHBondContact NE2-ND2 3.49Å; S929-N935 PolarHBondContact O-ND2 2.89Å; L931-N935 PolarHBondContact O-ND2 2.73Å; Y932-N935 PolarHBondContact O-N 3.28Å; Y933-N935 PolarHBondContact O-N 2.82Å; N935-A937 VanDerWaalsContact C-N 3.3Å; N935-A937 PolarHBondContact O-N 3.2Å; N935-T938 WeakPolarHBondContact O-CB 3.42Å; N935-T938 PolarHBondContact O-N 2.95Å; N935-L939 PolarHBondContact O-N 2.97Å
936	E	92.6	Very high	93.6	Very high	9 Å²	9	17.5 Å²	17.5	4%	0.042	11%	0.114	C	C	.	.	H	α-helix	trans	-53.1	-43	-175.5	-165.8	62.5	-125.1	0	0	112.9	R684 K685 I686 I748 T938 L939 L940	R684-E936 WeakPolarHBondContact CB-OE2 3.29Å; R684-E936 IonicContact CZ-OE1 2.92Å; R684-E936 VanDerWaalsContact CZ-OE1 3.3Å; R684-E936 IonicContact NE-OE1 3.98Å; R684-E936 PolarHBondContact NE-OE1 2.97Å; R684-E936 VanDerWaalsContact NE-OE1 3.07Å; R684-E936 IonicContact NE-OE2 2.77Å; R684-E936 IonicContact NH2-OE1 3.74Å; R684-E936 PolarHBondContact NH2-OE1 3.15Å; K685-E936 HydrophobicContact CB-CG 4.26Å; K685-E936 PolarHBondContact N-OE2 3.42Å; I686-E936 HydrophobicContact CD1-CG 3.85Å; I686-E936 WeakPolarHBondContact CD1-OE1 3.15Å; I686-E936 HydrophobicContact CG1-CG 3.93Å; I748-E936 HydrophobicContact CD1-CG 4.04Å; I748-E936 HydrophobicContact CG1-CG 4.13Å; E936-T938 VanDerWaalsContact C-N 3.28Å; E936-T938 PolarHBondContact O-N 3.33Å; E936-L939 PolarHBondContact O-N 3.41Å; E936-L940 WeakPolarHBondContact O-CB 3.12Å; E936-L940 PolarHBondContact O-N 3.22Å
937	A	92.3	Very high	94	Very high	66 Å²	66	16.3 Å²	16.3	55%	0.545	11%	0.106	S	C	.	.	H	α-helix	trans	-60.5	-35.9	178.6	0	0	0	0	0	113.2	N935 I941	N935-A937 VanDerWaalsContact C-N 3.3Å; N935-A937 PolarHBondContact O-N 3.2Å; A937-I941 WeakPolarHBondContact O-CD1 3.33Å; A937-I941 VanDerWaalsContact O-CG1 3.25Å; A937-I941 WeakPolarHBondContact O-CG1 3.35Å; A937-I941 PolarHBondContact O-N 3.01Å
938	T	94.1	Very high	94.3	Very high	17 Å²	17	16.3 Å²	16.3	10%	0.104	11%	0.106	C	C	.	.	H	α-helix	trans	-69.8	-43.1	177.4	-53.8	0	0	0	0	110.8	K627 N935 E936 F942	K627-T938 HydrophobicContact CD-CG2 4.38Å; K627-T938 PolarHBondContact NZ-OG1 3.49Å; N935-T938 WeakPolarHBondContact O-CB 3.42Å; N935-T938 PolarHBondContact O-N 2.95Å; E936-T938 VanDerWaalsContact C-N 3.28Å; E936-T938 PolarHBondContact O-N 3.33Å; T938-F942 WeakPolarHBondContact O-CB 3.4Å; T938-F942 PolarHBondContact O-N 3.42Å
939	L	94.8	Very high	94.5	Very high	8 Å²	8	17.5 Å²	17.5	4%	0.042	11%	0.112	C	C	.	.	H	α-helix	trans	-65.4	-46.4	179.1	-62	172.1	0	0	0	111	F624 R684 Y932 N935 E936 I941 F942 D943	F624-L939 HydrophobicContact CD2-CD2 3.91Å; F624-L939 HydrophobicContact CE2-CD2 3.34Å; F624-L939 HydrophobicContact CZ-CD2 4.21Å; R684-L939 HydrophobicContact CG-CD1 4.28Å; R684-L939 VanDerWaalsContact NH2-CB 3.3Å; Y932-L939 HydrophobicContact CD1-CD1 4.44Å; Y932-L939 HydrophobicContact CD2-CD1 4.27Å; Y932-L939 HydrophobicContact CG-CD1 4.03Å; N935-L939 PolarHBondContact O-N 2.97Å; E936-L939 PolarHBondContact O-N 3.41Å; L939-I941 PolarHBondContact O-N 3.46Å; L939-F942 PolarHBondContact O-N 3.31Å; L939-D943 WeakPolarHBondContact O-CB 3.37Å; L939-D943 PolarHBondContact O-N 2.93Å
940	L	95.9	Very high	94.9	Very high	10 Å²	10	16.2 Å²	16.2	5%	0.052	10%	0.103	C	C	.	.	H	α-helix	trans	-60.2	-45.1	179.9	-177.1	68.2	0	0	0	112.4	I686 W740 L741 I748 E936 L944	I686-L940 HydrophobicContact CD1-CD1 3.78Å; I686-L940 HydrophobicContact CD1-CD2 4.23Å; I686-L940 HydrophobicContact CD1-CG 4.4Å; W740-L940 VanDerWaalsContact NE1-CD1 3.32Å; L741-L940 HydrophobicContact CD2-CD2 4.44Å; I748-L940 HydrophobicContact CD1-CD2 4.39Å; E936-L940 WeakPolarHBondContact O-CB 3.12Å; E936-L940 PolarHBondContact O-N 3.22Å; L940-L944 VanDerWaalsContact O-CB 3.27Å; L940-L944 WeakPolarHBondContact O-CB 3.29Å; L940-L944 PolarHBondContact O-N 3.49Å
941	I	96.8	Very high	95	Very high	26 Å²	26	16 Å²	16	13%	0.133	10%	0.101	C	C	.	.	H	α-helix	trans	-67.7	-39.9	177.9	-65.8	168.8	0	0	0	110.7	F576 K620 A937 L939 L945	F576-I941 HydrophobicContact CD1-CD1 4.16Å; F576-I941 HydrophobicContact CD1-CG1 4.35Å; F576-I941 HydrophobicContact CD1-CG2 4.12Å; F576-I941 HydrophobicContact CD2-CG2 4.22Å; F576-I941 HydrophobicContact CE1-CD1 4Å; F576-I941 HydrophobicContact CE1-CG1 3.92Å; F576-I941 HydrophobicContact CE1-CG2 4.36Å; F576-I941 HydrophobicContact CE2-CG2 4.49Å; F576-I941 HydrophobicContact CG-CG2 4.03Å; F576-I941 HydrophobicContact CZ-CG1 4.23Å; K620-I941 HydrophobicContact CD-CG2 4.18Å; K620-I941 HydrophobicContact CG-CG2 4.27Å; A937-I941 WeakPolarHBondContact O-CD1 3.33Å; A937-I941 VanDerWaalsContact O-CG1 3.25Å; A937-I941 WeakPolarHBondContact O-CG1 3.35Å; A937-I941 PolarHBondContact O-N 3.01Å; L939-I941 PolarHBondContact O-N 3.46Å; I941-L945 HydrophobicContact CG2-CD1 3.79Å; I941-L945 HydrophobicContact CG2-CG 4.26Å; I941-L945 WeakPolarHBondContact O-CB 3.06Å; I941-L945 VanDerWaalsContact O-CG 3.3Å; I941-L945 WeakPolarHBondContact O-CG 3.32Å; I941-L945 PolarHBondContact O-N 3.38Å
942	F	97.2	Very high	95.1	Very high	9 Å²	9	17 Å²	17	4%	0.039	11%	0.106	C	C	.	.	H	α-helix	trans	-62.4	-50	177	174	-109.9	0	0	0	111.5	F617 K620 A621 F624 T938 L939 L944 L945 F946 Q967 F971	F617-F942 HydrophobicContact CE2-CD2 4.33Å; F617-F942 AromaticContact CE2-CE2 3.8Å; F617-F942 HydrophobicContact CE2-CE2 3.8Å; K620-F942 HydrophobicContact CG-CB 4.25Å; A621-F942 HydrophobicContact CB-CD2 4.48Å; A621-F942 HydrophobicContact CB-CE2 3.83Å; F624-F942 HydrophobicContact CB-CD2 4.23Å; F624-F942 HydrophobicContact CB-CG 4.28Å; F624-F942 AromaticContact CD1-CD1 3.87Å; F624-F942 HydrophobicContact CD1-CD1 3.87Å; F624-F942 HydrophobicContact CD1-CD2 4.34Å; F624-F942 AromaticContact CD1-CE1 3.62Å; F624-F942 HydrophobicContact CD1-CE1 3.62Å; F624-F942 HydrophobicContact CD1-CE2 4.15Å; F624-F942 HydrophobicContact CD1-CG 4.21Å; F624-F942 AromaticContact CD1-CZ 3.79Å; F624-F942 HydrophobicContact CD1-CZ 3.79Å; F624-F942 HydrophobicContact CE1-CD1 4.12Å; F624-F942 AromaticContact CE1-CE1 3.71Å; F624-F942 HydrophobicContact CE1-CE1 3.71Å; F624-F942 HydrophobicContact CE1-CZ 4.18Å; F624-F942 HydrophobicContact CG-CD1 4.15Å; F624-F942 HydrophobicContact CG-CD2 4.45Å; F624-F942 HydrophobicContact CG-CE1 4.35Å; F624-F942 HydrophobicContact CG-CG 4.18Å; T938-F942 WeakPolarHBondContact O-CB 3.4Å; T938-F942 PolarHBondContact O-N 3.42Å; L939-F942 PolarHBondContact O-N 3.31Å; F942-L944 VanDerWaalsContact C-N 3.32Å; F942-L944 PolarHBondContact O-N 2.96Å; F942-L945 PolarHBondContact O-N 2.47Å; F942-F946 WeakPolarHBondContact O-CB 3.3Å; F942-F946 PolarHBondContact O-N 3.2Å; F942-Q967 HydrophobicContact CE1-CG 4.26Å; F942-Q967 VanDerWaalsContact CE1-NE2 3.33Å; F942-F971 HydrophobicContact CE1-CD2 4.18Å; F942-F971 AromaticContact CE1-CE2 3.91Å; F942-F971 HydrophobicContact CE1-CE2 3.91Å; F942-F971 AromaticContact CZ-CE2 4Å; F942-F971 HydrophobicContact CZ-CE2 4Å
943	D	96.7	Very high	95.1	Very high	4 Å²	4	20.4 Å²	20.4	2%	0.021	14%	0.137	C	C	.	.	H	α-helix	trans	-61.4	-41	179.2	-63	-25.4	0	0	0	111	R684 W740 L939 F947 T964 Q967 Q968	R684-D943 IonicContact CZ-OD2 3.47Å; R684-D943 IonicContact NH1-OD2 3.93Å; R684-D943 PolarHBondContact NH1-OD2 2.85Å; R684-D943 IonicContact NH2-OD2 3.72Å; R684-D943 PolarHBondContact NH2-OD2 3.3Å; W740-D943 HydrophobicContact CZ2-CB 3.74Å; L939-D943 WeakPolarHBondContact O-CB 3.37Å; L939-D943 PolarHBondContact O-N 2.93Å; D943-F947 WeakPolarHBondContact O-CB 3.49Å; D943-F947 PolarHBondContact O-N 3.43Å; D943-T964 HydrophobicContact CB-CG2 4.3Å; D943-Q967 PolarHBondContact OD1-NE2 3.37Å; D943-Q968 PolarHBondContact OD2-NE2 3.11Å
944	L	97.4	Very high	95.2	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-47.5	174.8	170.8	141.2	0	0	0	112.7	F576 A737 W740 L741 L940 F942 F946 F947 C948	F576-L944 HydrophobicContact CD2-CD2 4Å; F576-L944 HydrophobicContact CE2-CD2 3.32Å; F576-L944 HydrophobicContact CZ-CD2 4.2Å; A737-L944 HydrophobicContact CB-CD1 4.12Å; W740-L944 HydrophobicContact CB-CD1 3.84Å; W740-L944 HydrophobicContact CD2-CB 4.4Å; W740-L944 HydrophobicContact CG-CB 4.1Å; W740-L944 HydrophobicContact CG-CD1 3.83Å; W740-L944 HydrophobicContact CG-CG 4.34Å; L741-L944 HydrophobicContact CD2-CD1 4.17Å; L741-L944 HydrophobicContact CG-CD1 3.88Å; L940-L944 VanDerWaalsContact O-CB 3.27Å; L940-L944 WeakPolarHBondContact O-CB 3.29Å; L940-L944 PolarHBondContact O-N 3.49Å; F942-L944 VanDerWaalsContact C-N 3.32Å; F942-L944 PolarHBondContact O-N 2.96Å; L944-F946 VanDerWaalsContact C-N 3.29Å; L944-F946 PolarHBondContact O-N 3.46Å; L944-F947 WeakPolarHBondContact O-CB 3.15Å; L944-F947 PolarHBondContact O-N 3.46Å; L944-C948 WeakPolarHBondContact O-CB 3.3Å; L944-C948 PolarHBondContact O-N 3Å; L944-C948 PolarHBondContact O-SG 3.05Å; L944-C948 VanDerWaalsContact O-SG 3.41Å
945	L	97.8	Very high	95.3	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.2	-37.6	-178.2	-76	172.5	0	0	0	110.4	F576 A616 F617 K620 I941 F942 C948 V949	F576-L945 HydrophobicContact CD2-CD2 4.04Å; F576-L945 HydrophobicContact CD2-CG 4.36Å; A616-L945 HydrophobicContact CB-CD1 4.13Å; A616-L945 HydrophobicContact CB-CD2 4.04Å; F617-L945 HydrophobicContact CB-CB 4.13Å; F617-L945 HydrophobicContact CD2-CB 3.99Å; K620-L945 HydrophobicContact CB-CD1 3.85Å; K620-L945 HydrophobicContact CG-CD1 4.07Å; I941-L945 HydrophobicContact CG2-CD1 3.79Å; I941-L945 HydrophobicContact CG2-CG 4.26Å; I941-L945 WeakPolarHBondContact O-CB 3.06Å; I941-L945 VanDerWaalsContact O-CG 3.3Å; I941-L945 WeakPolarHBondContact O-CG 3.32Å; I941-L945 PolarHBondContact O-N 3.38Å; F942-L945 PolarHBondContact O-N 2.47Å; L945-C948 PolarHBondContact O-N 2.87Å; L945-V949 WeakPolarHBondContact O-CB 3.31Å; L945-V949 VanDerWaalsContact O-CG2 3.29Å; L945-V949 WeakPolarHBondContact O-CG2 3.46Å; L945-V949 PolarHBondContact O-N 3Å
946	F	97.9	Very high	95.3	Very high	45 Å²	45	27.9 Å²	27.9	20%	0.197	17%	0.17	C	C	.	.	H	α-helix	trans	-62	-49.8	173.3	-175	-103.6	0	0	0	111.5	F617 F942 L944 C948 V949 V950 L963 T964 Q967	F617-F946 HydrophobicContact CD2-CB 4.39Å; F617-F946 HydrophobicContact CE2-CB 3.83Å; F617-F946 AromaticContact CE2-CD2 3.74Å; F617-F946 HydrophobicContact CE2-CD2 3.74Å; F617-F946 HydrophobicContact CE2-CG 4.29Å; F617-F946 AromaticContact CZ-CD2 3.66Å; F617-F946 HydrophobicContact CZ-CD2 3.66Å; F617-F946 HydrophobicContact CZ-CE2 4.43Å; F942-F946 WeakPolarHBondContact O-CB 3.3Å; F942-F946 PolarHBondContact O-N 3.2Å; L944-F946 VanDerWaalsContact C-N 3.29Å; L944-F946 PolarHBondContact O-N 3.46Å; F946-C948 VanDerWaalsContact C-N 3.34Å; F946-C948 PolarHBondContact O-N 2.71Å; F946-V949 PolarHBondContact O-N 2.68Å; F946-V950 HydrophobicContact CD1-CG2 4.44Å; F946-V950 HydrophobicContact CE1-CG2 4.09Å; F946-V950 HydrophobicContact CE2-CG2 4.18Å; F946-V950 HydrophobicContact CZ-CG2 3.96Å; F946-V950 WeakPolarHBondContact O-CG2 3.46Å; F946-V950 PolarHBondContact O-N 2.98Å; F946-L963 HydrophobicContact CE1-CB 4.11Å; F946-L963 HydrophobicContact CZ-CB 4.46Å; F946-T964 HydrophobicContact CD1-CG2 4.25Å; F946-Q967 HydrophobicContact CD1-CB 4.17Å; F946-Q967 HydrophobicContact CD1-CG 4.25Å; F946-Q967 HydrophobicContact CE1-CB 3.83Å; F946-Q967 HydrophobicContact CE1-CG 4.27Å; F946-Q967 HydrophobicContact CZ-CB 4.28Å
947	F	97.8	Very high	95.4	Very high	1 Å²	1	27.5 Å²	27.5	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-53.1	-50.7	174.8	177.6	-90.4	0	0	0	111.9	V695 L699 W740 D943 L944 V950 D951 F957 A960 S961 T964	V695-F947 HydrophobicContact CG1-CZ 4.34Å; L699-F947 HydrophobicContact CD1-CE1 4.27Å; L699-F947 HydrophobicContact CD1-CZ 3.88Å; W740-F947 HydrophobicContact CE3-CB 4.37Å; W740-F947 HydrophobicContact CE3-CD1 4.37Å; W740-F947 HydrophobicContact CE3-CD2 4.34Å; W740-F947 HydrophobicContact CE3-CG 4.1Å; W740-F947 HydrophobicContact CH2-CB 4.49Å; W740-F947 HydrophobicContact CZ3-CB 4.06Å; W740-F947 AromaticContact CZ3-CD2 3.79Å; W740-F947 HydrophobicContact CZ3-CD2 3.79Å; W740-F947 HydrophobicContact CZ3-CE2 4.4Å; W740-F947 AromaticContact CZ3-CG 3.88Å; W740-F947 HydrophobicContact CZ3-CG 3.88Å; D943-F947 WeakPolarHBondContact O-CB 3.49Å; D943-F947 PolarHBondContact O-N 3.43Å; L944-F947 WeakPolarHBondContact O-CB 3.15Å; L944-F947 PolarHBondContact O-N 3.46Å; F947-V950 PolarHBondContact O-N 3.13Å; F947-D951 WeakPolarHBondContact O-CB 3.06Å; F947-D951 PolarHBondContact O-N 2.85Å; F947-F957 HydrophobicContact CE1-CD1 4.19Å; F947-F957 AromaticContact CZ-CD1 3.91Å; F947-F957 HydrophobicContact CZ-CD1 3.91Å; F947-A960 HydrophobicContact CD2-CB 3.82Å; F947-A960 HydrophobicContact CE2-CB 3.74Å; F947-A960 HydrophobicContact CG-CB 4.39Å; F947-A960 HydrophobicContact CZ-CB 4.24Å; F947-S961 WeakPolarHBondContact CE2-OG 2.92Å; F947-T964 WeakPolarHBondContact CA-OG1 3.41Å; F947-T964 HydrophobicContact CB-CG2 4.3Å; F947-T964 WeakPolarHBondContact CB-OG1 3.42Å
948	C	97.1	Very high	95.6	Very high	1 Å²	1	29 Å²	29	1%	0.007	17%	0.167	C	C	.	.	H	α-helix	trans	-65.7	-40.6	-178.2	-75.6	0	0	0	0	113	Y733 L944 L945 F946 D951 L952	Y733-C948 HydrophobicContact CD2-CB 3.68Å; Y733-C948 HydrophobicContact CE2-CB 3.73Å; L944-C948 WeakPolarHBondContact O-CB 3.3Å; L944-C948 PolarHBondContact O-N 3Å; L944-C948 PolarHBondContact O-SG 3.05Å; L944-C948 VanDerWaalsContact O-SG 3.41Å; L945-C948 PolarHBondContact O-N 2.87Å; F946-C948 VanDerWaalsContact C-N 3.34Å; F946-C948 PolarHBondContact O-N 2.71Å; C948-D951 PolarHBondContact O-N 3.34Å; C948-L952 WeakPolarHBondContact O-CB 3.42Å; C948-L952 WeakPolarHBondContact O-CG 3.32Å; C948-L952 PolarHBondContact O-N 3.43Å
949	V	96.8	Very high	95.7	Very high	40 Å²	40	31.5 Å²	31.5	24%	0.242	18%	0.179	C	C	.	.	H	α-helix	trans	-66.3	-41.5	178.6	167.2	0	0	0	0	111	V613 F617 L945 F946 L952 A953	V613-V949 HydrophobicContact CG1-CG2 4.12Å; F617-V949 HydrophobicContact CB-CG2 3.73Å; F617-V949 HydrophobicContact CD1-CG2 4.3Å; F617-V949 HydrophobicContact CG-CG2 4.01Å; L945-V949 WeakPolarHBondContact O-CB 3.31Å; L945-V949 VanDerWaalsContact O-CG2 3.29Å; L945-V949 WeakPolarHBondContact O-CG2 3.46Å; L945-V949 PolarHBondContact O-N 3Å; F946-V949 PolarHBondContact O-N 2.68Å; V949-L952 PolarHBondContact O-N 2.89Å; V949-A953 WeakPolarHBondContact O-CB 3.3Å; V949-A953 PolarHBondContact O-N 2.93Å
950	V	96.8	Very high	95.8	Very high	17 Å²	17	31.1 Å²	31.1	10%	0.103	18%	0.177	C	C	.	.	H	α-helix	trans	-64.1	-43.3	175.7	176	0	0	0	0	110.8	F946 F947 A953 C954 A960 L963	F946-V950 HydrophobicContact CD1-CG2 4.44Å; F946-V950 HydrophobicContact CE1-CG2 4.09Å; F946-V950 HydrophobicContact CE2-CG2 4.18Å; F946-V950 HydrophobicContact CZ-CG2 3.96Å; F946-V950 WeakPolarHBondContact O-CG2 3.46Å; F946-V950 PolarHBondContact O-N 2.98Å; F947-V950 PolarHBondContact O-N 3.13Å; V950-A953 PolarHBondContact O-N 3.33Å; V950-C954 WeakPolarHBondContact O-CB 3.1Å; V950-C954 PolarHBondContact O-N 3.04Å; V950-A960 HydrophobicContact CB-CB 4.15Å; V950-A960 HydrophobicContact CG1-CB 3.93Å; V950-L963 HydrophobicContact CG1-CD1 3.83Å
951	D	95.8	Very high	95.8	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-65.9	-40.3	176.5	179.1	62.9	0	0	0	112.6	R732 F947 C948 A953 C954 Q955 N956 F957 A960	R732-D951 VanDerWaalsContact CD-OD2 3.22Å; R732-D951 WeakPolarHBondContact CD-OD2 3.44Å; R732-D951 WeakPolarHBondContact CG-OD2 3.35Å; R732-D951 IonicContact CZ-OD1 3.53Å; R732-D951 VanDerWaalsContact CZ-OD1 3.3Å; R732-D951 IonicContact CZ-OD2 2.83Å; R732-D951 VanDerWaalsContact NE-CG 3.26Å; R732-D951 IonicContact NE-OD1 3.38Å; R732-D951 PolarHBondContact NE-OD1 2.87Å; R732-D951 IonicContact NE-OD2 2.94Å; R732-D951 PolarHBondContact NE-OD2 2.77Å; R732-D951 IonicContact NH2-OD1 3.24Å; R732-D951 PolarHBondContact NH2-OD1 3.44Å; F947-D951 WeakPolarHBondContact O-CB 3.06Å; F947-D951 PolarHBondContact O-N 2.85Å; C948-D951 PolarHBondContact O-N 3.34Å; D951-A953 VanDerWaalsContact C-N 3.27Å; D951-A953 PolarHBondContact O-N 2.96Å; D951-C954 PolarHBondContact O-N 3.36Å; D951-Q955 WeakPolarHBondContact O-CA 3.12Å; D951-Q955 PolarHBondContact O-N 3.08Å; D951-N956 PolarHBondContact OD1-N 2.88Å; D951-F957 HydrophobicContact CB-CD1 4.29Å; D951-F957 HydrophobicContact CB-CE1 4.41Å; D951-F957 VanDerWaalsContact CG-CD1 3.5Å; D951-F957 VanDerWaalsContact OD1-CD1 3.24Å; D951-F957 WeakPolarHBondContact OD1-CD1 2.89Å; D951-F957 WeakPolarHBondContact OD1-CE1 2.98Å; D951-F957 WeakPolarHBondContact OD2-CE1 3.25Å; D951-A960 HydrophobicContact CB-CB 3.97Å
952	L	93.6	Very high	95.8	Very high	20 Å²	20	35.7 Å²	35.7	11%	0.105	20%	0.196	C	C	.	.	H	α-helix	trans	-64.3	-32.9	176.3	-74	173.6	0	0	0	112.5	V613 R729 Y733 C948 V949	V613-L952 HydrophobicContact CB-CD1 4.33Å; V613-L952 HydrophobicContact CG1-CD1 3.96Å; R729-L952 HydrophobicContact CB-CD2 3.82Å; R729-L952 HydrophobicContact CG-CD2 4.38Å; Y733-L952 HydrophobicContact CD2-CD1 4.34Å; C948-L952 WeakPolarHBondContact O-CB 3.42Å; C948-L952 WeakPolarHBondContact O-CG 3.32Å; C948-L952 PolarHBondContact O-N 3.43Å; V949-L952 PolarHBondContact O-N 2.89Å
953	A	92.4	Very high	95.8	Very high	81 Å²	81	37.9 Å²	37.9	67%	0.669	21%	0.208	S	C	*	.	H	α-helix	trans	-78	-42.8	177.9	0	0	0	0	0	113	V949 V950 D951	V949-A953 WeakPolarHBondContact O-CB 3.3Å; V949-A953 PolarHBondContact O-N 2.93Å; V950-A953 PolarHBondContact O-N 3.33Å; D951-A953 VanDerWaalsContact C-N 3.27Å; D951-A953 PolarHBondContact O-N 2.96Å
954	C	92.8	Very high	95.9	Very high	67 Å²	67	37.7 Å²	37.7	45%	0.453	21%	0.207	S	C	.	.	H	α-helix	trans	-103.3	-12.8	-171.9	-60.8	0	0	0	0	114.4	V950 D951 N956 L959	V950-C954 WeakPolarHBondContact O-CB 3.1Å; V950-C954 PolarHBondContact O-N 3.04Å; D951-C954 PolarHBondContact O-N 3.36Å; C954-N956 PolarHBondContact O-N 3.28Å; C954-L959 HydrophobicContact CB-CD2 3.94Å
955	Q	91.1	Very high	95.8	Very high	98 Å²	98	41.2 Å²	41.2	46%	0.458	22%	0.221	S	C	.	.			trans	50.3	38.5	-172.7	-58.8	-172.5	-5.3	0	0	113.5	R732 D951	R732-Q955 PolarHBondContact NH2-O 3.28Å; D951-Q955 WeakPolarHBondContact O-CA 3.12Å; D951-Q955 PolarHBondContact O-N 3.08Å
956	N	94.3	Very high	95.8	Very high	66 Å²	66	44.9 Å²	44.9	35%	0.353	24%	0.239	S	C	.	.			trans	-141	110.5	-176.3	-171.7	-37.5	0	0	0	111.7	D951 C954 I958 L959 A960	D951-N956 PolarHBondContact OD1-N 2.88Å; C954-N956 PolarHBondContact O-N 3.28Å; N956-I958 PolarHBondContact O-N 2.95Å; N956-I958 WeakPolarHBondContact OD1-CB 3.24Å; N956-I958 PolarHBondContact OD1-N 3.31Å; N956-L959 HydrophobicContact CB-CB 4.12Å; N956-L959 PolarHBondContact O-N 2.92Å; N956-L959 PolarHBondContact OD1-N 3.33Å; N956-L959 VanDerWaalsContact OD1-N 3.08Å; N956-A960 WeakPolarHBondContact O-CB 3.41Å; N956-A960 PolarHBondContact O-N 3.19Å
957	F	95.1	Very high	95.7	Very high	1 Å²	1	43.5 Å²	43.5	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-68.9	-30.8	-179	-64.8	-56.3	0	0	0	113.7	L696 L699 E700 K705 R732 S736 F947 D951 S961	L696-F957 HydrophobicContact CD1-CB 4.27Å; L699-F957 HydrophobicContact CB-CD2 4.31Å; L699-F957 HydrophobicContact CB-CG 4.44Å; L699-F957 HydrophobicContact CD1-CB 4.36Å; L699-F957 HydrophobicContact CD1-CD1 3.76Å; L699-F957 HydrophobicContact CD1-CE1 4.08Å; L699-F957 HydrophobicContact CD1-CG 3.97Å; L699-F957 HydrophobicContact CD2-CE1 4.41Å; L699-F957 HydrophobicContact CD2-CE2 4.4Å; L699-F957 HydrophobicContact CD2-CZ 4.18Å; E700-F957 HydrophobicContact CG-CB 4.45Å; E700-F957 WeakPolarHBondContact OE1-CD2 3.38Å; K705-F957 HydrophobicContact CB-CD2 4.18Å; K705-F957 HydrophobicContact CB-CE2 3.58Å; R732-F957 HydrophobicContact CG-CE1 3.94Å; R732-F957 HydrophobicContact CG-CE2 4.45Å; R732-F957 HydrophobicContact CG-CZ 3.48Å; R732-F957 VanDerWaalsContact CG-CZ 3.48Å; S736-F957 VanDerWaalsContact OG-CE1 3.23Å; S736-F957 WeakPolarHBondContact OG-CE1 3.42Å; F947-F957 HydrophobicContact CE1-CD1 4.19Å; F947-F957 AromaticContact CZ-CD1 3.91Å; F947-F957 HydrophobicContact CZ-CD1 3.91Å; D951-F957 HydrophobicContact CB-CD1 4.29Å; D951-F957 HydrophobicContact CB-CE1 4.41Å; D951-F957 VanDerWaalsContact CG-CD1 3.5Å; D951-F957 VanDerWaalsContact OD1-CD1 3.24Å; D951-F957 WeakPolarHBondContact OD1-CD1 2.89Å; D951-F957 WeakPolarHBondContact OD1-CE1 2.98Å; D951-F957 WeakPolarHBondContact OD2-CE1 3.25Å; F957-S961 VanDerWaalsContact O-CB 3.29Å; F957-S961 WeakPolarHBondContact O-CB 3.35Å; F957-S961 PolarHBondContact O-N 3.32Å; F957-S961 PolarHBondContact O-OG 3.23Å
958	I	96.1	Very high	95.6	Very high	98 Å²	98	44 Å²	44	50%	0.503	24%	0.236	S	C	.	.	H	α-helix	trans	-67.7	-47.6	178.9	-59.1	169.6	0	0	0	109.4	L696 E700 N956 S961 F962	L696-I958 HydrophobicContact CD1-CG1 4.04Å; E700-I958 HydrophobicContact CG-CG1 4.3Å; N956-I958 PolarHBondContact O-N 2.95Å; N956-I958 WeakPolarHBondContact OD1-CB 3.24Å; N956-I958 PolarHBondContact OD1-N 3.31Å; I958-S961 WeakPolarHBondContact O-CB 3.35Å; I958-S961 PolarHBondContact O-N 3.31Å; I958-F962 PolarHBondContact O-N 2.72Å
959	L	96.3	Very high	95.5	Very high	69 Å²	69	45.9 Å²	45.9	36%	0.361	25%	0.245	S	C	.	.	H	α-helix	trans	-63.2	-44.7	177.1	-178.1	62.6	0	0	0	111.2	C954 N956 S961 F962 L963	C954-L959 HydrophobicContact CB-CD2 3.94Å; N956-L959 HydrophobicContact CB-CB 4.12Å; N956-L959 PolarHBondContact O-N 2.92Å; N956-L959 PolarHBondContact OD1-N 3.33Å; N956-L959 VanDerWaalsContact OD1-N 3.08Å; L959-S961 VanDerWaalsContact C-N 3.32Å; L959-S961 PolarHBondContact O-N 3.41Å; L959-F962 PolarHBondContact O-N 2.8Å; L959-L963 HydrophobicContact CD1-CD1 4.02Å; L959-L963 HydrophobicContact CD1-CG 4.15Å; L959-L963 HydrophobicContact CG-CD1 4.05Å; L959-L963 WeakPolarHBondContact O-CB 3.35Å; L959-L963 WeakPolarHBondContact O-CG 3.36Å; L959-L963 PolarHBondContact O-N 1.99Å
960	A	96.6	Very high	95.4	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-58.6	-42.9	175.4	0	0	0	0	0	112.1	F947 V950 D951 N956 T964	F947-A960 HydrophobicContact CD2-CB 3.82Å; F947-A960 HydrophobicContact CE2-CB 3.74Å; F947-A960 HydrophobicContact CG-CB 4.39Å; F947-A960 HydrophobicContact CZ-CB 4.24Å; V950-A960 HydrophobicContact CB-CB 4.15Å; V950-A960 HydrophobicContact CG1-CB 3.93Å; D951-A960 HydrophobicContact CB-CB 3.97Å; N956-A960 WeakPolarHBondContact O-CB 3.41Å; N956-A960 PolarHBondContact O-N 3.19Å; A960-T964 VanDerWaalsContact O-CB 3.31Å; A960-T964 WeakPolarHBondContact O-CB 3.42Å; A960-T964 PolarHBondContact O-N 3.48Å; A960-T964 PolarHBondContact O-OG1 2.94Å
961	S	96.3	Very high	95.3	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-61.6	-50.3	177.4	-63	0	0	0	0	111.9	F947 F957 I958 L959 T964 Y965	F947-S961 WeakPolarHBondContact CE2-OG 2.92Å; F957-S961 VanDerWaalsContact O-CB 3.29Å; F957-S961 WeakPolarHBondContact O-CB 3.35Å; F957-S961 PolarHBondContact O-N 3.32Å; F957-S961 PolarHBondContact O-OG 3.23Å; I958-S961 WeakPolarHBondContact O-CB 3.35Å; I958-S961 PolarHBondContact O-N 3.31Å; L959-S961 VanDerWaalsContact C-N 3.32Å; L959-S961 PolarHBondContact O-N 3.41Å; S961-T964 PolarHBondContact O-N 2.64Å; S961-Y965 PolarHBondContact O-N 3.3Å
962	F	96.8	Very high	95.2	Very high	128 Å²	128	55.1 Å²	55.1	56%	0.561	28%	0.28	S	S	*	.	H	α-helix	trans	-60.8	-48	-179.4	175.5	-100.2	0	0	0	111.9	I958 L959 T964 Y965 L966	I958-F962 PolarHBondContact O-N 2.72Å; L959-F962 PolarHBondContact O-N 2.8Å; F962-T964 VanDerWaalsContact C-N 3.33Å; F962-T964 PolarHBondContact O-N 2.81Å; F962-Y965 PolarHBondContact O-N 3.47Å; F962-L966 WeakPolarHBondContact O-CB 3.5Å; F962-L966 PolarHBondContact O-N 2.89Å
963	L	97.3	Very high	95.2	Very high	56 Å²	56	61.7 Å²	61.7	29%	0.293	31%	0.305	S	S	.	.	H	α-helix	trans	-65.3	-37.8	179.5	-70	179	0	0	0	111.8	F946 V950 L959 L966 Q967	F946-L963 HydrophobicContact CE1-CB 4.11Å; F946-L963 HydrophobicContact CZ-CB 4.46Å; V950-L963 HydrophobicContact CG1-CD1 3.83Å; L959-L963 HydrophobicContact CD1-CD1 4.02Å; L959-L963 HydrophobicContact CD1-CG 4.15Å; L959-L963 HydrophobicContact CG-CD1 4.05Å; L959-L963 WeakPolarHBondContact O-CB 3.35Å; L959-L963 WeakPolarHBondContact O-CG 3.36Å; L959-L963 PolarHBondContact O-N 1.99Å; L963-L966 PolarHBondContact O-N 2.78Å; L963-Q967 WeakPolarHBondContact O-CB 3.15Å; L963-Q967 PolarHBondContact O-N 2.77Å
964	T	97.1	Very high	95.3	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.3	-42.5	177.7	-54	0	0	0	0	111.4	W740 D943 F946 F947 A960 S961 F962 Q967 Q968	W740-T964 HydrophobicContact CH2-CG2 3.68Å; W740-T964 HydrophobicContact CZ2-CG2 4.34Å; W740-T964 HydrophobicContact CZ3-CG2 4.47Å; D943-T964 HydrophobicContact CB-CG2 4.3Å; F946-T964 HydrophobicContact CD1-CG2 4.25Å; F947-T964 WeakPolarHBondContact CA-OG1 3.41Å; F947-T964 HydrophobicContact CB-CG2 4.3Å; F947-T964 WeakPolarHBondContact CB-OG1 3.42Å; A960-T964 VanDerWaalsContact O-CB 3.31Å; A960-T964 WeakPolarHBondContact O-CB 3.42Å; A960-T964 PolarHBondContact O-N 3.48Å; A960-T964 PolarHBondContact O-OG1 2.94Å; S961-T964 PolarHBondContact O-N 2.64Å; F962-T964 VanDerWaalsContact C-N 3.33Å; F962-T964 PolarHBondContact O-N 2.81Å; T964-Q967 WeakPolarHBondContact O-CB 3.3Å; T964-Q967 PolarHBondContact O-N 3.04Å; T964-Q968 WeakPolarHBondContact O-CG 3.23Å; T964-Q968 PolarHBondContact O-N 2Å
965	Y	97.1	Very high	95.3	Very high	74 Å²	74	57.6 Å²	57.6	29%	0.29	27%	0.266	S	S	.	.	H	α-helix	trans	-61.9	-45.5	174.2	179.1	-111.4	0	0	0	111.8	L689 S961 F962 Q967 Q968 E969	L689-Y965 HydrophobicContact CB-CE2 4.16Å; L689-Y965 HydrophobicContact CD1-CD2 4.35Å; L689-Y965 HydrophobicContact CD1-CE2 4.02Å; S961-Y965 PolarHBondContact O-N 3.3Å; F962-Y965 PolarHBondContact O-N 3.47Å; Y965-Q967 VanDerWaalsContact C-N 3.31Å; Y965-Q967 PolarHBondContact O-N 3Å; Y965-Q968 WeakPolarHBondContact O-CB 3.34Å; Y965-Q968 PolarHBondContact O-N 3.45Å; Y965-E969 HydrophobicContact CD1-CG 4.45Å; Y965-E969 HydrophobicContact CD2-CG 4.42Å; Y965-E969 HydrophobicContact CE1-CG 3.92Å; Y965-E969 HydrophobicContact CE2-CG 3.86Å; Y965-E969 WeakPolarHBondContact O-CG 3.05Å; Y965-E969 PolarHBondContact O-N 3.15Å; Y965-E969 PolarHBondContact OH-OE1 3.01Å
966	L	96.8	Very high	95.3	Very high	76 Å²	76	55.5 Å²	55.5	40%	0.398	26%	0.258	S	S	.	.	H	α-helix	trans	-59.3	-42.7	176.1	-178.3	64.2	0	0	0	111.8	F962 L963 E969 I970	F962-L966 WeakPolarHBondContact O-CB 3.5Å; F962-L966 PolarHBondContact O-N 2.89Å; L963-L966 PolarHBondContact O-N 2.78Å; L966-E969 PolarHBondContact O-N 3.14Å; L966-I970 HydrophobicContact CD1-CD1 4.16Å; L966-I970 HydrophobicContact CD1-CG1 4.4Å; L966-I970 HydrophobicContact CG-CD1 3.87Å; L966-I970 WeakPolarHBondContact O-CB 3.45Å; L966-I970 VanDerWaalsContact O-CG1 3.25Å; L966-I970 WeakPolarHBondContact O-CG1 3.43Å; L966-I970 PolarHBondContact O-N 3.05Å
967	Q	96.1	Very high	95.2	Very high	16 Å²	16	53.8 Å²	53.8	8%	0.075	25%	0.25	C	S	.	.	H	α-helix	trans	-60.1	-44.7	175.2	169.8	-102.3	-74.1	0	0	111.9	F942 D943 F946 L963 T964 Y965 I970 F971	F942-Q967 HydrophobicContact CE1-CG 4.26Å; F942-Q967 VanDerWaalsContact CE1-NE2 3.33Å; D943-Q967 PolarHBondContact OD1-NE2 3.37Å; F946-Q967 HydrophobicContact CD1-CB 4.17Å; F946-Q967 HydrophobicContact CD1-CG 4.25Å; F946-Q967 HydrophobicContact CE1-CB 3.83Å; F946-Q967 HydrophobicContact CE1-CG 4.27Å; F946-Q967 HydrophobicContact CZ-CB 4.28Å; L963-Q967 WeakPolarHBondContact O-CB 3.15Å; L963-Q967 PolarHBondContact O-N 2.77Å; T964-Q967 WeakPolarHBondContact O-CB 3.3Å; T964-Q967 PolarHBondContact O-N 3.04Å; Y965-Q967 VanDerWaalsContact C-N 3.31Å; Y965-Q967 PolarHBondContact O-N 3Å; Q967-I970 PolarHBondContact O-N 3.17Å; Q967-F971 HydrophobicContact CG-CD2 3.85Å; Q967-F971 HydrophobicContact CG-CE2 3.78Å; Q967-F971 WeakPolarHBondContact O-CD2 3.37Å; Q967-F971 PolarHBondContact O-N 2.84Å; Q967-F971 VanDerWaalsContact O-N 3.1Å
968	Q	95.1	Very high	95	Very high	12 Å²	12	56.5 Å²	56.5	6%	0.056	27%	0.267	C	S	.	.	H	α-helix	trans	-61	-44.6	176.8	-72.3	171	-14.9	0	0	111.6	S688 D943 T964 Y965 F971 R972	S688-Q968 PolarHBondContact OG-OE1 2.92Å; D943-Q968 PolarHBondContact OD2-NE2 3.11Å; T964-Q968 WeakPolarHBondContact O-CG 3.23Å; T964-Q968 PolarHBondContact O-N 2Å; Y965-Q968 WeakPolarHBondContact O-CB 3.34Å; Y965-Q968 PolarHBondContact O-N 3.45Å; Q968-F971 PolarHBondContact O-N 2.87Å; Q968-R972 WeakPolarHBondContact O-CB 3.09Å; Q968-R972 PolarHBondContact O-N 2.86Å
969	E	95.1	Very high	94.7	Very high	41 Å²	41	52 Å²	52	19%	0.192	24%	0.244	C	C	.	.	H	α-helix	trans	-64.2	-43.5	178.6	-73.8	-59.6	151.8	0	0	112.8	Y965 L966 F971 R972 Y973	Y965-E969 HydrophobicContact CD1-CG 4.45Å; Y965-E969 HydrophobicContact CD2-CG 4.42Å; Y965-E969 HydrophobicContact CE1-CG 3.92Å; Y965-E969 HydrophobicContact CE2-CG 3.86Å; Y965-E969 WeakPolarHBondContact O-CG 3.05Å; Y965-E969 PolarHBondContact O-N 3.15Å; Y965-E969 PolarHBondContact OH-OE1 3.01Å; L966-E969 PolarHBondContact O-N 3.14Å; E969-F971 PolarHBondContact O-N 2.9Å; E969-R972 PolarHBondContact O-N 2.93Å; E969-R972 IonicContact OE1-CZ 2.76Å; E969-R972 VanDerWaalsContact OE1-CZ 3.32Å; E969-R972 IonicContact OE1-NE 2.94Å; E969-R972 IonicContact OE1-NH1 2.81Å; E969-R972 IonicContact OE1-NH2 2.79Å; E969-R972 PolarHBondContact OE1-NH2 3.23Å; E969-R972 VanDerWaalsContact OE1-NH2 3.07Å; E969-R972 IonicContact OE2-CZ 3.95Å; E969-R972 IonicContact OE2-NE 2.78Å; E969-R972 PolarHBondContact OE2-NE 2.89Å; E969-R972 VanDerWaalsContact OE2-NE 3.1Å; E969-R972 IonicContact OE2-NH2 3.92Å; E969-R972 PolarHBondContact OE2-NH2 3.14Å; E969-Y973 WeakPolarHBondContact O-CB 3.41Å; E969-Y973 PolarHBondContact O-N 2.85Å
970	I	95.4	Very high	94.5	Very high	83 Å²	83	50.1 Å²	50.1	43%	0.426	23%	0.233	S	C	.	.	H	α-helix	trans	-60.2	-48.6	176.7	-71.3	167.6	0	0	0	110.6	L966 Q967 Y973 I974	L966-I970 HydrophobicContact CD1-CD1 4.16Å; L966-I970 HydrophobicContact CD1-CG1 4.4Å; L966-I970 HydrophobicContact CG-CD1 3.87Å; L966-I970 WeakPolarHBondContact O-CB 3.45Å; L966-I970 VanDerWaalsContact O-CG1 3.25Å; L966-I970 WeakPolarHBondContact O-CG1 3.43Å; L966-I970 PolarHBondContact O-N 3.05Å; Q967-I970 PolarHBondContact O-N 3.17Å; I970-Y973 PolarHBondContact O-N 3.1Å; I970-I974 HydrophobicContact CG2-CD1 3.72Å; I970-I974 HydrophobicContact CG2-CG1 4.44Å; I970-I974 VanDerWaalsContact O-CG1 3.26Å; I970-I974 WeakPolarHBondContact O-CG1 3.32Å; I970-I974 PolarHBondContact O-N 3.04Å
971	F	94.9	Very high	94.1	Very high	48 Å²	48	55.8 Å²	55.8	21%	0.211	26%	0.258	C	S	.	.	H	α-helix	trans	-69	-35	-179.5	-77.1	-62.7	0	0	0	112.8	F624 L628 Y932 F942 Q967 Q968 E969 I974 R975	F624-F971 HydrophobicContact CE1-CB 4.44Å; F624-F971 AromaticContact CE1-CD1 3.7Å; F624-F971 HydrophobicContact CE1-CD1 3.7Å; F624-F971 AromaticContact CE1-CD2 3.81Å; F624-F971 HydrophobicContact CE1-CD2 3.81Å; F624-F971 AromaticContact CE1-CE1 3.79Å; F624-F971 HydrophobicContact CE1-CE1 3.79Å; F624-F971 AromaticContact CE1-CE2 3.9Å; F624-F971 HydrophobicContact CE1-CE2 3.9Å; F624-F971 AromaticContact CE1-CG 3.72Å; F624-F971 HydrophobicContact CE1-CG 3.72Å; F624-F971 AromaticContact CE1-CZ 3.9Å; F624-F971 HydrophobicContact CE1-CZ 3.9Å; F624-F971 HydrophobicContact CZ-CB 4.15Å; F624-F971 HydrophobicContact CZ-CD1 4.07Å; F624-F971 HydrophobicContact CZ-CD2 4.31Å; F624-F971 AromaticContact CZ-CG 3.93Å; F624-F971 HydrophobicContact CZ-CG 3.93Å; L628-F971 HydrophobicContact CD2-CD1 3.73Å; L628-F971 HydrophobicContact CD2-CE1 4.13Å; Y932-F971 PolarHBondContact OH-O 2.73Å; F942-F971 HydrophobicContact CE1-CD2 4.18Å; F942-F971 AromaticContact CE1-CE2 3.91Å; F942-F971 HydrophobicContact CE1-CE2 3.91Å; F942-F971 AromaticContact CZ-CE2 4Å; F942-F971 HydrophobicContact CZ-CE2 4Å; Q967-F971 HydrophobicContact CG-CD2 3.85Å; Q967-F971 HydrophobicContact CG-CE2 3.78Å; Q967-F971 WeakPolarHBondContact O-CD2 3.37Å; Q967-F971 PolarHBondContact O-N 2.84Å; Q967-F971 VanDerWaalsContact O-N 3.1Å; Q968-F971 PolarHBondContact O-N 2.87Å; E969-F971 PolarHBondContact O-N 2.9Å; F971-I974 HydrophobicContact CD1-CD1 4.35Å; F971-I974 PolarHBondContact O-N 3.4Å; F971-R975 WeakPolarHBondContact O-CB 3.49Å; F971-R975 PolarHBondContact O-N 3.36Å
972	R	93.8	Very high	93.8	Very high	120 Å²	120	56.9 Å²	56.9	45%	0.453	26%	0.264	S	S	.	.	H	α-helix	trans	-59.7	-48	170.9	-177	175.1	73.1	159	6.4	111.2	T682 Q968 E969 R975 N976	T682-R972 HydrophobicContact CG2-CG 4.38Å; Q968-R972 WeakPolarHBondContact O-CB 3.09Å; Q968-R972 PolarHBondContact O-N 2.86Å; E969-R972 PolarHBondContact O-N 2.93Å; E969-R972 IonicContact OE1-CZ 2.76Å; E969-R972 VanDerWaalsContact OE1-CZ 3.32Å; E969-R972 IonicContact OE1-NE 2.94Å; E969-R972 IonicContact OE1-NH1 2.81Å; E969-R972 IonicContact OE1-NH2 2.79Å; E969-R972 PolarHBondContact OE1-NH2 3.23Å; E969-R972 VanDerWaalsContact OE1-NH2 3.07Å; E969-R972 IonicContact OE2-CZ 3.95Å; E969-R972 IonicContact OE2-NE 2.78Å; E969-R972 PolarHBondContact OE2-NE 2.89Å; E969-R972 VanDerWaalsContact OE2-NE 3.1Å; E969-R972 IonicContact OE2-NH2 3.92Å; E969-R972 PolarHBondContact OE2-NH2 3.14Å; R972-R975 PolarHBondContact O-N 3.46Å; R972-N976 WeakPolarHBondContact O-CB 3.38Å; R972-N976 PolarHBondContact O-N 2.9Å
973	Y	93.9	Very high	93.4	Very high	159 Å²	159	50.9 Å²	50.9	62%	0.624	24%	0.237	S	C	*	.	H	α-helix	trans	-61.6	-44.6	177.9	177.9	-99.2	0	0	0	112.2	E969 I970 N976 T977	E969-Y973 WeakPolarHBondContact O-CB 3.41Å; E969-Y973 PolarHBondContact O-N 2.85Å; I970-Y973 PolarHBondContact O-N 3.1Å; Y973-N976 PolarHBondContact O-N 3.24Å; Y973-T977 VanDerWaalsContact O-CB 3.3Å; Y973-T977 WeakPolarHBondContact O-CB 3.18Å; Y973-T977 PolarHBondContact O-N 3.07Å; Y973-T977 PolarHBondContact O-OG1 3.4Å
974	I	93.7	Very high	92.9	Very high	61 Å²	61	49.8 Å²	49.8	31%	0.313	23%	0.233	S	C	.	.	H	α-helix	trans	-60.8	-48.5	176.1	-69.2	167	0	0	0	110.4	I970 F971 N976 V978	I970-I974 HydrophobicContact CG2-CD1 3.72Å; I970-I974 HydrophobicContact CG2-CG1 4.44Å; I970-I974 VanDerWaalsContact O-CG1 3.26Å; I970-I974 WeakPolarHBondContact O-CG1 3.32Å; I970-I974 PolarHBondContact O-N 3.04Å; F971-I974 HydrophobicContact CD1-CD1 4.35Å; F971-I974 PolarHBondContact O-N 3.4Å; I974-N976 PolarHBondContact O-N 3.48Å; I974-V978 HydrophobicContact CG2-CG2 4.29Å; I974-V978 WeakPolarHBondContact O-CB 3.24Å; I974-V978 VanDerWaalsContact O-CG2 3.31Å; I974-V978 WeakPolarHBondContact O-CG2 3.27Å; I974-V978 PolarHBondContact O-N 2.88Å
975	R	92.7	Very high	92.2	Very high	1 Å²	1	52.8 Å²	52.8	0%	0.004	25%	0.254	C	S	.	.	H	α-helix	trans	-61.4	-43.8	-179.4	177.7	64.6	-176.1	91.3	-4.2	112.1	L628 Q631 T682 V930 Y932 F971 R972 G979	L628-R975 HydrophobicContact CD1-CB 4.07Å; L628-R975 HydrophobicContact CD1-CG 4.41Å; Q631-R975 PolarHBondContact O-NH2 3.35Å; T682-R975 HydrophobicContact CG2-CB 4.15Å; T682-R975 HydrophobicContact CG2-CG 3.84Å; V930-R975 PolarHBondContact O-NH2 3.46Å; Y932-R975 HydrophobicContact CD1-CG 4.25Å; Y932-R975 HydrophobicContact CE1-CB 4.12Å; Y932-R975 HydrophobicContact CE1-CG 3.66Å; Y932-R975 HydrophobicContact CE2-CB 4.23Å; Y932-R975 HydrophobicContact CE2-CG 4.25Å; Y932-R975 WeakPolarHBondContact OH-CB 3.35Å; F971-R975 WeakPolarHBondContact O-CB 3.49Å; F971-R975 PolarHBondContact O-N 3.36Å; R972-R975 PolarHBondContact O-N 3.46Å; R975-G979 WeakPolarHBondContact O-CA 3.08Å; R975-G979 PolarHBondContact O-N 3.39Å
976	N	91.6	Very high	91.5	Very high	53 Å²	53	50.8 Å²	50.8	28%	0.283	25%	0.247	S	C	.	.	H	α-helix	trans	-65.1	-55.4	179	-169.3	14	0	0	0	110.4	T682 R972 Y973 I974 V978 G979 Q980	T682-N976 HydrophobicContact CG2-CB 4.01Å; R972-N976 WeakPolarHBondContact O-CB 3.38Å; R972-N976 PolarHBondContact O-N 2.9Å; Y973-N976 PolarHBondContact O-N 3.24Å; I974-N976 PolarHBondContact O-N 3.48Å; N976-V978 PolarHBondContact O-N 3.04Å; N976-G979 PolarHBondContact O-N 2.9Å; N976-Q980 VanDerWaalsContact O-CB 3.3Å; N976-Q980 WeakPolarHBondContact O-CB 3.49Å; N976-Q980 PolarHBondContact O-N 2.77Å
977	T	91.4	Very high	90.7	Very high	31 Å²	31	47.3 Å²	47.3	19%	0.19	23%	0.229	C	C	.	.	H	α-helix	trans	-62.5	-45	-175	-53.6	0	0	0	0	112.7	Y973 K981	Y973-T977 VanDerWaalsContact O-CB 3.3Å; Y973-T977 WeakPolarHBondContact O-CB 3.18Å; Y973-T977 PolarHBondContact O-N 3.07Å; Y973-T977 PolarHBondContact O-OG1 3.4Å; T977-K981 WeakPolarHBondContact O-CG 3.48Å; T977-K981 PolarHBondContact O-N 2.87Å
978	V	92.1	Very high	89.8	Confident	58 Å²	58	49.2 Å²	49.2	35%	0.352	24%	0.239	S	C	.	.	H	α-helix	trans	-77.7	-34.3	-178.8	-174.1	0	0	0	0	110.9	I632 I974 N976 K981 N982	I632-V978 HydrophobicContact CB-CG1 4.14Å; I632-V978 HydrophobicContact CD1-CB 4.47Å; I632-V978 HydrophobicContact CD1-CG1 3.82Å; I632-V978 HydrophobicContact CG1-CG1 4.43Å; I632-V978 HydrophobicContact CG2-CB 4.45Å; I974-V978 HydrophobicContact CG2-CG2 4.29Å; I974-V978 WeakPolarHBondContact O-CB 3.24Å; I974-V978 VanDerWaalsContact O-CG2 3.31Å; I974-V978 WeakPolarHBondContact O-CG2 3.27Å; I974-V978 PolarHBondContact O-N 2.88Å; N976-V978 PolarHBondContact O-N 3.04Å; V978-K981 PolarHBondContact O-N 3.33Å; V978-N982 PolarHBondContact O-N 3.28Å
979	G	89.5	Confident	89.1	Confident	2 Å²	2	48.8 Å²	48.8	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-61.3	-46.1	173.1	0	0	0	0	0	112.9	R975 N976 K981 N982 L983	R975-G979 WeakPolarHBondContact O-CA 3.08Å; R975-G979 PolarHBondContact O-N 3.39Å; N976-G979 PolarHBondContact O-N 2.9Å; G979-K981 PolarHBondContact O-N 2.83Å; G979-N982 PolarHBondContact O-N 3.18Å; G979-L983 PolarHBondContact O-N 2.85Å
980	Q	90.5	Very high	88.3	Confident	30 Å²	30	50.2 Å²	50.2	14%	0.14	25%	0.247	C	C	.	.	H	α-helix	trans	-58.3	-47.1	174.3	-170.2	-170.1	25	0	0	111	N976 N982 L983 V984 L994	N976-Q980 VanDerWaalsContact O-CB 3.3Å; N976-Q980 WeakPolarHBondContact O-CB 3.49Å; N976-Q980 PolarHBondContact O-N 2.77Å; Q980-N982 VanDerWaalsContact C-N 3.34Å; Q980-N982 PolarHBondContact O-N 3.14Å; Q980-L983 WeakPolarHBondContact O-CB 3.04Å; Q980-L983 PolarHBondContact O-N 3.39Å; Q980-V984 WeakPolarHBondContact O-CG2 3.39Å; Q980-V984 PolarHBondContact O-N 2.94Å; Q980-L994 HydrophobicContact CG-CB 4.02Å; Q980-L994 HydrophobicContact CG-CD1 3.74Å; Q980-L994 PolarHBondContact NE2-O 3.27Å
981	K	89.5	Confident	87.6	Confident	119 Å²	119	50.6 Å²	50.6	52%	0.517	25%	0.246	S	C	.	.	H	α-helix	trans	-60.9	-40.6	176	-74.9	178.6	-179.8	-179.9	0	112.8	T977 V978 G979 S985	T977-K981 WeakPolarHBondContact O-CG 3.48Å; T977-K981 PolarHBondContact O-N 2.87Å; V978-K981 PolarHBondContact O-N 3.33Å; G979-K981 PolarHBondContact O-N 2.83Å; K981-S985 WeakPolarHBondContact O-CB 2.89Å; K981-S985 PolarHBondContact O-N 3.5Å
982	N	88.9	Confident	87	Confident	27 Å²	27	58.9 Å²	58.9	14%	0.144	28%	0.276	C	S	.	.	H	α-helix	trans	-64.7	-43.6	175.9	-174.5	54.3	0	0	0	110.9	I632 I634 V978 G979 Q980 V984 S985 K986	I632-N982 WeakPolarHBondContact O-CB 3.36Å; I632-N982 PolarHBondContact O-ND2 3.34Å; I634-N982 PolarHBondContact O-ND2 3.28Å; V978-N982 PolarHBondContact O-N 3.28Å; G979-N982 PolarHBondContact O-N 3.18Å; Q980-N982 VanDerWaalsContact C-N 3.34Å; Q980-N982 PolarHBondContact O-N 3.14Å; N982-V984 PolarHBondContact O-N 2.87Å; N982-S985 PolarHBondContact O-N 3.35Å; N982-K986 WeakPolarHBondContact O-CB 3.49Å; N982-K986 WeakPolarHBondContact O-CG 3.5Å; N982-K986 PolarHBondContact O-N 3.19Å
983	L	89.1	Confident	86.5	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-58.6	-49.6	177.4	-171.6	65.1	0	0	0	111.8	V636 F638 A674 N678 G979 Q980 S985 K986 T987 L994	V636-L983 HydrophobicContact CB-CD1 4.44Å; V636-L983 HydrophobicContact CG1-CD1 4.15Å; F638-L983 HydrophobicContact CE2-CD1 4.04Å; F638-L983 HydrophobicContact CZ-CD1 3.95Å; A674-L983 HydrophobicContact CB-CD2 4.37Å; A674-L983 WeakPolarHBondContact O-CD2 3.37Å; N678-L983 HydrophobicContact CB-CD2 4.28Å; G979-L983 PolarHBondContact O-N 2.85Å; Q980-L983 WeakPolarHBondContact O-CB 3.04Å; Q980-L983 PolarHBondContact O-N 3.39Å; L983-S985 VanDerWaalsContact C-N 3.34Å; L983-S985 PolarHBondContact O-N 3.01Å; L983-K986 PolarHBondContact O-N 2.86Å; L983-T987 HydrophobicContact CD1-CG2 3.84Å; L983-T987 WeakPolarHBondContact O-CB 3.13Å; L983-T987 PolarHBondContact O-N 3.29Å; L983-T987 PolarHBondContact O-OG1 2.04Å; L983-L994 HydrophobicContact CD2-CD1 4.01Å; L983-L994 HydrophobicContact CD2-CD2 4Å; L983-L994 HydrophobicContact CG-CD1 4.48Å
984	V	86.9	Confident	85.9	Confident	34 Å²	34	50 Å²	50	21%	0.206	25%	0.245	C	C	.	.	H	α-helix	trans	-55.8	-48.2	175.9	167.5	0	0	0	0	111.4	Q980 N982 K986 L988 V989 Q991 L994	Q980-V984 WeakPolarHBondContact O-CG2 3.39Å; Q980-V984 PolarHBondContact O-N 2.94Å; N982-V984 PolarHBondContact O-N 2.87Å; V984-K986 VanDerWaalsContact C-N 3.31Å; V984-K986 PolarHBondContact O-N 3.06Å; V984-L988 PolarHBondContact O-N 3.11Å; V984-V989 WeakPolarHBondContact CG1-O 3.35Å; V984-Q991 HydrophobicContact CG1-CB 4.42Å; V984-Q991 HydrophobicContact CG2-CB 3.77Å; V984-Q991 HydrophobicContact CG2-CG 4.12Å; V984-L994 HydrophobicContact CG2-CD1 3.42Å; V984-L994 VanDerWaalsContact CG2-CD1 3.42Å
985	S	82.6	Confident	84.9	Confident	63 Å²	63	55.3 Å²	55.3	44%	0.441	27%	0.272	S	S	.	.	H	α-helix	trans	-63	-37.5	-177.7	-173.6	0	0	0	0	112.5	K981 N982 L983	K981-S985 WeakPolarHBondContact O-CB 2.89Å; K981-S985 PolarHBondContact O-N 3.5Å; N982-S985 PolarHBondContact O-N 3.35Å; L983-S985 VanDerWaalsContact C-N 3.34Å; L983-S985 PolarHBondContact O-N 3.01Å
986	K	82.6	Confident	84.6	Confident	31 Å²	31	58.1 Å²	58.1	14%	0.135	29%	0.286	C	S	.	.	H	α-helix	trans	-91.6	-26	-172.2	-62	-72	178.3	161.9	0	114	D635 H847 I851 N982 L983 V984	D635-K986 WeakPolarHBondContact OD1-CE 3.06Å; D635-K986 IonicContact OD1-NZ 3.64Å; D635-K986 PolarHBondContact OD1-NZ 2.87Å; H847-K986 PolarHBondContact NE2-NZ 3.35Å; I851-K986 HydrophobicContact CD1-CD 4.19Å; N982-K986 WeakPolarHBondContact O-CB 3.49Å; N982-K986 WeakPolarHBondContact O-CG 3.5Å; N982-K986 PolarHBondContact O-N 3.19Å; L983-K986 PolarHBondContact O-N 2.86Å; V984-K986 VanDerWaalsContact C-N 3.31Å; V984-K986 PolarHBondContact O-N 3.06Å
987	T	80.3	Confident	84.2	Confident	4 Å²	4	58.3 Å²	58.3	3%	0.025	29%	0.286	C	S	.	.	H	α-helix	trans	-109.2	-3	-174.3	64.1	0	0	0	0	114	V636 F638 L983 V989	V636-T987 HydrophobicContact CG1-CG2 4.33Å; V636-T987 WeakPolarHBondContact O-CG2 3.19Å; F638-T987 HydrophobicContact CD2-CG2 3.71Å; F638-T987 HydrophobicContact CE2-CG2 3.66Å; F638-T987 HydrophobicContact CG-CG2 4.47Å; F638-T987 HydrophobicContact CZ-CG2 4.41Å; L983-T987 HydrophobicContact CD1-CG2 3.84Å; L983-T987 WeakPolarHBondContact O-CB 3.13Å; L983-T987 PolarHBondContact O-N 3.29Å; L983-T987 PolarHBondContact O-OG1 2.04Å; T987-V989 PolarHBondContact O-N 2.9Å; T987-V989 WeakPolarHBondContact OG1-CG2 3.39Å
988	L	75.3	Confident	83.8	Confident	55 Å²	55	59.8 Å²	59.8	29%	0.288	29%	0.291	S	S	.	.			trans	57.9	11	-173.6	-64.8	165.5	0	0	0	114.7	L850 S870 Y874 V984	L850-L988 HydrophobicContact CD2-CD1 3.63Å; L850-L988 HydrophobicContact CD2-CD2 4.1Å; L850-L988 HydrophobicContact CD2-CG 3.68Å; L850-L988 HydrophobicContact CG-CD1 4.12Å; S870-L988 WeakPolarHBondContact O-CD1 3.4Å; Y874-L988 HydrophobicContact CD2-CD1 4Å; Y874-L988 HydrophobicContact CG-CD1 4.09Å; V984-L988 PolarHBondContact O-N 3.11Å
989	V	81.6	Confident	83.3	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.018	29%	0.287	C	S	.	.			trans	-66.4	130	170.8	162.3	0	0	0	0	109.1	T670 Y671 A674 V984 T987 L994	T670-V989 HydrophobicContact CG2-CG2 4.27Å; Y671-V989 HydrophobicContact CD1-CB 4.15Å; Y671-V989 HydrophobicContact CD1-CG1 3.54Å; Y671-V989 HydrophobicContact CD1-CG2 3.92Å; Y671-V989 HydrophobicContact CE1-CB 3.99Å; Y671-V989 HydrophobicContact CE1-CG1 3.66Å; Y671-V989 HydrophobicContact CE1-CG2 4Å; A674-V989 HydrophobicContact CB-CG1 4.18Å; A674-V989 HydrophobicContact CB-CG2 3.94Å; V984-V989 WeakPolarHBondContact CG1-O 3.35Å; T987-V989 PolarHBondContact O-N 2.9Å; T987-V989 WeakPolarHBondContact OG1-CG2 3.39Å; V989-L994 HydrophobicContact CG1-CD1 4.24Å; V989-L994 HydrophobicContact CG1-CD2 3.82Å; V989-L994 HydrophobicContact CG1-CG 3.9Å
990	D	78.4	Confident	82.9	Confident	72 Å²	72	63.6 Å²	63.6	39%	0.385	30%	0.304	S	S	.	.			trans	-69.4	132.9	176.1	-172.6	-41.4	0	0	0	109.9	R992 F993	D990-R992 PolarHBondContact O-N 2.98Å; D990-R992 VanDerWaalsContact O-N 3.1Å; D990-R992 WeakPolarHBondContact OD1-CG 3.13Å; D990-R992 PolarHBondContact OD1-N 3.48Å; D990-F993 HydrophobicContact CB-CD2 3.97Å; D990-F993 HydrophobicContact CB-CE2 4.29Å; D990-F993 PolarHBondContact O-N 2.97Å; D990-F993 VanDerWaalsContact O-N 3.11Å
991	Q	80.8	Confident	82.4	Confident	90 Å²	90	65.8 Å²	65.8	42%	0.421	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-55.2	-29.5	-177.7	-169.5	178.2	-6.5	0	0	113	V984 F993 L994	V984-Q991 HydrophobicContact CG1-CB 4.42Å; V984-Q991 HydrophobicContact CG2-CB 3.77Å; V984-Q991 HydrophobicContact CG2-CG 4.12Å; Q991-F993 PolarHBondContact O-N 3.29Å; Q991-L994 PolarHBondContact O-N 2.76Å; Q991-L994 VanDerWaalsContact O-N 3.13Å
992	R	82.8	Confident	81.9	Confident	222 Å²	222	62 Å²	62	84%	0.838	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-65.1	-18.2	-178.9	-64.3	176.3	-174.6	-176	2.8	113.9	D990	D990-R992 PolarHBondContact O-N 2.98Å; D990-R992 VanDerWaalsContact O-N 3.1Å; D990-R992 WeakPolarHBondContact OD1-CG 3.13Å; D990-R992 PolarHBondContact OD1-N 3.48Å
993	F	81.6	Confident	81.4	Confident	84 Å²	84	64.7 Å²	64.7	37%	0.368	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-96.8	-2.1	178.1	-64.6	-74.8	0	0	0	113.5	W668 Y671 D990 Q991	W668-F993 HydrophobicContact CH2-CD1 4.36Å; W668-F993 AromaticContact CH2-CE1 3.61Å; W668-F993 HydrophobicContact CH2-CE1 3.61Å; W668-F993 HydrophobicContact CH2-CZ 4.18Å; W668-F993 AromaticContact CZ3-CD1 3.88Å; W668-F993 HydrophobicContact CZ3-CD1 3.88Å; W668-F993 AromaticContact CZ3-CE1 3.6Å; W668-F993 HydrophobicContact CZ3-CE1 3.6Å; W668-F993 HydrophobicContact CZ3-CZ 4.42Å; Y671-F993 HydrophobicContact CD1-CB 3.92Å; Y671-F993 HydrophobicContact CD1-CD2 4.29Å; Y671-F993 HydrophobicContact CD1-CG 4.26Å; Y671-F993 HydrophobicContact CD2-CD2 4.41Å; Y671-F993 HydrophobicContact CD2-CG 4.34Å; Y671-F993 HydrophobicContact CE1-CB 4.3Å; Y671-F993 AromaticContact CE1-CD2 3.9Å; Y671-F993 HydrophobicContact CE1-CD2 3.9Å; Y671-F993 HydrophobicContact CE1-CG 4.33Å; Y671-F993 HydrophobicContact CE2-CD2 4.01Å; Y671-F993 HydrophobicContact CE2-CE2 4.13Å; Y671-F993 HydrophobicContact CE2-CG 4.39Å; Y671-F993 HydrophobicContact CG-CB 4.15Å; Y671-F993 HydrophobicContact CG-CG 4.29Å; Y671-F993 AromaticContact CZ-CD2 3.75Å; D990-F993 HydrophobicContact CB-CD2 3.97Å; D990-F993 HydrophobicContact CB-CE2 4.29Å; D990-F993 PolarHBondContact O-N 2.97Å; D990-F993 VanDerWaalsContact O-N 3.11Å; Q991-F993 PolarHBondContact O-N 3.29Å
994	L	82.5	Confident	80.7	Confident	9 Å²	9	70 Å²	70	5%	0.047	34%	0.338	C	S	.	.			trans	-97.8	113.1	175	-61.8	178.1	0	0	0	108.7	A674 N678 Q980 L983 V984 V989 Q991	A674-L994 HydrophobicContact CB-CD2 3.85Å; N678-L994 HydrophobicContact CB-CD2 4.46Å; Q980-L994 HydrophobicContact CG-CB 4.02Å; Q980-L994 HydrophobicContact CG-CD1 3.74Å; Q980-L994 PolarHBondContact NE2-O 3.27Å; L983-L994 HydrophobicContact CD2-CD1 4.01Å; L983-L994 HydrophobicContact CD2-CD2 4Å; L983-L994 HydrophobicContact CG-CD1 4.48Å; V984-L994 HydrophobicContact CG2-CD1 3.42Å; V984-L994 VanDerWaalsContact CG2-CD1 3.42Å; V989-L994 HydrophobicContact CG1-CD1 4.24Å; V989-L994 HydrophobicContact CG1-CD2 3.82Å; V989-L994 HydrophobicContact CG1-CG 3.9Å; Q991-L994 PolarHBondContact O-N 2.76Å; Q991-L994 VanDerWaalsContact O-N 3.13Å
995	I	73.3	Confident	80.2	Confident	173 Å²	173	73.3 Å²	73.3	89%	0.887	35%	0.35	S	S	*	.			trans	-92.4	0	-178.5	-56.7	176.8	0	0	0	109.8	N675 N678	N675-I995 PolarHBondContact OD1-N 3.47Å; N678-I995 PolarHBondContact ND2-O 3.12Å

Retrieved 995 of 995 residues in 200.1 ms (Link to these results)

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