A0A087YGH4_POEFO Loading...

L3MBTL histone methyl-lysine binding protein 2

AlphaFold DB , UniProt , Accession A0A087YGH4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 825 aa.

						>A0A087YGH4_POEFO|A0A087YGH4
MPYHCVAYGCGKTVEDGVTLFRFPKDPDEFRKWEKQVQRTRVKWVATSFSHLCSEHFGKEYFEDKMPSGTLKLRPGAAPTVFVRPHCSSCGGVGCKQCLPSIQRRASAAETAERRNSGEHKGKEDEENNIRKEGCLPKVRVMRREKARSDGPLICEMCGTPGTFSTFFSKSKRFCSLSCSRSYSSNSKKSSILARLQGRPPSKKATVLNRMNKASATAGVEAHSVFDWGSYLTTEAALAASVSSFAHAPLSSDWDDVVVGMKVEVLNTNAVLSNKVYWIATVLQVAGYKALLRYEGYEHDSSHDFWCSIVSGELNPIGWCSMTSKLLVPPQDANNISDWKSYLMKKLVGSTTLPVDFYVKLAESMKPSFRVGARVEVVDPKHVSRTRLAVVDAVVGGRLRLVYADQSDVPDNVVFDFWCHMWSPLVHPLGWSKTVGHTIKAYGSNVEASSNPKGNGENMFQGLFKKPRIVYMGEGFFEEGMKLEAIDPLNLGNICVATVHKVLLDGYLMVGIDGTELNNGADWFCYHASSHAILPINFCKRNDITLTVPRGSDPQTFTWDKYLQDTKATAAPARLFNTENPGHGFSPNMKLEAVDLMEPRLVCVATVKRCVGRLLLIHFDGWEDEFDQWVDHQSPDLYPVGWCELVGYQLQPPPGLAHLTENHSAQSKKPKPIVHSRKRRRYGRKRMIQEQASDASNELPESSQSSQPEIPAIKTEAEEQEIVPVQVKVEEMETPIESPHKTQQASLRPVKQEKMEQQTESTRPGREEVGSPKENFRETTVQSENKNTDQEGLKAGSRENDGSQDGMWESNTEQDQAGETEDIDV
					

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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	51.1	Low	78.9	Confident	233 Å²	233	59.4 Å²	59.4	100%	1.148	32%	0.315	S	S	*	.				0	142.9	0	-69.2	177.8	174.6	0	0	108.3
2	P	66.4	Low	79.5	Confident	73 Å²	73	59.5 Å²	59.5	47%	0.474	31%	0.311	S	S	.	.			trans	-64.5	151.8	169.8	28.7	-34.2	0	0	0	110.8	T13	P2-T13 HydrophobicContact CG-CG2 4.35Å
3	Y	82.8	Confident	80.2	Confident	134 Å²	134	55.8 Å²	55.8	53%	0.525	29%	0.292	S	S	.	.			trans	-65.3	145.8	168.9	-62.2	-65.6	0	0	0	110	L20 H51	Y3-L20 VanDerWaalsContact O-CD1 3.24Å; Y3-L20 WeakPolarHBondContact O-CD1 3.22Å; Y3-H51 AromaticContact CD1-CE1 3.54Å; Y3-H51 AromaticContact CD1-ND1 3.7Å; Y3-H51 AromaticContact CE1-CE1 3.87Å; Y3-H51 AromaticContact CG-CE1 3.67Å; Y3-H51 AromaticContact CG-ND1 3.89Å
4	H	86.6	Confident	80.4	Confident	80 Å²	80	59.1 Å²	59.1	37%	0.37	32%	0.315	S	S	.	.			trans	-136.7	155.4	-179	63.9	-90.7	0	0	0	110.9	V6 K12 T13 I102	H4-V6 PolarHBondContact O-N 2.59Å; H4-K12 CarbonylContact C-O 3.6Å; H4-K12 WeakPolarHBondContact CA-O 3.25Å; H4-T13 HydrophobicContact CB-CG2 4.08Å; H4-I102 HydrophobicContact CB-CD1 4.24Å
5	C	89.6	Confident	80.6	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.014	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-65.9	124	178.6	-176.3	0	0	0	0	111.4	A7 C10 G11 K12 L20 H51 C53 H56	C5-A7 VanDerWaalsContact C-N 3.32Å; C5-A7 PolarHBondContact O-N 3.42Å; C5-C10 HydrophobicContact CB-CB 4.35Å; C5-G11 WeakPolarHBondContact O-CA 3.36Å; C5-G11 PolarHBondContact O-N 3.13Å; C5-K12 PolarHBondContact N-O 3.32Å; C5-L20 HydrophobicContact CB-CD2 4.39Å; C5-H51 WeakPolarHBondContact CA-O 3.44Å; C5-C53 HydrophobicContact CB-CB 4.09Å; C5-C53 PolarHBondContact SG-N 3.07Å; C5-C53 VanDerWaalsContact SG-N 3.38Å; C5-H56 PolarHBondContact SG-CD2 3.01Å; C5-H56 PolarHBondContact SG-NE2 2.57Å
6	V	89.6	Confident	80.6	Confident	12 Å²	12	68.1 Å²	68.1	7%	0.073	36%	0.357	C	S	.	.			trans	-79.2	-9.1	-177.4	-57	0	0	0	0	114.3	H4 F23 V37 R41 W44 H51 L52	H4-V6 PolarHBondContact O-N 2.59Å; V6-F23 HydrophobicContact CG2-CE2 4.02Å; V6-F23 HydrophobicContact CG2-CZ 4.34Å; V6-V37 HydrophobicContact CG2-CG1 4.35Å; V6-V37 HydrophobicContact CG2-CG2 4.13Å; V6-R41 WeakPolarHBondContact O-CD 3.48Å; V6-R41 PolarHBondContact O-NH1 2.97Å; V6-W44 HydrophobicContact CB-CH2 4.17Å; V6-W44 HydrophobicContact CB-CZ2 3.72Å; V6-W44 HydrophobicContact CG1-CZ2 4.03Å; V6-W44 HydrophobicContact CG2-CH2 3.61Å; V6-W44 HydrophobicContact CG2-CZ2 3.72Å; V6-W44 HydrophobicContact CG2-CZ3 4.44Å; V6-H51 WeakPolarHBondContact CG2-O 3.27Å; V6-H51 PolarHBondContact N-O 2.71Å; V6-L52 HydrophobicContact CG2-CD2 3.72Å; V6-L52 HydrophobicContact CG2-CG 4.13Å
7	A	84.8	Confident	80.8	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.008	38%	0.38	C	S	.	.	S	Bend	trans	-60.7	146.6	177.5	0	0	0	0	0	112.2	C5 G9 C10 L52 H56 F82	C5-A7 VanDerWaalsContact C-N 3.32Å; C5-A7 PolarHBondContact O-N 3.42Å; A7-G9 PolarHBondContact O-N 2.91Å; A7-C10 HydrophobicContact CB-CB 4.05Å; A7-C10 PolarHBondContact O-N 3.25Å; A7-L52 HydrophobicContact CB-CD2 3.81Å; A7-H56 VanDerWaalsContact CB-CE1 3.48Å; A7-H56 WeakPolarHBondContact CB-CE1 3.35Å; A7-H56 VanDerWaalsContact CB-NE2 3.34Å; A7-H56 WeakPolarHBondContact CB-NE2 3.18Å; A7-F82 HydrophobicContact CB-CD1 4.14Å; A7-F82 HydrophobicContact CB-CE1 3.72Å
8	Y	80.2	Confident	81.1	Confident	40 Å²	40	65.2 Å²	65.2	16%	0.157	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	132	-178.9	-173.2	-107.7	0	0	0	111.9	C10 T40 R41 R84 C98	Y8-C10 PolarHBondContact O-N 3.25Å; Y8-T40 VanDerWaalsContact CB-CB 3.48Å; Y8-T40 VanDerWaalsContact CB-OG1 3.3Å; Y8-T40 WeakPolarHBondContact CB-OG1 3.18Å; Y8-R41 HydrophobicContact CD2-CG 4.09Å; Y8-R41 HydrophobicContact CG-CG 4.4Å; Y8-R84 HydrophobicContact CD1-CG 4.12Å; Y8-R84 HydrophobicContact CE1-CG 4.24Å; Y8-C98 WeakPolarHBondContact OH-CB 3.3Å
9	G	73.1	Confident	81.6	Confident	37 Å²	37	64.2 Å²	64.2	38%	0.381	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	-13.2	179.1	0	0	0	0	0	116.3	A7	A7-G9 PolarHBondContact O-N 2.91Å
10	C	83.3	Confident	82.1	Confident	31 Å²	31	62.4 Å²	62.4	21%	0.209	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-75.5	-176.1	-176.4	0	0	0	0	112	C5 A7 Y8 K12 C53 H56	C5-C10 HydrophobicContact CB-CB 4.35Å; A7-C10 HydrophobicContact CB-CB 4.05Å; A7-C10 PolarHBondContact O-N 3.25Å; Y8-C10 PolarHBondContact O-N 3.25Å; C10-K12 PolarHBondContact O-N 3Å; C10-C53 VanDerWaalsContact SG-SG 3.68Å; C10-H56 PolarHBondContact SG-NE2 3.44Å
11	G	80.1	Confident	82.6	Confident	10 Å²	10	60.7 Å²	60.7	10%	0.103	34%	0.337	C	S	.	.			trans	62.9	8.2	177.9	0	0	0	0	0	116.2	C5	C5-G11 WeakPolarHBondContact O-CA 3.36Å; C5-G11 PolarHBondContact O-N 3.13Å
12	K	85.9	Confident	84.6	Confident	61 Å²	61	55.9 Å²	55.9	27%	0.265	31%	0.306	S	S	.	.			trans	-61.2	148.5	179.1	-74.2	-178.7	171.1	173	0	112.5	H4 C5 C10 D16 V18 E55	H4-K12 CarbonylContact C-O 3.6Å; H4-K12 WeakPolarHBondContact CA-O 3.25Å; C5-K12 PolarHBondContact N-O 3.32Å; C10-K12 PolarHBondContact O-N 3Å; K12-D16 HydrophobicContact CB-CB 4.08Å; K12-D16 HydrophobicContact CD-CB 4.33Å; K12-D16 HydrophobicContact CG-CB 4.05Å; K12-V18 HydrophobicContact CB-CG2 3.87Å; K12-V18 HydrophobicContact CD-CG1 4.15Å; K12-V18 HydrophobicContact CD-CG2 4.39Å; K12-E55 IonicContact NZ-OE1 3.16Å; K12-E55 PolarHBondContact NZ-OE1 2.86Å; K12-E55 IonicContact NZ-OE2 3.89Å; K12-E55 PolarHBondContact NZ-OE2 2.86Å
13	T	88.8	Confident	85.8	Confident	11 Å²	11	53 Å²	53	7%	0.067	29%	0.286	C	S	.	.			trans	-115.9	179	179	66	0	0	0	0	110.3	P2 H4 E15 D16 V18 I102	P2-T13 HydrophobicContact CG-CG2 4.35Å; H4-T13 HydrophobicContact CB-CG2 4.08Å; T13-E15 PolarHBondContact O-N 3.27Å; T13-E15 WeakPolarHBondContact OG1-CB 3.32Å; T13-E15 PolarHBondContact OG1-N 2.89Å; T13-D16 PolarHBondContact N-OD2 3.14Å; T13-D16 WeakPolarHBondContact O-CB 3.42Å; T13-D16 PolarHBondContact O-N 2.94Å; T13-D16 PolarHBondContact OG1-OD2 3.45Å; T13-V18 VanDerWaalsContact O-CG2 3.25Å; T13-V18 WeakPolarHBondContact O-CG2 3.21Å; T13-I102 HydrophobicContact CG2-CD1 4.27Å
14	V	84.1	Confident	86.2	Confident	102 Å²	102	47.7 Å²	47.7	62%	0.618	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-64.6	-26.8	173.5	-173.3	0	0	0	0	111.7	D16 G17 L20	V14-D16 PolarHBondContact O-N 3.06Å; V14-G17 PolarHBondContact O-N 3Å; V14-G17 VanDerWaalsContact O-N 3.1Å; V14-L20 HydrophobicContact CG2-CD1 3.89Å; V14-L20 HydrophobicContact CG2-CG 4.07Å
15	E	82.6	Confident	86.2	Confident	171 Å²	171	54 Å²	54	80%	0.799	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-64.9	-24.8	176.2	-59.7	168.8	-150.9	0	0	112.3	T13 G17	T13-E15 PolarHBondContact O-N 3.27Å; T13-E15 WeakPolarHBondContact OG1-CB 3.32Å; T13-E15 PolarHBondContact OG1-N 2.89Å; E15-G17 PolarHBondContact O-N 3.44Å
16	D	81.2	Confident	86.2	Confident	92 Å²	92	57.5 Å²	57.5	49%	0.492	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-79.2	7.3	175.2	-58.7	-88.6	0	0	0	113.2	K12 T13 V14	K12-D16 HydrophobicContact CB-CB 4.08Å; K12-D16 HydrophobicContact CD-CB 4.33Å; K12-D16 HydrophobicContact CG-CB 4.05Å; T13-D16 PolarHBondContact N-OD2 3.14Å; T13-D16 WeakPolarHBondContact O-CB 3.42Å; T13-D16 PolarHBondContact O-N 2.94Å; T13-D16 PolarHBondContact OG1-OD2 3.45Å; V14-D16 PolarHBondContact O-N 3.06Å
17	G	82.8	Confident	86.1	Confident	74 Å²	74	60.9 Å²	60.9	76%	0.763	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	15.5	176.6	0	0	0	0	0	115.2	V14 E15	V14-G17 PolarHBondContact O-N 3Å; V14-G17 VanDerWaalsContact O-N 3.1Å; E15-G17 PolarHBondContact O-N 3.44Å
18	V	87.6	Confident	86.1	Confident	10 Å²	10	64.8 Å²	64.8	6%	0.061	36%	0.356	C	S	.	.			trans	-108.1	145.2	180	-64	0	0	0	0	112.2	K12 T13 C53 E55	K12-V18 HydrophobicContact CB-CG2 3.87Å; K12-V18 HydrophobicContact CD-CG1 4.15Å; K12-V18 HydrophobicContact CD-CG2 4.39Å; T13-V18 VanDerWaalsContact O-CG2 3.25Å; T13-V18 WeakPolarHBondContact O-CG2 3.21Å; V18-C53 HydrophobicContact CB-CB 3.92Å; V18-C53 HydrophobicContact CG2-CB 3.57Å; V18-E55 HydrophobicContact CG1-CG 4.07Å
19	T	89.9	Confident	86.5	Confident	45 Å²	45	65.2 Å²	65.2	28%	0.276	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-76.1	133.6	170.9	-50.2	0	0	0	0	109.2	F21 C53 S54	T19-F21 HydrophobicContact CG2-CE1 3.89Å; T19-F21 HydrophobicContact CG2-CE2 4.04Å; T19-F21 HydrophobicContact CG2-CZ 3.57Å; T19-C53 CarbonylContact O-C 3.56Å; T19-C53 VanDerWaalsContact O-CA 3.23Å; T19-C53 WeakPolarHBondContact O-CA 3.45Å; T19-S54 PolarHBondContact N-OG 3.46Å; T19-S54 PolarHBondContact O-N 3.45Å
20	L	91.5	Very high	87.3	Confident	29 Å²	29	65.6 Å²	65.6	15%	0.152	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	120.9	174.5	-67.4	-177.4	0	0	0	110.8	Y3 C5 V14 H51 C53	Y3-L20 VanDerWaalsContact O-CD1 3.24Å; Y3-L20 WeakPolarHBondContact O-CD1 3.22Å; C5-L20 HydrophobicContact CB-CD2 4.39Å; V14-L20 HydrophobicContact CG2-CD1 3.89Å; V14-L20 HydrophobicContact CG2-CG 4.07Å; L20-H51 HydrophobicContact CB-CB 4.45Å; L20-C53 HydrophobicContact CD2-CB 3.72Å
21	F	92.3	Very high	87.5	Confident	27 Å²	27	71 Å²	71	12%	0.118	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	125.3	173.9	-59.6	-73.8	0	0	0	110.2	T19 W33 H51 L52 F57 F62 L71 L73	T19-F21 HydrophobicContact CG2-CE1 3.89Å; T19-F21 HydrophobicContact CG2-CE2 4.04Å; T19-F21 HydrophobicContact CG2-CZ 3.57Å; F21-W33 HydrophobicContact CB-CH2 3.91Å; F21-W33 HydrophobicContact CB-CZ3 4.17Å; F21-H51 CarbonylContact O-C 3.53Å; F21-H51 WeakPolarHBondContact O-CA 3.24Å; F21-L52 PolarHBondContact N-O 3.06Å; F21-L52 PolarHBondContact O-N 2.94Å; F21-F57 HydrophobicContact CB-CZ 4.49Å; F21-F57 HydrophobicContact CD2-CD2 4.23Å; F21-F57 AromaticContact CD2-CE2 3.86Å; F21-F57 HydrophobicContact CD2-CE2 3.86Å; F21-F57 HydrophobicContact CD2-CZ 4.46Å; F21-F62 AromaticContact CE2-CE1 3.74Å; F21-F62 HydrophobicContact CE2-CE1 3.74Å; F21-F62 HydrophobicContact CE2-CZ 4.32Å; F21-F62 AromaticContact CZ-CE1 3.77Å; F21-F62 HydrophobicContact CZ-CE1 3.77Å; F21-L71 WeakPolarHBondContact CE1-O 3.37Å; F21-L71 HydrophobicContact CZ-CB 4Å; F21-L71 WeakPolarHBondContact CZ-O 3.3Å; F21-L73 HydrophobicContact CB-CD1 4.05Å; F21-L73 HydrophobicContact CD1-CD1 3.81Å; F21-L73 HydrophobicContact CD1-CG 4.03Å; F21-L73 HydrophobicContact CD2-CD1 3.93Å; F21-L73 HydrophobicContact CD2-CG 4.31Å; F21-L73 HydrophobicContact CE1-CD1 4.28Å; F21-L73 HydrophobicContact CE1-CG 3.99Å; F21-L73 HydrophobicContact CE2-CD1 4.38Å; F21-L73 HydrophobicContact CE2-CG 4.26Å; F21-L73 HydrophobicContact CG-CD1 3.62Å; F21-L73 HydrophobicContact CG-CG 4.2Å; F21-L73 HydrophobicContact CZ-CG 4.11Å
22	R	92.8	Very high	87.8	Confident	132 Å²	132	76.1 Å²	76.1	50%	0.498	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	148.1	169.1	-168.9	175.8	-177.6	171.4	3.2	109.2	S48 H51	R22-S48 PolarHBondContact NE-O 2.87Å; R22-S48 PolarHBondContact NH2-O 2.63Å; R22-H51 PolarHBondContact N-CD2 2.87Å
23	F	93	Very high	88.1	Confident	11 Å²	11	73.7 Å²	73.7	5%	0.048	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-55.9	144.8	173.5	-85.7	-132	0	0	0	111.4	V6 F30 W33 E34 V37 W44 A46 S50 L52	V6-F23 HydrophobicContact CG2-CE2 4.02Å; V6-F23 HydrophobicContact CG2-CZ 4.34Å; F23-F30 HydrophobicContact CB-CD2 3.72Å; F23-F30 HydrophobicContact CB-CE2 3.79Å; F23-F30 AromaticContact CD1-CD2 3.86Å; F23-F30 HydrophobicContact CD1-CD2 3.86Å; F23-F30 AromaticContact CD1-CE2 3.81Å; F23-F30 HydrophobicContact CD1-CE2 3.81Å; F23-F30 HydrophobicContact CD1-CG 4.31Å; F23-F30 HydrophobicContact CD1-CZ 4.24Å; F23-F30 HydrophobicContact CG-CD2 4.29Å; F23-F30 HydrophobicContact CG-CE2 4.19Å; F23-W33 HydrophobicContact CB-CE3 4.45Å; F23-W33 HydrophobicContact CD1-CB 3.78Å; F23-W33 AromaticContact CD2-CE3 3.78Å; F23-W33 HydrophobicContact CD2-CE3 3.78Å; F23-W33 HydrophobicContact CD2-CZ3 4.34Å; F23-W33 HydrophobicContact CE1-CB 3.61Å; F23-W33 HydrophobicContact CE2-CE3 4.13Å; F23-W33 HydrophobicContact CG-CB 4.39Å; F23-W33 AromaticContact CG-CE3 4Å; F23-W33 HydrophobicContact CG-CE3 4Å; F23-W33 HydrophobicContact CZ-CB 4.08Å; F23-E34 HydrophobicContact CE1-CB 4.29Å; F23-V37 HydrophobicContact CZ-CG2 4.06Å; F23-W44 HydrophobicContact CE1-CH2 4.28Å; F23-W44 HydrophobicContact CE1-CZ3 4.37Å; F23-W44 HydrophobicContact CE2-CH2 4.34Å; F23-W44 AromaticContact CZ-CH2 3.7Å; F23-W44 HydrophobicContact CZ-CH2 3.7Å; F23-W44 AromaticContact CZ-CZ3 3.96Å; F23-W44 HydrophobicContact CZ-CZ3 3.96Å; F23-A46 HydrophobicContact CD1-CB 3.94Å; F23-A46 HydrophobicContact CE1-CB 3.51Å; F23-A46 HydrophobicContact CZ-CB 4.22Å; F23-S50 VanDerWaalsContact CD2-O 3.32Å; F23-S50 WeakPolarHBondContact CD2-O 3.38Å; F23-S50 PolarHBondContact N-O 2.66Å; F23-S50 VanDerWaalsContact N-O 3.13Å; F23-L52 HydrophobicContact CE2-CD1 4.02Å; F23-L52 HydrophobicContact CE2-CG 4Å; F23-L52 HydrophobicContact CZ-CD1 4.34Å
24	P	90.3	Very high	88.2	Confident	23 Å²	23	74.8 Å²	74.8	15%	0.149	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-54.3	156.1	177.1	-30.1	37.5	0	0	0	113.8	E29 F30 W33	P24-E29 HydrophobicContact CB-CB 3.65Å; P24-E29 HydrophobicContact CG-CB 3.79Å; P24-F30 WeakPolarHBondContact O-CD2 3.35Å; P24-W33 VanDerWaalsContact CD-CE2 3.48Å; P24-W33 HydrophobicContact CG-CD2 3.98Å; P24-W33 HydrophobicContact CG-CG 4.3Å; P24-W33 HydrophobicContact CG-CH2 4.4Å; P24-W33 HydrophobicContact CG-CZ2 3.8Å
25	K	87.1	Confident	88.2	Confident	214 Å²	214	77 Å²	77	93%	0.93	38%	0.381	S	S	*	.	S	Bend	trans	-83.6	-21.5	171.9	-69.4	-174.9	179.3	-179.7	0	113
26	D	89.1	Confident	88.3	Confident	75 Å²	75	69.9 Å²	69.9	40%	0.401	35%	0.347	S	S	.	.	S	Bend	trans	-68.3	130.9	175.9	176.2	75.3	0	0	0	110.2	D28 E29 F30	D26-D28 VanDerWaalsContact C-N 3.3Å; D26-D28 PolarHBondContact O-N 2.82Å; D26-D28 WeakPolarHBondContact OD2-CA 3.5Å; D26-D28 PolarHBondContact OD2-N 2.56Å; D26-E29 HydrophobicContact CB-CB 4.12Å; D26-E29 HydrophobicContact CB-CG 4.2Å; D26-E29 PolarHBondContact OD2-N 3Å; D26-F30 WeakPolarHBondContact O-CB 3.31Å; D26-F30 PolarHBondContact O-N 3.12Å
27	P	87.8	Confident	88.4	Confident	83 Å²	83	65.5 Å²	65.5	54%	0.539	32%	0.324	S	S	.	.	H	α-helix	trans	-60.3	-34.9	-176.5	-25.9	35.5	0	0	0	114.4	R31	P27-R31 WeakPolarHBondContact O-CB 3.44Å; P27-R31 WeakPolarHBondContact O-CD 3.36Å; P27-R31 WeakPolarHBondContact O-CG 3.47Å; P27-R31 PolarHBondContact O-N 3.33Å
28	D	85.9	Confident	88.5	Confident	82 Å²	82	64.9 Å²	64.9	44%	0.439	30%	0.301	S	S	.	.	H	α-helix	trans	-88.3	-33.1	-174.6	-69.4	-31.7	0	0	0	112	D26 R31 K32	D26-D28 VanDerWaalsContact C-N 3.3Å; D26-D28 PolarHBondContact O-N 2.82Å; D26-D28 WeakPolarHBondContact OD2-CA 3.5Å; D26-D28 PolarHBondContact OD2-N 2.56Å; D28-R31 IonicContact OD1-CZ 3.52Å; D28-R31 IonicContact OD1-NH1 2.74Å; D28-R31 PolarHBondContact OD1-NH1 2.76Å; D28-K32 WeakPolarHBondContact O-CB 3.22Å; D28-K32 WeakPolarHBondContact O-CD 3.47Å; D28-K32 WeakPolarHBondContact O-CE 3.26Å; D28-K32 WeakPolarHBondContact O-CG 3.42Å; D28-K32 PolarHBondContact O-N 2.93Å
29	E	86.9	Confident	87.6	Confident	50 Å²	50	71.9 Å²	71.9	23%	0.234	33%	0.327	C	S	.	.	H	α-helix	trans	-63.5	-40.8	163.5	-64.4	-166.3	150	0	0	112.2	P24 D26 R31 K32 W33 G76	P24-E29 HydrophobicContact CB-CB 3.65Å; P24-E29 HydrophobicContact CG-CB 3.79Å; D26-E29 HydrophobicContact CB-CB 4.12Å; D26-E29 HydrophobicContact CB-CG 4.2Å; D26-E29 PolarHBondContact OD2-N 3Å; E29-R31 PolarHBondContact O-N 3.17Å; E29-K32 WeakPolarHBondContact O-CB 3.33Å; E29-K32 PolarHBondContact O-N 2.86Å; E29-W33 PolarHBondContact O-N 2.98Å; E29-G76 WeakPolarHBondContact OE1-CA 3.13Å; E29-G76 PolarHBondContact OE1-N 3.07Å
30	F	90.6	Very high	86.6	Confident	44 Å²	44	70.1 Å²	70.1	19%	0.193	32%	0.315	C	S	.	.	H	α-helix	trans	-58.8	-48	174.6	-175.8	-82.2	0	0	0	111.3	F23 P24 D26 K32 W33 E34 A46	F23-F30 HydrophobicContact CB-CD2 3.72Å; F23-F30 HydrophobicContact CB-CE2 3.79Å; F23-F30 AromaticContact CD1-CD2 3.86Å; F23-F30 HydrophobicContact CD1-CD2 3.86Å; F23-F30 AromaticContact CD1-CE2 3.81Å; F23-F30 HydrophobicContact CD1-CE2 3.81Å; F23-F30 HydrophobicContact CD1-CG 4.31Å; F23-F30 HydrophobicContact CD1-CZ 4.24Å; F23-F30 HydrophobicContact CG-CD2 4.29Å; F23-F30 HydrophobicContact CG-CE2 4.19Å; P24-F30 WeakPolarHBondContact O-CD2 3.35Å; D26-F30 WeakPolarHBondContact O-CB 3.31Å; D26-F30 PolarHBondContact O-N 3.12Å; F30-K32 PolarHBondContact O-N 3.14Å; F30-W33 PolarHBondContact O-N 2.78Å; F30-E34 WeakPolarHBondContact O-CB 3.47Å; F30-E34 PolarHBondContact O-N 2.82Å; F30-A46 HydrophobicContact CE1-CB 3.64Å; F30-A46 HydrophobicContact CE2-CB 4.4Å; F30-A46 HydrophobicContact CZ-CB 3.51Å
31	R	88	Confident	85.8	Confident	146 Å²	146	72.1 Å²	72.1	55%	0.551	32%	0.321	S	S	*	.	H	α-helix	trans	-62	-38.8	174.7	-76.1	163.8	169.5	171.2	-6.2	113	P27 D28 E29 E34 K35	P27-R31 WeakPolarHBondContact O-CB 3.44Å; P27-R31 WeakPolarHBondContact O-CD 3.36Å; P27-R31 WeakPolarHBondContact O-CG 3.47Å; P27-R31 PolarHBondContact O-N 3.33Å; D28-R31 IonicContact OD1-CZ 3.52Å; D28-R31 IonicContact OD1-NH1 2.74Å; D28-R31 PolarHBondContact OD1-NH1 2.76Å; E29-R31 PolarHBondContact O-N 3.17Å; R31-E34 PolarHBondContact O-N 2.88Å; R31-K35 WeakPolarHBondContact O-CB 3.1Å; R31-K35 WeakPolarHBondContact O-CG 3.39Å; R31-K35 PolarHBondContact O-N 3.07Å
32	K	86.3	Confident	84.6	Confident	117 Å²	117	76.3 Å²	76.3	51%	0.509	35%	0.348	S	S	.	.	H	α-helix	trans	-60.4	-49.1	173.8	-72.3	161.5	-153.9	161.2	0	110.4	D28 E29 F30 E34 K35 Q36	D28-K32 WeakPolarHBondContact O-CB 3.22Å; D28-K32 WeakPolarHBondContact O-CD 3.47Å; D28-K32 WeakPolarHBondContact O-CE 3.26Å; D28-K32 WeakPolarHBondContact O-CG 3.42Å; D28-K32 PolarHBondContact O-N 2.93Å; E29-K32 WeakPolarHBondContact O-CB 3.33Å; E29-K32 PolarHBondContact O-N 2.86Å; F30-K32 PolarHBondContact O-N 3.14Å; K32-E34 PolarHBondContact O-N 2.71Å; K32-K35 PolarHBondContact O-N 2.9Å; K32-Q36 VanDerWaalsContact O-CG 3.28Å; K32-Q36 WeakPolarHBondContact O-CG 3.36Å; K32-Q36 PolarHBondContact O-N 2.78Å; K32-Q36 VanDerWaalsContact O-N 3.09Å
33	W	91.8	Very high	83.7	Confident	10 Å²	10	79.5 Å²	79.5	4%	0.038	37%	0.366	C	S	.	.	H	α-helix	trans	-63.8	-40.1	178.5	-75.8	43.3	0	0	0	112.2	F21 F23 P24 E29 F30 Q36 V37 L52 F57 L73 A77 P79	F21-W33 HydrophobicContact CB-CH2 3.91Å; F21-W33 HydrophobicContact CB-CZ3 4.17Å; F23-W33 HydrophobicContact CB-CE3 4.45Å; F23-W33 HydrophobicContact CD1-CB 3.78Å; F23-W33 AromaticContact CD2-CE3 3.78Å; F23-W33 HydrophobicContact CD2-CE3 3.78Å; F23-W33 HydrophobicContact CD2-CZ3 4.34Å; F23-W33 HydrophobicContact CE1-CB 3.61Å; F23-W33 HydrophobicContact CE2-CE3 4.13Å; F23-W33 HydrophobicContact CG-CB 4.39Å; F23-W33 AromaticContact CG-CE3 4Å; F23-W33 HydrophobicContact CG-CE3 4Å; F23-W33 HydrophobicContact CZ-CB 4.08Å; P24-W33 VanDerWaalsContact CD-CE2 3.48Å; P24-W33 HydrophobicContact CG-CD2 3.98Å; P24-W33 HydrophobicContact CG-CG 4.3Å; P24-W33 HydrophobicContact CG-CH2 4.4Å; P24-W33 HydrophobicContact CG-CZ2 3.8Å; E29-W33 PolarHBondContact O-N 2.98Å; F30-W33 PolarHBondContact O-N 2.78Å; W33-Q36 PolarHBondContact O-N 2.61Å; W33-V37 PolarHBondContact O-N 3.37Å; W33-V37 VanDerWaalsContact O-N 3.15Å; W33-L52 HydrophobicContact CE3-CD1 4Å; W33-F57 HydrophobicContact CE3-CZ 4.26Å; W33-F57 AromaticContact CH2-CE1 3.75Å; W33-F57 HydrophobicContact CH2-CE1 3.75Å; W33-F57 AromaticContact CH2-CZ 3.45Å; W33-F57 HydrophobicContact CH2-CZ 3.45Å; W33-F57 VanDerWaalsContact CH2-CZ 3.45Å; W33-F57 AromaticContact CZ2-CE1 3.59Å; W33-F57 HydrophobicContact CZ2-CE1 3.59Å; W33-F57 AromaticContact CZ2-CZ 3.81Å; W33-F57 HydrophobicContact CZ2-CZ 3.81Å; W33-F57 HydrophobicContact CZ3-CE1 4.32Å; W33-F57 AromaticContact CZ3-CZ 3.7Å; W33-F57 HydrophobicContact CZ3-CZ 3.7Å; W33-L73 HydrophobicContact CH2-CD1 3.78Å; W33-L73 HydrophobicContact CZ2-CD1 3.9Å; W33-A77 PolarHBondContact NE1-O 2.89Å; W33-P79 HydrophobicContact CB-CG 4.31Å; W33-P79 VanDerWaalsContact CD1-CD 3.46Å; W33-P79 HydrophobicContact CD2-CG 4.14Å; W33-P79 HydrophobicContact CG-CG 4.01Å
34	E	90.9	Very high	83.4	Confident	33 Å²	33	80.8 Å²	80.8	15%	0.154	37%	0.371	C	S	.	.	H	α-helix	trans	-60.8	-52.6	176	178.3	173.2	-134.1	0	0	111.7	F23 F30 R31 K32 Q36 V37 Q38 V45 A46	F23-E34 HydrophobicContact CE1-CB 4.29Å; F30-E34 WeakPolarHBondContact O-CB 3.47Å; F30-E34 PolarHBondContact O-N 2.82Å; R31-E34 PolarHBondContact O-N 2.88Å; K32-E34 PolarHBondContact O-N 2.71Å; E34-Q36 VanDerWaalsContact C-N 3.26Å; E34-Q36 PolarHBondContact O-N 3.44Å; E34-V37 PolarHBondContact O-N 2.95Å; E34-V37 VanDerWaalsContact O-N 3.11Å; E34-Q38 HydrophobicContact CG-CG 4.48Å; E34-Q38 WeakPolarHBondContact O-CG 3.31Å; E34-Q38 PolarHBondContact O-N 2.72Å; E34-V45 WeakPolarHBondContact OE1-CA 3.41Å; E34-A46 HydrophobicContact CB-CB 3.81Å; E34-A46 HydrophobicContact CG-CB 3.78Å; E34-A46 PolarHBondContact OE1-N 3.02Å
35	K	84.6	Confident	83.1	Confident	149 Å²	149	84.4 Å²	84.4	65%	0.648	39%	0.392	S	S	*	.	H	α-helix	trans	-57	-39.1	177.1	-76.8	-173	173.9	-170.9	0	111.9	R31 K32 Q38 R39	R31-K35 WeakPolarHBondContact O-CB 3.1Å; R31-K35 WeakPolarHBondContact O-CG 3.39Å; R31-K35 PolarHBondContact O-N 3.07Å; K32-K35 PolarHBondContact O-N 2.9Å; K35-Q38 WeakPolarHBondContact O-CB 3.5Å; K35-Q38 PolarHBondContact O-N 2.9Å; K35-R39 PolarHBondContact O-N 3.1Å
36	Q	83.8	Confident	83.1	Confident	21 Å²	21	74.8 Å²	74.8	10%	0.098	35%	0.352	C	S	.	.	H	α-helix	trans	-65.2	-39.3	177.1	-67.7	-69.4	-5.1	0	0	112.8	K32 W33 E34 R39 P79 F82	K32-Q36 VanDerWaalsContact O-CG 3.28Å; K32-Q36 WeakPolarHBondContact O-CG 3.36Å; K32-Q36 PolarHBondContact O-N 2.78Å; K32-Q36 VanDerWaalsContact O-N 3.09Å; W33-Q36 PolarHBondContact O-N 2.61Å; E34-Q36 VanDerWaalsContact C-N 3.26Å; E34-Q36 PolarHBondContact O-N 3.44Å; Q36-R39 WeakPolarHBondContact O-CB 3.43Å; Q36-R39 PolarHBondContact O-N 3.34Å; Q36-P79 HydrophobicContact CB-CG 4.03Å; Q36-P79 HydrophobicContact CG-CG 4.46Å; Q36-P79 WeakPolarHBondContact CG-O 3.44Å; Q36-F82 HydrophobicContact CB-CD2 4.45Å; Q36-F82 HydrophobicContact CB-CE2 3.71Å; Q36-F82 HydrophobicContact CB-CZ 4.22Å
37	V	84.1	Confident	83.1	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-67.2	-38.8	172.6	179.4	0	0	0	0	111.2	V6 F23 W33 E34 R39 T40 R41 W44 L52 F82	V6-V37 HydrophobicContact CG2-CG1 4.35Å; V6-V37 HydrophobicContact CG2-CG2 4.13Å; F23-V37 HydrophobicContact CZ-CG2 4.06Å; W33-V37 PolarHBondContact O-N 3.37Å; W33-V37 VanDerWaalsContact O-N 3.15Å; E34-V37 PolarHBondContact O-N 2.95Å; E34-V37 VanDerWaalsContact O-N 3.11Å; V37-R39 PolarHBondContact O-N 2.85Å; V37-T40 PolarHBondContact O-N 3.31Å; V37-T40 PolarHBondContact O-OG1 3.39Å; V37-T40 VanDerWaalsContact O-OG1 3.12Å; V37-R41 HydrophobicContact CG1-CB 4.36Å; V37-R41 HydrophobicContact CG1-CG 4.16Å; V37-R41 PolarHBondContact O-N 3.18Å; V37-W44 HydrophobicContact CB-CE3 3.71Å; V37-W44 HydrophobicContact CB-CH2 4.45Å; V37-W44 HydrophobicContact CB-CZ3 3.58Å; V37-W44 HydrophobicContact CG1-CD2 3.87Å; V37-W44 HydrophobicContact CG1-CE3 3.36Å; V37-W44 HydrophobicContact CG1-CH2 4.22Å; V37-W44 HydrophobicContact CG1-CZ3 3.56Å; V37-W44 HydrophobicContact CG2-CZ3 4Å; V37-L52 HydrophobicContact CG2-CD1 3.91Å; V37-L52 HydrophobicContact CG2-CD2 3.96Å; V37-L52 HydrophobicContact CG2-CG 4.39Å; V37-F82 HydrophobicContact CB-CE1 4.47Å; V37-F82 HydrophobicContact CG2-CE1 4Å; V37-F82 HydrophobicContact CG2-CZ 3.87Å
38	Q	83.8	Confident	82.7	Confident	61 Å²	61	74.2 Å²	74.2	29%	0.285	35%	0.353	S	S	.	.	H	α-helix	trans	-59.1	-29.4	177.9	-73.7	171.2	-8.4	0	0	113.4	E34 K35 T40 R41 V42 W44	E34-Q38 HydrophobicContact CG-CG 4.48Å; E34-Q38 WeakPolarHBondContact O-CG 3.31Å; E34-Q38 PolarHBondContact O-N 2.72Å; K35-Q38 WeakPolarHBondContact O-CB 3.5Å; K35-Q38 PolarHBondContact O-N 2.9Å; Q38-T40 PolarHBondContact O-N 2.86Å; Q38-R41 CarbonylContact O-C 3.42Å; Q38-R41 VanDerWaalsContact O-C 3.27Å; Q38-R41 PolarHBondContact O-N 3.24Å; Q38-R41 VanDerWaalsContact O-N 3.16Å; Q38-V42 PolarHBondContact O-N 3.04Å; Q38-W44 VanDerWaalsContact CG-O 3.23Å; Q38-W44 WeakPolarHBondContact CG-O 3.28Å; Q38-W44 PolarHBondContact NE2-O 2.71Å
39	R	70.1	Confident	82.6	Confident	158 Å²	158	76.1 Å²	76.1	60%	0.596	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-27	171.9	-62.6	174.4	78.2	179.9	4.9	113.5	K35 Q36 V37	K35-R39 PolarHBondContact O-N 3.1Å; Q36-R39 WeakPolarHBondContact O-CB 3.43Å; Q36-R39 PolarHBondContact O-N 3.34Å; V37-R39 PolarHBondContact O-N 2.85Å
40	T	68.6	Low	82.9	Confident	7 Å²	7	74 Å²	74	4%	0.043	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-22.4	175	60.8	0	0	0	0	113.7	Y8 V37 Q38 F82 R84	Y8-T40 VanDerWaalsContact CB-CB 3.48Å; Y8-T40 VanDerWaalsContact CB-OG1 3.3Å; Y8-T40 WeakPolarHBondContact CB-OG1 3.18Å; V37-T40 PolarHBondContact O-N 3.31Å; V37-T40 PolarHBondContact O-OG1 3.39Å; V37-T40 VanDerWaalsContact O-OG1 3.12Å; Q38-T40 PolarHBondContact O-N 2.86Å; T40-F82 HydrophobicContact CG2-CB 3.8Å; T40-F82 HydrophobicContact CG2-CD1 4.14Å; T40-F82 HydrophobicContact CG2-CG 4.35Å; T40-R84 HydrophobicContact CG2-CB 4.33Å; T40-R84 HydrophobicContact CG2-CG 4.32Å; T40-R84 PolarHBondContact O-NH2 3.46Å
41	R	75	Confident	83	Confident	72 Å²	72	72.8 Å²	72.8	27%	0.272	34%	0.343	S	S	.	.	S	Bend	trans	-123.1	75.7	-178.6	-55.9	-170.7	64.7	170.2	-1.8	111.4	V6 Y8 V37 Q38 K43 W44	V6-R41 WeakPolarHBondContact O-CD 3.48Å; V6-R41 PolarHBondContact O-NH1 2.97Å; Y8-R41 HydrophobicContact CD2-CG 4.09Å; Y8-R41 HydrophobicContact CG-CG 4.4Å; V37-R41 HydrophobicContact CG1-CB 4.36Å; V37-R41 HydrophobicContact CG1-CG 4.16Å; V37-R41 PolarHBondContact O-N 3.18Å; Q38-R41 CarbonylContact O-C 3.42Å; Q38-R41 VanDerWaalsContact O-C 3.27Å; Q38-R41 PolarHBondContact O-N 3.24Å; Q38-R41 VanDerWaalsContact O-N 3.16Å; R41-K43 PolarHBondContact O-N 3.27Å; R41-W44 HydrophobicContact CB-CB 3.55Å; R41-W44 HydrophobicContact CB-CG 4.2Å; R41-W44 VanDerWaalsContact O-CB 3.23Å; R41-W44 WeakPolarHBondContact O-CB 3.33Å; R41-W44 PolarHBondContact O-N 3.07Å
42	V	67	Low	83.2	Confident	114 Å²	114	65.8 Å²	65.8	69%	0.691	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	132.6	176.5	-170.6	0	0	0	0	110.2	Q38 W44	Q38-V42 PolarHBondContact O-N 3.04Å; V42-W44 VanDerWaalsContact C-N 3.29Å; V42-W44 PolarHBondContact O-N 3.38Å
43	K	73.6	Confident	83.5	Confident	200 Å²	200	60.2 Å²	60.2	87%	0.87	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	15.1	-173	-57.9	178.3	-177.8	-177.8	0	116.7	R41	R41-K43 PolarHBondContact O-N 3.27Å
44	W	85.6	Confident	83.4	Confident	38 Å²	38	60.6 Å²	60.6	14%	0.144	30%	0.297	C	S	.	.			trans	-78.2	139.5	167.8	-178.6	77.7	0	0	0	111.4	V6 F23 V37 Q38 R41 V42 A46	V6-W44 HydrophobicContact CB-CH2 4.17Å; V6-W44 HydrophobicContact CB-CZ2 3.72Å; V6-W44 HydrophobicContact CG1-CZ2 4.03Å; V6-W44 HydrophobicContact CG2-CH2 3.61Å; V6-W44 HydrophobicContact CG2-CZ2 3.72Å; V6-W44 HydrophobicContact CG2-CZ3 4.44Å; F23-W44 HydrophobicContact CE1-CH2 4.28Å; F23-W44 HydrophobicContact CE1-CZ3 4.37Å; F23-W44 HydrophobicContact CE2-CH2 4.34Å; F23-W44 AromaticContact CZ-CH2 3.7Å; F23-W44 HydrophobicContact CZ-CH2 3.7Å; F23-W44 AromaticContact CZ-CZ3 3.96Å; F23-W44 HydrophobicContact CZ-CZ3 3.96Å; V37-W44 HydrophobicContact CB-CE3 3.71Å; V37-W44 HydrophobicContact CB-CH2 4.45Å; V37-W44 HydrophobicContact CB-CZ3 3.58Å; V37-W44 HydrophobicContact CG1-CD2 3.87Å; V37-W44 HydrophobicContact CG1-CE3 3.36Å; V37-W44 HydrophobicContact CG1-CH2 4.22Å; V37-W44 HydrophobicContact CG1-CZ3 3.56Å; V37-W44 HydrophobicContact CG2-CZ3 4Å; Q38-W44 VanDerWaalsContact CG-O 3.23Å; Q38-W44 WeakPolarHBondContact CG-O 3.28Å; Q38-W44 PolarHBondContact NE2-O 2.71Å; R41-W44 HydrophobicContact CB-CB 3.55Å; R41-W44 HydrophobicContact CB-CG 4.2Å; R41-W44 VanDerWaalsContact O-CB 3.23Å; R41-W44 WeakPolarHBondContact O-CB 3.33Å; R41-W44 PolarHBondContact O-N 3.07Å; V42-W44 VanDerWaalsContact C-N 3.29Å; V42-W44 PolarHBondContact O-N 3.38Å; W44-A46 VanDerWaalsContact CH2-CA 3.49Å; W44-A46 HydrophobicContact CH2-CB 3.68Å; W44-A46 HydrophobicContact CZ3-CB 3.71Å
45	V	85.3	Confident	83.3	Confident	99 Å²	99	63.5 Å²	63.5	60%	0.6	31%	0.31	S	S	*	.			trans	-116.3	135.2	178.8	179.4	0	0	0	0	108.8	E34	E34-V45 WeakPolarHBondContact OE1-CA 3.41Å
46	A	87.3	Confident	83.5	Confident	11 Å²	11	57.2 Å²	57.2	9%	0.091	28%	0.283	C	S	.	.			trans	-77	150.1	178.9	0	0	0	0	0	111.8	F23 F30 E34 W44	F23-A46 HydrophobicContact CD1-CB 3.94Å; F23-A46 HydrophobicContact CE1-CB 3.51Å; F23-A46 HydrophobicContact CZ-CB 4.22Å; F30-A46 HydrophobicContact CE1-CB 3.64Å; F30-A46 HydrophobicContact CE2-CB 4.4Å; F30-A46 HydrophobicContact CZ-CB 3.51Å; E34-A46 HydrophobicContact CB-CB 3.81Å; E34-A46 HydrophobicContact CG-CB 3.78Å; E34-A46 PolarHBondContact OE1-N 3.02Å; W44-A46 VanDerWaalsContact CH2-CA 3.49Å; W44-A46 HydrophobicContact CH2-CB 3.68Å; W44-A46 HydrophobicContact CZ3-CB 3.71Å
47	T	87.8	Confident	83.9	Confident	74 Å²	74	56.6 Å²	56.6	45%	0.454	28%	0.28	S	S	.	.			trans	-121.8	158.8	173.8	66.4	0	0	0	0	109.8	F49 S50	T47-F49 PolarHBondContact O-N 3.06Å; T47-F49 PolarHBondContact OG1-N 3.26Å; T47-S50 PolarHBondContact N-OG 3.17Å; T47-S50 VanDerWaalsContact O-CB 3.23Å; T47-S50 WeakPolarHBondContact O-CB 3.5Å; T47-S50 PolarHBondContact O-N 3.05Å; T47-S50 PolarHBondContact O-OG 3.48Å; T47-S50 PolarHBondContact OG1-N 3.35Å; T47-S50 PolarHBondContact OG1-OG 3.11Å
48	S	79.8	Confident	83.7	Confident	72 Å²	72	57 Å²	57	50%	0.503	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-5.9	172.7	62.8	0	0	0	0	113.9	R22	R22-S48 PolarHBondContact NE-O 2.87Å; R22-S48 PolarHBondContact NH2-O 2.63Å
49	F	84.8	Confident	83.6	Confident	123 Å²	123	63.2 Å²	63.2	54%	0.539	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	8	173.3	-58.5	-79.3	0	0	0	113.3	T47 H51	T47-F49 PolarHBondContact O-N 3.06Å; T47-F49 PolarHBondContact OG1-N 3.26Å; F49-H51 PolarHBondContact O-CE1 2.81Å; F49-H51 PolarHBondContact O-ND1 2.78Å
50	S	92	Very high	84.1	Confident	5 Å²	5	61.4 Å²	61.4	4%	0.035	31%	0.309	C	S	.	.			trans	-72.2	141.2	175.2	-65.8	0	0	0	0	111.1	F23 T47	F23-S50 VanDerWaalsContact CD2-O 3.32Å; F23-S50 WeakPolarHBondContact CD2-O 3.38Å; F23-S50 PolarHBondContact N-O 2.66Å; F23-S50 VanDerWaalsContact N-O 3.13Å; T47-S50 PolarHBondContact N-OG 3.17Å; T47-S50 VanDerWaalsContact O-CB 3.23Å; T47-S50 WeakPolarHBondContact O-CB 3.5Å; T47-S50 PolarHBondContact O-N 3.05Å; T47-S50 PolarHBondContact O-OG 3.48Å; T47-S50 PolarHBondContact OG1-N 3.35Å; T47-S50 PolarHBondContact OG1-OG 3.11Å
51	H	93.3	Very high	85	Confident	18 Å²	18	63.9 Å²	63.9	8%	0.083	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.2	-177.4	-68.5	79.7	0	0	0	111	Y3 C5 V6 L20 F21 R22 F49	Y3-H51 AromaticContact CD1-CE1 3.54Å; Y3-H51 AromaticContact CD1-ND1 3.7Å; Y3-H51 AromaticContact CE1-CE1 3.87Å; Y3-H51 AromaticContact CG-CE1 3.67Å; Y3-H51 AromaticContact CG-ND1 3.89Å; C5-H51 WeakPolarHBondContact CA-O 3.44Å; V6-H51 WeakPolarHBondContact CG2-O 3.27Å; V6-H51 PolarHBondContact N-O 2.71Å; L20-H51 HydrophobicContact CB-CB 4.45Å; F21-H51 CarbonylContact O-C 3.53Å; F21-H51 WeakPolarHBondContact O-CA 3.24Å; R22-H51 PolarHBondContact N-CD2 2.87Å; F49-H51 PolarHBondContact O-CE1 2.81Å; F49-H51 PolarHBondContact O-ND1 2.78Å
52	L	92.1	Very high	85.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.5	171.7	-72.6	170.1	0	0	0	110.1	V6 A7 F21 F23 W33 V37 F57 P79 F82	V6-L52 HydrophobicContact CG2-CD2 3.72Å; V6-L52 HydrophobicContact CG2-CG 4.13Å; A7-L52 HydrophobicContact CB-CD2 3.81Å; F21-L52 PolarHBondContact N-O 3.06Å; F21-L52 PolarHBondContact O-N 2.94Å; F23-L52 HydrophobicContact CE2-CD1 4.02Å; F23-L52 HydrophobicContact CE2-CG 4Å; F23-L52 HydrophobicContact CZ-CD1 4.34Å; W33-L52 HydrophobicContact CE3-CD1 4Å; V37-L52 HydrophobicContact CG2-CD1 3.91Å; V37-L52 HydrophobicContact CG2-CD2 3.96Å; V37-L52 HydrophobicContact CG2-CG 4.39Å; L52-F57 HydrophobicContact CB-CE2 3.96Å; L52-F57 HydrophobicContact CB-CZ 4.19Å; L52-P79 HydrophobicContact CD1-CB 3.66Å; L52-P79 HydrophobicContact CD1-CG 3.56Å; L52-F82 HydrophobicContact CD1-CZ 4.24Å; L52-F82 HydrophobicContact CD2-CE1 4.44Å; L52-F82 HydrophobicContact CD2-CZ 4.41Å
53	C	91.7	Very high	86.4	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	158.5	176.7	71.3	0	0	0	0	112.7	C5 C10 V18 T19 L20 E55 H56 F57	C5-C53 HydrophobicContact CB-CB 4.09Å; C5-C53 PolarHBondContact SG-N 3.07Å; C5-C53 VanDerWaalsContact SG-N 3.38Å; C10-C53 VanDerWaalsContact SG-SG 3.68Å; V18-C53 HydrophobicContact CB-CB 3.92Å; V18-C53 HydrophobicContact CG2-CB 3.57Å; T19-C53 CarbonylContact O-C 3.56Å; T19-C53 VanDerWaalsContact O-CA 3.23Å; T19-C53 WeakPolarHBondContact O-CA 3.45Å; L20-C53 HydrophobicContact CD2-CB 3.72Å; C53-E55 PolarHBondContact O-N 2.91Å; C53-H56 PolarHBondContact O-N 3.31Å; C53-H56 PolarHBondContact SG-CD2 2.97Å; C53-F57 WeakPolarHBondContact O-CD2 3.44Å
54	S	90.8	Very high	86.4	Confident	18 Å²	18	55.5 Å²	55.5	13%	0.126	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-53.2	-23.5	179.9	50.5	0	0	0	0	115.1	T19 H56 F57	T19-S54 PolarHBondContact N-OG 3.46Å; T19-S54 PolarHBondContact O-N 3.45Å; S54-H56 PolarHBondContact O-N 3.01Å; S54-F57 PolarHBondContact O-N 3.04Å
55	E	88.7	Confident	85.2	Confident	93 Å²	93	63.7 Å²	63.7	44%	0.435	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-70.5	-15.7	176.8	-63.8	178.7	179.8	0	0	113.9	K12 V18 C53 F57 V81	K12-E55 IonicContact NZ-OE1 3.16Å; K12-E55 PolarHBondContact NZ-OE1 2.86Å; K12-E55 IonicContact NZ-OE2 3.89Å; K12-E55 PolarHBondContact NZ-OE2 2.86Å; V18-E55 HydrophobicContact CG1-CG 4.07Å; C53-E55 PolarHBondContact O-N 2.91Å; E55-F57 VanDerWaalsContact C-N 3.33Å; E55-V81 WeakPolarHBondContact O-CB 3.25Å; E55-V81 WeakPolarHBondContact O-CG1 3.45Å
56	H	89.7	Confident	83.8	Confident	17 Å²	17	64.8 Å²	64.8	8%	0.079	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-88.1	2.7	178.3	-64.9	-60.3	0	0	0	114	C5 A7 C10 C53 S54 P79 T80 V81	C5-H56 PolarHBondContact SG-CD2 3.01Å; C5-H56 PolarHBondContact SG-NE2 2.57Å; A7-H56 VanDerWaalsContact CB-CE1 3.48Å; A7-H56 WeakPolarHBondContact CB-CE1 3.35Å; A7-H56 VanDerWaalsContact CB-NE2 3.34Å; A7-H56 WeakPolarHBondContact CB-NE2 3.18Å; C10-H56 PolarHBondContact SG-NE2 3.44Å; C53-H56 PolarHBondContact O-N 3.31Å; C53-H56 PolarHBondContact SG-CD2 2.97Å; S54-H56 PolarHBondContact O-N 3.01Å; H56-P79 HydrophobicContact CB-CB 4.34Å; H56-P79 CarbonylContact O-C 3.27Å; H56-P79 VanDerWaalsContact O-CA 3.23Å; H56-P79 WeakPolarHBondContact O-CA 3.39Å; H56-T80 PolarHBondContact O-N 3.44Å; H56-V81 PolarHBondContact ND1-O 2.83Å; H56-V81 PolarHBondContact O-N 2.95Å
57	F	91.3	Very high	82.1	Confident	9 Å²	9	70.8 Å²	70.8	4%	0.039	36%	0.356	C	S	.	.	S	Bend	trans	-117.2	140.6	-180	-59	-96	0	0	0	109.8	F21 W33 L52 C53 S54 E55 F62 L73 A78 P79	F21-F57 HydrophobicContact CB-CZ 4.49Å; F21-F57 HydrophobicContact CD2-CD2 4.23Å; F21-F57 AromaticContact CD2-CE2 3.86Å; F21-F57 HydrophobicContact CD2-CE2 3.86Å; F21-F57 HydrophobicContact CD2-CZ 4.46Å; W33-F57 HydrophobicContact CE3-CZ 4.26Å; W33-F57 AromaticContact CH2-CE1 3.75Å; W33-F57 HydrophobicContact CH2-CE1 3.75Å; W33-F57 AromaticContact CH2-CZ 3.45Å; W33-F57 HydrophobicContact CH2-CZ 3.45Å; W33-F57 VanDerWaalsContact CH2-CZ 3.45Å; W33-F57 AromaticContact CZ2-CE1 3.59Å; W33-F57 HydrophobicContact CZ2-CE1 3.59Å; W33-F57 AromaticContact CZ2-CZ 3.81Å; W33-F57 HydrophobicContact CZ2-CZ 3.81Å; W33-F57 HydrophobicContact CZ3-CE1 4.32Å; W33-F57 AromaticContact CZ3-CZ 3.7Å; W33-F57 HydrophobicContact CZ3-CZ 3.7Å; L52-F57 HydrophobicContact CB-CE2 3.96Å; L52-F57 HydrophobicContact CB-CZ 4.19Å; C53-F57 WeakPolarHBondContact O-CD2 3.44Å; S54-F57 PolarHBondContact O-N 3.04Å; E55-F57 VanDerWaalsContact C-N 3.33Å; F57-F62 HydrophobicContact CB-CE2 3.85Å; F57-F62 HydrophobicContact CB-CZ 3.77Å; F57-F62 HydrophobicContact CG-CZ 4.44Å; F57-L73 HydrophobicContact CB-CD2 4.16Å; F57-L73 HydrophobicContact CD1-CD1 3.95Å; F57-L73 HydrophobicContact CD1-CD2 3.74Å; F57-L73 HydrophobicContact CE1-CD1 3.61Å; F57-L73 HydrophobicContact CE1-CD2 4.28Å; F57-L73 HydrophobicContact CE2-CD1 4.39Å; F57-L73 HydrophobicContact CG-CD1 4.49Å; F57-L73 HydrophobicContact CG-CD2 3.88Å; F57-L73 HydrophobicContact CZ-CD1 3.86Å; F57-A78 WeakPolarHBondContact CD1-O 3.26Å; F57-P79 HydrophobicContact CD1-CB 4.17Å; F57-P79 HydrophobicContact CE1-CB 3.75Å; F57-P79 HydrophobicContact CE1-CG 4.32Å; F57-P79 HydrophobicContact CE2-CB 4.34Å; F57-P79 HydrophobicContact CZ-CB 3.83Å; F57-P79 HydrophobicContact CZ-CG 4.47Å
58	G	79.4	Confident	80.7	Confident	9 Å²	9	71.2 Å²	71.2	9%	0.093	36%	0.362	C	S	.	.			trans	-63.6	157	168.8	0	0	0	0	0	112.1	E60 Y61 F62 T80	G58-E60 WeakPolarHBondContact CA-OE1 3.2Å; G58-E60 VanDerWaalsContact CA-OE2 3.3Å; G58-E60 WeakPolarHBondContact CA-OE2 3.25Å; G58-E60 PolarHBondContact O-N 2.8Å; G58-Y61 PolarHBondContact O-N 2.89Å; G58-F62 WeakPolarHBondContact O-CD2 3.23Å; G58-F62 WeakPolarHBondContact O-CE2 3.27Å; G58-T80 PolarHBondContact N-OG1 2.83Å
59	K	82.1	Confident	79.9	Confident	190 Å²	190	71.1 Å²	71.1	83%	0.826	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-64.1	-32.7	-176.6	-71	-179.4	179.7	175.8	0	112.3	Y61 F62	K59-Y61 PolarHBondContact O-N 2.85Å; K59-F62 PolarHBondContact O-N 3.48Å
60	E	80.8	Confident	79.1	Confident	121 Å²	121	69.8 Å²	69.8	57%	0.565	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-59	-27.1	177	65.2	-78	-177.2	0	0	113.7	G58 F62 R74	G58-E60 WeakPolarHBondContact CA-OE1 3.2Å; G58-E60 VanDerWaalsContact CA-OE2 3.3Å; G58-E60 WeakPolarHBondContact CA-OE2 3.25Å; G58-E60 PolarHBondContact O-N 2.8Å; E60-F62 VanDerWaalsContact C-N 3.29Å; E60-F62 PolarHBondContact O-N 2.97Å; E60-R74 PolarHBondContact O-NE 3.43Å
61	Y	86.4	Confident	78.6	Confident	58 Å²	58	72.9 Å²	72.9	23%	0.227	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-81.2	-4.9	-179.5	-66.6	-70.7	0	0	0	114.2	G58 K59 L73 R74 A77 T80	G58-Y61 PolarHBondContact O-N 2.89Å; K59-Y61 PolarHBondContact O-N 2.85Å; Y61-L73 CarbonylContact O-C 3.03Å; Y61-L73 WeakPolarHBondContact O-CA 3.32Å; Y61-R74 PolarHBondContact O-N 2.74Å; Y61-A77 HydrophobicContact CD1-CB 3.76Å; Y61-A77 HydrophobicContact CG-CB 4.16Å; Y61-T80 HydrophobicContact CE2-CG2 3.78Å
62	F	87.8	Confident	78.2	Confident	24 Å²	24	77.8 Å²	77.8	11%	0.105	41%	0.411	C	S	.	.	B	Isolated β-bridge	trans	-95.4	144.3	178	-63.9	-79.5	0	0	0	111.9	F21 F57 G58 K59 E60 L71 K72 L73 R74	F21-F62 AromaticContact CE2-CE1 3.74Å; F21-F62 HydrophobicContact CE2-CE1 3.74Å; F21-F62 HydrophobicContact CE2-CZ 4.32Å; F21-F62 AromaticContact CZ-CE1 3.77Å; F21-F62 HydrophobicContact CZ-CE1 3.77Å; F57-F62 HydrophobicContact CB-CE2 3.85Å; F57-F62 HydrophobicContact CB-CZ 3.77Å; F57-F62 HydrophobicContact CG-CZ 4.44Å; G58-F62 WeakPolarHBondContact O-CD2 3.23Å; G58-F62 WeakPolarHBondContact O-CE2 3.27Å; K59-F62 PolarHBondContact O-N 3.48Å; E60-F62 VanDerWaalsContact C-N 3.29Å; E60-F62 PolarHBondContact O-N 2.97Å; F62-L71 HydrophobicContact CD1-CB 3.9Å; F62-L71 HydrophobicContact CD1-CD2 4.12Å; F62-L71 HydrophobicContact CD1-CG 4.41Å; F62-L71 HydrophobicContact CE1-CB 3.93Å; F62-L71 HydrophobicContact CE1-CD1 4.14Å; F62-L71 HydrophobicContact CE1-CG 4.44Å; F62-L71 HydrophobicContact CG-CD2 4.42Å; F62-L71 HydrophobicContact CZ-CD1 4.48Å; F62-K72 WeakPolarHBondContact CA-O 3.44Å; F62-L73 HydrophobicContact CD1-CD2 3.83Å; F62-L73 HydrophobicContact CE1-CD2 3.55Å; F62-L73 HydrophobicContact CE1-CG 4.33Å; F62-L73 HydrophobicContact CG-CD2 4.47Å; F62-L73 HydrophobicContact CZ-CD2 3.97Å; F62-R74 VanDerWaalsContact O-CZ 3.26Å; F62-R74 PolarHBondContact O-NE 2.9Å; F62-R74 PolarHBondContact O-NH2 3.05Å
63	E	83.9	Confident	78	Confident	61 Å²	61	79.1 Å²	79.1	29%	0.285	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-67.9	147.4	167.9	-68	174.9	179.3	0	0	110.7	K72 R74	E63-K72 PolarHBondContact N-O 3.1Å; E63-K72 IonicContact OE1-NZ 3.53Å; E63-K72 PolarHBondContact OE1-NZ 3.47Å; E63-K72 VanDerWaalsContact OE2-CD 3.22Å; E63-K72 WeakPolarHBondContact OE2-CD 3.42Å; E63-K72 VanDerWaalsContact OE2-CG 3.31Å; E63-K72 WeakPolarHBondContact OE2-CG 3.26Å; E63-K72 IonicContact OE2-NZ 2.72Å; E63-K72 PolarHBondContact OE2-NZ 3.01Å; E63-R74 HydrophobicContact CG-CG 3.81Å
64	D	73.8	Confident	77.7	Confident	126 Å²	126	83.8 Å²	83.8	67%	0.674	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-64.1	148.9	-178.3	-63.1	-71.8	0	0	0	111.8	M66 R74	D64-M66 PolarHBondContact O-N 3.07Å; D64-R74 IonicContact OD1-NH2 3.66Å; D64-R74 IonicContact OD2-CZ 2.65Å; D64-R74 IonicContact OD2-NH1 2.71Å; D64-R74 IonicContact OD2-NH2 2.71Å; D64-R74 PolarHBondContact OD2-NH2 2.93Å
65	K	61.4	Low	77.2	Confident	209 Å²	209	88.9 Å²	88.9	91%	0.909	47%	0.468	S	S	*	.			trans	-58.1	102.7	-157.6	-75.6	-177.7	176.7	176	0	114.4
66	M	56	Low	76.7	Confident	123 Å²	123	86.9 Å²	86.9	61%	0.606	47%	0.472	S	S	*	.			trans	-61.6	144.7	164.1	-78	-75.1	-84.8	0	0	111.7	D64 S68 G69	D64-M66 PolarHBondContact O-N 3.07Å; M66-S68 PolarHBondContact O-N 2.76Å; M66-G69 PolarHBondContact O-N 3.04Å; M66-G69 VanDerWaalsContact O-N 3.14Å
67	P	50.6	Low	76.5	Confident	136 Å²	136	86.3 Å²	86.3	88%	0.883	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-19	-179.7	-26.8	35.3	0	0	0	115.5	G69	P67-G69 VanDerWaalsContact C-N 3.27Å; P67-G69 PolarHBondContact O-N 3.02Å
68	S	59.4	Low	76.2	Confident	83 Å²	83	86.6 Å²	86.6	58%	0.58	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-3.8	179.3	59.9	0	0	0	0	114.6	M66 T70	M66-S68 PolarHBondContact O-N 2.76Å; S68-T70 PolarHBondContact O-N 3.15Å; S68-T70 PolarHBondContact O-OG1 3.45Å
69	G	61.6	Low	76.5	Confident	70 Å²	70	86.2 Å²	86.2	72%	0.722	47%	0.471	S	S	*	.			trans	65.3	3.7	178.8	0	0	0	0	0	115.5	M66 P67	M66-G69 PolarHBondContact O-N 3.04Å; M66-G69 VanDerWaalsContact O-N 3.14Å; P67-G69 VanDerWaalsContact C-N 3.27Å; P67-G69 PolarHBondContact O-N 3.02Å
70	T	68.6	Low	76.2	Confident	95 Å²	95	78.8 Å²	78.8	58%	0.583	44%	0.442	S	S	*	.			trans	-84.9	123.7	-179.7	-57	0	0	0	0	109.8	S68	S68-T70 PolarHBondContact O-N 3.15Å; S68-T70 PolarHBondContact O-OG1 3.45Å
71	L	81.1	Confident	76.1	Confident	70 Å²	70	75.9 Å²	75.9	37%	0.366	43%	0.432	S	S	.	.			trans	-71.3	131.4	175.8	-67.5	175	0	0	0	110.7	F21 F62	F21-L71 WeakPolarHBondContact CE1-O 3.37Å; F21-L71 HydrophobicContact CZ-CB 4Å; F21-L71 WeakPolarHBondContact CZ-O 3.3Å; F62-L71 HydrophobicContact CD1-CB 3.9Å; F62-L71 HydrophobicContact CD1-CD2 4.12Å; F62-L71 HydrophobicContact CD1-CG 4.41Å; F62-L71 HydrophobicContact CE1-CB 3.93Å; F62-L71 HydrophobicContact CE1-CD1 4.14Å; F62-L71 HydrophobicContact CE1-CG 4.44Å; F62-L71 HydrophobicContact CG-CD2 4.42Å; F62-L71 HydrophobicContact CZ-CD1 4.48Å
72	K	85.6	Confident	75.6	Confident	121 Å²	121	74.7 Å²	74.7	53%	0.526	43%	0.428	S	S	.	.			trans	-127.4	136.6	175.3	-178.2	162.4	167.3	-87.1	0	109.5	F62 E63	F62-K72 WeakPolarHBondContact CA-O 3.44Å; E63-K72 PolarHBondContact N-O 3.1Å; E63-K72 IonicContact OE1-NZ 3.53Å; E63-K72 PolarHBondContact OE1-NZ 3.47Å; E63-K72 VanDerWaalsContact OE2-CD 3.22Å; E63-K72 WeakPolarHBondContact OE2-CD 3.42Å; E63-K72 VanDerWaalsContact OE2-CG 3.31Å; E63-K72 WeakPolarHBondContact OE2-CG 3.26Å; E63-K72 IonicContact OE2-NZ 2.72Å; E63-K72 PolarHBondContact OE2-NZ 3.01Å
73	L	86.9	Confident	74.4	Confident	28 Å²	28	79.3 Å²	79.3	15%	0.147	46%	0.458	C	S	.	.	B	Isolated β-bridge	trans	-85	141.8	178.7	-67.3	172.1	0	0	0	110.6	F21 W33 F57 Y61 F62 A77	F21-L73 HydrophobicContact CB-CD1 4.05Å; F21-L73 HydrophobicContact CD1-CD1 3.81Å; F21-L73 HydrophobicContact CD1-CG 4.03Å; F21-L73 HydrophobicContact CD2-CD1 3.93Å; F21-L73 HydrophobicContact CD2-CG 4.31Å; F21-L73 HydrophobicContact CE1-CD1 4.28Å; F21-L73 HydrophobicContact CE1-CG 3.99Å; F21-L73 HydrophobicContact CE2-CD1 4.38Å; F21-L73 HydrophobicContact CE2-CG 4.26Å; F21-L73 HydrophobicContact CG-CD1 3.62Å; F21-L73 HydrophobicContact CG-CG 4.2Å; F21-L73 HydrophobicContact CZ-CG 4.11Å; W33-L73 HydrophobicContact CH2-CD1 3.78Å; W33-L73 HydrophobicContact CZ2-CD1 3.9Å; F57-L73 HydrophobicContact CB-CD2 4.16Å; F57-L73 HydrophobicContact CD1-CD1 3.95Å; F57-L73 HydrophobicContact CD1-CD2 3.74Å; F57-L73 HydrophobicContact CE1-CD1 3.61Å; F57-L73 HydrophobicContact CE1-CD2 4.28Å; F57-L73 HydrophobicContact CE2-CD1 4.39Å; F57-L73 HydrophobicContact CG-CD1 4.49Å; F57-L73 HydrophobicContact CG-CD2 3.88Å; F57-L73 HydrophobicContact CZ-CD1 3.86Å; Y61-L73 CarbonylContact O-C 3.03Å; Y61-L73 WeakPolarHBondContact O-CA 3.32Å; F62-L73 HydrophobicContact CD1-CD2 3.83Å; F62-L73 HydrophobicContact CE1-CD2 3.55Å; F62-L73 HydrophobicContact CE1-CG 4.33Å; F62-L73 HydrophobicContact CG-CD2 4.47Å; F62-L73 HydrophobicContact CZ-CD2 3.97Å; L73-A77 HydrophobicContact CB-CB 3.92Å; L73-A77 HydrophobicContact CD1-CB 4.48Å; L73-A77 HydrophobicContact CD2-CB 4.21Å; L73-A77 HydrophobicContact CG-CB 4.43Å
74	R	86.1	Confident	73.2	Confident	99 Å²	99	80.4 Å²	80.4	37%	0.374	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-68.8	154.1	170.5	-60.4	-177.3	-166.4	-114.3	-7.3	110.3	E60 Y61 F62 E63 D64 A77	E60-R74 PolarHBondContact O-NE 3.43Å; Y61-R74 PolarHBondContact O-N 2.74Å; F62-R74 VanDerWaalsContact O-CZ 3.26Å; F62-R74 PolarHBondContact O-NE 2.9Å; F62-R74 PolarHBondContact O-NH2 3.05Å; E63-R74 HydrophobicContact CG-CG 3.81Å; D64-R74 IonicContact OD1-NH2 3.66Å; D64-R74 IonicContact OD2-CZ 2.65Å; D64-R74 IonicContact OD2-NH1 2.71Å; D64-R74 IonicContact OD2-NH2 2.71Å; D64-R74 PolarHBondContact OD2-NH2 2.93Å; R74-A77 WeakPolarHBondContact O-CB 3.45Å; R74-A77 PolarHBondContact O-N 3.31Å
75	P	80.4	Confident	72.2	Confident	124 Å²	124	78.5 Å²	78.5	81%	0.805	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	146.1	169.5	-23.8	34.5	0	0	0	111.8	A77	P75-A77 PolarHBondContact O-N 3.47Å
76	G	78.8	Confident	71.7	Confident	51 Å²	51	78 Å²	78	53%	0.526	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	-1.2	-174.9	0	0	0	0	0	115	E29 A78	E29-G76 WeakPolarHBondContact OE1-CA 3.13Å; E29-G76 PolarHBondContact OE1-N 3.07Å; G76-A78 PolarHBondContact O-N 2.82Å
77	A	84.1	Confident	71.5	Confident	6 Å²	6	73.5 Å²	73.5	5%	0.05	44%	0.435	C	S	.	.			trans	-63.4	132.3	-179.3	0	0	0	0	0	112.9	W33 Y61 L73 R74 P75	W33-A77 PolarHBondContact NE1-O 2.89Å; Y61-A77 HydrophobicContact CD1-CB 3.76Å; Y61-A77 HydrophobicContact CG-CB 4.16Å; L73-A77 HydrophobicContact CB-CB 3.92Å; L73-A77 HydrophobicContact CD1-CB 4.48Å; L73-A77 HydrophobicContact CD2-CB 4.21Å; L73-A77 HydrophobicContact CG-CB 4.43Å; R74-A77 WeakPolarHBondContact O-CB 3.45Å; R74-A77 PolarHBondContact O-N 3.31Å; P75-A77 PolarHBondContact O-N 3.47Å
78	A	85.2	Confident	71.9	Confident	15 Å²	15	73.2 Å²	73.2	12%	0.124	44%	0.436	C	S	.	.			trans	-120.9	147.2	175.6	0	0	0	0	0	110.6	F57 G76 T80	F57-A78 WeakPolarHBondContact CD1-O 3.26Å; G76-A78 PolarHBondContact O-N 2.82Å; A78-T80 PolarHBondContact O-N 2.76Å
79	P	85.9	Confident	71.6	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	44%	0.436	C	S	.	.			trans	-72	124.2	170.4	32.1	-35.4	0	0	0	108.9	W33 Q36 L52 H56 F57 F82	W33-P79 HydrophobicContact CB-CG 4.31Å; W33-P79 VanDerWaalsContact CD1-CD 3.46Å; W33-P79 HydrophobicContact CD2-CG 4.14Å; W33-P79 HydrophobicContact CG-CG 4.01Å; Q36-P79 HydrophobicContact CB-CG 4.03Å; Q36-P79 HydrophobicContact CG-CG 4.46Å; Q36-P79 WeakPolarHBondContact CG-O 3.44Å; L52-P79 HydrophobicContact CD1-CB 3.66Å; L52-P79 HydrophobicContact CD1-CG 3.56Å; H56-P79 HydrophobicContact CB-CB 4.34Å; H56-P79 CarbonylContact O-C 3.27Å; H56-P79 VanDerWaalsContact O-CA 3.23Å; H56-P79 WeakPolarHBondContact O-CA 3.39Å; F57-P79 HydrophobicContact CD1-CB 4.17Å; F57-P79 HydrophobicContact CE1-CB 3.75Å; F57-P79 HydrophobicContact CE1-CG 4.32Å; F57-P79 HydrophobicContact CE2-CB 4.34Å; F57-P79 HydrophobicContact CZ-CB 3.83Å; F57-P79 HydrophobicContact CZ-CG 4.47Å; P79-F82 HydrophobicContact CB-CE2 3.71Å; P79-F82 HydrophobicContact CB-CZ 3.96Å; P79-F82 HydrophobicContact CG-CE2 4.07Å; P79-F82 HydrophobicContact CG-CZ 4.21Å
80	T	76.4	Confident	71.6	Confident	35 Å²	35	71 Å²	71	22%	0.215	41%	0.409	C	S	.	.			trans	-118.9	-21.5	-174.5	53.3	0	0	0	0	113.4	H56 G58 Y61 A78 F82	H56-T80 PolarHBondContact O-N 3.44Å; G58-T80 PolarHBondContact N-OG1 2.83Å; Y61-T80 HydrophobicContact CE2-CG2 3.78Å; A78-T80 PolarHBondContact O-N 2.76Å; T80-F82 PolarHBondContact O-N 2.84Å
81	V	77.2	Confident	70.8	Confident	60 Å²	60	70.2 Å²	70.2	36%	0.364	42%	0.42	S	S	.	.			trans	-98.5	83.5	-169.6	-175.1	0	0	0	0	110.7	E55 H56	E55-V81 WeakPolarHBondContact O-CB 3.25Å; E55-V81 WeakPolarHBondContact O-CG1 3.45Å; H56-V81 PolarHBondContact ND1-O 2.83Å; H56-V81 PolarHBondContact O-N 2.95Å
82	F	77	Confident	69.5	Low	33 Å²	33	68.4 Å²	68.4	15%	0.145	42%	0.418	C	S	.	.			trans	-111.8	78.5	179	-74.7	-86.8	0	0	0	112.1	A7 Q36 V37 T40 L52 P79 T80 R84	A7-F82 HydrophobicContact CB-CD1 4.14Å; A7-F82 HydrophobicContact CB-CE1 3.72Å; Q36-F82 HydrophobicContact CB-CD2 4.45Å; Q36-F82 HydrophobicContact CB-CE2 3.71Å; Q36-F82 HydrophobicContact CB-CZ 4.22Å; V37-F82 HydrophobicContact CB-CE1 4.47Å; V37-F82 HydrophobicContact CG2-CE1 4Å; V37-F82 HydrophobicContact CG2-CZ 3.87Å; T40-F82 HydrophobicContact CG2-CB 3.8Å; T40-F82 HydrophobicContact CG2-CD1 4.14Å; T40-F82 HydrophobicContact CG2-CG 4.35Å; L52-F82 HydrophobicContact CD1-CZ 4.24Å; L52-F82 HydrophobicContact CD2-CE1 4.44Å; L52-F82 HydrophobicContact CD2-CZ 4.41Å; P79-F82 HydrophobicContact CB-CE2 3.71Å; P79-F82 HydrophobicContact CB-CZ 3.96Å; P79-F82 HydrophobicContact CG-CE2 4.07Å; P79-F82 HydrophobicContact CG-CZ 4.21Å; T80-F82 PolarHBondContact O-N 2.84Å; F82-R84 PolarHBondContact O-N 2.89Å
83	V	62.5	Low	67.8	Low	120 Å²	120	69.1 Å²	69.1	73%	0.727	43%	0.432	S	S	*	.			trans	-70.4	119.4	173.3	-176.7	0	0	0	0	109.6
84	R	59	Low	66.3	Low	84 Å²	84	69.4 Å²	69.4	32%	0.317	44%	0.442	S	S	.	.			trans	-103.4	110.8	179.9	-159	176.3	-161.8	-140.9	-1.6	109.9	Y8 T40 F82 H86 G92	Y8-R84 HydrophobicContact CD1-CG 4.12Å; Y8-R84 HydrophobicContact CE1-CG 4.24Å; T40-R84 HydrophobicContact CG2-CB 4.33Å; T40-R84 HydrophobicContact CG2-CG 4.32Å; T40-R84 PolarHBondContact O-NH2 3.46Å; F82-R84 PolarHBondContact O-N 2.89Å; R84-H86 PolarHBondContact O-N 2.91Å; R84-G92 PolarHBondContact NH1-O 3.08Å; R84-G92 PolarHBondContact NH2-O 3.27Å
85	P	52.7	Low	65.2	Low	86 Å²	86	66.5 Å²	66.5	56%	0.558	44%	0.437	S	S	*	.			trans	-63.4	128.4	179.6	-22.4	33.8	0	0	0	111.4	C87	P85-C87 PolarHBondContact O-N 3.25Å
86	H	50.1	Low	64.1	Low	198 Å²	198	69.5 Å²	69.5	92%	0.917	44%	0.437	S	S	*	.			trans	-64.6	126.6	175.7	-66.2	-87.1	0	0	0	110.4	R84	R84-H86 PolarHBondContact O-N 2.91Å
87	C	53	Low	63	Low	30 Å²	30	74.1 Å²	74.1	20%	0.203	45%	0.445	C	S	.	.			trans	-118.3	106.9	173.7	176.8	0	0	0	0	109.3	P85 S89 C90 G91	P85-C87 PolarHBondContact O-N 3.25Å; C87-S89 PolarHBondContact O-N 2.85Å; C87-S89 VanDerWaalsContact O-N 3.12Å; C87-C90 PolarHBondContact O-N 3.19Å; C87-G91 PolarHBondContact O-N 3.14Å
88	S	57.4	Low	61.9	Low	129 Å²	129	75.1 Å²	75.1	90%	0.902	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-21.5	176.7	49	0	0	0	0	113.5
89	S	53.9	Low	60.5	Low	84 Å²	84	77.7 Å²	77.7	59%	0.587	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-6.2	-177.9	-34.9	0	0	0	0	115	C87	C87-S89 PolarHBondContact O-N 2.85Å; C87-S89 VanDerWaalsContact O-N 3.12Å
90	C	61.8	Low	59	Low	23 Å²	23	78.7 Å²	78.7	16%	0.155	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-147.9	6.1	-173	73.7	0	0	0	0	117	C87 G92 V93 C95	C87-C90 PolarHBondContact O-N 3.19Å; C90-G92 PolarHBondContact O-N 2.88Å; C90-V93 PolarHBondContact O-N 2.93Å; C90-C95 HydrophobicContact CB-CB 3.88Å
91	G	52.6	Low	57.7	Low	79 Å²	79	81 Å²	81	81%	0.814	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	15.6	173.3	0	0	0	0	0	116.1	C87	C87-G91 PolarHBondContact O-N 3.14Å
92	G	52.1	Low	56.5	Low	31 Å²	31	81.4 Å²	81.4	32%	0.32	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	6.7	-173.2	0	0	0	0	0	115.7	R84 C90	R84-G92 PolarHBondContact NH1-O 3.08Å; R84-G92 PolarHBondContact NH2-O 3.27Å; C90-G92 PolarHBondContact O-N 2.88Å
93	V	50.6	Low	55.4	Low	136 Å²	136	84.2 Å²	84.2	82%	0.824	50%	0.499	S	S	*	.	S	Bend	trans	-80	-28.3	172.3	-170	0	0	0	0	111.4	C90	C90-V93 PolarHBondContact O-N 2.93Å
94	G	54.7	Low	54.9	Low	35 Å²	35	85.3 Å²	85.3	36%	0.361	49%	0.49	S	S	.	.			trans	99	137	176.7	0	0	0	0	0	113.3
95	C	63.3	Low	54.3	Low	38 Å²	38	91 Å²	91	26%	0.257	51%	0.512	S	S	.	.			trans	-135.8	169.1	-179.1	75.2	0	0	0	0	112.2	C90 Q97 C98	C90-C95 HydrophobicContact CB-CB 3.88Å; C95-Q97 PolarHBondContact O-N 3.1Å; C95-Q97 VanDerWaalsContact O-N 3.07Å; C95-C98 WeakPolarHBondContact O-CB 3.48Å; C95-C98 PolarHBondContact O-N 3.06Å
96	K	58	Low	53.7	Low	187 Å²	187	89.8 Å²	89.8	81%	0.813	51%	0.509	S	S	*	.	G	3₁₀ helix	trans	-56.9	-25.9	-178	-64	-174.9	179.5	-178.4	0	114.1
97	Q	55.4	Low	53	Low	148 Å²	148	84.2 Å²	84.2	69%	0.692	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-78.7	-19.3	176.7	-64.5	-176	-4.4	0	0	113.6	C95 L99	C95-Q97 PolarHBondContact O-N 3.1Å; C95-Q97 VanDerWaalsContact O-N 3.07Å; Q97-L99 VanDerWaalsContact C-N 3.31Å
98	C	60.7	Low	52.3	Low	26 Å²	26	86.6 Å²	86.6	18%	0.176	51%	0.514	C	S	.	.	G	3₁₀ helix	trans	-83.6	-1.8	178.3	-63	0	0	0	0	113.9	Y8 C95	Y8-C98 WeakPolarHBondContact OH-CB 3.3Å; C95-C98 WeakPolarHBondContact O-CB 3.48Å; C95-C98 PolarHBondContact O-N 3.06Å
99	L	56.1	Low	51.4	Low	70 Å²	70	84 Å²	84	37%	0.366	50%	0.501	S	S	.	.	S	Bend	trans	-72.3	143.9	-176	-62.9	176.1	0	0	0	112	Q97 R104	Q97-L99 VanDerWaalsContact C-N 3.31Å; L99-R104 PolarHBondContact O-NE 3.41Å; L99-R104 VanDerWaalsContact O-NE 3.15Å; L99-R104 PolarHBondContact O-NH2 3.14Å
100	P	55.2	Low	50.5	Low	21 Å²	21	88 Å²	88	14%	0.136	51%	0.51	C	S	.	.			trans	-54.7	150.6	178.1	-26.7	35	0	0	0	113.7	I102 Q103 R104	P100-I102 PolarHBondContact O-N 3.07Å; P100-I102 VanDerWaalsContact O-N 3.07Å; P100-Q103 PolarHBondContact O-N 2.66Å; P100-R104 PolarHBondContact O-N 3.44Å
101	S	48.7	Very low	49.2	Very low	82 Å²	82	92.8 Å²	92.8	57%	0.573	54%	0.539	S	S	*	.	H	α-helix	trans	-55.3	-29.9	-175.7	-53.1	0	0	0	0	114.1	R104 R105	S101-R104 PolarHBondContact O-N 2.99Å; S101-R105 PolarHBondContact O-N 2.65Å
102	I	52.1	Low	48.3	Very low	70 Å²	70	93.1 Å²	93.1	36%	0.359	53%	0.534	S	S	.	.	H	α-helix	trans	-62	-42.3	175.2	-92.4	171.1	0	0	0	112.3	H4 T13 P100 R104 R105	H4-I102 HydrophobicContact CB-CD1 4.24Å; T13-I102 HydrophobicContact CG2-CD1 4.27Å; P100-I102 PolarHBondContact O-N 3.07Å; P100-I102 VanDerWaalsContact O-N 3.07Å; I102-R104 VanDerWaalsContact C-N 3.32Å; I102-R104 PolarHBondContact O-N 3.17Å; I102-R105 PolarHBondContact O-N 3.38Å
103	Q	52.9	Low	47.5	Very low	92 Å²	92	100 Å²	100	43%	0.43	56%	0.558	S	S	.	*	H	α-helix	trans	-71.7	-29.8	179.4	-70.1	-176.6	-51.6	0	0	111.9	P100 R105 A106	P100-Q103 PolarHBondContact O-N 2.66Å; Q103-R105 PolarHBondContact O-N 3.36Å; Q103-A106 PolarHBondContact O-N 3.28Å
104	R	52.5	Low	46.7	Very low	142 Å²	142	105.1 Å²	105.1	54%	0.536	56%	0.563	S	S	.	*	H	α-helix	trans	-67.5	-19.5	171.7	-81.3	-179.7	-93.1	-178.4	-9.2	114	L99 P100 S101 I102	L99-R104 PolarHBondContact O-NE 3.41Å; L99-R104 VanDerWaalsContact O-NE 3.15Å; L99-R104 PolarHBondContact O-NH2 3.14Å; P100-R104 PolarHBondContact O-N 3.44Å; S101-R104 PolarHBondContact O-N 2.99Å; I102-R104 VanDerWaalsContact C-N 3.32Å; I102-R104 PolarHBondContact O-N 3.17Å
105	R	45.8	Very low	45.4	Very low	203 Å²	203	114.9 Å²	114.9	77%	0.766	59%	0.589	S	S	*	*	H	α-helix	trans	-79.8	-29.4	172.7	-69.2	-177.8	-179.2	170.3	1.7	112.9	S101 I102 Q103	S101-R105 PolarHBondContact O-N 2.65Å; I102-R105 PolarHBondContact O-N 3.38Å; Q103-R105 PolarHBondContact O-N 3.36Å
106	A	41.6	Very low	43.7	Very low	61 Å²	61	120.8 Å²	120.8	50%	0.504	62%	0.617	S	S	.	*	H	α-helix	trans	-69.3	-47.2	179	0	0	0	0	0	112.4	Q103 A108 A109	Q103-A106 PolarHBondContact O-N 3.28Å; A106-A108 PolarHBondContact O-N 2.71Å; A106-A109 PolarHBondContact O-N 2.92Å; A106-A109 VanDerWaalsContact O-N 3.09Å
107	S	34.8	Very low	42.2	Very low	82 Å²	82	117.8 Å²	117.8	57%	0.573	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-13.2	-175.3	-51.3	0	0	0	0	115.3	A109 T111	S107-A109 VanDerWaalsContact C-N 3.35Å; S107-T111 PolarHBondContact O-OG1 2.92Å
108	A	38	Very low	40.9	Very low	79 Å²	79	113.9 Å²	113.9	65%	0.653	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-11.8	176.8	0	0	0	0	0	113.8	A106	A106-A108 PolarHBondContact O-N 2.71Å
109	A	38.6	Very low	39.4	Very low	76 Å²	76	122.3 Å²	122.3	63%	0.628	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-28.9	-178.8	0	0	0	0	0	113.8	A106 S107	A106-A109 PolarHBondContact O-N 2.92Å; A106-A109 VanDerWaalsContact O-N 3.09Å; S107-A109 VanDerWaalsContact C-N 3.35Å
110	E	35.4	Very low	38	Very low	166 Å²	166	127.7 Å²	127.7	78%	0.776	68%	0.679	S	S	*	*	S	Bend	trans	-101.2	3.5	-170.7	-65	-179.7	132.4	0	0	114.4
111	T	33.3	Very low	36.8	Very low	124 Å²	124	136.8 Å²	136.8	76%	0.761	72%	0.717	S	S	*	*	S	Bend	trans	-98	8.1	178.5	30.9	0	0	0	0	114.4	S107	S107-T111 PolarHBondContact O-OG1 2.92Å
112	A	34.9	Very low	35.6	Very low	87 Å²	87	136.2 Å²	136.2	72%	0.719	72%	0.723	S	S	*	*	S	Bend	trans	-88.5	-25.9	172.1	0	0	0	0	0	113.6
113	E	35	Very low	34.4	Very low	176 Å²	176	140.7 Å²	140.7	82%	0.822	74%	0.74	S	S	*	*	S	Bend	trans	-106.8	49.2	-167.5	-63.9	-164.3	153.1	0	0	114.7
114	R	33.4	Very low	33.1	Very low	242 Å²	242	142.6 Å²	142.6	91%	0.913	75%	0.749	S	S	*	*	S	Bend	trans	-164.4	56.4	163.6	-115.7	161	-168.9	-157.4	1.6	115.5
115	R	27.8	Very low	31.8	Very low	241 Å²	241	142.3 Å²	142.3	91%	0.909	76%	0.758	S	S	*	*	S	Bend	trans	-163.4	62.9	165.4	-114.2	168.5	-159	-166.7	4.4	115.2
116	N	27.8	Very low	30.9	Very low	161 Å²	161	140.7 Å²	140.7	86%	0.861	76%	0.759	S	S	*	*			trans	-175.9	115.2	133.4	-102.7	2.9	0	0	0	112.1
117	S	27.1	Very low	30.2	Very low	125 Å²	125	145.5 Å²	145.5	87%	0.874	77%	0.771	S	S	*	*			trans	-99.4	109.8	153	50.7	0	0	0	0	106.7
118	G	27.9	Very low	29.8	Very low	65 Å²	65	147.5 Å²	147.5	67%	0.67	78%	0.776	S	S	*	*			trans	-166	51.9	-164.5	0	0	0	0	0	115.7
119	E	28.1	Very low	29.3	Very low	204 Å²	204	150.1 Å²	150.1	95%	0.953	78%	0.779	S	S	*	*			trans	64.1	169.6	159.6	-56.9	-164.4	112.8	0	0	119.9
120	H	27.4	Very low	28.7	Very low	183 Å²	183	154.4 Å²	154.4	85%	0.847	79%	0.789	S	S	*	*			trans	-101.4	147.1	-166.8	-91.2	-79.7	0	0	0	114.3
121	K	28.9	Very low	28.4	Very low	212 Å²	212	157.2 Å²	157.2	92%	0.922	79%	0.793	S	S	*	*			trans	137.4	132.5	147.7	-77	156.8	-174.8	173.5	0	109.5
122	G	25.1	Very low	28	Very low	69 Å²	69	159.4 Å²	159.4	71%	0.711	79%	0.792	S	S	*	*			cis	157.3	165.6	-4.8	0	0	0	0	0	110.6
123	K	26.9	Very low	27.5	Very low	164 Å²	164	162.8 Å²	162.8	71%	0.713	79%	0.793	S	S	*	*			trans	71.9	129.5	174.6	-67.6	-175	153.8	-74.8	0	114.6
124	E	24.7	Very low	26.9	Very low	133 Å²	133	158.4 Å²	158.4	62%	0.621	79%	0.794	S	S	*	*				72.6	137.3	94.6	-64.8	157	-162.6	0	0	112.7
125	D	26	Very low	26.4	Very low	136 Å²	136	152.2 Å²	152.2	73%	0.727	79%	0.787	S	S	*	*			cis	-157.2	174	5.5	-99.1	-24.5	0	0	0	113.5
126	E	27.4	Very low	26.4	Very low	169 Å²	169	148.5 Å²	148.5	79%	0.79	78%	0.784	S	S	*	*			trans	32.4	125.2	148.5	-68.2	-169	146	0	0	125.4
127	E	26	Very low	27	Very low	161 Å²	161	145.7 Å²	145.7	75%	0.752	78%	0.775	S	S	*	*				50.8	154.9	122.1	-76.1	-154.9	166.9	0	0	127.1
128	N	26.5	Very low	26.9	Very low	124 Å²	124	148.8 Å²	148.8	66%	0.663	77%	0.773	S	S	*	*			trans	68.6	87.5	148.1	-67.4	-32.4	0	0	0	123.1
129	N	27.5	Very low	26.7	Very low	134 Å²	134	152 Å²	152	72%	0.717	78%	0.779	S	S	*	*				31.1	115	103.8	-178.8	28.1	0	0	0	119.2
130	I	26.5	Very low	26.8	Very low	167 Å²	167	153 Å²	153	86%	0.856	77%	0.774	S	S	*	*			trans	-157.9	157.3	142.5	-109.9	156.9	0	0	0	111.6
131	R	28.6	Very low	26.8	Very low	224 Å²	224	151.2 Å²	151.2	85%	0.845	78%	0.776	S	S	*	*			trans	-99.5	141.3	-179.1	-54.2	166.5	176.6	167.1	-3.4	111.6
132	K	24.7	Very low	26.7	Very low	170 Å²	170	147.9 Å²	147.9	74%	0.739	77%	0.765	S	S	*	*				158.4	145.2	118.2	-94.9	-175	158.7	-143.1	0	115.2
133	E	23.4	Very low	26.8	Very low	159 Å²	159	157 Å²	157	74%	0.743	78%	0.778	S	S	*	*			trans	59.8	170	143.4	-68	167.9	-149.4	0	0	120
134	G	22.4	Very low	27	Very low	83 Å²	83	159.5 Å²	159.5	86%	0.856	78%	0.783	S	S	*	*			trans	106.2	89.9	176.9	0	0	0	0	0	115
135	C	23	Very low	27.1	Very low	113 Å²	113	161 Å²	161	76%	0.764	79%	0.79	S	S	*	*			trans	-125.9	122.1	176	-167.8	0	0	0	0	111.1
136	L	29.5	Very low	27.3	Very low	162 Å²	162	163.1 Å²	163.1	85%	0.848	79%	0.793	S	S	*	*			trans	66.2	171.1	172.9	-59.5	171.9	0	0	0	115.7
137	P	39.2	Very low	27.7	Very low	102 Å²	102	159.9 Å²	159.9	66%	0.662	80%	0.795	S	S	*	*			cis	-118	170.8	-5.9	28.3	-6.6	0	0	0	113.1
138	K	24.7	Very low	28.3	Very low	191 Å²	191	163.8 Å²	163.8	83%	0.83	80%	0.803	S	S	*	*				176	164.5	75.5	-78.7	178.1	-179.4	170.5	0	107.8
139	V	25.2	Very low	29.1	Very low	131 Å²	131	163.6 Å²	163.6	79%	0.794	81%	0.811	S	S	*	*			cis	-157.1	153.5	-20.7	133.6	0	0	0	0	106.7
140	R	29.7	Very low	30.4	Very low	226 Å²	226	162.3 Å²	162.3	85%	0.853	81%	0.805	S	S	*	*			trans	-99.9	156.2	174.4	-70.9	174.7	169.5	170	-5	112.3
141	V	27.1	Very low	32	Very low	146 Å²	146	155.8 Å²	155.8	89%	0.885	78%	0.778	S	S	*	*			trans	-110.9	97.3	148	-178.6	0	0	0	0	106.3
142	M	27.4	Very low	33.9	Very low	142 Å²	142	150.6 Å²	150.6	70%	0.7	77%	0.773	S	S	*	*				76.1	100.6	77.3	-81.2	-78.3	-166.4	0	0	114.4	R144	M142-R144 HydrophobicContact SD-CB 4.28Å
143	R	26.3	Very low	36.5	Very low	260 Å²	260	145.1 Å²	145.1	98%	0.981	75%	0.752	S	S	*	*				-125.7	146.1	129.3	-153.4	170.2	-174.5	172.2	2	107.2
144	R	30.8	Very low	39	Very low	216 Å²	216	142.7 Å²	142.7	82%	0.815	74%	0.743	S	S	*	*			trans	-127.6	128.5	-149.2	177.3	-169	-168.7	-174.9	5.4	110.7	M142	M142-R144 HydrophobicContact SD-CB 4.28Å
145	E	27.1	Very low	41.9	Very low	165 Å²	165	138.8 Å²	138.8	77%	0.771	70%	0.703	S	S	*	*			trans	-162.8	150.4	139.3	-116.2	-172.6	144.9	0	0	115.5
146	K	29.5	Very low	44.7	Very low	180 Å²	180	137.6 Å²	137.6	78%	0.783	69%	0.686	S	S	*	*			trans	16.1	108.3	170.5	-74.8	164.6	179.5	153.6	0	119.8
147	A	36.3	Very low	47.2	Very low	102 Å²	102	132.8 Å²	132.8	84%	0.843	66%	0.66	S	S	*	*			trans	-64.8	152.8	150.2	0	0	0	0	0	111.3
148	R	39.3	Very low	49.1	Very low	243 Å²	243	131 Å²	131	92%	0.917	65%	0.649	S	S	*	*			trans	-110.5	155.1	159.4	-72.7	-172.5	174.1	-153.6	-1.7	108.5
149	S	42.5	Very low	51.5	Low	119 Å²	119	124.1 Å²	124.1	83%	0.832	63%	0.633	S	S	*	*			trans	-64.9	136.2	177	38.5	0	0	0	0	111.8	G151	S149-G151 PolarHBondContact O-N 2.71Å
150	D	55.9	Low	54	Low	108 Å²	108	121.2 Å²	121.2	58%	0.578	62%	0.615	S	S	*	*			trans	-82.1	70.7	173.7	-156.7	4.5	0	0	0	109.1	F164	D150-F164 VanDerWaalsContact OD1-CB 3.23Å; D150-F164 WeakPolarHBondContact OD1-CB 3.4Å; D150-F164 PolarHBondContact OD1-N 3.33Å
151	G	58.5	Low	56.3	Low	30 Å²	30	114.9 Å²	114.9	31%	0.309	60%	0.603	S	S	.	*			trans	-81.5	162.8	172.4	0	0	0	0	0	111.8	S149 L153	S149-G151 PolarHBondContact O-N 2.71Å; G151-L153 PolarHBondContact O-N 3.39Å; G151-L153 VanDerWaalsContact O-N 3.08Å
152	P	69.8	Low	58.9	Low	114 Å²	114	108.8 Å²	108.8	74%	0.74	57%	0.57	S	S	*	*			trans	-60.8	115.2	176.6	25.6	-33.7	0	0	0	110.5	G162	P152-G162 CarbonylContact C-O 3.56Å; P152-G162 WeakPolarHBondContact CA-O 3.45Å
153	L	78.1	Confident	61.3	Low	55 Å²	55	104.6 Å²	104.6	29%	0.288	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.8	139.4	175.8	-73.5	127.8	0	0	0	109.4	G151 P161 G162 F164 F167	G151-L153 PolarHBondContact O-N 3.39Å; G151-L153 VanDerWaalsContact O-N 3.08Å; L153-P161 CarbonylContact O-C 3.55Å; L153-P161 VanDerWaalsContact O-CA 3.29Å; L153-P161 WeakPolarHBondContact O-CA 3.43Å; L153-G162 PolarHBondContact N-O 3.22Å; L153-G162 PolarHBondContact O-N 2.86Å; L153-F164 HydrophobicContact CD1-CB 3.9Å; L153-F164 HydrophobicContact CD1-CD2 4.26Å; L153-F164 VanDerWaalsContact CD1-N 3.34Å; L153-F167 HydrophobicContact CB-CD1 4.39Å; L153-F167 HydrophobicContact CB-CE1 4.03Å; L153-F167 HydrophobicContact CB-CE2 4.36Å; L153-F167 HydrophobicContact CB-CZ 4.03Å; L153-F167 VanDerWaalsContact O-CZ 3.24Å; L153-F167 WeakPolarHBondContact O-CZ 3.41Å
154	I	77.8	Confident	63.7	Low	109 Å²	109	97.8 Å²	97.8	56%	0.559	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	131.9	179.8	-68.2	175.2	0	0	0	108.7	E156 P161	I154-E156 PolarHBondContact O-N 2.74Å; I154-P161 HydrophobicContact CG1-CB 4.38Å
155	C	82.9	Confident	65.6	Low	1 Å²	1	91.8 Å²	91.8	1%	0.007	52%	0.521	C	S	.	.			trans	-71.1	119.8	-179.2	179.7	0	0	0	0	110.6	M157 C158 G159 T160 F167 F174 C175	C155-M157 PolarHBondContact O-N 3.12Å; C155-C158 PolarHBondContact O-N 3.38Å; C155-G159 PolarHBondContact O-N 3.23Å; C155-T160 PolarHBondContact N-O 2.82Å; C155-F167 HydrophobicContact CB-CE1 4.04Å; C155-F167 HydrophobicContact CB-CZ 3.99Å; C155-F174 VanDerWaalsContact SG-CA 3.59Å; C155-C175 HydrophobicContact CB-CB 4.1Å; C155-C175 PolarHBondContact SG-N 3.06Å; C155-C175 VanDerWaalsContact SG-SG 3.7Å
156	E	81.9	Confident	67.7	Low	87 Å²	87	88.2 Å²	88.2	41%	0.407	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	8.9	-175.3	-62	-179.3	-133.3	0	0	116.1	I154 R173 F174 Y183	I154-E156 PolarHBondContact O-N 2.74Å; E156-R173 PolarHBondContact N-O 3.42Å; E156-R173 WeakPolarHBondContact OE1-CB 3.44Å; E156-R173 WeakPolarHBondContact OE1-CG 3.23Å; E156-R173 IonicContact OE1-CZ 3.42Å; E156-R173 IonicContact OE1-NE 2.94Å; E156-R173 PolarHBondContact OE1-NE 3.26Å; E156-R173 IonicContact OE1-NH2 2.92Å; E156-R173 PolarHBondContact OE1-NH2 3.31Å; E156-R173 IonicContact OE2-CZ 3.09Å; E156-R173 IonicContact OE2-NE 3.18Å; E156-R173 IonicContact OE2-NH2 2.61Å; E156-R173 PolarHBondContact OE2-NH2 2.86Å; E156-F174 HydrophobicContact CB-CD1 4.49Å; E156-F174 HydrophobicContact CB-CE1 4.02Å; E156-Y183 HydrophobicContact CB-CD2 4.15Å; E156-Y183 HydrophobicContact CB-CE2 3.71Å; E156-Y183 WeakPolarHBondContact O-CD2 3.22Å; E156-Y183 WeakPolarHBondContact O-CE2 3.31Å; E156-Y183 PolarHBondContact OE2-OH 2.81Å
157	M	81.2	Confident	70.1	Confident	61 Å²	61	80 Å²	80	30%	0.3	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	-40.3	172.6	-91.2	-53.7	-50.4	0	0	114.2	C155 C179 Y183 N186	C155-M157 PolarHBondContact O-N 3.12Å; M157-C179 HydrophobicContact CB-CB 4.14Å; M157-C179 VanDerWaalsContact CG-O 3.27Å; M157-C179 WeakPolarHBondContact CG-O 3.41Å; M157-Y183 HydrophobicContact CG-CD2 3.83Å; M157-Y183 HydrophobicContact CG-CG 4.23Å; M157-Y183 VanDerWaalsContact SD-CA 3.52Å; M157-Y183 HydrophobicContact SD-CD2 3.83Å; M157-Y183 HydrophobicContact SD-CG 4.31Å; M157-N186 HydrophobicContact SD-CB 4.23Å
158	C	78.4	Confident	71.7	Confident	65 Å²	65	79.3 Å²	79.3	44%	0.439	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.4	0.3	-169.9	57.3	0	0	0	0	113.6	C155 T160 C175 C179	C155-C158 PolarHBondContact O-N 3.38Å; C158-T160 PolarHBondContact O-N 3.13Å; C158-T160 VanDerWaalsContact O-N 3.09Å; C158-T160 PolarHBondContact SG-OG1 2.88Å; C158-C175 VanDerWaalsContact SG-SG 3.6Å; C158-C179 VanDerWaalsContact SG-SG 3.64Å
159	G	76.7	Confident	72.5	Confident	47 Å²	47	70.3 Å²	70.3	49%	0.485	43%	0.428	S	S	.	.			trans	71.3	-2.8	178.8	0	0	0	0	0	115	C155 P161	C155-G159 PolarHBondContact O-N 3.23Å; G159-P161 WeakPolarHBondContact O-CD 3.48Å
160	T	77.1	Confident	73.3	Confident	70 Å²	70	74.9 Å²	74.9	43%	0.429	43%	0.433	S	S	.	.			trans	-62.4	122.8	-179.1	-49.2	0	0	0	0	111.1	C155 C158	C155-T160 PolarHBondContact N-O 2.82Å; C158-T160 PolarHBondContact O-N 3.13Å; C158-T160 VanDerWaalsContact O-N 3.09Å; C158-T160 PolarHBondContact SG-OG1 2.88Å
161	P	78.3	Confident	74	Confident	92 Å²	92	73.2 Å²	73.2	60%	0.597	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	155.9	174.2	32.7	-34.6	0	0	0	111.9	L153 I154 G159	L153-P161 CarbonylContact O-C 3.55Å; L153-P161 VanDerWaalsContact O-CA 3.29Å; L153-P161 WeakPolarHBondContact O-CA 3.43Å; I154-P161 HydrophobicContact CG1-CB 4.38Å; G159-P161 WeakPolarHBondContact O-CD 3.48Å
162	G	81	Confident	75.1	Confident	19 Å²	19	73.7 Å²	73.7	20%	0.196	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175	-156.7	174.5	0	0	0	0	0	111.5	P152 L153	P152-G162 CarbonylContact C-O 3.56Å; P152-G162 WeakPolarHBondContact CA-O 3.45Å; L153-G162 PolarHBondContact N-O 3.22Å; L153-G162 PolarHBondContact O-N 2.86Å
163	T	78.4	Confident	75.8	Confident	53 Å²	53	73.1 Å²	73.1	33%	0.325	41%	0.406	S	S	.	.			trans	-125.8	171.7	-174.9	58.1	0	0	0	0	111.1	S165 T166 F167	T163-S165 PolarHBondContact O-N 3.25Å; T163-S165 VanDerWaalsContact O-N 3.16Å; T163-S165 PolarHBondContact OG1-OG 3.34Å; T163-T166 PolarHBondContact N-OG1 2.88Å; T163-T166 VanDerWaalsContact N-OG1 3.16Å; T163-T166 PolarHBondContact O-N 3.22Å; T163-T166 PolarHBondContact O-OG1 3.47Å; T163-F167 PolarHBondContact O-N 3.31Å
164	F	76.1	Confident	76.3	Confident	118 Å²	118	71.1 Å²	71.1	52%	0.518	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-24	179.4	-165.1	-90.4	0	0	0	112.4	D150 L153 K172	D150-F164 VanDerWaalsContact OD1-CB 3.23Å; D150-F164 WeakPolarHBondContact OD1-CB 3.4Å; D150-F164 PolarHBondContact OD1-N 3.33Å; L153-F164 HydrophobicContact CD1-CB 3.9Å; L153-F164 HydrophobicContact CD1-CD2 4.26Å; L153-F164 VanDerWaalsContact CD1-N 3.34Å; F164-K172 HydrophobicContact CD1-CG 4.29Å; F164-K172 HydrophobicContact CD2-CB 3.99Å; F164-K172 HydrophobicContact CD2-CG 3.93Å; F164-K172 HydrophobicContact CE1-CG 4Å; F164-K172 HydrophobicContact CE2-CB 3.82Å; F164-K172 HydrophobicContact CE2-CG 3.62Å; F164-K172 HydrophobicContact CG-CG 4.26Å; F164-K172 HydrophobicContact CZ-CB 4.37Å; F164-K172 HydrophobicContact CZ-CG 3.67Å; F164-K172 VanDerWaalsContact O-CD 3.26Å; F164-K172 WeakPolarHBondContact O-CD 3.34Å; F164-K172 WeakPolarHBondContact O-CE 3.35Å; F164-K172 PolarHBondContact O-NZ 3.28Å
165	S	71.6	Confident	76.6	Confident	89 Å²	89	67.9 Å²	67.9	62%	0.622	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-46	173.6	58	0	0	0	0	112.7	T163 F167 K172	T163-S165 PolarHBondContact O-N 3.25Å; T163-S165 VanDerWaalsContact O-N 3.16Å; T163-S165 PolarHBondContact OG1-OG 3.34Å; S165-F167 PolarHBondContact O-N 2.93Å; S165-K172 PolarHBondContact O-NZ 2.8Å; S165-K172 VanDerWaalsContact O-NZ 3.12Å
166	T	69.8	Low	76.6	Confident	91 Å²	91	69.6 Å²	69.6	56%	0.558	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-16.2	-172	61.1	0	0	0	0	115.2	T163	T163-T166 PolarHBondContact N-OG1 2.88Å; T163-T166 VanDerWaalsContact N-OG1 3.16Å; T163-T166 PolarHBondContact O-N 3.22Å; T163-T166 PolarHBondContact O-OG1 3.47Å
167	F	79.9	Confident	76.3	Confident	8 Å²	8	69.7 Å²	69.7	4%	0.035	40%	0.396	C	S	.	.	S	Bend	trans	-78.7	152.8	-180	-86.1	-136.3	0	0	0	113.4	L153 C155 T163 S165 K172 C175	L153-F167 HydrophobicContact CB-CD1 4.39Å; L153-F167 HydrophobicContact CB-CE1 4.03Å; L153-F167 HydrophobicContact CB-CE2 4.36Å; L153-F167 HydrophobicContact CB-CZ 4.03Å; L153-F167 VanDerWaalsContact O-CZ 3.24Å; L153-F167 WeakPolarHBondContact O-CZ 3.41Å; C155-F167 HydrophobicContact CB-CE1 4.04Å; C155-F167 HydrophobicContact CB-CZ 3.99Å; T163-F167 PolarHBondContact O-N 3.31Å; S165-F167 PolarHBondContact O-N 2.93Å; F167-K172 HydrophobicContact CB-CB 4.21Å; F167-K172 HydrophobicContact CB-CD 3.81Å; F167-K172 VanDerWaalsContact CD1-O 3.29Å; F167-K172 WeakPolarHBondContact CD1-O 3.43Å; F167-K172 WeakPolarHBondContact O-CD 3.46Å; F167-K172 WeakPolarHBondContact O-CE 3.14Å; F167-K172 PolarHBondContact O-NZ 2.86Å; F167-C175 HydrophobicContact CD2-CB 4.49Å; F167-C175 HydrophobicContact CE2-CB 4.31Å
168	F	69.7	Low	76.2	Confident	86 Å²	86	70.8 Å²	70.8	38%	0.377	41%	0.41	S	S	.	.	B	Isolated β-bridge	trans	-85.7	145	-173.1	-176	-98.4	0	0	0	113.3	F174 L177	F168-F174 WeakPolarHBondContact CB-O 3.42Å; F168-F174 PolarHBondContact N-O 2.64Å; F168-L177 HydrophobicContact CD1-CB 4.35Å; F168-L177 HydrophobicContact CE1-CB 3.84Å; F168-L177 HydrophobicContact CE1-CD1 3.76Å; F168-L177 HydrophobicContact CE1-CG 4.37Å; F168-L177 HydrophobicContact CE2-CB 4.24Å; F168-L177 HydrophobicContact CZ-CB 3.79Å; F168-L177 HydrophobicContact CZ-CD1 4.02Å; F168-L177 HydrophobicContact CZ-CG 4.33Å
169	S	57.7	Low	76.1	Confident	54 Å²	54	68.7 Å²	68.7	38%	0.378	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.4	175	177.8	85.6	0	0	0	0	116.7	S171 K172	S169-S171 PolarHBondContact O-N 2.68Å; S169-S171 PolarHBondContact OG-N 3.28Å; S169-S171 PolarHBondContact OG-OG 3.13Å; S169-K172 WeakPolarHBondContact O-CD 3.5Å; S169-K172 WeakPolarHBondContact O-CE 3.39Å; S169-K172 PolarHBondContact O-N 3.43Å
170	K	58.3	Low	76.3	Confident	216 Å²	216	67.8 Å²	67.8	94%	0.939	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-20.3	179.1	-71.9	-175.1	177.1	-179.8	0	114.3
171	S	71.4	Confident	76.2	Confident	72 Å²	72	73.2 Å²	73.2	50%	0.503	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-17.7	-177.1	62.8	0	0	0	0	114.2	S169 R173	S169-S171 PolarHBondContact O-N 2.68Å; S169-S171 PolarHBondContact OG-N 3.28Å; S169-S171 PolarHBondContact OG-OG 3.13Å; S171-R173 PolarHBondContact O-N 3.4Å; S171-R173 VanDerWaalsContact O-N 3.13Å
172	K	80.9	Confident	75.6	Confident	40 Å²	40	71.3 Å²	71.3	17%	0.174	38%	0.384	C	S	.	.			trans	51.5	34.2	175	-59.3	-67.2	-173.2	157.9	0	115.4	F164 S165 F167 S169	F164-K172 HydrophobicContact CD1-CG 4.29Å; F164-K172 HydrophobicContact CD2-CB 3.99Å; F164-K172 HydrophobicContact CD2-CG 3.93Å; F164-K172 HydrophobicContact CE1-CG 4Å; F164-K172 HydrophobicContact CE2-CB 3.82Å; F164-K172 HydrophobicContact CE2-CG 3.62Å; F164-K172 HydrophobicContact CG-CG 4.26Å; F164-K172 HydrophobicContact CZ-CB 4.37Å; F164-K172 HydrophobicContact CZ-CG 3.67Å; F164-K172 VanDerWaalsContact O-CD 3.26Å; F164-K172 WeakPolarHBondContact O-CD 3.34Å; F164-K172 WeakPolarHBondContact O-CE 3.35Å; F164-K172 PolarHBondContact O-NZ 3.28Å; S165-K172 PolarHBondContact O-NZ 2.8Å; S165-K172 VanDerWaalsContact O-NZ 3.12Å; F167-K172 HydrophobicContact CB-CB 4.21Å; F167-K172 HydrophobicContact CB-CD 3.81Å; F167-K172 VanDerWaalsContact CD1-O 3.29Å; F167-K172 WeakPolarHBondContact CD1-O 3.43Å; F167-K172 WeakPolarHBondContact O-CD 3.46Å; F167-K172 WeakPolarHBondContact O-CE 3.14Å; F167-K172 PolarHBondContact O-NZ 2.86Å; S169-K172 WeakPolarHBondContact O-CD 3.5Å; S169-K172 WeakPolarHBondContact O-CE 3.39Å; S169-K172 PolarHBondContact O-N 3.43Å
173	R	84.6	Confident	74.8	Confident	103 Å²	103	73.8 Å²	73.8	39%	0.389	39%	0.388	S	S	.	.			trans	-93.4	-16.7	176.2	-68.1	176.1	65.9	-170.9	-2.3	114.6	E156 S171 Y183	E156-R173 PolarHBondContact N-O 3.42Å; E156-R173 WeakPolarHBondContact OE1-CB 3.44Å; E156-R173 WeakPolarHBondContact OE1-CG 3.23Å; E156-R173 IonicContact OE1-CZ 3.42Å; E156-R173 IonicContact OE1-NE 2.94Å; E156-R173 PolarHBondContact OE1-NE 3.26Å; E156-R173 IonicContact OE1-NH2 2.92Å; E156-R173 PolarHBondContact OE1-NH2 3.31Å; E156-R173 IonicContact OE2-CZ 3.09Å; E156-R173 IonicContact OE2-NE 3.18Å; E156-R173 IonicContact OE2-NH2 2.61Å; E156-R173 PolarHBondContact OE2-NH2 2.86Å; S171-R173 PolarHBondContact O-N 3.4Å; S171-R173 VanDerWaalsContact O-N 3.13Å; R173-Y183 PolarHBondContact NH2-OH 3.43Å
174	F	88.7	Confident	73.8	Confident	12 Å²	12	75 Å²	75	5%	0.053	40%	0.398	C	S	.	.	B	Isolated β-bridge	trans	-133.5	142.9	-173	-50.4	-67	0	0	0	111.3	C155 E156 F168 S176 C179 S180 Y183	C155-F174 VanDerWaalsContact SG-CA 3.59Å; E156-F174 HydrophobicContact CB-CD1 4.49Å; E156-F174 HydrophobicContact CB-CE1 4.02Å; F168-F174 WeakPolarHBondContact CB-O 3.42Å; F168-F174 PolarHBondContact N-O 2.64Å; F174-S176 VanDerWaalsContact C-N 3.32Å; F174-C179 HydrophobicContact CB-CB 4.23Å; F174-S180 VanDerWaalsContact CD2-CB 3.49Å; F174-S180 WeakPolarHBondContact CD2-OG 3.26Å; F174-Y183 HydrophobicContact CE1-CD1 4.17Å; F174-Y183 AromaticContact CE1-CD2 3.59Å; F174-Y183 HydrophobicContact CE1-CD2 3.59Å; F174-Y183 HydrophobicContact CE1-CE2 4.23Å; F174-Y183 AromaticContact CE1-CG 3.5Å; F174-Y183 HydrophobicContact CE1-CG 3.5Å; F174-Y183 AromaticContact CZ-CD1 3.79Å; F174-Y183 HydrophobicContact CZ-CD1 3.79Å; F174-Y183 HydrophobicContact CZ-CD2 4.07Å; F174-Y183 HydrophobicContact CZ-CE1 4.37Å; F174-Y183 AromaticContact CZ-CG 3.59Å; F174-Y183 HydrophobicContact CZ-CG 3.59Å
175	C	83.8	Confident	72.6	Confident	42 Å²	42	73 Å²	73	28%	0.284	40%	0.399	S	S	.	.	S	Bend	trans	-75.1	-19.4	176.6	65.1	0	0	0	0	113.3	C155 C158 F167	C155-C175 HydrophobicContact CB-CB 4.1Å; C155-C175 PolarHBondContact SG-N 3.06Å; C155-C175 VanDerWaalsContact SG-SG 3.7Å; C158-C175 VanDerWaalsContact SG-SG 3.6Å; F167-C175 HydrophobicContact CD2-CB 4.49Å; F167-C175 HydrophobicContact CE2-CB 4.31Å
176	S	82.3	Confident	71.4	Confident	36 Å²	36	72.5 Å²	72.5	25%	0.252	39%	0.389	S	S	.	.	S	Bend	trans	-148.9	162.2	-178.5	74.5	0	0	0	0	113.3	F174 S178 C179 S180	F174-S176 VanDerWaalsContact C-N 3.32Å; S176-S178 VanDerWaalsContact C-N 3.28Å; S176-S178 PolarHBondContact O-N 2.85Å; S176-S178 PolarHBondContact OG-N 3.48Å; S176-C179 PolarHBondContact O-N 2.79Å; S176-C179 PolarHBondContact OG-N 3.18Å; S176-C179 PolarHBondContact OG-SG 3.44Å; S176-S180 PolarHBondContact O-N 3.21Å
177	L	76.5	Confident	70.3	Confident	89 Å²	89	71.2 Å²	71.2	47%	0.466	38%	0.384	S	S	.	.	H	α-helix	trans	-59.7	-38.2	171.2	178.7	59.9	0	0	0	111.9	F168 S180 R181	F168-L177 HydrophobicContact CD1-CB 4.35Å; F168-L177 HydrophobicContact CE1-CB 3.84Å; F168-L177 HydrophobicContact CE1-CD1 3.76Å; F168-L177 HydrophobicContact CE1-CG 4.37Å; F168-L177 HydrophobicContact CE2-CB 4.24Å; F168-L177 HydrophobicContact CZ-CB 3.79Å; F168-L177 HydrophobicContact CZ-CD1 4.02Å; F168-L177 HydrophobicContact CZ-CG 4.33Å; L177-S180 PolarHBondContact O-N 2.81Å; L177-R181 PolarHBondContact O-N 2.98Å
178	S	78.9	Confident	68.7	Low	85 Å²	85	78.8 Å²	78.8	59%	0.594	42%	0.417	S	S	*	.	H	α-helix	trans	-62	-48.6	176.6	-54.9	0	0	0	0	111	S176 S180 R181 S182	S176-S178 VanDerWaalsContact C-N 3.28Å; S176-S178 PolarHBondContact O-N 2.85Å; S176-S178 PolarHBondContact OG-N 3.48Å; S178-S180 VanDerWaalsContact C-N 3.33Å; S178-S180 PolarHBondContact O-N 2.91Å; S178-R181 PolarHBondContact O-N 2.92Å; S178-R181 VanDerWaalsContact O-N 3.15Å; S178-S182 PolarHBondContact O-N 2.83Å; S178-S182 PolarHBondContact O-OG 2.83Å; S178-S182 VanDerWaalsContact O-OG 3.09Å
179	C	76.8	Confident	67.3	Low	20 Å²	20	81.3 Å²	81.3	14%	0.135	43%	0.428	C	S	.	.	H	α-helix	trans	-60.8	-40.4	175.2	-65.7	0	0	0	0	112.1	M157 C158 F174 S176 R181 S182 Y183	M157-C179 HydrophobicContact CB-CB 4.14Å; M157-C179 VanDerWaalsContact CG-O 3.27Å; M157-C179 WeakPolarHBondContact CG-O 3.41Å; C158-C179 VanDerWaalsContact SG-SG 3.64Å; F174-C179 HydrophobicContact CB-CB 4.23Å; S176-C179 PolarHBondContact O-N 2.79Å; S176-C179 PolarHBondContact OG-N 3.18Å; S176-C179 PolarHBondContact OG-SG 3.44Å; C179-R181 VanDerWaalsContact C-N 3.34Å; C179-R181 PolarHBondContact O-N 3.29Å; C179-S182 PolarHBondContact O-N 2.96Å; C179-Y183 PolarHBondContact O-N 2.64Å
180	S	81.4	Confident	66.1	Low	29 Å²	29	82.3 Å²	82.3	20%	0.203	44%	0.435	C	S	.	.	H	α-helix	trans	-61	-40.9	174.9	-171.3	0	0	0	0	112.5	F174 S176 L177 S178 S184	F174-S180 VanDerWaalsContact CD2-CB 3.49Å; F174-S180 WeakPolarHBondContact CD2-OG 3.26Å; S176-S180 PolarHBondContact O-N 3.21Å; L177-S180 PolarHBondContact O-N 2.81Å; S178-S180 VanDerWaalsContact C-N 3.33Å; S178-S180 PolarHBondContact O-N 2.91Å; S180-S184 PolarHBondContact O-N 3.48Å; S180-S184 PolarHBondContact O-OG 2.93Å
181	R	73.8	Confident	65.1	Low	183 Å²	183	74.7 Å²	74.7	69%	0.691	41%	0.409	S	S	*	.	H	α-helix	trans	-68.4	-44.9	176.1	-77	-178.7	163.6	-162.7	-5.5	111.8	L177 S178 C179 Y183 S184 S185	L177-R181 PolarHBondContact O-N 2.98Å; S178-R181 PolarHBondContact O-N 2.92Å; S178-R181 VanDerWaalsContact O-N 3.15Å; C179-R181 VanDerWaalsContact C-N 3.34Å; C179-R181 PolarHBondContact O-N 3.29Å; R181-Y183 VanDerWaalsContact C-N 3.27Å; R181-Y183 PolarHBondContact O-N 3.08Å; R181-S184 PolarHBondContact O-N 3.03Å; R181-S184 VanDerWaalsContact O-N 3.16Å; R181-S185 PolarHBondContact O-N 3.22Å; R181-S185 VanDerWaalsContact O-N 3.16Å; R181-S185 PolarHBondContact O-OG 3.07Å
182	S	66.3	Low	63.6	Low	52 Å²	52	76 Å²	76	36%	0.364	41%	0.409	S	S	.	.	H	α-helix	trans	-58.4	-38	177.3	-60.7	0	0	0	0	112.3	S178 C179 S185 N186	S178-S182 PolarHBondContact O-N 2.83Å; S178-S182 PolarHBondContact O-OG 2.83Å; S178-S182 VanDerWaalsContact O-OG 3.09Å; C179-S182 PolarHBondContact O-N 2.96Å; S182-S185 WeakPolarHBondContact CA-OG 3.43Å; S182-S185 PolarHBondContact O-N 3.41Å; S182-S185 PolarHBondContact O-OG 3.1Å; S182-N186 WeakPolarHBondContact O-CB 3.41Å; S182-N186 PolarHBondContact O-N 2.75Å
183	Y	63.4	Low	61.6	Low	71 Å²	71	80.3 Å²	80.3	28%	0.278	43%	0.434	S	S	.	.	H	α-helix	trans	-62.9	-45.6	175.4	-162.7	-91.4	0	0	0	112.3	E156 M157 R173 F174 C179 R181 S185 N186 S187	E156-Y183 HydrophobicContact CB-CD2 4.15Å; E156-Y183 HydrophobicContact CB-CE2 3.71Å; E156-Y183 WeakPolarHBondContact O-CD2 3.22Å; E156-Y183 WeakPolarHBondContact O-CE2 3.31Å; E156-Y183 PolarHBondContact OE2-OH 2.81Å; M157-Y183 HydrophobicContact CG-CD2 3.83Å; M157-Y183 HydrophobicContact CG-CG 4.23Å; M157-Y183 VanDerWaalsContact SD-CA 3.52Å; M157-Y183 HydrophobicContact SD-CD2 3.83Å; M157-Y183 HydrophobicContact SD-CG 4.31Å; R173-Y183 PolarHBondContact NH2-OH 3.43Å; F174-Y183 HydrophobicContact CE1-CD1 4.17Å; F174-Y183 AromaticContact CE1-CD2 3.59Å; F174-Y183 HydrophobicContact CE1-CD2 3.59Å; F174-Y183 HydrophobicContact CE1-CE2 4.23Å; F174-Y183 AromaticContact CE1-CG 3.5Å; F174-Y183 HydrophobicContact CE1-CG 3.5Å; F174-Y183 AromaticContact CZ-CD1 3.79Å; F174-Y183 HydrophobicContact CZ-CD1 3.79Å; F174-Y183 HydrophobicContact CZ-CD2 4.07Å; F174-Y183 HydrophobicContact CZ-CE1 4.37Å; F174-Y183 AromaticContact CZ-CG 3.59Å; F174-Y183 HydrophobicContact CZ-CG 3.59Å; C179-Y183 PolarHBondContact O-N 2.64Å; R181-Y183 VanDerWaalsContact C-N 3.27Å; R181-Y183 PolarHBondContact O-N 3.08Å; Y183-S185 PolarHBondContact O-N 3.26Å; Y183-N186 PolarHBondContact O-N 2.94Å; Y183-S187 PolarHBondContact O-N 3.03Å
184	S	58.9	Low	59.4	Low	79 Å²	79	79.2 Å²	79.2	55%	0.552	45%	0.447	S	S	*	.	H	α-helix	trans	-62.8	-28.3	177.6	-59.3	0	0	0	0	113.4	S180 R181	S180-S184 PolarHBondContact O-N 3.48Å; S180-S184 PolarHBondContact O-OG 2.93Å; R181-S184 PolarHBondContact O-N 3.03Å; R181-S184 VanDerWaalsContact O-N 3.16Å
185	S	50.7	Low	57.2	Low	77 Å²	77	88 Å²	88	54%	0.538	48%	0.479	S	S	.	.	H	α-helix	trans	-79.2	-34.7	169.2	45.9	0	0	0	0	113.5	R181 S182 Y183	R181-S185 PolarHBondContact O-N 3.22Å; R181-S185 VanDerWaalsContact O-N 3.16Å; R181-S185 PolarHBondContact O-OG 3.07Å; S182-S185 WeakPolarHBondContact CA-OG 3.43Å; S182-S185 PolarHBondContact O-N 3.41Å; S182-S185 PolarHBondContact O-OG 3.1Å; Y183-S185 PolarHBondContact O-N 3.26Å
186	N	45.7	Very low	54.9	Low	77 Å²	77	92.5 Å²	92.5	41%	0.412	50%	0.5	S	S	.	.	H	α-helix	trans	-84.2	-22.7	-173.6	-148.5	26.3	0	0	0	113.5	M157 S182 Y183 K188 K189 S190	M157-N186 HydrophobicContact SD-CB 4.23Å; S182-N186 WeakPolarHBondContact O-CB 3.41Å; S182-N186 PolarHBondContact O-N 2.75Å; Y183-N186 PolarHBondContact O-N 2.94Å; N186-K188 PolarHBondContact O-N 2.8Å; N186-K188 VanDerWaalsContact O-N 3.12Å; N186-K189 PolarHBondContact O-N 3.35Å; N186-S190 PolarHBondContact O-N 3.21Å
187	S	47.7	Very low	53	Low	65 Å²	65	99 Å²	99	46%	0.455	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-8.7	172.5	75.6	0	0	0	0	114	Y183 S190	Y183-S187 PolarHBondContact O-N 3.03Å; S187-S190 PolarHBondContact O-OG 2.84Å
188	K	45.7	Very low	51.1	Low	167 Å²	167	98.4 Å²	98.4	73%	0.726	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-15	167.3	-66.5	-175.5	177.6	-177.6	0	113.6	N186 S191	N186-K188 PolarHBondContact O-N 2.8Å; N186-K188 VanDerWaalsContact O-N 3.12Å; K188-S191 PolarHBondContact O-OG 2.83Å
189	K	39	Very low	48.9	Very low	139 Å²	139	105.4 Å²	105.4	60%	0.604	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-27.1	175.2	-71.9	-173.7	172.2	-175.1	0	113.1	N186 S191 I192	N186-K189 PolarHBondContact O-N 3.35Å; K189-S191 PolarHBondContact O-N 2.84Å; K189-I192 WeakPolarHBondContact O-CB 3.36Å; K189-I192 PolarHBondContact O-N 3.42Å
190	S	33.8	Very low	46.7	Very low	74 Å²	74	110.4 Å²	110.4	52%	0.517	59%	0.587	S	S	.	*	H	α-helix	trans	-64.3	-18.8	178.4	52.1	0	0	0	0	114.3	N186 S187 I192	N186-S190 PolarHBondContact O-N 3.21Å; S187-S190 PolarHBondContact O-OG 2.84Å; S190-I192 PolarHBondContact O-N 3.24Å
191	S	36.9	Very low	44.3	Very low	57 Å²	57	114.8 Å²	114.8	40%	0.399	62%	0.615	S	S	.	*	H	α-helix	trans	-74.1	-10.2	170.8	62.8	0	0	0	0	114.3	K188 K189 R195	K188-S191 PolarHBondContact O-OG 2.83Å; K189-S191 PolarHBondContact O-N 2.84Å; S191-R195 WeakPolarHBondContact O-CD 3.39Å; S191-R195 WeakPolarHBondContact O-CG 3.21Å
192	I	40.1	Very low	42.6	Very low	98 Å²	98	111.4 Å²	111.4	50%	0.503	62%	0.619	S	S	.	*	H	α-helix	trans	-89.3	-43.1	179.4	-56.6	176.7	0	0	0	110.5	K189 S190 A194 R195	K189-I192 WeakPolarHBondContact O-CB 3.36Å; K189-I192 PolarHBondContact O-N 3.42Å; S190-I192 PolarHBondContact O-N 3.24Å; I192-A194 VanDerWaalsContact C-N 3.29Å; I192-A194 PolarHBondContact O-N 3.29Å; I192-R195 WeakPolarHBondContact O-CB 3.29Å; I192-R195 PolarHBondContact O-N 3.23Å
193	L	38.9	Very low	41.6	Very low	132 Å²	132	118.8 Å²	118.8	69%	0.691	65%	0.645	S	S	*	*	H	α-helix	trans	-62.3	-35.1	176.8	-90.8	162.1	0	0	0	112.6	R195 L196	L193-R195 PolarHBondContact O-N 3.35Å; L193-L196 HydrophobicContact CD2-CD1 4.36Å; L193-L196 PolarHBondContact O-N 2.97Å
194	A	38.1	Very low	40.4	Very low	80 Å²	80	125.2 Å²	125.2	66%	0.661	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-11.4	173.2	0	0	0	0	0	114.4	I192	I192-A194 VanDerWaalsContact C-N 3.29Å; I192-A194 PolarHBondContact O-N 3.29Å
195	R	42	Very low	39.1	Very low	195 Å²	195	126.1 Å²	126.1	74%	0.736	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-8.6	177.2	-71.1	173.5	171.9	172	-3	113.7	S191 I192 L193 Q197	S191-R195 WeakPolarHBondContact O-CD 3.39Å; S191-R195 WeakPolarHBondContact O-CG 3.21Å; I192-R195 WeakPolarHBondContact O-CB 3.29Å; I192-R195 PolarHBondContact O-N 3.23Å; L193-R195 PolarHBondContact O-N 3.35Å; R195-Q197 VanDerWaalsContact C-N 3.33Å
196	L	35.5	Very low	38.2	Very low	137 Å²	137	127 Å²	127	72%	0.717	69%	0.688	S	S	*	*	S	Bend	trans	-88.3	5.6	179.9	-69.2	169.9	0	0	0	113.9	L193	L193-L196 HydrophobicContact CD2-CD1 4.36Å; L193-L196 PolarHBondContact O-N 2.97Å
197	Q	42.1	Very low	37.6	Very low	174 Å²	174	129.6 Å²	129.6	81%	0.813	71%	0.707	S	S	*	*	S	Bend	trans	-116	40.8	-179.9	-66.9	-171.6	-17.9	0	0	113.8	R195 R199	R195-Q197 VanDerWaalsContact C-N 3.33Å; Q197-R199 PolarHBondContact O-N 3.27Å
198	G	37.1	Very low	37	Very low	76 Å²	76	133.6 Å²	133.6	78%	0.784	72%	0.723	S	S	*	*	S	Bend	trans	67.5	41.1	146.8	0	0	0	0	0	118.7
199	R	33.8	Very low	36.3	Very low	232 Å²	232	132.4 Å²	132.4	88%	0.875	72%	0.724	S	S	*	*			trans	-131.5	140	163.7	-68.8	-170.7	177.3	-171.6	-0.9	111.6	Q197	Q197-R199 PolarHBondContact O-N 3.27Å
200	P	29.7	Very low	35.9	Very low	125 Å²	125	136.3 Å²	136.3	81%	0.812	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-75.4	131.2	-167	28.6	-35.1	0	0	0	112.8
201	P	30.5	Very low	35.8	Very low	120 Å²	120	140.8 Å²	140.8	78%	0.779	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-78.1	124.6	174.5	30.8	-32.8	0	0	0	111.2
202	S	39	Very low	35.6	Very low	113 Å²	113	145.4 Å²	145.4	79%	0.79	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-76.5	133	175.2	52.8	0	0	0	0	112.3	K204	S202-K204 PolarHBondContact O-N 3.2Å
203	K	45.1	Very low	35.3	Very low	206 Å²	206	150.4 Å²	150.4	90%	0.896	79%	0.788	S	S	*	*	S	Bend	trans	21.8	88.6	160.7	-63.6	-178.2	178.6	-179.8	0	116.8
204	K	38.4	Very low	34.6	Very low	206 Å²	206	148.8 Å²	148.8	90%	0.896	79%	0.793	S	S	*	*			trans	-156	60.2	157.8	-115.9	161.6	-169.2	176.4	0	113.9	S202	S202-K204 PolarHBondContact O-N 3.2Å
205	A	30.5	Very low	34	Very low	98 Å²	98	149.8 Å²	149.8	81%	0.81	80%	0.796	S	S	*	*			trans	-132.9	61	168.7	0	0	0	0	0	109.3
206	T	33.6	Very low	33.4	Very low	95 Å²	95	145.3 Å²	145.3	58%	0.583	80%	0.801	S	S	*	*			trans	-154.6	67.3	-177	-40.2	0	0	0	0	110.2
207	V	32.9	Very low	33.1	Very low	132 Å²	132	144.8 Å²	144.8	80%	0.8	80%	0.803	S	S	*	*	S	Bend	trans	-134.8	46.2	174.2	-159.2	0	0	0	0	110.4
208	L	34.5	Very low	32.6	Very low	150 Å²	150	141.3 Å²	141.3	79%	0.785	80%	0.804	S	S	*	*	S	Bend	trans	-127.5	-46.3	157.8	-135	75.9	0	0	0	108.8	R210	L208-R210 PolarHBondContact O-N 3.42Å
209	N	30.9	Very low	32.5	Very low	141 Å²	141	141.5 Å²	141.5	75%	0.754	81%	0.806	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	49.6	174.9	-54.6	40.8	0	0	0	113.6
210	R	30.9	Very low	32.4	Very low	222 Å²	222	136.7 Å²	136.7	84%	0.838	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.9	15.3	176	-123.7	-178.8	-168.3	-151.3	-0.4	116.5	L208	L208-R210 PolarHBondContact O-N 3.42Å
211	M	30.3	Very low	32.3	Very low	168 Å²	168	138.7 Å²	138.7	83%	0.828	80%	0.801	S	S	*	*	S	Bend	trans	-85.7	-37.7	161.7	-136.4	69.3	172.6	0	0	111.4	K213	M211-K213 VanDerWaalsContact C-N 3.29Å; M211-K213 PolarHBondContact O-N 3Å
212	N	33.2	Very low	32.3	Very low	153 Å²	153	138 Å²	138	82%	0.818	81%	0.806	S	S	*	*	S	Bend	trans	-82.6	38.1	-167	-56.1	28	0	0	0	115.3
213	K	33.3	Very low	32.3	Very low	204 Å²	204	139.9 Å²	139.9	89%	0.887	80%	0.801	S	S	*	*			trans	-159.1	67.5	164.3	-135.1	168.1	-170.6	171.7	0	117.6	M211	M211-K213 VanDerWaalsContact C-N 3.29Å; M211-K213 PolarHBondContact O-N 3Å
214	A	25.9	Very low	32.7	Very low	97 Å²	97	133.5 Å²	133.5	80%	0.802	78%	0.783	S	S	*	*			trans	-159.9	143	145.5	0	0	0	0	0	107.6
215	S	25.8	Very low	34.6	Very low	102 Å²	102	130.3 Å²	130.3	71%	0.713	78%	0.78	S	S	*	*			cis	-110.9	150.7	3.2	-171.7	0	0	0	0	111.9
216	A	29.1	Very low	37.5	Very low	101 Å²	101	127.3 Å²	127.3	84%	0.835	75%	0.749	S	S	*	*			trans	-109.8	73.6	167.5	0	0	0	0	0	109.1
217	T	28.4	Very low	40.4	Very low	125 Å²	125	126 Å²	126	77%	0.767	74%	0.738	S	S	*	*			trans	-69.1	144.6	161.7	34.8	0	0	0	0	109.4
218	A	31.1	Very low	43.4	Very low	102 Å²	102	120 Å²	120	84%	0.843	70%	0.702	S	S	*	*	S	Bend	trans	-76.8	145	-163.2	0	0	0	0	0	113.8
219	G	34.5	Very low	46.3	Very low	79 Å²	79	112.9 Å²	112.9	81%	0.814	66%	0.664	S	S	*	*			trans	74.6	66.9	154.9	0	0	0	0	0	116.7
220	V	32.2	Very low	49.3	Very low	131 Å²	131	109.7 Å²	109.7	79%	0.794	65%	0.653	S	S	*	*			trans	-127.4	143.9	155.7	-175.7	0	0	0	0	107.7
221	E	27.6	Very low	52.4	Low	167 Å²	167	100.1 Å²	100.1	78%	0.78	62%	0.617	S	S	*	*			trans	-71.9	154.3	-175.7	-64.3	179.5	135.3	0	0	111.8	H223	E221-H223 VanDerWaalsContact C-N 3.27Å; E221-H223 PolarHBondContact O-N 3.11Å
222	A	30.6	Very low	55.5	Low	107 Å²	107	92.2 Å²	92.2	88%	0.884	58%	0.578	S	S	*	*			trans	-80.9	72.1	-174.2	0	0	0	0	0	111.3	S224	A222-S224 PolarHBondContact O-N 2.89Å
223	H	40.2	Very low	58.3	Low	151 Å²	151	89.1 Å²	89.1	70%	0.699	57%	0.565	S	S	*	*			trans	-52.9	136.3	168.6	-63.3	-66.2	0	0	0	110.2	E221 V225	E221-H223 VanDerWaalsContact C-N 3.27Å; E221-H223 PolarHBondContact O-N 3.11Å; H223-V225 PolarHBondContact O-N 3.29Å; H223-V225 VanDerWaalsContact O-N 3.16Å
224	S	52	Low	61.1	Low	73 Å²	73	84.9 Å²	84.9	51%	0.51	56%	0.556	S	S	.	*			trans	-60.7	115.3	179.2	50.1	0	0	0	0	110.6	A222 F226	A222-S224 PolarHBondContact O-N 2.89Å; S224-F226 PolarHBondContact O-N 3.4Å
225	V	79	Confident	64.2	Low	139 Å²	139	85 Å²	85	84%	0.842	54%	0.54	S	S	*	.			trans	-63.3	128.7	172.9	-178.1	0	0	0	0	108.5	H223	H223-V225 PolarHBondContact O-N 3.29Å; H223-V225 VanDerWaalsContact O-N 3.16Å
226	F	92.1	Very high	67.4	Low	35 Å²	35	84.4 Å²	84.4	15%	0.154	54%	0.541	C	S	.	.			trans	-60.6	132.5	178.2	177.2	-94.4	0	0	0	111.6	S224 W228 Y231 V604 L650 P652 P653 L656	S224-F226 PolarHBondContact O-N 3.4Å; F226-W228 HydrophobicContact CD1-CG 4.49Å; F226-W228 HydrophobicContact CE1-CB 4.41Å; F226-W228 AromaticContact CE1-CD2 3.61Å; F226-W228 HydrophobicContact CE1-CD2 3.61Å; F226-W228 AromaticContact CE1-CE2 3.88Å; F226-W228 AromaticContact CE1-CE3 3.97Å; F226-W228 HydrophobicContact CE1-CE3 3.97Å; F226-W228 AromaticContact CE1-CG 3.79Å; F226-W228 HydrophobicContact CE1-CG 3.79Å; F226-W228 HydrophobicContact CE1-CZ2 4.46Å; F226-W228 HydrophobicContact CZ-CD2 4.3Å; F226-W228 HydrophobicContact CZ-CE3 4.19Å; F226-Y231 HydrophobicContact CE2-CD1 4.24Å; F226-Y231 HydrophobicContact CE2-CD2 4.33Å; F226-Y231 AromaticContact CE2-CG 3.93Å; F226-Y231 HydrophobicContact CE2-CG 3.93Å; F226-Y231 AromaticContact CZ-CD1 3.66Å; F226-Y231 HydrophobicContact CZ-CD1 3.66Å; F226-Y231 HydrophobicContact CZ-CE1 4.47Å; F226-Y231 AromaticContact CZ-CG 3.69Å; F226-Y231 HydrophobicContact CZ-CG 3.69Å; F226-V604 HydrophobicContact CD1-CG2 4.02Å; F226-V604 HydrophobicContact CE1-CG2 3.48Å; F226-V604 VanDerWaalsContact CE1-CG2 3.48Å; F226-V604 HydrophobicContact CE2-CG2 4.06Å; F226-V604 HydrophobicContact CZ-CB 4.43Å; F226-V604 HydrophobicContact CZ-CG1 4.08Å; F226-V604 HydrophobicContact CZ-CG2 3.51Å; F226-L650 HydrophobicContact CD1-CD2 3.75Å; F226-L650 HydrophobicContact CE1-CD2 4.09Å; F226-P652 HydrophobicContact CB-CB 4.14Å; F226-P652 HydrophobicContact CD2-CB 3.88Å; F226-P652 HydrophobicContact CG-CB 4.28Å; F226-P653 HydrophobicContact CE2-CG 4.33Å; F226-L656 HydrophobicContact CD2-CD2 3.79Å; F226-L656 HydrophobicContact CE2-CD2 3.64Å
227	D	94	Very high	70.3	Confident	67 Å²	67	80.2 Å²	80.2	36%	0.358	51%	0.506	S	S	.	.			trans	-112.8	112.6	173.9	173.7	39.5	0	0	0	111.7	G229 S230 Y231	D227-G229 PolarHBondContact O-N 3.31Å; D227-G229 PolarHBondContact OD1-N 3.39Å; D227-S230 VanDerWaalsContact OD2-CB 3.28Å; D227-S230 WeakPolarHBondContact OD2-CB 3.31Å; D227-S230 PolarHBondContact OD2-N 3.14Å; D227-S230 PolarHBondContact OD2-OG 3.15Å; D227-Y231 WeakPolarHBondContact O-CB 3.28Å; D227-Y231 PolarHBondContact O-N 3.34Å; D227-Y231 VanDerWaalsContact O-N 3.1Å
228	W	96.3	Very high	73.5	Confident	7 Å²	7	79.5 Å²	79.5	3%	0.027	50%	0.498	C	S	.	.	H	α-helix	trans	-55	-34.8	171.3	-87.3	120.4	0	0	0	113.6	F226 Y231 L232 K590 L591 E592 V604 V640 L650	F226-W228 HydrophobicContact CD1-CG 4.49Å; F226-W228 HydrophobicContact CE1-CB 4.41Å; F226-W228 AromaticContact CE1-CD2 3.61Å; F226-W228 HydrophobicContact CE1-CD2 3.61Å; F226-W228 AromaticContact CE1-CE2 3.88Å; F226-W228 AromaticContact CE1-CE3 3.97Å; F226-W228 HydrophobicContact CE1-CE3 3.97Å; F226-W228 AromaticContact CE1-CG 3.79Å; F226-W228 HydrophobicContact CE1-CG 3.79Å; F226-W228 HydrophobicContact CE1-CZ2 4.46Å; F226-W228 HydrophobicContact CZ-CD2 4.3Å; F226-W228 HydrophobicContact CZ-CE3 4.19Å; W228-Y231 HydrophobicContact CE3-CD1 4.13Å; W228-Y231 AromaticContact CZ3-CD1 3.95Å; W228-Y231 HydrophobicContact CZ3-CD1 3.95Å; W228-Y231 HydrophobicContact CZ3-CE1 4.39Å; W228-Y231 PolarHBondContact O-N 2.89Å; W228-L232 HydrophobicContact CE3-CD1 4.48Å; W228-L232 HydrophobicContact CE3-CD2 4.37Å; W228-L232 HydrophobicContact CE3-CG 4.15Å; W228-L232 HydrophobicContact CZ3-CD2 4.48Å; W228-L232 WeakPolarHBondContact O-CB 3.11Å; W228-L232 WeakPolarHBondContact O-CG 3.27Å; W228-L232 PolarHBondContact O-N 3.14Å; W228-K590 HydrophobicContact CH2-CB 4.23Å; W228-K590 HydrophobicContact CZ3-CB 3.91Å; W228-K590 HydrophobicContact CZ3-CG 4.43Å; W228-L591 WeakPolarHBondContact CH2-O 3.5Å; W228-E592 HydrophobicContact CZ2-CG 3.6Å; W228-E592 PolarHBondContact NE1-OE1 2.87Å; W228-V604 HydrophobicContact CH2-CB 4.24Å; W228-V604 HydrophobicContact CH2-CG1 3.69Å; W228-V604 HydrophobicContact CH2-CG2 4.1Å; W228-V604 HydrophobicContact CZ2-CB 4.43Å; W228-V604 HydrophobicContact CZ2-CG1 4.33Å; W228-V604 HydrophobicContact CZ2-CG2 3.9Å; W228-V604 HydrophobicContact CZ3-CG1 4.07Å; W228-V640 HydrophobicContact CB-CG1 3.98Å; W228-V640 HydrophobicContact CD2-CB 4.34Å; W228-V640 HydrophobicContact CD2-CG1 3.57Å; W228-V640 HydrophobicContact CD2-CG2 4.04Å; W228-V640 HydrophobicContact CE3-CG1 4.03Å; W228-V640 HydrophobicContact CE3-CG2 3.99Å; W228-V640 HydrophobicContact CG-CG1 3.57Å; W228-V640 HydrophobicContact CH2-CG2 3.77Å; W228-V640 HydrophobicContact CZ2-CG2 3.83Å; W228-V640 HydrophobicContact CZ3-CG2 3.86Å; W228-L650 HydrophobicContact CZ2-CD2 4.35Å; W228-L650 VanDerWaalsContact NE1-CD2 3.35Å
229	G	94.6	Very high	76.7	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	46%	0.463	C	S	.	.	H	α-helix	trans	-64.9	-54.4	-177.6	0	0	0	0	0	111.9	D227 Y231 T233 W306	D227-G229 PolarHBondContact O-N 3.31Å; D227-G229 PolarHBondContact OD1-N 3.39Å; G229-Y231 VanDerWaalsContact C-N 3.3Å; G229-Y231 PolarHBondContact O-N 3.1Å; G229-T233 WeakPolarHBondContact O-CB 3.25Å; G229-T233 PolarHBondContact O-N 3.29Å; G229-T233 VanDerWaalsContact O-N 3.07Å; G229-T233 PolarHBondContact O-OG1 2.79Å; G229-W306 PolarHBondContact O-NE1 3.23Å; G229-W306 VanDerWaalsContact O-NE1 3.14Å
230	S	93.6	Very high	79.7	Confident	73 Å²	73	71.6 Å²	71.6	51%	0.51	42%	0.424	S	S	.	.	H	α-helix	trans	-58.7	-41.1	175.1	-57.2	0	0	0	0	111.9	D227 T234	D227-S230 VanDerWaalsContact OD2-CB 3.28Å; D227-S230 WeakPolarHBondContact OD2-CB 3.31Å; D227-S230 PolarHBondContact OD2-N 3.14Å; D227-S230 PolarHBondContact OD2-OG 3.15Å; S230-T234 WeakPolarHBondContact O-CB 3.19Å; S230-T234 PolarHBondContact O-N 2.84Å; S230-T234 PolarHBondContact O-OG1 2.84Å
231	Y	95.9	Very high	82.7	Confident	21 Å²	21	67.4 Å²	67.4	8%	0.082	40%	0.401	C	S	.	.	H	α-helix	trans	-65.4	-54	179.3	-172.2	-119.1	0	0	0	112.2	F226 D227 W228 G229 T233 T234 E235 K590 V604 D620 L656	F226-Y231 HydrophobicContact CE2-CD1 4.24Å; F226-Y231 HydrophobicContact CE2-CD2 4.33Å; F226-Y231 AromaticContact CE2-CG 3.93Å; F226-Y231 HydrophobicContact CE2-CG 3.93Å; F226-Y231 AromaticContact CZ-CD1 3.66Å; F226-Y231 HydrophobicContact CZ-CD1 3.66Å; F226-Y231 HydrophobicContact CZ-CE1 4.47Å; F226-Y231 AromaticContact CZ-CG 3.69Å; F226-Y231 HydrophobicContact CZ-CG 3.69Å; D227-Y231 WeakPolarHBondContact O-CB 3.28Å; D227-Y231 PolarHBondContact O-N 3.34Å; D227-Y231 VanDerWaalsContact O-N 3.1Å; W228-Y231 HydrophobicContact CE3-CD1 4.13Å; W228-Y231 AromaticContact CZ3-CD1 3.95Å; W228-Y231 HydrophobicContact CZ3-CD1 3.95Å; W228-Y231 HydrophobicContact CZ3-CE1 4.39Å; W228-Y231 PolarHBondContact O-N 2.89Å; G229-Y231 VanDerWaalsContact C-N 3.3Å; G229-Y231 PolarHBondContact O-N 3.1Å; Y231-T233 PolarHBondContact O-N 3.01Å; Y231-T234 PolarHBondContact O-N 2.77Å; Y231-T234 VanDerWaalsContact O-N 3.08Å; Y231-E235 HydrophobicContact CD1-CG 4.44Å; Y231-E235 HydrophobicContact CD2-CG 3.86Å; Y231-E235 HydrophobicContact CE1-CG 4.08Å; Y231-E235 HydrophobicContact CE2-CG 3.4Å; Y231-E235 VanDerWaalsContact CE2-CG 3.4Å; Y231-E235 VanDerWaalsContact CE2-OE1 3.25Å; Y231-E235 WeakPolarHBondContact CE2-OE1 3.29Å; Y231-E235 HydrophobicContact CG-CG 4.33Å; Y231-E235 WeakPolarHBondContact O-CG 3.36Å; Y231-E235 PolarHBondContact O-N 2.97Å; Y231-K590 HydrophobicContact CE1-CD 4.32Å; Y231-K590 PolarHBondContact OH-NZ 2.95Å; Y231-V604 HydrophobicContact CD1-CG1 4.31Å; Y231-V604 HydrophobicContact CE1-CG1 3.85Å; Y231-D620 PolarHBondContact OH-OD2 2.88Å; Y231-L656 HydrophobicContact CD2-CD2 4.35Å
232	L	95.2	Very high	86.1	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.016	36%	0.364	C	S	.	.	H	α-helix	trans	-58.6	-35.1	178.3	-69.8	169.7	0	0	0	112.8	W228 A236 A237 A239 A286 W306 K590 V640	W228-L232 HydrophobicContact CE3-CD1 4.48Å; W228-L232 HydrophobicContact CE3-CD2 4.37Å; W228-L232 HydrophobicContact CE3-CG 4.15Å; W228-L232 HydrophobicContact CZ3-CD2 4.48Å; W228-L232 WeakPolarHBondContact O-CB 3.11Å; W228-L232 WeakPolarHBondContact O-CG 3.27Å; W228-L232 PolarHBondContact O-N 3.14Å; L232-A236 WeakPolarHBondContact O-CA 3.48Å; L232-A236 PolarHBondContact O-N 2.9Å; L232-A236 VanDerWaalsContact O-N 3.17Å; L232-A237 HydrophobicContact CD2-CB 4.2Å; L232-A237 PolarHBondContact O-N 3.17Å; L232-A239 HydrophobicContact CD2-CB 4.38Å; L232-A286 HydrophobicContact CD1-CB 3.62Å; L232-W306 HydrophobicContact CB-CZ2 4.25Å; L232-W306 HydrophobicContact CD1-CH2 4.14Å; L232-W306 HydrophobicContact CD1-CZ3 4.5Å; L232-K590 HydrophobicContact CD2-CB 4.06Å; L232-K590 HydrophobicContact CD2-CG 3.92Å; L232-V640 HydrophobicContact CD1-CG1 4.28Å
233	T	93.6	Very high	89.2	Confident	88 Å²	88	57 Å²	57	54%	0.54	34%	0.34	S	S	.	.	H	α-helix	trans	-70	-39.2	177.3	-49.2	0	0	0	0	111.8	G229 Y231 W306	G229-T233 WeakPolarHBondContact O-CB 3.25Å; G229-T233 PolarHBondContact O-N 3.29Å; G229-T233 VanDerWaalsContact O-N 3.07Å; G229-T233 PolarHBondContact O-OG1 2.79Å; Y231-T233 PolarHBondContact O-N 3.01Å; T233-W306 PolarHBondContact OG1-NE1 3.5Å
234	T	92.1	Very high	91.8	Very high	114 Å²	114	50.6 Å²	50.6	70%	0.699	31%	0.312	S	S	*	.	H	α-helix	trans	-71.8	-44.5	-179.8	-56.3	0	0	0	0	111.9	S230 Y231 A236	S230-T234 WeakPolarHBondContact O-CB 3.19Å; S230-T234 PolarHBondContact O-N 2.84Å; S230-T234 PolarHBondContact O-OG1 2.84Å; Y231-T234 PolarHBondContact O-N 2.77Å; Y231-T234 VanDerWaalsContact O-N 3.08Å; T234-A236 PolarHBondContact O-N 3.03Å
235	E	90.3	Very high	94	Very high	99 Å²	99	47.2 Å²	47.2	46%	0.463	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-5.9	179.3	-60.7	-66	148.5	0	0	113.4	Y231 A237	Y231-E235 HydrophobicContact CD1-CG 4.44Å; Y231-E235 HydrophobicContact CD2-CG 3.86Å; Y231-E235 HydrophobicContact CE1-CG 4.08Å; Y231-E235 HydrophobicContact CE2-CG 3.4Å; Y231-E235 VanDerWaalsContact CE2-CG 3.4Å; Y231-E235 VanDerWaalsContact CE2-OE1 3.25Å; Y231-E235 WeakPolarHBondContact CE2-OE1 3.29Å; Y231-E235 HydrophobicContact CG-CG 4.33Å; Y231-E235 WeakPolarHBondContact O-CG 3.36Å; Y231-E235 PolarHBondContact O-N 2.97Å; E235-A237 HydrophobicContact CB-CB 3.77Å; E235-A237 PolarHBondContact O-N 3.49Å; E235-A237 VanDerWaalsContact O-N 3.1Å
236	A	92	Very high	94.7	Very high	90 Å²	90	43.9 Å²	43.9	74%	0.744	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	30	-167.4	0	0	0	0	0	113.7	L232 T234	L232-A236 WeakPolarHBondContact O-CA 3.48Å; L232-A236 PolarHBondContact O-N 2.9Å; L232-A236 VanDerWaalsContact O-N 3.17Å; T234-A236 PolarHBondContact O-N 3.03Å
237	A	91.6	Very high	94.8	Very high	13 Å²	13	43.4 Å²	43.4	11%	0.107	27%	0.273	C	S	.	.			trans	-89.7	149.3	-164.5	0	0	0	0	0	113.5	L232 E235 K590	L232-A237 HydrophobicContact CD2-CB 4.2Å; L232-A237 PolarHBondContact O-N 3.17Å; E235-A237 HydrophobicContact CB-CB 3.77Å; E235-A237 PolarHBondContact O-N 3.49Å; E235-A237 VanDerWaalsContact O-N 3.1Å; A237-K590 HydrophobicContact CB-CD 4.48Å; A237-K590 HydrophobicContact CB-CG 3.8Å
238	L	95	Very high	94.9	Very high	111 Å²	111	40.7 Å²	40.7	58%	0.581	26%	0.26	S	S	*	.			trans	-89.9	147	170	-60.8	-179.2	0	0	0	110.1	M589 K590	L238-M589 CarbonylContact O-C 3.55Å; L238-M589 WeakPolarHBondContact O-CA 3.37Å; L238-K590 PolarHBondContact O-N 2.96Å
239	A	97.5	Very high	94.9	Very high	13 Å²	13	40.8 Å²	40.8	11%	0.107	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-108.1	151.1	170.6	0	0	0	0	0	110.9	L232 A286 K590 V640	L232-A239 HydrophobicContact CD2-CB 4.38Å; A239-A286 HydrophobicContact CB-CB 3.75Å; A239-K590 VanDerWaalsContact CA-O 3.28Å; A239-K590 WeakPolarHBondContact CA-O 3.47Å; A239-K590 HydrophobicContact CB-CB 4.48Å; A239-V640 HydrophobicContact CB-CB 4.06Å; A239-V640 HydrophobicContact CB-CG2 3.58Å
240	A	97.6	Very high	95	Very high	1 Å²	1	41 Å²	41	1%	0.008	26%	0.263	C	S	.	.			trans	-65.4	140.7	175.6	0	0	0	0	0	112	F245 F585 M589 K590	A240-F245 HydrophobicContact CB-CE2 3.59Å; A240-F245 HydrophobicContact CB-CZ 3.66Å; A240-F585 HydrophobicContact CB-CD1 3.82Å; A240-F585 HydrophobicContact CB-CE1 3.69Å; A240-M589 HydrophobicContact CB-CB 4.32Å; A240-M589 HydrophobicContact CB-SD 4.01Å; A240-K590 PolarHBondContact N-O 3Å
241	S	96.7	Very high	95.1	Very high	44 Å²	44	38.2 Å²	38.2	31%	0.308	24%	0.243	S	C	.	.			trans	-66.2	145.8	177	-179.1	0	0	0	0	111.8	S243 S244 F245	S241-S243 PolarHBondContact O-N 2.92Å; S241-S243 PolarHBondContact OG-N 3.37Å; S241-S243 PolarHBondContact OG-OG 2.82Å; S241-S244 VanDerWaalsContact O-CB 3.27Å; S241-S244 WeakPolarHBondContact O-CB 3.19Å; S241-S244 PolarHBondContact O-N 3.24Å; S241-S244 PolarHBondContact O-OG 3.11Å; S241-F245 WeakPolarHBondContact O-CD2 3.47Å; S241-F245 VanDerWaalsContact O-CE2 3.29Å; S241-F245 WeakPolarHBondContact O-CE2 3.47Å
242	V	98	Very high	94.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-59.2	-30.1	174.2	-174.3	0	0	0	0	111.9	S244 F245 A248 P249 S251 W254 Y288 P639	V242-S244 PolarHBondContact O-N 3.33Å; V242-F245 PolarHBondContact O-N 3.13Å; V242-F245 VanDerWaalsContact O-N 3.1Å; V242-A248 HydrophobicContact CG1-CB 4.39Å; V242-P249 WeakPolarHBondContact CG1-O 3.34Å; V242-S251 WeakPolarHBondContact O-CB 3.42Å; V242-S251 PolarHBondContact O-OG 3.1Å; V242-W254 HydrophobicContact CB-CB 4.33Å; V242-W254 HydrophobicContact CB-CD2 3.61Å; V242-W254 HydrophobicContact CB-CE3 4.11Å; V242-W254 HydrophobicContact CB-CG 3.67Å; V242-W254 HydrophobicContact CG1-CD2 4.16Å; V242-W254 HydrophobicContact CG1-CE3 4.18Å; V242-W254 HydrophobicContact CG1-CG 4.39Å; V242-W254 HydrophobicContact CG2-CD2 3.73Å; V242-W254 VanDerWaalsContact CG2-CE2 3.46Å; V242-W254 HydrophobicContact CG2-CE3 4.16Å; V242-W254 HydrophobicContact CG2-CG 4.24Å; V242-W254 HydrophobicContact CG2-CH2 4.15Å; V242-W254 HydrophobicContact CG2-CZ2 3.7Å; V242-W254 HydrophobicContact CG2-CZ3 4.36Å; V242-Y288 HydrophobicContact CB-CE1 4.43Å; V242-Y288 HydrophobicContact CG1-CE1 3.69Å; V242-Y288 HydrophobicContact CG2-CD1 3.85Å; V242-Y288 HydrophobicContact CG2-CE1 3.79Å; V242-Y288 HydrophobicContact CG2-CG 4.26Å; V242-P639 HydrophobicContact CB-CB 4.45Å; V242-P639 HydrophobicContact CB-CG 4.2Å; V242-P639 HydrophobicContact CG1-CG 3.99Å; V242-P639 HydrophobicContact CG2-CB 3.86Å; V242-P639 HydrophobicContact CG2-CG 4.04Å
243	S	95.5	Very high	94.8	Very high	54 Å²	54	44.6 Å²	44.6	38%	0.378	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-66.3	-17.6	174.6	49.4	0	0	0	0	114.2	S241 F245	S241-S243 PolarHBondContact O-N 2.92Å; S241-S243 PolarHBondContact OG-N 3.37Å; S241-S243 PolarHBondContact OG-OG 2.82Å; S243-F245 VanDerWaalsContact C-N 3.29Å
244	S	95.8	Very high	94.9	Very high	17 Å²	17	40.7 Å²	40.7	12%	0.119	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-71.6	-23.9	171.3	-50.9	0	0	0	0	112.8	S241 V242	S241-S244 VanDerWaalsContact O-CB 3.27Å; S241-S244 WeakPolarHBondContact O-CB 3.19Å; S241-S244 PolarHBondContact O-N 3.24Å; S241-S244 PolarHBondContact O-OG 3.11Å; V242-S244 PolarHBondContact O-N 3.33Å
245	F	97.1	Very high	94.8	Very high	3 Å²	3	41.6 Å²	41.6	1%	0.013	26%	0.263	C	S	.	.			trans	-105.5	79	-171.7	-55.2	-94.9	0	0	0	111.3	A240 S241 V242 S243 H247 A248 S251 F585 L591 L637 Y638 P639	A240-F245 HydrophobicContact CB-CE2 3.59Å; A240-F245 HydrophobicContact CB-CZ 3.66Å; S241-F245 WeakPolarHBondContact O-CD2 3.47Å; S241-F245 VanDerWaalsContact O-CE2 3.29Å; S241-F245 WeakPolarHBondContact O-CE2 3.47Å; V242-F245 PolarHBondContact O-N 3.13Å; V242-F245 VanDerWaalsContact O-N 3.1Å; S243-F245 VanDerWaalsContact C-N 3.29Å; F245-H247 PolarHBondContact O-N 2.79Å; F245-A248 HydrophobicContact CB-CB 3.79Å; F245-A248 VanDerWaalsContact O-CB 3.31Å; F245-A248 WeakPolarHBondContact O-CB 3.28Å; F245-A248 PolarHBondContact O-N 2.88Å; F245-S251 VanDerWaalsContact O-CB 3.3Å; F245-S251 WeakPolarHBondContact O-CB 3.28Å; F245-S251 PolarHBondContact O-OG 2.85Å; F245-F585 HydrophobicContact CD1-CE1 4.43Å; F245-F585 AromaticContact CD1-CZ 3.93Å; F245-F585 HydrophobicContact CD1-CZ 3.93Å; F245-F585 HydrophobicContact CD2-CZ 4.46Å; F245-F585 AromaticContact CE1-CE1 3.76Å; F245-F585 HydrophobicContact CE1-CE1 3.76Å; F245-F585 AromaticContact CE1-CZ 3.7Å; F245-F585 HydrophobicContact CE1-CZ 3.7Å; F245-F585 HydrophobicContact CE2-CE1 4.09Å; F245-F585 HydrophobicContact CE2-CZ 4.27Å; F245-F585 HydrophobicContact CG-CZ 4.33Å; F245-F585 AromaticContact CZ-CE1 3.57Å; F245-F585 HydrophobicContact CZ-CE1 3.57Å; F245-F585 AromaticContact CZ-CZ 3.9Å; F245-F585 HydrophobicContact CZ-CZ 3.9Å; F245-L591 HydrophobicContact CE1-CB 4.37Å; F245-L591 HydrophobicContact CE1-CD2 4.19Å; F245-L591 HydrophobicContact CZ-CB 3.88Å; F245-L591 HydrophobicContact CZ-CD2 4.13Å; F245-L637 HydrophobicContact CD1-CB 4.19Å; F245-L637 VanDerWaalsContact CD1-O 3.26Å; F245-L637 WeakPolarHBondContact CD1-O 3.39Å; F245-L637 HydrophobicContact CE1-CB 3.92Å; F245-Y638 WeakPolarHBondContact CE1-O 3.38Å; F245-Y638 WeakPolarHBondContact CZ-O 3.26Å; F245-P639 HydrophobicContact CB-CG 4.16Å; F245-P639 HydrophobicContact CD2-CB 3.93Å; F245-P639 HydrophobicContact CD2-CG 3.51Å; F245-P639 HydrophobicContact CE2-CB 3.82Å; F245-P639 HydrophobicContact CE2-CG 3.93Å; F245-P639 HydrophobicContact CG-CG 3.89Å; F245-P639 HydrophobicContact CZ-CB 4.49Å
246	A	93.6	Very high	94.8	Very high	68 Å²	68	40.7 Å²	40.7	56%	0.562	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	3	-170.5	0	0	0	0	0	117.5
247	H	94.9	Very high	95	Very high	26 Å²	26	37 Å²	37	12%	0.12	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-9.5	173.5	66.6	-90	0	0	0	113	F245 W422 S634 L637 Y638	F245-H247 PolarHBondContact O-N 2.79Å; H247-W422 HydrophobicContact CB-CD2 4.29Å; H247-W422 HydrophobicContact CB-CE3 3.5Å; H247-W422 VanDerWaalsContact CB-CE3 3.5Å; H247-W422 HydrophobicContact CB-CH2 3.9Å; H247-W422 HydrophobicContact CB-CZ3 3.29Å; H247-S634 PolarHBondContact CE1-O 2.78Å; H247-S634 PolarHBondContact ND1-O 3.28Å; H247-L637 PolarHBondContact CE1-O 3.03Å; H247-L637 PolarHBondContact NE2-O 2.83Å; H247-L637 VanDerWaalsContact NE2-O 3.14Å; H247-Y638 AromaticContact CD2-CE1 3.83Å; H247-Y638 AromaticContact NE2-CD1 3.28Å; H247-Y638 VanDerWaalsContact NE2-CD1 3.28Å; H247-Y638 WeakPolarHBondContact NE2-CD1 3.41Å; H247-Y638 AromaticContact NE2-CE1 3.18Å; H247-Y638 WeakPolarHBondContact NE2-CE1 3.21Å
248	A	96.5	Very high	95.1	Very high	9 Å²	9	39 Å²	39	7%	0.074	24%	0.241	C	C	.	.	S	Bend	trans	-79.5	149.5	-175.5	0	0	0	0	0	111.7	V242 F245 L250 S251 Y288 P639	V242-A248 HydrophobicContact CG1-CB 4.39Å; F245-A248 HydrophobicContact CB-CB 3.79Å; F245-A248 VanDerWaalsContact O-CB 3.31Å; F245-A248 WeakPolarHBondContact O-CB 3.28Å; F245-A248 PolarHBondContact O-N 2.88Å; A248-L250 PolarHBondContact O-N 3.22Å; A248-S251 VanDerWaalsContact O-CB 3.27Å; A248-S251 WeakPolarHBondContact O-CB 3.42Å; A248-S251 PolarHBondContact O-N 2.73Å; A248-Y288 WeakPolarHBondContact CB-OH 3.43Å; A248-P639 HydrophobicContact CB-CG 3.9Å
249	P	96.1	Very high	95.2	Very high	10 Å²	10	38.1 Å²	38.1	7%	0.065	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.2	139	173.1	-30.4	35.3	0	0	0	113.3	V242 S251 Y288 L361 M365 L645	V242-P249 WeakPolarHBondContact CG1-O 3.34Å; P249-S251 PolarHBondContact O-N 2.69Å; P249-Y288 VanDerWaalsContact CD-OH 3.31Å; P249-Y288 WeakPolarHBondContact CD-OH 3.26Å; P249-Y288 PolarHBondContact O-OH 3.31Å; P249-L361 HydrophobicContact CB-CD1 4Å; P249-M365 HydrophobicContact CB-CG 4.31Å; P249-M365 HydrophobicContact CB-SD 4.13Å; P249-M365 HydrophobicContact CG-CG 4.24Å; P249-M365 HydrophobicContact CG-SD 3.48Å; P249-M365 WeakPolarHBondContact CG-SD 3.4Å; P249-L645 HydrophobicContact CB-CD2 4.02Å; P249-L645 HydrophobicContact CG-CD2 3.99Å
250	L	96.1	Very high	95.1	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.021	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	58	4.8	-177.4	-62.8	174.2	0	0	0	117.7	A248 S252 D253 W254 V310 F357 K360 L361 S364	A248-L250 PolarHBondContact O-N 3.22Å; L250-S252 VanDerWaalsContact C-N 3.25Å; L250-S252 PolarHBondContact O-N 2.87Å; L250-S252 VanDerWaalsContact O-N 3.11Å; L250-D253 CarbonylContact O-C 3.57Å; L250-D253 WeakPolarHBondContact O-CA 3.36Å; L250-D253 PolarHBondContact O-N 2.89Å; L250-W254 HydrophobicContact CB-CE3 3.82Å; L250-W254 HydrophobicContact CB-CZ3 4.15Å; L250-W254 HydrophobicContact CD1-CE3 4.23Å; L250-W254 HydrophobicContact CD1-CZ3 3.8Å; L250-W254 PolarHBondContact O-N 2.84Å; L250-W254 VanDerWaalsContact O-N 3.13Å; L250-V310 HydrophobicContact CD1-CG1 4.28Å; L250-F357 HydrophobicContact CD1-CD2 4.12Å; L250-F357 HydrophobicContact CD1-CE1 3.98Å; L250-F357 HydrophobicContact CD1-CE2 3.5Å; L250-F357 VanDerWaalsContact CD1-CE2 3.5Å; L250-F357 HydrophobicContact CD1-CZ 3.41Å; L250-F357 VanDerWaalsContact CD1-CZ 3.41Å; L250-K360 HydrophobicContact CD2-CB 3.49Å; L250-K360 VanDerWaalsContact CD2-CB 3.49Å; L250-L361 HydrophobicContact CD1-CB 4.01Å; L250-L361 HydrophobicContact CD1-CD1 3.84Å; L250-L361 HydrophobicContact CD1-CG 4.42Å; L250-L361 HydrophobicContact CD2-CB 4.25Å; L250-L361 HydrophobicContact CG-CB 4.16Å; L250-L361 HydrophobicContact CG-CD1 3.95Å; L250-S364 PolarHBondContact N-OG 3Å
251	S	95.2	Very high	95.1	Very high	15 Å²	15	39.1 Å²	39.1	11%	0.105	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-54.4	-36.2	-175.2	-173.4	0	0	0	0	114.5	V242 F245 A248 P249 D253	V242-S251 WeakPolarHBondContact O-CB 3.42Å; V242-S251 PolarHBondContact O-OG 3.1Å; F245-S251 VanDerWaalsContact O-CB 3.3Å; F245-S251 WeakPolarHBondContact O-CB 3.28Å; F245-S251 PolarHBondContact O-OG 2.85Å; A248-S251 VanDerWaalsContact O-CB 3.27Å; A248-S251 WeakPolarHBondContact O-CB 3.42Å; A248-S251 PolarHBondContact O-N 2.73Å; P249-S251 PolarHBondContact O-N 2.69Å; S251-D253 VanDerWaalsContact C-N 3.27Å; S251-D253 PolarHBondContact O-N 3.33Å
252	S	92.4	Very high	95.1	Very high	105 Å²	105	38 Å²	38	73%	0.734	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-73.8	-10.1	176.3	49.9	0	0	0	0	115.7	L250	L250-S252 VanDerWaalsContact C-N 3.25Å; L250-S252 PolarHBondContact O-N 2.87Å; L250-S252 VanDerWaalsContact O-N 3.11Å
253	D	92.9	Very high	95.1	Very high	52 Å²	52	38 Å²	38	28%	0.278	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-129.8	12.9	-169.3	-66.5	-103	0	0	0	111.2	L250 S251 K360	L250-D253 CarbonylContact O-C 3.57Å; L250-D253 WeakPolarHBondContact O-CA 3.36Å; L250-D253 PolarHBondContact O-N 2.89Å; S251-D253 VanDerWaalsContact C-N 3.27Å; S251-D253 PolarHBondContact O-N 3.33Å; D253-K360 HydrophobicContact CB-CD 3.97Å; D253-K360 WeakPolarHBondContact OD1-CD 3.49Å; D253-K360 VanDerWaalsContact OD1-CE 3.29Å; D253-K360 WeakPolarHBondContact OD1-CE 3.18Å; D253-K360 IonicContact OD1-NZ 3.72Å; D253-K360 PolarHBondContact OD1-NZ 3.23Å
254	W	95.3	Very high	95.2	Very high	7 Å²	7	35.6 Å²	35.6	3%	0.027	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-81.8	-15.5	-174.2	-156.7	-102.3	0	0	0	113.7	V242 L250 D256 V257 V285 G287 Y288 I309 V310 F357	V242-W254 HydrophobicContact CB-CB 4.33Å; V242-W254 HydrophobicContact CB-CD2 3.61Å; V242-W254 HydrophobicContact CB-CE3 4.11Å; V242-W254 HydrophobicContact CB-CG 3.67Å; V242-W254 HydrophobicContact CG1-CD2 4.16Å; V242-W254 HydrophobicContact CG1-CE3 4.18Å; V242-W254 HydrophobicContact CG1-CG 4.39Å; V242-W254 HydrophobicContact CG2-CD2 3.73Å; V242-W254 VanDerWaalsContact CG2-CE2 3.46Å; V242-W254 HydrophobicContact CG2-CE3 4.16Å; V242-W254 HydrophobicContact CG2-CG 4.24Å; V242-W254 HydrophobicContact CG2-CH2 4.15Å; V242-W254 HydrophobicContact CG2-CZ2 3.7Å; V242-W254 HydrophobicContact CG2-CZ3 4.36Å; L250-W254 HydrophobicContact CB-CE3 3.82Å; L250-W254 HydrophobicContact CB-CZ3 4.15Å; L250-W254 HydrophobicContact CD1-CE3 4.23Å; L250-W254 HydrophobicContact CD1-CZ3 3.8Å; L250-W254 PolarHBondContact O-N 2.84Å; L250-W254 VanDerWaalsContact O-N 3.13Å; W254-D256 PolarHBondContact O-N 2.87Å; W254-D256 VanDerWaalsContact O-N 3.15Å; W254-V257 HydrophobicContact CD2-CB 4.16Å; W254-V257 HydrophobicContact CD2-CG2 3.95Å; W254-V257 HydrophobicContact CE3-CG2 4.01Å; W254-V257 HydrophobicContact CG-CB 4.43Å; W254-V257 HydrophobicContact CG-CG2 4.48Å; W254-V257 HydrophobicContact CH2-CG1 4.37Å; W254-V257 HydrophobicContact CH2-CG2 4.29Å; W254-V257 HydrophobicContact CZ2-CB 4.23Å; W254-V257 HydrophobicContact CZ2-CG1 3.78Å; W254-V257 HydrophobicContact CZ2-CG2 4.24Å; W254-V257 HydrophobicContact CZ3-CG2 4.19Å; W254-V257 WeakPolarHBondContact O-CB 3.34Å; W254-V257 PolarHBondContact O-N 2.62Å; W254-V285 HydrophobicContact CZ2-CG1 4.33Å; W254-G287 VanDerWaalsContact CZ2-O 3.25Å; W254-G287 WeakPolarHBondContact CZ2-O 3.48Å; W254-Y288 AromaticContact CH2-CD1 3.67Å; W254-Y288 HydrophobicContact CH2-CD1 3.67Å; W254-Y288 HydrophobicContact CH2-CE1 4.3Å; W254-Y288 HydrophobicContact CZ2-CD1 4.41Å; W254-Y288 AromaticContact CZ3-CD1 3.87Å; W254-Y288 HydrophobicContact CZ3-CD1 3.87Å; W254-Y288 HydrophobicContact CZ3-CE1 4.05Å; W254-I309 HydrophobicContact CH2-CB 4.37Å; W254-I309 HydrophobicContact CH2-CD1 3.98Å; W254-I309 HydrophobicContact CH2-CG2 4.38Å; W254-I309 HydrophobicContact CZ2-CD1 3.77Å; W254-V310 HydrophobicContact CH2-CG1 4.49Å; W254-V310 HydrophobicContact CZ3-CG1 4.44Å; W254-F357 HydrophobicContact CE3-CE2 4.48Å; W254-F357 HydrophobicContact CH2-CZ 4.28Å; W254-F357 AromaticContact CZ3-CE2 3.99Å; W254-F357 HydrophobicContact CZ3-CE2 3.99Å; W254-F357 AromaticContact CZ3-CZ 3.86Å; W254-F357 HydrophobicContact CZ3-CZ 3.86Å
255	D	91	Very high	95.3	Very high	132 Å²	132	35 Å²	35	71%	0.706	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-63.7	-19	177.9	-62.5	-16.2	0	0	0	112.7	V257	D255-V257 PolarHBondContact O-N 3.16Å
256	D	90.8	Very high	95.2	Very high	80 Å²	80	36.2 Å²	36.2	43%	0.428	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-70.6	-16.3	170.6	-71.7	-34.3	0	0	0	112.9	W254 V258 P354 K360	W254-D256 PolarHBondContact O-N 2.87Å; W254-D256 VanDerWaalsContact O-N 3.15Å; D256-V258 PolarHBondContact O-N 3.4Å; D256-P354 HydrophobicContact CB-CG 3.49Å; D256-P354 VanDerWaalsContact CB-CG 3.49Å; D256-P354 WeakPolarHBondContact OD2-CG 3.1Å; D256-K360 IonicContact OD2-NZ 3.75Å; D256-K360 PolarHBondContact OD2-NZ 3.27Å
257	V	94.9	Very high	95.2	Very high	12 Å²	12	33.5 Å²	33.5	7%	0.073	20%	0.201	C	C	.	.			trans	-97.5	90.1	-173	-176.7	0	0	0	0	110.6	W254 D255 M261 V285 I309 F357	W254-V257 HydrophobicContact CD2-CB 4.16Å; W254-V257 HydrophobicContact CD2-CG2 3.95Å; W254-V257 HydrophobicContact CE3-CG2 4.01Å; W254-V257 HydrophobicContact CG-CB 4.43Å; W254-V257 HydrophobicContact CG-CG2 4.48Å; W254-V257 HydrophobicContact CH2-CG1 4.37Å; W254-V257 HydrophobicContact CH2-CG2 4.29Å; W254-V257 HydrophobicContact CZ2-CB 4.23Å; W254-V257 HydrophobicContact CZ2-CG1 3.78Å; W254-V257 HydrophobicContact CZ2-CG2 4.24Å; W254-V257 HydrophobicContact CZ3-CG2 4.19Å; W254-V257 WeakPolarHBondContact O-CB 3.34Å; W254-V257 PolarHBondContact O-N 2.62Å; D255-V257 PolarHBondContact O-N 3.16Å; V257-M261 HydrophobicContact CG1-CE 3.91Å; V257-V285 HydrophobicContact CG1-CG1 4.27Å; V257-V285 HydrophobicContact CG1-CG2 4.26Å; V257-I309 HydrophobicContact CG1-CD1 3.92Å; V257-F357 HydrophobicContact CG2-CD2 4.49Å; V257-F357 HydrophobicContact CG2-CE2 3.72Å
258	V	94.4	Very high	95	Very high	57 Å²	57	37.5 Å²	37.5	35%	0.345	23%	0.228	S	C	.	.			trans	-114.4	147.4	-171.8	-60.7	0	0	0	0	114.2	D256 M261	D256-V258 PolarHBondContact O-N 3.4Å; V258-M261 HydrophobicContact CG2-CB 4.2Å; V258-M261 WeakPolarHBondContact O-CB 3.34Å; V258-M261 VanDerWaalsContact O-CG 3.27Å; V258-M261 WeakPolarHBondContact O-CG 3.42Å; V258-M261 PolarHBondContact O-N 2.66Å
259	V	96.1	Very high	94.6	Very high	91 Å²	91	38.8 Å²	38.8	55%	0.552	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	140.9	166.7	172.1	0	0	0	0	109.8	L283 V285	V259-L283 VanDerWaalsContact CG1-O 3.27Å; V259-L283 WeakPolarHBondContact CG1-O 3.37Å; V259-V285 HydrophobicContact CG2-CG2 4.2Å
260	G	96.3	Very high	94.2	Very high	35 Å²	35	39.4 Å²	39.4	36%	0.361	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.6	-9.6	-174.8	0	0	0	0	0	114.9	V282	G260-V282 PolarHBondContact N-O 3.21Å
261	M	96.8	Very high	93.3	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	27%	0.27	C	S	.	.			trans	-65.8	147.6	176.6	78.9	172.5	171.3	0	0	112.1	V257 V258 V263 V282 T351 L353	V257-M261 HydrophobicContact CG1-CE 3.91Å; V258-M261 HydrophobicContact CG2-CB 4.2Å; V258-M261 WeakPolarHBondContact O-CB 3.34Å; V258-M261 VanDerWaalsContact O-CG 3.27Å; V258-M261 WeakPolarHBondContact O-CG 3.42Å; V258-M261 PolarHBondContact O-N 2.66Å; M261-V263 HydrophobicContact CE-CG1 4.33Å; M261-V263 HydrophobicContact CG-CG1 4.44Å; M261-V263 HydrophobicContact SD-CG1 4.5Å; M261-V282 HydrophobicContact CE-CG2 3.76Å; M261-V282 HydrophobicContact CG-CB 4.07Å; M261-V282 HydrophobicContact CG-CG2 3.62Å; M261-V282 PolarHBondContact O-N 2.85Å; M261-T351 WeakPolarHBondContact CB-OG1 3.23Å; M261-L353 HydrophobicContact CE-CD2 3.68Å; M261-L353 HydrophobicContact CE-CG 3.94Å; M261-L353 HydrophobicContact SD-CD2 4.14Å; M261-L353 HydrophobicContact SD-CG 4.13Å
262	K	97.9	Very high	92.6	Very high	20 Å²	20	48 Å²	48	9%	0.087	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	135.4	178.9	-56.1	-71.8	-178.1	177.4	0	110	I279 A280 T281 E295 I317 K346 L347 S350 T351 T352	K262-I279 HydrophobicContact CB-CG2 4.29Å; K262-A280 CarbonylContact C-O 3.53Å; K262-A280 WeakPolarHBondContact CA-O 3.27Å; K262-T281 WeakPolarHBondContact CD-OG1 3.26Å; K262-T281 WeakPolarHBondContact CE-OG1 3.32Å; K262-T281 PolarHBondContact NZ-OG1 2.56Å; K262-E295 IonicContact NZ-OE1 2.82Å; K262-E295 PolarHBondContact NZ-OE1 2.87Å; K262-E295 IonicContact NZ-OE2 2.67Å; K262-E295 PolarHBondContact NZ-OE2 2.67Å; K262-I317 HydrophobicContact CB-CD1 3.92Å; K262-I317 HydrophobicContact CB-CG1 4Å; K262-K346 WeakPolarHBondContact CE-O 3.46Å; K262-L347 HydrophobicContact CB-CD2 4.03Å; K262-L347 HydrophobicContact CG-CD2 4.04Å; K262-S350 WeakPolarHBondContact CG-OG 3.47Å; K262-T351 PolarHBondContact N-O 3.18Å; K262-T352 WeakPolarHBondContact O-CA 3.42Å; K262-T352 WeakPolarHBondContact O-CB 3.43Å; K262-T352 PolarHBondContact O-OG1 3Å
263	V	97.9	Very high	91.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	149.6	179.5	-66.5	0	0	0	0	111.3	M261 I279 A280 L292 L314 N315 L353	M261-V263 HydrophobicContact CE-CG1 4.33Å; M261-V263 HydrophobicContact CG-CG1 4.44Å; M261-V263 HydrophobicContact SD-CG1 4.5Å; V263-I279 CarbonylContact O-C 3.6Å; V263-I279 VanDerWaalsContact O-CA 3.3Å; V263-I279 WeakPolarHBondContact O-CA 3.31Å; V263-A280 HydrophobicContact CG2-CB 4.4Å; V263-A280 PolarHBondContact N-O 3.13Å; V263-A280 PolarHBondContact O-N 3.09Å; V263-L292 HydrophobicContact CG2-CD2 4.18Å; V263-L314 HydrophobicContact CB-CB 4.49Å; V263-L314 HydrophobicContact CG1-CD2 4.4Å; V263-L314 HydrophobicContact CG2-CD2 4.08Å; V263-L314 HydrophobicContact CG2-CG 4.17Å; V263-N315 WeakPolarHBondContact CA-O 3.2Å; V263-L353 HydrophobicContact CG1-CD1 3.77Å; V263-L353 HydrophobicContact CG1-CG 3.89Å
264	E	97.9	Very high	91.3	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.019	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	121	167.3	-67.4	178.8	179.5	0	0	109.3	W278 I279 L314 N315 I317 G318 W319 C320 L327	E264-W278 WeakPolarHBondContact CA-O 3.41Å; E264-I279 HydrophobicContact CG-CG1 4.2Å; E264-L314 CarbonylContact O-C 3.58Å; E264-N315 HydrophobicContact CB-CB 4.19Å; E264-N315 PolarHBondContact N-O 2.89Å; E264-N315 WeakPolarHBondContact O-CB 3.44Å; E264-N315 PolarHBondContact O-N 2.78Å; E264-I317 HydrophobicContact CG-CD1 4.02Å; E264-G318 PolarHBondContact OE1-N 3.41Å; E264-W319 PolarHBondContact OE2-N 3.04Å; E264-C320 VanDerWaalsContact OE2-CB 3.23Å; E264-C320 WeakPolarHBondContact OE2-CB 3.33Å; E264-C320 PolarHBondContact OE2-N 3.25Å; E264-C320 PolarHBondContact OE2-SG 3.33Å; E264-L327 HydrophobicContact CG-CD2 4.12Å
265	V	97	Very high	91.1	Very high	3 Å²	3	58.3 Å²	58.3	2%	0.018	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	158.4	-175.9	66.2	0	0	0	0	110.2	N267 Y277 W278 A280 L292 Y294 F305 L314	V265-N267 PolarHBondContact O-N 3.34Å; V265-Y277 CarbonylContact O-C 3.59Å; V265-Y277 VanDerWaalsContact O-CA 3.23Å; V265-Y277 WeakPolarHBondContact O-CA 3.18Å; V265-Y277 WeakPolarHBondContact O-CB 3.3Å; V265-W278 PolarHBondContact N-O 2.98Å; V265-W278 PolarHBondContact O-N 3.5Å; V265-A280 HydrophobicContact CG1-CB 3.82Å; V265-L292 HydrophobicContact CB-CD1 4.48Å; V265-L292 HydrophobicContact CG1-CD1 4.39Å; V265-L292 HydrophobicContact CG2-CD1 4.12Å; V265-Y294 HydrophobicContact CG1-CE1 3.98Å; V265-F305 HydrophobicContact CG1-CZ 3.96Å; V265-F305 HydrophobicContact CG2-CE2 4.36Å; V265-F305 HydrophobicContact CG2-CZ 4.47Å; V265-L314 HydrophobicContact CG2-CD1 4.26Å; V265-L314 HydrophobicContact CG2-CG 4.47Å
266	L	95.2	Very high	91.2	Very high	30 Å²	30	52.3 Å²	52.3	16%	0.157	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	122.6	178	-178	71.6	0	0	0	110.4	T268 K275 Y294	L266-T268 PolarHBondContact O-N 3.12Å; L266-K275 HydrophobicContact CD1-CB 3.81Å; L266-K275 HydrophobicContact CD1-CD 3.7Å; L266-K275 HydrophobicContact CD1-CG 3.71Å; L266-K275 HydrophobicContact CD2-CD 4.45Å; L266-Y294 PolarHBondContact O-OH 3.33Å; L266-Y294 VanDerWaalsContact O-OH 3.08Å
267	N	94.1	Very high	91.5	Very high	10 Å²	10	49.7 Å²	49.7	5%	0.053	29%	0.292	C	S	.	.			trans	-80.8	108.1	176.1	-174.7	-3.2	0	0	0	109.9	V265 N269 A270 V276 W278 V328 P329	V265-N267 PolarHBondContact O-N 3.34Å; N267-N269 VanDerWaalsContact OD1-C 3.31Å; N267-N269 WeakPolarHBondContact OD1-CA 3.4Å; N267-N269 PolarHBondContact OD1-N 2.67Å; N267-A270 HydrophobicContact CB-CB 4.32Å; N267-V276 PolarHBondContact N-O 3.38Å; N267-W278 HydrophobicContact CB-CB 3.93Å; N267-V328 PolarHBondContact ND2-O 3.27Å; N267-P329 PolarHBondContact ND2-O 3.41Å
268	T	91	Very high	91.6	Very high	111 Å²	111	49.4 Å²	49.4	68%	0.681	29%	0.289	S	S	*	.	S	Bend	trans	-81.2	-20.1	177.3	49	0	0	0	0	113.7	L266 Y294	L266-T268 PolarHBondContact O-N 3.12Å; T268-Y294 PolarHBondContact N-OH 2.97Å; T268-Y294 PolarHBondContact OG1-OH 3.43Å
269	N	88.3	Confident	91.7	Very high	36 Å²	36	46.8 Å²	46.8	19%	0.193	27%	0.273	C	S	.	.	S	Bend	trans	-106.1	48.4	177.2	-168.6	14.3	0	0	0	111.5	N267 Y297 P330 Q331 D332	N267-N269 VanDerWaalsContact OD1-C 3.31Å; N267-N269 WeakPolarHBondContact OD1-CA 3.4Å; N267-N269 PolarHBondContact OD1-N 2.67Å; N269-Y297 PolarHBondContact ND2-OH 2.61Å; N269-P330 HydrophobicContact CB-CB 4.34Å; N269-P330 CarbonylContact O-C 3.51Å; N269-P330 VanDerWaalsContact O-CA 3.28Å; N269-P330 WeakPolarHBondContact O-CA 3.37Å; N269-Q331 PolarHBondContact O-N 3.44Å; N269-D332 PolarHBondContact ND2-OD2 2.79Å
270	A	85.8	Confident	91.8	Very high	23 Å²	23	42.5 Å²	42.5	19%	0.19	25%	0.247	C	C	.	.			trans	-103.3	140.3	179.4	0	0	0	0	0	111.8	N267 L272 V276	N267-A270 HydrophobicContact CB-CB 4.32Å; A270-L272 PolarHBondContact O-N 3.06Å; A270-V276 HydrophobicContact CB-CG2 3.48Å; A270-V276 VanDerWaalsContact CB-CG2 3.48Å
271	V	78.1	Confident	91.9	Very high	110 Å²	110	41.8 Å²	41.8	67%	0.667	24%	0.236	S	C	*	.	S	Bend	trans	-61.1	-15.4	173.7	-162.2	0	0	0	0	112.7	Q331	V271-Q331 HydrophobicContact CG2-CB 4Å; V271-Q331 HydrophobicContact CG2-CG 3.96Å
272	L	79.9	Confident	91.9	Very high	89 Å²	89	41.7 Å²	41.7	47%	0.466	24%	0.236	S	C	.	.	S	Bend	trans	-101.9	130	-174	-63.4	173.9	0	0	0	111.6	A270 N274 V276 V328	A270-L272 PolarHBondContact O-N 3.06Å; L272-N274 PolarHBondContact O-N 2.78Å; L272-V276 HydrophobicContact CD1-CG1 4.17Å; L272-V328 HydrophobicContact CD1-CG1 4.43Å; L272-V328 HydrophobicContact CD1-CG2 4.23Å
273	S	74	Confident	91.8	Very high	130 Å²	130	43.7 Å²	43.7	91%	0.909	25%	0.247	S	C	*	.	S	Bend	trans	-72.8	-1.6	176.5	55.7	0	0	0	0	115.3
274	N	85.4	Confident	91.8	Very high	123 Å²	123	46.2 Å²	46.2	66%	0.658	26%	0.259	S	S	*	.	S	Bend	trans	-90.2	147	173.3	-75.1	-49.7	0	0	0	110.2	L272 V276	L272-N274 PolarHBondContact O-N 2.78Å; N274-V276 PolarHBondContact O-N 2.77Å
275	K	89.8	Confident	91.7	Very high	127 Å²	127	47.8 Å²	47.8	55%	0.552	27%	0.268	S	S	*	.			trans	-59.3	100.2	171.3	-77.9	-153.7	162.5	-151.3	0	110.8	L266 E313	L266-K275 HydrophobicContact CD1-CB 3.81Å; L266-K275 HydrophobicContact CD1-CD 3.7Å; L266-K275 HydrophobicContact CD1-CG 3.71Å; L266-K275 HydrophobicContact CD2-CD 4.45Å; K275-E313 IonicContact NZ-OE1 3.57Å; K275-E313 PolarHBondContact NZ-OE1 2.73Å
276	V	94.3	Very high	91.7	Very high	7 Å²	7	47.7 Å²	47.7	4%	0.042	27%	0.268	C	S	.	.			trans	-112.1	162.4	170.7	-66	0	0	0	0	109.4	N267 A270 L272 N274 L326 V328	N267-V276 PolarHBondContact N-O 3.38Å; A270-V276 HydrophobicContact CB-CG2 3.48Å; A270-V276 VanDerWaalsContact CB-CG2 3.48Å; L272-V276 HydrophobicContact CD1-CG1 4.17Å; N274-V276 PolarHBondContact O-N 2.77Å; V276-L326 HydrophobicContact CG1-CB 4.38Å; V276-V328 HydrophobicContact CB-CB 4.15Å; V276-V328 HydrophobicContact CB-CG2 3.9Å; V276-V328 HydrophobicContact CG1-CG2 3.93Å; V276-V328 HydrophobicContact CG2-CB 4.02Å; V276-V328 HydrophobicContact CG2-CG2 4.21Å
277	Y	96.6	Very high	91.8	Very high	24 Å²	24	46.3 Å²	46.3	9%	0.094	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	162.9	-170.8	-67.8	-102.5	0	0	0	110.3	V265 W319 C320 K325 L326 L327 V328	V265-Y277 CarbonylContact O-C 3.59Å; V265-Y277 VanDerWaalsContact O-CA 3.23Å; V265-Y277 WeakPolarHBondContact O-CA 3.18Å; V265-Y277 WeakPolarHBondContact O-CB 3.3Å; Y277-W319 HydrophobicContact CD1-CZ3 4.23Å; Y277-W319 HydrophobicContact CD2-CZ3 4.49Å; Y277-W319 HydrophobicContact CE1-CH2 4.31Å; Y277-W319 AromaticContact CE1-CZ3 3.86Å; Y277-W319 HydrophobicContact CE1-CZ3 3.86Å; Y277-W319 HydrophobicContact CE2-CZ3 4.15Å; Y277-W319 AromaticContact CZ-CZ3 3.82Å; Y277-C320 VanDerWaalsContact CB-SG 3.53Å; Y277-K325 HydrophobicContact CD2-CB 4.09Å; Y277-K325 HydrophobicContact CD2-CG 4.42Å; Y277-K325 HydrophobicContact CE2-CB 4.37Å; Y277-K325 HydrophobicContact CE2-CD 4.26Å; Y277-K325 HydrophobicContact CE2-CG 4.2Å; Y277-L326 PolarHBondContact N-O 3.28Å; Y277-L327 CarbonylContact O-C 3.6Å; Y277-L327 VanDerWaalsContact O-CA 3.26Å; Y277-L327 WeakPolarHBondContact O-CA 3.47Å; Y277-V328 PolarHBondContact O-N 3.08Å
278	W	96.7	Very high	92	Very high	6 Å²	6	45.8 Å²	45.8	2%	0.023	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	168.9	167.1	-164.3	-118.4	0	0	0	111.1	E264 V265 N267 Y294 E295 L327 V328 P329 P330 W339 L343	E264-W278 WeakPolarHBondContact CA-O 3.41Å; V265-W278 PolarHBondContact N-O 2.98Å; V265-W278 PolarHBondContact O-N 3.5Å; N267-W278 HydrophobicContact CB-CB 3.93Å; W278-Y294 HydrophobicContact CB-CD1 4.04Å; W278-Y294 HydrophobicContact CB-CE1 4.22Å; W278-Y294 AromaticContact CD1-CD1 3.84Å; W278-Y294 HydrophobicContact CG-CD1 4.36Å; W278-E295 PolarHBondContact NE1-O 3.19Å; W278-L327 HydrophobicContact CE3-CB 3.94Å; W278-L327 HydrophobicContact CZ3-CB 3.96Å; W278-V328 VanDerWaalsContact CE3-O 3.24Å; W278-P329 HydrophobicContact CD2-CB 4.48Å; W278-P329 HydrophobicContact CE3-CB 4.48Å; W278-P329 HydrophobicContact CH2-CB 3.84Å; W278-P329 HydrophobicContact CH2-CG 4.42Å; W278-P329 HydrophobicContact CZ2-CB 3.87Å; W278-P329 HydrophobicContact CZ3-CB 4.17Å; W278-P330 HydrophobicContact CG-CG 4.41Å; W278-W339 HydrophobicContact CH2-CD2 4.14Å; W278-W339 AromaticContact CH2-CE3 3.84Å; W278-W339 HydrophobicContact CH2-CE3 3.84Å; W278-W339 HydrophobicContact CH2-CG 4.49Å; W278-W339 HydrophobicContact CH2-CZ3 4.36Å; W278-W339 HydrophobicContact CZ2-CD2 4.13Å; W278-W339 AromaticContact CZ2-CE3 3.44Å; W278-W339 HydrophobicContact CZ2-CE3 3.44Å; W278-W339 VanDerWaalsContact CZ2-CE3 3.44Å; W278-W339 HydrophobicContact CZ2-CH2 4.29Å; W278-W339 AromaticContact CZ2-CZ3 3.54Å; W278-W339 HydrophobicContact CZ2-CZ3 3.54Å; W278-L343 HydrophobicContact CH2-CD1 3.73Å; W278-L343 HydrophobicContact CH2-CG 4.49Å; W278-L343 HydrophobicContact CZ2-CD1 4.11Å; W278-L343 HydrophobicContact CZ2-CD2 4.27Å; W278-L343 HydrophobicContact CZ2-CG 4.47Å; W278-L343 HydrophobicContact CZ3-CD1 4.34Å
279	I	97.4	Very high	92.3	Very high	3 Å²	3	41.1 Å²	41.1	2%	0.015	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	136.5	177.9	-61	168.6	0	0	0	108.8	K262 V263 E264 E295 I317 L327 L343 L347	K262-I279 HydrophobicContact CB-CG2 4.29Å; V263-I279 CarbonylContact O-C 3.6Å; V263-I279 VanDerWaalsContact O-CA 3.3Å; V263-I279 WeakPolarHBondContact O-CA 3.31Å; E264-I279 HydrophobicContact CG-CG1 4.2Å; I279-E295 HydrophobicContact CB-CG 4.01Å; I279-E295 HydrophobicContact CG2-CG 3.63Å; I279-E295 PolarHBondContact O-N 3.23Å; I279-I317 HydrophobicContact CD1-CD1 4.28Å; I279-I317 HydrophobicContact CG1-CD1 4.08Å; I279-I317 HydrophobicContact CG2-CD1 3.83Å; I279-L327 HydrophobicContact CD1-CD1 4.01Å; I279-L327 HydrophobicContact CG1-CD1 4.25Å; I279-L327 HydrophobicContact CG1-CD2 4.34Å; I279-L343 HydrophobicContact CD1-CD1 4.14Å; I279-L343 HydrophobicContact CD1-CD2 4Å; I279-L347 HydrophobicContact CD1-CD1 3.98Å; I279-L347 HydrophobicContact CD1-CD2 4.38Å; I279-L347 HydrophobicContact CG2-CD2 4.31Å
280	A	97.8	Very high	92.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	153.6	174.5	0	0	0	0	0	111.4	K262 V263 V265 L292 R293 Y294	K262-A280 CarbonylContact C-O 3.53Å; K262-A280 WeakPolarHBondContact CA-O 3.27Å; V263-A280 HydrophobicContact CG2-CB 4.4Å; V263-A280 PolarHBondContact N-O 3.13Å; V263-A280 PolarHBondContact O-N 3.09Å; V265-A280 HydrophobicContact CG1-CB 3.82Å; A280-L292 HydrophobicContact CB-CB 4.22Å; A280-R293 CarbonylContact C-O 3.57Å; A280-R293 WeakPolarHBondContact CA-O 3.33Å; A280-R293 VanDerWaalsContact CB-O 3.32Å; A280-R293 WeakPolarHBondContact CB-O 3.34Å; A280-Y294 HydrophobicContact CB-CD1 4.39Å
281	T	97.7	Very high	93.3	Very high	20 Å²	20	39.7 Å²	39.7	12%	0.123	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	137.7	167.3	-63.1	0	0	0	0	110	K262 L283 L292 R293 E295	K262-T281 WeakPolarHBondContact CD-OG1 3.26Å; K262-T281 WeakPolarHBondContact CE-OG1 3.32Å; K262-T281 PolarHBondContact NZ-OG1 2.56Å; T281-L283 HydrophobicContact CG2-CD2 4.15Å; T281-L283 PolarHBondContact O-N 3.37Å; T281-L292 WeakPolarHBondContact O-CA 3.33Å; T281-R293 PolarHBondContact N-O 3.41Å; T281-R293 PolarHBondContact O-N 2.88Å; T281-E295 PolarHBondContact OG1-OE1 2.81Å
282	V	97.6	Very high	94.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	112.8	165.6	176.8	0	0	0	0	109.5	G260 M261 V285 A290 L292	G260-V282 PolarHBondContact N-O 3.21Å; M261-V282 HydrophobicContact CE-CG2 3.76Å; M261-V282 HydrophobicContact CG-CB 4.07Å; M261-V282 HydrophobicContact CG-CG2 3.62Å; M261-V282 PolarHBondContact O-N 2.85Å; V282-V285 HydrophobicContact CG1-CG2 3.65Å; V282-A290 HydrophobicContact CG1-CB 4.16Å; V282-A290 HydrophobicContact CG2-CB 4.48Å; V282-L292 HydrophobicContact CB-CD2 4.39Å; V282-L292 HydrophobicContact CG2-CD2 3.68Å
283	L	96.4	Very high	95.1	Very high	61 Å²	61	31.9 Å²	31.9	32%	0.319	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-34.6	177.3	-60.7	-172.9	0	0	0	112.9	V259 T281 L291 R293 D304	V259-L283 VanDerWaalsContact CG1-O 3.27Å; V259-L283 WeakPolarHBondContact CG1-O 3.37Å; T281-L283 HydrophobicContact CG2-CD2 4.15Å; T281-L283 PolarHBondContact O-N 3.37Å; L283-L291 HydrophobicContact CB-CB 4.48Å; L283-L291 HydrophobicContact CB-CD2 4.41Å; L283-L291 HydrophobicContact CB-CG 4.39Å; L283-L291 PolarHBondContact N-O 2.93Å; L283-R293 HydrophobicContact CD1-CB 3.85Å; L283-R293 HydrophobicContact CD2-CB 4.35Å; L283-R293 HydrophobicContact CG-CB 4.09Å; L283-D304 WeakPolarHBondContact CD1-OD2 3.42Å
284	Q	96	Very high	96.1	Very high	54 Å²	54	26 Å²	26	25%	0.252	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	146.7	-179.5	-173.1	178.2	-6.3	0	0	109.1	A290 L291 W306	Q284-A290 CarbonylContact O-C 3.46Å; Q284-A290 VanDerWaalsContact O-CA 3.26Å; Q284-A290 WeakPolarHBondContact O-CA 3.31Å; Q284-L291 HydrophobicContact CB-CB 3.92Å; Q284-L291 PolarHBondContact O-N 3.27Å; Q284-W306 HydrophobicContact CB-CH2 4.42Å; Q284-W306 HydrophobicContact CG-CH2 4.21Å
285	V	96.9	Very high	96.6	Very high	37 Å²	37	20.6 Å²	20.6	22%	0.224	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.7	169.2	-180	0	0	0	0	107.6	W254 V257 V259 V282 I309	W254-V285 HydrophobicContact CZ2-CG1 4.33Å; V257-V285 HydrophobicContact CG1-CG1 4.27Å; V257-V285 HydrophobicContact CG1-CG2 4.26Å; V259-V285 HydrophobicContact CG2-CG2 4.2Å; V282-V285 HydrophobicContact CG1-CG2 3.65Å; V285-I309 HydrophobicContact CG1-CD1 4.17Å
286	A	97.4	Very high	96.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	94.9	-176.9	0	0	0	0	0	109.6	L232 A239 Y288 K289 W306	L232-A286 HydrophobicContact CD1-CB 3.62Å; A239-A286 HydrophobicContact CB-CB 3.75Å; A286-Y288 PolarHBondContact O-N 3.02Å; A286-K289 PolarHBondContact N-O 2.94Å; A286-K289 WeakPolarHBondContact O-CB 3.31Å; A286-K289 PolarHBondContact O-N 2.96Å; A286-W306 HydrophobicContact CB-CH2 3.94Å; A286-W306 HydrophobicContact CB-CZ3 3.84Å
287	G	97.6	Very high	96.7	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.01	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	-124.4	-164.7	0	0	0	0	0	110.7	W254	W254-G287 VanDerWaalsContact CZ2-O 3.25Å; W254-G287 WeakPolarHBondContact CZ2-O 3.48Å
288	Y	98.1	Very high	96.3	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-3.1	174.9	-61.9	-68.6	0	0	0	114.7	V242 A248 P249 W254 A286 I309 V310 P639 V640 W642 L645	V242-Y288 HydrophobicContact CB-CE1 4.43Å; V242-Y288 HydrophobicContact CG1-CE1 3.69Å; V242-Y288 HydrophobicContact CG2-CD1 3.85Å; V242-Y288 HydrophobicContact CG2-CE1 3.79Å; V242-Y288 HydrophobicContact CG2-CG 4.26Å; A248-Y288 WeakPolarHBondContact CB-OH 3.43Å; P249-Y288 VanDerWaalsContact CD-OH 3.31Å; P249-Y288 WeakPolarHBondContact CD-OH 3.26Å; P249-Y288 PolarHBondContact O-OH 3.31Å; W254-Y288 AromaticContact CH2-CD1 3.67Å; W254-Y288 HydrophobicContact CH2-CD1 3.67Å; W254-Y288 HydrophobicContact CH2-CE1 4.3Å; W254-Y288 HydrophobicContact CZ2-CD1 4.41Å; W254-Y288 AromaticContact CZ3-CD1 3.87Å; W254-Y288 HydrophobicContact CZ3-CD1 3.87Å; W254-Y288 HydrophobicContact CZ3-CE1 4.05Å; A286-Y288 PolarHBondContact O-N 3.02Å; Y288-I309 WeakPolarHBondContact O-CB 3.2Å; Y288-I309 WeakPolarHBondContact O-CG1 3.23Å; Y288-I309 PolarHBondContact O-N 3.44Å; Y288-V310 HydrophobicContact CD1-CG1 3.54Å; Y288-V310 HydrophobicContact CD1-CG2 4.23Å; Y288-V310 HydrophobicContact CE1-CG1 4.12Å; Y288-V310 HydrophobicContact CG-CG1 4.3Å; Y288-V310 HydrophobicContact CG-CG2 4.17Å; Y288-P639 HydrophobicContact CD2-CB 4.09Å; Y288-P639 HydrophobicContact CD2-CG 4.35Å; Y288-P639 HydrophobicContact CE2-CB 3.87Å; Y288-P639 HydrophobicContact CE2-CG 3.63Å; Y288-V640 PolarHBondContact N-O 2.88Å; Y288-W642 HydrophobicContact CD2-CB 4.39Å; Y288-W642 HydrophobicContact CE2-CB 4.01Å; Y288-L645 HydrophobicContact CD2-CD2 4.48Å; Y288-L645 HydrophobicContact CE1-CD2 4.18Å; Y288-L645 HydrophobicContact CE2-CD2 4.1Å
289	K	97.3	Very high	96	Very high	13 Å²	13	26.4 Å²	26.4	6%	0.057	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	148.7	176.1	-62.9	-71.8	-171.5	175.5	0	111	A286 W306 C307 V640 E644	A286-K289 PolarHBondContact N-O 2.94Å; A286-K289 WeakPolarHBondContact O-CB 3.31Å; A286-K289 PolarHBondContact O-N 2.96Å; K289-W306 HydrophobicContact CB-CE3 3.87Å; K289-W306 HydrophobicContact CB-CZ3 4.01Å; K289-C307 CarbonylContact C-O 3.5Å; K289-C307 WeakPolarHBondContact CA-O 3.38Å; K289-V640 HydrophobicContact CG-CG1 4.03Å; K289-E644 WeakPolarHBondContact CE-OE2 3.44Å; K289-E644 IonicContact NZ-OE1 3.46Å; K289-E644 PolarHBondContact NZ-OE1 3.12Å; K289-E644 IonicContact NZ-OE2 2.7Å; K289-E644 PolarHBondContact NZ-OE2 3.46Å
290	A	97.1	Very high	95.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	140.4	168.2	0	0	0	0	0	110.6	V282 Q284 L292 W306 C307 I309	V282-A290 HydrophobicContact CG1-CB 4.16Å; V282-A290 HydrophobicContact CG2-CB 4.48Å; Q284-A290 CarbonylContact O-C 3.46Å; Q284-A290 VanDerWaalsContact O-CA 3.26Å; Q284-A290 WeakPolarHBondContact O-CA 3.31Å; A290-L292 HydrophobicContact CB-CD2 4.09Å; A290-W306 WeakPolarHBondContact O-CA 3.48Å; A290-C307 PolarHBondContact N-O 2.96Å; A290-C307 PolarHBondContact O-N 3.23Å; A290-I309 HydrophobicContact CB-CD1 3.92Å; A290-I309 HydrophobicContact CB-CG1 3.65Å
291	L	97.3	Very high	95.4	Very high	28 Å²	28	33.2 Å²	33.2	15%	0.147	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	124.6	164.7	-175.4	60.8	0	0	0	108.3	L283 Q284 D304 W306	L283-L291 HydrophobicContact CB-CB 4.48Å; L283-L291 HydrophobicContact CB-CD2 4.41Å; L283-L291 HydrophobicContact CB-CG 4.39Å; L283-L291 PolarHBondContact N-O 2.93Å; Q284-L291 HydrophobicContact CB-CB 3.92Å; Q284-L291 PolarHBondContact O-N 3.27Å; L291-D304 HydrophobicContact CD1-CB 3.97Å; L291-D304 HydrophobicContact CG-CB 4.45Å; L291-W306 HydrophobicContact CB-CD2 4.15Å; L291-W306 HydrophobicContact CB-CE3 4.1Å; L291-W306 HydrophobicContact CB-CH2 4.09Å; L291-W306 HydrophobicContact CB-CZ2 4.11Å; L291-W306 HydrophobicContact CB-CZ3 4.07Å; L291-W306 HydrophobicContact CD1-CD2 4.1Å; L291-W306 HydrophobicContact CD1-CG 4.12Å
292	L	97.3	Very high	95.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	139.3	-174.4	-61	-177	0	0	0	111.4	V263 V265 A280 T281 V282 A290 D304 F305 C307 L314	V263-L292 HydrophobicContact CG2-CD2 4.18Å; V265-L292 HydrophobicContact CB-CD1 4.48Å; V265-L292 HydrophobicContact CG1-CD1 4.39Å; V265-L292 HydrophobicContact CG2-CD1 4.12Å; A280-L292 HydrophobicContact CB-CB 4.22Å; T281-L292 WeakPolarHBondContact O-CA 3.33Å; V282-L292 HydrophobicContact CB-CD2 4.39Å; V282-L292 HydrophobicContact CG2-CD2 3.68Å; A290-L292 HydrophobicContact CB-CD2 4.09Å; L292-D304 WeakPolarHBondContact O-CA 3.3Å; L292-F305 HydrophobicContact CB-CD1 4.27Å; L292-F305 HydrophobicContact CB-CD2 4.4Å; L292-F305 HydrophobicContact CB-CE1 3.9Å; L292-F305 HydrophobicContact CB-CE2 4.06Å; L292-F305 HydrophobicContact CB-CZ 3.8Å; L292-F305 HydrophobicContact CD1-CE2 3.78Å; L292-F305 HydrophobicContact CD1-CZ 3.95Å; L292-F305 HydrophobicContact CG-CE2 4.46Å; L292-F305 PolarHBondContact N-O 3.44Å; L292-F305 WeakPolarHBondContact O-CD1 3.3Å; L292-F305 PolarHBondContact O-N 2.82Å; L292-C307 HydrophobicContact CD1-CB 3.79Å; L292-C307 HydrophobicContact CG-CB 4.45Å; L292-L314 HydrophobicContact CD1-CD1 4.2Å; L292-L314 HydrophobicContact CD1-CD2 4.25Å; L292-L314 HydrophobicContact CD1-CG 4.21Å; L292-L314 HydrophobicContact CD2-CD2 4.37Å
293	R	97.2	Very high	94.8	Very high	35 Å²	35	39.2 Å²	39.2	13%	0.132	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	129.9	167.3	-175.2	174.4	-60.9	-179.8	-0.7	110.6	A280 T281 L283 E298 H299 D300 S301 D304	A280-R293 CarbonylContact C-O 3.57Å; A280-R293 WeakPolarHBondContact CA-O 3.33Å; A280-R293 VanDerWaalsContact CB-O 3.32Å; A280-R293 WeakPolarHBondContact CB-O 3.34Å; T281-R293 PolarHBondContact N-O 3.41Å; T281-R293 PolarHBondContact O-N 2.88Å; L283-R293 HydrophobicContact CD1-CB 3.85Å; L283-R293 HydrophobicContact CD2-CB 4.35Å; L283-R293 HydrophobicContact CG-CB 4.09Å; R293-E298 WeakPolarHBondContact CD-O 3.49Å; R293-E298 PolarHBondContact NH1-O 3.38Å; R293-H299 VanDerWaalsContact NH1-CA 3.3Å; R293-H299 PolarHBondContact NH1-O 2.87Å; R293-D300 WeakPolarHBondContact CD-O 3.09Å; R293-D300 PolarHBondContact NE-O 3.05Å; R293-D300 VanDerWaalsContact NE-O 3.1Å; R293-S301 VanDerWaalsContact NH2-CB 3.29Å; R293-D304 VanDerWaalsContact CB-OD1 3.25Å; R293-D304 WeakPolarHBondContact CB-OD1 3.5Å; R293-D304 VanDerWaalsContact CG-OD1 3.31Å; R293-D304 WeakPolarHBondContact CG-OD1 3.38Å; R293-D304 IonicContact CZ-OD1 2.9Å; R293-D304 IonicContact CZ-OD2 2.76Å; R293-D304 IonicContact NE-OD1 3.44Å; R293-D304 PolarHBondContact NE-OD1 3.23Å; R293-D304 IonicContact NE-OD2 2.71Å; R293-D304 IonicContact NH2-OD1 3.49Å; R293-D304 PolarHBondContact NH2-OD1 3.12Å; R293-D304 IonicContact NH2-OD2 3.54Å; R293-D304 PolarHBondContact NH2-OD2 3.34Å
294	Y	96.6	Very high	94.8	Very high	7 Å²	7	38.2 Å²	38.2	3%	0.027	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	138.9	174.7	-68.8	-62.4	0	0	0	112.1	V265 L266 T268 W278 A280 G296 Y297 F305 P330	V265-Y294 HydrophobicContact CG1-CE1 3.98Å; L266-Y294 PolarHBondContact O-OH 3.33Å; L266-Y294 VanDerWaalsContact O-OH 3.08Å; T268-Y294 PolarHBondContact N-OH 2.97Å; T268-Y294 PolarHBondContact OG1-OH 3.43Å; W278-Y294 HydrophobicContact CB-CD1 4.04Å; W278-Y294 HydrophobicContact CB-CE1 4.22Å; W278-Y294 AromaticContact CD1-CD1 3.84Å; W278-Y294 HydrophobicContact CG-CD1 4.36Å; A280-Y294 HydrophobicContact CB-CD1 4.39Å; Y294-G296 PolarHBondContact O-N 3.09Å; Y294-Y297 HydrophobicContact CD2-CE2 4.28Å; Y294-Y297 PolarHBondContact O-N 3.37Å; Y294-F305 HydrophobicContact CD1-CE1 4.22Å; Y294-F305 AromaticContact CD2-CE1 3.88Å; Y294-F305 HydrophobicContact CD2-CE1 3.88Å; Y294-F305 AromaticContact CE1-CE1 3.87Å; Y294-F305 HydrophobicContact CE1-CE1 3.87Å; Y294-F305 AromaticContact CE1-CZ 3.86Å; Y294-F305 HydrophobicContact CE1-CZ 3.86Å; Y294-F305 HydrophobicContact CE2-CD1 4.11Å; Y294-F305 AromaticContact CE2-CE1 3.48Å; Y294-F305 HydrophobicContact CE2-CE1 3.48Å; Y294-F305 VanDerWaalsContact CE2-CE1 3.48Å; Y294-F305 HydrophobicContact CE2-CZ 4.15Å; Y294-F305 HydrophobicContact CG-CE1 4.24Å; Y294-F305 AromaticContact CZ-CE1 3.48Å; Y294-F305 VanDerWaalsContact CZ-CE1 3.48Å; Y294-F305 AromaticContact CZ-CZ 3.65Å; Y294-P330 HydrophobicContact CD1-CG 4.36Å; Y294-P330 HydrophobicContact CD2-CG 4Å; Y294-P330 HydrophobicContact CG-CG 3.84Å
295	E	95.6	Very high	94.8	Very high	10 Å²	10	37.9 Å²	37.9	5%	0.047	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	128	171.7	-65.1	-62.9	102.8	0	0	110	K262 W278 I279 T281 Y342 L343 K346	K262-E295 IonicContact NZ-OE1 2.82Å; K262-E295 PolarHBondContact NZ-OE1 2.87Å; K262-E295 IonicContact NZ-OE2 2.67Å; K262-E295 PolarHBondContact NZ-OE2 2.67Å; W278-E295 PolarHBondContact NE1-O 3.19Å; I279-E295 HydrophobicContact CB-CG 4.01Å; I279-E295 HydrophobicContact CG2-CG 3.63Å; I279-E295 PolarHBondContact O-N 3.23Å; T281-E295 PolarHBondContact OG1-OE1 2.81Å; E295-Y342 HydrophobicContact CB-CE1 4.19Å; E295-L343 HydrophobicContact CB-CD2 4.08Å; E295-L343 HydrophobicContact CG-CD2 4.4Å; E295-K346 WeakPolarHBondContact OE2-CB 3.48Å; E295-K346 WeakPolarHBondContact OE2-CD 3.28Å
296	G	93.3	Very high	94.7	Very high	13 Å²	13	38.3 Å²	38.3	13%	0.134	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	120.4	-29.2	-173.8	0	0	0	0	0	114	Y294 Y342	Y294-G296 PolarHBondContact O-N 3.09Å; G296-Y342 WeakPolarHBondContact CA-OH 3.45Å; G296-Y342 PolarHBondContact N-OH 3.28Å
297	Y	92.4	Very high	94.6	Very high	17 Å²	17	39.3 Å²	39.3	7%	0.067	21%	0.205	C	C	.	.			trans	-81	-14.3	178.7	-74.9	-91.6	0	0	0	114	N269 Y294 H299 D300 H303 P330 A333	N269-Y297 PolarHBondContact ND2-OH 2.61Å; Y294-Y297 HydrophobicContact CD2-CE2 4.28Å; Y294-Y297 PolarHBondContact O-N 3.37Å; Y297-H299 PolarHBondContact O-N 3.2Å; Y297-D300 HydrophobicContact CD1-CB 4.35Å; Y297-D300 WeakPolarHBondContact O-CB 3.5Å; Y297-D300 PolarHBondContact O-N 3.42Å; Y297-H303 HydrophobicContact CD1-CB 4.17Å; Y297-H303 HydrophobicContact CE1-CB 3.78Å; Y297-H303 AromaticContact CE1-CD2 3.92Å; Y297-H303 AromaticContact CE1-CE1 3.77Å; Y297-H303 AromaticContact CE1-CG 3.42Å; Y297-H303 VanDerWaalsContact CE1-CG 3.42Å; Y297-H303 AromaticContact CE1-ND1 3.33Å; Y297-H303 VanDerWaalsContact CE1-ND1 3.33Å; Y297-H303 WeakPolarHBondContact CE1-ND1 3.35Å; Y297-H303 HydrophobicContact CE2-CB 4.34Å; Y297-H303 AromaticContact CZ-CD2 3.75Å; Y297-H303 AromaticContact CZ-CG 3.61Å; Y297-H303 AromaticContact CZ-ND1 3.97Å; Y297-H303 PolarHBondContact OH-CD2 2.92Å; Y297-H303 PolarHBondContact OH-NE2 3.21Å; Y297-P330 HydrophobicContact CE2-CB 3.79Å; Y297-P330 HydrophobicContact CE2-CG 3.94Å; Y297-A333 HydrophobicContact CD2-CB 4.39Å; Y297-A333 HydrophobicContact CE2-CB 4.08Å
298	E	88.8	Confident	94.6	Very high	81 Å²	81	39.6 Å²	39.6	38%	0.379	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	-102.2	179.2	-61.7	-63	154.3	0	0	113	R293 Y342 K346	R293-E298 WeakPolarHBondContact CD-O 3.49Å; R293-E298 PolarHBondContact NH1-O 3.38Å; E298-Y342 WeakPolarHBondContact OE1-CE2 3.39Å; E298-Y342 VanDerWaalsContact OE1-CZ 3.3Å; E298-Y342 PolarHBondContact OE1-OH 2.9Å; E298-K346 WeakPolarHBondContact OE1-CE 3.15Å; E298-K346 IonicContact OE1-NZ 2.66Å; E298-K346 PolarHBondContact OE1-NZ 2.97Å; E298-K346 IonicContact OE2-NZ 2.59Å; E298-K346 PolarHBondContact OE2-NZ 3.2Å
299	H	89.3	Confident	94.5	Very high	174 Å²	174	39.6 Å²	39.6	81%	0.806	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-14.3	-177.5	-61.6	-61.1	0	0	0	113.8	R293 Y297 S301	R293-H299 VanDerWaalsContact NH1-CA 3.3Å; R293-H299 PolarHBondContact NH1-O 2.87Å; Y297-H299 PolarHBondContact O-N 3.2Å; H299-S301 PolarHBondContact O-N 2.82Å
300	D	91.6	Very high	94.4	Very high	70 Å²	70	39.5 Å²	39.5	37%	0.374	21%	0.208	S	C	.	.			trans	-68.2	121.7	179.4	179.6	15.2	0	0	0	111.8	R293 Y297 S302	R293-D300 WeakPolarHBondContact CD-O 3.09Å; R293-D300 PolarHBondContact NE-O 3.05Å; R293-D300 VanDerWaalsContact NE-O 3.1Å; Y297-D300 HydrophobicContact CD1-CB 4.35Å; Y297-D300 WeakPolarHBondContact O-CB 3.5Å; Y297-D300 PolarHBondContact O-N 3.42Å; D300-S302 WeakPolarHBondContact OD1-CB 3.46Å; D300-S302 PolarHBondContact OD1-N 3.31Å; D300-S302 PolarHBondContact OD1-OG 3.21Å; D300-S302 PolarHBondContact OD2-OG 3.38Å
301	S	92.6	Very high	94.1	Very high	76 Å²	76	42.2 Å²	42.2	53%	0.531	23%	0.227	S	C	.	.			trans	-97.2	-2	178.2	63.6	0	0	0	0	114.1	R293 H299 H303 D304	R293-S301 VanDerWaalsContact NH2-CB 3.29Å; H299-S301 PolarHBondContact O-N 2.82Å; S301-H303 PolarHBondContact O-N 3.34Å; S301-H303 VanDerWaalsContact O-N 3.07Å; S301-D304 WeakPolarHBondContact CA-OD2 3.25Å; S301-D304 VanDerWaalsContact CB-OD2 3.26Å; S301-D304 WeakPolarHBondContact CB-OD2 3.49Å; S301-D304 WeakPolarHBondContact O-CB 3.45Å; S301-D304 PolarHBondContact O-N 2.92Å; S301-D304 VanDerWaalsContact O-N 3.1Å
302	S	91.4	Very high	93.7	Very high	81 Å²	81	42.6 Å²	42.6	57%	0.566	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-14.7	-175.3	65.4	0	0	0	0	114.3	D300	D300-S302 WeakPolarHBondContact OD1-CB 3.46Å; D300-S302 PolarHBondContact OD1-N 3.31Å; D300-S302 PolarHBondContact OD1-OG 3.21Å; D300-S302 PolarHBondContact OD2-OG 3.38Å
303	H	91.4	Very high	93.3	Very high	65 Å²	65	46.2 Å²	46.2	30%	0.301	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	17.9	178.7	-66.5	73.8	0	0	0	112.5	Y297 S301	Y297-H303 HydrophobicContact CD1-CB 4.17Å; Y297-H303 HydrophobicContact CE1-CB 3.78Å; Y297-H303 AromaticContact CE1-CD2 3.92Å; Y297-H303 AromaticContact CE1-CE1 3.77Å; Y297-H303 AromaticContact CE1-CG 3.42Å; Y297-H303 VanDerWaalsContact CE1-CG 3.42Å; Y297-H303 AromaticContact CE1-ND1 3.33Å; Y297-H303 VanDerWaalsContact CE1-ND1 3.33Å; Y297-H303 WeakPolarHBondContact CE1-ND1 3.35Å; Y297-H303 HydrophobicContact CE2-CB 4.34Å; Y297-H303 AromaticContact CZ-CD2 3.75Å; Y297-H303 AromaticContact CZ-CG 3.61Å; Y297-H303 AromaticContact CZ-ND1 3.97Å; Y297-H303 PolarHBondContact OH-CD2 2.92Å; Y297-H303 PolarHBondContact OH-NE2 3.21Å; S301-H303 PolarHBondContact O-N 3.34Å; S301-H303 VanDerWaalsContact O-N 3.07Å
304	D	95.5	Very high	93.2	Very high	41 Å²	41	44.6 Å²	44.6	22%	0.219	25%	0.248	C	C	.	.			trans	-69.4	139.3	171.8	-70	-11.5	0	0	0	110.2	L283 L291 L292 R293 S301	L283-D304 WeakPolarHBondContact CD1-OD2 3.42Å; L291-D304 HydrophobicContact CD1-CB 3.97Å; L291-D304 HydrophobicContact CG-CB 4.45Å; L292-D304 WeakPolarHBondContact O-CA 3.3Å; R293-D304 VanDerWaalsContact CB-OD1 3.25Å; R293-D304 WeakPolarHBondContact CB-OD1 3.5Å; R293-D304 VanDerWaalsContact CG-OD1 3.31Å; R293-D304 WeakPolarHBondContact CG-OD1 3.38Å; R293-D304 IonicContact CZ-OD1 2.9Å; R293-D304 IonicContact CZ-OD2 2.76Å; R293-D304 IonicContact NE-OD1 3.44Å; R293-D304 PolarHBondContact NE-OD1 3.23Å; R293-D304 IonicContact NE-OD2 2.71Å; R293-D304 IonicContact NH2-OD1 3.49Å; R293-D304 PolarHBondContact NH2-OD1 3.12Å; R293-D304 IonicContact NH2-OD2 3.54Å; R293-D304 PolarHBondContact NH2-OD2 3.34Å; S301-D304 WeakPolarHBondContact CA-OD2 3.25Å; S301-D304 VanDerWaalsContact CB-OD2 3.26Å; S301-D304 WeakPolarHBondContact CB-OD2 3.49Å; S301-D304 WeakPolarHBondContact O-CB 3.45Å; S301-D304 PolarHBondContact O-N 2.92Å; S301-D304 VanDerWaalsContact O-N 3.1Å
305	F	95.9	Very high	93.2	Very high	47 Å²	47	44.8 Å²	44.8	21%	0.206	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	140.7	-176.6	65.4	-80.1	0	0	0	112.6	V265 L292 Y294 C307	V265-F305 HydrophobicContact CG1-CZ 3.96Å; V265-F305 HydrophobicContact CG2-CE2 4.36Å; V265-F305 HydrophobicContact CG2-CZ 4.47Å; L292-F305 HydrophobicContact CB-CD1 4.27Å; L292-F305 HydrophobicContact CB-CD2 4.4Å; L292-F305 HydrophobicContact CB-CE1 3.9Å; L292-F305 HydrophobicContact CB-CE2 4.06Å; L292-F305 HydrophobicContact CB-CZ 3.8Å; L292-F305 HydrophobicContact CD1-CE2 3.78Å; L292-F305 HydrophobicContact CD1-CZ 3.95Å; L292-F305 HydrophobicContact CG-CE2 4.46Å; L292-F305 PolarHBondContact N-O 3.44Å; L292-F305 WeakPolarHBondContact O-CD1 3.3Å; L292-F305 PolarHBondContact O-N 2.82Å; Y294-F305 HydrophobicContact CD1-CE1 4.22Å; Y294-F305 AromaticContact CD2-CE1 3.88Å; Y294-F305 HydrophobicContact CD2-CE1 3.88Å; Y294-F305 AromaticContact CE1-CE1 3.87Å; Y294-F305 HydrophobicContact CE1-CE1 3.87Å; Y294-F305 AromaticContact CE1-CZ 3.86Å; Y294-F305 HydrophobicContact CE1-CZ 3.86Å; Y294-F305 HydrophobicContact CE2-CD1 4.11Å; Y294-F305 AromaticContact CE2-CE1 3.48Å; Y294-F305 HydrophobicContact CE2-CE1 3.48Å; Y294-F305 VanDerWaalsContact CE2-CE1 3.48Å; Y294-F305 HydrophobicContact CE2-CZ 4.15Å; Y294-F305 HydrophobicContact CG-CE1 4.24Å; Y294-F305 AromaticContact CZ-CE1 3.48Å; Y294-F305 VanDerWaalsContact CZ-CE1 3.48Å; Y294-F305 AromaticContact CZ-CZ 3.65Å; F305-C307 HydrophobicContact CE2-CB 4.45Å
306	W	96	Very high	93.3	Very high	46 Å²	46	45.1 Å²	45.1	17%	0.174	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	138	173.4	-73.7	97.7	0	0	0	111.1	G229 L232 T233 Q284 A286 K289 A290 L291	G229-W306 PolarHBondContact O-NE1 3.23Å; G229-W306 VanDerWaalsContact O-NE1 3.14Å; L232-W306 HydrophobicContact CB-CZ2 4.25Å; L232-W306 HydrophobicContact CD1-CH2 4.14Å; L232-W306 HydrophobicContact CD1-CZ3 4.5Å; T233-W306 PolarHBondContact OG1-NE1 3.5Å; Q284-W306 HydrophobicContact CB-CH2 4.42Å; Q284-W306 HydrophobicContact CG-CH2 4.21Å; A286-W306 HydrophobicContact CB-CH2 3.94Å; A286-W306 HydrophobicContact CB-CZ3 3.84Å; K289-W306 HydrophobicContact CB-CE3 3.87Å; K289-W306 HydrophobicContact CB-CZ3 4.01Å; A290-W306 WeakPolarHBondContact O-CA 3.48Å; L291-W306 HydrophobicContact CB-CD2 4.15Å; L291-W306 HydrophobicContact CB-CE3 4.1Å; L291-W306 HydrophobicContact CB-CH2 4.09Å; L291-W306 HydrophobicContact CB-CZ2 4.11Å; L291-W306 HydrophobicContact CB-CZ3 4.07Å; L291-W306 HydrophobicContact CD1-CD2 4.1Å; L291-W306 HydrophobicContact CD1-CG 4.12Å
307	C	95.1	Very high	93.5	Very high	20 Å²	20	47.1 Å²	47.1	14%	0.135	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	155.7	173.9	-162.1	0	0	0	0	110.7	K289 A290 L292 F305 L314	K289-C307 CarbonylContact C-O 3.5Å; K289-C307 WeakPolarHBondContact CA-O 3.38Å; A290-C307 PolarHBondContact N-O 2.96Å; A290-C307 PolarHBondContact O-N 3.23Å; L292-C307 HydrophobicContact CD1-CB 3.79Å; L292-C307 HydrophobicContact CG-CB 4.45Å; F305-C307 HydrophobicContact CE2-CB 4.45Å; C307-L314 HydrophobicContact CB-CD1 3.99Å; C307-L314 WeakPolarHBondContact SG-CD1 3.36Å
308	S	95.9	Very high	93.6	Very high	8 Å²	8	47.6 Å²	47.6	6%	0.056	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	121	172.7	170.1	0	0	0	0	110.1	V310 S311 E644	S308-V310 PolarHBondContact O-N 3.41Å; S308-V310 WeakPolarHBondContact OG-CG2 3.21Å; S308-S311 WeakPolarHBondContact O-CB 3.49Å; S308-S311 PolarHBondContact O-N 2.9Å; S308-S311 PolarHBondContact O-OG 3.2Å; S308-E644 WeakPolarHBondContact CB-OE1 3.19Å
309	I	96.3	Very high	94	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-63	-34.2	-178.2	-54.5	161.7	0	0	0	110.1	W254 V257 V285 Y288 A290 S311 L314 L353 F357 Y358	W254-I309 HydrophobicContact CH2-CB 4.37Å; W254-I309 HydrophobicContact CH2-CD1 3.98Å; W254-I309 HydrophobicContact CH2-CG2 4.38Å; W254-I309 HydrophobicContact CZ2-CD1 3.77Å; V257-I309 HydrophobicContact CG1-CD1 3.92Å; V285-I309 HydrophobicContact CG1-CD1 4.17Å; Y288-I309 WeakPolarHBondContact O-CB 3.2Å; Y288-I309 WeakPolarHBondContact O-CG1 3.23Å; Y288-I309 PolarHBondContact O-N 3.44Å; A290-I309 HydrophobicContact CB-CD1 3.92Å; A290-I309 HydrophobicContact CB-CG1 3.65Å; I309-S311 VanDerWaalsContact C-N 3.33Å; I309-S311 PolarHBondContact O-N 3.17Å; I309-L314 HydrophobicContact CG1-CD2 4.31Å; I309-L314 HydrophobicContact CG2-CD2 4.41Å; I309-L353 HydrophobicContact CG2-CD2 4.17Å; I309-F357 HydrophobicContact CG2-CE1 3.97Å; I309-F357 HydrophobicContact CG2-CZ 3.64Å; I309-Y358 PolarHBondContact O-OH 3.31Å
310	V	95	Very high	94.3	Very high	11 Å²	11	38.9 Å²	38.9	7%	0.067	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-86	1.3	-178.3	-63.5	0	0	0	0	114.2	L250 W254 Y288 S308 G312 F357 L361 L645	L250-V310 HydrophobicContact CD1-CG1 4.28Å; W254-V310 HydrophobicContact CH2-CG1 4.49Å; W254-V310 HydrophobicContact CZ3-CG1 4.44Å; Y288-V310 HydrophobicContact CD1-CG1 3.54Å; Y288-V310 HydrophobicContact CD1-CG2 4.23Å; Y288-V310 HydrophobicContact CE1-CG1 4.12Å; Y288-V310 HydrophobicContact CG-CG1 4.3Å; Y288-V310 HydrophobicContact CG-CG2 4.17Å; S308-V310 PolarHBondContact O-N 3.41Å; S308-V310 WeakPolarHBondContact OG-CG2 3.21Å; V310-G312 VanDerWaalsContact C-N 3.3Å; V310-G312 PolarHBondContact O-N 2.94Å; V310-F357 HydrophobicContact CG1-CE1 4.44Å; V310-F357 HydrophobicContact CG1-CZ 4.32Å; V310-L361 HydrophobicContact CB-CD1 4.48Å; V310-L361 HydrophobicContact CB-CD2 3.82Å; V310-L361 HydrophobicContact CG1-CD1 4.14Å; V310-L361 HydrophobicContact CG1-CD2 4.1Å; V310-L645 HydrophobicContact CB-CD1 3.99Å; V310-L645 HydrophobicContact CG2-CB 3.95Å; V310-L645 HydrophobicContact CG2-CD1 3.79Å; V310-L645 HydrophobicContact CG2-CD2 4.17Å; V310-L645 HydrophobicContact CG2-CG 4.17Å
311	S	91.4	Very high	94.4	Very high	57 Å²	57	40.6 Å²	40.6	40%	0.399	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-63.4	-26.9	179.2	61.5	0	0	0	0	115.3	S308 I309 E313	S308-S311 WeakPolarHBondContact O-CB 3.49Å; S308-S311 PolarHBondContact O-N 2.9Å; S308-S311 PolarHBondContact O-OG 3.2Å; I309-S311 VanDerWaalsContact C-N 3.33Å; I309-S311 PolarHBondContact O-N 3.17Å; S311-E313 PolarHBondContact OG-N 3.4Å
312	G	89.6	Confident	94.6	Very high	36 Å²	36	45 Å²	45	37%	0.371	26%	0.258	S	S	.	.	S	Bend	trans	87.4	3.3	-166.5	0	0	0	0	0	114.8	V310 Y358	V310-G312 VanDerWaalsContact C-N 3.3Å; V310-G312 PolarHBondContact O-N 2.94Å; G312-Y358 PolarHBondContact N-OH 3.19Å
313	E	89.1	Confident	94.7	Very high	76 Å²	76	43.9 Å²	43.9	36%	0.355	25%	0.248	S	C	.	.			trans	-96.4	-17.6	178.5	-61.5	-150.6	124.7	0	0	114.5	K275 S311 N315	K275-E313 IonicContact NZ-OE1 3.57Å; K275-E313 PolarHBondContact NZ-OE1 2.73Å; S311-E313 PolarHBondContact OG-N 3.4Å; E313-N315 PolarHBondContact O-ND2 3.27Å; E313-N315 VanDerWaalsContact O-ND2 3.13Å
314	L	95.1	Very high	94.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.273	C	S	.	.			trans	-87	133.9	168.3	-77.6	69.8	0	0	0	109.7	V263 E264 V265 L292 C307 I309 L353 Y358	V263-L314 HydrophobicContact CB-CB 4.49Å; V263-L314 HydrophobicContact CG1-CD2 4.4Å; V263-L314 HydrophobicContact CG2-CD2 4.08Å; V263-L314 HydrophobicContact CG2-CG 4.17Å; E264-L314 CarbonylContact O-C 3.58Å; V265-L314 HydrophobicContact CG2-CD1 4.26Å; V265-L314 HydrophobicContact CG2-CG 4.47Å; L292-L314 HydrophobicContact CD1-CD1 4.2Å; L292-L314 HydrophobicContact CD1-CD2 4.25Å; L292-L314 HydrophobicContact CD1-CG 4.21Å; L292-L314 HydrophobicContact CD2-CD2 4.37Å; C307-L314 HydrophobicContact CB-CD1 3.99Å; C307-L314 WeakPolarHBondContact SG-CD1 3.36Å; I309-L314 HydrophobicContact CG1-CD2 4.31Å; I309-L314 HydrophobicContact CG2-CD2 4.41Å; L314-L353 HydrophobicContact CB-CD1 3.81Å; L314-Y358 WeakPolarHBondContact O-CE2 3.26Å; L314-Y358 PolarHBondContact O-OH 3.32Å
315	N	96.5	Very high	94.8	Very high	11 Å²	11	48.9 Å²	48.9	6%	0.059	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-131.5	153.1	-175.5	-69.2	-91.9	0	0	0	110.9	V263 E264 E313 W319	V263-N315 WeakPolarHBondContact CA-O 3.2Å; E264-N315 HydrophobicContact CB-CB 4.19Å; E264-N315 PolarHBondContact N-O 2.89Å; E264-N315 WeakPolarHBondContact O-CB 3.44Å; E264-N315 PolarHBondContact O-N 2.78Å; E313-N315 PolarHBondContact O-ND2 3.27Å; E313-N315 VanDerWaalsContact O-ND2 3.13Å; N315-W319 HydrophobicContact CB-CB 3.84Å; N315-W319 HydrophobicContact CB-CD2 3.81Å; N315-W319 HydrophobicContact CB-CE3 3.99Å; N315-W319 HydrophobicContact CB-CG 3.75Å; N315-W319 PolarHBondContact OD1-NE1 3.16Å
316	P	97.2	Very high	94.6	Very high	18 Å²	18	52.2 Å²	52.2	12%	0.117	30%	0.301	C	S	.	.			trans	-67.1	148.9	175.4	28.9	-35.6	0	0	0	111.5	G318 W319 T352 L353 V355	P316-G318 PolarHBondContact O-N 3.14Å; P316-W319 HydrophobicContact CG-CB 4.3Å; P316-W319 VanDerWaalsContact O-CB 3.25Å; P316-W319 WeakPolarHBondContact O-CB 3.48Å; P316-W319 PolarHBondContact O-N 2.79Å; P316-T352 WeakPolarHBondContact CA-OG1 3.28Å; P316-T352 HydrophobicContact CB-CG2 4.31Å; P316-L353 WeakPolarHBondContact CB-O 3.46Å; P316-V355 HydrophobicContact CB-CG1 4.38Å; P316-V355 HydrophobicContact CG-CG1 4.29Å
317	I	97.4	Very high	94.5	Very high	55 Å²	55	53 Å²	53	28%	0.282	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	127	176.2	-58.8	-53.9	0	0	0	110.5	K262 E264 I279 L347 T352	K262-I317 HydrophobicContact CB-CD1 3.92Å; K262-I317 HydrophobicContact CB-CG1 4Å; E264-I317 HydrophobicContact CG-CD1 4.02Å; I279-I317 HydrophobicContact CD1-CD1 4.28Å; I279-I317 HydrophobicContact CG1-CD1 4.08Å; I279-I317 HydrophobicContact CG2-CD1 3.83Å; I317-L347 HydrophobicContact CD1-CD2 4.11Å; I317-L347 HydrophobicContact CG1-CD2 4.08Å; I317-L347 HydrophobicContact CG2-CD1 4.32Å; I317-L347 HydrophobicContact CG2-CD2 4.3Å; I317-T352 HydrophobicContact CB-CG2 4.49Å; I317-T352 PolarHBondContact N-OG1 3.12Å
318	G	95.3	Very high	94.5	Very high	26 Å²	26	53.5 Å²	53.5	27%	0.268	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.3	-13	-176.6	0	0	0	0	0	114.5	E264 P316 C320 S321 M322	E264-G318 PolarHBondContact OE1-N 3.41Å; P316-G318 PolarHBondContact O-N 3.14Å; G318-C320 VanDerWaalsContact C-N 3.33Å; G318-C320 PolarHBondContact O-N 2.98Å; G318-S321 WeakPolarHBondContact O-CB 3.14Å; G318-S321 PolarHBondContact O-N 3.12Å; G318-S321 VanDerWaalsContact O-N 3.11Å; G318-M322 WeakPolarHBondContact O-CG 3.4Å; G318-M322 PolarHBondContact O-N 2.81Å
319	W	96.7	Very high	94.3	Very high	70 Å²	70	55 Å²	55	27%	0.265	32%	0.32	S	S	.	.	H	α-helix	trans	-58.5	-41.1	179.7	176.4	94.2	0	0	0	112.7	E264 Y277 N315 P316 S321 M322 T323 K325	E264-W319 PolarHBondContact OE2-N 3.04Å; Y277-W319 HydrophobicContact CD1-CZ3 4.23Å; Y277-W319 HydrophobicContact CD2-CZ3 4.49Å; Y277-W319 HydrophobicContact CE1-CH2 4.31Å; Y277-W319 AromaticContact CE1-CZ3 3.86Å; Y277-W319 HydrophobicContact CE1-CZ3 3.86Å; Y277-W319 HydrophobicContact CE2-CZ3 4.15Å; Y277-W319 AromaticContact CZ-CZ3 3.82Å; N315-W319 HydrophobicContact CB-CB 3.84Å; N315-W319 HydrophobicContact CB-CD2 3.81Å; N315-W319 HydrophobicContact CB-CE3 3.99Å; N315-W319 HydrophobicContact CB-CG 3.75Å; N315-W319 PolarHBondContact OD1-NE1 3.16Å; P316-W319 HydrophobicContact CG-CB 4.3Å; P316-W319 VanDerWaalsContact O-CB 3.25Å; P316-W319 WeakPolarHBondContact O-CB 3.48Å; P316-W319 PolarHBondContact O-N 2.79Å; W319-S321 VanDerWaalsContact C-N 3.32Å; W319-S321 PolarHBondContact O-N 3.28Å; W319-M322 PolarHBondContact O-N 2.97Å; W319-M322 VanDerWaalsContact O-N 3.17Å; W319-T323 HydrophobicContact CD2-CG2 4.16Å; W319-T323 HydrophobicContact CG-CG2 4.41Å; W319-T323 HydrophobicContact CZ2-CG2 4.15Å; W319-T323 WeakPolarHBondContact O-CB 3.49Å; W319-T323 WeakPolarHBondContact O-CG2 3.47Å; W319-T323 PolarHBondContact O-N 3.11Å; W319-T323 PolarHBondContact O-OG1 3.43Å; W319-K325 HydrophobicContact CH2-CG 4.19Å; W319-K325 HydrophobicContact CZ3-CB 4.47Å; W319-K325 HydrophobicContact CZ3-CG 3.87Å
320	C	95.9	Very high	94.1	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.014	32%	0.322	C	S	.	.	H	α-helix	trans	-61.2	-42	176.4	-76.9	0	0	0	0	111.4	E264 Y277 G318 M322 T323 S324 K325 L327	E264-C320 VanDerWaalsContact OE2-CB 3.23Å; E264-C320 WeakPolarHBondContact OE2-CB 3.33Å; E264-C320 PolarHBondContact OE2-N 3.25Å; E264-C320 PolarHBondContact OE2-SG 3.33Å; Y277-C320 VanDerWaalsContact CB-SG 3.53Å; G318-C320 VanDerWaalsContact C-N 3.33Å; G318-C320 PolarHBondContact O-N 2.98Å; C320-M322 VanDerWaalsContact C-N 3.33Å; C320-M322 PolarHBondContact O-N 3.31Å; C320-T323 PolarHBondContact O-N 2.74Å; C320-S324 PolarHBondContact O-N 2.92Å; C320-K325 HydrophobicContact CB-CB 3.88Å; C320-K325 PolarHBondContact O-N 2.88Å; C320-L327 HydrophobicContact CB-CD2 4.19Å; C320-L327 HydrophobicContact CB-CG 4.18Å
321	S	94.3	Very high	93.7	Very high	107 Å²	107	59.5 Å²	59.5	75%	0.748	34%	0.341	S	S	*	.	H	α-helix	trans	-64.5	-38.1	176.1	-171	0	0	0	0	111.7	G318 W319	G318-S321 WeakPolarHBondContact O-CB 3.14Å; G318-S321 PolarHBondContact O-N 3.12Å; G318-S321 VanDerWaalsContact O-N 3.11Å; W319-S321 VanDerWaalsContact C-N 3.32Å; W319-S321 PolarHBondContact O-N 3.28Å
322	M	95	Very high	93.3	Very high	167 Å²	167	60.6 Å²	60.6	82%	0.823	34%	0.342	S	S	*	.	H	α-helix	trans	-73.7	-24.8	177.8	-68.7	179.7	65.7	0	0	113.7	G318 W319 C320	G318-M322 WeakPolarHBondContact O-CG 3.4Å; G318-M322 PolarHBondContact O-N 2.81Å; W319-M322 PolarHBondContact O-N 2.97Å; W319-M322 VanDerWaalsContact O-N 3.17Å; C320-M322 VanDerWaalsContact C-N 3.33Å; C320-M322 PolarHBondContact O-N 3.31Å
323	T	94.5	Very high	92.8	Very high	58 Å²	58	59.2 Å²	59.2	36%	0.356	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	10.1	-173.9	58.9	0	0	0	0	114.2	W319 C320 K325	W319-T323 HydrophobicContact CD2-CG2 4.16Å; W319-T323 HydrophobicContact CG-CG2 4.41Å; W319-T323 HydrophobicContact CZ2-CG2 4.15Å; W319-T323 WeakPolarHBondContact O-CB 3.49Å; W319-T323 WeakPolarHBondContact O-CG2 3.47Å; W319-T323 PolarHBondContact O-N 3.11Å; W319-T323 PolarHBondContact O-OG1 3.43Å; C320-T323 PolarHBondContact O-N 2.74Å; T323-K325 VanDerWaalsContact C-N 3.32Å; T323-K325 PolarHBondContact O-N 3.07Å; T323-K325 WeakPolarHBondContact OG1-CG 3.45Å
324	S	93.7	Very high	91.6	Very high	116 Å²	116	60.9 Å²	60.9	81%	0.811	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	44.7	-176.5	-56.6	0	0	0	0	113.1	C320	C320-S324 PolarHBondContact O-N 2.92Å
325	K	94.3	Very high	90.7	Very high	96 Å²	96	68.9 Å²	68.9	42%	0.417	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-101.5	156.3	170.2	-57.3	-61.3	179.9	-176.5	0	110.4	Y277 W319 C320 T323	Y277-K325 HydrophobicContact CD2-CB 4.09Å; Y277-K325 HydrophobicContact CD2-CG 4.42Å; Y277-K325 HydrophobicContact CE2-CB 4.37Å; Y277-K325 HydrophobicContact CE2-CD 4.26Å; Y277-K325 HydrophobicContact CE2-CG 4.2Å; W319-K325 HydrophobicContact CH2-CG 4.19Å; W319-K325 HydrophobicContact CZ3-CB 4.47Å; W319-K325 HydrophobicContact CZ3-CG 3.87Å; C320-K325 HydrophobicContact CB-CB 3.88Å; C320-K325 PolarHBondContact O-N 2.88Å; T323-K325 VanDerWaalsContact C-N 3.32Å; T323-K325 PolarHBondContact O-N 3.07Å; T323-K325 WeakPolarHBondContact OG1-CG 3.45Å
326	L	92.8	Very high	90.2	Very high	116 Å²	116	70.2 Å²	70.2	61%	0.607	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-100.3	127.9	-179.5	-60.4	178.4	0	0	0	110.1	V276 Y277 V328	V276-L326 HydrophobicContact CG1-CB 4.38Å; Y277-L326 PolarHBondContact N-O 3.28Å; L326-V328 HydrophobicContact CB-CG2 4.01Å
327	L	94.4	Very high	89.6	Confident	63 Å²	63	75.4 Å²	75.4	33%	0.33	43%	0.425	S	S	.	.	B	Isolated β-bridge	trans	-79.5	121.5	159.4	-64.7	176.6	0	0	0	108	E264 Y277 W278 I279 C320	E264-L327 HydrophobicContact CG-CD2 4.12Å; Y277-L327 CarbonylContact O-C 3.6Å; Y277-L327 VanDerWaalsContact O-CA 3.26Å; Y277-L327 WeakPolarHBondContact O-CA 3.47Å; W278-L327 HydrophobicContact CE3-CB 3.94Å; W278-L327 HydrophobicContact CZ3-CB 3.96Å; I279-L327 HydrophobicContact CD1-CD1 4.01Å; I279-L327 HydrophobicContact CG1-CD1 4.25Å; I279-L327 HydrophobicContact CG1-CD2 4.34Å; C320-L327 HydrophobicContact CB-CD2 4.19Å; C320-L327 HydrophobicContact CB-CG 4.18Å
328	V	93.5	Very high	89.4	Confident	30 Å²	30	76.4 Å²	76.4	18%	0.182	43%	0.431	C	S	.	.			trans	-131.5	126.3	-180	179	0	0	0	0	108.3	N267 L272 V276 Y277 W278 L326	N267-V328 PolarHBondContact ND2-O 3.27Å; L272-V328 HydrophobicContact CD1-CG1 4.43Å; L272-V328 HydrophobicContact CD1-CG2 4.23Å; V276-V328 HydrophobicContact CB-CB 4.15Å; V276-V328 HydrophobicContact CB-CG2 3.9Å; V276-V328 HydrophobicContact CG1-CG2 3.93Å; V276-V328 HydrophobicContact CG2-CB 4.02Å; V276-V328 HydrophobicContact CG2-CG2 4.21Å; Y277-V328 PolarHBondContact O-N 3.08Å; W278-V328 VanDerWaalsContact CE3-O 3.24Å; L326-V328 HydrophobicContact CB-CG2 4.01Å
329	P	92.8	Very high	89.2	Confident	40 Å²	40	77.7 Å²	77.7	26%	0.26	43%	0.428	S	S	.	.			trans	-66.2	152.9	-177	26.4	-34.3	0	0	0	112.3	N267 W278 W339	N267-P329 PolarHBondContact ND2-O 3.41Å; W278-P329 HydrophobicContact CD2-CB 4.48Å; W278-P329 HydrophobicContact CE3-CB 4.48Å; W278-P329 HydrophobicContact CH2-CB 3.84Å; W278-P329 HydrophobicContact CH2-CG 4.42Å; W278-P329 HydrophobicContact CZ2-CB 3.87Å; W278-P329 HydrophobicContact CZ3-CB 4.17Å; P329-W339 HydrophobicContact CB-CD2 4.1Å; P329-W339 HydrophobicContact CB-CH2 3.96Å; P329-W339 HydrophobicContact CB-CZ2 3.51Å; P329-W339 HydrophobicContact CB-CZ3 4.44Å; P329-W339 HydrophobicContact CG-CD2 4.44Å; P329-W339 HydrophobicContact CG-CZ2 4.24Å
330	P	91.8	Very high	89	Confident	5 Å²	5	82.1 Å²	82.1	3%	0.032	45%	0.449	C	S	.	.			trans	-58.3	143.8	171.1	-25.4	36.1	0	0	0	112.2	N269 W278 Y294 Y297 D332 A333	N269-P330 HydrophobicContact CB-CB 4.34Å; N269-P330 CarbonylContact O-C 3.51Å; N269-P330 VanDerWaalsContact O-CA 3.28Å; N269-P330 WeakPolarHBondContact O-CA 3.37Å; W278-P330 HydrophobicContact CG-CG 4.41Å; Y294-P330 HydrophobicContact CD1-CG 4.36Å; Y294-P330 HydrophobicContact CD2-CG 4Å; Y294-P330 HydrophobicContact CG-CG 3.84Å; Y297-P330 HydrophobicContact CE2-CB 3.79Å; Y297-P330 HydrophobicContact CE2-CG 3.94Å; P330-D332 VanDerWaalsContact C-N 3.29Å; P330-D332 PolarHBondContact O-N 3.19Å; P330-A333 HydrophobicContact CB-CB 4.14Å; P330-A333 PolarHBondContact O-N 2.99Å
331	Q	86.6	Confident	89	Confident	101 Å²	101	85.4 Å²	85.4	47%	0.472	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-37.5	-174.8	-179.3	174.9	-50.3	0	0	113	N269 V271 N334	N269-Q331 PolarHBondContact O-N 3.44Å; V271-Q331 HydrophobicContact CG2-CB 4Å; V271-Q331 HydrophobicContact CG2-CG 3.96Å; Q331-N334 PolarHBondContact O-ND2 2.79Å; Q331-N334 VanDerWaalsContact O-ND2 3.14Å
332	D	83.8	Confident	89	Confident	79 Å²	79	82 Å²	82	42%	0.422	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-6.5	-173.6	-54.8	-59.1	0	0	0	113.5	N269 P330 N334	N269-D332 PolarHBondContact ND2-OD2 2.79Å; P330-D332 VanDerWaalsContact C-N 3.29Å; P330-D332 PolarHBondContact O-N 3.19Å; D332-N334 VanDerWaalsContact C-ND2 3.32Å; D332-N334 WeakPolarHBondContact CA-ND2 3.37Å; D332-N334 PolarHBondContact O-N 3.06Å; D332-N334 PolarHBondContact O-ND2 2.97Å; D332-N334 VanDerWaalsContact O-ND2 3.12Å
333	A	78.4	Confident	89	Confident	8 Å²	8	75 Å²	75	7%	0.066	41%	0.409	C	S	.	.			trans	-74.6	54.7	176.5	0	0	0	0	0	112.4	Y297 P330 W339	Y297-A333 HydrophobicContact CD2-CB 4.39Å; Y297-A333 HydrophobicContact CE2-CB 4.08Å; P330-A333 HydrophobicContact CB-CB 4.14Å; P330-A333 PolarHBondContact O-N 2.99Å; A333-W339 HydrophobicContact CB-CH2 3.9Å; A333-W339 HydrophobicContact CB-CZ2 4.24Å; A333-W339 WeakPolarHBondContact O-CZ2 3.48Å
334	N	63.8	Low	88.9	Confident	110 Å²	110	77.7 Å²	77.7	59%	0.588	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	164.5	179.9	-69	-82.8	0	0	0	111.3	Q331 D332	Q331-N334 PolarHBondContact O-ND2 2.79Å; Q331-N334 VanDerWaalsContact O-ND2 3.14Å; D332-N334 VanDerWaalsContact C-ND2 3.32Å; D332-N334 WeakPolarHBondContact CA-ND2 3.37Å; D332-N334 PolarHBondContact O-N 3.06Å; D332-N334 PolarHBondContact O-ND2 2.97Å; D332-N334 VanDerWaalsContact O-ND2 3.12Å
335	N	75.6	Confident	89	Confident	168 Å²	168	80.8 Å²	80.8	90%	0.898	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.4	-6.7	-175.2	-47.9	-47.1	0	0	0	117.4
336	I	86.1	Confident	88.9	Confident	39 Å²	39	79 Å²	79	20%	0.2	41%	0.41	C	S	.	.			trans	-99.9	112.6	173.4	-64.1	165.9	0	0	0	110.6	W339 Y342	I336-W339 HydrophobicContact CB-CD2 4.08Å; I336-W339 HydrophobicContact CB-CE3 4.24Å; I336-W339 HydrophobicContact CB-CH2 4.03Å; I336-W339 HydrophobicContact CB-CZ2 3.82Å; I336-W339 HydrophobicContact CB-CZ3 4.22Å; I336-W339 HydrophobicContact CD1-CE3 4.18Å; I336-W339 HydrophobicContact CD1-CH2 3.6Å; I336-W339 HydrophobicContact CD1-CZ2 4.28Å; I336-W339 HydrophobicContact CD1-CZ3 3.52Å; I336-W339 HydrophobicContact CG1-CH2 4.36Å; I336-W339 HydrophobicContact CG1-CZ3 4.47Å; I336-W339 HydrophobicContact CG2-CD2 3.51Å; I336-W339 HydrophobicContact CG2-CE3 3.67Å; I336-W339 HydrophobicContact CG2-CG 3.92Å; I336-W339 HydrophobicContact CG2-CH2 4.38Å; I336-W339 HydrophobicContact CG2-CZ2 4.22Å; I336-W339 HydrophobicContact CG2-CZ3 4.11Å; I336-W339 PolarHBondContact O-NE1 2.93Å; I336-Y342 HydrophobicContact CD1-CD1 4.07Å; I336-Y342 HydrophobicContact CD1-CD2 3.78Å; I336-Y342 HydrophobicContact CD1-CE1 3.9Å; I336-Y342 HydrophobicContact CD1-CE2 3.6Å; I336-Y342 HydrophobicContact CD1-CG 4.01Å; I336-Y342 HydrophobicContact CG1-CD2 4.3Å; I336-Y342 HydrophobicContact CG1-CE2 4.46Å; I336-Y342 HydrophobicContact CG2-CD2 4.5Å; I336-Y342 HydrophobicContact CG2-CG 4.1Å
337	S	85.3	Confident	89	Confident	127 Å²	127	75.4 Å²	75.4	89%	0.888	39%	0.391	S	S	*	.	S	Bend	trans	-91	-37.5	-179.4	54.3	0	0	0	0	113.8
338	D	92.7	Very high	89	Confident	77 Å²	77	77.9 Å²	77.9	41%	0.412	41%	0.409	S	S	.	.			trans	-113.3	85.2	173.2	-176	-2.3	0	0	0	110.9	K340 S341 Y342	D338-K340 PolarHBondContact O-N 2.95Å; D338-K340 WeakPolarHBondContact OD1-CA 3.3Å; D338-K340 VanDerWaalsContact OD1-CB 3.3Å; D338-K340 WeakPolarHBondContact OD1-CB 3.42Å; D338-K340 PolarHBondContact OD1-N 2.77Å; D338-S341 PolarHBondContact O-N 3.44Å; D338-S341 PolarHBondContact OD1-N 2.77Å; D338-S341 WeakPolarHBondContact OD2-CB 3.47Å; D338-S341 PolarHBondContact OD2-OG 3.09Å; D338-Y342 WeakPolarHBondContact O-CB 3.04Å; D338-Y342 PolarHBondContact O-N 3.48Å
339	W	92.6	Very high	88.9	Confident	53 Å²	53	80.5 Å²	80.5	20%	0.201	44%	0.442	C	S	.	.	H	α-helix	trans	-58.5	-26.7	173.5	-74	103.9	0	0	0	113.8	W278 P329 A333 I336 Y342 L343	W278-W339 HydrophobicContact CH2-CD2 4.14Å; W278-W339 AromaticContact CH2-CE3 3.84Å; W278-W339 HydrophobicContact CH2-CE3 3.84Å; W278-W339 HydrophobicContact CH2-CG 4.49Å; W278-W339 HydrophobicContact CH2-CZ3 4.36Å; W278-W339 HydrophobicContact CZ2-CD2 4.13Å; W278-W339 AromaticContact CZ2-CE3 3.44Å; W278-W339 HydrophobicContact CZ2-CE3 3.44Å; W278-W339 VanDerWaalsContact CZ2-CE3 3.44Å; W278-W339 HydrophobicContact CZ2-CH2 4.29Å; W278-W339 AromaticContact CZ2-CZ3 3.54Å; W278-W339 HydrophobicContact CZ2-CZ3 3.54Å; P329-W339 HydrophobicContact CB-CD2 4.1Å; P329-W339 HydrophobicContact CB-CH2 3.96Å; P329-W339 HydrophobicContact CB-CZ2 3.51Å; P329-W339 HydrophobicContact CB-CZ3 4.44Å; P329-W339 HydrophobicContact CG-CD2 4.44Å; P329-W339 HydrophobicContact CG-CZ2 4.24Å; A333-W339 HydrophobicContact CB-CH2 3.9Å; A333-W339 HydrophobicContact CB-CZ2 4.24Å; A333-W339 WeakPolarHBondContact O-CZ2 3.48Å; I336-W339 HydrophobicContact CB-CD2 4.08Å; I336-W339 HydrophobicContact CB-CE3 4.24Å; I336-W339 HydrophobicContact CB-CH2 4.03Å; I336-W339 HydrophobicContact CB-CZ2 3.82Å; I336-W339 HydrophobicContact CB-CZ3 4.22Å; I336-W339 HydrophobicContact CD1-CE3 4.18Å; I336-W339 HydrophobicContact CD1-CH2 3.6Å; I336-W339 HydrophobicContact CD1-CZ2 4.28Å; I336-W339 HydrophobicContact CD1-CZ3 3.52Å; I336-W339 HydrophobicContact CG1-CH2 4.36Å; I336-W339 HydrophobicContact CG1-CZ3 4.47Å; I336-W339 HydrophobicContact CG2-CD2 3.51Å; I336-W339 HydrophobicContact CG2-CE3 3.67Å; I336-W339 HydrophobicContact CG2-CG 3.92Å; I336-W339 HydrophobicContact CG2-CH2 4.38Å; I336-W339 HydrophobicContact CG2-CZ2 4.22Å; I336-W339 HydrophobicContact CG2-CZ3 4.11Å; I336-W339 PolarHBondContact O-NE1 2.93Å; W339-Y342 AromaticContact CE3-CD1 3.87Å; W339-Y342 HydrophobicContact CE3-CD1 3.87Å; W339-Y342 HydrophobicContact CE3-CE1 4.36Å; W339-Y342 AromaticContact CZ3-CD1 3.99Å; W339-Y342 HydrophobicContact CZ3-CD1 3.99Å; W339-Y342 HydrophobicContact CZ3-CE1 4.01Å; W339-L343 VanDerWaalsContact O-CB 3.31Å; W339-L343 WeakPolarHBondContact O-CB 3.47Å; W339-L343 VanDerWaalsContact O-CG 3.26Å; W339-L343 WeakPolarHBondContact O-CG 3.42Å; W339-L343 PolarHBondContact O-N 3.07Å
340	K	92.5	Very high	89	Confident	163 Å²	163	80.5 Å²	80.5	71%	0.709	44%	0.443	S	S	*	.	H	α-helix	trans	-72.5	-51.8	179.6	-178.2	-170.8	174.7	-172	0	110.1	D338 Y342 L343 M344	D338-K340 PolarHBondContact O-N 2.95Å; D338-K340 WeakPolarHBondContact OD1-CA 3.3Å; D338-K340 VanDerWaalsContact OD1-CB 3.3Å; D338-K340 WeakPolarHBondContact OD1-CB 3.42Å; D338-K340 PolarHBondContact OD1-N 2.77Å; K340-Y342 VanDerWaalsContact C-N 3.3Å; K340-Y342 PolarHBondContact O-N 3.29Å; K340-L343 PolarHBondContact O-N 3.44Å; K340-M344 WeakPolarHBondContact O-CB 3.31Å; K340-M344 WeakPolarHBondContact O-CG 3.18Å; K340-M344 PolarHBondContact O-N 2.67Å
341	S	94.4	Very high	89.2	Confident	70 Å²	70	83.9 Å²	83.9	49%	0.49	46%	0.463	S	S	.	.	H	α-helix	trans	-63.3	-37.2	175.9	-64.7	0	0	0	0	112.2	D338 K345	D338-S341 PolarHBondContact O-N 3.44Å; D338-S341 PolarHBondContact OD1-N 2.77Å; D338-S341 WeakPolarHBondContact OD2-CB 3.47Å; D338-S341 PolarHBondContact OD2-OG 3.09Å; S341-K345 PolarHBondContact O-N 2.7Å; S341-K345 VanDerWaalsContact O-N 3.07Å
342	Y	94.5	Very high	89.7	Confident	35 Å²	35	81.4 Å²	81.4	14%	0.137	46%	0.455	C	S	.	.	H	α-helix	trans	-60.3	-55.2	174.3	177	-96.2	0	0	0	112.3	E295 G296 E298 I336 D338 W339 K340 M344 K345 K346	E295-Y342 HydrophobicContact CB-CE1 4.19Å; G296-Y342 WeakPolarHBondContact CA-OH 3.45Å; G296-Y342 PolarHBondContact N-OH 3.28Å; E298-Y342 WeakPolarHBondContact OE1-CE2 3.39Å; E298-Y342 VanDerWaalsContact OE1-CZ 3.3Å; E298-Y342 PolarHBondContact OE1-OH 2.9Å; I336-Y342 HydrophobicContact CD1-CD1 4.07Å; I336-Y342 HydrophobicContact CD1-CD2 3.78Å; I336-Y342 HydrophobicContact CD1-CE1 3.9Å; I336-Y342 HydrophobicContact CD1-CE2 3.6Å; I336-Y342 HydrophobicContact CD1-CG 4.01Å; I336-Y342 HydrophobicContact CG1-CD2 4.3Å; I336-Y342 HydrophobicContact CG1-CE2 4.46Å; I336-Y342 HydrophobicContact CG2-CD2 4.5Å; I336-Y342 HydrophobicContact CG2-CG 4.1Å; D338-Y342 WeakPolarHBondContact O-CB 3.04Å; D338-Y342 PolarHBondContact O-N 3.48Å; W339-Y342 AromaticContact CE3-CD1 3.87Å; W339-Y342 HydrophobicContact CE3-CD1 3.87Å; W339-Y342 HydrophobicContact CE3-CE1 4.36Å; W339-Y342 AromaticContact CZ3-CD1 3.99Å; W339-Y342 HydrophobicContact CZ3-CD1 3.99Å; W339-Y342 HydrophobicContact CZ3-CE1 4.01Å; K340-Y342 VanDerWaalsContact C-N 3.3Å; K340-Y342 PolarHBondContact O-N 3.29Å; Y342-M344 PolarHBondContact O-N 2.71Å; Y342-K345 WeakPolarHBondContact O-CB 3.28Å; Y342-K345 PolarHBondContact O-N 2.81Å; Y342-K345 VanDerWaalsContact O-N 3.13Å; Y342-K346 HydrophobicContact CD1-CG 4.42Å; Y342-K346 HydrophobicContact CE1-CG 4.04Å; Y342-K346 HydrophobicContact CE2-CG 4.29Å; Y342-K346 WeakPolarHBondContact O-CG 3.44Å; Y342-K346 PolarHBondContact O-N 3.08Å; Y342-K346 WeakPolarHBondContact OH-CE 3.32Å
343	L	94.9	Very high	90.2	Very high	22 Å²	22	77.8 Å²	77.8	12%	0.115	44%	0.436	C	S	.	.	H	α-helix	trans	-64.3	-39.6	-179.9	-71.9	175.8	0	0	0	111.9	W278 I279 E295 W339 K340 K345 K346 L347	W278-L343 HydrophobicContact CH2-CD1 3.73Å; W278-L343 HydrophobicContact CH2-CG 4.49Å; W278-L343 HydrophobicContact CZ2-CD1 4.11Å; W278-L343 HydrophobicContact CZ2-CD2 4.27Å; W278-L343 HydrophobicContact CZ2-CG 4.47Å; W278-L343 HydrophobicContact CZ3-CD1 4.34Å; I279-L343 HydrophobicContact CD1-CD1 4.14Å; I279-L343 HydrophobicContact CD1-CD2 4Å; E295-L343 HydrophobicContact CB-CD2 4.08Å; E295-L343 HydrophobicContact CG-CD2 4.4Å; W339-L343 VanDerWaalsContact O-CB 3.31Å; W339-L343 WeakPolarHBondContact O-CB 3.47Å; W339-L343 VanDerWaalsContact O-CG 3.26Å; W339-L343 WeakPolarHBondContact O-CG 3.42Å; W339-L343 PolarHBondContact O-N 3.07Å; K340-L343 PolarHBondContact O-N 3.44Å; L343-K345 VanDerWaalsContact C-N 3.26Å; L343-K345 PolarHBondContact O-N 3.33Å; L343-K346 PolarHBondContact O-N 3.17Å; L343-L347 HydrophobicContact CB-CD1 4.24Å; L343-L347 VanDerWaalsContact O-CB 3.32Å; L343-L347 WeakPolarHBondContact O-CB 3.07Å; L343-L347 VanDerWaalsContact O-CG 3.24Å; L343-L347 WeakPolarHBondContact O-CG 3.34Å; L343-L347 PolarHBondContact O-N 3.36Å
344	M	93.3	Very high	91	Very high	113 Å²	113	78.7 Å²	78.7	56%	0.557	44%	0.441	S	S	*	.	H	α-helix	trans	-58.7	-37.8	174.1	-73.6	-60.8	-55.4	0	0	112.1	K340 Y342 V348	K340-M344 WeakPolarHBondContact O-CB 3.31Å; K340-M344 WeakPolarHBondContact O-CG 3.18Å; K340-M344 PolarHBondContact O-N 2.67Å; Y342-M344 PolarHBondContact O-N 2.71Å; M344-V348 WeakPolarHBondContact O-CG2 3.26Å; M344-V348 PolarHBondContact O-N 3.44Å
345	K	94.4	Very high	92.5	Very high	181 Å²	181	80 Å²	80	79%	0.787	45%	0.452	S	S	*	.	H	α-helix	trans	-69.4	-33.9	174.2	-175.2	-179.8	176.1	-174.7	0	112.8	S341 Y342 L343	S341-K345 PolarHBondContact O-N 2.7Å; S341-K345 VanDerWaalsContact O-N 3.07Å; Y342-K345 WeakPolarHBondContact O-CB 3.28Å; Y342-K345 PolarHBondContact O-N 2.81Å; Y342-K345 VanDerWaalsContact O-N 3.13Å; L343-K345 VanDerWaalsContact C-N 3.26Å; L343-K345 PolarHBondContact O-N 3.33Å
346	K	93.7	Very high	93.4	Very high	58 Å²	58	75.3 Å²	75.3	25%	0.252	43%	0.428	S	S	.	.	H	α-helix	trans	-83.4	-23.6	-177	-71.3	-76.2	-175.2	159	0	114.8	K262 E295 E298 Y342 L343	K262-K346 WeakPolarHBondContact CE-O 3.46Å; E295-K346 WeakPolarHBondContact OE2-CB 3.48Å; E295-K346 WeakPolarHBondContact OE2-CD 3.28Å; E298-K346 WeakPolarHBondContact OE1-CE 3.15Å; E298-K346 IonicContact OE1-NZ 2.66Å; E298-K346 PolarHBondContact OE1-NZ 2.97Å; E298-K346 IonicContact OE2-NZ 2.59Å; E298-K346 PolarHBondContact OE2-NZ 3.2Å; Y342-K346 HydrophobicContact CD1-CG 4.42Å; Y342-K346 HydrophobicContact CE1-CG 4.04Å; Y342-K346 HydrophobicContact CE2-CG 4.29Å; Y342-K346 WeakPolarHBondContact O-CG 3.44Å; Y342-K346 PolarHBondContact O-N 3.08Å; Y342-K346 WeakPolarHBondContact OH-CE 3.32Å; L343-K346 PolarHBondContact O-N 3.17Å
347	L	95.1	Very high	93.8	Very high	41 Å²	41	73.7 Å²	73.7	22%	0.215	42%	0.419	C	S	.	.	H	α-helix	trans	-98.1	-17.4	-176.5	-66.4	172.1	0	0	0	114.2	K262 I279 I317 L343 G349 S350	K262-L347 HydrophobicContact CB-CD2 4.03Å; K262-L347 HydrophobicContact CG-CD2 4.04Å; I279-L347 HydrophobicContact CD1-CD1 3.98Å; I279-L347 HydrophobicContact CD1-CD2 4.38Å; I279-L347 HydrophobicContact CG2-CD2 4.31Å; I317-L347 HydrophobicContact CD1-CD2 4.11Å; I317-L347 HydrophobicContact CG1-CD2 4.08Å; I317-L347 HydrophobicContact CG2-CD1 4.32Å; I317-L347 HydrophobicContact CG2-CD2 4.3Å; L343-L347 HydrophobicContact CB-CD1 4.24Å; L343-L347 VanDerWaalsContact O-CB 3.32Å; L343-L347 WeakPolarHBondContact O-CB 3.07Å; L343-L347 VanDerWaalsContact O-CG 3.24Å; L343-L347 WeakPolarHBondContact O-CG 3.34Å; L343-L347 PolarHBondContact O-N 3.36Å; L347-G349 PolarHBondContact O-N 3.19Å; L347-G349 VanDerWaalsContact O-N 3.14Å; L347-S350 WeakPolarHBondContact CA-OG 3.39Å; L347-S350 PolarHBondContact O-N 3.16Å; L347-S350 PolarHBondContact O-OG 2.94Å
348	V	93.6	Very high	94.3	Very high	115 Å²	115	70.5 Å²	70.5	70%	0.697	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	115.4	178	162.8	0	0	0	0	109.8	M344	M344-V348 WeakPolarHBondContact O-CG2 3.26Å; M344-V348 PolarHBondContact O-N 3.44Å
349	G	91.3	Very high	94.4	Very high	85 Å²	85	71 Å²	71	88%	0.876	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	-0.4	-179.6	0	0	0	0	0	115.4	L347	L347-G349 PolarHBondContact O-N 3.19Å; L347-G349 VanDerWaalsContact O-N 3.14Å
350	S	94.1	Very high	94.5	Very high	40 Å²	40	70.6 Å²	70.6	28%	0.28	39%	0.393	S	S	.	.			trans	-78.8	142.4	177.8	65.4	0	0	0	0	112.7	K262 L347	K262-S350 WeakPolarHBondContact CG-OG 3.47Å; L347-S350 WeakPolarHBondContact CA-OG 3.39Å; L347-S350 PolarHBondContact O-N 3.16Å; L347-S350 PolarHBondContact O-OG 2.94Å
351	T	96.3	Very high	94.6	Very high	76 Å²	76	63.5 Å²	63.5	47%	0.466	36%	0.363	S	S	.	.			trans	-74.3	162.2	167.7	51.2	0	0	0	0	111.9	M261 K262	M261-T351 WeakPolarHBondContact CB-OG1 3.23Å; K262-T351 PolarHBondContact N-O 3.18Å
352	T	97.4	Very high	94.6	Very high	49 Å²	49	63.1 Å²	63.1	30%	0.301	36%	0.364	S	S	.	.			trans	-149	168.9	174.2	-167.1	0	0	0	0	109.4	K262 P316 I317	K262-T352 WeakPolarHBondContact O-CA 3.42Å; K262-T352 WeakPolarHBondContact O-CB 3.43Å; K262-T352 PolarHBondContact O-OG1 3Å; P316-T352 WeakPolarHBondContact CA-OG1 3.28Å; P316-T352 HydrophobicContact CB-CG2 4.31Å; I317-T352 HydrophobicContact CB-CG2 4.49Å; I317-T352 PolarHBondContact N-OG1 3.12Å
353	L	95.2	Very high	94.5	Very high	3 Å²	3	66.9 Å²	66.9	2%	0.016	38%	0.383	C	S	.	.			trans	-55.2	144.2	178.2	-80.6	168.1	0	0	0	112.2	M261 V263 I309 L314 P316 V355 F357	M261-L353 HydrophobicContact CE-CD2 3.68Å; M261-L353 HydrophobicContact CE-CG 3.94Å; M261-L353 HydrophobicContact SD-CD2 4.14Å; M261-L353 HydrophobicContact SD-CG 4.13Å; V263-L353 HydrophobicContact CG1-CD1 3.77Å; V263-L353 HydrophobicContact CG1-CG 3.89Å; I309-L353 HydrophobicContact CG2-CD2 4.17Å; L314-L353 HydrophobicContact CB-CD1 3.81Å; P316-L353 WeakPolarHBondContact CB-O 3.46Å; L353-V355 PolarHBondContact O-N 3.42Å; L353-F357 HydrophobicContact CD2-CD1 4.39Å; L353-F357 HydrophobicContact CD2-CD2 4.06Å; L353-F357 HydrophobicContact CD2-CE1 4.48Å; L353-F357 HydrophobicContact CD2-CE2 4.15Å; L353-F357 HydrophobicContact CD2-CG 4.19Å; L353-F357 HydrophobicContact CD2-CZ 4.36Å
354	P	94.9	Very high	94.3	Very high	27 Å²	27	68.6 Å²	68.6	18%	0.175	40%	0.397	C	S	.	.			trans	-58.1	136.3	170.2	-24.6	33.7	0	0	0	112.1	D256 D356 F357	D256-P354 HydrophobicContact CB-CG 3.49Å; D256-P354 VanDerWaalsContact CB-CG 3.49Å; D256-P354 WeakPolarHBondContact OD2-CG 3.1Å; P354-D356 WeakPolarHBondContact CB-OD1 3.46Å; P354-D356 PolarHBondContact O-N 2.95Å; P354-D356 VanDerWaalsContact O-N 3.12Å; P354-F357 HydrophobicContact CB-CB 4.22Å; P354-F357 WeakPolarHBondContact O-CB 3.42Å; P354-F357 PolarHBondContact O-N 2.89Å
355	V	93.9	Very high	94.2	Very high	137 Å²	137	66.6 Å²	66.6	83%	0.83	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-16.6	-178.9	-64.1	0	0	0	0	113.8	P316 L353	P316-V355 HydrophobicContact CB-CG1 4.38Å; P316-V355 HydrophobicContact CG-CG1 4.29Å; L353-V355 PolarHBondContact O-N 3.42Å
356	D	94.5	Very high	93.8	Very high	71 Å²	71	63.3 Å²	63.3	38%	0.38	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	3.3	175.4	68.6	-26.2	0	0	0	113.5	P354 Y358 V359 K360	P354-D356 WeakPolarHBondContact CB-OD1 3.46Å; P354-D356 PolarHBondContact O-N 2.95Å; P354-D356 VanDerWaalsContact O-N 3.12Å; D356-Y358 PolarHBondContact O-N 2.82Å; D356-V359 HydrophobicContact CB-CB 4.47Å; D356-V359 CarbonylContact O-C 3.55Å; D356-V359 VanDerWaalsContact O-CA 3.31Å; D356-V359 WeakPolarHBondContact O-CA 3.37Å; D356-V359 VanDerWaalsContact O-CB 3.26Å; D356-V359 WeakPolarHBondContact O-CB 3.22Å; D356-V359 PolarHBondContact O-N 2.96Å; D356-K360 PolarHBondContact O-N 3.3Å; D356-K360 WeakPolarHBondContact OD2-CE 3.19Å
357	F	95.6	Very high	92.9	Very high	4 Å²	4	65.2 Å²	65.2	2%	0.018	39%	0.391	C	S	.	.	H	α-helix	trans	-48.5	-50.1	-177.4	179.2	-94.8	0	0	0	113.3	L250 W254 V257 I309 V310 L353 P354 V359 K360 L361	L250-F357 HydrophobicContact CD1-CD2 4.12Å; L250-F357 HydrophobicContact CD1-CE1 3.98Å; L250-F357 HydrophobicContact CD1-CE2 3.5Å; L250-F357 VanDerWaalsContact CD1-CE2 3.5Å; L250-F357 HydrophobicContact CD1-CZ 3.41Å; L250-F357 VanDerWaalsContact CD1-CZ 3.41Å; W254-F357 HydrophobicContact CE3-CE2 4.48Å; W254-F357 HydrophobicContact CH2-CZ 4.28Å; W254-F357 AromaticContact CZ3-CE2 3.99Å; W254-F357 HydrophobicContact CZ3-CE2 3.99Å; W254-F357 AromaticContact CZ3-CZ 3.86Å; W254-F357 HydrophobicContact CZ3-CZ 3.86Å; V257-F357 HydrophobicContact CG2-CD2 4.49Å; V257-F357 HydrophobicContact CG2-CE2 3.72Å; I309-F357 HydrophobicContact CG2-CE1 3.97Å; I309-F357 HydrophobicContact CG2-CZ 3.64Å; V310-F357 HydrophobicContact CG1-CE1 4.44Å; V310-F357 HydrophobicContact CG1-CZ 4.32Å; L353-F357 HydrophobicContact CD2-CD1 4.39Å; L353-F357 HydrophobicContact CD2-CD2 4.06Å; L353-F357 HydrophobicContact CD2-CE1 4.48Å; L353-F357 HydrophobicContact CD2-CE2 4.15Å; L353-F357 HydrophobicContact CD2-CG 4.19Å; L353-F357 HydrophobicContact CD2-CZ 4.36Å; P354-F357 HydrophobicContact CB-CB 4.22Å; P354-F357 WeakPolarHBondContact O-CB 3.42Å; P354-F357 PolarHBondContact O-N 2.89Å; F357-V359 VanDerWaalsContact C-N 3.29Å; F357-V359 PolarHBondContact O-N 2.9Å; F357-K360 PolarHBondContact O-N 2.78Å; F357-L361 PolarHBondContact O-N 2.94Å
358	Y	94.6	Very high	92.2	Very high	61 Å²	61	65.5 Å²	65.5	24%	0.239	40%	0.396	C	S	.	.	H	α-helix	trans	-72.5	-19.8	177.4	-67.8	-58.5	0	0	0	114.2	I309 G312 L314 D356 L361 A362	I309-Y358 PolarHBondContact O-OH 3.31Å; G312-Y358 PolarHBondContact N-OH 3.19Å; L314-Y358 WeakPolarHBondContact O-CE2 3.26Å; L314-Y358 PolarHBondContact O-OH 3.32Å; D356-Y358 PolarHBondContact O-N 2.82Å; Y358-L361 HydrophobicContact CD1-CD2 4Å; Y358-L361 HydrophobicContact CE1-CD2 4.42Å; Y358-A362 WeakPolarHBondContact O-CB 3.27Å; Y358-A362 PolarHBondContact O-N 3.39Å; Y358-A362 VanDerWaalsContact O-N 3.15Å
359	V	94.7	Very high	92	Very high	87 Å²	87	60.1 Å²	60.1	53%	0.527	36%	0.363	S	S	.	.	H	α-helix	trans	-72.6	-52	169.2	-173.2	0	0	0	0	108.7	D356 F357 L361 A362 E363	D356-V359 HydrophobicContact CB-CB 4.47Å; D356-V359 CarbonylContact O-C 3.55Å; D356-V359 VanDerWaalsContact O-CA 3.31Å; D356-V359 WeakPolarHBondContact O-CA 3.37Å; D356-V359 VanDerWaalsContact O-CB 3.26Å; D356-V359 WeakPolarHBondContact O-CB 3.22Å; D356-V359 PolarHBondContact O-N 2.96Å; F357-V359 VanDerWaalsContact C-N 3.29Å; F357-V359 PolarHBondContact O-N 2.9Å; V359-L361 VanDerWaalsContact C-N 3.27Å; V359-L361 PolarHBondContact O-N 3.24Å; V359-A362 CarbonylContact O-C 3.57Å; V359-A362 PolarHBondContact O-N 3.34Å; V359-A362 VanDerWaalsContact O-N 3.14Å; V359-E363 HydrophobicContact CG1-CG 4.19Å; V359-E363 WeakPolarHBondContact O-CG 3.26Å; V359-E363 PolarHBondContact O-N 3.1Å
360	K	95.2	Very high	91.8	Very high	45 Å²	45	65 Å²	65	20%	0.196	36%	0.355	C	S	.	.	H	α-helix	trans	-52.2	-44.3	174.1	-62.9	-178.6	179.2	-166.9	0	111.5	L250 D253 D256 D356 F357 E363 S364	L250-K360 HydrophobicContact CD2-CB 3.49Å; L250-K360 VanDerWaalsContact CD2-CB 3.49Å; D253-K360 HydrophobicContact CB-CD 3.97Å; D253-K360 WeakPolarHBondContact OD1-CD 3.49Å; D253-K360 VanDerWaalsContact OD1-CE 3.29Å; D253-K360 WeakPolarHBondContact OD1-CE 3.18Å; D253-K360 IonicContact OD1-NZ 3.72Å; D253-K360 PolarHBondContact OD1-NZ 3.23Å; D256-K360 IonicContact OD2-NZ 3.75Å; D256-K360 PolarHBondContact OD2-NZ 3.27Å; D356-K360 PolarHBondContact O-N 3.3Å; D356-K360 WeakPolarHBondContact OD2-CE 3.19Å; F357-K360 PolarHBondContact O-N 2.78Å; K360-E363 WeakPolarHBondContact O-CB 3.33Å; K360-E363 PolarHBondContact O-N 3.29Å; K360-E363 VanDerWaalsContact O-N 3.14Å; K360-S364 PolarHBondContact O-N 3.05Å; K360-S364 PolarHBondContact O-OG 3.47Å
361	L	95.2	Very high	91.7	Very high	14 Å²	14	67.8 Å²	67.8	7%	0.073	37%	0.371	C	S	.	.	H	α-helix	trans	-59	-54.2	176.5	-178.3	63.1	0	0	0	111.2	P249 L250 V310 F357 Y358 V359 E363 S364 M365 L645	P249-L361 HydrophobicContact CB-CD1 4Å; L250-L361 HydrophobicContact CD1-CB 4.01Å; L250-L361 HydrophobicContact CD1-CD1 3.84Å; L250-L361 HydrophobicContact CD1-CG 4.42Å; L250-L361 HydrophobicContact CD2-CB 4.25Å; L250-L361 HydrophobicContact CG-CB 4.16Å; L250-L361 HydrophobicContact CG-CD1 3.95Å; V310-L361 HydrophobicContact CB-CD1 4.48Å; V310-L361 HydrophobicContact CB-CD2 3.82Å; V310-L361 HydrophobicContact CG1-CD1 4.14Å; V310-L361 HydrophobicContact CG1-CD2 4.1Å; F357-L361 PolarHBondContact O-N 2.94Å; Y358-L361 HydrophobicContact CD1-CD2 4Å; Y358-L361 HydrophobicContact CE1-CD2 4.42Å; V359-L361 VanDerWaalsContact C-N 3.27Å; V359-L361 PolarHBondContact O-N 3.24Å; L361-E363 PolarHBondContact O-N 3Å; L361-S364 PolarHBondContact O-N 3.39Å; L361-S364 PolarHBondContact O-OG 3.35Å; L361-M365 HydrophobicContact CD1-CG 4.19Å; L361-M365 HydrophobicContact CG-CG 4.49Å; L361-M365 WeakPolarHBondContact O-CB 3.38Å; L361-M365 WeakPolarHBondContact O-CG 3.06Å; L361-M365 PolarHBondContact O-N 2.87Å; L361-L645 HydrophobicContact CD1-CD1 4.25Å; L361-L645 HydrophobicContact CD1-CD2 4.3Å; L361-L645 HydrophobicContact CD2-CD1 4.42Å
362	A	94	Very high	91.5	Very high	62 Å²	62	66.6 Å²	66.6	51%	0.512	37%	0.373	S	S	.	.	H	α-helix	trans	-66.2	-15.3	177.7	0	0	0	0	0	113.7	Y358 V359 K366	Y358-A362 WeakPolarHBondContact O-CB 3.27Å; Y358-A362 PolarHBondContact O-N 3.39Å; Y358-A362 VanDerWaalsContact O-N 3.15Å; V359-A362 CarbonylContact O-C 3.57Å; V359-A362 PolarHBondContact O-N 3.34Å; V359-A362 VanDerWaalsContact O-N 3.14Å; A362-K366 WeakPolarHBondContact O-CG 3.29Å
363	E	92.4	Very high	91.2	Very high	114 Å²	114	65.1 Å²	65.1	53%	0.533	37%	0.366	S	S	.	.	H	α-helix	trans	-81.6	-46.4	170	-58.7	-107.6	120.5	0	0	111.5	V359 K360 L361 M365 K366	V359-E363 HydrophobicContact CG1-CG 4.19Å; V359-E363 WeakPolarHBondContact O-CG 3.26Å; V359-E363 PolarHBondContact O-N 3.1Å; K360-E363 WeakPolarHBondContact O-CB 3.33Å; K360-E363 PolarHBondContact O-N 3.29Å; K360-E363 VanDerWaalsContact O-N 3.14Å; L361-E363 PolarHBondContact O-N 3Å; E363-M365 PolarHBondContact O-N 3.15Å; E363-K366 WeakPolarHBondContact O-CB 3.46Å; E363-K366 WeakPolarHBondContact O-CD 3.49Å; E363-K366 WeakPolarHBondContact O-CG 3.41Å; E363-K366 PolarHBondContact O-N 2.89Å; E363-K366 IonicContact OE1-NZ 3.59Å; E363-K366 PolarHBondContact OE1-NZ 3.44Å; E363-K366 IonicContact OE2-NZ 2.66Å; E363-K366 PolarHBondContact OE2-NZ 2.96Å
364	S	91.3	Very high	91.1	Very high	57 Å²	57	68.4 Å²	68.4	40%	0.399	38%	0.378	S	S	.	.	H	α-helix	trans	-67.3	-31.5	178	66.4	0	0	0	0	113.6	L250 K360 L361 K366	L250-S364 PolarHBondContact N-OG 3Å; K360-S364 PolarHBondContact O-N 3.05Å; K360-S364 PolarHBondContact O-OG 3.47Å; L361-S364 PolarHBondContact O-N 3.39Å; L361-S364 PolarHBondContact O-OG 3.35Å; S364-K366 PolarHBondContact O-N 3.31Å
365	M	89.8	Confident	91.1	Very high	71 Å²	71	67.1 Å²	67.1	35%	0.35	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	7.6	178.3	-71.9	-75.7	-80	0	0	114.5	P249 L361 E363 L645 V646	P249-M365 HydrophobicContact CB-CG 4.31Å; P249-M365 HydrophobicContact CB-SD 4.13Å; P249-M365 HydrophobicContact CG-CG 4.24Å; P249-M365 HydrophobicContact CG-SD 3.48Å; P249-M365 WeakPolarHBondContact CG-SD 3.4Å; L361-M365 HydrophobicContact CD1-CG 4.19Å; L361-M365 HydrophobicContact CG-CG 4.49Å; L361-M365 WeakPolarHBondContact O-CB 3.38Å; L361-M365 WeakPolarHBondContact O-CG 3.06Å; L361-M365 PolarHBondContact O-N 2.87Å; E363-M365 PolarHBondContact O-N 3.15Å; M365-L645 HydrophobicContact CE-CD1 4.07Å; M365-L645 HydrophobicContact CE-CG 4.09Å; M365-L645 HydrophobicContact SD-CD2 4.4Å; M365-L645 HydrophobicContact SD-CG 4.38Å; M365-V646 HydrophobicContact CE-CG1 4.12Å; M365-V646 HydrophobicContact SD-CG1 4.38Å
366	K	86.3	Confident	91.2	Very high	113 Å²	113	61.2 Å²	61.2	49%	0.491	33%	0.333	S	S	.	.			trans	-76	124.1	-179.3	-70.8	170.7	-174.2	155	0	111.1	A362 E363 S364 S368	A362-K366 WeakPolarHBondContact O-CG 3.29Å; E363-K366 WeakPolarHBondContact O-CB 3.46Å; E363-K366 WeakPolarHBondContact O-CD 3.49Å; E363-K366 WeakPolarHBondContact O-CG 3.41Å; E363-K366 PolarHBondContact O-N 2.89Å; E363-K366 IonicContact OE1-NZ 3.59Å; E363-K366 PolarHBondContact OE1-NZ 3.44Å; E363-K366 IonicContact OE2-NZ 2.66Å; E363-K366 PolarHBondContact OE2-NZ 2.96Å; S364-K366 PolarHBondContact O-N 3.31Å; K366-S368 PolarHBondContact O-N 3.09Å
367	P	74.8	Confident	91.3	Very high	97 Å²	97	57.8 Å²	57.8	63%	0.63	32%	0.315	S	S	*	.			trans	-67.4	123.9	-179.3	26.8	-34.2	0	0	0	111.7
368	S	81.9	Confident	91.2	Very high	47 Å²	47	58.8 Å²	58.8	33%	0.329	32%	0.321	S	S	.	.	S	Bend	trans	-82	-52.3	175.4	54.9	0	0	0	0	111.3	K366 M421 L463	K366-S368 PolarHBondContact O-N 3.09Å; S368-M421 WeakPolarHBondContact OG-CE 3.41Å; S368-M421 PolarHBondContact OG-SD 2.93Å; S368-L463 WeakPolarHBondContact O-CD1 3.21Å
369	F	88.1	Confident	91.1	Very high	3 Å²	3	55.9 Å²	55.9	1%	0.013	31%	0.31	C	S	.	.	S	Bend	trans	-73.5	162.4	170.5	-81.2	-101.7	0	0	0	111.7	V375 V391 L399 M421 F460 L463 F464	F369-V375 HydrophobicContact CE1-CG1 4.37Å; F369-V391 HydrophobicContact CD1-CG2 4.48Å; F369-L399 HydrophobicContact CB-CD2 3.79Å; F369-L399 HydrophobicContact CD1-CD1 4.06Å; F369-L399 HydrophobicContact CD1-CD2 4.5Å; F369-L399 HydrophobicContact CE1-CD1 4.31Å; F369-L399 HydrophobicContact CG-CD1 4.29Å; F369-L399 HydrophobicContact CG-CD2 4.11Å; F369-M421 HydrophobicContact CB-CE 4.46Å; F369-M421 HydrophobicContact CD2-CB 3.72Å; F369-M421 HydrophobicContact CD2-CE 4.14Å; F369-M421 HydrophobicContact CD2-SD 4.35Å; F369-M421 HydrophobicContact CE2-CB 3.86Å; F369-F460 AromaticContact CD1-CE2 3.98Å; F369-F460 HydrophobicContact CD1-CE2 3.98Å; F369-F460 HydrophobicContact CD1-CZ 4.24Å; F369-F460 AromaticContact CE1-CE2 3.92Å; F369-F460 HydrophobicContact CE1-CE2 3.92Å; F369-F460 AromaticContact CE1-CZ 3.88Å; F369-F460 HydrophobicContact CE1-CZ 3.88Å; F369-L463 HydrophobicContact CD2-CB 4.27Å; F369-L463 HydrophobicContact CD2-CD1 4.45Å; F369-L463 HydrophobicContact CE2-CB 3.69Å; F369-L463 HydrophobicContact CZ-CB 4.02Å; F369-F464 HydrophobicContact CE1-CE1 4.14Å; F369-F464 HydrophobicContact CE1-CE2 4.26Å; F369-F464 AromaticContact CE1-CZ 3.86Å; F369-F464 HydrophobicContact CE1-CZ 3.86Å; F369-F464 HydrophobicContact CZ-CD1 4.14Å; F369-F464 HydrophobicContact CZ-CD2 4.29Å; F369-F464 AromaticContact CZ-CE1 3.93Å; F369-F464 HydrophobicContact CZ-CE1 3.93Å; F369-F464 HydrophobicContact CZ-CE2 4.08Å; F369-F464 HydrophobicContact CZ-CG 4.32Å; F369-F464 AromaticContact CZ-CZ 3.9Å; F369-F464 HydrophobicContact CZ-CZ 3.9Å
370	R	87.9	Confident	90.7	Very high	187 Å²	187	54.5 Å²	54.5	71%	0.706	30%	0.303	S	S	*	.			trans	-136.7	144.1	-176.9	-61.1	-175	-179.2	-155.5	-2.1	111	A373 V391	R370-A373 WeakPolarHBondContact O-CB 3.5Å; R370-A373 PolarHBondContact O-N 2.8Å; R370-A373 VanDerWaalsContact O-N 3.13Å; R370-V391 WeakPolarHBondContact O-CB 3.39Å
371	V	92.6	Very high	90.1	Very high	99 Å²	99	57.5 Å²	57.5	60%	0.6	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	139.2	167.4	177.5	0	0	0	0	110	A373 V391 D392	V371-A373 VanDerWaalsContact C-N 3.31Å; V371-V391 CarbonylContact C-O 3.6Å; V371-V391 WeakPolarHBondContact CA-O 3.29Å; V371-D392 VanDerWaalsContact CG1-O 3.25Å; V371-D392 WeakPolarHBondContact CG1-O 3.36Å; V371-D392 VanDerWaalsContact CG2-O 3.3Å; V371-D392 WeakPolarHBondContact CG2-O 3.24Å
372	G	91.4	Very high	89.8	Confident	51 Å²	51	60.5 Å²	60.5	53%	0.526	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	-1.3	-173.5	0	0	0	0	0	115.1	V391	G372-V391 PolarHBondContact N-O 3.37Å
373	A	91.2	Very high	89.7	Confident	17 Å²	17	58.7 Å²	58.7	14%	0.14	31%	0.311	C	S	.	.			trans	-68.8	143	170.6	0	0	0	0	0	110.9	R370 V371 V390 V391 F460	R370-A373 WeakPolarHBondContact O-CB 3.5Å; R370-A373 PolarHBondContact O-N 2.8Å; R370-A373 VanDerWaalsContact O-N 3.13Å; V371-A373 VanDerWaalsContact C-N 3.31Å; A373-V390 CarbonylContact O-C 3.58Å; A373-V390 WeakPolarHBondContact O-CA 3.49Å; A373-V391 HydrophobicContact CB-CB 4.4Å; A373-V391 HydrophobicContact CB-CG2 4.05Å; A373-V391 PolarHBondContact O-N 3.29Å; A373-F460 HydrophobicContact CB-CE2 3.76Å; A373-F460 HydrophobicContact CB-CZ 3.84Å
374	R	92.7	Very high	89.7	Confident	73 Å²	73	54.2 Å²	54.2	28%	0.275	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	135.3	179.2	-65.7	-167	-67.4	-164.6	0.4	110.3	L388 A389 V390 L429 S449 F460	R374-L388 HydrophobicContact CB-CD1 4.2Å; R374-A389 WeakPolarHBondContact CA-O 3.48Å; R374-V390 HydrophobicContact CG-CG2 4.48Å; R374-L429 HydrophobicContact CB-CD1 4.02Å; R374-L429 HydrophobicContact CB-CD2 4.18Å; R374-L429 HydrophobicContact CB-CG 4.5Å; R374-S449 PolarHBondContact NH1-OG 2.94Å; R374-S449 PolarHBondContact NH2-O 2.89Å; R374-F460 WeakPolarHBondContact O-CE1 3.4Å
375	V	95.1	Very high	89.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	154.5	-177.6	-59.9	0	0	0	0	111.3	F369 A389 L401 V426 F460 F464	F369-V375 HydrophobicContact CE1-CG1 4.37Å; V375-A389 HydrophobicContact CG2-CB 4.16Å; V375-A389 PolarHBondContact N-O 3.49Å; V375-A389 PolarHBondContact O-N 3.45Å; V375-L401 HydrophobicContact CG2-CD1 3.97Å; V375-L401 HydrophobicContact CG2-CD2 3.91Å; V375-V426 HydrophobicContact CB-CG2 3.85Å; V375-V426 HydrophobicContact CG1-CG2 4.22Å; V375-V426 HydrophobicContact CG2-CG2 3.75Å; V375-F460 HydrophobicContact CG1-CE1 4.45Å; V375-F460 HydrophobicContact CG1-CZ 4.03Å; V375-F464 HydrophobicContact CG1-CE1 4.41Å; V375-F464 HydrophobicContact CG1-CZ 4.04Å
376	E	96.4	Very high	90.1	Very high	12 Å²	12	50.5 Å²	50.5	6%	0.056	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	136.9	161.5	-71.3	174.6	-161.3	0	0	107.9	H427 L429 G430 W431 S432 I439	E376-H427 HydrophobicContact CB-CB 4.21Å; E376-H427 PolarHBondContact N-O 3.29Å; E376-H427 PolarHBondContact O-N 3.37Å; E376-L429 HydrophobicContact CG-CD2 4.32Å; E376-G430 WeakPolarHBondContact OE1-CA 3.39Å; E376-G430 PolarHBondContact OE1-N 2.78Å; E376-W431 PolarHBondContact OE2-N 3.41Å; E376-S432 VanDerWaalsContact OE2-CB 3.26Å; E376-S432 WeakPolarHBondContact OE2-CB 3.36Å; E376-S432 PolarHBondContact OE2-N 3.18Å; E376-S432 PolarHBondContact OE2-OG 3.22Å; E376-I439 HydrophobicContact CG-CD1 3.83Å
377	V	96.1	Very high	90.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	154.7	177.7	57.4	0	0	0	0	108.8	T386 R387 A389 L401 Y403 F417 L425 V426	V377-T386 CarbonylContact O-C 3.49Å; V377-T386 WeakPolarHBondContact O-CA 3.25Å; V377-T386 WeakPolarHBondContact O-CB 3.23Å; V377-R387 PolarHBondContact N-O 3.49Å; V377-R387 VanDerWaalsContact N-O 3.08Å; V377-R387 PolarHBondContact O-N 3.29Å; V377-A389 HydrophobicContact CG1-CB 3.61Å; V377-L401 HydrophobicContact CB-CD1 4.09Å; V377-L401 HydrophobicContact CG1-CD1 4.14Å; V377-L401 HydrophobicContact CG2-CD1 3.98Å; V377-Y403 HydrophobicContact CG1-CD1 4.47Å; V377-Y403 HydrophobicContact CG1-CE1 3.7Å; V377-F417 HydrophobicContact CG2-CD1 3.86Å; V377-F417 HydrophobicContact CG2-CE1 3.89Å; V377-L425 WeakPolarHBondContact CA-O 3.4Å; V377-L425 WeakPolarHBondContact CG2-O 3.4Å; V377-V426 HydrophobicContact CB-CG2 4.37Å
378	V	94.4	Very high	91.4	Very high	25 Å²	25	41.5 Å²	41.5	15%	0.152	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.6	147	175	68.5	0	0	0	0	112.2	P380 Y403 L425	V378-P380 WeakPolarHBondContact O-CD 3.39Å; V378-Y403 PolarHBondContact O-OH 2.9Å; V378-L425 HydrophobicContact CG1-CB 4.11Å; V378-L425 HydrophobicContact CG1-CD1 4.25Å; V378-L425 HydrophobicContact CG1-CD2 4.36Å; V378-L425 HydrophobicContact CG1-CG 4.47Å; V378-L425 PolarHBondContact N-O 2.89Å
379	D	90.9	Very high	92	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	109.8	172.7	-173.7	8.2	0	0	0	109.7	K381 H382 V383 R385 R387	D379-K381 PolarHBondContact O-N 3.49Å; D379-H382 HydrophobicContact CB-CB 4.38Å; D379-H382 CarbonylContact O-C 3.05Å; D379-H382 PolarHBondContact O-N 3.15Å; D379-H382 IonicContact OD2-ND1 2.88Å; D379-V383 PolarHBondContact O-N 2.65Å; D379-R385 HydrophobicContact CB-CG 4Å; D379-R385 PolarHBondContact N-O 3.16Å; D379-R385 IonicContact OD2-CZ 3.78Å; D379-R385 IonicContact OD2-NE 3.75Å; D379-R385 PolarHBondContact OD2-NE 3.03Å; D379-R385 IonicContact OD2-NH2 3.29Å; D379-R385 PolarHBondContact OD2-NH2 3.36Å; D379-R387 HydrophobicContact CB-CG 4.04Å; D379-R387 WeakPolarHBondContact OD1-CD 3.32Å; D379-R387 IonicContact OD1-CZ 2.77Å; D379-R387 IonicContact OD1-NE 2.7Å; D379-R387 IonicContact OD1-NH1 2.68Å; D379-R387 PolarHBondContact OD1-NH1 3.38Å; D379-R387 IonicContact OD2-NH1 3.89Å; D379-R387 PolarHBondContact OD2-NH1 3Å
380	P	86.3	Confident	92.3	Very high	58 Å²	58	41.4 Å²	41.4	38%	0.377	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-19.3	-174.4	-24	34.4	0	0	0	113.9	V378 Y403 F415 F417	V378-P380 WeakPolarHBondContact O-CD 3.39Å; P380-Y403 WeakPolarHBondContact CD-OH 3.41Å; P380-Y403 WeakPolarHBondContact CG-OH 3.23Å; P380-F415 HydrophobicContact CB-CZ 4.26Å; P380-F415 HydrophobicContact CG-CZ 4.21Å; P380-F417 HydrophobicContact CG-CD2 4.31Å
381	K	84.5	Confident	92.7	Very high	107 Å²	107	32.5 Å²	32.5	47%	0.465	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-16.9	173.6	-60.3	-171.2	-178.6	-168.2	0	113.3	D379 D408 F415	D379-K381 PolarHBondContact O-N 3.49Å; K381-D408 PolarHBondContact NZ-O 3.41Å; K381-F415 HydrophobicContact CD-CE1 4.45Å; K381-F415 HydrophobicContact CD-CZ 4.34Å; K381-F415 HydrophobicContact CG-CE1 4.31Å; K381-F415 HydrophobicContact CG-CZ 3.91Å
382	H	88.5	Confident	92.8	Very high	78 Å²	78	31.3 Å²	31.3	36%	0.361	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	75.8	-170.9	-64.3	79.8	0	0	0	109.5	D379 S384 R385	D379-H382 HydrophobicContact CB-CB 4.38Å; D379-H382 CarbonylContact O-C 3.05Å; D379-H382 PolarHBondContact O-N 3.15Å; D379-H382 IonicContact OD2-ND1 2.88Å; H382-S384 PolarHBondContact O-N 3.37Å; H382-R385 HydrophobicContact CB-CG 3.91Å; H382-R385 PolarHBondContact CE1-NH2 3.44Å; H382-R385 VanDerWaalsContact CG-CZ 3.46Å; H382-R385 PolarHBondContact ND1-NH2 3.32Å; H382-R385 WeakPolarHBondContact O-CG 3.43Å; H382-R385 PolarHBondContact O-N 3.33Å
383	V	91.1	Very high	93	Very high	23 Å²	23	30 Å²	30	14%	0.139	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	-24.1	-168.5	-65.7	0	0	0	0	114.8	D379 R385 F524	D379-V383 PolarHBondContact O-N 2.65Å; V383-R385 PolarHBondContact O-N 3.16Å; V383-F524 HydrophobicContact CB-CD1 3.8Å; V383-F524 HydrophobicContact CB-CE1 3.88Å; V383-F524 HydrophobicContact CG1-CD1 4.23Å; V383-F524 HydrophobicContact CG1-CE1 3.92Å; V383-F524 HydrophobicContact CG2-CD1 3.69Å; V383-F524 HydrophobicContact CG2-CE1 3.56Å; V383-F524 HydrophobicContact CG2-CG 4.44Å; V383-F524 HydrophobicContact CG2-CZ 4.17Å
384	S	93.1	Very high	93.2	Very high	20 Å²	20	31.3 Å²	31.3	14%	0.14	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	5.5	176.4	72.2	0	0	0	0	115.5	H382 T438 G520 A521 W523	H382-S384 PolarHBondContact O-N 3.37Å; S384-T438 WeakPolarHBondContact O-CB 3.35Å; S384-G520 WeakPolarHBondContact CB-O 3.3Å; S384-G520 PolarHBondContact OG-O 2.99Å; S384-A521 PolarHBondContact OG-O 3.16Å; S384-W523 WeakPolarHBondContact CA-O 3.44Å; S384-W523 WeakPolarHBondContact CB-O 3.22Å; S384-W523 PolarHBondContact N-O 3.03Å
385	R	93.7	Very high	93.2	Very high	48 Å²	48	29.8 Å²	29.8	18%	0.181	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	156.6	172.9	71	176.6	-173.2	-139.7	-0.1	113.6	D379 H382 V383 T438	D379-R385 HydrophobicContact CB-CG 4Å; D379-R385 PolarHBondContact N-O 3.16Å; D379-R385 IonicContact OD2-CZ 3.78Å; D379-R385 IonicContact OD2-NE 3.75Å; D379-R385 PolarHBondContact OD2-NE 3.03Å; D379-R385 IonicContact OD2-NH2 3.29Å; D379-R385 PolarHBondContact OD2-NH2 3.36Å; H382-R385 HydrophobicContact CB-CG 3.91Å; H382-R385 PolarHBondContact CE1-NH2 3.44Å; H382-R385 VanDerWaalsContact CG-CZ 3.46Å; H382-R385 PolarHBondContact ND1-NH2 3.32Å; H382-R385 WeakPolarHBondContact O-CG 3.43Å; H382-R385 PolarHBondContact O-N 3.33Å; V383-R385 PolarHBondContact O-N 3.16Å; R385-T438 WeakPolarHBondContact CA-O 3.05Å; R385-T438 HydrophobicContact CB-CG2 3.75Å
386	T	95.6	Very high	93.1	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.012	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	167.1	164.6	57.3	0	0	0	0	111.6	V377 W431 S432 T438 I439 K440	V377-T386 CarbonylContact O-C 3.49Å; V377-T386 WeakPolarHBondContact O-CA 3.25Å; V377-T386 WeakPolarHBondContact O-CB 3.23Å; T386-W431 HydrophobicContact CG2-CE3 4.35Å; T386-W431 HydrophobicContact CG2-CZ3 3.86Å; T386-S432 PolarHBondContact OG1-OG 3.1Å; T386-T438 PolarHBondContact N-O 2.76Å; T386-T438 PolarHBondContact OG1-O 2.78Å; T386-I439 CarbonylContact O-C 3.57Å; T386-I439 WeakPolarHBondContact O-CA 3.38Å; T386-I439 WeakPolarHBondContact OG1-CB 3.36Å; T386-I439 WeakPolarHBondContact OG1-CG1 3.37Å; T386-K440 PolarHBondContact O-N 3.34Å
387	R	93.6	Very high	93	Very high	3 Å²	3	31.1 Å²	31.1	1%	0.011	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	166.2	167.8	61.6	-168.8	-71.7	151.3	2.4	110.1	V377 D379 Y403 D405 D408 K440	V377-R387 PolarHBondContact N-O 3.49Å; V377-R387 VanDerWaalsContact N-O 3.08Å; V377-R387 PolarHBondContact O-N 3.29Å; D379-R387 HydrophobicContact CB-CG 4.04Å; D379-R387 WeakPolarHBondContact OD1-CD 3.32Å; D379-R387 IonicContact OD1-CZ 2.77Å; D379-R387 IonicContact OD1-NE 2.7Å; D379-R387 IonicContact OD1-NH1 2.68Å; D379-R387 PolarHBondContact OD1-NH1 3.38Å; D379-R387 IonicContact OD2-NH1 3.89Å; D379-R387 PolarHBondContact OD2-NH1 3Å; R387-Y403 VanDerWaalsContact CD-CD1 3.4Å; R387-Y403 HydrophobicContact CG-CD1 3.42Å; R387-Y403 VanDerWaalsContact CG-CD1 3.42Å; R387-Y403 HydrophobicContact CG-CE1 3.45Å; R387-Y403 VanDerWaalsContact CG-CE1 3.45Å; R387-Y403 HydrophobicContact CG-CG 4.47Å; R387-Y403 VanDerWaalsContact NE-CD1 3.34Å; R387-D405 PolarHBondContact NH2-O 3.41Å; R387-D408 IonicContact CZ-OD2 3.29Å; R387-D408 VanDerWaalsContact CZ-OD2 3.29Å; R387-D408 IonicContact NH1-OD2 2.88Å; R387-D408 PolarHBondContact NH1-OD2 3.28Å; R387-D408 IonicContact NH2-OD2 2.77Å; R387-D408 PolarHBondContact NH2-OD2 3.33Å; R387-K440 HydrophobicContact CB-CB 4.04Å
388	L	94.5	Very high	93	Very high	19 Å²	19	31.1 Å²	31.1	10%	0.099	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	132.2	178.8	-174	70.1	0	0	0	110	R374 A404 L429 Y442	R374-L388 HydrophobicContact CB-CD1 4.2Å; L388-A404 HydrophobicContact CB-CB 4.03Å; L388-A404 HydrophobicContact CD2-CB 3.69Å; L388-A404 HydrophobicContact CG-CB 3.77Å; L388-A404 PolarHBondContact O-N 3.3Å; L388-L429 HydrophobicContact CD1-CD2 3.53Å; L388-Y442 HydrophobicContact CB-CD1 4.4Å; L388-Y442 HydrophobicContact CB-CE1 3.42Å; L388-Y442 VanDerWaalsContact CB-CE1 3.42Å; L388-Y442 WeakPolarHBondContact CB-OH 3.34Å; L388-Y442 HydrophobicContact CD2-CE1 4.45Å; L388-Y442 PolarHBondContact N-OH 3.38Å
389	A	95	Very high	93.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	161.9	168.4	0	0	0	0	0	111.7	R374 V375 V377 L401 V402 Y403	R374-A389 WeakPolarHBondContact CA-O 3.48Å; V375-A389 HydrophobicContact CG2-CB 4.16Å; V375-A389 PolarHBondContact N-O 3.49Å; V375-A389 PolarHBondContact O-N 3.45Å; V377-A389 HydrophobicContact CG1-CB 3.61Å; A389-L401 HydrophobicContact CB-CB 3.98Å; A389-V402 CarbonylContact C-O 3.44Å; A389-V402 WeakPolarHBondContact CA-O 3.47Å; A389-Y403 HydrophobicContact CB-CD1 4.03Å; A389-Y403 HydrophobicContact CB-CE1 4.34Å
390	V	94.3	Very high	93.4	Very high	47 Å²	47	32.6 Å²	32.6	29%	0.285	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	135.2	175.4	-173	0	0	0	0	108.6	A373 R374 D392 L401 V402 A404	A373-V390 CarbonylContact O-C 3.58Å; A373-V390 WeakPolarHBondContact O-CA 3.49Å; R374-V390 HydrophobicContact CG-CG2 4.48Å; V390-D392 PolarHBondContact O-N 3.31Å; V390-L401 WeakPolarHBondContact O-CA 3.42Å; V390-V402 PolarHBondContact N-O 3.44Å; V390-V402 PolarHBondContact O-N 3.02Å; V390-A404 HydrophobicContact CG2-CB 4.32Å
391	V	95.6	Very high	93.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	110.4	170.8	-179	0	0	0	0	108.6	F369 R370 V371 G372 A373 V394 L399 L401	F369-V391 HydrophobicContact CD1-CG2 4.48Å; R370-V391 WeakPolarHBondContact O-CB 3.39Å; V371-V391 CarbonylContact C-O 3.6Å; V371-V391 WeakPolarHBondContact CA-O 3.29Å; G372-V391 PolarHBondContact N-O 3.37Å; A373-V391 HydrophobicContact CB-CB 4.4Å; A373-V391 HydrophobicContact CB-CG2 4.05Å; A373-V391 PolarHBondContact O-N 3.29Å; V391-V394 HydrophobicContact CG1-CG2 3.58Å; V391-L399 HydrophobicContact CG1-CD2 4.3Å; V391-L401 HydrophobicContact CB-CD2 4.37Å; V391-L401 HydrophobicContact CG2-CD2 3.7Å
392	D	95.4	Very high	94.3	Very high	74 Å²	74	26 Å²	26	40%	0.396	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-43.7	178.2	176.2	75.8	0	0	0	111.4	V371 V390 R400 V402	V371-D392 VanDerWaalsContact CG1-O 3.25Å; V371-D392 WeakPolarHBondContact CG1-O 3.36Å; V371-D392 VanDerWaalsContact CG2-O 3.3Å; V371-D392 WeakPolarHBondContact CG2-O 3.24Å; V390-D392 PolarHBondContact O-N 3.31Å; D392-R400 HydrophobicContact CB-CG 4.48Å; D392-R400 PolarHBondContact N-O 2.9Å; D392-R400 IonicContact OD1-NH1 2.71Å; D392-R400 WeakPolarHBondContact OD2-CD 3.4Å; D392-R400 IonicContact OD2-CZ 3.14Å; D392-R400 IonicContact OD2-NE 2.72Å; D392-R400 IonicContact OD2-NH1 4Å; D392-R400 PolarHBondContact OD2-NH1 2.76Å; D392-V402 HydrophobicContact CB-CB 4.44Å; D392-V402 HydrophobicContact CB-CG2 3.69Å
393	A	95.2	Very high	94.5	Very high	25 Å²	25	22.5 Å²	22.5	21%	0.207	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	157.3	177.4	0	0	0	0	0	112.1	R400	A393-R400 HydrophobicContact CB-CB 3.87Å; A393-R400 PolarHBondContact N-O 3.47Å; A393-R400 PolarHBondContact O-N 3.09Å
394	V	94.7	Very high	94.4	Very high	43 Å²	43	24 Å²	24	26%	0.261	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	118.3	173	-175.5	0	0	0	0	108.1	V391 R398 L399	V391-V394 HydrophobicContact CG1-CG2 3.58Å; V394-R398 CarbonylContact C-O 3.58Å; V394-R398 WeakPolarHBondContact CA-O 3.33Å; V394-L399 HydrophobicContact CB-CD2 4.47Å; V394-L399 HydrophobicContact CG1-CD2 4.12Å; V394-L399 HydrophobicContact CG2-CD2 3.82Å
395	V	94.3	Very high	94	Very high	42 Å²	42	25.1 Å²	25.1	26%	0.255	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	119.8	-178.4	-169.8	0	0	0	0	109.2	G397 R398 Y648	V395-G397 PolarHBondContact O-N 2.96Å; V395-R398 PolarHBondContact N-O 2.83Å; V395-R398 WeakPolarHBondContact O-CA 3.27Å; V395-R398 WeakPolarHBondContact O-CB 3.4Å; V395-R398 PolarHBondContact O-N 2.93Å; V395-Y648 HydrophobicContact CB-CD2 4.14Å; V395-Y648 HydrophobicContact CB-CE2 4.44Å; V395-Y648 HydrophobicContact CG1-CD2 3.82Å
396	G	92.1	Very high	93.4	Very high	28 Å²	28	25.5 Å²	25.5	29%	0.289	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	1.2	178.2	0	0	0	0	0	117.3
397	G	93.2	Very high	92.6	Very high	11 Å²	11	30 Å²	30	11%	0.113	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	114.1	-21	-169	0	0	0	0	0	113.4	V395 H420 M421	V395-G397 PolarHBondContact O-N 2.96Å; G397-H420 PolarHBondContact O-CD2 3.33Å; G397-M421 WeakPolarHBondContact O-CB 3.43Å; G397-M421 WeakPolarHBondContact O-CG 3.46Å; G397-M421 PolarHBondContact O-N 2.88Å
398	R	96.3	Very high	91.7	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	136.4	171	-53.4	-168.2	65.6	61.5	-2.6	110.5	V394 V395 W418 V594 P599 D636 Y638 W642	V394-R398 CarbonylContact C-O 3.58Å; V394-R398 WeakPolarHBondContact CA-O 3.33Å; V395-R398 PolarHBondContact N-O 2.83Å; V395-R398 WeakPolarHBondContact O-CA 3.27Å; V395-R398 WeakPolarHBondContact O-CB 3.4Å; V395-R398 PolarHBondContact O-N 2.93Å; R398-W418 HydrophobicContact CB-CE3 4.17Å; R398-W418 HydrophobicContact CB-CZ3 4.29Å; R398-V594 VanDerWaalsContact CZ-CG2 3.45Å; R398-P599 PolarHBondContact NH2-O 3.18Å; R398-D636 IonicContact CZ-OD1 3.68Å; R398-D636 IonicContact NH1-OD1 3.91Å; R398-D636 PolarHBondContact NH1-OD1 3.29Å; R398-D636 IonicContact NH2-OD1 2.72Å; R398-Y638 PolarHBondContact NH1-OH 3.04Å; R398-W642 HydrophobicContact CG-CH2 3.88Å; R398-W642 HydrophobicContact CG-CZ2 4.28Å
399	L	96.5	Very high	90.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	132.5	175.4	-53	-178.9	0	0	0	108.5	F369 V391 V394 L401 W418 C419 M421	F369-L399 HydrophobicContact CB-CD2 3.79Å; F369-L399 HydrophobicContact CD1-CD1 4.06Å; F369-L399 HydrophobicContact CD1-CD2 4.5Å; F369-L399 HydrophobicContact CE1-CD1 4.31Å; F369-L399 HydrophobicContact CG-CD1 4.29Å; F369-L399 HydrophobicContact CG-CD2 4.11Å; V391-L399 HydrophobicContact CG1-CD2 4.3Å; V394-L399 HydrophobicContact CB-CD2 4.47Å; V394-L399 HydrophobicContact CG1-CD2 4.12Å; V394-L399 HydrophobicContact CG2-CD2 3.82Å; L399-L401 HydrophobicContact CB-CD2 3.96Å; L399-L401 HydrophobicContact CB-CG 4.27Å; L399-L401 HydrophobicContact CD1-CD2 4.28Å; L399-W418 WeakPolarHBondContact O-CA 3.36Å; L399-C419 PolarHBondContact N-O 2.79Å; L399-C419 PolarHBondContact O-N 2.87Å; L399-M421 HydrophobicContact CD1-CB 4.15Å; L399-M421 HydrophobicContact CD2-CB 4.23Å; L399-M421 HydrophobicContact CG-CB 4.12Å
400	R	97	Very high	90.1	Very high	56 Å²	56	37.3 Å²	37.3	21%	0.211	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	115.4	158	-172.3	-178.8	-177.9	-121.2	-4.5	107.5	D392 A393 D416 W418	D392-R400 HydrophobicContact CB-CG 4.48Å; D392-R400 PolarHBondContact N-O 2.9Å; D392-R400 IonicContact OD1-NH1 2.71Å; D392-R400 WeakPolarHBondContact OD2-CD 3.4Å; D392-R400 IonicContact OD2-CZ 3.14Å; D392-R400 IonicContact OD2-NE 2.72Å; D392-R400 IonicContact OD2-NH1 4Å; D392-R400 PolarHBondContact OD2-NH1 2.76Å; A393-R400 HydrophobicContact CB-CB 3.87Å; A393-R400 PolarHBondContact N-O 3.47Å; A393-R400 PolarHBondContact O-N 3.09Å; R400-D416 HydrophobicContact CG-CB 4.45Å; R400-D416 IonicContact CZ-OD2 3.18Å; R400-D416 IonicContact NE-OD2 2.83Å; R400-D416 PolarHBondContact NE-OD2 3.43Å; R400-D416 IonicContact NH2-OD2 2.71Å; R400-D416 PolarHBondContact NH2-OD2 3.47Å; R400-W418 HydrophobicContact CB-CD2 4.09Å; R400-W418 HydrophobicContact CB-CE3 4.17Å; R400-W418 HydrophobicContact CB-CH2 3.86Å; R400-W418 HydrophobicContact CB-CZ2 3.75Å; R400-W418 HydrophobicContact CB-CZ3 4.05Å; R400-W418 HydrophobicContact CG-CD2 4.33Å; R400-W418 HydrophobicContact CG-CH2 4.49Å; R400-W418 HydrophobicContact CG-CZ2 3.87Å
401	L	96.1	Very high	89.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.1	176.8	-58.8	-174.9	0	0	0	108.9	V375 V377 A389 V390 V391 L399 D416 F417 V426	V375-L401 HydrophobicContact CG2-CD1 3.97Å; V375-L401 HydrophobicContact CG2-CD2 3.91Å; V377-L401 HydrophobicContact CB-CD1 4.09Å; V377-L401 HydrophobicContact CG1-CD1 4.14Å; V377-L401 HydrophobicContact CG2-CD1 3.98Å; A389-L401 HydrophobicContact CB-CB 3.98Å; V390-L401 WeakPolarHBondContact O-CA 3.42Å; V391-L401 HydrophobicContact CB-CD2 4.37Å; V391-L401 HydrophobicContact CG2-CD2 3.7Å; L399-L401 HydrophobicContact CB-CD2 3.96Å; L399-L401 HydrophobicContact CB-CG 4.27Å; L399-L401 HydrophobicContact CD1-CD2 4.28Å; L401-D416 CarbonylContact O-C 3.51Å; L401-D416 WeakPolarHBondContact O-CA 3.28Å; L401-D416 WeakPolarHBondContact O-CB 3.46Å; L401-F417 HydrophobicContact CD1-CD1 4.37Å; L401-F417 PolarHBondContact N-O 2.78Å; L401-F417 PolarHBondContact O-N 3.29Å; L401-V426 HydrophobicContact CD1-CG2 3.92Å
402	V	94.8	Very high	88.2	Confident	28 Å²	28	51 Å²	51	17%	0.17	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	129.1	172.5	174	0	0	0	0	108.3	A389 V390 D392 A404 V414 D416	A389-V402 CarbonylContact C-O 3.44Å; A389-V402 WeakPolarHBondContact CA-O 3.47Å; V390-V402 PolarHBondContact N-O 3.44Å; V390-V402 PolarHBondContact O-N 3.02Å; D392-V402 HydrophobicContact CB-CB 4.44Å; D392-V402 HydrophobicContact CB-CG2 3.69Å; V402-A404 PolarHBondContact O-N 3.28Å; V402-V414 HydrophobicContact CG1-CG1 3.8Å; V402-V414 HydrophobicContact CG2-CG1 4.02Å; V402-D416 HydrophobicContact CG2-CB 4.1Å
403	Y	92.6	Very high	87.5	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.016	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	133.4	-178.1	-67	-67.5	0	0	0	111.3	V377 V378 P380 R387 A389 D405 Q406 F415 F417	V377-Y403 HydrophobicContact CG1-CD1 4.47Å; V377-Y403 HydrophobicContact CG1-CE1 3.7Å; V378-Y403 PolarHBondContact O-OH 2.9Å; P380-Y403 WeakPolarHBondContact CD-OH 3.41Å; P380-Y403 WeakPolarHBondContact CG-OH 3.23Å; R387-Y403 VanDerWaalsContact CD-CD1 3.4Å; R387-Y403 HydrophobicContact CG-CD1 3.42Å; R387-Y403 VanDerWaalsContact CG-CD1 3.42Å; R387-Y403 HydrophobicContact CG-CE1 3.45Å; R387-Y403 VanDerWaalsContact CG-CE1 3.45Å; R387-Y403 HydrophobicContact CG-CG 4.47Å; R387-Y403 VanDerWaalsContact NE-CD1 3.34Å; A389-Y403 HydrophobicContact CB-CD1 4.03Å; A389-Y403 HydrophobicContact CB-CE1 4.34Å; Y403-D405 VanDerWaalsContact C-N 3.25Å; Y403-D405 PolarHBondContact O-N 2.79Å; Y403-Q406 PolarHBondContact O-NE2 3.38Å; Y403-F415 HydrophobicContact CD2-CB 4.17Å; Y403-F415 AromaticContact CD2-CD1 3.24Å; Y403-F415 HydrophobicContact CD2-CD1 3.24Å; Y403-F415 AromaticContact CD2-CE1 3.73Å; Y403-F415 HydrophobicContact CD2-CE1 3.73Å; Y403-F415 AromaticContact CD2-CG 3.79Å; Y403-F415 HydrophobicContact CD2-CG 3.79Å; Y403-F415 VanDerWaalsContact CD2-O 3.31Å; Y403-F415 WeakPolarHBondContact CD2-O 3.34Å; Y403-F415 AromaticContact CE2-CD1 3.68Å; Y403-F415 HydrophobicContact CE2-CD1 3.68Å; Y403-F415 AromaticContact CE2-CE1 3.72Å; Y403-F415 HydrophobicContact CE2-CE1 3.72Å; Y403-F415 HydrophobicContact CE2-CG 4.19Å; Y403-F415 HydrophobicContact CE2-CZ 4.27Å; Y403-F415 HydrophobicContact CG-CD1 4.11Å; Y403-F415 PolarHBondContact N-O 3.36Å; Y403-F417 HydrophobicContact CE2-CB 4.08Å; Y403-F417 WeakPolarHBondContact OH-CB 3.46Å
404	A	88.3	Confident	86.8	Confident	55 Å²	55	54.3 Å²	54.3	46%	0.455	32%	0.324	S	S	.	.	S	Bend	trans	-73.6	-21.2	-175.2	0	0	0	0	0	113	L388 V390 V402	L388-A404 HydrophobicContact CB-CB 4.03Å; L388-A404 HydrophobicContact CD2-CB 3.69Å; L388-A404 HydrophobicContact CG-CB 3.77Å; L388-A404 PolarHBondContact O-N 3.3Å; V390-A404 HydrophobicContact CG2-CB 4.32Å; V402-A404 PolarHBondContact O-N 3.28Å
405	D	85.1	Confident	86.4	Confident	42 Å²	42	54.2 Å²	54.2	23%	0.225	32%	0.32	C	S	.	.			trans	-110.7	122.8	166.8	172.5	20.7	0	0	0	108.2	R387 Y403 S407 K440	R387-D405 PolarHBondContact NH2-O 3.41Å; Y403-D405 VanDerWaalsContact C-N 3.25Å; Y403-D405 PolarHBondContact O-N 2.79Å; D405-S407 VanDerWaalsContact OD1-CB 3.31Å; D405-S407 WeakPolarHBondContact OD1-CB 3.39Å; D405-S407 PolarHBondContact OD1-N 2.9Å; D405-S407 PolarHBondContact OD1-OG 3.45Å; D405-S407 PolarHBondContact OD2-OG 2.88Å; D405-K440 IonicContact OD2-NZ 3.84Å; D405-K440 PolarHBondContact OD2-NZ 3.45Å
406	Q	81.2	Confident	86.2	Confident	57 Å²	57	54.6 Å²	54.6	27%	0.266	32%	0.321	S	S	.	.			trans	-114.2	7.8	179.4	-64.4	-74.3	-30.3	0	0	111.9	Y403 D408 V409 F415	Y403-Q406 PolarHBondContact O-NE2 3.38Å; Q406-D408 PolarHBondContact O-N 2.79Å; Q406-D408 VanDerWaalsContact O-N 3.13Å; Q406-V409 VanDerWaalsContact O-CB 3.26Å; Q406-V409 WeakPolarHBondContact O-CB 3.33Å; Q406-V409 WeakPolarHBondContact O-CG2 3.45Å; Q406-V409 PolarHBondContact O-N 3.25Å; Q406-V409 VanDerWaalsContact O-N 3.11Å; Q406-F415 PolarHBondContact NE2-O 3.12Å; Q406-F415 VanDerWaalsContact OE1-CB 3.31Å
407	S	77.9	Confident	86.2	Confident	95 Å²	95	54.8 Å²	54.8	66%	0.664	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.9	-177.1	58.5	0	0	0	0	114.5	D405 V409	D405-S407 VanDerWaalsContact OD1-CB 3.31Å; D405-S407 WeakPolarHBondContact OD1-CB 3.39Å; D405-S407 PolarHBondContact OD1-N 2.9Å; D405-S407 PolarHBondContact OD1-OG 3.45Å; D405-S407 PolarHBondContact OD2-OG 2.88Å; S407-V409 PolarHBondContact O-N 3.34Å
408	D	75.8	Confident	86.4	Confident	60 Å²	60	55.9 Å²	55.9	32%	0.321	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	14.4	174.8	-38.5	-56.6	0	0	0	113.3	K381 R387 Q406 K440	K381-D408 PolarHBondContact NZ-O 3.41Å; R387-D408 IonicContact CZ-OD2 3.29Å; R387-D408 VanDerWaalsContact CZ-OD2 3.29Å; R387-D408 IonicContact NH1-OD2 2.88Å; R387-D408 PolarHBondContact NH1-OD2 3.28Å; R387-D408 IonicContact NH2-OD2 2.77Å; R387-D408 PolarHBondContact NH2-OD2 3.33Å; Q406-D408 PolarHBondContact O-N 2.79Å; Q406-D408 VanDerWaalsContact O-N 3.13Å; D408-K440 IonicContact OD1-NZ 3.43Å; D408-K440 PolarHBondContact OD1-NZ 2.78Å; D408-K440 IonicContact OD2-NZ 2.81Å; D408-K440 PolarHBondContact OD2-NZ 3.32Å
409	V	75.7	Confident	86.5	Confident	22 Å²	22	56 Å²	56	13%	0.133	32%	0.315	C	S	.	.	S	Bend	trans	-142.7	140.2	-161	-163.5	0	0	0	0	110.8	Q406 S407 V413 F415	Q406-V409 VanDerWaalsContact O-CB 3.26Å; Q406-V409 WeakPolarHBondContact O-CB 3.33Å; Q406-V409 WeakPolarHBondContact O-CG2 3.45Å; Q406-V409 PolarHBondContact O-N 3.25Å; Q406-V409 VanDerWaalsContact O-N 3.11Å; S407-V409 PolarHBondContact O-N 3.34Å; V409-V413 HydrophobicContact CG1-CB 4.02Å; V409-V413 HydrophobicContact CG1-CG1 4.2Å; V409-V413 VanDerWaalsContact CG1-O 3.23Å; V409-V413 WeakPolarHBondContact CG1-O 3.44Å; V409-F415 HydrophobicContact CB-CB 4.49Å; V409-F415 HydrophobicContact CG1-CB 4.06Å; V409-F415 HydrophobicContact CG2-CB 3.62Å; V409-F415 HydrophobicContact CG2-CD1 4.22Å; V409-F415 HydrophobicContact CG2-CG 4.1Å
410	P	79.1	Confident	86.5	Confident	94 Å²	94	56.3 Å²	56.3	61%	0.61	32%	0.317	S	S	*	.			trans	-65	141.5	172.9	-20.5	33.1	0	0	0	112.4	N412 V413	P410-N412 PolarHBondContact O-N 2.91Å; P410-V413 PolarHBondContact O-N 2.74Å
411	D	73.8	Confident	86.4	Confident	171 Å²	171	54.4 Å²	54.4	91%	0.914	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-23.1	-173	-63.7	-49	0	0	0	115.9
412	N	77.8	Confident	86.4	Confident	165 Å²	165	58.4 Å²	58.4	88%	0.882	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-3.6	-178.9	-63.5	-51.5	0	0	0	114.2	P410	P410-N412 PolarHBondContact O-N 2.91Å
413	V	79.9	Confident	86.4	Confident	86 Å²	86	57.5 Å²	57.5	52%	0.521	32%	0.321	S	S	.	.			trans	-119.9	120.6	-176.5	-179.3	0	0	0	0	109.6	V409 P410 F415	V409-V413 HydrophobicContact CG1-CB 4.02Å; V409-V413 HydrophobicContact CG1-CG1 4.2Å; V409-V413 VanDerWaalsContact CG1-O 3.23Å; V409-V413 WeakPolarHBondContact CG1-O 3.44Å; P410-V413 PolarHBondContact O-N 2.74Å; V413-F415 PolarHBondContact O-N 2.9Å
414	V	79.9	Confident	86.6	Confident	82 Å²	82	61.7 Å²	61.7	50%	0.497	35%	0.348	S	S	.	.			trans	-81.8	111.7	169.4	180	0	0	0	0	108	V402 D416	V402-V414 HydrophobicContact CG1-CG1 3.8Å; V402-V414 HydrophobicContact CG2-CG1 4.02Å; V414-D416 PolarHBondContact O-N 2.75Å; V414-D416 VanDerWaalsContact O-N 3.17Å
415	F	86	Confident	86.9	Confident	40 Å²	40	62.2 Å²	62.2	18%	0.175	34%	0.343	C	S	.	.			trans	-75.1	107.3	171.6	-164.6	-136.2	0	0	0	108.3	P380 K381 Y403 Q406 V409 V413	P380-F415 HydrophobicContact CB-CZ 4.26Å; P380-F415 HydrophobicContact CG-CZ 4.21Å; K381-F415 HydrophobicContact CD-CE1 4.45Å; K381-F415 HydrophobicContact CD-CZ 4.34Å; K381-F415 HydrophobicContact CG-CE1 4.31Å; K381-F415 HydrophobicContact CG-CZ 3.91Å; Y403-F415 HydrophobicContact CD2-CB 4.17Å; Y403-F415 AromaticContact CD2-CD1 3.24Å; Y403-F415 HydrophobicContact CD2-CD1 3.24Å; Y403-F415 AromaticContact CD2-CE1 3.73Å; Y403-F415 HydrophobicContact CD2-CE1 3.73Å; Y403-F415 AromaticContact CD2-CG 3.79Å; Y403-F415 HydrophobicContact CD2-CG 3.79Å; Y403-F415 VanDerWaalsContact CD2-O 3.31Å; Y403-F415 WeakPolarHBondContact CD2-O 3.34Å; Y403-F415 AromaticContact CE2-CD1 3.68Å; Y403-F415 HydrophobicContact CE2-CD1 3.68Å; Y403-F415 AromaticContact CE2-CE1 3.72Å; Y403-F415 HydrophobicContact CE2-CE1 3.72Å; Y403-F415 HydrophobicContact CE2-CG 4.19Å; Y403-F415 HydrophobicContact CE2-CZ 4.27Å; Y403-F415 HydrophobicContact CG-CD1 4.11Å; Y403-F415 PolarHBondContact N-O 3.36Å; Q406-F415 PolarHBondContact NE2-O 3.12Å; Q406-F415 VanDerWaalsContact OE1-CB 3.31Å; V409-F415 HydrophobicContact CB-CB 4.49Å; V409-F415 HydrophobicContact CG1-CB 4.06Å; V409-F415 HydrophobicContact CG2-CB 3.62Å; V409-F415 HydrophobicContact CG2-CD1 4.22Å; V409-F415 HydrophobicContact CG2-CG 4.1Å; V413-F415 PolarHBondContact O-N 2.9Å
416	D	90.9	Very high	87.4	Confident	51 Å²	51	60.6 Å²	60.6	27%	0.273	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	174.2	177.4	72	-2.6	0	0	0	111.8	R400 L401 V402 V414	R400-D416 HydrophobicContact CG-CB 4.45Å; R400-D416 IonicContact CZ-OD2 3.18Å; R400-D416 IonicContact NE-OD2 2.83Å; R400-D416 PolarHBondContact NE-OD2 3.43Å; R400-D416 IonicContact NH2-OD2 2.71Å; R400-D416 PolarHBondContact NH2-OD2 3.47Å; L401-D416 CarbonylContact O-C 3.51Å; L401-D416 WeakPolarHBondContact O-CA 3.28Å; L401-D416 WeakPolarHBondContact O-CB 3.46Å; V402-D416 HydrophobicContact CG2-CB 4.1Å; V414-D416 PolarHBondContact O-N 2.75Å; V414-D416 VanDerWaalsContact O-N 3.17Å
417	F	93.3	Very high	88.1	Confident	32 Å²	32	58.6 Å²	58.6	14%	0.14	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	137.7	177.8	179.8	-108.7	0	0	0	109.1	V377 P380 L401 Y403 C419 L425 P599	V377-F417 HydrophobicContact CG2-CD1 3.86Å; V377-F417 HydrophobicContact CG2-CE1 3.89Å; P380-F417 HydrophobicContact CG-CD2 4.31Å; L401-F417 HydrophobicContact CD1-CD1 4.37Å; L401-F417 PolarHBondContact N-O 2.78Å; L401-F417 PolarHBondContact O-N 3.29Å; Y403-F417 HydrophobicContact CE2-CB 4.08Å; Y403-F417 WeakPolarHBondContact OH-CB 3.46Å; F417-C419 HydrophobicContact CD1-CB 4.33Å; F417-C419 HydrophobicContact CE1-CB 3.72Å; F417-C419 HydrophobicContact CZ-CB 4.37Å; F417-L425 HydrophobicContact CZ-CD1 3.95Å; F417-P599 HydrophobicContact CE2-CG 4.48Å
418	W	97	Very high	88.9	Confident	33 Å²	33	55.2 Å²	55.2	13%	0.125	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.3	178.8	-77.2	88.6	0	0	0	110.5	R398 L399 R400 P599 R600 Y648	R398-W418 HydrophobicContact CB-CE3 4.17Å; R398-W418 HydrophobicContact CB-CZ3 4.29Å; L399-W418 WeakPolarHBondContact O-CA 3.36Å; R400-W418 HydrophobicContact CB-CD2 4.09Å; R400-W418 HydrophobicContact CB-CE3 4.17Å; R400-W418 HydrophobicContact CB-CH2 3.86Å; R400-W418 HydrophobicContact CB-CZ2 3.75Å; R400-W418 HydrophobicContact CB-CZ3 4.05Å; R400-W418 HydrophobicContact CG-CD2 4.33Å; R400-W418 HydrophobicContact CG-CH2 4.49Å; R400-W418 HydrophobicContact CG-CZ2 3.87Å; W418-P599 HydrophobicContact CB-CB 4.06Å; W418-P599 VanDerWaalsContact CB-O 3.22Å; W418-P599 WeakPolarHBondContact CB-O 3.33Å; W418-P599 WeakPolarHBondContact O-CB 3.45Å; W418-R600 HydrophobicContact CG-CB 4.44Å; W418-Y648 HydrophobicContact CE3-CE2 4.31Å; W418-Y648 HydrophobicContact CH2-CE2 4.06Å; W418-Y648 AromaticContact CZ3-CE2 3.75Å; W418-Y648 HydrophobicContact CZ3-CE2 3.75Å
419	C	97.2	Very high	89.6	Confident	3 Å²	3	55.6 Å²	55.6	2%	0.02	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	154.9	175.3	62.9	0	0	0	0	110.8	L399 F417	L399-C419 PolarHBondContact N-O 2.79Å; L399-C419 PolarHBondContact O-N 2.87Å; F417-C419 HydrophobicContact CD1-CB 4.33Å; F417-C419 HydrophobicContact CE1-CB 3.72Å; F417-C419 HydrophobicContact CZ-CB 4.37Å
420	H	97.3	Very high	90.3	Very high	6 Å²	6	56 Å²	56	3%	0.028	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	150.9	168.2	-167	-103.6	0	0	0	112	G397 W422 S423 P635	G397-H420 PolarHBondContact O-CD2 3.33Å; H420-W422 AromaticContact ND1-CG 3.88Å; H420-W422 PolarHBondContact ND1-N 2.76Å; H420-W422 PolarHBondContact O-N 2.98Å; H420-S423 WeakPolarHBondContact O-CB 3.44Å; H420-S423 PolarHBondContact O-N 3.34Å; H420-P635 HydrophobicContact CB-CB 3.78Å; H420-P635 HydrophobicContact CB-CG 4.23Å; H420-P635 WeakPolarHBondContact CB-O 3.36Å; H420-P635 VanDerWaalsContact CG-O 3.29Å; H420-P635 WeakPolarHBondContact ND1-CB 3.43Å
421	M	94.8	Very high	91	Very high	17 Å²	17	52.6 Å²	52.6	8%	0.084	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-9.1	175.9	60.8	169.1	55.4	0	0	115.8	S368 F369 G397 L399	S368-M421 WeakPolarHBondContact OG-CE 3.41Å; S368-M421 PolarHBondContact OG-SD 2.93Å; F369-M421 HydrophobicContact CB-CE 4.46Å; F369-M421 HydrophobicContact CD2-CB 3.72Å; F369-M421 HydrophobicContact CD2-CE 4.14Å; F369-M421 HydrophobicContact CD2-SD 4.35Å; F369-M421 HydrophobicContact CE2-CB 3.86Å; G397-M421 WeakPolarHBondContact O-CB 3.43Å; G397-M421 WeakPolarHBondContact O-CG 3.46Å; G397-M421 PolarHBondContact O-N 2.88Å; L399-M421 HydrophobicContact CD1-CB 4.15Å; L399-M421 HydrophobicContact CD2-CB 4.23Å; L399-M421 HydrophobicContact CG-CB 4.12Å
422	W	95.3	Very high	92.1	Very high	83 Å²	83	44.5 Å²	44.5	31%	0.314	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	7.8	174.7	-64	0.3	0	0	0	112.8	H247 H420 K465 P635	H247-W422 HydrophobicContact CB-CD2 4.29Å; H247-W422 HydrophobicContact CB-CE3 3.5Å; H247-W422 VanDerWaalsContact CB-CE3 3.5Å; H247-W422 HydrophobicContact CB-CH2 3.9Å; H247-W422 HydrophobicContact CB-CZ3 3.29Å; H420-W422 AromaticContact ND1-CG 3.88Å; H420-W422 PolarHBondContact ND1-N 2.76Å; H420-W422 PolarHBondContact O-N 2.98Å; W422-K465 HydrophobicContact CB-CB 3.71Å; W422-K465 HydrophobicContact CB-CG 4.16Å; W422-K465 HydrophobicContact CD2-CB 4.49Å; W422-K465 HydrophobicContact CD2-CD 4.05Å; W422-K465 HydrophobicContact CE3-CD 3.98Å; W422-K465 HydrophobicContact CG-CB 3.86Å; W422-K465 HydrophobicContact CG-CD 4.3Å; W422-K465 HydrophobicContact CG-CG 4.36Å; W422-P635 HydrophobicContact CB-CB 4Å; W422-P635 HydrophobicContact CB-CG 4.4Å
423	S	96.3	Very high	92.7	Very high	10 Å²	10	45.6 Å²	45.6	7%	0.07	24%	0.24	C	C	.	.			trans	-56.6	139.2	176.6	177.2	0	0	0	0	110.7	H420 L425	H420-S423 WeakPolarHBondContact O-CB 3.44Å; H420-S423 PolarHBondContact O-N 3.34Å; S423-L425 PolarHBondContact O-N 3.48Å; S423-L425 PolarHBondContact OG-N 2.92Å
424	P	95.4	Very high	93.2	Very high	91 Å²	91	45.7 Å²	45.7	59%	0.591	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-10.4	177.4	29.9	-36.3	0	0	0	113.4	H427	P424-H427 PolarHBondContact O-CE1 3.21Å; P424-H427 PolarHBondContact O-NE2 3.38Å
425	L	95.9	Very high	93.8	Very high	67 Å²	67	41.9 Å²	41.9	35%	0.351	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-8.2	-175	-56.8	176.3	0	0	0	114.2	V377 V378 F417 S423	V377-L425 WeakPolarHBondContact CA-O 3.4Å; V377-L425 WeakPolarHBondContact CG2-O 3.4Å; V378-L425 HydrophobicContact CG1-CB 4.11Å; V378-L425 HydrophobicContact CG1-CD1 4.25Å; V378-L425 HydrophobicContact CG1-CD2 4.36Å; V378-L425 HydrophobicContact CG1-CG 4.47Å; V378-L425 PolarHBondContact N-O 2.89Å; F417-L425 HydrophobicContact CZ-CD1 3.95Å; S423-L425 PolarHBondContact O-N 3.48Å; S423-L425 PolarHBondContact OG-N 2.92Å
426	V	95.7	Very high	94.2	Very high	7 Å²	7	41.7 Å²	41.7	4%	0.042	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132.1	-175.5	69.9	0	0	0	0	111.6	V375 V377 L401 F464	V375-V426 HydrophobicContact CB-CG2 3.85Å; V375-V426 HydrophobicContact CG1-CG2 4.22Å; V375-V426 HydrophobicContact CG2-CG2 3.75Å; V377-V426 HydrophobicContact CB-CG2 4.37Å; L401-V426 HydrophobicContact CD1-CG2 3.92Å; V426-F464 HydrophobicContact CG2-CE1 4.35Å; V426-F464 WeakPolarHBondContact O-CD1 3.47Å
427	H	95.6	Very high	94.4	Very high	16 Å²	16	40 Å²	40	7%	0.074	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	154.1	-163.1	-51.3	-75.3	0	0	0	112.5	E376 P424 W431	E376-H427 HydrophobicContact CB-CB 4.21Å; E376-H427 PolarHBondContact N-O 3.29Å; E376-H427 PolarHBondContact O-N 3.37Å; P424-H427 PolarHBondContact O-CE1 3.21Å; P424-H427 PolarHBondContact O-NE2 3.38Å; H427-W431 HydrophobicContact CB-CB 3.72Å; H427-W431 HydrophobicContact CB-CD2 3.69Å; H427-W431 HydrophobicContact CB-CE3 3.83Å; H427-W431 HydrophobicContact CB-CG 3.64Å; H427-W431 AromaticContact CD2-CE3 3.56Å; H427-W431 AromaticContact CD2-CZ3 3.64Å; H427-W431 AromaticContact CE1-CE2 3.79Å; H427-W431 AromaticContact CE1-CH2 3.77Å; H427-W431 AromaticContact CE1-CZ2 3.63Å; H427-W431 AromaticContact CG-CD2 3.48Å; H427-W431 VanDerWaalsContact CG-CD2 3.48Å; H427-W431 AromaticContact CG-CE2 3.93Å; H427-W431 AromaticContact CG-CE3 3.5Å; H427-W431 VanDerWaalsContact CG-CE3 3.5Å; H427-W431 AromaticContact CG-CG 3.93Å; H427-W431 AromaticContact ND1-CD2 3.56Å; H427-W431 AromaticContact ND1-CE2 3.5Å; H427-W431 AromaticContact ND1-CE3 3.92Å; H427-W431 AromaticContact ND1-CZ2 3.85Å; H427-W431 AromaticContact ND1-NE1 3.84Å; H427-W431 AromaticContact NE2-CH2 3.71Å; H427-W431 AromaticContact NE2-CZ3 3.68Å
428	P	94.2	Very high	94.5	Very high	24 Å²	24	42.3 Å²	42.3	16%	0.156	23%	0.234	C	C	.	.			trans	-69	154.9	173	28.4	-33.7	0	0	0	111.7	G430 W431 Q461 F464	P428-G430 PolarHBondContact O-N 2.76Å; P428-W431 HydrophobicContact CG-CB 4.25Å; P428-W431 WeakPolarHBondContact O-CB 3.34Å; P428-W431 PolarHBondContact O-N 2.91Å; P428-Q461 HydrophobicContact CB-CG 3.94Å; P428-F464 HydrophobicContact CB-CD2 4.04Å; P428-F464 HydrophobicContact CB-CE2 3.72Å; P428-F464 HydrophobicContact CB-CZ 4.08Å; P428-F464 HydrophobicContact CG-CD2 4.33Å; P428-F464 HydrophobicContact CG-CE2 4.45Å
429	L	91.3	Very high	94.3	Very high	67 Å²	67	43.4 Å²	43.4	35%	0.351	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	135.2	174.8	-56.7	-176.8	0	0	0	111.6	R374 E376 L388 W431	R374-L429 HydrophobicContact CB-CD1 4.02Å; R374-L429 HydrophobicContact CB-CD2 4.18Å; R374-L429 HydrophobicContact CB-CG 4.5Å; E376-L429 HydrophobicContact CG-CD2 4.32Å; L388-L429 HydrophobicContact CD1-CD2 3.53Å; L429-W431 VanDerWaalsContact C-N 3.35Å
430	G	89.7	Confident	94.1	Very high	30 Å²	30	44.9 Å²	44.9	31%	0.309	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	86	-4.7	-174.3	0	0	0	0	0	114.6	E376 P428 K433 T434	E376-G430 WeakPolarHBondContact OE1-CA 3.39Å; E376-G430 PolarHBondContact OE1-N 2.78Å; P428-G430 PolarHBondContact O-N 2.76Å; G430-K433 PolarHBondContact O-N 2.91Å; G430-T434 WeakPolarHBondContact O-CB 3.45Å; G430-T434 PolarHBondContact O-N 3.38Å; G430-T434 PolarHBondContact O-OG1 2.86Å
431	W	95.1	Very high	93.3	Very high	24 Å²	24	48.7 Å²	48.7	9%	0.091	28%	0.281	C	S	.	.	H	α-helix	trans	-59.1	-50	-178.6	171.3	85	0	0	0	112	E376 T386 H427 P428 L429 K433 T434 V435 H437 Y507	E376-W431 PolarHBondContact OE2-N 3.41Å; T386-W431 HydrophobicContact CG2-CE3 4.35Å; T386-W431 HydrophobicContact CG2-CZ3 3.86Å; H427-W431 HydrophobicContact CB-CB 3.72Å; H427-W431 HydrophobicContact CB-CD2 3.69Å; H427-W431 HydrophobicContact CB-CE3 3.83Å; H427-W431 HydrophobicContact CB-CG 3.64Å; H427-W431 AromaticContact CD2-CE3 3.56Å; H427-W431 AromaticContact CD2-CZ3 3.64Å; H427-W431 AromaticContact CE1-CE2 3.79Å; H427-W431 AromaticContact CE1-CH2 3.77Å; H427-W431 AromaticContact CE1-CZ2 3.63Å; H427-W431 AromaticContact CG-CD2 3.48Å; H427-W431 VanDerWaalsContact CG-CD2 3.48Å; H427-W431 AromaticContact CG-CE2 3.93Å; H427-W431 AromaticContact CG-CE3 3.5Å; H427-W431 VanDerWaalsContact CG-CE3 3.5Å; H427-W431 AromaticContact CG-CG 3.93Å; H427-W431 AromaticContact ND1-CD2 3.56Å; H427-W431 AromaticContact ND1-CE2 3.5Å; H427-W431 AromaticContact ND1-CE3 3.92Å; H427-W431 AromaticContact ND1-CZ2 3.85Å; H427-W431 AromaticContact ND1-NE1 3.84Å; H427-W431 AromaticContact NE2-CH2 3.71Å; H427-W431 AromaticContact NE2-CZ3 3.68Å; P428-W431 HydrophobicContact CG-CB 4.25Å; P428-W431 WeakPolarHBondContact O-CB 3.34Å; P428-W431 PolarHBondContact O-N 2.91Å; L429-W431 VanDerWaalsContact C-N 3.35Å; W431-K433 VanDerWaalsContact C-N 3.3Å; W431-K433 PolarHBondContact O-N 3.24Å; W431-T434 CarbonylContact O-C 3.44Å; W431-T434 WeakPolarHBondContact O-CA 3.23Å; W431-T434 WeakPolarHBondContact O-CB 3.38Å; W431-T434 PolarHBondContact O-N 2.93Å; W431-V435 HydrophobicContact CD2-CG2 4.15Å; W431-V435 HydrophobicContact CE3-CG2 4.39Å; W431-V435 HydrophobicContact CH2-CG2 3.91Å; W431-V435 HydrophobicContact CZ2-CG1 4.29Å; W431-V435 HydrophobicContact CZ2-CG2 3.63Å; W431-V435 HydrophobicContact CZ3-CG2 4.27Å; W431-V435 PolarHBondContact O-N 2.81Å; W431-H437 HydrophobicContact CH2-CB 4.06Å; W431-H437 AromaticContact CH2-CG 3.99Å; W431-H437 HydrophobicContact CZ3-CB 3.91Å; W431-H437 AromaticContact CZ3-CG 3.86Å; W431-Y507 AromaticContact CE2-CZ 3.94Å; W431-Y507 AromaticContact CZ2-CD1 3.81Å; W431-Y507 HydrophobicContact CZ2-CD1 3.81Å; W431-Y507 HydrophobicContact CZ2-CD2 4.14Å; W431-Y507 AromaticContact CZ2-CE1 3.6Å; W431-Y507 HydrophobicContact CZ2-CE1 3.6Å; W431-Y507 AromaticContact CZ2-CE2 3.95Å; W431-Y507 HydrophobicContact CZ2-CE2 3.95Å; W431-Y507 HydrophobicContact CZ2-CG 4.06Å; W431-Y507 AromaticContact CZ2-CZ 3.66Å; W431-Y507 AromaticContact NE1-CE2 3.6Å; W431-Y507 AromaticContact NE1-CZ 3.63Å
432	S	95	Very high	92.1	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59.4	-45	-175.2	-50.8	0	0	0	0	111	E376 T386 T434 V435 G436 H437	E376-S432 VanDerWaalsContact OE2-CB 3.26Å; E376-S432 WeakPolarHBondContact OE2-CB 3.36Å; E376-S432 PolarHBondContact OE2-N 3.18Å; E376-S432 PolarHBondContact OE2-OG 3.22Å; T386-S432 PolarHBondContact OG1-OG 3.1Å; S432-T434 VanDerWaalsContact C-N 3.28Å; S432-T434 PolarHBondContact O-N 3.16Å; S432-V435 PolarHBondContact O-N 2.74Å; S432-G436 PolarHBondContact O-N 3.34Å; S432-H437 CarbonylContact C-O 3.57Å; S432-H437 PolarHBondContact O-N 3.12Å
433	K	91.8	Very high	90.3	Very high	189 Å²	189	51 Å²	51	82%	0.822	31%	0.307	S	S	*	.	H	α-helix	trans	-65.6	-27	174.3	-176.7	172.7	-177.9	172.3	0	113.6	G430 W431	G430-K433 PolarHBondContact O-N 2.91Å; W431-K433 VanDerWaalsContact C-N 3.3Å; W431-K433 PolarHBondContact O-N 3.24Å
434	T	90.9	Very high	87.9	Confident	87 Å²	87	55.5 Å²	55.5	53%	0.534	34%	0.339	S	S	.	.	H	α-helix	trans	-79.5	-40.3	178.8	-58.2	0	0	0	0	111.3	G430 W431 S432	G430-T434 WeakPolarHBondContact O-CB 3.45Å; G430-T434 PolarHBondContact O-N 3.38Å; G430-T434 PolarHBondContact O-OG1 2.86Å; W431-T434 CarbonylContact O-C 3.44Å; W431-T434 WeakPolarHBondContact O-CA 3.23Å; W431-T434 WeakPolarHBondContact O-CB 3.38Å; W431-T434 PolarHBondContact O-N 2.93Å; S432-T434 VanDerWaalsContact C-N 3.28Å; S432-T434 PolarHBondContact O-N 3.16Å
435	V	92.5	Very high	85.6	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.012	35%	0.351	C	S	.	.	H	α-helix	trans	-87.7	-20.9	-179.3	-55.3	0	0	0	0	114.1	W431 S432 H437 L503 L504 D505 Y507	W431-V435 HydrophobicContact CD2-CG2 4.15Å; W431-V435 HydrophobicContact CE3-CG2 4.39Å; W431-V435 HydrophobicContact CH2-CG2 3.91Å; W431-V435 HydrophobicContact CZ2-CG1 4.29Å; W431-V435 HydrophobicContact CZ2-CG2 3.63Å; W431-V435 HydrophobicContact CZ3-CG2 4.27Å; W431-V435 PolarHBondContact O-N 2.81Å; S432-V435 PolarHBondContact O-N 2.74Å; V435-H437 HydrophobicContact CG2-CB 3.72Å; V435-L503 HydrophobicContact CG2-CD1 4.49Å; V435-L504 PolarHBondContact O-N 2.95Å; V435-D505 HydrophobicContact CG1-CB 4.4Å; V435-Y507 HydrophobicContact CB-CD2 4.42Å; V435-Y507 HydrophobicContact CG1-CD2 3.96Å; V435-Y507 HydrophobicContact CG1-CE2 4.17Å
436	G	92.5	Very high	83.4	Confident	37 Å²	37	58.6 Å²	58.6	38%	0.381	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.8	19.8	-175.1	0	0	0	0	0	114.7	S432 K501 L503	S432-G436 PolarHBondContact O-N 3.34Å; G436-K501 PolarHBondContact O-NZ 2.81Å; G436-K501 VanDerWaalsContact O-NZ 3.1Å; G436-L503 WeakPolarHBondContact O-CD2 3.39Å
437	H	95.9	Very high	81	Confident	15 Å²	15	65.1 Å²	65.1	7%	0.069	38%	0.383	C	S	.	.			trans	-84.8	150.4	176.6	-167.2	-85.7	0	0	0	111.5	W431 S432 V435 L503 M509 C525	W431-H437 HydrophobicContact CH2-CB 4.06Å; W431-H437 AromaticContact CH2-CG 3.99Å; W431-H437 HydrophobicContact CZ3-CB 3.91Å; W431-H437 AromaticContact CZ3-CG 3.86Å; S432-H437 CarbonylContact C-O 3.57Å; S432-H437 PolarHBondContact O-N 3.12Å; V435-H437 HydrophobicContact CG2-CB 3.72Å; H437-L503 HydrophobicContact CB-CD1 4.02Å; H437-M509 VanDerWaalsContact CD2-SD 3.53Å; H437-C525 PolarHBondContact CD2-SG 3.07Å; H437-C525 VanDerWaalsContact NE2-CB 3.28Å; H437-C525 WeakPolarHBondContact NE2-CB 3.44Å
438	T	95	Very high	78.4	Confident	80 Å²	80	69.5 Å²	69.5	49%	0.491	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	144.6	178	-47.8	0	0	0	0	111.2	S384 R385 T386	S384-T438 WeakPolarHBondContact O-CB 3.35Å; R385-T438 WeakPolarHBondContact CA-O 3.05Å; R385-T438 HydrophobicContact CB-CG2 3.75Å; T386-T438 PolarHBondContact N-O 2.76Å; T386-T438 PolarHBondContact OG1-O 2.78Å
439	I	93.9	Very high	76.1	Confident	57 Å²	57	71 Å²	71	29%	0.292	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	137.8	176.5	-173.6	163.9	0	0	0	109.8	E376 T386 A441 Y442	E376-I439 HydrophobicContact CG-CD1 3.83Å; T386-I439 CarbonylContact O-C 3.57Å; T386-I439 WeakPolarHBondContact O-CA 3.38Å; T386-I439 WeakPolarHBondContact OG1-CB 3.36Å; T386-I439 WeakPolarHBondContact OG1-CG1 3.37Å; I439-A441 PolarHBondContact O-N 3.27Å; I439-Y442 WeakPolarHBondContact CD1-OH 3.28Å; I439-Y442 WeakPolarHBondContact CG1-OH 3.34Å
440	K	92.2	Very high	73.9	Confident	34 Å²	34	71.6 Å²	71.6	15%	0.148	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-62.2	125.1	176.4	-164.4	-170.4	-175.6	-168.6	0	109.2	T386 R387 D405 D408	T386-K440 PolarHBondContact O-N 3.34Å; R387-K440 HydrophobicContact CB-CB 4.04Å; D405-K440 IonicContact OD2-NZ 3.84Å; D405-K440 PolarHBondContact OD2-NZ 3.45Å; D408-K440 IonicContact OD1-NZ 3.43Å; D408-K440 PolarHBondContact OD1-NZ 2.78Å; D408-K440 IonicContact OD2-NZ 2.81Å; D408-K440 PolarHBondContact OD2-NZ 3.32Å
441	A	79.7	Confident	71.6	Confident	86 Å²	86	76 Å²	76	71%	0.711	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-65.6	145.7	175.3	0	0	0	0	0	111.2	I439	I439-A441 PolarHBondContact O-N 3.27Å
442	Y	71.3	Confident	69.2	Low	90 Å²	90	77.8 Å²	77.8	35%	0.353	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-99	148.8	-179.6	-51	-67.8	0	0	0	111.4	L388 I439	L388-Y442 HydrophobicContact CB-CD1 4.4Å; L388-Y442 HydrophobicContact CB-CE1 3.42Å; L388-Y442 VanDerWaalsContact CB-CE1 3.42Å; L388-Y442 WeakPolarHBondContact CB-OH 3.34Å; L388-Y442 HydrophobicContact CD2-CE1 4.45Å; L388-Y442 PolarHBondContact N-OH 3.38Å; I439-Y442 WeakPolarHBondContact CD1-OH 3.28Å; I439-Y442 WeakPolarHBondContact CG1-OH 3.34Å
443	G	57.1	Low	66.7	Low	58 Å²	58	87.3 Å²	87.3	60%	0.598	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-58.3	139.4	165.2	0	0	0	0	0	111	N445 V446	G443-N445 PolarHBondContact O-N 3.32Å; G443-V446 PolarHBondContact O-N 2.79Å
444	S	44.8	Very low	64.3	Low	105 Å²	105	80.7 Å²	80.7	73%	0.734	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-56.5	-16.8	-170.6	50	0	0	0	0	115.6	V446	S444-V446 PolarHBondContact O-N 3.03Å
445	N	47.1	Very low	62	Low	159 Å²	159	84.1 Å²	84.1	85%	0.85	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-69	-15.1	179.8	-131.8	-2.8	0	0	0	114.1	G443	G443-N445 PolarHBondContact O-N 3.32Å
446	V	51	Low	59.8	Low	64 Å²	64	86.1 Å²	86.1	39%	0.388	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-88.8	-24.1	-176.6	-171.7	0	0	0	0	112.9	G443 S444 A448 S449	G443-V446 PolarHBondContact O-N 2.79Å; S444-V446 PolarHBondContact O-N 3.03Å; V446-A448 PolarHBondContact O-N 3.29Å; V446-A448 VanDerWaalsContact O-N 3.16Å; V446-S449 PolarHBondContact O-N 2.84Å; V446-S449 PolarHBondContact O-OG 3.25Å
447	E	45.5	Very low	57.8	Low	144 Å²	144	88.6 Å²	88.6	67%	0.673	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-59.7	-30.7	-172.6	-66.2	-161.2	130.6	0	0	113.7	S449 S450	E447-S449 PolarHBondContact O-N 3.11Å; E447-S450 WeakPolarHBondContact O-CB 3.38Å; E447-S450 PolarHBondContact O-N 3.3Å; E447-S450 PolarHBondContact O-OG 2.82Å
448	A	39.8	Very low	55.8	Low	107 Å²	107	93.6 Å²	93.6	88%	0.884	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-59.9	-15.6	177.2	0	0	0	0	0	113.9	V446	V446-A448 PolarHBondContact O-N 3.29Å; V446-A448 VanDerWaalsContact O-N 3.16Å
449	S	46.3	Very low	54.1	Low	57 Å²	57	96.3 Å²	96.3	40%	0.399	57%	0.574	S	S	.	*	G	3₁₀ helix	trans	-104.2	5.1	177.3	77.4	0	0	0	0	114.5	R374 V446 E447 N451	R374-S449 PolarHBondContact NH1-OG 2.94Å; R374-S449 PolarHBondContact NH2-O 2.89Å; V446-S449 PolarHBondContact O-N 2.84Å; V446-S449 PolarHBondContact O-OG 3.25Å; E447-S449 PolarHBondContact O-N 3.11Å; S449-N451 PolarHBondContact O-N 2.67Å
450	S	45.2	Very low	53	Low	79 Å²	79	96 Å²	96	55%	0.552	57%	0.57	S	S	*	*			trans	-84.8	-1.9	-165.1	66.3	0	0	0	0	116.1	E447 P452	E447-S450 WeakPolarHBondContact O-CB 3.38Å; E447-S450 PolarHBondContact O-N 3.3Å; E447-S450 PolarHBondContact O-OG 2.82Å; S450-P452 WeakPolarHBondContact O-CD 3.39Å
451	N	41.7	Very low	51.9	Low	123 Å²	123	98.8 Å²	98.8	66%	0.658	58%	0.584	S	S	*	*			trans	-128.8	70.3	-166.2	-151.2	-33.8	0	0	0	114.5	S449 K453	S449-N451 PolarHBondContact O-N 2.67Å; N451-K453 PolarHBondContact O-N 3.07Å
452	P	43.6	Very low	51.7	Low	60 Å²	60	97.3 Å²	97.3	39%	0.39	58%	0.577	S	S	.	*			trans	-75.9	86	178.3	-9.6	28.7	0	0	0	111.5	S450 G454 E457	S450-P452 WeakPolarHBondContact O-CD 3.39Å; P452-G454 VanDerWaalsContact C-N 3.31Å; P452-G454 PolarHBondContact O-N 2.96Å; P452-E457 WeakPolarHBondContact CD-OE1 3.44Å; P452-E457 VanDerWaalsContact CG-OE1 3.29Å; P452-E457 WeakPolarHBondContact CG-OE1 3.33Å
453	K	43.7	Very low	52.3	Low	200 Å²	200	95.2 Å²	95.2	87%	0.87	57%	0.572	S	S	*	*			trans	-62.9	84.8	173.4	-68.8	-177.7	-180	174.4	0	111.8	N451	N451-K453 PolarHBondContact O-N 3.07Å
454	G	40.4	Very low	53.9	Low	50 Å²	50	93.4 Å²	93.4	52%	0.515	55%	0.548	S	S	.	.	S	Bend	trans	-162.4	144.9	-175.2	0	0	0	0	0	114.8	P452 G456	P452-G454 VanDerWaalsContact C-N 3.31Å; P452-G454 PolarHBondContact O-N 2.96Å; G454-G456 PolarHBondContact O-N 2.7Å
455	N	42.4	Very low	56.1	Low	159 Å²	159	93.8 Å²	93.8	85%	0.85	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	15.9	-178.5	-160.5	58.9	0	0	0	114.6
456	G	47.7	Very low	58	Low	44 Å²	44	94.1 Å²	94.1	45%	0.454	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-24.8	-175.6	0	0	0	0	0	114.5	G454 N458 M459 F460	G454-G456 PolarHBondContact O-N 2.7Å; G456-N458 PolarHBondContact O-N 3.35Å; G456-M459 WeakPolarHBondContact O-CA 3.24Å; G456-M459 WeakPolarHBondContact O-CB 3.29Å; G456-M459 PolarHBondContact O-N 2.7Å; G456-F460 PolarHBondContact O-N 3.43Å; G456-F460 VanDerWaalsContact O-N 3.11Å
457	E	49.2	Very low	59.8	Low	90 Å²	90	93.8 Å²	93.8	42%	0.421	53%	0.529	S	S	.	.	H	α-helix	trans	-64.6	-41.8	-175.7	-60.9	-170.5	137.1	0	0	112	P452 M459 F460 Q461	P452-E457 WeakPolarHBondContact CD-OE1 3.44Å; P452-E457 VanDerWaalsContact CG-OE1 3.29Å; P452-E457 WeakPolarHBondContact CG-OE1 3.33Å; E457-M459 PolarHBondContact O-N 3.2Å; E457-F460 PolarHBondContact O-N 3.34Å; E457-Q461 WeakPolarHBondContact O-CG 3.18Å; E457-Q461 PolarHBondContact O-N 3.32Å
458	N	54.3	Low	61.8	Low	119 Å²	119	92.5 Å²	92.5	64%	0.636	52%	0.518	S	S	*	.	H	α-helix	trans	-58.4	-28.1	172.6	-67.8	-7.1	0	0	0	113.1	G456 G462	G456-N458 PolarHBondContact O-N 3.35Å; N458-G462 PolarHBondContact O-N 3.48Å
459	M	59.5	Low	63.8	Low	138 Å²	138	93.3 Å²	93.3	68%	0.68	51%	0.506	S	S	*	.	H	α-helix	trans	-78.6	-35.8	175.9	-163.3	-175.1	107	0	0	111.3	G456 E457 G462	G456-M459 WeakPolarHBondContact O-CA 3.24Å; G456-M459 WeakPolarHBondContact O-CB 3.29Å; G456-M459 PolarHBondContact O-N 2.7Å; E457-M459 PolarHBondContact O-N 3.2Å; M459-G462 PolarHBondContact O-N 2.92Å
460	F	69.9	Low	65.6	Low	49 Å²	49	92.8 Å²	92.8	22%	0.215	50%	0.5	C	S	.	.	H	α-helix	trans	-69.7	-42.3	175.6	-174.7	-110.3	0	0	0	112.1	F369 A373 R374 V375 G456 E457 G462 L463 F464	F369-F460 AromaticContact CD1-CE2 3.98Å; F369-F460 HydrophobicContact CD1-CE2 3.98Å; F369-F460 HydrophobicContact CD1-CZ 4.24Å; F369-F460 AromaticContact CE1-CE2 3.92Å; F369-F460 HydrophobicContact CE1-CE2 3.92Å; F369-F460 AromaticContact CE1-CZ 3.88Å; F369-F460 HydrophobicContact CE1-CZ 3.88Å; A373-F460 HydrophobicContact CB-CE2 3.76Å; A373-F460 HydrophobicContact CB-CZ 3.84Å; R374-F460 WeakPolarHBondContact O-CE1 3.4Å; V375-F460 HydrophobicContact CG1-CE1 4.45Å; V375-F460 HydrophobicContact CG1-CZ 4.03Å; G456-F460 PolarHBondContact O-N 3.43Å; G456-F460 VanDerWaalsContact O-N 3.11Å; E457-F460 PolarHBondContact O-N 3.34Å; F460-G462 PolarHBondContact O-N 3.22Å; F460-L463 HydrophobicContact CD2-CD1 3.68Å; F460-L463 HydrophobicContact CE2-CD1 4.11Å; F460-L463 WeakPolarHBondContact O-CB 3.39Å; F460-L463 WeakPolarHBondContact O-CG 3.38Å; F460-L463 PolarHBondContact O-N 3.14Å; F460-F464 HydrophobicContact CD1-CE2 4Å; F460-F464 AromaticContact CE1-CE2 3.7Å; F460-F464 HydrophobicContact CE1-CE2 3.7Å; F460-F464 AromaticContact CE1-CZ 3.83Å; F460-F464 HydrophobicContact CE1-CZ 3.83Å; F460-F464 HydrophobicContact CZ-CE2 4.05Å; F460-F464 HydrophobicContact CZ-CZ 4Å; F460-F464 WeakPolarHBondContact O-CD2 3.4Å; F460-F464 WeakPolarHBondContact O-CE2 3.23Å
461	Q	69.9	Low	67.2	Low	93 Å²	93	96.1 Å²	96.1	44%	0.435	50%	0.502	S	S	.	.	H	α-helix	trans	-57.8	-27.4	171.2	-71.2	179.4	-5	0	0	112.8	P428 E457 L463	P428-Q461 HydrophobicContact CB-CG 3.94Å; E457-Q461 WeakPolarHBondContact O-CG 3.18Å; E457-Q461 PolarHBondContact O-N 3.32Å; Q461-L463 VanDerWaalsContact C-N 3.27Å; Q461-L463 PolarHBondContact O-N 3.02Å
462	G	75.9	Confident	69.3	Low	55 Å²	55	94.3 Å²	94.3	57%	0.567	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-6.8	175.7	0	0	0	0	0	115.5	N458 M459 F460	N458-G462 PolarHBondContact O-N 3.48Å; M459-G462 PolarHBondContact O-N 2.92Å; F460-G462 PolarHBondContact O-N 3.22Å
463	L	83.9	Confident	71	Confident	46 Å²	46	93.7 Å²	93.7	24%	0.241	50%	0.496	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-22	179.8	-54.8	-178.9	0	0	0	113.5	S368 F369 F460 Q461	S368-L463 WeakPolarHBondContact O-CD1 3.21Å; F369-L463 HydrophobicContact CD2-CB 4.27Å; F369-L463 HydrophobicContact CD2-CD1 4.45Å; F369-L463 HydrophobicContact CE2-CB 3.69Å; F369-L463 HydrophobicContact CZ-CB 4.02Å; F460-L463 HydrophobicContact CD2-CD1 3.68Å; F460-L463 HydrophobicContact CE2-CD1 4.11Å; F460-L463 WeakPolarHBondContact O-CB 3.39Å; F460-L463 WeakPolarHBondContact O-CG 3.38Å; F460-L463 PolarHBondContact O-N 3.14Å; Q461-L463 VanDerWaalsContact C-N 3.27Å; Q461-L463 PolarHBondContact O-N 3.02Å
464	F	90.1	Very high	72.6	Confident	21 Å²	21	93.8 Å²	93.8	9%	0.092	50%	0.499	C	S	.	.	S	Bend	trans	-75.6	137.8	-177.3	-66.1	-96.7	0	0	0	110.8	F369 V375 V426 P428 F460 K466	F369-F464 HydrophobicContact CE1-CE1 4.14Å; F369-F464 HydrophobicContact CE1-CE2 4.26Å; F369-F464 AromaticContact CE1-CZ 3.86Å; F369-F464 HydrophobicContact CE1-CZ 3.86Å; F369-F464 HydrophobicContact CZ-CD1 4.14Å; F369-F464 HydrophobicContact CZ-CD2 4.29Å; F369-F464 AromaticContact CZ-CE1 3.93Å; F369-F464 HydrophobicContact CZ-CE1 3.93Å; F369-F464 HydrophobicContact CZ-CE2 4.08Å; F369-F464 HydrophobicContact CZ-CG 4.32Å; F369-F464 AromaticContact CZ-CZ 3.9Å; F369-F464 HydrophobicContact CZ-CZ 3.9Å; V375-F464 HydrophobicContact CG1-CE1 4.41Å; V375-F464 HydrophobicContact CG1-CZ 4.04Å; V426-F464 HydrophobicContact CG2-CE1 4.35Å; V426-F464 WeakPolarHBondContact O-CD1 3.47Å; P428-F464 HydrophobicContact CB-CD2 4.04Å; P428-F464 HydrophobicContact CB-CE2 3.72Å; P428-F464 HydrophobicContact CB-CZ 4.08Å; P428-F464 HydrophobicContact CG-CD2 4.33Å; P428-F464 HydrophobicContact CG-CE2 4.45Å; F460-F464 HydrophobicContact CD1-CE2 4Å; F460-F464 AromaticContact CE1-CE2 3.7Å; F460-F464 HydrophobicContact CE1-CE2 3.7Å; F460-F464 AromaticContact CE1-CZ 3.83Å; F460-F464 HydrophobicContact CE1-CZ 3.83Å; F460-F464 HydrophobicContact CZ-CE2 4.05Å; F460-F464 HydrophobicContact CZ-CZ 4Å; F460-F464 WeakPolarHBondContact O-CD2 3.4Å; F460-F464 WeakPolarHBondContact O-CE2 3.23Å; F464-K466 PolarHBondContact O-N 3.41Å; F464-K466 VanDerWaalsContact O-N 3.14Å
465	K	90.6	Very high	74.6	Confident	113 Å²	113	92.7 Å²	92.7	49%	0.491	49%	0.487	S	S	.	.			trans	-63.2	114.7	172.7	-177.3	73.9	172.5	-161.3	0	108.6	W422	W422-K465 HydrophobicContact CB-CB 3.71Å; W422-K465 HydrophobicContact CB-CG 4.16Å; W422-K465 HydrophobicContact CD2-CB 4.49Å; W422-K465 HydrophobicContact CD2-CD 4.05Å; W422-K465 HydrophobicContact CE3-CD 3.98Å; W422-K465 HydrophobicContact CG-CB 3.86Å; W422-K465 HydrophobicContact CG-CD 4.3Å; W422-K465 HydrophobicContact CG-CG 4.36Å
466	K	87.9	Confident	77.1	Confident	165 Å²	165	85.8 Å²	85.8	72%	0.717	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-75.3	135.4	177.1	-63.4	-168.3	176.4	-168.8	0	110.1	F464	F464-K466 PolarHBondContact O-N 3.41Å; F464-K466 VanDerWaalsContact O-N 3.14Å
467	P	88.5	Confident	79.4	Confident	57 Å²	57	83.9 Å²	83.9	37%	0.37	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-59.4	165.5	168.2	-21.4	32.3	0	0	0	112.2	Y507 H527	P467-Y507 WeakPolarHBondContact CG-OH 3.34Å; P467-H527 HydrophobicContact CB-CB 4.5Å; P467-H527 WeakPolarHBondContact CB-ND1 3.29Å
468	R	87.2	Confident	81.7	Confident	117 Å²	117	84.5 Å²	84.5	44%	0.442	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-61.3	140.9	169.5	-176.4	-174.6	-177.5	158.2	14.7	109.3	V470 H527 N577 E579	R468-V470 PolarHBondContact O-N 2.81Å; R468-H527 PolarHBondContact O-CE1 3.37Å; R468-N577 PolarHBondContact NH1-ND2 2.95Å; R468-N577 PolarHBondContact NH1-OD1 3.26Å; R468-E579 IonicContact CZ-OE1 2.83Å; R468-E579 IonicContact CZ-OE2 3.42Å; R468-E579 IonicContact NH1-OE1 3.55Å; R468-E579 PolarHBondContact NH1-OE1 3.34Å; R468-E579 VanDerWaalsContact NH1-OE1 3.09Å; R468-E579 IonicContact NH1-OE2 3.93Å; R468-E579 PolarHBondContact NH1-OE2 3.17Å; R468-E579 IonicContact NH2-OE1 2.62Å; R468-E579 PolarHBondContact NH2-OE1 2.81Å; R468-E579 IonicContact NH2-OE2 2.83Å
469	I	82.7	Confident	83.7	Confident	124 Å²	124	84.9 Å²	84.9	64%	0.636	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-69.7	126	173.3	-59.8	172.9	0	0	0	109.3
470	V	83.4	Confident	85.5	Confident	46 Å²	46	80 Å²	80	28%	0.279	42%	0.415	S	S	.	.			trans	-119.6	149	176.9	-177.9	0	0	0	0	109.7	R468 F476 A528	R468-V470 PolarHBondContact O-N 2.81Å; V470-F476 HydrophobicContact CG1-CE2 3.66Å; V470-F476 HydrophobicContact CG1-CZ 4.43Å; V470-A528 HydrophobicContact CG1-CB 4.23Å; V470-A528 HydrophobicContact CG2-CB 4.43Å
471	Y	78.9	Confident	86.8	Confident	150 Å²	150	78.2 Å²	78.2	59%	0.588	41%	0.407	S	S	*	.			trans	-99	102.4	-177.4	-64.5	-79.8	0	0	0	111.2	G473	Y471-G473 PolarHBondContact O-N 3.27Å
472	M	86.6	Confident	88.2	Confident	84 Å²	84	74.8 Å²	74.8	41%	0.414	39%	0.391	S	S	.	.			trans	-75.1	72.5	171.3	-58.1	175.9	77.4	0	0	110.3	F476 V502 L503 G506	M472-F476 HydrophobicContact CB-CD1 4.32Å; M472-F476 HydrophobicContact CB-CG 4.36Å; M472-F476 HydrophobicContact CE-CD1 4.24Å; M472-F476 HydrophobicContact CE-CE1 3.94Å; M472-F476 HydrophobicContact CG-CD1 4.07Å; M472-F476 HydrophobicContact CG-CD2 4.46Å; M472-F476 HydrophobicContact CG-CE1 3.83Å; M472-F476 HydrophobicContact CG-CE2 4.25Å; M472-F476 HydrophobicContact CG-CG 4.38Å; M472-F476 HydrophobicContact CG-CZ 3.92Å; M472-V502 HydrophobicContact CE-CG1 3.86Å; M472-L503 WeakPolarHBondContact CE-O 3.48Å; M472-G506 PolarHBondContact SD-N 3.3Å; M472-G506 VanDerWaalsContact SD-N 3.36Å
473	G	77.3	Confident	89.3	Confident	48 Å²	48	72.1 Å²	72.1	50%	0.495	36%	0.364	S	S	.	.			trans	-98.9	-167.9	176	0	0	0	0	0	113	Y471 G475 F476	Y471-G473 PolarHBondContact O-N 3.27Å; G473-G475 PolarHBondContact O-N 3.12Å; G473-F476 WeakPolarHBondContact O-CB 3.46Å; G473-F476 PolarHBondContact O-N 2.83Å
474	E	77.2	Confident	90	Very high	202 Å²	202	70 Å²	70	94%	0.944	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	132.7	168.7	-68.2	165.9	166.2	0	0	110
475	G	82.7	Confident	90.3	Very high	26 Å²	26	69 Å²	69	27%	0.268	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	45	-173.6	0	0	0	0	0	113.4	G473 R574	G473-G475 PolarHBondContact O-N 3.12Å; G475-R574 VanDerWaalsContact O-CZ 3.25Å; G475-R574 PolarHBondContact O-NH1 3.48Å; G475-R574 PolarHBondContact O-NH2 2.98Å
476	F	94.8	Very high	90.7	Very high	14 Å²	14	63.6 Å²	63.6	6%	0.061	33%	0.325	C	S	.	.			trans	-74.8	-161.7	162.7	-173.3	-120	0	0	0	110.2	V470 M472 G473 V502 L508 A528 L575	V470-F476 HydrophobicContact CG1-CE2 3.66Å; V470-F476 HydrophobicContact CG1-CZ 4.43Å; M472-F476 HydrophobicContact CB-CD1 4.32Å; M472-F476 HydrophobicContact CB-CG 4.36Å; M472-F476 HydrophobicContact CE-CD1 4.24Å; M472-F476 HydrophobicContact CE-CE1 3.94Å; M472-F476 HydrophobicContact CG-CD1 4.07Å; M472-F476 HydrophobicContact CG-CD2 4.46Å; M472-F476 HydrophobicContact CG-CE1 3.83Å; M472-F476 HydrophobicContact CG-CE2 4.25Å; M472-F476 HydrophobicContact CG-CG 4.38Å; M472-F476 HydrophobicContact CG-CZ 3.92Å; G473-F476 WeakPolarHBondContact O-CB 3.46Å; G473-F476 PolarHBondContact O-N 2.83Å; F476-V502 HydrophobicContact CD1-CG1 4.13Å; F476-V502 HydrophobicContact CE1-CG1 3.98Å; F476-L508 HydrophobicContact CE1-CD2 4.16Å; F476-A528 HydrophobicContact CE2-CB 4.08Å; F476-A528 HydrophobicContact CZ-CB 3.77Å; F476-L575 HydrophobicContact CD2-CD2 4.24Å; F476-L575 WeakPolarHBondContact O-CD1 3.46Å
477	F	97.2	Very high	91	Very high	5 Å²	5	56.8 Å²	56.8	2%	0.022	30%	0.296	C	S	.	.			trans	-67	145.6	161.4	-72.2	-85	0	0	0	109.9	L483 V499 V502 L508 A528 I533 A571 L575 F576	F477-L483 HydrophobicContact CD1-CD2 4.49Å; F477-L483 HydrophobicContact CE1-CD2 4Å; F477-V499 HydrophobicContact CD1-CG2 4.07Å; F477-V502 WeakPolarHBondContact O-CG2 3.39Å; F477-L508 HydrophobicContact CB-CD1 4.3Å; F477-L508 HydrophobicContact CB-CD2 3.75Å; F477-L508 HydrophobicContact CD1-CD1 4.13Å; F477-L508 HydrophobicContact CD2-CD1 3.7Å; F477-L508 HydrophobicContact CD2-CD2 4.32Å; F477-L508 HydrophobicContact CE1-CD1 4.35Å; F477-L508 HydrophobicContact CE2-CD1 3.95Å; F477-L508 HydrophobicContact CG-CD1 3.8Å; F477-L508 HydrophobicContact CG-CD2 4.16Å; F477-L508 HydrophobicContact CZ-CD1 4.26Å; F477-A528 HydrophobicContact CD2-CB 4.14Å; F477-A528 HydrophobicContact CE2-CB 3.87Å; F477-I533 HydrophobicContact CE2-CD1 4.48Å; F477-I533 HydrophobicContact CZ-CD1 4.03Å; F477-A571 HydrophobicContact CD1-CB 4.05Å; F477-A571 HydrophobicContact CE1-CB 3.78Å; F477-L575 HydrophobicContact CD1-CD1 3.96Å; F477-L575 HydrophobicContact CD2-CB 4.18Å; F477-L575 HydrophobicContact CD2-CD1 4Å; F477-L575 HydrophobicContact CE1-CB 4.29Å; F477-L575 HydrophobicContact CE1-CD1 4.16Å; F477-L575 HydrophobicContact CE2-CB 3.59Å; F477-L575 HydrophobicContact CE2-CD1 4.19Å; F477-L575 HydrophobicContact CE2-CG 4.41Å; F477-L575 HydrophobicContact CG-CD1 3.89Å; F477-L575 HydrophobicContact CZ-CB 3.66Å; F477-L575 HydrophobicContact CZ-CD1 4.27Å; F477-F576 HydrophobicContact CE1-CE1 4.03Å; F477-F576 HydrophobicContact CE1-CE2 4.13Å; F477-F576 AromaticContact CE1-CZ 3.69Å; F477-F576 HydrophobicContact CE1-CZ 3.69Å; F477-F576 HydrophobicContact CZ-CD1 4.24Å; F477-F576 HydrophobicContact CZ-CD2 4.49Å; F477-F576 AromaticContact CZ-CE1 3.92Å; F477-F576 HydrophobicContact CZ-CE1 3.92Å; F477-F576 HydrophobicContact CZ-CE2 4.19Å; F477-F576 AromaticContact CZ-CZ 3.91Å; F477-F576 HydrophobicContact CZ-CZ 3.91Å
478	E	96.7	Very high	91.1	Very high	103 Å²	103	56.1 Å²	56.1	48%	0.481	29%	0.292	S	S	.	.			trans	-134.3	158.4	-179.8	-60.5	173	-177.9	0	0	109.4	M481	E478-M481 HydrophobicContact CB-CE 3.89Å; E478-M481 HydrophobicContact CB-CG 4.29Å; E478-M481 HydrophobicContact CB-SD 4.18Å; E478-M481 HydrophobicContact CG-CE 3.98Å; E478-M481 PolarHBondContact N-SD 3.18Å; E478-M481 VanDerWaalsContact N-SD 3.37Å; E478-M481 WeakPolarHBondContact O-CB 3.46Å; E478-M481 WeakPolarHBondContact O-CG 3.42Å; E478-M481 PolarHBondContact O-N 2.88Å
479	E	96.6	Very high	91.2	Very high	126 Å²	126	55.5 Å²	55.5	59%	0.589	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	138.2	-176.9	-63	175.5	177.4	0	0	110.6	M481 V499 K501 V502	E479-M481 VanDerWaalsContact C-N 3.34Å; E479-V499 WeakPolarHBondContact CA-O 3.37Å; E479-K501 WeakPolarHBondContact OE1-CA 3.43Å; E479-V502 HydrophobicContact CG-CG2 4.25Å; E479-V502 PolarHBondContact OE1-N 3.05Å
480	G	96.6	Very high	91.6	Very high	35 Å²	35	52.7 Å²	52.7	36%	0.361	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	-2.2	-171.3	0	0	0	0	0	115.3	K482 V499	G480-K482 PolarHBondContact O-N 3.17Å; G480-V499 PolarHBondContact N-O 3.32Å
481	M	98.4	Very high	92.2	Very high	13 Å²	13	51.7 Å²	51.7	6%	0.064	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	130.5	172.3	-75.8	-172.8	171.1	0	0	111.6	E478 E479 V499 T569 A571	E478-M481 HydrophobicContact CB-CE 3.89Å; E478-M481 HydrophobicContact CB-CG 4.29Å; E478-M481 HydrophobicContact CB-SD 4.18Å; E478-M481 HydrophobicContact CG-CE 3.98Å; E478-M481 PolarHBondContact N-SD 3.18Å; E478-M481 VanDerWaalsContact N-SD 3.37Å; E478-M481 WeakPolarHBondContact O-CB 3.46Å; E478-M481 WeakPolarHBondContact O-CG 3.42Å; E478-M481 PolarHBondContact O-N 2.88Å; E479-M481 VanDerWaalsContact C-N 3.34Å; M481-V499 HydrophobicContact CB-CG2 4.36Å; M481-V499 PolarHBondContact O-N 3.38Å; M481-T569 CarbonylContact C-O 3.58Å; M481-T569 WeakPolarHBondContact CA-O 3.11Å; M481-A571 HydrophobicContact CB-CB 4.21Å; M481-A571 HydrophobicContact SD-CB 4.28Å
482	K	98.4	Very high	93	Very high	20 Å²	20	45.7 Å²	45.7	9%	0.087	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	145	175.1	-58.3	-63.2	-174.3	174.7	0	112.4	G480 A497 T498 D513 W559 Y562 L563 A568 T569 A571	G480-K482 PolarHBondContact O-N 3.17Å; K482-A497 CarbonylContact C-O 3.59Å; K482-A497 WeakPolarHBondContact CA-O 3.46Å; K482-T498 VanDerWaalsContact CD-OG1 3.28Å; K482-T498 WeakPolarHBondContact CD-OG1 3.26Å; K482-T498 PolarHBondContact NZ-OG1 2.96Å; K482-D513 IonicContact NZ-OD1 3.79Å; K482-D513 IonicContact NZ-OD2 2.73Å; K482-D513 PolarHBondContact NZ-OD2 2.89Å; K482-W559 HydrophobicContact CB-CH2 4.26Å; K482-W559 HydrophobicContact CB-CZ3 3.74Å; K482-W559 HydrophobicContact CG-CZ3 4.39Å; K482-Y562 HydrophobicContact CD-CE1 4.28Å; K482-L563 HydrophobicContact CB-CD2 4Å; K482-L563 HydrophobicContact CG-CD2 3.81Å; K482-A568 HydrophobicContact CD-CB 4.3Å; K482-A568 HydrophobicContact CG-CB 3.73Å; K482-T569 PolarHBondContact N-O 3.09Å; K482-A571 WeakPolarHBondContact O-CB 3.44Å; K482-A571 PolarHBondContact O-N 3.03Å
483	L	98.7	Very high	93.4	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	176.8	178	58.1	86.1	0	0	0	111.2	F477 A485 A497 V499 V510 I533 W559 A571 F576	F477-L483 HydrophobicContact CD1-CD2 4.49Å; F477-L483 HydrophobicContact CE1-CD2 4Å; L483-A485 HydrophobicContact CD1-CB 3.91Å; L483-A497 HydrophobicContact CD1-CB 3.92Å; L483-A497 PolarHBondContact N-O 2.96Å; L483-A497 PolarHBondContact O-N 3.02Å; L483-A497 VanDerWaalsContact O-O 3.13Å; L483-V499 HydrophobicContact CD2-CG2 3.58Å; L483-V510 HydrophobicContact CD1-CG1 4.19Å; L483-I533 HydrophobicContact CD1-CB 4.21Å; L483-I533 HydrophobicContact CD1-CG2 4.14Å; L483-W559 WeakPolarHBondContact O-CH2 3.5Å; L483-A571 HydrophobicContact CB-CB 4.25Å; L483-F576 HydrophobicContact CB-CE1 4.24Å; L483-F576 HydrophobicContact CB-CZ 3.86Å; L483-F576 HydrophobicContact CD2-CE1 4.34Å; L483-F576 HydrophobicContact CD2-CZ 4.28Å
484	E	98.6	Very high	94.4	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	139.1	169.5	-70.9	173.8	-168.2	0	0	108.5	I494 C495 L534 N537 F538 C539 L546 W559	E484-I494 HydrophobicContact CB-CG2 4.01Å; E484-C495 CarbonylContact C-O 3.59Å; E484-C495 WeakPolarHBondContact CA-O 3.32Å; E484-L534 HydrophobicContact CB-CB 3.97Å; E484-L534 PolarHBondContact N-O 3.23Å; E484-L534 WeakPolarHBondContact O-CA 3.06Å; E484-L534 WeakPolarHBondContact O-CB 3.39Å; E484-L534 PolarHBondContact O-N 3.01Å; E484-N537 VanDerWaalsContact OE1-CA 3.28Å; E484-N537 WeakPolarHBondContact OE1-CA 3.23Å; E484-N537 PolarHBondContact OE1-N 3.12Å; E484-F538 PolarHBondContact OE1-N 3.06Å; E484-F538 WeakPolarHBondContact OE2-CA 3.3Å; E484-F538 VanDerWaalsContact OE2-CB 3.28Å; E484-F538 WeakPolarHBondContact OE2-CB 3.49Å; E484-F538 PolarHBondContact OE2-N 3.34Å; E484-C539 PolarHBondContact OE2-N 3.17Å; E484-L546 HydrophobicContact CG-CD1 3.83Å; E484-W559 HydrophobicContact CG-CZ2 3.56Å; E484-W559 PolarHBondContact OE1-NE1 2.77Å
485	A	98.1	Very high	95.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	146.1	-179.1	0	0	0	0	0	112.3	L483 I494 C495 A497 V510 I512 A532 I533	L483-A485 HydrophobicContact CD1-CB 3.91Å; A485-I494 CarbonylContact O-C 3.53Å; A485-I494 WeakPolarHBondContact O-CA 3.49Å; A485-C495 PolarHBondContact N-O 2.85Å; A485-C495 PolarHBondContact O-N 2.91Å; A485-A497 HydrophobicContact CB-CB 3.72Å; A485-V510 HydrophobicContact CB-CG1 4.45Å; A485-I512 HydrophobicContact CB-CD1 4.17Å; A485-A532 CarbonylContact C-O 3.59Å; A485-A532 WeakPolarHBondContact CA-O 3.32Å; A485-A532 WeakPolarHBondContact CB-O 3.36Å; A485-I533 HydrophobicContact CB-CG2 4.47Å
486	I	97.6	Very high	96.1	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	135.5	168.3	-54.3	171.1	0	0	0	107.5	P488 L491 N493 I494 Y526 A532 L614 W629	I486-P488 WeakPolarHBondContact O-CD 3.28Å; I486-L491 HydrophobicContact CG2-CB 4.41Å; I486-L491 HydrophobicContact CG2-CD2 3.83Å; I486-N493 WeakPolarHBondContact CA-O 3.36Å; I486-I494 HydrophobicContact CG1-CG1 3.88Å; I486-Y526 PolarHBondContact O-OH 2.72Å; I486-A532 HydrophobicContact CB-CB 4.05Å; I486-A532 HydrophobicContact CD1-CB 3.89Å; I486-A532 HydrophobicContact CG1-CB 4.14Å; I486-A532 PolarHBondContact N-O 3.16Å; I486-L614 HydrophobicContact CD1-CD2 4.18Å; I486-W629 HydrophobicContact CD1-CB 3.72Å; I486-W629 HydrophobicContact CG1-CB 4.21Å; I486-W629 HydrophobicContact CG2-CB 4.36Å
487	D	94.5	Very high	96.2	Very high	22 Å²	22	30.7 Å²	30.7	12%	0.118	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	118.4	177.1	178.2	-1.3	0	0	0	111.1	L489 N490 L491 N493	D487-L489 PolarHBondContact O-N 3.06Å; D487-L489 VanDerWaalsContact O-N 3.16Å; D487-L489 WeakPolarHBondContact OD1-CB 3.46Å; D487-L489 PolarHBondContact OD1-N 2.94Å; D487-N490 CarbonylContact O-C 3.51Å; D487-N490 PolarHBondContact O-N 3.29Å; D487-N490 VanDerWaalsContact O-N 3.1Å; D487-N490 VanDerWaalsContact O-O 3.11Å; D487-L491 WeakPolarHBondContact O-CA 3.13Å; D487-L491 PolarHBondContact O-N 2.87Å; D487-N493 HydrophobicContact CB-CB 4.38Å; D487-N493 PolarHBondContact N-O 2.67Å; D487-N493 VanDerWaalsContact N-O 3.1Å
488	P	90.4	Very high	96.2	Very high	42 Å²	42	30.9 Å²	30.9	27%	0.273	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-10.5	177.6	-25.1	39.2	0	0	0	115.5	I486 F524 Y526	I486-P488 WeakPolarHBondContact O-CD 3.28Å; P488-F524 HydrophobicContact CB-CD1 3.67Å; P488-F524 HydrophobicContact CB-CE1 3.62Å; P488-F524 HydrophobicContact CB-CG 4.39Å; P488-F524 HydrophobicContact CB-CZ 4.35Å; P488-F524 HydrophobicContact CG-CB 4.15Å; P488-F524 HydrophobicContact CG-CD1 3.42Å; P488-F524 VanDerWaalsContact CG-CD1 3.42Å; P488-F524 HydrophobicContact CG-CD2 4.16Å; P488-F524 HydrophobicContact CG-CE1 3.73Å; P488-F524 HydrophobicContact CG-CE2 4.45Å; P488-F524 HydrophobicContact CG-CG 3.64Å; P488-F524 HydrophobicContact CG-CZ 4.25Å; P488-Y526 VanDerWaalsContact CG-OH 3.25Å; P488-Y526 WeakPolarHBondContact CG-OH 3.44Å
489	L	89.8	Confident	96.3	Very high	104 Å²	104	26 Å²	26	55%	0.545	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-8.7	174.7	-54.9	178.5	0	0	0	112.4	D487 F524 M597	D487-L489 PolarHBondContact O-N 3.06Å; D487-L489 VanDerWaalsContact O-N 3.16Å; D487-L489 WeakPolarHBondContact OD1-CB 3.46Å; D487-L489 PolarHBondContact OD1-N 2.94Å; L489-F524 HydrophobicContact CD1-CE1 4.4Å; L489-F524 HydrophobicContact CD1-CZ 3.92Å; L489-F524 HydrophobicContact CD2-CE1 4.35Å; L489-F524 HydrophobicContact CG-CE1 4Å; L489-F524 HydrophobicContact CG-CZ 3.82Å; L489-M597 WeakPolarHBondContact O-CE 3.49Å
490	N	91.7	Very high	96.2	Very high	65 Å²	65	22 Å²	22	35%	0.348	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	90.9	167.6	-174.5	-30.7	0	0	0	109.9	D487 G492 N493	D487-N490 CarbonylContact O-C 3.51Å; D487-N490 PolarHBondContact O-N 3.29Å; D487-N490 VanDerWaalsContact O-N 3.1Å; D487-N490 VanDerWaalsContact O-O 3.11Å; N490-G492 PolarHBondContact O-N 2.93Å; N490-G492 VanDerWaalsContact O-N 3.14Å; N490-G492 PolarHBondContact OD1-N 2.98Å; N490-N493 VanDerWaalsContact CG-ND2 3.27Å; N490-N493 PolarHBondContact ND2-ND2 2.8Å; N490-N493 WeakPolarHBondContact O-CB 3.12Å; N490-N493 PolarHBondContact O-N 2.92Å
491	L	94.6	Very high	96.2	Very high	26 Å²	26	24 Å²	24	14%	0.136	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-5.4	-169.3	-66.7	157.9	0	0	0	114.5	I486 D487 L596 M597 Q628 W629	I486-L491 HydrophobicContact CG2-CB 4.41Å; I486-L491 HydrophobicContact CG2-CD2 3.83Å; D487-L491 WeakPolarHBondContact O-CA 3.13Å; D487-L491 PolarHBondContact O-N 2.87Å; L491-L596 HydrophobicContact CD1-CB 3.27Å; L491-L596 HydrophobicContact CD1-CD1 3.88Å; L491-L596 HydrophobicContact CD1-CG 4.22Å; L491-M597 HydrophobicContact CD1-SD 4.39Å; L491-Q628 HydrophobicContact CB-CB 4.22Å; L491-Q628 HydrophobicContact CB-CG 4.07Å; L491-W629 PolarHBondContact O-N 2.92Å
492	G	95.6	Very high	96.1	Very high	24 Å²	24	25.4 Å²	25.4	25%	0.247	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	-23.7	167.1	0	0	0	0	0	112.9	N490 D627 W629	N490-G492 PolarHBondContact O-N 2.93Å; N490-G492 VanDerWaalsContact O-N 3.14Å; N490-G492 PolarHBondContact OD1-N 2.98Å; G492-D627 WeakPolarHBondContact CA-O 3.43Å; G492-D627 PolarHBondContact N-O 3.04Å; G492-W629 PolarHBondContact O-NE1 2.84Å
493	N	95.8	Very high	95.9	Very high	53 Å²	53	24.7 Å²	24.7	28%	0.283	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	136.3	179.9	-69.9	-35.8	0	0	0	112.3	I486 D487 N490 T547	I486-N493 WeakPolarHBondContact CA-O 3.36Å; D487-N493 HydrophobicContact CB-CB 4.38Å; D487-N493 PolarHBondContact N-O 2.67Å; D487-N493 VanDerWaalsContact N-O 3.1Å; N490-N493 VanDerWaalsContact CG-ND2 3.27Å; N490-N493 PolarHBondContact ND2-ND2 2.8Å; N490-N493 WeakPolarHBondContact O-CB 3.12Å; N490-N493 PolarHBondContact O-N 2.92Å; N493-T547 PolarHBondContact OD1-OG1 3.49Å
494	I	97.7	Very high	95.6	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.4	156.5	-65.9	162.5	0	0	0	107.3	E484 A485 I486 L534 C539 I544 L546 T547 W629	E484-I494 HydrophobicContact CB-CG2 4.01Å; A485-I494 CarbonylContact O-C 3.53Å; A485-I494 WeakPolarHBondContact O-CA 3.49Å; I486-I494 HydrophobicContact CG1-CG1 3.88Å; I494-L534 HydrophobicContact CD1-CD1 3.85Å; I494-L534 HydrophobicContact CG1-CD1 4.25Å; I494-L534 HydrophobicContact CG2-CD1 3.94Å; I494-C539 WeakPolarHBondContact CG2-SG 3.5Å; I494-I544 HydrophobicContact CD1-CD1 4.2Å; I494-I544 HydrophobicContact CD1-CG2 4.43Å; I494-L546 HydrophobicContact CG2-CD1 4.48Å; I494-T547 PolarHBondContact O-N 3.13Å; I494-W629 HydrophobicContact CD1-CD2 4.28Å; I494-W629 HydrophobicContact CD1-CG 4.25Å
495	C	97.4	Very high	95.3	Very high	4 Å²	4	35.2 Å²	35.2	3%	0.027	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	161.2	-170.2	-58.4	0	0	0	0	112.3	E484 A485 I512 T547	E484-C495 CarbonylContact C-O 3.59Å; E484-C495 WeakPolarHBondContact CA-O 3.32Å; A485-C495 PolarHBondContact N-O 2.85Å; A485-C495 PolarHBondContact O-N 2.91Å; C495-I512 HydrophobicContact CB-CD1 4.22Å; C495-I512 HydrophobicContact CB-CG2 3.59Å; C495-T547 VanDerWaalsContact CA-O 3.3Å; C495-T547 WeakPolarHBondContact CA-O 3.18Å; C495-T547 VanDerWaalsContact SG-CB 3.57Å
496	V	97.9	Very high	95.1	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	133.3	161.8	175.4	0	0	0	0	109.3	D513 L546 T547 P549 F557 W559 Y562	V496-D513 HydrophobicContact CB-CB 4.33Å; V496-D513 HydrophobicContact CG1-CB 3.84Å; V496-D513 WeakPolarHBondContact CG1-OD2 3.38Å; V496-D513 PolarHBondContact O-N 3.47Å; V496-L546 HydrophobicContact CG2-CD1 4.21Å; V496-L546 HydrophobicContact CG2-CD2 3.89Å; V496-L546 HydrophobicContact CG2-CG 4.1Å; V496-T547 PolarHBondContact N-O 3.15Å; V496-P549 HydrophobicContact CB-CG 3.9Å; V496-P549 HydrophobicContact CG1-CG 3.75Å; V496-P549 HydrophobicContact CG2-CG 4.4Å; V496-F557 HydrophobicContact CG2-CE1 4.14Å; V496-F557 HydrophobicContact CG2-CE2 4.19Å; V496-F557 HydrophobicContact CG2-CZ 3.62Å; V496-W559 HydrophobicContact CB-CH2 4.24Å; V496-W559 HydrophobicContact CB-CZ2 4.47Å; V496-W559 HydrophobicContact CG1-CH2 3.66Å; V496-W559 HydrophobicContact CG1-CZ2 4.34Å; V496-W559 HydrophobicContact CG1-CZ3 4.15Å; V496-W559 HydrophobicContact CG2-CH2 4.07Å; V496-W559 HydrophobicContact CG2-CZ2 3.91Å; V496-Y562 HydrophobicContact CG1-CD1 4.16Å; V496-Y562 HydrophobicContact CG1-CE1 3.64Å
497	A	97.6	Very high	95.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	159	-171.8	0	0	0	0	0	113.8	K482 L483 A485 V510 G511 I512 D513	K482-A497 CarbonylContact C-O 3.59Å; K482-A497 WeakPolarHBondContact CA-O 3.46Å; L483-A497 HydrophobicContact CD1-CB 3.92Å; L483-A497 PolarHBondContact N-O 2.96Å; L483-A497 PolarHBondContact O-N 3.02Å; L483-A497 VanDerWaalsContact O-O 3.13Å; A485-A497 HydrophobicContact CB-CB 3.72Å; A497-V510 HydrophobicContact CB-CG1 3.87Å; A497-G511 CarbonylContact C-O 3.5Å; A497-G511 VanDerWaalsContact CA-O 3.26Å; A497-G511 WeakPolarHBondContact CA-O 3.25Å; A497-G511 VanDerWaalsContact CB-O 3.25Å; A497-G511 WeakPolarHBondContact CB-O 3.41Å; A497-I512 HydrophobicContact CB-CD1 3.96Å; A497-D513 WeakPolarHBondContact CA-OD1 3.47Å
498	T	97.4	Very high	95.3	Very high	8 Å²	8	35.5 Å²	35.5	5%	0.049	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	136.6	-175.5	-60.1	0	0	0	0	112	K482 H500 V510 G511 D513	K482-T498 VanDerWaalsContact CD-OG1 3.28Å; K482-T498 WeakPolarHBondContact CD-OG1 3.26Å; K482-T498 PolarHBondContact NZ-OG1 2.96Å; T498-H500 PolarHBondContact O-CD2 2.93Å; T498-H500 PolarHBondContact O-N 3.05Å; T498-V510 VanDerWaalsContact O-CA 3.3Å; T498-V510 WeakPolarHBondContact O-CA 3.35Å; T498-G511 PolarHBondContact N-O 3.39Å; T498-G511 PolarHBondContact O-N 3.31Å; T498-D513 WeakPolarHBondContact CB-OD1 3.19Å; T498-D513 PolarHBondContact N-OD1 3.31Å; T498-D513 VanDerWaalsContact OG1-CG 3.29Å; T498-D513 PolarHBondContact OG1-OD1 2.87Å; T498-D513 PolarHBondContact OG1-OD2 3.5Å
499	V	98.1	Very high	95.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	108.3	165.9	-179.3	0	0	0	0	109	F477 E479 G480 M481 L483 V502 L508	F477-V499 HydrophobicContact CD1-CG2 4.07Å; E479-V499 WeakPolarHBondContact CA-O 3.37Å; G480-V499 PolarHBondContact N-O 3.32Å; M481-V499 HydrophobicContact CB-CG2 4.36Å; M481-V499 PolarHBondContact O-N 3.38Å; L483-V499 HydrophobicContact CD2-CG2 3.58Å; V499-V502 HydrophobicContact CG1-CG2 4.21Å; V499-L508 HydrophobicContact CG1-CD2 4.39Å
500	H	95.9	Very high	96	Very high	42 Å²	42	28.9 Å²	28.9	19%	0.194	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	-26	178.7	-82.4	-87	0	0	0	113.6	T498 M509 E516 W523	T498-H500 PolarHBondContact O-CD2 2.93Å; T498-H500 PolarHBondContact O-N 3.05Å; H500-M509 PolarHBondContact N-O 2.77Å; H500-E516 IonicContact CD2-OE1 3.95Å; H500-E516 IonicContact CE1-OE1 2.71Å; H500-E516 PolarHBondContact CE1-OE1 2.77Å; H500-E516 IonicContact CE1-OE2 2.7Å; H500-E516 PolarHBondContact CE1-OE2 3.1Å; H500-E516 IonicContact NE2-OE1 2.78Å; H500-E516 PolarHBondContact NE2-OE1 3.16Å; H500-E516 IonicContact NE2-OE2 2.67Å; H500-E516 PolarHBondContact NE2-OE2 3.1Å; H500-W523 HydrophobicContact CB-CD2 3.7Å; H500-W523 VanDerWaalsContact CB-CE2 3.49Å; H500-W523 HydrophobicContact CB-CE3 3.97Å; H500-W523 HydrophobicContact CB-CG 4.3Å; H500-W523 HydrophobicContact CB-CH2 3.9Å; H500-W523 HydrophobicContact CB-CZ2 3.62Å; H500-W523 HydrophobicContact CB-CZ3 4.07Å; H500-W523 AromaticContact CD2-CD1 3.96Å; H500-W523 AromaticContact CD2-NE1 3.55Å; H500-W523 AromaticContact CE1-NE1 3.74Å; H500-W523 AromaticContact CG-CE2 3.39Å; H500-W523 AromaticContact CG-CZ2 3.57Å; H500-W523 AromaticContact CG-NE1 3.4Å; H500-W523 AromaticContact ND1-CE2 3.5Å; H500-W523 AromaticContact ND1-CZ2 3.28Å; H500-W523 VanDerWaalsContact ND1-CZ2 3.28Å; H500-W523 WeakPolarHBondContact ND1-CZ2 3.4Å; H500-W523 AromaticContact ND1-NE1 3.56Å; H500-W523 AromaticContact NE2-NE1 3.74Å
501	K	95.8	Very high	96.1	Very high	79 Å²	79	25.8 Å²	25.8	34%	0.343	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	138.4	178.1	-166.4	-178.4	175.9	-165.2	0	112.7	G436 E479 L503 L508 M509	G436-K501 PolarHBondContact O-NZ 2.81Å; G436-K501 VanDerWaalsContact O-NZ 3.1Å; E479-K501 WeakPolarHBondContact OE1-CA 3.43Å; K501-L503 HydrophobicContact CD-CD2 3.75Å; K501-L503 HydrophobicContact CG-CD2 4.09Å; K501-L508 CarbonylContact O-C 3.36Å; K501-L508 WeakPolarHBondContact O-CA 3.48Å; K501-M509 HydrophobicContact CB-CB 3.85Å; K501-M509 HydrophobicContact CB-CG 3.87Å; K501-M509 HydrophobicContact CD-CG 4.38Å; K501-M509 PolarHBondContact N-O 2.88Å; K501-M509 PolarHBondContact O-N 3.25Å
502	V	96.6	Very high	96.1	Very high	41 Å²	41	24.9 Å²	24.9	25%	0.248	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	126.5	170.2	-176.8	0	0	0	0	110.2	M472 F476 F477 E479 V499 L508	M472-V502 HydrophobicContact CE-CG1 3.86Å; F476-V502 HydrophobicContact CD1-CG1 4.13Å; F476-V502 HydrophobicContact CE1-CG1 3.98Å; F477-V502 WeakPolarHBondContact O-CG2 3.39Å; E479-V502 HydrophobicContact CG-CG2 4.25Å; E479-V502 PolarHBondContact OE1-N 3.05Å; V499-V502 HydrophobicContact CG1-CG2 4.21Å; V502-L508 HydrophobicContact CB-CD2 4.49Å; V502-L508 HydrophobicContact CG1-CD2 4.23Å; V502-L508 HydrophobicContact CG2-CD2 4.16Å
503	L	95.1	Very high	96	Very high	6 Å²	6	24.1 Å²	24.1	3%	0.031	12%	0.123	C	C	.	.			trans	-107	167.1	178.4	-58.8	-174.5	0	0	0	111.3	V435 G436 H437 M472 K501 Y507 M509	V435-L503 HydrophobicContact CG2-CD1 4.49Å; G436-L503 WeakPolarHBondContact O-CD2 3.39Å; H437-L503 HydrophobicContact CB-CD1 4.02Å; M472-L503 WeakPolarHBondContact CE-O 3.48Å; K501-L503 HydrophobicContact CD-CD2 3.75Å; K501-L503 HydrophobicContact CG-CD2 4.09Å; L503-Y507 WeakPolarHBondContact CA-O 3.2Å; L503-Y507 WeakPolarHBondContact CB-O 3.34Å; L503-Y507 PolarHBondContact N-O 3.32Å; L503-M509 HydrophobicContact CD1-CG 4.2Å; L503-M509 HydrophobicContact CD1-SD 3.79Å; L503-M509 HydrophobicContact CG-CG 4.38Å
504	L	91.6	Very high	95.5	Very high	106 Å²	106	23.3 Å²	23.3	56%	0.555	13%	0.128	S	C	*	.	G	3₁₀ helix	trans	-71	166.5	176.5	-59	172.1	0	0	0	111.6	V435 G506 Y507	V435-L504 PolarHBondContact O-N 2.95Å; L504-G506 PolarHBondContact O-N 2.98Å; L504-G506 VanDerWaalsContact O-N 3.11Å; L504-Y507 PolarHBondContact O-N 3.39Å
505	D	91.4	Very high	94.5	Very high	115 Å²	115	26 Å²	26	62%	0.615	14%	0.144	S	C	*	.	G	3₁₀ helix	trans	52.3	28.4	-177.1	-69.2	-16	0	0	0	114.5	V435 Y507 H527	V435-D505 HydrophobicContact CG1-CB 4.4Å; D505-Y507 HydrophobicContact CB-CD2 4.43Å; D505-H527 PolarHBondContact O-CD2 2.87Å; D505-H527 PolarHBondContact O-NE2 2.97Å
506	G	93.9	Very high	92.9	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.01	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	83	11.5	172.9	0	0	0	0	0	115.3	M472 L504 H527 A528	M472-G506 PolarHBondContact SD-N 3.3Å; M472-G506 VanDerWaalsContact SD-N 3.36Å; L504-G506 PolarHBondContact O-N 2.98Å; L504-G506 VanDerWaalsContact O-N 3.11Å; G506-H527 VanDerWaalsContact C-CD2 3.47Å; G506-H527 PolarHBondContact O-CD2 3.24Å; G506-H527 VanDerWaalsContact O-CD2 3.27Å; G506-A528 VanDerWaalsContact O-CB 3.28Å; G506-A528 WeakPolarHBondContact O-CB 3.17Å; G506-A528 PolarHBondContact O-N 3.47Å
507	Y	97.9	Very high	91.2	Very high	27 Å²	27	33.6 Å²	33.6	11%	0.106	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	154.8	174.1	-69.4	-90.4	0	0	0	112.2	W431 V435 P467 L503 L504 D505 Y526 H527	W431-Y507 AromaticContact CE2-CZ 3.94Å; W431-Y507 AromaticContact CZ2-CD1 3.81Å; W431-Y507 HydrophobicContact CZ2-CD1 3.81Å; W431-Y507 HydrophobicContact CZ2-CD2 4.14Å; W431-Y507 AromaticContact CZ2-CE1 3.6Å; W431-Y507 HydrophobicContact CZ2-CE1 3.6Å; W431-Y507 AromaticContact CZ2-CE2 3.95Å; W431-Y507 HydrophobicContact CZ2-CE2 3.95Å; W431-Y507 HydrophobicContact CZ2-CG 4.06Å; W431-Y507 AromaticContact CZ2-CZ 3.66Å; W431-Y507 AromaticContact NE1-CE2 3.6Å; W431-Y507 AromaticContact NE1-CZ 3.63Å; V435-Y507 HydrophobicContact CB-CD2 4.42Å; V435-Y507 HydrophobicContact CG1-CD2 3.96Å; V435-Y507 HydrophobicContact CG1-CE2 4.17Å; P467-Y507 WeakPolarHBondContact CG-OH 3.34Å; L503-Y507 WeakPolarHBondContact CA-O 3.2Å; L503-Y507 WeakPolarHBondContact CB-O 3.34Å; L503-Y507 PolarHBondContact N-O 3.32Å; L504-Y507 PolarHBondContact O-N 3.39Å; D505-Y507 HydrophobicContact CB-CD2 4.43Å; Y507-Y526 CarbonylContact C-O 3.58Å; Y507-Y526 WeakPolarHBondContact CA-O 3.41Å; Y507-H527 HydrophobicContact CD1-CB 3.96Å; Y507-H527 HydrophobicContact CE1-CB 3.89Å
508	L	98.1	Very high	89.4	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	139.6	-174.6	-55.6	171.9	0	0	0	108.5	F476 F477 V499 K501 V502 V510 C525 Y526 A528 I533	F476-L508 HydrophobicContact CE1-CD2 4.16Å; F477-L508 HydrophobicContact CB-CD1 4.3Å; F477-L508 HydrophobicContact CB-CD2 3.75Å; F477-L508 HydrophobicContact CD1-CD1 4.13Å; F477-L508 HydrophobicContact CD2-CD1 3.7Å; F477-L508 HydrophobicContact CD2-CD2 4.32Å; F477-L508 HydrophobicContact CE1-CD1 4.35Å; F477-L508 HydrophobicContact CE2-CD1 3.95Å; F477-L508 HydrophobicContact CG-CD1 3.8Å; F477-L508 HydrophobicContact CG-CD2 4.16Å; F477-L508 HydrophobicContact CZ-CD1 4.26Å; V499-L508 HydrophobicContact CG1-CD2 4.39Å; K501-L508 CarbonylContact O-C 3.36Å; K501-L508 WeakPolarHBondContact O-CA 3.48Å; V502-L508 HydrophobicContact CB-CD2 4.49Å; V502-L508 HydrophobicContact CG1-CD2 4.23Å; V502-L508 HydrophobicContact CG2-CD2 4.16Å; L508-V510 HydrophobicContact CB-CG2 4.19Å; L508-C525 WeakPolarHBondContact O-CA 3.47Å; L508-Y526 PolarHBondContact N-O 2.72Å; L508-Y526 PolarHBondContact O-N 3.14Å; L508-A528 HydrophobicContact CD1-CB 4.3Å; L508-I533 HydrophobicContact CD1-CD1 3.97Å
509	M	97.5	Very high	88.1	Confident	8 Å²	8	47.4 Å²	47.4	4%	0.039	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	125.3	162.3	-55	-54.6	-58.7	0	0	108.5	H437 H500 K501 L503 W523 F524 C525	H437-M509 VanDerWaalsContact CD2-SD 3.53Å; H500-M509 PolarHBondContact N-O 2.77Å; K501-M509 HydrophobicContact CB-CB 3.85Å; K501-M509 HydrophobicContact CB-CG 3.87Å; K501-M509 HydrophobicContact CD-CG 4.38Å; K501-M509 PolarHBondContact N-O 2.88Å; K501-M509 PolarHBondContact O-N 3.25Å; L503-M509 HydrophobicContact CD1-CG 4.2Å; L503-M509 HydrophobicContact CD1-SD 3.79Å; L503-M509 HydrophobicContact CG-CG 4.38Å; M509-W523 HydrophobicContact CB-CB 4.27Å; M509-W523 HydrophobicContact CB-CE3 4.2Å; M509-W523 HydrophobicContact CE-CB 4.02Å; M509-W523 VanDerWaalsContact CE-O 3.3Å; M509-W523 WeakPolarHBondContact CE-O 3.21Å; M509-F524 CarbonylContact C-O 3.55Å; M509-F524 WeakPolarHBondContact CA-O 3.17Å; M509-C525 HydrophobicContact CE-CB 4.09Å; M509-C525 HydrophobicContact SD-CB 3.83Å
510	V	97.4	Very high	87.1	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	129.7	-176.5	179.8	0	0	0	0	109	L483 A485 A497 T498 L508 W523 F524 Y526 I533	L483-V510 HydrophobicContact CD1-CG1 4.19Å; A485-V510 HydrophobicContact CB-CG1 4.45Å; A497-V510 HydrophobicContact CB-CG1 3.87Å; T498-V510 VanDerWaalsContact O-CA 3.3Å; T498-V510 WeakPolarHBondContact O-CA 3.35Å; L508-V510 HydrophobicContact CB-CG2 4.19Å; V510-W523 CarbonylContact O-C 3.53Å; V510-F524 PolarHBondContact N-O 3Å; V510-F524 PolarHBondContact O-N 3.37Å; V510-Y526 HydrophobicContact CB-CD2 4.17Å; V510-Y526 HydrophobicContact CG2-CD2 4.2Å; V510-I533 HydrophobicContact CG2-CG2 4.42Å
511	G	95.4	Very high	86.4	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	152.5	172.9	0	0	0	0	0	110.6	A497 T498	A497-G511 CarbonylContact C-O 3.5Å; A497-G511 VanDerWaalsContact CA-O 3.26Å; A497-G511 WeakPolarHBondContact CA-O 3.25Å; A497-G511 VanDerWaalsContact CB-O 3.25Å; A497-G511 WeakPolarHBondContact CB-O 3.41Å; T498-G511 PolarHBondContact N-O 3.39Å; T498-G511 PolarHBondContact O-N 3.31Å
512	I	94.8	Very high	86	Confident	7 Å²	7	44.1 Å²	44.1	4%	0.036	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	124.7	172.1	-57.5	-53.7	0	0	0	108.5	A485 C495 A497 G514 T515 E516 F524	A485-I512 HydrophobicContact CB-CD1 4.17Å; C495-I512 HydrophobicContact CB-CD1 4.22Å; C495-I512 HydrophobicContact CB-CG2 3.59Å; A497-I512 HydrophobicContact CB-CD1 3.96Å; I512-G514 PolarHBondContact O-N 3.38Å; I512-T515 HydrophobicContact CB-CG2 4.27Å; I512-T515 HydrophobicContact CG2-CG2 4.08Å; I512-T515 PolarHBondContact O-N 3.02Å; I512-T515 VanDerWaalsContact O-N 3.14Å; I512-T515 PolarHBondContact O-OG1 2.84Å; I512-E516 WeakPolarHBondContact O-CG 3.46Å; I512-F524 HydrophobicContact CG1-CD2 4.45Å; I512-F524 HydrophobicContact CG1-CE2 4Å
513	D	93	Very high	85.8	Confident	7 Å²	7	45.2 Å²	45.2	4%	0.037	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	120.8	-169.1	-75	25.7	0	0	0	110.4	K482 V496 A497 T498 P549 Y562	K482-D513 IonicContact NZ-OD1 3.79Å; K482-D513 IonicContact NZ-OD2 2.73Å; K482-D513 PolarHBondContact NZ-OD2 2.89Å; V496-D513 HydrophobicContact CB-CB 4.33Å; V496-D513 HydrophobicContact CG1-CB 3.84Å; V496-D513 WeakPolarHBondContact CG1-OD2 3.38Å; V496-D513 PolarHBondContact O-N 3.47Å; A497-D513 WeakPolarHBondContact CA-OD1 3.47Å; T498-D513 WeakPolarHBondContact CB-OD1 3.19Å; T498-D513 PolarHBondContact N-OD1 3.31Å; T498-D513 VanDerWaalsContact OG1-CG 3.29Å; T498-D513 PolarHBondContact OG1-OD1 2.87Å; T498-D513 PolarHBondContact OG1-OD2 3.5Å; D513-P549 HydrophobicContact CB-CB 4.12Å; D513-P549 HydrophobicContact CB-CG 3.71Å; D513-P549 VanDerWaalsContact O-CA 3.32Å; D513-P549 WeakPolarHBondContact O-CA 3.43Å; D513-P549 WeakPolarHBondContact O-CB 3.45Å; D513-Y562 WeakPolarHBondContact OD2-CE1 3.3Å; D513-Y562 PolarHBondContact OD2-OH 3.05Å
514	G	84.9	Confident	85.8	Confident	37 Å²	37	45.5 Å²	45.5	38%	0.381	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	4.5	-178.9	0	0	0	0	0	115.7	I512 R550	I512-G514 PolarHBondContact O-N 3.38Å; G514-R550 VanDerWaalsContact O-CD 3.24Å; G514-R550 WeakPolarHBondContact O-CD 3.47Å; G514-R550 WeakPolarHBondContact O-CG 3.49Å
515	T	76.3	Confident	86.1	Confident	56 Å²	56	42 Å²	42	34%	0.344	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-20.4	156.1	65.4	0	0	0	0	112.6	I512 L517 D522	I512-T515 HydrophobicContact CB-CG2 4.27Å; I512-T515 HydrophobicContact CG2-CG2 4.08Å; I512-T515 PolarHBondContact O-N 3.02Å; I512-T515 VanDerWaalsContact O-N 3.14Å; I512-T515 PolarHBondContact O-OG1 2.84Å; T515-L517 PolarHBondContact O-N 2.61Å; T515-D522 PolarHBondContact OG1-OD2 3.01Å; T515-D522 VanDerWaalsContact OG1-OD2 3.04Å
516	E	63.6	Low	86.4	Confident	66 Å²	66	38 Å²	38	31%	0.308	21%	0.209	S	C	.	.			trans	-46.8	120.2	-164.3	-57.8	-169.1	-175.8	0	0	114.3	H500 I512 D522	H500-E516 IonicContact CD2-OE1 3.95Å; H500-E516 IonicContact CE1-OE1 2.71Å; H500-E516 PolarHBondContact CE1-OE1 2.77Å; H500-E516 IonicContact CE1-OE2 2.7Å; H500-E516 PolarHBondContact CE1-OE2 3.1Å; H500-E516 IonicContact NE2-OE1 2.78Å; H500-E516 PolarHBondContact NE2-OE1 3.16Å; H500-E516 IonicContact NE2-OE2 2.67Å; H500-E516 PolarHBondContact NE2-OE2 3.1Å; I512-E516 WeakPolarHBondContact O-CG 3.46Å; E516-D522 VanDerWaalsContact CA-OD2 3.3Å; E516-D522 WeakPolarHBondContact CA-OD2 3.33Å
517	L	63.6	Low	86.6	Confident	100 Å²	100	38.8 Å²	38.8	52%	0.524	21%	0.213	S	C	.	.			trans	-79.5	128.7	159.8	-66.9	170.2	0	0	0	107.4	T515 N519 G520 A521 D522	T515-L517 PolarHBondContact O-N 2.61Å; L517-N519 VanDerWaalsContact CB-OD1 3.31Å; L517-N519 WeakPolarHBondContact CB-OD1 3.49Å; L517-N519 PolarHBondContact O-N 3.46Å; L517-G520 PolarHBondContact O-N 3.19Å; L517-A521 HydrophobicContact CD1-CB 4.29Å; L517-D522 PolarHBondContact N-OD1 3.17Å
518	N	59.7	Low	86.5	Confident	177 Å²	177	37.6 Å²	37.6	95%	0.947	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	14	-177.1	-68.3	-19.9	0	0	0	115.6
519	N	68.9	Low	86.4	Confident	120 Å²	120	38.4 Å²	38.4	64%	0.642	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-120.4	-1.9	177.6	63	12.9	0	0	0	113.6	L517 A521	L517-N519 VanDerWaalsContact CB-OD1 3.31Å; L517-N519 WeakPolarHBondContact CB-OD1 3.49Å; L517-N519 PolarHBondContact O-N 3.46Å; N519-A521 VanDerWaalsContact C-N 3.34Å; N519-A521 PolarHBondContact O-N 3.12Å; N519-A521 WeakPolarHBondContact OD1-CB 3.4Å; N519-A521 PolarHBondContact OD1-N 3.44Å
520	G	77.4	Confident	86.3	Confident	7 Å²	7	39.1 Å²	39.1	7%	0.072	22%	0.22	C	C	.	.	S	Bend	trans	69.3	24.4	-179.3	0	0	0	0	0	114.8	S384 L517 D522	S384-G520 WeakPolarHBondContact CB-O 3.3Å; S384-G520 PolarHBondContact OG-O 2.99Å; L517-G520 PolarHBondContact O-N 3.19Å; G520-D522 VanDerWaalsContact C-N 3.31Å
521	A	81.9	Confident	86.2	Confident	28 Å²	28	41.3 Å²	41.3	23%	0.231	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-27.1	177	0	0	0	0	0	113.3	S384 L517 N519	S384-A521 PolarHBondContact OG-O 3.16Å; L517-A521 HydrophobicContact CD1-CB 4.29Å; N519-A521 VanDerWaalsContact C-N 3.34Å; N519-A521 PolarHBondContact O-N 3.12Å; N519-A521 WeakPolarHBondContact OD1-CB 3.4Å; N519-A521 PolarHBondContact OD1-N 3.44Å
522	D	86.6	Confident	86.2	Confident	17 Å²	17	41.5 Å²	41.5	9%	0.091	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	6.1	-177.6	65.6	-50.4	0	0	0	114.3	T515 E516 L517 G520 F524	T515-D522 PolarHBondContact OG1-OD2 3.01Å; T515-D522 VanDerWaalsContact OG1-OD2 3.04Å; E516-D522 VanDerWaalsContact CA-OD2 3.3Å; E516-D522 WeakPolarHBondContact CA-OD2 3.33Å; L517-D522 PolarHBondContact N-OD1 3.17Å; G520-D522 VanDerWaalsContact C-N 3.31Å; D522-F524 VanDerWaalsContact O-CD2 3.25Å; D522-F524 WeakPolarHBondContact O-CD2 3.36Å; D522-F524 WeakPolarHBondContact O-CE2 3.03Å; D522-F524 PolarHBondContact O-N 3.08Å
523	W	93.5	Very high	86.4	Confident	65 Å²	65	41.3 Å²	41.3	25%	0.246	23%	0.231	C	C	.	.			trans	-70.4	127	174.5	-61.2	-12.7	0	0	0	111.9	S384 H500 M509 V510	S384-W523 WeakPolarHBondContact CA-O 3.44Å; S384-W523 WeakPolarHBondContact CB-O 3.22Å; S384-W523 PolarHBondContact N-O 3.03Å; H500-W523 HydrophobicContact CB-CD2 3.7Å; H500-W523 VanDerWaalsContact CB-CE2 3.49Å; H500-W523 HydrophobicContact CB-CE3 3.97Å; H500-W523 HydrophobicContact CB-CG 4.3Å; H500-W523 HydrophobicContact CB-CH2 3.9Å; H500-W523 HydrophobicContact CB-CZ2 3.62Å; H500-W523 HydrophobicContact CB-CZ3 4.07Å; H500-W523 AromaticContact CD2-CD1 3.96Å; H500-W523 AromaticContact CD2-NE1 3.55Å; H500-W523 AromaticContact CE1-NE1 3.74Å; H500-W523 AromaticContact CG-CE2 3.39Å; H500-W523 AromaticContact CG-CZ2 3.57Å; H500-W523 AromaticContact CG-NE1 3.4Å; H500-W523 AromaticContact ND1-CE2 3.5Å; H500-W523 AromaticContact ND1-CZ2 3.28Å; H500-W523 VanDerWaalsContact ND1-CZ2 3.28Å; H500-W523 WeakPolarHBondContact ND1-CZ2 3.4Å; H500-W523 AromaticContact ND1-NE1 3.56Å; H500-W523 AromaticContact NE2-NE1 3.74Å; M509-W523 HydrophobicContact CB-CB 4.27Å; M509-W523 HydrophobicContact CB-CE3 4.2Å; M509-W523 HydrophobicContact CE-CB 4.02Å; M509-W523 VanDerWaalsContact CE-O 3.3Å; M509-W523 WeakPolarHBondContact CE-O 3.21Å; V510-W523 CarbonylContact O-C 3.53Å
524	F	94.9	Very high	86.6	Confident	12 Å²	12	41.6 Å²	41.6	5%	0.053	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	144.6	179.4	-52.7	-85.6	0	0	0	111.5	V383 P488 L489 M509 V510 I512 D522 Y526	V383-F524 HydrophobicContact CB-CD1 3.8Å; V383-F524 HydrophobicContact CB-CE1 3.88Å; V383-F524 HydrophobicContact CG1-CD1 4.23Å; V383-F524 HydrophobicContact CG1-CE1 3.92Å; V383-F524 HydrophobicContact CG2-CD1 3.69Å; V383-F524 HydrophobicContact CG2-CE1 3.56Å; V383-F524 HydrophobicContact CG2-CG 4.44Å; V383-F524 HydrophobicContact CG2-CZ 4.17Å; P488-F524 HydrophobicContact CB-CD1 3.67Å; P488-F524 HydrophobicContact CB-CE1 3.62Å; P488-F524 HydrophobicContact CB-CG 4.39Å; P488-F524 HydrophobicContact CB-CZ 4.35Å; P488-F524 HydrophobicContact CG-CB 4.15Å; P488-F524 HydrophobicContact CG-CD1 3.42Å; P488-F524 VanDerWaalsContact CG-CD1 3.42Å; P488-F524 HydrophobicContact CG-CD2 4.16Å; P488-F524 HydrophobicContact CG-CE1 3.73Å; P488-F524 HydrophobicContact CG-CE2 4.45Å; P488-F524 HydrophobicContact CG-CG 3.64Å; P488-F524 HydrophobicContact CG-CZ 4.25Å; L489-F524 HydrophobicContact CD1-CE1 4.4Å; L489-F524 HydrophobicContact CD1-CZ 3.92Å; L489-F524 HydrophobicContact CD2-CE1 4.35Å; L489-F524 HydrophobicContact CG-CE1 4Å; L489-F524 HydrophobicContact CG-CZ 3.82Å; M509-F524 CarbonylContact C-O 3.55Å; M509-F524 WeakPolarHBondContact CA-O 3.17Å; V510-F524 PolarHBondContact N-O 3Å; V510-F524 PolarHBondContact O-N 3.37Å; I512-F524 HydrophobicContact CG1-CD2 4.45Å; I512-F524 HydrophobicContact CG1-CE2 4Å; D522-F524 VanDerWaalsContact O-CD2 3.25Å; D522-F524 WeakPolarHBondContact O-CD2 3.36Å; D522-F524 WeakPolarHBondContact O-CE2 3.03Å; D522-F524 PolarHBondContact O-N 3.08Å; F524-Y526 HydrophobicContact CB-CE2 4.46Å
525	C	97.4	Very high	87.2	Confident	31 Å²	31	40.6 Å²	40.6	21%	0.209	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	115.8	177.1	-174.7	0	0	0	0	111.7	H437 L508 M509	H437-C525 PolarHBondContact CD2-SG 3.07Å; H437-C525 VanDerWaalsContact NE2-CB 3.28Å; H437-C525 WeakPolarHBondContact NE2-CB 3.44Å; L508-C525 WeakPolarHBondContact O-CA 3.47Å; M509-C525 HydrophobicContact CE-CB 4.09Å; M509-C525 HydrophobicContact SD-CB 3.83Å
526	Y	98	Very high	88.2	Confident	31 Å²	31	39.3 Å²	39.3	12%	0.122	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	145.8	172.6	-73.2	-55.3	0	0	0	111.7	I486 P488 Y507 L508 V510 F524 A532 I533	I486-Y526 PolarHBondContact O-OH 2.72Å; P488-Y526 VanDerWaalsContact CG-OH 3.25Å; P488-Y526 WeakPolarHBondContact CG-OH 3.44Å; Y507-Y526 CarbonylContact C-O 3.58Å; Y507-Y526 WeakPolarHBondContact CA-O 3.41Å; L508-Y526 PolarHBondContact N-O 2.72Å; L508-Y526 PolarHBondContact O-N 3.14Å; V510-Y526 HydrophobicContact CB-CD2 4.17Å; V510-Y526 HydrophobicContact CG2-CD2 4.2Å; F524-Y526 HydrophobicContact CB-CE2 4.46Å; Y526-A532 HydrophobicContact CD1-CB 4.26Å; Y526-A532 HydrophobicContact CE1-CB 3.5Å; Y526-A532 HydrophobicContact CE2-CB 4.43Å; Y526-I533 HydrophobicContact CD2-CG2 3.49Å; Y526-I533 VanDerWaalsContact CD2-CG2 3.49Å; Y526-I533 HydrophobicContact CE2-CG2 4.07Å; Y526-I533 HydrophobicContact CG-CG2 3.93Å
527	H	97.8	Very high	89.8	Confident	19 Å²	19	38.1 Å²	38.1	9%	0.088	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	144.7	164.1	-176.5	-101.5	0	0	0	110.1	P467 R468 D505 G506 Y507 S529 S530	P467-H527 HydrophobicContact CB-CB 4.5Å; P467-H527 WeakPolarHBondContact CB-ND1 3.29Å; R468-H527 PolarHBondContact O-CE1 3.37Å; D505-H527 PolarHBondContact O-CD2 2.87Å; D505-H527 PolarHBondContact O-NE2 2.97Å; G506-H527 VanDerWaalsContact C-CD2 3.47Å; G506-H527 PolarHBondContact O-CD2 3.24Å; G506-H527 VanDerWaalsContact O-CD2 3.27Å; Y507-H527 HydrophobicContact CD1-CB 3.96Å; Y507-H527 HydrophobicContact CE1-CB 3.89Å; H527-S529 PolarHBondContact CE1-OG 2.96Å; H527-S529 WeakPolarHBondContact ND1-CB 3.26Å; H527-S529 PolarHBondContact ND1-N 3.48Å; H527-S529 VanDerWaalsContact ND1-N 3.17Å; H527-S529 PolarHBondContact ND1-OG 3.13Å; H527-S529 PolarHBondContact O-N 3.15Å; H527-S530 WeakPolarHBondContact O-CB 3.39Å; H527-S530 PolarHBondContact O-N 3.38Å
528	A	96.6	Very high	91.4	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.008	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-15	-178.8	0	0	0	0	0	115	V470 F476 F477 G506 L508	V470-A528 HydrophobicContact CG1-CB 4.23Å; V470-A528 HydrophobicContact CG2-CB 4.43Å; F476-A528 HydrophobicContact CE2-CB 4.08Å; F476-A528 HydrophobicContact CZ-CB 3.77Å; F477-A528 HydrophobicContact CD2-CB 4.14Å; F477-A528 HydrophobicContact CE2-CB 3.87Å; G506-A528 VanDerWaalsContact O-CB 3.28Å; G506-A528 WeakPolarHBondContact O-CB 3.17Å; G506-A528 PolarHBondContact O-N 3.47Å; L508-A528 HydrophobicContact CD1-CB 4.3Å
529	S	95.1	Very high	93.2	Very high	18 Å²	18	26.2 Å²	26.2	13%	0.126	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	7.8	172.8	83	0	0	0	0	114.7	H527 R613	H527-S529 PolarHBondContact CE1-OG 2.96Å; H527-S529 WeakPolarHBondContact ND1-CB 3.26Å; H527-S529 PolarHBondContact ND1-N 3.48Å; H527-S529 VanDerWaalsContact ND1-N 3.17Å; H527-S529 PolarHBondContact ND1-OG 3.13Å; H527-S529 PolarHBondContact O-N 3.15Å; S529-R613 PolarHBondContact O-NH1 3.27Å
530	S	96.3	Very high	94.4	Very high	23 Å²	23	27.9 Å²	27.9	16%	0.161	14%	0.143	C	C	.	.			trans	-59.9	155	179.1	-172.3	0	0	0	0	110.7	H527 A532	H527-S530 WeakPolarHBondContact O-CB 3.39Å; H527-S530 PolarHBondContact O-N 3.38Å; S530-A532 PolarHBondContact OG-N 3.36Å; S530-A532 VanDerWaalsContact OG-N 3.17Å
531	H	93.8	Very high	95.3	Very high	45 Å²	45	34.8 Å²	34.8	21%	0.208	17%	0.167	C	C	.	.	S	Bend	trans	-81.2	-23.5	169.5	62.8	-86	0	0	0	111.6	I533 L614 D631	H531-I533 VanDerWaalsContact C-N 3.3Å; H531-I533 PolarHBondContact O-N 3.37Å; H531-L614 HydrophobicContact CB-CD2 3.85Å; H531-D631 HydrophobicContact CB-CB 3.86Å; H531-D631 PolarHBondContact CD2-N 2.96Å
532	A	96.6	Very high	96	Very high	4 Å²	4	36.1 Å²	36.1	3%	0.033	17%	0.17	C	C	.	.	S	Bend	trans	-85.3	4.4	-174.4	0	0	0	0	0	114.5	A485 I486 Y526 S530	A485-A532 CarbonylContact C-O 3.59Å; A485-A532 WeakPolarHBondContact CA-O 3.32Å; A485-A532 WeakPolarHBondContact CB-O 3.36Å; I486-A532 HydrophobicContact CB-CB 4.05Å; I486-A532 HydrophobicContact CD1-CB 3.89Å; I486-A532 HydrophobicContact CG1-CB 4.14Å; I486-A532 PolarHBondContact N-O 3.16Å; Y526-A532 HydrophobicContact CD1-CB 4.26Å; Y526-A532 HydrophobicContact CE1-CB 3.5Å; Y526-A532 HydrophobicContact CE2-CB 4.43Å; S530-A532 PolarHBondContact OG-N 3.36Å; S530-A532 VanDerWaalsContact OG-N 3.17Å
533	I	97.9	Very high	96.4	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	136.5	166.2	60.2	169.9	0	0	0	108.9	F477 L483 A485 L508 V510 Y526 H531 F576	F477-I533 HydrophobicContact CE2-CD1 4.48Å; F477-I533 HydrophobicContact CZ-CD1 4.03Å; L483-I533 HydrophobicContact CD1-CB 4.21Å; L483-I533 HydrophobicContact CD1-CG2 4.14Å; A485-I533 HydrophobicContact CB-CG2 4.47Å; L508-I533 HydrophobicContact CD1-CD1 3.97Å; V510-I533 HydrophobicContact CG2-CG2 4.42Å; Y526-I533 HydrophobicContact CD2-CG2 3.49Å; Y526-I533 VanDerWaalsContact CD2-CG2 3.49Å; Y526-I533 HydrophobicContact CE2-CG2 4.07Å; Y526-I533 HydrophobicContact CG-CG2 3.93Å; H531-I533 VanDerWaalsContact C-N 3.3Å; H531-I533 PolarHBondContact O-N 3.37Å; I533-F576 HydrophobicContact CB-CD1 4.49Å; I533-F576 HydrophobicContact CB-CE1 4.17Å; I533-F576 HydrophobicContact CD1-CE1 4.43Å; I533-F576 HydrophobicContact CG1-CD1 4.21Å; I533-F576 HydrophobicContact CG1-CE1 4.26Å; I533-F576 WeakPolarHBondContact O-CD1 3.5Å
534	L	97.8	Very high	96.6	Very high	13 Å²	13	40.1 Å²	40.1	7%	0.068	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	143.4	-163.1	-61.5	163.2	0	0	0	109.7	E484 I494 F538 F576 L614	E484-L534 HydrophobicContact CB-CB 3.97Å; E484-L534 PolarHBondContact N-O 3.23Å; E484-L534 WeakPolarHBondContact O-CA 3.06Å; E484-L534 WeakPolarHBondContact O-CB 3.39Å; E484-L534 PolarHBondContact O-N 3.01Å; I494-L534 HydrophobicContact CD1-CD1 3.85Å; I494-L534 HydrophobicContact CG1-CD1 4.25Å; I494-L534 HydrophobicContact CG2-CD1 3.94Å; L534-F538 HydrophobicContact CB-CB 4.1Å; L534-F538 HydrophobicContact CB-CD1 4.31Å; L534-F538 HydrophobicContact CB-CG 4.14Å; L534-F538 HydrophobicContact CD1-CD1 3.71Å; L534-F538 HydrophobicContact CD1-CE1 3.87Å; L534-F538 HydrophobicContact CD1-CG 4.35Å; L534-F538 HydrophobicContact CD2-CD1 4.1Å; L534-F538 HydrophobicContact CD2-CD2 4.1Å; L534-F538 HydrophobicContact CD2-CE1 4.05Å; L534-F538 HydrophobicContact CD2-CE2 4.05Å; L534-F538 HydrophobicContact CD2-CG 4.13Å; L534-F538 HydrophobicContact CD2-CZ 4.03Å; L534-F538 HydrophobicContact CG-CD1 4.25Å; L534-F538 HydrophobicContact CG-CG 4.43Å; L534-F576 WeakPolarHBondContact O-CE1 3.4Å; L534-L614 HydrophobicContact CD1-CD1 4.17Å; L534-L614 HydrophobicContact CD2-CD1 4.14Å
535	P	97.6	Very high	96.6	Very high	15 Å²	15	45.4 Å²	45.4	10%	0.097	23%	0.229	C	C	.	.			trans	-70	147.2	176.6	28.9	-33.3	0	0	0	110.7	F538 A573 F576	P535-F538 WeakPolarHBondContact O-CB 3.5Å; P535-F538 PolarHBondContact O-N 3.31Å; P535-F538 VanDerWaalsContact O-N 3.11Å; P535-A573 HydrophobicContact CB-CB 3.98Å; P535-F576 HydrophobicContact CB-CD2 3.7Å; P535-F576 HydrophobicContact CB-CE2 3.78Å; P535-F576 HydrophobicContact CB-CG 4.22Å; P535-F576 HydrophobicContact CB-CZ 4.36Å; P535-F576 HydrophobicContact CG-CD2 4.24Å; P535-F576 HydrophobicContact CG-CG 4.32Å
536	I	97.9	Very high	96.6	Very high	30 Å²	30	45.3 Å²	45.3	15%	0.154	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	153	179.6	67.1	157.5	0	0	0	113.4	F538 R541 W559 L563 A570	I536-F538 PolarHBondContact O-N 3.47Å; I536-R541 PolarHBondContact O-NH2 3.36Å; I536-W559 HydrophobicContact CB-CD2 3.79Å; I536-W559 HydrophobicContact CB-CE3 4.27Å; I536-W559 HydrophobicContact CB-CG 4.07Å; I536-W559 HydrophobicContact CB-CZ2 4.15Å; I536-W559 HydrophobicContact CD1-CB 4.16Å; I536-W559 HydrophobicContact CD1-CD2 4.37Å; I536-W559 HydrophobicContact CD1-CG 4.21Å; I536-W559 HydrophobicContact CG2-CD2 3.82Å; I536-W559 HydrophobicContact CG2-CE3 3.82Å; I536-W559 HydrophobicContact CG2-CH2 3.69Å; I536-W559 HydrophobicContact CG2-CZ2 3.72Å; I536-W559 HydrophobicContact CG2-CZ3 3.77Å; I536-L563 HydrophobicContact CD1-CD1 4.11Å; I536-A570 HydrophobicContact CD1-CB 3.45Å; I536-A570 VanDerWaalsContact CD1-CB 3.45Å; I536-A570 HydrophobicContact CG1-CB 3.87Å; I536-A570 HydrophobicContact CG2-CB 4.22Å
537	N	96.7	Very high	96.5	Very high	40 Å²	40	46.2 Å²	46.2	21%	0.214	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	21.9	-168.9	-59.6	-84.6	0	0	0	113.5	E484 K540 R541	E484-N537 VanDerWaalsContact OE1-CA 3.28Å; E484-N537 WeakPolarHBondContact OE1-CA 3.23Å; E484-N537 PolarHBondContact OE1-N 3.12Å; N537-K540 HydrophobicContact CB-CB 4.33Å; N537-R541 VanDerWaalsContact O-CB 3.3Å; N537-R541 WeakPolarHBondContact O-CB 3.4Å; N537-R541 VanDerWaalsContact O-CG 3.26Å; N537-R541 WeakPolarHBondContact O-CG 3.36Å; N537-R541 PolarHBondContact O-N 3.17Å; N537-R541 VanDerWaalsContact O-N 3.08Å; N537-R541 PolarHBondContact O-NE 3.11Å
538	F	96.6	Very high	96.4	Very high	27 Å²	27	46.5 Å²	46.5	12%	0.118	24%	0.238	C	C	.	.	H	α-helix	trans	-67.9	-49.3	173.8	170.3	-86.1	0	0	0	109.7	E484 L534 P535 I536 K540 R541 N542 I544 V611 L614	E484-F538 PolarHBondContact OE1-N 3.06Å; E484-F538 WeakPolarHBondContact OE2-CA 3.3Å; E484-F538 VanDerWaalsContact OE2-CB 3.28Å; E484-F538 WeakPolarHBondContact OE2-CB 3.49Å; E484-F538 PolarHBondContact OE2-N 3.34Å; L534-F538 HydrophobicContact CB-CB 4.1Å; L534-F538 HydrophobicContact CB-CD1 4.31Å; L534-F538 HydrophobicContact CB-CG 4.14Å; L534-F538 HydrophobicContact CD1-CD1 3.71Å; L534-F538 HydrophobicContact CD1-CE1 3.87Å; L534-F538 HydrophobicContact CD1-CG 4.35Å; L534-F538 HydrophobicContact CD2-CD1 4.1Å; L534-F538 HydrophobicContact CD2-CD2 4.1Å; L534-F538 HydrophobicContact CD2-CE1 4.05Å; L534-F538 HydrophobicContact CD2-CE2 4.05Å; L534-F538 HydrophobicContact CD2-CG 4.13Å; L534-F538 HydrophobicContact CD2-CZ 4.03Å; L534-F538 HydrophobicContact CG-CD1 4.25Å; L534-F538 HydrophobicContact CG-CG 4.43Å; P535-F538 WeakPolarHBondContact O-CB 3.5Å; P535-F538 PolarHBondContact O-N 3.31Å; P535-F538 VanDerWaalsContact O-N 3.11Å; I536-F538 PolarHBondContact O-N 3.47Å; F538-K540 PolarHBondContact O-N 3.11Å; F538-R541 PolarHBondContact O-N 3.02Å; F538-N542 WeakPolarHBondContact CD2-ND2 3.35Å; F538-N542 WeakPolarHBondContact CE2-ND2 3.08Å; F538-N542 PolarHBondContact O-N 3.34Å; F538-N542 VanDerWaalsContact O-N 3.13Å; F538-N542 PolarHBondContact O-ND2 2.75Å; F538-I544 HydrophobicContact CD1-CD1 4.35Å; F538-I544 HydrophobicContact CE1-CD1 3.78Å; F538-V611 HydrophobicContact CE1-CG1 4.28Å; F538-V611 HydrophobicContact CE2-CG1 4.44Å; F538-V611 HydrophobicContact CZ-CG1 3.68Å; F538-L614 HydrophobicContact CE1-CD1 4.03Å; F538-L614 HydrophobicContact CZ-CD1 3.99Å
539	C	97.1	Very high	96.2	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56.3	-50.2	175.4	-77.3	0	0	0	0	111.8	E484 I494 R541 N542 D543 I544 L546	E484-C539 PolarHBondContact OE2-N 3.17Å; I494-C539 WeakPolarHBondContact CG2-SG 3.5Å; C539-R541 VanDerWaalsContact C-N 3.3Å; C539-R541 PolarHBondContact O-N 3.45Å; C539-N542 CarbonylContact O-C 2.99Å; C539-N542 PolarHBondContact O-N 3.38Å; C539-N542 VanDerWaalsContact O-N 3.11Å; C539-D543 PolarHBondContact O-N 2.89Å; C539-I544 HydrophobicContact CB-CB 3.96Å; C539-I544 WeakPolarHBondContact CB-O 3.43Å; C539-I544 PolarHBondContact O-N 3.03Å; C539-L546 HydrophobicContact CB-CB 3.97Å; C539-L546 HydrophobicContact CB-CD1 4.38Å
540	K	95.8	Very high	95.7	Very high	156 Å²	156	55.9 Å²	55.9	68%	0.678	27%	0.272	S	S	*	.	H	α-helix	trans	-59.6	-33.4	177.5	-175.3	172.9	-179	174.3	0	114.1	N537 F538	N537-K540 HydrophobicContact CB-CB 4.33Å; F538-K540 PolarHBondContact O-N 3.11Å
541	R	95.9	Very high	95.1	Very high	151 Å²	151	59 Å²	59	57%	0.57	31%	0.308	S	S	*	.	H	α-helix	trans	-80.2	-19.1	178	-79.6	176.2	-70.6	147.2	-3.4	114	I536 N537 F538 C539	I536-R541 PolarHBondContact O-NH2 3.36Å; N537-R541 VanDerWaalsContact O-CB 3.3Å; N537-R541 WeakPolarHBondContact O-CB 3.4Å; N537-R541 VanDerWaalsContact O-CG 3.26Å; N537-R541 WeakPolarHBondContact O-CG 3.36Å; N537-R541 PolarHBondContact O-N 3.17Å; N537-R541 VanDerWaalsContact O-N 3.08Å; N537-R541 PolarHBondContact O-NE 3.11Å; F538-R541 PolarHBondContact O-N 3.02Å; C539-R541 VanDerWaalsContact C-N 3.3Å; C539-R541 PolarHBondContact O-N 3.45Å
542	N	95.7	Very high	94.8	Very high	57 Å²	57	58.9 Å²	58.9	31%	0.305	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	11.1	-175.2	-66.7	-81.7	0	0	0	112.8	F538 C539 I544 R609 V611	F538-N542 WeakPolarHBondContact CD2-ND2 3.35Å; F538-N542 WeakPolarHBondContact CE2-ND2 3.08Å; F538-N542 PolarHBondContact O-N 3.34Å; F538-N542 VanDerWaalsContact O-N 3.13Å; F538-N542 PolarHBondContact O-ND2 2.75Å; C539-N542 CarbonylContact O-C 2.99Å; C539-N542 PolarHBondContact O-N 3.38Å; C539-N542 VanDerWaalsContact O-N 3.11Å; N542-I544 HydrophobicContact CB-CD1 4.14Å; N542-I544 HydrophobicContact CB-CG1 4.29Å; N542-R609 PolarHBondContact O-NH2 3.3Å; N542-V611 HydrophobicContact CB-CG1 3.6Å; N542-V611 VanDerWaalsContact CG-CG1 3.47Å; N542-V611 WeakPolarHBondContact OD1-CG1 3.46Å
543	D	96.2	Very high	94.4	Very high	142 Å²	142	62.1 Å²	62.1	76%	0.759	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	61	-175.8	-163	41.1	0	0	0	112	C539 R609	C539-D543 PolarHBondContact O-N 2.89Å; D543-R609 PolarHBondContact O-NH1 2.86Å; D543-R609 PolarHBondContact O-NH2 3.45Å
544	I	96.5	Very high	93.9	Very high	23 Å²	23	66 Å²	66	12%	0.118	35%	0.354	C	S	.	.			trans	-123.8	137.7	173	-52.8	168.5	0	0	0	107.7	I494 F538 C539 N542 L546 V611 W629	I494-I544 HydrophobicContact CD1-CD1 4.2Å; I494-I544 HydrophobicContact CD1-CG2 4.43Å; F538-I544 HydrophobicContact CD1-CD1 4.35Å; F538-I544 HydrophobicContact CE1-CD1 3.78Å; C539-I544 HydrophobicContact CB-CB 3.96Å; C539-I544 WeakPolarHBondContact CB-O 3.43Å; C539-I544 PolarHBondContact O-N 3.03Å; N542-I544 HydrophobicContact CB-CD1 4.14Å; N542-I544 HydrophobicContact CB-CG1 4.29Å; I544-L546 PolarHBondContact O-N 3.04Å; I544-V611 HydrophobicContact CD1-CG1 4.37Å; I544-W629 HydrophobicContact CD1-CH2 3.83Å; I544-W629 HydrophobicContact CD1-CZ2 3.78Å; I544-W629 HydrophobicContact CG1-CH2 4.22Å; I544-W629 HydrophobicContact CG1-CZ2 4Å; I544-W629 HydrophobicContact CG2-CZ2 3.98Å
545	T	95.8	Very high	93.4	Very high	123 Å²	123	73.7 Å²	73.7	76%	0.755	39%	0.39	S	S	*	.			trans	-62.2	119.7	169.5	-51.2	0	0	0	0	109.9
546	L	97.1	Very high	93.2	Very high	30 Å²	30	77.7 Å²	77.7	16%	0.157	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	123.6	172.9	178.1	65.6	0	0	0	109.2	E484 I494 V496 C539 I544 V548 F557 W559	E484-L546 HydrophobicContact CG-CD1 3.83Å; I494-L546 HydrophobicContact CG2-CD1 4.48Å; V496-L546 HydrophobicContact CG2-CD1 4.21Å; V496-L546 HydrophobicContact CG2-CD2 3.89Å; V496-L546 HydrophobicContact CG2-CG 4.1Å; C539-L546 HydrophobicContact CB-CB 3.97Å; C539-L546 HydrophobicContact CB-CD1 4.38Å; I544-L546 PolarHBondContact O-N 3.04Å; L546-V548 PolarHBondContact O-N 2.77Å; L546-F557 HydrophobicContact CD2-CD1 4.23Å; L546-F557 HydrophobicContact CD2-CE1 3.74Å; L546-W559 HydrophobicContact CD2-CZ2 4.36Å
547	T	96.4	Very high	93	Very high	50 Å²	50	78 Å²	78	31%	0.307	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	111.5	172.5	-63.6	0	0	0	0	109.3	N493 I494 C495 V496	N493-T547 PolarHBondContact OD1-OG1 3.49Å; I494-T547 PolarHBondContact O-N 3.13Å; C495-T547 VanDerWaalsContact CA-O 3.3Å; C495-T547 WeakPolarHBondContact CA-O 3.18Å; C495-T547 VanDerWaalsContact SG-CB 3.57Å; V496-T547 PolarHBondContact N-O 3.15Å
548	V	94.8	Very high	93	Very high	24 Å²	24	78.9 Å²	78.9	15%	0.145	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-87.4	158.9	-175.7	-57.9	0	0	0	0	111.8	L546 P554 F557	L546-V548 PolarHBondContact O-N 2.77Å; V548-P554 HydrophobicContact CG2-CB 4.25Å; V548-P554 HydrophobicContact CG2-CG 3.83Å; V548-F557 HydrophobicContact CB-CB 4.46Å; V548-F557 HydrophobicContact CB-CD2 4.04Å; V548-F557 HydrophobicContact CB-CG 4.19Å; V548-F557 HydrophobicContact CG1-CB 3.69Å; V548-F557 HydrophobicContact CG1-CD1 3.78Å; V548-F557 HydrophobicContact CG1-CD2 3.83Å; V548-F557 HydrophobicContact CG1-CE1 4.4Å; V548-F557 HydrophobicContact CG1-CE2 4.42Å; V548-F557 HydrophobicContact CG1-CG 3.47Å; V548-F557 VanDerWaalsContact CG1-CG 3.47Å
549	P	91.8	Very high	93	Very high	8 Å²	8	77.9 Å²	77.9	5%	0.052	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-62.6	146.3	-178.2	-23	35.3	0	0	0	112.4	V496 D513 G551 S552 Y562	V496-P549 HydrophobicContact CB-CG 3.9Å; V496-P549 HydrophobicContact CG1-CG 3.75Å; V496-P549 HydrophobicContact CG2-CG 4.4Å; D513-P549 HydrophobicContact CB-CB 4.12Å; D513-P549 HydrophobicContact CB-CG 3.71Å; D513-P549 VanDerWaalsContact O-CA 3.32Å; D513-P549 WeakPolarHBondContact O-CA 3.43Å; D513-P549 WeakPolarHBondContact O-CB 3.45Å; P549-G551 PolarHBondContact O-N 2.91Å; P549-S552 WeakPolarHBondContact O-CB 3.37Å; P549-S552 PolarHBondContact O-N 2.85Å; P549-S552 PolarHBondContact O-OG 2.91Å; P549-Y562 HydrophobicContact CG-CE1 4.43Å; P549-Y562 HydrophobicContact CG-CE2 3.96Å
550	R	86	Confident	93	Very high	208 Å²	208	82.9 Å²	82.9	79%	0.785	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	129.1	177.9	-63.7	-171.9	-176.6	178.4	0.7	111.1	G514	G514-R550 VanDerWaalsContact O-CD 3.24Å; G514-R550 WeakPolarHBondContact O-CD 3.47Å; G514-R550 WeakPolarHBondContact O-CG 3.49Å
551	G	82.9	Confident	93	Very high	90 Å²	90	81 Å²	81	93%	0.928	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.3	-8.1	-174.4	0	0	0	0	0	114.9	P549	P549-G551 PolarHBondContact O-N 2.91Å
552	S	87.3	Confident	93	Very high	42 Å²	42	75.5 Å²	75.5	29%	0.294	42%	0.415	S	S	.	.	S	Bend	trans	-87	141.7	165.8	-53.6	0	0	0	0	110.4	P549	P549-S552 WeakPolarHBondContact O-CB 3.37Å; P549-S552 PolarHBondContact O-N 2.85Å; P549-S552 PolarHBondContact O-OG 2.91Å
553	D	88.3	Confident	93.1	Very high	71 Å²	71	74 Å²	74	38%	0.38	41%	0.407	S	S	.	.			trans	-83.5	124.6	169	157.8	42.5	0	0	0	110.3	Q555 T556 F557	D553-Q555 PolarHBondContact O-N 3.33Å; D553-Q555 PolarHBondContact OD1-N 2.92Å; D553-T556 PolarHBondContact O-N 3.05Å; D553-T556 VanDerWaalsContact OD2-CB 3.29Å; D553-T556 WeakPolarHBondContact OD2-CB 3.46Å; D553-T556 VanDerWaalsContact OD2-CG2 3.28Å; D553-T556 WeakPolarHBondContact OD2-CG2 3.14Å; D553-T556 PolarHBondContact OD2-N 3.19Å; D553-T556 PolarHBondContact OD2-OG1 3.14Å; D553-F557 WeakPolarHBondContact O-CB 3.49Å; D553-F557 PolarHBondContact O-N 2.66Å
554	P	88.4	Confident	93.1	Very high	86 Å²	86	74 Å²	74	56%	0.558	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.4	177.1	-22.6	31.3	0	0	0	114.8	V548	V548-P554 HydrophobicContact CG2-CB 4.25Å; V548-P554 HydrophobicContact CG2-CG 3.83Å
555	Q	87.4	Confident	93	Very high	174 Å²	174	78 Å²	78	81%	0.813	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-30.7	-175.5	-61.8	-63.6	-34.5	0	0	112.9	D553	D553-Q555 PolarHBondContact O-N 3.33Å; D553-Q555 PolarHBondContact OD1-N 2.92Å
556	T	91.9	Very high	92.9	Very high	99 Å²	99	74.7 Å²	74.7	61%	0.607	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-2.7	178.3	57.7	0	0	0	0	114.3	D553 T558	D553-T556 PolarHBondContact O-N 3.05Å; D553-T556 VanDerWaalsContact OD2-CB 3.29Å; D553-T556 WeakPolarHBondContact OD2-CB 3.46Å; D553-T556 VanDerWaalsContact OD2-CG2 3.28Å; D553-T556 WeakPolarHBondContact OD2-CG2 3.14Å; D553-T556 PolarHBondContact OD2-N 3.19Å; D553-T556 PolarHBondContact OD2-OG1 3.14Å; T556-T558 PolarHBondContact O-N 2.96Å
557	F	95.4	Very high	92.9	Very high	37 Å²	37	82.5 Å²	82.5	16%	0.162	44%	0.436	C	S	.	.			trans	-60.4	128.7	175.9	-178.9	-90.2	0	0	0	112.1	V496 L546 V548 D553 W559 Y562	V496-F557 HydrophobicContact CG2-CE1 4.14Å; V496-F557 HydrophobicContact CG2-CE2 4.19Å; V496-F557 HydrophobicContact CG2-CZ 3.62Å; L546-F557 HydrophobicContact CD2-CD1 4.23Å; L546-F557 HydrophobicContact CD2-CE1 3.74Å; V548-F557 HydrophobicContact CB-CB 4.46Å; V548-F557 HydrophobicContact CB-CD2 4.04Å; V548-F557 HydrophobicContact CB-CG 4.19Å; V548-F557 HydrophobicContact CG1-CB 3.69Å; V548-F557 HydrophobicContact CG1-CD1 3.78Å; V548-F557 HydrophobicContact CG1-CD2 3.83Å; V548-F557 HydrophobicContact CG1-CE1 4.4Å; V548-F557 HydrophobicContact CG1-CE2 4.42Å; V548-F557 HydrophobicContact CG1-CG 3.47Å; V548-F557 VanDerWaalsContact CG1-CG 3.47Å; D553-F557 WeakPolarHBondContact O-CB 3.49Å; D553-F557 PolarHBondContact O-N 2.66Å; F557-W559 HydrophobicContact CE1-CD2 4.25Å; F557-W559 HydrophobicContact CE1-CG 4.28Å; F557-W559 HydrophobicContact CZ-CD2 4.27Å; F557-W559 HydrophobicContact CZ-CE3 4.43Å; F557-Y562 HydrophobicContact CE2-CD1 4.18Å; F557-Y562 AromaticContact CE2-CD2 3.81Å; F557-Y562 HydrophobicContact CE2-CD2 3.81Å; F557-Y562 AromaticContact CE2-CG 3.62Å; F557-Y562 HydrophobicContact CE2-CG 3.62Å; F557-Y562 HydrophobicContact CZ-CD1 4.24Å; F557-Y562 HydrophobicContact CZ-CG 4.01Å
558	T	95.5	Very high	92.9	Very high	58 Å²	58	81.2 Å²	81.2	36%	0.356	43%	0.431	S	S	.	.			trans	-137.8	138.3	170.2	51.7	0	0	0	0	109.8	T556 D560 K561 Y562	T556-T558 PolarHBondContact O-N 2.96Å; T558-D560 VanDerWaalsContact C-N 3.27Å; T558-D560 PolarHBondContact O-N 3.26Å; T558-K561 PolarHBondContact O-N 2.59Å; T558-K561 WeakPolarHBondContact OG1-CB 3.4Å; T558-Y562 WeakPolarHBondContact O-CB 3.33Å; T558-Y562 PolarHBondContact O-N 2.95Å
559	W	96.9	Very high	93	Very high	6 Å²	6	84.2 Å²	84.2	2%	0.023	45%	0.449	C	S	.	.	H	α-helix	trans	-57.5	-39.9	179	-88.3	113.2	0	0	0	112.6	K482 L483 E484 V496 I536 L546 F557 K561 Y562 L563	K482-W559 HydrophobicContact CB-CH2 4.26Å; K482-W559 HydrophobicContact CB-CZ3 3.74Å; K482-W559 HydrophobicContact CG-CZ3 4.39Å; L483-W559 WeakPolarHBondContact O-CH2 3.5Å; E484-W559 HydrophobicContact CG-CZ2 3.56Å; E484-W559 PolarHBondContact OE1-NE1 2.77Å; V496-W559 HydrophobicContact CB-CH2 4.24Å; V496-W559 HydrophobicContact CB-CZ2 4.47Å; V496-W559 HydrophobicContact CG1-CH2 3.66Å; V496-W559 HydrophobicContact CG1-CZ2 4.34Å; V496-W559 HydrophobicContact CG1-CZ3 4.15Å; V496-W559 HydrophobicContact CG2-CH2 4.07Å; V496-W559 HydrophobicContact CG2-CZ2 3.91Å; I536-W559 HydrophobicContact CB-CD2 3.79Å; I536-W559 HydrophobicContact CB-CE3 4.27Å; I536-W559 HydrophobicContact CB-CG 4.07Å; I536-W559 HydrophobicContact CB-CZ2 4.15Å; I536-W559 HydrophobicContact CD1-CB 4.16Å; I536-W559 HydrophobicContact CD1-CD2 4.37Å; I536-W559 HydrophobicContact CD1-CG 4.21Å; I536-W559 HydrophobicContact CG2-CD2 3.82Å; I536-W559 HydrophobicContact CG2-CE3 3.82Å; I536-W559 HydrophobicContact CG2-CH2 3.69Å; I536-W559 HydrophobicContact CG2-CZ2 3.72Å; I536-W559 HydrophobicContact CG2-CZ3 3.77Å; L546-W559 HydrophobicContact CD2-CZ2 4.36Å; F557-W559 HydrophobicContact CE1-CD2 4.25Å; F557-W559 HydrophobicContact CE1-CG 4.28Å; F557-W559 HydrophobicContact CZ-CD2 4.27Å; F557-W559 HydrophobicContact CZ-CE3 4.43Å; W559-K561 PolarHBondContact O-N 2.65Å; W559-Y562 HydrophobicContact CE3-CD1 4.35Å; W559-Y562 HydrophobicContact CZ3-CD1 4.05Å; W559-Y562 PolarHBondContact O-N 3.41Å; W559-L563 HydrophobicContact CE3-CG 4.4Å; W559-L563 WeakPolarHBondContact O-CB 3.31Å; W559-L563 WeakPolarHBondContact O-CD1 3.28Å; W559-L563 WeakPolarHBondContact O-CG 3.4Å; W559-L563 PolarHBondContact O-N 3.21Å
560	D	96.6	Very high	93.3	Very high	106 Å²	106	85.3 Å²	85.3	57%	0.567	46%	0.459	S	S	*	.	H	α-helix	trans	-64.2	-42.5	-178.8	-52.9	-71.9	0	0	0	112.4	T558 Q564	T558-D560 VanDerWaalsContact C-N 3.27Å; T558-D560 PolarHBondContact O-N 3.26Å; D560-Q564 VanDerWaalsContact O-CG 3.26Å; D560-Q564 WeakPolarHBondContact O-CG 3.25Å; D560-Q564 PolarHBondContact O-N 3.48Å; D560-Q564 PolarHBondContact O-NE2 3Å; D560-Q564 VanDerWaalsContact O-NE2 3.15Å
561	K	95.4	Very high	93.9	Very high	117 Å²	117	75.6 Å²	75.6	51%	0.509	42%	0.423	S	S	.	.	H	α-helix	trans	-66.8	-47.1	173.1	-179.3	-177.2	169.2	-172.8	0	110.8	T558 W559 L563 Q564 D565	T558-K561 PolarHBondContact O-N 2.59Å; T558-K561 WeakPolarHBondContact OG1-CB 3.4Å; W559-K561 PolarHBondContact O-N 2.65Å; K561-L563 VanDerWaalsContact C-N 3.3Å; K561-L563 PolarHBondContact O-N 2.82Å; K561-Q564 WeakPolarHBondContact O-CB 3.39Å; K561-Q564 PolarHBondContact O-N 3.43Å; K561-D565 WeakPolarHBondContact CE-OD2 3.43Å; K561-D565 WeakPolarHBondContact CG-OD2 3.42Å; K561-D565 PolarHBondContact O-N 2.96Å
562	Y	96.4	Very high	94.5	Very high	35 Å²	35	73.4 Å²	73.4	14%	0.137	39%	0.392	C	S	.	.	H	α-helix	trans	-61.1	-38.3	-176.6	-170.2	-109.8	0	0	0	112.6	K482 V496 D513 P549 F557 T558 W559 T566	K482-Y562 HydrophobicContact CD-CE1 4.28Å; V496-Y562 HydrophobicContact CG1-CD1 4.16Å; V496-Y562 HydrophobicContact CG1-CE1 3.64Å; D513-Y562 WeakPolarHBondContact OD2-CE1 3.3Å; D513-Y562 PolarHBondContact OD2-OH 3.05Å; P549-Y562 HydrophobicContact CG-CE1 4.43Å; P549-Y562 HydrophobicContact CG-CE2 3.96Å; F557-Y562 HydrophobicContact CE2-CD1 4.18Å; F557-Y562 AromaticContact CE2-CD2 3.81Å; F557-Y562 HydrophobicContact CE2-CD2 3.81Å; F557-Y562 AromaticContact CE2-CG 3.62Å; F557-Y562 HydrophobicContact CE2-CG 3.62Å; F557-Y562 HydrophobicContact CZ-CD1 4.24Å; F557-Y562 HydrophobicContact CZ-CG 4.01Å; T558-Y562 WeakPolarHBondContact O-CB 3.33Å; T558-Y562 PolarHBondContact O-N 2.95Å; W559-Y562 HydrophobicContact CE3-CD1 4.35Å; W559-Y562 HydrophobicContact CZ3-CD1 4.05Å; W559-Y562 PolarHBondContact O-N 3.41Å; Y562-T566 HydrophobicContact CD1-CG2 4.45Å; Y562-T566 HydrophobicContact CD2-CG2 4.26Å; Y562-T566 HydrophobicContact CE1-CG2 3.99Å; Y562-T566 HydrophobicContact CE2-CG2 3.78Å; Y562-T566 WeakPolarHBondContact O-CB 3.26Å; Y562-T566 WeakPolarHBondContact O-CG2 3.3Å; Y562-T566 PolarHBondContact O-N 2.99Å; Y562-T566 PolarHBondContact O-OG1 2.83Å
563	L	97.3	Very high	94.8	Very high	26 Å²	26	74.2 Å²	74.2	14%	0.136	40%	0.402	C	S	.	.	H	α-helix	trans	-66.5	-37.5	174	-70.2	165.2	0	0	0	112.6	K482 I536 W559 K561 K567 A568 A570	K482-L563 HydrophobicContact CB-CD2 4Å; K482-L563 HydrophobicContact CG-CD2 3.81Å; I536-L563 HydrophobicContact CD1-CD1 4.11Å; W559-L563 HydrophobicContact CE3-CG 4.4Å; W559-L563 WeakPolarHBondContact O-CB 3.31Å; W559-L563 WeakPolarHBondContact O-CD1 3.28Å; W559-L563 WeakPolarHBondContact O-CG 3.4Å; W559-L563 PolarHBondContact O-N 3.21Å; K561-L563 VanDerWaalsContact C-N 3.3Å; K561-L563 PolarHBondContact O-N 2.82Å; L563-K567 CarbonylContact O-C 3.59Å; L563-K567 VanDerWaalsContact O-CA 3.31Å; L563-K567 WeakPolarHBondContact O-CA 3.2Å; L563-K567 PolarHBondContact O-N 2.73Å; L563-A568 HydrophobicContact CD2-CB 4.31Å; L563-A568 PolarHBondContact O-N 3.29Å; L563-A570 HydrophobicContact CD1-CB 4.06Å; L563-A570 HydrophobicContact CD2-CB 4.41Å
564	Q	96.8	Very high	95.1	Very high	142 Å²	142	79 Å²	79	66%	0.664	41%	0.414	S	S	*	.	H	α-helix	trans	-67.8	-49.9	175.4	-71.1	167.8	43.7	0	0	111.6	D560 K561 T566 K567	D560-Q564 VanDerWaalsContact O-CG 3.26Å; D560-Q564 WeakPolarHBondContact O-CG 3.25Å; D560-Q564 PolarHBondContact O-N 3.48Å; D560-Q564 PolarHBondContact O-NE2 3Å; D560-Q564 VanDerWaalsContact O-NE2 3.15Å; K561-Q564 WeakPolarHBondContact O-CB 3.39Å; K561-Q564 PolarHBondContact O-N 3.43Å; Q564-T566 VanDerWaalsContact C-N 3.34Å; Q564-T566 PolarHBondContact O-N 2.95Å; Q564-K567 PolarHBondContact O-N 3.23Å; Q564-K567 VanDerWaalsContact O-N 3.14Å
565	D	94.3	Very high	95.4	Very high	106 Å²	106	75.9 Å²	75.9	57%	0.567	39%	0.393	S	S	*	.	H	α-helix	trans	-61.3	-41.7	-179.6	-70.2	-12.8	0	0	0	111.5	K561	K561-D565 WeakPolarHBondContact CE-OD2 3.43Å; K561-D565 WeakPolarHBondContact CG-OD2 3.42Å; K561-D565 PolarHBondContact O-N 2.96Å
566	T	94.7	Very high	95.7	Very high	53 Å²	53	68.3 Å²	68.3	33%	0.325	36%	0.357	S	S	.	.	H	α-helix	trans	-84.1	-7.2	177.2	59.5	0	0	0	0	114.4	Y562 Q564 A568	Y562-T566 HydrophobicContact CD1-CG2 4.45Å; Y562-T566 HydrophobicContact CD2-CG2 4.26Å; Y562-T566 HydrophobicContact CE1-CG2 3.99Å; Y562-T566 HydrophobicContact CE2-CG2 3.78Å; Y562-T566 WeakPolarHBondContact O-CB 3.26Å; Y562-T566 WeakPolarHBondContact O-CG2 3.3Å; Y562-T566 PolarHBondContact O-N 2.99Å; Y562-T566 PolarHBondContact O-OG1 2.83Å; Q564-T566 VanDerWaalsContact C-N 3.34Å; Q564-T566 PolarHBondContact O-N 2.95Å; T566-A568 PolarHBondContact O-N 2.88Å; T566-A568 WeakPolarHBondContact OG1-CB 3.25Å
567	K	96.9	Very high	95.6	Very high	194 Å²	194	65 Å²	65	84%	0.843	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	27.2	-173.2	-54.1	176.2	-174.4	172.8	0	113.7	L563 Q564	L563-K567 CarbonylContact O-C 3.59Å; L563-K567 VanDerWaalsContact O-CA 3.31Å; L563-K567 WeakPolarHBondContact O-CA 3.2Å; L563-K567 PolarHBondContact O-N 2.73Å; Q564-K567 PolarHBondContact O-N 3.23Å; Q564-K567 VanDerWaalsContact O-N 3.14Å
568	A	96.6	Very high	94.8	Very high	24 Å²	24	69 Å²	69	20%	0.198	36%	0.364	C	S	.	.			trans	-96.2	170.3	-175.6	0	0	0	0	0	112.1	K482 L563 T566	K482-A568 HydrophobicContact CD-CB 4.3Å; K482-A568 HydrophobicContact CG-CB 3.73Å; L563-A568 HydrophobicContact CD2-CB 4.31Å; L563-A568 PolarHBondContact O-N 3.29Å; T566-A568 PolarHBondContact O-N 2.88Å; T566-A568 WeakPolarHBondContact OG1-CB 3.25Å
569	T	97.4	Very high	93.9	Very high	86 Å²	86	70.9 Å²	70.9	53%	0.528	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	150.6	172.8	65	0	0	0	0	111.1	M481 K482	M481-T569 CarbonylContact C-O 3.58Å; M481-T569 WeakPolarHBondContact CA-O 3.11Å; K482-T569 PolarHBondContact N-O 3.09Å
570	A	98.1	Very high	92.8	Very high	31 Å²	31	75 Å²	75	26%	0.256	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	135.8	174.9	0	0	0	0	0	110.9	I536 L563 P572	I536-A570 HydrophobicContact CD1-CB 3.45Å; I536-A570 VanDerWaalsContact CD1-CB 3.45Å; I536-A570 HydrophobicContact CG1-CB 3.87Å; I536-A570 HydrophobicContact CG2-CB 4.22Å; L563-A570 HydrophobicContact CD1-CB 4.06Å; L563-A570 HydrophobicContact CD2-CB 4.41Å; A570-P572 VanDerWaalsContact O-CD 3.32Å; A570-P572 WeakPolarHBondContact O-CD 3.38Å
571	A	97.9	Very high	91.4	Very high	4 Å²	4	74.1 Å²	74.1	3%	0.033	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-57.9	121.9	171.9	0	0	0	0	0	110.6	F477 M481 K482 L483 A573 F576	F477-A571 HydrophobicContact CD1-CB 4.05Å; F477-A571 HydrophobicContact CE1-CB 3.78Å; M481-A571 HydrophobicContact CB-CB 4.21Å; M481-A571 HydrophobicContact SD-CB 4.28Å; K482-A571 WeakPolarHBondContact O-CB 3.44Å; K482-A571 PolarHBondContact O-N 3.03Å; L483-A571 HydrophobicContact CB-CB 4.25Å; A571-A573 PolarHBondContact O-N 3.36Å; A571-F576 HydrophobicContact CB-CE2 3.75Å; A571-F576 HydrophobicContact CB-CZ 3.65Å
572	P	95.8	Very high	90.5	Very high	44 Å²	44	71.5 Å²	71.5	29%	0.286	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-59.2	129.2	-176.5	-29	35.8	0	0	0	113.3	A570 R574 L575	A570-P572 VanDerWaalsContact O-CD 3.32Å; A570-P572 WeakPolarHBondContact O-CD 3.38Å; P572-R574 HydrophobicContact CB-CG 3.97Å; P572-R574 PolarHBondContact O-N 3.36Å; P572-L575 HydrophobicContact CB-CD1 4.47Å; P572-L575 HydrophobicContact CB-CG 4.48Å; P572-L575 HydrophobicContact CG-CD1 4.45Å; P572-L575 WeakPolarHBondContact O-CB 3.39Å; P572-L575 WeakPolarHBondContact O-CG 3.45Å; P572-L575 PolarHBondContact O-N 3.28Å
573	A	93.9	Very high	90.1	Very high	59 Å²	59	71.1 Å²	71.1	49%	0.488	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-54.3	-25.7	-174.5	0	0	0	0	0	115	P535 A571 L575 F576	P535-A573 HydrophobicContact CB-CB 3.98Å; A571-A573 PolarHBondContact O-N 3.36Å; A573-L575 PolarHBondContact O-N 3.34Å; A573-F576 PolarHBondContact O-N 3.15Å
574	R	93.1	Very high	89.8	Confident	171 Å²	171	72.3 Å²	72.3	65%	0.645	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-64.4	-9.5	173.6	63.2	168.5	176.8	74	4.4	115.5	G475 P572	G475-R574 VanDerWaalsContact O-CZ 3.25Å; G475-R574 PolarHBondContact O-NH1 3.48Å; G475-R574 PolarHBondContact O-NH2 2.98Å; P572-R574 HydrophobicContact CB-CG 3.97Å; P572-R574 PolarHBondContact O-N 3.36Å
575	L	94.3	Very high	89.7	Confident	22 Å²	22	66.1 Å²	66.1	12%	0.115	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-88.2	-20.4	179.2	-65.5	176.2	0	0	0	113.4	F476 F477 P572 A573	F476-L575 HydrophobicContact CD2-CD2 4.24Å; F476-L575 WeakPolarHBondContact O-CD1 3.46Å; F477-L575 HydrophobicContact CD1-CD1 3.96Å; F477-L575 HydrophobicContact CD2-CB 4.18Å; F477-L575 HydrophobicContact CD2-CD1 4Å; F477-L575 HydrophobicContact CE1-CB 4.29Å; F477-L575 HydrophobicContact CE1-CD1 4.16Å; F477-L575 HydrophobicContact CE2-CB 3.59Å; F477-L575 HydrophobicContact CE2-CD1 4.19Å; F477-L575 HydrophobicContact CE2-CG 4.41Å; F477-L575 HydrophobicContact CG-CD1 3.89Å; F477-L575 HydrophobicContact CZ-CB 3.66Å; F477-L575 HydrophobicContact CZ-CD1 4.27Å; P572-L575 HydrophobicContact CB-CD1 4.47Å; P572-L575 HydrophobicContact CB-CG 4.48Å; P572-L575 HydrophobicContact CG-CD1 4.45Å; P572-L575 WeakPolarHBondContact O-CB 3.39Å; P572-L575 WeakPolarHBondContact O-CG 3.45Å; P572-L575 PolarHBondContact O-N 3.28Å; A573-L575 PolarHBondContact O-N 3.34Å
576	F	94.4	Very high	89.8	Confident	14 Å²	14	63.4 Å²	63.4	6%	0.061	38%	0.375	C	S	.	.	S	Bend	trans	-90.4	153.3	-173.5	-61.5	-93.5	0	0	0	111.5	F477 L483 I533 L534 P535 A571 A573 T578	F477-F576 HydrophobicContact CE1-CE1 4.03Å; F477-F576 HydrophobicContact CE1-CE2 4.13Å; F477-F576 AromaticContact CE1-CZ 3.69Å; F477-F576 HydrophobicContact CE1-CZ 3.69Å; F477-F576 HydrophobicContact CZ-CD1 4.24Å; F477-F576 HydrophobicContact CZ-CD2 4.49Å; F477-F576 AromaticContact CZ-CE1 3.92Å; F477-F576 HydrophobicContact CZ-CE1 3.92Å; F477-F576 HydrophobicContact CZ-CE2 4.19Å; F477-F576 AromaticContact CZ-CZ 3.91Å; F477-F576 HydrophobicContact CZ-CZ 3.91Å; L483-F576 HydrophobicContact CB-CE1 4.24Å; L483-F576 HydrophobicContact CB-CZ 3.86Å; L483-F576 HydrophobicContact CD2-CE1 4.34Å; L483-F576 HydrophobicContact CD2-CZ 4.28Å; I533-F576 HydrophobicContact CB-CD1 4.49Å; I533-F576 HydrophobicContact CB-CE1 4.17Å; I533-F576 HydrophobicContact CD1-CE1 4.43Å; I533-F576 HydrophobicContact CG1-CD1 4.21Å; I533-F576 HydrophobicContact CG1-CE1 4.26Å; I533-F576 WeakPolarHBondContact O-CD1 3.5Å; L534-F576 WeakPolarHBondContact O-CE1 3.4Å; P535-F576 HydrophobicContact CB-CD2 3.7Å; P535-F576 HydrophobicContact CB-CE2 3.78Å; P535-F576 HydrophobicContact CB-CG 4.22Å; P535-F576 HydrophobicContact CB-CZ 4.36Å; P535-F576 HydrophobicContact CG-CD2 4.24Å; P535-F576 HydrophobicContact CG-CG 4.32Å; A571-F576 HydrophobicContact CB-CE2 3.75Å; A571-F576 HydrophobicContact CB-CZ 3.65Å; A573-F576 PolarHBondContact O-N 3.15Å; F576-T578 PolarHBondContact O-N 2.79Å
577	N	89.3	Confident	89.9	Confident	29 Å²	29	63.9 Å²	63.9	16%	0.155	38%	0.38	C	S	.	.			trans	-80.2	104.3	177	-171.7	5.2	0	0	0	111.9	R468 E579 R613	R468-N577 PolarHBondContact NH1-ND2 2.95Å; R468-N577 PolarHBondContact NH1-OD1 3.26Å; N577-E579 PolarHBondContact ND2-OE2 3.35Å; N577-E579 VanDerWaalsContact OD1-CB 3.31Å; N577-E579 WeakPolarHBondContact OD1-CB 3.2Å; N577-E579 WeakPolarHBondContact OD1-CG 3.35Å; N577-E579 PolarHBondContact OD1-N 2.8Å; N577-E579 PolarHBondContact OD1-OE2 2.79Å; N577-R613 PolarHBondContact ND2-NH1 3.32Å
578	T	79.3	Confident	89.9	Confident	122 Å²	122	60.4 Å²	60.4	75%	0.748	37%	0.37	S	S	*	.			trans	-92.9	13.2	177.9	59.1	0	0	0	0	114.5	F576 N580	F576-T578 PolarHBondContact O-N 2.79Å; T578-N580 PolarHBondContact O-N 2.85Å
579	E	77.4	Confident	90	Very high	98 Å²	98	60.7 Å²	60.7	46%	0.458	37%	0.368	S	S	.	.			trans	-66.4	121.7	176.5	-75	168.4	167.3	0	0	111.8	R468 N577	R468-E579 IonicContact CZ-OE1 2.83Å; R468-E579 IonicContact CZ-OE2 3.42Å; R468-E579 IonicContact NH1-OE1 3.55Å; R468-E579 PolarHBondContact NH1-OE1 3.34Å; R468-E579 VanDerWaalsContact NH1-OE1 3.09Å; R468-E579 IonicContact NH1-OE2 3.93Å; R468-E579 PolarHBondContact NH1-OE2 3.17Å; R468-E579 IonicContact NH2-OE1 2.62Å; R468-E579 PolarHBondContact NH2-OE1 2.81Å; R468-E579 IonicContact NH2-OE2 2.83Å; N577-E579 PolarHBondContact ND2-OE2 3.35Å; N577-E579 VanDerWaalsContact OD1-CB 3.31Å; N577-E579 WeakPolarHBondContact OD1-CB 3.2Å; N577-E579 WeakPolarHBondContact OD1-CG 3.35Å; N577-E579 PolarHBondContact OD1-N 2.8Å; N577-E579 PolarHBondContact OD1-OE2 2.79Å
580	N	72.7	Confident	90.1	Very high	93 Å²	93	57.5 Å²	57.5	50%	0.497	35%	0.347	S	S	.	.			trans	-120.3	96.3	165	177.2	-1	0	0	0	108.3	T578 G582 G612	T578-N580 PolarHBondContact O-N 2.85Å; N580-G582 VanDerWaalsContact C-N 3.29Å; N580-G582 PolarHBondContact O-N 3.45Å; N580-G582 PolarHBondContact OD1-N 2.9Å; N580-G612 PolarHBondContact ND2-O 2.69Å; N580-G612 PolarHBondContact OD1-O 2.95Å
581	P	66.6	Low	90.1	Very high	86 Å²	86	56 Å²	56	56%	0.558	33%	0.334	S	S	*	.			trans	-84.2	12	-172.3	34	-36.3	0	0	0	114.8	H632	P581-H632 WeakPolarHBondContact CG-NE2 3.32Å
582	G	77.6	Confident	90.1	Very high	63 Å²	63	55.9 Å²	55.9	65%	0.649	33%	0.333	S	S	*	.			trans	74.2	56.9	-178.8	0	0	0	0	0	112.7	N580 G584	N580-G582 VanDerWaalsContact C-N 3.29Å; N580-G582 PolarHBondContact O-N 3.45Å; N580-G582 PolarHBondContact OD1-N 2.9Å; G582-G584 PolarHBondContact O-N 2.83Å
583	H	88.6	Confident	90.3	Very high	27 Å²	27	53.8 Å²	53.8	13%	0.125	32%	0.319	C	S	.	.			trans	-69.5	12.4	-161.4	55.8	46.2	0	0	0	118.6	F585 G612 H632	H583-F585 HydrophobicContact CB-CD2 4.28Å; H583-F585 PolarHBondContact CE1-O 3.05Å; H583-F585 VanDerWaalsContact CE1-O 3.28Å; H583-F585 AromaticContact ND1-CD2 3.93Å; H583-F585 PolarHBondContact ND1-N 2.88Å; H583-F585 PolarHBondContact ND1-O 3.44Å; H583-F585 VanDerWaalsContact O-CD2 3.28Å; H583-F585 WeakPolarHBondContact O-CD2 3.2Å; H583-F585 PolarHBondContact O-N 3.3Å; H583-G612 PolarHBondContact NE2-O 2.92Å; H583-H632 HydrophobicContact CB-CB 3.82Å; H583-H632 WeakPolarHBondContact CB-ND1 3.37Å; H583-H632 AromaticContact CD2-CD2 3.78Å; H583-H632 AromaticContact CD2-CG 3.68Å; H583-H632 AromaticContact CG-CG 3.76Å
584	G	89.8	Confident	90.5	Very high	51 Å²	51	51.1 Å²	51.1	53%	0.526	30%	0.297	S	S	.	.	S	Bend	trans	72.5	-32.2	178.7	0	0	0	0	0	116.5	G582	G582-G584 PolarHBondContact O-N 2.83Å
585	F	95.9	Very high	90.7	Very high	12 Å²	12	44.5 Å²	44.5	5%	0.053	28%	0.275	C	S	.	.			trans	-63.4	134.9	175.1	-60.6	-82.6	0	0	0	113.2	A240 F245 H583 L591 V607 L615 H632	A240-F585 HydrophobicContact CB-CD1 3.82Å; A240-F585 HydrophobicContact CB-CE1 3.69Å; F245-F585 HydrophobicContact CD1-CE1 4.43Å; F245-F585 AromaticContact CD1-CZ 3.93Å; F245-F585 HydrophobicContact CD1-CZ 3.93Å; F245-F585 HydrophobicContact CD2-CZ 4.46Å; F245-F585 AromaticContact CE1-CE1 3.76Å; F245-F585 HydrophobicContact CE1-CE1 3.76Å; F245-F585 AromaticContact CE1-CZ 3.7Å; F245-F585 HydrophobicContact CE1-CZ 3.7Å; F245-F585 HydrophobicContact CE2-CE1 4.09Å; F245-F585 HydrophobicContact CE2-CZ 4.27Å; F245-F585 HydrophobicContact CG-CZ 4.33Å; F245-F585 AromaticContact CZ-CE1 3.57Å; F245-F585 HydrophobicContact CZ-CE1 3.57Å; F245-F585 AromaticContact CZ-CZ 3.9Å; F245-F585 HydrophobicContact CZ-CZ 3.9Å; H583-F585 HydrophobicContact CB-CD2 4.28Å; H583-F585 PolarHBondContact CE1-O 3.05Å; H583-F585 VanDerWaalsContact CE1-O 3.28Å; H583-F585 AromaticContact ND1-CD2 3.93Å; H583-F585 PolarHBondContact ND1-N 2.88Å; H583-F585 PolarHBondContact ND1-O 3.44Å; H583-F585 VanDerWaalsContact O-CD2 3.28Å; H583-F585 WeakPolarHBondContact O-CD2 3.2Å; H583-F585 PolarHBondContact O-N 3.3Å; F585-L591 HydrophobicContact CD1-CD2 4.36Å; F585-L591 HydrophobicContact CE1-CD2 3.89Å; F585-V607 HydrophobicContact CD1-CG2 4Å; F585-L615 HydrophobicContact CB-CD1 4.27Å; F585-L615 HydrophobicContact CB-CD2 4.05Å; F585-L615 HydrophobicContact CD1-CD1 4.13Å; F585-L615 HydrophobicContact CD2-CD1 3.78Å; F585-L615 HydrophobicContact CE1-CD1 4.38Å; F585-L615 HydrophobicContact CE2-CD1 4.06Å; F585-L615 HydrophobicContact CG-CD1 3.81Å; F585-L615 HydrophobicContact CG-CD2 4.45Å; F585-L615 HydrophobicContact CZ-CD1 4.35Å; F585-H632 HydrophobicContact CD2-CB 4.08Å; F585-H632 HydrophobicContact CE2-CB 4.17Å
586	S	95.9	Very high	90.8	Very high	48 Å²	48	45.8 Å²	45.8	34%	0.336	28%	0.282	S	S	.	.			trans	-120.4	164.5	164.7	72.5	0	0	0	0	110.6	M589 V607	S586-M589 PolarHBondContact N-SD 3.42Å; S586-M589 VanDerWaalsContact N-SD 3.44Å; S586-V607 WeakPolarHBondContact O-CB 3.23Å; S586-V607 WeakPolarHBondContact O-CG1 3.41Å
587	P	96.9	Very high	90.7	Very high	64 Å²	64	50.2 Å²	50.2	42%	0.416	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	155.4	164.3	-25.7	36.2	0	0	0	112.4	M589 V607	P587-M589 PolarHBondContact O-N 3.18Å; P587-V607 CarbonylContact C-O 3.52Å; P587-V607 VanDerWaalsContact CA-O 3.26Å; P587-V607 WeakPolarHBondContact CA-O 3.11Å
588	N	96.9	Very high	91	Very high	121 Å²	121	53.2 Å²	53.2	65%	0.647	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	8.1	-178.6	-53.5	-23.4	0	0	0	115.7	V607	N588-V607 PolarHBondContact N-O 2.84Å
589	M	98.1	Very high	91.7	Very high	30 Å²	30	48.5 Å²	48.5	15%	0.148	29%	0.288	C	S	.	.			trans	-76	126.7	170.3	-75.5	-172.4	172.2	0	0	111.4	L238 A240 S586 P587 T606 V607	L238-M589 CarbonylContact O-C 3.55Å; L238-M589 WeakPolarHBondContact O-CA 3.37Å; A240-M589 HydrophobicContact CB-CB 4.32Å; A240-M589 HydrophobicContact CB-SD 4.01Å; S586-M589 PolarHBondContact N-SD 3.42Å; S586-M589 VanDerWaalsContact N-SD 3.44Å; P587-M589 PolarHBondContact O-N 3.18Å; M589-T606 WeakPolarHBondContact O-CA 3.32Å; M589-V607 HydrophobicContact CB-CB 4.49Å; M589-V607 HydrophobicContact CB-CG2 4.3Å; M589-V607 PolarHBondContact O-N 2.72Å
590	K	98.6	Very high	92.6	Very high	18 Å²	18	51.4 Å²	51.4	8%	0.078	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	144	170.8	-58.4	-61.1	-174.7	176.3	0	112	W228 Y231 L232 A237 L238 A239 A240 A605 T606 D620 V640	W228-K590 HydrophobicContact CH2-CB 4.23Å; W228-K590 HydrophobicContact CZ3-CB 3.91Å; W228-K590 HydrophobicContact CZ3-CG 4.43Å; Y231-K590 HydrophobicContact CE1-CD 4.32Å; Y231-K590 PolarHBondContact OH-NZ 2.95Å; L232-K590 HydrophobicContact CD2-CB 4.06Å; L232-K590 HydrophobicContact CD2-CG 3.92Å; A237-K590 HydrophobicContact CB-CD 4.48Å; A237-K590 HydrophobicContact CB-CG 3.8Å; L238-K590 PolarHBondContact O-N 2.96Å; A239-K590 VanDerWaalsContact CA-O 3.28Å; A239-K590 WeakPolarHBondContact CA-O 3.47Å; A239-K590 HydrophobicContact CB-CB 4.48Å; A240-K590 PolarHBondContact N-O 3Å; K590-A605 CarbonylContact C-O 3.45Å; K590-A605 WeakPolarHBondContact CA-O 3.28Å; K590-T606 VanDerWaalsContact CD-OG1 3.3Å; K590-T606 WeakPolarHBondContact CD-OG1 3.36Å; K590-T606 PolarHBondContact NZ-OG1 2.84Å; K590-D620 WeakPolarHBondContact CD-OD2 3.41Å; K590-D620 WeakPolarHBondContact CE-OD2 3.47Å; K590-D620 IonicContact NZ-OD1 3.59Å; K590-D620 IonicContact NZ-OD2 3.35Å; K590-D620 PolarHBondContact NZ-OD2 3.1Å; K590-V640 HydrophobicContact CB-CG2 4.42Å
591	L	98.9	Very high	93.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	177.5	175.4	55.9	75.1	0	0	0	111.1	W228 F245 F585 A593 A605 V607 I617 L637	W228-L591 WeakPolarHBondContact CH2-O 3.5Å; F245-L591 HydrophobicContact CE1-CB 4.37Å; F245-L591 HydrophobicContact CE1-CD2 4.19Å; F245-L591 HydrophobicContact CZ-CB 3.88Å; F245-L591 HydrophobicContact CZ-CD2 4.13Å; F585-L591 HydrophobicContact CD1-CD2 4.36Å; F585-L591 HydrophobicContact CE1-CD2 3.89Å; L591-A593 HydrophobicContact CD1-CB 3.76Å; L591-A605 HydrophobicContact CD1-CB 3.92Å; L591-A605 PolarHBondContact N-O 2.81Å; L591-A605 PolarHBondContact O-N 3.16Å; L591-A605 VanDerWaalsContact O-O 3.12Å; L591-V607 HydrophobicContact CD2-CG2 3.58Å; L591-V607 HydrophobicContact CG-CG2 4.42Å; L591-I617 HydrophobicContact CD1-CG2 4.42Å; L591-I617 HydrophobicContact CD2-CD1 4.23Å; L591-L637 HydrophobicContact CD1-CD2 4.1Å; L591-L637 HydrophobicContact CD2-CD1 4.4Å
592	E	98.9	Very high	95.3	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	118.2	170.4	-70.1	176.7	-168.8	0	0	108.4	W228 V602 C603 Y638 G641 W642 C643 L650	W228-E592 HydrophobicContact CZ2-CG 3.6Å; W228-E592 PolarHBondContact NE1-OE1 2.87Å; E592-V602 HydrophobicContact CB-CG1 3.98Å; E592-C603 WeakPolarHBondContact CA-O 3.39Å; E592-Y638 PolarHBondContact N-O 2.85Å; E592-Y638 PolarHBondContact O-N 2.88Å; E592-G641 WeakPolarHBondContact OE1-CA 3.37Å; E592-G641 PolarHBondContact OE1-N 3.31Å; E592-W642 PolarHBondContact OE1-N 3.3Å; E592-W642 WeakPolarHBondContact OE2-CB 3.33Å; E592-W642 PolarHBondContact OE2-N 3.04Å; E592-C643 WeakPolarHBondContact OE2-CB 3.2Å; E592-C643 PolarHBondContact OE2-N 3.45Å; E592-C643 PolarHBondContact OE2-SG 2.81Å; E592-L650 HydrophobicContact CB-CD1 4.44Å; E592-L650 HydrophobicContact CG-CD1 3.85Å; E592-L650 HydrophobicContact CG-CD2 4.48Å
593	A	98.9	Very high	96.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.4	-177.8	0	0	0	0	0	111.5	L591 V602 C603 A605 I617 F619 L637	L591-A593 HydrophobicContact CD1-CB 3.76Å; A593-V602 CarbonylContact O-C 3.6Å; A593-V602 WeakPolarHBondContact O-CA 3.38Å; A593-C603 PolarHBondContact N-O 2.82Å; A593-C603 PolarHBondContact O-N 3.32Å; A593-A605 HydrophobicContact CB-CB 3.55Å; A593-I617 HydrophobicContact CB-CG2 3.76Å; A593-F619 HydrophobicContact CB-CE1 3.79Å; A593-F619 HydrophobicContact CB-CZ 4.43Å; A593-L637 HydrophobicContact CB-CD2 3.72Å
594	V	98.8	Very high	96.8	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.024	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	133.1	164.4	176.1	0	0	0	0	108.3	R398 L596 P599 L601 V602 D636 Y638	R398-V594 VanDerWaalsContact CZ-CG2 3.45Å; V594-L596 HydrophobicContact CB-CD2 4.48Å; V594-L596 HydrophobicContact CG1-CD2 4.02Å; V594-L596 PolarHBondContact O-N 3.31Å; V594-P599 HydrophobicContact CG1-CB 4.32Å; V594-L601 WeakPolarHBondContact CA-O 3.14Å; V594-V602 HydrophobicContact CG2-CG2 4.01Å; V594-D636 HydrophobicContact CB-CB 3.95Å; V594-D636 WeakPolarHBondContact CB-O 3.26Å; V594-D636 HydrophobicContact CG2-CB 3.82Å; V594-D636 VanDerWaalsContact CG2-O 3.23Å; V594-D636 WeakPolarHBondContact CG2-O 3.37Å; V594-D636 PolarHBondContact N-O 2.83Å; V594-Y638 HydrophobicContact CG2-CE2 3.73Å
595	D	97.9	Very high	97.2	Very high	31 Å²	31	38.9 Å²	38.9	17%	0.166	20%	0.198	C	C	.	.			trans	-73	113.5	158.9	171.2	20.3	0	0	0	107.9	M597 E598 P599 L601 F619 Q628	D595-M597 PolarHBondContact O-N 2.8Å; D595-M597 WeakPolarHBondContact OD1-CB 3.47Å; D595-M597 PolarHBondContact OD1-N 3.08Å; D595-E598 CarbonylContact O-C 3.46Å; D595-E598 PolarHBondContact O-N 3.29Å; D595-E598 VanDerWaalsContact O-O 3.13Å; D595-E598 PolarHBondContact OD2-N 3.5Å; D595-P599 WeakPolarHBondContact O-CA 3.47Å; D595-P599 VanDerWaalsContact O-N 3.07Å; D595-L601 HydrophobicContact CB-CB 4.32Å; D595-L601 PolarHBondContact N-O 2.88Å; D595-F619 HydrophobicContact CB-CE1 4.4Å; D595-F619 HydrophobicContact CB-CZ 4.26Å; D595-Q628 PolarHBondContact OD1-NE2 3.44Å
596	L	95.6	Very high	97.3	Very high	50 Å²	50	39 Å²	39	26%	0.262	20%	0.199	S	C	.	.	S	Bend	trans	-76.3	-10	-178.2	-66	170.5	0	0	0	113.1	L491 V594 P599 V630 D636	L491-L596 HydrophobicContact CD1-CB 3.27Å; L491-L596 HydrophobicContact CD1-CD1 3.88Å; L491-L596 HydrophobicContact CD1-CG 4.22Å; V594-L596 HydrophobicContact CB-CD2 4.48Å; V594-L596 HydrophobicContact CG1-CD2 4.02Å; V594-L596 PolarHBondContact O-N 3.31Å; L596-P599 WeakPolarHBondContact O-CG 3.37Å; L596-V630 HydrophobicContact CD1-CG1 3.7Å; L596-D636 HydrophobicContact CD2-CB 3.96Å
597	M	93	Very high	97.4	Very high	106 Å²	106	36.7 Å²	36.7	52%	0.522	18%	0.183	S	C	.	.	S	Bend	trans	-83	-39	171.1	-60.5	-57.1	-64	0	0	111.9	L489 L491 D595 P599	L489-M597 WeakPolarHBondContact O-CE 3.49Å; L491-M597 HydrophobicContact CD1-SD 4.39Å; D595-M597 PolarHBondContact O-N 2.8Å; D595-M597 WeakPolarHBondContact OD1-CB 3.47Å; D595-M597 PolarHBondContact OD1-N 3.08Å; M597-P599 WeakPolarHBondContact O-CD 3.46Å
598	E	94.3	Very high	97.5	Very high	93 Å²	93	36.7 Å²	36.7	44%	0.435	18%	0.177	S	C	.	.	S	Bend	trans	-117.1	80	161.9	-162.5	-170.9	148.7	0	0	112.4	D595 R600 L601	D595-E598 CarbonylContact O-C 3.46Å; D595-E598 PolarHBondContact O-N 3.29Å; D595-E598 VanDerWaalsContact O-O 3.13Å; D595-E598 PolarHBondContact OD2-N 3.5Å; E598-R600 HydrophobicContact CG-CB 4.46Å; E598-R600 PolarHBondContact O-N 2.84Å; E598-L601 HydrophobicContact CB-CD1 4.09Å; E598-L601 HydrophobicContact CB-CG 4.15Å; E598-L601 HydrophobicContact CG-CD1 4.44Å; E598-L601 HydrophobicContact CG-CG 4.18Å; E598-L601 PolarHBondContact O-N 2.89Å
599	P	95.1	Very high	97.5	Very high	23 Å²	23	34.5 Å²	34.5	15%	0.149	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-0.5	-172.2	-28.8	36.8	0	0	0	118.3	R398 F417 W418 V594 D595 L596 M597	R398-P599 PolarHBondContact NH2-O 3.18Å; F417-P599 HydrophobicContact CE2-CG 4.48Å; W418-P599 HydrophobicContact CB-CB 4.06Å; W418-P599 VanDerWaalsContact CB-O 3.22Å; W418-P599 WeakPolarHBondContact CB-O 3.33Å; W418-P599 WeakPolarHBondContact O-CB 3.45Å; V594-P599 HydrophobicContact CG1-CB 4.32Å; D595-P599 WeakPolarHBondContact O-CA 3.47Å; D595-P599 VanDerWaalsContact O-N 3.07Å; L596-P599 WeakPolarHBondContact O-CG 3.37Å; M597-P599 WeakPolarHBondContact O-CD 3.46Å
600	R	95.3	Very high	97.4	Very high	159 Å²	159	35 Å²	35	60%	0.6	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-25.4	169.3	179.4	-178.1	174.5	-171.3	-4.4	112.1	W418 E598 Y648	W418-R600 HydrophobicContact CG-CB 4.44Å; E598-R600 HydrophobicContact CG-CB 4.46Å; E598-R600 PolarHBondContact O-N 2.84Å; R600-Y648 WeakPolarHBondContact O-CE1 3.44Å; R600-Y648 PolarHBondContact O-OH 3.31Å; R600-Y648 VanDerWaalsContact O-OH 3.05Å
601	L	97.3	Very high	97.2	Very high	40 Å²	40	34.6 Å²	34.6	21%	0.209	17%	0.165	C	C	.	.			trans	-85.1	141.1	179.5	-53.6	-176.8	0	0	0	110.1	V594 D595 E598 Q651	V594-L601 WeakPolarHBondContact CA-O 3.14Å; D595-L601 HydrophobicContact CB-CB 4.32Å; D595-L601 PolarHBondContact N-O 2.88Å; E598-L601 HydrophobicContact CB-CD1 4.09Å; E598-L601 HydrophobicContact CB-CG 4.15Å; E598-L601 HydrophobicContact CG-CD1 4.44Å; E598-L601 HydrophobicContact CG-CG 4.18Å; E598-L601 PolarHBondContact O-N 2.89Å; L601-Q651 HydrophobicContact CB-CG 4.26Å; L601-Q651 HydrophobicContact CD2-CG 4.15Å
602	V	98.6	Very high	96.8	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.4	162.7	177.3	0	0	0	0	105.9	E592 A593 V594 Y638 W642 Y648 L650 Q651	E592-V602 HydrophobicContact CB-CG1 3.98Å; A593-V602 CarbonylContact O-C 3.6Å; A593-V602 WeakPolarHBondContact O-CA 3.38Å; V594-V602 HydrophobicContact CG2-CG2 4.01Å; V602-Y638 HydrophobicContact CG1-CD2 4.3Å; V602-Y638 HydrophobicContact CG2-CE2 4.4Å; V602-W642 HydrophobicContact CG2-CZ3 4.37Å; V602-Y648 HydrophobicContact CB-CD1 4.16Å; V602-Y648 HydrophobicContact CB-CE1 4.29Å; V602-Y648 HydrophobicContact CG2-CD1 3.79Å; V602-Y648 HydrophobicContact CG2-CE1 3.65Å; V602-L650 HydrophobicContact CG1-CD1 4.33Å; V602-L650 CarbonylContact O-C 3.51Å; V602-L650 WeakPolarHBondContact O-CA 3.32Å; V602-Q651 PolarHBondContact O-N 2.73Å
603	C	98.6	Very high	96.6	Very high	13 Å²	13	38 Å²	38	9%	0.088	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	155.3	-163.3	-61.7	0	0	0	0	111	E592 A593 F619 Q651	E592-C603 WeakPolarHBondContact CA-O 3.39Å; A593-C603 PolarHBondContact N-O 2.82Å; A593-C603 PolarHBondContact O-N 3.32Å; C603-F619 HydrophobicContact CB-CD1 3.65Å; C603-F619 HydrophobicContact CB-CE1 4.09Å; C603-Q651 HydrophobicContact CB-CB 4.41Å
604	V	98.6	Very high	96.4	Very high	3 Å²	3	38 Å²	38	2%	0.018	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	126.1	166.7	172.7	0	0	0	0	108.6	F226 W228 Y231 D620 L650 Q651 P653	F226-V604 HydrophobicContact CD1-CG2 4.02Å; F226-V604 HydrophobicContact CE1-CG2 3.48Å; F226-V604 VanDerWaalsContact CE1-CG2 3.48Å; F226-V604 HydrophobicContact CE2-CG2 4.06Å; F226-V604 HydrophobicContact CZ-CB 4.43Å; F226-V604 HydrophobicContact CZ-CG1 4.08Å; F226-V604 HydrophobicContact CZ-CG2 3.51Å; W228-V604 HydrophobicContact CH2-CB 4.24Å; W228-V604 HydrophobicContact CH2-CG1 3.69Å; W228-V604 HydrophobicContact CH2-CG2 4.1Å; W228-V604 HydrophobicContact CZ2-CB 4.43Å; W228-V604 HydrophobicContact CZ2-CG1 4.33Å; W228-V604 HydrophobicContact CZ2-CG2 3.9Å; W228-V604 HydrophobicContact CZ3-CG1 4.07Å; Y231-V604 HydrophobicContact CD1-CG1 4.31Å; Y231-V604 HydrophobicContact CE1-CG1 3.85Å; V604-D620 HydrophobicContact CG1-CB 4Å; V604-D620 WeakPolarHBondContact CG1-OD2 3.1Å; V604-D620 PolarHBondContact O-N 3.49Å; V604-D620 VanDerWaalsContact O-N 3.08Å; V604-L650 HydrophobicContact CG2-CD1 4.07Å; V604-L650 HydrophobicContact CG2-CD2 3.91Å; V604-L650 HydrophobicContact CG2-CG 4.02Å; V604-Q651 WeakPolarHBondContact CG2-O 3.3Å; V604-Q651 PolarHBondContact N-O 3.42Å; V604-Q651 VanDerWaalsContact N-O 3.17Å; V604-P653 HydrophobicContact CB-CG 4.11Å; V604-P653 HydrophobicContact CG1-CG 3.84Å
605	A	98.8	Very high	96.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	158.9	-170.3	0	0	0	0	0	113.1	K590 L591 A593 I617 H618 F619	K590-A605 CarbonylContact C-O 3.45Å; K590-A605 WeakPolarHBondContact CA-O 3.28Å; L591-A605 HydrophobicContact CD1-CB 3.92Å; L591-A605 PolarHBondContact N-O 2.81Å; L591-A605 PolarHBondContact O-N 3.16Å; L591-A605 VanDerWaalsContact O-O 3.12Å; A593-A605 HydrophobicContact CB-CB 3.55Å; A605-I617 HydrophobicContact CB-CG2 3.88Å; A605-H618 CarbonylContact C-O 3.56Å; A605-H618 WeakPolarHBondContact CA-O 3.09Å; A605-H618 VanDerWaalsContact CB-O 3.22Å; A605-H618 WeakPolarHBondContact CB-O 3.18Å; A605-F619 HydrophobicContact CB-CD1 4.2Å
606	T	98.8	Very high	96.4	Very high	14 Å²	14	37.2 Å²	37.2	9%	0.086	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	137.6	-179.7	-60	0	0	0	0	110.8	M589 K590 K608 H618 D620	M589-T606 WeakPolarHBondContact O-CA 3.32Å; K590-T606 VanDerWaalsContact CD-OG1 3.3Å; K590-T606 WeakPolarHBondContact CD-OG1 3.36Å; K590-T606 PolarHBondContact NZ-OG1 2.84Å; T606-K608 PolarHBondContact O-N 3.2Å; T606-K608 VanDerWaalsContact O-N 3.1Å; T606-H618 PolarHBondContact N-O 3.44Å; T606-H618 PolarHBondContact O-N 3.28Å; T606-D620 WeakPolarHBondContact CB-OD1 3.13Å; T606-D620 PolarHBondContact N-OD1 3.32Å; T606-D620 VanDerWaalsContact N-OD1 3.16Å; T606-D620 PolarHBondContact OG1-OD1 2.72Å; T606-D620 PolarHBondContact OG1-OD2 2.57Å
607	V	98.7	Very high	96.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	103.8	163.7	-178.4	0	0	0	0	108.2	F585 S586 P587 N588 M589 L591 L615 I617	F585-V607 HydrophobicContact CD1-CG2 4Å; S586-V607 WeakPolarHBondContact O-CB 3.23Å; S586-V607 WeakPolarHBondContact O-CG1 3.41Å; P587-V607 CarbonylContact C-O 3.52Å; P587-V607 VanDerWaalsContact CA-O 3.26Å; P587-V607 WeakPolarHBondContact CA-O 3.11Å; N588-V607 PolarHBondContact N-O 2.84Å; M589-V607 HydrophobicContact CB-CB 4.49Å; M589-V607 HydrophobicContact CB-CG2 4.3Å; M589-V607 PolarHBondContact O-N 2.72Å; L591-V607 HydrophobicContact CD2-CG2 3.58Å; L591-V607 HydrophobicContact CG-CG2 4.42Å; V607-L615 HydrophobicContact CG1-CD2 4.26Å; V607-I617 HydrophobicContact CB-CD1 4.47Å; V607-I617 HydrophobicContact CG2-CD1 3.94Å
608	K	98.3	Very high	96.8	Very high	64 Å²	64	31.5 Å²	31.5	28%	0.278	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	-36.4	-179.6	-172.6	175.7	178.4	175.7	0	112.1	T606 L616 H618 D624 D627	T606-K608 PolarHBondContact O-N 3.2Å; T606-K608 VanDerWaalsContact O-N 3.1Å; K608-L616 HydrophobicContact CB-CG 4.48Å; K608-L616 HydrophobicContact CD-CD2 4.13Å; K608-L616 PolarHBondContact N-O 3.01Å; K608-H618 HydrophobicContact CB-CB 4.03Å; K608-H618 HydrophobicContact CD-CB 4.11Å; K608-D624 IonicContact NZ-OD1 3.11Å; K608-D624 PolarHBondContact NZ-OD1 3.04Å; K608-D624 IonicContact NZ-OD2 3.49Å; K608-D624 PolarHBondContact NZ-OD2 3.14Å; K608-D627 WeakPolarHBondContact CD-OD2 3.29Å; K608-D627 WeakPolarHBondContact CE-OD2 3.47Å; K608-D627 IonicContact NZ-OD1 3.86Å; K608-D627 IonicContact NZ-OD2 2.73Å; K608-D627 PolarHBondContact NZ-OD2 2.81Å
609	R	97.4	Very high	97	Very high	75 Å²	75	27.5 Å²	27.5	28%	0.283	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	147.9	-179.6	-116.1	174.2	76.1	160.3	11.8	112.3	N542 D543 L615 L616	N542-R609 PolarHBondContact O-NH2 3.3Å; D543-R609 PolarHBondContact O-NH1 2.86Å; D543-R609 PolarHBondContact O-NH2 3.45Å; R609-L615 CarbonylContact O-C 3.58Å; R609-L615 WeakPolarHBondContact O-CA 3.44Å; R609-L616 HydrophobicContact CB-CB 3.78Å; R609-L616 HydrophobicContact CB-CD2 4.39Å; R609-L616 PolarHBondContact N-O 2.72Å; R609-L616 PolarHBondContact O-N 2.71Å
610	C	96	Very high	97.1	Very high	41 Å²	41	26.7 Å²	26.7	28%	0.277	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128.2	168.3	-54.6	0	0	0	0	108.8	L615	C610-L615 HydrophobicContact CB-CD2 4.17Å
611	V	94.1	Very high	97.2	Very high	9 Å²	9	21.8 Å²	21.8	6%	0.055	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	88.5	-178.6	-174.2	0	0	0	0	109.6	F538 N542 I544 R613 L614 W629	F538-V611 HydrophobicContact CE1-CG1 4.28Å; F538-V611 HydrophobicContact CE2-CG1 4.44Å; F538-V611 HydrophobicContact CZ-CG1 3.68Å; N542-V611 HydrophobicContact CB-CG1 3.6Å; N542-V611 VanDerWaalsContact CG-CG1 3.47Å; N542-V611 WeakPolarHBondContact OD1-CG1 3.46Å; I544-V611 HydrophobicContact CD1-CG1 4.37Å; V611-R613 PolarHBondContact O-N 3.17Å; V611-L614 PolarHBondContact N-O 2.74Å; V611-L614 PolarHBondContact O-N 3.07Å; V611-W629 HydrophobicContact CB-CH2 4.47Å; V611-W629 HydrophobicContact CB-CZ3 4.19Å; V611-W629 HydrophobicContact CG2-CH2 3.67Å; V611-W629 HydrophobicContact CG2-CZ3 3.77Å
612	G	90.8	Very high	97.2	Very high	36 Å²	36	26.2 Å²	26.2	37%	0.371	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	-96.1	-175.7	0	0	0	0	0	111.5	N580 H583	N580-G612 PolarHBondContact ND2-O 2.69Å; N580-G612 PolarHBondContact OD1-O 2.95Å; H583-G612 PolarHBondContact NE2-O 2.92Å
613	R	93	Very high	97.1	Very high	36 Å²	36	32.4 Å²	32.4	14%	0.136	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-13.1	175	67.9	175.7	-66.8	-159.6	5	114.2	S529 N577 V611 D631 H632	S529-R613 PolarHBondContact O-NH1 3.27Å; N577-R613 PolarHBondContact ND2-NH1 3.32Å; V611-R613 PolarHBondContact O-N 3.17Å; R613-D631 IonicContact CZ-OD1 2.67Å; R613-D631 IonicContact CZ-OD2 2.96Å; R613-D631 IonicContact NE-OD1 3.83Å; R613-D631 PolarHBondContact NE-OD1 3.47Å; R613-D631 IonicContact NH2-OD1 2.65Å; R613-D631 PolarHBondContact NH2-OD1 3.01Å; R613-D631 IonicContact NH2-OD2 3.98Å; R613-D631 PolarHBondContact NH2-OD2 2.92Å; R613-H632 PolarHBondContact O-N 2.89Å
614	L	95.8	Very high	97	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	142.9	178.6	-69.3	179.7	0	0	0	110.8	I486 H531 L534 F538 V611 W629 V630	I486-L614 HydrophobicContact CD1-CD2 4.18Å; H531-L614 HydrophobicContact CB-CD2 3.85Å; L534-L614 HydrophobicContact CD1-CD1 4.17Å; L534-L614 HydrophobicContact CD2-CD1 4.14Å; F538-L614 HydrophobicContact CE1-CD1 4.03Å; F538-L614 HydrophobicContact CZ-CD1 3.99Å; V611-L614 PolarHBondContact N-O 2.74Å; V611-L614 PolarHBondContact O-N 3.07Å; L614-W629 HydrophobicContact CB-CE3 3.94Å; L614-W629 HydrophobicContact CB-CZ3 4.18Å; L614-W629 HydrophobicContact CD1-CE3 4.38Å; L614-V630 CarbonylContact C-O 3.43Å; L614-V630 WeakPolarHBondContact CA-O 3.45Å
615	L	97.7	Very high	96.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	136	168.7	-53.2	179.4	0	0	0	108.1	F585 V607 R609 C610 I617 W629 V630 H632 L637	F585-L615 HydrophobicContact CB-CD1 4.27Å; F585-L615 HydrophobicContact CB-CD2 4.05Å; F585-L615 HydrophobicContact CD1-CD1 4.13Å; F585-L615 HydrophobicContact CD2-CD1 3.78Å; F585-L615 HydrophobicContact CE1-CD1 4.38Å; F585-L615 HydrophobicContact CE2-CD1 4.06Å; F585-L615 HydrophobicContact CG-CD1 3.81Å; F585-L615 HydrophobicContact CG-CD2 4.45Å; F585-L615 HydrophobicContact CZ-CD1 4.35Å; V607-L615 HydrophobicContact CG1-CD2 4.26Å; R609-L615 CarbonylContact O-C 3.58Å; R609-L615 WeakPolarHBondContact O-CA 3.44Å; C610-L615 HydrophobicContact CB-CD2 4.17Å; L615-I617 HydrophobicContact CB-CD1 3.85Å; L615-I617 HydrophobicContact CB-CG1 4.31Å; L615-I617 HydrophobicContact CD1-CD1 4.34Å; L615-W629 WeakPolarHBondContact O-CA 3.25Å; L615-V630 HydrophobicContact CB-CG2 4.34Å; L615-V630 PolarHBondContact N-O 2.99Å; L615-V630 PolarHBondContact O-N 3.01Å; L615-H632 HydrophobicContact CD1-CB 4.11Å; L615-H632 HydrophobicContact CD2-CB 4.49Å; L615-H632 HydrophobicContact CG-CB 4.18Å; L615-L637 HydrophobicContact CD1-CD1 4.01Å
616	L	98.5	Very high	96.7	Very high	18 Å²	18	47.6 Å²	47.6	9%	0.094	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	119.6	162.2	-174.4	62.8	0	0	0	107.1	K608 R609 D627 W629	K608-L616 HydrophobicContact CB-CG 4.48Å; K608-L616 HydrophobicContact CD-CD2 4.13Å; K608-L616 PolarHBondContact N-O 3.01Å; R609-L616 HydrophobicContact CB-CB 3.78Å; R609-L616 HydrophobicContact CB-CD2 4.39Å; R609-L616 PolarHBondContact N-O 2.72Å; R609-L616 PolarHBondContact O-N 2.71Å; L616-D627 HydrophobicContact CD1-CB 3.68Å; L616-D627 HydrophobicContact CG-CB 4.08Å; L616-W629 HydrophobicContact CB-CD2 4.31Å; L616-W629 HydrophobicContact CB-CE3 3.95Å; L616-W629 HydrophobicContact CB-CH2 3.89Å; L616-W629 HydrophobicContact CB-CZ2 4.24Å; L616-W629 HydrophobicContact CB-CZ3 3.74Å; L616-W629 HydrophobicContact CD1-CD2 3.87Å; L616-W629 HydrophobicContact CD1-CE3 4.36Å; L616-W629 HydrophobicContact CD1-CG 4.13Å; L616-W629 HydrophobicContact CD1-CZ2 4.15Å; L616-W629 HydrophobicContact CD2-CH2 4.48Å; L616-W629 HydrophobicContact CD2-CZ2 4.25Å; L616-W629 HydrophobicContact CG-CZ2 4.46Å
617	I	98.8	Very high	96.7	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.01	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124.7	-176.9	-57.4	-60.8	0	0	0	108.8	L591 A593 A605 V607 L615 D627 Q628 V630 L637	L591-I617 HydrophobicContact CD1-CG2 4.42Å; L591-I617 HydrophobicContact CD2-CD1 4.23Å; A593-I617 HydrophobicContact CB-CG2 3.76Å; A605-I617 HydrophobicContact CB-CG2 3.88Å; V607-I617 HydrophobicContact CB-CD1 4.47Å; V607-I617 HydrophobicContact CG2-CD1 3.94Å; L615-I617 HydrophobicContact CB-CD1 3.85Å; L615-I617 HydrophobicContact CB-CG1 4.31Å; L615-I617 HydrophobicContact CD1-CD1 4.34Å; I617-D627 CarbonylContact O-C 3.58Å; I617-D627 VanDerWaalsContact O-CA 3.26Å; I617-D627 WeakPolarHBondContact O-CA 3.28Å; I617-Q628 PolarHBondContact N-O 2.96Å; I617-Q628 PolarHBondContact O-N 2.93Å; I617-V630 HydrophobicContact CD1-CG2 4.44Å; I617-V630 HydrophobicContact CG1-CG2 3.58Å; I617-L637 HydrophobicContact CD1-CD1 4.06Å; I617-L637 HydrophobicContact CD1-CD2 4.32Å; I617-L637 HydrophobicContact CG1-CD1 4.26Å; I617-L637 HydrophobicContact CG1-CD2 3.98Å; I617-L637 HydrophobicContact CG2-CD2 4.39Å
618	H	98.8	Very high	96.7	Very high	35 Å²	35	48 Å²	48	16%	0.162	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	138.6	176.8	174.6	72.3	0	0	0	110	A605 T606 K608 D620 W622 D627	A605-H618 CarbonylContact C-O 3.56Å; A605-H618 WeakPolarHBondContact CA-O 3.09Å; A605-H618 VanDerWaalsContact CB-O 3.22Å; A605-H618 WeakPolarHBondContact CB-O 3.18Å; T606-H618 PolarHBondContact N-O 3.44Å; T606-H618 PolarHBondContact O-N 3.28Å; K608-H618 HydrophobicContact CB-CB 4.03Å; K608-H618 HydrophobicContact CD-CB 4.11Å; H618-D620 IonicContact CD2-OD1 2.7Å; H618-W622 PolarHBondContact CE1-O 3.37Å; H618-D627 VanDerWaalsContact CA-OD1 3.27Å; H618-D627 WeakPolarHBondContact CA-OD1 3.13Å; H618-D627 WeakPolarHBondContact CB-OD1 3.33Å; H618-D627 IonicContact CG-OD1 3.42Å; H618-D627 IonicContact ND1-OD1 3.32Å; H618-D627 PolarHBondContact ND1-OD1 3.24Å
619	F	98.6	Very high	96.7	Very high	9 Å²	9	45.4 Å²	45.4	4%	0.039	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	114.9	175.2	-63	-78.2	0	0	0	109.6	A593 D595 C603 A605 G621 W622 F626 Q628	A593-F619 HydrophobicContact CB-CE1 3.79Å; A593-F619 HydrophobicContact CB-CZ 4.43Å; D595-F619 HydrophobicContact CB-CE1 4.4Å; D595-F619 HydrophobicContact CB-CZ 4.26Å; C603-F619 HydrophobicContact CB-CD1 3.65Å; C603-F619 HydrophobicContact CB-CE1 4.09Å; A605-F619 HydrophobicContact CB-CD1 4.2Å; F619-G621 PolarHBondContact O-N 2.99Å; F619-W622 HydrophobicContact CB-CB 4.26Å; F619-W622 HydrophobicContact CB-CG 4.25Å; F619-W622 WeakPolarHBondContact O-CB 3.43Å; F619-W622 PolarHBondContact O-N 2.9Å; F619-F626 WeakPolarHBondContact CD2-O 3.32Å; F619-F626 WeakPolarHBondContact CE2-O 3.45Å; F619-Q628 HydrophobicContact CE2-CB 4.45Å; F619-Q628 HydrophobicContact CE2-CG 3.93Å
620	D	97.9	Very high	96.7	Very high	6 Å²	6	42.1 Å²	42.1	3%	0.032	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	123.8	-166.1	-69.7	3.8	0	0	0	111.3	Y231 K590 V604 T606 H618 P653 P654	Y231-D620 PolarHBondContact OH-OD2 2.88Å; K590-D620 WeakPolarHBondContact CD-OD2 3.41Å; K590-D620 WeakPolarHBondContact CE-OD2 3.47Å; K590-D620 IonicContact NZ-OD1 3.59Å; K590-D620 IonicContact NZ-OD2 3.35Å; K590-D620 PolarHBondContact NZ-OD2 3.1Å; V604-D620 HydrophobicContact CG1-CB 4Å; V604-D620 WeakPolarHBondContact CG1-OD2 3.1Å; V604-D620 PolarHBondContact O-N 3.49Å; V604-D620 VanDerWaalsContact O-N 3.08Å; T606-D620 WeakPolarHBondContact CB-OD1 3.13Å; T606-D620 PolarHBondContact N-OD1 3.32Å; T606-D620 VanDerWaalsContact N-OD1 3.16Å; T606-D620 PolarHBondContact OG1-OD1 2.72Å; T606-D620 PolarHBondContact OG1-OD2 2.57Å; H618-D620 IonicContact CD2-OD1 2.7Å; D620-P653 HydrophobicContact CB-CB 4.37Å; D620-P653 HydrophobicContact CB-CG 3.96Å; D620-P653 VanDerWaalsContact O-CA 3.29Å; D620-P653 WeakPolarHBondContact O-CA 3.17Å; D620-P653 VanDerWaalsContact O-CB 3.26Å; D620-P653 WeakPolarHBondContact O-CB 3.34Å; D620-P654 WeakPolarHBondContact O-CD 3.43Å
621	G	95.9	Very high	96.7	Very high	55 Å²	55	40.5 Å²	40.5	57%	0.567	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.8	-0.9	-179.4	0	0	0	0	0	115.3	F619 P654	F619-G621 PolarHBondContact O-N 2.99Å; G621-P654 WeakPolarHBondContact O-CG 3.3Å
622	W	96.9	Very high	96.8	Very high	134 Å²	134	40.9 Å²	40.9	51%	0.508	21%	0.211	S	C	.	.	S	Bend	trans	-92.2	174.5	167.6	-66.1	84.9	0	0	0	111.4	H618 F619 F626 P654	H618-W622 PolarHBondContact CE1-O 3.37Å; F619-W622 HydrophobicContact CB-CB 4.26Å; F619-W622 HydrophobicContact CB-CG 4.25Å; F619-W622 WeakPolarHBondContact O-CB 3.43Å; F619-W622 PolarHBondContact O-N 2.9Å; W622-F626 HydrophobicContact CB-CB 4.46Å; W622-F626 HydrophobicContact CB-CD2 4.3Å; W622-F626 HydrophobicContact CE3-CD2 4.36Å; W622-F626 HydrophobicContact CE3-CE2 4.23Å; W622-F626 HydrophobicContact CE3-CZ 4.37Å; W622-P654 HydrophobicContact CD2-CG 4.48Å
623	E	96.4	Very high	97	Very high	130 Å²	130	44 Å²	44	61%	0.607	22%	0.216	S	C	*	.			trans	-82.8	158	-179.7	-54.8	171.1	133.8	0	0	110.6	E625 F626	E623-E625 WeakPolarHBondContact CB-OE2 3.24Å; E623-E625 PolarHBondContact O-N 3.24Å; E623-F626 HydrophobicContact CB-CD2 4Å; E623-F626 HydrophobicContact CB-CE2 4.12Å; E623-F626 PolarHBondContact O-N 2.95Å; E623-F626 VanDerWaalsContact O-N 3.1Å
624	D	96.5	Very high	97.2	Very high	96 Å²	96	42.9 Å²	42.9	51%	0.513	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-63	-24.8	-174.1	-90.5	10.6	0	0	0	113	K608 F626 D627	K608-D624 IonicContact NZ-OD1 3.11Å; K608-D624 PolarHBondContact NZ-OD1 3.04Å; K608-D624 IonicContact NZ-OD2 3.49Å; K608-D624 PolarHBondContact NZ-OD2 3.14Å; D624-F626 PolarHBondContact O-N 2.7Å; D624-D627 WeakPolarHBondContact O-CB 3.43Å; D624-D627 VanDerWaalsContact O-CG 3.24Å; D624-D627 PolarHBondContact O-N 2.94Å; D624-D627 VanDerWaalsContact O-N 3.12Å
625	E	95.6	Very high	97.2	Very high	145 Å²	145	43.6 Å²	43.6	68%	0.678	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-64	-15.8	176.4	-67.7	73.9	-168.6	0	0	113.6	E623	E623-E625 WeakPolarHBondContact CB-OE2 3.24Å; E623-E625 PolarHBondContact O-N 3.24Å
626	F	96.8	Very high	97.3	Very high	94 Å²	94	44.2 Å²	44.2	41%	0.412	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-94.7	-2.5	176	-62.7	-86.1	0	0	0	113.5	F619 W622 E623 D624	F619-F626 WeakPolarHBondContact CD2-O 3.32Å; F619-F626 WeakPolarHBondContact CE2-O 3.45Å; W622-F626 HydrophobicContact CB-CB 4.46Å; W622-F626 HydrophobicContact CB-CD2 4.3Å; W622-F626 HydrophobicContact CE3-CD2 4.36Å; W622-F626 HydrophobicContact CE3-CE2 4.23Å; W622-F626 HydrophobicContact CE3-CZ 4.37Å; E623-F626 HydrophobicContact CB-CD2 4Å; E623-F626 HydrophobicContact CB-CE2 4.12Å; E623-F626 PolarHBondContact O-N 2.95Å; E623-F626 VanDerWaalsContact O-N 3.1Å; D624-F626 PolarHBondContact O-N 2.7Å
627	D	98.4	Very high	97.3	Very high	10 Å²	10	43.5 Å²	43.5	5%	0.053	22%	0.218	C	C	.	.			trans	-61.1	144	177.8	-70.5	-7.4	0	0	0	111.9	G492 K608 L616 I617 H618 D624	G492-D627 WeakPolarHBondContact CA-O 3.43Å; G492-D627 PolarHBondContact N-O 3.04Å; K608-D627 WeakPolarHBondContact CD-OD2 3.29Å; K608-D627 WeakPolarHBondContact CE-OD2 3.47Å; K608-D627 IonicContact NZ-OD1 3.86Å; K608-D627 IonicContact NZ-OD2 2.73Å; K608-D627 PolarHBondContact NZ-OD2 2.81Å; L616-D627 HydrophobicContact CD1-CB 3.68Å; L616-D627 HydrophobicContact CG-CB 4.08Å; I617-D627 CarbonylContact O-C 3.58Å; I617-D627 VanDerWaalsContact O-CA 3.26Å; I617-D627 WeakPolarHBondContact O-CA 3.28Å; H618-D627 VanDerWaalsContact CA-OD1 3.27Å; H618-D627 WeakPolarHBondContact CA-OD1 3.13Å; H618-D627 WeakPolarHBondContact CB-OD1 3.33Å; H618-D627 IonicContact CG-OD1 3.42Å; H618-D627 IonicContact ND1-OD1 3.32Å; H618-D627 PolarHBondContact ND1-OD1 3.24Å; D624-D627 WeakPolarHBondContact O-CB 3.43Å; D624-D627 VanDerWaalsContact O-CG 3.24Å; D624-D627 PolarHBondContact O-N 2.94Å; D624-D627 VanDerWaalsContact O-N 3.12Å
628	Q	98.6	Very high	97.3	Very high	11 Å²	11	43.4 Å²	43.4	5%	0.051	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	131.1	-175.9	-65.9	175.4	16.3	0	0	112.5	L491 D595 I617 F619	L491-Q628 HydrophobicContact CB-CB 4.22Å; L491-Q628 HydrophobicContact CB-CG 4.07Å; D595-Q628 PolarHBondContact OD1-NE2 3.44Å; I617-Q628 PolarHBondContact N-O 2.96Å; I617-Q628 PolarHBondContact O-N 2.93Å; F619-Q628 HydrophobicContact CE2-CB 4.45Å; F619-Q628 HydrophobicContact CE2-CG 3.93Å
629	W	98.3	Very high	97.3	Very high	10 Å²	10	41.8 Å²	41.8	4%	0.038	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	124.7	171.5	-72.9	106.3	0	0	0	111.2	I486 L491 G492 I494 I544 V611 L614 L615 L616	I486-W629 HydrophobicContact CD1-CB 3.72Å; I486-W629 HydrophobicContact CG1-CB 4.21Å; I486-W629 HydrophobicContact CG2-CB 4.36Å; L491-W629 PolarHBondContact O-N 2.92Å; G492-W629 PolarHBondContact O-NE1 2.84Å; I494-W629 HydrophobicContact CD1-CD2 4.28Å; I494-W629 HydrophobicContact CD1-CG 4.25Å; I544-W629 HydrophobicContact CD1-CH2 3.83Å; I544-W629 HydrophobicContact CD1-CZ2 3.78Å; I544-W629 HydrophobicContact CG1-CH2 4.22Å; I544-W629 HydrophobicContact CG1-CZ2 4Å; I544-W629 HydrophobicContact CG2-CZ2 3.98Å; V611-W629 HydrophobicContact CB-CH2 4.47Å; V611-W629 HydrophobicContact CB-CZ3 4.19Å; V611-W629 HydrophobicContact CG2-CH2 3.67Å; V611-W629 HydrophobicContact CG2-CZ3 3.77Å; L614-W629 HydrophobicContact CB-CE3 3.94Å; L614-W629 HydrophobicContact CB-CZ3 4.18Å; L614-W629 HydrophobicContact CD1-CE3 4.38Å; L615-W629 WeakPolarHBondContact O-CA 3.25Å; L616-W629 HydrophobicContact CB-CD2 4.31Å; L616-W629 HydrophobicContact CB-CE3 3.95Å; L616-W629 HydrophobicContact CB-CH2 3.89Å; L616-W629 HydrophobicContact CB-CZ2 4.24Å; L616-W629 HydrophobicContact CB-CZ3 3.74Å; L616-W629 HydrophobicContact CD1-CD2 3.87Å; L616-W629 HydrophobicContact CD1-CE3 4.36Å; L616-W629 HydrophobicContact CD1-CG 4.13Å; L616-W629 HydrophobicContact CD1-CZ2 4.15Å; L616-W629 HydrophobicContact CD2-CH2 4.48Å; L616-W629 HydrophobicContact CD2-CZ2 4.25Å; L616-W629 HydrophobicContact CG-CZ2 4.46Å
630	V	97.6	Very high	97.3	Very high	6 Å²	6	41.3 Å²	41.3	4%	0.036	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	161.5	179.6	-61.9	0	0	0	0	111.7	L596 L614 L615 I617 L637	L596-V630 HydrophobicContact CD1-CG1 3.7Å; L614-V630 CarbonylContact C-O 3.43Å; L614-V630 WeakPolarHBondContact CA-O 3.45Å; L615-V630 HydrophobicContact CB-CG2 4.34Å; L615-V630 PolarHBondContact N-O 2.99Å; L615-V630 PolarHBondContact O-N 3.01Å; I617-V630 HydrophobicContact CD1-CG2 4.44Å; I617-V630 HydrophobicContact CG1-CG2 3.58Å; V630-L637 HydrophobicContact CG2-CD1 3.72Å; V630-L637 HydrophobicContact CG2-CD2 4.24Å; V630-L637 HydrophobicContact CG2-CG 4.15Å
631	D	96.4	Very high	97.3	Very high	8 Å²	8	41 Å²	41	4%	0.043	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	149.1	170.9	-163.5	42.8	0	0	0	112.5	H531 R613 Q633 S634	H531-D631 HydrophobicContact CB-CB 3.86Å; H531-D631 PolarHBondContact CD2-N 2.96Å; R613-D631 IonicContact CZ-OD1 2.67Å; R613-D631 IonicContact CZ-OD2 2.96Å; R613-D631 IonicContact NE-OD1 3.83Å; R613-D631 PolarHBondContact NE-OD1 3.47Å; R613-D631 IonicContact NH2-OD1 2.65Å; R613-D631 PolarHBondContact NH2-OD1 3.01Å; R613-D631 IonicContact NH2-OD2 3.98Å; R613-D631 PolarHBondContact NH2-OD2 2.92Å; D631-Q633 PolarHBondContact O-N 2.86Å; D631-Q633 VanDerWaalsContact O-N 3.16Å; D631-Q633 VanDerWaalsContact OD2-CB 3.31Å; D631-Q633 WeakPolarHBondContact OD2-CB 3.47Å; D631-Q633 PolarHBondContact OD2-N 3.33Å; D631-S634 WeakPolarHBondContact O-CB 3.34Å; D631-S634 PolarHBondContact O-N 3.05Å
632	H	95.4	Very high	97.4	Very high	16 Å²	16	38.5 Å²	38.5	7%	0.074	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-17.7	169.9	85.1	83.9	0	0	0	113.8	P581 H583 F585 R613 L615	P581-H632 WeakPolarHBondContact CG-NE2 3.32Å; H583-H632 HydrophobicContact CB-CB 3.82Å; H583-H632 WeakPolarHBondContact CB-ND1 3.37Å; H583-H632 AromaticContact CD2-CD2 3.78Å; H583-H632 AromaticContact CD2-CG 3.68Å; H583-H632 AromaticContact CG-CG 3.76Å; F585-H632 HydrophobicContact CD2-CB 4.08Å; F585-H632 HydrophobicContact CE2-CB 4.17Å; R613-H632 PolarHBondContact O-N 2.89Å; L615-H632 HydrophobicContact CD1-CB 4.11Å; L615-H632 HydrophobicContact CD2-CB 4.49Å; L615-H632 HydrophobicContact CG-CB 4.18Å
633	Q	94.8	Very high	97.5	Very high	103 Å²	103	32.4 Å²	32.4	48%	0.481	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	12.9	170.5	-50	-165.2	-23	0	0	113	D631	D631-Q633 PolarHBondContact O-N 2.86Å; D631-Q633 VanDerWaalsContact O-N 3.16Å; D631-Q633 VanDerWaalsContact OD2-CB 3.31Å; D631-Q633 WeakPolarHBondContact OD2-CB 3.47Å; D631-Q633 PolarHBondContact OD2-N 3.33Å
634	S	97	Very high	97.4	Very high	12 Å²	12	31.2 Å²	31.2	8%	0.084	15%	0.152	C	C	.	.			trans	-52.4	131.1	178.9	179.1	0	0	0	0	110.7	H247 D631 D636	H247-S634 PolarHBondContact CE1-O 2.78Å; H247-S634 PolarHBondContact ND1-O 3.28Å; D631-S634 WeakPolarHBondContact O-CB 3.34Å; D631-S634 PolarHBondContact O-N 3.05Å; S634-D636 PolarHBondContact O-N 3.34Å; S634-D636 PolarHBondContact OG-N 2.71Å
635	P	97.2	Very high	97.4	Very high	15 Å²	15	28.2 Å²	28.2	10%	0.097	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	6.9	177.3	35.8	-33.4	0	0	0	113	H420 W422 Y638	H420-P635 HydrophobicContact CB-CB 3.78Å; H420-P635 HydrophobicContact CB-CG 4.23Å; H420-P635 WeakPolarHBondContact CB-O 3.36Å; H420-P635 VanDerWaalsContact CG-O 3.29Å; H420-P635 WeakPolarHBondContact ND1-CB 3.43Å; W422-P635 HydrophobicContact CB-CB 4Å; W422-P635 HydrophobicContact CB-CG 4.4Å; P635-Y638 WeakPolarHBondContact O-CE1 3.41Å; P635-Y638 PolarHBondContact O-OH 2.85Å
636	D	98.5	Very high	97.4	Very high	13 Å²	13	22.3 Å²	22.3	7%	0.07	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	14.9	-175.2	-65.3	-76.4	0	0	0	111.7	R398 V594 L596 S634	R398-D636 IonicContact CZ-OD1 3.68Å; R398-D636 IonicContact NH1-OD1 3.91Å; R398-D636 PolarHBondContact NH1-OD1 3.29Å; R398-D636 IonicContact NH2-OD1 2.72Å; V594-D636 HydrophobicContact CB-CB 3.95Å; V594-D636 WeakPolarHBondContact CB-O 3.26Å; V594-D636 HydrophobicContact CG2-CB 3.82Å; V594-D636 VanDerWaalsContact CG2-O 3.23Å; V594-D636 WeakPolarHBondContact CG2-O 3.37Å; V594-D636 PolarHBondContact N-O 2.83Å; L596-D636 HydrophobicContact CD2-CB 3.96Å; S634-D636 PolarHBondContact O-N 3.34Å; S634-D636 PolarHBondContact OG-N 2.71Å
637	L	98.8	Very high	97.3	Very high	4 Å²	4	21 Å²	21	2%	0.021	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	139.3	164.4	-60.3	-178.6	0	0	0	109.8	F245 H247 L591 A593 L615 I617 V630	F245-L637 HydrophobicContact CD1-CB 4.19Å; F245-L637 VanDerWaalsContact CD1-O 3.26Å; F245-L637 WeakPolarHBondContact CD1-O 3.39Å; F245-L637 HydrophobicContact CE1-CB 3.92Å; H247-L637 PolarHBondContact CE1-O 3.03Å; H247-L637 PolarHBondContact NE2-O 2.83Å; H247-L637 VanDerWaalsContact NE2-O 3.14Å; L591-L637 HydrophobicContact CD1-CD2 4.1Å; L591-L637 HydrophobicContact CD2-CD1 4.4Å; A593-L637 HydrophobicContact CB-CD2 3.72Å; L615-L637 HydrophobicContact CD1-CD1 4.01Å; I617-L637 HydrophobicContact CD1-CD1 4.06Å; I617-L637 HydrophobicContact CD1-CD2 4.32Å; I617-L637 HydrophobicContact CG1-CD1 4.26Å; I617-L637 HydrophobicContact CG1-CD2 3.98Å; I617-L637 HydrophobicContact CG2-CD2 4.39Å; V630-L637 HydrophobicContact CG2-CD1 3.72Å; V630-L637 HydrophobicContact CG2-CD2 4.24Å; V630-L637 HydrophobicContact CG2-CG 4.15Å
638	Y	98.8	Very high	97.2	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152.6	-174.4	-54.1	-60.4	0	0	0	113	F245 H247 R398 E592 V594 V602 P635 W642	F245-Y638 WeakPolarHBondContact CE1-O 3.38Å; F245-Y638 WeakPolarHBondContact CZ-O 3.26Å; H247-Y638 AromaticContact CD2-CE1 3.83Å; H247-Y638 AromaticContact NE2-CD1 3.28Å; H247-Y638 VanDerWaalsContact NE2-CD1 3.28Å; H247-Y638 WeakPolarHBondContact NE2-CD1 3.41Å; H247-Y638 AromaticContact NE2-CE1 3.18Å; H247-Y638 WeakPolarHBondContact NE2-CE1 3.21Å; R398-Y638 PolarHBondContact NH1-OH 3.04Å; E592-Y638 PolarHBondContact N-O 2.85Å; E592-Y638 PolarHBondContact O-N 2.88Å; V594-Y638 HydrophobicContact CG2-CE2 3.73Å; V602-Y638 HydrophobicContact CG1-CD2 4.3Å; V602-Y638 HydrophobicContact CG2-CE2 4.4Å; P635-Y638 WeakPolarHBondContact O-CE1 3.41Å; P635-Y638 PolarHBondContact O-OH 2.85Å; Y638-W642 AromaticContact CD1-CD2 3.93Å; Y638-W642 HydrophobicContact CD1-CD2 3.93Å; Y638-W642 AromaticContact CD1-CE2 3.72Å; Y638-W642 HydrophobicContact CD1-CG 4.14Å; Y638-W642 HydrophobicContact CD1-CZ2 4.19Å; Y638-W642 AromaticContact CD1-NE1 3.75Å; Y638-W642 AromaticContact CD2-CD2 3.83Å; Y638-W642 HydrophobicContact CD2-CD2 3.83Å; Y638-W642 AromaticContact CD2-CE3 3.6Å; Y638-W642 HydrophobicContact CD2-CE3 3.6Å; Y638-W642 HydrophobicContact CD2-CH2 4.15Å; Y638-W642 HydrophobicContact CD2-CZ2 4.3Å; Y638-W642 AromaticContact CD2-CZ3 3.79Å; Y638-W642 HydrophobicContact CD2-CZ3 3.79Å; Y638-W642 AromaticContact CE1-CE2 3.97Å; Y638-W642 AromaticContact CE1-CZ2 3.98Å; Y638-W642 HydrophobicContact CE1-CZ2 3.98Å; Y638-W642 HydrophobicContact CE2-CD2 4.42Å; Y638-W642 HydrophobicContact CE2-CE3 4.14Å; Y638-W642 AromaticContact CE2-CH2 3.83Å; Y638-W642 HydrophobicContact CE2-CH2 3.83Å; Y638-W642 HydrophobicContact CE2-CZ2 4.07Å; Y638-W642 AromaticContact CE2-CZ3 3.86Å; Y638-W642 HydrophobicContact CE2-CZ3 3.86Å; Y638-W642 HydrophobicContact CG-CB 4.4Å; Y638-W642 AromaticContact CG-CD2 3.57Å; Y638-W642 HydrophobicContact CG-CD2 3.57Å; Y638-W642 AromaticContact CG-CE2 3.84Å; Y638-W642 AromaticContact CG-CE3 3.84Å; Y638-W642 HydrophobicContact CG-CE3 3.84Å; Y638-W642 AromaticContact CG-CG 3.83Å; Y638-W642 HydrophobicContact CG-CG 3.83Å; Y638-W642 HydrophobicContact CG-CZ2 4.38Å; Y638-W642 HydrophobicContact CG-CZ3 4.39Å; Y638-W642 AromaticContact CZ-CZ2 3.94Å
639	P	98.6	Very high	97.1	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.152	C	C	.	.			trans	-66.3	150.8	173.6	-6.4	17.9	0	0	0	111.7	V242 F245 A248 Y288 G641 W642	V242-P639 HydrophobicContact CB-CB 4.45Å; V242-P639 HydrophobicContact CB-CG 4.2Å; V242-P639 HydrophobicContact CG1-CG 3.99Å; V242-P639 HydrophobicContact CG2-CB 3.86Å; V242-P639 HydrophobicContact CG2-CG 4.04Å; F245-P639 HydrophobicContact CB-CG 4.16Å; F245-P639 HydrophobicContact CD2-CB 3.93Å; F245-P639 HydrophobicContact CD2-CG 3.51Å; F245-P639 HydrophobicContact CE2-CB 3.82Å; F245-P639 HydrophobicContact CE2-CG 3.93Å; F245-P639 HydrophobicContact CG-CG 3.89Å; F245-P639 HydrophobicContact CZ-CB 4.49Å; A248-P639 HydrophobicContact CB-CG 3.9Å; Y288-P639 HydrophobicContact CD2-CB 4.09Å; Y288-P639 HydrophobicContact CD2-CG 4.35Å; Y288-P639 HydrophobicContact CE2-CB 3.87Å; Y288-P639 HydrophobicContact CE2-CG 3.63Å; P639-G641 PolarHBondContact O-N 2.68Å; P639-W642 VanDerWaalsContact O-CB 3.23Å; P639-W642 WeakPolarHBondContact O-CB 3.19Å; P639-W642 PolarHBondContact O-N 2.96Å
640	V	98.7	Very high	97.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49	127.2	171.5	163.3	0	0	0	0	111.5	W228 L232 A239 Y288 K289 K590	W228-V640 HydrophobicContact CB-CG1 3.98Å; W228-V640 HydrophobicContact CD2-CB 4.34Å; W228-V640 HydrophobicContact CD2-CG1 3.57Å; W228-V640 HydrophobicContact CD2-CG2 4.04Å; W228-V640 HydrophobicContact CE3-CG1 4.03Å; W228-V640 HydrophobicContact CE3-CG2 3.99Å; W228-V640 HydrophobicContact CG-CG1 3.57Å; W228-V640 HydrophobicContact CH2-CG2 3.77Å; W228-V640 HydrophobicContact CZ2-CG2 3.83Å; W228-V640 HydrophobicContact CZ3-CG2 3.86Å; L232-V640 HydrophobicContact CD1-CG1 4.28Å; A239-V640 HydrophobicContact CB-CB 4.06Å; A239-V640 HydrophobicContact CB-CG2 3.58Å; Y288-V640 PolarHBondContact N-O 2.88Å; K289-V640 HydrophobicContact CG-CG1 4.03Å; K590-V640 HydrophobicContact CB-CG2 4.42Å
641	G	97.9	Very high	97.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	7.8	-177.4	0	0	0	0	0	115	E592 P639 E644 L645	E592-G641 WeakPolarHBondContact OE1-CA 3.37Å; E592-G641 PolarHBondContact OE1-N 3.31Å; P639-G641 PolarHBondContact O-N 2.68Å; G641-E644 PolarHBondContact O-N 3.25Å; G641-L645 PolarHBondContact O-N 2.64Å; G641-L645 VanDerWaalsContact O-N 3.09Å
642	W	98.4	Very high	97.1	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.008	19%	0.185	C	C	.	.	H	α-helix	trans	-66.2	-45.7	176.8	175.2	93.6	0	0	0	111.8	Y288 R398 E592 V602 Y638 P639 E644 L645 V646 Y648	Y288-W642 HydrophobicContact CD2-CB 4.39Å; Y288-W642 HydrophobicContact CE2-CB 4.01Å; R398-W642 HydrophobicContact CG-CH2 3.88Å; R398-W642 HydrophobicContact CG-CZ2 4.28Å; E592-W642 PolarHBondContact OE1-N 3.3Å; E592-W642 WeakPolarHBondContact OE2-CB 3.33Å; E592-W642 PolarHBondContact OE2-N 3.04Å; V602-W642 HydrophobicContact CG2-CZ3 4.37Å; Y638-W642 AromaticContact CD1-CD2 3.93Å; Y638-W642 HydrophobicContact CD1-CD2 3.93Å; Y638-W642 AromaticContact CD1-CE2 3.72Å; Y638-W642 HydrophobicContact CD1-CG 4.14Å; Y638-W642 HydrophobicContact CD1-CZ2 4.19Å; Y638-W642 AromaticContact CD1-NE1 3.75Å; Y638-W642 AromaticContact CD2-CD2 3.83Å; Y638-W642 HydrophobicContact CD2-CD2 3.83Å; Y638-W642 AromaticContact CD2-CE3 3.6Å; Y638-W642 HydrophobicContact CD2-CE3 3.6Å; Y638-W642 HydrophobicContact CD2-CH2 4.15Å; Y638-W642 HydrophobicContact CD2-CZ2 4.3Å; Y638-W642 AromaticContact CD2-CZ3 3.79Å; Y638-W642 HydrophobicContact CD2-CZ3 3.79Å; Y638-W642 AromaticContact CE1-CE2 3.97Å; Y638-W642 AromaticContact CE1-CZ2 3.98Å; Y638-W642 HydrophobicContact CE1-CZ2 3.98Å; Y638-W642 HydrophobicContact CE2-CD2 4.42Å; Y638-W642 HydrophobicContact CE2-CE3 4.14Å; Y638-W642 AromaticContact CE2-CH2 3.83Å; Y638-W642 HydrophobicContact CE2-CH2 3.83Å; Y638-W642 HydrophobicContact CE2-CZ2 4.07Å; Y638-W642 AromaticContact CE2-CZ3 3.86Å; Y638-W642 HydrophobicContact CE2-CZ3 3.86Å; Y638-W642 HydrophobicContact CG-CB 4.4Å; Y638-W642 AromaticContact CG-CD2 3.57Å; Y638-W642 HydrophobicContact CG-CD2 3.57Å; Y638-W642 AromaticContact CG-CE2 3.84Å; Y638-W642 AromaticContact CG-CE3 3.84Å; Y638-W642 HydrophobicContact CG-CE3 3.84Å; Y638-W642 AromaticContact CG-CG 3.83Å; Y638-W642 HydrophobicContact CG-CG 3.83Å; Y638-W642 HydrophobicContact CG-CZ2 4.38Å; Y638-W642 HydrophobicContact CG-CZ3 4.39Å; Y638-W642 AromaticContact CZ-CZ2 3.94Å; P639-W642 VanDerWaalsContact O-CB 3.23Å; P639-W642 WeakPolarHBondContact O-CB 3.19Å; P639-W642 PolarHBondContact O-N 2.96Å; W642-E644 VanDerWaalsContact C-N 3.25Å; W642-E644 PolarHBondContact O-N 3.17Å; W642-L645 WeakPolarHBondContact O-CB 3.31Å; W642-L645 PolarHBondContact O-N 3.42Å; W642-V646 HydrophobicContact CD2-CG1 4.17Å; W642-V646 HydrophobicContact CD2-CG2 4.01Å; W642-V646 HydrophobicContact CE3-CG2 3.94Å; W642-V646 HydrophobicContact CG-CG1 4.36Å; W642-V646 HydrophobicContact CH2-CG2 3.71Å; W642-V646 HydrophobicContact CZ2-CG1 4.13Å; W642-V646 HydrophobicContact CZ2-CG2 3.82Å; W642-V646 HydrophobicContact CZ3-CG2 3.78Å; W642-V646 WeakPolarHBondContact O-CG2 3.35Å; W642-V646 PolarHBondContact O-N 3Å; W642-Y648 HydrophobicContact CH2-CG 4.42Å; W642-Y648 HydrophobicContact CZ3-CD1 4.44Å; W642-Y648 HydrophobicContact CZ3-CG 4.1Å
643	C	98.1	Very high	97.1	Very high	5 Å²	5	33.3 Å²	33.3	3%	0.034	19%	0.185	C	C	.	.	H	α-helix	trans	-54.3	-42.4	175.6	-86.6	0	0	0	0	111.7	E592 G647 Y648 L650	E592-C643 WeakPolarHBondContact OE2-CB 3.2Å; E592-C643 PolarHBondContact OE2-N 3.45Å; E592-C643 PolarHBondContact OE2-SG 2.81Å; C643-G647 CarbonylContact O-C 3.51Å; C643-G647 WeakPolarHBondContact O-CA 3.21Å; C643-G647 PolarHBondContact O-N 2.98Å; C643-Y648 WeakPolarHBondContact CB-O 3.31Å; C643-Y648 PolarHBondContact O-N 2.85Å; C643-L650 HydrophobicContact CB-CB 3.93Å
644	E	95.9	Very high	96.9	Very high	105 Å²	105	31.3 Å²	31.3	49%	0.491	18%	0.181	S	C	.	.	H	α-helix	trans	-65.1	-42.4	175.8	-178.8	176.3	120.1	0	0	112.6	K289 S308 G641 W642	K289-E644 WeakPolarHBondContact CE-OE2 3.44Å; K289-E644 IonicContact NZ-OE1 3.46Å; K289-E644 PolarHBondContact NZ-OE1 3.12Å; K289-E644 IonicContact NZ-OE2 2.7Å; K289-E644 PolarHBondContact NZ-OE2 3.46Å; S308-E644 WeakPolarHBondContact CB-OE1 3.19Å; G641-E644 PolarHBondContact O-N 3.25Å; W642-E644 VanDerWaalsContact C-N 3.25Å; W642-E644 PolarHBondContact O-N 3.17Å
645	L	96.2	Very high	96	Very high	33 Å²	33	33.6 Å²	33.6	17%	0.173	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-44.6	176.4	167.3	60.3	0	0	0	112.4	P249 Y288 V310 L361 M365 G641 W642	P249-L645 HydrophobicContact CB-CD2 4.02Å; P249-L645 HydrophobicContact CG-CD2 3.99Å; Y288-L645 HydrophobicContact CD2-CD2 4.48Å; Y288-L645 HydrophobicContact CE1-CD2 4.18Å; Y288-L645 HydrophobicContact CE2-CD2 4.1Å; V310-L645 HydrophobicContact CB-CD1 3.99Å; V310-L645 HydrophobicContact CG2-CB 3.95Å; V310-L645 HydrophobicContact CG2-CD1 3.79Å; V310-L645 HydrophobicContact CG2-CD2 4.17Å; V310-L645 HydrophobicContact CG2-CG 4.17Å; L361-L645 HydrophobicContact CD1-CD1 4.25Å; L361-L645 HydrophobicContact CD1-CD2 4.3Å; L361-L645 HydrophobicContact CD2-CD1 4.42Å; M365-L645 HydrophobicContact CE-CD1 4.07Å; M365-L645 HydrophobicContact CE-CG 4.09Å; M365-L645 HydrophobicContact SD-CD2 4.4Å; M365-L645 HydrophobicContact SD-CG 4.38Å; G641-L645 PolarHBondContact O-N 2.64Å; G641-L645 VanDerWaalsContact O-N 3.09Å; W642-L645 WeakPolarHBondContact O-CB 3.31Å; W642-L645 PolarHBondContact O-N 3.42Å
646	V	95.6	Very high	94.7	Very high	21 Å²	21	35.6 Å²	35.6	13%	0.127	22%	0.216	C	C	.	.	H	α-helix	trans	-94	-10.8	-172	-49.5	0	0	0	0	113.8	M365 W642	M365-V646 HydrophobicContact CE-CG1 4.12Å; M365-V646 HydrophobicContact SD-CG1 4.38Å; W642-V646 HydrophobicContact CD2-CG1 4.17Å; W642-V646 HydrophobicContact CD2-CG2 4.01Å; W642-V646 HydrophobicContact CE3-CG2 3.94Å; W642-V646 HydrophobicContact CG-CG1 4.36Å; W642-V646 HydrophobicContact CH2-CG2 3.71Å; W642-V646 HydrophobicContact CZ2-CG1 4.13Å; W642-V646 HydrophobicContact CZ2-CG2 3.82Å; W642-V646 HydrophobicContact CZ3-CG2 3.78Å; W642-V646 WeakPolarHBondContact O-CG2 3.35Å; W642-V646 PolarHBondContact O-N 3Å
647	G	95.1	Very high	92.5	Very high	66 Å²	66	37.9 Å²	37.9	68%	0.68	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.1	34.4	-175	0	0	0	0	0	114	C643	C643-G647 CarbonylContact O-C 3.51Å; C643-G647 WeakPolarHBondContact O-CA 3.21Å; C643-G647 PolarHBondContact O-N 2.98Å
648	Y	96.2	Very high	89.8	Confident	32 Å²	32	44 Å²	44	13%	0.125	27%	0.265	C	S	.	.			trans	-96.1	155.9	174.5	-149.6	-93.6	0	0	0	111	V395 W418 R600 V602 W642 C643 L650	V395-Y648 HydrophobicContact CB-CD2 4.14Å; V395-Y648 HydrophobicContact CB-CE2 4.44Å; V395-Y648 HydrophobicContact CG1-CD2 3.82Å; W418-Y648 HydrophobicContact CE3-CE2 4.31Å; W418-Y648 HydrophobicContact CH2-CE2 4.06Å; W418-Y648 AromaticContact CZ3-CE2 3.75Å; W418-Y648 HydrophobicContact CZ3-CE2 3.75Å; R600-Y648 WeakPolarHBondContact O-CE1 3.44Å; R600-Y648 PolarHBondContact O-OH 3.31Å; R600-Y648 VanDerWaalsContact O-OH 3.05Å; V602-Y648 HydrophobicContact CB-CD1 4.16Å; V602-Y648 HydrophobicContact CB-CE1 4.29Å; V602-Y648 HydrophobicContact CG2-CD1 3.79Å; V602-Y648 HydrophobicContact CG2-CE1 3.65Å; W642-Y648 HydrophobicContact CH2-CG 4.42Å; W642-Y648 HydrophobicContact CZ3-CD1 4.44Å; W642-Y648 HydrophobicContact CZ3-CG 4.1Å; C643-Y648 WeakPolarHBondContact CB-O 3.31Å; C643-Y648 PolarHBondContact O-N 2.85Å; Y648-L650 PolarHBondContact O-N 3.25Å
649	Q	96.4	Very high	87.2	Confident	132 Å²	132	49.1 Å²	49.1	62%	0.617	29%	0.292	S	S	*	.			trans	-86.1	112.5	179.4	-176.4	62	57.2	0	0	110.7
650	L	97.7	Very high	84.3	Confident	19 Å²	19	53.2 Å²	53.2	10%	0.099	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	138	168.2	-175.1	61.4	0	0	0	110.3	F226 W228 E592 V602 V604 C643 Y648	F226-L650 HydrophobicContact CD1-CD2 3.75Å; F226-L650 HydrophobicContact CE1-CD2 4.09Å; W228-L650 HydrophobicContact CZ2-CD2 4.35Å; W228-L650 VanDerWaalsContact NE1-CD2 3.35Å; E592-L650 HydrophobicContact CB-CD1 4.44Å; E592-L650 HydrophobicContact CG-CD1 3.85Å; E592-L650 HydrophobicContact CG-CD2 4.48Å; V602-L650 HydrophobicContact CG1-CD1 4.33Å; V602-L650 CarbonylContact O-C 3.51Å; V602-L650 WeakPolarHBondContact O-CA 3.32Å; V604-L650 HydrophobicContact CG2-CD1 4.07Å; V604-L650 HydrophobicContact CG2-CD2 3.91Å; V604-L650 HydrophobicContact CG2-CG 4.02Å; C643-L650 HydrophobicContact CB-CB 3.93Å; Y648-L650 PolarHBondContact O-N 3.25Å
651	Q	97.5	Very high	81.4	Confident	62 Å²	62	59.2 Å²	59.2	29%	0.29	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	128.7	168.6	-51.3	-49.3	-49.2	0	0	109.8	L601 V602 C603 V604	L601-Q651 HydrophobicContact CB-CG 4.26Å; L601-Q651 HydrophobicContact CD2-CG 4.15Å; V602-Q651 PolarHBondContact O-N 2.73Å; C603-Q651 HydrophobicContact CB-CB 4.41Å; V604-Q651 WeakPolarHBondContact CG2-O 3.3Å; V604-Q651 PolarHBondContact N-O 3.42Å; V604-Q651 VanDerWaalsContact N-O 3.17Å
652	P	96	Very high	78.3	Confident	64 Å²	64	64.5 Å²	64.5	42%	0.416	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-72.9	163.7	173.1	31.5	-34.8	0	0	0	111.8	F226	F226-P652 HydrophobicContact CB-CB 4.14Å; F226-P652 HydrophobicContact CD2-CB 3.88Å; F226-P652 HydrophobicContact CG-CB 4.28Å
653	P	95	Very high	75.5	Confident	11 Å²	11	72.3 Å²	72.3	7%	0.071	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-55	137.2	161.3	-23.8	35.7	0	0	0	111	F226 V604 D620 L656	F226-P653 HydrophobicContact CE2-CG 4.33Å; V604-P653 HydrophobicContact CB-CG 4.11Å; V604-P653 HydrophobicContact CG1-CG 3.84Å; D620-P653 HydrophobicContact CB-CB 4.37Å; D620-P653 HydrophobicContact CB-CG 3.96Å; D620-P653 VanDerWaalsContact O-CA 3.29Å; D620-P653 WeakPolarHBondContact O-CA 3.17Å; D620-P653 VanDerWaalsContact O-CB 3.26Å; D620-P653 WeakPolarHBondContact O-CB 3.34Å; P653-L656 HydrophobicContact CB-CB 4.41Å; P653-L656 HydrophobicContact CG-CD2 4.3Å; P653-L656 WeakPolarHBondContact O-CB 3.42Å
654	P	90.9	Very high	72.3	Confident	62 Å²	62	76.6 Å²	76.6	40%	0.403	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	158.4	172.1	28.8	-35.4	0	0	0	111	D620 G621 W622 L656	D620-P654 WeakPolarHBondContact O-CD 3.43Å; G621-P654 WeakPolarHBondContact O-CG 3.3Å; W622-P654 HydrophobicContact CD2-CG 4.48Å; P654-L656 PolarHBondContact O-N 3.41Å
655	G	78.6	Confident	69.4	Low	60 Å²	60	75.3 Å²	75.3	62%	0.619	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	-32.7	-177.2	0	0	0	0	0	115.6	A657 H658	G655-A657 PolarHBondContact O-N 3.48Å; G655-A657 VanDerWaalsContact O-N 3.12Å; G655-H658 PolarHBondContact O-N 3.07Å
656	L	69.8	Low	66.6	Low	56 Å²	56	82.5 Å²	82.5	29%	0.293	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-36.4	-175.2	-170.4	68.4	0	0	0	113.4	F226 Y231 P653 P654 H658 L659	F226-L656 HydrophobicContact CD2-CD2 3.79Å; F226-L656 HydrophobicContact CE2-CD2 3.64Å; Y231-L656 HydrophobicContact CD2-CD2 4.35Å; P653-L656 HydrophobicContact CB-CB 4.41Å; P653-L656 HydrophobicContact CG-CD2 4.3Å; P653-L656 WeakPolarHBondContact O-CB 3.42Å; P654-L656 PolarHBondContact O-N 3.41Å; L656-H658 PolarHBondContact O-N 2.77Å; L656-L659 HydrophobicContact CD1-CD1 4.42Å; L656-L659 PolarHBondContact O-N 2.68Å
657	A	51.9	Low	63.6	Low	61 Å²	61	86.4 Å²	86.4	50%	0.504	51%	0.508	S	S	.	.	H	α-helix	trans	-60	-24.8	178.7	0	0	0	0	0	114.3	G655 T660	G655-A657 PolarHBondContact O-N 3.48Å; G655-A657 VanDerWaalsContact O-N 3.12Å; A657-T660 PolarHBondContact O-OG1 2.77Å
658	H	42.6	Very low	60.5	Low	133 Å²	133	93 Å²	93	62%	0.616	52%	0.518	S	S	*	.	H	α-helix	trans	-80.9	-16.8	-179.3	-117.3	-41	0	0	0	113.7	G655 L656 E661 N662	G655-H658 PolarHBondContact O-N 3.07Å; L656-H658 PolarHBondContact O-N 2.77Å; H658-E661 IonicContact ND1-OE2 2.67Å; H658-N662 PolarHBondContact O-ND2 2.74Å; H658-N662 VanDerWaalsContact O-ND2 3.12Å
659	L	44.6	Very low	57.4	Low	108 Å²	108	101.2 Å²	101.2	57%	0.565	55%	0.554	S	S	*	*	H	α-helix	trans	-78	-34.4	178.7	-63.3	175.8	0	0	0	111.7	L656 E661 N662	L656-L659 HydrophobicContact CD1-CD1 4.42Å; L656-L659 PolarHBondContact O-N 2.68Å; L659-E661 VanDerWaalsContact C-N 3.32Å; L659-E661 PolarHBondContact O-N 2.88Å; L659-N662 PolarHBondContact O-N 2.7Å
660	T	37.8	Very low	54	Low	86 Å²	86	101 Å²	101	53%	0.528	56%	0.564	S	S	.	*	H	α-helix	trans	-64	-29.3	-179	27.6	0	0	0	0	114.6	A657	A657-T660 PolarHBondContact O-OG1 2.77Å
661	E	36.4	Very low	50.8	Low	126 Å²	126	109.5 Å²	109.5	59%	0.589	60%	0.6	S	S	*	*	H	α-helix	trans	-71.2	-41.7	177.5	-62.6	-164.7	129.1	0	0	112	H658 L659 H663 S664	H658-E661 IonicContact ND1-OE2 2.67Å; L659-E661 VanDerWaalsContact C-N 3.32Å; L659-E661 PolarHBondContact O-N 2.88Å; E661-H663 VanDerWaalsContact C-N 3.33Å; E661-H663 PolarHBondContact O-N 3.11Å; E661-S664 WeakPolarHBondContact O-CB 3.23Å; E661-S664 PolarHBondContact O-N 3.13Å; E661-S664 PolarHBondContact O-OG 2.91Å
662	N	33	Very low	47.4	Very low	110 Å²	110	112.4 Å²	112.4	59%	0.588	62%	0.624	S	S	*	*	H	α-helix	trans	-65.7	-32.4	-172.9	-75.3	-52.7	0	0	0	113.4	H658 L659 S664	H658-N662 PolarHBondContact O-ND2 2.74Å; H658-N662 VanDerWaalsContact O-ND2 3.12Å; L659-N662 PolarHBondContact O-N 2.7Å; N662-S664 VanDerWaalsContact C-N 3.28Å; N662-S664 PolarHBondContact O-N 2.82Å
663	H	39.4	Very low	44.1	Very low	166 Å²	166	116 Å²	116	77%	0.769	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-73.3	-16.1	175.6	-75.2	-79.2	0	0	0	114	E661 A665	E661-H663 VanDerWaalsContact C-N 3.33Å; E661-H663 PolarHBondContact O-N 3.11Å; H663-A665 VanDerWaalsContact C-N 3.29Å; H663-A665 PolarHBondContact O-N 3.34Å
664	S	32	Very low	40.8	Very low	96 Å²	96	122 Å²	122	67%	0.671	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-75.1	-16.1	177.5	77.8	0	0	0	0	114	E661 N662	E661-S664 WeakPolarHBondContact O-CB 3.23Å; E661-S664 PolarHBondContact O-N 3.13Å; E661-S664 PolarHBondContact O-OG 2.91Å; N662-S664 VanDerWaalsContact C-N 3.28Å; N662-S664 PolarHBondContact O-N 2.82Å
665	A	35.8	Very low	37.7	Very low	77 Å²	77	127 Å²	127	64%	0.636	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-85.3	-21.4	-170.5	0	0	0	0	0	114.9	H663	H663-A665 VanDerWaalsContact C-N 3.29Å; H663-A665 PolarHBondContact O-N 3.34Å
666	Q	36.5	Very low	35.2	Very low	184 Å²	184	130 Å²	130	86%	0.86	70%	0.704	S	S	*	*	S	Bend	trans	-105.6	38	-165	-63	-160.7	7.2	0	0	116.1
667	S	33.1	Very low	33.2	Very low	104 Å²	104	138 Å²	138	73%	0.727	73%	0.73	S	S	*	*			trans	-137	52.2	175.8	78.2	0	0	0	0	115.7
668	K	30.1	Very low	31.9	Very low	203 Å²	203	143.7 Å²	143.7	88%	0.883	74%	0.744	S	S	*	*			trans	-128.7	99.5	170.7	-71.3	177.4	-175.9	163.7	0	112
669	K	29.3	Very low	31.1	Very low	206 Å²	206	148.1 Å²	148.1	90%	0.896	76%	0.755	S	S	*	*			trans	-64.7	142.3	171.9	-69.7	-175.6	178	179.9	0	110.6
670	P	26.5	Very low	30.2	Very low	128 Å²	128	153.5 Å²	153.5	83%	0.831	77%	0.768	S	S	*	*			trans	-74	157.5	-171.5	29.9	-36.2	0	0	0	113.5
671	K	29.3	Very low	29.6	Very low	197 Å²	197	161.1 Å²	161.1	86%	0.857	79%	0.787	S	S	*	*			trans	-119	149.6	164.2	-77	-173.2	176.8	-178.8	0	109.6
672	P	26.9	Very low	29.2	Very low	122 Å²	122	165.2 Å²	165.2	79%	0.792	80%	0.798	S	S	*	*			trans	-74.9	150.5	-162	28.8	-36.3	0	0	0	114.2
673	I	25.6	Very low	28.9	Very low	141 Å²	141	163.3 Å²	163.3	72%	0.723	80%	0.804	S	S	*	*			trans	-83	131.8	173.3	-63.8	167.7	0	0	0	109.4
674	V	26.8	Very low	28.3	Very low	135 Å²	135	167.6 Å²	167.6	82%	0.818	81%	0.814	S	S	*	*			trans	-126.1	129.2	161.2	178.8	0	0	0	0	108.1
675	H	25.6	Very low	28.1	Very low	169 Å²	169	172.4 Å²	172.4	78%	0.782	82%	0.823	S	S	*	*			trans	-82.7	136.6	-173.6	-63	-66.8	0	0	0	113.3
676	S	26.5	Very low	27.7	Very low	122 Å²	122	177.7 Å²	177.7	85%	0.853	83%	0.826	S	S	*	*			trans	-139.8	151.1	147.6	68.1	0	0	0	0	109.8
677	R	26.7	Very low	27.1	Very low	225 Å²	225	174.9 Å²	174.9	85%	0.849	82%	0.815	S	S	*	*			trans	-129.3	149.7	-167.3	-87.3	176.5	157.1	179.1	-6	110.8
678	K	25.6	Very low	27	Very low	180 Å²	180	175.5 Å²	175.5	78%	0.783	81%	0.809	S	S	*	*			trans	76.3	150.2	168.2	-58.9	159.2	-178.8	172.9	0	114.1
679	R	26.2	Very low	26.8	Very low	226 Å²	226	173.9 Å²	173.9	85%	0.853	80%	0.804	S	S	*	*			cis	-154.5	158.7	1.5	-130.3	167.7	-177.4	-177.6	-1.6	112.8
680	R	25.3	Very low	26.9	Very low	220 Å²	220	171.9 Å²	171.9	83%	0.83	80%	0.798	S	S	*	*			trans	-42.3	155.2	174.4	-65	171.3	165.2	175.6	-6.4	117.1
681	R	25.9	Very low	26.9	Very low	246 Å²	246	175 Å²	175	93%	0.928	80%	0.801	S	S	*	*				-153.6	145.5	126.2	-107.6	175	-170	-170.1	2.4	112.6
682	Y	26.3	Very low	26.9	Very low	212 Å²	212	170.4 Å²	170.4	83%	0.831	80%	0.8	S	S	*	*			trans	-80.6	164.2	163.8	-78.7	-129.7	0	0	0	108.6
683	G	27.1	Very low	26.7	Very low	70 Å²	70	169.8 Å²	169.8	72%	0.722	80%	0.799	S	S	*	*			cis	126	147.2	5.7	0	0	0	0	0	111.9
684	R	27.3	Very low	26.8	Very low	257 Å²	257	170.9 Å²	170.9	97%	0.97	81%	0.806	S	S	*	*			trans	-156.7	149	170.6	-123.4	176.7	-174.8	-173.3	-0	114.9
685	K	27.4	Very low	27	Very low	196 Å²	196	168.2 Å²	168.2	85%	0.852	80%	0.798	S	S	*	*			trans	-88.6	-174	170.1	-61.3	178	174.5	-178.3	0	109.5
686	R	27.7	Very low	27.1	Very low	188 Å²	188	165.8 Å²	165.8	71%	0.709	80%	0.801	S	S	*	*			cis	-150.1	-165.4	15	-146.5	170.7	161.9	-167	-0.5	106.2
687	M	23.5	Very low	27.2	Very low	125 Å²	125	167.3 Å²	167.3	62%	0.616	80%	0.799	S	S	*	*			cis	-160	136.6	10.3	-147.2	138.4	151.7	0	0	105.4
688	I	32.4	Very low	27	Very low	118 Å²	118	165.4 Å²	165.4	61%	0.605	80%	0.8	S	S	*	*				54	116.8	69.3	-52.9	174.3	0	0	0	114.8
689	Q	25.6	Very low	27.2	Very low	168 Å²	168	164.4 Å²	164.4	79%	0.785	80%	0.802	S	S	*	*			trans	-156.4	136.7	139.6	-168.6	74.3	38.1	0	0	108.3
690	E	30.4	Very low	28.1	Very low	164 Å²	164	158.5 Å²	158.5	77%	0.766	79%	0.793	S	S	*	*			trans	-116.6	161.2	173.4	-61.5	162.2	111.1	0	0	109.6
691	Q	27.1	Very low	28.2	Very low	193 Å²	193	156.4 Å²	156.4	90%	0.902	79%	0.793	S	S	*	*			trans	-168.6	158.5	139.6	-112.4	168.2	-9.8	0	0	112.8
692	A	29.3	Very low	28.2	Very low	101 Å²	101	149.8 Å²	149.8	84%	0.835	78%	0.784	S	S	*	*			trans	-155	165.7	-174.5	0	0	0	0	0	112.5
693	S	23.2	Very low	28.2	Very low	110 Å²	110	144.2 Å²	144.2	77%	0.769	78%	0.776	S	S	*	*			trans	-167.5	126.3	165.3	52.3	0	0	0	0	108
694	D	28	Very low	28.3	Very low	164 Å²	164	148.9 Å²	148.9	88%	0.877	78%	0.779	S	S	*	*				65.7	138.2	62.9	-84.2	-3.4	0	0	0	114.8
695	A	30.9	Very low	28.2	Very low	78 Å²	78	141.9 Å²	141.9	65%	0.645	77%	0.77	S	S	*	*			cis	-168.5	-171.9	-9	0	0	0	0	0	111.6
696	S	27.9	Very low	28	Very low	119 Å²	119	137.8 Å²	137.8	83%	0.832	77%	0.766	S	S	*	*			trans	90.6	146.9	160.1	77.5	0	0	0	0	119.2
697	N	27.1	Very low	27.9	Very low	154 Å²	154	137.9 Å²	137.9	82%	0.824	77%	0.774	S	S	*	*			cis	-171.1	148.8	-36.8	-140.7	22.3	0	0	0	109.3
698	E	23.3	Very low	28.3	Very low	185 Å²	185	137.4 Å²	137.4	86%	0.864	78%	0.781	S	S	*	*			trans	161.2	154.8	131.4	-89.9	-175.2	-179.7	0	0	114.9
699	L	28.6	Very low	27.8	Very low	158 Å²	158	140.9 Å²	140.9	83%	0.827	79%	0.794	S	S	*	*			trans	-164.6	160.6	-172	-110.4	171.3	0	0	0	106.3
700	P	45.3	Very low	28.2	Very low	103 Å²	103	140 Å²	140	67%	0.669	79%	0.794	S	S	*	*				-160.2	164.3	73.7	43.4	-22.1	0	0	0	119.8
701	E	27.6	Very low	28.1	Very low	175 Å²	175	138.1 Å²	138.1	82%	0.818	80%	0.796	S	S	*	*			trans	51.5	151.2	134.1	-68	-179.6	155.4	0	0	123.5
702	S	26.7	Very low	28.2	Very low	107 Å²	107	133.4 Å²	133.4	75%	0.748	79%	0.789	S	S	*	*			cis	-169.8	-165.2	-13.1	62.1	0	0	0	0	107.6
703	S	26.8	Very low	28	Very low	95 Å²	95	136.3 Å²	136.3	66%	0.664	79%	0.789	S	S	*	*			cis	-165	-173.7	-1.3	64.2	0	0	0	0	107.1
704	Q	28.2	Very low	28.1	Very low	169 Å²	169	140.5 Å²	140.5	79%	0.79	79%	0.794	S	S	*	*			cis	-163.4	148.4	-7.4	-142.8	-178.5	103.6	0	0	111.3
705	S	24.6	Very low	27.9	Very low	109 Å²	109	138.9 Å²	138.9	76%	0.762	79%	0.79	S	S	*	*			trans	68.5	163.7	158.7	92	0	0	0	0	118.3
706	S	23.6	Very low	27.6	Very low	111 Å²	111	143.1 Å²	143.1	78%	0.776	80%	0.796	S	S	*	*			cis	-153.5	168	-0.6	37.4	0	0	0	0	112.1
707	Q	26.9	Very low	27.9	Very low	189 Å²	189	142.4 Å²	142.4	88%	0.883	80%	0.797	S	S	*	*			trans	-114.3	155.2	167.5	-84	-168.5	-40.3	0	0	111.2
708	P	30.2	Very low	27.9	Very low	116 Å²	116	142.6 Å²	142.6	75%	0.753	79%	0.793	S	S	*	*				-145.9	171.8	124.4	38.1	-24	0	0	0	112.9
709	E	23.1	Very low	28.4	Very low	191 Å²	191	143.3 Å²	143.3	89%	0.893	80%	0.796	S	S	*	*			cis	-154.8	177.2	-33.7	-117.8	-171.2	144.3	0	0	108.7
710	I	34.3	Very low	28.4	Very low	150 Å²	150	143.7 Å²	143.7	77%	0.769	79%	0.794	S	S	*	*			trans	-92.2	164.5	-175.5	-20.3	178.5	0	0	0	111.4
711	P	27.8	Very low	27.6	Very low	124 Å²	124	147 Å²	147	81%	0.805	80%	0.801	S	S	*	*				-143.8	152.3	94.1	37.8	-23.4	0	0	0	115.3
712	A	29.7	Very low	27.9	Very low	93 Å²	93	146.4 Å²	146.4	77%	0.769	80%	0.801	S	S	*	*			trans	-108	142.8	167.1	0	0	0	0	0	110.3
713	I	23.4	Very low	28	Very low	163 Å²	163	146.7 Å²	146.7	84%	0.836	80%	0.798	S	S	*	*			trans	-124.9	144.1	169	-65.6	-178.8	0	0	0	108.6
714	K	25.6	Very low	28.1	Very low	198 Å²	198	147 Å²	147	86%	0.861	80%	0.798	S	S	*	*			trans	-104.3	144.5	179.3	-46.9	160	-177.7	170.4	0	109
715	T	25.3	Very low	28	Very low	129 Å²	129	145.4 Å²	145.4	79%	0.791	80%	0.8	S	S	*	*			trans	-151.7	164.2	146.1	0.3	0	0	0	0	111.6
716	E	24.2	Very low	28.1	Very low	168 Å²	168	148.6 Å²	148.6	79%	0.785	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-58.2	163.3	-171.1	-70.4	114.1	143.6	0	0	116.6
717	A	34.1	Very low	28.4	Very low	103 Å²	103	149.3 Å²	149.3	85%	0.851	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-80.5	120.6	156.8	0	0	0	0	0	109.1
718	E	26.3	Very low	28.3	Very low	159 Å²	159	148.1 Å²	148.1	74%	0.743	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-99	128.9	161.1	-74	-165.7	138.1	0	0	109.6	Q720	E718-Q720 PolarHBondContact O-N 2.88Å
719	E	34.5	Very low	28.3	Very low	199 Å²	199	148.1 Å²	148.1	93%	0.93	79%	0.791	S	S	*	*			trans	-77.5	100.5	169.8	-64.5	178.6	129.8	0	0	108.9	E721	E719-E721 PolarHBondContact O-N 3.16Å
720	Q	28.9	Very low	28.5	Very low	166 Å²	166	146.2 Å²	146.2	78%	0.776	78%	0.782	S	S	*	*			trans	-89.8	90.8	170.7	-68.6	-160.9	-0.6	0	0	111.3	E718 I722	E718-Q720 PolarHBondContact O-N 2.88Å; Q720-I722 PolarHBondContact O-N 3.01Å
721	E	28.4	Very low	28.1	Very low	174 Å²	174	147.3 Å²	147.3	81%	0.813	78%	0.784	S	S	*	*			trans	-28.2	115.6	163	-175.4	173.4	-149.8	0	0	113.9	E719 V723	E719-E721 PolarHBondContact O-N 3.16Å; E721-V723 PolarHBondContact O-N 3.04Å
722	I	32.6	Very low	28	Very low	162 Å²	162	150.4 Å²	150.4	83%	0.831	79%	0.79	S	S	*	*			trans	-72.7	100.5	172.1	-61.1	174.8	0	0	0	108.3	Q720 P724	Q720-I722 PolarHBondContact O-N 3.01Å; I722-P724 WeakPolarHBondContact O-CD 3.26Å
723	V	29.2	Very low	27.9	Very low	112 Å²	112	153.7 Å²	153.7	68%	0.679	79%	0.79	S	S	*	*			trans	-60.6	122.1	175	178.6	0	0	0	0	109.8	E721 V725	E721-V723 PolarHBondContact O-N 3.04Å; V723-V725 PolarHBondContact O-N 3.21Å
724	P	28.5	Very low	28.2	Very low	101 Å²	101	151.9 Å²	151.9	66%	0.656	79%	0.786	S	S	*	*			trans	-72.3	117.6	179.8	28.1	-33.6	0	0	0	110.8	I722 Q726	I722-P724 WeakPolarHBondContact O-CD 3.26Å; P724-Q726 PolarHBondContact O-N 3.27Å
725	V	26.2	Very low	28.4	Very low	137 Å²	137	148.3 Å²	148.3	83%	0.83	78%	0.783	S	S	*	*			trans	-68.2	105	170.9	177	0	0	0	0	108.9	V723 V727	V723-V725 PolarHBondContact O-N 3.21Å; V725-V727 PolarHBondContact O-N 2.9Å; V725-V727 VanDerWaalsContact O-N 3.07Å
726	Q	26.4	Very low	28.8	Very low	176 Å²	176	150 Å²	150	82%	0.822	79%	0.786	S	S	*	*			trans	-70.3	100.4	178.7	-66.9	-178.7	-11.3	0	0	110.8	P724 K728	P724-Q726 PolarHBondContact O-N 3.27Å; Q726-K728 PolarHBondContact O-N 3.43Å
727	V	30.3	Very low	28.7	Very low	125 Å²	125	151.1 Å²	151.1	76%	0.758	79%	0.791	S	S	*	*			trans	-70.8	108	163.3	-178.1	0	0	0	0	107.7	V725 V729	V725-V727 PolarHBondContact O-N 2.9Å; V725-V727 VanDerWaalsContact O-N 3.07Å; V727-V729 PolarHBondContact O-N 2.62Å
728	K	25.2	Very low	28.3	Very low	164 Å²	164	151.2 Å²	151.2	71%	0.713	79%	0.785	S	S	*	*			trans	-73.8	93.3	-177.8	-163.2	-164.8	-168.7	-160.1	0	110.6	Q726 E730	Q726-K728 PolarHBondContact O-N 3.43Å; K728-E730 VanDerWaalsContact CE-OE1 3.25Å; K728-E730 WeakPolarHBondContact CE-OE1 3.31Å; K728-E730 IonicContact NZ-OE1 2.65Å; K728-E730 PolarHBondContact NZ-OE1 2.92Å
729	V	29.4	Very low	29	Very low	116 Å²	116	148.9 Å²	148.9	70%	0.703	78%	0.784	S	S	*	*			trans	-76.8	118.3	165.5	-175.7	0	0	0	0	108	V727 E731	V727-V729 PolarHBondContact O-N 2.62Å; V729-E731 HydrophobicContact CG1-CG 4.17Å
730	E	27.1	Very low	28.5	Very low	151 Å²	151	147.7 Å²	147.7	71%	0.706	78%	0.778	S	S	*	*			trans	-104.2	105.1	165.8	-99.5	173.2	-172	0	0	108.7	K728	K728-E730 VanDerWaalsContact CE-OE1 3.25Å; K728-E730 WeakPolarHBondContact CE-OE1 3.31Å; K728-E730 IonicContact NZ-OE1 2.65Å; K728-E730 PolarHBondContact NZ-OE1 2.92Å
731	E	26.8	Very low	28.5	Very low	173 Å²	173	148.4 Å²	148.4	81%	0.808	78%	0.779	S	S	*	*			trans	-78.1	140.8	168.1	-62.3	-179.9	125	0	0	109.8	V729	V729-E731 HydrophobicContact CG1-CG 4.17Å
732	M	25.8	Very low	28.3	Very low	190 Å²	190	145.4 Å²	145.4	94%	0.936	77%	0.772	S	S	*	*			trans	-141.7	129.6	154.4	-166	161.7	63.5	0	0	108.9
733	E	28.5	Very low	28	Very low	162 Å²	162	145.9 Å²	145.9	76%	0.757	77%	0.771	S	S	*	*			trans	-93.6	178.6	-156.8	-60.4	-177.7	99.4	0	0	115.5
734	T	28	Very low	27.9	Very low	125 Å²	125	149.7 Å²	149.7	77%	0.767	78%	0.782	S	S	*	*			trans	86.5	154.9	154.3	78.6	0	0	0	0	118.2
735	P	30.8	Very low	27.8	Very low	122 Å²	122	149 Å²	149	79%	0.792	79%	0.785	S	S	*	*				-134.2	178	-59.1	38.1	-23.1	0	0	0	113.4
736	I	32.7	Very low	27.8	Very low	166 Å²	166	147.3 Å²	147.3	85%	0.851	78%	0.779	S	S	*	*			trans	-79.6	134.9	-178.3	-62.4	157.1	0	0	0	111.9
737	E	23.6	Very low	27.8	Very low	190 Å²	190	145.5 Å²	145.5	89%	0.888	77%	0.774	S	S	*	*			trans	-159.4	-177	132.4	-123.7	-177.7	-161.9	0	0	115
738	S	25.8	Very low	27.5	Very low	105 Å²	105	149.7 Å²	149.7	73%	0.734	78%	0.776	S	S	*	*			trans	-99.5	171.6	-150.8	82	0	0	0	0	115.5
739	P	39.6	Very low	28.1	Very low	111 Å²	111	146.8 Å²	146.8	72%	0.721	77%	0.774	S	S	*	*			trans	-95.8	141.8	-156.9	35.5	-35	0	0	0	116.1
740	H	25	Very low	27.9	Very low	173 Å²	173	148 Å²	148	80%	0.801	78%	0.782	S	S	*	*			trans	-167.2	136.4	137.6	-101.8	-59.7	0	0	0	113.6
741	K	28.1	Very low	27.8	Very low	181 Å²	181	149.8 Å²	149.8	79%	0.787	79%	0.787	S	S	*	*			trans	11.9	149.8	153.2	-61.2	174.2	177.3	175.3	0	119.4
742	T	23.8	Very low	27.9	Very low	111 Å²	111	150.8 Å²	150.8	68%	0.681	79%	0.792	S	S	*	*				176.7	135.6	87.8	-72.6	0	0	0	0	115.3
743	Q	27.3	Very low	27.9	Very low	172 Å²	172	149.8 Å²	149.8	80%	0.804	79%	0.785	S	S	*	*			trans	51.7	133.5	152.3	-66.2	160.9	21.4	0	0	125.3
744	Q	26.7	Very low	27.8	Very low	192 Å²	192	150.5 Å²	150.5	90%	0.897	79%	0.785	S	S	*	*				-116.2	156.2	111.5	-76.4	177.9	-20.8	0	0	107.1
745	A	26.5	Very low	27.7	Very low	88 Å²	88	151.2 Å²	151.2	73%	0.727	78%	0.782	S	S	*	*			cis	141.4	136.3	-9.6	0	0	0	0	0	107
746	S	25.9	Very low	27.6	Very low	100 Å²	100	151.9 Å²	151.9	70%	0.699	77%	0.774	S	S	*	*			cis	-166.2	134.1	-0.2	-149	0	0	0	0	113.2
747	L	26.7	Very low	27.4	Very low	139 Å²	139	150.6 Å²	150.6	73%	0.728	77%	0.765	S	S	*	*			trans	61.6	156.4	152.4	-57.1	173	0	0	0	118.7
748	R	23.4	Very low	27.5	Very low	212 Å²	212	148.4 Å²	148.4	80%	0.8	75%	0.754	S	S	*	*			cis	-166.6	-176.9	3.1	-123.4	169.7	-165.8	-164.6	7.4	108.3
749	P	39.1	Very low	27.5	Very low	104 Å²	104	149 Å²	149	68%	0.675	75%	0.753	S	S	*	*			cis	-140.8	-176.7	-6.2	34.2	-10.6	0	0	0	117.9
750	V	24.6	Very low	26.9	Very low	141 Å²	141	151.3 Å²	151.3	86%	0.855	76%	0.755	S	S	*	*			trans	87.2	151.1	160	-163.3	0	0	0	0	118.9
751	K	26.1	Very low	26.9	Very low	188 Å²	188	147.8 Å²	147.8	82%	0.817	75%	0.75	S	S	*	*			trans	-94.8	158.2	-167.6	-43.4	164	175.9	177.8	0	113
752	Q	27.2	Very low	26.7	Very low	195 Å²	195	145.3 Å²	145.3	91%	0.911	75%	0.75	S	S	*	*				-166.4	-172.8	107.3	-120.5	173.5	-36.3	0	0	112.8
753	E	26.5	Very low	27.1	Very low	168 Å²	168	151 Å²	151	79%	0.785	76%	0.759	S	S	*	*			trans	-115.4	163.1	-161	-54.7	-179.4	122.2	0	0	115.6
754	K	27.2	Very low	28.2	Very low	177 Å²	177	148.7 Å²	148.7	77%	0.77	76%	0.759	S	S	*	*			trans	91.3	143.9	136.6	-107.2	-178.4	178.2	177.6	0	123.1
755	M	25.5	Very low	28.1	Very low	140 Å²	140	143 Å²	143	69%	0.69	75%	0.753	S	S	*	*			trans	75	104.1	151.4	-78.4	172.7	69.6	0	0	121.9
756	E	28.1	Very low	28.1	Very low	137 Å²	137	149.1 Å²	149.1	64%	0.64	76%	0.757	S	S	*	*				63.4	127.8	111.6	-72	-164.3	105.6	0	0	123.6
757	Q	28.4	Very low	28	Very low	139 Å²	139	151 Å²	151	65%	0.65	76%	0.755	S	S	*	*			trans	66.8	157.7	140.2	-62.7	-172.4	47.4	0	0	117.6
758	Q	26.7	Very low	28	Very low	143 Å²	143	152.4 Å²	152.4	67%	0.668	76%	0.757	S	S	*	*			cis	-159.9	148.3	-17.9	-115.4	-179.7	21.9	0	0	108.3
759	T	25.8	Very low	28.1	Very low	117 Å²	117	148.8 Å²	148.8	72%	0.718	76%	0.759	S	S	*	*			trans	50.1	-175.8	152.8	69.3	0	0	0	0	117.3
760	E	26.9	Very low	27.4	Very low	160 Å²	160	147.5 Å²	147.5	75%	0.748	76%	0.764	S	S	*	*			cis	-148.5	151	-23.8	-140.5	176.9	135.3	0	0	110.2
761	S	25.4	Very low	27.6	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	76%	0.762	S	S	*	*			trans	61.1	176.5	155.2	71.8	0	0	0	0	117
762	T	23.5	Very low	28.2	Very low	129 Å²	129	142.8 Å²	142.8	79%	0.791	76%	0.758	S	S	*	*			cis	-145.1	157.1	1	-22.5	0	0	0	0	110.6
763	R	32.3	Very low	28.3	Very low	229 Å²	229	142.8 Å²	142.8	86%	0.864	76%	0.755	S	S	*	*			trans	-88.8	-172.3	156	-67.2	-177.4	168.4	-176.6	-3.4	108.7
764	P	50.3	Low	28.4	Very low	124 Å²	124	143.7 Å²	143.7	81%	0.805	76%	0.759	S	S	*	*			cis	-140.4	177.6	-0.9	43.1	-25.3	0	0	0	117.2
765	G	24.9	Very low	28.3	Very low	74 Å²	74	142.6 Å²	142.6	76%	0.763	76%	0.762	S	S	*	*			trans	88.6	171.5	149.7	0	0	0	0	0	117.1
766	R	26.5	Very low	28.4	Very low	215 Å²	215	145.6 Å²	145.6	81%	0.811	77%	0.771	S	S	*	*			cis	-167.2	164.5	-15.3	-149.3	169.1	-177.1	-120.2	10.3	108.2
767	E	24.2	Very low	28.3	Very low	141 Å²	141	150 Å²	150	66%	0.659	78%	0.782	S	S	*	*			trans	63.6	161.3	163.2	-78	140	-129.6	0	0	117.1
768	E	25.4	Very low	28.4	Very low	168 Å²	168	152.5 Å²	152.5	79%	0.785	79%	0.794	S	S	*	*			cis	-158.4	167.2	-40.2	-142.7	-174.7	-148.8	0	0	109.6
769	V	25.6	Very low	28.3	Very low	136 Å²	136	152.1 Å²	152.1	82%	0.824	80%	0.801	S	S	*	*			trans	53.5	129.5	160.1	-177.4	0	0	0	0	120.1
770	G	24.9	Very low	28.4	Very low	76 Å²	76	152.5 Å²	152.5	78%	0.784	80%	0.804	S	S	*	*			trans	157.2	90.6	156.2	0	0	0	0	0	117.7
771	S	28.8	Very low	28.4	Very low	116 Å²	116	151.6 Å²	151.6	81%	0.811	81%	0.809	S	S	*	*			trans	-92.4	154.5	159.3	30.2	0	0	0	0	109.4
772	P	38.1	Very low	28.5	Very low	114 Å²	114	155 Å²	155	74%	0.74	81%	0.814	S	S	*	*				-150.7	170.4	58.6	42	-21.5	0	0	0	119.5
773	K	29.4	Very low	28.7	Very low	196 Å²	196	154.8 Å²	154.8	85%	0.852	82%	0.818	S	S	*	*			trans	6.3	137.3	148.8	-50.4	174	-176	178.7	0	119.4
774	E	27.7	Very low	28.6	Very low	186 Å²	186	151.9 Å²	151.9	87%	0.869	81%	0.814	S	S	*	*				-138.2	162.4	128	-80.1	-138.9	119	0	0	110.5
775	N	27	Very low	27.6	Very low	154 Å²	154	151.8 Å²	151.8	82%	0.824	81%	0.806	S	S	*	*			trans	-93.9	156.8	173.7	-60.5	-51	0	0	0	109.9
776	F	26.4	Very low	27.9	Very low	204 Å²	204	156.3 Å²	156.3	90%	0.895	81%	0.805	S	S	*	*			trans	-127.7	143	155	-114.5	-93.6	0	0	0	112
777	R	27.2	Very low	28.1	Very low	230 Å²	230	152 Å²	152	87%	0.868	80%	0.798	S	S	*	*			trans	-100.3	150.5	175.4	-101.1	175.9	164.4	168.3	-7	109.4
778	E	29.1	Very low	28.3	Very low	191 Å²	191	151.5 Å²	151.5	89%	0.893	81%	0.805	S	S	*	*			trans	-69.6	145.7	165	-61.3	167.8	108.4	0	0	110.9
779	T	24.9	Very low	28.6	Very low	135 Å²	135	149.8 Å²	149.8	83%	0.828	80%	0.801	S	S	*	*			trans	-146.4	134.9	157.3	-46.1	0	0	0	0	109.5
780	T	27.7	Very low	28.8	Very low	125 Å²	125	151.4 Å²	151.4	77%	0.767	80%	0.8	S	S	*	*			trans	-77.3	148.9	-177.8	-44.8	0	0	0	0	113
781	V	26.7	Very low	29.1	Very low	140 Å²	140	157 Å²	157	85%	0.848	81%	0.805	S	S	*	*			trans	-136	145.5	158	-176.9	0	0	0	0	109.1
782	Q	27.6	Very low	29.1	Very low	172 Å²	172	155.3 Å²	155.3	80%	0.804	81%	0.806	S	S	*	*			trans	-103	168.5	-175.1	-58.6	160.1	-66	0	0	112.1
783	S	27.9	Very low	28.7	Very low	125 Å²	125	158.1 Å²	158.1	87%	0.874	81%	0.814	S	S	*	*			trans	-146.8	147.8	152.6	55.8	0	0	0	0	110.7
784	E	30.5	Very low	28.8	Very low	168 Å²	168	158.7 Å²	158.7	79%	0.785	82%	0.817	S	S	*	*			trans	-119.1	-176.9	-165.9	-55.5	179	111.4	0	0	113.7
785	N	28.7	Very low	29.1	Very low	122 Å²	122	154.9 Å²	154.9	65%	0.652	82%	0.817	S	S	*	*			trans	106.3	135.1	164.2	-61.1	-87.5	0	0	0	115
786	K	31.3	Very low	29.2	Very low	168 Å²	168	151.4 Å²	151.4	73%	0.73	82%	0.818	S	S	*	*			cis	-162	163.6	-8.8	-123	172.1	-175.6	134.3	0	111.5
787	N	30.6	Very low	29.5	Very low	125 Å²	125	147.2 Å²	147.2	67%	0.668	81%	0.814	S	S	*	*			trans	5.7	146.5	161.6	-52.2	17.7	0	0	0	119.3
788	T	28.7	Very low	29.6	Very low	131 Å²	131	147 Å²	147	80%	0.804	81%	0.813	S	S	*	*				-167.2	157.7	56.6	49.3	0	0	0	0	111
789	D	31.1	Very low	30	Very low	131 Å²	131	145.3 Å²	145.3	70%	0.701	81%	0.805	S	S	*	*			cis	-170.6	-165.3	-18.4	-115.9	-77.7	0	0	0	109.3
790	Q	30.3	Very low	30.3	Very low	171 Å²	171	146.8 Å²	146.8	80%	0.799	81%	0.808	S	S	*	*			trans	77.1	95.5	165.9	-76.3	-175	-14.9	0	0	121.4
791	E	31.1	Very low	30.7	Very low	192 Å²	192	148 Å²	148	90%	0.897	81%	0.81	S	S	*	*				41.3	127	123.2	-57.3	-170.9	132.2	0	0	122.5
792	G	28.7	Very low	30.8	Very low	81 Å²	81	144.7 Å²	144.7	84%	0.835	80%	0.804	S	S	*	*			trans	-178.9	68.7	170.8	0	0	0	0	0	115.5
793	L	31.3	Very low	31.1	Very low	173 Å²	173	141.8 Å²	141.8	91%	0.906	80%	0.802	S	S	*	*			trans	-70.6	126.2	-176.8	-74.6	155.8	0	0	0	114.2
794	K	31.6	Very low	31.3	Very low	208 Å²	208	143.8 Å²	143.8	90%	0.904	80%	0.798	S	S	*	*				179.4	146.3	112.1	-98.4	168.4	-174.4	177.2	0	113.8
795	A	33.4	Very low	31.3	Very low	106 Å²	106	142.6 Å²	142.6	88%	0.876	80%	0.797	S	S	*	*			trans	-98.1	156.1	164.5	0	0	0	0	0	110.6
796	G	28.7	Very low	31.3	Very low	82 Å²	82	140.8 Å²	140.8	85%	0.845	81%	0.808	S	S	*	*			trans	-170.1	87.9	178.2	0	0	0	0	0	112
797	S	32.1	Very low	31.2	Very low	116 Å²	116	139.9 Å²	139.9	81%	0.811	81%	0.808	S	S	*	*			trans	-91.1	139.2	175.1	46.6	0	0	0	0	111.4
798	R	30.6	Very low	31.2	Very low	224 Å²	224	146.5 Å²	146.5	85%	0.845	82%	0.824	S	S	*	*				-175.2	160.8	120.7	-106.3	-168.4	158.9	121.8	-1.8	115.6
799	E	36.5	Very low	31.4	Very low	157 Å²	157	147.5 Å²	147.5	73%	0.734	82%	0.819	S	S	*	*			trans	-57.8	155.4	168.7	-49.3	112.1	136	0	0	112.5
800	N	31.2	Very low	31.4	Very low	166 Å²	166	146 Å²	146	89%	0.888	82%	0.819	S	S	*	*				-150.7	152.8	129	-148.4	18.7	0	0	0	111.6
801	D	36.2	Very low	31.3	Very low	151 Å²	151	146.1 Å²	146.1	81%	0.807	83%	0.825	S	S	*	*			trans	-105.6	162.6	178.1	-168	4	0	0	0	109.9
802	G	29.2	Very low	31.5	Very low	69 Å²	69	142.8 Å²	142.8	71%	0.711	82%	0.818	S	S	*	*			trans	165.8	106.8	178.6	0	0	0	0	0	115.8
803	S	33.4	Very low	31.7	Very low	111 Å²	111	147.5 Å²	147.5	78%	0.776	82%	0.818	S	S	*	*			trans	-83.7	157	169.2	-45.8	0	0	0	0	112.2
804	Q	31.2	Very low	31.8	Very low	167 Å²	167	147.9 Å²	147.9	78%	0.78	82%	0.815	S	S	*	*				175.6	140.8	111.8	-92.7	-162.7	-88.9	0	0	114.1
805	D	31.6	Very low	31.8	Very low	143 Å²	143	144 Å²	144	77%	0.765	80%	0.804	S	S	*	*			trans	22.3	132.6	137.6	-45.5	-43.4	0	0	0	121.3
806	G	29.5	Very low	31.7	Very low	85 Å²	85	147.2 Å²	147.2	88%	0.876	80%	0.801	S	S	*	*			trans	-165.5	61.9	173.9	0	0	0	0	0	113.7
807	M	29.3	Very low	31.9	Very low	149 Å²	149	148.4 Å²	148.4	73%	0.734	80%	0.803	S	S	*	*			trans	-97.9	123.5	178.6	177	174.7	172.2	0	0	111.3	E809	M807-E809 HydrophobicContact CE-CG 3.86Å
808	W	30	Very low	31.9	Very low	264 Å²	264	146 Å²	146	100%	1	80%	0.797	S	S	*	*			trans	-132.9	137.6	164.9	-85.5	-10.9	0	0	0	110.3
809	E	31.7	Very low	32	Very low	152 Å²	152	144.3 Å²	144.3	71%	0.71	80%	0.798	S	S	*	*			trans	-109.1	162.4	177.5	-66	-175.6	116.8	0	0	111.3	M807	M807-E809 HydrophobicContact CE-CG 3.86Å
810	S	32.3	Very low	32	Very low	100 Å²	100	142.6 Å²	142.6	70%	0.699	80%	0.799	S	S	*	*			trans	56.3	122.9	152.2	61.7	0	0	0	0	120.3
811	N	28.6	Very low	32.5	Very low	173 Å²	173	143.2 Å²	143.2	93%	0.925	80%	0.796	S	S	*	*				-148.3	160.1	125	-113	-19.4	0	0	0	110.2
812	T	34.4	Very low	32.9	Very low	122 Å²	122	143.6 Å²	143.6	75%	0.748	80%	0.799	S	S	*	*			trans	-145	124.7	-160.8	-44.6	0	0	0	0	111.9
813	E	32.3	Very low	33.6	Very low	179 Å²	179	147.6 Å²	147.6	84%	0.836	80%	0.802	S	S	*	*			trans	-165.3	130.3	166.2	-103.1	153.6	167	0	0	104.9
814	Q	33.8	Very low	34.3	Very low	181 Å²	181	149.6 Å²	149.6	85%	0.846	80%	0.804	S	S	*	*				57.2	128.4	61	-64.7	-173	-27.4	0	0	111.2
815	D	31.6	Very low	35.1	Very low	126 Å²	126	152 Å²	152	67%	0.674	83%	0.83	S	S	*	*			cis	-163.9	-177.2	31.2	-162.7	18.1	0	0	0	113.4
816	Q	31.9	Very low	35.2	Very low	175 Å²	175	152.5 Å²	152.5	82%	0.818	83%	0.833	S	S	*	*			trans	82.5	153.1	154.1	-84.6	156.5	62.4	0	0	122.7
817	A	33.3	Very low	35.5	Very low	107 Å²	107	156.1 Å²	156.1	88%	0.884	83%	0.831	S	S	*	*			trans	-126.4	173.8	-163.3	0	0	0	0	0	112.8
818	G	31.6	Very low	35.9	Very low	66 Å²	66	156.4 Å²	156.4	68%	0.68	84%	0.836	S	S	*	*			trans	174.6	97.4	170.6	0	0	0	0	0	107.6
819	E	32.9	Very low	36.2	Very low	187 Å²	187	150.1 Å²	150.1	87%	0.874	83%	0.827	S	S	*	*				76.4	105.3	84.2	-74.4	-165.2	146.3	0	0	114
820	T	36.8	Very low	36.5	Very low	122 Å²	122	150 Å²	150	75%	0.748	83%	0.834	S	S	*	*			trans	17.8	134.7	144.3	53.7	0	0	0	0	121.2
821	E	42	Very low	36.8	Very low	178 Å²	178	153.3 Å²	153.3	83%	0.832	84%	0.843	S	S	*	*				-155.5	130.7	114.3	-116.1	173.5	-167.4	0	0	111.7
822	D	43.3	Very low	37.4	Very low	160 Å²	160	151.9 Å²	151.9	86%	0.856	84%	0.837	S	S	*	*			trans	-101.6	127.7	167.7	-72.3	-63.9	0	0	0	108.5
823	I	43.9	Very low	37.6	Very low	152 Å²	152	154.2 Å²	154.2	78%	0.779	84%	0.844	S	S	*	*			trans	-142.9	128	163.3	-56.3	-176.6	0	0	0	109.6
824	D	49.2	Very low	38.1	Very low	154 Å²	154	152.2 Å²	152.2	82%	0.824	85%	0.845	S	S	*	*			trans	-70.9	154.6	175.3	-64.4	-73.2	0	0	0	114
825	V	46.4	Very low	38.4	Very low	218 Å²	218	149.5 Å²	149.5	100%	1.321	85%	0.845	S	S	*	*				-170.2	0	120.9	144.9	0	0	0	0	110.5

Retrieved 825 of 825 residues in 1764.4 ms (Link to these results)

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