A0A087X8M5_POEFO Loading...

Immunoglobulin superfamily member 3

AlphaFold DB , UniProt , Accession A0A087X8M5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,054 aa.

						>A0A087X8M5_POEFO|A0A087X8M5
MATGALLLACALLAGVAVAQRVVTVQSGPLVRTEGSHVTIWCNVTGYKDGVKQDFDWSMYLPSVPEREIRIVSTAQSDYAYAVYAQRVNSKEIFVERLSDDSAVLHITKVQARDQGVFECYTPNTDGRYLGSYSARTNLTVIPDSLTVTAPPQTLSKVEGDTLQLNCEVSRTTMQHTHLSVGWYLRSPENATAPPQELVTLSRDFVLRSGGPYRQRMAAGDLRLDKTSATSYRLTIHKLQPVDQGLLYCQAVEWIQDPDGSWFAMTRKQSEKTQLRIQPTDRDFSIQVSTERRSFMAGESLELRCTIEAQNVPERFFSVSWVFSSSPVAVVGPSAVPVLGPGYVAREAAGLVTVRKESPNIHLLKLHRLSTEDSGKYICRVTEREKTPTGDFIDRSKRSRNVQITVQPLKNNTTVSLSANSSEVLEGDPIQLICSVNSAIAPLTVVWQWTDRQSAGPIQEVAAVDRDGTVTHGPSYRERSGYGEIRVERVRPNIFSLSLYNALPGDEGQYRCSATQWINIGTETEPNWEKVGEQSATKTVTVKTVESSFMVSASSRTPSISFGDSFDLLCLVKPRHNPRVPTSVTWRFMPAGAQDDDQGEFKDLVTFTREGTLQWGEQLLGLGTRTTVDRSHSNTNFRLSVTRAGRREAGKYQCTAILWRKNYDNSWSRVANRTSNLLGINVLQPESRLKVQKNNQSLVYQEDSRVRINCSITSQTSQDSQHAVLWYIRRAAGSETDELLLRIERTGAFEYGAYADEERLRRRVQAERLSPRLYALTLNRAESSDSGTYYCLVEEWLSDPDGAWYRLSRDTSGYTRVLVKQPEPQLRVDELENNVTVEESSSIRLGCNIFSQSSPDSRFSVFWYVDRSDDEDIEDQPGEDDDKRDCVFSIGHDAIFGNGNCSPPDDNGPNSRFQFERTTSDQYSLTIHGARPADAGRYYCHVEEWLLNPRNEWYRLATNNSGVTIVNVLQQVSTIHSVVCSNESLFYFLFFYPFPIFGILLIALLVVRYKGRNNNKSQEGKNGAPLLWIKEPHLSYSPTCLDPPALSLHPGSVD
					

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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	53.2	Low	51.7	Low	242 Å²	242	119.8 Å²	119.8	100%	1.192	77%	0.769	S	S	*	*				0	173.1	0	-61.2	-176.8	-166.4	0	0	108.8
2	A	52.1	Low	51.5	Low	102 Å²	102	122.5 Å²	122.5	84%	0.843	77%	0.772	S	S	*	*			trans	68.7	50.1	163.4	0	0	0	0	0	119.6
3	T	49.3	Very low	51.1	Low	140 Å²	140	125.4 Å²	125.4	86%	0.859	78%	0.777	S	S	*	*	S	Bend	trans	-133.9	-0.1	156.5	47.4	0	0	0	0	114.8
4	G	49.2	Very low	50.7	Low	64 Å²	64	122.8 Å²	122.8	66%	0.66	77%	0.774	S	S	*	*	S	Bend	trans	-86	-9.9	-172.4	0	0	0	0	0	117.2
5	A	53.6	Low	50.1	Low	90 Å²	90	119.3 Å²	119.3	74%	0.744	77%	0.77	S	S	*	*	S	Bend	trans	-88.3	-20.8	-166.3	0	0	0	0	0	115.4
6	L	50.8	Low	49.9	Very low	153 Å²	153	120.5 Å²	120.5	80%	0.801	78%	0.775	S	S	*	*	S	Bend	trans	-78.8	-23.9	-167.4	-134	76.3	0	0	0	114.4
7	L	53.1	Low	49.9	Very low	145 Å²	145	118.9 Å²	118.9	76%	0.759	77%	0.774	S	S	*	*	S	Bend	trans	-84.3	-24.4	-172.2	-81.3	164.3	0	0	0	114.5	A9 C10	L7-A9 PolarHBondContact O-N 3.46Å; L7-C10 PolarHBondContact O-N 3.28Å
8	L	54.1	Low	50.4	Low	133 Å²	133	119.3 Å²	119.3	70%	0.696	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-23.3	177.3	-85.1	86.1	0	0	0	113
9	A	51.8	Low	51.1	Low	65 Å²	65	116.7 Å²	116.7	54%	0.537	76%	0.764	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.5	-31.8	-179.5	0	0	0	0	0	113.4	L7 A11	L7-A9 PolarHBondContact O-N 3.46Å; A9-A11 VanDerWaalsContact C-N 3.33Å; A9-A11 PolarHBondContact O-N 3.42Å
10	C	49.2	Very low	52.4	Low	99 Å²	99	117.4 Å²	117.4	67%	0.669	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-75.2	-21.2	-177.2	-69.2	0	0	0	0	113.5	L7 L12	L7-C10 PolarHBondContact O-N 3.28Å; C10-L12 VanDerWaalsContact C-N 3.28Å; C10-L12 PolarHBondContact O-N 3.15Å
11	A	52.1	Low	54.1	Low	85 Å²	85	111.9 Å²	111.9	70%	0.702	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-73.5	-15.4	-177.6	0	0	0	0	0	114.1	A9	A9-A11 VanDerWaalsContact C-N 3.33Å; A9-A11 PolarHBondContact O-N 3.42Å
12	L	49.2	Very low	55.9	Low	152 Å²	152	103.5 Å²	103.5	80%	0.796	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-100.6	1.9	-171.3	-75.7	164.4	0	0	0	114.8	C10	C10-L12 VanDerWaalsContact C-N 3.28Å; C10-L12 PolarHBondContact O-N 3.15Å
13	L	47	Very low	57.8	Low	160 Å²	160	99 Å²	99	84%	0.838	64%	0.644	S	S	*	*			trans	-121.9	1.3	-175.5	-73.1	170.6	0	0	0	114.8	G15	L13-G15 PolarHBondContact O-N 3.37Å; L13-G15 VanDerWaalsContact O-N 3.15Å
14	A	45.2	Very low	59.9	Low	89 Å²	89	94.9 Å²	94.9	74%	0.736	62%	0.619	S	S	*	*			trans	-78.7	93	169.6	0	0	0	0	0	109.9
15	G	42.1	Very low	62	Low	70 Å²	70	92.5 Å²	92.5	72%	0.722	59%	0.592	S	S	*	*			trans	-58.7	147.5	174.9	0	0	0	0	0	112.2	L13 A17	L13-G15 PolarHBondContact O-N 3.37Å; L13-G15 VanDerWaalsContact O-N 3.15Å; G15-A17 PolarHBondContact O-N 3.24Å
16	V	47	Very low	63.9	Low	139 Å²	139	88.8 Å²	88.8	84%	0.842	56%	0.559	S	S	*	*			trans	-62.7	100.1	-173	-175.9	0	0	0	0	111.2	V18	V16-V18 PolarHBondContact O-N 2.9Å
17	A	49.5	Very low	65.7	Low	93 Å²	93	84.7 Å²	84.7	77%	0.769	54%	0.543	S	S	*	.			trans	-68.2	112.6	164.8	0	0	0	0	0	108.2	G15 A19	G15-A17 PolarHBondContact O-N 3.24Å; A17-A19 PolarHBondContact O-N 3.36Å
18	V	58.5	Low	67.3	Low	126 Å²	126	79.3 Å²	79.3	76%	0.764	52%	0.523	S	S	*	.			trans	-68.3	103.7	175.3	-178.4	0	0	0	0	108	V16 Q20	V16-V18 PolarHBondContact O-N 2.9Å; V18-Q20 PolarHBondContact O-N 3Å
19	A	63.5	Low	69	Low	70 Å²	70	76.6 Å²	76.6	58%	0.579	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-58.7	129.1	174.1	0	0	0	0	0	109.4	A17	A17-A19 PolarHBondContact O-N 3.36Å
20	Q	77.9	Confident	70.9	Confident	131 Å²	131	73.5 Å²	73.5	61%	0.612	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-79.3	152.3	173.4	-63.1	-179	2.3	0	0	109.4	V18 V22	V18-Q20 PolarHBondContact O-N 3Å; Q20-V22 PolarHBondContact O-N 3.47Å
21	R	87.4	Confident	72.9	Confident	2 Å²	2	69.3 Å²	69.3	1%	0.008	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	136.3	179.5	-167.6	-172.7	-178.3	104	-8.5	110.6	V44 T45 G46 T122 L130 G131 S132 Y133	R21-V44 HydrophobicContact CG-CG1 4Å; R21-T45 CarbonylContact C-O 3.58Å; R21-T45 WeakPolarHBondContact CA-O 3.46Å; R21-G46 VanDerWaalsContact CA-O 3.28Å; R21-G46 WeakPolarHBondContact CA-O 3.35Å; R21-G46 PolarHBondContact N-O 3.15Å; R21-T122 PolarHBondContact NE-OG1 3.11Å; R21-T122 PolarHBondContact NH2-OG1 2.93Å; R21-L130 WeakPolarHBondContact CB-O 3.45Å; R21-L130 PolarHBondContact N-O 2.82Å; R21-G131 CarbonylContact O-C 3.55Å; R21-G131 VanDerWaalsContact O-CA 3.23Å; R21-G131 WeakPolarHBondContact O-CA 3.49Å; R21-S132 PolarHBondContact O-N 3.41Å; R21-Y133 HydrophobicContact CG-CE1 4.49Å
22	V	91.3	Very high	74.9	Confident	65 Å²	65	65.3 Å²	65.3	39%	0.394	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	111.9	171.6	-174.3	0	0	0	0	109	Q20 T24 T45	Q20-V22 PolarHBondContact O-N 3.47Å; V22-T24 HydrophobicContact CG1-CG2 3.99Å; V22-T45 PolarHBondContact N-O 3.13Å; V22-T45 PolarHBondContact O-N 3.46Å; V22-T45 PolarHBondContact O-OG1 2.74Å
23	V	92.6	Very high	76.9	Confident	7 Å²	7	58.1 Å²	58.1	4%	0.042	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	139.5	161.5	-176.8	0	0	0	0	109.1	N43 V44 T122 S132 Y133 A135	V23-N43 CarbonylContact C-O 3.55Å; V23-N43 WeakPolarHBondContact CA-O 3.46Å; V23-V44 HydrophobicContact CG2-CG1 4.28Å; V23-V44 HydrophobicContact CG2-CG2 4.3Å; V23-T122 HydrophobicContact CG1-CG2 4.43Å; V23-T122 HydrophobicContact CG2-CG2 4.1Å; V23-T122 WeakPolarHBondContact CG2-OG1 3.31Å; V23-S132 PolarHBondContact N-O 3.27Å; V23-Y133 WeakPolarHBondContact CG2-O 3.31Å; V23-A135 HydrophobicContact CB-CB 4.37Å; V23-A135 HydrophobicContact CG1-CB 3.95Å
24	T	93.4	Very high	79.1	Confident	55 Å²	55	54.7 Å²	54.7	34%	0.337	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	152.4	173	57.3	0	0	0	0	109.8	V22 C42 N43	V22-T24 HydrophobicContact CG1-CG2 3.99Å; T24-C42 CarbonylContact O-C 3.42Å; T24-C42 VanDerWaalsContact O-CA 3.29Å; T24-C42 WeakPolarHBondContact O-CA 3.23Å; T24-C42 PolarHBondContact O-SG 3.35Å; T24-N43 PolarHBondContact N-O 2.79Å; T24-N43 PolarHBondContact O-N 3.3Å; T24-N43 PolarHBondContact OG1-O 3.08Å
25	V	93.6	Very high	81.1	Confident	14 Å²	14	52.3 Å²	52.3	9%	0.085	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	156.6	-178.9	70	0	0	0	0	108.8	S27 I40 W41 C42 W57 C120 A135 T137	V25-S27 PolarHBondContact O-N 3.4Å; V25-I40 HydrophobicContact CG2-CG2 4Å; V25-W41 WeakPolarHBondContact CA-O 3.43Å; V25-W41 VanDerWaalsContact CG2-O 3.3Å; V25-W41 WeakPolarHBondContact CG2-O 3.14Å; V25-C42 HydrophobicContact CG2-CB 4.41Å; V25-W57 HydrophobicContact CG2-CH2 3.73Å; V25-W57 HydrophobicContact CG2-CZ3 4.06Å; V25-C120 HydrophobicContact CG2-CB 4.49Å; V25-A135 HydrophobicContact CB-CB 3.95Å; V25-A135 HydrophobicContact CG1-CB 3.66Å; V25-T137 HydrophobicContact CG1-CG2 4.37Å; V25-T137 HydrophobicContact CG2-CG2 3.87Å
26	Q	91.8	Very high	83.4	Confident	12 Å²	12	49.8 Å²	49.8	6%	0.056	32%	0.323	C	S	.	.			trans	-54.9	124.7	-179.5	-168	178.6	4.4	0	0	112.8	G28 L30 I40 W41 T137 D257 D259	Q26-G28 PolarHBondContact O-N 3Å; Q26-L30 HydrophobicContact CB-CD1 4.24Å; Q26-L30 HydrophobicContact CG-CD1 4.19Å; Q26-L30 HydrophobicContact CG-CD2 4.03Å; Q26-I40 HydrophobicContact CB-CG2 4.17Å; Q26-W41 HydrophobicContact CB-CD2 4.01Å; Q26-W41 HydrophobicContact CB-CG 4.07Å; Q26-W41 HydrophobicContact CB-CZ2 4.15Å; Q26-W41 HydrophobicContact CG-CZ2 4.34Å; Q26-W41 PolarHBondContact N-O 3.3Å; Q26-T137 WeakPolarHBondContact O-CB 3.46Å; Q26-T137 PolarHBondContact O-OG1 2.86Å; Q26-D257 PolarHBondContact NE2-OD2 2.85Å; Q26-D259 PolarHBondContact NE2-OD2 2.85Å
27	S	89.4	Confident	85.5	Confident	66 Å²	66	48 Å²	48	46%	0.462	31%	0.305	S	S	.	.			trans	-59	116.4	-175.9	-60.1	0	0	0	0	113.1	V25 L30 P258	V25-S27 PolarHBondContact O-N 3.4Å; S27-L30 WeakPolarHBondContact O-CD2 3.28Å; S27-P258 WeakPolarHBondContact O-CG 3.33Å
28	G	85.9	Confident	87.5	Confident	33 Å²	33	43.6 Å²	43.6	34%	0.34	27%	0.269	S	S	.	.	S	Bend	trans	-91.4	176.4	176.6	0	0	0	0	0	114.3	Q26 T137	Q26-G28 PolarHBondContact O-N 3Å; G28-T137 VanDerWaalsContact CA-OG1 3.32Å; G28-T137 WeakPolarHBondContact CA-OG1 2.98Å; G28-T137 PolarHBondContact N-OG1 3.15Å; G28-T137 VanDerWaalsContact N-OG1 3.13Å
29	P	89.6	Confident	89.1	Confident	75 Å²	75	39.8 Å²	39.8	49%	0.487	25%	0.246	S	C	.	.			cis	-76.2	127.4	3.3	30.3	-34.2	0	0	0	112.6	N138	P29-N138 CarbonylContact C-O 3.52Å; P29-N138 WeakPolarHBondContact CA-O 3.5Å; P29-N138 HydrophobicContact CB-CB 4.38Å
30	L	92.8	Very high	90.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	114.2	173.2	-57.9	-179.8	0	0	0	108.1	Q26 S27 I40 N138 L139 T140	Q26-L30 HydrophobicContact CB-CD1 4.24Å; Q26-L30 HydrophobicContact CG-CD1 4.19Å; Q26-L30 HydrophobicContact CG-CD2 4.03Å; S27-L30 WeakPolarHBondContact O-CD2 3.28Å; L30-I40 HydrophobicContact CD1-CD1 4.34Å; L30-I40 HydrophobicContact CD1-CG1 4.02Å; L30-I40 HydrophobicContact CD1-CG2 4.15Å; L30-N138 PolarHBondContact N-O 2.98Å; L30-L139 HydrophobicContact CB-CD1 4.36Å; L30-T140 PolarHBondContact O-N 3.05Å
31	V	92.1	Very high	91.3	Very high	12 Å²	12	34.1 Å²	34.1	7%	0.073	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	129.5	176.7	-169.8	0	0	0	0	109.7	T140 I142 Q175 I255	V31-T140 WeakPolarHBondContact CA-O 3.39Å; V31-T140 HydrophobicContact CG1-CG2 4.47Å; V31-I142 HydrophobicContact CG1-CB 4.45Å; V31-I142 HydrophobicContact CG1-CD1 3.83Å; V31-I142 HydrophobicContact CG1-CG1 3.89Å; V31-I142 HydrophobicContact CG1-CG2 3.73Å; V31-Q175 HydrophobicContact CG1-CG 4.13Å; V31-I255 HydrophobicContact CB-CD1 3.97Å
32	R	92.6	Very high	91.6	Very high	1 Å²	1	34 Å²	34	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	146.7	-174.3	-58.3	-67.5	-178.7	-103.2	6.4	110.6	V38 V110 L139 T140 V141 I142 D257	R32-V38 HydrophobicContact CB-CG2 3.61Å; R32-V38 HydrophobicContact CG-CB 4.36Å; R32-V38 HydrophobicContact CG-CG1 3.87Å; R32-V38 HydrophobicContact CG-CG2 3.54Å; R32-V110 HydrophobicContact CB-CG1 4.46Å; R32-L139 HydrophobicContact CB-CD1 4.14Å; R32-L139 HydrophobicContact CG-CD1 3.6Å; R32-T140 PolarHBondContact N-O 2.97Å; R32-V141 WeakPolarHBondContact O-CA 3.3Å; R32-I142 WeakPolarHBondContact O-CG1 3.15Å; R32-I142 PolarHBondContact O-N 3.01Å; R32-D257 IonicContact CZ-OD1 3.23Å; R32-D257 IonicContact CZ-OD2 2.78Å; R32-D257 IonicContact NH1-OD1 2.84Å; R32-D257 PolarHBondContact NH1-OD1 2.86Å; R32-D257 IonicContact NH1-OD2 3.51Å; R32-D257 PolarHBondContact NH1-OD2 2.98Å; R32-D257 IonicContact NH2-OD1 3.81Å; R32-D257 PolarHBondContact NH2-OD1 3.4Å; R32-D257 IonicContact NH2-OD2 3.95Å; R32-D257 PolarHBondContact NH2-OD2 3.24Å
33	T	92.4	Very high	91.7	Very high	1 Å²	1	33.3 Å²	33.3	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	138.9	179	42.2	0	0	0	0	111.7	G35 S36 V110 I142 M265 T266	T33-G35 PolarHBondContact O-N 3.1Å; T33-S36 VanDerWaalsContact O-CB 3.26Å; T33-S36 WeakPolarHBondContact O-CB 3.26Å; T33-S36 PolarHBondContact O-N 2.86Å; T33-S36 PolarHBondContact O-OG 3.49Å; T33-V110 WeakPolarHBondContact O-CG1 3.22Å; T33-I142 CarbonylContact C-O 3.59Å; T33-I142 VanDerWaalsContact CA-O 3.3Å; T33-I142 WeakPolarHBondContact CA-O 3.49Å; T33-I142 HydrophobicContact CG2-CD1 3.96Å; T33-I142 HydrophobicContact CG2-CG1 3.85Å; T33-M265 HydrophobicContact CG2-CB 4.05Å; T33-M265 HydrophobicContact CG2-CE 4.31Å; T33-M265 HydrophobicContact CG2-SD 4.36Å; T33-M265 PolarHBondContact OG1-O 3.33Å; T33-T266 WeakPolarHBondContact CB-OG1 3.47Å; T33-T266 WeakPolarHBondContact CG2-OG1 3.48Å; T33-T266 PolarHBondContact OG1-OG1 3.3Å
34	E	91.8	Very high	91.6	Very high	88 Å²	88	33 Å²	33	41%	0.411	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	134.7	175.4	-178.6	161.1	-129.1	0	0	110.9	S36 Q111 A112 V141 I142	E34-S36 VanDerWaalsContact C-N 3.34Å; E34-Q111 WeakPolarHBondContact OE1-CA 3.47Å; E34-A112 PolarHBondContact OE1-N 2.89Å; E34-V141 HydrophobicContact CB-CG1 4.02Å; E34-I142 PolarHBondContact N-O 2.96Å
35	G	88.9	Confident	91.4	Very high	39 Å²	39	34 Å²	34	40%	0.402	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	-9.9	-174.3	0	0	0	0	0	115.4	T33 V110	T33-G35 PolarHBondContact O-N 3.1Å; G35-V110 PolarHBondContact N-O 3.1Å
36	S	88.8	Confident	90.9	Very high	16 Å²	16	34.8 Å²	34.8	11%	0.112	21%	0.213	C	C	.	.	S	Bend	trans	-76.1	156.7	175.5	68.7	0	0	0	0	113	T33 E34 K109 V110 M265	T33-S36 VanDerWaalsContact O-CB 3.26Å; T33-S36 WeakPolarHBondContact O-CB 3.26Å; T33-S36 PolarHBondContact O-N 2.86Å; T33-S36 PolarHBondContact O-OG 3.49Å; E34-S36 VanDerWaalsContact C-N 3.34Å; S36-K109 WeakPolarHBondContact O-CA 3.41Å; S36-V110 PolarHBondContact O-N 3.44Å; S36-M265 WeakPolarHBondContact CB-O 3.39Å
37	H	91.4	Very high	90.4	Very high	102 Å²	102	36.8 Å²	36.8	47%	0.472	22%	0.22	S	C	.	.			trans	-82.2	119.9	166.8	173.3	-160.4	0	0	0	108.7	T39 H106 I107 T108 F263	H37-T39 WeakPolarHBondContact NE2-CG2 3.33Å; H37-H106 AromaticContact CE1-CE1 3.94Å; H37-H106 AromaticContact CE1-ND1 3.48Å; H37-H106 PolarHBondContact CE1-ND1 3.01Å; H37-H106 WeakPolarHBondContact NE2-CB 3.29Å; H37-H106 AromaticContact NE2-CD2 3.91Å; H37-H106 AromaticContact NE2-CE1 3.59Å; H37-H106 AromaticContact NE2-CG 2.91Å; H37-H106 AromaticContact NE2-ND1 2.64Å; H37-H106 PolarHBondContact NE2-ND1 3Å; H37-I107 CarbonylContact C-O 3.56Å; H37-I107 WeakPolarHBondContact CA-O 3.21Å; H37-T108 WeakPolarHBondContact CA-O 3.49Å; H37-T108 WeakPolarHBondContact CB-O 3.47Å; H37-F263 WeakPolarHBondContact O-CZ 3.39Å
38	V	91.1	Very high	89.9	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.006	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	140.9	178.1	-179.4	0	0	0	0	110.2	R32 I40 I107 V110 L139	R32-V38 HydrophobicContact CB-CG2 3.61Å; R32-V38 HydrophobicContact CG-CB 4.36Å; R32-V38 HydrophobicContact CG-CG1 3.87Å; R32-V38 HydrophobicContact CG-CG2 3.54Å; V38-I40 HydrophobicContact CG1-CG1 4.19Å; V38-I107 HydrophobicContact CB-CB 4.45Å; V38-I107 PolarHBondContact N-O 2.92Å; V38-I107 PolarHBondContact O-N 2.84Å; V38-V110 HydrophobicContact CG2-CB 3.7Å; V38-V110 HydrophobicContact CG2-CG1 3.7Å; V38-V110 HydrophobicContact CG2-CG2 4.18Å; V38-L139 HydrophobicContact CG1-CD1 4.09Å
39	T	92.6	Very high	89.2	Confident	45 Å²	45	45.8 Å²	45.8	28%	0.276	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	145.3	166.3	47.4	0	0	0	0	110.2	H37 V104 L105	H37-T39 WeakPolarHBondContact NE2-CG2 3.33Å; T39-V104 HydrophobicContact CG2-CG1 3.93Å; T39-L105 CarbonylContact C-O 3.56Å; T39-L105 VanDerWaalsContact CA-O 3.3Å; T39-L105 WeakPolarHBondContact CA-O 3.36Å
40	I	93.5	Very high	88.5	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	117.5	172.4	-50	-178.5	0	0	0	107.8	V25 Q26 L30 V38 W57 V104 L105 F118 T137 L139	V25-I40 HydrophobicContact CG2-CG2 4Å; Q26-I40 HydrophobicContact CB-CG2 4.17Å; L30-I40 HydrophobicContact CD1-CD1 4.34Å; L30-I40 HydrophobicContact CD1-CG1 4.02Å; L30-I40 HydrophobicContact CD1-CG2 4.15Å; V38-I40 HydrophobicContact CG1-CG1 4.19Å; I40-W57 HydrophobicContact CB-CH2 4.13Å; I40-W57 HydrophobicContact CG2-CH2 3.76Å; I40-W57 HydrophobicContact CG2-CZ3 4.1Å; I40-V104 CarbonylContact O-C 3.55Å; I40-V104 WeakPolarHBondContact O-CA 3.36Å; I40-L105 HydrophobicContact CB-CB 4.47Å; I40-L105 PolarHBondContact N-O 3.29Å; I40-L105 PolarHBondContact O-N 3.04Å; I40-F118 HydrophobicContact CD1-CD2 4.45Å; I40-F118 HydrophobicContact CD1-CG 4.31Å; I40-T137 HydrophobicContact CD1-CG2 4.47Å; I40-T137 HydrophobicContact CG2-CG2 3.73Å; I40-L139 HydrophobicContact CD1-CD2 4.46Å
41	W	94.1	Very high	87.9	Confident	82 Å²	82	48.4 Å²	48.4	31%	0.311	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	150.8	179.6	61.7	-101.8	0	0	0	112.7	V25 Q26 V104	V25-W41 WeakPolarHBondContact CA-O 3.43Å; V25-W41 VanDerWaalsContact CG2-O 3.3Å; V25-W41 WeakPolarHBondContact CG2-O 3.14Å; Q26-W41 HydrophobicContact CB-CD2 4.01Å; Q26-W41 HydrophobicContact CB-CG 4.07Å; Q26-W41 HydrophobicContact CB-CZ2 4.15Å; Q26-W41 HydrophobicContact CG-CZ2 4.34Å; Q26-W41 PolarHBondContact N-O 3.3Å; W41-V104 HydrophobicContact CB-CG2 4.06Å
42	C	94.5	Very high	87.7	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	131.5	173.1	178.6	0	0	0	0	110.7	T24 V25 F55 W57 A103 C120	T24-C42 CarbonylContact O-C 3.42Å; T24-C42 VanDerWaalsContact O-CA 3.29Å; T24-C42 WeakPolarHBondContact O-CA 3.23Å; T24-C42 PolarHBondContact O-SG 3.35Å; V25-C42 HydrophobicContact CG2-CB 4.41Å; C42-F55 HydrophobicContact CB-CD1 4.35Å; C42-W57 HydrophobicContact CB-CH2 3.87Å; C42-W57 HydrophobicContact CB-CZ2 3.43Å; C42-W57 VanDerWaalsContact CB-CZ2 3.43Å; C42-A103 PolarHBondContact N-O 2.87Å; C42-A103 PolarHBondContact O-N 2.88Å; C42-A103 VanDerWaalsContact O-O 3.14Å; C42-C120 HydrophobicContact CB-CB 3.67Å; C42-C120 WeakPolarHBondContact CB-SG 3.45Å; C42-C120 WeakPolarHBondContact SG-CB 3.18Å; C42-C120 CovalentContact SG-SG 2.03Å; C42-C120 PolarHBondContact SG-SG 2.79Å
43	N	93.6	Very high	87.6	Confident	50 Å²	50	53 Å²	53	27%	0.267	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	147.9	-175.2	-60.3	-7.3	0	0	0	110.9	V23 T24 D101 S102	V23-N43 CarbonylContact C-O 3.55Å; V23-N43 WeakPolarHBondContact CA-O 3.46Å; T24-N43 PolarHBondContact N-O 2.79Å; T24-N43 PolarHBondContact O-N 3.3Å; T24-N43 PolarHBondContact OG1-O 3.08Å; N43-D101 CarbonylContact C-O 3.59Å; N43-D101 WeakPolarHBondContact CA-O 3.15Å; N43-S102 WeakPolarHBondContact OD1-CB 3.37Å; N43-S102 PolarHBondContact OD1-OG 3.34Å
44	V	90.7	Very high	87.6	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	137.9	176.9	-165	0	0	0	0	110.7	R21 V23 Y47 Q53 F55 D101 T122	R21-V44 HydrophobicContact CG-CG1 4Å; V23-V44 HydrophobicContact CG2-CG1 4.28Å; V23-V44 HydrophobicContact CG2-CG2 4.3Å; V44-Y47 HydrophobicContact CB-CD1 4.26Å; V44-Y47 HydrophobicContact CG1-CD1 3.93Å; V44-Q53 HydrophobicContact CB-CG 4.46Å; V44-Q53 HydrophobicContact CG2-CB 4.35Å; V44-F55 HydrophobicContact CG2-CE1 3.72Å; V44-F55 HydrophobicContact CG2-CZ 3.84Å; V44-D101 PolarHBondContact N-O 3.35Å; V44-T122 HydrophobicContact CG2-CG2 3.69Å
45	T	88.1	Confident	87.7	Confident	75 Å²	75	50.8 Å²	50.8	46%	0.46	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	163.4	171.4	58.2	0	0	0	0	110.2	R21 V22 Y47	R21-T45 CarbonylContact C-O 3.58Å; R21-T45 WeakPolarHBondContact CA-O 3.46Å; V22-T45 PolarHBondContact N-O 3.13Å; V22-T45 PolarHBondContact O-N 3.46Å; V22-T45 PolarHBondContact O-OG1 2.74Å; T45-Y47 PolarHBondContact O-N 2.82Å
46	G	82.5	Confident	88	Confident	31 Å²	31	49.6 Å²	49.6	32%	0.32	28%	0.276	S	S	.	.	S	Bend	trans	69.2	31.4	176.6	0	0	0	0	0	114.9	R21	R21-G46 VanDerWaalsContact CA-O 3.28Å; R21-G46 WeakPolarHBondContact CA-O 3.35Å; R21-G46 PolarHBondContact N-O 3.15Å
47	Y	82.7	Confident	88.3	Confident	55 Å²	55	48.9 Å²	48.9	22%	0.216	27%	0.27	C	S	.	.	S	Bend	trans	-107.2	169.8	170.8	68.8	-86.2	0	0	0	109.8	V44 T45 V51 Q53 D101	V44-Y47 HydrophobicContact CB-CD1 4.26Å; V44-Y47 HydrophobicContact CG1-CD1 3.93Å; T45-Y47 PolarHBondContact O-N 2.82Å; Y47-V51 VanDerWaalsContact CE2-O 3.26Å; Y47-V51 WeakPolarHBondContact CE2-O 3.49Å; Y47-Q53 HydrophobicContact CD1-CG 4.13Å; Y47-Q53 HydrophobicContact CD2-CG 3.9Å; Y47-Q53 HydrophobicContact CE1-CG 4.34Å; Y47-Q53 HydrophobicContact CE2-CG 4.12Å; Y47-Q53 HydrophobicContact CG-CG 3.93Å; Y47-D101 HydrophobicContact CE1-CB 3.78Å; Y47-D101 WeakPolarHBondContact OH-CB 3.25Å
48	K	77.4	Confident	88.5	Confident	137 Å²	137	44.1 Å²	44.1	60%	0.596	25%	0.248	S	C	*	.			trans	-70	129.9	-179.9	-178.9	-176	175.5	-169	0	113.8	V51 D126	K48-V51 HydrophobicContact CB-CG2 4.27Å; K48-V51 HydrophobicContact CD-CG2 4.18Å; K48-V51 HydrophobicContact CG-CG2 4.24Å; K48-V51 WeakPolarHBondContact O-CB 3.21Å; K48-V51 PolarHBondContact O-N 3.19Å; K48-D126 WeakPolarHBondContact CB-OD1 3.4Å; K48-D126 PolarHBondContact N-OD2 3.07Å; K48-D126 VanDerWaalsContact N-OD2 3.1Å
49	D	72.8	Confident	88.6	Confident	150 Å²	150	44 Å²	44	80%	0.802	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.9	139.6	177.6	-69.8	-51.9	0	0	0	113.9	V51	D49-V51 PolarHBondContact O-N 2.9Å
50	G	73.4	Confident	88.7	Confident	87 Å²	87	43.3 Å²	43.3	90%	0.897	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.3	-1.3	177.8	0	0	0	0	0	115.5
51	V	82.1	Confident	88.5	Confident	44 Å²	44	45.2 Å²	45.2	27%	0.267	25%	0.251	S	S	.	.			trans	-95.9	113.7	176	-170.9	0	0	0	0	110.3	Y47 K48 D49 Q53 T125	Y47-V51 VanDerWaalsContact CE2-O 3.26Å; Y47-V51 WeakPolarHBondContact CE2-O 3.49Å; K48-V51 HydrophobicContact CB-CG2 4.27Å; K48-V51 HydrophobicContact CD-CG2 4.18Å; K48-V51 HydrophobicContact CG-CG2 4.24Å; K48-V51 WeakPolarHBondContact O-CB 3.21Å; K48-V51 PolarHBondContact O-N 3.19Å; D49-V51 PolarHBondContact O-N 2.9Å; V51-Q53 PolarHBondContact O-N 2.84Å; V51-Q53 PolarHBondContact O-NE2 3.45Å; V51-T125 HydrophobicContact CG1-CG2 4.05Å
52	K	86.6	Confident	88.1	Confident	108 Å²	108	45.5 Å²	45.5	47%	0.47	26%	0.263	S	S	.	.			trans	-60.9	129.4	172.6	176	177.7	175.9	-171.9	0	110.8	D100	K52-D100 HydrophobicContact CB-CB 4.36Å; K52-D100 WeakPolarHBondContact CD-OD1 3.5Å; K52-D100 HydrophobicContact CG-CB 4.4Å; K52-D100 VanDerWaalsContact CG-OD1 3.32Å; K52-D100 WeakPolarHBondContact CG-OD1 3.3Å
53	Q	90.2	Very high	87.6	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	30%	0.296	C	S	.	.			trans	-93.6	145.1	178.4	-57	-54.1	-54.5	0	0	110.4	V44 Y47 V51 F55 R97 D100 T125	V44-Q53 HydrophobicContact CB-CG 4.46Å; V44-Q53 HydrophobicContact CG2-CB 4.35Å; Y47-Q53 HydrophobicContact CD1-CG 4.13Å; Y47-Q53 HydrophobicContact CD2-CG 3.9Å; Y47-Q53 HydrophobicContact CE1-CG 4.34Å; Y47-Q53 HydrophobicContact CE2-CG 4.12Å; Y47-Q53 HydrophobicContact CG-CG 3.93Å; V51-Q53 PolarHBondContact O-N 2.84Å; V51-Q53 PolarHBondContact O-NE2 3.45Å; Q53-F55 HydrophobicContact CB-CE2 4.29Å; Q53-F55 HydrophobicContact CB-CZ 4.44Å; Q53-F55 WeakPolarHBondContact O-CE2 3.35Å; Q53-R97 PolarHBondContact O-NH1 3.02Å; Q53-R97 PolarHBondContact O-NH2 2.57Å; Q53-D100 PolarHBondContact N-O 3.26Å; Q53-T125 PolarHBondContact NE2-OG1 2.91Å; Q53-T125 PolarHBondContact OE1-OG1 2.86Å; Q53-T125 VanDerWaalsContact OE1-OG1 3.14Å
54	D	92.4	Very high	87.3	Confident	44 Å²	44	50.7 Å²	50.7	24%	0.235	30%	0.301	C	S	.	.			trans	-107.8	154.1	172.6	-82.1	-54.8	0	0	0	112.1	T74 A75 R97 T122 P123	D54-T74 WeakPolarHBondContact CA-OG1 3.29Å; D54-T74 WeakPolarHBondContact CB-OG1 3.13Å; D54-T74 WeakPolarHBondContact OD1-CB 3.28Å; D54-T74 PolarHBondContact OD1-OG1 3.24Å; D54-A75 HydrophobicContact CB-CB 3.91Å; D54-R97 IonicContact OD1-NH2 3.66Å; D54-R97 PolarHBondContact OD1-NH2 3.14Å; D54-T122 VanDerWaalsContact O-CA 3.28Å; D54-T122 WeakPolarHBondContact O-CA 3.48Å; D54-T122 VanDerWaalsContact O-CB 3.23Å; D54-T122 WeakPolarHBondContact O-CB 3.21Å; D54-T122 WeakPolarHBondContact O-CG2 3.44Å; D54-P123 WeakPolarHBondContact O-CD 3.28Å
55	F	94.7	Very high	87.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	32%	0.323	C	S	.	.			trans	-126.2	111.8	-166.7	-63.3	-95.9	0	0	0	109.5	C42 V44 Q53 S73 T74 D101 A103 T122	C42-F55 HydrophobicContact CB-CD1 4.35Å; V44-F55 HydrophobicContact CG2-CE1 3.72Å; V44-F55 HydrophobicContact CG2-CZ 3.84Å; Q53-F55 HydrophobicContact CB-CE2 4.29Å; Q53-F55 HydrophobicContact CB-CZ 4.44Å; Q53-F55 WeakPolarHBondContact O-CE2 3.35Å; F55-S73 CarbonylContact O-C 3.59Å; F55-S73 WeakPolarHBondContact O-CA 3.34Å; F55-T74 HydrophobicContact CB-CG2 4.15Å; F55-T74 PolarHBondContact N-OG1 2.98Å; F55-T74 PolarHBondContact O-N 2.85Å; F55-D101 WeakPolarHBondContact CZ-O 3.45Å; F55-A103 HydrophobicContact CB-CB 4.27Å; F55-A103 HydrophobicContact CD1-CB 3.92Å; F55-A103 HydrophobicContact CD2-CB 3.75Å; F55-A103 HydrophobicContact CE1-CB 4.19Å; F55-A103 HydrophobicContact CE2-CB 4.05Å; F55-A103 HydrophobicContact CG-CB 3.7Å; F55-A103 HydrophobicContact CZ-CB 4.26Å; F55-T122 HydrophobicContact CD1-CG2 3.75Å; F55-T122 HydrophobicContact CE1-CG2 3.98Å; F55-T122 HydrophobicContact CG-CG2 4.35Å
56	D	95.1	Very high	87.2	Confident	14 Å²	14	59.2 Å²	59.2	8%	0.075	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	111.9	180	-75.3	-9.4	0	0	0	108.4	S73 Y79 Y121 P123	D56-S73 WeakPolarHBondContact OD1-CB 3.3Å; D56-S73 PolarHBondContact OD1-OG 3.35Å; D56-Y79 HydrophobicContact CB-CE1 4.43Å; D56-Y79 HydrophobicContact CB-CE2 4.18Å; D56-Y121 HydrophobicContact CB-CD1 4.12Å; D56-Y121 PolarHBondContact N-O 3.49Å; D56-Y121 PolarHBondContact O-N 2.91Å; D56-P123 WeakPolarHBondContact OD2-CG 3.09Å
57	W	96.1	Very high	87.6	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	115	179.8	-72.6	86.8	0	0	0	111.3	V25 I40 C42 I71 V72 V95 L105 F118 E119 C120	V25-W57 HydrophobicContact CG2-CH2 3.73Å; V25-W57 HydrophobicContact CG2-CZ3 4.06Å; I40-W57 HydrophobicContact CB-CH2 4.13Å; I40-W57 HydrophobicContact CG2-CH2 3.76Å; I40-W57 HydrophobicContact CG2-CZ3 4.1Å; C42-W57 HydrophobicContact CB-CH2 3.87Å; C42-W57 HydrophobicContact CB-CZ2 3.43Å; C42-W57 VanDerWaalsContact CB-CZ2 3.43Å; W57-I71 WeakPolarHBondContact O-CB 3.47Å; W57-I71 PolarHBondContact O-N 2.99Å; W57-V72 HydrophobicContact CB-CG1 4.03Å; W57-V72 PolarHBondContact N-O 2.86Å; W57-V72 PolarHBondContact O-N 3.38Å; W57-V95 HydrophobicContact CG-CG2 4.47Å; W57-L105 HydrophobicContact CD2-CB 3.96Å; W57-L105 HydrophobicContact CD2-CD2 3.96Å; W57-L105 HydrophobicContact CD2-CG 4.43Å; W57-L105 HydrophobicContact CE3-CB 4.29Å; W57-L105 HydrophobicContact CE3-CD2 3.76Å; W57-L105 HydrophobicContact CG-CB 4.46Å; W57-L105 HydrophobicContact CG-CD1 4.47Å; W57-L105 HydrophobicContact CG-CD2 4.35Å; W57-L105 HydrophobicContact CH2-CB 4.12Å; W57-L105 HydrophobicContact CZ2-CB 3.8Å; W57-L105 HydrophobicContact CZ3-CB 4.37Å; W57-L105 HydrophobicContact CZ3-CD2 4.17Å; W57-F118 HydrophobicContact CE3-CB 4.26Å; W57-F118 HydrophobicContact CE3-CD1 4.43Å; W57-F118 HydrophobicContact CZ3-CB 4.15Å; W57-E119 WeakPolarHBondContact CA-O 3.3Å; W57-C120 HydrophobicContact CD2-CB 4.17Å; W57-C120 HydrophobicContact CE3-CB 4.07Å; W57-C120 HydrophobicContact CH2-CB 3.99Å; W57-C120 HydrophobicContact CZ2-CB 4.04Å; W57-C120 HydrophobicContact CZ3-CB 3.98Å
58	S	94.8	Very high	88	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.014	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	159.6	172.1	-77.2	0	0	0	0	110.3	E68 I69 Y79 F118 E119	S58-E68 WeakPolarHBondContact OG-CG 3.42Å; S58-E68 PolarHBondContact OG-OE1 2.67Å; S58-I69 CarbonylContact C-O 3.54Å; S58-I69 WeakPolarHBondContact CA-O 3.36Å; S58-Y79 PolarHBondContact OG-OH 3.24Å; S58-F118 WeakPolarHBondContact O-CA 3.39Å; S58-E119 PolarHBondContact N-O 3.48Å; S58-E119 PolarHBondContact O-N 2.64Å
59	M	93.5	Very high	88.7	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	157.6	169.5	70	179.1	-57.3	0	0	112.5	L61 I69 I71 Y84 V117 F118	M59-L61 HydrophobicContact CE-CD2 3.63Å; M59-L61 HydrophobicContact CE-CG 4.24Å; M59-I69 HydrophobicContact CG-CB 4.02Å; M59-I69 HydrophobicContact CG-CG2 4.37Å; M59-I69 PolarHBondContact N-O 3Å; M59-I69 WeakPolarHBondContact O-CB 3.37Å; M59-I69 PolarHBondContact O-N 3.44Å; M59-I71 HydrophobicContact CB-CD1 3.84Å; M59-I71 HydrophobicContact CB-CG1 4.47Å; M59-I71 HydrophobicContact CG-CD1 3.76Å; M59-I71 HydrophobicContact CG-CG1 4.08Å; M59-I71 HydrophobicContact SD-CD1 3.77Å; M59-I71 HydrophobicContact SD-CG1 4.34Å; M59-Y84 HydrophobicContact SD-CE1 4.39Å; M59-Y84 HydrophobicContact SD-CE2 3.89Å; M59-Y84 VanDerWaalsContact SD-CZ 3.6Å; M59-Y84 PolarHBondContact SD-OH 2.84Å; M59-V117 CarbonylContact C-O 3.59Å; M59-V117 VanDerWaalsContact CA-O 3.25Å; M59-V117 WeakPolarHBondContact CA-O 3.34Å; M59-F118 HydrophobicContact CB-CD1 4.45Å; M59-F118 HydrophobicContact CE-CE2 4.37Å; M59-F118 HydrophobicContact CE-CZ 4.38Å
60	Y	93.6	Very high	89.7	Confident	29 Å²	29	56.4 Å²	56.4	11%	0.114	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	116.6	173.4	-57.1	-91.4	0	0	0	107.8	P65 R67 E68 V117 E119 R136	Y60-P65 WeakPolarHBondContact CD1-O 3.23Å; Y60-R67 WeakPolarHBondContact CD1-O 3.03Å; Y60-E68 HydrophobicContact CE1-CB 4.08Å; Y60-V117 PolarHBondContact N-O 2.54Å; Y60-V117 PolarHBondContact O-N 3.36Å; Y60-E119 HydrophobicContact CD2-CB 4.49Å; Y60-E119 HydrophobicContact CE2-CB 3.81Å; Y60-E119 VanDerWaalsContact CE2-OE2 3.27Å; Y60-E119 WeakPolarHBondContact CE2-OE2 3Å; Y60-E119 PolarHBondContact OH-OE2 2.82Å; Y60-R136 VanDerWaalsContact CZ-NH2 3.35Å; Y60-R136 PolarHBondContact OH-NH2 2.88Å; Y60-R136 VanDerWaalsContact OH-NH2 3.1Å
61	L	90.3	Very high	90.7	Very high	42 Å²	42	52.3 Å²	52.3	22%	0.22	27%	0.267	C	S	.	.			trans	-74.1	141.2	178.6	-73.5	168.9	0	0	0	110	M59 S63 V64 I69	M59-L61 HydrophobicContact CE-CD2 3.63Å; M59-L61 HydrophobicContact CE-CG 4.24Å; L61-S63 PolarHBondContact O-N 2.73Å; L61-V64 HydrophobicContact CB-CG2 3.92Å; L61-V64 HydrophobicContact CD1-CG2 4.41Å; L61-V64 CarbonylContact O-C 3.59Å; L61-V64 VanDerWaalsContact O-C 3.22Å; L61-V64 PolarHBondContact O-N 3.1Å; L61-I69 HydrophobicContact CD1-CD1 3.55Å; L61-I69 HydrophobicContact CG-CD1 3.88Å
62	P	84.8	Confident	91.3	Very high	88 Å²	88	50.8 Å²	50.8	57%	0.571	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-21.2	179.2	-25.9	35.4	0	0	0	114.7	Q115	P62-Q115 WeakPolarHBondContact CD-O 3.38Å
63	S	85.2	Confident	91.6	Very high	99 Å²	99	46.4 Å²	46.4	69%	0.692	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-17.6	176.2	51.7	0	0	0	0	114.6	L61	L61-S63 PolarHBondContact O-N 2.73Å
64	V	87.4	Confident	91.7	Very high	60 Å²	60	48.4 Å²	48.4	36%	0.364	25%	0.253	S	S	.	.	S	Bend	trans	-145.4	64.6	179.9	-74.3	0	0	0	0	110.3	L61 E66 R67	L61-V64 HydrophobicContact CB-CG2 3.92Å; L61-V64 HydrophobicContact CD1-CG2 4.41Å; L61-V64 CarbonylContact O-C 3.59Å; L61-V64 VanDerWaalsContact O-C 3.22Å; L61-V64 PolarHBondContact O-N 3.1Å; V64-E66 PolarHBondContact O-N 3.28Å; V64-E66 VanDerWaalsContact O-N 3.13Å; V64-R67 HydrophobicContact CB-CB 4.15Å; V64-R67 HydrophobicContact CG2-CB 4.2Å; V64-R67 PolarHBondContact O-N 3.34Å
65	P	87.1	Confident	91.6	Very high	74 Å²	74	49.2 Å²	49.2	48%	0.481	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-21.7	-166.3	25.5	-35.9	0	0	0	115.1	Y60	Y60-P65 WeakPolarHBondContact CD1-O 3.23Å
66	E	88.3	Confident	91.3	Very high	179 Å²	179	53.9 Å²	53.9	84%	0.836	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-6.2	177.2	-56.9	-54.7	142.2	0	0	113.6	V64	V64-E66 PolarHBondContact O-N 3.28Å; V64-E66 VanDerWaalsContact O-N 3.13Å
67	R	90.9	Very high	90.8	Very high	149 Å²	149	58.8 Å²	58.8	56%	0.562	32%	0.323	S	S	*	.			trans	-95.6	109.2	-175.4	-175.4	178.4	-178.7	173.8	2.1	111.2	Y60 V64 I69	Y60-R67 WeakPolarHBondContact CD1-O 3.03Å; V64-R67 HydrophobicContact CB-CB 4.15Å; V64-R67 HydrophobicContact CG2-CB 4.2Å; V64-R67 PolarHBondContact O-N 3.34Å; R67-I69 HydrophobicContact CG-CG1 4.34Å; R67-I69 PolarHBondContact O-N 2.78Å
68	E	91.4	Very high	90.4	Very high	54 Å²	54	65.1 Å²	65.1	25%	0.252	36%	0.357	S	S	.	.			trans	-58.1	127.9	165	-170.9	-168.2	-153	0	0	109.9	S58 Y60 R70	S58-E68 WeakPolarHBondContact OG-CG 3.42Å; S58-E68 PolarHBondContact OG-OE1 2.67Å; Y60-E68 HydrophobicContact CE1-CB 4.08Å; E68-R70 HydrophobicContact CG-CG 4.22Å; E68-R70 IonicContact OE1-NE 2.65Å; E68-R70 IonicContact OE2-CZ 3.49Å; E68-R70 IonicContact OE2-NE 3.46Å; E68-R70 PolarHBondContact OE2-NE 2.97Å; E68-R70 IonicContact OE2-NH2 2.9Å; E68-R70 PolarHBondContact OE2-NH2 2.87Å
69	I	92.4	Very high	90.3	Very high	18 Å²	18	65.7 Å²	65.7	9%	0.092	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	108.1	168.1	-59.4	172.4	0	0	0	107.9	S58 M59 L61 R67 Y81 Y84	S58-I69 CarbonylContact C-O 3.54Å; S58-I69 WeakPolarHBondContact CA-O 3.36Å; M59-I69 HydrophobicContact CG-CB 4.02Å; M59-I69 HydrophobicContact CG-CG2 4.37Å; M59-I69 PolarHBondContact N-O 3Å; M59-I69 WeakPolarHBondContact O-CB 3.37Å; M59-I69 PolarHBondContact O-N 3.44Å; L61-I69 HydrophobicContact CD1-CD1 3.55Å; L61-I69 HydrophobicContact CG-CD1 3.88Å; R67-I69 HydrophobicContact CG-CG1 4.34Å; R67-I69 PolarHBondContact O-N 2.78Å; I69-Y81 HydrophobicContact CB-CD2 4.4Å; I69-Y81 HydrophobicContact CG2-CD2 3.9Å; I69-Y81 HydrophobicContact CG2-CG 4.31Å; I69-Y84 HydrophobicContact CG2-CD2 3.98Å; I69-Y84 HydrophobicContact CG2-CE2 3.82Å
70	R	94.4	Very high	90.2	Very high	93 Å²	93	66.6 Å²	66.6	35%	0.351	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	127.1	-177.9	-65.3	-178.2	-176	-169.5	-2	110.7	E68 Y79 Y81	E68-R70 HydrophobicContact CG-CG 4.22Å; E68-R70 IonicContact OE1-NE 2.65Å; E68-R70 IonicContact OE2-CZ 3.49Å; E68-R70 IonicContact OE2-NE 3.46Å; E68-R70 PolarHBondContact OE2-NE 2.97Å; E68-R70 IonicContact OE2-NH2 2.9Å; E68-R70 PolarHBondContact OE2-NH2 2.87Å; R70-Y79 HydrophobicContact CB-CD1 3.73Å; R70-Y79 HydrophobicContact CB-CE1 3.47Å; R70-Y79 VanDerWaalsContact CB-CE1 3.47Å; R70-Y79 HydrophobicContact CB-CG 4.39Å; R70-Y79 WeakPolarHBondContact CB-O 3.35Å; R70-Y79 HydrophobicContact CG-CD1 4.35Å; R70-Y79 HydrophobicContact CG-CE1 3.74Å; R70-Y79 HydrophobicContact CG-CE2 4.25Å; R70-Y81 HydrophobicContact CB-CD1 3.77Å; R70-Y81 HydrophobicContact CB-CE1 3.99Å; R70-Y81 HydrophobicContact CG-CD1 4.31Å; R70-Y81 HydrophobicContact CG-CE1 4.01Å; R70-Y81 PolarHBondContact O-N 2.89Å
71	I	93.8	Very high	90.2	Very high	2 Å²	2	69.5 Å²	69.5	1%	0.01	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-59.6	-178.4	-54.5	-179.2	0	0	0	110.6	W57 M59 A80 Y84 V88 I93 F118	W57-I71 WeakPolarHBondContact O-CB 3.47Å; W57-I71 PolarHBondContact O-N 2.99Å; M59-I71 HydrophobicContact CB-CD1 3.84Å; M59-I71 HydrophobicContact CB-CG1 4.47Å; M59-I71 HydrophobicContact CG-CD1 3.76Å; M59-I71 HydrophobicContact CG-CG1 4.08Å; M59-I71 HydrophobicContact SD-CD1 3.77Å; M59-I71 HydrophobicContact SD-CG1 4.34Å; I71-A80 WeakPolarHBondContact O-CA 3.38Å; I71-A80 WeakPolarHBondContact O-CB 3.32Å; I71-Y84 HydrophobicContact CG1-CD2 4.47Å; I71-Y84 HydrophobicContact CG2-CD1 4.45Å; I71-Y84 HydrophobicContact CG2-CG 4.36Å; I71-V88 WeakPolarHBondContact O-CG2 3.23Å; I71-I93 HydrophobicContact CG2-CD1 4.27Å; I71-I93 HydrophobicContact CG2-CG2 3.8Å; I71-F118 HydrophobicContact CD1-CD1 3.9Å; I71-F118 HydrophobicContact CD1-CE1 3.34Å; I71-F118 HydrophobicContact CD1-CZ 4.13Å
72	V	95.1	Very high	90	Very high	12 Å²	12	72 Å²	72	7%	0.073	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	143.8	-170.2	56.5	0	0	0	0	110.7	W57 V88 I93 V95 L105	W57-V72 HydrophobicContact CB-CG1 4.03Å; W57-V72 PolarHBondContact N-O 2.86Å; W57-V72 PolarHBondContact O-N 3.38Å; V72-V88 HydrophobicContact CB-CG2 4.24Å; V72-V88 HydrophobicContact CG2-CG1 4.2Å; V72-I93 HydrophobicContact CG1-CG2 4.27Å; V72-V95 HydrophobicContact CB-CG2 4.36Å; V72-V95 HydrophobicContact CG1-CG2 3.56Å; V72-V95 HydrophobicContact CG2-CG2 3.91Å; V72-L105 HydrophobicContact CG1-CD1 3.6Å
73	S	93.3	Very high	90.1	Very high	15 Å²	15	72.3 Å²	72.3	11%	0.105	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	152.2	178.5	170.2	0	0	0	0	110.4	F55 D56 A75 Q76 Y79	F55-S73 CarbonylContact O-C 3.59Å; F55-S73 WeakPolarHBondContact O-CA 3.34Å; D56-S73 WeakPolarHBondContact OD1-CB 3.3Å; D56-S73 PolarHBondContact OD1-OG 3.35Å; S73-A75 PolarHBondContact OG-N 3.46Å; S73-Q76 PolarHBondContact OG-N 3.13Å; S73-Q76 VanDerWaalsContact OG-N 3.11Å; S73-Y79 VanDerWaalsContact CB-CG 3.46Å
74	T	92.1	Very high	90.4	Very high	43 Å²	43	68 Å²	68	26%	0.264	37%	0.373	S	S	.	.	S	Bend	trans	-85.5	-14.8	167.2	61.3	0	0	0	0	113.6	D54 F55 V95 R97	D54-T74 WeakPolarHBondContact CA-OG1 3.29Å; D54-T74 WeakPolarHBondContact CB-OG1 3.13Å; D54-T74 WeakPolarHBondContact OD1-CB 3.28Å; D54-T74 PolarHBondContact OD1-OG1 3.24Å; F55-T74 HydrophobicContact CB-CG2 4.15Å; F55-T74 PolarHBondContact N-OG1 2.98Å; F55-T74 PolarHBondContact O-N 2.85Å; T74-V95 HydrophobicContact CG2-CB 4.05Å; T74-V95 HydrophobicContact CG2-CG1 3.66Å; T74-R97 PolarHBondContact OG1-NH2 2.03Å
75	A	88.8	Confident	90.5	Very high	60 Å²	60	66.4 Å²	66.4	50%	0.496	37%	0.366	S	S	.	.	S	Bend	trans	-94.9	-34.3	178.1	0	0	0	0	0	113.3	D54 S73	D54-A75 HydrophobicContact CB-CB 3.91Å; S73-A75 PolarHBondContact OG-N 3.46Å
76	Q	88.4	Confident	90.7	Very high	99 Å²	99	70.4 Å²	70.4	46%	0.463	38%	0.378	S	S	.	.			trans	-125.2	119.6	-172.1	-70.6	177.7	5.8	0	0	111.8	S73 D78 Y79	S73-Q76 PolarHBondContact OG-N 3.13Å; S73-Q76 VanDerWaalsContact OG-N 3.11Å; Q76-D78 VanDerWaalsContact C-N 3.33Å; Q76-D78 PolarHBondContact O-N 2.84Å; Q76-Y79 HydrophobicContact CB-CD2 4.41Å; Q76-Y79 WeakPolarHBondContact O-CB 3.29Å
77	S	86.1	Confident	91	Very high	117 Å²	117	62.3 Å²	62.3	82%	0.818	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-24.7	-179.7	48.1	0	0	0	0	114.1
78	D	87.6	Confident	91.1	Very high	133 Å²	133	56.5 Å²	56.5	71%	0.711	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	10.3	-177.7	60.4	-39.1	0	0	0	113.2	Q76 A80	Q76-D78 VanDerWaalsContact C-N 3.33Å; Q76-D78 PolarHBondContact O-N 2.84Å; D78-A80 PolarHBondContact O-N 3.02Å
79	Y	92.6	Very high	91.1	Very high	14 Å²	14	60.3 Å²	60.3	6%	0.055	34%	0.343	C	S	.	.			trans	-57.5	-29	179.4	-171.3	-100	0	0	0	114.1	D56 S58 R70 S73 Q76 Y81	D56-Y79 HydrophobicContact CB-CE1 4.43Å; D56-Y79 HydrophobicContact CB-CE2 4.18Å; S58-Y79 PolarHBondContact OG-OH 3.24Å; R70-Y79 HydrophobicContact CB-CD1 3.73Å; R70-Y79 HydrophobicContact CB-CE1 3.47Å; R70-Y79 VanDerWaalsContact CB-CE1 3.47Å; R70-Y79 HydrophobicContact CB-CG 4.39Å; R70-Y79 WeakPolarHBondContact CB-O 3.35Å; R70-Y79 HydrophobicContact CG-CD1 4.35Å; R70-Y79 HydrophobicContact CG-CE1 3.74Å; R70-Y79 HydrophobicContact CG-CE2 4.25Å; S73-Y79 VanDerWaalsContact CB-CG 3.46Å; Q76-Y79 HydrophobicContact CB-CD2 4.41Å; Q76-Y79 WeakPolarHBondContact O-CB 3.29Å; Y79-Y81 PolarHBondContact O-N 2.9Å
80	A	91.8	Very high	91.1	Very high	19 Å²	19	63 Å²	63	16%	0.157	36%	0.363	C	S	.	.	S	Bend	trans	-68.1	126.1	-172.1	0	0	0	0	0	113.1	I71 D78 A85 V88	I71-A80 WeakPolarHBondContact O-CA 3.38Å; I71-A80 WeakPolarHBondContact O-CB 3.32Å; D78-A80 PolarHBondContact O-N 3.02Å; A80-A85 HydrophobicContact CB-CB 4.02Å; A80-V88 HydrophobicContact CB-CG2 4.24Å
81	Y	91.5	Very high	90.9	Very high	90 Å²	90	65.9 Å²	65.9	35%	0.353	38%	0.378	S	S	.	.			trans	-59.6	145.5	166.1	-85.1	25	0	0	0	110.1	I69 R70 Y79 V83 Y84 A85	I69-Y81 HydrophobicContact CB-CD2 4.4Å; I69-Y81 HydrophobicContact CG2-CD2 3.9Å; I69-Y81 HydrophobicContact CG2-CG 4.31Å; R70-Y81 HydrophobicContact CB-CD1 3.77Å; R70-Y81 HydrophobicContact CB-CE1 3.99Å; R70-Y81 HydrophobicContact CG-CD1 4.31Å; R70-Y81 HydrophobicContact CG-CE1 4.01Å; R70-Y81 PolarHBondContact O-N 2.89Å; Y79-Y81 PolarHBondContact O-N 2.9Å; Y81-V83 PolarHBondContact O-N 2.95Å; Y81-Y84 PolarHBondContact O-N 2.81Å; Y81-A85 PolarHBondContact O-N 3.21Å
82	A	86.2	Confident	90.9	Very high	93 Å²	93	67.5 Å²	67.5	77%	0.769	39%	0.386	S	S	*	.	H	α-helix	trans	-53.4	-26.9	-170.7	0	0	0	0	0	115.3	Y84	A82-Y84 VanDerWaalsContact C-N 3.3Å; A82-Y84 PolarHBondContact O-N 2.7Å
83	V	87.8	Confident	90.9	Very high	96 Å²	96	67 Å²	67	58%	0.582	38%	0.383	S	S	*	.	H	α-helix	trans	-66.3	-29.8	176	-176.4	0	0	0	0	112.6	Y81	Y81-V83 PolarHBondContact O-N 2.95Å
84	Y	91.1	Very high	90.9	Very high	8 Å²	8	69.1 Å²	69.1	3%	0.031	39%	0.39	C	S	.	.	H	α-helix	trans	-105.7	-24	-179.9	-69.1	-76	0	0	0	113.4	M59 I69 I71 Y81 A82 Q86 R87 V88 I93 R113	M59-Y84 HydrophobicContact SD-CE1 4.39Å; M59-Y84 HydrophobicContact SD-CE2 3.89Å; M59-Y84 VanDerWaalsContact SD-CZ 3.6Å; M59-Y84 PolarHBondContact SD-OH 2.84Å; I69-Y84 HydrophobicContact CG2-CD2 3.98Å; I69-Y84 HydrophobicContact CG2-CE2 3.82Å; I71-Y84 HydrophobicContact CG1-CD2 4.47Å; I71-Y84 HydrophobicContact CG2-CD1 4.45Å; I71-Y84 HydrophobicContact CG2-CG 4.36Å; Y81-Y84 PolarHBondContact O-N 2.81Å; A82-Y84 VanDerWaalsContact C-N 3.3Å; A82-Y84 PolarHBondContact O-N 2.7Å; Y84-Q86 VanDerWaalsContact C-N 3.27Å; Y84-Q86 PolarHBondContact O-N 2.86Å; Y84-Q86 VanDerWaalsContact O-N 3.11Å; Y84-R87 WeakPolarHBondContact O-CA 3.49Å; Y84-R87 PolarHBondContact O-N 3.4Å; Y84-V88 PolarHBondContact O-N 2.79Å; Y84-I93 HydrophobicContact CD1-CD1 3.79Å; Y84-I93 HydrophobicContact CE1-CD1 4.36Å; Y84-R113 PolarHBondContact OH-O 2.86Å
85	A	89.9	Confident	91	Very high	26 Å²	26	68.3 Å²	68.3	22%	0.215	39%	0.385	C	S	.	.	H	α-helix	trans	-50.1	-40.1	-177.3	0	0	0	0	0	114.3	A80 Y81 R87 V88 N89	A80-A85 HydrophobicContact CB-CB 4.02Å; Y81-A85 PolarHBondContact O-N 3.21Å; A85-R87 VanDerWaalsContact C-N 3.34Å; A85-R87 PolarHBondContact O-N 2.65Å; A85-V88 PolarHBondContact O-N 2.9Å; A85-N89 WeakPolarHBondContact O-CB 3.47Å; A85-N89 PolarHBondContact O-N 2.82Å; A85-N89 PolarHBondContact O-ND2 2.87Å
86	Q	92.1	Very high	91.3	Very high	159 Å²	159	69.8 Å²	69.8	74%	0.743	38%	0.382	S	S	*	.	H	α-helix	trans	-61.6	-40	175.7	-174.8	-177.7	1.5	0	0	112.7	Y84 N89 S90	Y84-Q86 VanDerWaalsContact C-N 3.27Å; Y84-Q86 PolarHBondContact O-N 2.86Å; Y84-Q86 VanDerWaalsContact O-N 3.11Å; Q86-N89 PolarHBondContact O-N 2.74Å; Q86-S90 PolarHBondContact O-N 2.63Å; Q86-S90 PolarHBondContact O-OG 3.06Å
87	R	93.7	Very high	91.5	Very high	9 Å²	9	68.1 Å²	68.1	3%	0.034	37%	0.371	C	S	.	.	H	α-helix	trans	-77.2	-26.9	-178.2	-66	174.9	70.9	-154.5	2.9	112.1	Y84 A85 S90 K91 E92 I93 K109 D114	Y84-R87 WeakPolarHBondContact O-CA 3.49Å; Y84-R87 PolarHBondContact O-N 3.4Å; A85-R87 VanDerWaalsContact C-N 3.34Å; A85-R87 PolarHBondContact O-N 2.65Å; R87-S90 WeakPolarHBondContact CA-OG 3.13Å; R87-S90 PolarHBondContact O-OG 2.8Å; R87-S90 VanDerWaalsContact O-OG 3.13Å; R87-K91 PolarHBondContact O-N 2.89Å; R87-E92 HydrophobicContact CB-CB 4.17Å; R87-E92 IonicContact CZ-OE1 2.7Å; R87-E92 VanDerWaalsContact NE-CD 3.26Å; R87-E92 IonicContact NE-OE1 2.72Å; R87-E92 PolarHBondContact NE-OE1 3.1Å; R87-E92 IonicContact NE-OE2 3.87Å; R87-E92 PolarHBondContact NE-OE2 2.97Å; R87-E92 IonicContact NH2-OE1 3.81Å; R87-E92 PolarHBondContact NH2-OE1 2.98Å; R87-E92 WeakPolarHBondContact O-CA 3.41Å; R87-E92 WeakPolarHBondContact O-CB 3.16Å; R87-E92 PolarHBondContact O-N 3.18Å; R87-I93 HydrophobicContact CB-CD1 4.18Å; R87-I93 HydrophobicContact CB-CG1 4.19Å; R87-I93 PolarHBondContact O-N 2.83Å; R87-K109 PolarHBondContact NH2-O 2.86Å; R87-K109 VanDerWaalsContact NH2-O 3.07Å; R87-D114 IonicContact CZ-OD1 2.68Å; R87-D114 IonicContact CZ-OD2 3.22Å; R87-D114 VanDerWaalsContact NH1-CG 3.29Å; R87-D114 IonicContact NH1-OD1 3.04Å; R87-D114 PolarHBondContact NH1-OD1 2.93Å; R87-D114 IonicContact NH1-OD2 2.81Å; R87-D114 PolarHBondContact NH1-OD2 2.79Å; R87-D114 VanDerWaalsContact NH1-OD2 3.15Å; R87-D114 IonicContact NH2-OD1 2.66Å; R87-D114 IonicContact NH2-OD2 3.93Å; R87-D114 PolarHBondContact NH2-OD2 3.4Å
88	V	92.9	Very high	91.8	Very high	27 Å²	27	67.6 Å²	67.6	16%	0.164	36%	0.358	C	S	.	.	H	α-helix	trans	-71.2	-47.2	169.2	-179.9	0	0	0	0	110.7	I71 V72 A80 Y84 A85 S90 K91 I93	I71-V88 WeakPolarHBondContact O-CG2 3.23Å; V72-V88 HydrophobicContact CB-CG2 4.24Å; V72-V88 HydrophobicContact CG2-CG1 4.2Å; A80-V88 HydrophobicContact CB-CG2 4.24Å; Y84-V88 PolarHBondContact O-N 2.79Å; A85-V88 PolarHBondContact O-N 2.9Å; V88-S90 VanDerWaalsContact C-N 3.28Å; V88-S90 PolarHBondContact O-N 2.78Å; V88-K91 PolarHBondContact O-N 3Å; V88-I93 WeakPolarHBondContact CA-O 3.34Å; V88-I93 HydrophobicContact CG2-CB 4.27Å; V88-I93 HydrophobicContact CG2-CG2 4.43Å
89	N	91.1	Very high	91.8	Very high	134 Å²	134	63.2 Å²	63.2	72%	0.717	34%	0.339	S	S	*	.	H	α-helix	trans	-62.3	-31.4	178.2	-71.2	-16.2	0	0	0	113.4	A85 Q86 K91	A85-N89 WeakPolarHBondContact O-CB 3.47Å; A85-N89 PolarHBondContact O-N 2.82Å; A85-N89 PolarHBondContact O-ND2 2.87Å; Q86-N89 PolarHBondContact O-N 2.74Å; N89-K91 VanDerWaalsContact C-N 3.31Å
90	S	92.6	Very high	91.6	Very high	74 Å²	74	66.9 Å²	66.9	52%	0.517	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-3.7	174.1	65.2	0	0	0	0	114.5	Q86 R87 V88 E92	Q86-S90 PolarHBondContact O-N 2.63Å; Q86-S90 PolarHBondContact O-OG 3.06Å; R87-S90 WeakPolarHBondContact CA-OG 3.13Å; R87-S90 PolarHBondContact O-OG 2.8Å; R87-S90 VanDerWaalsContact O-OG 3.13Å; V88-S90 VanDerWaalsContact C-N 3.28Å; V88-S90 PolarHBondContact O-N 2.78Å; S90-E92 PolarHBondContact O-N 2.54Å; S90-E92 WeakPolarHBondContact OG-CB 3.27Å; S90-E92 PolarHBondContact OG-N 2.83Å
91	K	90.8	Very high	91.6	Very high	153 Å²	153	68.6 Å²	68.6	67%	0.665	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	30.6	-167.3	-55.2	-172.5	179	-172.9	0	113.8	R87 V88 N89 F94	R87-K91 PolarHBondContact O-N 2.89Å; V88-K91 PolarHBondContact O-N 3Å; N89-K91 VanDerWaalsContact C-N 3.31Å; K91-F94 HydrophobicContact CB-CD1 4.19Å; K91-F94 WeakPolarHBondContact O-CD1 3.41Å
92	E	93	Very high	91.7	Very high	37 Å²	37	65 Å²	65	17%	0.173	35%	0.354	C	S	.	.	S	Bend	trans	-73.6	-34.8	163.8	-166.4	-167.9	142.2	0	0	110.5	R87 S90 I107 T108 K109 Q111	R87-E92 HydrophobicContact CB-CB 4.17Å; R87-E92 IonicContact CZ-OE1 2.7Å; R87-E92 VanDerWaalsContact NE-CD 3.26Å; R87-E92 IonicContact NE-OE1 2.72Å; R87-E92 PolarHBondContact NE-OE1 3.1Å; R87-E92 IonicContact NE-OE2 3.87Å; R87-E92 PolarHBondContact NE-OE2 2.97Å; R87-E92 IonicContact NH2-OE1 3.81Å; R87-E92 PolarHBondContact NH2-OE1 2.98Å; R87-E92 WeakPolarHBondContact O-CA 3.41Å; R87-E92 WeakPolarHBondContact O-CB 3.16Å; R87-E92 PolarHBondContact O-N 3.18Å; S90-E92 PolarHBondContact O-N 2.54Å; S90-E92 WeakPolarHBondContact OG-CB 3.27Å; S90-E92 PolarHBondContact OG-N 2.83Å; E92-I107 CarbonylContact O-C 3.56Å; E92-I107 WeakPolarHBondContact O-CA 3.44Å; E92-T108 WeakPolarHBondContact CA-OG1 2.98Å; E92-T108 PolarHBondContact O-N 2.93Å; E92-T108 PolarHBondContact O-OG1 2.7Å; E92-K109 HydrophobicContact CG-CB 4.31Å; E92-Q111 PolarHBondContact OE1-NE2 3.27Å
93	I	94.7	Very high	92.1	Very high	2 Å²	2	60.6 Å²	60.6	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	131.1	167.7	-58.7	178	0	0	0	108.6	I71 V72 Y84 R87 V88 L105 H106 I107	I71-I93 HydrophobicContact CG2-CD1 4.27Å; I71-I93 HydrophobicContact CG2-CG2 3.8Å; V72-I93 HydrophobicContact CG1-CG2 4.27Å; Y84-I93 HydrophobicContact CD1-CD1 3.79Å; Y84-I93 HydrophobicContact CE1-CD1 4.36Å; R87-I93 HydrophobicContact CB-CD1 4.18Å; R87-I93 HydrophobicContact CB-CG1 4.19Å; R87-I93 PolarHBondContact O-N 2.83Å; V88-I93 WeakPolarHBondContact CA-O 3.34Å; V88-I93 HydrophobicContact CG2-CB 4.27Å; V88-I93 HydrophobicContact CG2-CG2 4.43Å; I93-L105 HydrophobicContact CG2-CD1 3.86Å; I93-H106 VanDerWaalsContact CA-O 3.28Å; I93-H106 WeakPolarHBondContact CA-O 3.43Å; I93-I107 HydrophobicContact CG1-CG1 4.26Å; I93-I107 HydrophobicContact CG1-CG2 4.17Å; I93-I107 HydrophobicContact CG2-CG1 4.46Å
94	F	94.9	Very high	92.5	Very high	58 Å²	58	56.7 Å²	56.7	25%	0.254	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	164.4	173.3	61.2	-88.5	0	0	0	111.3	K91 E96 H106 T108	K91-F94 HydrophobicContact CB-CD1 4.19Å; K91-F94 WeakPolarHBondContact O-CD1 3.41Å; F94-E96 HydrophobicContact CD2-CB 4.48Å; F94-E96 HydrophobicContact CE2-CB 4.21Å; F94-H106 HydrophobicContact CD1-CB 4.04Å; F94-H106 HydrophobicContact CD2-CB 4.04Å; F94-H106 HydrophobicContact CE1-CB 3.75Å; F94-H106 HydrophobicContact CE2-CB 3.75Å; F94-H106 AromaticContact CE2-CG 3.6Å; F94-H106 AromaticContact CE2-ND1 3.6Å; F94-H106 HydrophobicContact CG-CB 4.19Å; F94-H106 HydrophobicContact CZ-CB 3.61Å; F94-H106 AromaticContact CZ-CG 3.67Å; F94-H106 AromaticContact CZ-ND1 3.44Å; F94-H106 WeakPolarHBondContact CZ-ND1 3.49Å; F94-H106 PolarHBondContact N-O 3.13Å; F94-H106 PolarHBondContact O-N 3.02Å; F94-T108 HydrophobicContact CE1-CG2 3.73Å
95	V	94.4	Very high	92.7	Very high	26 Å²	26	56.3 Å²	56.3	16%	0.158	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	119.8	170	-178.9	0	0	0	0	108.6	W57 V72 T74 A103 V104 L105	W57-V95 HydrophobicContact CG-CG2 4.47Å; V72-V95 HydrophobicContact CB-CG2 4.36Å; V72-V95 HydrophobicContact CG1-CG2 3.56Å; V72-V95 HydrophobicContact CG2-CG2 3.91Å; T74-V95 HydrophobicContact CG2-CB 4.05Å; T74-V95 HydrophobicContact CG2-CG1 3.66Å; V95-A103 HydrophobicContact CG1-CB 3.72Å; V95-V104 CarbonylContact C-O 3.56Å; V95-V104 WeakPolarHBondContact CA-O 3.36Å; V95-L105 HydrophobicContact CG2-CD1 4.17Å
96	E	94.1	Very high	92.9	Very high	91 Å²	91	55.7 Å²	55.7	43%	0.425	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	128.9	167.5	-169.5	168.1	161.2	0	0	108.7	F94 L98 A103 V104 H106	F94-E96 HydrophobicContact CD2-CB 4.48Å; F94-E96 HydrophobicContact CE2-CB 4.21Å; E96-L98 HydrophobicContact CG-CD2 4.39Å; E96-A103 CarbonylContact O-C 3.6Å; E96-A103 VanDerWaalsContact O-CA 3.31Å; E96-A103 WeakPolarHBondContact O-CA 3.16Å; E96-V104 PolarHBondContact N-O 3.08Å; E96-V104 PolarHBondContact O-N 2.7Å; E96-H106 IonicContact OE2-CE1 3.51Å; E96-H106 PolarHBondContact OE2-CE1 3.36Å; E96-H106 IonicContact OE2-ND1 2.7Å; E96-H106 IonicContact OE2-NE2 3.38Å
97	R	92.7	Very high	93.1	Very high	65 Å²	65	48.2 Å²	48.2	25%	0.245	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	116.3	176.1	178.9	178.7	-73.9	-88.3	6.8	108.8	Q53 D54 T74 S99 D100	Q53-R97 PolarHBondContact O-NH1 3.02Å; Q53-R97 PolarHBondContact O-NH2 2.57Å; D54-R97 IonicContact OD1-NH2 3.66Å; D54-R97 PolarHBondContact OD1-NH2 3.14Å; T74-R97 PolarHBondContact OG1-NH2 2.03Å; R97-S99 WeakPolarHBondContact CD-O 3.5Å; R97-S99 WeakPolarHBondContact CG-O 3.29Å; R97-S99 PolarHBondContact NH1-O 2.95Å; R97-D100 PolarHBondContact NH1-O 3.11Å
98	L	91.5	Very high	93	Very high	105 Å²	105	50.5 Å²	50.5	55%	0.55	27%	0.265	S	S	.	.			trans	-84.8	-35	178.1	-58.6	-174.6	0	0	0	111.7	E96 S102 V104	E96-L98 HydrophobicContact CG-CD2 4.39Å; L98-S102 PolarHBondContact N-O 2.89Å; L98-V104 HydrophobicContact CD1-CG2 3.57Å; L98-V104 HydrophobicContact CD2-CG2 4.38Å; L98-V104 HydrophobicContact CG-CG2 3.91Å
99	S	89.4	Confident	93	Very high	42 Å²	42	54.9 Å²	54.9	29%	0.294	28%	0.281	S	S	.	.	S	Bend	trans	-154.3	-174.6	179.2	59	0	0	0	0	111	R97 D101 S102	R97-S99 WeakPolarHBondContact CD-O 3.5Å; R97-S99 WeakPolarHBondContact CG-O 3.29Å; R97-S99 PolarHBondContact NH1-O 2.95Å; S99-D101 VanDerWaalsContact CB-OD1 3.25Å; S99-D101 WeakPolarHBondContact CB-OD1 3.16Å; S99-D101 PolarHBondContact O-N 2.84Å; S99-D101 PolarHBondContact OG-OD1 2.82Å; S99-S102 PolarHBondContact N-O 3.38Å; S99-S102 VanDerWaalsContact N-O 3.1Å; S99-S102 VanDerWaalsContact OG-CB 3.23Å; S99-S102 WeakPolarHBondContact OG-CB 3.32Å; S99-S102 PolarHBondContact OG-N 2.79Å
100	D	88.4	Confident	93	Very high	90 Å²	90	48.5 Å²	48.5	48%	0.481	25%	0.247	S	C	.	.	S	Bend	trans	-70	-17.6	175.1	-73.5	-47.8	0	0	0	113.1	K52 Q53 R97	K52-D100 HydrophobicContact CB-CB 4.36Å; K52-D100 WeakPolarHBondContact CD-OD1 3.5Å; K52-D100 HydrophobicContact CG-CB 4.4Å; K52-D100 VanDerWaalsContact CG-OD1 3.32Å; K52-D100 WeakPolarHBondContact CG-OD1 3.3Å; Q53-D100 PolarHBondContact N-O 3.26Å; R97-D100 PolarHBondContact NH1-O 3.11Å
101	D	90.6	Very high	93	Very high	56 Å²	56	46.6 Å²	46.6	30%	0.299	23%	0.23	S	C	.	.	S	Bend	trans	-121.3	-3.4	-176.1	67.4	-39.9	0	0	0	115.2	N43 V44 Y47 F55 S99	N43-D101 CarbonylContact C-O 3.59Å; N43-D101 WeakPolarHBondContact CA-O 3.15Å; V44-D101 PolarHBondContact N-O 3.35Å; Y47-D101 HydrophobicContact CE1-CB 3.78Å; Y47-D101 WeakPolarHBondContact OH-CB 3.25Å; F55-D101 WeakPolarHBondContact CZ-O 3.45Å; S99-D101 VanDerWaalsContact CB-OD1 3.25Å; S99-D101 WeakPolarHBondContact CB-OD1 3.16Å; S99-D101 PolarHBondContact O-N 2.84Å; S99-D101 PolarHBondContact OG-OD1 2.82Å
102	S	93.8	Very high	93	Very high	14 Å²	14	42.1 Å²	42.1	10%	0.098	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	137.4	177.4	-176.8	0	0	0	0	113	N43 L98 S99	N43-S102 WeakPolarHBondContact OD1-CB 3.37Å; N43-S102 PolarHBondContact OD1-OG 3.34Å; L98-S102 PolarHBondContact N-O 2.89Å; S99-S102 PolarHBondContact N-O 3.38Å; S99-S102 VanDerWaalsContact N-O 3.1Å; S99-S102 VanDerWaalsContact OG-CB 3.23Å; S99-S102 WeakPolarHBondContact OG-CB 3.32Å; S99-S102 PolarHBondContact OG-N 2.79Å
103	A	94.7	Very high	92.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	157.2	174.9	0	0	0	0	0	111.8	C42 F55 V95 E96	C42-A103 PolarHBondContact N-O 2.87Å; C42-A103 PolarHBondContact O-N 2.88Å; C42-A103 VanDerWaalsContact O-O 3.14Å; F55-A103 HydrophobicContact CB-CB 4.27Å; F55-A103 HydrophobicContact CD1-CB 3.92Å; F55-A103 HydrophobicContact CD2-CB 3.75Å; F55-A103 HydrophobicContact CE1-CB 4.19Å; F55-A103 HydrophobicContact CE2-CB 4.05Å; F55-A103 HydrophobicContact CG-CB 3.7Å; F55-A103 HydrophobicContact CZ-CB 4.26Å; V95-A103 HydrophobicContact CG1-CB 3.72Å; E96-A103 CarbonylContact O-C 3.6Å; E96-A103 VanDerWaalsContact O-CA 3.31Å; E96-A103 WeakPolarHBondContact O-CA 3.16Å
104	V	95.4	Very high	92.6	Very high	14 Å²	14	46.8 Å²	46.8	9%	0.085	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.7	177.6	-174	0	0	0	0	109.2	T39 I40 W41 V95 E96 L98 H106	T39-V104 HydrophobicContact CG2-CG1 3.93Å; I40-V104 CarbonylContact O-C 3.55Å; I40-V104 WeakPolarHBondContact O-CA 3.36Å; W41-V104 HydrophobicContact CB-CG2 4.06Å; V95-V104 CarbonylContact C-O 3.56Å; V95-V104 WeakPolarHBondContact CA-O 3.36Å; E96-V104 PolarHBondContact N-O 3.08Å; E96-V104 PolarHBondContact O-N 2.7Å; L98-V104 HydrophobicContact CD1-CG2 3.57Å; L98-V104 HydrophobicContact CD2-CG2 4.38Å; L98-V104 HydrophobicContact CG-CG2 3.91Å; V104-H106 VanDerWaalsContact CG1-CD2 3.49Å; V104-H106 WeakPolarHBondContact CG1-CD2 3.4Å; V104-H106 WeakPolarHBondContact CG1-NE2 3.31Å; V104-H106 PolarHBondContact O-CD2 2.7Å
105	L	95.6	Very high	92.6	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	123.5	165.9	177.2	64.9	0	0	0	109.2	T39 I40 W57 V72 I93 V95 I107 F118	T39-L105 CarbonylContact C-O 3.56Å; T39-L105 VanDerWaalsContact CA-O 3.3Å; T39-L105 WeakPolarHBondContact CA-O 3.36Å; I40-L105 HydrophobicContact CB-CB 4.47Å; I40-L105 PolarHBondContact N-O 3.29Å; I40-L105 PolarHBondContact O-N 3.04Å; W57-L105 HydrophobicContact CD2-CB 3.96Å; W57-L105 HydrophobicContact CD2-CD2 3.96Å; W57-L105 HydrophobicContact CD2-CG 4.43Å; W57-L105 HydrophobicContact CE3-CB 4.29Å; W57-L105 HydrophobicContact CE3-CD2 3.76Å; W57-L105 HydrophobicContact CG-CB 4.46Å; W57-L105 HydrophobicContact CG-CD1 4.47Å; W57-L105 HydrophobicContact CG-CD2 4.35Å; W57-L105 HydrophobicContact CH2-CB 4.12Å; W57-L105 HydrophobicContact CZ2-CB 3.8Å; W57-L105 HydrophobicContact CZ3-CB 4.37Å; W57-L105 HydrophobicContact CZ3-CD2 4.17Å; V72-L105 HydrophobicContact CG1-CD1 3.6Å; I93-L105 HydrophobicContact CG2-CD1 3.86Å; V95-L105 HydrophobicContact CG2-CD1 4.17Å; L105-I107 HydrophobicContact CG-CG1 4.42Å; L105-F118 HydrophobicContact CD2-CD1 3.48Å; L105-F118 VanDerWaalsContact CD2-CD1 3.48Å; L105-F118 HydrophobicContact CD2-CE1 3.64Å
106	H	95.4	Very high	92.5	Very high	13 Å²	13	46.1 Å²	46.1	6%	0.06	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	131.3	175.3	-71.1	-138.2	0	0	0	108.9	H37 I93 F94 E96 V104	H37-H106 AromaticContact CE1-CE1 3.94Å; H37-H106 AromaticContact CE1-ND1 3.48Å; H37-H106 PolarHBondContact CE1-ND1 3.01Å; H37-H106 WeakPolarHBondContact NE2-CB 3.29Å; H37-H106 AromaticContact NE2-CD2 3.91Å; H37-H106 AromaticContact NE2-CE1 3.59Å; H37-H106 AromaticContact NE2-CG 2.91Å; H37-H106 AromaticContact NE2-ND1 2.64Å; H37-H106 PolarHBondContact NE2-ND1 3Å; I93-H106 VanDerWaalsContact CA-O 3.28Å; I93-H106 WeakPolarHBondContact CA-O 3.43Å; F94-H106 HydrophobicContact CD1-CB 4.04Å; F94-H106 HydrophobicContact CD2-CB 4.04Å; F94-H106 HydrophobicContact CE1-CB 3.75Å; F94-H106 HydrophobicContact CE2-CB 3.75Å; F94-H106 AromaticContact CE2-CG 3.6Å; F94-H106 AromaticContact CE2-ND1 3.6Å; F94-H106 HydrophobicContact CG-CB 4.19Å; F94-H106 HydrophobicContact CZ-CB 3.61Å; F94-H106 AromaticContact CZ-CG 3.67Å; F94-H106 AromaticContact CZ-ND1 3.44Å; F94-H106 WeakPolarHBondContact CZ-ND1 3.49Å; F94-H106 PolarHBondContact N-O 3.13Å; F94-H106 PolarHBondContact O-N 3.02Å; E96-H106 IonicContact OE2-CE1 3.51Å; E96-H106 PolarHBondContact OE2-CE1 3.36Å; E96-H106 IonicContact OE2-ND1 2.7Å; E96-H106 IonicContact OE2-NE2 3.38Å; V104-H106 VanDerWaalsContact CG1-CD2 3.49Å; V104-H106 WeakPolarHBondContact CG1-CD2 3.4Å; V104-H106 WeakPolarHBondContact CG1-NE2 3.31Å; V104-H106 PolarHBondContact O-CD2 2.7Å
107	I	95	Very high	92.5	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	95.2	168.6	-54.9	177.5	0	0	0	105.8	H37 V38 E92 I93 L105 K109 V110 F118 L139	H37-I107 CarbonylContact C-O 3.56Å; H37-I107 WeakPolarHBondContact CA-O 3.21Å; V38-I107 HydrophobicContact CB-CB 4.45Å; V38-I107 PolarHBondContact N-O 2.92Å; V38-I107 PolarHBondContact O-N 2.84Å; E92-I107 CarbonylContact O-C 3.56Å; E92-I107 WeakPolarHBondContact O-CA 3.44Å; I93-I107 HydrophobicContact CG1-CG1 4.26Å; I93-I107 HydrophobicContact CG1-CG2 4.17Å; I93-I107 HydrophobicContact CG2-CG1 4.46Å; L105-I107 HydrophobicContact CG-CG1 4.42Å; I107-K109 PolarHBondContact O-N 3.38Å; I107-V110 HydrophobicContact CG2-CB 4.12Å; I107-V110 HydrophobicContact CG2-CG2 4.42Å; I107-F118 HydrophobicContact CD1-CE1 4.04Å; I107-F118 HydrophobicContact CD1-CZ 3.95Å; I107-L139 HydrophobicContact CD1-CD2 4.18Å
108	T	92.3	Very high	92.7	Very high	56 Å²	56	41.2 Å²	41.2	34%	0.344	22%	0.217	S	C	.	.	S	Bend	trans	-67.7	-19.5	-169.6	64.7	0	0	0	0	113.7	H37 E92 F94	H37-T108 WeakPolarHBondContact CA-O 3.49Å; H37-T108 WeakPolarHBondContact CB-O 3.47Å; E92-T108 WeakPolarHBondContact CA-OG1 2.98Å; E92-T108 PolarHBondContact O-N 2.93Å; E92-T108 PolarHBondContact O-OG1 2.7Å; F94-T108 HydrophobicContact CE1-CG2 3.73Å
109	K	91.7	Very high	92.9	Very high	119 Å²	119	37 Å²	37	52%	0.517	20%	0.195	S	C	.	.	S	Bend	trans	-143.7	92.1	170.9	-169.6	-176.3	-179.5	-179.1	0	109.7	S36 R87 E92 I107	S36-K109 WeakPolarHBondContact O-CA 3.41Å; R87-K109 PolarHBondContact NH2-O 2.86Å; R87-K109 VanDerWaalsContact NH2-O 3.07Å; E92-K109 HydrophobicContact CG-CB 4.31Å; I107-K109 PolarHBondContact O-N 3.38Å
110	V	92.4	Very high	93.2	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.			trans	-66.9	141.4	177.9	73.5	0	0	0	0	111.1	R32 T33 G35 S36 V38 I107 D114 L139 V141	R32-V110 HydrophobicContact CB-CG1 4.46Å; T33-V110 WeakPolarHBondContact O-CG1 3.22Å; G35-V110 PolarHBondContact N-O 3.1Å; S36-V110 PolarHBondContact O-N 3.44Å; V38-V110 HydrophobicContact CG2-CB 3.7Å; V38-V110 HydrophobicContact CG2-CG1 3.7Å; V38-V110 HydrophobicContact CG2-CG2 4.18Å; I107-V110 HydrophobicContact CG2-CB 4.12Å; I107-V110 HydrophobicContact CG2-CG2 4.42Å; V110-D114 HydrophobicContact CG2-CB 3.91Å; V110-L139 HydrophobicContact CG2-CD2 4.06Å; V110-V141 HydrophobicContact CG1-CG1 4.41Å; V110-V141 HydrophobicContact CG2-CG1 4.45Å; V110-V141 HydrophobicContact CG2-CG2 3.68Å
111	Q	92.6	Very high	93.4	Very high	34 Å²	34	34.5 Å²	34.5	16%	0.159	17%	0.173	C	C	.	.			trans	-123.9	155	-175.9	-55.7	176.1	13.2	0	0	109.2	E34 E92 R113 D114	E34-Q111 WeakPolarHBondContact OE1-CA 3.47Å; E92-Q111 PolarHBondContact OE1-NE2 3.27Å; Q111-R113 HydrophobicContact CB-CG 4.13Å; Q111-R113 PolarHBondContact O-N 3.48Å; Q111-R113 VanDerWaalsContact OE1-CZ 3.23Å; Q111-D114 PolarHBondContact N-OD2 2.82Å; Q111-D114 VanDerWaalsContact O-CB 3.27Å; Q111-D114 WeakPolarHBondContact O-CB 3.35Å; Q111-D114 PolarHBondContact O-N 2.72Å
112	A	89.6	Confident	93.5	Very high	60 Å²	60	31.8 Å²	31.8	50%	0.496	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-56.2	-28	-177.6	0	0	0	0	0	114.1	E34 D114 Q115	E34-A112 PolarHBondContact OE1-N 2.89Å; A112-D114 VanDerWaalsContact C-N 3.28Å; A112-D114 PolarHBondContact O-N 3.47Å; A112-Q115 WeakPolarHBondContact O-CB 3.25Å; A112-Q115 PolarHBondContact O-N 2.83Å
113	R	89.1	Confident	93.2	Very high	135 Å²	135	33 Å²	33	51%	0.509	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-75.1	-9.5	174.3	64.4	175.3	166.8	-177.9	-3.2	115.2	Y84 Q111 Q115	Y84-R113 PolarHBondContact OH-O 2.86Å; Q111-R113 HydrophobicContact CB-CG 4.13Å; Q111-R113 PolarHBondContact O-N 3.48Å; Q111-R113 VanDerWaalsContact OE1-CZ 3.23Å; R113-Q115 VanDerWaalsContact C-N 3.26Å
114	D	91.8	Very high	92.6	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.011	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-85.7	-3.1	176.5	-56.1	-25.2	0	0	0	111.5	R87 V110 Q111 A112 G116 F118	R87-D114 IonicContact CZ-OD1 2.68Å; R87-D114 IonicContact CZ-OD2 3.22Å; R87-D114 VanDerWaalsContact NH1-CG 3.29Å; R87-D114 IonicContact NH1-OD1 3.04Å; R87-D114 PolarHBondContact NH1-OD1 2.93Å; R87-D114 IonicContact NH1-OD2 2.81Å; R87-D114 PolarHBondContact NH1-OD2 2.79Å; R87-D114 VanDerWaalsContact NH1-OD2 3.15Å; R87-D114 IonicContact NH2-OD1 2.66Å; R87-D114 IonicContact NH2-OD2 3.93Å; R87-D114 PolarHBondContact NH2-OD2 3.4Å; V110-D114 HydrophobicContact CG2-CB 3.91Å; Q111-D114 PolarHBondContact N-OD2 2.82Å; Q111-D114 VanDerWaalsContact O-CB 3.27Å; Q111-D114 WeakPolarHBondContact O-CB 3.35Å; Q111-D114 PolarHBondContact O-N 2.72Å; A112-D114 VanDerWaalsContact C-N 3.28Å; A112-D114 PolarHBondContact O-N 3.47Å; D114-G116 PolarHBondContact O-N 2.97Å; D114-F118 VanDerWaalsContact O-CE2 3.23Å; D114-F118 WeakPolarHBondContact O-CE2 3.23Å
115	Q	93.5	Very high	91.8	Very high	70 Å²	70	36.6 Å²	36.6	33%	0.327	19%	0.187	S	C	.	.			trans	-66.3	126.2	173.9	172.8	161.3	-61.8	0	0	111.5	P62 A112 R113 L139 V141	P62-Q115 WeakPolarHBondContact CD-O 3.38Å; A112-Q115 WeakPolarHBondContact O-CB 3.25Å; A112-Q115 PolarHBondContact O-N 2.83Å; R113-Q115 VanDerWaalsContact C-N 3.26Å; Q115-L139 VanDerWaalsContact CA-O 3.31Å; Q115-L139 WeakPolarHBondContact CA-O 3.14Å; Q115-L139 WeakPolarHBondContact CG-O 3.43Å; Q115-V141 HydrophobicContact CB-CB 4.34Å; Q115-V141 HydrophobicContact CB-CG2 4.05Å
116	G	92.8	Very high	90.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.4	-176.9	178.2	0	0	0	0	0	113.3	D114 N138 L139	D114-G116 PolarHBondContact O-N 2.97Å; G116-N138 PolarHBondContact O-OD1 2.59Å; G116-L139 PolarHBondContact N-O 2.94Å; G116-L139 VanDerWaalsContact N-O 3.1Å; G116-L139 PolarHBondContact O-N 2.88Å
117	V	94.9	Very high	89.4	Confident	51 Å²	51	41.9 Å²	41.9	31%	0.309	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	113.9	174.8	179.9	0	0	0	0	108.6	M59 Y60 R136 T137	M59-V117 CarbonylContact C-O 3.59Å; M59-V117 VanDerWaalsContact CA-O 3.25Å; M59-V117 WeakPolarHBondContact CA-O 3.34Å; Y60-V117 PolarHBondContact N-O 2.54Å; Y60-V117 PolarHBondContact O-N 3.36Å; V117-R136 HydrophobicContact CG1-CB 3.86Å; V117-R136 HydrophobicContact CG1-CG 4.32Å; V117-T137 CarbonylContact C-O 3.56Å; V117-T137 VanDerWaalsContact CA-O 3.29Å; V117-T137 WeakPolarHBondContact CA-O 3.36Å
118	F	95.4	Very high	88.5	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	129.1	172.5	-74.1	-106.6	0	0	0	109	I40 W57 S58 M59 I71 L105 I107 D114 R136 T137 L139	I40-F118 HydrophobicContact CD1-CD2 4.45Å; I40-F118 HydrophobicContact CD1-CG 4.31Å; W57-F118 HydrophobicContact CE3-CB 4.26Å; W57-F118 HydrophobicContact CE3-CD1 4.43Å; W57-F118 HydrophobicContact CZ3-CB 4.15Å; S58-F118 WeakPolarHBondContact O-CA 3.39Å; M59-F118 HydrophobicContact CB-CD1 4.45Å; M59-F118 HydrophobicContact CE-CE2 4.37Å; M59-F118 HydrophobicContact CE-CZ 4.38Å; I71-F118 HydrophobicContact CD1-CD1 3.9Å; I71-F118 HydrophobicContact CD1-CE1 3.34Å; I71-F118 HydrophobicContact CD1-CZ 4.13Å; L105-F118 HydrophobicContact CD2-CD1 3.48Å; L105-F118 VanDerWaalsContact CD2-CD1 3.48Å; L105-F118 HydrophobicContact CD2-CE1 3.64Å; I107-F118 HydrophobicContact CD1-CE1 4.04Å; I107-F118 HydrophobicContact CD1-CZ 3.95Å; D114-F118 VanDerWaalsContact O-CE2 3.23Å; D114-F118 WeakPolarHBondContact O-CE2 3.23Å; F118-R136 CarbonylContact O-C 3.59Å; F118-R136 VanDerWaalsContact O-CA 3.3Å; F118-R136 WeakPolarHBondContact O-CA 3.27Å; F118-T137 HydrophobicContact CB-CG2 4.33Å; F118-T137 PolarHBondContact N-O 3.27Å; F118-T137 PolarHBondContact O-N 3.12Å; F118-L139 HydrophobicContact CD2-CB 3.82Å; F118-L139 HydrophobicContact CD2-CD2 4.4Å; F118-L139 HydrophobicContact CE2-CB 3.67Å; F118-L139 HydrophobicContact CE2-CD2 3.61Å; F118-L139 HydrophobicContact CE2-CG 4.25Å; F118-L139 HydrophobicContact CZ-CD2 3.92Å
119	E	95.6	Very high	87.9	Confident	17 Å²	17	56.4 Å²	56.4	8%	0.079	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	123.3	170.1	-179.3	154.8	-124.1	0	0	109.3	W57 S58 Y60 S134 A135 R136	W57-E119 WeakPolarHBondContact CA-O 3.3Å; S58-E119 PolarHBondContact N-O 3.48Å; S58-E119 PolarHBondContact O-N 2.64Å; Y60-E119 HydrophobicContact CD2-CB 4.49Å; Y60-E119 HydrophobicContact CE2-CB 3.81Å; Y60-E119 VanDerWaalsContact CE2-OE2 3.27Å; Y60-E119 WeakPolarHBondContact CE2-OE2 3Å; Y60-E119 PolarHBondContact OH-OE2 2.82Å; E119-S134 WeakPolarHBondContact OE1-CB 3.33Å; E119-S134 PolarHBondContact OE1-OG 2.85Å; E119-A135 WeakPolarHBondContact CA-O 3.41Å; E119-R136 HydrophobicContact CB-CG 3.94Å; E119-R136 VanDerWaalsContact CD-NH2 3.34Å; E119-R136 HydrophobicContact CG-CG 3.99Å; E119-R136 IonicContact OE1-CZ 3.47Å; E119-R136 IonicContact OE1-NE 2.78Å; E119-R136 PolarHBondContact OE1-NE 2.84Å; E119-R136 IonicContact OE1-NH2 3.28Å; E119-R136 PolarHBondContact OE1-NH2 3.03Å; E119-R136 IonicContact OE2-CZ 3.38Å; E119-R136 IonicContact OE2-NE 3.34Å; E119-R136 PolarHBondContact OE2-NE 2.81Å; E119-R136 IonicContact OE2-NH2 2.73Å; E119-R136 PolarHBondContact OE2-NH2 2.92Å
120	C	95.6	Very high	87.2	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	107.3	161	177.9	0	0	0	0	107.2	V25 C42 W57 S134 A135	V25-C120 HydrophobicContact CG2-CB 4.49Å; C42-C120 HydrophobicContact CB-CB 3.67Å; C42-C120 WeakPolarHBondContact CB-SG 3.45Å; C42-C120 WeakPolarHBondContact SG-CB 3.18Å; C42-C120 CovalentContact SG-SG 2.03Å; C42-C120 PolarHBondContact SG-SG 2.79Å; W57-C120 HydrophobicContact CD2-CB 4.17Å; W57-C120 HydrophobicContact CE3-CB 4.07Å; W57-C120 HydrophobicContact CH2-CB 3.99Å; W57-C120 HydrophobicContact CZ2-CB 4.04Å; W57-C120 HydrophobicContact CZ3-CB 3.98Å; C120-S134 CarbonylContact O-C 3.6Å; C120-S134 WeakPolarHBondContact O-CA 3.39Å; C120-S134 VanDerWaalsContact O-CB 3.29Å; C120-S134 WeakPolarHBondContact O-CB 3.39Å; C120-A135 PolarHBondContact N-O 3.2Å; C120-A135 PolarHBondContact O-N 3.37Å
121	Y	94.3	Very high	86.8	Confident	78 Å²	78	57.3 Å²	57.3	31%	0.306	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	149.5	166.1	175.2	-108.4	0	0	0	109.2	D56 P123 Y133	D56-Y121 HydrophobicContact CB-CD1 4.12Å; D56-Y121 PolarHBondContact N-O 3.49Å; D56-Y121 PolarHBondContact O-N 2.91Å; Y121-P123 HydrophobicContact CD1-CG 4.32Å; Y121-P123 HydrophobicContact CE1-CB 4.29Å; Y121-P123 HydrophobicContact CE1-CG 3.95Å; Y121-Y133 WeakPolarHBondContact CD2-O 3.07Å
122	T	91.8	Very high	86.6	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.317	C	S	.	.			trans	-130.6	115	173.8	62.1	0	0	0	0	109.2	R21 V23 V44 D54 F55 Y133	R21-T122 PolarHBondContact NE-OG1 3.11Å; R21-T122 PolarHBondContact NH2-OG1 2.93Å; V23-T122 HydrophobicContact CG1-CG2 4.43Å; V23-T122 HydrophobicContact CG2-CG2 4.1Å; V23-T122 WeakPolarHBondContact CG2-OG1 3.31Å; V44-T122 HydrophobicContact CG2-CG2 3.69Å; D54-T122 VanDerWaalsContact O-CA 3.28Å; D54-T122 WeakPolarHBondContact O-CA 3.48Å; D54-T122 VanDerWaalsContact O-CB 3.23Å; D54-T122 WeakPolarHBondContact O-CB 3.21Å; D54-T122 WeakPolarHBondContact O-CG2 3.44Å; F55-T122 HydrophobicContact CD1-CG2 3.75Å; F55-T122 HydrophobicContact CE1-CG2 3.98Å; F55-T122 HydrophobicContact CG-CG2 4.35Å; T122-Y133 PolarHBondContact N-O 2.88Å; T122-Y133 PolarHBondContact OG1-O 3.17Å
123	P	87.3	Confident	86.7	Confident	40 Å²	40	56.6 Å²	56.6	26%	0.26	30%	0.297	S	S	.	.			trans	-54	142	-178.7	-29.3	36.3	0	0	0	112.9	D54 D56 Y121 T125	D54-P123 WeakPolarHBondContact O-CD 3.28Å; D56-P123 WeakPolarHBondContact OD2-CG 3.09Å; Y121-P123 HydrophobicContact CD1-CG 4.32Å; Y121-P123 HydrophobicContact CE1-CB 4.29Å; Y121-P123 HydrophobicContact CE1-CG 3.95Å; P123-T125 PolarHBondContact O-N 2.68Å; P123-T125 VanDerWaalsContact O-N 3.15Å
124	N	82.3	Confident	86.9	Confident	30 Å²	30	51.8 Å²	51.8	16%	0.16	28%	0.284	C	S	.	.			trans	-73.3	110.5	-177.7	-172.7	16	0	0	0	111.8	D126 R128 Y129 Y133	N124-D126 PolarHBondContact ND2-O 2.85Å; N124-D126 PolarHBondContact OD1-N 2.85Å; N124-D126 PolarHBondContact OD1-O 3.41Å; N124-R128 PolarHBondContact ND2-O 2.93Å; N124-R128 VanDerWaalsContact ND2-O 3.15Å; N124-Y129 HydrophobicContact CB-CD1 3.89Å; N124-Y129 HydrophobicContact CB-CE1 3.37Å; N124-Y129 HydrophobicContact CB-CE2 4.19Å; N124-Y129 WeakPolarHBondContact ND2-CD1 3.44Å; N124-Y129 VanDerWaalsContact ND2-CD2 3.31Å; N124-Y129 WeakPolarHBondContact ND2-CD2 3.45Å; N124-Y129 WeakPolarHBondContact ND2-CE2 3.47Å; N124-Y129 VanDerWaalsContact ND2-CG 3.3Å; N124-Y133 HydrophobicContact CB-CD1 3.82Å; N124-Y133 HydrophobicContact CB-CE1 3.35Å; N124-Y133 PolarHBondContact ND2-OH 3.48Å; N124-Y133 WeakPolarHBondContact OD1-CE1 3.25Å; N124-Y133 PolarHBondContact OD1-OH 2.91Å; N124-Y133 VanDerWaalsContact OD1-OH 3.08Å
125	T	78.5	Confident	87	Confident	59 Å²	59	52.5 Å²	52.5	36%	0.362	29%	0.29	S	S	.	.			trans	-86.9	-11.4	174.7	58.3	0	0	0	0	113.6	V51 Q53 P123	V51-T125 HydrophobicContact CG1-CG2 4.05Å; Q53-T125 PolarHBondContact NE2-OG1 2.91Å; Q53-T125 PolarHBondContact OE1-OG1 2.86Å; Q53-T125 VanDerWaalsContact OE1-OG1 3.14Å; P123-T125 PolarHBondContact O-N 2.68Å; P123-T125 VanDerWaalsContact O-N 3.15Å
126	D	71.4	Confident	87.1	Confident	36 Å²	36	55.5 Å²	55.5	19%	0.193	30%	0.299	C	S	.	.	S	Bend	trans	-102.9	133.9	-177.3	-69.4	-48	0	0	0	110.5	K48 N124 R128	K48-D126 WeakPolarHBondContact CB-OD1 3.4Å; K48-D126 PolarHBondContact N-OD2 3.07Å; K48-D126 VanDerWaalsContact N-OD2 3.1Å; N124-D126 PolarHBondContact ND2-O 2.85Å; N124-D126 PolarHBondContact OD1-N 2.85Å; N124-D126 PolarHBondContact OD1-O 3.41Å; D126-R128 PolarHBondContact O-N 3.48Å
127	G	68.9	Low	87.1	Confident	89 Å²	89	55.8 Å²	55.8	92%	0.918	30%	0.3	S	S	*	.	S	Bend	trans	-64.7	9.5	-167.7	0	0	0	0	0	117.4
128	R	76.6	Confident	87.1	Confident	202 Å²	202	56.2 Å²	56.2	76%	0.762	30%	0.301	S	S	*	.	S	Bend	trans	-142.9	143	171.5	-62.9	-178.3	-179.6	175.6	-0.5	108.5	N124 D126 L130 Y133	N124-R128 PolarHBondContact ND2-O 2.93Å; N124-R128 VanDerWaalsContact ND2-O 3.15Å; D126-R128 PolarHBondContact O-N 3.48Å; R128-L130 HydrophobicContact CB-CD1 4.49Å; R128-L130 HydrophobicContact CB-CG 4.46Å; R128-L130 PolarHBondContact O-N 3.49Å; R128-Y133 PolarHBondContact O-OH 2.96Å
129	Y	78.9	Confident	87	Confident	160 Å²	160	56.1 Å²	56.1	63%	0.627	30%	0.301	S	S	*	.			trans	-84	109.8	174.5	-74.4	-99.5	0	0	0	109.7	N124 Y133	N124-Y129 HydrophobicContact CB-CD1 3.89Å; N124-Y129 HydrophobicContact CB-CE1 3.37Å; N124-Y129 HydrophobicContact CB-CE2 4.19Å; N124-Y129 WeakPolarHBondContact ND2-CD1 3.44Å; N124-Y129 VanDerWaalsContact ND2-CD2 3.31Å; N124-Y129 WeakPolarHBondContact ND2-CD2 3.45Å; N124-Y129 WeakPolarHBondContact ND2-CE2 3.47Å; N124-Y129 VanDerWaalsContact ND2-CG 3.3Å; Y129-Y133 WeakPolarHBondContact CA-OH 3.36Å; Y129-Y133 HydrophobicContact CD1-CD2 4.11Å; Y129-Y133 HydrophobicContact CD1-CE1 4.38Å; Y129-Y133 AromaticContact CD1-CE2 3.93Å; Y129-Y133 HydrophobicContact CD1-CE2 3.93Å; Y129-Y133 HydrophobicContact CD1-CG 4.41Å; Y129-Y133 HydrophobicContact CG-CE2 4.48Å
130	L	78.5	Confident	86.9	Confident	99 Å²	99	56.9 Å²	56.9	52%	0.518	31%	0.307	S	S	.	.			trans	-141.7	107.4	-179.9	-69.4	175.2	0	0	0	111.4	R21 R128 Y133	R21-L130 WeakPolarHBondContact CB-O 3.45Å; R21-L130 PolarHBondContact N-O 2.82Å; R128-L130 HydrophobicContact CB-CD1 4.49Å; R128-L130 HydrophobicContact CB-CG 4.46Å; R128-L130 PolarHBondContact O-N 3.49Å; L130-Y133 PolarHBondContact N-OH 3.45Å; L130-Y133 VanDerWaalsContact N-OH 3.13Å
131	G	83.7	Confident	86.8	Confident	40 Å²	40	57.7 Å²	57.7	41%	0.412	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	111.9	-164.5	-178.7	0	0	0	0	0	113.2	R21	R21-G131 CarbonylContact O-C 3.55Å; R21-G131 VanDerWaalsContact O-CA 3.23Å; R21-G131 WeakPolarHBondContact O-CA 3.49Å
132	S	88.8	Confident	86.7	Confident	56 Å²	56	55.4 Å²	55.4	39%	0.392	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	131.2	174.7	-164	0	0	0	0	111.6	R21 V23 S134	R21-S132 PolarHBondContact O-N 3.41Å; V23-S132 PolarHBondContact N-O 3.27Å; S132-S134 PolarHBondContact OG-O 3.4Å
133	Y	91.1	Very high	86.6	Confident	23 Å²	23	60.1 Å²	60.1	9%	0.09	34%	0.335	C	S	.	.			trans	-106.1	-4.8	179.5	-72.2	-94.7	0	0	0	113.6	R21 V23 Y121 T122 N124 R128 Y129 L130	R21-Y133 HydrophobicContact CG-CE1 4.49Å; V23-Y133 WeakPolarHBondContact CG2-O 3.31Å; Y121-Y133 WeakPolarHBondContact CD2-O 3.07Å; T122-Y133 PolarHBondContact N-O 2.88Å; T122-Y133 PolarHBondContact OG1-O 3.17Å; N124-Y133 HydrophobicContact CB-CD1 3.82Å; N124-Y133 HydrophobicContact CB-CE1 3.35Å; N124-Y133 PolarHBondContact ND2-OH 3.48Å; N124-Y133 WeakPolarHBondContact OD1-CE1 3.25Å; N124-Y133 PolarHBondContact OD1-OH 2.91Å; N124-Y133 VanDerWaalsContact OD1-OH 3.08Å; R128-Y133 PolarHBondContact O-OH 2.96Å; Y129-Y133 WeakPolarHBondContact CA-OH 3.36Å; Y129-Y133 HydrophobicContact CD1-CD2 4.11Å; Y129-Y133 HydrophobicContact CD1-CE1 4.38Å; Y129-Y133 AromaticContact CD1-CE2 3.93Å; Y129-Y133 HydrophobicContact CD1-CE2 3.93Å; Y129-Y133 HydrophobicContact CD1-CG 4.41Å; Y129-Y133 HydrophobicContact CG-CE2 4.48Å; L130-Y133 PolarHBondContact N-OH 3.45Å; L130-Y133 VanDerWaalsContact N-OH 3.13Å
134	S	92.9	Very high	86.8	Confident	33 Å²	33	61.1 Å²	61.1	23%	0.231	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	163.9	169.2	65.6	0	0	0	0	113.1	E119 C120 S132	E119-S134 WeakPolarHBondContact OE1-CB 3.33Å; E119-S134 PolarHBondContact OE1-OG 2.85Å; C120-S134 CarbonylContact O-C 3.6Å; C120-S134 WeakPolarHBondContact O-CA 3.39Å; C120-S134 VanDerWaalsContact O-CB 3.29Å; C120-S134 WeakPolarHBondContact O-CB 3.39Å; S132-S134 PolarHBondContact OG-O 3.4Å
135	A	94.9	Very high	87.2	Confident	17 Å²	17	60.8 Å²	60.8	14%	0.14	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	148.7	166.8	0	0	0	0	0	110	V23 V25 E119 C120	V23-A135 HydrophobicContact CB-CB 4.37Å; V23-A135 HydrophobicContact CG1-CB 3.95Å; V25-A135 HydrophobicContact CB-CB 3.95Å; V25-A135 HydrophobicContact CG1-CB 3.66Å; E119-A135 WeakPolarHBondContact CA-O 3.41Å; C120-A135 PolarHBondContact N-O 3.2Å; C120-A135 PolarHBondContact O-N 3.37Å
136	R	94.4	Very high	87.9	Confident	133 Å²	133	58 Å²	58	50%	0.502	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	140	-172.3	-64.9	-174.3	178.7	-159	-9.1	112.2	Y60 V117 F118 E119	Y60-R136 VanDerWaalsContact CZ-NH2 3.35Å; Y60-R136 PolarHBondContact OH-NH2 2.88Å; Y60-R136 VanDerWaalsContact OH-NH2 3.1Å; V117-R136 HydrophobicContact CG1-CB 3.86Å; V117-R136 HydrophobicContact CG1-CG 4.32Å; F118-R136 CarbonylContact O-C 3.59Å; F118-R136 VanDerWaalsContact O-CA 3.3Å; F118-R136 WeakPolarHBondContact O-CA 3.27Å; E119-R136 HydrophobicContact CB-CG 3.94Å; E119-R136 VanDerWaalsContact CD-NH2 3.34Å; E119-R136 HydrophobicContact CG-CG 3.99Å; E119-R136 IonicContact OE1-CZ 3.47Å; E119-R136 IonicContact OE1-NE 2.78Å; E119-R136 PolarHBondContact OE1-NE 2.84Å; E119-R136 IonicContact OE1-NH2 3.28Å; E119-R136 PolarHBondContact OE1-NH2 3.03Å; E119-R136 IonicContact OE2-CZ 3.38Å; E119-R136 IonicContact OE2-NE 3.34Å; E119-R136 PolarHBondContact OE2-NE 2.81Å; E119-R136 IonicContact OE2-NH2 2.73Å; E119-R136 PolarHBondContact OE2-NH2 2.92Å
137	T	94.3	Very high	88.9	Confident	6 Å²	6	59.1 Å²	59.1	4%	0.037	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	156.9	172.5	-168.1	0	0	0	0	111.2	V25 Q26 G28 I40 V117 F118	V25-T137 HydrophobicContact CG1-CG2 4.37Å; V25-T137 HydrophobicContact CG2-CG2 3.87Å; Q26-T137 WeakPolarHBondContact O-CB 3.46Å; Q26-T137 PolarHBondContact O-OG1 2.86Å; G28-T137 VanDerWaalsContact CA-OG1 3.32Å; G28-T137 WeakPolarHBondContact CA-OG1 2.98Å; G28-T137 PolarHBondContact N-OG1 3.15Å; G28-T137 VanDerWaalsContact N-OG1 3.13Å; I40-T137 HydrophobicContact CD1-CG2 4.47Å; I40-T137 HydrophobicContact CG2-CG2 3.73Å; V117-T137 CarbonylContact C-O 3.56Å; V117-T137 VanDerWaalsContact CA-O 3.29Å; V117-T137 WeakPolarHBondContact CA-O 3.36Å; F118-T137 HydrophobicContact CB-CG2 4.33Å; F118-T137 PolarHBondContact N-O 3.27Å; F118-T137 PolarHBondContact O-N 3.12Å
138	N	94.1	Very high	90.2	Very high	61 Å²	61	55.6 Å²	55.6	33%	0.326	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	122	-177.5	-175.9	12.3	0	0	0	110.1	P29 L30 G116	P29-N138 CarbonylContact C-O 3.52Å; P29-N138 WeakPolarHBondContact CA-O 3.5Å; P29-N138 HydrophobicContact CB-CB 4.38Å; L30-N138 PolarHBondContact N-O 2.98Å; G116-N138 PolarHBondContact O-OD1 2.59Å
139	L	93.5	Very high	91	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	116.6	173	177.5	62.5	0	0	0	109.2	L30 R32 V38 I40 I107 V110 Q115 G116 F118 V141	L30-L139 HydrophobicContact CB-CD1 4.36Å; R32-L139 HydrophobicContact CB-CD1 4.14Å; R32-L139 HydrophobicContact CG-CD1 3.6Å; V38-L139 HydrophobicContact CG1-CD1 4.09Å; I40-L139 HydrophobicContact CD1-CD2 4.46Å; I107-L139 HydrophobicContact CD1-CD2 4.18Å; V110-L139 HydrophobicContact CG2-CD2 4.06Å; Q115-L139 VanDerWaalsContact CA-O 3.31Å; Q115-L139 WeakPolarHBondContact CA-O 3.14Å; Q115-L139 WeakPolarHBondContact CG-O 3.43Å; G116-L139 PolarHBondContact N-O 2.94Å; G116-L139 VanDerWaalsContact N-O 3.1Å; G116-L139 PolarHBondContact O-N 2.88Å; F118-L139 HydrophobicContact CD2-CB 3.82Å; F118-L139 HydrophobicContact CD2-CD2 4.4Å; F118-L139 HydrophobicContact CE2-CB 3.67Å; F118-L139 HydrophobicContact CE2-CD2 3.61Å; F118-L139 HydrophobicContact CE2-CG 4.25Å; F118-L139 HydrophobicContact CZ-CD2 3.92Å; L139-V141 HydrophobicContact CG-CG2 4.33Å
140	T	92.8	Very high	91.6	Very high	33 Å²	33	42.8 Å²	42.8	20%	0.202	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.8	176.3	-59.5	0	0	0	0	109.4	L30 V31 R32 I142	L30-T140 PolarHBondContact O-N 3.05Å; V31-T140 WeakPolarHBondContact CA-O 3.39Å; V31-T140 HydrophobicContact CG1-CG2 4.47Å; R32-T140 PolarHBondContact N-O 2.97Å; T140-I142 HydrophobicContact CG2-CG2 4.49Å
141	V	92.8	Very high	92.1	Very high	17 Å²	17	41.8 Å²	41.8	10%	0.103	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	118.8	-176.4	-173.5	0	0	0	0	109.7	R32 E34 V110 Q115 L139	R32-V141 WeakPolarHBondContact O-CA 3.3Å; E34-V141 HydrophobicContact CB-CG1 4.02Å; V110-V141 HydrophobicContact CG1-CG1 4.41Å; V110-V141 HydrophobicContact CG2-CG1 4.45Å; V110-V141 HydrophobicContact CG2-CG2 3.68Å; Q115-V141 HydrophobicContact CB-CB 4.34Å; Q115-V141 HydrophobicContact CB-CG2 4.05Å; L139-V141 HydrophobicContact CG-CG2 4.33Å
142	I	92.3	Very high	92.3	Very high	29 Å²	29	44 Å²	44	15%	0.149	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	152	179.3	58	166.6	0	0	0	111	V31 R32 T33 E34 T140 T173 M265	V31-I142 HydrophobicContact CG1-CB 4.45Å; V31-I142 HydrophobicContact CG1-CD1 3.83Å; V31-I142 HydrophobicContact CG1-CG1 3.89Å; V31-I142 HydrophobicContact CG1-CG2 3.73Å; R32-I142 WeakPolarHBondContact O-CG1 3.15Å; R32-I142 PolarHBondContact O-N 3.01Å; T33-I142 CarbonylContact C-O 3.59Å; T33-I142 VanDerWaalsContact CA-O 3.3Å; T33-I142 WeakPolarHBondContact CA-O 3.49Å; T33-I142 HydrophobicContact CG2-CD1 3.96Å; T33-I142 HydrophobicContact CG2-CG1 3.85Å; E34-I142 PolarHBondContact N-O 2.96Å; T140-I142 HydrophobicContact CG2-CG2 4.49Å; I142-T173 HydrophobicContact CD1-CG2 3.82Å; I142-M265 HydrophobicContact CD1-CE 4.26Å; I142-M265 HydrophobicContact CD1-SD 4.26Å
143	P	91	Very high	92.3	Very high	100 Å²	100	45.2 Å²	45.2	65%	0.649	26%	0.258	S	S	*	.			trans	-65.4	144.2	174.6	27.5	-35.1	0	0	0	111.4	S145	P143-S145 PolarHBondContact O-N 3.36Å
144	D	90.3	Very high	92.2	Very high	61 Å²	61	48.7 Å²	48.7	33%	0.326	28%	0.281	S	S	.	.			trans	-70.6	109.9	172	172.8	5.9	0	0	0	110.6	L146 T266 K268	D144-L146 PolarHBondContact OD1-N 2.9Å; D144-L146 VanDerWaalsContact OD1-N 3.07Å; D144-T266 WeakPolarHBondContact OD1-CG2 3.38Å; D144-K268 IonicContact OD1-NZ 3.58Å; D144-K268 PolarHBondContact OD1-NZ 2.83Å; D144-K268 WeakPolarHBondContact OD2-CE 3.46Å; D144-K268 IonicContact OD2-NZ 3.15Å; D144-K268 PolarHBondContact OD2-NZ 3.14Å
145	S	90.8	Very high	92	Very high	22 Å²	22	49 Å²	49	15%	0.154	28%	0.28	C	S	.	.			trans	-100.7	-4	-179.4	83.8	0	0	0	0	114.9	P143 T172 T173	P143-S145 PolarHBondContact O-N 3.36Å; S145-T172 WeakPolarHBondContact CB-OG1 3.31Å; S145-T172 PolarHBondContact OG-N 2.82Å; S145-T173 PolarHBondContact OG-N 3.15Å; S145-T173 PolarHBondContact OG-OG1 3.34Å
146	L	93.3	Very high	91.6	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	30%	0.296	C	S	.	.			trans	-73.5	136.5	-171.9	-178	65.4	0	0	0	110.5	D144 V148 V169 S170 R171 L179 A251 E253 T266 K268	D144-L146 PolarHBondContact OD1-N 2.9Å; D144-L146 VanDerWaalsContact OD1-N 3.07Å; L146-V148 HydrophobicContact CG-CG2 4.41Å; L146-V169 HydrophobicContact CD1-CG1 4.03Å; L146-S170 CarbonylContact C-O 3.56Å; L146-R171 HydrophobicContact CD1-CB 4.45Å; L146-L179 HydrophobicContact CD1-CD1 3.96Å; L146-A251 HydrophobicContact CD1-CB 4.49Å; L146-E253 HydrophobicContact CD2-CB 4.32Å; L146-T266 HydrophobicContact CB-CG2 4.02Å; L146-T266 HydrophobicContact CD2-CG2 3.89Å; L146-K268 HydrophobicContact CB-CD 4.17Å; L146-K268 HydrophobicContact CD2-CB 4.22Å; L146-K268 HydrophobicContact CD2-CD 4.46Å; L146-K268 HydrophobicContact CG-CD 4.24Å; L146-K268 WeakPolarHBondContact O-CD 3.28Å; L146-K268 WeakPolarHBondContact O-CE 3.17Å; L146-K268 PolarHBondContact O-NZ 2.99Å
147	T	93	Very high	91.1	Very high	59 Å²	59	48 Å²	48	36%	0.362	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	142	174.5	53.7	0	0	0	0	109.5	V169 S170	T147-V169 VanDerWaalsContact O-CA 3.32Å; T147-V169 WeakPolarHBondContact O-CA 3.45Å; T147-S170 PolarHBondContact N-O 2.9Å; T147-S170 PolarHBondContact O-N 3.42Å; T147-S170 PolarHBondContact OG1-N 3.47Å; T147-S170 PolarHBondContact OG1-O 3.29Å; T147-S170 PolarHBondContact OG1-OG 2.97Å
148	V	96.1	Very high	90.5	Very high	15 Å²	15	49.6 Å²	49.6	9%	0.091	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	106.2	179	-177.3	0	0	0	0	108.1	L146 E168 V169 A251 K268	L146-V148 HydrophobicContact CG-CG2 4.41Å; V148-E168 WeakPolarHBondContact CA-O 3.49Å; V148-V169 HydrophobicContact CG1-CG2 4.41Å; V148-V169 HydrophobicContact CG2-CG1 4.35Å; V148-V169 HydrophobicContact CG2-CG2 4.43Å; V148-A251 HydrophobicContact CG2-CB 3.49Å; V148-A251 VanDerWaalsContact CG2-CB 3.49Å; V148-K268 HydrophobicContact CB-CB 4.1Å; V148-K268 HydrophobicContact CG2-CB 3.59Å
149	T	93.3	Very high	89.8	Confident	81 Å²	81	50.7 Å²	50.7	50%	0.497	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	122.3	-173.4	32.4	0	0	0	0	111	E168	T149-E168 PolarHBondContact N-O 3.21Å; T149-E168 PolarHBondContact O-N 3Å
150	A	92.1	Very high	89.1	Confident	11 Å²	11	52.6 Å²	52.6	9%	0.091	32%	0.317	C	S	.	.			trans	-134.5	136.2	165.9	0	0	0	0	0	107.2	N166 C167 W183	A150-N166 WeakPolarHBondContact CB-O 3.49Å; A150-C167 HydrophobicContact CB-CB 4.34Å; A150-W183 HydrophobicContact CB-CH2 4.45Å
151	P	88.1	Confident	88.7	Confident	78 Å²	78	53.7 Å²	53.7	51%	0.506	32%	0.322	S	S	.	.			trans	-67.6	130.6	-178.3	26.7	-33.6	0	0	0	110.5	T273	P151-T273 PolarHBondContact O-OG1 2.92Å
152	P	88.9	Confident	88.5	Confident	87 Å²	87	55.6 Å²	55.6	57%	0.565	33%	0.334	S	S	*	.			trans	-66.9	133.5	172	26.1	-31.1	0	0	0	110.2	E271	P152-E271 HydrophobicContact CB-CB 4.05Å; P152-E271 HydrophobicContact CG-CB 4.16Å
153	Q	87.8	Confident	88.5	Confident	81 Å²	81	54.4 Å²	54.4	38%	0.379	33%	0.328	S	S	.	.			trans	-138.9	155.1	179.8	-61.2	-179.3	15.8	0	0	110.4	L155 T273 Q274	Q153-L155 HydrophobicContact CB-CD2 4.35Å; Q153-L155 HydrophobicContact CB-CG 4.16Å; Q153-T273 HydrophobicContact CB-CG2 4.07Å; Q153-T273 CarbonylContact O-C 3.55Å; Q153-T273 VanDerWaalsContact O-CA 3.31Å; Q153-T273 WeakPolarHBondContact O-CA 3.45Å; Q153-Q274 PolarHBondContact O-N 2.88Å
154	T	89.2	Confident	88.7	Confident	96 Å²	96	54.9 Å²	54.9	59%	0.589	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	107.2	168	-59.9	0	0	0	0	108.1	Q274	T154-Q274 CarbonylContact C-O 3.46Å; T154-Q274 WeakPolarHBondContact CA-O 3.25Å; T154-Q274 HydrophobicContact CG2-CB 4.36Å; T154-Q274 HydrophobicContact CG2-CG 4.48Å
155	L	88.9	Confident	88.8	Confident	39 Å²	39	52.3 Å²	52.3	20%	0.204	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	126.3	-172.5	-62.6	177.3	0	0	0	110	Q153 L163 L165 T273 Q274 L275 R276	Q153-L155 HydrophobicContact CB-CD2 4.35Å; Q153-L155 HydrophobicContact CB-CG 4.16Å; L155-L163 HydrophobicContact CD1-CD1 3.57Å; L155-L165 HydrophobicContact CD1-CD2 4.01Å; L155-T273 HydrophobicContact CD1-CG2 3.97Å; L155-T273 HydrophobicContact CG-CG2 4.29Å; L155-Q274 PolarHBondContact N-O 3.34Å; L155-L275 HydrophobicContact CB-CD1 3.94Å; L155-L275 CarbonylContact O-C 3.59Å; L155-R276 PolarHBondContact O-N 2.94Å
156	S	86.1	Confident	89	Confident	69 Å²	69	55.5 Å²	55.5	48%	0.483	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	128.7	164.4	-169.1	0	0	0	0	108.6	R276 Q278	S156-R276 WeakPolarHBondContact CA-O 3.27Å; S156-Q278 PolarHBondContact OG-NE2 2.91Å
157	K	84.3	Confident	89.1	Confident	61 Å²	61	55.4 Å²	55.4	27%	0.265	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	163.6	-179.5	-74.9	-74	-178.5	164	0	110.3	D161 T162 L239 L275 R276 I277 Q278	K157-D161 HydrophobicContact CB-CB 4.19Å; K157-D161 HydrophobicContact CD-CB 3.85Å; K157-D161 WeakPolarHBondContact CD-OD2 3.48Å; K157-T162 PolarHBondContact NZ-O 3.03Å; K157-L239 HydrophobicContact CB-CD1 3.5Å; K157-L239 HydrophobicContact CD-CD1 4.38Å; K157-L239 HydrophobicContact CG-CD1 3.75Å; K157-L275 HydrophobicContact CB-CD1 4.35Å; K157-L275 HydrophobicContact CG-CD1 4.04Å; K157-R276 PolarHBondContact N-O 3.34Å; K157-I277 CarbonylContact O-C 3.58Å; K157-I277 WeakPolarHBondContact O-CA 3.11Å; K157-Q278 PolarHBondContact O-N 3.1Å
158	V	81.4	Confident	89.2	Confident	39 Å²	39	57.7 Å²	57.7	24%	0.236	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	152	174.5	-179.2	0	0	0	0	108.9	G160 D161 Q278 T280	V158-G160 PolarHBondContact O-N 3.11Å; V158-D161 PolarHBondContact N-OD2 2.96Å; V158-D161 VanDerWaalsContact O-CB 3.27Å; V158-D161 WeakPolarHBondContact O-CB 3.35Å; V158-D161 PolarHBondContact O-N 3.41Å; V158-D161 VanDerWaalsContact O-N 3.1Å; V158-Q278 WeakPolarHBondContact CA-O 3.49Å; V158-T280 HydrophobicContact CG1-CG2 4.34Å; V158-T280 WeakPolarHBondContact CG1-OG1 3.23Å
159	E	81	Confident	89.1	Confident	84 Å²	84	57.2 Å²	57.2	39%	0.393	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	130.3	172.3	-173.6	170.6	-156.8	0	0	111	P241 I277 Q278	E159-P241 WeakPolarHBondContact OE1-CD 2.95Å; E159-I277 HydrophobicContact CB-CG2 4.26Å; E159-Q278 PolarHBondContact N-O 2.81Å
160	G	78.6	Confident	89.1	Confident	40 Å²	40	55.8 Å²	55.8	41%	0.412	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.2	-15.4	-173.5	0	0	0	0	0	115.7	V158 K238 L239	V158-G160 PolarHBondContact O-N 3.11Å; G160-K238 WeakPolarHBondContact O-CA 3.41Å; G160-L239 PolarHBondContact N-O 2.93Å
161	D	84.4	Confident	89	Confident	57 Å²	57	59.6 Å²	59.6	31%	0.305	33%	0.332	S	S	.	.			trans	-56.6	163.9	177.9	-99.8	-38.1	0	0	0	113.6	K157 V158 K238 L239	K157-D161 HydrophobicContact CB-CB 4.19Å; K157-D161 HydrophobicContact CD-CB 3.85Å; K157-D161 WeakPolarHBondContact CD-OD2 3.48Å; V158-D161 PolarHBondContact N-OD2 2.96Å; V158-D161 VanDerWaalsContact O-CB 3.27Å; V158-D161 WeakPolarHBondContact O-CB 3.35Å; V158-D161 PolarHBondContact O-N 3.41Å; V158-D161 VanDerWaalsContact O-N 3.1Å; D161-K238 PolarHBondContact O-N 2.87Å; D161-L239 HydrophobicContact CB-CB 4.49Å; D161-L239 HydrophobicContact CB-CD1 3.94Å; D161-L239 HydrophobicContact CB-CG 4.49Å; D161-L239 WeakPolarHBondContact O-CB 3.47Å; D161-L239 WeakPolarHBondContact O-CG 3.32Å; D161-L239 PolarHBondContact O-N 2.64Å
162	T	87.4	Confident	89	Confident	57 Å²	57	61.4 Å²	61.4	35%	0.35	34%	0.341	S	S	.	.			trans	-98.5	137.7	162.4	-65.6	0	0	0	0	111.4	K157 Q164 T235 I236 H237	K157-T162 PolarHBondContact NZ-O 3.03Å; T162-Q164 HydrophobicContact CG2-CG 4.43Å; T162-T235 HydrophobicContact CG2-CG2 4.04Å; T162-I236 CarbonylContact C-O 3.52Å; T162-I236 WeakPolarHBondContact CA-O 3.5Å; T162-H237 VanDerWaalsContact CG2-ND1 3.35Å; T162-H237 WeakPolarHBondContact CG2-ND1 3.5Å; T162-H237 PolarHBondContact OG1-ND1 2.65Å
163	L	93.1	Very high	89	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.016	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	140.8	169.7	178.5	63.6	0	0	0	110.5	L155 L165 T235 I236 L239 L247 L275	L155-L163 HydrophobicContact CD1-CD1 3.57Å; L163-L165 HydrophobicContact CD1-CD2 4.16Å; L163-L165 HydrophobicContact CD1-CG 4.13Å; L163-L165 HydrophobicContact CD2-CD1 4.22Å; L163-L165 HydrophobicContact CD2-CG 4.39Å; L163-L165 HydrophobicContact CG-CG 4.2Å; L163-T235 WeakPolarHBondContact O-CA 3.22Å; L163-I236 HydrophobicContact CB-CB 4.36Å; L163-I236 HydrophobicContact CD2-CD1 4.31Å; L163-I236 PolarHBondContact N-O 2.78Å; L163-I236 PolarHBondContact O-N 3.28Å; L163-L239 HydrophobicContact CB-CD1 4.12Å; L163-L239 HydrophobicContact CB-CD2 3.99Å; L163-L239 HydrophobicContact CB-CG 4.24Å; L163-L239 HydrophobicContact CD2-CD2 4.39Å; L163-L247 HydrophobicContact CD2-CD1 3.59Å; L163-L275 HydrophobicContact CD1-CD1 4.38Å; L163-L275 HydrophobicContact CD2-CD1 4.27Å; L163-L275 HydrophobicContact CD2-CD2 3.91Å
164	Q	93.8	Very high	88.8	Confident	110 Å²	110	63.3 Å²	63.3	51%	0.514	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	134.8	167.5	-69	-176.5	-9.4	0	0	109.5	T162 L234 T235	T162-Q164 HydrophobicContact CG2-CG 4.43Å; Q164-L234 VanDerWaalsContact CA-O 3.31Å; Q164-L234 WeakPolarHBondContact CA-O 3.32Å; Q164-T235 HydrophobicContact CG-CG2 3.89Å
165	L	94.2	Very high	88.7	Confident	8 Å²	8	62.6 Å²	62.6	4%	0.042	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	136.8	176.2	-63.7	176.8	0	0	0	109.8	L155 L163 W183 R233 L234 L247 T273	L155-L165 HydrophobicContact CD1-CD2 4.01Å; L163-L165 HydrophobicContact CD1-CD2 4.16Å; L163-L165 HydrophobicContact CD1-CG 4.13Å; L163-L165 HydrophobicContact CD2-CD1 4.22Å; L163-L165 HydrophobicContact CD2-CG 4.39Å; L163-L165 HydrophobicContact CG-CG 4.2Å; L165-W183 HydrophobicContact CB-CH2 3.57Å; L165-W183 HydrophobicContact CB-CZ2 4.19Å; L165-W183 HydrophobicContact CB-CZ3 3.92Å; L165-W183 HydrophobicContact CD1-CZ3 4.02Å; L165-R233 CarbonylContact O-C 3.6Å; L165-R233 WeakPolarHBondContact O-CA 3.49Å; L165-L234 HydrophobicContact CB-CB 4.46Å; L165-L234 HydrophobicContact CD1-CD2 4.45Å; L165-L234 PolarHBondContact N-O 2.55Å; L165-L234 PolarHBondContact O-N 2.74Å; L165-L247 HydrophobicContact CD1-CB 3.93Å; L165-L247 HydrophobicContact CD1-CD1 3.86Å; L165-T273 HydrophobicContact CD1-CG2 4.15Å; L165-T273 HydrophobicContact CD2-CG2 4Å
166	N	93.6	Very high	88.8	Confident	88 Å²	88	69.3 Å²	69.3	47%	0.471	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	142.9	179.2	-64.2	-24.1	0	0	0	110.7	A150 R233	A150-N166 WeakPolarHBondContact CB-O 3.49Å; N166-R233 WeakPolarHBondContact OD1-CB 3.42Å; N166-R233 VanDerWaalsContact OD1-CG 3.32Å; N166-R233 WeakPolarHBondContact OD1-CG 3.12Å
167	C	95.1	Very high	89	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	130.7	173.2	173.8	0	0	0	0	109.1	A150 W183 S231 Y232 C249	A150-C167 HydrophobicContact CB-CB 4.34Å; C167-W183 HydrophobicContact CB-CH2 3.97Å; C167-W183 HydrophobicContact CB-CZ2 3.42Å; C167-W183 VanDerWaalsContact CB-CZ2 3.42Å; C167-S231 WeakPolarHBondContact O-CA 3.33Å; C167-Y232 PolarHBondContact N-O 3.08Å; C167-Y232 PolarHBondContact O-N 3.22Å; C167-C249 HydrophobicContact CB-CB 3.45Å; C167-C249 VanDerWaalsContact CB-CB 3.45Å; C167-C249 WeakPolarHBondContact CB-SG 3.39Å; C167-C249 WeakPolarHBondContact SG-CB 3.41Å; C167-C249 CovalentContact SG-SG 2.03Å; C167-C249 PolarHBondContact SG-SG 3.13Å
168	E	95.4	Very high	89.4	Confident	108 Å²	108	67 Å²	67	51%	0.505	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	131.7	172.3	-63.5	-173.9	153	0	0	109.5	V148 T149 T230	V148-E168 WeakPolarHBondContact CA-O 3.49Å; T149-E168 PolarHBondContact N-O 3.21Å; T149-E168 PolarHBondContact O-N 3Å; E168-T230 WeakPolarHBondContact CA-O 3.21Å
169	V	95.2	Very high	89.9	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.024	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	118.5	178.6	-176.1	0	0	0	0	108.3	L146 T147 V148 L179 V181 T230 Y232 A251	L146-V169 HydrophobicContact CD1-CG1 4.03Å; T147-V169 VanDerWaalsContact O-CA 3.32Å; T147-V169 WeakPolarHBondContact O-CA 3.45Å; V148-V169 HydrophobicContact CG1-CG2 4.41Å; V148-V169 HydrophobicContact CG2-CG1 4.35Å; V148-V169 HydrophobicContact CG2-CG2 4.43Å; V169-L179 HydrophobicContact CG1-CD1 3.99Å; V169-L179 HydrophobicContact CG1-CD2 3.82Å; V169-L179 HydrophobicContact CG1-CG 4.41Å; V169-V181 HydrophobicContact CB-CG2 4.29Å; V169-V181 HydrophobicContact CG1-CG2 4.17Å; V169-V181 HydrophobicContact CG2-CG1 3.92Å; V169-V181 HydrophobicContact CG2-CG2 4.01Å; V169-T230 PolarHBondContact N-O 2.64Å; V169-T230 VanDerWaalsContact O-CA 3.29Å; V169-T230 WeakPolarHBondContact O-CA 3.31Å; V169-T230 VanDerWaalsContact O-CB 3.23Å; V169-T230 WeakPolarHBondContact O-CB 3.27Å; V169-T230 WeakPolarHBondContact O-CG2 3.29Å; V169-Y232 HydrophobicContact CB-CD2 4.28Å; V169-Y232 HydrophobicContact CB-CE2 4.13Å; V169-Y232 HydrophobicContact CG2-CD2 4.17Å; V169-Y232 HydrophobicContact CG2-CE2 4.43Å; V169-A251 HydrophobicContact CB-CB 4.46Å; V169-A251 HydrophobicContact CG1-CB 3.52Å; V169-A251 HydrophobicContact CG2-CB 4.05Å
170	S	92.3	Very high	90.6	Very high	51 Å²	51	63 Å²	63	36%	0.357	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	159.5	176.8	90.2	0	0	0	0	111.9	L146 T147	L146-S170 CarbonylContact C-O 3.56Å; T147-S170 PolarHBondContact N-O 2.9Å; T147-S170 PolarHBondContact O-N 3.42Å; T147-S170 PolarHBondContact OG1-N 3.47Å; T147-S170 PolarHBondContact OG1-O 3.29Å; T147-S170 PolarHBondContact OG1-OG 2.97Å
171	R	90.6	Very high	91.4	Very high	92 Å²	92	61.1 Å²	61.1	35%	0.347	31%	0.311	S	S	.	.			trans	-153.5	149.8	-177.5	64.4	-172.4	-172.5	163.1	11	108.9	L146 T177 H178 E253	L146-R171 HydrophobicContact CD1-CB 4.45Å; R171-T177 VanDerWaalsContact CZ-O 3.28Å; R171-T177 VanDerWaalsContact NH1-C 3.28Å; R171-T177 PolarHBondContact NH1-O 3.46Å; R171-T177 PolarHBondContact NH1-OG1 3.02Å; R171-T177 PolarHBondContact NH2-O 2.83Å; R171-H178 VanDerWaalsContact NH1-C 3.32Å; R171-H178 PolarHBondContact NH1-O 3.09Å; R171-E253 WeakPolarHBondContact CD-OE1 3.45Å; R171-E253 IonicContact NH1-OE1 3.76Å
172	T	88.3	Confident	91.9	Very high	115 Å²	115	58.4 Å²	58.4	71%	0.706	30%	0.297	S	S	*	.			trans	-126.6	19.3	175.2	57.3	0	0	0	0	112.5	S145 M174	S145-T172 WeakPolarHBondContact CB-OG1 3.31Å; S145-T172 PolarHBondContact OG-N 2.82Å; T172-M174 PolarHBondContact O-N 3.47Å
173	T	88.3	Confident	92.3	Very high	24 Å²	24	55.9 Å²	55.9	15%	0.147	28%	0.281	C	S	.	.			trans	-56.7	125.4	176.7	-55	0	0	0	0	111.6	I142 S145 Q175 T177 E253 M265	I142-T173 HydrophobicContact CD1-CG2 3.82Å; S145-T173 PolarHBondContact OG-N 3.15Å; S145-T173 PolarHBondContact OG-OG1 3.34Å; T173-Q175 VanDerWaalsContact C-N 3.28Å; T173-Q175 HydrophobicContact CG2-CB 4.13Å; T173-Q175 PolarHBondContact O-N 3.39Å; T173-T177 HydrophobicContact CG2-CG2 3.79Å; T173-E253 WeakPolarHBondContact CB-OE1 3.16Å; T173-E253 PolarHBondContact OG1-OE1 2.91Å; T173-E253 PolarHBondContact OG1-OE2 3Å; T173-E253 VanDerWaalsContact OG1-OE2 3.05Å; T173-M265 HydrophobicContact CG2-CE 4.19Å
174	M	84.4	Confident	92.3	Very high	184 Å²	184	57 Å²	57	91%	0.906	29%	0.285	S	S	*	.	S	Bend	trans	-78.7	-5.9	-177.5	-64.7	-64.4	-67.7	0	0	114.5	T172	T172-M174 PolarHBondContact O-N 3.47Å
175	Q	87.4	Confident	92.3	Very high	81 Å²	81	52.2 Å²	52.2	38%	0.379	26%	0.263	S	S	.	.	S	Bend	trans	-91.1	159.6	178.3	-62.8	-63.3	-15.8	0	0	111.6	V31 T173 T177 I255	V31-Q175 HydrophobicContact CG1-CG 4.13Å; T173-Q175 VanDerWaalsContact C-N 3.28Å; T173-Q175 HydrophobicContact CG2-CB 4.13Å; T173-Q175 PolarHBondContact O-N 3.39Å; Q175-T177 HydrophobicContact CB-CG2 4.14Å; Q175-T177 PolarHBondContact O-N 3.03Å; Q175-I255 HydrophobicContact CB-CD1 4.03Å; Q175-I255 HydrophobicContact CG-CD1 4.36Å
176	H	89.3	Confident	92.1	Very high	180 Å²	180	54.9 Å²	54.9	83%	0.833	27%	0.272	S	S	*	.			trans	-72.7	92.6	173.8	-70.6	-68.2	0	0	0	111.3
177	T	91.4	Very high	91.7	Very high	11 Å²	11	52.8 Å²	52.8	7%	0.067	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	151.4	-176.2	60.8	0	0	0	0	112.7	R171 T173 Q175 E253 W254 I255 M265	R171-T177 VanDerWaalsContact CZ-O 3.28Å; R171-T177 VanDerWaalsContact NH1-C 3.28Å; R171-T177 PolarHBondContact NH1-O 3.46Å; R171-T177 PolarHBondContact NH1-OG1 3.02Å; R171-T177 PolarHBondContact NH2-O 2.83Å; T173-T177 HydrophobicContact CG2-CG2 3.79Å; Q175-T177 HydrophobicContact CB-CG2 4.14Å; Q175-T177 PolarHBondContact O-N 3.03Å; T177-E253 VanDerWaalsContact CB-OE1 3.25Å; T177-E253 WeakPolarHBondContact CB-OE1 3.4Å; T177-E253 HydrophobicContact CG2-CG 4.2Å; T177-E253 WeakPolarHBondContact CG2-OE1 3.48Å; T177-E253 PolarHBondContact OG1-OE1 2.92Å; T177-W254 CarbonylContact C-O 3.56Å; T177-W254 WeakPolarHBondContact CA-O 3.24Å; T177-W254 VanDerWaalsContact CB-O 3.23Å; T177-W254 WeakPolarHBondContact CB-O 3.3Å; T177-I255 HydrophobicContact CG2-CB 4.4Å; T177-I255 HydrophobicContact CG2-CG1 4.42Å; T177-M265 HydrophobicContact CG2-CE 3.46Å; T177-M265 VanDerWaalsContact CG2-CE 3.46Å
178	H	92.6	Very high	90.9	Very high	70 Å²	70	56 Å²	56	32%	0.324	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	159	171.7	-77.3	-126.6	0	0	0	111.3	R171 R203 E253 W254 W262	R171-H178 VanDerWaalsContact NH1-C 3.32Å; R171-H178 PolarHBondContact NH1-O 3.09Å; H178-R203 HydrophobicContact CB-CB 3.98Å; H178-R203 PolarHBondContact ND1-O 2.88Å; H178-E253 WeakPolarHBondContact O-CA 3.49Å; H178-W254 HydrophobicContact CB-CB 4.39Å; H178-W254 PolarHBondContact N-O 2.79Å; H178-W254 PolarHBondContact O-N 3.11Å; H178-W262 HydrophobicContact CB-CH2 4.27Å; H178-W262 HydrophobicContact CB-CZ3 3.98Å; H178-W262 AromaticContact CD2-CH2 3.44Å; H178-W262 VanDerWaalsContact CD2-CH2 3.44Å; H178-W262 WeakPolarHBondContact CD2-CH2 3.43Å; H178-W262 AromaticContact CD2-CZ3 3.88Å; H178-W262 AromaticContact CG-CH2 3.74Å; H178-W262 AromaticContact CG-CZ3 3.96Å; H178-W262 AromaticContact NE2-CH2 3.83Å
179	L	92.7	Very high	90	Very high	26 Å²	26	58.7 Å²	58.7	14%	0.136	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.8	-177.2	-173.8	71.4	0	0	0	109.5	L146 V169 V181 A251	L146-L179 HydrophobicContact CD1-CD1 3.96Å; V169-L179 HydrophobicContact CG1-CD1 3.99Å; V169-L179 HydrophobicContact CG1-CD2 3.82Å; V169-L179 HydrophobicContact CG1-CG 4.41Å; L179-V181 HydrophobicContact CD2-CG2 3.92Å; L179-V181 HydrophobicContact CG-CG2 3.93Å; L179-A251 HydrophobicContact CD1-CB 4.28Å
180	S	94.8	Very high	89.2	Confident	13 Å²	13	63.3 Å²	63.3	9%	0.091	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.2	166.6	59.6	0	0	0	0	110	L201 A251 V252 W254	S180-L201 CarbonylContact C-O 3.54Å; S180-L201 WeakPolarHBondContact CA-O 3.48Å; S180-L201 VanDerWaalsContact CB-O 3.31Å; S180-L201 WeakPolarHBondContact CB-O 3.37Å; S180-A251 CarbonylContact O-C 3.45Å; S180-A251 VanDerWaalsContact O-CA 3.29Å; S180-A251 WeakPolarHBondContact O-CA 3.43Å; S180-V252 PolarHBondContact N-O 3.12Å; S180-V252 PolarHBondContact O-N 2.77Å; S180-W254 PolarHBondContact OG-NE1 2.84Å
181	V	95.8	Very high	88.2	Confident	1 Å²	1	64 Å²	64	1%	0.006	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.4	-177.1	-175.6	0	0	0	0	109.4	V169 L179 L201 Y232 Q250 A251	V169-V181 HydrophobicContact CB-CG2 4.29Å; V169-V181 HydrophobicContact CG1-CG2 4.17Å; V169-V181 HydrophobicContact CG2-CG1 3.92Å; V169-V181 HydrophobicContact CG2-CG2 4.01Å; L179-V181 HydrophobicContact CD2-CG2 3.92Å; L179-V181 HydrophobicContact CG-CG2 3.93Å; V181-L201 PolarHBondContact N-O 3.15Å; V181-L201 PolarHBondContact O-N 3.24Å; V181-Y232 HydrophobicContact CB-CD1 4.11Å; V181-Y232 HydrophobicContact CB-CD2 4.49Å; V181-Y232 HydrophobicContact CB-CE1 4.06Å; V181-Y232 HydrophobicContact CB-CE2 4.48Å; V181-Y232 HydrophobicContact CB-CG 4.32Å; V181-Y232 HydrophobicContact CG1-CD1 4.17Å; V181-Y232 HydrophobicContact CG1-CD2 4.15Å; V181-Y232 HydrophobicContact CG1-CG 3.94Å; V181-Y232 HydrophobicContact CG2-CD1 4.45Å; V181-Y232 HydrophobicContact CG2-CD2 4.24Å; V181-Y232 HydrophobicContact CG2-CE1 4.05Å; V181-Y232 HydrophobicContact CG2-CE2 3.84Å; V181-Q250 WeakPolarHBondContact CA-O 3.39Å; V181-A251 HydrophobicContact CG2-CB 4.06Å
182	G	94.5	Very high	87.5	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.01	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	158.1	-179	0	0	0	0	0	114.2	V199 C249 Q250	G182-V199 CarbonylContact C-O 3.42Å; G182-V199 WeakPolarHBondContact CA-O 3.43Å; G182-C249 CarbonylContact O-C 3.54Å; G182-Q250 PolarHBondContact N-O 2.91Å; G182-Q250 PolarHBondContact O-N 2.84Å
183	W	95.5	Very high	87.1	Confident	3 Å²	3	62.8 Å²	62.8	1%	0.011	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	137.9	179.5	-73.7	86.6	0	0	0	111.3	A150 L165 C167 L198 V199 L234 Y248 C249	A150-W183 HydrophobicContact CB-CH2 4.45Å; L165-W183 HydrophobicContact CB-CH2 3.57Å; L165-W183 HydrophobicContact CB-CZ2 4.19Å; L165-W183 HydrophobicContact CB-CZ3 3.92Å; L165-W183 HydrophobicContact CD1-CZ3 4.02Å; C167-W183 HydrophobicContact CB-CH2 3.97Å; C167-W183 HydrophobicContact CB-CZ2 3.42Å; C167-W183 VanDerWaalsContact CB-CZ2 3.42Å; W183-L198 HydrophobicContact CB-CB 4.47Å; W183-L198 PolarHBondContact O-N 2.67Å; W183-V199 HydrophobicContact CB-CG1 4.46Å; W183-V199 PolarHBondContact N-O 3.38Å; W183-L234 HydrophobicContact CB-CD1 4.31Å; W183-L234 HydrophobicContact CB-CD2 4.12Å; W183-L234 HydrophobicContact CD2-CB 3.78Å; W183-L234 HydrophobicContact CD2-CD2 3.83Å; W183-L234 HydrophobicContact CD2-CG 4.36Å; W183-L234 HydrophobicContact CE3-CB 4.42Å; W183-L234 HydrophobicContact CE3-CD2 3.85Å; W183-L234 HydrophobicContact CG-CB 3.92Å; W183-L234 HydrophobicContact CG-CD1 4.29Å; W183-L234 HydrophobicContact CG-CD2 3.97Å; W183-L234 HydrophobicContact CG-CG 4.29Å; W183-L234 HydrophobicContact CZ2-CB 4.1Å; W183-Y248 WeakPolarHBondContact CA-O 3.32Å; W183-C249 HydrophobicContact CD2-CB 4.2Å; W183-C249 HydrophobicContact CE3-CB 4.21Å; W183-C249 HydrophobicContact CH2-CB 4.14Å; W183-C249 HydrophobicContact CZ2-CB 4.13Å; W183-C249 HydrophobicContact CZ3-CB 4.17Å
184	Y	94.4	Very high	86.8	Confident	28 Å²	28	67.3 Å²	67.3	11%	0.11	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	140.7	-172.8	-65.1	-91.3	0	0	0	110.4	P195 Q196 E197 T200 L247 Y248 Q250	Y184-P195 HydrophobicContact CD1-CB 4.41Å; Y184-Q196 CarbonylContact C-O 3.52Å; Y184-Q196 WeakPolarHBondContact CA-O 3.39Å; Y184-E197 HydrophobicContact CD1-CB 3.96Å; Y184-E197 HydrophobicContact CD1-CG 4.27Å; Y184-E197 HydrophobicContact CE1-CB 3.63Å; Y184-E197 HydrophobicContact CE1-CG 3.67Å; Y184-E197 PolarHBondContact OH-OE2 3.07Å; Y184-E197 VanDerWaalsContact OH-OE2 3.11Å; Y184-T200 PolarHBondContact OH-OG1 2.81Å; Y184-L247 WeakPolarHBondContact O-CA 3.49Å; Y184-Y248 PolarHBondContact N-O 2.88Å; Y184-Y248 WeakPolarHBondContact O-CD1 3.41Å; Y184-Y248 PolarHBondContact O-N 3.48Å; Y184-Q250 HydrophobicContact CD2-CB 3.92Å; Y184-Q250 HydrophobicContact CE2-CB 3.86Å
185	L	92.7	Very high	87	Confident	9 Å²	9	61.1 Å²	61.1	5%	0.047	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	138	172.5	177.1	65.7	0	0	0	109	Q196 L198 V242 L246 L247	L185-Q196 HydrophobicContact CB-CB 4.45Å; L185-Q196 PolarHBondContact N-O 3.28Å; L185-Q196 PolarHBondContact O-N 3.42Å; L185-L198 HydrophobicContact CB-CD1 3.52Å; L185-V242 WeakPolarHBondContact CD2-O 3.47Å; L185-L246 WeakPolarHBondContact CA-O 3.25Å; L185-L247 HydrophobicContact CB-CD2 3.93Å; L185-L247 HydrophobicContact CD1-CD2 3.85Å; L185-L247 HydrophobicContact CD1-CG 3.97Å; L185-L247 HydrophobicContact CG-CD2 4.45Å
186	R	90.4	Very high	87.1	Confident	63 Å²	63	60.5 Å²	60.5	24%	0.238	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	141.9	170.7	-163.5	-179.5	-61	-145.8	2.9	110.1	A191 L246 Y248	R186-A191 PolarHBondContact NH1-O 3.45Å; R186-L246 HydrophobicContact CB-CB 4.49Å; R186-L246 PolarHBondContact N-O 2.95Å; R186-L246 PolarHBondContact O-N 2.03Å; R186-Y248 HydrophobicContact CB-CE1 4.31Å; R186-Y248 PolarHBondContact NH2-OH 3.03Å
187	S	83.9	Confident	87.2	Confident	44 Å²	44	54.8 Å²	54.8	31%	0.308	31%	0.312	S	S	.	.			trans	-59.3	134.9	167.7	171.9	0	0	0	0	109.7	E189 N190	S187-E189 PolarHBondContact O-N 2.81Å; S187-E189 PolarHBondContact OG-N 3.5Å; S187-E189 VanDerWaalsContact OG-N 3.14Å; S187-N190 PolarHBondContact OG-N 2.94Å
188	P	78.3	Confident	87.3	Confident	67 Å²	67	54.3 Å²	54.3	44%	0.435	31%	0.309	S	S	.	.	S	Bend	trans	-71.1	-17.5	172.4	29.5	-33.3	0	0	0	112.7	L246	P188-L246 HydrophobicContact CB-CD1 4.23Å; P188-L246 HydrophobicContact CB-CG 4.11Å
189	E	77.1	Confident	87.4	Confident	166 Å²	166	51 Å²	51	78%	0.776	29%	0.294	S	S	*	.	S	Bend	trans	-94	-45.1	-176	-67	162.6	-168.6	0	0	111.4	S187	S187-E189 PolarHBondContact O-N 2.81Å; S187-E189 PolarHBondContact OG-N 3.5Å; S187-E189 VanDerWaalsContact OG-N 3.14Å
190	N	77.9	Confident	87.5	Confident	101 Å²	101	50.3 Å²	50.3	54%	0.54	29%	0.291	S	S	.	.			trans	-103.3	77.2	-177.8	-75.4	-37.8	0	0	0	112	S187 T192 A193	S187-N190 PolarHBondContact OG-N 2.94Å; N190-T192 PolarHBondContact O-N 3.38Å; N190-A193 HydrophobicContact CB-CB 4.08Å; N190-A193 WeakPolarHBondContact O-CB 3.44Å; N190-A193 PolarHBondContact O-N 3.04Å; N190-A193 VanDerWaalsContact O-N 3.12Å
191	A	71.6	Confident	87.5	Confident	66 Å²	66	51.1 Å²	51.1	55%	0.545	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-23.7	-176.6	0	0	0	0	0	115.1	R186	R186-A191 PolarHBondContact NH1-O 3.45Å
192	T	77.1	Confident	87.3	Confident	141 Å²	141	51.7 Å²	51.7	87%	0.865	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-12.2	178.1	48.8	0	0	0	0	114.2	N190	N190-T192 PolarHBondContact O-N 3.38Å
193	A	80.1	Confident	87.1	Confident	40 Å²	40	55.3 Å²	55.3	33%	0.331	31%	0.312	S	S	.	.	S	Bend	trans	-66.5	145.5	176.3	0	0	0	0	0	110.9	N190	N190-A193 HydrophobicContact CB-CB 4.08Å; N190-A193 WeakPolarHBondContact O-CB 3.44Å; N190-A193 PolarHBondContact O-N 3.04Å; N190-A193 VanDerWaalsContact O-N 3.12Å
194	P	82.1	Confident	86.7	Confident	119 Å²	119	58.9 Å²	58.9	77%	0.773	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-60.7	134.4	176.3	25.8	-33.9	0	0	0	110.2	Q196	P194-Q196 PolarHBondContact O-N 2.86Å
195	P	86.9	Confident	86.3	Confident	53 Å²	53	64.4 Å²	64.4	34%	0.344	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-68.2	134.9	-178.3	28.5	-34.7	0	0	0	111	Y184 E197 Y248	Y184-P195 HydrophobicContact CD1-CB 4.41Å; P195-E197 PolarHBondContact O-N 3.06Å; P195-Y248 HydrophobicContact CB-CE1 4.4Å; P195-Y248 VanDerWaalsContact CB-OH 3.25Å; P195-Y248 WeakPolarHBondContact CB-OH 3.36Å; P195-Y248 WeakPolarHBondContact CG-OH 3.31Å
196	Q	89.4	Confident	86.2	Confident	69 Å²	69	67 Å²	67	32%	0.322	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	115.6	179.6	178.5	170.2	-29.9	0	0	109.6	Y184 L185 P194 P212 Y213	Y184-Q196 CarbonylContact C-O 3.52Å; Y184-Q196 WeakPolarHBondContact CA-O 3.39Å; L185-Q196 HydrophobicContact CB-CB 4.45Å; L185-Q196 PolarHBondContact N-O 3.28Å; L185-Q196 PolarHBondContact O-N 3.42Å; P194-Q196 PolarHBondContact O-N 2.86Å; Q196-P212 HydrophobicContact CG-CG 4.39Å; Q196-Y213 HydrophobicContact CG-CE2 4.3Å
197	E	92.3	Very high	86.2	Confident	60 Å²	60	67.6 Å²	67.6	28%	0.28	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	134.2	172.7	-169.5	165.1	145	0	0	110.6	Y184 P195 T200 G210	Y184-E197 HydrophobicContact CD1-CB 3.96Å; Y184-E197 HydrophobicContact CD1-CG 4.27Å; Y184-E197 HydrophobicContact CE1-CB 3.63Å; Y184-E197 HydrophobicContact CE1-CG 3.67Å; Y184-E197 PolarHBondContact OH-OE2 3.07Å; Y184-E197 VanDerWaalsContact OH-OE2 3.11Å; P195-E197 PolarHBondContact O-N 3.06Å; E197-T200 VanDerWaalsContact OE1-CB 3.24Å; E197-T200 WeakPolarHBondContact OE1-CB 3.38Å; E197-T200 PolarHBondContact OE1-OG1 3.02Å; E197-G210 WeakPolarHBondContact O-CA 3.23Å
198	L	93.6	Very high	86.6	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-64.2	169.4	-87.2	59.6	0	0	0	109	W183 L185 S209 G210 Y213 L222 L234 I236 L247	W183-L198 HydrophobicContact CB-CB 4.47Å; W183-L198 PolarHBondContact O-N 2.67Å; L185-L198 HydrophobicContact CB-CD1 3.52Å; L198-S209 WeakPolarHBondContact O-CA 3.49Å; L198-G210 PolarHBondContact O-N 3.11Å; L198-Y213 HydrophobicContact CB-CD2 4.24Å; L198-Y213 HydrophobicContact CB-CE2 4.42Å; L198-Y213 HydrophobicContact CD1-CD2 3.87Å; L198-Y213 HydrophobicContact CD1-CE2 3.31Å; L198-Y213 HydrophobicContact CD2-CE2 4.48Å; L198-Y213 HydrophobicContact CG-CD1 4.37Å; L198-Y213 HydrophobicContact CG-CD2 3.72Å; L198-Y213 HydrophobicContact CG-CE1 4.13Å; L198-Y213 HydrophobicContact CG-CE2 3.43Å; L198-Y213 VanDerWaalsContact CG-CE2 3.43Å; L198-Y213 HydrophobicContact CG-CG 4.19Å; L198-L222 HydrophobicContact CB-CD2 4.45Å; L198-L234 HydrophobicContact CD2-CD1 4.32Å; L198-L234 HydrophobicContact CD2-CD2 4.05Å; L198-I236 HydrophobicContact CD2-CD1 3.8Å; L198-L247 HydrophobicContact CD1-CD2 4.39Å; L198-L247 HydrophobicContact CD2-CD2 3.63Å
199	V	94.5	Very high	87.1	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	133.4	-172.9	50	0	0	0	0	110.7	G182 W183 L207 R208 M217 L222 L224 L234	G182-V199 CarbonylContact C-O 3.42Å; G182-V199 WeakPolarHBondContact CA-O 3.43Å; W183-V199 HydrophobicContact CB-CG1 4.46Å; W183-V199 PolarHBondContact N-O 3.38Å; V199-L207 HydrophobicContact CG2-CD1 3.6Å; V199-L207 HydrophobicContact CG2-CD2 4.2Å; V199-L207 HydrophobicContact CG2-CG 3.9Å; V199-R208 CarbonylContact C-O 3.56Å; V199-R208 VanDerWaalsContact CA-O 3.3Å; V199-R208 WeakPolarHBondContact CA-O 3.47Å; V199-M217 HydrophobicContact CB-CE 3.64Å; V199-M217 HydrophobicContact CG2-CE 3.34Å; V199-L222 HydrophobicContact CB-CD2 4.2Å; V199-L222 HydrophobicContact CG1-CD1 4.12Å; V199-L222 HydrophobicContact CG1-CD2 4.33Å; V199-L222 HydrophobicContact CG1-CG 4.33Å; V199-L224 HydrophobicContact CB-CB 4.4Å; V199-L224 HydrophobicContact CG1-CB 3.9Å; V199-L224 HydrophobicContact CG1-CD2 4.4Å; V199-L224 HydrophobicContact CG2-CB 3.54Å; V199-L224 HydrophobicContact CG2-CD2 3.89Å; V199-L224 HydrophobicContact CG2-CG 4.37Å; V199-L234 HydrophobicContact CG1-CD1 3.72Å
200	T	94.9	Very high	87.4	Confident	13 Å²	13	62.1 Å²	62.1	8%	0.08	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	129.6	178.2	-56.7	0	0	0	0	110.9	Y184 E197 R208	Y184-T200 PolarHBondContact OH-OG1 2.81Å; E197-T200 VanDerWaalsContact OE1-CB 3.24Å; E197-T200 WeakPolarHBondContact OE1-CB 3.38Å; E197-T200 PolarHBondContact OE1-OG1 3.02Å; T200-R208 PolarHBondContact N-O 3.33Å; T200-R208 PolarHBondContact O-N 3.4Å
201	L	94.6	Very high	87.6	Confident	29 Å²	29	59.3 Å²	59.3	15%	0.152	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	112.5	159.8	-173.2	72.2	0	0	0	107.9	S180 V181 F205 L207 L224 Y232	S180-L201 CarbonylContact C-O 3.54Å; S180-L201 WeakPolarHBondContact CA-O 3.48Å; S180-L201 VanDerWaalsContact CB-O 3.31Å; S180-L201 WeakPolarHBondContact CB-O 3.37Å; V181-L201 PolarHBondContact N-O 3.15Å; V181-L201 PolarHBondContact O-N 3.24Å; L201-F205 VanDerWaalsContact CD1-O 3.25Å; L201-F205 WeakPolarHBondContact CD1-O 3.49Å; L201-L207 HydrophobicContact CB-CD1 4.3Å; L201-L207 HydrophobicContact CD1-CD1 4.29Å; L201-L224 HydrophobicContact CB-CD2 4.34Å; L201-Y232 HydrophobicContact CD2-CE1 3.85Å
202	S	91.9	Very high	88.1	Confident	13 Å²	13	60.3 Å²	60.3	9%	0.091	34%	0.339	C	S	.	.			trans	-82.7	168.1	-177.9	49.2	0	0	0	0	112.7	D204 F205 V206 R208	S202-D204 WeakPolarHBondContact CB-OD1 3.26Å; S202-D204 PolarHBondContact O-N 2.82Å; S202-D204 VanDerWaalsContact O-N 3.11Å; S202-D204 PolarHBondContact OG-OD1 3.41Å; S202-F205 WeakPolarHBondContact O-CA 3.47Å; S202-F205 PolarHBondContact O-N 3.05Å; S202-V206 PolarHBondContact N-O 2.65Å; S202-V206 PolarHBondContact OG-O 2.9Å; S202-R208 PolarHBondContact OG-NE 2.87Å
203	R	89.6	Confident	88.7	Confident	78 Å²	78	53.7 Å²	53.7	29%	0.294	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-20.2	-171	67.9	179.9	-179.7	-138.2	0.8	114.2	H178 F205 W254 W262	H178-R203 HydrophobicContact CB-CB 3.98Å; H178-R203 PolarHBondContact ND1-O 2.88Å; R203-F205 VanDerWaalsContact C-N 3.31Å; R203-W254 HydrophobicContact CB-CG 4.35Å; R203-W262 VanDerWaalsContact CZ-CB 3.4Å; R203-W262 VanDerWaalsContact NH1-CB 3.34Å
204	D	88	Confident	89.1	Confident	77 Å²	77	59.2 Å²	59.2	41%	0.412	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	10.9	174.1	47.4	-52.4	0	0	0	113	S202 V206 R208	S202-D204 WeakPolarHBondContact CB-OD1 3.26Å; S202-D204 PolarHBondContact O-N 2.82Å; S202-D204 VanDerWaalsContact O-N 3.11Å; S202-D204 PolarHBondContact OG-OD1 3.41Å; D204-V206 HydrophobicContact CB-CG2 4.46Å; D204-V206 PolarHBondContact O-N 2.83Å; D204-V206 VanDerWaalsContact O-N 3.08Å; D204-V206 WeakPolarHBondContact OD2-CB 3.48Å; D204-V206 WeakPolarHBondContact OD2-CG2 3.43Å; D204-R208 IonicContact OD1-NH2 3.52Å; D204-R208 IonicContact OD2-CZ 3.32Å; D204-R208 IonicContact OD2-NH2 2.82Å; D204-R208 PolarHBondContact OD2-NH2 2.97Å
205	F	86.3	Confident	89.3	Confident	144 Å²	144	61.5 Å²	61.5	63%	0.632	31%	0.311	S	S	*	.	S	Bend	trans	59	10.4	-175.2	-56	-81.5	0	0	0	115.3	L201 S202 R203	L201-F205 VanDerWaalsContact CD1-O 3.25Å; L201-F205 WeakPolarHBondContact CD1-O 3.49Å; S202-F205 WeakPolarHBondContact O-CA 3.47Å; S202-F205 PolarHBondContact O-N 3.05Å; R203-F205 VanDerWaalsContact C-N 3.31Å
206	V	90.1	Very high	89.4	Confident	65 Å²	65	60 Å²	60	39%	0.394	30%	0.298	S	S	.	.			trans	-77.3	132	173.6	176.6	0	0	0	0	109.9	S202 D204 R208	S202-V206 PolarHBondContact N-O 2.65Å; S202-V206 PolarHBondContact OG-O 2.9Å; D204-V206 HydrophobicContact CB-CG2 4.46Å; D204-V206 PolarHBondContact O-N 2.83Å; D204-V206 VanDerWaalsContact O-N 3.08Å; D204-V206 WeakPolarHBondContact OD2-CB 3.48Å; D204-V206 WeakPolarHBondContact OD2-CG2 3.43Å; V206-R208 HydrophobicContact CG1-CG 4.1Å
207	L	91.1	Very high	89.3	Confident	74 Å²	74	58.7 Å²	58.7	39%	0.387	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	130	172.5	-162.6	72.3	0	0	0	110.5	V199 L201 M217 L224	V199-L207 HydrophobicContact CG2-CD1 3.6Å; V199-L207 HydrophobicContact CG2-CD2 4.2Å; V199-L207 HydrophobicContact CG2-CG 3.9Å; L201-L207 HydrophobicContact CB-CD1 4.3Å; L201-L207 HydrophobicContact CD1-CD1 4.29Å; L207-M217 HydrophobicContact CD2-CE 4.1Å; L207-M217 HydrophobicContact CD2-SD 4.1Å; L207-M217 HydrophobicContact CG-CE 4.29Å; L207-M217 HydrophobicContact CG-SD 4.46Å; L207-L224 HydrophobicContact CD1-CB 4.09Å; L207-L224 HydrophobicContact CD1-CD2 4.07Å; L207-L224 HydrophobicContact CD1-CG 4.4Å
208	R	90.9	Very high	89	Confident	126 Å²	126	60.3 Å²	60.3	48%	0.475	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	139.2	-175.8	-57.3	-179.9	-173	-101.4	-2.1	109.5	V199 T200 S202 D204 V206	V199-R208 CarbonylContact C-O 3.56Å; V199-R208 VanDerWaalsContact CA-O 3.3Å; V199-R208 WeakPolarHBondContact CA-O 3.47Å; T200-R208 PolarHBondContact N-O 3.33Å; T200-R208 PolarHBondContact O-N 3.4Å; S202-R208 PolarHBondContact OG-NE 2.87Å; D204-R208 IonicContact OD1-NH2 3.52Å; D204-R208 IonicContact OD2-CZ 3.32Å; D204-R208 IonicContact OD2-NH2 2.82Å; D204-R208 PolarHBondContact OD2-NH2 2.97Å; V206-R208 HydrophobicContact CG1-CG 4.1Å
209	S	89.4	Confident	88.7	Confident	27 Å²	27	63.6 Å²	63.6	19%	0.189	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	141.3	176.7	62.5	0	0	0	0	111.4	L198 R214	L198-S209 WeakPolarHBondContact O-CA 3.49Å; S209-R214 WeakPolarHBondContact OG-CA 3.39Å; S209-R214 WeakPolarHBondContact OG-CB 3.42Å
210	G	83.4	Confident	88.2	Confident	10 Å²	10	64.5 Å²	64.5	10%	0.103	35%	0.352	C	S	.	.			trans	-63	155.7	164.1	0	0	0	0	0	112.3	E197 L198 Y213 R214	E197-G210 WeakPolarHBondContact O-CA 3.23Å; L198-G210 PolarHBondContact O-N 3.11Å; G210-Y213 PolarHBondContact O-N 3.48Å; G210-R214 PolarHBondContact O-N 3.13Å; G210-R214 VanDerWaalsContact O-N 3.13Å
211	G	82.5	Confident	87.9	Confident	42 Å²	42	65 Å²	65	43%	0.433	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-43.8	-61.8	-172.1	0	0	0	0	0	115.9	Y213 R214	G211-Y213 VanDerWaalsContact C-N 3.27Å; G211-Y213 PolarHBondContact O-N 3.29Å; G211-R214 WeakPolarHBondContact O-CB 3.45Å; G211-R214 PolarHBondContact O-N 2.79Å
212	P	81.8	Confident	87.8	Confident	86 Å²	86	63.7 Å²	63.7	56%	0.558	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-70	-21.9	-178.9	27.4	-34.8	0	0	0	113.5	Q196	Q196-P212 HydrophobicContact CG-CG 4.39Å
213	Y	89.4	Confident	87.8	Confident	3 Å²	3	69.1 Å²	69.1	1%	0.012	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-86.1	-10.3	-178.4	-81	-70.1	0	0	0	114.1	Q196 L198 G210 G211 Q215 R216 M217 L222 D243	Q196-Y213 HydrophobicContact CG-CE2 4.3Å; L198-Y213 HydrophobicContact CB-CD2 4.24Å; L198-Y213 HydrophobicContact CB-CE2 4.42Å; L198-Y213 HydrophobicContact CD1-CD2 3.87Å; L198-Y213 HydrophobicContact CD1-CE2 3.31Å; L198-Y213 HydrophobicContact CD2-CE2 4.48Å; L198-Y213 HydrophobicContact CG-CD1 4.37Å; L198-Y213 HydrophobicContact CG-CD2 3.72Å; L198-Y213 HydrophobicContact CG-CE1 4.13Å; L198-Y213 HydrophobicContact CG-CE2 3.43Å; L198-Y213 VanDerWaalsContact CG-CE2 3.43Å; L198-Y213 HydrophobicContact CG-CG 4.19Å; G210-Y213 PolarHBondContact O-N 3.48Å; G211-Y213 VanDerWaalsContact C-N 3.27Å; G211-Y213 PolarHBondContact O-N 3.29Å; Y213-Q215 PolarHBondContact O-N 2.96Å; Y213-R216 PolarHBondContact O-N 2.81Å; Y213-R216 VanDerWaalsContact O-N 3.15Å; Y213-M217 PolarHBondContact O-N 2.91Å; Y213-L222 HydrophobicContact CD1-CD2 3.83Å; Y213-L222 HydrophobicContact CG-CD2 3.97Å; Y213-D243 VanDerWaalsContact CE1-OD1 3.25Å; Y213-D243 WeakPolarHBondContact CE1-OD1 3.29Å; Y213-D243 PolarHBondContact OH-OD1 2.9Å
214	R	88.7	Confident	88	Confident	156 Å²	156	66.3 Å²	66.3	59%	0.589	36%	0.357	S	S	*	.	H	α-helix	trans	-55	-44.9	-178.4	-170.8	-177.8	-62.2	118.9	-2.6	113.9	S209 G210 G211 M217 A218	S209-R214 WeakPolarHBondContact OG-CA 3.39Å; S209-R214 WeakPolarHBondContact OG-CB 3.42Å; G210-R214 PolarHBondContact O-N 3.13Å; G210-R214 VanDerWaalsContact O-N 3.13Å; G211-R214 WeakPolarHBondContact O-CB 3.45Å; G211-R214 PolarHBondContact O-N 2.79Å; R214-M217 PolarHBondContact O-N 3.07Å; R214-A218 PolarHBondContact O-N 2.82Å; R214-A218 VanDerWaalsContact O-N 3.07Å
215	Q	86.2	Confident	88.1	Confident	167 Å²	167	65 Å²	65	78%	0.78	35%	0.35	S	S	*	.	H	α-helix	trans	-67	-39	178.8	-73.2	-178.3	-14.6	0	0	112	Y213 A218 A219	Y213-Q215 PolarHBondContact O-N 2.96Å; Q215-A218 PolarHBondContact O-N 3.27Å; Q215-A219 WeakPolarHBondContact O-CB 3.15Å; Q215-A219 PolarHBondContact O-N 2.81Å
216	R	89.5	Confident	88.3	Confident	22 Å²	22	63.4 Å²	63.4	8%	0.083	34%	0.343	C	S	.	.	H	α-helix	trans	-70.3	-34.2	178.7	-68.8	177.5	72.7	-166.6	3	112.1	Y213 A219 G220 D221 L222 H237 K238 D243	Y213-R216 PolarHBondContact O-N 2.81Å; Y213-R216 VanDerWaalsContact O-N 3.15Å; R216-A219 PolarHBondContact O-N 2.9Å; R216-G220 PolarHBondContact O-N 2.89Å; R216-D221 HydrophobicContact CB-CB 4.15Å; R216-D221 WeakPolarHBondContact O-CA 3.11Å; R216-D221 PolarHBondContact O-N 2.99Å; R216-L222 HydrophobicContact CB-CB 4.28Å; R216-L222 PolarHBondContact O-N 3.44Å; R216-L222 VanDerWaalsContact O-N 3.09Å; R216-H237 PolarHBondContact NH2-O 2.68Å; R216-H237 VanDerWaalsContact NH2-O 3.11Å; R216-K238 PolarHBondContact NH2-O 2.91Å; R216-D243 IonicContact CZ-OD1 3.5Å; R216-D243 IonicContact CZ-OD2 3.47Å; R216-D243 VanDerWaalsContact CZ-OD2 3.31Å; R216-D243 IonicContact NH1-OD1 3.98Å; R216-D243 PolarHBondContact NH1-OD1 3.34Å; R216-D243 IonicContact NH1-OD2 3.12Å; R216-D243 PolarHBondContact NH1-OD2 3.22Å; R216-D243 IonicContact NH2-OD1 3.15Å; R216-D243 IonicContact NH2-OD2 2.61Å; R216-D243 PolarHBondContact NH2-OD2 2.8Å
217	M	86.7	Confident	88.3	Confident	41 Å²	41	63.3 Å²	63.3	20%	0.202	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-44.7	169.8	-172.4	179.6	-72	0	0	111.6	V199 L207 Y213 R214 A219 G220 L222	V199-M217 HydrophobicContact CB-CE 3.64Å; V199-M217 HydrophobicContact CG2-CE 3.34Å; L207-M217 HydrophobicContact CD2-CE 4.1Å; L207-M217 HydrophobicContact CD2-SD 4.1Å; L207-M217 HydrophobicContact CG-CE 4.29Å; L207-M217 HydrophobicContact CG-SD 4.46Å; Y213-M217 PolarHBondContact O-N 2.91Å; R214-M217 PolarHBondContact O-N 3.07Å; M217-A219 VanDerWaalsContact C-N 3.32Å; M217-A219 PolarHBondContact O-N 2.83Å; M217-G220 PolarHBondContact O-N 2.94Å; M217-L222 HydrophobicContact CB-CB 4.41Å; M217-L222 HydrophobicContact CE-CD2 4.3Å
218	A	86.5	Confident	88.2	Confident	93 Å²	93	62.6 Å²	62.6	77%	0.769	34%	0.344	S	S	*	.	H	α-helix	trans	-64.5	-33.5	177.2	0	0	0	0	0	113.3	R214 Q215 G220	R214-A218 PolarHBondContact O-N 2.82Å; R214-A218 VanDerWaalsContact O-N 3.07Å; Q215-A218 PolarHBondContact O-N 3.27Å; A218-G220 PolarHBondContact O-N 3.47Å
219	A	86.1	Confident	87.9	Confident	69 Å²	69	60.6 Å²	60.6	57%	0.57	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-5.7	172.2	0	0	0	0	0	113.9	Q215 R216 M217 D221	Q215-A219 WeakPolarHBondContact O-CB 3.15Å; Q215-A219 PolarHBondContact O-N 2.81Å; R216-A219 PolarHBondContact O-N 2.9Å; M217-A219 VanDerWaalsContact C-N 3.32Å; M217-A219 PolarHBondContact O-N 2.83Å; A219-D221 PolarHBondContact O-N 2.7Å
220	G	84.7	Confident	88	Confident	19 Å²	19	61.7 Å²	61.7	20%	0.196	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	6.2	-175	0	0	0	0	0	115	R216 M217 A218 R223	R216-G220 PolarHBondContact O-N 2.89Å; M217-G220 PolarHBondContact O-N 2.94Å; A218-G220 PolarHBondContact O-N 3.47Å; G220-R223 PolarHBondContact O-NE 2.84Å
221	D	87.8	Confident	88.4	Confident	24 Å²	24	61.9 Å²	61.9	13%	0.128	36%	0.359	C	S	.	.	S	Bend	trans	-79.4	-14.1	178.3	-78.8	-33.7	0	0	0	113.6	R216 A219 I236 H237 K238	R216-D221 HydrophobicContact CB-CB 4.15Å; R216-D221 WeakPolarHBondContact O-CA 3.11Å; R216-D221 PolarHBondContact O-N 2.99Å; A219-D221 PolarHBondContact O-N 2.7Å; D221-I236 WeakPolarHBondContact O-CA 3.45Å; D221-H237 HydrophobicContact CB-CB 4.41Å; D221-H237 PolarHBondContact O-N 2.84Å; D221-K238 IonicContact OD1-NZ 2.77Å; D221-K238 PolarHBondContact OD1-NZ 3.31Å; D221-K238 IonicContact OD2-NZ 3.74Å; D221-K238 PolarHBondContact OD2-NZ 3.23Å
222	L	92.7	Very high	89	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.01	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	129	169.5	174.2	67.2	0	0	0	109.9	L198 V199 Y213 R216 M217 L234 I236	L198-L222 HydrophobicContact CB-CD2 4.45Å; V199-L222 HydrophobicContact CB-CD2 4.2Å; V199-L222 HydrophobicContact CG1-CD1 4.12Å; V199-L222 HydrophobicContact CG1-CD2 4.33Å; V199-L222 HydrophobicContact CG1-CG 4.33Å; Y213-L222 HydrophobicContact CD1-CD2 3.83Å; Y213-L222 HydrophobicContact CG-CD2 3.97Å; R216-L222 HydrophobicContact CB-CB 4.28Å; R216-L222 PolarHBondContact O-N 3.44Å; R216-L222 VanDerWaalsContact O-N 3.09Å; M217-L222 HydrophobicContact CB-CB 4.41Å; M217-L222 HydrophobicContact CE-CD2 4.3Å; L222-L234 HydrophobicContact CD1-CD1 3.59Å; L222-I236 HydrophobicContact CD1-CG1 3.97Å
223	R	91.7	Very high	89.7	Confident	127 Å²	127	60 Å²	60	48%	0.479	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	151.2	179.3	-55.1	-176.4	-175.5	-146.8	-1.2	112	G220 T235	G220-R223 PolarHBondContact O-NE 2.84Å; R223-T235 PolarHBondContact N-O 3.44Å; R223-T235 PolarHBondContact O-N 3.41Å
224	L	93.9	Very high	89.9	Confident	18 Å²	18	59.9 Å²	59.9	9%	0.094	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	107.3	167.9	174.5	59.1	0	0	0	108.4	V199 L201 L207 R233	V199-L224 HydrophobicContact CB-CB 4.4Å; V199-L224 HydrophobicContact CG1-CB 3.9Å; V199-L224 HydrophobicContact CG1-CD2 4.4Å; V199-L224 HydrophobicContact CG2-CB 3.54Å; V199-L224 HydrophobicContact CG2-CD2 3.89Å; V199-L224 HydrophobicContact CG2-CG 4.37Å; L201-L224 HydrophobicContact CB-CD2 4.34Å; L207-L224 HydrophobicContact CD1-CB 4.09Å; L207-L224 HydrophobicContact CD1-CD2 4.07Å; L207-L224 HydrophobicContact CD1-CG 4.4Å; L224-R233 CarbonylContact C-O 3.22Å; L224-R233 WeakPolarHBondContact CA-O 3.1Å
225	D	91.4	Very high	90.2	Very high	50 Å²	50	52.6 Å²	52.6	27%	0.267	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133.4	179.2	-48.3	-42.8	0	0	0	109.5	T227 Y232 R233	D225-T227 HydrophobicContact CB-CG2 3.87Å; D225-T227 PolarHBondContact O-N 2.9Å; D225-Y232 CarbonylContact O-C 3.51Å; D225-Y232 WeakPolarHBondContact O-CA 3.49Å; D225-R233 HydrophobicContact CB-CB 4.44Å; D225-R233 PolarHBondContact N-O 3.34Å; D225-R233 PolarHBondContact O-N 2.91Å; D225-R233 IonicContact OD2-CZ 2.76Å; D225-R233 VanDerWaalsContact OD2-CZ 3.25Å; D225-R233 IonicContact OD2-NE 3.7Å; D225-R233 PolarHBondContact OD2-NE 2.83Å; D225-R233 IonicContact OD2-NH2 2.89Å; D225-R233 PolarHBondContact OD2-NH2 3.5Å
226	K	90.8	Very high	90.6	Very high	110 Å²	110	44.7 Å²	44.7	48%	0.478	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	104.5	160.6	-167.5	-174.1	-173.4	-163.8	0	107.9	S228 A229 Y232	K226-S228 WeakPolarHBondContact CE-O 3.37Å; K226-S228 WeakPolarHBondContact CG-O 3.27Å; K226-A229 WeakPolarHBondContact CE-O 3.44Å; K226-A229 PolarHBondContact NZ-O 2.92Å; K226-Y232 HydrophobicContact CB-CD1 4.19Å; K226-Y232 HydrophobicContact CB-CE1 4.07Å; K226-Y232 HydrophobicContact CD-CE1 3.93Å; K226-Y232 VanDerWaalsContact CE-OH 3.27Å; K226-Y232 WeakPolarHBondContact CE-OH 3.27Å; K226-Y232 HydrophobicContact CG-CD1 4.05Å; K226-Y232 HydrophobicContact CG-CE1 3.69Å; K226-Y232 HydrophobicContact CG-CE2 4.48Å
227	T	89	Confident	90.4	Very high	64 Å²	64	46.2 Å²	46.2	39%	0.393	27%	0.272	S	S	.	.			trans	-93.2	-20.7	-169.3	52.7	0	0	0	0	113.8	D225 S231 R233	D225-T227 HydrophobicContact CB-CG2 3.87Å; D225-T227 PolarHBondContact O-N 2.9Å; T227-S231 PolarHBondContact N-O 2.73Å; T227-S231 VanDerWaalsContact OG1-CB 3.28Å; T227-S231 WeakPolarHBondContact OG1-CB 3.37Å; T227-S231 PolarHBondContact OG1-O 2.64Å; T227-S231 PolarHBondContact OG1-OG 3.01Å; T227-R233 HydrophobicContact CG2-CB 3.88Å
228	S	88.6	Confident	90.4	Very high	59 Å²	59	49.9 Å²	49.9	41%	0.413	29%	0.286	S	S	.	.	S	Bend	trans	-145	-168.6	173.5	84.1	0	0	0	0	111	K226 T230 S231	K226-S228 WeakPolarHBondContact CE-O 3.37Å; K226-S228 WeakPolarHBondContact CG-O 3.27Å; S228-T230 PolarHBondContact O-N 2.86Å; S228-T230 PolarHBondContact OG-N 2.77Å; S228-T230 PolarHBondContact OG-OG1 2.8Å; S228-S231 PolarHBondContact N-O 2.99Å; S228-S231 VanDerWaalsContact OG-CB 3.22Å; S228-S231 WeakPolarHBondContact OG-CB 3.37Å; S228-S231 PolarHBondContact OG-N 3.39Å
229	A	85.1	Confident	90.5	Very high	84 Å²	84	45.5 Å²	45.5	69%	0.694	25%	0.25	S	S	*	.	S	Bend	trans	-58	-35.7	171.8	0	0	0	0	0	112.7	K226	K226-A229 WeakPolarHBondContact CE-O 3.44Å; K226-A229 PolarHBondContact NZ-O 2.92Å
230	T	90.7	Very high	90.6	Very high	49 Å²	49	46.2 Å²	46.2	30%	0.301	24%	0.242	S	C	.	.	S	Bend	trans	-119.2	-19	-173	53	0	0	0	0	114.2	E168 V169 S228 Y232	E168-T230 WeakPolarHBondContact CA-O 3.21Å; V169-T230 PolarHBondContact N-O 2.64Å; V169-T230 VanDerWaalsContact O-CA 3.29Å; V169-T230 WeakPolarHBondContact O-CA 3.31Å; V169-T230 VanDerWaalsContact O-CB 3.23Å; V169-T230 WeakPolarHBondContact O-CB 3.27Å; V169-T230 WeakPolarHBondContact O-CG2 3.29Å; S228-T230 PolarHBondContact O-N 2.86Å; S228-T230 PolarHBondContact OG-N 2.77Å; S228-T230 PolarHBondContact OG-OG1 2.8Å; T230-Y232 VanDerWaalsContact O-CD2 3.27Å; T230-Y232 WeakPolarHBondContact O-CD2 3.25Å
231	S	93.1	Very high	90.6	Very high	14 Å²	14	49.2 Å²	49.2	10%	0.098	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	135.5	-172.2	-165.8	0	0	0	0	112.8	C167 T227 S228	C167-S231 WeakPolarHBondContact O-CA 3.33Å; T227-S231 PolarHBondContact N-O 2.73Å; T227-S231 VanDerWaalsContact OG1-CB 3.28Å; T227-S231 WeakPolarHBondContact OG1-CB 3.37Å; T227-S231 PolarHBondContact OG1-O 2.64Å; T227-S231 PolarHBondContact OG1-OG 3.01Å; S228-S231 PolarHBondContact N-O 2.99Å; S228-S231 VanDerWaalsContact OG-CB 3.22Å; S228-S231 WeakPolarHBondContact OG-CB 3.37Å; S228-S231 PolarHBondContact OG-N 3.39Å
232	Y	94.8	Very high	90.5	Very high	9 Å²	9	51.9 Å²	51.9	4%	0.035	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	119.2	-177.6	-67.6	-95.1	0	0	0	109.5	C167 V169 V181 L201 D225 K226 T230	C167-Y232 PolarHBondContact N-O 3.08Å; C167-Y232 PolarHBondContact O-N 3.22Å; V169-Y232 HydrophobicContact CB-CD2 4.28Å; V169-Y232 HydrophobicContact CB-CE2 4.13Å; V169-Y232 HydrophobicContact CG2-CD2 4.17Å; V169-Y232 HydrophobicContact CG2-CE2 4.43Å; V181-Y232 HydrophobicContact CB-CD1 4.11Å; V181-Y232 HydrophobicContact CB-CD2 4.49Å; V181-Y232 HydrophobicContact CB-CE1 4.06Å; V181-Y232 HydrophobicContact CB-CE2 4.48Å; V181-Y232 HydrophobicContact CB-CG 4.32Å; V181-Y232 HydrophobicContact CG1-CD1 4.17Å; V181-Y232 HydrophobicContact CG1-CD2 4.15Å; V181-Y232 HydrophobicContact CG1-CG 3.94Å; V181-Y232 HydrophobicContact CG2-CD1 4.45Å; V181-Y232 HydrophobicContact CG2-CD2 4.24Å; V181-Y232 HydrophobicContact CG2-CE1 4.05Å; V181-Y232 HydrophobicContact CG2-CE2 3.84Å; L201-Y232 HydrophobicContact CD2-CE1 3.85Å; D225-Y232 CarbonylContact O-C 3.51Å; D225-Y232 WeakPolarHBondContact O-CA 3.49Å; K226-Y232 HydrophobicContact CB-CD1 4.19Å; K226-Y232 HydrophobicContact CB-CE1 4.07Å; K226-Y232 HydrophobicContact CD-CE1 3.93Å; K226-Y232 VanDerWaalsContact CE-OH 3.27Å; K226-Y232 WeakPolarHBondContact CE-OH 3.27Å; K226-Y232 HydrophobicContact CG-CD1 4.05Å; K226-Y232 HydrophobicContact CG-CE1 3.69Å; K226-Y232 HydrophobicContact CG-CE2 4.48Å; T230-Y232 VanDerWaalsContact O-CD2 3.27Å; T230-Y232 WeakPolarHBondContact O-CD2 3.25Å
233	R	95.4	Very high	90.3	Very high	80 Å²	80	51.8 Å²	51.8	30%	0.302	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	117.8	-176.7	177.1	176	62.8	-153.4	-1.5	111.8	L165 N166 L224 D225 T227	L165-R233 CarbonylContact O-C 3.6Å; L165-R233 WeakPolarHBondContact O-CA 3.49Å; N166-R233 WeakPolarHBondContact OD1-CB 3.42Å; N166-R233 VanDerWaalsContact OD1-CG 3.32Å; N166-R233 WeakPolarHBondContact OD1-CG 3.12Å; L224-R233 CarbonylContact C-O 3.22Å; L224-R233 WeakPolarHBondContact CA-O 3.1Å; D225-R233 HydrophobicContact CB-CB 4.44Å; D225-R233 PolarHBondContact N-O 3.34Å; D225-R233 PolarHBondContact O-N 2.91Å; D225-R233 IonicContact OD2-CZ 2.76Å; D225-R233 VanDerWaalsContact OD2-CZ 3.25Å; D225-R233 IonicContact OD2-NE 3.7Å; D225-R233 PolarHBondContact OD2-NE 2.83Å; D225-R233 IonicContact OD2-NH2 2.89Å; D225-R233 PolarHBondContact OD2-NH2 3.5Å; T227-R233 HydrophobicContact CG2-CB 3.88Å
234	L	95	Very high	90.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	133.8	162.5	176.4	66.8	0	0	0	109.4	Q164 L165 W183 L198 V199 L222 I236	Q164-L234 VanDerWaalsContact CA-O 3.31Å; Q164-L234 WeakPolarHBondContact CA-O 3.32Å; L165-L234 HydrophobicContact CB-CB 4.46Å; L165-L234 HydrophobicContact CD1-CD2 4.45Å; L165-L234 PolarHBondContact N-O 2.55Å; L165-L234 PolarHBondContact O-N 2.74Å; W183-L234 HydrophobicContact CB-CD1 4.31Å; W183-L234 HydrophobicContact CB-CD2 4.12Å; W183-L234 HydrophobicContact CD2-CB 3.78Å; W183-L234 HydrophobicContact CD2-CD2 3.83Å; W183-L234 HydrophobicContact CD2-CG 4.36Å; W183-L234 HydrophobicContact CE3-CB 4.42Å; W183-L234 HydrophobicContact CE3-CD2 3.85Å; W183-L234 HydrophobicContact CG-CB 3.92Å; W183-L234 HydrophobicContact CG-CD1 4.29Å; W183-L234 HydrophobicContact CG-CD2 3.97Å; W183-L234 HydrophobicContact CG-CG 4.29Å; W183-L234 HydrophobicContact CZ2-CB 4.1Å; L198-L234 HydrophobicContact CD2-CD1 4.32Å; L198-L234 HydrophobicContact CD2-CD2 4.05Å; V199-L234 HydrophobicContact CG1-CD1 3.72Å; L222-L234 HydrophobicContact CD1-CD1 3.59Å; L234-I236 HydrophobicContact CD1-CG1 4.2Å; L234-I236 HydrophobicContact CD2-CD1 4.26Å; L234-I236 HydrophobicContact CD2-CG1 4.35Å; L234-I236 HydrophobicContact CG-CG1 4.14Å
235	T	94.6	Very high	90.1	Very high	4 Å²	4	49.8 Å²	49.8	3%	0.025	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	129.7	165.9	-56.2	0	0	0	0	109.6	T162 L163 Q164 R223 H237	T162-T235 HydrophobicContact CG2-CG2 4.04Å; L163-T235 WeakPolarHBondContact O-CA 3.22Å; Q164-T235 HydrophobicContact CG-CG2 3.89Å; R223-T235 PolarHBondContact N-O 3.44Å; R223-T235 PolarHBondContact O-N 3.41Å; T235-H237 WeakPolarHBondContact CG2-NE2 3.28Å
236	I	93.6	Very high	90.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	116	172.1	-47.6	-176	0	0	0	107.9	T162 L163 L198 D221 L222 L234 L239	T162-I236 CarbonylContact C-O 3.52Å; T162-I236 WeakPolarHBondContact CA-O 3.5Å; L163-I236 HydrophobicContact CB-CB 4.36Å; L163-I236 HydrophobicContact CD2-CD1 4.31Å; L163-I236 PolarHBondContact N-O 2.78Å; L163-I236 PolarHBondContact O-N 3.28Å; L198-I236 HydrophobicContact CD2-CD1 3.8Å; D221-I236 WeakPolarHBondContact O-CA 3.45Å; L222-I236 HydrophobicContact CD1-CG1 3.97Å; L234-I236 HydrophobicContact CD1-CG1 4.2Å; L234-I236 HydrophobicContact CD2-CD1 4.26Å; L234-I236 HydrophobicContact CD2-CG1 4.35Å; L234-I236 HydrophobicContact CG-CG1 4.14Å; I236-L239 HydrophobicContact CB-CD2 4.29Å; I236-L239 HydrophobicContact CG2-CD2 4.08Å
237	H	86.4	Confident	90.3	Very high	54 Å²	54	44.1 Å²	44.1	25%	0.25	25%	0.245	C	C	.	.			trans	-93.2	156.8	170.6	-58.1	-68.3	0	0	0	110.5	T162 R216 D221 T235	T162-H237 VanDerWaalsContact CG2-ND1 3.35Å; T162-H237 WeakPolarHBondContact CG2-ND1 3.5Å; T162-H237 PolarHBondContact OG1-ND1 2.65Å; R216-H237 PolarHBondContact NH2-O 2.68Å; R216-H237 VanDerWaalsContact NH2-O 3.11Å; D221-H237 HydrophobicContact CB-CB 4.41Å; D221-H237 PolarHBondContact O-N 2.84Å; T235-H237 WeakPolarHBondContact CG2-NE2 3.28Å
238	K	86.1	Confident	90.6	Very high	118 Å²	118	41.3 Å²	41.3	51%	0.513	23%	0.227	S	C	.	.	S	Bend	trans	49.5	64.5	-177.3	-49.1	-169.2	-165.8	79.7	0	111	G160 D161 R216 D221 Q240	G160-K238 WeakPolarHBondContact O-CA 3.41Å; D161-K238 PolarHBondContact O-N 2.87Å; R216-K238 PolarHBondContact NH2-O 2.91Å; D221-K238 IonicContact OD1-NZ 2.77Å; D221-K238 PolarHBondContact OD1-NZ 3.31Å; D221-K238 IonicContact OD2-NZ 3.74Å; D221-K238 PolarHBondContact OD2-NZ 3.23Å; K238-Q240 PolarHBondContact O-N 2.74Å
239	L	90	Very high	90.9	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	21%	0.208	C	C	.	.			trans	-52.1	126.3	178.7	-84.8	-178.6	0	0	0	110.7	K157 G160 D161 L163 I236 D243 L275 I277	K157-L239 HydrophobicContact CB-CD1 3.5Å; K157-L239 HydrophobicContact CD-CD1 4.38Å; K157-L239 HydrophobicContact CG-CD1 3.75Å; G160-L239 PolarHBondContact N-O 2.93Å; D161-L239 HydrophobicContact CB-CB 4.49Å; D161-L239 HydrophobicContact CB-CD1 3.94Å; D161-L239 HydrophobicContact CB-CG 4.49Å; D161-L239 WeakPolarHBondContact O-CB 3.47Å; D161-L239 WeakPolarHBondContact O-CG 3.32Å; D161-L239 PolarHBondContact O-N 2.64Å; L163-L239 HydrophobicContact CB-CD1 4.12Å; L163-L239 HydrophobicContact CB-CD2 3.99Å; L163-L239 HydrophobicContact CB-CG 4.24Å; L163-L239 HydrophobicContact CD2-CD2 4.39Å; I236-L239 HydrophobicContact CB-CD2 4.29Å; I236-L239 HydrophobicContact CG2-CD2 4.08Å; L239-D243 HydrophobicContact CD2-CB 3.88Å; L239-L275 HydrophobicContact CD1-CD1 4.42Å; L239-L275 HydrophobicContact CD1-CD2 4.37Å; L239-L275 HydrophobicContact CD2-CD2 3.88Å; L239-I277 HydrophobicContact CB-CD1 4.24Å; L239-I277 HydrophobicContact CD2-CD1 4.42Å
240	Q	87.3	Confident	91.4	Very high	85 Å²	85	36 Å²	36	40%	0.397	18%	0.182	S	C	.	.			trans	-112.5	153.8	179.7	-74.4	174.1	-27	0	0	109.5	K238 V242 D243 I277	K238-Q240 PolarHBondContact O-N 2.74Å; Q240-V242 HydrophobicContact CB-CG1 3.94Å; Q240-V242 PolarHBondContact O-N 3.49Å; Q240-D243 PolarHBondContact N-OD2 2.83Å; Q240-D243 WeakPolarHBondContact O-CB 3Å; Q240-D243 PolarHBondContact O-N 2.82Å; Q240-I277 WeakPolarHBondContact O-CD1 3.32Å
241	P	84.3	Confident	91.7	Very high	81 Å²	81	33.7 Å²	33.7	53%	0.526	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-52.4	-24.2	177.7	-29.9	36.4	0	0	0	115.4	E159 D243 Q244	E159-P241 WeakPolarHBondContact OE1-CD 2.95Å; P241-D243 VanDerWaalsContact C-N 3.27Å; P241-D243 PolarHBondContact O-N 2.86Å; P241-Q244 VanDerWaalsContact O-CB 3.31Å; P241-Q244 WeakPolarHBondContact O-CB 3.44Å; P241-Q244 PolarHBondContact O-N 2.81Å
242	V	85.4	Confident	91.7	Very high	80 Å²	80	33.2 Å²	33.2	49%	0.485	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-68.3	-18.4	174.4	72	0	0	0	0	114.3	L185 Q240 Q244	L185-V242 WeakPolarHBondContact CD2-O 3.47Å; Q240-V242 HydrophobicContact CB-CG1 3.94Å; Q240-V242 PolarHBondContact O-N 3.49Å; V242-Q244 VanDerWaalsContact C-N 3.27Å
243	D	89.8	Confident	91.7	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-79.6	-9.2	176.7	-62	-41.5	0	0	0	112.8	Y213 R216 L239 Q240 P241 L275 I277	Y213-D243 VanDerWaalsContact CE1-OD1 3.25Å; Y213-D243 WeakPolarHBondContact CE1-OD1 3.29Å; Y213-D243 PolarHBondContact OH-OD1 2.9Å; R216-D243 IonicContact CZ-OD1 3.5Å; R216-D243 IonicContact CZ-OD2 3.47Å; R216-D243 VanDerWaalsContact CZ-OD2 3.31Å; R216-D243 IonicContact NH1-OD1 3.98Å; R216-D243 PolarHBondContact NH1-OD1 3.34Å; R216-D243 IonicContact NH1-OD2 3.12Å; R216-D243 PolarHBondContact NH1-OD2 3.22Å; R216-D243 IonicContact NH2-OD1 3.15Å; R216-D243 IonicContact NH2-OD2 2.61Å; R216-D243 PolarHBondContact NH2-OD2 2.8Å; L239-D243 HydrophobicContact CD2-CB 3.88Å; Q240-D243 PolarHBondContact N-OD2 2.83Å; Q240-D243 WeakPolarHBondContact O-CB 3Å; Q240-D243 PolarHBondContact O-N 2.82Å; P241-D243 VanDerWaalsContact C-N 3.27Å; P241-D243 PolarHBondContact O-N 2.86Å; D243-L275 HydrophobicContact CB-CD2 4.16Å; D243-L275 WeakPolarHBondContact O-CD2 3.31Å; D243-I277 HydrophobicContact CB-CD1 4.01Å
244	Q	89.4	Confident	91.6	Very high	100 Å²	100	31.3 Å²	31.3	47%	0.467	16%	0.157	S	C	.	.			trans	-69	130.1	-177.1	179.1	161.4	-91	0	0	112.3	P241 V242 L275 I277	P241-Q244 VanDerWaalsContact O-CB 3.31Å; P241-Q244 WeakPolarHBondContact O-CB 3.44Å; P241-Q244 PolarHBondContact O-N 2.81Å; V242-Q244 VanDerWaalsContact C-N 3.27Å; Q244-L275 WeakPolarHBondContact CG-O 3.46Å; Q244-I277 HydrophobicContact CB-CD1 4.43Å
245	G	90.8	Very high	91.4	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.021	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	149.6	-148.4	175.6	0	0	0	0	0	113.6	Q274 L275	G245-Q274 WeakPolarHBondContact O-CA 3.5Å; G245-L275 PolarHBondContact N-O 3.24Å; G245-L275 PolarHBondContact O-N 2.84Å
246	L	92.8	Very high	91.3	Very high	41 Å²	41	36.4 Å²	36.4	22%	0.215	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	103.3	-178.9	-61.4	177.4	0	0	0	110.6	L185 R186 P188 K272 T273 Q274	L185-L246 WeakPolarHBondContact CA-O 3.25Å; R186-L246 HydrophobicContact CB-CB 4.49Å; R186-L246 PolarHBondContact N-O 2.95Å; R186-L246 PolarHBondContact O-N 2.03Å; P188-L246 HydrophobicContact CB-CD1 4.23Å; P188-L246 HydrophobicContact CB-CG 4.11Å; L246-K272 HydrophobicContact CB-CB 4.38Å; L246-K272 HydrophobicContact CB-CD 4.45Å; L246-K272 HydrophobicContact CD1-CD 4.45Å; L246-T273 CarbonylContact C-O 3.53Å; L246-T273 WeakPolarHBondContact CA-O 3.05Å; L246-Q274 HydrophobicContact CD2-CB 3.96Å; L246-Q274 HydrophobicContact CD2-CG 4.31Å
247	L	94.1	Very high	91.1	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	135	177.2	-72.9	166.6	0	0	0	111	L163 L165 Y184 L185 L198 K272 T273 L275	L163-L247 HydrophobicContact CD2-CD1 3.59Å; L165-L247 HydrophobicContact CD1-CB 3.93Å; L165-L247 HydrophobicContact CD1-CD1 3.86Å; Y184-L247 WeakPolarHBondContact O-CA 3.49Å; L185-L247 HydrophobicContact CB-CD2 3.93Å; L185-L247 HydrophobicContact CD1-CD2 3.85Å; L185-L247 HydrophobicContact CD1-CG 3.97Å; L185-L247 HydrophobicContact CG-CD2 4.45Å; L198-L247 HydrophobicContact CD1-CD2 4.39Å; L198-L247 HydrophobicContact CD2-CD2 3.63Å; L247-K272 WeakPolarHBondContact O-CA 3.41Å; L247-T273 PolarHBondContact N-O 2.84Å; L247-T273 PolarHBondContact O-N 3.28Å; L247-L275 HydrophobicContact CD1-CB 4.49Å; L247-L275 HydrophobicContact CD1-CD2 4.39Å
248	Y	95.3	Very high	91.1	Very high	5 Å²	5	37.7 Å²	37.7	2%	0.02	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	157.9	176.4	68.8	-81	0	0	0	113	W183 Y184 R186 P195 Q269 K272	W183-Y248 WeakPolarHBondContact CA-O 3.32Å; Y184-Y248 PolarHBondContact N-O 2.88Å; Y184-Y248 WeakPolarHBondContact O-CD1 3.41Å; Y184-Y248 PolarHBondContact O-N 3.48Å; R186-Y248 HydrophobicContact CB-CE1 4.31Å; R186-Y248 PolarHBondContact NH2-OH 3.03Å; P195-Y248 HydrophobicContact CB-CE1 4.4Å; P195-Y248 VanDerWaalsContact CB-OH 3.25Å; P195-Y248 WeakPolarHBondContact CB-OH 3.36Å; P195-Y248 WeakPolarHBondContact CG-OH 3.31Å; Y248-Q269 HydrophobicContact CD2-CB 4.06Å; Y248-Q269 HydrophobicContact CE2-CB 4.19Å; Y248-K272 HydrophobicContact CD1-CD 4.48Å; Y248-K272 HydrophobicContact CG-CG 4.42Å
249	C	95.8	Very high	91.1	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	145.5	176.5	179.7	0	0	0	0	110	C167 G182 W183 Q269 S270	C167-C249 HydrophobicContact CB-CB 3.45Å; C167-C249 VanDerWaalsContact CB-CB 3.45Å; C167-C249 WeakPolarHBondContact CB-SG 3.39Å; C167-C249 WeakPolarHBondContact SG-CB 3.41Å; C167-C249 CovalentContact SG-SG 2.03Å; C167-C249 PolarHBondContact SG-SG 3.13Å; G182-C249 CarbonylContact O-C 3.54Å; W183-C249 HydrophobicContact CD2-CB 4.2Å; W183-C249 HydrophobicContact CE3-CB 4.21Å; W183-C249 HydrophobicContact CH2-CB 4.14Å; W183-C249 HydrophobicContact CZ2-CB 4.13Å; W183-C249 HydrophobicContact CZ3-CB 4.17Å; C249-Q269 CarbonylContact O-C 3.59Å; C249-Q269 WeakPolarHBondContact O-CA 3.48Å; C249-S270 PolarHBondContact N-OG 3.06Å; C249-S270 PolarHBondContact O-N 3.44Å; C249-S270 PolarHBondContact O-OG 2.96Å
250	Q	95.8	Very high	90.9	Very high	31 Å²	31	37.2 Å²	37.2	15%	0.145	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	133.9	173.2	174.9	-175	-128.5	0	0	109.3	V181 G182 Y184 R267 K268	V181-Q250 WeakPolarHBondContact CA-O 3.39Å; G182-Q250 PolarHBondContact N-O 2.91Å; G182-Q250 PolarHBondContact O-N 2.84Å; Y184-Q250 HydrophobicContact CD2-CB 3.92Å; Y184-Q250 HydrophobicContact CE2-CB 3.86Å; Q250-R267 VanDerWaalsContact CD-NH1 3.27Å; Q250-R267 HydrophobicContact CG-CG 4.35Å; Q250-K268 WeakPolarHBondContact CA-O 3.42Å
251	A	95.6	Very high	91	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	151.2	170.3	0	0	0	0	0	111.8	L146 V148 V169 L179 S180 V181 R267 K268	L146-A251 HydrophobicContact CD1-CB 4.49Å; V148-A251 HydrophobicContact CG2-CB 3.49Å; V148-A251 VanDerWaalsContact CG2-CB 3.49Å; V169-A251 HydrophobicContact CB-CB 4.46Å; V169-A251 HydrophobicContact CG1-CB 3.52Å; V169-A251 HydrophobicContact CG2-CB 4.05Å; L179-A251 HydrophobicContact CD1-CB 4.28Å; S180-A251 CarbonylContact O-C 3.45Å; S180-A251 VanDerWaalsContact O-CA 3.29Å; S180-A251 WeakPolarHBondContact O-CA 3.43Å; V181-A251 HydrophobicContact CG2-CB 4.06Å; A251-R267 WeakPolarHBondContact O-CA 3.31Å; A251-K268 PolarHBondContact N-O 2.89Å; A251-K268 PolarHBondContact O-N 3.21Å
252	V	94.5	Very high	91.3	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.03	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	127.9	173.4	-171.2	0	0	0	0	108.9	S180 W254 A264 T266 R267	S180-V252 PolarHBondContact N-O 3.12Å; S180-V252 PolarHBondContact O-N 2.77Å; V252-W254 HydrophobicContact CG1-CD2 4.28Å; V252-W254 HydrophobicContact CG1-CZ2 4.03Å; V252-A264 HydrophobicContact CG1-CB 3.75Å; V252-T266 CarbonylContact C-O 3.6Å; V252-T266 VanDerWaalsContact CA-O 3.31Å; V252-T266 WeakPolarHBondContact CA-O 3.37Å; V252-R267 HydrophobicContact CG2-CB 4.28Å; V252-R267 HydrophobicContact CG2-CG 4.13Å
253	E	93.8	Very high	91.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	129.7	171.2	-173.6	168.4	-163.2	0	0	109.9	L146 R171 T173 T177 H178 M265 T266	L146-E253 HydrophobicContact CD2-CB 4.32Å; R171-E253 WeakPolarHBondContact CD-OE1 3.45Å; R171-E253 IonicContact NH1-OE1 3.76Å; T173-E253 WeakPolarHBondContact CB-OE1 3.16Å; T173-E253 PolarHBondContact OG1-OE1 2.91Å; T173-E253 PolarHBondContact OG1-OE2 3Å; T173-E253 VanDerWaalsContact OG1-OE2 3.05Å; T177-E253 VanDerWaalsContact CB-OE1 3.25Å; T177-E253 WeakPolarHBondContact CB-OE1 3.4Å; T177-E253 HydrophobicContact CG2-CG 4.2Å; T177-E253 WeakPolarHBondContact CG2-OE1 3.48Å; T177-E253 PolarHBondContact OG1-OE1 2.92Å; H178-E253 WeakPolarHBondContact O-CA 3.49Å; E253-M265 HydrophobicContact CG-CE 4.08Å; E253-M265 PolarHBondContact O-N 2.9Å; E253-T266 PolarHBondContact N-O 3.18Å
254	W	93.1	Very high	91.6	Very high	48 Å²	48	35 Å²	35	18%	0.182	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	140.7	-173.8	-59.7	85.2	0	0	0	110.7	T177 H178 S180 R203 V252 W262 F263 A264	T177-W254 CarbonylContact C-O 3.56Å; T177-W254 WeakPolarHBondContact CA-O 3.24Å; T177-W254 VanDerWaalsContact CB-O 3.23Å; T177-W254 WeakPolarHBondContact CB-O 3.3Å; H178-W254 HydrophobicContact CB-CB 4.39Å; H178-W254 PolarHBondContact N-O 2.79Å; H178-W254 PolarHBondContact O-N 3.11Å; S180-W254 PolarHBondContact OG-NE1 2.84Å; R203-W254 HydrophobicContact CB-CG 4.35Å; V252-W254 HydrophobicContact CG1-CD2 4.28Å; V252-W254 HydrophobicContact CG1-CZ2 4.03Å; W254-W262 HydrophobicContact CB-CE3 3.89Å; W254-W262 HydrophobicContact CB-CZ3 4.2Å; W254-W262 HydrophobicContact CE3-CB 4.43Å; W254-F263 CarbonylContact C-O 3.55Å; W254-F263 VanDerWaalsContact CA-O 3.28Å; W254-F263 WeakPolarHBondContact CA-O 3.4Å; W254-A264 HydrophobicContact CD2-CB 4.22Å; W254-A264 HydrophobicContact CE3-CB 3.79Å; W254-A264 HydrophobicContact CH2-CB 4.02Å; W254-A264 HydrophobicContact CZ2-CB 4.43Å; W254-A264 HydrophobicContact CZ3-CB 3.67Å
255	I	91.8	Very high	91.5	Very high	12 Å²	12	30.5 Å²	30.5	6%	0.062	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	154.1	168.1	-160.9	166	0	0	0	109.4	V31 Q175 T177 W262 F263 M265	V31-I255 HydrophobicContact CB-CD1 3.97Å; Q175-I255 HydrophobicContact CB-CD1 4.03Å; Q175-I255 HydrophobicContact CG-CD1 4.36Å; T177-I255 HydrophobicContact CG2-CB 4.4Å; T177-I255 HydrophobicContact CG2-CG1 4.42Å; I255-W262 CarbonylContact O-C 3.56Å; I255-W262 WeakPolarHBondContact O-CA 3.47Å; I255-F263 HydrophobicContact CG2-CB 4.12Å; I255-F263 PolarHBondContact N-O 2.82Å; I255-F263 PolarHBondContact O-N 3.02Å; I255-M265 HydrophobicContact CB-CE 4.22Å; I255-M265 HydrophobicContact CB-CG 4.03Å; I255-M265 HydrophobicContact CB-SD 3.77Å; I255-M265 HydrophobicContact CD1-SD 3.99Å; I255-M265 HydrophobicContact CG1-SD 4.49Å; I255-M265 HydrophobicContact CG2-CG 3.58Å; I255-M265 HydrophobicContact CG2-SD 3.69Å
256	Q	91.1	Very high	91.5	Very high	99 Å²	99	31 Å²	31	46%	0.463	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.1	169.3	-159.4	171.5	15.5	0	0	108.4	G260 S261 W262	Q256-G260 PolarHBondContact NE2-O 2.99Å; Q256-S261 CarbonylContact C-O 3.5Å; Q256-S261 VanDerWaalsContact CA-O 3.29Å; Q256-S261 WeakPolarHBondContact CA-O 3.35Å; Q256-S261 WeakPolarHBondContact CG-O 3.37Å; Q256-W262 HydrophobicContact CB-CD2 4.13Å; Q256-W262 HydrophobicContact CB-CE3 4.1Å; Q256-W262 HydrophobicContact CB-CH2 3.98Å; Q256-W262 HydrophobicContact CB-CZ2 3.98Å; Q256-W262 HydrophobicContact CB-CZ3 4.04Å; Q256-W262 HydrophobicContact CG-CD2 4.2Å; Q256-W262 HydrophobicContact CG-CZ2 4.15Å
257	D	89.7	Confident	91.5	Very high	6 Å²	6	35.8 Å²	35.8	3%	0.032	19%	0.187	C	C	.	.			trans	-75.7	162.8	175.1	-81.1	-23	0	0	0	110.5	Q26 R32 D259 G260 S261	Q26-D257 PolarHBondContact NE2-OD2 2.85Å; R32-D257 IonicContact CZ-OD1 3.23Å; R32-D257 IonicContact CZ-OD2 2.78Å; R32-D257 IonicContact NH1-OD1 2.84Å; R32-D257 PolarHBondContact NH1-OD1 2.86Å; R32-D257 IonicContact NH1-OD2 3.51Å; R32-D257 PolarHBondContact NH1-OD2 2.98Å; R32-D257 IonicContact NH2-OD1 3.81Å; R32-D257 PolarHBondContact NH2-OD1 3.4Å; R32-D257 IonicContact NH2-OD2 3.95Å; R32-D257 PolarHBondContact NH2-OD2 3.24Å; D257-D259 WeakPolarHBondContact CB-OD1 3.36Å; D257-D259 PolarHBondContact O-N 2.93Å; D257-G260 PolarHBondContact O-N 2.86Å; D257-S261 PolarHBondContact N-O 2.84Å
258	P	87.7	Confident	91.4	Very high	75 Å²	75	39 Å²	39	49%	0.487	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-17.7	-177.9	-26	36.3	0	0	0	115.3	S27 G260	S27-P258 WeakPolarHBondContact O-CG 3.33Å; P258-G260 VanDerWaalsContact C-N 3.27Å
259	D	85.1	Confident	91.3	Very high	74 Å²	74	43.5 Å²	43.5	40%	0.396	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-1.3	172.5	58.4	25.7	0	0	0	113.7	Q26 D257 S261	Q26-D259 PolarHBondContact NE2-OD2 2.85Å; D257-D259 WeakPolarHBondContact CB-OD1 3.36Å; D257-D259 PolarHBondContact O-N 2.93Å; D259-S261 VanDerWaalsContact C-N 3.31Å; D259-S261 WeakPolarHBondContact OD1-CB 3.49Å; D259-S261 PolarHBondContact OD1-N 2.86Å; D259-S261 PolarHBondContact OD1-OG 2.93Å
260	G	86.2	Confident	91.3	Very high	36 Å²	36	43.6 Å²	43.6	37%	0.371	22%	0.224	S	C	.	.	S	Bend	trans	83.9	-2.8	-177.7	0	0	0	0	0	114.5	Q256 D257 P258	Q256-G260 PolarHBondContact NE2-O 2.99Å; D257-G260 PolarHBondContact O-N 2.86Å; P258-G260 VanDerWaalsContact C-N 3.27Å
261	S	89.1	Confident	91.2	Very high	52 Å²	52	48 Å²	48	36%	0.364	24%	0.244	S	C	.	.			trans	-73.3	158.6	175.5	76.3	0	0	0	0	111.9	Q256 D257 D259	Q256-S261 CarbonylContact C-O 3.5Å; Q256-S261 VanDerWaalsContact CA-O 3.29Å; Q256-S261 WeakPolarHBondContact CA-O 3.35Å; Q256-S261 WeakPolarHBondContact CG-O 3.37Å; D257-S261 PolarHBondContact N-O 2.84Å; D259-S261 VanDerWaalsContact C-N 3.31Å; D259-S261 WeakPolarHBondContact OD1-CB 3.49Å; D259-S261 PolarHBondContact OD1-N 2.86Å; D259-S261 PolarHBondContact OD1-OG 2.93Å
262	W	90.6	Very high	91.1	Very high	73 Å²	73	50.7 Å²	50.7	28%	0.277	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	108.5	-175.9	-79.6	92	0	0	0	112	H178 R203 W254 I255 Q256	H178-W262 HydrophobicContact CB-CH2 4.27Å; H178-W262 HydrophobicContact CB-CZ3 3.98Å; H178-W262 AromaticContact CD2-CH2 3.44Å; H178-W262 VanDerWaalsContact CD2-CH2 3.44Å; H178-W262 WeakPolarHBondContact CD2-CH2 3.43Å; H178-W262 AromaticContact CD2-CZ3 3.88Å; H178-W262 AromaticContact CG-CH2 3.74Å; H178-W262 AromaticContact CG-CZ3 3.96Å; H178-W262 AromaticContact NE2-CH2 3.83Å; R203-W262 VanDerWaalsContact CZ-CB 3.4Å; R203-W262 VanDerWaalsContact NH1-CB 3.34Å; W254-W262 HydrophobicContact CB-CE3 3.89Å; W254-W262 HydrophobicContact CB-CZ3 4.2Å; W254-W262 HydrophobicContact CE3-CB 4.43Å; I255-W262 CarbonylContact O-C 3.56Å; I255-W262 WeakPolarHBondContact O-CA 3.47Å; Q256-W262 HydrophobicContact CB-CD2 4.13Å; Q256-W262 HydrophobicContact CB-CE3 4.1Å; Q256-W262 HydrophobicContact CB-CH2 3.98Å; Q256-W262 HydrophobicContact CB-CZ2 3.98Å; Q256-W262 HydrophobicContact CB-CZ3 4.04Å; Q256-W262 HydrophobicContact CG-CD2 4.2Å; Q256-W262 HydrophobicContact CG-CZ2 4.15Å
263	F	89.5	Confident	91	Very high	39 Å²	39	50.7 Å²	50.7	17%	0.171	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	138.2	179.4	-168.5	-92.9	0	0	0	111.7	H37 W254 I255 M265	H37-F263 WeakPolarHBondContact O-CZ 3.39Å; W254-F263 CarbonylContact C-O 3.55Å; W254-F263 VanDerWaalsContact CA-O 3.28Å; W254-F263 WeakPolarHBondContact CA-O 3.4Å; I255-F263 HydrophobicContact CG2-CB 4.12Å; I255-F263 PolarHBondContact N-O 2.82Å; I255-F263 PolarHBondContact O-N 3.02Å; F263-M265 HydrophobicContact CD1-CG 4.17Å; F263-M265 PolarHBondContact O-N 2.88Å
264	A	91.1	Very high	91	Very high	36 Å²	36	53.2 Å²	53.2	30%	0.298	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	97.7	174.7	0	0	0	0	0	109.7	V252 W254	V252-A264 HydrophobicContact CG1-CB 3.75Å; W254-A264 HydrophobicContact CD2-CB 4.22Å; W254-A264 HydrophobicContact CE3-CB 3.79Å; W254-A264 HydrophobicContact CH2-CB 4.02Å; W254-A264 HydrophobicContact CZ2-CB 4.43Å; W254-A264 HydrophobicContact CZ3-CB 3.67Å
265	M	88.8	Confident	91	Very high	6 Å²	6	51 Å²	51	3%	0.03	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	-54.4	-175.7	-62.3	-164.6	-57.4	0	0	112	T33 S36 I142 T173 T177 E253 I255 F263	T33-M265 HydrophobicContact CG2-CB 4.05Å; T33-M265 HydrophobicContact CG2-CE 4.31Å; T33-M265 HydrophobicContact CG2-SD 4.36Å; T33-M265 PolarHBondContact OG1-O 3.33Å; S36-M265 WeakPolarHBondContact CB-O 3.39Å; I142-M265 HydrophobicContact CD1-CE 4.26Å; I142-M265 HydrophobicContact CD1-SD 4.26Å; T173-M265 HydrophobicContact CG2-CE 4.19Å; T177-M265 HydrophobicContact CG2-CE 3.46Å; T177-M265 VanDerWaalsContact CG2-CE 3.46Å; E253-M265 HydrophobicContact CG-CE 4.08Å; E253-M265 PolarHBondContact O-N 2.9Å; I255-M265 HydrophobicContact CB-CE 4.22Å; I255-M265 HydrophobicContact CB-CG 4.03Å; I255-M265 HydrophobicContact CB-SD 3.77Å; I255-M265 HydrophobicContact CD1-SD 3.99Å; I255-M265 HydrophobicContact CG1-SD 4.49Å; I255-M265 HydrophobicContact CG2-CG 3.58Å; I255-M265 HydrophobicContact CG2-SD 3.69Å; F263-M265 HydrophobicContact CD1-CG 4.17Å; F263-M265 PolarHBondContact O-N 2.88Å
266	T	90	Very high	90.8	Very high	12 Å²	12	56.5 Å²	56.5	7%	0.074	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	138.4	-176.8	-51.6	0	0	0	0	110.9	T33 D144 L146 V252 E253 K268	T33-T266 WeakPolarHBondContact CB-OG1 3.47Å; T33-T266 WeakPolarHBondContact CG2-OG1 3.48Å; T33-T266 PolarHBondContact OG1-OG1 3.3Å; D144-T266 WeakPolarHBondContact OD1-CG2 3.38Å; L146-T266 HydrophobicContact CB-CG2 4.02Å; L146-T266 HydrophobicContact CD2-CG2 3.89Å; V252-T266 CarbonylContact C-O 3.6Å; V252-T266 VanDerWaalsContact CA-O 3.31Å; V252-T266 WeakPolarHBondContact CA-O 3.37Å; E253-T266 PolarHBondContact N-O 3.18Å; T266-K268 HydrophobicContact CG2-CD 4.22Å; T266-K268 HydrophobicContact CG2-CG 4.28Å
267	R	92.4	Very high	90.5	Very high	141 Å²	141	52.8 Å²	52.8	53%	0.532	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	125.8	171.9	173.1	-176.8	-60.5	-84.3	-4.9	109.2	Q250 A251 V252	Q250-R267 VanDerWaalsContact CD-NH1 3.27Å; Q250-R267 HydrophobicContact CG-CG 4.35Å; A251-R267 WeakPolarHBondContact O-CA 3.31Å; V252-R267 HydrophobicContact CG2-CB 4.28Å; V252-R267 HydrophobicContact CG2-CG 4.13Å
268	K	92.7	Very high	89.8	Confident	68 Å²	68	57.8 Å²	57.8	30%	0.296	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	150.4	177	-82.9	169.4	172.6	162.9	0	111	D144 L146 V148 Q250 A251 T266	D144-K268 IonicContact OD1-NZ 3.58Å; D144-K268 PolarHBondContact OD1-NZ 2.83Å; D144-K268 WeakPolarHBondContact OD2-CE 3.46Å; D144-K268 IonicContact OD2-NZ 3.15Å; D144-K268 PolarHBondContact OD2-NZ 3.14Å; L146-K268 HydrophobicContact CB-CD 4.17Å; L146-K268 HydrophobicContact CD2-CB 4.22Å; L146-K268 HydrophobicContact CD2-CD 4.46Å; L146-K268 HydrophobicContact CG-CD 4.24Å; L146-K268 WeakPolarHBondContact O-CD 3.28Å; L146-K268 WeakPolarHBondContact O-CE 3.17Å; L146-K268 PolarHBondContact O-NZ 2.99Å; V148-K268 HydrophobicContact CB-CB 4.1Å; V148-K268 HydrophobicContact CG2-CB 3.59Å; Q250-K268 WeakPolarHBondContact CA-O 3.42Å; A251-K268 PolarHBondContact N-O 2.89Å; A251-K268 PolarHBondContact O-N 3.21Å; T266-K268 HydrophobicContact CG2-CD 4.22Å; T266-K268 HydrophobicContact CG2-CG 4.28Å
269	Q	94.1	Very high	88.7	Confident	100 Å²	100	59.5 Å²	59.5	47%	0.467	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	151.2	178.4	67.4	-179.4	-7	0	0	109.7	Y248 C249	Y248-Q269 HydrophobicContact CD2-CB 4.06Å; Y248-Q269 HydrophobicContact CE2-CB 4.19Å; C249-Q269 CarbonylContact O-C 3.59Å; C249-Q269 WeakPolarHBondContact O-CA 3.48Å
270	S	95.6	Very high	87.4	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.021	29%	0.294	C	S	.	.			trans	-77	171.4	170.1	71.1	0	0	0	0	112	C249	C249-S270 PolarHBondContact N-OG 3.06Å; C249-S270 PolarHBondContact O-N 3.44Å; C249-S270 PolarHBondContact O-OG 2.96Å
271	E	93.3	Very high	85.9	Confident	123 Å²	123	62.2 Å²	62.2	58%	0.575	31%	0.305	S	S	*	.			trans	-60.7	162.2	156.6	-70.8	-52	141.6	0	0	112.2	P152	P152-E271 HydrophobicContact CB-CB 4.05Å; P152-E271 HydrophobicContact CG-CB 4.16Å
272	K	92.8	Very high	84.6	Confident	57 Å²	57	67.2 Å²	67.2	25%	0.248	32%	0.316	C	S	.	.			trans	-105.7	134.6	-168	-51.4	-173.6	171.7	51.5	0	111	L246 L247 Y248	L246-K272 HydrophobicContact CB-CB 4.38Å; L246-K272 HydrophobicContact CB-CD 4.45Å; L246-K272 HydrophobicContact CD1-CD 4.45Å; L247-K272 WeakPolarHBondContact O-CA 3.41Å; Y248-K272 HydrophobicContact CD1-CD 4.48Å; Y248-K272 HydrophobicContact CG-CG 4.42Å
273	T	92.9	Very high	83.6	Confident	5 Å²	5	68.7 Å²	68.7	3%	0.031	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.1	171.4	-73.8	0	0	0	0	109.8	P151 Q153 L155 L165 L246 L247	P151-T273 PolarHBondContact O-OG1 2.92Å; Q153-T273 HydrophobicContact CB-CG2 4.07Å; Q153-T273 CarbonylContact O-C 3.55Å; Q153-T273 VanDerWaalsContact O-CA 3.31Å; Q153-T273 WeakPolarHBondContact O-CA 3.45Å; L155-T273 HydrophobicContact CD1-CG2 3.97Å; L155-T273 HydrophobicContact CG-CG2 4.29Å; L165-T273 HydrophobicContact CD1-CG2 4.15Å; L165-T273 HydrophobicContact CD2-CG2 4Å; L246-T273 CarbonylContact C-O 3.53Å; L246-T273 WeakPolarHBondContact CA-O 3.05Å; L247-T273 PolarHBondContact N-O 2.84Å; L247-T273 PolarHBondContact O-N 3.28Å
274	Q	92.7	Very high	83.1	Confident	53 Å²	53	67.3 Å²	67.3	25%	0.248	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	116.1	172.9	-177.5	175.6	44.5	0	0	109.9	Q153 T154 L155 G245 L246	Q153-Q274 PolarHBondContact O-N 2.88Å; T154-Q274 CarbonylContact C-O 3.46Å; T154-Q274 WeakPolarHBondContact CA-O 3.25Å; T154-Q274 HydrophobicContact CG2-CB 4.36Å; T154-Q274 HydrophobicContact CG2-CG 4.48Å; L155-Q274 PolarHBondContact N-O 3.34Å; G245-Q274 WeakPolarHBondContact O-CA 3.5Å; L246-Q274 HydrophobicContact CD2-CB 3.96Å; L246-Q274 HydrophobicContact CD2-CG 4.31Å
275	L	93	Very high	82.6	Confident	2 Å²	2	68 Å²	68	1%	0.01	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	135.7	170	-172.6	68.5	0	0	0	110.2	L155 K157 L163 L239 D243 Q244 G245 L247 I277	L155-L275 HydrophobicContact CB-CD1 3.94Å; L155-L275 CarbonylContact O-C 3.59Å; K157-L275 HydrophobicContact CB-CD1 4.35Å; K157-L275 HydrophobicContact CG-CD1 4.04Å; L163-L275 HydrophobicContact CD1-CD1 4.38Å; L163-L275 HydrophobicContact CD2-CD1 4.27Å; L163-L275 HydrophobicContact CD2-CD2 3.91Å; L239-L275 HydrophobicContact CD1-CD1 4.42Å; L239-L275 HydrophobicContact CD1-CD2 4.37Å; L239-L275 HydrophobicContact CD2-CD2 3.88Å; D243-L275 HydrophobicContact CB-CD2 4.16Å; D243-L275 WeakPolarHBondContact O-CD2 3.31Å; Q244-L275 WeakPolarHBondContact CG-O 3.46Å; G245-L275 PolarHBondContact N-O 3.24Å; G245-L275 PolarHBondContact O-N 2.84Å; L247-L275 HydrophobicContact CD1-CB 4.49Å; L247-L275 HydrophobicContact CD1-CD2 4.39Å; L275-I277 HydrophobicContact CD2-CD1 4.02Å; L275-I277 HydrophobicContact CD2-CG1 4.2Å; L275-I277 HydrophobicContact CG-CG1 4.21Å
276	R	87.9	Confident	82.7	Confident	127 Å²	127	68.8 Å²	68.8	48%	0.479	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	143.3	165.5	-70.5	-174.5	174.2	108.6	-4.3	110	L155 S156 K157	L155-R276 PolarHBondContact O-N 2.94Å; S156-R276 WeakPolarHBondContact CA-O 3.27Å; K157-R276 PolarHBondContact N-O 3.34Å
277	I	85.9	Confident	82.5	Confident	21 Å²	21	73.1 Å²	73.1	11%	0.108	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126	-177.1	-59.1	173.8	0	0	0	109.6	K157 E159 L239 Q240 D243 Q244 L275	K157-I277 CarbonylContact O-C 3.58Å; K157-I277 WeakPolarHBondContact O-CA 3.11Å; E159-I277 HydrophobicContact CB-CG2 4.26Å; L239-I277 HydrophobicContact CB-CD1 4.24Å; L239-I277 HydrophobicContact CD2-CD1 4.42Å; Q240-I277 WeakPolarHBondContact O-CD1 3.32Å; D243-I277 HydrophobicContact CB-CD1 4.01Å; Q244-I277 HydrophobicContact CB-CD1 4.43Å; L275-I277 HydrophobicContact CD2-CD1 4.02Å; L275-I277 HydrophobicContact CD2-CG1 4.2Å; L275-I277 HydrophobicContact CG-CG1 4.21Å
278	Q	74.4	Confident	82.4	Confident	110 Å²	110	67.8 Å²	67.8	51%	0.514	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	137.1	178.1	-59.9	-173.2	20.8	0	0	110.5	S156 K157 V158 E159	S156-Q278 PolarHBondContact OG-NE2 2.91Å; K157-Q278 PolarHBondContact O-N 3.1Å; V158-Q278 WeakPolarHBondContact CA-O 3.49Å; E159-Q278 PolarHBondContact N-O 2.81Å
279	P	65.3	Low	82.1	Confident	112 Å²	112	67.4 Å²	67.4	73%	0.727	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-72.9	148.3	174.6	31.5	-34.9	0	0	0	111.5
280	T	57.9	Low	81.8	Confident	55 Å²	55	64.4 Å²	64.4	34%	0.337	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-84.8	127.2	-170.1	-45.7	0	0	0	0	113.2	V158	V158-T280 HydrophobicContact CG1-CG2 4.34Å; V158-T280 WeakPolarHBondContact CG1-OG1 3.23Å
281	D	53.6	Low	81.2	Confident	112 Å²	112	71.8 Å²	71.8	60%	0.599	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-85.5	145.9	169.6	-171.3	8.5	0	0	0	110.8
282	R	61.8	Low	80.8	Confident	157 Å²	157	73 Å²	73	59%	0.592	36%	0.36	S	S	*	.			trans	-113.9	-8.9	-164.7	-71.9	-175.9	167.1	-139.1	2.2	115.4	R315 E385	R282-R315 PolarHBondContact O-NH1 2.92Å; R282-R315 PolarHBondContact O-NH2 2.78Å; R282-E385 IonicContact CZ-OE1 3.41Å; R282-E385 IonicContact NH1-OE1 3.98Å; R282-E385 PolarHBondContact NH1-OE1 2.72Å
283	D	68.9	Low	80.4	Confident	104 Å²	104	77.3 Å²	77.3	56%	0.556	38%	0.375	S	S	*	.			trans	-72.5	166.3	-177.9	-158.5	32.4	0	0	0	113.9	K397	D283-K397 WeakPolarHBondContact OD1-CE 3.07Å; D283-K397 IonicContact OD1-NZ 2.68Å; D283-K397 PolarHBondContact OD1-NZ 3.34Å; D283-K397 IonicContact OD2-NZ 2.7Å; D283-K397 PolarHBondContact OD2-NZ 2.92Å
284	F	79.5	Confident	80	Confident	10 Å²	10	79.8 Å²	79.8	4%	0.044	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	152.1	176.3	70.1	-92.5	0	0	0	114.9	I286 I307 E308 A309 F317 V381 E383 K397	F284-I286 HydrophobicContact CD2-CG1 4.4Å; F284-I286 HydrophobicContact CE2-CD1 4.42Å; F284-I286 HydrophobicContact CE2-CG1 4.3Å; F284-I307 HydrophobicContact CD2-CG2 4.47Å; F284-E308 CarbonylContact C-O 3.59Å; F284-E308 VanDerWaalsContact CA-O 3.28Å; F284-E308 WeakPolarHBondContact CA-O 3.3Å; F284-A309 HydrophobicContact CB-CB 3.55Å; F284-F317 HydrophobicContact CD1-CE1 4.05Å; F284-F317 HydrophobicContact CD2-CE1 4.22Å; F284-F317 HydrophobicContact CE1-CE1 4.08Å; F284-F317 HydrophobicContact CE2-CE1 4.26Å; F284-F317 HydrophobicContact CG-CE1 4.12Å; F284-F317 HydrophobicContact CG-CZ 4.48Å; F284-F317 HydrophobicContact CZ-CE1 4.19Å; F284-V381 HydrophobicContact CE2-CB 4.34Å; F284-V381 HydrophobicContact CE2-CG1 4.19Å; F284-E383 HydrophobicContact CE1-CB 3.99Å; F284-E383 WeakPolarHBondContact CE1-OE2 3.44Å; F284-E383 HydrophobicContact CZ-CB 4.27Å; F284-K397 HydrophobicContact CD2-CD 4.3Å; F284-K397 HydrophobicContact CE2-CB 4.02Å; F284-K397 HydrophobicContact CE2-CD 4.06Å; F284-K397 HydrophobicContact CE2-CG 4.17Å; F284-K397 HydrophobicContact CZ-CB 4.33Å; F284-K397 HydrophobicContact CZ-CD 4.28Å; F284-K397 HydrophobicContact CZ-CG 4.15Å; F284-K397 WeakPolarHBondContact O-CD 3.46Å; F284-K397 WeakPolarHBondContact O-CE 3.45Å; F284-K397 PolarHBondContact O-NZ 3.08Å
285	S	81.8	Confident	79.6	Confident	50 Å²	50	78 Å²	78	35%	0.35	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	159.9	176.5	159.8	0	0	0	0	111.9	E308	S285-E308 WeakPolarHBondContact CB-OE2 3.49Å; S285-E308 PolarHBondContact N-O 2.82Å; S285-E308 PolarHBondContact O-N 2.82Å; S285-E308 PolarHBondContact OG-OE2 2.92Å
286	I	89.6	Confident	78.9	Confident	22 Å²	22	80.7 Å²	80.7	11%	0.113	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	120.9	176.8	-51.5	166.5	0	0	0	109.3	F284 C379 V381 K397	F284-I286 HydrophobicContact CD2-CG1 4.4Å; F284-I286 HydrophobicContact CE2-CD1 4.42Å; F284-I286 HydrophobicContact CE2-CG1 4.3Å; I286-C379 HydrophobicContact CG2-CB 4.49Å; I286-V381 HydrophobicContact CD1-CB 3.67Å; I286-V381 HydrophobicContact CD1-CG2 3.7Å; I286-V381 HydrophobicContact CG1-CB 4.07Å; I286-V381 HydrophobicContact CG1-CG2 3.84Å; I286-V381 HydrophobicContact CG2-CG2 4Å; I286-K397 HydrophobicContact CD1-CB 3.52Å; I286-K397 VanDerWaalsContact CD1-O 3.28Å; I286-K397 WeakPolarHBondContact CD1-O 3.06Å; I286-K397 HydrophobicContact CG1-CB 4.41Å
287	Q	86.9	Confident	78.3	Confident	104 Å²	104	75.8 Å²	75.8	49%	0.486	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	149.8	170.9	-56.5	-161.1	23.4	0	0	111.1	C305 T306 E308	Q287-C305 WeakPolarHBondContact O-CA 3.33Å; Q287-T306 PolarHBondContact N-O 3.48Å; Q287-T306 PolarHBondContact O-N 2.74Å; Q287-E308 WeakPolarHBondContact CG-OE2 3.42Å; Q287-E308 PolarHBondContact NE2-OE1 2.82Å; Q287-E308 PolarHBondContact NE2-OE2 2.85Å
288	V	89.6	Confident	77.7	Confident	29 Å²	29	76.6 Å²	76.6	18%	0.176	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.3	171.8	-178.5	0	0	0	0	109.5	L303 R304 C305 W321 C379 S399 V402	V288-L303 HydrophobicContact CG1-CD2 4.35Å; V288-R304 CarbonylContact C-O 3.47Å; V288-R304 VanDerWaalsContact CA-O 3.25Å; V288-R304 WeakPolarHBondContact CA-O 3.3Å; V288-C305 HydrophobicContact CG2-CB 4.19Å; V288-W321 HydrophobicContact CG1-CH2 4.25Å; V288-W321 HydrophobicContact CG1-CZ3 4.09Å; V288-C379 HydrophobicContact CG2-CB 3.4Å; V288-C379 VanDerWaalsContact CG2-CB 3.4Å; V288-S399 VanDerWaalsContact CG2-CB 3.49Å; V288-V402 HydrophobicContact CB-CG2 4.07Å; V288-V402 HydrophobicContact CG1-CG2 3.79Å
289	S	86.8	Confident	78	Confident	60 Å²	60	75.2 Å²	75.2	42%	0.42	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	159.9	179.1	61.8	0	0	0	0	112.3	R304	S289-R304 PolarHBondContact N-O 3.04Å; S289-R304 PolarHBondContact O-N 2.76Å
290	T	88.4	Confident	78.9	Confident	37 Å²	37	72.5 Å²	72.5	23%	0.227	37%	0.374	C	S	.	.			trans	-158.2	156	173.9	-178.2	0	0	0	0	107.7	R292 E302 L303 V402 I404	T290-R292 VanDerWaalsContact CG2-O 3.23Å; T290-R292 WeakPolarHBondContact CG2-O 3.46Å; T290-R292 PolarHBondContact OG1-O 3.03Å; T290-E302 VanDerWaalsContact CB-O 3.25Å; T290-E302 WeakPolarHBondContact CB-O 3.48Å; T290-E302 PolarHBondContact OG1-O 3.18Å; T290-L303 HydrophobicContact CG2-CD2 4.31Å; T290-V402 HydrophobicContact CG2-CG1 4.17Å; T290-I404 HydrophobicContact CG2-CD1 4.24Å
291	E	82.5	Confident	80.4	Confident	157 Å²	157	69.9 Å²	69.9	73%	0.734	36%	0.358	S	S	*	.	S	Bend	trans	-66.2	-40.6	-178.1	-166	-159.5	137.5	0	0	112
292	R	83.6	Confident	82.2	Confident	149 Å²	149	67.2 Å²	67.2	56%	0.562	34%	0.342	S	S	*	.			trans	-141	164.2	-172.1	-55.4	-175.3	-165.4	-176.5	6.7	110.9	T290 F295	T290-R292 VanDerWaalsContact CG2-O 3.23Å; T290-R292 WeakPolarHBondContact CG2-O 3.46Å; T290-R292 PolarHBondContact OG1-O 3.03Å; R292-F295 HydrophobicContact CB-CE1 4.4Å; R292-F295 HydrophobicContact CB-CE2 4.31Å; R292-F295 HydrophobicContact CB-CZ 3.96Å; R292-F295 WeakPolarHBondContact O-CE2 3.34Å
293	R	84.3	Confident	83.7	Confident	148 Å²	148	59.8 Å²	59.8	56%	0.558	31%	0.314	S	S	*	.	S	Bend	trans	-120.2	-13	179.4	-65.9	178.3	-178.4	-99.5	2	114.3	I404 T405	R293-I404 WeakPolarHBondContact O-CA 3.48Å; R293-T405 PolarHBondContact O-N 3.21Å
294	S	85	Confident	84.8	Confident	56 Å²	56	58 Å²	58	39%	0.392	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	134.2	171.5	-174.2	0	0	0	0	108.2	T405 Q407	S294-T405 WeakPolarHBondContact CA-O 3.22Å; S294-Q407 PolarHBondContact OG-NE2 3.19Å
295	F	85.3	Confident	85.4	Confident	16 Å²	16	57.5 Å²	57.5	7%	0.07	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	162.6	-179.4	-65.3	-95.1	0	0	0	109.8	R292 E299 L301 L369 I404 T405 V406 Q407	R292-F295 HydrophobicContact CB-CE1 4.4Å; R292-F295 HydrophobicContact CB-CE2 4.31Å; R292-F295 HydrophobicContact CB-CZ 3.96Å; R292-F295 WeakPolarHBondContact O-CE2 3.34Å; F295-E299 WeakPolarHBondContact CA-OE2 3.35Å; F295-E299 HydrophobicContact CB-CB 4.47Å; F295-E299 WeakPolarHBondContact CB-OE2 3.5Å; F295-E299 HydrophobicContact CD1-CB 4.31Å; F295-L301 HydrophobicContact CE1-CD1 4.49Å; F295-L301 HydrophobicContact CE2-CD1 3.65Å; F295-L301 HydrophobicContact CZ-CD1 3.6Å; F295-L369 HydrophobicContact CB-CD1 3.63Å; F295-L369 HydrophobicContact CD1-CD1 3.95Å; F295-L369 HydrophobicContact CD2-CD1 4.37Å; F295-L369 HydrophobicContact CG-CD1 3.73Å; F295-I404 HydrophobicContact CD2-CG2 3.81Å; F295-I404 HydrophobicContact CE2-CD1 4.29Å; F295-I404 HydrophobicContact CE2-CG2 4.08Å; F295-T405 PolarHBondContact N-O 3Å; F295-V406 CarbonylContact O-C 3.52Å; F295-V406 WeakPolarHBondContact O-CA 3.47Å; F295-Q407 PolarHBondContact O-N 2.94Å
296	M	78.6	Confident	85.8	Confident	59 Å²	59	56.7 Å²	56.7	29%	0.291	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	152.9	167.3	-60	-58.7	-58.2	0	0	110.4	G298 E299 Q407 P408 L409	M296-G298 PolarHBondContact O-N 3.2Å; M296-E299 HydrophobicContact CB-CG 4.04Å; M296-E299 PolarHBondContact N-OE2 2.84Å; M296-E299 WeakPolarHBondContact O-CB 3.43Å; M296-E299 PolarHBondContact O-N 2.86Å; M296-E299 VanDerWaalsContact O-N 3.13Å; M296-Q407 CarbonylContact C-O 3.53Å; M296-Q407 WeakPolarHBondContact CA-O 3.47Å; M296-Q407 HydrophobicContact CE-CB 4.25Å; M296-Q407 HydrophobicContact SD-CB 3.92Å; M296-P408 VanDerWaalsContact CE-O 3.27Å; M296-P408 WeakPolarHBondContact CE-O 3.49Å; M296-L409 HydrophobicContact CB-CD1 4.13Å; M296-L409 HydrophobicContact CE-CD1 4.25Å
297	A	75.6	Confident	85.7	Confident	24 Å²	24	55.8 Å²	55.8	20%	0.198	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	136.2	171.4	0	0	0	0	0	110.7	L369 V406 Q407 L409	A297-L369 CarbonylContact C-O 3.59Å; A297-L369 WeakPolarHBondContact CA-O 3.4Å; A297-V406 HydrophobicContact CB-CG1 4.39Å; A297-Q407 PolarHBondContact N-O 2.98Å; A297-L409 HydrophobicContact CB-CD1 4.32Å; A297-L409 WeakPolarHBondContact O-CD1 3.26Å
298	G	72.8	Confident	85.6	Confident	38 Å²	38	54.7 Å²	54.7	39%	0.392	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.4	-14.6	-174.7	0	0	0	0	0	115.7	M296 L369	M296-G298 PolarHBondContact O-N 3.2Å; G298-L369 PolarHBondContact N-O 3.17Å
299	E	80.7	Confident	84.9	Confident	80 Å²	80	54.8 Å²	54.8	37%	0.374	28%	0.284	S	S	.	.			trans	-69.4	179.2	173.9	-68.1	-174.5	152.9	0	0	112.4	F295 M296 R368 L369	F295-E299 WeakPolarHBondContact CA-OE2 3.35Å; F295-E299 HydrophobicContact CB-CB 4.47Å; F295-E299 WeakPolarHBondContact CB-OE2 3.5Å; F295-E299 HydrophobicContact CD1-CB 4.31Å; M296-E299 HydrophobicContact CB-CG 4.04Å; M296-E299 PolarHBondContact N-OE2 2.84Å; M296-E299 WeakPolarHBondContact O-CB 3.43Å; M296-E299 PolarHBondContact O-N 2.86Å; M296-E299 VanDerWaalsContact O-N 3.13Å; E299-R368 PolarHBondContact O-N 2.04Å; E299-R368 VanDerWaalsContact O-N 3.15Å; E299-L369 HydrophobicContact CB-CD1 4.4Å; E299-L369 WeakPolarHBondContact O-CG 3.46Å; E299-L369 PolarHBondContact O-N 3.28Å
300	S	84.7	Confident	84	Confident	55 Å²	55	56 Å²	56	39%	0.385	28%	0.283	S	S	.	.			trans	-119.2	131.6	176.7	-57.4	0	0	0	0	111.8	L366 H367	S300-L366 CarbonylContact C-O 3.45Å; S300-L366 WeakPolarHBondContact CA-O 3.38Å; S300-L366 WeakPolarHBondContact CB-O 3.44Å; S300-H367 PolarHBondContact OG-ND1 2.88Å
301	L	89.2	Confident	83.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	133.4	173.9	171.7	62.9	0	0	0	109.8	F295 L303 K365 L366 L369 Y377 I404	F295-L301 HydrophobicContact CE1-CD1 4.49Å; F295-L301 HydrophobicContact CE2-CD1 3.65Å; F295-L301 HydrophobicContact CZ-CD1 3.6Å; L301-L303 HydrophobicContact CD1-CD2 4.41Å; L301-L303 HydrophobicContact CD1-CG 4.13Å; L301-L303 HydrophobicContact CD2-CD1 3.88Å; L301-L303 HydrophobicContact CD2-CG 4.15Å; L301-L303 HydrophobicContact CG-CD1 4.3Å; L301-L303 HydrophobicContact CG-CG 4.07Å; L301-K365 CarbonylContact O-C 3.5Å; L301-K365 VanDerWaalsContact O-CA 3.26Å; L301-K365 WeakPolarHBondContact O-CA 3.46Å; L301-K365 WeakPolarHBondContact O-CG 3.44Å; L301-L366 HydrophobicContact CD2-CD1 4.24Å; L301-L366 PolarHBondContact N-O 2.99Å; L301-L366 PolarHBondContact O-N 2.67Å; L301-L369 HydrophobicContact CB-CD1 3.95Å; L301-L369 HydrophobicContact CB-CD2 3.84Å; L301-L369 HydrophobicContact CB-CG 4.31Å; L301-Y377 HydrophobicContact CD2-CD2 4.45Å; L301-Y377 HydrophobicContact CD2-CE1 4.45Å; L301-Y377 HydrophobicContact CD2-CE2 3.86Å; L301-I404 HydrophobicContact CD1-CD1 3.91Å; L301-I404 HydrophobicContact CD1-CG1 4.34Å; L301-I404 HydrophobicContact CD2-CG1 4.05Å; L301-I404 HydrophobicContact CD2-CG2 4.31Å
302	E	91.6	Very high	82.6	Confident	57 Å²	57	51 Å²	51	27%	0.266	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.3	164.3	-167.6	173.2	124	0	0	110.1	T290 R304 K365	T290-E302 VanDerWaalsContact CB-O 3.25Å; T290-E302 WeakPolarHBondContact CB-O 3.48Å; T290-E302 PolarHBondContact OG1-O 3.18Å; E302-R304 IonicContact OE1-NH2 3.71Å; E302-K365 HydrophobicContact CB-CG 4.24Å; E302-K365 HydrophobicContact CG-CB 4.47Å; E302-K365 HydrophobicContact CG-CD 4.45Å; E302-K365 HydrophobicContact CG-CG 4.38Å; E302-K365 WeakPolarHBondContact OE2-CD 3.39Å; E302-K365 WeakPolarHBondContact OE2-CE 3.37Å; E302-K365 IonicContact OE2-NZ 3.45Å; E302-K365 PolarHBondContact OE2-NZ 2.83Å
303	L	91.7	Very high	82	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	127.9	177.5	-72.9	162.5	0	0	0	109.3	V288 T290 L301 W321 L363 L364 Y377 V402	V288-L303 HydrophobicContact CG1-CD2 4.35Å; T290-L303 HydrophobicContact CG2-CD2 4.31Å; L301-L303 HydrophobicContact CD1-CD2 4.41Å; L301-L303 HydrophobicContact CD1-CG 4.13Å; L301-L303 HydrophobicContact CD2-CD1 3.88Å; L301-L303 HydrophobicContact CD2-CG 4.15Å; L301-L303 HydrophobicContact CG-CD1 4.3Å; L301-L303 HydrophobicContact CG-CG 4.07Å; L303-W321 HydrophobicContact CB-CH2 3.64Å; L303-W321 HydrophobicContact CB-CZ2 4.43Å; L303-W321 HydrophobicContact CB-CZ3 3.78Å; L303-W321 HydrophobicContact CD1-CZ3 4.39Å; L303-L363 WeakPolarHBondContact O-CA 3.44Å; L303-L364 HydrophobicContact CB-CB 4.43Å; L303-L364 HydrophobicContact CD1-CD2 4.05Å; L303-L364 PolarHBondContact N-O 2.94Å; L303-L364 PolarHBondContact O-N 2.9Å; L303-Y377 HydrophobicContact CD1-CD1 3.42Å; L303-Y377 VanDerWaalsContact CD1-CD1 3.42Å; L303-Y377 HydrophobicContact CD1-CD2 4.14Å; L303-Y377 HydrophobicContact CD1-CE1 3.99Å; L303-Y377 HydrophobicContact CD1-CG 3.49Å; L303-Y377 VanDerWaalsContact CD1-CG 3.49Å; L303-V402 HydrophobicContact CD2-CG1 4.16Å
304	R	92.4	Very high	81.3	Confident	67 Å²	67	48.7 Å²	48.7	25%	0.253	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	115.6	-175.7	176.5	173.7	-67	-92	-13.8	110	V288 S289 E302 E357 I361 L363	V288-R304 CarbonylContact C-O 3.47Å; V288-R304 VanDerWaalsContact CA-O 3.25Å; V288-R304 WeakPolarHBondContact CA-O 3.3Å; S289-R304 PolarHBondContact N-O 3.04Å; S289-R304 PolarHBondContact O-N 2.76Å; E302-R304 IonicContact OE1-NH2 3.71Å; R304-E357 IonicContact CZ-OE2 3.6Å; R304-E357 IonicContact NH1-OE2 3.76Å; R304-E357 PolarHBondContact NH1-OE2 2.92Å; R304-E357 IonicContact NH2-OE2 2.72Å; R304-E357 PolarHBondContact NH2-OE2 3Å; R304-I361 HydrophobicContact CG-CG2 3.99Å; R304-L363 HydrophobicContact CB-CD2 3.68Å; R304-L363 HydrophobicContact CG-CD2 3.7Å
305	C	91.8	Very high	81	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	122.4	174.6	-173.8	0	0	0	0	110.1	Q287 V288 W321 I361 H362 C379	Q287-C305 WeakPolarHBondContact O-CA 3.33Å; V288-C305 HydrophobicContact CG2-CB 4.19Å; C305-W321 HydrophobicContact CB-CH2 3.55Å; C305-W321 HydrophobicContact CB-CZ2 3.61Å; C305-W321 HydrophobicContact CB-CZ3 4.36Å; C305-I361 WeakPolarHBondContact O-CA 3.47Å; C305-H362 PolarHBondContact N-O 2.68Å; C305-H362 PolarHBondContact O-N 2.87Å; C305-C379 HydrophobicContact CB-CB 3.74Å; C305-C379 WeakPolarHBondContact CB-SG 3.4Å; C305-C379 WeakPolarHBondContact SG-CB 3.41Å; C305-C379 CovalentContact SG-SG 2.04Å; C305-C379 PolarHBondContact SG-SG 2.87Å
306	T	90.1	Very high	80.8	Confident	32 Å²	32	53.2 Å²	53.2	20%	0.196	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.4	-177.2	-54.9	0	0	0	0	110	Q287 E308 N360 I361	Q287-T306 PolarHBondContact N-O 3.48Å; Q287-T306 PolarHBondContact O-N 2.74Å; T306-E308 HydrophobicContact CG2-CG 4.47Å; T306-N360 WeakPolarHBondContact CA-O 3.34Å; T306-I361 HydrophobicContact CG2-CG1 4.45Å
307	I	88.9	Confident	81.1	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.015	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	127.6	174.1	-53.5	172.1	0	0	0	108.3	F284 F317 V319 N360 V381	F284-I307 HydrophobicContact CD2-CG2 4.47Å; I307-F317 HydrophobicContact CD1-CB 3.76Å; I307-F317 HydrophobicContact CD1-CD1 4.31Å; I307-F317 HydrophobicContact CD1-CD2 4.22Å; I307-F317 HydrophobicContact CD1-CG 3.85Å; I307-F317 HydrophobicContact CG2-CD1 4.43Å; I307-F317 HydrophobicContact CG2-CD2 4.43Å; I307-F317 HydrophobicContact CG2-CE1 4.17Å; I307-F317 HydrophobicContact CG2-CE2 4.17Å; I307-F317 HydrophobicContact CG2-CZ 4.04Å; I307-V319 HydrophobicContact CD1-CG2 4.08Å; I307-N360 PolarHBondContact N-O 3.46Å; I307-V381 HydrophobicContact CD1-CG1 3.74Å; I307-V381 HydrophobicContact CD1-CG2 4.4Å; I307-V381 HydrophobicContact CG1-CG1 4.13Å; I307-V381 HydrophobicContact CG1-CG2 4.14Å
308	E	83.9	Confident	81.7	Confident	81 Å²	81	50.4 Å²	50.4	38%	0.379	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	103	179.9	-64.7	176.2	134.4	0	0	108.9	F284 S285 Q287 T306	F284-E308 CarbonylContact C-O 3.59Å; F284-E308 VanDerWaalsContact CA-O 3.28Å; F284-E308 WeakPolarHBondContact CA-O 3.3Å; S285-E308 WeakPolarHBondContact CB-OE2 3.49Å; S285-E308 PolarHBondContact N-O 2.82Å; S285-E308 PolarHBondContact O-N 2.82Å; S285-E308 PolarHBondContact OG-OE2 2.92Å; Q287-E308 WeakPolarHBondContact CG-OE2 3.42Å; Q287-E308 PolarHBondContact NE2-OE1 2.82Å; Q287-E308 PolarHBondContact NE2-OE2 2.85Å; T306-E308 HydrophobicContact CG2-CG 4.47Å
309	A	75.3	Confident	82.5	Confident	31 Å²	31	48.6 Å²	48.6	26%	0.256	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	163.7	-179.9	0	0	0	0	0	111.2	F284 V312 F317	F284-A309 HydrophobicContact CB-CB 3.55Å; A309-V312 HydrophobicContact CB-CG2 3.84Å; A309-V312 WeakPolarHBondContact O-CG2 3.28Å; A309-F317 HydrophobicContact CB-CZ 4.29Å
310	Q	68	Low	83	Confident	86 Å²	86	46 Å²	46	40%	0.402	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	145	164.4	-60.9	-174.6	9.6	0	0	110.4	V312 R315	Q310-V312 VanDerWaalsContact C-N 3.34Å; Q310-V312 PolarHBondContact O-N 2.79Å; Q310-R315 VanDerWaalsContact O-CD 3.26Å; Q310-R315 WeakPolarHBondContact O-CD 3.39Å; Q310-R315 PolarHBondContact O-NH1 2.83Å
311	N	68.8	Low	83.4	Confident	75 Å²	75	43.4 Å²	43.4	40%	0.401	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	47	42.3	177.4	-64	15.9	0	0	0	116.1	P313 E314	N311-P313 VanDerWaalsContact C-N 3.31Å; N311-P313 VanDerWaalsContact O-N 3.15Å; N311-E314 PolarHBondContact ND2-OE2 3.23Å; N311-E314 VanDerWaalsContact ND2-OE2 3.08Å; N311-E314 PolarHBondContact O-N 3.34Å
312	V	73	Confident	83.5	Confident	14 Å²	14	43.6 Å²	43.6	9%	0.085	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-47.5	-40.3	177.7	-179.6	0	0	0	0	114.9	A309 Q310 E314 R315 F317 P359 N360	A309-V312 HydrophobicContact CB-CG2 3.84Å; A309-V312 WeakPolarHBondContact O-CG2 3.28Å; Q310-V312 VanDerWaalsContact C-N 3.34Å; Q310-V312 PolarHBondContact O-N 2.79Å; V312-E314 PolarHBondContact O-N 3.17Å; V312-R315 PolarHBondContact O-N 3.33Å; V312-F317 HydrophobicContact CB-CE2 4.38Å; V312-F317 HydrophobicContact CG1-CD2 3.96Å; V312-F317 HydrophobicContact CG1-CE2 3.93Å; V312-F317 HydrophobicContact CG2-CE2 4.33Å; V312-P359 HydrophobicContact CG1-CB 4Å; V312-P359 WeakPolarHBondContact CG1-O 3.33Å; V312-N360 HydrophobicContact CG1-CB 3.98Å; V312-N360 HydrophobicContact CG2-CB 4.44Å
313	P	70.6	Confident	83.4	Confident	105 Å²	105	42.1 Å²	42.1	68%	0.682	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-62.7	-21.6	179.5	-23.9	35.8	0	0	0	115	N311 P359	N311-P313 VanDerWaalsContact C-N 3.31Å; N311-P313 VanDerWaalsContact O-N 3.15Å; P313-P359 HydrophobicContact CG-CB 4.35Å; P313-P359 HydrophobicContact CG-CG 4.36Å
314	E	69.8	Low	83	Confident	143 Å²	143	44.8 Å²	44.8	67%	0.668	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-97.7	-1.7	-177.8	-56.3	-177.3	143.3	0	0	112.4	N311 V312	N311-E314 PolarHBondContact ND2-OE2 3.23Å; N311-E314 VanDerWaalsContact ND2-OE2 3.08Å; N311-E314 PolarHBondContact O-N 3.34Å; V312-E314 PolarHBondContact O-N 3.17Å
315	R	78.2	Confident	82.4	Confident	46 Å²	46	46.5 Å²	46.5	17%	0.174	26%	0.257	C	S	.	.	S	Bend	trans	-113.4	132.7	-173.7	-64.6	172.3	72.7	162.5	4.8	111.1	R282 Q310 V312 F317 E383	R282-R315 PolarHBondContact O-NH1 2.92Å; R282-R315 PolarHBondContact O-NH2 2.78Å; Q310-R315 VanDerWaalsContact O-CD 3.26Å; Q310-R315 WeakPolarHBondContact O-CD 3.39Å; Q310-R315 PolarHBondContact O-NH1 2.83Å; V312-R315 PolarHBondContact O-N 3.33Å; R315-F317 HydrophobicContact CB-CD2 4.05Å; R315-F317 HydrophobicContact CB-CE2 3.51Å; R315-F317 HydrophobicContact CB-CZ 4.04Å; R315-F317 HydrophobicContact CG-CE2 4.49Å; R315-F317 PolarHBondContact O-N 3.25Å; R315-E383 IonicContact CZ-OE1 2.81Å; R315-E383 IonicContact CZ-OE2 3.69Å; R315-E383 IonicContact NE-OE1 3.2Å; R315-E383 PolarHBondContact NE-OE1 2.71Å; R315-E383 IonicContact NH2-OE1 3.41Å; R315-E383 PolarHBondContact NH2-OE1 2.83Å; R315-E383 IonicContact NH2-OE2 2.69Å; R315-E383 PolarHBondContact NH2-OE2 3.49Å
316	F	80.4	Confident	82.2	Confident	121 Å²	121	49.7 Å²	49.7	53%	0.531	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	80.5	-174.5	-64.8	-83.3	0	0	0	112.3	P333 R384	F316-P333 HydrophobicContact CB-CG 4.43Å; F316-P333 HydrophobicContact CD1-CB 4.16Å; F316-P333 HydrophobicContact CD1-CG 4.46Å; F316-R384 HydrophobicContact CB-CB 4.05Å; F316-R384 PolarHBondContact O-N 2.82Å
317	F	85.8	Confident	82	Confident	4 Å²	4	52 Å²	52	2%	0.018	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	141.8	172.2	-62.8	-73.3	0	0	0	112.8	F284 I307 A309 V312 R315 V381 E383	F284-F317 HydrophobicContact CD1-CE1 4.05Å; F284-F317 HydrophobicContact CD2-CE1 4.22Å; F284-F317 HydrophobicContact CE1-CE1 4.08Å; F284-F317 HydrophobicContact CE2-CE1 4.26Å; F284-F317 HydrophobicContact CG-CE1 4.12Å; F284-F317 HydrophobicContact CG-CZ 4.48Å; F284-F317 HydrophobicContact CZ-CE1 4.19Å; I307-F317 HydrophobicContact CD1-CB 3.76Å; I307-F317 HydrophobicContact CD1-CD1 4.31Å; I307-F317 HydrophobicContact CD1-CD2 4.22Å; I307-F317 HydrophobicContact CD1-CG 3.85Å; I307-F317 HydrophobicContact CG2-CD1 4.43Å; I307-F317 HydrophobicContact CG2-CD2 4.43Å; I307-F317 HydrophobicContact CG2-CE1 4.17Å; I307-F317 HydrophobicContact CG2-CE2 4.17Å; I307-F317 HydrophobicContact CG2-CZ 4.04Å; A309-F317 HydrophobicContact CB-CZ 4.29Å; V312-F317 HydrophobicContact CB-CE2 4.38Å; V312-F317 HydrophobicContact CG1-CD2 3.96Å; V312-F317 HydrophobicContact CG1-CE2 3.93Å; V312-F317 HydrophobicContact CG2-CE2 4.33Å; R315-F317 HydrophobicContact CB-CD2 4.05Å; R315-F317 HydrophobicContact CB-CE2 3.51Å; R315-F317 HydrophobicContact CB-CZ 4.04Å; R315-F317 HydrophobicContact CG-CE2 4.49Å; R315-F317 PolarHBondContact O-N 3.25Å; F317-V381 HydrophobicContact CB-CG1 4.24Å; F317-V381 HydrophobicContact CD1-CG1 3.67Å; F317-V381 HydrophobicContact CE1-CG1 4.46Å; F317-V381 HydrophobicContact CG-CG1 4.29Å; F317-E383 HydrophobicContact CD1-CB 3.88Å; F317-E383 HydrophobicContact CD1-CG 4.44Å; F317-E383 HydrophobicContact CE1-CB 3.77Å; F317-E383 HydrophobicContact CE1-CG 4.14Å
318	S	87.6	Confident	82	Confident	21 Å²	21	51.9 Å²	51.9	15%	0.147	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	143.3	166.6	60.1	0	0	0	0	109.5	V331 V381 T382	S318-V331 WeakPolarHBondContact CA-O 3.28Å; S318-V381 WeakPolarHBondContact O-CA 3.46Å; S318-T382 PolarHBondContact N-O 3.15Å; S318-T382 PolarHBondContact O-N 2.81Å; S318-T382 PolarHBondContact OG-O 2.79Å
319	V	90.9	Very high	82.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	123.7	-169.7	-177.3	0	0	0	0	110.5	I307 V330 V331 H362 C379 R380 V381	I307-V319 HydrophobicContact CD1-CG2 4.08Å; V319-V330 CarbonylContact O-C 3.58Å; V319-V330 WeakPolarHBondContact O-CA 3.5Å; V319-V331 PolarHBondContact N-O 2.84Å; V319-V331 PolarHBondContact O-N 3.41Å; V319-H362 HydrophobicContact CB-CB 4.35Å; V319-H362 HydrophobicContact CG1-CB 4.12Å; V319-H362 HydrophobicContact CG2-CB 4.38Å; V319-C379 WeakPolarHBondContact CG1-SG 3.42Å; V319-R380 WeakPolarHBondContact CA-O 3.39Å; V319-V381 HydrophobicContact CG1-CG2 4.41Å; V319-V381 HydrophobicContact CG2-CG1 4.37Å; V319-V381 HydrophobicContact CG2-CG2 4.14Å
320	S	90.9	Very high	82.9	Confident	26 Å²	26	49.5 Å²	49.5	18%	0.182	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.7	175.5	62.1	0	0	0	0	112.2	A329 R380	S320-A329 CarbonylContact C-O 3.57Å; S320-A329 WeakPolarHBondContact CA-O 3.45Å; S320-R380 PolarHBondContact N-O 2.85Å; S320-R380 PolarHBondContact O-N 2.73Å
321	W	92.7	Very high	83.8	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	134.1	172.8	-69.4	105	0	0	0	110.1	V288 L303 C305 V328 A329 L364 C379	V288-W321 HydrophobicContact CG1-CH2 4.25Å; V288-W321 HydrophobicContact CG1-CZ3 4.09Å; L303-W321 HydrophobicContact CB-CH2 3.64Å; L303-W321 HydrophobicContact CB-CZ2 4.43Å; L303-W321 HydrophobicContact CB-CZ3 3.78Å; L303-W321 HydrophobicContact CD1-CZ3 4.39Å; C305-W321 HydrophobicContact CB-CH2 3.55Å; C305-W321 HydrophobicContact CB-CZ2 3.61Å; C305-W321 HydrophobicContact CB-CZ3 4.36Å; W321-V328 HydrophobicContact CB-CB 4.06Å; W321-V328 PolarHBondContact O-N 3.24Å; W321-A329 PolarHBondContact N-O 3.29Å; W321-L364 HydrophobicContact CB-CD2 3.89Å; W321-L364 HydrophobicContact CD2-CB 3.71Å; W321-L364 HydrophobicContact CD2-CD2 3.87Å; W321-L364 HydrophobicContact CD2-CG 4.46Å; W321-L364 VanDerWaalsContact CE2-CB 3.48Å; W321-L364 HydrophobicContact CE3-CB 4.32Å; W321-L364 HydrophobicContact CE3-CD2 4.05Å; W321-L364 HydrophobicContact CG-CB 3.93Å; W321-L364 HydrophobicContact CG-CD2 3.83Å; W321-L364 HydrophobicContact CG-CG 4.47Å; W321-L364 HydrophobicContact CH2-CB 4.46Å; W321-L364 HydrophobicContact CZ2-CB 3.89Å; W321-C379 HydrophobicContact CE3-CB 4.24Å; W321-C379 HydrophobicContact CZ3-CB 4.08Å
322	V	90.7	Very high	84.3	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.024	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	128.1	-178.4	-179.9	0	0	0	0	109.1	S326 Y377 I378	V322-S326 CarbonylContact C-O 3.58Å; V322-S326 WeakPolarHBondContact CA-O 3.4Å; V322-S326 WeakPolarHBondContact CG1-O 3.41Å; V322-Y377 CarbonylContact O-C 3.56Å; V322-Y377 WeakPolarHBondContact O-CA 3.4Å; V322-I378 HydrophobicContact CB-CB 4.43Å; V322-I378 PolarHBondContact N-O 2.93Å; V322-I378 PolarHBondContact O-N 2.94Å
323	F	89.7	Confident	84.1	Confident	25 Å²	25	45 Å²	45	11%	0.11	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	119.9	176.1	170.8	-106.7	0	0	0	109.1	S325 S326 V328 E372 D373 Y377	F323-S325 PolarHBondContact O-N 2.85Å; F323-S326 PolarHBondContact N-O 2.88Å; F323-S326 PolarHBondContact O-N 2.87Å; F323-V328 HydrophobicContact CB-CG2 3.44Å; F323-V328 VanDerWaalsContact CB-CG2 3.44Å; F323-E372 WeakPolarHBondContact CZ-O 3.45Å; F323-D373 WeakPolarHBondContact CE2-O 3.17Å; F323-Y377 HydrophobicContact CB-CD1 4.14Å; F323-Y377 HydrophobicContact CB-CE1 4.02Å; F323-Y377 AromaticContact CD2-CD1 3.92Å; F323-Y377 HydrophobicContact CD2-CD1 3.92Å; F323-Y377 AromaticContact CD2-CD2 3.94Å; F323-Y377 HydrophobicContact CD2-CD2 3.94Å; F323-Y377 AromaticContact CD2-CE1 3.52Å; F323-Y377 HydrophobicContact CD2-CE1 3.52Å; F323-Y377 AromaticContact CD2-CE2 3.54Å; F323-Y377 HydrophobicContact CD2-CE2 3.54Å; F323-Y377 HydrophobicContact CD2-CG 4.13Å; F323-Y377 AromaticContact CD2-CZ 3.33Å; F323-Y377 HydrophobicContact CE2-CD2 4.34Å; F323-Y377 HydrophobicContact CE2-CE1 4.33Å; F323-Y377 AromaticContact CE2-CE2 3.67Å; F323-Y377 HydrophobicContact CE2-CE2 3.67Å; F323-Y377 AromaticContact CE2-CZ 3.67Å; F323-Y377 HydrophobicContact CG-CD1 4.5Å; F323-Y377 HydrophobicContact CG-CE1 4.09Å
324	S	82.5	Confident	84	Confident	57 Å²	57	44.4 Å²	44.4	40%	0.399	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	40.9	173.8	-58.6	0	0	0	0	113.3	S326 K376	S324-S326 PolarHBondContact O-N 3.05Å; S324-K376 PolarHBondContact N-O 2.77Å; S324-K376 PolarHBondContact OG-N 3.23Å
325	S	81.3	Confident	84	Confident	103 Å²	103	40 Å²	40	72%	0.72	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	-13.9	-173.4	76.2	0	0	0	0	118.3	F323	F323-S325 PolarHBondContact O-N 2.85Å
326	S	86.4	Confident	84	Confident	67 Å²	67	42.2 Å²	42.2	47%	0.469	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	142.9	174.1	-63.6	0	0	0	0	112.8	V322 F323 S324	V322-S326 CarbonylContact C-O 3.58Å; V322-S326 WeakPolarHBondContact CA-O 3.4Å; V322-S326 WeakPolarHBondContact CG1-O 3.41Å; F323-S326 PolarHBondContact N-O 2.88Å; F323-S326 PolarHBondContact O-N 2.87Å; S324-S326 PolarHBondContact O-N 3.05Å
327	P	87.3	Confident	84.2	Confident	81 Å²	81	38.8 Å²	38.8	53%	0.526	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	131.5	175.4	30	-33.7	0	0	0	111.4
328	V	88.3	Confident	84.2	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-53	176	-177.4	0	0	0	0	110.4	W321 F323 G340 Y343 L364	W321-V328 HydrophobicContact CB-CB 4.06Å; W321-V328 PolarHBondContact O-N 3.24Å; F323-V328 HydrophobicContact CB-CG2 3.44Å; F323-V328 VanDerWaalsContact CB-CG2 3.44Å; V328-G340 PolarHBondContact O-N 3Å; V328-Y343 HydrophobicContact CB-CD2 4.19Å; V328-Y343 HydrophobicContact CB-CE2 4.03Å; V328-Y343 HydrophobicContact CG1-CD1 4.18Å; V328-Y343 HydrophobicContact CG1-CD2 3.9Å; V328-Y343 HydrophobicContact CG1-CE1 4.2Å; V328-Y343 HydrophobicContact CG1-CE2 3.91Å; V328-Y343 HydrophobicContact CG1-CG 4.02Å; V328-Y343 HydrophobicContact CG2-CD2 4.43Å; V328-Y343 HydrophobicContact CG2-CE2 3.77Å; V328-L364 HydrophobicContact CG1-CD1 3.96Å; V328-L364 HydrophobicContact CG1-CD2 4.03Å
329	A	89.4	Confident	84.1	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.008	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	155.2	-177.1	0	0	0	0	0	111.7	S320 W321 V338 L339 V354	S320-A329 CarbonylContact C-O 3.57Å; S320-A329 WeakPolarHBondContact CA-O 3.45Å; W321-A329 PolarHBondContact N-O 3.29Å; A329-V338 CarbonylContact C-O 3.55Å; A329-V338 VanDerWaalsContact CA-O 3.3Å; A329-V338 WeakPolarHBondContact CA-O 3.44Å; A329-L339 HydrophobicContact CB-CD2 3.79Å; A329-V354 HydrophobicContact CB-CB 4.3Å; A329-V354 HydrophobicContact CB-CG1 3.97Å; A329-V354 HydrophobicContact CB-CG2 3.76Å
330	V	88.6	Confident	83.9	Confident	61 Å²	61	44.2 Å²	44.2	37%	0.37	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.5	172.1	-170.7	0	0	0	0	109.1	V319 P337 V338	V319-V330 CarbonylContact O-C 3.58Å; V319-V330 WeakPolarHBondContact O-CA 3.5Å; V330-P337 WeakPolarHBondContact O-CA 3.36Å; V330-V338 PolarHBondContact N-O 2.64Å; V330-V338 PolarHBondContact O-N 2.91Å
331	V	87.4	Confident	83.4	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	115.3	172.7	-174.2	0	0	0	0	108.3	S318 V319 P337 V354 K356	S318-V331 WeakPolarHBondContact CA-O 3.28Å; V319-V331 PolarHBondContact N-O 2.84Å; V319-V331 PolarHBondContact O-N 3.41Å; V331-P337 HydrophobicContact CG2-CB 4.38Å; V331-V354 HydrophobicContact CG2-CG1 3.59Å; V331-K356 HydrophobicContact CG1-CB 4.33Å
332	G	78.3	Confident	82.8	Confident	16 Å²	16	51.6 Å²	51.6	17%	0.165	35%	0.352	C	S	.	.			trans	-81.8	176.5	176.5	0	0	0	0	0	113.2	S334 A335	G332-S334 PolarHBondContact O-N 2.78Å; G332-S334 VanDerWaalsContact O-N 3.17Å; G332-A335 PolarHBondContact O-N 3.25Å
333	P	68.9	Low	82.5	Confident	65 Å²	65	52.4 Å²	52.4	42%	0.422	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-29.5	173.8	-25.6	35.5	0	0	0	113.5	F316 A335	F316-P333 HydrophobicContact CB-CG 4.43Å; F316-P333 HydrophobicContact CD1-CB 4.16Å; F316-P333 HydrophobicContact CD1-CG 4.46Å; P333-A335 PolarHBondContact O-N 2.89Å
334	S	69	Low	82.2	Confident	91 Å²	91	54.8 Å²	54.8	64%	0.636	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-0.4	174.1	52.6	0	0	0	0	115.2	G332 V336	G332-S334 PolarHBondContact O-N 2.78Å; G332-S334 VanDerWaalsContact O-N 3.17Å; S334-V336 PolarHBondContact O-N 3.15Å
335	A	68.8	Low	82.1	Confident	51 Å²	51	55.8 Å²	55.8	42%	0.421	38%	0.383	S	S	.	.			trans	61.1	-4.6	-178.3	0	0	0	0	0	116.9	G332 P333 K356	G332-A335 PolarHBondContact O-N 3.25Å; P333-A335 PolarHBondContact O-N 2.89Å; A335-K356 HydrophobicContact CB-CB 4.38Å; A335-K356 HydrophobicContact CB-CD 4.28Å
336	V	80.2	Confident	82.2	Confident	92 Å²	92	53.5 Å²	53.5	56%	0.558	36%	0.358	S	S	*	.			trans	-69.3	125.1	170.4	-177.1	0	0	0	0	109.6	S334	S334-V336 PolarHBondContact O-N 3.15Å
337	P	83	Confident	82	Confident	49 Å²	49	54.8 Å²	54.8	32%	0.318	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	136.4	172.9	32.2	-32.9	0	0	0	111	V330 V331 V354	V330-P337 WeakPolarHBondContact O-CA 3.36Å; V331-P337 HydrophobicContact CG2-CB 4.38Å; P337-V354 HydrophobicContact CB-CB 4.16Å; P337-V354 HydrophobicContact CB-CG1 4.47Å
338	V	85.8	Confident	81.6	Confident	99 Å²	99	55 Å²	55	60%	0.6	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.5	168.8	-179.1	0	0	0	0	107.8	A329 V330	A329-V338 CarbonylContact C-O 3.55Å; A329-V338 VanDerWaalsContact CA-O 3.3Å; A329-V338 WeakPolarHBondContact CA-O 3.44Å; V330-V338 PolarHBondContact N-O 2.64Å; V330-V338 PolarHBondContact O-N 2.91Å
339	L	86.6	Confident	81.1	Confident	34 Å²	34	56.8 Å²	56.8	18%	0.178	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	151	-174.7	-60.6	173.9	0	0	0	112.3	A329 V344 E347 V354	A329-L339 HydrophobicContact CB-CD2 3.79Å; L339-V344 HydrophobicContact CB-CG2 4.1Å; L339-E347 HydrophobicContact CD1-CB 3.27Å; L339-E347 HydrophobicContact CD1-CG 3.69Å; L339-V354 HydrophobicContact CD2-CG2 4.1Å
340	G	85.3	Confident	80.6	Confident	7 Å²	7	59 Å²	59	7%	0.072	40%	0.403	C	S	.	.			trans	-70.3	152.2	166.3	0	0	0	0	0	111	V328 G342 Y343 V344	V328-G340 PolarHBondContact O-N 3Å; G340-G342 VanDerWaalsContact C-N 3.29Å; G340-G342 PolarHBondContact O-N 3.44Å; G340-G342 VanDerWaalsContact O-N 3.15Å; G340-Y343 PolarHBondContact O-N 2.73Å; G340-V344 PolarHBondContact O-N 2.88Å
341	P	80.7	Confident	80.3	Confident	120 Å²	120	57.2 Å²	57.2	78%	0.779	39%	0.391	S	S	*	.	H	α-helix	trans	-58	-35.9	-169.5	20	-32.3	0	0	0	114	Y343	P341-Y343 PolarHBondContact O-N 2.74Å
342	G	80	Confident	80.4	Confident	60 Å²	60	57.2 Å²	57.2	62%	0.619	39%	0.391	S	S	*	.	H	α-helix	trans	-72.1	-4.7	176.1	0	0	0	0	0	115.6	G340	G340-G342 VanDerWaalsContact C-N 3.29Å; G340-G342 PolarHBondContact O-N 3.44Å; G340-G342 VanDerWaalsContact O-N 3.15Å
343	Y	85.3	Confident	80.8	Confident	21 Å²	21	59.4 Å²	59.4	8%	0.082	40%	0.402	C	S	.	.	H	α-helix	trans	-116	-12.2	-177.4	-69.7	-78.2	0	0	0	114.1	V328 G340 P341 A345 R346 E347 V352 L366	V328-Y343 HydrophobicContact CB-CD2 4.19Å; V328-Y343 HydrophobicContact CB-CE2 4.03Å; V328-Y343 HydrophobicContact CG1-CD1 4.18Å; V328-Y343 HydrophobicContact CG1-CD2 3.9Å; V328-Y343 HydrophobicContact CG1-CE1 4.2Å; V328-Y343 HydrophobicContact CG1-CE2 3.91Å; V328-Y343 HydrophobicContact CG1-CG 4.02Å; V328-Y343 HydrophobicContact CG2-CD2 4.43Å; V328-Y343 HydrophobicContact CG2-CE2 3.77Å; G340-Y343 PolarHBondContact O-N 2.73Å; P341-Y343 PolarHBondContact O-N 2.74Å; Y343-A345 PolarHBondContact O-N 3.24Å; Y343-R346 PolarHBondContact O-N 2.83Å; Y343-R346 VanDerWaalsContact O-N 3.11Å; Y343-E347 PolarHBondContact O-N 2.76Å; Y343-V352 HydrophobicContact CD1-CG2 4.15Å; Y343-L366 HydrophobicContact CE1-CD2 4.04Å
344	V	82.6	Confident	81.7	Confident	76 Å²	76	57.1 Å²	57.1	46%	0.461	39%	0.386	S	S	.	.	H	α-helix	trans	-57.1	-50.3	177.7	-180	0	0	0	0	111.4	L339 G340 R346 E347 A348	L339-V344 HydrophobicContact CB-CG2 4.1Å; G340-V344 PolarHBondContact O-N 2.88Å; V344-R346 PolarHBondContact O-N 2.85Å; V344-E347 PolarHBondContact O-N 2.97Å; V344-A348 PolarHBondContact O-N 3.21Å
345	A	80.1	Confident	82.6	Confident	77 Å²	77	58.3 Å²	58.3	64%	0.636	38%	0.377	S	S	*	.	H	α-helix	trans	-64.4	-27.9	178.2	0	0	0	0	0	113.2	Y343 A349	Y343-A345 PolarHBondContact O-N 3.24Å; A345-A349 WeakPolarHBondContact O-CB 3.46Å; A345-A349 PolarHBondContact O-N 2.78Å
346	R	83.8	Confident	83.4	Confident	55 Å²	55	59 Å²	59	21%	0.208	37%	0.371	C	S	.	.	H	α-helix	trans	-76.8	-32.1	177.4	-63.6	-178.4	73.3	175.9	2.5	111.9	Y343 V344 G350 L351 V352 D373	Y343-R346 PolarHBondContact O-N 2.83Å; Y343-R346 VanDerWaalsContact O-N 3.11Å; V344-R346 PolarHBondContact O-N 2.85Å; R346-G350 PolarHBondContact O-N 2.92Å; R346-L351 HydrophobicContact CB-CB 4.37Å; R346-L351 WeakPolarHBondContact O-CA 3.39Å; R346-L351 WeakPolarHBondContact O-CB 3.42Å; R346-L351 PolarHBondContact O-N 3.28Å; R346-V352 HydrophobicContact CB-CB 4.41Å; R346-V352 HydrophobicContact CB-CG2 3.79Å; R346-V352 PolarHBondContact O-N 2.84Å; R346-D373 IonicContact CZ-OD1 2.82Å; R346-D373 IonicContact CZ-OD2 2.81Å; R346-D373 IonicContact NH1-OD1 3.31Å; R346-D373 PolarHBondContact NH1-OD1 3.06Å; R346-D373 IonicContact NH1-OD2 2.7Å; R346-D373 PolarHBondContact NH1-OD2 2.85Å; R346-D373 IonicContact NH2-OD1 3.25Å; R346-D373 PolarHBondContact NH2-OD1 2.85Å; R346-D373 IonicContact NH2-OD2 2.94Å; R346-D373 PolarHBondContact NH2-OD2 2.95Å
347	E	82	Confident	83.7	Confident	95 Å²	95	58.3 Å²	58.3	44%	0.444	36%	0.361	S	S	.	.	H	α-helix	trans	-76.4	-39	173.9	-178.1	-100.1	-166.6	0	0	112.4	L339 Y343 V344 A349 G350 V352	L339-E347 HydrophobicContact CD1-CB 3.27Å; L339-E347 HydrophobicContact CD1-CG 3.69Å; Y343-E347 PolarHBondContact O-N 2.76Å; V344-E347 PolarHBondContact O-N 2.97Å; E347-A349 PolarHBondContact O-N 2.83Å; E347-A349 VanDerWaalsContact O-N 3.15Å; E347-G350 WeakPolarHBondContact O-CA 3.33Å; E347-G350 PolarHBondContact O-N 2.67Å; E347-V352 WeakPolarHBondContact CG-O 3.35Å
348	A	79.1	Confident	83.7	Confident	86 Å²	86	57.5 Å²	57.5	71%	0.711	36%	0.357	S	S	*	.	H	α-helix	trans	-58.4	-27.1	170.8	0	0	0	0	0	113	V344	V344-A348 PolarHBondContact O-N 3.21Å
349	A	77.8	Confident	83.5	Confident	37 Å²	37	55.6 Å²	55.6	31%	0.306	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	4.1	172.7	0	0	0	0	0	114.5	A345 E347 L351 T522	A345-A349 WeakPolarHBondContact O-CB 3.46Å; A345-A349 PolarHBondContact O-N 2.78Å; E347-A349 PolarHBondContact O-N 2.83Å; E347-A349 VanDerWaalsContact O-N 3.15Å; A349-L351 HydrophobicContact CB-CD1 4.17Å; A349-L351 HydrophobicContact CB-CG 4.02Å; A349-L351 PolarHBondContact O-N 3.47Å; A349-T522 HydrophobicContact CB-CG2 3.65Å
350	G	79.3	Confident	83.4	Confident	46 Å²	46	56.7 Å²	56.7	47%	0.474	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.6	5.3	-174.8	0	0	0	0	0	115.1	R346 E347	R346-G350 PolarHBondContact O-N 2.92Å; E347-G350 WeakPolarHBondContact O-CA 3.33Å; E347-G350 PolarHBondContact O-N 2.67Å
351	L	83.1	Confident	83.6	Confident	25 Å²	25	57.9 Å²	57.9	13%	0.131	36%	0.357	C	S	.	.	S	Bend	trans	-83.5	-11.4	-174.5	-59.4	179.3	0	0	0	113.9	R346 A349 H367 R368	R346-L351 HydrophobicContact CB-CB 4.37Å; R346-L351 WeakPolarHBondContact O-CA 3.39Å; R346-L351 WeakPolarHBondContact O-CB 3.42Å; R346-L351 PolarHBondContact O-N 3.28Å; A349-L351 HydrophobicContact CB-CD1 4.17Å; A349-L351 HydrophobicContact CB-CG 4.02Å; A349-L351 PolarHBondContact O-N 3.47Å; L351-H367 HydrophobicContact CD2-CB 4.42Å; L351-H367 PolarHBondContact O-N 2.89Å; L351-R368 HydrophobicContact CD2-CB 4.22Å; L351-R368 HydrophobicContact CD2-CG 3.86Å
352	V	88.1	Confident	84.1	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	131.1	173.3	174.9	0	0	0	0	109.5	Y343 R346 E347 V354 L364 K365 L366	Y343-V352 HydrophobicContact CD1-CG2 4.15Å; R346-V352 HydrophobicContact CB-CB 4.41Å; R346-V352 HydrophobicContact CB-CG2 3.79Å; R346-V352 PolarHBondContact O-N 2.84Å; E347-V352 WeakPolarHBondContact CG-O 3.35Å; V352-V354 HydrophobicContact CG1-CG2 4.16Å; V352-L364 HydrophobicContact CG1-CD1 4.06Å; V352-K365 WeakPolarHBondContact CA-O 3.39Å; V352-L366 HydrophobicContact CG2-CD2 4.13Å; V352-L366 HydrophobicContact CG2-CG 4.05Å
353	T	87.2	Confident	84.6	Confident	62 Å²	62	49.5 Å²	49.5	38%	0.38	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	139.3	172.6	59.2	0	0	0	0	110.7	K365	T353-K365 PolarHBondContact N-O 2.86Å; T353-K365 PolarHBondContact O-N 2.86Å
354	V	89.1	Confident	84.9	Confident	16 Å²	16	48.5 Å²	48.5	10%	0.097	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	118.2	-178.5	-171.1	0	0	0	0	108.1	A329 V331 P337 L339 V352 L363 L364	A329-V354 HydrophobicContact CB-CB 4.3Å; A329-V354 HydrophobicContact CB-CG1 3.97Å; A329-V354 HydrophobicContact CB-CG2 3.76Å; V331-V354 HydrophobicContact CG2-CG1 3.59Å; P337-V354 HydrophobicContact CB-CB 4.16Å; P337-V354 HydrophobicContact CB-CG1 4.47Å; L339-V354 HydrophobicContact CD2-CG2 4.1Å; V352-V354 HydrophobicContact CG1-CG2 4.16Å; V354-L363 WeakPolarHBondContact CA-O 3.36Å; V354-L363 WeakPolarHBondContact CG1-O 3.39Å; V354-L364 HydrophobicContact CG2-CD1 3.75Å
355	R	85.9	Confident	85.3	Confident	117 Å²	117	48.1 Å²	48.1	44%	0.442	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	147.2	-173.8	66.2	-179.2	-179.4	88.6	3.5	113.1	E357 L363	R355-E357 IonicContact CZ-OE1 2.94Å; R355-E357 IonicContact NH1-OE1 3.14Å; R355-E357 PolarHBondContact NH1-OE1 2.96Å; R355-E357 IonicContact NH2-OE1 3.69Å; R355-E357 PolarHBondContact NH2-OE1 2.91Å; R355-L363 HydrophobicContact CG-CB 4.25Å; R355-L363 HydrophobicContact CG-CD1 4.4Å; R355-L363 VanDerWaalsContact CZ-CD1 3.47Å; R355-L363 PolarHBondContact N-O 2.66Å; R355-L363 PolarHBondContact O-N 2.82Å
356	K	87.2	Confident	85.7	Confident	66 Å²	66	44.4 Å²	44.4	29%	0.287	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	116.4	164.8	-172.2	167	-175.3	170.7	0	107.8	V331 A335 S358 H362	V331-K356 HydrophobicContact CG1-CB 4.33Å; A335-K356 HydrophobicContact CB-CB 4.38Å; A335-K356 HydrophobicContact CB-CD 4.28Å; K356-S358 WeakPolarHBondContact CE-O 3.06Å; K356-S358 VanDerWaalsContact CG-O 3.22Å; K356-S358 WeakPolarHBondContact CG-O 3.26Å; K356-H362 WeakPolarHBondContact CD-NE2 3.03Å
357	E	85.8	Confident	85.6	Confident	77 Å²	77	44.5 Å²	44.5	36%	0.36	25%	0.251	S	S	.	.			trans	-88.9	-31.6	179.8	-179.4	157.1	-94.1	0	0	111.5	R304 R355 I361 L363	R304-E357 IonicContact CZ-OE2 3.6Å; R304-E357 IonicContact NH1-OE2 3.76Å; R304-E357 PolarHBondContact NH1-OE2 2.92Å; R304-E357 IonicContact NH2-OE2 2.72Å; R304-E357 PolarHBondContact NH2-OE2 3Å; R355-E357 IonicContact CZ-OE1 2.94Å; R355-E357 IonicContact NH1-OE1 3.14Å; R355-E357 PolarHBondContact NH1-OE1 2.96Å; R355-E357 IonicContact NH2-OE1 3.69Å; R355-E357 PolarHBondContact NH2-OE1 2.91Å; E357-I361 HydrophobicContact CB-CB 4.36Å; E357-I361 HydrophobicContact CB-CG2 4.16Å; E357-I361 PolarHBondContact N-O 2.86Å; E357-L363 HydrophobicContact CB-CD1 4.2Å; E357-L363 HydrophobicContact CB-CG 4.31Å
358	S	83	Confident	85.5	Confident	32 Å²	32	44.1 Å²	44.1	22%	0.224	25%	0.246	C	C	.	.	S	Bend	trans	-154.9	175.3	175.1	69.4	0	0	0	0	109.5	K356 N360 I361	K356-S358 WeakPolarHBondContact CE-O 3.06Å; K356-S358 VanDerWaalsContact CG-O 3.22Å; K356-S358 WeakPolarHBondContact CG-O 3.26Å; S358-N360 PolarHBondContact O-N 3.26Å; S358-N360 PolarHBondContact OG-N 3.03Å; S358-N360 PolarHBondContact OG-OD1 2.82Å; S358-I361 PolarHBondContact N-O 2.7Å; S358-I361 PolarHBondContact O-N 3.28Å; S358-I361 VanDerWaalsContact OG-CB 3.3Å; S358-I361 WeakPolarHBondContact OG-CB 3.42Å; S358-I361 WeakPolarHBondContact OG-CG1 3.25Å; S358-I361 PolarHBondContact OG-N 3.11Å
359	P	80.8	Confident	85.8	Confident	58 Å²	58	40.2 Å²	40.2	38%	0.377	21%	0.213	S	C	.	.	S	Bend	trans	-53.6	-34.5	173.6	-28.5	37.4	0	0	0	113.6	V312 P313	V312-P359 HydrophobicContact CG1-CB 4Å; V312-P359 WeakPolarHBondContact CG1-O 3.33Å; P313-P359 HydrophobicContact CG-CB 4.35Å; P313-P359 HydrophobicContact CG-CG 4.36Å
360	N	86	Confident	86	Confident	58 Å²	58	40.1 Å²	40.1	31%	0.31	21%	0.21	S	C	.	.	S	Bend	trans	-99.7	-11.6	-177.9	64.8	-43.6	0	0	0	115.4	T306 I307 V312 S358	T306-N360 WeakPolarHBondContact CA-O 3.34Å; I307-N360 PolarHBondContact N-O 3.46Å; V312-N360 HydrophobicContact CG1-CB 3.98Å; V312-N360 HydrophobicContact CG2-CB 4.44Å; S358-N360 PolarHBondContact O-N 3.26Å; S358-N360 PolarHBondContact OG-N 3.03Å; S358-N360 PolarHBondContact OG-OD1 2.82Å
361	I	88.4	Confident	85.9	Confident	32 Å²	32	41.9 Å²	41.9	16%	0.164	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	125.3	-174.5	-57.1	175.7	0	0	0	111.6	R304 C305 T306 E357 S358 L363	R304-I361 HydrophobicContact CG-CG2 3.99Å; C305-I361 WeakPolarHBondContact O-CA 3.47Å; T306-I361 HydrophobicContact CG2-CG1 4.45Å; E357-I361 HydrophobicContact CB-CB 4.36Å; E357-I361 HydrophobicContact CB-CG2 4.16Å; E357-I361 PolarHBondContact N-O 2.86Å; S358-I361 PolarHBondContact N-O 2.7Å; S358-I361 PolarHBondContact O-N 3.28Å; S358-I361 VanDerWaalsContact OG-CB 3.3Å; S358-I361 WeakPolarHBondContact OG-CB 3.42Å; S358-I361 WeakPolarHBondContact OG-CG1 3.25Å; S358-I361 PolarHBondContact OG-N 3.11Å; I361-L363 HydrophobicContact CG2-CD2 3.9Å; I361-L363 HydrophobicContact CG2-CG 4.48Å
362	H	90.9	Very high	85.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	138.3	177	-59.9	71.6	0	0	0	109.3	C305 V319 K356	C305-H362 PolarHBondContact N-O 2.68Å; C305-H362 PolarHBondContact O-N 2.87Å; V319-H362 HydrophobicContact CB-CB 4.35Å; V319-H362 HydrophobicContact CG1-CB 4.12Å; V319-H362 HydrophobicContact CG2-CB 4.38Å; K356-H362 WeakPolarHBondContact CD-NE2 3.03Å
363	L	91.3	Very high	85.7	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	142.2	-174.5	-54.9	-177.9	0	0	0	111.5	L303 R304 V354 R355 E357 I361	L303-L363 WeakPolarHBondContact O-CA 3.44Å; R304-L363 HydrophobicContact CB-CD2 3.68Å; R304-L363 HydrophobicContact CG-CD2 3.7Å; V354-L363 WeakPolarHBondContact CA-O 3.36Å; V354-L363 WeakPolarHBondContact CG1-O 3.39Å; R355-L363 HydrophobicContact CG-CB 4.25Å; R355-L363 HydrophobicContact CG-CD1 4.4Å; R355-L363 VanDerWaalsContact CZ-CD1 3.47Å; R355-L363 PolarHBondContact N-O 2.66Å; R355-L363 PolarHBondContact O-N 2.82Å; E357-L363 HydrophobicContact CB-CD1 4.2Å; E357-L363 HydrophobicContact CB-CG 4.31Å; I361-L363 HydrophobicContact CG2-CD2 3.9Å; I361-L363 HydrophobicContact CG2-CG 4.48Å
364	L	91.8	Very high	85.7	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	126.5	165.2	162.5	63.7	0	0	0	107.5	L303 W321 V328 V352 V354 L366 Y377	L303-L364 HydrophobicContact CB-CB 4.43Å; L303-L364 HydrophobicContact CD1-CD2 4.05Å; L303-L364 PolarHBondContact N-O 2.94Å; L303-L364 PolarHBondContact O-N 2.9Å; W321-L364 HydrophobicContact CB-CD2 3.89Å; W321-L364 HydrophobicContact CD2-CB 3.71Å; W321-L364 HydrophobicContact CD2-CD2 3.87Å; W321-L364 HydrophobicContact CD2-CG 4.46Å; W321-L364 VanDerWaalsContact CE2-CB 3.48Å; W321-L364 HydrophobicContact CE3-CB 4.32Å; W321-L364 HydrophobicContact CE3-CD2 4.05Å; W321-L364 HydrophobicContact CG-CB 3.93Å; W321-L364 HydrophobicContact CG-CD2 3.83Å; W321-L364 HydrophobicContact CG-CG 4.47Å; W321-L364 HydrophobicContact CH2-CB 4.46Å; W321-L364 HydrophobicContact CZ2-CB 3.89Å; V328-L364 HydrophobicContact CG1-CD1 3.96Å; V328-L364 HydrophobicContact CG1-CD2 4.03Å; V352-L364 HydrophobicContact CG1-CD1 4.06Å; V354-L364 HydrophobicContact CG2-CD1 3.75Å; L364-L366 HydrophobicContact CD1-CD1 3.87Å; L364-L366 HydrophobicContact CD1-CG 4.43Å; L364-L366 HydrophobicContact CD2-CD1 4.11Å; L364-L366 HydrophobicContact CG-CD1 3.8Å; L364-Y377 HydrophobicContact CD2-CD1 4.25Å; L364-Y377 HydrophobicContact CD2-CE1 4.39Å
365	K	90.8	Very high	85.6	Confident	67 Å²	67	47.3 Å²	47.3	29%	0.291	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	129.7	176.8	-164.2	171.2	-163.7	148.9	0	110.1	L301 E302 V352 T353	L301-K365 CarbonylContact O-C 3.5Å; L301-K365 VanDerWaalsContact O-CA 3.26Å; L301-K365 WeakPolarHBondContact O-CA 3.46Å; L301-K365 WeakPolarHBondContact O-CG 3.44Å; E302-K365 HydrophobicContact CB-CG 4.24Å; E302-K365 HydrophobicContact CG-CB 4.47Å; E302-K365 HydrophobicContact CG-CD 4.45Å; E302-K365 HydrophobicContact CG-CG 4.38Å; E302-K365 WeakPolarHBondContact OE2-CD 3.39Å; E302-K365 WeakPolarHBondContact OE2-CE 3.37Å; E302-K365 IonicContact OE2-NZ 3.45Å; E302-K365 PolarHBondContact OE2-NZ 2.83Å; V352-K365 WeakPolarHBondContact CA-O 3.39Å; T353-K365 PolarHBondContact N-O 2.86Å; T353-K365 PolarHBondContact O-N 2.86Å
366	L	88.9	Confident	85.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132.9	173.1	-62.7	94.3	0	0	0	108.5	S300 L301 Y343 V352 L364 L369 Y377	S300-L366 CarbonylContact C-O 3.45Å; S300-L366 WeakPolarHBondContact CA-O 3.38Å; S300-L366 WeakPolarHBondContact CB-O 3.44Å; L301-L366 HydrophobicContact CD2-CD1 4.24Å; L301-L366 PolarHBondContact N-O 2.99Å; L301-L366 PolarHBondContact O-N 2.67Å; Y343-L366 HydrophobicContact CE1-CD2 4.04Å; V352-L366 HydrophobicContact CG2-CD2 4.13Å; V352-L366 HydrophobicContact CG2-CG 4.05Å; L364-L366 HydrophobicContact CD1-CD1 3.87Å; L364-L366 HydrophobicContact CD1-CG 4.43Å; L364-L366 HydrophobicContact CD2-CD1 4.11Å; L364-L366 HydrophobicContact CG-CD1 3.8Å; L366-L369 HydrophobicContact CB-CD2 4.19Å; L366-Y377 HydrophobicContact CD1-CE1 4.21Å
367	H	80.9	Confident	86	Confident	56 Å²	56	43.7 Å²	43.7	26%	0.259	23%	0.225	S	C	.	.	S	Bend	trans	-109.4	149	175.7	-61.7	-75.1	0	0	0	109.9	S300 L351	S300-H367 PolarHBondContact OG-ND1 2.88Å; L351-H367 HydrophobicContact CD2-CB 4.42Å; L351-H367 PolarHBondContact O-N 2.89Å
368	R	80.8	Confident	86.3	Confident	88 Å²	88	41.2 Å²	41.2	33%	0.332	21%	0.214	S	C	.	.	S	Bend	trans	53.2	63.8	-174.3	-52.8	-170.7	-164.4	177.4	12.3	112.1	E299 L351 S370 N519 G521	E299-R368 PolarHBondContact O-N 2.04Å; E299-R368 VanDerWaalsContact O-N 3.15Å; L351-R368 HydrophobicContact CD2-CB 4.22Å; L351-R368 HydrophobicContact CD2-CG 3.86Å; R368-S370 PolarHBondContact O-N 2.74Å; R368-N519 PolarHBondContact NH1-O 2.89Å; R368-G521 PolarHBondContact NH1-O 2.96Å
369	L	84.4	Confident	86.8	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.016	20%	0.204	C	C	.	.			trans	-55.2	131	176.5	-70.5	167.3	0	0	0	111.8	F295 A297 G298 E299 L301 L366 D373 V406	F295-L369 HydrophobicContact CB-CD1 3.63Å; F295-L369 HydrophobicContact CD1-CD1 3.95Å; F295-L369 HydrophobicContact CD2-CD1 4.37Å; F295-L369 HydrophobicContact CG-CD1 3.73Å; A297-L369 CarbonylContact C-O 3.59Å; A297-L369 WeakPolarHBondContact CA-O 3.4Å; G298-L369 PolarHBondContact N-O 3.17Å; E299-L369 HydrophobicContact CB-CD1 4.4Å; E299-L369 WeakPolarHBondContact O-CG 3.46Å; E299-L369 PolarHBondContact O-N 3.28Å; L301-L369 HydrophobicContact CB-CD1 3.95Å; L301-L369 HydrophobicContact CB-CD2 3.84Å; L301-L369 HydrophobicContact CB-CG 4.31Å; L366-L369 HydrophobicContact CB-CD2 4.19Å; L369-D373 HydrophobicContact CD2-CB 3.8Å; L369-V406 HydrophobicContact CB-CG1 4.16Å; L369-V406 HydrophobicContact CB-CG2 4.18Å; L369-V406 HydrophobicContact CD1-CG2 4.37Å
370	S	81.3	Confident	87.2	Confident	35 Å²	35	42.2 Å²	42.2	25%	0.245	21%	0.206	C	C	.	.			trans	-94	170.3	168.1	75.4	0	0	0	0	111.1	R368 E372 D373 V406	R368-S370 PolarHBondContact O-N 2.74Å; S370-E372 PolarHBondContact O-N 3.32Å; S370-E372 WeakPolarHBondContact OG-CB 3.37Å; S370-E372 PolarHBondContact OG-N 2.83Å; S370-E372 VanDerWaalsContact OG-N 3.11Å; S370-D373 PolarHBondContact N-OD2 2.78Å; S370-D373 PolarHBondContact O-N 3.02Å; S370-D373 PolarHBondContact OG-N 3.34Å; S370-V406 WeakPolarHBondContact O-CB 3.44Å; S370-V406 WeakPolarHBondContact O-CG1 3.49Å; S370-V406 WeakPolarHBondContact O-CG2 3.48Å
371	T	78.4	Confident	87.4	Confident	83 Å²	83	39.4 Å²	39.4	51%	0.509	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-62.6	-20.5	168.3	41.1	0	0	0	0	112.9	S374	T371-S374 WeakPolarHBondContact O-CB 3.32Å; T371-S374 PolarHBondContact O-N 3.28Å
372	E	81.8	Confident	87.4	Confident	162 Å²	162	39.2 Å²	39.2	76%	0.757	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-78.2	-23	177.3	-49.1	-176.2	152.3	0	0	112.9	F323 S370 S374	F323-E372 WeakPolarHBondContact CZ-O 3.45Å; S370-E372 PolarHBondContact O-N 3.32Å; S370-E372 WeakPolarHBondContact OG-CB 3.37Å; S370-E372 PolarHBondContact OG-N 2.83Å; S370-E372 VanDerWaalsContact OG-N 3.11Å; E372-S374 PolarHBondContact O-N 3.03Å
373	D	84.9	Confident	87.2	Confident	3 Å²	3	40.1 Å²	40.1	2%	0.016	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-72.1	-1.4	171.9	-68.5	-51.6	0	0	0	112.7	F323 R346 L369 S370 G375 Y377 V406	F323-D373 WeakPolarHBondContact CE2-O 3.17Å; R346-D373 IonicContact CZ-OD1 2.82Å; R346-D373 IonicContact CZ-OD2 2.81Å; R346-D373 IonicContact NH1-OD1 3.31Å; R346-D373 PolarHBondContact NH1-OD1 3.06Å; R346-D373 IonicContact NH1-OD2 2.7Å; R346-D373 PolarHBondContact NH1-OD2 2.85Å; R346-D373 IonicContact NH2-OD1 3.25Å; R346-D373 PolarHBondContact NH2-OD1 2.85Å; R346-D373 IonicContact NH2-OD2 2.94Å; R346-D373 PolarHBondContact NH2-OD2 2.95Å; L369-D373 HydrophobicContact CD2-CB 3.8Å; S370-D373 PolarHBondContact N-OD2 2.78Å; S370-D373 PolarHBondContact O-N 3.02Å; S370-D373 PolarHBondContact OG-N 3.34Å; D373-G375 PolarHBondContact O-N 2.98Å; D373-Y377 PolarHBondContact O-OH 3.44Å; D373-V406 HydrophobicContact CB-CG2 4.48Å
374	S	87	Confident	86.6	Confident	47 Å²	47	45.4 Å²	45.4	33%	0.329	22%	0.215	S	C	.	.			trans	-73.4	110.6	175.1	-168.6	0	0	0	0	111	T371 E372 V406	T371-S374 WeakPolarHBondContact O-CB 3.32Å; T371-S374 PolarHBondContact O-N 3.28Å; E372-S374 PolarHBondContact O-N 3.03Å; S374-V406 PolarHBondContact OG-N 3.3Å
375	G	87.9	Confident	85.6	Confident	6 Å²	6	47.9 Å²	47.9	6%	0.062	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.4	-158.8	-173.8	0	0	0	0	0	116	D373 Q403 I404	D373-G375 PolarHBondContact O-N 2.98Å; G375-Q403 WeakPolarHBondContact O-CA 3.31Å; G375-Q403 PolarHBondContact O-NE2 3.39Å; G375-I404 PolarHBondContact N-O 3.21Å; G375-I404 VanDerWaalsContact N-O 3.15Å; G375-I404 PolarHBondContact O-N 3.11Å
376	K	89.4	Confident	84.4	Confident	106 Å²	106	51 Å²	51	46%	0.461	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	110	-172.9	-69.7	173.1	-175.4	165.2	0	111.2	S324	S324-K376 PolarHBondContact N-O 2.77Å; S324-K376 PolarHBondContact OG-N 3.23Å
377	Y	91.9	Very high	83.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	139.6	175.2	-65.4	-95.1	0	0	0	111.1	L301 L303 V322 F323 L364 L366 D373 V402 I404	L301-Y377 HydrophobicContact CD2-CD2 4.45Å; L301-Y377 HydrophobicContact CD2-CE1 4.45Å; L301-Y377 HydrophobicContact CD2-CE2 3.86Å; L303-Y377 HydrophobicContact CD1-CD1 3.42Å; L303-Y377 VanDerWaalsContact CD1-CD1 3.42Å; L303-Y377 HydrophobicContact CD1-CD2 4.14Å; L303-Y377 HydrophobicContact CD1-CE1 3.99Å; L303-Y377 HydrophobicContact CD1-CG 3.49Å; L303-Y377 VanDerWaalsContact CD1-CG 3.49Å; V322-Y377 CarbonylContact O-C 3.56Å; V322-Y377 WeakPolarHBondContact O-CA 3.4Å; F323-Y377 HydrophobicContact CB-CD1 4.14Å; F323-Y377 HydrophobicContact CB-CE1 4.02Å; F323-Y377 AromaticContact CD2-CD1 3.92Å; F323-Y377 HydrophobicContact CD2-CD1 3.92Å; F323-Y377 AromaticContact CD2-CD2 3.94Å; F323-Y377 HydrophobicContact CD2-CD2 3.94Å; F323-Y377 AromaticContact CD2-CE1 3.52Å; F323-Y377 HydrophobicContact CD2-CE1 3.52Å; F323-Y377 AromaticContact CD2-CE2 3.54Å; F323-Y377 HydrophobicContact CD2-CE2 3.54Å; F323-Y377 HydrophobicContact CD2-CG 4.13Å; F323-Y377 AromaticContact CD2-CZ 3.33Å; F323-Y377 HydrophobicContact CE2-CD2 4.34Å; F323-Y377 HydrophobicContact CE2-CE1 4.33Å; F323-Y377 AromaticContact CE2-CE2 3.67Å; F323-Y377 HydrophobicContact CE2-CE2 3.67Å; F323-Y377 AromaticContact CE2-CZ 3.67Å; F323-Y377 HydrophobicContact CG-CD1 4.5Å; F323-Y377 HydrophobicContact CG-CE1 4.09Å; L364-Y377 HydrophobicContact CD2-CD1 4.25Å; L364-Y377 HydrophobicContact CD2-CE1 4.39Å; L366-Y377 HydrophobicContact CD1-CE1 4.21Å; D373-Y377 PolarHBondContact O-OH 3.44Å; Y377-V402 PolarHBondContact N-O 2.88Å; Y377-V402 PolarHBondContact O-N 2.84Å; Y377-I404 HydrophobicContact CD2-CB 4.19Å; Y377-I404 HydrophobicContact CD2-CG1 3.59Å; Y377-I404 HydrophobicContact CE2-CB 4Å; Y377-I404 HydrophobicContact CE2-CG1 3.77Å
378	I	91.9	Very high	82.2	Confident	25 Å²	25	56.6 Å²	56.6	13%	0.128	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	135.7	-179.4	-54.1	175.3	0	0	0	108.4	V322 R380 R398 N401	V322-I378 HydrophobicContact CB-CB 4.43Å; V322-I378 PolarHBondContact N-O 2.93Å; V322-I378 PolarHBondContact O-N 2.94Å; I378-R380 HydrophobicContact CG2-CG 4.37Å; I378-R398 HydrophobicContact CG2-CB 4.47Å; I378-N401 VanDerWaalsContact CD1-OD1 3.28Å; I378-N401 WeakPolarHBondContact CD1-OD1 3.42Å; I378-N401 WeakPolarHBondContact CG1-OD1 3.25Å
379	C	92.6	Very high	81.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	131.4	165.8	-177.4	0	0	0	0	109	I286 V288 C305 V319 W321 S399	I286-C379 HydrophobicContact CG2-CB 4.49Å; V288-C379 HydrophobicContact CG2-CB 3.4Å; V288-C379 VanDerWaalsContact CG2-CB 3.4Å; C305-C379 HydrophobicContact CB-CB 3.74Å; C305-C379 WeakPolarHBondContact CB-SG 3.4Å; C305-C379 WeakPolarHBondContact SG-CB 3.41Å; C305-C379 CovalentContact SG-SG 2.04Å; C305-C379 PolarHBondContact SG-SG 2.87Å; V319-C379 WeakPolarHBondContact CG1-SG 3.42Å; W321-C379 HydrophobicContact CE3-CB 4.24Å; W321-C379 HydrophobicContact CZ3-CB 4.08Å; C379-S399 PolarHBondContact N-OG 3.34Å; C379-S399 WeakPolarHBondContact O-CB 3.39Å; C379-S399 PolarHBondContact O-N 3.48Å; C379-S399 PolarHBondContact O-OG 2.86Å
380	R	90.8	Very high	80	Confident	111 Å²	111	59.2 Å²	59.2	42%	0.419	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.4	167.8	-54.3	173.6	-179.5	164.9	0.5	108.4	V319 S320 I378 K397 R398	V319-R380 WeakPolarHBondContact CA-O 3.39Å; S320-R380 PolarHBondContact N-O 2.85Å; S320-R380 PolarHBondContact O-N 2.73Å; I378-R380 HydrophobicContact CG2-CG 4.37Å; R380-K397 WeakPolarHBondContact CA-O 3.28Å; R380-R398 HydrophobicContact CG-CB 4.16Å
381	V	90.1	Very high	79.2	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	125.9	-179.8	-178.3	0	0	0	0	107.9	F284 I286 I307 F317 S318 V319 S396 K397	F284-V381 HydrophobicContact CE2-CB 4.34Å; F284-V381 HydrophobicContact CE2-CG1 4.19Å; I286-V381 HydrophobicContact CD1-CB 3.67Å; I286-V381 HydrophobicContact CD1-CG2 3.7Å; I286-V381 HydrophobicContact CG1-CB 4.07Å; I286-V381 HydrophobicContact CG1-CG2 3.84Å; I286-V381 HydrophobicContact CG2-CG2 4Å; I307-V381 HydrophobicContact CD1-CG1 3.74Å; I307-V381 HydrophobicContact CD1-CG2 4.4Å; I307-V381 HydrophobicContact CG1-CG1 4.13Å; I307-V381 HydrophobicContact CG1-CG2 4.14Å; F317-V381 HydrophobicContact CB-CG1 4.24Å; F317-V381 HydrophobicContact CD1-CG1 3.67Å; F317-V381 HydrophobicContact CE1-CG1 4.46Å; F317-V381 HydrophobicContact CG-CG1 4.29Å; S318-V381 WeakPolarHBondContact O-CA 3.46Å; V319-V381 HydrophobicContact CG1-CG2 4.41Å; V319-V381 HydrophobicContact CG2-CG1 4.37Å; V319-V381 HydrophobicContact CG2-CG2 4.14Å; V381-S396 WeakPolarHBondContact O-CA 3.47Å; V381-K397 PolarHBondContact N-O 3.2Å; V381-K397 PolarHBondContact O-N 2.86Å
382	T	87.9	Confident	78.6	Confident	27 Å²	27	64.2 Å²	64.2	17%	0.166	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	116.9	175.8	-56	0	0	0	0	109.2	S318 D394 R395 S396	S318-T382 PolarHBondContact N-O 3.15Å; S318-T382 PolarHBondContact O-N 2.81Å; S318-T382 PolarHBondContact OG-O 2.79Å; T382-D394 HydrophobicContact CG2-CB 3.77Å; T382-R395 CarbonylContact C-O 3.59Å; T382-R395 WeakPolarHBondContact CA-O 3.38Å; T382-S396 WeakPolarHBondContact OG1-CB 3.19Å
383	E	85.8	Confident	78.2	Confident	19 Å²	19	60.4 Å²	60.4	9%	0.089	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	140.8	170.3	176	169.6	-144.6	0	0	110.6	F284 R315 F317 D394 R395	F284-E383 HydrophobicContact CE1-CB 3.99Å; F284-E383 WeakPolarHBondContact CE1-OE2 3.44Å; F284-E383 HydrophobicContact CZ-CB 4.27Å; R315-E383 IonicContact CZ-OE1 2.81Å; R315-E383 IonicContact CZ-OE2 3.69Å; R315-E383 IonicContact NE-OE1 3.2Å; R315-E383 PolarHBondContact NE-OE1 2.71Å; R315-E383 IonicContact NH2-OE1 3.41Å; R315-E383 PolarHBondContact NH2-OE1 2.83Å; R315-E383 IonicContact NH2-OE2 2.69Å; R315-E383 PolarHBondContact NH2-OE2 3.49Å; F317-E383 HydrophobicContact CD1-CB 3.88Å; F317-E383 HydrophobicContact CD1-CG 4.44Å; F317-E383 HydrophobicContact CE1-CB 3.77Å; F317-E383 HydrophobicContact CE1-CG 4.14Å; E383-D394 CarbonylContact O-C 3.59Å; E383-D394 WeakPolarHBondContact O-CA 3.37Å; E383-R395 HydrophobicContact CB-CB 4.48Å; E383-R395 PolarHBondContact N-O 2.92Å; E383-R395 PolarHBondContact O-N 3.11Å
384	R	78.8	Confident	77.9	Confident	116 Å²	116	64 Å²	64	44%	0.438	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	109.2	167.7	-90.8	177	-179.9	160.5	11.5	111.4	F316 F392 D394	F316-R384 HydrophobicContact CB-CB 4.05Å; F316-R384 PolarHBondContact O-N 2.82Å; R384-F392 HydrophobicContact CB-CD1 4.43Å; R384-D394 WeakPolarHBondContact CG-OD1 3.33Å; R384-D394 IonicContact CZ-OD1 3.9Å; R384-D394 IonicContact CZ-OD2 3.77Å; R384-D394 VanDerWaalsContact NE-CG 3.34Å; R384-D394 IonicContact NE-OD1 2.67Å; R384-D394 PolarHBondContact NE-OD1 3.05Å; R384-D394 IonicContact NE-OD2 3.82Å; R384-D394 PolarHBondContact NE-OD2 2.91Å; R384-D394 IonicContact NH2-OD1 3Å; R384-D394 IonicContact NH2-OD2 3.01Å; R384-D394 PolarHBondContact NH2-OD2 3.01Å
385	E	72.2	Confident	77.5	Confident	51 Å²	51	67.9 Å²	67.9	24%	0.238	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127.5	167.4	-178.8	167.1	-151.4	0	0	108.9	R282 F392 I393 R395	R282-E385 IonicContact CZ-OE1 3.41Å; R282-E385 IonicContact NH1-OE1 3.98Å; R282-E385 PolarHBondContact NH1-OE1 2.72Å; E385-F392 CarbonylContact O-C 3.54Å; E385-F392 WeakPolarHBondContact O-CA 3.38Å; E385-I393 PolarHBondContact N-O 3.42Å; E385-I393 PolarHBondContact O-N 2.83Å; E385-R395 IonicContact OE2-CZ 3.84Å; E385-R395 IonicContact OE2-NE 3Å; E385-R395 IonicContact OE2-NH2 2.89Å; E385-R395 PolarHBondContact OE2-NH2 3.49Å
386	K	64.1	Low	77.3	Confident	133 Å²	133	71.9 Å²	71.9	58%	0.578	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	123.9	173.5	-170.7	179.9	178.9	-179.4	0	109.4	D391 F392	K386-D391 CarbonylContact C-O 3.43Å; K386-D391 WeakPolarHBondContact CA-O 3.23Å; K386-F392 HydrophobicContact CB-CD1 3.99Å; K386-F392 HydrophobicContact CB-CE1 3.78Å; K386-F392 HydrophobicContact CD-CE1 4.03Å; K386-F392 HydrophobicContact CD-CZ 3.97Å; K386-F392 HydrophobicContact CG-CD1 4.22Å; K386-F392 HydrophobicContact CG-CE1 3.84Å; K386-F392 HydrophobicContact CG-CZ 4.1Å
387	T	65.1	Low	77.2	Confident	28 Å²	28	70.6 Å²	70.6	17%	0.172	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-75.7	162.1	-179.8	66.1	0	0	0	0	111.7	T389 G390 D391 I393	T387-T389 PolarHBondContact O-N 2.89Å; T387-T389 PolarHBondContact OG1-N 2.95Å; T387-T389 PolarHBondContact OG1-OG1 3.15Å; T387-G390 PolarHBondContact O-N 3.49Å; T387-G390 PolarHBondContact OG1-N 3.48Å; T387-D391 HydrophobicContact CG2-CB 4.37Å; T387-D391 PolarHBondContact N-O 3.34Å; T387-D391 WeakPolarHBondContact OG1-CB 3.34Å; T387-D391 PolarHBondContact OG1-N 3.08Å; T387-D391 VanDerWaalsContact OG1-N 3.08Å; T387-D391 PolarHBondContact OG1-O 3.11Å; T387-I393 HydrophobicContact CG2-CD1 3.64Å; T387-I393 HydrophobicContact CG2-CG1 3.84Å
388	P	58.6	Low	77	Confident	146 Å²	146	79.9 Å²	79.9	95%	0.948	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-23.2	170.6	-25.1	35.7	0	0	0	114.4	G390	P388-G390 VanDerWaalsContact C-N 3.31Å
389	T	61.2	Low	76.9	Confident	114 Å²	114	79 Å²	79	70%	0.699	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-14.5	174.4	48.1	0	0	0	0	113.4	T387 D391	T387-T389 PolarHBondContact O-N 2.89Å; T387-T389 PolarHBondContact OG1-N 2.95Å; T387-T389 PolarHBondContact OG1-OG1 3.15Å; T389-D391 VanDerWaalsContact CB-OD2 3.27Å; T389-D391 WeakPolarHBondContact CB-OD2 3.12Å; T389-D391 PolarHBondContact OG1-OD2 2.85Å
390	G	58.8	Low	76.6	Confident	32 Å²	32	89.9 Å²	89.9	33%	0.33	43%	0.433	S	S	.	.	S	Bend	trans	102.8	-10.4	179.3	0	0	0	0	0	114.8	T387 P388	T387-G390 PolarHBondContact O-N 3.49Å; T387-G390 PolarHBondContact OG1-N 3.48Å; P388-G390 VanDerWaalsContact C-N 3.31Å
391	D	63.3	Low	76.3	Confident	102 Å²	102	89.1 Å²	89.1	55%	0.545	44%	0.437	S	S	.	.			trans	-68.2	167.5	175.2	-49.9	-73.8	0	0	0	112.2	K386 T387 T389	K386-D391 CarbonylContact C-O 3.43Å; K386-D391 WeakPolarHBondContact CA-O 3.23Å; T387-D391 HydrophobicContact CG2-CB 4.37Å; T387-D391 PolarHBondContact N-O 3.34Å; T387-D391 WeakPolarHBondContact OG1-CB 3.34Å; T387-D391 PolarHBondContact OG1-N 3.08Å; T387-D391 VanDerWaalsContact OG1-N 3.08Å; T387-D391 PolarHBondContact OG1-O 3.11Å; T389-D391 VanDerWaalsContact CB-OD2 3.27Å; T389-D391 WeakPolarHBondContact CB-OD2 3.12Å; T389-D391 PolarHBondContact OG1-OD2 2.85Å
392	F	66.6	Low	76.2	Confident	121 Å²	121	89.4 Å²	89.4	53%	0.531	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	135	176.7	-66.9	-87.6	0	0	0	111.2	R384 E385 K386	R384-F392 HydrophobicContact CB-CD1 4.43Å; E385-F392 CarbonylContact O-C 3.54Å; E385-F392 WeakPolarHBondContact O-CA 3.38Å; K386-F392 HydrophobicContact CB-CD1 3.99Å; K386-F392 HydrophobicContact CB-CE1 3.78Å; K386-F392 HydrophobicContact CD-CE1 4.03Å; K386-F392 HydrophobicContact CD-CZ 3.97Å; K386-F392 HydrophobicContact CG-CD1 4.22Å; K386-F392 HydrophobicContact CG-CE1 3.84Å; K386-F392 HydrophobicContact CG-CZ 4.1Å
393	I	72.9	Confident	76.3	Confident	81 Å²	81	91.8 Å²	91.8	42%	0.415	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	115.7	174.6	-60.4	176.4	0	0	0	108.6	E385 T387 R395	E385-I393 PolarHBondContact N-O 3.42Å; E385-I393 PolarHBondContact O-N 2.83Å; T387-I393 HydrophobicContact CG2-CD1 3.64Å; T387-I393 HydrophobicContact CG2-CG1 3.84Å; I393-R395 HydrophobicContact CG2-CG 4.36Å
394	D	78.4	Confident	76.6	Confident	79 Å²	79	90.9 Å²	90.9	42%	0.422	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	115.7	177.9	-78.9	34.1	0	0	0	110.7	T382 E383 R384	T382-D394 HydrophobicContact CG2-CB 3.77Å; E383-D394 CarbonylContact O-C 3.59Å; E383-D394 WeakPolarHBondContact O-CA 3.37Å; R384-D394 WeakPolarHBondContact CG-OD1 3.33Å; R384-D394 IonicContact CZ-OD1 3.9Å; R384-D394 IonicContact CZ-OD2 3.77Å; R384-D394 VanDerWaalsContact NE-CG 3.34Å; R384-D394 IonicContact NE-OD1 2.67Å; R384-D394 PolarHBondContact NE-OD1 3.05Å; R384-D394 IonicContact NE-OD2 3.82Å; R384-D394 PolarHBondContact NE-OD2 2.91Å; R384-D394 IonicContact NH2-OD1 3Å; R384-D394 IonicContact NH2-OD2 3.01Å; R384-D394 PolarHBondContact NH2-OD2 3.01Å
395	R	80.2	Confident	76.9	Confident	128 Å²	128	88.4 Å²	88.4	48%	0.483	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	113.2	173.7	-59.6	-172.4	-165.9	-157	8.7	110.4	T382 E383 E385 I393	T382-R395 CarbonylContact C-O 3.59Å; T382-R395 WeakPolarHBondContact CA-O 3.38Å; E383-R395 HydrophobicContact CB-CB 4.48Å; E383-R395 PolarHBondContact N-O 2.92Å; E383-R395 PolarHBondContact O-N 3.11Å; E385-R395 IonicContact OE2-CZ 3.84Å; E385-R395 IonicContact OE2-NE 3Å; E385-R395 IonicContact OE2-NH2 2.89Å; E385-R395 PolarHBondContact OE2-NH2 3.49Å; I393-R395 HydrophobicContact CG2-CG 4.36Å
396	S	83.2	Confident	77.4	Confident	90 Å²	90	86.5 Å²	86.5	63%	0.629	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	137.2	-177.9	72	0	0	0	0	113.9	V381 T382	V381-S396 WeakPolarHBondContact O-CA 3.47Å; T382-S396 WeakPolarHBondContact OG1-CB 3.19Å
397	K	86.1	Confident	77.7	Confident	79 Å²	79	84.3 Å²	84.3	34%	0.343	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	161.6	167.9	-70.6	-170.8	-175.8	-171.7	0	109.8	D283 F284 I286 R380 V381	D283-K397 WeakPolarHBondContact OD1-CE 3.07Å; D283-K397 IonicContact OD1-NZ 2.68Å; D283-K397 PolarHBondContact OD1-NZ 3.34Å; D283-K397 IonicContact OD2-NZ 2.7Å; D283-K397 PolarHBondContact OD2-NZ 2.92Å; F284-K397 HydrophobicContact CD2-CD 4.3Å; F284-K397 HydrophobicContact CE2-CB 4.02Å; F284-K397 HydrophobicContact CE2-CD 4.06Å; F284-K397 HydrophobicContact CE2-CG 4.17Å; F284-K397 HydrophobicContact CZ-CB 4.33Å; F284-K397 HydrophobicContact CZ-CD 4.28Å; F284-K397 HydrophobicContact CZ-CG 4.15Å; F284-K397 WeakPolarHBondContact O-CD 3.46Å; F284-K397 WeakPolarHBondContact O-CE 3.45Å; F284-K397 PolarHBondContact O-NZ 3.08Å; I286-K397 HydrophobicContact CD1-CB 3.52Å; I286-K397 VanDerWaalsContact CD1-O 3.28Å; I286-K397 WeakPolarHBondContact CD1-O 3.06Å; I286-K397 HydrophobicContact CG1-CB 4.41Å; R380-K397 WeakPolarHBondContact CA-O 3.28Å; V381-K397 PolarHBondContact N-O 3.2Å; V381-K397 PolarHBondContact O-N 2.86Å
398	R	88.3	Confident	77.6	Confident	195 Å²	195	87.2 Å²	87.2	74%	0.736	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	146.8	177.8	71.1	-179.3	-176.1	-167.9	-0.1	112	I378 R380	I378-R398 HydrophobicContact CG2-CB 4.47Å; R380-R398 HydrophobicContact CG-CB 4.16Å
399	S	89.3	Confident	77.5	Confident	8 Å²	8	84 Å²	84	6%	0.056	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-68.9	171.2	171.1	74.8	0	0	0	0	112.2	V288 C379	V288-S399 VanDerWaalsContact CG2-CB 3.49Å; C379-S399 PolarHBondContact N-OG 3.34Å; C379-S399 WeakPolarHBondContact O-CB 3.39Å; C379-S399 PolarHBondContact O-N 3.48Å; C379-S399 PolarHBondContact O-OG 2.86Å
400	R	86.4	Confident	77.2	Confident	227 Å²	227	87 Å²	87	86%	0.857	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-67.1	157.6	158.6	-61	-178	-176.4	-178.7	1.7	109.9
401	N	85.1	Confident	76.9	Confident	95 Å²	95	88.2 Å²	88.2	51%	0.508	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-73.8	133.9	178.6	-60.2	-12.6	0	0	0	111	I378	I378-N401 VanDerWaalsContact CD1-OD1 3.28Å; I378-N401 WeakPolarHBondContact CD1-OD1 3.42Å; I378-N401 WeakPolarHBondContact CG1-OD1 3.25Å
402	V	88.8	Confident	76.7	Confident	6 Å²	6	88.8 Å²	88.8	4%	0.036	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	105.9	169.4	-178.4	0	0	0	0	108.6	V288 T290 L303 Y377 I404	V288-V402 HydrophobicContact CB-CG2 4.07Å; V288-V402 HydrophobicContact CG1-CG2 3.79Å; T290-V402 HydrophobicContact CG2-CG1 4.17Å; L303-V402 HydrophobicContact CD2-CG1 4.16Å; Y377-V402 PolarHBondContact N-O 2.88Å; Y377-V402 PolarHBondContact O-N 2.84Å; V402-I404 HydrophobicContact CG1-CD1 3.87Å; V402-I404 HydrophobicContact CG1-CG1 4.37Å
403	Q	89.2	Confident	76.7	Confident	78 Å²	78	83.4 Å²	83.4	36%	0.364	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	130.5	168.4	-175.8	71.3	52.4	0	0	109.3	G375	G375-Q403 WeakPolarHBondContact O-CA 3.31Å; G375-Q403 PolarHBondContact O-NE2 3.39Å
404	I	91.1	Very high	77	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	147.9	169.2	-56.4	-62.8	0	0	0	108.1	T290 R293 F295 L301 G375 Y377 V402	T290-I404 HydrophobicContact CG2-CD1 4.24Å; R293-I404 WeakPolarHBondContact O-CA 3.48Å; F295-I404 HydrophobicContact CD2-CG2 3.81Å; F295-I404 HydrophobicContact CE2-CD1 4.29Å; F295-I404 HydrophobicContact CE2-CG2 4.08Å; L301-I404 HydrophobicContact CD1-CD1 3.91Å; L301-I404 HydrophobicContact CD1-CG1 4.34Å; L301-I404 HydrophobicContact CD2-CG1 4.05Å; L301-I404 HydrophobicContact CD2-CG2 4.31Å; G375-I404 PolarHBondContact N-O 3.21Å; G375-I404 VanDerWaalsContact N-O 3.15Å; G375-I404 PolarHBondContact O-N 3.11Å; Y377-I404 HydrophobicContact CD2-CB 4.19Å; Y377-I404 HydrophobicContact CD2-CG1 3.59Å; Y377-I404 HydrophobicContact CE2-CB 4Å; Y377-I404 HydrophobicContact CE2-CG1 3.77Å; V402-I404 HydrophobicContact CG1-CD1 3.87Å; V402-I404 HydrophobicContact CG1-CG1 4.37Å
405	T	85.9	Confident	77.4	Confident	64 Å²	64	80.9 Å²	80.9	39%	0.393	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	131.6	174	-56.3	0	0	0	0	109.6	R293 S294 F295	R293-T405 PolarHBondContact O-N 3.21Å; S294-T405 WeakPolarHBondContact CA-O 3.22Å; F295-T405 PolarHBondContact N-O 3Å
406	V	82.8	Confident	77.8	Confident	10 Å²	10	78 Å²	78	6%	0.061	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.5	174.1	-172.3	0	0	0	0	109.4	F295 A297 L369 S370 D373 S374	F295-V406 CarbonylContact O-C 3.52Å; F295-V406 WeakPolarHBondContact O-CA 3.47Å; A297-V406 HydrophobicContact CB-CG1 4.39Å; L369-V406 HydrophobicContact CB-CG1 4.16Å; L369-V406 HydrophobicContact CB-CG2 4.18Å; L369-V406 HydrophobicContact CD1-CG2 4.37Å; S370-V406 WeakPolarHBondContact O-CB 3.44Å; S370-V406 WeakPolarHBondContact O-CG1 3.49Å; S370-V406 WeakPolarHBondContact O-CG2 3.48Å; D373-V406 HydrophobicContact CB-CG2 4.48Å; S374-V406 PolarHBondContact OG-N 3.3Å
407	Q	71.4	Confident	78.2	Confident	88 Å²	88	74.5 Å²	74.5	41%	0.411	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	139.8	-179.9	-60.1	-172.9	41.2	0	0	111	S294 F295 M296 A297	S294-Q407 PolarHBondContact OG-NE2 3.19Å; F295-Q407 PolarHBondContact O-N 2.94Å; M296-Q407 CarbonylContact C-O 3.53Å; M296-Q407 WeakPolarHBondContact CA-O 3.47Å; M296-Q407 HydrophobicContact CE-CB 4.25Å; M296-Q407 HydrophobicContact SD-CB 3.92Å; A297-Q407 PolarHBondContact N-O 2.98Å
408	P	62.3	Low	78.4	Confident	88 Å²	88	73.7 Å²	73.7	57%	0.571	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-66.6	147.8	174.1	29.2	-35	0	0	0	111.2	M296 K410	M296-P408 VanDerWaalsContact CE-O 3.27Å; M296-P408 WeakPolarHBondContact CE-O 3.49Å; P408-K410 PolarHBondContact O-N 2.69Å
409	L	56.1	Low	78.4	Confident	78 Å²	78	65.3 Å²	65.3	41%	0.408	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-61	131.4	175.3	-107.5	72.4	0	0	0	110.9	M296 A297 V531	M296-L409 HydrophobicContact CB-CD1 4.13Å; M296-L409 HydrophobicContact CE-CD1 4.25Å; A297-L409 HydrophobicContact CB-CD1 4.32Å; A297-L409 WeakPolarHBondContact O-CD1 3.26Å; L409-V531 HydrophobicContact CB-CG1 4.36Å
410	K	54.1	Low	78.2	Confident	179 Å²	179	71.3 Å²	71.3	78%	0.778	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-92.1	121	167.4	-68.4	-176.2	179.1	179.1	0	108.6	P408 N412	P408-K410 PolarHBondContact O-N 2.69Å; K410-N412 PolarHBondContact O-N 2.99Å
411	N	52.5	Low	78	Confident	57 Å²	57	63.1 Å²	63.1	31%	0.305	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-61.5	116.3	177.1	-177.1	9.9	0	0	0	110.6	T413 Q516	N411-T413 WeakPolarHBondContact OD1-CB 3.44Å; N411-T413 PolarHBondContact OD1-N 3.36Å; N411-T413 PolarHBondContact OD1-OG1 3.47Å; N411-Q516 PolarHBondContact OD1-OE1 2.84Å
412	N	59.7	Low	77.9	Confident	113 Å²	113	61.4 Å²	61.4	60%	0.604	35%	0.348	S	S	*	.			trans	-112.3	9.7	174.3	67.2	-10.7	0	0	0	112.6	K410 T414	K410-N412 PolarHBondContact O-N 2.99Å; N412-T414 PolarHBondContact O-N 3.31Å
413	T	67.4	Low	77.7	Confident	9 Å²	9	65.9 Å²	65.9	6%	0.055	37%	0.368	C	S	.	.			trans	-62.2	132.3	179.6	-64.5	0	0	0	0	110.2	N411 V415 V436 N437 S438 Q516	N411-T413 WeakPolarHBondContact OD1-CB 3.44Å; N411-T413 PolarHBondContact OD1-N 3.36Å; N411-T413 PolarHBondContact OD1-OG1 3.47Å; T413-V415 HydrophobicContact CG2-CG2 4.3Å; T413-V436 HydrophobicContact CG2-CG1 3.59Å; T413-N437 WeakPolarHBondContact CA-O 3.13Å; T413-S438 WeakPolarHBondContact OG1-CB 3.38Å; T413-S438 PolarHBondContact OG1-OG 3.27Å; T413-Q516 PolarHBondContact OG1-OE1 2.81Å
414	T	78.4	Confident	77.5	Confident	81 Å²	81	62.8 Å²	62.8	50%	0.497	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	134.1	171.4	40.8	0	0	0	0	109.9	N412 N437	N412-T414 PolarHBondContact O-N 3.31Å; T414-N437 PolarHBondContact N-O 3.02Å; T414-N437 PolarHBondContact O-N 3.02Å
415	V	86.8	Confident	76.7	Confident	26 Å²	26	65 Å²	65	16%	0.158	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.4	-179	-178.7	0	0	0	0	108.4	T413 V436 A514 Q534 A536	T413-V415 HydrophobicContact CG2-CG2 4.3Å; V415-V436 HydrophobicContact CG2-CG1 4.29Å; V415-V436 HydrophobicContact CG2-CG2 4.4Å; V415-A514 HydrophobicContact CG2-CB 3.78Å; V415-Q534 HydrophobicContact CB-CB 4.39Å; V415-Q534 HydrophobicContact CG2-CB 3.69Å; V415-A536 HydrophobicContact CB-CB 4.44Å; V415-A536 HydrophobicContact CG1-CB 3.95Å
416	S	88.8	Confident	76.3	Confident	66 Å²	66	62.6 Å²	62.6	46%	0.462	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	136.6	174	55.5	0	0	0	0	109.5	C434 S435	S416-C434 WeakPolarHBondContact O-CA 3.4Å; S416-S435 PolarHBondContact N-O 2.86Å; S416-S435 PolarHBondContact O-N 2.93Å; S416-S435 PolarHBondContact OG-O 2.98Å
417	L	91.6	Very high	75.9	Confident	18 Å²	18	63.2 Å²	63.2	9%	0.094	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	111.8	179.7	-179.3	60.8	0	0	0	109.1	L432 C434 C512 A536 K538	L417-L432 HydrophobicContact CD1-CB 4.21Å; L417-L432 HydrophobicContact CD1-CD2 4.14Å; L417-L432 HydrophobicContact CG-CD2 4.35Å; L417-C434 HydrophobicContact CD1-CB 4.17Å; L417-C512 HydrophobicContact CB-CB 4.46Å; L417-C512 HydrophobicContact CD1-CB 4Å; L417-C512 HydrophobicContact CD2-CB 4.06Å; L417-C512 HydrophobicContact CG-CB 4.41Å; L417-A536 HydrophobicContact CB-CB 3.76Å; L417-A536 WeakPolarHBondContact CD2-O 3.39Å; L417-K538 HydrophobicContact CB-CB 4.45Å; L417-K538 HydrophobicContact CD2-CB 3.71Å; L417-K538 HydrophobicContact CG-CB 3.79Å
418	S	89.4	Confident	76.4	Confident	61 Å²	61	62.5 Å²	62.5	43%	0.427	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	155	169.7	59	0	0	0	0	110.7	L432 I433	S418-L432 WeakPolarHBondContact O-CA 3.4Å; S418-I433 PolarHBondContact N-O 2.83Å; S418-I433 PolarHBondContact O-N 2.67Å; S418-I433 PolarHBondContact OG-O 2.94Å
419	A	89	Confident	77.6	Confident	20 Å²	20	61.8 Å²	61.8	17%	0.165	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	146.2	168.3	0	0	0	0	0	107.5	S421 Q431 L432 K538 V540	A419-S421 VanDerWaalsContact C-N 3.25Å; A419-S421 VanDerWaalsContact CB-O 3.28Å; A419-S421 WeakPolarHBondContact CB-O 3.14Å; A419-S421 PolarHBondContact O-N 3.43Å; A419-Q431 WeakPolarHBondContact CA-O 3.48Å; A419-L432 HydrophobicContact CB-CD2 3.78Å; A419-K538 HydrophobicContact CB-CG 3.87Å; A419-V540 HydrophobicContact CB-CG2 4.31Å
420	N	84.5	Confident	79.2	Confident	133 Å²	133	58.2 Å²	58.2	71%	0.711	33%	0.334	S	S	*	.	S	Bend	trans	-63.3	-35	178.1	-166.4	17.2	0	0	0	111.6	Q431	N420-Q431 HydrophobicContact CB-CB 4.32Å; N420-Q431 PolarHBondContact N-O 3.5Å
421	S	83.6	Confident	81	Confident	55 Å²	55	53 Å²	53	39%	0.385	31%	0.313	S	S	.	.			trans	-137.4	152.7	164.5	-175.2	0	0	0	0	110.3	A419 E423	A419-S421 VanDerWaalsContact C-N 3.25Å; A419-S421 VanDerWaalsContact CB-O 3.28Å; A419-S421 WeakPolarHBondContact CB-O 3.14Å; A419-S421 PolarHBondContact O-N 3.43Å; S421-E423 WeakPolarHBondContact CB-O 3.34Å; S421-E423 PolarHBondContact OG-N 3.28Å; S421-E423 VanDerWaalsContact OG-N 3.08Å; S421-E423 PolarHBondContact OG-O 3.09Å
422	S	83.3	Confident	83	Confident	60 Å²	60	50.3 Å²	50.3	42%	0.42	30%	0.299	S	S	.	.	S	Bend	trans	-86.1	-15.8	166.7	50.1	0	0	0	0	113.3	V540 T541	S422-V540 WeakPolarHBondContact O-CA 3.42Å; S422-T541 PolarHBondContact O-N 3.13Å; S422-T541 PolarHBondContact O-OG1 3.43Å
423	E	83.6	Confident	84.6	Confident	100 Å²	100	47.9 Å²	47.9	47%	0.467	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	119.5	175.1	-49	-163.8	106.9	0	0	108.6	S421 T541 K543	S421-E423 WeakPolarHBondContact CB-O 3.34Å; S421-E423 PolarHBondContact OG-N 3.28Å; S421-E423 VanDerWaalsContact OG-N 3.08Å; S421-E423 PolarHBondContact OG-O 3.09Å; E423-T541 WeakPolarHBondContact CG-OG1 3.45Å; E423-K543 WeakPolarHBondContact OE1-CE 3.48Å; E423-K543 IonicContact OE1-NZ 3.6Å; E423-K543 PolarHBondContact OE1-NZ 2.85Å; E423-K543 VanDerWaalsContact OE1-NZ 3.15Å; E423-K543 IonicContact OE2-NZ 2.74Å; E423-K543 PolarHBondContact OE2-NZ 2.87Å
424	V	84.3	Confident	85.8	Confident	13 Å²	13	47.5 Å²	47.5	8%	0.079	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	148.8	-178	-178.2	0	0	0	0	108.5	D428 I430 A502 V540 T541 V542 K543	V424-D428 HydrophobicContact CG1-CB 3.62Å; V424-I430 HydrophobicContact CB-CG1 4.13Å; V424-I430 HydrophobicContact CG1-CG1 4Å; V424-I430 HydrophobicContact CG2-CG1 4.07Å; V424-A502 HydrophobicContact CG1-CB 4.38Å; V424-V540 HydrophobicContact CB-CG1 4.47Å; V424-V540 HydrophobicContact CG2-CG1 4Å; V424-T541 PolarHBondContact N-O 2.86Å; V424-V542 CarbonylContact O-C 3.55Å; V424-V542 WeakPolarHBondContact O-CA 3.35Å; V424-K543 PolarHBondContact O-N 2.78Å
425	L	76	Confident	86.4	Confident	45 Å²	45	45.7 Å²	45.7	24%	0.236	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	148.7	173.8	-62.8	168	0	0	0	109.9	G427 D428 K543 H576	L425-G427 PolarHBondContact O-N 3.32Å; L425-D428 HydrophobicContact CB-CB 4.38Å; L425-D428 WeakPolarHBondContact CB-OD2 3.34Å; L425-D428 WeakPolarHBondContact O-CB 3.37Å; L425-D428 PolarHBondContact O-N 3.32Å; L425-K543 HydrophobicContact CD2-CB 4.04Å; L425-H576 HydrophobicContact CD1-CB 3.48Å; L425-H576 VanDerWaalsContact CD1-CB 3.48Å
426	E	76.2	Confident	86.4	Confident	14 Å²	14	44.4 Å²	44.4	7%	0.065	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	123.7	170.1	178.6	-174.4	177.6	0	0	110.7	A502 P504 V542 K543 T544 V545 R660	E426-A502 CarbonylContact C-O 3.57Å; E426-A502 WeakPolarHBondContact CA-O 3.25Å; E426-P504 HydrophobicContact CG-CG 4.34Å; E426-V542 HydrophobicContact CB-CG1 4.11Å; E426-K543 PolarHBondContact N-O 2.71Å; E426-T544 VanDerWaalsContact OE2-CA 3.3Å; E426-T544 WeakPolarHBondContact OE2-CA 3.36Å; E426-V545 HydrophobicContact CB-CG2 3.86Å; E426-V545 HydrophobicContact CG-CG2 3.96Å; E426-V545 PolarHBondContact OE2-N 3.37Å; E426-R660 IonicContact OE1-CZ 2.89Å; E426-R660 IonicContact OE1-NE 3.64Å; E426-R660 PolarHBondContact OE1-NE 2.96Å; E426-R660 IonicContact OE1-NH2 2.68Å; E426-R660 PolarHBondContact OE1-NH2 3.22Å
427	G	75.1	Confident	86	Confident	23 Å²	23	46.6 Å²	46.6	24%	0.237	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.9	-19.4	-172.8	0	0	0	0	0	115.6	L425 A502	L425-G427 PolarHBondContact O-N 3.32Å; G427-A502 PolarHBondContact N-O 3.43Å
428	D	82.4	Confident	84.9	Confident	74 Å²	74	46.2 Å²	46.2	40%	0.396	27%	0.271	S	S	.	.	S	Bend	trans	-78.2	162.6	175.5	-81.6	-14.2	0	0	0	111.8	V424 L425 A502	V424-D428 HydrophobicContact CG1-CB 3.62Å; L425-D428 HydrophobicContact CB-CB 4.38Å; L425-D428 WeakPolarHBondContact CB-OD2 3.34Å; L425-D428 WeakPolarHBondContact O-CB 3.37Å; L425-D428 PolarHBondContact O-N 3.32Å; D428-A502 WeakPolarHBondContact O-CB 3.36Å; D428-A502 PolarHBondContact O-N 3.18Å; D428-A502 VanDerWaalsContact O-N 3.08Å
429	P	87.3	Confident	83.3	Confident	72 Å²	72	46.5 Å²	46.5	47%	0.468	28%	0.277	S	S	.	.			trans	-81.5	123.9	178.6	30.6	-33.8	0	0	0	113.3	Q431 L499 Y500	P429-Q431 PolarHBondContact O-N 2.96Å; P429-L499 CarbonylContact C-O 3.58Å; P429-L499 VanDerWaalsContact CA-O 3.3Å; P429-L499 WeakPolarHBondContact CA-O 3.29Å; P429-Y500 HydrophobicContact CB-CD1 3.93Å; P429-Y500 HydrophobicContact CB-CE1 4.43Å
430	I	90.1	Very high	81.9	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.015	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	106.9	164.2	-62.7	166.4	0	0	0	107.7	V424 L432 S498 L499 A502 D506 Y510 V540 V542	V424-I430 HydrophobicContact CB-CG1 4.13Å; V424-I430 HydrophobicContact CG1-CG1 4Å; V424-I430 HydrophobicContact CG2-CG1 4.07Å; I430-L432 HydrophobicContact CG2-CD1 4.15Å; I430-L432 HydrophobicContact CG2-CG 4.15Å; I430-S498 WeakPolarHBondContact O-CA 3.41Å; I430-L499 HydrophobicContact CB-CB 4.35Å; I430-L499 PolarHBondContact N-O 2.86Å; I430-L499 PolarHBondContact O-N 2.92Å; I430-A502 HydrophobicContact CD1-CB 3.7Å; I430-A502 HydrophobicContact CG1-CB 3.82Å; I430-D506 HydrophobicContact CD1-CB 3.93Å; I430-Y510 HydrophobicContact CG2-CE2 4.4Å; I430-V540 HydrophobicContact CD1-CG1 4.1Å; I430-V540 HydrophobicContact CG1-CG1 4.1Å; I430-V540 HydrophobicContact CG2-CG1 4.26Å; I430-V540 HydrophobicContact CG2-CG2 4.32Å; I430-V542 HydrophobicContact CD1-CG2 4.14Å
431	Q	91.8	Very high	81	Confident	71 Å²	71	48.5 Å²	48.5	33%	0.332	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	119.6	172	-169.2	176.7	20.2	0	0	111.2	A419 N420 P429 S496	A419-Q431 WeakPolarHBondContact CA-O 3.48Å; N420-Q431 HydrophobicContact CB-CB 4.32Å; N420-Q431 PolarHBondContact N-O 3.5Å; P429-Q431 PolarHBondContact O-N 2.96Å; Q431-S496 PolarHBondContact NE2-OG 3.05Å
432	L	93.2	Very high	80.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	136.7	176.5	-71.4	159.4	0	0	0	109.3	L417 S418 A419 I430 S496 L497 Y510 K538 V540	L417-L432 HydrophobicContact CD1-CB 4.21Å; L417-L432 HydrophobicContact CD1-CD2 4.14Å; L417-L432 HydrophobicContact CG-CD2 4.35Å; S418-L432 WeakPolarHBondContact O-CA 3.4Å; A419-L432 HydrophobicContact CB-CD2 3.78Å; I430-L432 HydrophobicContact CG2-CD1 4.15Å; I430-L432 HydrophobicContact CG2-CG 4.15Å; L432-S496 VanDerWaalsContact O-CA 3.26Å; L432-S496 WeakPolarHBondContact O-CA 3Å; L432-S496 PolarHBondContact O-OG 3.31Å; L432-L497 HydrophobicContact CB-CB 4.35Å; L432-L497 HydrophobicContact CD1-CD2 3.99Å; L432-L497 HydrophobicContact CD1-CG 4.5Å; L432-L497 PolarHBondContact N-O 2.86Å; L432-L497 PolarHBondContact O-N 3.47Å; L432-Y510 HydrophobicContact CD1-CD1 3.59Å; L432-Y510 HydrophobicContact CD1-CD2 3.92Å; L432-Y510 HydrophobicContact CD1-CE1 4.04Å; L432-Y510 HydrophobicContact CD1-CE2 4.33Å; L432-Y510 HydrophobicContact CD1-CG 3.5Å; L432-K538 HydrophobicContact CD2-CG 4.43Å; L432-V540 HydrophobicContact CD2-CG2 4.43Å
433	I	93.1	Very high	80.8	Confident	62 Å²	62	45.4 Å²	45.4	32%	0.318	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	115.2	178	-57.6	176.1	0	0	0	107.9	S418 I494	S418-I433 PolarHBondContact N-O 2.83Å; S418-I433 PolarHBondContact O-N 2.67Å; S418-I433 PolarHBondContact OG-O 2.94Å; I433-I494 HydrophobicContact CG2-CG2 3.68Å
434	C	92.9	Very high	81.1	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.6	174.4	-166.8	0	0	0	0	109.5	S416 L417 W447 F495 C512	S416-C434 WeakPolarHBondContact O-CA 3.4Å; L417-C434 HydrophobicContact CD1-CB 4.17Å; C434-W447 HydrophobicContact CB-CZ2 4.35Å; C434-F495 PolarHBondContact N-O 2.94Å; C434-F495 PolarHBondContact O-N 3.41Å; C434-C512 HydrophobicContact CB-CB 3.77Å; C434-C512 WeakPolarHBondContact CB-SG 3.47Å; C434-C512 WeakPolarHBondContact SG-CB 3.34Å; C434-C512 CovalentContact SG-SG 2.03Å; C434-C512 PolarHBondContact SG-SG 2.88Å
435	S	91	Very high	81.5	Confident	43 Å²	43	40.9 Å²	40.9	30%	0.301	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	119.8	179.6	179.8	0	0	0	0	109.3	S416	S416-S435 PolarHBondContact N-O 2.86Å; S416-S435 PolarHBondContact O-N 2.93Å; S416-S435 PolarHBondContact OG-O 2.98Å
436	V	88.1	Confident	82.3	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	100.8	-173.9	-174.8	0	0	0	0	108.7	T413 V415 S438 L443 N493 F495 A514	T413-V436 HydrophobicContact CG2-CG1 3.59Å; V415-V436 HydrophobicContact CG2-CG1 4.29Å; V415-V436 HydrophobicContact CG2-CG2 4.4Å; V436-S438 PolarHBondContact O-N 2.86Å; V436-L443 HydrophobicContact CB-CD1 3.87Å; V436-L443 HydrophobicContact CG1-CD1 3.69Å; V436-L443 HydrophobicContact CG1-CD2 4.08Å; V436-L443 HydrophobicContact CG2-CD1 4.39Å; V436-N493 PolarHBondContact N-O 2.9Å; V436-N493 VanDerWaalsContact O-CB 3.27Å; V436-N493 WeakPolarHBondContact O-CB 3.04Å; V436-N493 PolarHBondContact O-ND2 2.88Å; V436-N493 VanDerWaalsContact O-ND2 3.15Å; V436-F495 HydrophobicContact CG2-CE2 4.49Å; V436-A514 HydrophobicContact CG1-CB 4.04Å; V436-A514 HydrophobicContact CG2-CB 3.63Å
437	N	80	Confident	83.2	Confident	112 Å²	112	39.6 Å²	39.6	60%	0.599	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	99.3	175.4	-174.1	31.2	0	0	0	109.1	T413 T414	T413-N437 WeakPolarHBondContact CA-O 3.13Å; T414-N437 PolarHBondContact N-O 3.02Å; T414-N437 PolarHBondContact O-N 3.02Å
438	S	67.6	Low	84	Confident	10 Å²	10	41 Å²	41	7%	0.07	24%	0.238	C	C	.	.			trans	-139.7	144.9	-178.3	-167	0	0	0	0	111.1	T413 V436 I440 N493 Q516	T413-S438 WeakPolarHBondContact OG1-CB 3.38Å; T413-S438 PolarHBondContact OG1-OG 3.27Å; V436-S438 PolarHBondContact O-N 2.86Å; S438-I440 PolarHBondContact O-N 3.25Å; S438-I440 VanDerWaalsContact O-N 3.12Å; S438-N493 PolarHBondContact O-ND2 3.21Å; S438-Q516 PolarHBondContact OG-NE2 2.72Å
439	A	55.9	Low	84.5	Confident	67 Å²	67	38.7 Å²	38.7	55%	0.554	22%	0.224	S	C	*	.	S	Bend	trans	-84.8	79	-177.1	0	0	0	0	0	111.8
440	I	60.5	Low	84.6	Confident	171 Å²	171	35.9 Å²	35.9	88%	0.877	21%	0.205	S	C	*	.	S	Bend	trans	58.4	78.3	165.5	-44.9	176.9	0	0	0	113.7	S438	S438-I440 PolarHBondContact O-N 3.25Å; S438-I440 VanDerWaalsContact O-N 3.12Å
441	A	65.3	Low	84.2	Confident	24 Å²	24	38.4 Å²	38.4	20%	0.198	22%	0.219	C	C	.	.			trans	-150.2	154.7	170.5	0	0	0	0	0	111	Q516	A441-Q516 HydrophobicContact CB-CG 3.65Å
442	P	77.4	Confident	83.3	Confident	48 Å²	48	42.3 Å²	42.3	31%	0.312	23%	0.23	S	C	.	.			trans	-63.3	135.6	169.2	-26.7	39.8	0	0	0	111.9	R466 W517 W528	P442-R466 HydrophobicContact CB-CB 4.15Å; P442-W517 PolarHBondContact O-N 3.5Å; P442-W517 VanDerWaalsContact O-N 3.09Å; P442-W528 HydrophobicContact CB-CH2 4.22Å; P442-W528 HydrophobicContact CB-CZ3 4.02Å; P442-W528 HydrophobicContact CG-CH2 3.74Å; P442-W528 HydrophobicContact CG-CZ3 3.68Å
443	L	85.6	Confident	82.2	Confident	1 Å²	1	50 Å²	50	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	134.6	-175.1	-62.4	173.4	0	0	0	109.3	V436 V445 F495 T515 Q516	V436-L443 HydrophobicContact CB-CD1 3.87Å; V436-L443 HydrophobicContact CG1-CD1 3.69Å; V436-L443 HydrophobicContact CG1-CD2 4.08Å; V436-L443 HydrophobicContact CG2-CD1 4.39Å; L443-V445 HydrophobicContact CB-CG2 4.45Å; L443-F495 HydrophobicContact CB-CZ 4.19Å; L443-F495 HydrophobicContact CD1-CE2 4.04Å; L443-F495 HydrophobicContact CD1-CZ 4.28Å; L443-T515 WeakPolarHBondContact CA-O 3.27Å; L443-Q516 HydrophobicContact CD2-CB 4.32Å; L443-Q516 HydrophobicContact CD2-CG 4.49Å
444	T	89.9	Confident	80.9	Confident	19 Å²	19	50.8 Å²	50.8	12%	0.117	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	131.8	159.8	58.3	0	0	0	0	108.1	V464 D465 R466 T515 W517	T444-V464 WeakPolarHBondContact CA-O 3.46Å; T444-D465 VanDerWaalsContact CG2-OD1 3.25Å; T444-D465 WeakPolarHBondContact CG2-OD1 3.45Å; T444-R466 HydrophobicContact CG2-CB 4.24Å; T444-T515 PolarHBondContact N-O 3.15Å; T444-T515 VanDerWaalsContact N-O 3.08Å; T444-T515 PolarHBondContact O-N 2.88Å; T444-W517 PolarHBondContact OG1-NE1 2.68Å
445	V	92	Very high	79.5	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.1	-177.2	-174.7	0	0	0	0	109.4	L443 W447 A463 V464 F495 C512 S513 A514	L443-V445 HydrophobicContact CB-CG2 4.45Å; V445-W447 HydrophobicContact CB-CH2 3.81Å; V445-W447 HydrophobicContact CB-CZ3 3.87Å; V445-W447 HydrophobicContact CG1-CD2 4.35Å; V445-W447 HydrophobicContact CG1-CE3 4.12Å; V445-W447 HydrophobicContact CG1-CH2 3.43Å; V445-W447 VanDerWaalsContact CG1-CH2 3.43Å; V445-W447 HydrophobicContact CG1-CZ2 3.7Å; V445-W447 HydrophobicContact CG1-CZ3 3.65Å; V445-W447 VanDerWaalsContact O-CZ3 3.26Å; V445-W447 WeakPolarHBondContact O-CZ3 3.32Å; V445-A463 CarbonylContact O-C 3.5Å; V445-A463 VanDerWaalsContact O-CA 3.27Å; V445-A463 WeakPolarHBondContact O-CA 3.33Å; V445-V464 PolarHBondContact N-O 2.97Å; V445-V464 PolarHBondContact O-N 3.06Å; V445-F495 HydrophobicContact CB-CD1 4.34Å; V445-F495 HydrophobicContact CB-CE1 4.47Å; V445-F495 HydrophobicContact CB-CG 4.43Å; V445-F495 HydrophobicContact CG2-CD1 4.02Å; V445-F495 HydrophobicContact CG2-CD2 3.81Å; V445-F495 HydrophobicContact CG2-CE1 3.83Å; V445-F495 HydrophobicContact CG2-CE2 3.64Å; V445-F495 HydrophobicContact CG2-CG 4.01Å; V445-F495 HydrophobicContact CG2-CZ 3.65Å; V445-C512 WeakPolarHBondContact CG1-SG 3.16Å; V445-S513 WeakPolarHBondContact CA-O 3.23Å; V445-A514 HydrophobicContact CG2-CB 4.26Å
446	V	93.4	Very high	78.3	Confident	32 Å²	32	54.2 Å²	54.2	19%	0.194	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	131	-178.6	-172.5	0	0	0	0	108.9	Q448 E460 A463 S513	V446-Q448 HydrophobicContact CG1-CG 4.2Å; V446-E460 HydrophobicContact CG1-CG 3.91Å; V446-A463 HydrophobicContact CB-CB 4.42Å; V446-A463 HydrophobicContact CG1-CB 4.34Å; V446-A463 HydrophobicContact CG2-CB 3.99Å; V446-S513 PolarHBondContact N-O 2.9Å; V446-S513 PolarHBondContact O-N 3.08Å
447	W	94.3	Very high	77.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	118	172.9	-68.3	-102.1	0	0	0	109.3	C434 V445 V461 A462 V464 V487 F495 L497 R511	C434-W447 HydrophobicContact CB-CZ2 4.35Å; V445-W447 HydrophobicContact CB-CH2 3.81Å; V445-W447 HydrophobicContact CB-CZ3 3.87Å; V445-W447 HydrophobicContact CG1-CD2 4.35Å; V445-W447 HydrophobicContact CG1-CE3 4.12Å; V445-W447 HydrophobicContact CG1-CH2 3.43Å; V445-W447 VanDerWaalsContact CG1-CH2 3.43Å; V445-W447 HydrophobicContact CG1-CZ2 3.7Å; V445-W447 HydrophobicContact CG1-CZ3 3.65Å; V445-W447 VanDerWaalsContact O-CZ3 3.26Å; V445-W447 WeakPolarHBondContact O-CZ3 3.32Å; W447-V461 HydrophobicContact CB-CB 4.36Å; W447-V461 PolarHBondContact O-N 3.21Å; W447-A462 PolarHBondContact N-O 3.02Å; W447-V464 HydrophobicContact CH2-CB 4.46Å; W447-V464 HydrophobicContact CH2-CG2 3.94Å; W447-V464 HydrophobicContact CZ3-CB 4.16Å; W447-V464 HydrophobicContact CZ3-CG2 3.74Å; W447-V487 HydrophobicContact CE3-CG1 4.15Å; W447-V487 HydrophobicContact CH2-CG1 3.51Å; W447-V487 HydrophobicContact CZ2-CG1 4.08Å; W447-V487 HydrophobicContact CZ3-CG1 3.56Å; W447-F495 HydrophobicContact CH2-CB 3.6Å; W447-F495 HydrophobicContact CH2-CD1 4.3Å; W447-F495 HydrophobicContact CH2-CG 4.25Å; W447-F495 HydrophobicContact CZ2-CB 3.57Å; W447-L497 HydrophobicContact CB-CD2 3.64Å; W447-L497 VanDerWaalsContact CD1-CD2 3.44Å; W447-L497 HydrophobicContact CD2-CB 4.18Å; W447-L497 HydrophobicContact CD2-CD2 4.4Å; W447-L497 HydrophobicContact CG-CB 4.1Å; W447-L497 HydrophobicContact CG-CD2 3.56Å; W447-L497 HydrophobicContact CG-CG 4.43Å; W447-L497 HydrophobicContact CZ2-CB 4.48Å; W447-R511 WeakPolarHBondContact CA-O 3.43Å
448	Q	92.8	Very high	78.1	Confident	52 Å²	52	58.5 Å²	58.5	24%	0.243	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	147	175.6	-66.6	174.5	-30.3	0	0	109.6	V446 I458 Q459 Y510 R511	V446-Q448 HydrophobicContact CG1-CG 4.2Å; Q448-I458 HydrophobicContact CB-CG2 3.72Å; Q448-I458 HydrophobicContact CG-CG2 3.97Å; Q448-Q459 CarbonylContact C-O 3.58Å; Q448-Q459 VanDerWaalsContact CA-O 3.24Å; Q448-Q459 WeakPolarHBondContact CA-O 3.41Å; Q448-Y510 CarbonylContact O-C 3.58Å; Q448-Y510 WeakPolarHBondContact O-CA 3.4Å; Q448-R511 HydrophobicContact CB-CB 4.28Å; Q448-R511 PolarHBondContact N-O 2.89Å; Q448-R511 PolarHBondContact O-N 2.89Å
449	W	92	Very high	79.2	Confident	25 Å²	25	60.8 Å²	60.8	10%	0.095	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	143.7	173.2	173.3	96.3	0	0	0	109.6	D451 Q459 V461 G505 D506 E507 Y510	W449-D451 HydrophobicContact CH2-CB 4.25Å; W449-Q459 HydrophobicContact CE3-CB 4.31Å; W449-Q459 HydrophobicContact CE3-CG 4.25Å; W449-Q459 HydrophobicContact CZ3-CG 4.48Å; W449-Q459 PolarHBondContact N-O 2.89Å; W449-Q459 PolarHBondContact O-N 3.28Å; W449-V461 HydrophobicContact CB-CG2 3.68Å; W449-G505 WeakPolarHBondContact CZ2-O 3.44Å; W449-D506 PolarHBondContact NE1-O 3.13Å; W449-E507 VanDerWaalsContact CZ2-O 3.29Å; W449-E507 WeakPolarHBondContact CZ2-O 3.48Å; W449-E507 PolarHBondContact NE1-O 3.19Å; W449-Y510 HydrophobicContact CB-CD1 4.22Å; W449-Y510 HydrophobicContact CB-CE1 4.21Å; W449-Y510 AromaticContact CD1-CE1 3.71Å; W449-Y510 AromaticContact CD1-CE2 3.92Å; W449-Y510 AromaticContact CD1-CZ 3.62Å; W449-Y510 HydrophobicContact CG-CE1 4.34Å
450	T	89.3	Confident	80.8	Confident	13 Å²	13	61.2 Å²	61.2	8%	0.08	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	143.2	173	43.5	0	0	0	0	109.2	I458 G508 Q509	T450-I458 HydrophobicContact CG2-CB 4.11Å; T450-I458 HydrophobicContact CG2-CG1 3.7Å; T450-I458 HydrophobicContact CG2-CG2 4.19Å; T450-G508 CarbonylContact O-C 3.58Å; T450-G508 VanDerWaalsContact O-CA 3.31Å; T450-G508 WeakPolarHBondContact O-CA 3.42Å; T450-Q509 PolarHBondContact N-O 3.49Å; T450-Q509 PolarHBondContact O-N 2.8Å; T450-Q509 PolarHBondContact OG1-O 2.82Å; T450-Q509 VanDerWaalsContact OG1-O 3.04Å
451	D	82.8	Confident	82.3	Confident	57 Å²	57	53 Å²	53	31%	0.305	30%	0.297	S	S	.	.			trans	-50.1	152.2	171.7	167.1	58.1	0	0	0	112.3	W449 Q453 S454	W449-D451 HydrophobicContact CH2-CB 4.25Å; D451-Q453 PolarHBondContact O-N 2.93Å; D451-Q453 VanDerWaalsContact O-N 3.11Å; D451-Q453 WeakPolarHBondContact OD2-CB 3.27Å; D451-Q453 PolarHBondContact OD2-N 3.44Å; D451-S454 WeakPolarHBondContact O-CA 3.47Å; D451-S454 PolarHBondContact O-N 3.43Å
452	R	71.8	Confident	83.6	Confident	152 Å²	152	51.9 Å²	51.9	57%	0.574	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.4	-176.9	-178.7	170.4	171.4	-175.8	-1.8	114	S454 E507	R452-S454 VanDerWaalsContact C-N 3.35Å; R452-E507 WeakPolarHBondContact CD-OE1 3.43Å; R452-E507 IonicContact CZ-OE1 3.68Å; R452-E507 IonicContact NE-OE1 2.85Å; R452-E507 IonicContact NH1-OE1 3.07Å; R452-E507 PolarHBondContact NH1-OE1 2.98Å; R452-E507 IonicContact NH1-OE2 3.58Å
453	Q	70.4	Confident	84.3	Confident	163 Å²	163	50.2 Å²	50.2	76%	0.762	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-2.6	175.6	-55.3	-170.4	13.4	0	0	113.6	D451 A455	D451-Q453 PolarHBondContact O-N 2.93Å; D451-Q453 VanDerWaalsContact O-N 3.11Å; D451-Q453 WeakPolarHBondContact OD2-CB 3.27Å; D451-Q453 PolarHBondContact OD2-N 3.44Å; Q453-A455 HydrophobicContact CB-CB 4.43Å; Q453-A455 PolarHBondContact O-N 2.99Å; Q453-A455 VanDerWaalsContact O-N 3.12Å
454	S	65.4	Low	84.6	Confident	78 Å²	78	50.3 Å²	50.3	55%	0.545	28%	0.278	S	S	.	.	S	Bend	trans	58.3	15.3	-174.7	-51.2	0	0	0	0	114.9	D451 R452	D451-S454 WeakPolarHBondContact O-CA 3.47Å; D451-S454 PolarHBondContact O-N 3.43Å; R452-S454 VanDerWaalsContact C-N 3.35Å
455	A	63.1	Low	84.5	Confident	86 Å²	86	52.6 Å²	52.6	71%	0.711	29%	0.29	S	S	*	.			trans	-96.8	-16.8	-176.9	0	0	0	0	0	113.9	Q453	Q453-A455 HydrophobicContact CB-CB 4.43Å; Q453-A455 PolarHBondContact O-N 2.99Å; Q453-A455 VanDerWaalsContact O-N 3.12Å
456	G	67.8	Low	84	Confident	29 Å²	29	54.7 Å²	54.7	30%	0.299	30%	0.298	S	S	.	.	S	Bend	trans	-81	165.3	177.2	0	0	0	0	0	113.8
457	P	79.1	Confident	83.3	Confident	104 Å²	104	59.5 Å²	59.5	68%	0.675	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-63.8	140.6	175.5	28.3	-34.9	0	0	0	111.5	Q459	P457-Q459 PolarHBondContact O-N 2.79Å
458	I	84.4	Confident	82.5	Confident	97 Å²	97	61 Å²	61	50%	0.497	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-66.8	122.9	173.3	-51.1	178.8	0	0	0	108.6	Q448 T450	Q448-I458 HydrophobicContact CB-CG2 3.72Å; Q448-I458 HydrophobicContact CG-CG2 3.97Å; T450-I458 HydrophobicContact CG2-CB 4.11Å; T450-I458 HydrophobicContact CG2-CG1 3.7Å; T450-I458 HydrophobicContact CG2-CG2 4.19Å
459	Q	89	Confident	82.1	Confident	59 Å²	59	62.4 Å²	62.4	28%	0.276	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	138.7	174.6	-58.8	-169.3	41.6	0	0	110.2	Q448 W449 P457 S475 Y476	Q448-Q459 CarbonylContact C-O 3.58Å; Q448-Q459 VanDerWaalsContact CA-O 3.24Å; Q448-Q459 WeakPolarHBondContact CA-O 3.41Å; W449-Q459 HydrophobicContact CE3-CB 4.31Å; W449-Q459 HydrophobicContact CE3-CG 4.25Å; W449-Q459 HydrophobicContact CZ3-CG 4.48Å; W449-Q459 PolarHBondContact N-O 2.89Å; W449-Q459 PolarHBondContact O-N 3.28Å; P457-Q459 PolarHBondContact O-N 2.79Å; Q459-S475 VanDerWaalsContact OE1-CB 3.25Å; Q459-S475 PolarHBondContact OE1-OG 2.93Å; Q459-Y476 HydrophobicContact CB-CE2 4.3Å
460	E	91.1	Very high	82	Confident	75 Å²	75	63.9 Å²	63.9	35%	0.35	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	126.6	166.7	-171.7	180	124.2	0	0	109.2	V446 G473 Y476	V446-E460 HydrophobicContact CG1-CG 3.91Å; E460-G473 WeakPolarHBondContact O-CA 3.42Å; E460-Y476 WeakPolarHBondContact O-CD2 3.35Å
461	V	91.8	Very high	82.1	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-53.2	173.1	-173.2	0	0	0	0	109	W447 W449 G473 Y476 I485 L497 Y510	W447-V461 HydrophobicContact CB-CB 4.36Å; W447-V461 PolarHBondContact O-N 3.21Å; W449-V461 HydrophobicContact CB-CG2 3.68Å; V461-G473 PolarHBondContact O-N 2.95Å; V461-Y476 HydrophobicContact CB-CD2 4.25Å; V461-Y476 HydrophobicContact CB-CE2 4.31Å; V461-Y476 HydrophobicContact CG1-CD1 4.19Å; V461-Y476 HydrophobicContact CG1-CD2 4.26Å; V461-Y476 HydrophobicContact CG1-CE1 4.4Å; V461-Y476 HydrophobicContact CG1-CE2 4.46Å; V461-Y476 HydrophobicContact CG1-CG 4.09Å; V461-Y476 HydrophobicContact CG2-CD2 4.33Å; V461-Y476 HydrophobicContact CG2-CE2 3.88Å; V461-I485 HydrophobicContact CG1-CG2 4.38Å; V461-L497 HydrophobicContact CB-CD2 4.42Å; V461-L497 HydrophobicContact CG1-CD1 4.16Å; V461-L497 HydrophobicContact CG1-CD2 4.11Å; V461-Y510 HydrophobicContact CG2-CD1 4.41Å; V461-Y510 HydrophobicContact CG2-CE1 4.18Å
462	A	93.1	Very high	82.4	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	166.7	176.5	0	0	0	0	0	110.9	W447 T471 V487	W447-A462 PolarHBondContact N-O 3.02Å; A462-T471 CarbonylContact C-O 3.6Å; A462-T471 WeakPolarHBondContact CA-O 3.45Å; A462-T471 WeakPolarHBondContact CB-O 3.44Å; A462-V487 HydrophobicContact CB-CG2 3.55Å
463	A	91.9	Very high	83.2	Confident	13 Å²	13	58.4 Å²	58.4	11%	0.107	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	155.4	168.6	0	0	0	0	0	111.4	V445 V446 V470 T471	V445-A463 CarbonylContact O-C 3.5Å; V445-A463 VanDerWaalsContact O-CA 3.27Å; V445-A463 WeakPolarHBondContact O-CA 3.33Å; V446-A463 HydrophobicContact CB-CB 4.42Å; V446-A463 HydrophobicContact CG1-CB 4.34Å; V446-A463 HydrophobicContact CG2-CB 3.99Å; A463-V470 WeakPolarHBondContact O-CA 3.26Å; A463-T471 PolarHBondContact N-O 2.84Å; A463-T471 PolarHBondContact O-N 2.98Å
464	V	91.4	Very high	83.9	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.012	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	117.2	166.9	173.2	0	0	0	0	107	T444 V445 W447 T469 V470 V487 F495	T444-V464 WeakPolarHBondContact CA-O 3.46Å; V445-V464 PolarHBondContact N-O 2.97Å; V445-V464 PolarHBondContact O-N 3.06Å; W447-V464 HydrophobicContact CH2-CB 4.46Å; W447-V464 HydrophobicContact CH2-CG2 3.94Å; W447-V464 HydrophobicContact CZ3-CB 4.16Å; W447-V464 HydrophobicContact CZ3-CG2 3.74Å; V464-T469 WeakPolarHBondContact CA-O 3.27Å; V464-V470 HydrophobicContact CG2-CG2 4.28Å; V464-V487 HydrophobicContact CG2-CB 4.26Å; V464-V487 HydrophobicContact CG2-CG1 3.48Å; V464-V487 VanDerWaalsContact CG2-CG1 3.48Å; V464-F495 HydrophobicContact CB-CD1 4.32Å; V464-F495 HydrophobicContact CB-CE1 4.44Å; V464-F495 HydrophobicContact CG1-CD1 4.1Å; V464-F495 HydrophobicContact CG1-CE1 3.91Å; V464-F495 HydrophobicContact CG2-CD1 4.48Å
465	D	87.1	Confident	84.8	Confident	67 Å²	67	55.9 Å²	55.9	36%	0.358	34%	0.343	S	S	.	.			trans	-77.7	167.7	176.3	-161.3	8.6	0	0	0	111.5	T444 D467 G468 T469	T444-D465 VanDerWaalsContact CG2-OD1 3.25Å; T444-D465 WeakPolarHBondContact CG2-OD1 3.45Å; D465-D467 PolarHBondContact O-N 3.15Å; D465-D467 VanDerWaalsContact O-N 3.11Å; D465-G468 PolarHBondContact O-N 3.4Å; D465-T469 PolarHBondContact N-O 2.78Å
466	R	82.5	Confident	86	Confident	44 Å²	44	52.3 Å²	52.3	17%	0.166	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-36.3	-174.4	51.2	167.9	62.3	103.9	4.5	113.7	P442 T444 G468 R489 W528	P442-R466 HydrophobicContact CB-CB 4.15Å; T444-R466 HydrophobicContact CG2-CB 4.24Å; R466-G468 VanDerWaalsContact C-N 3.29Å; R466-G468 PolarHBondContact O-N 3.12Å; R466-R489 PolarHBondContact O-NH1 2.72Å; R466-W528 VanDerWaalsContact NH2-CB 3.34Å
467	D	77.6	Confident	86.8	Confident	133 Å²	133	58.2 Å²	58.2	71%	0.711	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-2.4	-177.5	-56	-27.3	0	0	0	112.7	D465	D465-D467 PolarHBondContact O-N 3.15Å; D465-D467 VanDerWaalsContact O-N 3.11Å
468	G	77.7	Confident	87	Confident	32 Å²	32	58.7 Å²	58.7	33%	0.33	32%	0.317	S	S	.	.	S	Bend	trans	95	-3.4	-179.3	0	0	0	0	0	114.9	D465 R466 V470	D465-G468 PolarHBondContact O-N 3.4Å; R466-G468 VanDerWaalsContact C-N 3.29Å; R466-G468 PolarHBondContact O-N 3.12Å; G468-V470 PolarHBondContact O-N 3.44Å
469	T	85.9	Confident	87.1	Confident	82 Å²	82	55 Å²	55	50%	0.503	30%	0.297	S	S	.	.			trans	-58.6	128.8	175.4	-52.1	0	0	0	0	111	V464 D465	V464-T469 WeakPolarHBondContact CA-O 3.27Å; D465-T469 PolarHBondContact N-O 2.78Å
470	V	89.5	Confident	86.8	Confident	55 Å²	55	53.3 Å²	53.3	33%	0.333	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	130	177	-175.9	0	0	0	0	109.9	A463 V464 G468 V487	A463-V470 WeakPolarHBondContact O-CA 3.26Å; V464-V470 HydrophobicContact CG2-CG2 4.28Å; G468-V470 PolarHBondContact O-N 3.44Å; V470-V487 HydrophobicContact CG1-CB 3.94Å; V470-V487 HydrophobicContact CG1-CG2 4.13Å; V470-V487 HydrophobicContact CG2-CB 4.49Å
471	T	90.3	Very high	86.4	Confident	67 Å²	67	53 Å²	53	41%	0.411	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	136	170.4	53.2	0	0	0	0	110.4	A462 A463	A462-T471 CarbonylContact C-O 3.6Å; A462-T471 WeakPolarHBondContact CA-O 3.45Å; A462-T471 WeakPolarHBondContact CB-O 3.44Å; A463-T471 PolarHBondContact N-O 2.84Å; A463-T471 PolarHBondContact O-N 2.98Å
472	H	90.4	Very high	85.9	Confident	38 Å²	38	59.6 Å²	59.6	18%	0.176	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	135.9	177	-63.3	-83.9	0	0	0	111.3	R477 S480 I485	H472-R477 PolarHBondContact O-NH2 2.78Å; H472-S480 WeakPolarHBondContact CB-OG 3.47Å; H472-S480 WeakPolarHBondContact ND1-CB 3.41Å; H472-I485 PolarHBondContact CE1-O 3.08Å
473	G	87.7	Confident	85.4	Confident	2 Å²	2	61.9 Å²	61.9	2%	0.021	36%	0.359	C	S	.	.			trans	-66.6	158.8	-178.6	0	0	0	0	0	112.6	E460 V461 S475 Y476 R477	E460-G473 WeakPolarHBondContact O-CA 3.42Å; V461-G473 PolarHBondContact O-N 2.95Å; G473-S475 PolarHBondContact O-N 3.2Å; G473-Y476 PolarHBondContact O-N 2.9Å; G473-Y476 VanDerWaalsContact O-N 3.08Å; G473-R477 PolarHBondContact O-N 3.42Å
474	P	86.2	Confident	85.1	Confident	118 Å²	118	62.4 Å²	62.4	77%	0.766	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-57.1	-44	-168.3	-27.3	35.8	0	0	0	114.5	Y476	P474-Y476 VanDerWaalsContact C-N 3.3Å; P474-Y476 PolarHBondContact O-N 3.43Å
475	S	84.3	Confident	85.1	Confident	70 Å²	70	62.5 Å²	62.5	49%	0.49	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-73.2	-17.2	-179.9	43.4	0	0	0	0	114.5	Q459 G473	Q459-S475 VanDerWaalsContact OE1-CB 3.25Å; Q459-S475 PolarHBondContact OE1-OG 2.93Å; G473-S475 PolarHBondContact O-N 3.2Å
476	Y	86.8	Confident	85.2	Confident	12 Å²	12	65.8 Å²	65.8	5%	0.047	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-107.6	-3.9	-178.6	-68.5	-80.4	0	0	0	112.9	Q459 E460 V461 G473 P474 E478 R479 S480 I485 L499	Q459-Y476 HydrophobicContact CB-CE2 4.3Å; E460-Y476 WeakPolarHBondContact O-CD2 3.35Å; V461-Y476 HydrophobicContact CB-CD2 4.25Å; V461-Y476 HydrophobicContact CB-CE2 4.31Å; V461-Y476 HydrophobicContact CG1-CD1 4.19Å; V461-Y476 HydrophobicContact CG1-CD2 4.26Å; V461-Y476 HydrophobicContact CG1-CE1 4.4Å; V461-Y476 HydrophobicContact CG1-CE2 4.46Å; V461-Y476 HydrophobicContact CG1-CG 4.09Å; V461-Y476 HydrophobicContact CG2-CD2 4.33Å; V461-Y476 HydrophobicContact CG2-CE2 3.88Å; G473-Y476 PolarHBondContact O-N 2.9Å; G473-Y476 VanDerWaalsContact O-N 3.08Å; P474-Y476 VanDerWaalsContact C-N 3.3Å; P474-Y476 PolarHBondContact O-N 3.43Å; Y476-E478 PolarHBondContact O-N 2.83Å; Y476-R479 PolarHBondContact O-N 2.92Å; Y476-S480 PolarHBondContact O-N 2.8Å; Y476-I485 HydrophobicContact CD1-CD1 3.49Å; Y476-I485 VanDerWaalsContact CD1-CD1 3.49Å; Y476-I485 HydrophobicContact CG-CD1 4.05Å; Y476-L499 HydrophobicContact CE1-CD2 4.32Å
477	R	85.2	Confident	85.6	Confident	153 Å²	153	64.3 Å²	64.3	58%	0.577	36%	0.362	S	S	*	.	H	α-helix	trans	-60.5	-43.5	-175.6	-176.2	162.5	-66.8	-132	-6.4	113.7	H472 G473 S480 G481	H472-R477 PolarHBondContact O-NH2 2.78Å; G473-R477 PolarHBondContact O-N 3.42Å; R477-S480 WeakPolarHBondContact CA-OG 3.21Å; R477-S480 PolarHBondContact O-N 2.88Å; R477-S480 PolarHBondContact O-OG 2.93Å; R477-G481 PolarHBondContact O-N 3.08Å
478	E	83.3	Confident	86.1	Confident	114 Å²	114	61 Å²	61	53%	0.533	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-50	179.4	-176.1	175.3	-169	0	0	111.5	Y476 S480 G481 Y482 Y663	Y476-E478 PolarHBondContact O-N 2.83Å; E478-S480 VanDerWaalsContact C-N 3.29Å; E478-S480 PolarHBondContact O-N 2.92Å; E478-G481 WeakPolarHBondContact O-CA 3.04Å; E478-G481 PolarHBondContact O-N 3.01Å; E478-Y482 HydrophobicContact CG-CD2 4.18Å; E478-Y482 HydrophobicContact CG-CE2 3.8Å; E478-Y482 VanDerWaalsContact O-CD2 3.31Å; E478-Y482 WeakPolarHBondContact O-CD2 3.26Å; E478-Y482 PolarHBondContact O-N 2.9Å; E478-Y663 WeakPolarHBondContact OE1-CB 3.49Å
479	R	86.3	Confident	86.6	Confident	19 Å²	19	63.9 Å²	63.9	7%	0.072	34%	0.343	C	S	.	.	H	α-helix	trans	-59.3	-37	176	-71.2	176.1	73.2	-168.1	7.1	112.4	Y476 G481 Y482 G483 E484 I485 N501 D506 Y663	Y476-R479 PolarHBondContact O-N 2.92Å; R479-G481 VanDerWaalsContact C-N 3.34Å; R479-G481 PolarHBondContact O-N 2.89Å; R479-Y482 PolarHBondContact O-N 3.4Å; R479-G483 PolarHBondContact O-N 3.18Å; R479-E484 HydrophobicContact CB-CB 4.21Å; R479-E484 WeakPolarHBondContact CG-OE2 3.3Å; R479-E484 IonicContact CZ-OE2 2.99Å; R479-E484 IonicContact NE-OE2 3.74Å; R479-E484 PolarHBondContact NE-OE2 3.44Å; R479-E484 IonicContact NH2-OE2 2.73Å; R479-E484 WeakPolarHBondContact O-CB 3.39Å; R479-E484 PolarHBondContact O-N 3.37Å; R479-I485 HydrophobicContact CB-CD1 3.64Å; R479-I485 HydrophobicContact CB-CG1 4.01Å; R479-N501 PolarHBondContact NH2-O 2.98Å; R479-D506 IonicContact CZ-OD1 2.64Å; R479-D506 IonicContact CZ-OD2 2.73Å; R479-D506 VanDerWaalsContact NH1-CG 3.3Å; R479-D506 IonicContact NH1-OD1 3.87Å; R479-D506 PolarHBondContact NH1-OD1 3.02Å; R479-D506 IonicContact NH1-OD2 3.93Å; R479-D506 PolarHBondContact NH1-OD2 3.34Å; R479-D506 IonicContact NH2-OD1 2.82Å; R479-D506 IonicContact NH2-OD2 2.65Å; R479-D506 PolarHBondContact NH2-OD2 2.87Å; R479-Y663 HydrophobicContact CG-CE2 4.07Å
480	S	83.9	Confident	86.6	Confident	24 Å²	24	63.6 Å²	63.6	17%	0.168	34%	0.341	C	S	.	.	H	α-helix	trans	-65	-34.6	172.4	74.1	0	0	0	0	113.3	H472 Y476 R477 E478 Y482 G483	H472-S480 WeakPolarHBondContact CB-OG 3.47Å; H472-S480 WeakPolarHBondContact ND1-CB 3.41Å; Y476-S480 PolarHBondContact O-N 2.8Å; R477-S480 WeakPolarHBondContact CA-OG 3.21Å; R477-S480 PolarHBondContact O-N 2.88Å; R477-S480 PolarHBondContact O-OG 2.93Å; E478-S480 VanDerWaalsContact C-N 3.29Å; E478-S480 PolarHBondContact O-N 2.92Å; S480-Y482 VanDerWaalsContact C-N 3.3Å; S480-Y482 PolarHBondContact O-N 2.86Å; S480-G483 PolarHBondContact O-N 2.79Å
481	G	82.1	Confident	86.3	Confident	69 Å²	69	68.9 Å²	68.9	71%	0.711	36%	0.355	S	S	*	.	H	α-helix	trans	-65.6	-30.4	175.2	0	0	0	0	0	113.6	R477 E478 R479 G483	R477-G481 PolarHBondContact O-N 3.08Å; E478-G481 WeakPolarHBondContact O-CA 3.04Å; E478-G481 PolarHBondContact O-N 3.01Å; R479-G481 VanDerWaalsContact C-N 3.34Å; R479-G481 PolarHBondContact O-N 2.89Å; G481-G483 VanDerWaalsContact C-N 3.29Å
482	Y	81.6	Confident	85.8	Confident	138 Å²	138	69.9 Å²	69.9	54%	0.541	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	1.5	170.3	-67.8	-70	0	0	0	113.9	E478 R479 S480 E484 Y663	E478-Y482 HydrophobicContact CG-CD2 4.18Å; E478-Y482 HydrophobicContact CG-CE2 3.8Å; E478-Y482 VanDerWaalsContact O-CD2 3.31Å; E478-Y482 WeakPolarHBondContact O-CD2 3.26Å; E478-Y482 PolarHBondContact O-N 2.9Å; R479-Y482 PolarHBondContact O-N 3.4Å; S480-Y482 VanDerWaalsContact C-N 3.3Å; S480-Y482 PolarHBondContact O-N 2.86Å; Y482-E484 VanDerWaalsContact C-N 3.31Å; Y482-E484 PolarHBondContact O-N 3.35Å; Y482-Y663 AromaticContact CD2-CD1 3.78Å; Y482-Y663 HydrophobicContact CD2-CD1 3.78Å; Y482-Y663 HydrophobicContact CD2-CE1 4.46Å; Y482-Y663 HydrophobicContact CD2-CG 4.28Å; Y482-Y663 AromaticContact CE2-CD1 3.91Å; Y482-Y663 HydrophobicContact CE2-CD1 3.91Å; Y482-Y663 HydrophobicContact CE2-CG 4.06Å; Y482-Y663 HydrophobicContact CG-CD1 4.4Å; Y482-Y663 PolarHBondContact OH-O 2.99Å
483	G	81.6	Confident	85.6	Confident	48 Å²	48	70.6 Å²	70.6	50%	0.495	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	8.1	180	0	0	0	0	0	115.2	R479 S480 G481 I485	R479-G483 PolarHBondContact O-N 3.18Å; S480-G483 PolarHBondContact O-N 2.79Å; G481-G483 VanDerWaalsContact C-N 3.29Å; G483-I485 VanDerWaalsContact C-N 3.29Å; G483-I485 PolarHBondContact O-N 3Å
484	E	85.9	Confident	85.7	Confident	23 Å²	23	72.6 Å²	72.6	11%	0.107	38%	0.378	C	S	.	.			trans	-69.6	-26.4	178.1	-65.4	-163.2	155.1	0	0	113	R479 Y482 L499 Y500 N501 Y663	R479-E484 HydrophobicContact CB-CB 4.21Å; R479-E484 WeakPolarHBondContact CG-OE2 3.3Å; R479-E484 IonicContact CZ-OE2 2.99Å; R479-E484 IonicContact NE-OE2 3.74Å; R479-E484 PolarHBondContact NE-OE2 3.44Å; R479-E484 IonicContact NH2-OE2 2.73Å; R479-E484 WeakPolarHBondContact O-CB 3.39Å; R479-E484 PolarHBondContact O-N 3.37Å; Y482-E484 VanDerWaalsContact C-N 3.31Å; Y482-E484 PolarHBondContact O-N 3.35Å; E484-L499 CarbonylContact O-C 3.59Å; E484-Y500 VanDerWaalsContact O-CD2 3.23Å; E484-Y500 WeakPolarHBondContact O-CD2 3.41Å; E484-Y500 PolarHBondContact O-N 3.42Å; E484-N501 WeakPolarHBondContact OE1-CB 3.39Å; E484-N501 PolarHBondContact OE1-ND2 3.01Å; E484-Y663 PolarHBondContact OE1-OH 3.04Å; E484-Y663 VanDerWaalsContact OE1-OH 3.13Å; E484-Y663 PolarHBondContact OE2-OH 3.25Å
485	I	90.5	Very high	85.9	Confident	5 Å²	5	67 Å²	67	3%	0.026	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	108.3	-175.6	-58	178.7	0	0	0	108.5	V461 H472 Y476 R479 G483 L497 S498 L499	V461-I485 HydrophobicContact CG1-CG2 4.38Å; H472-I485 PolarHBondContact CE1-O 3.08Å; Y476-I485 HydrophobicContact CD1-CD1 3.49Å; Y476-I485 VanDerWaalsContact CD1-CD1 3.49Å; Y476-I485 HydrophobicContact CG-CD1 4.05Å; R479-I485 HydrophobicContact CB-CD1 3.64Å; R479-I485 HydrophobicContact CB-CG1 4.01Å; G483-I485 VanDerWaalsContact C-N 3.29Å; G483-I485 PolarHBondContact O-N 3Å; I485-L497 HydrophobicContact CG2-CD1 4.03Å; I485-S498 WeakPolarHBondContact CA-O 3.15Å; I485-L499 HydrophobicContact CG1-CG 4.32Å
486	R	89.8	Confident	86.3	Confident	136 Å²	136	63.7 Å²	63.7	51%	0.513	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	133.7	-178.7	176.5	174.8	169.6	146.6	-5.4	109.6	E488 S498 Y500	R486-E488 IonicContact CZ-OE2 3.59Å; R486-E488 IonicContact NE-OE2 2.85Å; R486-E488 PolarHBondContact NE-OE2 3.4Å; R486-E488 IonicContact NH2-OE2 3.78Å; R486-E488 PolarHBondContact NH2-OE2 3.06Å; R486-S498 PolarHBondContact N-O 3.43Å; R486-S498 PolarHBondContact O-N 3.28Å; R486-Y500 HydrophobicContact CB-CE2 3.9Å
487	V	91.7	Very high	86.7	Confident	13 Å²	13	63.1 Å²	63.1	8%	0.079	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	137.4	169.9	-163	0	0	0	0	108.9	W447 A462 V464 V470 S496 L497	W447-V487 HydrophobicContact CE3-CG1 4.15Å; W447-V487 HydrophobicContact CH2-CG1 3.51Å; W447-V487 HydrophobicContact CZ2-CG1 4.08Å; W447-V487 HydrophobicContact CZ3-CG1 3.56Å; A462-V487 HydrophobicContact CB-CG2 3.55Å; V464-V487 HydrophobicContact CG2-CB 4.26Å; V464-V487 HydrophobicContact CG2-CG1 3.48Å; V464-V487 VanDerWaalsContact CG2-CG1 3.48Å; V470-V487 HydrophobicContact CG1-CB 3.94Å; V470-V487 HydrophobicContact CG1-CG2 4.13Å; V470-V487 HydrophobicContact CG2-CB 4.49Å; V487-S496 WeakPolarHBondContact CA-O 3.48Å; V487-S496 WeakPolarHBondContact CG1-O 3.39Å; V487-L497 HydrophobicContact CG2-CD1 3.86Å
488	E	87.4	Confident	87	Confident	62 Å²	62	56.1 Å²	56.1	29%	0.29	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	139.3	-177.4	54.3	178.8	-137.7	0	0	112.9	R486 V490 F495 S496	R486-E488 IonicContact CZ-OE2 3.59Å; R486-E488 IonicContact NE-OE2 2.85Å; R486-E488 PolarHBondContact NE-OE2 3.4Å; R486-E488 IonicContact NH2-OE2 3.78Å; R486-E488 PolarHBondContact NH2-OE2 3.06Å; E488-V490 HydrophobicContact CG-CG2 3.95Å; E488-V490 PolarHBondContact O-N 3.11Å; E488-F495 CarbonylContact O-C 3.54Å; E488-F495 WeakPolarHBondContact O-CA 3.48Å; E488-S496 PolarHBondContact N-O 3.39Å; E488-S496 PolarHBondContact O-N 2.68Å
489	R	88.3	Confident	87.4	Confident	93 Å²	93	50.7 Å²	50.7	35%	0.351	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	78.8	173.9	-171.8	173.8	-169.7	-178.3	2.3	109.7	R466 R491 P492 F495	R466-R489 PolarHBondContact O-NH1 2.72Å; R489-R491 VanDerWaalsContact C-N 3.26Å; R489-R491 WeakPolarHBondContact CG-O 3.42Å; R489-R491 PolarHBondContact O-N 2.96Å; R489-P492 PolarHBondContact NE-O 3.48Å; R489-P492 PolarHBondContact NH2-O 3.38Å; R489-F495 HydrophobicContact CB-CD1 4.06Å; R489-F495 HydrophobicContact CB-CE1 4.16Å; R489-F495 HydrophobicContact CG-CD1 3.88Å; R489-F495 HydrophobicContact CG-CE1 3.6Å; R489-F495 HydrophobicContact CG-CZ 4.15Å
490	V	86.1	Confident	87.2	Confident	76 Å²	76	54.3 Å²	54.3	46%	0.461	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	-37.5	-175.6	-171	0	0	0	0	112.4	E488 I494	E488-V490 HydrophobicContact CG-CG2 3.95Å; E488-V490 PolarHBondContact O-N 3.11Å; V490-I494 PolarHBondContact N-O 2.98Å
491	R	82.7	Confident	87.1	Confident	166 Å²	166	56 Å²	56	63%	0.626	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.4	166.9	172.4	-61.3	-171.1	-176.3	151.3	1.4	109.1	R489 N493 I494	R489-R491 VanDerWaalsContact C-N 3.26Å; R489-R491 WeakPolarHBondContact CG-O 3.42Å; R489-R491 PolarHBondContact O-N 2.96Å; R491-N493 PolarHBondContact O-N 2.95Å; R491-I494 HydrophobicContact CB-CB 4.1Å; R491-I494 HydrophobicContact CB-CG1 4.32Å; R491-I494 PolarHBondContact N-O 2.84Å; R491-I494 PolarHBondContact O-N 2.84Å
492	P	80.7	Confident	87.3	Confident	88 Å²	88	52.7 Å²	52.7	57%	0.571	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-33.1	-179.4	-31.1	37.3	0	0	0	115	R489	R489-P492 PolarHBondContact NE-O 3.48Å; R489-P492 PolarHBondContact NH2-O 3.38Å
493	N	85.5	Confident	87.4	Confident	54 Å²	54	47.9 Å²	47.9	29%	0.289	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	3	-177.4	-73.4	24.6	0	0	0	114.1	V436 S438 R491	V436-N493 PolarHBondContact N-O 2.9Å; V436-N493 VanDerWaalsContact O-CB 3.27Å; V436-N493 WeakPolarHBondContact O-CB 3.04Å; V436-N493 PolarHBondContact O-ND2 2.88Å; V436-N493 VanDerWaalsContact O-ND2 3.15Å; S438-N493 PolarHBondContact O-ND2 3.21Å; R491-N493 PolarHBondContact O-N 2.95Å
494	I	88.9	Confident	87.3	Confident	43 Å²	43	48.2 Å²	48.2	22%	0.221	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	124.3	-177.6	-53.8	-177.9	0	0	0	109.8	I433 V490 R491	I433-I494 HydrophobicContact CG2-CG2 3.68Å; V490-I494 PolarHBondContact N-O 2.98Å; R491-I494 HydrophobicContact CB-CB 4.1Å; R491-I494 HydrophobicContact CB-CG1 4.32Å; R491-I494 PolarHBondContact N-O 2.84Å; R491-I494 PolarHBondContact O-N 2.84Å
495	F	91.9	Very high	87.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	138.3	-175.6	-54.9	-107.8	0	0	0	109.2	C434 V436 L443 V445 W447 V464 E488 R489	C434-F495 PolarHBondContact N-O 2.94Å; C434-F495 PolarHBondContact O-N 3.41Å; V436-F495 HydrophobicContact CG2-CE2 4.49Å; L443-F495 HydrophobicContact CB-CZ 4.19Å; L443-F495 HydrophobicContact CD1-CE2 4.04Å; L443-F495 HydrophobicContact CD1-CZ 4.28Å; V445-F495 HydrophobicContact CB-CD1 4.34Å; V445-F495 HydrophobicContact CB-CE1 4.47Å; V445-F495 HydrophobicContact CB-CG 4.43Å; V445-F495 HydrophobicContact CG2-CD1 4.02Å; V445-F495 HydrophobicContact CG2-CD2 3.81Å; V445-F495 HydrophobicContact CG2-CE1 3.83Å; V445-F495 HydrophobicContact CG2-CE2 3.64Å; V445-F495 HydrophobicContact CG2-CG 4.01Å; V445-F495 HydrophobicContact CG2-CZ 3.65Å; W447-F495 HydrophobicContact CH2-CB 3.6Å; W447-F495 HydrophobicContact CH2-CD1 4.3Å; W447-F495 HydrophobicContact CH2-CG 4.25Å; W447-F495 HydrophobicContact CZ2-CB 3.57Å; V464-F495 HydrophobicContact CB-CD1 4.32Å; V464-F495 HydrophobicContact CB-CE1 4.44Å; V464-F495 HydrophobicContact CG1-CD1 4.1Å; V464-F495 HydrophobicContact CG1-CE1 3.91Å; V464-F495 HydrophobicContact CG2-CD1 4.48Å; E488-F495 CarbonylContact O-C 3.54Å; E488-F495 WeakPolarHBondContact O-CA 3.48Å; R489-F495 HydrophobicContact CB-CD1 4.06Å; R489-F495 HydrophobicContact CB-CE1 4.16Å; R489-F495 HydrophobicContact CG-CD1 3.88Å; R489-F495 HydrophobicContact CG-CE1 3.6Å; R489-F495 HydrophobicContact CG-CZ 4.15Å
496	S	92.6	Very high	86.9	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.014	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134.8	175.2	-166.6	0	0	0	0	111.2	Q431 L432 V487 E488	Q431-S496 PolarHBondContact NE2-OG 3.05Å; L432-S496 VanDerWaalsContact O-CA 3.26Å; L432-S496 WeakPolarHBondContact O-CA 3Å; L432-S496 PolarHBondContact O-OG 3.31Å; V487-S496 WeakPolarHBondContact CA-O 3.48Å; V487-S496 WeakPolarHBondContact CG1-O 3.39Å; E488-S496 PolarHBondContact N-O 3.39Å; E488-S496 PolarHBondContact O-N 2.68Å
497	L	94.1	Very high	86.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126	165	162.6	64.4	0	0	0	106.9	L432 W447 V461 I485 V487 L499	L432-L497 HydrophobicContact CB-CB 4.35Å; L432-L497 HydrophobicContact CD1-CD2 3.99Å; L432-L497 HydrophobicContact CD1-CG 4.5Å; L432-L497 PolarHBondContact N-O 2.86Å; L432-L497 PolarHBondContact O-N 3.47Å; W447-L497 HydrophobicContact CB-CD2 3.64Å; W447-L497 VanDerWaalsContact CD1-CD2 3.44Å; W447-L497 HydrophobicContact CD2-CB 4.18Å; W447-L497 HydrophobicContact CD2-CD2 4.4Å; W447-L497 HydrophobicContact CG-CB 4.1Å; W447-L497 HydrophobicContact CG-CD2 3.56Å; W447-L497 HydrophobicContact CG-CG 4.43Å; W447-L497 HydrophobicContact CZ2-CB 4.48Å; V461-L497 HydrophobicContact CB-CD2 4.42Å; V461-L497 HydrophobicContact CG1-CD1 4.16Å; V461-L497 HydrophobicContact CG1-CD2 4.11Å; I485-L497 HydrophobicContact CG2-CD1 4.03Å; V487-L497 HydrophobicContact CG2-CD1 3.86Å; L497-L499 HydrophobicContact CD1-CD1 3.86Å; L497-L499 HydrophobicContact CD2-CD1 3.92Å; L497-L499 HydrophobicContact CG-CD1 3.74Å
498	S	92.2	Very high	86.6	Confident	6 Å²	6	44.6 Å²	44.6	4%	0.042	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	119.9	173.6	-61.4	0	0	0	0	109.5	I430 I485 R486	I430-S498 WeakPolarHBondContact O-CA 3.41Å; I485-S498 WeakPolarHBondContact CA-O 3.15Å; R486-S498 PolarHBondContact N-O 3.43Å; R486-S498 PolarHBondContact O-N 3.28Å
499	L	91.4	Very high	86.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	102.6	164.1	-62.9	83.7	0	0	0	107.1	P429 I430 Y476 E484 I485 L497 Y510	P429-L499 CarbonylContact C-O 3.58Å; P429-L499 VanDerWaalsContact CA-O 3.3Å; P429-L499 WeakPolarHBondContact CA-O 3.29Å; I430-L499 HydrophobicContact CB-CB 4.35Å; I430-L499 PolarHBondContact N-O 2.86Å; I430-L499 PolarHBondContact O-N 2.92Å; Y476-L499 HydrophobicContact CE1-CD2 4.32Å; E484-L499 CarbonylContact O-C 3.59Å; I485-L499 HydrophobicContact CG1-CG 4.32Å; L497-L499 HydrophobicContact CD1-CD1 3.86Å; L497-L499 HydrophobicContact CD2-CD1 3.92Å; L497-L499 HydrophobicContact CG-CD1 3.74Å; L499-Y510 HydrophobicContact CD1-CE1 4.19Å
500	Y	82.9	Confident	87	Confident	94 Å²	94	39.2 Å²	39.2	37%	0.369	21%	0.212	S	C	.	.	S	Bend	trans	-71.6	152.8	166	-51.8	-71.1	0	0	0	109	P429 E484 R486	P429-Y500 HydrophobicContact CB-CD1 3.93Å; P429-Y500 HydrophobicContact CB-CE1 4.43Å; E484-Y500 VanDerWaalsContact O-CD2 3.23Å; E484-Y500 WeakPolarHBondContact O-CD2 3.41Å; E484-Y500 PolarHBondContact O-N 3.42Å; R486-Y500 HydrophobicContact CB-CE2 3.9Å
501	N	81.9	Confident	87.3	Confident	60 Å²	60	39.5 Å²	39.5	32%	0.321	20%	0.204	S	C	.	.	S	Bend	trans	55.7	60.9	-179	-170.4	34.3	0	0	0	113	R479 E484 L503	R479-N501 PolarHBondContact NH2-O 2.98Å; E484-N501 WeakPolarHBondContact OE1-CB 3.39Å; E484-N501 PolarHBondContact OE1-ND2 3.01Å; N501-L503 PolarHBondContact O-N 2.03Å
502	A	85.1	Confident	87.8	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.175	C	C	.	.			trans	-59.3	131.3	179.4	0	0	0	0	0	112.4	V424 E426 G427 D428 I430	V424-A502 HydrophobicContact CG1-CB 4.38Å; E426-A502 CarbonylContact C-O 3.57Å; E426-A502 WeakPolarHBondContact CA-O 3.25Å; G427-A502 PolarHBondContact N-O 3.43Å; D428-A502 WeakPolarHBondContact O-CB 3.36Å; D428-A502 PolarHBondContact O-N 3.18Å; D428-A502 VanDerWaalsContact O-N 3.08Å; I430-A502 HydrophobicContact CD1-CB 3.7Å; I430-A502 HydrophobicContact CG1-CB 3.82Å
503	L	83.3	Confident	88.3	Confident	37 Å²	37	27.8 Å²	27.8	19%	0.194	15%	0.15	C	C	.	.			trans	-102.8	159.9	179.3	-61	176.4	0	0	0	110.8	N501 G505 D506	N501-L503 PolarHBondContact O-N 2.03Å; L503-G505 PolarHBondContact O-N 3.17Å; L503-G505 VanDerWaalsContact O-N 3.13Å; L503-D506 PolarHBondContact N-OD2 2.92Å; L503-D506 WeakPolarHBondContact O-CB 3.29Å; L503-D506 PolarHBondContact O-N 2.69Å
504	P	80.1	Confident	88.5	Confident	54 Å²	54	25.3 Å²	25.3	35%	0.351	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-58.4	-28.3	175.6	-25.5	36.2	0	0	0	113.5	E426 D506 E507 T544	E426-P504 HydrophobicContact CG-CG 4.34Å; P504-D506 VanDerWaalsContact C-N 3.26Å; P504-D506 PolarHBondContact O-N 2.98Å; P504-E507 WeakPolarHBondContact O-CB 3.44Å; P504-E507 PolarHBondContact O-N 3.42Å; P504-T544 HydrophobicContact CB-CG2 4.01Å; P504-T544 HydrophobicContact CG-CG2 3.93Å
505	G	81	Confident	88.4	Confident	53 Å²	53	23.6 Å²	23.6	55%	0.546	13%	0.129	S	C	.	.	G	3₁₀ helix	trans	-77	-2.3	173.5	0	0	0	0	0	115.3	W449 L503	W449-G505 WeakPolarHBondContact CZ2-O 3.44Å; L503-G505 PolarHBondContact O-N 3.17Å; L503-G505 VanDerWaalsContact O-N 3.13Å
506	D	86.6	Confident	88	Confident	3 Å²	3	24.1 Å²	24.1	2%	0.016	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-86.7	-10.3	169.3	-65.8	-44	0	0	0	111.7	I430 W449 R479 L503 P504 G508 Y510 V542	I430-D506 HydrophobicContact CD1-CB 3.93Å; W449-D506 PolarHBondContact NE1-O 3.13Å; R479-D506 IonicContact CZ-OD1 2.64Å; R479-D506 IonicContact CZ-OD2 2.73Å; R479-D506 VanDerWaalsContact NH1-CG 3.3Å; R479-D506 IonicContact NH1-OD1 3.87Å; R479-D506 PolarHBondContact NH1-OD1 3.02Å; R479-D506 IonicContact NH1-OD2 3.93Å; R479-D506 PolarHBondContact NH1-OD2 3.34Å; R479-D506 IonicContact NH2-OD1 2.82Å; R479-D506 IonicContact NH2-OD2 2.65Å; R479-D506 PolarHBondContact NH2-OD2 2.87Å; L503-D506 PolarHBondContact N-OD2 2.92Å; L503-D506 WeakPolarHBondContact O-CB 3.29Å; L503-D506 PolarHBondContact O-N 2.69Å; P504-D506 VanDerWaalsContact C-N 3.26Å; P504-D506 PolarHBondContact O-N 2.98Å; D506-G508 PolarHBondContact O-N 2.76Å; D506-Y510 PolarHBondContact O-OH 2.8Å; D506-V542 HydrophobicContact CB-CG2 4.46Å
507	E	87.4	Confident	87.2	Confident	43 Å²	43	26.9 Å²	26.9	20%	0.201	14%	0.141	C	C	.	.			trans	-62.1	128.1	174.8	171.2	158.8	136	0	0	111.5	W449 R452 P504 T541 V542	W449-E507 VanDerWaalsContact CZ2-O 3.29Å; W449-E507 WeakPolarHBondContact CZ2-O 3.48Å; W449-E507 PolarHBondContact NE1-O 3.19Å; R452-E507 WeakPolarHBondContact CD-OE1 3.43Å; R452-E507 IonicContact CZ-OE1 3.68Å; R452-E507 IonicContact NE-OE1 2.85Å; R452-E507 IonicContact NH1-OE1 3.07Å; R452-E507 PolarHBondContact NH1-OE1 2.98Å; R452-E507 IonicContact NH1-OE2 3.58Å; P504-E507 WeakPolarHBondContact O-CB 3.44Å; P504-E507 PolarHBondContact O-N 3.42Å; E507-T541 WeakPolarHBondContact OE2-CA 3.24Å; E507-T541 VanDerWaalsContact OE2-CB 3.3Å; E507-T541 WeakPolarHBondContact OE2-CB 3.44Å; E507-V542 HydrophobicContact CB-CB 4.16Å; E507-V542 HydrophobicContact CB-CG2 4.1Å; E507-V542 PolarHBondContact OE2-N 3.49Å
508	G	89.1	Confident	86.2	Confident	2 Å²	2	29.4 Å²	29.4	2%	0.021	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.7	-162.7	179.2	0	0	0	0	0	114.7	T450 D506 T539 V540	T450-G508 CarbonylContact O-C 3.58Å; T450-G508 VanDerWaalsContact O-CA 3.31Å; T450-G508 WeakPolarHBondContact O-CA 3.42Å; D506-G508 PolarHBondContact O-N 2.76Å; G508-T539 WeakPolarHBondContact O-CA 3.42Å; G508-V540 PolarHBondContact N-O 2.93Å; G508-V540 PolarHBondContact O-N 2.96Å
509	Q	90.4	Very high	85.1	Confident	43 Å²	43	30.7 Å²	30.7	20%	0.201	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	116.6	168.1	-175.8	179.5	114.9	0	0	109.2	T450 T537 T539	T450-Q509 PolarHBondContact N-O 3.49Å; T450-Q509 PolarHBondContact O-N 2.8Å; T450-Q509 PolarHBondContact OG1-O 2.82Å; T450-Q509 VanDerWaalsContact OG1-O 3.04Å; Q509-T537 HydrophobicContact CG-CG2 4.34Å; Q509-T537 VanDerWaalsContact OE1-CG2 3.26Å; Q509-T539 HydrophobicContact CB-CG2 3.96Å; Q509-T539 HydrophobicContact CG-CG2 4.21Å
510	Y	92.4	Very high	83.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	140.5	166.8	-69.4	-90.9	0	0	0	109.7	I430 L432 Q448 W449 V461 L499 D506 T537 K538 V540	I430-Y510 HydrophobicContact CG2-CE2 4.4Å; L432-Y510 HydrophobicContact CD1-CD1 3.59Å; L432-Y510 HydrophobicContact CD1-CD2 3.92Å; L432-Y510 HydrophobicContact CD1-CE1 4.04Å; L432-Y510 HydrophobicContact CD1-CE2 4.33Å; L432-Y510 HydrophobicContact CD1-CG 3.5Å; Q448-Y510 CarbonylContact O-C 3.58Å; Q448-Y510 WeakPolarHBondContact O-CA 3.4Å; W449-Y510 HydrophobicContact CB-CD1 4.22Å; W449-Y510 HydrophobicContact CB-CE1 4.21Å; W449-Y510 AromaticContact CD1-CE1 3.71Å; W449-Y510 AromaticContact CD1-CE2 3.92Å; W449-Y510 AromaticContact CD1-CZ 3.62Å; W449-Y510 HydrophobicContact CG-CE1 4.34Å; V461-Y510 HydrophobicContact CG2-CD1 4.41Å; V461-Y510 HydrophobicContact CG2-CE1 4.18Å; L499-Y510 HydrophobicContact CD1-CE1 4.19Å; D506-Y510 PolarHBondContact O-OH 2.8Å; Y510-T537 CarbonylContact O-C 3.53Å; Y510-T537 VanDerWaalsContact O-CA 3.27Å; Y510-T537 WeakPolarHBondContact O-CA 3.49Å; Y510-K538 PolarHBondContact N-O 2.9Å; Y510-K538 PolarHBondContact O-N 2.98Å; Y510-V540 HydrophobicContact CD2-CB 4.21Å; Y510-V540 HydrophobicContact CD2-CG2 3.95Å; Y510-V540 HydrophobicContact CE2-CB 4.09Å; Y510-V540 HydrophobicContact CE2-CG2 4.17Å
511	R	92.1	Very high	82.7	Confident	82 Å²	82	30.8 Å²	30.8	31%	0.309	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	126.3	173	-178.1	-177.5	-61.4	-164.9	2.3	108.7	W447 Q448 A536 T537	W447-R511 WeakPolarHBondContact CA-O 3.43Å; Q448-R511 HydrophobicContact CB-CB 4.28Å; Q448-R511 PolarHBondContact N-O 2.89Å; Q448-R511 PolarHBondContact O-N 2.89Å; R511-A536 WeakPolarHBondContact CA-O 3.42Å; R511-T537 HydrophobicContact CB-CG2 3.93Å; R511-T537 HydrophobicContact CG-CG2 3.88Å
512	C	93.6	Very high	81.4	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	119.6	163.8	176.1	0	0	0	0	108	L417 C434 V445 S535 A536	L417-C512 HydrophobicContact CB-CB 4.46Å; L417-C512 HydrophobicContact CD1-CB 4Å; L417-C512 HydrophobicContact CD2-CB 4.06Å; L417-C512 HydrophobicContact CG-CB 4.41Å; C434-C512 HydrophobicContact CB-CB 3.77Å; C434-C512 WeakPolarHBondContact CB-SG 3.47Å; C434-C512 WeakPolarHBondContact SG-CB 3.34Å; C434-C512 CovalentContact SG-SG 2.03Å; C434-C512 PolarHBondContact SG-SG 2.88Å; V445-C512 WeakPolarHBondContact CG1-SG 3.16Å; C512-S535 CarbonylContact O-C 3.57Å; C512-S535 WeakPolarHBondContact O-CA 3.42Å; C512-S535 WeakPolarHBondContact O-CB 3.24Å; C512-A536 PolarHBondContact N-O 2.91Å; C512-A536 PolarHBondContact O-N 3.45Å
513	S	91.6	Very high	79.9	Confident	7 Å²	7	38.4 Å²	38.4	5%	0.049	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122.3	172.3	-61.4	0	0	0	0	108.9	V445 V446 S535	V445-S513 WeakPolarHBondContact CA-O 3.23Å; V446-S513 PolarHBondContact N-O 2.9Å; V446-S513 PolarHBondContact O-N 3.08Å; S513-S535 WeakPolarHBondContact OG-CB 3.46Å
514	A	90.1	Very high	78.4	Confident	2 Å²	2	42.7 Å²	42.7	2%	0.017	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	122.3	174	0	0	0	0	0	109.5	V415 V436 V445 E533 Q534	V415-A514 HydrophobicContact CG2-CB 3.78Å; V436-A514 HydrophobicContact CG1-CB 4.04Å; V436-A514 HydrophobicContact CG2-CB 3.63Å; V445-A514 HydrophobicContact CG2-CB 4.26Å; A514-E533 WeakPolarHBondContact O-CA 3.45Å; A514-Q534 PolarHBondContact N-O 2.91Å; A514-Q534 PolarHBondContact O-N 2.85Å; A514-Q534 VanDerWaalsContact O-N 3.08Å
515	T	86.7	Confident	77.3	Confident	8 Å²	8	47.5 Å²	47.5	5%	0.049	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.1	172.1	-70.7	0	0	0	0	109.5	L443 T444 W517 K530 G532 E533	L443-T515 WeakPolarHBondContact CA-O 3.27Å; T444-T515 PolarHBondContact N-O 3.15Å; T444-T515 VanDerWaalsContact N-O 3.08Å; T444-T515 PolarHBondContact O-N 2.88Å; T515-W517 HydrophobicContact CG2-CD2 4.17Å; T515-W517 HydrophobicContact CG2-CG 4.5Å; T515-W517 HydrophobicContact CG2-CZ2 3.84Å; T515-K530 HydrophobicContact CG2-CB 4.44Å; T515-K530 HydrophobicContact CG2-CD 3.6Å; T515-K530 HydrophobicContact CG2-CG 3.68Å; T515-K530 PolarHBondContact OG1-NZ 3.2Å; T515-K530 VanDerWaalsContact OG1-NZ 3.11Å; T515-G532 WeakPolarHBondContact CA-O 3.29Å; T515-E533 PolarHBondContact OG1-OE1 2.85Å
516	Q	82.6	Confident	76.2	Confident	11 Å²	11	48 Å²	48	5%	0.051	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	132.2	175.8	-173.2	-178.1	6.5	0	0	110.2	N411 T413 S438 A441 L443 V531 G532	N411-Q516 PolarHBondContact OD1-OE1 2.84Å; T413-Q516 PolarHBondContact OG1-OE1 2.81Å; S438-Q516 PolarHBondContact OG-NE2 2.72Å; A441-Q516 HydrophobicContact CB-CG 3.65Å; L443-Q516 HydrophobicContact CD2-CB 4.32Å; L443-Q516 HydrophobicContact CD2-CG 4.49Å; Q516-V531 HydrophobicContact CB-CB 4.29Å; Q516-V531 HydrophobicContact CG-CB 4.18Å; Q516-V531 HydrophobicContact CG-CG2 4.48Å; Q516-V531 PolarHBondContact O-N 2.9Å; Q516-G532 PolarHBondContact N-O 3.21Å
517	W	77	Confident	75.3	Confident	59 Å²	59	52.3 Å²	52.3	22%	0.223	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	149.8	-178.5	-59.7	91.7	0	0	0	112.5	P442 T444 T515 W528 E529 K530	P442-W517 PolarHBondContact O-N 3.5Å; P442-W517 VanDerWaalsContact O-N 3.09Å; T444-W517 PolarHBondContact OG1-NE1 2.68Å; T515-W517 HydrophobicContact CG2-CD2 4.17Å; T515-W517 HydrophobicContact CG2-CG 4.5Å; T515-W517 HydrophobicContact CG2-CZ2 3.84Å; W517-W528 HydrophobicContact CB-CE3 3.91Å; W517-W528 HydrophobicContact CB-CZ3 4.43Å; W517-W528 HydrophobicContact CE3-CB 4.22Å; W517-E529 WeakPolarHBondContact CA-O 3.33Å; W517-K530 HydrophobicContact CE3-CB 4.13Å; W517-K530 HydrophobicContact CH2-CB 4.3Å; W517-K530 HydrophobicContact CZ3-CB 3.9Å
518	I	72.6	Confident	74.6	Confident	53 Å²	53	53.4 Å²	53.4	27%	0.272	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	134.6	172.2	-170.5	167.2	0	0	0	109.9	I520 W528 E529 V531	I518-I520 HydrophobicContact CG2-CD1 4.21Å; I518-I520 HydrophobicContact CG2-CG1 4.02Å; I518-W528 WeakPolarHBondContact O-CA 3.39Å; I518-E529 HydrophobicContact CG2-CB 4.29Å; I518-E529 PolarHBondContact N-O 3.35Å; I518-E529 PolarHBondContact O-N 2.94Å; I518-V531 HydrophobicContact CB-CG2 3.69Å; I518-V531 HydrophobicContact CG2-CG2 3.56Å
519	N	68.7	Low	73.8	Confident	34 Å²	34	58.6 Å²	58.6	18%	0.182	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	110.5	172.6	-174.3	7.6	0	0	0	109.4	R368 G521 T522 P526 N527 W528	R368-N519 PolarHBondContact NH1-O 2.89Å; N519-G521 WeakPolarHBondContact OD1-CA 3.44Å; N519-G521 PolarHBondContact OD1-N 3.41Å; N519-G521 PolarHBondContact OD1-O 3.36Å; N519-T522 PolarHBondContact ND2-O 3.04Å; N519-P526 WeakPolarHBondContact ND2-CB 3.49Å; N519-P526 WeakPolarHBondContact OD1-CA 3.27Å; N519-N527 PolarHBondContact OD1-N 3.45Å; N519-N527 PolarHBondContact OD1-O 3.19Å; N519-N527 VanDerWaalsContact OD1-O 3.08Å; N519-W528 HydrophobicContact CB-CD2 4.02Å; N519-W528 HydrophobicContact CB-CE3 3.77Å; N519-W528 HydrophobicContact CB-CH2 3.8Å; N519-W528 HydrophobicContact CB-CZ2 4.06Å; N519-W528 HydrophobicContact CB-CZ3 3.66Å
520	I	64.8	Low	72.9	Confident	81 Å²	81	61.5 Å²	61.5	42%	0.415	31%	0.307	S	S	.	.			trans	-93.3	-23.8	176.8	-52	-172.5	0	0	0	110.3	I518 N527 E529	I518-I520 HydrophobicContact CG2-CD1 4.21Å; I518-I520 HydrophobicContact CG2-CG1 4.02Å; I520-N527 PolarHBondContact N-O 2.93Å; I520-E529 HydrophobicContact CD1-CB 3.94Å; I520-E529 VanDerWaalsContact CD1-CD 3.5Å; I520-E529 HydrophobicContact CD1-CG 3.75Å; I520-E529 WeakPolarHBondContact CD1-OE2 3.21Å
521	G	60.6	Low	72	Confident	14 Å²	14	63.2 Å²	63.2	14%	0.144	32%	0.317	C	S	.	.	S	Bend	trans	-79.4	-171.8	175.2	0	0	0	0	0	114.6	R368 N519 E525 N527	R368-G521 PolarHBondContact NH1-O 2.96Å; N519-G521 WeakPolarHBondContact OD1-CA 3.44Å; N519-G521 PolarHBondContact OD1-N 3.41Å; N519-G521 PolarHBondContact OD1-O 3.36Å; G521-E525 CarbonylContact C-O 3.38Å; G521-E525 WeakPolarHBondContact CA-O 3.46Å; G521-N527 PolarHBondContact N-O 2.98Å
522	T	54.5	Low	71.1	Confident	41 Å²	41	60.1 Å²	60.1	25%	0.252	31%	0.31	S	S	.	.			trans	-82.2	-175.8	-178.2	69.6	0	0	0	0	111.2	A349 N519 T524 E525 P526	A349-T522 HydrophobicContact CB-CG2 3.65Å; N519-T522 PolarHBondContact ND2-O 3.04Å; T522-T524 VanDerWaalsContact C-N 3.33Å; T522-T524 PolarHBondContact OG1-N 3.5Å; T522-T524 PolarHBondContact OG1-OG1 2.96Å; T522-E525 PolarHBondContact N-O 2.88Å; T522-E525 PolarHBondContact OG1-N 3.21Å; T522-P526 WeakPolarHBondContact O-CA 3.16Å
523	E	53.3	Low	70.6	Confident	179 Å²	179	64.2 Å²	64.2	84%	0.836	33%	0.33	S	S	*	.	S	Bend	trans	-77.5	-21.4	170.4	-64.1	-174.2	161.2	0	0	112.4
524	T	51.7	Low	70.3	Confident	127 Å²	127	68.5 Å²	68.5	78%	0.779	35%	0.349	S	S	*	.	S	Bend	trans	-91.1	-32.2	177.3	56.9	0	0	0	0	113	T522	T522-T524 VanDerWaalsContact C-N 3.33Å; T522-T524 PolarHBondContact OG1-N 3.5Å; T522-T524 PolarHBondContact OG1-OG1 2.96Å
525	E	55.9	Low	70.3	Confident	155 Å²	155	71 Å²	71	72%	0.724	37%	0.366	S	S	*	.	S	Bend	trans	-128.4	80.1	175.3	-67.5	-171.3	166.4	0	0	109.4	G521 T522 N527	G521-E525 CarbonylContact C-O 3.38Å; G521-E525 WeakPolarHBondContact CA-O 3.46Å; T522-E525 PolarHBondContact N-O 2.88Å; T522-E525 PolarHBondContact OG1-N 3.21Å; E525-N527 PolarHBondContact O-N 3.24Å; E525-N527 VanDerWaalsContact O-N 3.11Å
526	P	58.8	Low	70.4	Confident	63 Å²	63	71.4 Å²	71.4	41%	0.409	37%	0.37	S	S	.	.			trans	-79.7	96.3	-174.2	32.6	-36.1	0	0	0	111.3	N519 T522 W528	N519-P526 WeakPolarHBondContact ND2-CB 3.49Å; N519-P526 WeakPolarHBondContact OD1-CA 3.27Å; T522-P526 WeakPolarHBondContact O-CA 3.16Å; P526-W528 PolarHBondContact O-NE1 2.9Å
527	N	68.6	Low	70.8	Confident	95 Å²	95	74.2 Å²	74.2	51%	0.508	39%	0.388	S	S	.	.			trans	-82.1	120.5	172.4	-176.5	24.5	0	0	0	110.7	N519 I520 G521 E525	N519-N527 PolarHBondContact OD1-N 3.45Å; N519-N527 PolarHBondContact OD1-O 3.19Å; N519-N527 VanDerWaalsContact OD1-O 3.08Å; I520-N527 PolarHBondContact N-O 2.93Å; G521-N527 PolarHBondContact N-O 2.98Å; E525-N527 PolarHBondContact O-N 3.24Å; E525-N527 VanDerWaalsContact O-N 3.11Å
528	W	71.7	Confident	71.4	Confident	66 Å²	66	74.6 Å²	74.6	25%	0.25	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	123.4	-171.6	-65.1	93.3	0	0	0	113.1	P442 R466 W517 I518 N519 P526	P442-W528 HydrophobicContact CB-CH2 4.22Å; P442-W528 HydrophobicContact CB-CZ3 4.02Å; P442-W528 HydrophobicContact CG-CH2 3.74Å; P442-W528 HydrophobicContact CG-CZ3 3.68Å; R466-W528 VanDerWaalsContact NH2-CB 3.34Å; W517-W528 HydrophobicContact CB-CE3 3.91Å; W517-W528 HydrophobicContact CB-CZ3 4.43Å; W517-W528 HydrophobicContact CE3-CB 4.22Å; I518-W528 WeakPolarHBondContact O-CA 3.39Å; N519-W528 HydrophobicContact CB-CD2 4.02Å; N519-W528 HydrophobicContact CB-CE3 3.77Å; N519-W528 HydrophobicContact CB-CH2 3.8Å; N519-W528 HydrophobicContact CB-CZ2 4.06Å; N519-W528 HydrophobicContact CB-CZ3 3.66Å; P526-W528 PolarHBondContact O-NE1 2.9Å
529	E	71.3	Confident	72.2	Confident	111 Å²	111	75.8 Å²	75.8	52%	0.519	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	150.2	173	-70.2	-168.1	173.6	0	0	113	W517 I518 I520 V531	W517-E529 WeakPolarHBondContact CA-O 3.33Å; I518-E529 HydrophobicContact CG2-CB 4.29Å; I518-E529 PolarHBondContact N-O 3.35Å; I518-E529 PolarHBondContact O-N 2.94Å; I520-E529 HydrophobicContact CD1-CB 3.94Å; I520-E529 VanDerWaalsContact CD1-CD 3.5Å; I520-E529 HydrophobicContact CD1-CG 3.75Å; I520-E529 WeakPolarHBondContact CD1-OE2 3.21Å; E529-V531 PolarHBondContact O-N 3.36Å
530	K	73.1	Confident	73.3	Confident	104 Å²	104	74.2 Å²	74.2	45%	0.452	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	104.1	179	172.8	159.2	179.6	157.2	0	109.9	T515 W517 G532 E533	T515-K530 HydrophobicContact CG2-CB 4.44Å; T515-K530 HydrophobicContact CG2-CD 3.6Å; T515-K530 HydrophobicContact CG2-CG 3.68Å; T515-K530 PolarHBondContact OG1-NZ 3.2Å; T515-K530 VanDerWaalsContact OG1-NZ 3.11Å; W517-K530 HydrophobicContact CE3-CB 4.13Å; W517-K530 HydrophobicContact CH2-CB 4.3Å; W517-K530 HydrophobicContact CZ3-CB 3.9Å; K530-G532 VanDerWaalsContact C-N 3.28Å; K530-G532 PolarHBondContact O-N 3Å; K530-E533 IonicContact NZ-OE1 2.77Å; K530-E533 IonicContact NZ-OE2 2.86Å; K530-E533 PolarHBondContact NZ-OE2 3.08Å
531	V	72.3	Confident	74.3	Confident	36 Å²	36	71.7 Å²	71.7	22%	0.218	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	-32	177.3	-176	0	0	0	0	111.1	L409 Q516 I518 E529	L409-V531 HydrophobicContact CB-CG1 4.36Å; Q516-V531 HydrophobicContact CB-CB 4.29Å; Q516-V531 HydrophobicContact CG-CB 4.18Å; Q516-V531 HydrophobicContact CG-CG2 4.48Å; Q516-V531 PolarHBondContact O-N 2.9Å; I518-V531 HydrophobicContact CB-CG2 3.69Å; I518-V531 HydrophobicContact CG2-CG2 3.56Å; E529-V531 PolarHBondContact O-N 3.36Å
532	G	73.4	Confident	75.4	Confident	16 Å²	16	71.3 Å²	71.3	17%	0.165	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.4	174.8	174	0	0	0	0	0	112.6	T515 Q516 K530	T515-G532 WeakPolarHBondContact CA-O 3.29Å; Q516-G532 PolarHBondContact N-O 3.21Å; K530-G532 VanDerWaalsContact C-N 3.28Å; K530-G532 PolarHBondContact O-N 3Å
533	E	83.6	Confident	76.5	Confident	87 Å²	87	73.6 Å²	73.6	41%	0.407	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	145.8	178.5	177.1	165.7	-142.6	0	0	109.7	A514 T515 K530	A514-E533 WeakPolarHBondContact O-CA 3.45Å; T515-E533 PolarHBondContact OG1-OE1 2.85Å; K530-E533 IonicContact NZ-OE1 2.77Å; K530-E533 IonicContact NZ-OE2 2.86Å; K530-E533 PolarHBondContact NZ-OE2 3.08Å
534	Q	84.9	Confident	77.4	Confident	97 Å²	97	67.2 Å²	67.2	45%	0.453	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	149.3	171.7	-75.5	-61	-43.9	0	0	108.9	V415 A514	V415-Q534 HydrophobicContact CB-CB 4.39Å; V415-Q534 HydrophobicContact CG2-CB 3.69Å; A514-Q534 PolarHBondContact N-O 2.91Å; A514-Q534 PolarHBondContact O-N 2.85Å; A514-Q534 VanDerWaalsContact O-N 3.08Å
535	S	89.6	Confident	78.3	Confident	55 Å²	55	61.7 Å²	61.7	39%	0.385	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	138.1	-177.5	68.1	0	0	0	0	112.6	C512 S513	C512-S535 CarbonylContact O-C 3.57Å; C512-S535 WeakPolarHBondContact O-CA 3.42Å; C512-S535 WeakPolarHBondContact O-CB 3.24Å; S513-S535 WeakPolarHBondContact OG-CB 3.46Å
536	A	89.9	Confident	78.8	Confident	16 Å²	16	58.3 Å²	58.3	13%	0.132	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	143.7	170.6	0	0	0	0	0	110.4	V415 L417 R511 C512	V415-A536 HydrophobicContact CB-CB 4.44Å; V415-A536 HydrophobicContact CG1-CB 3.95Å; L417-A536 HydrophobicContact CB-CB 3.76Å; L417-A536 WeakPolarHBondContact CD2-O 3.39Å; R511-A536 WeakPolarHBondContact CA-O 3.42Å; C512-A536 PolarHBondContact N-O 2.91Å; C512-A536 PolarHBondContact O-N 3.45Å
537	T	90.9	Very high	79.2	Confident	69 Å²	69	59.5 Å²	59.5	42%	0.423	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	149	-179.4	56.2	0	0	0	0	111.6	Q509 Y510 R511	Q509-T537 HydrophobicContact CG-CG2 4.34Å; Q509-T537 VanDerWaalsContact OE1-CG2 3.26Å; Y510-T537 CarbonylContact O-C 3.53Å; Y510-T537 VanDerWaalsContact O-CA 3.27Å; Y510-T537 WeakPolarHBondContact O-CA 3.49Å; R511-T537 HydrophobicContact CB-CG2 3.93Å; R511-T537 HydrophobicContact CG-CG2 3.88Å
538	K	90.5	Very high	79.1	Confident	68 Å²	68	55.5 Å²	55.5	30%	0.296	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	125	177.7	-175.5	63.6	178.7	179.7	0	109.2	L417 A419 L432 Y510	L417-K538 HydrophobicContact CB-CB 4.45Å; L417-K538 HydrophobicContact CD2-CB 3.71Å; L417-K538 HydrophobicContact CG-CB 3.79Å; A419-K538 HydrophobicContact CB-CG 3.87Å; L432-K538 HydrophobicContact CD2-CG 4.43Å; Y510-K538 PolarHBondContact N-O 2.9Å; Y510-K538 PolarHBondContact O-N 2.98Å
539	T	89.4	Confident	79.4	Confident	77 Å²	77	52.8 Å²	52.8	47%	0.472	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	141.7	172.3	40.5	0	0	0	0	111.2	G508 Q509	G508-T539 WeakPolarHBondContact O-CA 3.42Å; Q509-T539 HydrophobicContact CB-CG2 3.96Å; Q509-T539 HydrophobicContact CG-CG2 4.21Å
540	V	89.9	Confident	79.9	Confident	1 Å²	1	51 Å²	51	1%	0.006	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	126.1	173.2	-179	0	0	0	0	107.6	A419 S422 V424 I430 L432 G508 Y510	A419-V540 HydrophobicContact CB-CG2 4.31Å; S422-V540 WeakPolarHBondContact O-CA 3.42Å; V424-V540 HydrophobicContact CB-CG1 4.47Å; V424-V540 HydrophobicContact CG2-CG1 4Å; I430-V540 HydrophobicContact CD1-CG1 4.1Å; I430-V540 HydrophobicContact CG1-CG1 4.1Å; I430-V540 HydrophobicContact CG2-CG1 4.26Å; I430-V540 HydrophobicContact CG2-CG2 4.32Å; L432-V540 HydrophobicContact CD2-CG2 4.43Å; G508-V540 PolarHBondContact N-O 2.93Å; G508-V540 PolarHBondContact O-N 2.96Å; Y510-V540 HydrophobicContact CD2-CB 4.21Å; Y510-V540 HydrophobicContact CD2-CG2 3.95Å; Y510-V540 HydrophobicContact CE2-CB 4.09Å; Y510-V540 HydrophobicContact CE2-CG2 4.17Å
541	T	86.4	Confident	80.7	Confident	29 Å²	29	46.9 Å²	46.9	18%	0.178	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	145.1	172.1	55.9	0	0	0	0	110.7	S422 E423 V424 E507	S422-T541 PolarHBondContact O-N 3.13Å; S422-T541 PolarHBondContact O-OG1 3.43Å; E423-T541 WeakPolarHBondContact CG-OG1 3.45Å; V424-T541 PolarHBondContact N-O 2.86Å; E507-T541 WeakPolarHBondContact OE2-CA 3.24Å; E507-T541 VanDerWaalsContact OE2-CB 3.3Å; E507-T541 WeakPolarHBondContact OE2-CB 3.44Å
542	V	84.6	Confident	81.6	Confident	6 Å²	6	47.7 Å²	47.7	4%	0.036	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	103.6	-178.8	-176.4	0	0	0	0	109.4	V424 E426 I430 D506 E507 T544	V424-V542 CarbonylContact O-C 3.55Å; V424-V542 WeakPolarHBondContact O-CA 3.35Å; E426-V542 HydrophobicContact CB-CG1 4.11Å; I430-V542 HydrophobicContact CD1-CG2 4.14Å; D506-V542 HydrophobicContact CB-CG2 4.46Å; E507-V542 HydrophobicContact CB-CB 4.16Å; E507-V542 HydrophobicContact CB-CG2 4.1Å; E507-V542 PolarHBondContact OE2-N 3.49Å; V542-T544 PolarHBondContact O-N 3.13Å
543	K	77	Confident	82.4	Confident	88 Å²	88	47.2 Å²	47.2	38%	0.383	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	107.8	177.5	-73.9	175.3	-176.7	171.3	0	109.3	E423 V424 L425 E426	E423-K543 WeakPolarHBondContact OE1-CE 3.48Å; E423-K543 IonicContact OE1-NZ 3.6Å; E423-K543 PolarHBondContact OE1-NZ 2.85Å; E423-K543 VanDerWaalsContact OE1-NZ 3.15Å; E423-K543 IonicContact OE2-NZ 2.74Å; E423-K543 PolarHBondContact OE2-NZ 2.87Å; V424-K543 PolarHBondContact O-N 2.78Å; L425-K543 HydrophobicContact CD2-CB 4.04Å; E426-K543 PolarHBondContact N-O 2.71Å
544	T	72.8	Confident	82.8	Confident	45 Å²	45	45.2 Å²	45.2	28%	0.276	26%	0.259	S	S	.	.			trans	-59.4	147.2	-177	70	0	0	0	0	112.1	E426 P504 V542 E546 S547	E426-T544 VanDerWaalsContact OE2-CA 3.3Å; E426-T544 WeakPolarHBondContact OE2-CA 3.36Å; P504-T544 HydrophobicContact CB-CG2 4.01Å; P504-T544 HydrophobicContact CG-CG2 3.93Å; V542-T544 PolarHBondContact O-N 3.13Å; T544-E546 PolarHBondContact O-N 3Å; T544-S547 PolarHBondContact O-N 2.9Å; T544-S547 VanDerWaalsContact O-N 3.14Å; T544-S547 PolarHBondContact O-OG 3.26Å; T544-S547 PolarHBondContact OG1-N 2.84Å
545	V	69.4	Low	83	Confident	12 Å²	12	41.9 Å²	41.9	7%	0.073	25%	0.246	C	C	.	.	H	α-helix	trans	-59	-37.6	177.1	-175.8	0	0	0	0	110.2	E426 S547 S548 F549 L658	E426-V545 HydrophobicContact CB-CG2 3.86Å; E426-V545 HydrophobicContact CG-CG2 3.96Å; E426-V545 PolarHBondContact OE2-N 3.37Å; V545-S547 VanDerWaalsContact C-N 3.29Å; V545-S547 PolarHBondContact O-N 2.79Å; V545-S548 CarbonylContact O-C 3.52Å; V545-S548 WeakPolarHBondContact O-CA 3.33Å; V545-S548 PolarHBondContact O-N 2.83Å; V545-S548 PolarHBondContact O-OG 3.3Å; V545-F549 PolarHBondContact O-N 3.43Å; V545-L658 HydrophobicContact CB-CD1 4.48Å; V545-L658 HydrophobicContact CG1-CD1 3.61Å
546	E	68	Low	82.9	Confident	84 Å²	84	50.8 Å²	50.8	39%	0.393	27%	0.271	S	S	.	.	H	α-helix	trans	-52.7	-41.6	176.3	-179.7	176.8	-145.6	0	0	113.2	T544 S548 F549 A671	T544-E546 PolarHBondContact O-N 3Å; E546-S548 PolarHBondContact O-N 2.95Å; E546-S548 VanDerWaalsContact O-N 3.16Å; E546-F549 PolarHBondContact O-N 3.48Å; E546-A671 HydrophobicContact CB-CB 3.95Å; E546-A671 HydrophobicContact CG-CB 3.85Å
547	S	66.4	Low	82.6	Confident	87 Å²	87	52.6 Å²	52.6	61%	0.608	28%	0.281	S	S	*	.	H	α-helix	trans	-63	-20.9	178.6	73.7	0	0	0	0	113.3	T544 V545	T544-S547 PolarHBondContact O-N 2.9Å; T544-S547 VanDerWaalsContact O-N 3.14Å; T544-S547 PolarHBondContact O-OG 3.26Å; T544-S547 PolarHBondContact OG1-N 2.84Å; V545-S547 VanDerWaalsContact C-N 3.29Å; V545-S547 PolarHBondContact O-N 2.79Å
548	S	66.3	Low	82.3	Confident	12 Å²	12	52.8 Å²	52.8	8%	0.084	28%	0.283	C	S	.	.	H	α-helix	trans	-111.1	-0.5	-176.6	81.1	0	0	0	0	113.9	V545 E546 R575	V545-S548 CarbonylContact O-C 3.52Å; V545-S548 WeakPolarHBondContact O-CA 3.33Å; V545-S548 PolarHBondContact O-N 2.83Å; V545-S548 PolarHBondContact O-OG 3.3Å; E546-S548 PolarHBondContact O-N 2.95Å; E546-S548 VanDerWaalsContact O-N 3.16Å; S548-R575 WeakPolarHBondContact O-CG 3.3Å; S548-R575 PolarHBondContact O-N 3.02Å
549	F	78.9	Confident	82.1	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.035	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	112.8	-176.8	178.3	-125.4	0	0	0	110.8	V545 E546 V551 V572 A656 L658 A671 R673	V545-F549 PolarHBondContact O-N 3.43Å; E546-F549 PolarHBondContact O-N 3.48Å; F549-V551 HydrophobicContact CE1-CG2 4.02Å; F549-V551 HydrophobicContact CE2-CG2 4.25Å; F549-V551 HydrophobicContact CZ-CG2 3.8Å; F549-V572 HydrophobicContact CD2-CG1 4.3Å; F549-V572 HydrophobicContact CE2-CG1 3.44Å; F549-V572 VanDerWaalsContact CE2-CG1 3.44Å; F549-V572 HydrophobicContact CZ-CG1 4.16Å; F549-A656 WeakPolarHBondContact CE1-O 3.34Å; F549-A656 HydrophobicContact CZ-CB 3.76Å; F549-L658 HydrophobicContact CB-CD1 3.97Å; F549-L658 HydrophobicContact CD1-CD1 4.12Å; F549-L658 HydrophobicContact CD1-CG 4.15Å; F549-L658 HydrophobicContact CD2-CD1 3.59Å; F549-L658 HydrophobicContact CD2-CD2 3.85Å; F549-L658 HydrophobicContact CD2-CG 3.69Å; F549-L658 HydrophobicContact CE1-CG 4.03Å; F549-L658 HydrophobicContact CE2-CD1 3.99Å; F549-L658 HydrophobicContact CE2-CD2 3.47Å; F549-L658 VanDerWaalsContact CE2-CD2 3.47Å; F549-L658 HydrophobicContact CE2-CG 3.52Å; F549-L658 HydrophobicContact CG-CD1 3.65Å; F549-L658 HydrophobicContact CG-CG 3.99Å; F549-L658 HydrophobicContact CZ-CD1 4.44Å; F549-L658 HydrophobicContact CZ-CD2 4.01Å; F549-L658 HydrophobicContact CZ-CG 3.71Å; F549-A671 HydrophobicContact CD1-CB 3.64Å; F549-A671 HydrophobicContact CE1-CB 4.09Å; F549-A671 HydrophobicContact CG-CB 4.41Å; F549-R673 HydrophobicContact CD1-CB 4Å; F549-R673 HydrophobicContact CD1-CG 3.46Å; F549-R673 VanDerWaalsContact CD1-CG 3.46Å; F549-R673 HydrophobicContact CE1-CB 3.74Å; F549-R673 HydrophobicContact CE1-CG 3.72Å
550	M	80.9	Confident	82.1	Confident	75 Å²	75	49.3 Å²	49.3	37%	0.369	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	140.8	178.7	-57.7	-171.5	-50.3	0	0	111.4	K573 R575	M550-K573 HydrophobicContact CE-CB 4.37Å; M550-K573 PolarHBondContact N-O 2.98Å; M550-K573 VanDerWaalsContact N-O 3.16Å; M550-K573 PolarHBondContact O-N 2.88Å; M550-R575 HydrophobicContact CE-CG 4.14Å; M550-R575 VanDerWaalsContact CE-NE 3.33Å; M550-R575 PolarHBondContact SD-NE 2.85Å; M550-R575 PolarHBondContact SD-NH2 2.81Å
551	V	88.9	Confident	82	Confident	17 Å²	17	51.3 Å²	51.3	10%	0.103	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	122.7	174.9	-174.5	0	0	0	0	107.2	F549 L571 V572 C654 A656 R673	F549-V551 HydrophobicContact CE1-CG2 4.02Å; F549-V551 HydrophobicContact CE2-CG2 4.25Å; F549-V551 HydrophobicContact CZ-CG2 3.8Å; V551-L571 WeakPolarHBondContact CA-O 3.41Å; V551-V572 HydrophobicContact CG1-CG2 4.47Å; V551-C654 VanDerWaalsContact CG1-SG 3.59Å; V551-A656 HydrophobicContact CG1-CB 4.28Å; V551-A656 HydrophobicContact CG2-CB 3.7Å; V551-R673 HydrophobicContact CB-CB 4.24Å; V551-R673 HydrophobicContact CG2-CB 3.63Å
552	S	91.2	Very high	82	Confident	53 Å²	53	51.5 Å²	51.5	37%	0.371	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	142.1	172.1	63.4	0	0	0	0	110.9	L571 N676	S552-L571 PolarHBondContact N-O 2.8Å; S552-L571 PolarHBondContact O-N 2.81Å; S552-N676 WeakPolarHBondContact CA-OD1 3.14Å
553	A	91.8	Very high	81.7	Confident	6 Å²	6	52.9 Å²	52.9	5%	0.05	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	139.9	177.6	0	0	0	0	0	108.9	L569 W586 S675 N676 L678	A553-L569 WeakPolarHBondContact CA-O 3.48Å; A553-W586 HydrophobicContact CB-CH2 4.48Å; A553-W586 HydrophobicContact CB-CZ3 4.49Å; A553-S675 WeakPolarHBondContact CB-OG 3.48Å; A553-N676 PolarHBondContact N-OD1 2.98Å; A553-N676 PolarHBondContact O-ND2 2.91Å; A553-N676 PolarHBondContact O-OD1 3.49Å; A553-L678 HydrophobicContact CB-CD1 3.68Å; A553-L678 HydrophobicContact CB-CG 3.83Å
554	S	91.1	Very high	82.2	Confident	44 Å²	44	52.1 Å²	52.1	31%	0.308	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	147.2	178.4	55.2	0	0	0	0	111	L569	S554-L569 PolarHBondContact N-O 2.89Å; S554-L569 PolarHBondContact O-N 2.86Å; S554-L569 PolarHBondContact OG-O 2.77Å
555	S	89.3	Confident	82.9	Confident	28 Å²	28	53.2 Å²	53.2	20%	0.196	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	148.4	166.3	173.8	0	0	0	0	108.3	T557 D567	S555-T557 VanDerWaalsContact OG-C 3.31Å; S555-T557 PolarHBondContact OG-N 2.96Å; S555-T557 PolarHBondContact OG-O 3.04Å; S555-D567 PolarHBondContact OG-O 3.41Å
556	R	86.4	Confident	83.9	Confident	241 Å²	241	52.8 Å²	52.8	91%	0.909	30%	0.304	S	S	*	.	S	Bend	trans	-86.6	-18	170.1	-66.7	-176	177.8	-171.9	-0.8	112.5
557	T	85.2	Confident	84.9	Confident	54 Å²	54	51.6 Å²	51.6	33%	0.331	30%	0.301	S	S	.	.			trans	-132.7	76.3	-174.2	45.2	0	0	0	0	109.3	S555 S559 I560	S555-T557 VanDerWaalsContact OG-C 3.31Å; S555-T557 PolarHBondContact OG-N 2.96Å; S555-T557 PolarHBondContact OG-O 3.04Å; T557-S559 PolarHBondContact O-N 3.27Å; T557-I560 HydrophobicContact CG2-CG2 4.41Å
558	P	83.4	Confident	86.1	Confident	73 Å²	73	47.5 Å²	47.5	47%	0.474	27%	0.272	S	S	.	.	S	Bend	trans	-73.3	-10	179.7	32.1	-36.9	0	0	0	113.2	N681	P558-N681 PolarHBondContact O-N 3.15Å
559	S	87.7	Confident	87.4	Confident	58 Å²	58	49.6 Å²	49.6	41%	0.406	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	134.3	169.3	-60.1	0	0	0	0	108.6	T557 N681	T557-S559 PolarHBondContact O-N 3.27Å; S559-N681 VanDerWaalsContact CA-O 3.3Å; S559-N681 WeakPolarHBondContact CA-O 3.39Å; S559-N681 PolarHBondContact OG-ND2 3.25Å
560	I	89.2	Confident	88	Confident	15 Å²	15	49.2 Å²	49.2	8%	0.077	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	167.7	-176.1	55.4	156.5	0	0	0	109.9	T557 D564 F566 A644 N681 V682 L683	T557-I560 HydrophobicContact CG2-CG2 4.41Å; I560-D564 HydrophobicContact CB-CB 3.9Å; I560-D564 HydrophobicContact CD1-CB 4.04Å; I560-D564 HydrophobicContact CG2-CB 4.43Å; I560-F566 HydrophobicContact CD1-CB 4.23Å; I560-F566 HydrophobicContact CD1-CD1 3.54Å; I560-F566 HydrophobicContact CD1-CE1 4.31Å; I560-F566 HydrophobicContact CD1-CG 4.29Å; I560-F566 HydrophobicContact CG2-CB 4.37Å; I560-A644 HydrophobicContact CD1-CB 3.59Å; I560-N681 PolarHBondContact N-O 3.13Å; I560-V682 HydrophobicContact CD1-CG1 4.3Å; I560-V682 HydrophobicContact CD1-CG2 4.22Å; I560-V682 HydrophobicContact CG1-CG1 4.29Å; I560-V682 HydrophobicContact CG1-CG2 4.19Å; I560-L683 PolarHBondContact O-N 2.87Å
561	S	86.6	Confident	88.4	Confident	42 Å²	42	47.4 Å²	47.4	29%	0.294	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	165.8	174.9	75	0	0	0	0	113.2	G563 D564 L683	S561-G563 PolarHBondContact O-N 2.99Å; S561-D564 WeakPolarHBondContact CA-OD2 3.29Å; S561-D564 WeakPolarHBondContact CB-OD2 3.39Å; S561-D564 PolarHBondContact N-OD2 2.86Å; S561-D564 WeakPolarHBondContact O-CB 3.37Å; S561-D564 PolarHBondContact O-N 3.07Å; S561-D564 VanDerWaalsContact O-N 3.14Å; S561-D564 PolarHBondContact OG-OD2 3.14Å; S561-L683 CarbonylContact C-O 3.53Å; S561-L683 VanDerWaalsContact CA-O 3.23Å; S561-L683 WeakPolarHBondContact CA-O 3.04Å
562	F	86.1	Confident	88.3	Confident	33 Å²	33	46.6 Å²	46.6	15%	0.145	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	122.6	176.8	-84	26.8	0	0	0	111	R646 V682 L683 Q684 D799 P800 Y805	F562-R646 HydrophobicContact CZ-CB 4.22Å; F562-V682 HydrophobicContact CD1-CG1 3.82Å; F562-V682 HydrophobicContact CE1-CG1 4.21Å; F562-L683 WeakPolarHBondContact CD1-O 3.37Å; F562-L683 PolarHBondContact N-O 2.74Å; F562-Q684 HydrophobicContact CD1-CG 4.45Å; F562-Q684 HydrophobicContact CE1-CG 4.02Å; F562-Q684 HydrophobicContact CE2-CG 4.07Å; F562-Q684 HydrophobicContact CZ-CG 3.82Å; F562-D799 HydrophobicContact CD2-CB 3.63Å; F562-D799 HydrophobicContact CE2-CB 3.56Å; F562-P800 HydrophobicContact CB-CG 4.44Å; F562-Y805 AromaticContact CD2-CE1 3.68Å; F562-Y805 HydrophobicContact CD2-CE1 3.68Å; F562-Y805 AromaticContact CD2-CZ 3.78Å; F562-Y805 HydrophobicContact CE2-CD1 4.27Å; F562-Y805 AromaticContact CE2-CE1 3.82Å; F562-Y805 HydrophobicContact CE2-CE1 3.82Å
563	G	79.3	Confident	87.5	Confident	35 Å²	35	49.3 Å²	49.3	36%	0.361	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.4	-8.9	179.4	0	0	0	0	0	114.8	S561 R643 A644	S561-G563 PolarHBondContact O-N 2.99Å; G563-R643 WeakPolarHBondContact O-CA 3.47Å; G563-A644 PolarHBondContact N-O 2.83Å
564	D	86.5	Confident	86.2	Confident	73 Å²	73	50.1 Å²	50.1	39%	0.39	28%	0.277	S	S	.	.			trans	-65.2	174.8	169.7	-78.1	-39.2	0	0	0	112	I560 S561 R643 A644	I560-D564 HydrophobicContact CB-CB 3.9Å; I560-D564 HydrophobicContact CD1-CB 4.04Å; I560-D564 HydrophobicContact CG2-CB 4.43Å; S561-D564 WeakPolarHBondContact CA-OD2 3.29Å; S561-D564 WeakPolarHBondContact CB-OD2 3.39Å; S561-D564 PolarHBondContact N-OD2 2.86Å; S561-D564 WeakPolarHBondContact O-CB 3.37Å; S561-D564 PolarHBondContact O-N 3.07Å; S561-D564 VanDerWaalsContact O-N 3.14Å; S561-D564 PolarHBondContact OG-OD2 3.14Å; D564-R643 CarbonylContact O-C 3.58Å; D564-R643 WeakPolarHBondContact O-CA 3.33Å; D564-R643 PolarHBondContact O-N 2.94Å; D564-R643 VanDerWaalsContact O-N 3.13Å; D564-A644 PolarHBondContact O-N 3.26Å
565	S	88.4	Confident	84.6	Confident	68 Å²	68	55.4 Å²	55.4	48%	0.476	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	144.8	173.5	-54.5	0	0	0	0	110.5	V641 T642	S565-V641 CarbonylContact C-O 3.5Å; S565-V641 VanDerWaalsContact CA-O 3.22Å; S565-V641 WeakPolarHBondContact CA-O 3.46Å; S565-V641 WeakPolarHBondContact CB-O 3.36Å; S565-T642 WeakPolarHBondContact OG-CA 3.35Å; S565-T642 WeakPolarHBondContact OG-CB 3.28Å
566	F	89.9	Confident	83	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.009	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	153.4	178.2	67.8	-88.2	0	0	0	112.6	I560 L568 S640 V641 A644 E648 Y652 I680	I560-F566 HydrophobicContact CD1-CB 4.23Å; I560-F566 HydrophobicContact CD1-CD1 3.54Å; I560-F566 HydrophobicContact CD1-CE1 4.31Å; I560-F566 HydrophobicContact CD1-CG 4.29Å; I560-F566 HydrophobicContact CG2-CB 4.37Å; F566-L568 HydrophobicContact CD2-CD2 3.72Å; F566-L568 HydrophobicContact CD2-CG 3.93Å; F566-L568 HydrophobicContact CE2-CD1 4Å; F566-L568 HydrophobicContact CE2-CD2 3.83Å; F566-L568 HydrophobicContact CE2-CG 3.81Å; F566-S640 WeakPolarHBondContact O-CA 3.45Å; F566-V641 HydrophobicContact CD1-CB 4.02Å; F566-V641 HydrophobicContact CE1-CB 3.58Å; F566-V641 HydrophobicContact CE1-CG1 3.78Å; F566-V641 HydrophobicContact CE1-CG2 4.17Å; F566-V641 HydrophobicContact CE2-CB 4.11Å; F566-V641 HydrophobicContact CE2-CG2 3.91Å; F566-V641 HydrophobicContact CZ-CB 3.64Å; F566-V641 HydrophobicContact CZ-CG1 4.03Å; F566-V641 HydrophobicContact CZ-CG2 3.67Å; F566-V641 PolarHBondContact N-O 2.83Å; F566-V641 PolarHBondContact O-N 3.24Å; F566-A644 HydrophobicContact CD1-CB 3.84Å; F566-A644 HydrophobicContact CE1-CB 3.65Å; F566-E648 HydrophobicContact CE1-CB 4.21Å; F566-E648 HydrophobicContact CZ-CB 4.42Å; F566-Y652 HydrophobicContact CE2-CE2 4.1Å; F566-Y652 AromaticContact CZ-CE2 3.99Å; F566-Y652 HydrophobicContact CZ-CE2 3.99Å; F566-Y652 AromaticContact CZ-CZ 3.89Å; F566-I680 HydrophobicContact CD1-CG2 4.19Å; F566-I680 HydrophobicContact CD2-CD1 4.21Å; F566-I680 HydrophobicContact CD2-CG1 4.15Å; F566-I680 HydrophobicContact CD2-CG2 4.16Å; F566-I680 HydrophobicContact CE1-CG2 4.04Å; F566-I680 HydrophobicContact CE2-CB 4.42Å; F566-I680 HydrophobicContact CE2-CD1 4.45Å; F566-I680 HydrophobicContact CE2-CG1 3.89Å; F566-I680 HydrophobicContact CE2-CG2 4.04Å; F566-I680 HydrophobicContact CG-CG2 4.22Å; F566-I680 HydrophobicContact CZ-CG1 4.48Å; F566-I680 HydrophobicContact CZ-CG2 3.96Å
567	D	90.3	Very high	81.6	Confident	60 Å²	60	49.9 Å²	49.9	32%	0.321	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	119	-177	-79.5	-52	0	0	0	110.8	S555 R638 S640	S555-D567 PolarHBondContact OG-O 3.41Å; D567-R638 IonicContact OD1-CZ 2.84Å; D567-R638 VanDerWaalsContact OD1-CZ 3.23Å; D567-R638 IonicContact OD1-NE 3.18Å; D567-R638 PolarHBondContact OD1-NE 2.92Å; D567-R638 IonicContact OD1-NH2 3.39Å; D567-R638 PolarHBondContact OD1-NH2 3.35Å; D567-R638 IonicContact OD2-CZ 3.73Å; D567-R638 IonicContact OD2-NE 2.67Å; D567-R638 IonicContact OD2-NH2 2.76Å; D567-R638 PolarHBondContact OD2-NH2 2.96Å; D567-S640 WeakPolarHBondContact OD1-CB 3.38Å; D567-S640 PolarHBondContact OD1-OG 2.98Å
568	L	91.4	Very high	80.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.1	169.6	-50.8	-176.6	0	0	0	109.3	F566 W586 R638 L639 Y652 L678 I680	F566-L568 HydrophobicContact CD2-CD2 3.72Å; F566-L568 HydrophobicContact CD2-CG 3.93Å; F566-L568 HydrophobicContact CE2-CD1 4Å; F566-L568 HydrophobicContact CE2-CD2 3.83Å; F566-L568 HydrophobicContact CE2-CG 3.81Å; L568-W586 HydrophobicContact CB-CH2 3.42Å; L568-W586 VanDerWaalsContact CB-CH2 3.42Å; L568-W586 HydrophobicContact CB-CZ2 3.82Å; L568-W586 HydrophobicContact CB-CZ3 3.89Å; L568-W586 HydrophobicContact CD1-CE3 4.4Å; L568-W586 HydrophobicContact CD1-CH2 4.45Å; L568-W586 HydrophobicContact CD1-CZ3 4.07Å; L568-R638 CarbonylContact O-C 3.58Å; L568-R638 VanDerWaalsContact O-CA 3.31Å; L568-R638 WeakPolarHBondContact O-CA 3.36Å; L568-L639 HydrophobicContact CB-CB 4.41Å; L568-L639 HydrophobicContact CD1-CD2 4.31Å; L568-L639 PolarHBondContact N-O 2.86Å; L568-L639 PolarHBondContact O-N 2.97Å; L568-Y652 HydrophobicContact CD1-CD1 3.36Å; L568-Y652 HydrophobicContact CD1-CD2 3.98Å; L568-Y652 HydrophobicContact CD1-CE1 3.92Å; L568-Y652 HydrophobicContact CD1-CE2 4.47Å; L568-Y652 HydrophobicContact CD1-CG 3.39Å; L568-L678 HydrophobicContact CD2-CD1 3.97Å; L568-I680 HydrophobicContact CD2-CD1 3.7Å; L568-I680 HydrophobicContact CD2-CG1 3.91Å
569	L	92.3	Very high	79	Confident	57 Å²	57	59.4 Å²	59.4	30%	0.298	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	109.5	179.6	176.7	62.3	0	0	0	109.9	A553 S554 L571 N636	A553-L569 WeakPolarHBondContact CA-O 3.48Å; S554-L569 PolarHBondContact N-O 2.89Å; S554-L569 PolarHBondContact O-N 2.86Å; S554-L569 PolarHBondContact OG-O 2.77Å; L569-L571 HydrophobicContact CD1-CD2 4.24Å; L569-L571 HydrophobicContact CD2-CD2 3.94Å; L569-L571 HydrophobicContact CD2-CG 4.26Å; L569-L571 HydrophobicContact CG-CD2 3.98Å; L569-L571 HydrophobicContact CG-CG 4.11Å; L569-N636 HydrophobicContact CD1-CB 3.97Å
570	C	91.6	Very high	78	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	115	168.1	-174.4	0	0	0	0	108.6	W586 F637 C654	C570-W586 HydrophobicContact CB-CH2 3.83Å; C570-W586 HydrophobicContact CB-CZ2 3.5Å; C570-W586 VanDerWaalsContact CB-CZ2 3.5Å; C570-F637 HydrophobicContact CB-CB 4.24Å; C570-F637 PolarHBondContact N-O 2.57Å; C570-F637 PolarHBondContact O-N 2.89Å; C570-C654 HydrophobicContact CB-CB 3.65Å; C570-C654 WeakPolarHBondContact CB-SG 3.19Å; C570-C654 WeakPolarHBondContact SG-CB 3.45Å; C570-C654 CovalentContact SG-SG 2.03Å; C570-C654 PolarHBondContact SG-SG 2.87Å
571	L	89.5	Confident	77.3	Confident	37 Å²	37	59.3 Å²	59.3	19%	0.194	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	105.2	173.8	-67.7	176.6	0	0	0	108.9	V551 S552 L569	V551-L571 WeakPolarHBondContact CA-O 3.41Å; S552-L571 PolarHBondContact N-O 2.8Å; S552-L571 PolarHBondContact O-N 2.81Å; L569-L571 HydrophobicContact CD1-CD2 4.24Å; L569-L571 HydrophobicContact CD2-CD2 3.94Å; L569-L571 HydrophobicContact CD2-CG 4.26Å; L569-L571 HydrophobicContact CG-CD2 3.98Å; L569-L571 HydrophobicContact CG-CG 4.11Å
572	V	86.3	Confident	77.1	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	116	169.5	-173.2	0	0	0	0	108.3	F549 V551 P574 T582 V584 T635 F637 A656	F549-V572 HydrophobicContact CD2-CG1 4.3Å; F549-V572 HydrophobicContact CE2-CG1 3.44Å; F549-V572 VanDerWaalsContact CE2-CG1 3.44Å; F549-V572 HydrophobicContact CZ-CG1 4.16Å; V551-V572 HydrophobicContact CG1-CG2 4.47Å; V572-P574 WeakPolarHBondContact O-CD 3.37Å; V572-T582 HydrophobicContact CG1-CG2 4.21Å; V572-V584 HydrophobicContact CG2-CG2 3.9Å; V572-T635 PolarHBondContact N-O 2.76Å; V572-T635 VanDerWaalsContact O-CA 3.31Å; V572-T635 WeakPolarHBondContact O-CA 3Å; V572-T635 VanDerWaalsContact O-CB 3.31Å; V572-T635 WeakPolarHBondContact O-CB 3.43Å; V572-F637 HydrophobicContact CB-CE2 4.24Å; V572-F637 HydrophobicContact CG2-CD2 4Å; V572-F637 HydrophobicContact CG2-CE2 3.95Å; V572-A656 HydrophobicContact CG1-CB 4.26Å; V572-A656 HydrophobicContact CG2-CB 3.75Å
573	K	75.8	Confident	77.2	Confident	110 Å²	110	57 Å²	57	48%	0.478	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	91.5	179.1	-68.1	-172.1	179.5	-176.9	0	109.8	M550 R575	M550-K573 HydrophobicContact CE-CB 4.37Å; M550-K573 PolarHBondContact N-O 2.98Å; M550-K573 VanDerWaalsContact N-O 3.16Å; M550-K573 PolarHBondContact O-N 2.88Å; K573-R575 PolarHBondContact O-N 3.03Å; K573-R575 VanDerWaalsContact O-N 3.12Å
574	P	63.6	Low	77.8	Confident	22 Å²	22	55.3 Å²	55.3	14%	0.143	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	102.3	156.6	30.3	-29.5	0	0	0	106.3	V572 H576	V572-P574 WeakPolarHBondContact O-CD 3.37Å; P574-H576 PolarHBondContact O-N 2.91Å
575	R	57.8	Low	78	Confident	156 Å²	156	52.6 Å²	52.6	59%	0.589	26%	0.261	S	S	*	.	S	Bend	trans	-56.9	-22.2	-165.9	-78.5	176.7	174.4	-120.9	6.2	115	S548 M550 K573	S548-R575 WeakPolarHBondContact O-CG 3.3Å; S548-R575 PolarHBondContact O-N 3.02Å; M550-R575 HydrophobicContact CE-CG 4.14Å; M550-R575 VanDerWaalsContact CE-NE 3.33Å; M550-R575 PolarHBondContact SD-NE 2.85Å; M550-R575 PolarHBondContact SD-NH2 2.81Å; K573-R575 PolarHBondContact O-N 3.03Å; K573-R575 VanDerWaalsContact O-N 3.12Å
576	H	55.7	Low	78.2	Confident	110 Å²	110	49.3 Å²	49.3	51%	0.509	24%	0.238	S	C	.	.	S	Bend	trans	-134.7	-13.6	-170.1	-46.6	111.3	0	0	0	116.3	L425 P574	L425-H576 HydrophobicContact CD1-CB 3.48Å; L425-H576 VanDerWaalsContact CD1-CB 3.48Å; P574-H576 PolarHBondContact O-N 2.91Å
577	N	58	Low	78.2	Confident	43 Å²	43	52.6 Å²	52.6	23%	0.23	25%	0.25	C	S	.	.			trans	-137.2	104.6	-178.1	-170.5	-16.2	0	0	0	112.4	R579 V580	N577-R579 VanDerWaalsContact C-N 3.28Å; N577-R579 PolarHBondContact O-N 2.65Å; N577-R579 WeakPolarHBondContact OD1-CB 3.19Å; N577-R579 PolarHBondContact OD1-N 2.82Å; N577-V580 HydrophobicContact CB-CG2 4.3Å
578	P	55.7	Low	78.2	Confident	104 Å²	104	50.1 Å²	50.1	68%	0.675	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	0.7	-179.2	34.4	-36.5	0	0	0	114
579	R	57.4	Low	78	Confident	223 Å²	223	51.3 Å²	51.3	84%	0.842	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-7.6	-176.5	-61.9	-179	178.7	156.8	0.1	114.1	N577 P581	N577-R579 VanDerWaalsContact C-N 3.28Å; N577-R579 PolarHBondContact O-N 2.65Å; N577-R579 WeakPolarHBondContact OD1-CB 3.19Å; N577-R579 PolarHBondContact OD1-N 2.82Å; R579-P581 VanDerWaalsContact O-CD 3.24Å; R579-P581 WeakPolarHBondContact O-CD 3.42Å
580	V	66.1	Low	77.6	Confident	26 Å²	26	51.8 Å²	51.8	16%	0.158	25%	0.249	C	C	.	.	S	Bend	trans	-76.2	116.5	-178.2	-173.5	0	0	0	0	110.1	N577 T582 L658	N577-V580 HydrophobicContact CB-CG2 4.3Å; V580-T582 PolarHBondContact O-N 2.96Å; V580-T582 PolarHBondContact O-OG1 3.06Å; V580-L658 HydrophobicContact CB-CD2 4.41Å; V580-L658 HydrophobicContact CG1-CB 4.16Å; V580-L658 HydrophobicContact CG1-CD2 3.98Å; V580-L658 HydrophobicContact CG1-CG 4.46Å
581	P	75.6	Confident	76.8	Confident	45 Å²	45	55 Å²	55	29%	0.292	28%	0.275	S	S	.	.			trans	-62.8	130.6	-179.6	-26.6	39.4	0	0	0	111.9	R579 R609 W659 W667	R579-P581 VanDerWaalsContact O-CD 3.24Å; R579-P581 WeakPolarHBondContact O-CD 3.42Å; P581-R609 HydrophobicContact CB-CG 3.34Å; P581-W659 PolarHBondContact O-N 2.84Å; P581-W667 HydrophobicContact CB-CH2 4.49Å; P581-W667 HydrophobicContact CB-CZ3 4.22Å; P581-W667 HydrophobicContact CG-CH2 3.98Å; P581-W667 HydrophobicContact CG-CZ3 3.89Å
582	T	81.7	Confident	75.7	Confident	14 Å²	14	56.2 Å²	56.2	9%	0.086	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.5	-173	-56.3	0	0	0	0	109.5	V572 V580 V584 A656 I657 L658	V572-T582 HydrophobicContact CG1-CG2 4.21Å; V580-T582 PolarHBondContact O-N 2.96Å; V580-T582 PolarHBondContact O-OG1 3.06Å; T582-V584 HydrophobicContact CG2-CG2 3.83Å; T582-A656 HydrophobicContact CG2-CB 4.22Å; T582-I657 WeakPolarHBondContact CA-O 3.42Å; T582-L658 HydrophobicContact CG2-CD2 4.33Å; T582-L658 VanDerWaalsContact OG1-CD2 3.29Å; T582-L658 WeakPolarHBondContact OG1-CD2 3.39Å
583	S	88.9	Confident	74.3	Confident	11 Å²	11	58.3 Å²	58.3	8%	0.077	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	139.1	164.9	60	0	0	0	0	110	F607 A656 I657 W659	S583-F607 CarbonylContact C-O 3.59Å; S583-F607 WeakPolarHBondContact CA-O 3.01Å; S583-F607 VanDerWaalsContact CB-O 3.3Å; S583-F607 WeakPolarHBondContact CB-O 3.47Å; S583-A656 WeakPolarHBondContact O-CA 3.3Å; S583-I657 PolarHBondContact N-O 2.88Å; S583-I657 PolarHBondContact O-N 3.48Å; S583-W659 PolarHBondContact OG-NE1 3.03Å
584	V	90.8	Very high	73.2	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	125.1	-176.5	-176.8	0	0	0	0	110.4	V572 T582 T606 F607 F637 C654 T655 A656	V572-V584 HydrophobicContact CG2-CG2 3.9Å; T582-V584 HydrophobicContact CG2-CG2 3.83Å; V584-T606 CarbonylContact O-C 3.5Å; V584-T606 WeakPolarHBondContact O-CA 3.31Å; V584-F607 HydrophobicContact CB-CD2 4.47Å; V584-F607 PolarHBondContact N-O 2.94Å; V584-F607 PolarHBondContact O-N 3.33Å; V584-F637 HydrophobicContact CB-CD1 4.12Å; V584-F637 HydrophobicContact CB-CD2 4.23Å; V584-F637 HydrophobicContact CB-CE1 4.26Å; V584-F637 HydrophobicContact CB-CE2 4.39Å; V584-F637 HydrophobicContact CB-CG 4.09Å; V584-F637 HydrophobicContact CB-CZ 4.39Å; V584-F637 HydrophobicContact CG1-CB 4.32Å; V584-F637 HydrophobicContact CG1-CD2 4.29Å; V584-F637 HydrophobicContact CG1-CG 4.17Å; V584-F637 HydrophobicContact CG2-CD1 4.16Å; V584-F637 HydrophobicContact CG2-CD2 3.7Å; V584-F637 HydrophobicContact CG2-CE1 3.93Å; V584-F637 HydrophobicContact CG2-CE2 3.47Å; V584-F637 VanDerWaalsContact CG2-CE2 3.47Å; V584-F637 HydrophobicContact CG2-CG 4.04Å; V584-F637 HydrophobicContact CG2-CZ 3.58Å; V584-C654 HydrophobicContact CG1-CB 4.25Å; V584-T655 CarbonylContact C-O 3.6Å; V584-T655 WeakPolarHBondContact CA-O 3.37Å; V584-A656 HydrophobicContact CG2-CB 3.86Å
585	T	91.4	Very high	72.7	Confident	16 Å²	16	67.8 Å²	67.8	10%	0.098	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	123.6	-179.3	-54.4	0	0	0	0	110.3	D603 V605 T606 C654 T655	T585-D603 HydrophobicContact CG2-CB 3.94Å; T585-D603 WeakPolarHBondContact CG2-OD1 3.39Å; T585-V605 CarbonylContact C-O 3.58Å; T585-V605 WeakPolarHBondContact CA-O 3.31Å; T585-T606 WeakPolarHBondContact CB-OG1 3.47Å; T585-T606 WeakPolarHBondContact CG2-OG1 3.01Å; T585-T606 WeakPolarHBondContact OG1-CG2 3.31Å; T585-T606 PolarHBondContact OG1-OG1 3.12Å; T585-C654 CarbonylContact O-C 3.59Å; T585-C654 WeakPolarHBondContact O-CA 3.5Å; T585-T655 PolarHBondContact N-O 3.36Å; T585-T655 PolarHBondContact O-N 3.36Å
586	W	92.2	Very high	72.3	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	134.3	168.5	-80.9	107.5	0	0	0	110.4	A553 L568 C570 L604 V605 L639 C654	A553-W586 HydrophobicContact CB-CH2 4.48Å; A553-W586 HydrophobicContact CB-CZ3 4.49Å; L568-W586 HydrophobicContact CB-CH2 3.42Å; L568-W586 VanDerWaalsContact CB-CH2 3.42Å; L568-W586 HydrophobicContact CB-CZ2 3.82Å; L568-W586 HydrophobicContact CB-CZ3 3.89Å; L568-W586 HydrophobicContact CD1-CE3 4.4Å; L568-W586 HydrophobicContact CD1-CH2 4.45Å; L568-W586 HydrophobicContact CD1-CZ3 4.07Å; C570-W586 HydrophobicContact CB-CH2 3.83Å; C570-W586 HydrophobicContact CB-CZ2 3.5Å; C570-W586 VanDerWaalsContact CB-CZ2 3.5Å; W586-L604 PolarHBondContact O-N 3.04Å; W586-V605 HydrophobicContact CB-CG1 3.97Å; W586-V605 HydrophobicContact CG-CG1 4.42Å; W586-V605 PolarHBondContact N-O 2.8Å; W586-L639 HydrophobicContact CB-CD2 3.96Å; W586-L639 HydrophobicContact CD2-CB 4.06Å; W586-L639 HydrophobicContact CD2-CD2 4.06Å; W586-L639 HydrophobicContact CG-CB 4.1Å; W586-L639 HydrophobicContact CG-CD2 3.82Å; W586-L639 HydrophobicContact CZ2-CB 4.21Å; W586-C654 HydrophobicContact CD2-CB 4.15Å; W586-C654 HydrophobicContact CE3-CB 3.94Å; W586-C654 HydrophobicContact CH2-CB 4.42Å; W586-C654 HydrophobicContact CZ3-CB 4.07Å
587	R	90.7	Very high	71.9	Confident	70 Å²	70	69.6 Å²	69.6	26%	0.264	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.4	-177.8	-84.6	-178.4	174.2	-125.8	-24.7	111.3	F601 K602 D603 Y652 Q653	R587-F601 HydrophobicContact CB-CB 4.09Å; R587-F601 HydrophobicContact CB-CD1 4.12Å; R587-F601 HydrophobicContact CB-CG 4.46Å; R587-F601 HydrophobicContact CG-CB 4.36Å; R587-K602 VanDerWaalsContact CA-O 3.3Å; R587-K602 WeakPolarHBondContact CA-O 3.31Å; R587-D603 WeakPolarHBondContact CD-OD1 3.44Å; R587-D603 WeakPolarHBondContact CG-OD1 3.39Å; R587-D603 IonicContact CZ-OD1 2.66Å; R587-D603 VanDerWaalsContact CZ-OD1 3.22Å; R587-D603 IonicContact CZ-OD2 3.19Å; R587-D603 IonicContact NE-OD1 3.45Å; R587-D603 PolarHBondContact NE-OD1 2.88Å; R587-D603 IonicContact NE-OD2 3.56Å; R587-D603 VanDerWaalsContact NH2-CG 3.27Å; R587-D603 IonicContact NH2-OD1 3.56Å; R587-D603 PolarHBondContact NH2-OD1 2.91Å; R587-D603 IonicContact NH2-OD2 3.74Å; R587-D603 PolarHBondContact NH2-OD2 2.88Å; R587-Y652 WeakPolarHBondContact O-CA 3.41Å; R587-Q653 HydrophobicContact CB-CG 3.79Å; R587-Q653 PolarHBondContact N-O 2.82Å; R587-Q653 PolarHBondContact O-N 3.02Å
588	F	89.7	Confident	71.6	Confident	8 Å²	8	75.9 Å²	75.9	4%	0.035	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	149.9	-177.2	175.8	-118.7	0	0	0	112.8	P590 K602 L604 L620 R647 K651 Y652	F588-P590 HydrophobicContact CD1-CG 4.37Å; F588-P590 HydrophobicContact CE1-CB 4.24Å; F588-P590 HydrophobicContact CE1-CG 3.78Å; F588-P590 HydrophobicContact CZ-CB 4.28Å; F588-P590 HydrophobicContact CZ-CG 4.29Å; F588-K602 PolarHBondContact N-O 2.9Å; F588-K602 PolarHBondContact O-N 2.87Å; F588-L604 HydrophobicContact CB-CD1 3.68Å; F588-L604 HydrophobicContact CB-CD2 3.92Å; F588-L604 HydrophobicContact CB-CG 3.75Å; F588-L604 HydrophobicContact CD1-CD2 4.45Å; F588-L604 HydrophobicContact CG-CD1 4.44Å; F588-L620 HydrophobicContact CD1-CD2 3.5Å; F588-L620 HydrophobicContact CE1-CD2 3.5Å; F588-L620 VanDerWaalsContact CE1-CD2 3.5Å; F588-L620 HydrophobicContact CG-CD2 4.06Å; F588-L620 HydrophobicContact CZ-CD2 4.07Å; F588-R647 WeakPolarHBondContact CZ-O 3.41Å; F588-K651 CarbonylContact C-O 3.58Å; F588-K651 WeakPolarHBondContact CA-O 3.37Å; F588-Y652 HydrophobicContact CB-CD1 4.1Å; F588-Y652 HydrophobicContact CB-CE1 4.02Å; F588-Y652 AromaticContact CD2-CD1 3.71Å; F588-Y652 HydrophobicContact CD2-CD1 3.71Å; F588-Y652 AromaticContact CD2-CD2 3.91Å; F588-Y652 HydrophobicContact CD2-CD2 3.91Å; F588-Y652 AromaticContact CD2-CE1 3.34Å; F588-Y652 HydrophobicContact CD2-CE1 3.34Å; F588-Y652 AromaticContact CD2-CE2 3.56Å; F588-Y652 HydrophobicContact CD2-CE2 3.56Å; F588-Y652 AromaticContact CD2-CG 3.99Å; F588-Y652 HydrophobicContact CD2-CG 3.99Å; F588-Y652 AromaticContact CD2-CZ 3.25Å; F588-Y652 HydrophobicContact CE2-CD2 4.18Å; F588-Y652 AromaticContact CE2-CE1 3.98Å; F588-Y652 HydrophobicContact CE2-CE1 3.98Å; F588-Y652 AromaticContact CE2-CE2 3.49Å; F588-Y652 HydrophobicContact CE2-CE2 3.49Å; F588-Y652 VanDerWaalsContact CE2-CE2 3.49Å; F588-Y652 AromaticContact CE2-CZ 3.37Å; F588-Y652 WeakPolarHBondContact CE2-OH 3.5Å; F588-Y652 HydrophobicContact CG-CD1 4.28Å; F588-Y652 AromaticContact CG-CE1 3.86Å; F588-Y652 HydrophobicContact CG-CE1 3.86Å
589	M	87.2	Confident	71.8	Confident	26 Å²	26	73.2 Å²	73.2	13%	0.128	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	115.7	176.5	170.6	-174.2	-65.3	0	0	108.6	G599 F601 G650 K651	M589-G599 WeakPolarHBondContact CE-O 3.48Å; M589-F601 HydrophobicContact CB-CD1 3.86Å; M589-F601 HydrophobicContact CB-CE1 3.73Å; M589-F601 HydrophobicContact CB-CG 4.48Å; M589-F601 HydrophobicContact CB-CZ 4.25Å; M589-F601 HydrophobicContact CE-CD1 4.38Å; M589-F601 HydrophobicContact CE-CD2 3.62Å; M589-F601 HydrophobicContact CE-CE1 4.25Å; M589-F601 HydrophobicContact CE-CE2 3.47Å; M589-F601 VanDerWaalsContact CE-CE2 3.47Å; M589-F601 HydrophobicContact CE-CG 4.09Å; M589-F601 HydrophobicContact CE-CZ 3.79Å; M589-F601 HydrophobicContact SD-CE2 4.49Å; M589-F601 HydrophobicContact SD-CZ 4.3Å; M589-G650 CarbonylContact O-C 3.43Å; M589-G650 VanDerWaalsContact O-CA 3.26Å; M589-G650 WeakPolarHBondContact O-CA 3.43Å; M589-K651 HydrophobicContact CB-CB 4.32Å; M589-K651 PolarHBondContact N-O 3.15Å; M589-K651 PolarHBondContact O-N 2.61Å; M589-K651 HydrophobicContact SD-CD 3.97Å
590	P	84.5	Confident	72.6	Confident	66 Å²	66	69.2 Å²	69.2	43%	0.429	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	147.9	-175.7	-22.4	32.5	0	0	0	115	F588 G592 A593	F588-P590 HydrophobicContact CD1-CG 4.37Å; F588-P590 HydrophobicContact CE1-CB 4.24Å; F588-P590 HydrophobicContact CE1-CG 3.78Å; F588-P590 HydrophobicContact CZ-CB 4.28Å; F588-P590 HydrophobicContact CZ-CG 4.29Å; P590-G592 VanDerWaalsContact C-N 3.28Å; P590-G592 PolarHBondContact O-N 2.85Å; P590-A593 PolarHBondContact O-N 3.11Å
591	A	74.4	Confident	73.4	Confident	67 Å²	67	69.6 Å²	69.6	55%	0.554	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	77	170.2	0	0	0	0	0	111.6	A649	A591-A649 HydrophobicContact CB-CB 3.93Å; A591-A649 VanDerWaalsContact CB-O 3.31Å; A591-A649 WeakPolarHBondContact CB-O 3.07Å; A591-A649 PolarHBondContact N-O 3Å
592	G	65.1	Low	73.8	Confident	63 Å²	63	73 Å²	73	65%	0.649	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	161.3	-11.8	177.6	0	0	0	0	0	115.1	P590 Q594	P590-G592 VanDerWaalsContact C-N 3.28Å; P590-G592 PolarHBondContact O-N 2.85Å; G592-Q594 PolarHBondContact O-N 2.78Å
593	A	58.8	Low	74.1	Confident	44 Å²	44	75 Å²	75	36%	0.364	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	65.1	176.5	0	0	0	0	0	111.4	P590	P590-A593 PolarHBondContact O-N 3.11Å
594	Q	52.7	Low	74	Confident	170 Å²	170	74.8 Å²	74.8	79%	0.794	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	-11.9	-172.6	-163.6	163	-23.9	0	0	114.7	G592	G592-Q594 PolarHBondContact O-N 2.78Å
595	D	52.4	Low	73.9	Confident	161 Å²	161	74.8 Å²	74.8	86%	0.861	42%	0.417	S	S	*	.	S	Bend	trans	-114.2	-28	-175.4	-75.4	-43.6	0	0	0	116.5
596	D	50.1	Low	73.9	Confident	166 Å²	166	75.3 Å²	75.3	89%	0.888	42%	0.421	S	S	*	.	S	Bend	trans	-150.2	11.5	-171.1	-142.4	9.1	0	0	0	117
597	D	45.7	Very low	73.7	Confident	139 Å²	139	75.6 Å²	75.6	74%	0.743	42%	0.422	S	S	*	.	S	Bend	trans	-149.4	148.8	166.1	-148.1	-13.6	0	0	0	109.7	G599	D597-G599 PolarHBondContact O-N 3.14Å
598	Q	51.6	Low	73.4	Confident	174 Å²	174	72.9 Å²	72.9	81%	0.813	41%	0.413	S	S	*	.			trans	-64.3	127.4	-167.1	-64.7	-174.3	24.8	0	0	111.3	E600	Q598-E600 PolarHBondContact O-N 2.68Å
599	G	59.9	Low	73	Confident	49 Å²	49	75.7 Å²	75.7	51%	0.505	42%	0.423	S	S	.	.			trans	-69.4	69.7	-179	0	0	0	0	0	113.2	M589 D597	M589-G599 WeakPolarHBondContact CE-O 3.48Å; D597-G599 PolarHBondContact O-N 3.14Å
600	E	74.8	Confident	72.5	Confident	139 Å²	139	79.9 Å²	79.9	65%	0.65	44%	0.442	S	S	*	.			trans	-99.3	150.1	178.8	-172.9	167.5	-152.4	0	0	112.2	Q598 K602	Q598-E600 PolarHBondContact O-N 2.68Å; E600-K602 PolarHBondContact O-N 3.09Å
601	F	82.5	Confident	71.9	Confident	34 Å²	34	77.7 Å²	77.7	15%	0.149	43%	0.432	C	S	.	.			trans	-83.5	106.1	174.7	-82.8	-76.7	0	0	0	111.7	R587 M589 K651 Q653 L677	R587-F601 HydrophobicContact CB-CB 4.09Å; R587-F601 HydrophobicContact CB-CD1 4.12Å; R587-F601 HydrophobicContact CB-CG 4.46Å; R587-F601 HydrophobicContact CG-CB 4.36Å; M589-F601 HydrophobicContact CB-CD1 3.86Å; M589-F601 HydrophobicContact CB-CE1 3.73Å; M589-F601 HydrophobicContact CB-CG 4.48Å; M589-F601 HydrophobicContact CB-CZ 4.25Å; M589-F601 HydrophobicContact CE-CD1 4.38Å; M589-F601 HydrophobicContact CE-CD2 3.62Å; M589-F601 HydrophobicContact CE-CE1 4.25Å; M589-F601 HydrophobicContact CE-CE2 3.47Å; M589-F601 VanDerWaalsContact CE-CE2 3.47Å; M589-F601 HydrophobicContact CE-CG 4.09Å; M589-F601 HydrophobicContact CE-CZ 3.79Å; M589-F601 HydrophobicContact SD-CE2 4.49Å; M589-F601 HydrophobicContact SD-CZ 4.3Å; F601-K651 HydrophobicContact CE1-CB 4.12Å; F601-K651 HydrophobicContact CZ-CB 4.16Å; F601-Q653 HydrophobicContact CD1-CG 3.96Å; F601-Q653 HydrophobicContact CE1-CG 3.93Å; F601-Q653 HydrophobicContact CG-CG 4.4Å; F601-Q653 HydrophobicContact CZ-CG 4.34Å; F601-L677 HydrophobicContact CE1-CD2 4.37Å; F601-L677 HydrophobicContact CE2-CD2 4.12Å; F601-L677 HydrophobicContact CZ-CD2 3.54Å
602	K	84.6	Confident	72.3	Confident	116 Å²	116	78.2 Å²	78.2	50%	0.504	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	143.8	174.3	-60.6	-171	-176.3	-174	0	111.2	R587 F588 E600 Q618	R587-K602 VanDerWaalsContact CA-O 3.3Å; R587-K602 WeakPolarHBondContact CA-O 3.31Å; F588-K602 PolarHBondContact N-O 2.9Å; F588-K602 PolarHBondContact O-N 2.87Å; E600-K602 PolarHBondContact O-N 3.09Å; K602-Q618 HydrophobicContact CB-CB 4.04Å; K602-Q618 HydrophobicContact CB-CG 4.34Å; K602-Q618 HydrophobicContact CD-CB 3.89Å; K602-Q618 HydrophobicContact CD-CG 3.87Å; K602-Q618 VanDerWaalsContact CD-OE1 3.28Å
603	D	87.8	Confident	73.3	Confident	56 Å²	56	79.1 Å²	79.1	30%	0.299	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	125.8	175.2	-70.9	-40.1	0	0	0	110.6	T585 R587	T585-D603 HydrophobicContact CG2-CB 3.94Å; T585-D603 WeakPolarHBondContact CG2-OD1 3.39Å; R587-D603 WeakPolarHBondContact CD-OD1 3.44Å; R587-D603 WeakPolarHBondContact CG-OD1 3.39Å; R587-D603 IonicContact CZ-OD1 2.66Å; R587-D603 VanDerWaalsContact CZ-OD1 3.22Å; R587-D603 IonicContact CZ-OD2 3.19Å; R587-D603 IonicContact NE-OD1 3.45Å; R587-D603 PolarHBondContact NE-OD1 2.88Å; R587-D603 IonicContact NE-OD2 3.56Å; R587-D603 VanDerWaalsContact NH2-CG 3.27Å; R587-D603 IonicContact NH2-OD1 3.56Å; R587-D603 PolarHBondContact NH2-OD1 2.91Å; R587-D603 IonicContact NH2-OD2 3.74Å; R587-D603 PolarHBondContact NH2-OD2 2.88Å
604	L	87.9	Confident	74.6	Confident	7 Å²	7	82.4 Å²	82.4	4%	0.037	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-50.7	175.5	-66.9	-174.9	0	0	0	111.6	W586 F588 G616 Q618 L620 L639 Y652	W586-L604 PolarHBondContact O-N 3.04Å; F588-L604 HydrophobicContact CB-CD1 3.68Å; F588-L604 HydrophobicContact CB-CD2 3.92Å; F588-L604 HydrophobicContact CB-CG 3.75Å; F588-L604 HydrophobicContact CD1-CD2 4.45Å; F588-L604 HydrophobicContact CG-CD1 4.44Å; L604-G616 PolarHBondContact O-N 2.96Å; L604-Q618 WeakPolarHBondContact CD2-O 3.47Å; L604-L620 HydrophobicContact CD1-CD1 3.79Å; L604-L620 HydrophobicContact CD1-CD2 4.31Å; L604-L620 HydrophobicContact CD1-CG 4Å; L604-L620 HydrophobicContact CD2-CD2 4.16Å; L604-L620 HydrophobicContact CD2-CG 3.98Å; L604-L639 HydrophobicContact CD1-CD2 3.91Å; L604-Y652 HydrophobicContact CD1-CD1 4.34Å; L604-Y652 HydrophobicContact CD1-CE1 3.93Å
605	V	88.8	Confident	76.1	Confident	0 Å²	0	79.9 Å²	79.9	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	132.8	-173	58.3	0	0	0	0	110.9	T585 W586 L613 Q614 W615 V628	T585-V605 CarbonylContact C-O 3.58Å; T585-V605 WeakPolarHBondContact CA-O 3.31Å; W586-V605 HydrophobicContact CB-CG1 3.97Å; W586-V605 HydrophobicContact CG-CG1 4.42Å; W586-V605 PolarHBondContact N-O 2.8Å; V605-L613 HydrophobicContact CG2-CD2 4.2Å; V605-Q614 CarbonylContact C-O 3.59Å; V605-Q614 WeakPolarHBondContact CA-O 3.21Å; V605-W615 HydrophobicContact CB-CD2 4.28Å; V605-W615 HydrophobicContact CB-CE3 3.72Å; V605-W615 HydrophobicContact CB-CZ3 3.9Å; V605-W615 HydrophobicContact CG1-CZ3 4.27Å; V605-W615 HydrophobicContact CG2-CD2 4.09Å; V605-W615 HydrophobicContact CG2-CE3 4.01Å; V605-W615 HydrophobicContact CG2-CH2 4.48Å; V605-W615 HydrophobicContact CG2-CZ3 4.21Å; V605-V628 HydrophobicContact CG1-CG1 3.87Å; V605-V628 HydrophobicContact CG2-CG1 4.25Å
606	T	89.8	Confident	77.3	Confident	27 Å²	27	73.3 Å²	73.3	17%	0.166	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	121.3	176	-63.8	0	0	0	0	109.9	V584 T585 Q614	V584-T606 CarbonylContact O-C 3.5Å; V584-T606 WeakPolarHBondContact O-CA 3.31Å; T585-T606 WeakPolarHBondContact CB-OG1 3.47Å; T585-T606 WeakPolarHBondContact CG2-OG1 3.01Å; T585-T606 WeakPolarHBondContact OG1-CG2 3.31Å; T585-T606 PolarHBondContact OG1-OG1 3.12Å; T606-Q614 PolarHBondContact N-O 3.32Å; T606-Q614 PolarHBondContact O-N 2.95Å
607	F	88.4	Confident	78.2	Confident	5 Å²	5	75.2 Å²	75.2	2%	0.022	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	115.7	157.2	-63	-94.5	0	0	0	107.5	S583 V584 L613 V628 D629 R630 F637	S583-F607 CarbonylContact C-O 3.59Å; S583-F607 WeakPolarHBondContact CA-O 3.01Å; S583-F607 VanDerWaalsContact CB-O 3.3Å; S583-F607 WeakPolarHBondContact CB-O 3.47Å; V584-F607 HydrophobicContact CB-CD2 4.47Å; V584-F607 PolarHBondContact N-O 2.94Å; V584-F607 PolarHBondContact O-N 3.33Å; F607-L613 HydrophobicContact CD1-CD2 3.51Å; F607-L613 HydrophobicContact CE1-CD2 3.61Å; F607-L613 HydrophobicContact CG-CD2 4.08Å; F607-L613 HydrophobicContact CZ-CD2 4.23Å; F607-V628 HydrophobicContact CE1-CB 4.47Å; F607-V628 HydrophobicContact CZ-CB 3.88Å; F607-V628 HydrophobicContact CZ-CG1 4.45Å; F607-D629 WeakPolarHBondContact CZ-O 3.21Å; F607-R630 HydrophobicContact CD1-CB 4.2Å; F607-R630 HydrophobicContact CD1-CG 4.38Å; F607-R630 HydrophobicContact CE1-CB 3.85Å; F607-R630 HydrophobicContact CE1-CG 4.21Å; F607-F637 HydrophobicContact CB-CD1 4.09Å; F607-F637 HydrophobicContact CB-CE1 4.04Å; F607-F637 AromaticContact CD1-CD1 3.94Å; F607-F637 HydrophobicContact CD1-CD1 3.94Å; F607-F637 HydrophobicContact CD1-CE1 4.34Å; F607-F637 HydrophobicContact CD2-CB 4.33Å; F607-F637 AromaticContact CD2-CD1 3.63Å; F607-F637 HydrophobicContact CD2-CD1 3.63Å; F607-F637 HydrophobicContact CD2-CE1 4.42Å; F607-F637 HydrophobicContact CD2-CG 4.37Å; F607-F637 HydrophobicContact CE1-CD1 4.18Å; F607-F637 HydrophobicContact CE2-CB 3.95Å; F607-F637 AromaticContact CE2-CD1 3.91Å; F607-F637 HydrophobicContact CE2-CD1 3.91Å; F607-F637 HydrophobicContact CE2-CG 4.41Å; F607-F637 AromaticContact CG-CD1 3.63Å; F607-F637 HydrophobicContact CG-CD1 3.63Å; F607-F637 HydrophobicContact CG-CE1 4.05Å; F607-F637 HydrophobicContact CZ-CB 4.37Å; F607-F637 HydrophobicContact CZ-CD1 4.16Å
608	T	85.9	Confident	79	Confident	13 Å²	13	72.2 Å²	72.2	8%	0.08	37%	0.365	C	S	.	.			trans	-72.9	167.3	178.3	68.8	0	0	0	0	111.3	E610 G611 T612 Q614	T608-E610 PolarHBondContact O-N 3.08Å; T608-E610 PolarHBondContact OG1-N 2.65Å; T608-G611 WeakPolarHBondContact O-CA 3.46Å; T608-G611 PolarHBondContact O-N 2.03Å; T608-G611 PolarHBondContact OG1-N 2.86Å; T608-T612 VanDerWaalsContact CG2-OG1 3.29Å; T608-T612 WeakPolarHBondContact CG2-OG1 3.42Å; T608-T612 PolarHBondContact N-O 3.06Å; T608-T612 PolarHBondContact OG1-N 3.28Å; T608-T612 PolarHBondContact OG1-O 2.91Å; T608-T612 PolarHBondContact OG1-OG1 3.16Å; T608-Q614 VanDerWaalsContact CG2-CD 3.5Å; T608-Q614 HydrophobicContact CG2-CG 3.8Å
609	R	79.6	Confident	79.7	Confident	67 Å²	67	69.1 Å²	69.1	25%	0.253	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-33.8	174.5	-175.4	-171.5	63.9	-145	-2.2	112.4	P581 G611 W659	P581-R609 HydrophobicContact CB-CG 3.34Å; R609-G611 PolarHBondContact O-N 3.16Å; R609-W659 HydrophobicContact CG-CB 4.32Å; R609-W659 HydrophobicContact CG-CG 4.35Å
610	E	77.3	Confident	79.8	Confident	114 Å²	114	67.4 Å²	67.4	53%	0.533	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-8.8	175.9	-70.3	57.4	-129.9	0	0	112.5	T608 T612	T608-E610 PolarHBondContact O-N 3.08Å; T608-E610 PolarHBondContact OG1-N 2.65Å; E610-T612 VanDerWaalsContact C-N 3.34Å; E610-T612 HydrophobicContact CB-CG2 4.38Å
611	G	71.3	Confident	79	Confident	20 Å²	20	61.6 Å²	61.6	21%	0.206	31%	0.309	C	S	.	.	S	Bend	trans	77.1	18.2	-176	0	0	0	0	0	114.2	T608 R609 R630	T608-G611 WeakPolarHBondContact O-CA 3.46Å; T608-G611 PolarHBondContact O-N 2.03Å; T608-G611 PolarHBondContact OG1-N 2.86Å; R609-G611 PolarHBondContact O-N 3.16Å; G611-R630 PolarHBondContact O-NH2 3.28Å
612	T	83.7	Confident	77.4	Confident	79 Å²	79	68.4 Å²	68.4	49%	0.485	35%	0.347	S	S	.	.			trans	-82.5	164.3	166.4	66	0	0	0	0	110.6	T608 E610	T608-T612 VanDerWaalsContact CG2-OG1 3.29Å; T608-T612 WeakPolarHBondContact CG2-OG1 3.42Å; T608-T612 PolarHBondContact N-O 3.06Å; T608-T612 PolarHBondContact OG1-N 3.28Å; T608-T612 PolarHBondContact OG1-O 2.91Å; T608-T612 PolarHBondContact OG1-OG1 3.16Å; E610-T612 VanDerWaalsContact C-N 3.34Å; E610-T612 HydrophobicContact CB-CG2 4.38Å
613	L	85.6	Confident	76	Confident	81 Å²	81	63.7 Å²	63.7	42%	0.424	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.2	179.4	-70.8	168.7	0	0	0	110.4	V605 F607 V628	V605-L613 HydrophobicContact CG2-CD2 4.2Å; F607-L613 HydrophobicContact CD1-CD2 3.51Å; F607-L613 HydrophobicContact CE1-CD2 3.61Å; F607-L613 HydrophobicContact CG-CD2 4.08Å; F607-L613 HydrophobicContact CZ-CD2 4.23Å; L613-V628 HydrophobicContact CD1-CG2 3.65Å; L613-V628 HydrophobicContact CD2-CG2 3.87Å; L613-V628 HydrophobicContact CG-CG2 4.42Å
614	Q	85.8	Confident	74.8	Confident	114 Å²	114	61.7 Å²	61.7	53%	0.533	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	116.1	171.9	-70.4	176.2	-30.1	0	0	108.3	V605 T606 T608	V605-Q614 CarbonylContact C-O 3.59Å; V605-Q614 WeakPolarHBondContact CA-O 3.21Å; T606-Q614 PolarHBondContact N-O 3.32Å; T606-Q614 PolarHBondContact O-N 2.95Å; T608-Q614 VanDerWaalsContact CG2-CD 3.5Å; T608-Q614 HydrophobicContact CG2-CG 3.8Å
615	W	84.6	Confident	74.1	Confident	116 Å²	116	70 Å²	70	44%	0.439	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	143.8	172.4	-64.9	94.6	0	0	0	110	V605 T626 V628	V605-W615 HydrophobicContact CB-CD2 4.28Å; V605-W615 HydrophobicContact CB-CE3 3.72Å; V605-W615 HydrophobicContact CB-CZ3 3.9Å; V605-W615 HydrophobicContact CG1-CZ3 4.27Å; V605-W615 HydrophobicContact CG2-CD2 4.09Å; V605-W615 HydrophobicContact CG2-CE3 4.01Å; V605-W615 HydrophobicContact CG2-CH2 4.48Å; V605-W615 HydrophobicContact CG2-CZ3 4.21Å; W615-T626 WeakPolarHBondContact CH2-OG1 3.35Å; W615-V628 HydrophobicContact CH2-CG1 3.99Å; W615-V628 HydrophobicContact CH2-CG2 4.16Å; W615-V628 HydrophobicContact CZ2-CG2 3.91Å
616	G	77.8	Confident	73.8	Confident	23 Å²	23	71.8 Å²	71.8	24%	0.237	36%	0.362	C	S	.	.			trans	-83.3	173.9	173.4	0	0	0	0	0	112.3	L604 Q618	L604-G616 PolarHBondContact O-N 2.96Å; G616-Q618 VanDerWaalsContact C-N 3.27Å; G616-Q618 PolarHBondContact O-N 2.93Å
617	E	68	Low	73.6	Confident	206 Å²	206	74.3 Å²	74.3	96%	0.963	38%	0.378	S	S	*	.	S	Bend	trans	-68.8	-24.7	-177	-58.1	-176.1	154.1	0	0	113.1	L619	E617-L619 PolarHBondContact O-N 2.86Å
618	Q	63.8	Low	73.6	Confident	77 Å²	77	75.6 Å²	75.6	36%	0.36	39%	0.386	S	S	.	.			trans	-93.8	96.9	179.3	-172.4	71.2	70	0	0	110.7	K602 L604 G616	K602-Q618 HydrophobicContact CB-CB 4.04Å; K602-Q618 HydrophobicContact CB-CG 4.34Å; K602-Q618 HydrophobicContact CD-CB 3.89Å; K602-Q618 HydrophobicContact CD-CG 3.87Å; K602-Q618 VanDerWaalsContact CD-OE1 3.28Å; L604-Q618 WeakPolarHBondContact CD2-O 3.47Å; G616-Q618 VanDerWaalsContact C-N 3.27Å; G616-Q618 PolarHBondContact O-N 2.93Å
619	L	64.9	Low	73.5	Confident	109 Å²	109	79.4 Å²	79.4	57%	0.571	41%	0.406	S	S	*	.			trans	-72.6	146.2	166.6	-63.5	175.5	0	0	0	111	E617	E617-L619 PolarHBondContact O-N 2.86Å
620	L	63	Low	73.8	Confident	12 Å²	12	80.7 Å²	80.7	6%	0.063	41%	0.411	C	S	.	.	S	Bend	trans	-79.3	119.6	164.9	-69.2	175.5	0	0	0	108.3	F588 L604 T624 T626 V641 E648 Y652	F588-L620 HydrophobicContact CD1-CD2 3.5Å; F588-L620 HydrophobicContact CE1-CD2 3.5Å; F588-L620 VanDerWaalsContact CE1-CD2 3.5Å; F588-L620 HydrophobicContact CG-CD2 4.06Å; F588-L620 HydrophobicContact CZ-CD2 4.07Å; L604-L620 HydrophobicContact CD1-CD1 3.79Å; L604-L620 HydrophobicContact CD1-CD2 4.31Å; L604-L620 HydrophobicContact CD1-CG 4Å; L604-L620 HydrophobicContact CD2-CD2 4.16Å; L604-L620 HydrophobicContact CD2-CG 3.98Å; L620-T624 PolarHBondContact O-OG1 2.84Å; L620-T624 VanDerWaalsContact O-OG1 3.07Å; L620-T626 HydrophobicContact CB-CG2 4.03Å; L620-T626 HydrophobicContact CD1-CG2 3.83Å; L620-T626 HydrophobicContact CG-CG2 4.4Å; L620-V641 HydrophobicContact CD1-CG1 4.42Å; L620-V641 HydrophobicContact CD1-CG2 3.89Å; L620-E648 HydrophobicContact CB-CG 4.45Å; L620-Y652 HydrophobicContact CD1-CE1 4.23Å
621	G	58.1	Low	74	Confident	17 Å²	17	76.5 Å²	76.5	18%	0.175	39%	0.394	C	S	.	.			trans	63.9	163.2	172.9	0	0	0	0	0	116.4	E648	G621-E648 PolarHBondContact N-OE1 3.07Å
622	L	49.6	Very low	74	Confident	178 Å²	178	85 Å²	85	93%	0.932	43%	0.428	S	S	*	.	S	Bend	trans	-97	-9.8	154.9	-95.2	75.1	0	0	0	111.4
623	G	53.6	Low	73.3	Confident	16 Å²	16	84.3 Å²	84.3	17%	0.165	43%	0.426	C	S	.	.	S	Bend	trans	-104.4	-27.5	177.2	0	0	0	0	0	115.4	R643	G623-R643 PolarHBondContact O-NH2 3.07Å
624	T	63	Low	72.8	Confident	15 Å²	15	83.5 Å²	83.5	9%	0.092	42%	0.423	C	S	.	.			trans	-84	135.2	-169.5	54.2	0	0	0	0	112.3	L620 T642 R643 E648	L620-T624 PolarHBondContact O-OG1 2.84Å; L620-T624 VanDerWaalsContact O-OG1 3.07Å; T624-T642 WeakPolarHBondContact CA-O 3.49Å; T624-R643 VanDerWaalsContact CG2-O 3.25Å; T624-R643 WeakPolarHBondContact CG2-O 3.47Å; T624-E648 HydrophobicContact CG2-CG 3.92Å; T624-E648 WeakPolarHBondContact CG2-OE1 3.46Å; T624-E648 PolarHBondContact OG1-OE1 2.86Å
625	R	74.3	Confident	72.6	Confident	181 Å²	181	79.8 Å²	79.8	68%	0.683	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	111.4	175.5	-60.8	176.8	177.6	171.1	-1.7	108.3	T642	R625-T642 WeakPolarHBondContact CB-OG1 3.22Å; R625-T642 PolarHBondContact N-O 2.78Å; R625-T642 PolarHBondContact O-N 2.83Å; R625-T642 VanDerWaalsContact O-N 3.09Å; R625-T642 PolarHBondContact O-OG1 3.31Å
626	T	82.4	Confident	72.7	Confident	37 Å²	37	77.2 Å²	77.2	23%	0.227	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	135.8	170.2	52	0	0	0	0	109.8	W615 L620 S640 V641	W615-T626 WeakPolarHBondContact CH2-OG1 3.35Å; L620-T626 HydrophobicContact CB-CG2 4.03Å; L620-T626 HydrophobicContact CD1-CG2 3.83Å; L620-T626 HydrophobicContact CG-CG2 4.4Å; T626-S640 WeakPolarHBondContact CA-O 3.41Å; T626-V641 HydrophobicContact CG2-CG2 4.48Å
627	T	85.3	Confident	73.2	Confident	80 Å²	80	76.3 Å²	76.3	49%	0.491	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	148.3	168.6	58	0	0	0	0	109.9	S640	T627-S640 PolarHBondContact N-O 2.88Å; T627-S640 PolarHBondContact O-N 3.42Å; T627-S640 WeakPolarHBondContact OG1-CB 3.41Å
628	V	87.5	Confident	74.3	Confident	33 Å²	33	71.4 Å²	71.4	20%	0.2	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	135.2	-172.1	-75.3	0	0	0	0	110.1	V605 F607 L613 W615 R638 L639	V605-V628 HydrophobicContact CG1-CG1 3.87Å; V605-V628 HydrophobicContact CG2-CG1 4.25Å; F607-V628 HydrophobicContact CE1-CB 4.47Å; F607-V628 HydrophobicContact CZ-CB 3.88Å; F607-V628 HydrophobicContact CZ-CG1 4.45Å; L613-V628 HydrophobicContact CD1-CG2 3.65Å; L613-V628 HydrophobicContact CD2-CG2 3.87Å; L613-V628 HydrophobicContact CG-CG2 4.42Å; W615-V628 HydrophobicContact CH2-CG1 3.99Å; W615-V628 HydrophobicContact CH2-CG2 4.16Å; W615-V628 HydrophobicContact CZ2-CG2 3.91Å; V628-R638 WeakPolarHBondContact CA-O 3.3Å; V628-L639 HydrophobicContact CG1-CD1 3.83Å
629	D	85.4	Confident	75.6	Confident	93 Å²	93	67.8 Å²	67.8	50%	0.497	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	149.2	-175.8	175.8	35.8	0	0	0	110.5	F607 R638	F607-D629 WeakPolarHBondContact CZ-O 3.21Å; D629-R638 HydrophobicContact CB-CB 4.27Å; D629-R638 PolarHBondContact N-O 2.89Å; D629-R638 PolarHBondContact O-N 3.02Å
630	R	84.3	Confident	76.8	Confident	94 Å²	94	63.2 Å²	63.2	36%	0.355	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	130.9	175.9	64.2	175.4	177.4	103.4	-1.7	111.1	F607 G611 N634 N636 F637	F607-R630 HydrophobicContact CD1-CB 4.2Å; F607-R630 HydrophobicContact CD1-CG 4.38Å; F607-R630 HydrophobicContact CE1-CB 3.85Å; F607-R630 HydrophobicContact CE1-CG 4.21Å; G611-R630 PolarHBondContact O-NH2 3.28Å; R630-N634 PolarHBondContact NH1-OD1 2.68Å; R630-N636 WeakPolarHBondContact CA-O 3.45Å; R630-F637 HydrophobicContact CB-CD1 3.96Å; R630-F637 HydrophobicContact CB-CE1 4.16Å
631	S	81.2	Confident	78	Confident	26 Å²	26	62.7 Å²	62.7	18%	0.182	32%	0.322	C	S	.	.			trans	-57.2	145.2	169.9	55	0	0	0	0	111.7	S633 N634 T635 N636	S631-S633 WeakPolarHBondContact CB-OG 3.05Å; S631-S633 PolarHBondContact O-N 2.66Å; S631-S633 PolarHBondContact OG-OG 3.27Å; S631-S633 VanDerWaalsContact OG-OG 3.13Å; S631-N634 PolarHBondContact O-N 3.14Å; S631-T635 PolarHBondContact OG-N 2.68Å; S631-N636 PolarHBondContact N-O 3.34Å; S631-N636 PolarHBondContact OG-N 3.18Å; S631-N636 PolarHBondContact OG-O 2.96Å
632	H	71.4	Confident	79.3	Confident	199 Å²	199	63.8 Å²	63.8	92%	0.921	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-25.6	171	-63.2	-69.9	0	0	0	114.1	N634	H632-N634 VanDerWaalsContact C-N 3.27Å; H632-N634 PolarHBondContact O-N 2.81Å
633	S	70.2	Confident	81	Confident	63 Å²	63	61 Å²	61	44%	0.441	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-5.7	175	51.6	0	0	0	0	114.7	S631 T635	S631-S633 WeakPolarHBondContact CB-OG 3.05Å; S631-S633 PolarHBondContact O-N 2.66Å; S631-S633 PolarHBondContact OG-OG 3.27Å; S631-S633 VanDerWaalsContact OG-OG 3.13Å; S633-T635 PolarHBondContact O-N 3.12Å; S633-T635 VanDerWaalsContact O-N 3.14Å; S633-T635 PolarHBondContact OG-OG1 3.04Å
634	N	74.3	Confident	82.6	Confident	65 Å²	65	60.3 Å²	60.3	35%	0.348	30%	0.295	S	S	.	.	S	Bend	trans	50.2	29.7	-170.4	-62.8	-36.1	0	0	0	114	R630 S631 H632 F637	R630-N634 PolarHBondContact NH1-OD1 2.68Å; S631-N634 PolarHBondContact O-N 3.14Å; H632-N634 VanDerWaalsContact C-N 3.27Å; H632-N634 PolarHBondContact O-N 2.81Å; N634-F637 HydrophobicContact CB-CZ 4.24Å; N634-F637 WeakPolarHBondContact O-CE2 3.02Å; N634-F637 WeakPolarHBondContact O-CZ 3.18Å
635	T	81.1	Confident	83.5	Confident	35 Å²	35	59.6 Å²	59.6	22%	0.215	29%	0.291	C	S	.	.			trans	-102.2	-27.5	176.7	56	0	0	0	0	113.2	V572 S631 S633	V572-T635 PolarHBondContact N-O 2.76Å; V572-T635 VanDerWaalsContact O-CA 3.31Å; V572-T635 WeakPolarHBondContact O-CA 3Å; V572-T635 VanDerWaalsContact O-CB 3.31Å; V572-T635 WeakPolarHBondContact O-CB 3.43Å; S631-T635 PolarHBondContact OG-N 2.68Å; S633-T635 PolarHBondContact O-N 3.12Å; S633-T635 VanDerWaalsContact O-N 3.14Å; S633-T635 PolarHBondContact OG-OG1 3.04Å
636	N	87.4	Confident	83.8	Confident	63 Å²	63	60 Å²	60	34%	0.337	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	117.7	-172.5	-56.4	4.9	0	0	0	108.4	L569 R630 S631	L569-N636 HydrophobicContact CD1-CB 3.97Å; R630-N636 WeakPolarHBondContact CA-O 3.45Å; S631-N636 PolarHBondContact N-O 3.34Å; S631-N636 PolarHBondContact OG-N 3.18Å; S631-N636 PolarHBondContact OG-O 2.96Å
637	F	89.6	Confident	83.7	Confident	3 Å²	3	65.6 Å²	65.6	1%	0.013	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	116.9	177.6	-57.9	-97.2	0	0	0	108.1	C570 V572 V584 F607 R630 N634	C570-F637 HydrophobicContact CB-CB 4.24Å; C570-F637 PolarHBondContact N-O 2.57Å; C570-F637 PolarHBondContact O-N 2.89Å; V572-F637 HydrophobicContact CB-CE2 4.24Å; V572-F637 HydrophobicContact CG2-CD2 4Å; V572-F637 HydrophobicContact CG2-CE2 3.95Å; V584-F637 HydrophobicContact CB-CD1 4.12Å; V584-F637 HydrophobicContact CB-CD2 4.23Å; V584-F637 HydrophobicContact CB-CE1 4.26Å; V584-F637 HydrophobicContact CB-CE2 4.39Å; V584-F637 HydrophobicContact CB-CG 4.09Å; V584-F637 HydrophobicContact CB-CZ 4.39Å; V584-F637 HydrophobicContact CG1-CB 4.32Å; V584-F637 HydrophobicContact CG1-CD2 4.29Å; V584-F637 HydrophobicContact CG1-CG 4.17Å; V584-F637 HydrophobicContact CG2-CD1 4.16Å; V584-F637 HydrophobicContact CG2-CD2 3.7Å; V584-F637 HydrophobicContact CG2-CE1 3.93Å; V584-F637 HydrophobicContact CG2-CE2 3.47Å; V584-F637 VanDerWaalsContact CG2-CE2 3.47Å; V584-F637 HydrophobicContact CG2-CG 4.04Å; V584-F637 HydrophobicContact CG2-CZ 3.58Å; F607-F637 HydrophobicContact CB-CD1 4.09Å; F607-F637 HydrophobicContact CB-CE1 4.04Å; F607-F637 AromaticContact CD1-CD1 3.94Å; F607-F637 HydrophobicContact CD1-CD1 3.94Å; F607-F637 HydrophobicContact CD1-CE1 4.34Å; F607-F637 HydrophobicContact CD2-CB 4.33Å; F607-F637 AromaticContact CD2-CD1 3.63Å; F607-F637 HydrophobicContact CD2-CD1 3.63Å; F607-F637 HydrophobicContact CD2-CE1 4.42Å; F607-F637 HydrophobicContact CD2-CG 4.37Å; F607-F637 HydrophobicContact CE1-CD1 4.18Å; F607-F637 HydrophobicContact CE2-CB 3.95Å; F607-F637 AromaticContact CE2-CD1 3.91Å; F607-F637 HydrophobicContact CE2-CD1 3.91Å; F607-F637 HydrophobicContact CE2-CG 4.41Å; F607-F637 AromaticContact CG-CD1 3.63Å; F607-F637 HydrophobicContact CG-CD1 3.63Å; F607-F637 HydrophobicContact CG-CE1 4.05Å; F607-F637 HydrophobicContact CZ-CB 4.37Å; F607-F637 HydrophobicContact CZ-CD1 4.16Å; R630-F637 HydrophobicContact CB-CD1 3.96Å; R630-F637 HydrophobicContact CB-CE1 4.16Å; N634-F637 HydrophobicContact CB-CZ 4.24Å; N634-F637 WeakPolarHBondContact O-CE2 3.02Å; N634-F637 WeakPolarHBondContact O-CZ 3.18Å
638	R	90.6	Very high	83.7	Confident	103 Å²	103	61.8 Å²	61.8	39%	0.389	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.5	-175.9	-175.6	-178.6	-176.4	-178.1	-1.6	109.5	D567 L568 V628 D629 S640	D567-R638 IonicContact OD1-CZ 2.84Å; D567-R638 VanDerWaalsContact OD1-CZ 3.23Å; D567-R638 IonicContact OD1-NE 3.18Å; D567-R638 PolarHBondContact OD1-NE 2.92Å; D567-R638 IonicContact OD1-NH2 3.39Å; D567-R638 PolarHBondContact OD1-NH2 3.35Å; D567-R638 IonicContact OD2-CZ 3.73Å; D567-R638 IonicContact OD2-NE 2.67Å; D567-R638 IonicContact OD2-NH2 2.76Å; D567-R638 PolarHBondContact OD2-NH2 2.96Å; L568-R638 CarbonylContact O-C 3.58Å; L568-R638 VanDerWaalsContact O-CA 3.31Å; L568-R638 WeakPolarHBondContact O-CA 3.36Å; V628-R638 WeakPolarHBondContact CA-O 3.3Å; D629-R638 HydrophobicContact CB-CB 4.27Å; D629-R638 PolarHBondContact N-O 2.89Å; D629-R638 PolarHBondContact O-N 3.02Å; R638-S640 PolarHBondContact NE-OG 3.13Å; R638-S640 VanDerWaalsContact NE-OG 3.14Å
639	L	90.8	Very high	83.7	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	114.2	164.6	170	60.2	0	0	0	107.1	L568 W586 L604 V628 V641	L568-L639 HydrophobicContact CB-CB 4.41Å; L568-L639 HydrophobicContact CD1-CD2 4.31Å; L568-L639 PolarHBondContact N-O 2.86Å; L568-L639 PolarHBondContact O-N 2.97Å; W586-L639 HydrophobicContact CB-CD2 3.96Å; W586-L639 HydrophobicContact CD2-CB 4.06Å; W586-L639 HydrophobicContact CD2-CD2 4.06Å; W586-L639 HydrophobicContact CG-CB 4.1Å; W586-L639 HydrophobicContact CG-CD2 3.82Å; W586-L639 HydrophobicContact CZ2-CB 4.21Å; L604-L639 HydrophobicContact CD1-CD2 3.91Å; V628-L639 HydrophobicContact CG1-CD1 3.83Å; L639-V641 HydrophobicContact CG-CG2 4.34Å
640	S	89.8	Confident	83.8	Confident	14 Å²	14	56.6 Å²	56.6	10%	0.098	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.9	176.4	-59.9	0	0	0	0	108.9	F566 D567 T626 T627 R638	F566-S640 WeakPolarHBondContact O-CA 3.45Å; D567-S640 WeakPolarHBondContact OD1-CB 3.38Å; D567-S640 PolarHBondContact OD1-OG 2.98Å; T626-S640 WeakPolarHBondContact CA-O 3.41Å; T627-S640 PolarHBondContact N-O 2.88Å; T627-S640 PolarHBondContact O-N 3.42Å; T627-S640 WeakPolarHBondContact OG1-CB 3.41Å; R638-S640 PolarHBondContact NE-OG 3.13Å; R638-S640 VanDerWaalsContact NE-OG 3.14Å
641	V	88.8	Confident	84.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	125.8	178.7	-175.5	0	0	0	0	107.8	S565 F566 L620 T626 L639 E648	S565-V641 CarbonylContact C-O 3.5Å; S565-V641 VanDerWaalsContact CA-O 3.22Å; S565-V641 WeakPolarHBondContact CA-O 3.46Å; S565-V641 WeakPolarHBondContact CB-O 3.36Å; F566-V641 HydrophobicContact CD1-CB 4.02Å; F566-V641 HydrophobicContact CE1-CB 3.58Å; F566-V641 HydrophobicContact CE1-CG1 3.78Å; F566-V641 HydrophobicContact CE1-CG2 4.17Å; F566-V641 HydrophobicContact CE2-CB 4.11Å; F566-V641 HydrophobicContact CE2-CG2 3.91Å; F566-V641 HydrophobicContact CZ-CB 3.64Å; F566-V641 HydrophobicContact CZ-CG1 4.03Å; F566-V641 HydrophobicContact CZ-CG2 3.67Å; F566-V641 PolarHBondContact N-O 2.83Å; F566-V641 PolarHBondContact O-N 3.24Å; L620-V641 HydrophobicContact CD1-CG1 4.42Å; L620-V641 HydrophobicContact CD1-CG2 3.89Å; T626-V641 HydrophobicContact CG2-CG2 4.48Å; L639-V641 HydrophobicContact CG-CG2 4.34Å; V641-E648 HydrophobicContact CG1-CB 4.42Å; V641-E648 HydrophobicContact CG1-CG 3.77Å
642	T	85.9	Confident	84.6	Confident	41 Å²	41	55.6 Å²	55.6	25%	0.252	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	142.9	-175.2	64.4	0	0	0	0	112.2	S565 T624 R625	S565-T642 WeakPolarHBondContact OG-CA 3.35Å; S565-T642 WeakPolarHBondContact OG-CB 3.28Å; T624-T642 WeakPolarHBondContact CA-O 3.49Å; R625-T642 WeakPolarHBondContact CB-OG1 3.22Å; R625-T642 PolarHBondContact N-O 2.78Å; R625-T642 PolarHBondContact O-N 2.83Å; R625-T642 VanDerWaalsContact O-N 3.09Å; R625-T642 PolarHBondContact O-OG1 3.31Å
643	R	84.3	Confident	85.6	Confident	120 Å²	120	47.1 Å²	47.1	45%	0.453	22%	0.216	S	C	.	.	S	Bend	trans	59.6	42.9	-170.9	-54.4	-170.4	-60.2	153	-0.2	113.4	G563 D564 G623 T624 G645 P800	G563-R643 WeakPolarHBondContact O-CA 3.47Å; D564-R643 CarbonylContact O-C 3.58Å; D564-R643 WeakPolarHBondContact O-CA 3.33Å; D564-R643 PolarHBondContact O-N 2.94Å; D564-R643 VanDerWaalsContact O-N 3.13Å; G623-R643 PolarHBondContact O-NH2 3.07Å; T624-R643 VanDerWaalsContact CG2-O 3.25Å; T624-R643 WeakPolarHBondContact CG2-O 3.47Å; R643-G645 PolarHBondContact O-N 2.95Å; R643-P800 HydrophobicContact CB-CB 4.3Å; R643-P800 WeakPolarHBondContact O-CB 3.03Å
644	A	86.3	Confident	86.6	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	20%	0.195	C	C	.	.			trans	-58.5	130.5	-175.5	0	0	0	0	0	112.4	I560 G563 D564 F566 E648 V682	I560-A644 HydrophobicContact CD1-CB 3.59Å; G563-A644 PolarHBondContact N-O 2.83Å; D564-A644 PolarHBondContact O-N 3.26Å; F566-A644 HydrophobicContact CD1-CB 3.84Å; F566-A644 HydrophobicContact CE1-CB 3.65Å; A644-E648 HydrophobicContact CB-CB 4.19Å; A644-V682 HydrophobicContact CB-CG1 4.34Å; A644-V682 HydrophobicContact CB-CG2 4.27Å; A644-V682 WeakPolarHBondContact O-CG1 3.25Å
645	G	83.2	Confident	87.5	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	18%	0.183	C	C	.	.			trans	-114.2	-158.9	175.6	0	0	0	0	0	111.9	R643 R647 E648 V682	R643-G645 PolarHBondContact O-N 2.95Å; G645-R647 PolarHBondContact O-N 3.39Å; G645-E648 WeakPolarHBondContact CA-OE2 3.18Å; G645-E648 PolarHBondContact N-OE2 2.89Å; G645-E648 PolarHBondContact O-N 2.87Å; G645-V682 WeakPolarHBondContact O-CB 3.47Å; G645-V682 WeakPolarHBondContact O-CG1 3.18Å
646	R	80.1	Confident	87.9	Confident	191 Å²	191	40.1 Å²	40.1	72%	0.721	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-25.9	-179.3	-173.2	176.3	176.1	-172.6	-1.5	112.9	F562	F562-R646 HydrophobicContact CZ-CB 4.22Å
647	R	80.1	Confident	88	Confident	153 Å²	153	38.1 Å²	38.1	58%	0.577	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-25.7	-176	-63.3	-177.4	-170.9	-137.6	-5.3	113.5	F588 G645 D801	F588-R647 WeakPolarHBondContact CZ-O 3.41Å; G645-R647 PolarHBondContact O-N 3.39Å; R647-D801 WeakPolarHBondContact CD-OD2 3.43Å; R647-D801 VanDerWaalsContact CG-OD2 3.28Å; R647-D801 WeakPolarHBondContact CG-OD2 3.36Å; R647-D801 IonicContact NE-OD1 3.78Å; R647-D801 IonicContact NE-OD2 3.56Å; R647-D801 PolarHBondContact NE-OD2 2.72Å
648	E	85.2	Confident	87.7	Confident	0 Å²	0	38 Å²	38	0%	0	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-10.4	177.3	-66	66.7	-148.9	0	0	112.7	F566 L620 G621 T624 V641 A644 G645 Y652	F566-E648 HydrophobicContact CE1-CB 4.21Å; F566-E648 HydrophobicContact CZ-CB 4.42Å; L620-E648 HydrophobicContact CB-CG 4.45Å; G621-E648 PolarHBondContact N-OE1 3.07Å; T624-E648 HydrophobicContact CG2-CG 3.92Å; T624-E648 WeakPolarHBondContact CG2-OE1 3.46Å; T624-E648 PolarHBondContact OG1-OE1 2.86Å; V641-E648 HydrophobicContact CG1-CB 4.42Å; V641-E648 HydrophobicContact CG1-CG 3.77Å; A644-E648 HydrophobicContact CB-CB 4.19Å; G645-E648 WeakPolarHBondContact CA-OE2 3.18Å; G645-E648 PolarHBondContact N-OE2 2.89Å; G645-E648 PolarHBondContact O-N 2.87Å; E648-Y652 WeakPolarHBondContact O-CE2 3.46Å; E648-Y652 PolarHBondContact O-OH 3Å
649	A	87.3	Confident	87.2	Confident	10 Å²	10	35.8 Å²	35.8	8%	0.083	15%	0.153	C	C	.	.			trans	-66.6	135	170	0	0	0	0	0	110	A591 I680 V682	A591-A649 HydrophobicContact CB-CB 3.93Å; A591-A649 VanDerWaalsContact CB-O 3.31Å; A591-A649 WeakPolarHBondContact CB-O 3.07Å; A591-A649 PolarHBondContact N-O 3Å; A649-I680 WeakPolarHBondContact CA-O 3.45Å; A649-V682 HydrophobicContact CB-CB 4.14Å; A649-V682 HydrophobicContact CB-CG2 3.94Å
650	G	88.4	Confident	86.7	Confident	8 Å²	8	39.4 Å²	39.4	8%	0.082	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	157.5	-163.2	-177.5	0	0	0	0	0	114.5	M589 I680	M589-G650 CarbonylContact O-C 3.43Å; M589-G650 VanDerWaalsContact O-CA 3.26Å; M589-G650 WeakPolarHBondContact O-CA 3.43Å; G650-I680 PolarHBondContact N-O 3.33Å; G650-I680 PolarHBondContact O-N 3.37Å
651	K	89.7	Confident	85.9	Confident	98 Å²	98	43.8 Å²	43.8	43%	0.426	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129.1	177.7	-64.3	168.5	-171.7	162.2	0	109.7	F588 M589 F601 L678	F588-K651 CarbonylContact C-O 3.58Å; F588-K651 WeakPolarHBondContact CA-O 3.37Å; M589-K651 HydrophobicContact CB-CB 4.32Å; M589-K651 PolarHBondContact N-O 3.15Å; M589-K651 PolarHBondContact O-N 2.61Å; M589-K651 HydrophobicContact SD-CD 3.97Å; F601-K651 HydrophobicContact CE1-CB 4.12Å; F601-K651 HydrophobicContact CZ-CB 4.16Å; K651-L678 CarbonylContact C-O 3.57Å; K651-L678 WeakPolarHBondContact CA-O 3.36Å
652	Y	91.3	Very high	85.1	Confident	0 Å²	0	46 Å²	46	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	146.4	174.3	-67.3	-94.7	0	0	0	110.4	F566 L568 R587 F588 L604 L620 E648 L678 I680	F566-Y652 HydrophobicContact CE2-CE2 4.1Å; F566-Y652 AromaticContact CZ-CE2 3.99Å; F566-Y652 HydrophobicContact CZ-CE2 3.99Å; F566-Y652 AromaticContact CZ-CZ 3.89Å; L568-Y652 HydrophobicContact CD1-CD1 3.36Å; L568-Y652 HydrophobicContact CD1-CD2 3.98Å; L568-Y652 HydrophobicContact CD1-CE1 3.92Å; L568-Y652 HydrophobicContact CD1-CE2 4.47Å; L568-Y652 HydrophobicContact CD1-CG 3.39Å; R587-Y652 WeakPolarHBondContact O-CA 3.41Å; F588-Y652 HydrophobicContact CB-CD1 4.1Å; F588-Y652 HydrophobicContact CB-CE1 4.02Å; F588-Y652 AromaticContact CD2-CD1 3.71Å; F588-Y652 HydrophobicContact CD2-CD1 3.71Å; F588-Y652 AromaticContact CD2-CD2 3.91Å; F588-Y652 HydrophobicContact CD2-CD2 3.91Å; F588-Y652 AromaticContact CD2-CE1 3.34Å; F588-Y652 HydrophobicContact CD2-CE1 3.34Å; F588-Y652 AromaticContact CD2-CE2 3.56Å; F588-Y652 HydrophobicContact CD2-CE2 3.56Å; F588-Y652 AromaticContact CD2-CG 3.99Å; F588-Y652 HydrophobicContact CD2-CG 3.99Å; F588-Y652 AromaticContact CD2-CZ 3.25Å; F588-Y652 HydrophobicContact CE2-CD2 4.18Å; F588-Y652 AromaticContact CE2-CE1 3.98Å; F588-Y652 HydrophobicContact CE2-CE1 3.98Å; F588-Y652 AromaticContact CE2-CE2 3.49Å; F588-Y652 HydrophobicContact CE2-CE2 3.49Å; F588-Y652 VanDerWaalsContact CE2-CE2 3.49Å; F588-Y652 AromaticContact CE2-CZ 3.37Å; F588-Y652 WeakPolarHBondContact CE2-OH 3.5Å; F588-Y652 HydrophobicContact CG-CD1 4.28Å; F588-Y652 AromaticContact CG-CE1 3.86Å; F588-Y652 HydrophobicContact CG-CE1 3.86Å; L604-Y652 HydrophobicContact CD1-CD1 4.34Å; L604-Y652 HydrophobicContact CD1-CE1 3.93Å; L620-Y652 HydrophobicContact CD1-CE1 4.23Å; E648-Y652 WeakPolarHBondContact O-CE2 3.46Å; E648-Y652 PolarHBondContact O-OH 3Å; Y652-L678 PolarHBondContact N-O 3.27Å; Y652-L678 PolarHBondContact O-N 2.74Å; Y652-I680 HydrophobicContact CD2-CB 4.19Å; Y652-I680 HydrophobicContact CD2-CG1 3.69Å; Y652-I680 HydrophobicContact CE2-CB 4.04Å; Y652-I680 HydrophobicContact CE2-CG1 3.91Å
653	Q	92.3	Very high	84.3	Confident	22 Å²	22	47.2 Å²	47.2	10%	0.103	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	160.6	168.3	65	-179.4	-2.8	0	0	109.8	R587 F601 S675 L677	R587-Q653 HydrophobicContact CB-CG 3.79Å; R587-Q653 PolarHBondContact N-O 2.82Å; R587-Q653 PolarHBondContact O-N 3.02Å; F601-Q653 HydrophobicContact CD1-CG 3.96Å; F601-Q653 HydrophobicContact CE1-CG 3.93Å; F601-Q653 HydrophobicContact CG-CG 4.4Å; F601-Q653 HydrophobicContact CZ-CG 4.34Å; Q653-S675 WeakPolarHBondContact CA-OG 3.45Å; Q653-S675 WeakPolarHBondContact CB-OG 3.3Å; Q653-L677 HydrophobicContact CB-CD2 4.12Å
654	C	93.1	Very high	83.7	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	139.1	168	63	0	0	0	0	111	V551 C570 V584 T585 W586 T674 S675	V551-C654 VanDerWaalsContact CG1-SG 3.59Å; C570-C654 HydrophobicContact CB-CB 3.65Å; C570-C654 WeakPolarHBondContact CB-SG 3.19Å; C570-C654 WeakPolarHBondContact SG-CB 3.45Å; C570-C654 CovalentContact SG-SG 2.03Å; C570-C654 PolarHBondContact SG-SG 2.87Å; V584-C654 HydrophobicContact CG1-CB 4.25Å; T585-C654 CarbonylContact O-C 3.59Å; T585-C654 WeakPolarHBondContact O-CA 3.5Å; W586-C654 HydrophobicContact CD2-CB 4.15Å; W586-C654 HydrophobicContact CE3-CB 3.94Å; W586-C654 HydrophobicContact CH2-CB 4.42Å; W586-C654 HydrophobicContact CZ3-CB 4.07Å; C654-T674 CarbonylContact O-C 3.56Å; C654-T674 WeakPolarHBondContact O-CA 3.41Å; C654-S675 PolarHBondContact N-OG 3.39Å; C654-S675 PolarHBondContact O-N 2.85Å; C654-S675 PolarHBondContact O-OG 2.84Å
655	T	92.3	Very high	82.9	Confident	15 Å²	15	51.4 Å²	51.4	9%	0.092	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.6	171.5	-53.8	0	0	0	0	107.8	V584 T585 N672 T674	V584-T655 CarbonylContact C-O 3.6Å; V584-T655 WeakPolarHBondContact CA-O 3.37Å; T585-T655 PolarHBondContact N-O 3.36Å; T585-T655 PolarHBondContact O-N 3.36Å; T655-N672 WeakPolarHBondContact CG2-OD1 3.47Å; T655-T674 HydrophobicContact CG2-CG2 4.26Å
656	A	90.2	Very high	82.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.3	174.5	0	0	0	0	0	111.2	F549 V551 V572 T582 S583 V584 R673	F549-A656 WeakPolarHBondContact CE1-O 3.34Å; F549-A656 HydrophobicContact CZ-CB 3.76Å; V551-A656 HydrophobicContact CG1-CB 4.28Å; V551-A656 HydrophobicContact CG2-CB 3.7Å; V572-A656 HydrophobicContact CG1-CB 4.26Å; V572-A656 HydrophobicContact CG2-CB 3.75Å; T582-A656 HydrophobicContact CG2-CB 4.22Å; S583-A656 WeakPolarHBondContact O-CA 3.3Å; V584-A656 HydrophobicContact CG2-CB 3.86Å; A656-R673 PolarHBondContact N-O 2.98Å; A656-R673 PolarHBondContact O-N 3.01Å
657	I	88.8	Confident	82.8	Confident	22 Å²	22	48.3 Å²	48.3	11%	0.113	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.7	-176.7	-59	174.3	0	0	0	108.7	T582 S583 W659 R669 A671 N672	T582-I657 WeakPolarHBondContact CA-O 3.42Å; S583-I657 PolarHBondContact N-O 2.88Å; S583-I657 PolarHBondContact O-N 3.48Å; I657-W659 HydrophobicContact CG2-CD2 4.39Å; I657-W659 HydrophobicContact CG2-CZ2 4.04Å; I657-R669 HydrophobicContact CG2-CG 3.54Å; I657-A671 WeakPolarHBondContact CA-O 3.41Å; I657-N672 HydrophobicContact CG1-CB 4.42Å
658	L	84.4	Confident	82.8	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	136.3	171.9	-68.2	-175.2	0	0	0	110.7	V545 F549 V580 T582 V670 A671	V545-L658 HydrophobicContact CB-CD1 4.48Å; V545-L658 HydrophobicContact CG1-CD1 3.61Å; F549-L658 HydrophobicContact CB-CD1 3.97Å; F549-L658 HydrophobicContact CD1-CD1 4.12Å; F549-L658 HydrophobicContact CD1-CG 4.15Å; F549-L658 HydrophobicContact CD2-CD1 3.59Å; F549-L658 HydrophobicContact CD2-CD2 3.85Å; F549-L658 HydrophobicContact CD2-CG 3.69Å; F549-L658 HydrophobicContact CE1-CG 4.03Å; F549-L658 HydrophobicContact CE2-CD1 3.99Å; F549-L658 HydrophobicContact CE2-CD2 3.47Å; F549-L658 VanDerWaalsContact CE2-CD2 3.47Å; F549-L658 HydrophobicContact CE2-CG 3.52Å; F549-L658 HydrophobicContact CG-CD1 3.65Å; F549-L658 HydrophobicContact CG-CG 3.99Å; F549-L658 HydrophobicContact CZ-CD1 4.44Å; F549-L658 HydrophobicContact CZ-CD2 4.01Å; F549-L658 HydrophobicContact CZ-CG 3.71Å; V580-L658 HydrophobicContact CB-CD2 4.41Å; V580-L658 HydrophobicContact CG1-CB 4.16Å; V580-L658 HydrophobicContact CG1-CD2 3.98Å; V580-L658 HydrophobicContact CG1-CG 4.46Å; T582-L658 HydrophobicContact CG2-CD2 4.33Å; T582-L658 VanDerWaalsContact OG1-CD2 3.29Å; T582-L658 WeakPolarHBondContact OG1-CD2 3.39Å; L658-V670 HydrophobicContact CB-CB 3.9Å; L658-V670 PolarHBondContact O-N 3.48Å; L658-A671 HydrophobicContact CB-CB 4.31Å; L658-A671 HydrophobicContact CD1-CB 4.16Å; L658-A671 HydrophobicContact CG-CB 4.36Å; L658-A671 PolarHBondContact N-O 2.95Å
659	W	80.1	Confident	82.8	Confident	56 Å²	56	49.8 Å²	49.8	21%	0.212	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.3	178.8	-63	93.2	0	0	0	111.4	P581 S583 R609 I657 W667 S668	P581-W659 PolarHBondContact O-N 2.84Å; S583-W659 PolarHBondContact OG-NE1 3.03Å; R609-W659 HydrophobicContact CG-CB 4.32Å; R609-W659 HydrophobicContact CG-CG 4.35Å; I657-W659 HydrophobicContact CG2-CD2 4.39Å; I657-W659 HydrophobicContact CG2-CZ2 4.04Å; W659-W667 HydrophobicContact CB-CE3 3.87Å; W659-W667 HydrophobicContact CB-CZ3 4.28Å; W659-W667 HydrophobicContact CE3-CB 4.18Å; W659-S668 WeakPolarHBondContact CA-O 3.47Å
660	R	78.6	Confident	82.3	Confident	78 Å²	78	50.3 Å²	50.3	29%	0.294	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	136	170.1	-173	-167.1	-51.6	116.2	-4.4	108.5	E426 W667 S668 V670	E426-R660 IonicContact OE1-CZ 2.89Å; E426-R660 IonicContact OE1-NE 3.64Å; E426-R660 PolarHBondContact OE1-NE 2.96Å; E426-R660 IonicContact OE1-NH2 2.68Å; E426-R660 PolarHBondContact OE1-NH2 3.22Å; R660-W667 VanDerWaalsContact C-CE3 3.41Å; R660-W667 CarbonylContact O-C 3.55Å; R660-W667 VanDerWaalsContact O-CA 3.29Å; R660-W667 WeakPolarHBondContact O-CA 3.31Å; R660-S668 PolarHBondContact N-O 3.45Å; R660-S668 PolarHBondContact NH1-OG 2.92Å; R660-S668 PolarHBondContact O-N 2.81Å; R660-V670 HydrophobicContact CB-CG2 3.44Å; R660-V670 VanDerWaalsContact CB-CG2 3.44Å
661	K	74.4	Confident	81.9	Confident	105 Å²	105	50.1 Å²	50.1	46%	0.457	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	131.6	169.9	-165.5	179.8	174.7	-169.5	0	108.8	N665 W667	K661-N665 WeakPolarHBondContact CE-OD1 3.33Å; K661-N665 PolarHBondContact NZ-OD1 3.3Å; K661-W667 HydrophobicContact CB-CD2 3.97Å; K661-W667 HydrophobicContact CB-CE3 3.83Å; K661-W667 HydrophobicContact CB-CH2 3.76Å; K661-W667 HydrophobicContact CB-CZ2 3.87Å; K661-W667 HydrophobicContact CB-CZ3 3.72Å; K661-W667 HydrophobicContact CD-CH2 4.37Å; K661-W667 HydrophobicContact CD-CZ2 3.85Å; K661-W667 HydrophobicContact CG-CD2 4.12Å; K661-W667 HydrophobicContact CG-CE3 4.49Å; K661-W667 HydrophobicContact CG-CH2 4.27Å; K661-W667 HydrophobicContact CG-CZ2 3.85Å
662	N	70.6	Confident	81.8	Confident	48 Å²	48	49.3 Å²	49.3	26%	0.257	23%	0.233	S	C	.	.			trans	-92.3	163.7	177	-59.4	-22.3	0	0	0	109.8	D664 N665 S666 S668	N662-D664 VanDerWaalsContact C-N 3.3Å; N662-D664 WeakPolarHBondContact CB-OD1 3.45Å; N662-D664 PolarHBondContact O-N 3.24Å; N662-N665 WeakPolarHBondContact O-CA 3.28Å; N662-N665 PolarHBondContact O-N 2.86Å; N662-S666 PolarHBondContact N-O 2.85Å; N662-S666 PolarHBondContact ND2-OG 2.97Å; N662-S668 WeakPolarHBondContact OD1-CB 3.47Å; N662-S668 PolarHBondContact OD1-OG 3.14Å
663	Y	68.9	Low	81.6	Confident	65 Å²	65	54.7 Å²	54.7	26%	0.255	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-28	-175.6	-55.7	-65.3	0	0	0	113.8	E478 R479 Y482 E484 N665	E478-Y663 WeakPolarHBondContact OE1-CB 3.49Å; R479-Y663 HydrophobicContact CG-CE2 4.07Å; Y482-Y663 AromaticContact CD2-CD1 3.78Å; Y482-Y663 HydrophobicContact CD2-CD1 3.78Å; Y482-Y663 HydrophobicContact CD2-CE1 4.46Å; Y482-Y663 HydrophobicContact CD2-CG 4.28Å; Y482-Y663 AromaticContact CE2-CD1 3.91Å; Y482-Y663 HydrophobicContact CE2-CD1 3.91Å; Y482-Y663 HydrophobicContact CE2-CG 4.06Å; Y482-Y663 HydrophobicContact CG-CD1 4.4Å; Y482-Y663 PolarHBondContact OH-O 2.99Å; E484-Y663 PolarHBondContact OE1-OH 3.04Å; E484-Y663 VanDerWaalsContact OE1-OH 3.13Å; E484-Y663 PolarHBondContact OE2-OH 3.25Å; Y663-N665 PolarHBondContact O-N 3.47Å
664	D	73.3	Confident	81.6	Confident	109 Å²	109	57.6 Å²	57.6	58%	0.583	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	2.2	169.7	67.8	-16.5	0	0	0	113.9	N662 S666	N662-D664 VanDerWaalsContact C-N 3.3Å; N662-D664 WeakPolarHBondContact CB-OD1 3.45Å; N662-D664 PolarHBondContact O-N 3.24Å; D664-S666 PolarHBondContact O-N 3.27Å; D664-S666 WeakPolarHBondContact OD1-CB 3.49Å; D664-S666 PolarHBondContact OD1-N 2.87Å; D664-S666 PolarHBondContact OD1-OG 3.2Å; D664-S666 WeakPolarHBondContact OD2-CB 3.26Å; D664-S666 PolarHBondContact OD2-OG 2.81Å
665	N	69.4	Low	81.6	Confident	99 Å²	99	58 Å²	58	53%	0.529	28%	0.276	S	S	.	.	S	Bend	trans	67.1	4.7	-169.7	-58.7	-93.9	0	0	0	115.8	K661 N662 Y663	K661-N665 WeakPolarHBondContact CE-OD1 3.33Å; K661-N665 PolarHBondContact NZ-OD1 3.3Å; N662-N665 WeakPolarHBondContact O-CA 3.28Å; N662-N665 PolarHBondContact O-N 2.86Å; Y663-N665 PolarHBondContact O-N 3.47Å
666	S	80.7	Confident	81.5	Confident	47 Å²	47	60.9 Å²	60.9	33%	0.329	29%	0.291	S	S	.	.			trans	-71.9	177	167.1	78.9	0	0	0	0	110.8	N662 D664	N662-S666 PolarHBondContact N-O 2.85Å; N662-S666 PolarHBondContact ND2-OG 2.97Å; D664-S666 PolarHBondContact O-N 3.27Å; D664-S666 WeakPolarHBondContact OD1-CB 3.49Å; D664-S666 PolarHBondContact OD1-N 2.87Å; D664-S666 PolarHBondContact OD1-OG 3.2Å; D664-S666 WeakPolarHBondContact OD2-CB 3.26Å; D664-S666 PolarHBondContact OD2-OG 2.81Å
667	W	80.1	Confident	81.5	Confident	79 Å²	79	65.4 Å²	65.4	30%	0.299	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	122.8	-176.5	-69.8	81.2	0	0	0	111.6	P581 W659 R660 K661	P581-W667 HydrophobicContact CB-CH2 4.49Å; P581-W667 HydrophobicContact CB-CZ3 4.22Å; P581-W667 HydrophobicContact CG-CH2 3.98Å; P581-W667 HydrophobicContact CG-CZ3 3.89Å; W659-W667 HydrophobicContact CB-CE3 3.87Å; W659-W667 HydrophobicContact CB-CZ3 4.28Å; W659-W667 HydrophobicContact CE3-CB 4.18Å; R660-W667 VanDerWaalsContact C-CE3 3.41Å; R660-W667 CarbonylContact O-C 3.55Å; R660-W667 VanDerWaalsContact O-CA 3.29Å; R660-W667 WeakPolarHBondContact O-CA 3.31Å; K661-W667 HydrophobicContact CB-CD2 3.97Å; K661-W667 HydrophobicContact CB-CE3 3.83Å; K661-W667 HydrophobicContact CB-CH2 3.76Å; K661-W667 HydrophobicContact CB-CZ2 3.87Å; K661-W667 HydrophobicContact CB-CZ3 3.72Å; K661-W667 HydrophobicContact CD-CH2 4.37Å; K661-W667 HydrophobicContact CD-CZ2 3.85Å; K661-W667 HydrophobicContact CG-CD2 4.12Å; K661-W667 HydrophobicContact CG-CE3 4.49Å; K661-W667 HydrophobicContact CG-CH2 4.27Å; K661-W667 HydrophobicContact CG-CZ2 3.85Å
668	S	80.6	Confident	81.5	Confident	29 Å²	29	65.4 Å²	65.4	20%	0.203	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	145.7	175.2	50	0	0	0	0	111.5	W659 R660 N662	W659-S668 WeakPolarHBondContact CA-O 3.47Å; R660-S668 PolarHBondContact N-O 3.45Å; R660-S668 PolarHBondContact NH1-OG 2.92Å; R660-S668 PolarHBondContact O-N 2.81Å; N662-S668 WeakPolarHBondContact OD1-CB 3.47Å; N662-S668 PolarHBondContact OD1-OG 3.14Å
669	R	83.6	Confident	81.8	Confident	155 Å²	155	67.4 Å²	67.4	59%	0.585	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	119.2	172.1	-161.2	-165	-50.3	-112.3	2	108.2	I657	I657-R669 HydrophobicContact CG2-CG 3.54Å
670	V	78.4	Confident	82.3	Confident	22 Å²	22	64.8 Å²	64.8	13%	0.133	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-42.8	-176.7	-176.6	0	0	0	0	111.6	L658 R660	L658-V670 HydrophobicContact CB-CB 3.9Å; L658-V670 PolarHBondContact O-N 3.48Å; R660-V670 HydrophobicContact CB-CG2 3.44Å; R660-V670 VanDerWaalsContact CB-CG2 3.44Å
671	A	79.2	Confident	82.7	Confident	3 Å²	3	65.3 Å²	65.3	3%	0.025	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	152.8	-178.8	0	0	0	0	0	109.9	E546 F549 I657 L658	E546-A671 HydrophobicContact CB-CB 3.95Å; E546-A671 HydrophobicContact CG-CB 3.85Å; F549-A671 HydrophobicContact CD1-CB 3.64Å; F549-A671 HydrophobicContact CE1-CB 4.09Å; F549-A671 HydrophobicContact CG-CB 4.41Å; I657-A671 WeakPolarHBondContact CA-O 3.41Å; L658-A671 HydrophobicContact CB-CB 4.31Å; L658-A671 HydrophobicContact CD1-CB 4.16Å; L658-A671 HydrophobicContact CG-CB 4.36Å; L658-A671 PolarHBondContact N-O 2.95Å
672	N	88.6	Confident	83.4	Confident	81 Å²	81	61.1 Å²	61.1	43%	0.433	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	124.3	170.2	-178.2	17.9	0	0	0	108.3	T655 I657	T655-N672 WeakPolarHBondContact CG2-OD1 3.47Å; I657-N672 HydrophobicContact CG1-CB 4.42Å
673	R	87.3	Confident	84.1	Confident	114 Å²	114	63.4 Å²	63.4	43%	0.43	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	131.6	179.2	-68.1	-68	-174.6	177.8	-4.3	110.5	F549 V551 A656	F549-R673 HydrophobicContact CD1-CB 4Å; F549-R673 HydrophobicContact CD1-CG 3.46Å; F549-R673 VanDerWaalsContact CD1-CG 3.46Å; F549-R673 HydrophobicContact CE1-CB 3.74Å; F549-R673 HydrophobicContact CE1-CG 3.72Å; V551-R673 HydrophobicContact CB-CB 4.24Å; V551-R673 HydrophobicContact CG2-CB 3.63Å; A656-R673 PolarHBondContact N-O 2.98Å; A656-R673 PolarHBondContact O-N 3.01Å
674	T	90.9	Very high	84.9	Confident	82 Å²	82	65.2 Å²	65.2	50%	0.503	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	150.8	165.8	43.1	0	0	0	0	110.5	C654 T655	C654-T674 CarbonylContact O-C 3.56Å; C654-T674 WeakPolarHBondContact O-CA 3.41Å; T655-T674 HydrophobicContact CG2-CG2 4.26Å
675	S	92.6	Very high	85.4	Confident	10 Å²	10	61.5 Å²	61.5	7%	0.07	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-73.6	172	169.9	67.4	0	0	0	0	112.4	A553 Q653 C654	A553-S675 WeakPolarHBondContact CB-OG 3.48Å; Q653-S675 WeakPolarHBondContact CA-OG 3.45Å; Q653-S675 WeakPolarHBondContact CB-OG 3.3Å; C654-S675 PolarHBondContact N-OG 3.39Å; C654-S675 PolarHBondContact O-N 2.85Å; C654-S675 PolarHBondContact O-OG 2.84Å
676	N	91.4	Very high	86.1	Confident	75 Å²	75	65.2 Å²	65.2	40%	0.401	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-54.7	154.6	152.6	59.8	-76.7	0	0	0	111.3	S552 A553	S552-N676 WeakPolarHBondContact CA-OD1 3.14Å; A553-N676 PolarHBondContact N-OD1 2.98Å; A553-N676 PolarHBondContact O-ND2 2.91Å; A553-N676 PolarHBondContact O-OD1 3.49Å
677	L	89.6	Confident	86.4	Confident	94 Å²	94	65.3 Å²	65.3	49%	0.492	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-71.6	145.3	170.9	-59.8	-178.6	0	0	0	110.8	F601 Q653	F601-L677 HydrophobicContact CE1-CD2 4.37Å; F601-L677 HydrophobicContact CE2-CD2 4.12Å; F601-L677 HydrophobicContact CZ-CD2 3.54Å; Q653-L677 HydrophobicContact CB-CD2 4.12Å
678	L	90	Very high	86.8	Confident	22 Å²	22	69.4 Å²	69.4	12%	0.115	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	113.4	166.6	-68.4	-178.5	0	0	0	109.3	A553 L568 K651 Y652	A553-L678 HydrophobicContact CB-CD1 3.68Å; A553-L678 HydrophobicContact CB-CG 3.83Å; L568-L678 HydrophobicContact CD2-CD1 3.97Å; K651-L678 CarbonylContact C-O 3.57Å; K651-L678 WeakPolarHBondContact CA-O 3.36Å; Y652-L678 PolarHBondContact N-O 3.27Å; Y652-L678 PolarHBondContact O-N 2.74Å
679	G	88.9	Confident	87.4	Confident	42 Å²	42	68.7 Å²	68.7	43%	0.433	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	128.4	163.2	0	0	0	0	0	109.8
680	I	91.1	Very high	87.8	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	115.5	167.5	-58.5	-61.5	0	0	0	107.7	F566 L568 A649 G650 Y652 V682	F566-I680 HydrophobicContact CD1-CG2 4.19Å; F566-I680 HydrophobicContact CD2-CD1 4.21Å; F566-I680 HydrophobicContact CD2-CG1 4.15Å; F566-I680 HydrophobicContact CD2-CG2 4.16Å; F566-I680 HydrophobicContact CE1-CG2 4.04Å; F566-I680 HydrophobicContact CE2-CB 4.42Å; F566-I680 HydrophobicContact CE2-CD1 4.45Å; F566-I680 HydrophobicContact CE2-CG1 3.89Å; F566-I680 HydrophobicContact CE2-CG2 4.04Å; F566-I680 HydrophobicContact CG-CG2 4.22Å; F566-I680 HydrophobicContact CZ-CG1 4.48Å; F566-I680 HydrophobicContact CZ-CG2 3.96Å; L568-I680 HydrophobicContact CD2-CD1 3.7Å; L568-I680 HydrophobicContact CD2-CG1 3.91Å; A649-I680 WeakPolarHBondContact CA-O 3.45Å; G650-I680 PolarHBondContact N-O 3.33Å; G650-I680 PolarHBondContact O-N 3.37Å; Y652-I680 HydrophobicContact CD2-CB 4.19Å; Y652-I680 HydrophobicContact CD2-CG1 3.69Å; Y652-I680 HydrophobicContact CE2-CB 4.04Å; Y652-I680 HydrophobicContact CE2-CG1 3.91Å; I680-V682 HydrophobicContact CG2-CG2 4.3Å
681	N	88.4	Confident	88.6	Confident	90 Å²	90	66.6 Å²	66.6	48%	0.481	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.2	174.1	-58.1	-31.6	0	0	0	109	P558 S559 I560 L683	P558-N681 PolarHBondContact O-N 3.15Å; S559-N681 VanDerWaalsContact CA-O 3.3Å; S559-N681 WeakPolarHBondContact CA-O 3.39Å; S559-N681 PolarHBondContact OG-ND2 3.25Å; I560-N681 PolarHBondContact N-O 3.13Å; N681-L683 HydrophobicContact CB-CD2 4.34Å
682	V	88.4	Confident	89.3	Confident	17 Å²	17	70 Å²	70	10%	0.103	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	109.1	173.5	-166.5	0	0	0	0	107.5	I560 F562 A644 G645 A649 I680	I560-V682 HydrophobicContact CD1-CG1 4.3Å; I560-V682 HydrophobicContact CD1-CG2 4.22Å; I560-V682 HydrophobicContact CG1-CG1 4.29Å; I560-V682 HydrophobicContact CG1-CG2 4.19Å; F562-V682 HydrophobicContact CD1-CG1 3.82Å; F562-V682 HydrophobicContact CE1-CG1 4.21Å; A644-V682 HydrophobicContact CB-CG1 4.34Å; A644-V682 HydrophobicContact CB-CG2 4.27Å; A644-V682 WeakPolarHBondContact O-CG1 3.25Å; G645-V682 WeakPolarHBondContact O-CB 3.47Å; G645-V682 WeakPolarHBondContact O-CG1 3.18Å; A649-V682 HydrophobicContact CB-CB 4.14Å; A649-V682 HydrophobicContact CB-CG2 3.94Å; I680-V682 HydrophobicContact CG2-CG2 4.3Å
683	L	86	Confident	89.4	Confident	96 Å²	96	71.3 Å²	71.3	50%	0.503	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	149.7	-170.6	-57.9	177.6	0	0	0	111.1	I560 S561 F562 N681	I560-L683 PolarHBondContact O-N 2.87Å; S561-L683 CarbonylContact C-O 3.53Å; S561-L683 VanDerWaalsContact CA-O 3.23Å; S561-L683 WeakPolarHBondContact CA-O 3.04Å; F562-L683 WeakPolarHBondContact CD1-O 3.37Å; F562-L683 PolarHBondContact N-O 2.74Å; N681-L683 HydrophobicContact CB-CD2 4.34Å
684	Q	84.2	Confident	89.4	Confident	102 Å²	102	70.5 Å²	70.5	48%	0.477	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-68.8	145.4	168.2	-69.7	174.8	-7.6	0	0	109.7	F562 Y805 L807	F562-Q684 HydrophobicContact CD1-CG 4.45Å; F562-Q684 HydrophobicContact CE1-CG 4.02Å; F562-Q684 HydrophobicContact CE2-CG 4.07Å; F562-Q684 HydrophobicContact CZ-CG 3.82Å; Q684-Y805 HydrophobicContact CB-CE2 4.2Å; Q684-Y805 HydrophobicContact CG-CD2 4.27Å; Q684-Y805 HydrophobicContact CG-CE2 3.74Å; Q684-L807 HydrophobicContact CB-CD1 4.02Å
685	P	83.7	Confident	89.4	Confident	32 Å²	32	72 Å²	72	21%	0.208	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-65.7	143	179.8	28.7	-35.1	0	0	0	110.9	S687 T716 L797 Y805 L807	P685-S687 PolarHBondContact O-N 2.62Å; P685-T716 HydrophobicContact CB-CG2 4.44Å; P685-L797 HydrophobicContact CG-CD1 3.85Å; P685-Y805 VanDerWaalsContact CD-OH 3.3Å; P685-Y805 WeakPolarHBondContact CD-OH 3.38Å; P685-L807 HydrophobicContact CG-CD1 4.36Å; P685-L807 HydrophobicContact CG-CD2 4.37Å; P685-L807 WeakPolarHBondContact O-CD1 3.29Å
686	E	84.3	Confident	89.1	Confident	177 Å²	177	76.5 Å²	76.5	83%	0.827	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-64.3	131	178.5	-68	-173.9	161.9	0	0	111.9	R688 T716	E686-R688 PolarHBondContact O-N 2.8Å; E686-T716 WeakPolarHBondContact O-CG2 3.41Å
687	S	86.4	Confident	89.1	Confident	49 Å²	49	77.6 Å²	77.6	34%	0.343	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-63.3	133.7	179.4	177.3	0	0	0	0	112.5	P685 L689 T716 S808	P685-S687 PolarHBondContact O-N 2.62Å; S687-L689 WeakPolarHBondContact OG-CB 3.36Å; S687-L689 PolarHBondContact OG-N 2.99Å; S687-L689 VanDerWaalsContact OG-N 3.17Å; S687-T716 WeakPolarHBondContact CA-OG1 3.14Å; S687-S808 VanDerWaalsContact CB-CB 3.48Å; S687-S808 VanDerWaalsContact CB-OG 3.27Å; S687-S808 WeakPolarHBondContact CB-OG 3.45Å; S687-S808 WeakPolarHBondContact OG-CB 3.47Å; S687-S808 PolarHBondContact OG-OG 2.88Å
688	R	89.9	Confident	89.1	Confident	165 Å²	165	75.2 Å²	75.2	62%	0.623	39%	0.387	S	S	*	.			trans	-113.7	12.8	169.2	-53.7	179.7	-179	172.4	0.5	111.8	E686 K690 S714 T716	E686-R688 PolarHBondContact O-N 2.8Å; R688-K690 PolarHBondContact O-N 3.27Å; R688-S714 CarbonylContact O-C 3.59Å; R688-S714 WeakPolarHBondContact O-CB 3.44Å; R688-S714 PolarHBondContact O-OG 2.6Å; R688-T716 PolarHBondContact N-OG1 3.48Å
689	L	92.9	Very high	89.1	Confident	13 Å²	13	78.7 Å²	78.7	7%	0.068	41%	0.409	C	S	.	.			trans	-58	125.2	176.5	-177.5	66.2	0	0	0	110.3	S687 I712 S714 V793 E795 D810	S687-L689 WeakPolarHBondContact OG-CB 3.36Å; S687-L689 PolarHBondContact OG-N 2.99Å; S687-L689 VanDerWaalsContact OG-N 3.17Å; L689-I712 HydrophobicContact CD1-CG2 3.94Å; L689-S714 WeakPolarHBondContact CA-O 3.17Å; L689-V793 HydrophobicContact CD1-CG1 4.07Å; L689-V793 HydrophobicContact CD2-CG1 4.42Å; L689-E795 HydrophobicContact CB-CB 4.46Å; L689-E795 HydrophobicContact CD1-CB 4.28Å; L689-E795 HydrophobicContact CD2-CB 3.95Å; L689-E795 HydrophobicContact CG-CB 4.46Å; L689-D810 HydrophobicContact CD2-CB 3.89Å; L689-D810 HydrophobicContact CG-CB 4.03Å
690	K	92.6	Very high	89.1	Confident	130 Å²	130	79.2 Å²	79.2	57%	0.565	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.3	117.6	170.5	-62.9	-175.9	179.4	-178.9	0	110.2	R688 T713 S714 D810	R688-K690 PolarHBondContact O-N 3.27Å; K690-T713 WeakPolarHBondContact CB-OG1 3.3Å; K690-T713 PolarHBondContact O-N 3.35Å; K690-T713 PolarHBondContact O-OG1 2.74Å; K690-S714 PolarHBondContact N-O 2.85Å; K690-S714 PolarHBondContact O-N 2.97Å; K690-D810 WeakPolarHBondContact CA-OD2 3.5Å
691	V	94	Very high	88.8	Confident	4 Å²	4	83.9 Å²	83.9	2%	0.024	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	149.3	174.5	-172.7	0	0	0	0	109.3	K693 S711 V793 D810	V691-K693 VanDerWaalsContact O-CG 3.29Å; V691-K693 WeakPolarHBondContact O-CG 3.39Å; V691-K693 PolarHBondContact O-N 2.8Å; V691-S711 WeakPolarHBondContact CA-O 3.37Å; V691-S711 WeakPolarHBondContact CG1-O 3.43Å; V691-V793 HydrophobicContact CG1-CG2 4.26Å; V691-V793 HydrophobicContact CG2-CB 3.69Å; V691-V793 HydrophobicContact CG2-CG2 3.5Å; V691-D810 HydrophobicContact CG2-CB 4.03Å; V691-D810 PolarHBondContact N-OD2 2.78Å
692	Q	93.1	Very high	88.6	Confident	74 Å²	74	81.1 Å²	81.1	35%	0.346	40%	0.404	S	S	.	.			trans	-64.8	117.9	-178.6	-179	175.7	11.5	0	0	111.7	N694 S711 T713 S812 G813	Q692-N694 HydrophobicContact CG-CB 4.16Å; Q692-N694 PolarHBondContact NE2-ND2 2.93Å; Q692-N694 VanDerWaalsContact NE2-ND2 3.14Å; Q692-N694 PolarHBondContact O-N 2.84Å; Q692-S711 VanDerWaalsContact CB-OG 3.24Å; Q692-S711 WeakPolarHBondContact CB-OG 3.12Å; Q692-S711 PolarHBondContact N-O 3.38Å; Q692-S711 PolarHBondContact OE1-OG 2.56Å; Q692-T713 HydrophobicContact CB-CG2 3.91Å; Q692-S812 CarbonylContact O-C 3.56Å; Q692-S812 WeakPolarHBondContact O-CA 3.29Å; Q692-G813 PolarHBondContact O-N 2.99Å
693	K	91.4	Very high	88.3	Confident	109 Å²	109	84.2 Å²	84.2	47%	0.474	42%	0.42	S	S	.	.			trans	-95.7	26.5	-175.3	-54.4	-158.9	-177.2	-103.4	0	115	V691 N695 D810 T811	V691-K693 VanDerWaalsContact O-CG 3.29Å; V691-K693 WeakPolarHBondContact O-CG 3.39Å; V691-K693 PolarHBondContact O-N 2.8Å; K693-N695 PolarHBondContact O-N 3.08Å; K693-D810 WeakPolarHBondContact CE-OD1 3.23Å; K693-D810 WeakPolarHBondContact CE-OD2 3.44Å; K693-D810 IonicContact NZ-OD1 3.21Å; K693-D810 PolarHBondContact NZ-OD1 3.07Å; K693-D810 IonicContact NZ-OD2 3.36Å; K693-T811 WeakPolarHBondContact CE-O 3.13Å; K693-T811 PolarHBondContact NZ-O 3.34Å; K693-T811 PolarHBondContact NZ-OG1 3.47Å
694	N	88.1	Confident	88.3	Confident	97 Å²	97	81.3 Å²	81.3	52%	0.519	41%	0.408	S	S	.	.			trans	-77.6	113.7	177.8	-66.3	17.9	0	0	0	109.3	Q692	Q692-N694 HydrophobicContact CG-CB 4.16Å; Q692-N694 PolarHBondContact NE2-ND2 2.93Å; Q692-N694 VanDerWaalsContact NE2-ND2 3.14Å; Q692-N694 PolarHBondContact O-N 2.84Å
695	N	89.4	Confident	88.5	Confident	114 Å²	114	83.3 Å²	83.3	61%	0.61	41%	0.411	S	S	*	.			trans	-71.7	141.1	169.5	-65.6	-18.9	0	0	0	109.7	K693 G813 Y814	K693-N695 PolarHBondContact O-N 3.08Å; N695-G813 WeakPolarHBondContact OD1-CA 3.42Å; N695-Y814 VanDerWaalsContact CA-O 3.29Å; N695-Y814 WeakPolarHBondContact CA-O 3.37Å; N695-Y814 PolarHBondContact OD1-N 3.35Å
696	Q	88.3	Confident	88.9	Confident	103 Å²	103	81.8 Å²	81.8	48%	0.481	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	151.7	179.7	-67.7	-171.5	-32.2	0	0	110.5	Y814 T815 R816	Q696-Y814 PolarHBondContact N-O 3.14Å; Q696-T815 HydrophobicContact CB-CG2 4.31Å; Q696-T815 CarbonylContact O-C 3.48Å; Q696-T815 WeakPolarHBondContact O-CA 3.44Å; Q696-R816 PolarHBondContact O-N 2.85Å
697	S	90.7	Very high	89.2	Confident	98 Å²	98	77.2 Å²	77.2	69%	0.685	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.4	111	171.3	54.8	0	0	0	0	108.6	R816	S697-R816 CarbonylContact C-O 3.59Å; S697-R816 WeakPolarHBondContact CA-O 3.29Å
698	L	89.9	Confident	89.5	Confident	45 Å²	45	75.2 Å²	75.2	24%	0.236	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	125.1	-178.1	-54	178.1	0	0	0	108.6	Y700 T815 R816 V817 L818	L698-Y700 HydrophobicContact CB-CD2 4.01Å; L698-Y700 HydrophobicContact CB-CE2 3.47Å; L698-Y700 VanDerWaalsContact CB-CE2 3.47Å; L698-Y700 HydrophobicContact CD1-CE2 4.05Å; L698-Y700 HydrophobicContact CG-CE2 4.39Å; L698-T815 HydrophobicContact CD1-CG2 3.65Å; L698-T815 HydrophobicContact CG-CG2 4.01Å; L698-R816 PolarHBondContact N-O 3Å; L698-V817 WeakPolarHBondContact O-CA 3.3Å; L698-L818 PolarHBondContact O-N 2.87Å
699	V	89.8	Confident	89.6	Confident	94 Å²	94	71.5 Å²	71.5	57%	0.57	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.8	176.1	-174.8	0	0	0	0	108.2	L818 K820	V699-L818 WeakPolarHBondContact CA-O 3.25Å; V699-K820 HydrophobicContact CG1-CD 4.16Å; V699-K820 HydrophobicContact CG1-CG 4.3Å
700	Y	88.6	Confident	89.6	Confident	54 Å²	54	70.9 Å²	70.9	21%	0.212	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	155.6	-175.7	-76.4	-84.1	0	0	0	109.8	L698 S704 V706 R707 V817 L818 V819 K820	L698-Y700 HydrophobicContact CB-CD2 4.01Å; L698-Y700 HydrophobicContact CB-CE2 3.47Å; L698-Y700 VanDerWaalsContact CB-CE2 3.47Å; L698-Y700 HydrophobicContact CD1-CE2 4.05Å; L698-Y700 HydrophobicContact CG-CE2 4.39Å; Y700-S704 WeakPolarHBondContact CD1-OG 3.23Å; Y700-V706 HydrophobicContact CD1-CG2 4.03Å; Y700-V706 HydrophobicContact CD2-CB 4.5Å; Y700-V706 HydrophobicContact CD2-CG1 4.44Å; Y700-V706 HydrophobicContact CD2-CG2 3.68Å; Y700-V706 HydrophobicContact CE1-CG2 4.26Å; Y700-V706 HydrophobicContact CE2-CB 4.21Å; Y700-V706 HydrophobicContact CE2-CG1 3.93Å; Y700-V706 HydrophobicContact CE2-CG2 3.88Å; Y700-V706 HydrophobicContact CG-CG2 3.72Å; Y700-R707 PolarHBondContact OH-N 3.49Å; Y700-V817 HydrophobicContact CD2-CG1 4.1Å; Y700-L818 PolarHBondContact N-O 3.05Å; Y700-V819 CarbonylContact O-C 3.44Å; Y700-V819 WeakPolarHBondContact O-CA 3.28Å; Y700-K820 PolarHBondContact O-N 3.05Å
701	Q	84.1	Confident	89.6	Confident	99 Å²	99	65.7 Å²	65.7	46%	0.463	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	159.8	168.3	-65.7	-66.6	-4.5	0	0	110.1	S704 K820 Q821	Q701-S704 VanDerWaalsContact O-CB 3.23Å; Q701-S704 WeakPolarHBondContact O-CB 3.41Å; Q701-S704 PolarHBondContact O-N 3.15Å; Q701-S704 PolarHBondContact O-OG 3.02Å; Q701-K820 CarbonylContact C-O 3.47Å; Q701-K820 WeakPolarHBondContact CA-O 3.41Å; Q701-K820 PolarHBondContact OE1-O 2.89Å; Q701-Q821 PolarHBondContact OE1-O 2.91Å
702	E	83.8	Confident	89.6	Confident	31 Å²	31	65.8 Å²	65.8	15%	0.145	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	151.4	171.9	-168.7	157.7	-119.1	0	0	111.9	S704 A781 V819 K820 P949 Y954	E702-S704 PolarHBondContact O-N 3.25Å; E702-A781 CarbonylContact C-O 3.57Å; E702-A781 WeakPolarHBondContact CA-O 3.05Å; E702-V819 HydrophobicContact CB-CG1 4.5Å; E702-K820 PolarHBondContact N-O 2.89Å; E702-P949 HydrophobicContact CG-CG 3.57Å; E702-Y954 WeakPolarHBondContact OE2-CE1 3.5Å; E702-Y954 PolarHBondContact OE2-OH 3.47Å
703	D	82.3	Confident	89.6	Confident	83 Å²	83	66.2 Å²	66.2	44%	0.444	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	-7.1	-168	-154.5	53.8	0	0	0	117	R780 A781 P949	D703-R780 WeakPolarHBondContact O-CA 3.44Å; D703-R780 VanDerWaalsContact OD1-CB 3.23Å; D703-R780 WeakPolarHBondContact OD1-CB 3.2Å; D703-R780 WeakPolarHBondContact OD1-CD 3.37Å; D703-R780 WeakPolarHBondContact OD1-CG 3.35Å; D703-R780 IonicContact OD1-NE 3.6Å; D703-A781 PolarHBondContact N-O 2.95Å; D703-P949 HydrophobicContact CB-CG 4.14Å
704	S	85.9	Confident	89.6	Confident	35 Å²	35	62.9 Å²	62.9	25%	0.245	33%	0.329	C	S	.	.			trans	-69.5	167.1	-178.7	76.6	0	0	0	0	114.1	Y700 Q701 E702 R780 A781	Y700-S704 WeakPolarHBondContact CD1-OG 3.23Å; Q701-S704 VanDerWaalsContact O-CB 3.23Å; Q701-S704 WeakPolarHBondContact O-CB 3.41Å; Q701-S704 PolarHBondContact O-N 3.15Å; Q701-S704 PolarHBondContact O-OG 3.02Å; E702-S704 PolarHBondContact O-N 3.25Å; S704-R780 PolarHBondContact O-N 3.4Å; S704-A781 WeakPolarHBondContact O-CB 3.41Å; S704-A781 PolarHBondContact O-N 3.49Å
705	R	89.7	Confident	89.6	Confident	143 Å²	143	59.1 Å²	59.1	54%	0.54	31%	0.309	S	S	.	.			trans	-97.9	103.5	-177.9	-170	179.7	-168.2	-144.7	-1	111.2	T777 N779	R705-T777 HydrophobicContact CG-CG2 3.87Å; R705-T777 VanDerWaalsContact NE-CG2 3.32Å; R705-N779 WeakPolarHBondContact CD-OD1 3.19Å; R705-N779 WeakPolarHBondContact CG-OD1 3.42Å; R705-N779 PolarHBondContact NE-OD1 2.92Å
706	V	90.4	Very high	89.6	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	134.7	175.7	174.2	0	0	0	0	109.7	Y700 I708 T777 L778 A781 V817	Y700-V706 HydrophobicContact CD1-CG2 4.03Å; Y700-V706 HydrophobicContact CD2-CB 4.5Å; Y700-V706 HydrophobicContact CD2-CG1 4.44Å; Y700-V706 HydrophobicContact CD2-CG2 3.68Å; Y700-V706 HydrophobicContact CE1-CG2 4.26Å; Y700-V706 HydrophobicContact CE2-CB 4.21Å; Y700-V706 HydrophobicContact CE2-CG1 3.93Å; Y700-V706 HydrophobicContact CE2-CG2 3.88Å; Y700-V706 HydrophobicContact CG-CG2 3.72Å; V706-I708 HydrophobicContact CG1-CD1 4.11Å; V706-I708 HydrophobicContact CG1-CG1 4.17Å; V706-T777 CarbonylContact O-C 3.58Å; V706-T777 WeakPolarHBondContact O-CA 3.38Å; V706-L778 HydrophobicContact CB-CB 4.12Å; V706-L778 HydrophobicContact CB-CD2 4.33Å; V706-L778 HydrophobicContact CG2-CD2 4.42Å; V706-L778 PolarHBondContact N-O 3.16Å; V706-L778 PolarHBondContact O-N 2.97Å; V706-A781 HydrophobicContact CG2-CB 3.7Å; V706-V817 HydrophobicContact CG1-CG1 4.06Å; V706-V817 HydrophobicContact CG1-CG2 3.97Å; V706-V817 HydrophobicContact CG2-CG1 4.06Å
707	R	91.4	Very high	89.5	Confident	81 Å²	81	52 Å²	52	31%	0.306	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	124.7	176.7	-171.8	178.9	-176	87	-12.7	110.9	Y700 E767 L776 T777	Y700-R707 PolarHBondContact OH-N 3.49Å; R707-E767 IonicContact CZ-OE1 2.73Å; R707-E767 IonicContact NH1-OE1 3.72Å; R707-E767 PolarHBondContact NH1-OE1 2.94Å; R707-E767 IonicContact NH2-OE1 2.89Å; R707-E767 PolarHBondContact NH2-OE1 3.03Å; R707-L776 WeakPolarHBondContact CA-O 3.47Å; R707-T777 PolarHBondContact NH1-OG1 3.44Å
708	I	91.9	Very high	89.2	Confident	7 Å²	7	54.5 Å²	54.5	4%	0.036	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	131.5	-176.7	-55.4	148	0	0	0	107.9	V706 W726 A775 L776 Y789 T815 V817	V706-I708 HydrophobicContact CG1-CD1 4.11Å; V706-I708 HydrophobicContact CG1-CG1 4.17Å; I708-W726 HydrophobicContact CB-CZ3 4.21Å; I708-W726 HydrophobicContact CG2-CH2 4.33Å; I708-W726 HydrophobicContact CG2-CZ3 3.8Å; I708-W726 VanDerWaalsContact O-CH2 3.32Å; I708-W726 WeakPolarHBondContact O-CH2 3.43Å; I708-A775 WeakPolarHBondContact O-CA 3.29Å; I708-L776 HydrophobicContact CB-CB 4.4Å; I708-L776 HydrophobicContact CD1-CD2 3.98Å; I708-L776 PolarHBondContact N-O 3.29Å; I708-L776 PolarHBondContact O-N 3.02Å; I708-Y789 HydrophobicContact CD1-CD1 3.69Å; I708-Y789 HydrophobicContact CD1-CD2 4.01Å; I708-Y789 HydrophobicContact CD1-CE1 4.28Å; I708-Y789 HydrophobicContact CD1-CG 3.53Å; I708-T815 HydrophobicContact CG1-CG2 4.14Å; I708-T815 HydrophobicContact CG2-CG2 4.13Å; I708-V817 HydrophobicContact CD1-CG2 4.08Å; I708-V817 HydrophobicContact CG1-CG2 4.36Å
709	N	92.3	Very high	88.9	Confident	87 Å²	87	57.7 Å²	57.7	47%	0.465	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	131.8	-176.5	-68.2	-31.8	0	0	0	111.3	L773	N709-L773 HydrophobicContact CB-CD1 4.25Å
710	C	93.4	Very high	88.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	109.9	173.6	174.9	0	0	0	0	107.9	W726 Y774 C791	C710-W726 HydrophobicContact CB-CH2 3.36Å; C710-W726 HydrophobicContact CB-CZ2 3.47Å; C710-W726 VanDerWaalsContact CB-CZ2 3.47Å; C710-W726 HydrophobicContact CB-CZ3 4.14Å; C710-Y774 PolarHBondContact N-O 3.22Å; C710-Y774 PolarHBondContact O-N 3.45Å; C710-C791 HydrophobicContact CB-CB 3.64Å; C710-C791 WeakPolarHBondContact CB-SG 3.43Å; C710-C791 WeakPolarHBondContact SG-CB 3.37Å; C710-C791 CovalentContact SG-SG 2.03Å; C710-C791 PolarHBondContact SG-SG 3.35Å
711	S	93.7	Very high	89	Confident	22 Å²	22	54.5 Å²	54.5	15%	0.154	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	135.8	-178	89.7	0	0	0	0	112.6	V691 Q692 R772	V691-S711 WeakPolarHBondContact CA-O 3.37Å; V691-S711 WeakPolarHBondContact CG1-O 3.43Å; Q692-S711 VanDerWaalsContact CB-OG 3.24Å; Q692-S711 WeakPolarHBondContact CB-OG 3.12Å; Q692-S711 PolarHBondContact N-O 3.38Å; Q692-S711 PolarHBondContact OE1-OG 2.56Å; S711-R772 CarbonylContact C-O 3.56Å; S711-R772 WeakPolarHBondContact CA-O 3Å
712	I	93.9	Very high	89.4	Confident	6 Å²	6	50 Å²	50	3%	0.031	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	101.1	179.8	-57.8	174.4	0	0	0	107.4	L689 S714 Q715 H722 R772 Y774 V793	L689-I712 HydrophobicContact CD1-CG2 3.94Å; I712-S714 VanDerWaalsContact C-N 3.34Å; I712-S714 WeakPolarHBondContact CG2-O 3.43Å; I712-Q715 HydrophobicContact CG2-CB 4.31Å; I712-H722 HydrophobicContact CD1-CB 3.97Å; I712-H722 VanDerWaalsContact CD1-CG 3.47Å; I712-H722 WeakPolarHBondContact CD1-ND1 3.16Å; I712-R772 HydrophobicContact CB-CB 4.02Å; I712-R772 HydrophobicContact CB-CG 4.24Å; I712-R772 PolarHBondContact N-O 3.36Å; I712-Y774 HydrophobicContact CD1-CE2 4.04Å; I712-V793 HydrophobicContact CD1-CG1 3.71Å; I712-V793 HydrophobicContact CD1-CG2 4.4Å; I712-V793 HydrophobicContact CG1-CG1 4.23Å; I712-V793 HydrophobicContact CG1-CG2 4.24Å
713	T	91.8	Very high	89.8	Confident	83 Å²	83	48.6 Å²	48.6	51%	0.509	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	-29.6	-177.6	66.1	0	0	0	0	112.5	K690 Q692	K690-T713 WeakPolarHBondContact CB-OG1 3.3Å; K690-T713 PolarHBondContact O-N 3.35Å; K690-T713 PolarHBondContact O-OG1 2.74Å; Q692-T713 HydrophobicContact CB-CG2 3.91Å
714	S	91.1	Very high	90.4	Very high	38 Å²	38	44.6 Å²	44.6	27%	0.266	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	146.3	178.3	179.8	0	0	0	0	110.1	R688 L689 K690 I712	R688-S714 CarbonylContact O-C 3.59Å; R688-S714 WeakPolarHBondContact O-CB 3.44Å; R688-S714 PolarHBondContact O-OG 2.6Å; L689-S714 WeakPolarHBondContact CA-O 3.17Å; K690-S714 PolarHBondContact N-O 2.85Å; K690-S714 PolarHBondContact O-N 2.97Å; I712-S714 VanDerWaalsContact C-N 3.34Å; I712-S714 WeakPolarHBondContact CG2-O 3.43Å
715	Q	89.9	Confident	90.8	Very high	18 Å²	18	43.7 Å²	43.7	8%	0.084	22%	0.222	C	C	.	.			trans	-140.2	161.9	177.1	67.3	-176	57.1	0	0	108.7	I712 S717 H722 R772	I712-Q715 HydrophobicContact CG2-CB 4.31Å; Q715-S717 WeakPolarHBondContact CG-O 3.49Å; Q715-S717 PolarHBondContact NE2-O 2.98Å; Q715-H722 PolarHBondContact OE1-CE1 3.46Å; Q715-R772 VanDerWaalsContact CD-NE 3.27Å; Q715-R772 VanDerWaalsContact CD-NH2 3.3Å; Q715-R772 VanDerWaalsContact OE1-CG 3.23Å
716	T	88.3	Confident	91	Very high	23 Å²	23	37 Å²	37	14%	0.141	20%	0.196	C	C	.	.	S	Bend	trans	-80.8	-47.2	-169.2	-55.5	0	0	0	0	114	P685 E686 S687 R688 E795 L807	P685-T716 HydrophobicContact CB-CG2 4.44Å; E686-T716 WeakPolarHBondContact O-CG2 3.41Å; S687-T716 WeakPolarHBondContact CA-OG1 3.14Å; R688-T716 PolarHBondContact N-OG1 3.48Å; T716-E795 WeakPolarHBondContact CB-OE1 3.5Å; T716-E795 WeakPolarHBondContact CB-OE2 3.3Å; T716-E795 PolarHBondContact N-OE1 2.81Å; T716-E795 PolarHBondContact OG1-OE1 2.82Å; T716-E795 PolarHBondContact OG1-OE2 3.24Å; T716-L807 HydrophobicContact CG2-CD2 3.77Å
717	S	86.2	Confident	91	Very high	44 Å²	44	39.1 Å²	39.1	31%	0.308	20%	0.204	S	C	.	.			trans	-122.2	171.1	172	-169.7	0	0	0	0	110.6	Q715 D719 S720	Q715-S717 WeakPolarHBondContact CG-O 3.49Å; Q715-S717 PolarHBondContact NE2-O 2.98Å; S717-D719 VanDerWaalsContact C-N 3.28Å; S717-D719 PolarHBondContact OG-N 3.38Å; S717-D719 PolarHBondContact OG-OD2 2.8Å; S717-S720 PolarHBondContact N-OG 3.33Å; S717-S720 WeakPolarHBondContact O-CB 3.32Å; S717-S720 PolarHBondContact O-OG 2.86Å
718	Q	83.7	Confident	91	Very high	152 Å²	152	35.2 Å²	35.2	71%	0.71	19%	0.19	S	C	*	.	S	Bend	trans	-72.6	-26.5	163.2	-62.1	-67	13.2	0	0	111.7	S720	Q718-S720 PolarHBondContact O-N 2.86Å
719	D	85.1	Confident	90.8	Very high	111 Å²	111	39 Å²	39	59%	0.594	20%	0.204	S	C	*	.	S	Bend	trans	-79	-0.8	175.3	-42.3	-74.8	0	0	0	113.5	S717 Q721	S717-D719 VanDerWaalsContact C-N 3.28Å; S717-D719 PolarHBondContact OG-N 3.38Å; S717-D719 PolarHBondContact OG-OD2 2.8Å; D719-Q721 PolarHBondContact O-N 3.39Å
720	S	89	Confident	90.3	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.063	20%	0.196	C	C	.	.			trans	-57	122.4	173.4	-70.7	0	0	0	0	110.8	S717 Q718 E795	S717-S720 PolarHBondContact N-OG 3.33Å; S717-S720 WeakPolarHBondContact O-CB 3.32Å; S717-S720 PolarHBondContact O-OG 2.86Å; Q718-S720 PolarHBondContact O-N 2.86Å; S720-E795 WeakPolarHBondContact CB-OE1 3.39Å; S720-E795 PolarHBondContact OG-OE1 2.99Å
721	Q	90.4	Very high	89.2	Confident	73 Å²	73	42.6 Å²	42.6	34%	0.341	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	139.1	172.8	-61.8	-174.4	-1.8	0	0	109.2	D719 R745 W796 W804	D719-Q721 PolarHBondContact O-N 3.39Å; Q721-R745 HydrophobicContact CB-CG 3.5Å; Q721-R745 VanDerWaalsContact CB-CG 3.5Å; Q721-W796 PolarHBondContact N-O 2.86Å; Q721-W796 WeakPolarHBondContact O-CB 3.47Å; Q721-W796 PolarHBondContact O-N 2.8Å; Q721-W804 HydrophobicContact CB-CH2 4.43Å; Q721-W804 HydrophobicContact CB-CZ3 4.02Å; Q721-W804 HydrophobicContact CG-CH2 3.75Å; Q721-W804 HydrophobicContact CG-CZ3 3.84Å
722	H	92.3	Very high	87.8	Confident	5 Å²	5	46.2 Å²	46.2	2%	0.023	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	131.4	-170.6	-45	110.1	0	0	0	111.4	I712 Q715 V724 P771 Y774 V793 E794	I712-H722 HydrophobicContact CD1-CB 3.97Å; I712-H722 VanDerWaalsContact CD1-CG 3.47Å; I712-H722 WeakPolarHBondContact CD1-ND1 3.16Å; Q715-H722 PolarHBondContact OE1-CE1 3.46Å; H722-V724 HydrophobicContact CB-CG2 4.46Å; H722-P771 PolarHBondContact CE1-O 2.92Å; H722-P771 PolarHBondContact ND1-O 3.46Å; H722-Y774 HydrophobicContact CB-CE2 4.44Å; H722-Y774 PolarHBondContact O-OH 2.64Å; H722-V793 HydrophobicContact CB-CG1 3.96Å; H722-E794 VanDerWaalsContact CA-O 3.3Å; H722-E794 WeakPolarHBondContact CA-O 3.23Å
723	A	93.3	Very high	86.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	139.7	159.9	0	0	0	0	0	108.3	I743 E794	A723-I743 CarbonylContact C-O 3.47Å; A723-I743 WeakPolarHBondContact CA-O 3.46Å; A723-I743 WeakPolarHBondContact CB-O 3.27Å; A723-E794 HydrophobicContact CB-CB 4.35Å; A723-E794 PolarHBondContact N-O 2.85Å; A723-E794 PolarHBondContact O-N 2.86Å
724	V	94.2	Very high	84.6	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	114.4	-173.7	-176.9	0	0	0	0	110	H722 R742 I743 Y774 C791 V793	H722-V724 HydrophobicContact CB-CG2 4.46Å; V724-R742 WeakPolarHBondContact O-CA 3.21Å; V724-I743 HydrophobicContact CB-CB 4.42Å; V724-I743 HydrophobicContact CB-CD1 4.36Å; V724-I743 PolarHBondContact N-O 2.98Å; V724-I743 PolarHBondContact O-N 3.02Å; V724-Y774 HydrophobicContact CB-CD1 4.19Å; V724-Y774 HydrophobicContact CB-CE1 4.34Å; V724-Y774 HydrophobicContact CB-CG 4.34Å; V724-Y774 HydrophobicContact CG1-CG 4.44Å; V724-Y774 HydrophobicContact CG2-CD1 3.8Å; V724-Y774 HydrophobicContact CG2-CD2 3.75Å; V724-Y774 HydrophobicContact CG2-CE1 3.67Å; V724-Y774 HydrophobicContact CG2-CE2 3.7Å; V724-Y774 HydrophobicContact CG2-CG 3.8Å; V724-C791 HydrophobicContact CG1-CB 3.99Å; V724-V793 HydrophobicContact CG1-CG2 4.38Å; V724-V793 HydrophobicContact CG2-CG1 4.38Å; V724-V793 HydrophobicContact CG2-CG2 4.17Å
725	L	94.4	Very high	83.3	Confident	16 Å²	16	54 Å²	54	8%	0.084	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	133.3	179.1	-66.2	78.7	0	0	0	108.7	Y727 L739 L741 R742 C791 L792 E794	L725-Y727 HydrophobicContact CB-CD2 4.32Å; L725-Y727 HydrophobicContact CB-CE2 3.67Å; L725-Y727 HydrophobicContact CD2-CE2 4.28Å; L725-L739 HydrophobicContact CB-CD1 3.81Å; L725-L739 HydrophobicContact CD2-CD1 4.09Å; L725-L739 HydrophobicContact CG-CD1 4.23Å; L725-L741 CarbonylContact C-O 3.56Å; L725-L741 WeakPolarHBondContact CA-O 3.36Å; L725-R742 HydrophobicContact CD1-CG 4.13Å; L725-R742 HydrophobicContact CG-CB 4.04Å; L725-R742 HydrophobicContact CG-CG 3.87Å; L725-C791 CarbonylContact O-C 3.59Å; L725-C791 VanDerWaalsContact O-CA 3.25Å; L725-C791 WeakPolarHBondContact O-CA 3.28Å; L725-L792 HydrophobicContact CB-CB 4.32Å; L725-L792 PolarHBondContact N-O 3.44Å; L725-L792 PolarHBondContact O-N 3.38Å; L725-E794 HydrophobicContact CD1-CG 4.06Å
726	W	93.4	Very high	82.7	Confident	1 Å²	1	57.1 Å²	57.1	0%	0.004	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127.7	179.3	-70.4	92.3	0	0	0	110.5	I708 C710 L740 L741 L776 C791	I708-W726 HydrophobicContact CB-CZ3 4.21Å; I708-W726 HydrophobicContact CG2-CH2 4.33Å; I708-W726 HydrophobicContact CG2-CZ3 3.8Å; I708-W726 VanDerWaalsContact O-CH2 3.32Å; I708-W726 WeakPolarHBondContact O-CH2 3.43Å; C710-W726 HydrophobicContact CB-CH2 3.36Å; C710-W726 HydrophobicContact CB-CZ2 3.47Å; C710-W726 VanDerWaalsContact CB-CZ2 3.47Å; C710-W726 HydrophobicContact CB-CZ3 4.14Å; W726-L740 HydrophobicContact CB-CB 4.34Å; W726-L740 HydrophobicContact CB-CD1 4.35Å; W726-L740 WeakPolarHBondContact O-CB 3.38Å; W726-L740 PolarHBondContact O-N 2.89Å; W726-L741 HydrophobicContact CB-CG 4.36Å; W726-L741 PolarHBondContact N-O 3.31Å; W726-L776 HydrophobicContact CB-CD1 4.33Å; W726-L776 HydrophobicContact CB-CD2 4.32Å; W726-L776 HydrophobicContact CD2-CB 3.72Å; W726-L776 HydrophobicContact CD2-CD1 4.27Å; W726-L776 HydrophobicContact CD2-CD2 4.04Å; W726-L776 HydrophobicContact CD2-CG 4.24Å; W726-L776 HydrophobicContact CE3-CB 3.71Å; W726-L776 HydrophobicContact CE3-CD2 3.72Å; W726-L776 HydrophobicContact CE3-CG 4.26Å; W726-L776 HydrophobicContact CG-CB 4.41Å; W726-L776 HydrophobicContact CG-CD1 4.1Å; W726-L776 HydrophobicContact CG-CD2 4.34Å; W726-L776 HydrophobicContact CH2-CB 3.67Å; W726-L776 HydrophobicContact CZ2-CB 3.74Å; W726-L776 HydrophobicContact CZ3-CB 3.69Å; W726-L776 HydrophobicContact CZ3-CD2 4.25Å; W726-C791 HydrophobicContact CD2-CB 4.08Å; W726-C791 HydrophobicContact CE3-CB 3.91Å; W726-C791 HydrophobicContact CH2-CB 4.42Å; W726-C791 HydrophobicContact CZ3-CB 4.09Å
727	Y	92.1	Very high	82.5	Confident	45 Å²	45	58.5 Å²	58.5	18%	0.176	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	147.9	-176.4	-74.2	-89.2	0	0	0	111.2	L725 D737 E738 L739 Y789 Y790 L792	L725-Y727 HydrophobicContact CB-CD2 4.32Å; L725-Y727 HydrophobicContact CB-CE2 3.67Å; L725-Y727 HydrophobicContact CD2-CE2 4.28Å; Y727-D737 HydrophobicContact CD1-CB 3.98Å; Y727-E738 VanDerWaalsContact CA-O 3.3Å; Y727-E738 WeakPolarHBondContact CA-O 3.43Å; Y727-L739 HydrophobicContact CD1-CB 4.37Å; Y727-L739 HydrophobicContact CD2-CD1 4.5Å; Y727-L739 HydrophobicContact CE1-CB 3.95Å; Y727-L739 HydrophobicContact CE1-CD1 4.21Å; Y727-L739 HydrophobicContact CE2-CD1 4.05Å; Y727-Y789 WeakPolarHBondContact O-CA 3.45Å; Y727-Y790 VanDerWaalsContact CB-CE1 3.43Å; Y727-Y790 VanDerWaalsContact CB-CZ 3.41Å; Y727-Y790 AromaticContact CD2-CE2 3.93Å; Y727-Y790 HydrophobicContact CD2-CE2 3.93Å; Y727-Y790 HydrophobicContact CG-CE1 4.27Å; Y727-Y790 HydrophobicContact CG-CE2 4.12Å; Y727-Y790 AromaticContact CG-CZ 3.75Å; Y727-Y790 PolarHBondContact N-O 3.49Å; Y727-Y790 PolarHBondContact O-N 3.35Å; Y727-L792 HydrophobicContact CD2-CB 4.21Å; Y727-L792 HydrophobicContact CE2-CB 3.94Å; Y727-L792 HydrophobicContact CE2-CD2 4.12Å
728	I	89.9	Confident	82.6	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	143	170.3	-169.6	178.1	0	0	0	109.8	E738 L740 Y754 T788 Y789	I728-E738 HydrophobicContact CG2-CB 4.02Å; I728-E738 PolarHBondContact N-O 3.01Å; I728-E738 PolarHBondContact O-N 2.69Å; I728-L740 HydrophobicContact CB-CD1 4.14Å; I728-L740 HydrophobicContact CB-CD2 4.3Å; I728-L740 HydrophobicContact CB-CG 4.21Å; I728-L740 HydrophobicContact CG2-CD2 3.9Å; I728-L740 HydrophobicContact CG2-CG 4.05Å; I728-Y754 HydrophobicContact CD1-CE1 4.47Å; I728-Y754 HydrophobicContact CG2-CD1 3.87Å; I728-Y754 HydrophobicContact CG2-CE1 3.56Å; I728-T788 CarbonylContact C-O 3.57Å; I728-Y789 HydrophobicContact CB-CD1 4.28Å; I728-Y789 HydrophobicContact CB-CE1 4.22Å; I728-Y789 HydrophobicContact CD1-CE1 3.84Å; I728-Y789 HydrophobicContact CD1-CE2 3.93Å; I728-Y789 VanDerWaalsContact CD1-CZ 3.47Å; I728-Y789 WeakPolarHBondContact CD1-OH 3.48Å; I728-Y789 HydrophobicContact CG1-CD1 4.29Å; I728-Y789 HydrophobicContact CG1-CD2 4.38Å; I728-Y789 HydrophobicContact CG1-CE1 4.03Å; I728-Y789 HydrophobicContact CG1-CE2 4.11Å; I728-Y789 HydrophobicContact CG1-CG 4.47Å
729	R	88.6	Confident	82.9	Confident	85 Å²	85	53.1 Å²	53.1	32%	0.321	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	113.6	161.6	-163.6	178.2	-57.8	178.2	0.9	108.7	D737 G787 T788	R729-D737 IonicContact CZ-OD1 3.69Å; R729-D737 VanDerWaalsContact CZ-OD1 3.23Å; R729-D737 IonicContact CZ-OD2 3.44Å; R729-D737 IonicContact NE-OD1 2.7Å; R729-D737 PolarHBondContact NE-OD1 2.9Å; R729-D737 IonicContact NE-OD2 3.48Å; R729-D737 IonicContact NH2-OD1 3.65Å; R729-D737 PolarHBondContact NH2-OD1 2.7Å; R729-D737 IonicContact NH2-OD2 3.7Å; R729-D737 PolarHBondContact NH2-OD2 2.68Å; R729-G787 CarbonylContact O-C 3.6Å; R729-G787 VanDerWaalsContact O-CA 3.25Å; R729-G787 WeakPolarHBondContact O-CA 3.44Å; R729-T788 PolarHBondContact N-O 3.31Å; R729-T788 PolarHBondContact O-N 3.26Å
730	R	82.4	Confident	83.2	Confident	84 Å²	84	47.8 Å²	47.8	32%	0.317	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	142.3	-176	-69.3	-175.7	-87.8	155.7	-5.4	111.4	A732 E738	R730-A732 PolarHBondContact O-N 2.8Å; R730-E738 IonicContact CZ-OE1 2.69Å; R730-E738 IonicContact CZ-OE2 3.3Å; R730-E738 IonicContact NE-OE1 3.16Å; R730-E738 IonicContact NE-OE2 3.53Å; R730-E738 PolarHBondContact NE-OE2 2.94Å; R730-E738 IonicContact NH2-OE1 3.47Å; R730-E738 PolarHBondContact NH2-OE1 2.79Å; R730-E738 IonicContact NH2-OE2 2.83Å; R730-E738 PolarHBondContact NH2-OE2 2.83Å
731	A	70.1	Confident	83.3	Confident	80 Å²	80	47.5 Å²	47.5	66%	0.661	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-27.7	174.8	0	0	0	0	0	112.8	G733 S786	A731-G733 VanDerWaalsContact C-N 3.33Å; A731-G733 PolarHBondContact O-N 2.94Å; A731-G733 VanDerWaalsContact O-N 3.15Å; A731-S786 WeakPolarHBondContact CB-O 3.46Å; A731-S786 PolarHBondContact N-O 3.07Å
732	A	63.2	Low	83.3	Confident	97 Å²	97	46.7 Å²	46.7	80%	0.802	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	54.1	-176	0	0	0	0	0	113.9	R730	R730-A732 PolarHBondContact O-N 2.8Å
733	G	58.7	Low	83.3	Confident	79 Å²	79	46.5 Å²	46.5	81%	0.814	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	20.9	157.6	0	0	0	0	0	118.8	A731	A731-G733 VanDerWaalsContact C-N 3.33Å; A731-G733 PolarHBondContact O-N 2.94Å; A731-G733 VanDerWaalsContact O-N 3.15Å
734	S	60.5	Low	83.2	Confident	29 Å²	29	48.6 Å²	48.6	20%	0.203	28%	0.28	C	S	.	.			trans	-101.8	130.3	166.1	-170.3	0	0	0	0	111.5	T736	S734-T736 PolarHBondContact OG-N 3.26Å; S734-T736 PolarHBondContact OG-OG1 2.67Å
735	E	63.7	Low	82.8	Confident	182 Å²	182	51.3 Å²	51.3	85%	0.85	29%	0.29	S	S	*	.			trans	-82.9	-12.6	173.4	-66	-159.7	138.6	0	0	113.4
736	T	76.9	Confident	82.3	Confident	84 Å²	84	55.4 Å²	55.4	52%	0.515	32%	0.316	S	S	.	.	S	Bend	trans	-83.3	127.8	-176.8	56.8	0	0	0	0	112.1	S734 E738	S734-T736 PolarHBondContact OG-N 3.26Å; S734-T736 PolarHBondContact OG-OG1 2.67Å; T736-E738 PolarHBondContact O-N 2.91Å
737	D	85.4	Confident	81.6	Confident	52 Å²	52	56.5 Å²	56.5	28%	0.278	33%	0.327	S	S	.	.			trans	-75.1	114.1	172.1	-65.5	-48.8	0	0	0	110.7	Y727 R729 Y790	Y727-D737 HydrophobicContact CD1-CB 3.98Å; R729-D737 IonicContact CZ-OD1 3.69Å; R729-D737 VanDerWaalsContact CZ-OD1 3.23Å; R729-D737 IonicContact CZ-OD2 3.44Å; R729-D737 IonicContact NE-OD1 2.7Å; R729-D737 PolarHBondContact NE-OD1 2.9Å; R729-D737 IonicContact NE-OD2 3.48Å; R729-D737 IonicContact NH2-OD1 3.65Å; R729-D737 PolarHBondContact NH2-OD1 2.7Å; R729-D737 IonicContact NH2-OD2 3.7Å; R729-D737 PolarHBondContact NH2-OD2 2.68Å; D737-Y790 HydrophobicContact CB-CE1 4.1Å; D737-Y790 VanDerWaalsContact CB-OH 3.29Å; D737-Y790 WeakPolarHBondContact CB-OH 3.48Å; D737-Y790 VanDerWaalsContact CG-OH 3.3Å; D737-Y790 PolarHBondContact OD2-OH 3.18Å
738	E	88.2	Confident	81.3	Confident	32 Å²	32	56.7 Å²	56.7	15%	0.15	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.5	-173.2	-75.6	155.1	170.6	0	0	111.1	Y727 I728 R730 T736 L740 Y754	Y727-E738 VanDerWaalsContact CA-O 3.3Å; Y727-E738 WeakPolarHBondContact CA-O 3.43Å; I728-E738 HydrophobicContact CG2-CB 4.02Å; I728-E738 PolarHBondContact N-O 3.01Å; I728-E738 PolarHBondContact O-N 2.69Å; R730-E738 IonicContact CZ-OE1 2.69Å; R730-E738 IonicContact CZ-OE2 3.3Å; R730-E738 IonicContact NE-OE1 3.16Å; R730-E738 IonicContact NE-OE2 3.53Å; R730-E738 PolarHBondContact NE-OE2 2.94Å; R730-E738 IonicContact NH2-OE1 3.47Å; R730-E738 PolarHBondContact NH2-OE1 2.79Å; R730-E738 IonicContact NH2-OE2 2.83Å; R730-E738 PolarHBondContact NH2-OE2 2.83Å; T736-E738 PolarHBondContact O-N 2.91Å; E738-L740 PolarHBondContact O-N 2.93Å; E738-Y754 HydrophobicContact CB-CD1 4.21Å; E738-Y754 HydrophobicContact CB-CD2 4.47Å; E738-Y754 HydrophobicContact CB-CG 3.97Å
739	L	90.2	Very high	81	Confident	51 Å²	51	61.7 Å²	61.7	27%	0.267	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	114.6	-179.8	-179.7	68.8	0	0	0	110.2	L725 Y727 L741 G752	L725-L739 HydrophobicContact CB-CD1 3.81Å; L725-L739 HydrophobicContact CD2-CD1 4.09Å; L725-L739 HydrophobicContact CG-CD1 4.23Å; Y727-L739 HydrophobicContact CD1-CB 4.37Å; Y727-L739 HydrophobicContact CD2-CD1 4.5Å; Y727-L739 HydrophobicContact CE1-CB 3.95Å; Y727-L739 HydrophobicContact CE1-CD1 4.21Å; Y727-L739 HydrophobicContact CE2-CD1 4.05Å; L739-L741 WeakPolarHBondContact CD1-O 3.27Å; L739-G752 WeakPolarHBondContact O-CA 3.34Å
740	L	89.4	Confident	80.9	Confident	0 Å²	0	62 Å²	62	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	-56.2	171.3	-65.1	165.2	0	0	0	110.4	W726 I728 E738 G752 Y754 A755 L760 L776 Y789	W726-L740 HydrophobicContact CB-CB 4.34Å; W726-L740 HydrophobicContact CB-CD1 4.35Å; W726-L740 WeakPolarHBondContact O-CB 3.38Å; W726-L740 PolarHBondContact O-N 2.89Å; I728-L740 HydrophobicContact CB-CD1 4.14Å; I728-L740 HydrophobicContact CB-CD2 4.3Å; I728-L740 HydrophobicContact CB-CG 4.21Å; I728-L740 HydrophobicContact CG2-CD2 3.9Å; I728-L740 HydrophobicContact CG2-CG 4.05Å; E738-L740 PolarHBondContact O-N 2.93Å; L740-G752 PolarHBondContact O-N 2.74Å; L740-Y754 HydrophobicContact CD2-CD1 3.9Å; L740-Y754 HydrophobicContact CD2-CE1 3.92Å; L740-A755 VanDerWaalsContact O-CB 3.28Å; L740-A755 WeakPolarHBondContact O-CB 3.27Å; L740-L760 HydrophobicContact CD2-CD1 3.94Å; L740-L776 HydrophobicContact CD1-CD2 3.8Å; L740-Y789 HydrophobicContact CD1-CD1 3.67Å; L740-Y789 HydrophobicContact CD1-CE1 3.63Å
741	L	91.1	Very high	81.2	Confident	3 Å²	3	61.6 Å²	61.6	2%	0.016	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	162.1	-178.9	68.1	96.5	0	0	0	112.1	L725 W726 L739 I743 E750 Y751 V764 A766 L776	L725-L741 CarbonylContact C-O 3.56Å; L725-L741 WeakPolarHBondContact CA-O 3.36Å; W726-L741 HydrophobicContact CB-CG 4.36Å; W726-L741 PolarHBondContact N-O 3.31Å; L739-L741 WeakPolarHBondContact CD1-O 3.27Å; L741-I743 HydrophobicContact CD1-CD1 4.5Å; L741-I743 HydrophobicContact CD1-CG1 3.78Å; L741-E750 CarbonylContact C-O 3.6Å; L741-E750 WeakPolarHBondContact CA-O 3.49Å; L741-E750 WeakPolarHBondContact CB-O 3.2Å; L741-Y751 HydrophobicContact CB-CD1 3.92Å; L741-Y751 HydrophobicContact CB-CE1 4.4Å; L741-Y751 HydrophobicContact CB-CG 4.49Å; L741-Y751 HydrophobicContact CD2-CD1 4.41Å; L741-Y751 HydrophobicContact CD2-CE1 4.13Å; L741-V764 HydrophobicContact CD2-CG1 3.6Å; L741-A766 HydrophobicContact CD1-CB 3.53Å; L741-A766 HydrophobicContact CD2-CB 3.79Å; L741-A766 HydrophobicContact CG-CB 4.3Å; L741-L776 HydrophobicContact CD2-CD1 3.7Å; L741-L776 HydrophobicContact CG-CD1 4.5Å
742	R	92.1	Very high	81.8	Confident	55 Å²	55	58.3 Å²	58.3	21%	0.208	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131	173.5	174.4	170.8	-179.4	-133.6	3.8	109.3	V724 L725 E744 E750	V724-R742 WeakPolarHBondContact O-CA 3.21Å; L725-R742 HydrophobicContact CD1-CG 4.13Å; L725-R742 HydrophobicContact CG-CB 4.04Å; L725-R742 HydrophobicContact CG-CG 3.87Å; R742-E744 IonicContact CZ-OE1 3.07Å; R742-E744 IonicContact CZ-OE2 2.77Å; R742-E744 IonicContact NE-OE1 3.96Å; R742-E744 IonicContact NE-OE2 3.23Å; R742-E744 IonicContact NH1-OE1 3.97Å; R742-E744 PolarHBondContact NH1-OE1 2.81Å; R742-E744 IonicContact NH2-OE1 3.19Å; R742-E744 PolarHBondContact NH2-OE1 2.89Å; R742-E744 IonicContact NH2-OE2 2.78Å; R742-E744 PolarHBondContact NH2-OE2 2.99Å; R742-E750 HydrophobicContact CB-CB 4.36Å; R742-E750 WeakPolarHBondContact CD-OE2 3.41Å; R742-E750 IonicContact CZ-OE2 3.56Å; R742-E750 PolarHBondContact N-O 2.85Å; R742-E750 IonicContact NE-OE2 3.75Å; R742-E750 IonicContact NH1-OE2 2.62Å; R742-E750 PolarHBondContact NH1-OE2 2.82Å; R742-E750 PolarHBondContact O-N 3.17Å
743	I	92.2	Very high	82.6	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.9	165.8	-46.5	176.2	0	0	0	105.4	A723 V724 L741 A748 F749 A766 Y774	A723-I743 CarbonylContact C-O 3.47Å; A723-I743 WeakPolarHBondContact CA-O 3.46Å; A723-I743 WeakPolarHBondContact CB-O 3.27Å; V724-I743 HydrophobicContact CB-CB 4.42Å; V724-I743 HydrophobicContact CB-CD1 4.36Å; V724-I743 PolarHBondContact N-O 2.98Å; V724-I743 PolarHBondContact O-N 3.02Å; L741-I743 HydrophobicContact CD1-CD1 4.5Å; L741-I743 HydrophobicContact CD1-CG1 3.78Å; I743-A748 CarbonylContact C-O 3.6Å; I743-F749 HydrophobicContact CB-CD1 4.42Å; I743-F749 HydrophobicContact CB-CE1 4.31Å; I743-F749 HydrophobicContact CD1-CE1 3.94Å; I743-F749 HydrophobicContact CG1-CD1 3.85Å; I743-F749 HydrophobicContact CG1-CE1 3.69Å; I743-F749 HydrophobicContact CG2-CD1 4.25Å; I743-F749 HydrophobicContact CG2-CE1 3.87Å; I743-F749 HydrophobicContact CG2-CZ 4.24Å; I743-A766 HydrophobicContact CD1-CB 3.96Å; I743-A766 HydrophobicContact CG1-CB 4.35Å; I743-Y774 HydrophobicContact CD1-CD1 3.58Å; I743-Y774 HydrophobicContact CD1-CE1 4.22Å; I743-Y774 HydrophobicContact CG2-CE1 4.29Å
744	E	89.8	Confident	83.7	Confident	43 Å²	43	53.7 Å²	53.7	20%	0.201	29%	0.289	C	S	.	.			trans	-73.9	161.9	180	-91.7	-73.3	-146.1	0	0	112.3	R742 T746 G747 A748	R742-E744 IonicContact CZ-OE1 3.07Å; R742-E744 IonicContact CZ-OE2 2.77Å; R742-E744 IonicContact NE-OE1 3.96Å; R742-E744 IonicContact NE-OE2 3.23Å; R742-E744 IonicContact NH1-OE1 3.97Å; R742-E744 PolarHBondContact NH1-OE1 2.81Å; R742-E744 IonicContact NH2-OE1 3.19Å; R742-E744 PolarHBondContact NH2-OE1 2.89Å; R742-E744 IonicContact NH2-OE2 2.78Å; R742-E744 PolarHBondContact NH2-OE2 2.99Å; E744-T746 PolarHBondContact O-N 2.84Å; E744-T746 VanDerWaalsContact O-N 3.08Å; E744-G747 PolarHBondContact O-N 3.14Å; E744-A748 HydrophobicContact CB-CB 4.24Å; E744-A748 PolarHBondContact N-O 2.8Å
745	R	85.8	Confident	84.5	Confident	57 Å²	57	52.3 Å²	52.3	22%	0.215	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-36.4	177.6	-174.8	-175.5	59.8	82.2	-5.3	113.1	Q721 G747 W796 W804	Q721-R745 HydrophobicContact CB-CG 3.5Å; Q721-R745 VanDerWaalsContact CB-CG 3.5Å; R745-G747 VanDerWaalsContact C-N 3.29Å; R745-G747 PolarHBondContact O-N 2.86Å; R745-W796 HydrophobicContact CG-CB 4.33Å; R745-W804 VanDerWaalsContact CZ-CD2 3.49Å; R745-W804 VanDerWaalsContact CZ-CG 3.5Å; R745-W804 VanDerWaalsContact NH1-CE2 3.33Å
746	T	84.2	Confident	85.1	Confident	102 Å²	102	47.5 Å²	47.5	63%	0.626	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-12.2	178.8	50.7	0	0	0	0	114.2	E744	E744-T746 PolarHBondContact O-N 2.84Å; E744-T746 VanDerWaalsContact O-N 3.08Å
747	G	79.3	Confident	85.1	Confident	24 Å²	24	50.1 Å²	50.1	25%	0.247	27%	0.267	C	S	.	.	S	Bend	trans	87.1	8.7	-169.9	0	0	0	0	0	114.5	E744 R745 F749	E744-G747 PolarHBondContact O-N 3.14Å; R745-G747 VanDerWaalsContact C-N 3.29Å; R745-G747 PolarHBondContact O-N 2.86Å; G747-F749 WeakPolarHBondContact O-CD2 3.01Å; G747-F749 VanDerWaalsContact O-CE2 3.28Å; G747-F749 WeakPolarHBondContact O-CE2 3.35Å
748	A	85	Confident	84.5	Confident	49 Å²	49	50.5 Å²	50.5	41%	0.405	27%	0.267	S	S	.	.			trans	-70.2	154.1	167	0	0	0	0	0	110.8	I743 E744	I743-A748 CarbonylContact C-O 3.6Å; E744-A748 HydrophobicContact CB-CB 4.24Å; E744-A748 PolarHBondContact N-O 2.8Å
749	F	84.3	Confident	83.9	Confident	106 Å²	106	58 Å²	58	47%	0.465	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.6	-178.7	-65.2	-92.5	0	0	0	110.5	I743 G747 A766	I743-F749 HydrophobicContact CB-CD1 4.42Å; I743-F749 HydrophobicContact CB-CE1 4.31Å; I743-F749 HydrophobicContact CD1-CE1 3.94Å; I743-F749 HydrophobicContact CG1-CD1 3.85Å; I743-F749 HydrophobicContact CG1-CE1 3.69Å; I743-F749 HydrophobicContact CG2-CD1 4.25Å; I743-F749 HydrophobicContact CG2-CE1 3.87Å; I743-F749 HydrophobicContact CG2-CZ 4.24Å; G747-F749 WeakPolarHBondContact O-CD2 3.01Å; G747-F749 VanDerWaalsContact O-CE2 3.28Å; G747-F749 WeakPolarHBondContact O-CE2 3.35Å; F749-A766 HydrophobicContact CD1-CB 4.49Å; F749-A766 HydrophobicContact CE1-CB 4.17Å; F749-A766 WeakPolarHBondContact CE1-O 3.5Å; F749-A766 WeakPolarHBondContact CZ-O 3.38Å
750	E	87.5	Confident	83.4	Confident	92 Å²	92	55.6 Å²	55.6	43%	0.43	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	128.4	177.1	-55.3	-179.5	142.8	0	0	108.4	L741 R742	L741-E750 CarbonylContact C-O 3.6Å; L741-E750 WeakPolarHBondContact CA-O 3.49Å; L741-E750 WeakPolarHBondContact CB-O 3.2Å; R742-E750 HydrophobicContact CB-CB 4.36Å; R742-E750 WeakPolarHBondContact CD-OE2 3.41Å; R742-E750 IonicContact CZ-OE2 3.56Å; R742-E750 PolarHBondContact N-O 2.85Å; R742-E750 IonicContact NE-OE2 3.75Å; R742-E750 IonicContact NH1-OE2 2.62Å; R742-E750 PolarHBondContact NH1-OE2 2.82Å; R742-E750 PolarHBondContact O-N 3.17Å
751	Y	86.8	Confident	82.9	Confident	75 Å²	75	60.6 Å²	60.6	29%	0.294	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133.6	175.4	-73.5	-83.2	0	0	0	110.5	L741 A755 R761 V764	L741-Y751 HydrophobicContact CB-CD1 3.92Å; L741-Y751 HydrophobicContact CB-CE1 4.4Å; L741-Y751 HydrophobicContact CB-CG 4.49Å; L741-Y751 HydrophobicContact CD2-CD1 4.41Å; L741-Y751 HydrophobicContact CD2-CE1 4.13Å; Y751-A755 HydrophobicContact CD1-CB 4.14Å; Y751-R761 HydrophobicContact CD1-CG 3.91Å; Y751-R761 HydrophobicContact CD2-CG 4Å; Y751-R761 HydrophobicContact CE1-CG 4.4Å; Y751-R761 HydrophobicContact CE2-CG 4.47Å; Y751-R761 HydrophobicContact CG-CG 3.69Å; Y751-R761 PolarHBondContact O-NH2 2.79Å; Y751-V764 PolarHBondContact OH-O 2.84Å
752	G	83.3	Confident	82.3	Confident	10 Å²	10	71.7 Å²	71.7	10%	0.103	34%	0.342	C	S	.	.			trans	-71.9	165.5	174.7	0	0	0	0	0	112.7	L739 L740 Y754 A755	L739-G752 WeakPolarHBondContact O-CA 3.34Å; L740-G752 PolarHBondContact O-N 2.74Å; G752-Y754 PolarHBondContact O-N 2.72Å; G752-A755 WeakPolarHBondContact O-CB 3.27Å; G752-A755 PolarHBondContact O-N 3.19Å
753	A	81.2	Confident	82	Confident	66 Å²	66	70.4 Å²	70.4	55%	0.545	34%	0.337	S	S	.	.	H	α-helix	trans	-58.4	-43.1	-173	0	0	0	0	0	113.3	A755 D756 E757	A753-A755 PolarHBondContact O-N 2.69Å; A753-A755 VanDerWaalsContact O-N 3.11Å; A753-D756 WeakPolarHBondContact O-CB 3.46Å; A753-D756 PolarHBondContact O-N 2.75Å; A753-E757 PolarHBondContact O-N 2.73Å; A753-E757 VanDerWaalsContact O-N 3.16Å
754	Y	80.8	Confident	81.8	Confident	13 Å²	13	70.4 Å²	70.4	5%	0.051	34%	0.337	C	S	.	.	H	α-helix	trans	-56.3	-30.5	177	175.4	-103.9	0	0	0	113.2	I728 E738 L740 G752 D756 E757 E758 L760	I728-Y754 HydrophobicContact CD1-CE1 4.47Å; I728-Y754 HydrophobicContact CG2-CD1 3.87Å; I728-Y754 HydrophobicContact CG2-CE1 3.56Å; E738-Y754 HydrophobicContact CB-CD1 4.21Å; E738-Y754 HydrophobicContact CB-CD2 4.47Å; E738-Y754 HydrophobicContact CB-CG 3.97Å; L740-Y754 HydrophobicContact CD2-CD1 3.9Å; L740-Y754 HydrophobicContact CD2-CE1 3.92Å; G752-Y754 PolarHBondContact O-N 2.72Å; Y754-D756 VanDerWaalsContact C-N 3.34Å; Y754-D756 PolarHBondContact O-N 3.33Å; Y754-E757 PolarHBondContact O-N 2.89Å; Y754-E758 HydrophobicContact CD2-CG 4.34Å; Y754-E758 HydrophobicContact CE2-CB 4.46Å; Y754-E758 HydrophobicContact CE2-CG 3.57Å; Y754-E758 PolarHBondContact O-N 2.68Å; Y754-L760 HydrophobicContact CD1-CD1 4.17Å; Y754-L760 HydrophobicContact CE1-CD1 3.59Å
755	A	78.4	Confident	81.7	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-76.1	-17.4	177.3	0	0	0	0	0	114.2	L740 Y751 G752 A753 L760 R761	L740-A755 VanDerWaalsContact O-CB 3.28Å; L740-A755 WeakPolarHBondContact O-CB 3.27Å; Y751-A755 HydrophobicContact CD1-CB 4.14Å; G752-A755 WeakPolarHBondContact O-CB 3.27Å; G752-A755 PolarHBondContact O-N 3.19Å; A753-A755 PolarHBondContact O-N 2.69Å; A753-A755 VanDerWaalsContact O-N 3.11Å; A755-L760 HydrophobicContact CB-CB 4.22Å; A755-L760 PolarHBondContact O-N 2.87Å; A755-R761 HydrophobicContact CB-CG 4.35Å; A755-R761 WeakPolarHBondContact O-CG 3.24Å; A755-R761 PolarHBondContact O-N 2.95Å
756	D	75.1	Confident	81.8	Confident	81 Å²	81	71.1 Å²	71.1	43%	0.433	35%	0.345	S	S	.	.	H	α-helix	trans	-77.1	-48.6	163.5	-84.1	-46.7	0	0	0	110.9	A753 Y754 E758 R759 R761	A753-D756 WeakPolarHBondContact O-CB 3.46Å; A753-D756 PolarHBondContact O-N 2.75Å; Y754-D756 VanDerWaalsContact C-N 3.34Å; Y754-D756 PolarHBondContact O-N 3.33Å; D756-E758 PolarHBondContact O-N 2.87Å; D756-R759 WeakPolarHBondContact O-CA 3.2Å; D756-R759 PolarHBondContact O-N 2.88Å; D756-R761 VanDerWaalsContact OD1-CD 3.23Å; D756-R761 WeakPolarHBondContact OD1-CD 3.34Å; D756-R761 IonicContact OD1-CZ 2.83Å; D756-R761 IonicContact OD1-NE 2.7Å; D756-R761 PolarHBondContact OD1-NE 2.79Å; D756-R761 IonicContact OD1-NH1 2.83Å; D756-R761 PolarHBondContact OD1-NH1 2.03Å; D756-R761 IonicContact OD1-NH2 2.73Å; D756-R761 IonicContact OD2-CZ 2.92Å; D756-R761 IonicContact OD2-NE 2.67Å; D756-R761 IonicContact OD2-NH1 2.74Å; D756-R761 PolarHBondContact OD2-NH1 2.86Å; D756-R761 IonicContact OD2-NH2 3.18Å; D756-R761 PolarHBondContact OD2-NH2 2.89Å
757	E	76.1	Confident	82	Confident	140 Å²	140	69.7 Å²	69.7	65%	0.654	33%	0.331	S	S	*	.	H	α-helix	trans	-56.7	-51.9	-172.4	-69.3	166.5	-173.1	0	0	112.1	A753 Y754 R759	A753-E757 PolarHBondContact O-N 2.73Å; A753-E757 VanDerWaalsContact O-N 3.16Å; Y754-E757 PolarHBondContact O-N 2.89Å; E757-R759 PolarHBondContact O-N 2.87Å
758	E	74.1	Confident	82.5	Confident	60 Å²	60	75 Å²	75	28%	0.28	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	17.2	176.9	-70.3	-70.5	178.2	0	0	113.3	Y754 D756 L760 R950	Y754-E758 HydrophobicContact CD2-CG 4.34Å; Y754-E758 HydrophobicContact CE2-CB 4.46Å; Y754-E758 HydrophobicContact CE2-CG 3.57Å; Y754-E758 PolarHBondContact O-N 2.68Å; D756-E758 PolarHBondContact O-N 2.87Å; E758-L760 HydrophobicContact CB-CD1 3.99Å; E758-L760 HydrophobicContact CB-CG 3.83Å; E758-L760 PolarHBondContact O-N 2.9Å; E758-R950 IonicContact OE2-NH2 2.73Å; E758-R950 PolarHBondContact OE2-NH2 3.43Å
759	R	76.3	Confident	82.7	Confident	190 Å²	190	76.4 Å²	76.4	72%	0.717	34%	0.344	S	S	*	.	S	Bend	trans	58.4	9.9	-178.9	-54.8	174.5	177.3	165.3	0.4	115.1	D756 E757 R761 R762	D756-R759 WeakPolarHBondContact O-CA 3.2Å; D756-R759 PolarHBondContact O-N 2.88Å; E757-R759 PolarHBondContact O-N 2.87Å; R759-R761 PolarHBondContact O-N 2.88Å; R759-R761 VanDerWaalsContact O-N 3.08Å; R759-R762 PolarHBondContact O-N 2.78Å
760	L	78.1	Confident	82.8	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-59.5	-23.1	-172.8	-67.5	172.9	0	0	0	113.8	L740 Y754 A755 E758 R762 R763 V764 L778	L740-L760 HydrophobicContact CD2-CD1 3.94Å; Y754-L760 HydrophobicContact CD1-CD1 4.17Å; Y754-L760 HydrophobicContact CE1-CD1 3.59Å; A755-L760 HydrophobicContact CB-CB 4.22Å; A755-L760 PolarHBondContact O-N 2.87Å; E758-L760 HydrophobicContact CB-CD1 3.99Å; E758-L760 HydrophobicContact CB-CG 3.83Å; E758-L760 PolarHBondContact O-N 2.9Å; L760-R762 PolarHBondContact O-N 2.83Å; L760-R763 PolarHBondContact O-N 2.87Å; L760-V764 HydrophobicContact CB-CG2 3.86Å; L760-V764 HydrophobicContact CD2-CG2 4.18Å; L760-V764 HydrophobicContact CG-CG2 4.44Å; L760-V764 WeakPolarHBondContact O-CB 3.23Å; L760-V764 PolarHBondContact O-N 2.82Å; L760-L778 HydrophobicContact CD2-CD1 4.09Å
761	R	79.3	Confident	82.7	Confident	105 Å²	105	73.5 Å²	73.5	40%	0.396	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-49.9	-24.2	175.3	-78	-162.2	176.1	157.5	-1.3	115.8	Y751 A755 D756 R759	Y751-R761 HydrophobicContact CD1-CG 3.91Å; Y751-R761 HydrophobicContact CD2-CG 4Å; Y751-R761 HydrophobicContact CE1-CG 4.4Å; Y751-R761 HydrophobicContact CE2-CG 4.47Å; Y751-R761 HydrophobicContact CG-CG 3.69Å; Y751-R761 PolarHBondContact O-NH2 2.79Å; A755-R761 HydrophobicContact CB-CG 4.35Å; A755-R761 WeakPolarHBondContact O-CG 3.24Å; A755-R761 PolarHBondContact O-N 2.95Å; D756-R761 VanDerWaalsContact OD1-CD 3.23Å; D756-R761 WeakPolarHBondContact OD1-CD 3.34Å; D756-R761 IonicContact OD1-CZ 2.83Å; D756-R761 IonicContact OD1-NE 2.7Å; D756-R761 PolarHBondContact OD1-NE 2.79Å; D756-R761 IonicContact OD1-NH1 2.83Å; D756-R761 PolarHBondContact OD1-NH1 2.03Å; D756-R761 IonicContact OD1-NH2 2.73Å; D756-R761 IonicContact OD2-CZ 2.92Å; D756-R761 IonicContact OD2-NE 2.67Å; D756-R761 IonicContact OD2-NH1 2.74Å; D756-R761 PolarHBondContact OD2-NH1 2.86Å; D756-R761 IonicContact OD2-NH2 3.18Å; D756-R761 PolarHBondContact OD2-NH2 2.89Å; R759-R761 PolarHBondContact O-N 2.88Å; R759-R761 VanDerWaalsContact O-N 3.08Å
762	R	78.4	Confident	82.8	Confident	236 Å²	236	74.2 Å²	74.2	89%	0.891	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-92.5	-15.6	177.3	-64.8	-174.7	-179.5	-175.3	1	114.1	R759 L760	R759-R762 PolarHBondContact O-N 2.78Å; L760-R762 PolarHBondContact O-N 2.83Å
763	R	86.1	Confident	83.2	Confident	28 Å²	28	76.4 Å²	76.4	11%	0.106	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-41.1	-170.5	-75.2	168.8	58.6	-129	-17	111.5	L760 L778 N779 R780 E782 D785	L760-R763 PolarHBondContact O-N 2.87Å; R763-L778 HydrophobicContact CB-CD1 4.13Å; R763-N779 WeakPolarHBondContact CB-O 3.06Å; R763-N779 PolarHBondContact O-N 2.88Å; R763-N779 PolarHBondContact O-ND2 2.66Å; R763-R780 VanDerWaalsContact CZ-O 3.25Å; R763-R780 PolarHBondContact NE-O 2.73Å; R763-R780 PolarHBondContact NH2-O 2.93Å; R763-E782 IonicContact CZ-OE1 3.46Å; R763-E782 IonicContact CZ-OE2 2.87Å; R763-E782 IonicContact NE-OE1 3.52Å; R763-E782 PolarHBondContact NE-OE1 3.04Å; R763-E782 IonicContact NH1-OE1 3.54Å; R763-E782 PolarHBondContact NH1-OE1 3.17Å; R763-E782 IonicContact NH1-OE2 2.77Å; R763-E782 PolarHBondContact NH1-OE2 2.95Å; R763-E782 IonicContact NH2-OE1 3.52Å; R763-E782 IonicContact NH2-OE2 3.59Å; R763-D785 IonicContact CZ-OD2 2.68Å; R763-D785 IonicContact NH1-OD1 3.55Å; R763-D785 IonicContact NH2-OD1 2.68Å; R763-D785 IonicContact NH2-OD2 3.49Å; R763-D785 PolarHBondContact NH2-OD2 2.99Å
764	V	87.8	Confident	83.8	Confident	2 Å²	2	73.4 Å²	73.4	1%	0.012	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131.7	173.9	177.7	0	0	0	0	110.7	L741 Y751 L760 L776 T777 L778	L741-V764 HydrophobicContact CD2-CG1 3.6Å; Y751-V764 PolarHBondContact OH-O 2.84Å; L760-V764 HydrophobicContact CB-CG2 3.86Å; L760-V764 HydrophobicContact CD2-CG2 4.18Å; L760-V764 HydrophobicContact CG-CG2 4.44Å; L760-V764 WeakPolarHBondContact O-CB 3.23Å; L760-V764 PolarHBondContact O-N 2.82Å; V764-L776 HydrophobicContact CG1-CD1 3.55Å; V764-T777 CarbonylContact C-O 3.57Å; V764-T777 WeakPolarHBondContact CA-O 3.49Å; V764-L778 HydrophobicContact CG2-CB 4.36Å; V764-L778 HydrophobicContact CG2-CD1 3.67Å
765	Q	87.4	Confident	84.4	Confident	99 Å²	99	72.8 Å²	72.8	46%	0.463	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	152	173.9	-67.7	169.5	-23.4	0	0	108.2	T777 N779	Q765-T777 PolarHBondContact N-O 2.87Å; Q765-T777 PolarHBondContact O-N 3.36Å; Q765-N779 PolarHBondContact OE1-ND2 3.08Å
766	A	88.3	Confident	85.1	Confident	16 Å²	16	72.8 Å²	72.8	13%	0.132	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	151.2	170.1	0	0	0	0	0	111.7	L741 I743 F749 A775 L776	L741-A766 HydrophobicContact CD1-CB 3.53Å; L741-A766 HydrophobicContact CD2-CB 3.79Å; L741-A766 HydrophobicContact CG-CB 4.3Å; I743-A766 HydrophobicContact CD1-CB 3.96Å; I743-A766 HydrophobicContact CG1-CB 4.35Å; F749-A766 HydrophobicContact CD1-CB 4.49Å; F749-A766 HydrophobicContact CE1-CB 4.17Å; F749-A766 WeakPolarHBondContact CE1-O 3.5Å; F749-A766 WeakPolarHBondContact CZ-O 3.38Å; A766-A775 VanDerWaalsContact CA-O 3.27Å; A766-A775 WeakPolarHBondContact CA-O 3.49Å; A766-L776 HydrophobicContact CB-CD1 4.44Å
767	E	88.2	Confident	85.9	Confident	72 Å²	72	69 Å²	69	34%	0.336	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	145.3	-175.5	58	-175.6	158.4	0	0	111.8	R707 L769 Y774 A775	R707-E767 IonicContact CZ-OE1 2.73Å; R707-E767 IonicContact NH1-OE1 3.72Å; R707-E767 PolarHBondContact NH1-OE1 2.94Å; R707-E767 IonicContact NH2-OE1 2.89Å; R707-E767 PolarHBondContact NH2-OE1 3.03Å; E767-L769 HydrophobicContact CG-CD2 3.81Å; E767-L769 HydrophobicContact CG-CG 4.18Å; E767-Y774 CarbonylContact O-C 3.56Å; E767-Y774 WeakPolarHBondContact O-CA 3.41Å; E767-A775 HydrophobicContact CG-CB 4.01Å; E767-A775 PolarHBondContact N-O 2.94Å; E767-A775 PolarHBondContact O-N 2.95Å
768	R	89.8	Confident	86.5	Confident	134 Å²	134	62.5 Å²	62.5	51%	0.506	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	91.9	172.3	-177.8	178.4	67.7	-169.4	-1.9	108.7	S770 Y774	R768-S770 VanDerWaalsContact C-N 3.32Å; R768-S770 VanDerWaalsContact CG-O 3.23Å; R768-S770 WeakPolarHBondContact CG-O 3.39Å; R768-Y774 HydrophobicContact CB-CD1 3.75Å; R768-Y774 HydrophobicContact CB-CE1 3.66Å; R768-Y774 WeakPolarHBondContact CD-OH 3.44Å; R768-Y774 HydrophobicContact CG-CD1 3.87Å; R768-Y774 HydrophobicContact CG-CE1 3.47Å; R768-Y774 VanDerWaalsContact CG-CE1 3.47Å; R768-Y774 HydrophobicContact CG-CE2 4.31Å
769	L	88.6	Confident	87.2	Confident	79 Å²	79	61.2 Å²	61.2	41%	0.414	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	-33.8	179.7	-60.5	177.3	0	0	0	112.4	E767 L773 A775	E767-L769 HydrophobicContact CG-CD2 3.81Å; E767-L769 HydrophobicContact CG-CG 4.18Å; L769-L773 HydrophobicContact CB-CB 4.42Å; L769-L773 HydrophobicContact CB-CD2 4.17Å; L769-L773 HydrophobicContact CB-CG 4.23Å; L769-L773 HydrophobicContact CD1-CD2 3.89Å; L769-L773 HydrophobicContact CD1-CG 4.12Å; L769-L773 PolarHBondContact N-O 3.11Å; L769-A775 HydrophobicContact CD1-CB 3.85Å; L769-A775 HydrophobicContact CG-CB 4.29Å
770	S	87.4	Confident	87.7	Confident	47 Å²	47	58.4 Å²	58.4	33%	0.329	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	171.5	172	87.7	0	0	0	0	110.1	R768 R772 L773	R768-S770 VanDerWaalsContact C-N 3.32Å; R768-S770 VanDerWaalsContact CG-O 3.23Å; R768-S770 WeakPolarHBondContact CG-O 3.39Å; S770-R772 PolarHBondContact O-N 3.16Å; S770-R772 PolarHBondContact OG-N 2.93Å; S770-L773 PolarHBondContact N-O 3.07Å; S770-L773 PolarHBondContact O-N 3.14Å; S770-L773 VanDerWaalsContact O-N 3.16Å; S770-L773 WeakPolarHBondContact OG-CB 3.32Å; S770-L773 PolarHBondContact OG-N 3.33Å; S770-L773 VanDerWaalsContact OG-N 3.15Å
771	P	84.6	Confident	88.1	Confident	90 Å²	90	58.4 Å²	58.4	58%	0.584	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-18.7	175.8	-26.1	35.8	0	0	0	114.9	H722	H722-P771 PolarHBondContact CE1-O 2.92Å; H722-P771 PolarHBondContact ND1-O 3.46Å
772	R	89.6	Confident	88.4	Confident	91 Å²	91	53.9 Å²	53.9	34%	0.343	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.7	3.7	-179.3	-65.6	-175	-168.3	-175.9	3.9	114.2	S711 I712 Q715 S770	S711-R772 CarbonylContact C-O 3.56Å; S711-R772 WeakPolarHBondContact CA-O 3Å; I712-R772 HydrophobicContact CB-CB 4.02Å; I712-R772 HydrophobicContact CB-CG 4.24Å; I712-R772 PolarHBondContact N-O 3.36Å; Q715-R772 VanDerWaalsContact CD-NE 3.27Å; Q715-R772 VanDerWaalsContact CD-NH2 3.3Å; Q715-R772 VanDerWaalsContact OE1-CG 3.23Å; S770-R772 PolarHBondContact O-N 3.16Å; S770-R772 PolarHBondContact OG-N 2.93Å
773	L	92.5	Very high	88.5	Confident	55 Å²	55	45.5 Å²	45.5	29%	0.288	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	119.5	-178	-174.9	66.4	0	0	0	110.5	N709 L769 S770	N709-L773 HydrophobicContact CB-CD1 4.25Å; L769-L773 HydrophobicContact CB-CB 4.42Å; L769-L773 HydrophobicContact CB-CD2 4.17Å; L769-L773 HydrophobicContact CB-CG 4.23Å; L769-L773 HydrophobicContact CD1-CD2 3.89Å; L769-L773 HydrophobicContact CD1-CG 4.12Å; L769-L773 PolarHBondContact N-O 3.11Å; S770-L773 PolarHBondContact N-O 3.07Å; S770-L773 PolarHBondContact O-N 3.14Å; S770-L773 VanDerWaalsContact O-N 3.16Å; S770-L773 WeakPolarHBondContact OG-CB 3.32Å; S770-L773 PolarHBondContact OG-N 3.33Å; S770-L773 VanDerWaalsContact OG-N 3.15Å
774	Y	93.3	Very high	88.3	Confident	3 Å²	3	46.6 Å²	46.6	1%	0.012	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	139.9	178.9	-64.8	-102.9	0	0	0	108.4	C710 I712 H722 V724 I743 E767 R768	C710-Y774 PolarHBondContact N-O 3.22Å; C710-Y774 PolarHBondContact O-N 3.45Å; I712-Y774 HydrophobicContact CD1-CE2 4.04Å; H722-Y774 HydrophobicContact CB-CE2 4.44Å; H722-Y774 PolarHBondContact O-OH 2.64Å; V724-Y774 HydrophobicContact CB-CD1 4.19Å; V724-Y774 HydrophobicContact CB-CE1 4.34Å; V724-Y774 HydrophobicContact CB-CG 4.34Å; V724-Y774 HydrophobicContact CG1-CG 4.44Å; V724-Y774 HydrophobicContact CG2-CD1 3.8Å; V724-Y774 HydrophobicContact CG2-CD2 3.75Å; V724-Y774 HydrophobicContact CG2-CE1 3.67Å; V724-Y774 HydrophobicContact CG2-CE2 3.7Å; V724-Y774 HydrophobicContact CG2-CG 3.8Å; I743-Y774 HydrophobicContact CD1-CD1 3.58Å; I743-Y774 HydrophobicContact CD1-CE1 4.22Å; I743-Y774 HydrophobicContact CG2-CE1 4.29Å; E767-Y774 CarbonylContact O-C 3.56Å; E767-Y774 WeakPolarHBondContact O-CA 3.41Å; R768-Y774 HydrophobicContact CB-CD1 3.75Å; R768-Y774 HydrophobicContact CB-CE1 3.66Å; R768-Y774 WeakPolarHBondContact CD-OH 3.44Å; R768-Y774 HydrophobicContact CG-CD1 3.87Å; R768-Y774 HydrophobicContact CG-CE1 3.47Å; R768-Y774 VanDerWaalsContact CG-CE1 3.47Å; R768-Y774 HydrophobicContact CG-CE2 4.31Å
775	A	92.6	Very high	88.2	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133.9	177.4	0	0	0	0	0	110.8	I708 A766 E767 L769	I708-A775 WeakPolarHBondContact O-CA 3.29Å; A766-A775 VanDerWaalsContact CA-O 3.27Å; A766-A775 WeakPolarHBondContact CA-O 3.49Å; E767-A775 HydrophobicContact CG-CB 4.01Å; E767-A775 PolarHBondContact N-O 2.94Å; E767-A775 PolarHBondContact O-N 2.95Å; L769-A775 HydrophobicContact CD1-CB 3.85Å; L769-A775 HydrophobicContact CG-CB 4.29Å
776	L	92.5	Very high	88.2	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	131	163.1	-175.9	69.2	0	0	0	107.4	R707 I708 W726 L740 L741 V764 A766 Y789	R707-L776 WeakPolarHBondContact CA-O 3.47Å; I708-L776 HydrophobicContact CB-CB 4.4Å; I708-L776 HydrophobicContact CD1-CD2 3.98Å; I708-L776 PolarHBondContact N-O 3.29Å; I708-L776 PolarHBondContact O-N 3.02Å; W726-L776 HydrophobicContact CB-CD1 4.33Å; W726-L776 HydrophobicContact CB-CD2 4.32Å; W726-L776 HydrophobicContact CD2-CB 3.72Å; W726-L776 HydrophobicContact CD2-CD1 4.27Å; W726-L776 HydrophobicContact CD2-CD2 4.04Å; W726-L776 HydrophobicContact CD2-CG 4.24Å; W726-L776 HydrophobicContact CE3-CB 3.71Å; W726-L776 HydrophobicContact CE3-CD2 3.72Å; W726-L776 HydrophobicContact CE3-CG 4.26Å; W726-L776 HydrophobicContact CG-CB 4.41Å; W726-L776 HydrophobicContact CG-CD1 4.1Å; W726-L776 HydrophobicContact CG-CD2 4.34Å; W726-L776 HydrophobicContact CH2-CB 3.67Å; W726-L776 HydrophobicContact CZ2-CB 3.74Å; W726-L776 HydrophobicContact CZ3-CB 3.69Å; W726-L776 HydrophobicContact CZ3-CD2 4.25Å; L740-L776 HydrophobicContact CD1-CD2 3.8Å; L741-L776 HydrophobicContact CD2-CD1 3.7Å; L741-L776 HydrophobicContact CG-CD1 4.5Å; V764-L776 HydrophobicContact CG1-CD1 3.55Å; A766-L776 HydrophobicContact CB-CD1 4.44Å; L776-Y789 HydrophobicContact CD2-CD1 3.79Å; L776-Y789 HydrophobicContact CD2-CE1 4.2Å
777	T	91.9	Very high	88.3	Confident	2 Å²	2	42 Å²	42	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	122.2	175.5	-60.1	0	0	0	0	108.8	R705 V706 R707 V764 Q765 N779	R705-T777 HydrophobicContact CG-CG2 3.87Å; R705-T777 VanDerWaalsContact NE-CG2 3.32Å; V706-T777 CarbonylContact O-C 3.58Å; V706-T777 WeakPolarHBondContact O-CA 3.38Å; R707-T777 PolarHBondContact NH1-OG1 3.44Å; V764-T777 CarbonylContact C-O 3.57Å; V764-T777 WeakPolarHBondContact CA-O 3.49Å; Q765-T777 PolarHBondContact N-O 2.87Å; Q765-T777 PolarHBondContact O-N 3.36Å; T777-N779 WeakPolarHBondContact CG2-OD1 3.37Å
778	L	90.3	Very high	88.4	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	110.9	170.5	164.4	71.3	0	0	0	107.1	V706 L760 R763 V764 A781 D785	V706-L778 HydrophobicContact CB-CB 4.12Å; V706-L778 HydrophobicContact CB-CD2 4.33Å; V706-L778 HydrophobicContact CG2-CD2 4.42Å; V706-L778 PolarHBondContact N-O 3.16Å; V706-L778 PolarHBondContact O-N 2.97Å; L760-L778 HydrophobicContact CD2-CD1 4.09Å; R763-L778 HydrophobicContact CB-CD1 4.13Å; V764-L778 HydrophobicContact CG2-CB 4.36Å; V764-L778 HydrophobicContact CG2-CD1 3.67Å; L778-A781 HydrophobicContact CD2-CB 4.35Å; L778-D785 HydrophobicContact CD2-CB 3.66Å
779	N	87.8	Confident	88.5	Confident	34 Å²	34	33.9 Å²	33.9	18%	0.182	18%	0.184	C	C	.	.	S	Bend	trans	-89.2	144.2	176.4	-50.7	-75	0	0	0	109.2	R705 R763 Q765 T777	R705-N779 WeakPolarHBondContact CD-OD1 3.19Å; R705-N779 WeakPolarHBondContact CG-OD1 3.42Å; R705-N779 PolarHBondContact NE-OD1 2.92Å; R763-N779 WeakPolarHBondContact CB-O 3.06Å; R763-N779 PolarHBondContact O-N 2.88Å; R763-N779 PolarHBondContact O-ND2 2.66Å; Q765-N779 PolarHBondContact OE1-ND2 3.08Å; T777-N779 WeakPolarHBondContact CG2-OD1 3.37Å
780	R	86.2	Confident	88.8	Confident	131 Å²	131	31.1 Å²	31.1	49%	0.494	17%	0.168	S	C	.	.	S	Bend	trans	57.3	67.3	-176.3	-59.6	-159.9	171.9	179.1	-4.5	112.8	D703 S704 R763 P949	D703-R780 WeakPolarHBondContact O-CA 3.44Å; D703-R780 VanDerWaalsContact OD1-CB 3.23Å; D703-R780 WeakPolarHBondContact OD1-CB 3.2Å; D703-R780 WeakPolarHBondContact OD1-CD 3.37Å; D703-R780 WeakPolarHBondContact OD1-CG 3.35Å; D703-R780 IonicContact OD1-NE 3.6Å; S704-R780 PolarHBondContact O-N 3.4Å; R763-R780 VanDerWaalsContact CZ-O 3.25Å; R763-R780 PolarHBondContact NE-O 2.73Å; R763-R780 PolarHBondContact NH2-O 2.93Å; R780-P949 HydrophobicContact CB-CB 4.24Å
781	A	86.8	Confident	89.1	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.153	C	C	.	.			trans	-69.3	135.5	-177.5	0	0	0	0	0	112.3	E702 D703 S704 V706 L778 V819	E702-A781 CarbonylContact C-O 3.57Å; E702-A781 WeakPolarHBondContact CA-O 3.05Å; D703-A781 PolarHBondContact N-O 2.95Å; S704-A781 WeakPolarHBondContact O-CB 3.41Å; S704-A781 PolarHBondContact O-N 3.49Å; V706-A781 HydrophobicContact CG2-CB 3.7Å; L778-A781 HydrophobicContact CD2-CB 4.35Å; A781-V819 HydrophobicContact CB-CG1 4.22Å; A781-V819 HydrophobicContact CB-CG2 3.92Å
782	E	85.4	Confident	89.6	Confident	10 Å²	10	25.8 Å²	25.8	5%	0.047	13%	0.131	C	C	.	.			trans	-110.4	156.2	179.1	-68.6	164.5	-165.2	0	0	109.7	R763 S784 D785 V819 P949 R950	R763-E782 IonicContact CZ-OE1 3.46Å; R763-E782 IonicContact CZ-OE2 2.87Å; R763-E782 IonicContact NE-OE1 3.52Å; R763-E782 PolarHBondContact NE-OE1 3.04Å; R763-E782 IonicContact NH1-OE1 3.54Å; R763-E782 PolarHBondContact NH1-OE1 3.17Å; R763-E782 IonicContact NH1-OE2 2.77Å; R763-E782 PolarHBondContact NH1-OE2 2.95Å; R763-E782 IonicContact NH2-OE1 3.52Å; R763-E782 IonicContact NH2-OE2 3.59Å; E782-S784 PolarHBondContact O-N 2.9Å; E782-S784 VanDerWaalsContact O-N 3.14Å; E782-S784 PolarHBondContact OE2-OG 2.96Å; E782-D785 PolarHBondContact N-OD2 2.72Å; E782-D785 WeakPolarHBondContact O-CB 3.29Å; E782-D785 PolarHBondContact O-N 3.45Å; E782-V819 WeakPolarHBondContact O-CB 3.45Å; E782-V819 WeakPolarHBondContact O-CG2 3.17Å; E782-P949 HydrophobicContact CG-CB 3.83Å; E782-P949 HydrophobicContact CG-CG 3.89Å; E782-R950 VanDerWaalsContact CD-NE 3.32Å; E782-R950 VanDerWaalsContact OE1-CG 3.32Å; E782-R950 WeakPolarHBondContact OE1-CG 3.25Å; E782-R950 IonicContact OE1-NE 2.76Å; E782-R950 IonicContact OE2-CZ 2.66Å; E782-R950 IonicContact OE2-NE 2.7Å; E782-R950 PolarHBondContact OE2-NE 2.91Å; E782-R950 IonicContact OE2-NH2 3.57Å; E782-R950 PolarHBondContact OE2-NH2 3.07Å
783	S	82.5	Confident	89.8	Confident	60 Å²	60	21.5 Å²	21.5	42%	0.42	12%	0.115	S	C	.	.	G	3₁₀ helix	trans	-53.4	-34.5	176.1	57.2	0	0	0	0	113.5	D785 S786	S783-D785 VanDerWaalsContact C-N 3.28Å; S783-D785 PolarHBondContact O-N 2.85Å; S783-S786 VanDerWaalsContact O-CB 3.25Å; S783-S786 WeakPolarHBondContact O-CB 3.48Å; S783-S786 PolarHBondContact O-N 2.62Å; S783-S786 PolarHBondContact O-OG 3.07Å
784	S	80.9	Confident	89.9	Confident	50 Å²	50	19.3 Å²	19.3	35%	0.35	10%	0.103	S	C	.	.	G	3₁₀ helix	trans	-64.6	-22.7	176.5	51.9	0	0	0	0	115	E782 S786	E782-S784 PolarHBondContact O-N 2.9Å; E782-S784 VanDerWaalsContact O-N 3.14Å; E782-S784 PolarHBondContact OE2-OG 2.96Å; S784-S786 PolarHBondContact O-N 2.76Å
785	D	85.5	Confident	89.9	Confident	2 Å²	2	19.2 Å²	19.2	1%	0.011	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-77.3	-3	177.4	-51.6	-42.3	0	0	0	112.2	R763 L778 E782 S783 G787 Y789	R763-D785 IonicContact CZ-OD2 2.68Å; R763-D785 IonicContact NH1-OD1 3.55Å; R763-D785 IonicContact NH2-OD1 2.68Å; R763-D785 IonicContact NH2-OD2 3.49Å; R763-D785 PolarHBondContact NH2-OD2 2.99Å; L778-D785 HydrophobicContact CD2-CB 3.66Å; E782-D785 PolarHBondContact N-OD2 2.72Å; E782-D785 WeakPolarHBondContact O-CB 3.29Å; E782-D785 PolarHBondContact O-N 3.45Å; S783-D785 VanDerWaalsContact C-N 3.28Å; S783-D785 PolarHBondContact O-N 2.85Å; D785-G787 PolarHBondContact O-N 2.97Å; D785-Y789 WeakPolarHBondContact O-CE2 2.99Å; D785-Y789 PolarHBondContact O-OH 2.99Å; D785-Y789 VanDerWaalsContact O-OH 3.07Å
786	S	88.1	Confident	89.9	Confident	15 Å²	15	21.8 Å²	21.8	11%	0.105	11%	0.112	C	C	.	.			trans	-61.5	118.1	176	-61.7	0	0	0	0	110.7	A731 S783 S784 V817 V819	A731-S786 WeakPolarHBondContact CB-O 3.46Å; A731-S786 PolarHBondContact N-O 3.07Å; S783-S786 VanDerWaalsContact O-CB 3.25Å; S783-S786 WeakPolarHBondContact O-CB 3.48Å; S783-S786 PolarHBondContact O-N 2.62Å; S783-S786 PolarHBondContact O-OG 3.07Å; S784-S786 PolarHBondContact O-N 2.76Å; S786-V817 WeakPolarHBondContact CA-O 3.44Å; S786-V819 PolarHBondContact OG-N 2.76Å
787	G	89	Confident	89.7	Confident	5 Å²	5	22.3 Å²	22.3	5%	0.052	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	177.6	-168	0	0	0	0	0	113.4	R729 D785 R816 V817	R729-G787 CarbonylContact O-C 3.6Å; R729-G787 VanDerWaalsContact O-CA 3.25Å; R729-G787 WeakPolarHBondContact O-CA 3.44Å; D785-G787 PolarHBondContact O-N 2.97Å; G787-R816 WeakPolarHBondContact O-CA 3.29Å; G787-V817 PolarHBondContact N-O 2.89Å; G787-V817 PolarHBondContact O-N 2.87Å
788	T	91.3	Very high	89.4	Confident	32 Å²	32	24.7 Å²	24.7	20%	0.196	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	112	176.8	-52.9	0	0	0	0	109.5	I728 R729 Y814 R816	I728-T788 CarbonylContact C-O 3.57Å; R729-T788 PolarHBondContact N-O 3.31Å; R729-T788 PolarHBondContact O-N 3.26Å; T788-Y814 HydrophobicContact CG2-CD1 3.65Å; T788-Y814 HydrophobicContact CG2-CG 3.93Å; T788-R816 HydrophobicContact CG2-CG 4.13Å
789	Y	92.3	Very high	89	Confident	3 Å²	3	25.8 Å²	25.8	1%	0.012	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	143	-178.9	-67.1	-104.6	0	0	0	111.2	I708 Y727 I728 L740 L776 D785 T815 V817	I708-Y789 HydrophobicContact CD1-CD1 3.69Å; I708-Y789 HydrophobicContact CD1-CD2 4.01Å; I708-Y789 HydrophobicContact CD1-CE1 4.28Å; I708-Y789 HydrophobicContact CD1-CG 3.53Å; Y727-Y789 WeakPolarHBondContact O-CA 3.45Å; I728-Y789 HydrophobicContact CB-CD1 4.28Å; I728-Y789 HydrophobicContact CB-CE1 4.22Å; I728-Y789 HydrophobicContact CD1-CE1 3.84Å; I728-Y789 HydrophobicContact CD1-CE2 3.93Å; I728-Y789 VanDerWaalsContact CD1-CZ 3.47Å; I728-Y789 WeakPolarHBondContact CD1-OH 3.48Å; I728-Y789 HydrophobicContact CG1-CD1 4.29Å; I728-Y789 HydrophobicContact CG1-CD2 4.38Å; I728-Y789 HydrophobicContact CG1-CE1 4.03Å; I728-Y789 HydrophobicContact CG1-CE2 4.11Å; I728-Y789 HydrophobicContact CG1-CG 4.47Å; L740-Y789 HydrophobicContact CD1-CD1 3.67Å; L740-Y789 HydrophobicContact CD1-CE1 3.63Å; L776-Y789 HydrophobicContact CD2-CD1 3.79Å; L776-Y789 HydrophobicContact CD2-CE1 4.2Å; D785-Y789 WeakPolarHBondContact O-CE2 2.99Å; D785-Y789 PolarHBondContact O-OH 2.99Å; D785-Y789 VanDerWaalsContact O-OH 3.07Å; Y789-T815 PolarHBondContact N-O 3.2Å; Y789-T815 PolarHBondContact O-N 3.3Å; Y789-V817 HydrophobicContact CD2-CB 3.99Å; Y789-V817 HydrophobicContact CD2-CG2 3.64Å; Y789-V817 HydrophobicContact CE2-CB 3.81Å; Y789-V817 HydrophobicContact CE2-CG1 4.49Å; Y789-V817 HydrophobicContact CE2-CG2 3.84Å
790	Y	93.7	Very high	88.6	Confident	21 Å²	21	25.3 Å²	25.3	8%	0.082	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	164.6	169	70.3	-84.4	0	0	0	111	Y727 D737 T811 S812 Y814	Y727-Y790 VanDerWaalsContact CB-CE1 3.43Å; Y727-Y790 VanDerWaalsContact CB-CZ 3.41Å; Y727-Y790 AromaticContact CD2-CE2 3.93Å; Y727-Y790 HydrophobicContact CD2-CE2 3.93Å; Y727-Y790 HydrophobicContact CG-CE1 4.27Å; Y727-Y790 HydrophobicContact CG-CE2 4.12Å; Y727-Y790 AromaticContact CG-CZ 3.75Å; Y727-Y790 PolarHBondContact N-O 3.49Å; Y727-Y790 PolarHBondContact O-N 3.35Å; D737-Y790 HydrophobicContact CB-CE1 4.1Å; D737-Y790 VanDerWaalsContact CB-OH 3.29Å; D737-Y790 WeakPolarHBondContact CB-OH 3.48Å; D737-Y790 VanDerWaalsContact CG-OH 3.3Å; D737-Y790 PolarHBondContact OD2-OH 3.18Å; Y790-T811 HydrophobicContact CD2-CG2 4.15Å; Y790-T811 HydrophobicContact CE2-CG2 3.99Å; Y790-S812 WeakPolarHBondContact CA-OG 3.46Å; Y790-S812 WeakPolarHBondContact CB-OG 3.47Å; Y790-Y814 AromaticContact CD1-CD1 3.93Å; Y790-Y814 HydrophobicContact CD1-CD1 3.93Å; Y790-Y814 AromaticContact CD1-CE1 3.68Å; Y790-Y814 HydrophobicContact CD1-CE1 3.68Å; Y790-Y814 HydrophobicContact CE1-CE1 4.14Å; Y790-Y814 HydrophobicContact CG-CD1 4.22Å; Y790-Y814 HydrophobicContact CG-CE1 4.06Å
791	C	94.6	Very high	87.9	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	145.8	168.3	71.6	0	0	0	0	111.5	C710 V724 L725 W726 T811 S812	C710-C791 HydrophobicContact CB-CB 3.64Å; C710-C791 WeakPolarHBondContact CB-SG 3.43Å; C710-C791 WeakPolarHBondContact SG-CB 3.37Å; C710-C791 CovalentContact SG-SG 2.03Å; C710-C791 PolarHBondContact SG-SG 3.35Å; V724-C791 HydrophobicContact CG1-CB 3.99Å; L725-C791 CarbonylContact O-C 3.59Å; L725-C791 VanDerWaalsContact O-CA 3.25Å; L725-C791 WeakPolarHBondContact O-CA 3.28Å; W726-C791 HydrophobicContact CD2-CB 4.08Å; W726-C791 HydrophobicContact CE3-CB 3.91Å; W726-C791 HydrophobicContact CH2-CB 4.42Å; W726-C791 HydrophobicContact CZ3-CB 4.09Å; C791-T811 CarbonylContact O-C 3.53Å; C791-T811 VanDerWaalsContact O-CA 3.29Å; C791-T811 WeakPolarHBondContact O-CA 3.39Å; C791-S812 PolarHBondContact N-OG 3.42Å; C791-S812 PolarHBondContact O-N 3.38Å; C791-S812 VanDerWaalsContact SG-CB 3.56Å
792	L	94.8	Very high	87.4	Confident	25 Å²	25	23.6 Å²	23.6	13%	0.131	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.8	163.4	172.7	70.7	0	0	0	107.3	L725 Y727 R809 T811	L725-L792 HydrophobicContact CB-CB 4.32Å; L725-L792 PolarHBondContact N-O 3.44Å; L725-L792 PolarHBondContact O-N 3.38Å; Y727-L792 HydrophobicContact CD2-CB 4.21Å; Y727-L792 HydrophobicContact CE2-CB 3.94Å; Y727-L792 HydrophobicContact CE2-CD2 4.12Å; L792-R809 HydrophobicContact CD1-CB 4.08Å; L792-T811 HydrophobicContact CB-CG2 4.33Å; L792-T811 HydrophobicContact CD1-CG2 3.67Å
793	V	94.8	Very high	87.3	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	127.2	175.6	-178.9	0	0	0	0	108.6	L689 V691 I712 H722 V724 R809 D810	L689-V793 HydrophobicContact CD1-CG1 4.07Å; L689-V793 HydrophobicContact CD2-CG1 4.42Å; V691-V793 HydrophobicContact CG1-CG2 4.26Å; V691-V793 HydrophobicContact CG2-CB 3.69Å; V691-V793 HydrophobicContact CG2-CG2 3.5Å; I712-V793 HydrophobicContact CD1-CG1 3.71Å; I712-V793 HydrophobicContact CD1-CG2 4.4Å; I712-V793 HydrophobicContact CG1-CG1 4.23Å; I712-V793 HydrophobicContact CG1-CG2 4.24Å; H722-V793 HydrophobicContact CB-CG1 3.96Å; V724-V793 HydrophobicContact CG1-CG2 4.38Å; V724-V793 HydrophobicContact CG2-CG1 4.38Å; V724-V793 HydrophobicContact CG2-CG2 4.17Å; V793-R809 CarbonylContact O-C 3.55Å; V793-R809 WeakPolarHBondContact O-CA 3.47Å; V793-D810 PolarHBondContact N-O 2.77Å; V793-D810 PolarHBondContact O-N 3.31Å
794	E	94.6	Very high	87.4	Confident	10 Å²	10	26.9 Å²	26.9	5%	0.047	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	128.5	165.1	-51.7	-158.8	134.1	0	0	109.9	H722 A723 L725 W796 R806 S808 R809	H722-E794 VanDerWaalsContact CA-O 3.3Å; H722-E794 WeakPolarHBondContact CA-O 3.23Å; A723-E794 HydrophobicContact CB-CB 4.35Å; A723-E794 PolarHBondContact N-O 2.85Å; A723-E794 PolarHBondContact O-N 2.86Å; L725-E794 HydrophobicContact CD1-CG 4.06Å; E794-W796 PolarHBondContact OE2-NE1 3.08Å; E794-R806 HydrophobicContact CB-CG 4.24Å; E794-R806 VanDerWaalsContact OE1-CD 3.27Å; E794-R806 WeakPolarHBondContact OE1-CD 3.44Å; E794-R806 IonicContact OE1-CZ 3.95Å; E794-R806 IonicContact OE1-NE 2.71Å; E794-R806 IonicContact OE1-NH1 3.18Å; E794-R806 PolarHBondContact OE1-NH1 3.42Å; E794-R806 VanDerWaalsContact OE2-CD 3.27Å; E794-R806 WeakPolarHBondContact OE2-CD 3.3Å; E794-R806 IonicContact OE2-NH1 3.91Å; E794-S808 WeakPolarHBondContact CA-O 3.42Å; E794-R809 HydrophobicContact CB-CG 4.27Å; E794-R809 HydrophobicContact CG-CG 3.91Å; E794-R809 WeakPolarHBondContact OE1-CD 3.38Å; E794-R809 IonicContact OE1-NH1 2.76Å
795	E	93.3	Very high	87.7	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133.2	173.1	179.7	173.7	-131.8	0	0	110.8	L689 T716 S720 R806 L807 S808	L689-E795 HydrophobicContact CB-CB 4.46Å; L689-E795 HydrophobicContact CD1-CB 4.28Å; L689-E795 HydrophobicContact CD2-CB 3.95Å; L689-E795 HydrophobicContact CG-CB 4.46Å; T716-E795 WeakPolarHBondContact CB-OE1 3.5Å; T716-E795 WeakPolarHBondContact CB-OE2 3.3Å; T716-E795 PolarHBondContact N-OE1 2.81Å; T716-E795 PolarHBondContact OG1-OE1 2.82Å; T716-E795 PolarHBondContact OG1-OE2 3.24Å; S720-E795 WeakPolarHBondContact CB-OE1 3.39Å; S720-E795 PolarHBondContact OG-OE1 2.99Å; E795-R806 CarbonylContact O-C 3.53Å; E795-R806 WeakPolarHBondContact O-CA 3.32Å; E795-L807 PolarHBondContact O-N 2.97Å; E795-S808 PolarHBondContact N-O 2.89Å; E795-S808 PolarHBondContact O-N 2.83Å
796	W	91.6	Very high	87.9	Confident	54 Å²	54	31.3 Å²	31.3	21%	0.205	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	141	-179.5	-65.6	73.9	0	0	0	111	Q721 R745 E794 W804 Y805 R806	Q721-W796 PolarHBondContact N-O 2.86Å; Q721-W796 WeakPolarHBondContact O-CB 3.47Å; Q721-W796 PolarHBondContact O-N 2.8Å; R745-W796 HydrophobicContact CG-CB 4.33Å; E794-W796 PolarHBondContact OE2-NE1 3.08Å; W796-W804 HydrophobicContact CB-CE3 4.22Å; W796-W804 HydrophobicContact CE3-CB 4.47Å; W796-Y805 VanDerWaalsContact CA-O 3.32Å; W796-Y805 WeakPolarHBondContact CA-O 3.34Å; W796-R806 HydrophobicContact CD2-CB 3.79Å; W796-R806 HydrophobicContact CD2-CG 4.36Å; W796-R806 HydrophobicContact CE3-CB 3.98Å; W796-R806 VanDerWaalsContact CE3-N 3.27Å; W796-R806 HydrophobicContact CG-CB 4.44Å; W796-R806 HydrophobicContact CH2-CB 3.94Å; W796-R806 HydrophobicContact CZ2-CB 3.75Å; W796-R806 HydrophobicContact CZ2-CG 4.24Å; W796-R806 HydrophobicContact CZ3-CB 4.05Å
797	L	89.1	Confident	88	Confident	12 Å²	12	32 Å²	32	6%	0.063	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	154.7	174.1	-71.1	174.5	0	0	0	110.2	P685 W804 Y805 L807	P685-L797 HydrophobicContact CG-CD1 3.85Å; L797-W804 CarbonylContact O-C 3.54Å; L797-W804 WeakPolarHBondContact O-CA 3.45Å; L797-Y805 HydrophobicContact CB-CE1 3.94Å; L797-Y805 HydrophobicContact CB-CE2 4.48Å; L797-Y805 PolarHBondContact N-O 2.85Å; L797-Y805 WeakPolarHBondContact O-CD1 3.48Å; L797-Y805 WeakPolarHBondContact O-CE1 3.49Å; L797-Y805 PolarHBondContact O-N 3.49Å; L797-L807 HydrophobicContact CD1-CD2 3.97Å
798	S	85.6	Confident	88.1	Confident	52 Å²	52	33.2 Å²	33.2	36%	0.364	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	138.9	164	54.5	0	0	0	0	110.3	A803	S798-A803 CarbonylContact C-O 3.55Å; S798-A803 WeakPolarHBondContact CA-O 3.34Å
799	D	81	Confident	88.3	Confident	25 Å²	25	38.3 Å²	38.3	13%	0.134	20%	0.198	C	C	.	.			trans	-75.7	170.3	163.8	75.7	12.8	0	0	0	111.3	F562 D801 G802 A803 Y805	F562-D799 HydrophobicContact CD2-CB 3.63Å; F562-D799 HydrophobicContact CE2-CB 3.56Å; D799-D801 PolarHBondContact O-N 3.17Å; D799-D801 WeakPolarHBondContact OD1-CA 3.23Å; D799-D801 WeakPolarHBondContact OD1-CB 3.21Å; D799-D801 PolarHBondContact OD1-N 3.41Å; D799-G802 WeakPolarHBondContact O-CA 3.33Å; D799-G802 PolarHBondContact O-N 2.85Å; D799-G802 PolarHBondContact OD1-N 2.82Å; D799-A803 PolarHBondContact N-O 2.82Å; D799-A803 PolarHBondContact OD1-N 2.99Å; D799-Y805 HydrophobicContact CB-CD1 4.09Å; D799-Y805 HydrophobicContact CB-CE1 3.99Å
800	P	78.8	Confident	88.4	Confident	24 Å²	24	39.7 Å²	39.7	16%	0.156	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-14.5	-178.9	-25	37.6	0	0	0	115.8	F562 R643 G802	F562-P800 HydrophobicContact CB-CG 4.44Å; R643-P800 HydrophobicContact CB-CB 4.3Å; R643-P800 WeakPolarHBondContact O-CB 3.03Å; P800-G802 VanDerWaalsContact C-N 3.33Å
801	D	72.6	Confident	88.4	Confident	48 Å²	48	41 Å²	41	26%	0.257	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-11.8	169.6	-75.2	-52.6	0	0	0	111.8	R647 D799	R647-D801 WeakPolarHBondContact CD-OD2 3.43Å; R647-D801 VanDerWaalsContact CG-OD2 3.28Å; R647-D801 WeakPolarHBondContact CG-OD2 3.36Å; R647-D801 IonicContact NE-OD1 3.78Å; R647-D801 IonicContact NE-OD2 3.56Å; R647-D801 PolarHBondContact NE-OD2 2.72Å; D799-D801 PolarHBondContact O-N 3.17Å; D799-D801 WeakPolarHBondContact OD1-CA 3.23Å; D799-D801 WeakPolarHBondContact OD1-CB 3.21Å; D799-D801 PolarHBondContact OD1-N 3.41Å
802	G	75.7	Confident	88.4	Confident	47 Å²	47	41.6 Å²	41.6	49%	0.485	22%	0.22	S	C	.	.	S	Bend	trans	100.6	4.1	177	0	0	0	0	0	115.2	D799 P800	D799-G802 WeakPolarHBondContact O-CA 3.33Å; D799-G802 PolarHBondContact O-N 2.85Å; D799-G802 PolarHBondContact OD1-N 2.82Å; P800-G802 VanDerWaalsContact C-N 3.33Å
803	A	82.9	Confident	88.3	Confident	55 Å²	55	40.6 Å²	40.6	46%	0.455	22%	0.216	S	C	.	.			trans	-84.7	135.2	-179.9	0	0	0	0	0	111.7	S798 D799	S798-A803 CarbonylContact C-O 3.55Å; S798-A803 WeakPolarHBondContact CA-O 3.34Å; D799-A803 PolarHBondContact N-O 2.82Å; D799-A803 PolarHBondContact OD1-N 2.99Å
804	W	86.1	Confident	88.1	Confident	84 Å²	84	45.1 Å²	45.1	32%	0.318	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.8	-178.8	-71.3	83.1	0	0	0	111.9	Q721 R745 W796 L797	Q721-W804 HydrophobicContact CB-CH2 4.43Å; Q721-W804 HydrophobicContact CB-CZ3 4.02Å; Q721-W804 HydrophobicContact CG-CH2 3.75Å; Q721-W804 HydrophobicContact CG-CZ3 3.84Å; R745-W804 VanDerWaalsContact CZ-CD2 3.49Å; R745-W804 VanDerWaalsContact CZ-CG 3.5Å; R745-W804 VanDerWaalsContact NH1-CE2 3.33Å; W796-W804 HydrophobicContact CB-CE3 4.22Å; W796-W804 HydrophobicContact CE3-CB 4.47Å; L797-W804 CarbonylContact O-C 3.54Å; L797-W804 WeakPolarHBondContact O-CA 3.45Å
805	Y	86.6	Confident	88	Confident	30 Å²	30	45 Å²	45	12%	0.118	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	144.8	175.3	66.7	-80.9	0	0	0	110.8	F562 Q684 P685 W796 L797 D799 L807	F562-Y805 AromaticContact CD2-CE1 3.68Å; F562-Y805 HydrophobicContact CD2-CE1 3.68Å; F562-Y805 AromaticContact CD2-CZ 3.78Å; F562-Y805 HydrophobicContact CE2-CD1 4.27Å; F562-Y805 AromaticContact CE2-CE1 3.82Å; F562-Y805 HydrophobicContact CE2-CE1 3.82Å; Q684-Y805 HydrophobicContact CB-CE2 4.2Å; Q684-Y805 HydrophobicContact CG-CD2 4.27Å; Q684-Y805 HydrophobicContact CG-CE2 3.74Å; P685-Y805 VanDerWaalsContact CD-OH 3.3Å; P685-Y805 WeakPolarHBondContact CD-OH 3.38Å; W796-Y805 VanDerWaalsContact CA-O 3.32Å; W796-Y805 WeakPolarHBondContact CA-O 3.34Å; L797-Y805 HydrophobicContact CB-CE1 3.94Å; L797-Y805 HydrophobicContact CB-CE2 4.48Å; L797-Y805 PolarHBondContact N-O 2.85Å; L797-Y805 WeakPolarHBondContact O-CD1 3.48Å; L797-Y805 WeakPolarHBondContact O-CE1 3.49Å; L797-Y805 PolarHBondContact O-N 3.49Å; D799-Y805 HydrophobicContact CB-CD1 4.09Å; D799-Y805 HydrophobicContact CB-CE1 3.99Å; Y805-L807 HydrophobicContact CE2-CB 4.28Å; Y805-L807 HydrophobicContact CE2-CD1 3.89Å; Y805-L807 PolarHBondContact O-N 2.88Å
806	R	90.4	Very high	87.9	Confident	115 Å²	115	53.1 Å²	53.1	43%	0.434	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	118	172.1	-174	179.8	62.8	-153.6	-13	108.7	E794 E795 W796	E794-R806 HydrophobicContact CB-CG 4.24Å; E794-R806 VanDerWaalsContact OE1-CD 3.27Å; E794-R806 WeakPolarHBondContact OE1-CD 3.44Å; E794-R806 IonicContact OE1-CZ 3.95Å; E794-R806 IonicContact OE1-NE 2.71Å; E794-R806 IonicContact OE1-NH1 3.18Å; E794-R806 PolarHBondContact OE1-NH1 3.42Å; E794-R806 VanDerWaalsContact OE2-CD 3.27Å; E794-R806 WeakPolarHBondContact OE2-CD 3.3Å; E794-R806 IonicContact OE2-NH1 3.91Å; E795-R806 CarbonylContact O-C 3.53Å; E795-R806 WeakPolarHBondContact O-CA 3.32Å; W796-R806 HydrophobicContact CD2-CB 3.79Å; W796-R806 HydrophobicContact CD2-CG 4.36Å; W796-R806 HydrophobicContact CE3-CB 3.98Å; W796-R806 VanDerWaalsContact CE3-N 3.27Å; W796-R806 HydrophobicContact CG-CB 4.44Å; W796-R806 HydrophobicContact CH2-CB 3.94Å; W796-R806 HydrophobicContact CZ2-CB 3.75Å; W796-R806 HydrophobicContact CZ2-CG 4.24Å; W796-R806 HydrophobicContact CZ3-CB 4.05Å
807	L	89.4	Confident	87.9	Confident	29 Å²	29	50.8 Å²	50.8	15%	0.152	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-43.6	178.3	-176.7	70	0	0	0	112	Q684 P685 T716 E795 L797 Y805	Q684-L807 HydrophobicContact CB-CD1 4.02Å; P685-L807 HydrophobicContact CG-CD1 4.36Å; P685-L807 HydrophobicContact CG-CD2 4.37Å; P685-L807 WeakPolarHBondContact O-CD1 3.29Å; T716-L807 HydrophobicContact CG2-CD2 3.77Å; E795-L807 PolarHBondContact O-N 2.97Å; L797-L807 HydrophobicContact CD1-CD2 3.97Å; Y805-L807 HydrophobicContact CE2-CB 4.28Å; Y805-L807 HydrophobicContact CE2-CD1 3.89Å; Y805-L807 PolarHBondContact O-N 2.88Å
808	S	91.8	Very high	88	Confident	31 Å²	31	54.1 Å²	54.1	22%	0.217	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	168	-166.5	-152.5	0	0	0	0	113.4	S687 E794 E795	S687-S808 VanDerWaalsContact CB-CB 3.48Å; S687-S808 VanDerWaalsContact CB-OG 3.27Å; S687-S808 WeakPolarHBondContact CB-OG 3.45Å; S687-S808 WeakPolarHBondContact OG-CB 3.47Å; S687-S808 PolarHBondContact OG-OG 2.88Å; E794-S808 WeakPolarHBondContact CA-O 3.42Å; E795-S808 PolarHBondContact N-O 2.89Å; E795-S808 PolarHBondContact O-N 2.83Å
809	R	94.6	Very high	88.2	Confident	139 Å²	139	52 Å²	52	53%	0.525	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	137.1	174.5	-50.5	-169.8	-63	-179.5	-0	110.5	L792 V793 E794	L792-R809 HydrophobicContact CD1-CB 4.08Å; V793-R809 CarbonylContact O-C 3.55Å; V793-R809 WeakPolarHBondContact O-CA 3.47Å; E794-R809 HydrophobicContact CB-CG 4.27Å; E794-R809 HydrophobicContact CG-CG 3.91Å; E794-R809 WeakPolarHBondContact OE1-CD 3.38Å; E794-R809 IonicContact OE1-NH1 2.76Å
810	D	94.4	Very high	88.3	Confident	33 Å²	33	55.4 Å²	55.4	18%	0.176	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	153.2	175.4	-172	35.8	0	0	0	111.6	L689 K690 V691 K693 V793	L689-D810 HydrophobicContact CD2-CB 3.89Å; L689-D810 HydrophobicContact CG-CB 4.03Å; K690-D810 WeakPolarHBondContact CA-OD2 3.5Å; V691-D810 HydrophobicContact CG2-CB 4.03Å; V691-D810 PolarHBondContact N-OD2 2.78Å; K693-D810 WeakPolarHBondContact CE-OD1 3.23Å; K693-D810 WeakPolarHBondContact CE-OD2 3.44Å; K693-D810 IonicContact NZ-OD1 3.21Å; K693-D810 PolarHBondContact NZ-OD1 3.07Å; K693-D810 IonicContact NZ-OD2 3.36Å; V793-D810 PolarHBondContact N-O 2.77Å; V793-D810 PolarHBondContact O-N 3.31Å
811	T	94.2	Very high	88.5	Confident	47 Å²	47	58.5 Å²	58.5	29%	0.288	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	147.2	-175.6	51.4	0	0	0	0	113.5	K693 Y790 C791 L792	K693-T811 WeakPolarHBondContact CE-O 3.13Å; K693-T811 PolarHBondContact NZ-O 3.34Å; K693-T811 PolarHBondContact NZ-OG1 3.47Å; Y790-T811 HydrophobicContact CD2-CG2 4.15Å; Y790-T811 HydrophobicContact CE2-CG2 3.99Å; C791-T811 CarbonylContact O-C 3.53Å; C791-T811 VanDerWaalsContact O-CA 3.29Å; C791-T811 WeakPolarHBondContact O-CA 3.39Å; L792-T811 HydrophobicContact CB-CG2 4.33Å; L792-T811 HydrophobicContact CD1-CG2 3.67Å
812	S	94.4	Very high	88.9	Confident	13 Å²	13	57.8 Å²	57.8	9%	0.091	28%	0.282	C	S	.	.			trans	-69.7	175.9	169.6	68.8	0	0	0	0	112.9	Q692 Y790 C791	Q692-S812 CarbonylContact O-C 3.56Å; Q692-S812 WeakPolarHBondContact O-CA 3.29Å; Y790-S812 WeakPolarHBondContact CA-OG 3.46Å; Y790-S812 WeakPolarHBondContact CB-OG 3.47Å; C791-S812 PolarHBondContact N-OG 3.42Å; C791-S812 PolarHBondContact O-N 3.38Å; C791-S812 VanDerWaalsContact SG-CB 3.56Å
813	G	91.7	Very high	89.1	Confident	5 Å²	5	61.7 Å²	61.7	5%	0.052	29%	0.288	C	S	.	.			trans	-65.9	163.8	160.3	0	0	0	0	0	110.9	Q692 N695	Q692-G813 PolarHBondContact O-N 2.99Å; N695-G813 WeakPolarHBondContact OD1-CA 3.42Å
814	Y	91.9	Very high	89.1	Confident	94 Å²	94	63.2 Å²	63.2	37%	0.369	29%	0.293	S	S	.	.			trans	-87.9	119.5	-179.1	-68.4	-68.3	0	0	0	110.7	N695 Q696 T788 Y790	N695-Y814 VanDerWaalsContact CA-O 3.29Å; N695-Y814 WeakPolarHBondContact CA-O 3.37Å; N695-Y814 PolarHBondContact OD1-N 3.35Å; Q696-Y814 PolarHBondContact N-O 3.14Å; T788-Y814 HydrophobicContact CG2-CD1 3.65Å; T788-Y814 HydrophobicContact CG2-CG 3.93Å; Y790-Y814 AromaticContact CD1-CD1 3.93Å; Y790-Y814 HydrophobicContact CD1-CD1 3.93Å; Y790-Y814 AromaticContact CD1-CE1 3.68Å; Y790-Y814 HydrophobicContact CD1-CE1 3.68Å; Y790-Y814 HydrophobicContact CE1-CE1 4.14Å; Y790-Y814 HydrophobicContact CG-CD1 4.22Å; Y790-Y814 HydrophobicContact CG-CE1 4.06Å
815	T	92.6	Very high	89	Confident	8 Å²	8	64.2 Å²	64.2	5%	0.049	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	103	173	-55.4	0	0	0	0	109	Q696 L698 I708 Y789 V817	Q696-T815 HydrophobicContact CB-CG2 4.31Å; Q696-T815 CarbonylContact O-C 3.48Å; Q696-T815 WeakPolarHBondContact O-CA 3.44Å; L698-T815 HydrophobicContact CD1-CG2 3.65Å; L698-T815 HydrophobicContact CG-CG2 4.01Å; I708-T815 HydrophobicContact CG1-CG2 4.14Å; I708-T815 HydrophobicContact CG2-CG2 4.13Å; Y789-T815 PolarHBondContact N-O 3.2Å; Y789-T815 PolarHBondContact O-N 3.3Å; T815-V817 HydrophobicContact CG2-CG2 4.3Å; T815-V817 PolarHBondContact O-N 2.73Å
816	R	91.3	Very high	89.1	Confident	170 Å²	170	63.4 Å²	63.4	64%	0.642	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	115.8	171.6	-70.4	178.4	175.7	165	-1.5	108.7	Q696 S697 L698 G787 T788	Q696-R816 PolarHBondContact O-N 2.85Å; S697-R816 CarbonylContact C-O 3.59Å; S697-R816 WeakPolarHBondContact CA-O 3.29Å; L698-R816 PolarHBondContact N-O 3Å; G787-R816 WeakPolarHBondContact O-CA 3.29Å; T788-R816 HydrophobicContact CG2-CG 4.13Å
817	V	91.8	Very high	89	Confident	5 Å²	5	65.4 Å²	65.4	3%	0.03	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128.1	172	177.1	0	0	0	0	107.5	L698 Y700 V706 I708 S786 G787 Y789 T815 V819	L698-V817 WeakPolarHBondContact O-CA 3.3Å; Y700-V817 HydrophobicContact CD2-CG1 4.1Å; V706-V817 HydrophobicContact CG1-CG1 4.06Å; V706-V817 HydrophobicContact CG1-CG2 3.97Å; V706-V817 HydrophobicContact CG2-CG1 4.06Å; I708-V817 HydrophobicContact CD1-CG2 4.08Å; I708-V817 HydrophobicContact CG1-CG2 4.36Å; S786-V817 WeakPolarHBondContact CA-O 3.44Å; G787-V817 PolarHBondContact N-O 2.89Å; G787-V817 PolarHBondContact O-N 2.87Å; Y789-V817 HydrophobicContact CD2-CB 3.99Å; Y789-V817 HydrophobicContact CD2-CG2 3.64Å; Y789-V817 HydrophobicContact CE2-CB 3.81Å; Y789-V817 HydrophobicContact CE2-CG1 4.49Å; Y789-V817 HydrophobicContact CE2-CG2 3.84Å; T815-V817 HydrophobicContact CG2-CG2 4.3Å; T815-V817 PolarHBondContact O-N 2.73Å; V817-V819 HydrophobicContact CG1-CG2 4.12Å
818	L	90.4	Very high	88.9	Confident	82 Å²	82	64.1 Å²	64.1	43%	0.429	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	116.8	171.6	177.8	65.2	0	0	0	108.5	L698 V699 Y700 K820	L698-L818 PolarHBondContact O-N 2.87Å; V699-L818 WeakPolarHBondContact CA-O 3.25Å; Y700-L818 PolarHBondContact N-O 3.05Å; L818-K820 HydrophobicContact CG-CG 4.48Å
819	V	88.9	Confident	88.7	Confident	7 Å²	7	65.1 Å²	65.1	4%	0.042	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	123.4	175.5	-173.4	0	0	0	0	108.2	Y700 E702 A781 E782 S786 V817	Y700-V819 CarbonylContact O-C 3.44Å; Y700-V819 WeakPolarHBondContact O-CA 3.28Å; E702-V819 HydrophobicContact CB-CG1 4.5Å; A781-V819 HydrophobicContact CB-CG1 4.22Å; A781-V819 HydrophobicContact CB-CG2 3.92Å; E782-V819 WeakPolarHBondContact O-CB 3.45Å; E782-V819 WeakPolarHBondContact O-CG2 3.17Å; S786-V819 PolarHBondContact OG-N 2.76Å; V817-V819 HydrophobicContact CG1-CG2 4.12Å
820	K	84.4	Confident	88.3	Confident	97 Å²	97	65 Å²	65	42%	0.422	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	152	177.4	-72.4	-170.7	169.2	-164.8	0	111.2	V699 Y700 Q701 E702 L818	V699-K820 HydrophobicContact CG1-CD 4.16Å; V699-K820 HydrophobicContact CG1-CG 4.3Å; Y700-K820 PolarHBondContact O-N 3.05Å; Q701-K820 CarbonylContact C-O 3.47Å; Q701-K820 WeakPolarHBondContact CA-O 3.41Å; Q701-K820 PolarHBondContact OE1-O 2.89Å; E702-K820 PolarHBondContact N-O 2.89Å; L818-K820 HydrophobicContact CG-CG 4.48Å
821	Q	82.1	Confident	87.8	Confident	89 Å²	89	68.4 Å²	68.4	42%	0.416	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-82	159.9	163.1	-64.7	-179.7	-53.9	0	0	110	Q701 Y954	Q701-Q821 PolarHBondContact OE1-O 2.91Å; Q821-Y954 VanDerWaalsContact NE2-CE2 3.33Å; Q821-Y954 PolarHBondContact NE2-OH 3.08Å
822	P	80.8	Confident	87.2	Confident	34 Å²	34	71.7 Å²	71.7	22%	0.221	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-57.5	153.9	173.1	-24.8	36.2	0	0	0	112.9	L946 L956	P822-L946 HydrophobicContact CG-CD2 3.8Å; P822-L956 HydrophobicContact CB-CD2 4.44Å
823	E	81.4	Confident	86.6	Confident	128 Å²	128	74.8 Å²	74.8	60%	0.598	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-82	134.7	177.5	-66.8	-178.9	172.8	0	0	110.6	Q825 S853	E823-Q825 PolarHBondContact O-N 3.36Å; E823-S853 WeakPolarHBondContact O-CB 3.32Å
824	P	82.6	Confident	86.2	Confident	88 Å²	88	79.6 Å²	79.6	57%	0.571	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-70.8	125.8	-178.1	27.4	-34	0	0	0	112.1	S853 A957	P824-S853 WeakPolarHBondContact CA-OG 3.46Å; P824-A957 HydrophobicContact CB-CB 3.93Å
825	Q	84.5	Confident	85.8	Confident	105 Å²	105	77 Å²	77	49%	0.491	37%	0.372	S	S	.	.			trans	-135.5	19.8	-177.4	-58.3	-169.1	14.1	0	0	113.7	E823 R827 S851 S853	E823-Q825 PolarHBondContact O-N 3.36Å; Q825-R827 PolarHBondContact O-N 2.76Å; Q825-S851 CarbonylContact O-C 3.45Å; Q825-S851 WeakPolarHBondContact O-CB 3.29Å; Q825-S851 PolarHBondContact O-OG 3.14Å; Q825-S853 PolarHBondContact N-OG 2.86Å
826	L	87.6	Confident	85.3	Confident	13 Å²	13	81.3 Å²	81.3	7%	0.068	40%	0.399	C	S	.	.			trans	-60	122.6	177.8	-177.2	65.1	0	0	0	112.4	I849 S851 F859 V942 E944 A957 N959	L826-I849 HydrophobicContact CD1-CG2 3.73Å; L826-S851 WeakPolarHBondContact CA-O 3.44Å; L826-F859 HydrophobicContact CD1-CD1 4.18Å; L826-F859 HydrophobicContact CD1-CE1 4.09Å; L826-V942 HydrophobicContact CD1-CG1 4.14Å; L826-V942 HydrophobicContact CD2-CB 4.39Å; L826-V942 HydrophobicContact CD2-CG1 4.14Å; L826-E944 HydrophobicContact CB-CB 4.49Å; L826-E944 HydrophobicContact CD1-CB 4.28Å; L826-E944 HydrophobicContact CD2-CB 4.04Å; L826-A957 HydrophobicContact CB-CB 3.57Å; L826-A957 HydrophobicContact CD2-CB 4.17Å; L826-N959 HydrophobicContact CD2-CB 3.98Å; L826-N959 HydrophobicContact CG-CB 4.1Å; L826-N959 PolarHBondContact O-ND2 3.46Å
827	R	88.2	Confident	84.9	Confident	156 Å²	156	73.9 Å²	73.9	59%	0.589	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.2	170.4	-63.2	178.9	-163.1	-173	4.9	110.5	Q825 I849 F850 S851	Q825-R827 PolarHBondContact O-N 2.76Å; R827-I849 CarbonylContact O-C 3.48Å; R827-I849 WeakPolarHBondContact O-CA 3.26Å; R827-I849 WeakPolarHBondContact O-CG2 3.04Å; R827-F850 HydrophobicContact CB-CB 4.3Å; R827-F850 PolarHBondContact O-N 2.87Å; R827-S851 WeakPolarHBondContact CB-OG 3.28Å; R827-S851 WeakPolarHBondContact CD-OG 3.42Å; R827-S851 VanDerWaalsContact CG-OG 3.23Å; R827-S851 WeakPolarHBondContact CG-OG 3.27Å; R827-S851 PolarHBondContact N-O 3.19Å
828	V	88.1	Confident	84.3	Confident	3 Å²	3	80.1 Å²	80.1	2%	0.018	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	163.1	178.6	-177.4	0	0	0	0	108	E830 N848 V942 N959	V828-E830 PolarHBondContact O-N 2.61Å; V828-E830 VanDerWaalsContact O-N 3.09Å; V828-N848 CarbonylContact C-O 3.51Å; V828-N848 WeakPolarHBondContact CA-O 3.38Å; V828-V942 HydrophobicContact CB-CG2 4.5Å; V828-V942 HydrophobicContact CG1-CG2 4.04Å; V828-V942 HydrophobicContact CG2-CB 3.7Å; V828-V942 HydrophobicContact CG2-CG1 4.35Å; V828-V942 HydrophobicContact CG2-CG2 3.54Å; V828-N959 HydrophobicContact CG2-CB 3.96Å
829	D	87	Confident	83.7	Confident	52 Å²	52	80.7 Å²	80.7	28%	0.278	40%	0.401	S	S	.	.			trans	-71.8	99.2	-179.2	-165.8	-4.5	0	0	0	112.3	L831 N848 F850 S961 G962	D829-L831 PolarHBondContact O-N 2.99Å; D829-L831 VanDerWaalsContact OD1-CB 3.31Å; D829-L831 WeakPolarHBondContact OD1-CB 3.43Å; D829-L831 PolarHBondContact OD1-N 3.37Å; D829-N848 HydrophobicContact CB-CB 4.05Å; D829-N848 PolarHBondContact N-O 2.83Å; D829-F850 HydrophobicContact CB-CD2 4.39Å; D829-F850 HydrophobicContact CB-CE2 3.7Å; D829-F850 HydrophobicContact CB-CZ 4.03Å; D829-F850 WeakPolarHBondContact OD1-CE2 3.5Å; D829-S961 CarbonylContact O-C 3.55Å; D829-S961 VanDerWaalsContact O-CA 3.22Å; D829-S961 WeakPolarHBondContact O-CA 3.39Å; D829-S961 VanDerWaalsContact O-CB 3.24Å; D829-S961 WeakPolarHBondContact O-CB 3.04Å; D829-G962 PolarHBondContact O-N 2.68Å
830	E	85.8	Confident	83.1	Confident	136 Å²	136	85 Å²	85	64%	0.636	43%	0.432	S	S	*	.			trans	-73.6	4.4	-178.1	-71.6	169.8	-150.6	0	0	114	V828 E832 G962	V828-E830 PolarHBondContact O-N 2.61Å; V828-E830 VanDerWaalsContact O-N 3.09Å; E830-E832 PolarHBondContact O-N 3.17Å; E830-G962 VanDerWaalsContact C-CA 3.49Å; E830-G962 WeakPolarHBondContact O-CA 3.27Å
831	L	83.3	Confident	83.1	Confident	105 Å²	105	82.5 Å²	82.5	55%	0.55	43%	0.427	S	S	.	.			trans	-78	114.4	-172.6	-160.1	131.1	0	0	0	113.3	D829 N833	D829-L831 PolarHBondContact O-N 2.99Å; D829-L831 VanDerWaalsContact OD1-CB 3.31Å; D829-L831 WeakPolarHBondContact OD1-CB 3.43Å; D829-L831 PolarHBondContact OD1-N 3.37Å; L831-N833 WeakPolarHBondContact CD2-ND2 3.42Å; L831-N833 PolarHBondContact O-ND2 3.29Å
832	E	83.4	Confident	83.1	Confident	116 Å²	116	81.4 Å²	81.4	54%	0.542	43%	0.429	S	S	.	.			trans	-65.4	136.3	171.2	-73.3	-159.7	135.3	0	0	111.3	E830 R937 V963	E830-E832 PolarHBondContact O-N 3.17Å; E832-R937 IonicContact OE1-CZ 2.82Å; E832-R937 IonicContact OE1-NH2 3.99Å; E832-R937 PolarHBondContact OE1-NH2 2.8Å; E832-V963 CarbonylContact C-O 3.55Å; E832-V963 VanDerWaalsContact CA-O 3.24Å; E832-V963 WeakPolarHBondContact CA-O 3.31Å; E832-V963 HydrophobicContact CG-CB 4.28Å
833	N	81.8	Confident	83.4	Confident	78 Å²	78	79.8 Å²	79.8	42%	0.417	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	154.8	-179.8	-77.7	-82.9	0	0	0	110.3	L831 V963 T964 I965	L831-N833 WeakPolarHBondContact CD2-ND2 3.42Å; L831-N833 PolarHBondContact O-ND2 3.29Å; N833-V963 PolarHBondContact N-O 3.09Å; N833-T964 HydrophobicContact CB-CG2 4.22Å; N833-T964 CarbonylContact O-C 3.51Å; N833-T964 WeakPolarHBondContact O-CA 3.47Å; N833-I965 PolarHBondContact O-N 2.84Å
834	N	82.9	Confident	83.7	Confident	105 Å²	105	80 Å²	80	56%	0.561	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	124.1	173.7	-170.1	-15.2	0	0	0	109.7	I965 N967	N834-I965 WeakPolarHBondContact CA-O 3.37Å; N834-I965 PolarHBondContact OD1-O 2.98Å; N834-N967 PolarHBondContact OD1-ND2 2.86Å
835	V	83.4	Confident	84	Confident	40 Å²	40	75.9 Å²	75.9	24%	0.242	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	100	-171.3	179.5	0	0	0	0	108.7	V837 T964 I965 V966 N967	V835-V837 HydrophobicContact CG1-CG1 4.09Å; V835-T964 HydrophobicContact CB-CG2 4.48Å; V835-T964 HydrophobicContact CG2-CG2 3.76Å; V835-I965 PolarHBondContact N-O 2.95Å; V835-V966 WeakPolarHBondContact O-CA 3.5Å; V835-N967 PolarHBondContact O-N 3.5Å
836	T	82	Confident	84	Confident	99 Å²	99	73.1 Å²	73.1	61%	0.607	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	127.4	167.7	33.1	0	0	0	0	110.6	N967	T836-N967 WeakPolarHBondContact CA-O 3.25Å; T836-N967 HydrophobicContact CG2-CB 3.76Å
837	V	81.6	Confident	84.1	Confident	14 Å²	14	72.6 Å²	72.6	9%	0.085	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	146.8	-177.7	-86.4	0	0	0	0	110.7	V835 S841 I843 A930 V966 N967 V968 L969	V835-V837 HydrophobicContact CG1-CG1 4.09Å; V837-S841 WeakPolarHBondContact CB-OG 3.18Å; V837-I843 HydrophobicContact CG1-CG1 4.35Å; V837-I843 HydrophobicContact CG2-CG1 3.94Å; V837-A930 HydrophobicContact CG2-CB 4.43Å; V837-V966 HydrophobicContact CG2-CG1 4.17Å; V837-N967 VanDerWaalsContact CG2-O 3.29Å; V837-N967 WeakPolarHBondContact CG2-O 3.4Å; V837-N967 PolarHBondContact N-O 2.77Å; V837-V968 HydrophobicContact CG2-CG2 3.99Å; V837-V968 WeakPolarHBondContact O-CA 3.38Å; V837-L969 PolarHBondContact O-N 3.23Å
838	E	79.1	Confident	84.2	Confident	135 Å²	135	66.5 Å²	66.5	63%	0.631	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	147.6	168.4	-64.5	-172.7	170	0	0	109.7	S840 S841	E838-S840 PolarHBondContact O-N 3.12Å; E838-S841 PolarHBondContact N-OG 3.18Å; E838-S841 WeakPolarHBondContact O-CB 3.48Å; E838-S841 PolarHBondContact O-N 3.36Å; E838-S841 PolarHBondContact O-OG 2.86Å
839	E	77.8	Confident	84.3	Confident	94 Å²	94	66.6 Å²	66.6	44%	0.439	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	137	174.1	-175.6	167.5	-145.8	0	0	111.1	S841 V968 L969	E839-S841 VanDerWaalsContact C-N 3.33Å; E839-S841 PolarHBondContact O-N 3.49Å; E839-V968 HydrophobicContact CB-CG1 4.3Å; E839-L969 PolarHBondContact N-O 2.77Å
840	S	77.5	Confident	84.3	Confident	99 Å²	99	70.4 Å²	70.4	69%	0.692	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	-2.2	-171.2	78.9	0	0	0	0	118.4	E838 A930	E838-S840 PolarHBondContact O-N 3.12Å; S840-A930 PolarHBondContact N-O 2.54Å
841	S	83.2	Confident	84.3	Confident	44 Å²	44	65.5 Å²	65.5	31%	0.308	36%	0.358	S	S	.	.	S	Bend	trans	-78.2	-172	171.5	71.2	0	0	0	0	113.1	V837 E838 E839 G929 A930	V837-S841 WeakPolarHBondContact CB-OG 3.18Å; E838-S841 PolarHBondContact N-OG 3.18Å; E838-S841 WeakPolarHBondContact O-CB 3.48Å; E838-S841 PolarHBondContact O-N 3.36Å; E838-S841 PolarHBondContact O-OG 2.86Å; E839-S841 VanDerWaalsContact C-N 3.33Å; E839-S841 PolarHBondContact O-N 3.49Å; S841-G929 PolarHBondContact O-N 3.19Å; S841-A930 WeakPolarHBondContact O-CB 3.34Å; S841-A930 PolarHBondContact O-N 2.99Å
842	S	84	Confident	84.5	Confident	65 Å²	65	63.5 Å²	63.5	46%	0.455	35%	0.346	S	S	.	.			trans	-114.8	126.1	-174.5	61.3	0	0	0	0	113	I927	S842-I927 CarbonylContact C-O 3.52Å; S842-I927 WeakPolarHBondContact CA-O 3.36Å
843	I	86.9	Confident	84.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	134.9	174.5	-58.2	149.4	0	0	0	108.5	V837 L845 T926 I927 A930 D934 V966	V837-I843 HydrophobicContact CG1-CG1 4.35Å; V837-I843 HydrophobicContact CG2-CG1 3.94Å; I843-L845 HydrophobicContact CG2-CD2 3.92Å; I843-L845 HydrophobicContact CG2-CG 4.15Å; I843-T926 CarbonylContact O-C 3.53Å; I843-T926 VanDerWaalsContact O-CA 3.24Å; I843-T926 WeakPolarHBondContact O-CA 3.49Å; I843-T926 WeakPolarHBondContact O-CG2 3.22Å; I843-I927 HydrophobicContact CB-CB 4.23Å; I843-I927 HydrophobicContact CD1-CB 4.33Å; I843-I927 PolarHBondContact N-O 3.09Å; I843-I927 PolarHBondContact O-N 3.21Å; I843-A930 HydrophobicContact CD1-CB 3.7Å; I843-A930 HydrophobicContact CG1-CB 4Å; I843-D934 HydrophobicContact CD1-CB 3.85Å; I843-V966 HydrophobicContact CD1-CG1 3.7Å; I843-V966 HydrophobicContact CG1-CG1 3.76Å; I843-V966 HydrophobicContact CG2-CG1 4.02Å; I843-V966 HydrophobicContact CG2-CG2 3.73Å
844	R	87.2	Confident	84.7	Confident	132 Å²	132	56 Å²	56	50%	0.498	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.3	173.7	-168.7	176.6	-170.9	-179.5	8.2	111.3	E916 S924	R844-E916 IonicContact CZ-OE2 3.55Å; R844-E916 IonicContact NH2-OE2 3.45Å; R844-E916 PolarHBondContact NH2-OE2 3.42Å; R844-S924 PolarHBondContact NE-OG 2.99Å; R844-S924 PolarHBondContact NH2-OG 2.81Å
845	L	87.9	Confident	84.5	Confident	3 Å²	3	56 Å²	56	2%	0.016	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	104.4	-176.3	-56.4	173.4	0	0	0	109.1	I843 W863 S924 L925 I927 Y938 T964 V966	I843-L845 HydrophobicContact CG2-CD2 3.92Å; I843-L845 HydrophobicContact CG2-CG 4.15Å; L845-W863 PolarHBondContact O-NE1 2.67Å; L845-S924 CarbonylContact O-C 3.53Å; L845-S924 VanDerWaalsContact O-CA 3.29Å; L845-S924 WeakPolarHBondContact O-CA 3.5Å; L845-L925 HydrophobicContact CB-CB 4.42Å; L845-L925 HydrophobicContact CD1-CD2 4.37Å; L845-L925 PolarHBondContact N-O 2.88Å; L845-L925 PolarHBondContact O-N 3.3Å; L845-I927 HydrophobicContact CD1-CD1 4.04Å; L845-Y938 HydrophobicContact CD1-CD1 3.29Å; L845-Y938 HydrophobicContact CD1-CE1 3.84Å; L845-Y938 HydrophobicContact CD1-CG 3.7Å; L845-Y938 HydrophobicContact CD2-CD1 4.38Å; L845-Y938 HydrophobicContact CD2-CD2 4.36Å; L845-Y938 HydrophobicContact CD2-CG 3.92Å; L845-Y938 HydrophobicContact CG-CD1 4.47Å; L845-Y938 HydrophobicContact CG-CG 4.48Å; L845-T964 HydrophobicContact CD2-CG2 3.76Å; L845-V966 HydrophobicContact CD2-CG2 4.12Å
846	G	85.8	Confident	84.5	Confident	47 Å²	47	59.2 Å²	59.2	49%	0.485	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	150.8	175.4	0	0	0	0	0	112.3
847	C	89.2	Confident	84.6	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.014	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	109.8	169.7	-177	0	0	0	0	107.7	V861 W863 Y923 C940	C847-V861 HydrophobicContact CB-CG1 4.23Å; C847-V861 WeakPolarHBondContact SG-CG1 3.3Å; C847-W863 HydrophobicContact CB-CZ2 3.7Å; C847-Y923 CarbonylContact C-O 3.59Å; C847-Y923 PolarHBondContact N-O 2.7Å; C847-Y923 PolarHBondContact O-N 2.84Å; C847-C940 HydrophobicContact CB-CB 3.59Å; C847-C940 WeakPolarHBondContact CB-SG 3.49Å; C847-C940 WeakPolarHBondContact SG-CB 3.4Å; C847-C940 CovalentContact SG-SG 2.03Å; C847-C940 PolarHBondContact SG-SG 3.01Å
848	N	90.1	Very high	84.9	Confident	28 Å²	28	59.2 Å²	59.2	15%	0.15	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	133	-170.7	-170.1	71.8	0	0	0	110.6	V828 D829 F850 Q922	V828-N848 CarbonylContact C-O 3.51Å; V828-N848 WeakPolarHBondContact CA-O 3.38Å; D829-N848 HydrophobicContact CB-CB 4.05Å; D829-N848 PolarHBondContact N-O 2.83Å; N848-F850 WeakPolarHBondContact ND2-CD1 3.35Å; N848-F850 WeakPolarHBondContact ND2-CE1 3.5Å; N848-Q922 WeakPolarHBondContact OD1-CB 3.02Å
849	I	89.6	Confident	85.4	Confident	5 Å²	5	53 Å²	53	3%	0.026	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	108.7	-174.5	-57.6	171.4	0	0	0	108.7	L826 R827 S851 F859 D921 Y923 V942	L826-I849 HydrophobicContact CD1-CG2 3.73Å; R827-I849 CarbonylContact O-C 3.48Å; R827-I849 WeakPolarHBondContact O-CA 3.26Å; R827-I849 WeakPolarHBondContact O-CG2 3.04Å; I849-S851 WeakPolarHBondContact CG2-O 3.46Å; I849-F859 HydrophobicContact CD1-CB 3.86Å; I849-F859 HydrophobicContact CD1-CD1 3.93Å; I849-F859 HydrophobicContact CD1-CD2 3.55Å; I849-F859 HydrophobicContact CD1-CE1 4.39Å; I849-F859 HydrophobicContact CD1-CE2 4.06Å; I849-F859 HydrophobicContact CD1-CG 3.48Å; I849-F859 VanDerWaalsContact CD1-CG 3.48Å; I849-F859 HydrophobicContact CD1-CZ 4.46Å; I849-F859 HydrophobicContact CG2-CE1 4.36Å; I849-F859 HydrophobicContact CG2-CZ 4.37Å; I849-D921 HydrophobicContact CB-CB 4.15Å; I849-D921 WeakPolarHBondContact CB-O 3.09Å; I849-D921 WeakPolarHBondContact CG1-O 3.28Å; I849-D921 PolarHBondContact N-O 2.95Å; I849-Y923 HydrophobicContact CD1-CD2 4.37Å; I849-Y923 HydrophobicContact CD1-CE2 3.91Å; I849-V942 HydrophobicContact CD1-CG1 3.69Å; I849-V942 HydrophobicContact CG1-CG1 4.2Å; I849-V942 HydrophobicContact CG1-CG2 4.4Å
850	F	87.2	Confident	86	Confident	131 Å²	131	48.6 Å²	48.6	58%	0.575	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	-23.3	-175.3	-71.5	-50.2	0	0	0	114.6	R827 D829 N848	R827-F850 HydrophobicContact CB-CB 4.3Å; R827-F850 PolarHBondContact O-N 2.87Å; D829-F850 HydrophobicContact CB-CD2 4.39Å; D829-F850 HydrophobicContact CB-CE2 3.7Å; D829-F850 HydrophobicContact CB-CZ 4.03Å; D829-F850 WeakPolarHBondContact OD1-CE2 3.5Å; N848-F850 WeakPolarHBondContact ND2-CD1 3.35Å; N848-F850 WeakPolarHBondContact ND2-CE1 3.5Å
851	S	87	Confident	86.5	Confident	33 Å²	33	43.9 Å²	43.9	23%	0.231	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	155.4	173.4	58.5	0	0	0	0	112.1	Q825 L826 R827 I849	Q825-S851 CarbonylContact O-C 3.45Å; Q825-S851 WeakPolarHBondContact O-CB 3.29Å; Q825-S851 PolarHBondContact O-OG 3.14Å; L826-S851 WeakPolarHBondContact CA-O 3.44Å; R827-S851 WeakPolarHBondContact CB-OG 3.28Å; R827-S851 WeakPolarHBondContact CD-OG 3.42Å; R827-S851 VanDerWaalsContact CG-OG 3.23Å; R827-S851 WeakPolarHBondContact CG-OG 3.27Å; R827-S851 PolarHBondContact N-O 3.19Å; I849-S851 WeakPolarHBondContact CG2-O 3.46Å
852	Q	87.2	Confident	86.8	Confident	63 Å²	63	42.7 Å²	42.7	29%	0.294	23%	0.229	S	C	.	.			trans	-134.7	152.5	-178.6	65	-173.1	85.7	0	0	110.5	S854 F859	Q852-S854 PolarHBondContact NE2-O 3.4Å; Q852-F859 HydrophobicContact CB-CE1 3.83Å; Q852-F859 HydrophobicContact CB-CZ 3.59Å; Q852-F859 HydrophobicContact CG-CZ 4.3Å
853	S	85.3	Confident	87	Confident	19 Å²	19	39.7 Å²	39.7	13%	0.133	21%	0.207	C	C	.	.	S	Bend	trans	-77.5	-26.4	-173.5	-46.8	0	0	0	0	113.8	E823 P824 Q825 E944 L956	E823-S853 WeakPolarHBondContact O-CB 3.32Å; P824-S853 WeakPolarHBondContact CA-OG 3.46Å; Q825-S853 PolarHBondContact N-OG 2.86Å; S853-E944 WeakPolarHBondContact CA-OE1 3.42Å; S853-E944 VanDerWaalsContact CB-OE1 3.27Å; S853-E944 WeakPolarHBondContact CB-OE1 3.24Å; S853-E944 VanDerWaalsContact CB-OE2 3.28Å; S853-E944 WeakPolarHBondContact CB-OE2 3.36Å; S853-E944 VanDerWaalsContact N-CD 3.32Å; S853-E944 PolarHBondContact N-OE1 2.61Å; S853-E944 PolarHBondContact N-OE2 3.37Å; S853-E944 VanDerWaalsContact OG-CD 3.28Å; S853-E944 PolarHBondContact OG-OE1 2.93Å; S853-E944 PolarHBondContact OG-OE2 3.03Å; S853-L956 VanDerWaalsContact CB-CD2 3.48Å
854	S	83	Confident	87	Confident	17 Å²	17	41.9 Å²	41.9	12%	0.119	22%	0.216	C	C	.	.			trans	-148.2	145	177.3	173	0	0	0	0	110.8	Q852 D856 S857 E944	Q852-S854 PolarHBondContact NE2-O 3.4Å; S854-D856 PolarHBondContact O-N 3.41Å; S854-D856 PolarHBondContact OG-N 2.99Å; S854-S857 WeakPolarHBondContact CB-OG 3.21Å; S854-S857 VanDerWaalsContact O-CB 3.27Å; S854-S857 WeakPolarHBondContact O-CB 3.43Å; S854-S857 PolarHBondContact O-N 2.98Å; S854-S857 PolarHBondContact O-OG 3.41Å; S854-S857 VanDerWaalsContact O-OG 3.12Å; S854-E944 PolarHBondContact N-OE1 3.07Å
855	P	80.3	Confident	86.9	Confident	107 Å²	107	35.7 Å²	35.7	70%	0.695	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-27.8	175	26.9	-36.1	0	0	0	113.2	S857	P855-S857 VanDerWaalsContact C-N 3.3Å
856	D	82	Confident	86.6	Confident	107 Å²	107	38.3 Å²	38.3	57%	0.572	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-4.3	-179.5	-67.9	-63.8	0	0	0	113.7	S854 R858 L946	S854-D856 PolarHBondContact O-N 3.41Å; S854-D856 PolarHBondContact OG-N 2.99Å; D856-R858 PolarHBondContact O-NH1 2.66Å; D856-R858 VanDerWaalsContact O-NH1 3.08Å; D856-L946 HydrophobicContact CB-CD1 3.98Å
857	S	85.2	Confident	86.1	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.014	20%	0.201	C	C	.	.			trans	-60.6	155.4	178.6	-65.9	0	0	0	0	114	S854 P855 E944 W945	S854-S857 WeakPolarHBondContact CB-OG 3.21Å; S854-S857 VanDerWaalsContact O-CB 3.27Å; S854-S857 WeakPolarHBondContact O-CB 3.43Å; S854-S857 PolarHBondContact O-N 2.98Å; S854-S857 PolarHBondContact O-OG 3.41Å; S854-S857 VanDerWaalsContact O-OG 3.12Å; P855-S857 VanDerWaalsContact C-N 3.3Å; S857-E944 WeakPolarHBondContact CB-OE1 3.4Å; S857-E944 PolarHBondContact OG-OE1 2.69Å; S857-W945 CarbonylContact C-O 3.46Å; S857-W945 VanDerWaalsContact CA-O 3.31Å; S857-W945 WeakPolarHBondContact CA-O 3.39Å
858	R	87.6	Confident	84.6	Confident	110 Å²	110	44.9 Å²	44.9	42%	0.415	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	150.3	173	-61	-63.7	175.2	-95.4	-4.7	108.9	D856 H892 W945 W953	D856-R858 PolarHBondContact O-NH1 2.66Å; D856-R858 VanDerWaalsContact O-NH1 3.08Å; R858-H892 HydrophobicContact CB-CB 3.77Å; R858-W945 PolarHBondContact N-O 2.87Å; R858-W945 PolarHBondContact O-N 3.04Å; R858-W953 HydrophobicContact CB-CH2 4.22Å; R858-W953 HydrophobicContact CB-CZ3 4.24Å; R858-W953 HydrophobicContact CG-CH2 3.52Å; R858-W953 HydrophobicContact CG-CZ2 4.36Å; R858-W953 HydrophobicContact CG-CZ3 3.96Å
859	F	89.4	Confident	82.5	Confident	5 Å²	5	50.4 Å²	50.4	2%	0.022	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	128.2	-176.1	-39.5	-77.4	0	0	0	112	L826 I849 Q852 V861 Y923 V942 E943 E944	L826-F859 HydrophobicContact CD1-CD1 4.18Å; L826-F859 HydrophobicContact CD1-CE1 4.09Å; I849-F859 HydrophobicContact CD1-CB 3.86Å; I849-F859 HydrophobicContact CD1-CD1 3.93Å; I849-F859 HydrophobicContact CD1-CD2 3.55Å; I849-F859 HydrophobicContact CD1-CE1 4.39Å; I849-F859 HydrophobicContact CD1-CE2 4.06Å; I849-F859 HydrophobicContact CD1-CG 3.48Å; I849-F859 VanDerWaalsContact CD1-CG 3.48Å; I849-F859 HydrophobicContact CD1-CZ 4.46Å; I849-F859 HydrophobicContact CG2-CE1 4.36Å; I849-F859 HydrophobicContact CG2-CZ 4.37Å; Q852-F859 HydrophobicContact CB-CE1 3.83Å; Q852-F859 HydrophobicContact CB-CZ 3.59Å; Q852-F859 HydrophobicContact CG-CZ 4.3Å; F859-V861 HydrophobicContact CB-CG2 4.28Å; F859-Y923 HydrophobicContact CD2-CE2 4.44Å; F859-Y923 PolarHBondContact O-OH 2.03Å; F859-V942 HydrophobicContact CB-CG1 3.99Å; F859-V942 HydrophobicContact CD1-CG1 4.31Å; F859-V942 HydrophobicContact CG-CG1 4.42Å; F859-E943 CarbonylContact C-O 3.55Å; F859-E943 WeakPolarHBondContact CA-O 3.46Å; F859-E944 HydrophobicContact CD1-CB 4.05Å; F859-E944 HydrophobicContact CD1-CG 4.02Å; F859-E944 HydrophobicContact CE1-CB 4.21Å; F859-E944 HydrophobicContact CE1-CG 3.79Å
860	S	89.9	Confident	80.3	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.014	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	135.7	157.7	-53.7	0	0	0	0	107.8	F862 I890 H892 V942 E943 W945	S860-F862 VanDerWaalsContact CB-CE2 3.49Å; S860-I890 CarbonylContact C-O 3.58Å; S860-I890 VanDerWaalsContact CA-O 3.24Å; S860-I890 WeakPolarHBondContact CA-O 3.44Å; S860-H892 PolarHBondContact OG-N 3.42Å; S860-H892 VanDerWaalsContact OG-N 3.14Å; S860-H892 PolarHBondContact OG-ND1 2.84Å; S860-V942 WeakPolarHBondContact O-CA 3.42Å; S860-E943 WeakPolarHBondContact CB-OE2 3.47Å; S860-E943 PolarHBondContact N-O 2.79Å; S860-E943 PolarHBondContact O-N 2.77Å; S860-E943 PolarHBondContact OG-OE2 3.05Å; S860-W945 PolarHBondContact OG-NE1 3.34Å
861	V	89.1	Confident	78.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	131.5	178.7	-174.9	0	0	0	0	109.9	C847 F859 W863 S889 I890 Y923 C940 H941 V942	C847-V861 HydrophobicContact CB-CG1 4.23Å; C847-V861 WeakPolarHBondContact SG-CG1 3.3Å; F859-V861 HydrophobicContact CB-CG2 4.28Å; V861-W863 HydrophobicContact CB-CH2 4.08Å; V861-W863 HydrophobicContact CB-CZ3 4.12Å; V861-W863 HydrophobicContact CG1-CE3 4.28Å; V861-W863 HydrophobicContact CG1-CH2 3.39Å; V861-W863 HydrophobicContact CG1-CZ2 3.91Å; V861-W863 HydrophobicContact CG1-CZ3 3.63Å; V861-S889 CarbonylContact O-C 3.51Å; V861-S889 WeakPolarHBondContact O-CA 3.32Å; V861-I890 HydrophobicContact CB-CG2 4.06Å; V861-I890 PolarHBondContact N-O 3.43Å; V861-I890 PolarHBondContact O-N 2.99Å; V861-Y923 HydrophobicContact CB-CD1 3.93Å; V861-Y923 HydrophobicContact CB-CE1 4.01Å; V861-Y923 HydrophobicContact CB-CG 4.43Å; V861-Y923 HydrophobicContact CG1-CD1 4.39Å; V861-Y923 HydrophobicContact CG2-CD1 3.67Å; V861-Y923 HydrophobicContact CG2-CD2 4.05Å; V861-Y923 HydrophobicContact CG2-CE1 3.45Å; V861-Y923 VanDerWaalsContact CG2-CE1 3.45Å; V861-Y923 HydrophobicContact CG2-CE2 3.88Å; V861-Y923 HydrophobicContact CG2-CG 3.97Å; V861-C940 HydrophobicContact CG1-CB 4.25Å; V861-H941 WeakPolarHBondContact CA-O 3.37Å; V861-V942 HydrophobicContact CG1-CG2 4.3Å; V861-V942 HydrophobicContact CG2-CG1 4.3Å; V861-V942 HydrophobicContact CG2-CG2 4.2Å
862	F	88.7	Confident	76.4	Confident	18 Å²	18	66.6 Å²	66.6	8%	0.079	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	142.5	-175.6	-49	-105.5	0	0	0	108.4	S860 Y864 F888 N898 C940 H941 E943	S860-F862 VanDerWaalsContact CB-CE2 3.49Å; F862-Y864 HydrophobicContact CB-CD2 4.29Å; F862-Y864 HydrophobicContact CB-CE2 3.69Å; F862-Y864 HydrophobicContact CG-CE2 4.49Å; F862-F888 CarbonylContact C-O 3.49Å; F862-F888 WeakPolarHBondContact CA-O 3.4Å; F862-N898 WeakPolarHBondContact CE1-O 3.38Å; F862-C940 CarbonylContact O-C 3.53Å; F862-C940 WeakPolarHBondContact O-CA 3.24Å; F862-C940 VanDerWaalsContact O-CB 3.32Å; F862-C940 WeakPolarHBondContact O-CB 3.49Å; F862-H941 HydrophobicContact CB-CB 4.34Å; F862-H941 HydrophobicContact CD2-CB 4.48Å; F862-H941 AromaticContact CD2-CD2 3.85Å; F862-H941 PolarHBondContact N-O 3.47Å; F862-H941 PolarHBondContact O-N 2.79Å; F862-E943 HydrophobicContact CE2-CG 3.98Å
863	W	88.4	Confident	74.2	Confident	2 Å²	2	71.4 Å²	71.4	1%	0.008	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.3	170.1	-72.3	-102.6	0	0	0	109.1	L845 C847 V861 V887 F888 I890 F915 Y923 L925 Y939 C940	L845-W863 PolarHBondContact O-NE1 2.67Å; C847-W863 HydrophobicContact CB-CZ2 3.7Å; V861-W863 HydrophobicContact CB-CH2 4.08Å; V861-W863 HydrophobicContact CB-CZ3 4.12Å; V861-W863 HydrophobicContact CG1-CE3 4.28Å; V861-W863 HydrophobicContact CG1-CH2 3.39Å; V861-W863 HydrophobicContact CG1-CZ2 3.91Å; V861-W863 HydrophobicContact CG1-CZ3 3.63Å; W863-V887 HydrophobicContact CB-CB 4.27Å; W863-V887 WeakPolarHBondContact O-CB 3.35Å; W863-V887 PolarHBondContact O-N 2.84Å; W863-F888 HydrophobicContact CE3-CB 4.26Å; W863-F888 AromaticContact CE3-CD1 3.92Å; W863-F888 HydrophobicContact CE3-CD1 3.92Å; W863-F888 AromaticContact CZ3-CD1 3.93Å; W863-F888 HydrophobicContact CZ3-CD1 3.93Å; W863-F888 PolarHBondContact N-O 2.86Å; W863-I890 HydrophobicContact CZ3-CG2 4.43Å; W863-F915 HydrophobicContact CH2-CD2 4.16Å; W863-F915 AromaticContact CH2-CE2 3.79Å; W863-F915 HydrophobicContact CH2-CE2 3.79Å; W863-F915 HydrophobicContact CZ3-CD2 4.32Å; W863-F915 HydrophobicContact CZ3-CE2 4.16Å; W863-Y923 HydrophobicContact CH2-CD1 4.33Å; W863-L925 HydrophobicContact CB-CD2 3.8Å; W863-L925 HydrophobicContact CD2-CB 3.9Å; W863-L925 HydrophobicContact CD2-CD2 4Å; W863-L925 HydrophobicContact CE3-CB 4.47Å; W863-L925 HydrophobicContact CE3-CD2 4.44Å; W863-L925 HydrophobicContact CG-CB 4.15Å; W863-L925 HydrophobicContact CG-CD2 3.7Å; W863-L925 HydrophobicContact CZ2-CB 4.25Å; W863-Y939 WeakPolarHBondContact CA-O 3.31Å; W863-C940 HydrophobicContact CG-CB 4.49Å
864	Y	86.8	Confident	72.3	Confident	47 Å²	47	79.4 Å²	79.4	18%	0.184	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	152.8	175.9	-71	-92	0	0	0	109.8	F862 R884 D885 C886 Y938 Y939 H941	F862-Y864 HydrophobicContact CB-CD2 4.29Å; F862-Y864 HydrophobicContact CB-CE2 3.69Å; F862-Y864 HydrophobicContact CG-CE2 4.49Å; Y864-R884 HydrophobicContact CD1-CB 4.24Å; Y864-D885 WeakPolarHBondContact CA-O 3.49Å; Y864-C886 HydrophobicContact CD1-CB 3.86Å; Y864-C886 HydrophobicContact CE1-CB 3.62Å; Y864-Y938 VanDerWaalsContact O-CA 3.29Å; Y864-Y938 WeakPolarHBondContact O-CA 3.44Å; Y864-Y939 HydrophobicContact CD2-CE2 4.07Å; Y864-Y939 HydrophobicContact CG-CE2 4.36Å; Y864-Y939 AromaticContact CG-CZ 3.99Å; Y864-Y939 PolarHBondContact N-O 2.76Å; Y864-Y939 PolarHBondContact O-N 2.83Å; Y864-H941 HydrophobicContact CD2-CB 4.27Å; Y864-H941 HydrophobicContact CE2-CB 3.97Å
865	V	85.7	Confident	70.3	Confident	2 Å²	2	85.5 Å²	85.5	1%	0.012	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	131.7	166.5	66.7	0	0	0	0	110.5	R867 R884 D885 V887 R937 Y938	V865-R867 HydrophobicContact CG2-CG 4.24Å; V865-R884 CarbonylContact O-C 3.53Å; V865-R884 WeakPolarHBondContact O-CA 3.37Å; V865-D885 HydrophobicContact CG1-CB 3.79Å; V865-D885 PolarHBondContact N-O 2.87Å; V865-D885 PolarHBondContact O-N 2.9Å; V865-V887 HydrophobicContact CB-CG2 3.92Å; V865-V887 HydrophobicContact CG1-CG2 3.78Å; V865-R937 WeakPolarHBondContact CA-O 3.36Å; V865-Y938 HydrophobicContact CB-CD1 3.71Å; V865-Y938 HydrophobicContact CB-CD2 4.44Å; V865-Y938 HydrophobicContact CB-CE1 3.59Å; V865-Y938 HydrophobicContact CB-CE2 4.31Å; V865-Y938 HydrophobicContact CB-CG 4.16Å; V865-Y938 HydrophobicContact CG1-CE1 4.29Å; V865-Y938 HydrophobicContact CG2-CD1 3.97Å; V865-Y938 HydrophobicContact CG2-CD2 3.79Å; V865-Y938 HydrophobicContact CG2-CE1 3.79Å; V865-Y938 HydrophobicContact CG2-CE2 3.56Å; V865-Y938 HydrophobicContact CG2-CG 3.99Å
866	D	82.1	Confident	68.2	Low	57 Å²	57	89.2 Å²	89.2	31%	0.305	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.9	172.2	163.7	30.4	0	0	0	108.8	R937	D866-R937 HydrophobicContact CB-CB 3.97Å; D866-R937 PolarHBondContact N-O 2.7Å; D866-R937 PolarHBondContact O-N 3.21Å; D866-R937 IonicContact OD2-NE 2.98Å
867	R	74.6	Confident	66.3	Low	93 Å²	93	90.4 Å²	90.4	35%	0.351	46%	0.459	S	S	.	.			trans	-126.7	98.5	-171.1	-74.1	178.3	168.8	142.6	-5.7	110.6	V865 D885 A933	V865-R867 HydrophobicContact CG2-CG 4.24Å; R867-D885 IonicContact CZ-OD2 3.86Å; R867-D885 IonicContact NH1-OD2 3.61Å; R867-D885 PolarHBondContact NH1-OD2 3.44Å; R867-A933 PolarHBondContact NH2-O 2.84Å
868	S	57.6	Low	63.9	Low	94 Å²	94	93.2 Å²	93.2	66%	0.657	49%	0.489	S	S	*	.			trans	-98.8	99.4	-179.9	61.1	0	0	0	0	112.3
869	D	46.8	Very low	61.6	Low	145 Å²	145	97.3 Å²	97.3	78%	0.775	51%	0.513	S	S	*	.			trans	-147.9	156.2	161.9	-95.2	-40.6	0	0	0	111.7	K883	D869-K883 PolarHBondContact O-NZ 3.49Å; D869-K883 VanDerWaalsContact O-NZ 3.15Å
870	D	41.9	Very low	59	Low	157 Å²	157	103.9 Å²	103.9	84%	0.84	55%	0.548	S	S	*	.			trans	53.3	136.8	-179.8	-77.2	-23.2	0	0	0	120.7
871	E	47.8	Very low	56.8	Low	187 Å²	187	108 Å²	108	87%	0.874	57%	0.57	S	S	*	*			trans	-96	124.8	179.3	-56.1	175.1	135.2	0	0	110.8
872	D	44.5	Very low	54.9	Low	165 Å²	165	116.1 Å²	116.1	88%	0.882	61%	0.613	S	S	*	*			trans	177.2	154.3	139	-105.4	-27.3	0	0	0	111.4
873	I	42.6	Very low	53.2	Low	164 Å²	164	121.2 Å²	121.2	84%	0.841	64%	0.635	S	S	*	*			trans	82.8	96.9	179.5	-49.5	171.9	0	0	0	115.7
874	E	45.1	Very low	52.3	Low	187 Å²	187	126.8 Å²	126.8	87%	0.874	66%	0.656	S	S	*	*			trans	-88.1	124.2	154.7	-59.6	179.8	126.6	0	0	109.6
875	D	39.7	Very low	51.7	Low	145 Å²	145	128.5 Å²	128.5	78%	0.775	67%	0.669	S	S	*	*			trans	173.8	74.9	143.9	-106.6	-21.3	0	0	0	114.6
876	Q	36.8	Very low	51.5	Low	184 Å²	184	129.7 Å²	129.7	86%	0.86	68%	0.677	S	S	*	*			trans	172.6	141.1	134.5	-99.5	154.8	94.5	0	0	113.2
877	P	42.2	Very low	51.4	Low	132 Å²	132	127.6 Å²	127.6	86%	0.857	67%	0.666	S	S	*	*			trans	-93.2	110.5	174	33.9	-30.1	0	0	0	112.1
878	G	35.4	Very low	51.8	Low	62 Å²	62	123.8 Å²	123.8	64%	0.639	65%	0.652	S	S	*	*	S	Bend	trans	-175.4	100.5	176	0	0	0	0	0	114.6
879	E	38.5	Very low	53.1	Low	196 Å²	196	119.3 Å²	119.3	92%	0.916	62%	0.621	S	S	*	*			trans	55.5	65.4	170	-62	-170.9	131.6	0	0	116	D881	E879-D881 VanDerWaalsContact C-N 3.35Å; E879-D881 PolarHBondContact O-N 2.56Å
880	D	35.2	Very low	54.9	Low	142 Å²	142	112.7 Å²	112.7	76%	0.759	59%	0.585	S	S	*	*			trans	-63	82	169.5	-59.6	-75.7	0	0	0	113.6
881	D	43.5	Very low	56.9	Low	89 Å²	89	105.3 Å²	105.3	48%	0.476	55%	0.546	S	S	.	.			trans	-109.9	-17.2	159.2	-149.2	32.2	0	0	0	111.9	E879 K883 R884	E879-D881 VanDerWaalsContact C-N 3.35Å; E879-D881 PolarHBondContact O-N 2.56Å; D881-K883 VanDerWaalsContact C-N 3.26Å; D881-K883 PolarHBondContact O-N 3.07Å; D881-R884 PolarHBondContact O-N 2.75Å; D881-R884 VanDerWaalsContact O-N 3.16Å; D881-R884 WeakPolarHBondContact OD1-CD 3.23Å; D881-R884 IonicContact OD1-CZ 2.8Å; D881-R884 IonicContact OD1-NE 3.37Å; D881-R884 IonicContact OD1-NH1 2.8Å; D881-R884 PolarHBondContact OD1-NH1 2.83Å
882	D	48.2	Very low	58.6	Low	170 Å²	170	98.1 Å²	98.1	91%	0.909	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	59.9	-176.7	-87.8	-19.9	0	0	0	114.5
883	K	53.8	Low	60.3	Low	126 Å²	126	93.9 Å²	93.9	55%	0.548	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.1	18.1	141.8	-113.5	177.7	-174.6	-175.5	0	112.7	D869 D881	D869-K883 PolarHBondContact O-NZ 3.49Å; D869-K883 VanDerWaalsContact O-NZ 3.15Å; D881-K883 VanDerWaalsContact C-N 3.26Å; D881-K883 PolarHBondContact O-N 3.07Å
884	R	69.6	Low	62	Low	119 Å²	119	88.8 Å²	88.8	45%	0.449	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	87.2	179.7	-62.5	179	-173.6	128.4	9.9	111.6	Y864 V865 D881 C886	Y864-R884 HydrophobicContact CD1-CB 4.24Å; V865-R884 CarbonylContact O-C 3.53Å; V865-R884 WeakPolarHBondContact O-CA 3.37Å; D881-R884 PolarHBondContact O-N 2.75Å; D881-R884 VanDerWaalsContact O-N 3.16Å; D881-R884 WeakPolarHBondContact OD1-CD 3.23Å; D881-R884 IonicContact OD1-CZ 2.8Å; D881-R884 IonicContact OD1-NE 3.37Å; D881-R884 IonicContact OD1-NH1 2.8Å; D881-R884 PolarHBondContact OD1-NH1 2.83Å; R884-C886 PolarHBondContact O-N 2.81Å
885	D	75.2	Confident	63.5	Low	83 Å²	83	84.8 Å²	84.8	44%	0.444	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	120.8	177	-72.5	-50	0	0	0	110.5	Y864 V865 R867 V887	Y864-D885 WeakPolarHBondContact CA-O 3.49Å; V865-D885 HydrophobicContact CG1-CB 3.79Å; V865-D885 PolarHBondContact N-O 2.87Å; V865-D885 PolarHBondContact O-N 2.9Å; R867-D885 IonicContact CZ-OD2 3.86Å; R867-D885 IonicContact NH1-OD2 3.61Å; R867-D885 PolarHBondContact NH1-OD2 3.44Å; D885-V887 PolarHBondContact O-N 2.81Å
886	C	80.6	Confident	65.2	Low	27 Å²	27	83.6 Å²	83.6	18%	0.182	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	115.7	173.6	-161	0	0	0	0	110.3	Y864 R884 C901	Y864-C886 HydrophobicContact CD1-CB 3.86Å; Y864-C886 HydrophobicContact CE1-CB 3.62Å; R884-C886 PolarHBondContact O-N 2.81Å; C886-C901 HydrophobicContact CB-CB 3.79Å; C886-C901 WeakPolarHBondContact CB-SG 3.43Å; C886-C901 WeakPolarHBondContact SG-CB 3.03Å; C886-C901 CovalentContact SG-SG 2.03Å; C886-C901 PolarHBondContact SG-SG 3.15Å
887	V	80.7	Confident	66.6	Low	13 Å²	13	76.1 Å²	76.1	8%	0.079	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-40.6	-168.8	-171.9	0	0	0	0	111.6	W863 V865 D885 F913 L925 I927 Y938	W863-V887 HydrophobicContact CB-CB 4.27Å; W863-V887 WeakPolarHBondContact O-CB 3.35Å; W863-V887 PolarHBondContact O-N 2.84Å; V865-V887 HydrophobicContact CB-CG2 3.92Å; V865-V887 HydrophobicContact CG1-CG2 3.78Å; D885-V887 PolarHBondContact O-N 2.81Å; V887-F913 HydrophobicContact CG1-CD1 4.13Å; V887-F913 HydrophobicContact CG1-CE1 3.46Å; V887-F913 VanDerWaalsContact CG1-CE1 3.46Å; V887-F913 HydrophobicContact CG1-CZ 4.04Å; V887-L925 HydrophobicContact CB-CD2 4.46Å; V887-L925 HydrophobicContact CG1-CD2 3.97Å; V887-I927 HydrophobicContact CG1-CD1 4.43Å; V887-Y938 HydrophobicContact CG1-CE1 4.38Å; V887-Y938 HydrophobicContact CG2-CD1 4.11Å; V887-Y938 HydrophobicContact CG2-CE1 3.81Å
888	F	83.1	Confident	67.2	Low	12 Å²	12	72.7 Å²	72.7	5%	0.053	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	150.4	-175.8	-168.9	-96	0	0	0	110.7	F862 W863 F896 F913 F915 L925	F862-F888 CarbonylContact C-O 3.49Å; F862-F888 WeakPolarHBondContact CA-O 3.4Å; W863-F888 HydrophobicContact CE3-CB 4.26Å; W863-F888 AromaticContact CE3-CD1 3.92Å; W863-F888 HydrophobicContact CE3-CD1 3.92Å; W863-F888 AromaticContact CZ3-CD1 3.93Å; W863-F888 HydrophobicContact CZ3-CD1 3.93Å; W863-F888 PolarHBondContact N-O 2.86Å; F888-F896 AromaticContact CE1-CD1 3.85Å; F888-F896 HydrophobicContact CE1-CD1 3.85Å; F888-F896 HydrophobicContact CE1-CE1 4.11Å; F888-F896 HydrophobicContact CE2-CD1 4.48Å; F888-F896 AromaticContact CZ-CD1 3.43Å; F888-F896 HydrophobicContact CZ-CD1 3.43Å; F888-F896 VanDerWaalsContact CZ-CD1 3.43Å; F888-F896 AromaticContact CZ-CE1 3.73Å; F888-F896 HydrophobicContact CZ-CE1 3.73Å; F888-F896 HydrophobicContact CZ-CG 4.2Å; F888-F913 HydrophobicContact CD2-CB 4.36Å; F888-F915 HydrophobicContact CD1-CD2 4.23Å; F888-F915 HydrophobicContact CE1-CB 3.72Å; F888-F915 AromaticContact CE1-CD2 3.56Å; F888-F915 HydrophobicContact CE1-CD2 3.56Å; F888-F915 HydrophobicContact CE1-CE2 4.36Å; F888-F915 AromaticContact CE1-CG 3.74Å; F888-F915 HydrophobicContact CE1-CG 3.74Å; F888-F915 HydrophobicContact CE2-CB 4.42Å; F888-F915 HydrophobicContact CZ-CB 3.58Å; F888-F915 HydrophobicContact CZ-CD2 4.3Å; F888-F915 HydrophobicContact CZ-CG 4.02Å; F888-L925 HydrophobicContact CB-CD1 3.92Å; F888-L925 HydrophobicContact CB-CD2 3.62Å; F888-L925 HydrophobicContact CB-CG 4.42Å; F888-L925 HydrophobicContact CD1-CD1 4.09Å; F888-L925 HydrophobicContact CD2-CD1 4.06Å; F888-L925 HydrophobicContact CG-CD1 3.76Å; F888-L925 HydrophobicContact CG-CD2 4.37Å
889	S	84.9	Confident	68.2	Low	0 Å²	0	72 Å²	72	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	153.3	168.4	72.9	0	0	0	0	113.8	V861 F896 G897 N898 C901	V861-S889 CarbonylContact O-C 3.51Å; V861-S889 WeakPolarHBondContact O-CA 3.32Å; S889-F896 WeakPolarHBondContact O-CA 3.49Å; S889-G897 PolarHBondContact O-N 2.95Å; S889-G897 WeakPolarHBondContact OG-CA 3.36Å; S889-N898 PolarHBondContact OG-N 3.36Å; S889-N898 PolarHBondContact OG-O 2.83Å; S889-C901 WeakPolarHBondContact OG-CB 3.5Å
890	I	84.6	Confident	69	Low	7 Å²	7	71 Å²	71	4%	0.036	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	129.4	168.2	-176	173.3	0	0	0	108.9	S860 V861 W863 A894 I895 F896 F915 Y923	S860-I890 CarbonylContact C-O 3.58Å; S860-I890 VanDerWaalsContact CA-O 3.24Å; S860-I890 WeakPolarHBondContact CA-O 3.44Å; V861-I890 HydrophobicContact CB-CG2 4.06Å; V861-I890 PolarHBondContact N-O 3.43Å; V861-I890 PolarHBondContact O-N 2.99Å; W863-I890 HydrophobicContact CZ3-CG2 4.43Å; I890-A894 HydrophobicContact CD1-CB 4.46Å; I890-I895 WeakPolarHBondContact CA-O 3.17Å; I890-F896 HydrophobicContact CB-CD1 4.15Å; I890-F896 HydrophobicContact CB-CE1 4.44Å; I890-F896 HydrophobicContact CD1-CD1 4.32Å; I890-F896 HydrophobicContact CD1-CE1 3.91Å; I890-F896 HydrophobicContact CG1-CD1 4.19Å; I890-F896 HydrophobicContact CG1-CE1 4.28Å; I890-F915 HydrophobicContact CB-CZ 4.47Å; I890-F915 HydrophobicContact CD1-CE1 3.64Å; I890-F915 HydrophobicContact CD1-CE2 4.46Å; I890-F915 HydrophobicContact CD1-CZ 3.58Å; I890-F915 HydrophobicContact CG2-CE2 3.91Å; I890-F915 HydrophobicContact CG2-CZ 3.94Å; I890-Y923 HydrophobicContact CG2-CD1 4.05Å; I890-Y923 HydrophobicContact CG2-CE1 3.88Å
891	G	83.8	Confident	70.4	Confident	1 Å²	1	64.4 Å²	64.4	1%	0.01	35%	0.35	C	S	.	.			trans	-78.4	166.7	178.4	0	0	0	0	0	113.9	D893 A894 I895	G891-D893 WeakPolarHBondContact CA-OD1 3.49Å; G891-D893 PolarHBondContact O-N 2.87Å; G891-A894 WeakPolarHBondContact O-CA 3.36Å; G891-A894 PolarHBondContact O-N 2.82Å; G891-I895 PolarHBondContact N-O 2.77Å
892	H	82.6	Confident	71.1	Confident	36 Å²	36	64.2 Å²	64.2	17%	0.167	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-20	171.9	62.8	-101.3	0	0	0	113.7	R858 S860 A894 W945 W953	R858-H892 HydrophobicContact CB-CB 3.77Å; S860-H892 PolarHBondContact OG-N 3.42Å; S860-H892 VanDerWaalsContact OG-N 3.14Å; S860-H892 PolarHBondContact OG-ND1 2.84Å; H892-A894 VanDerWaalsContact C-N 3.31Å; H892-W945 HydrophobicContact CB-CB 3.96Å; H892-W945 HydrophobicContact CB-CG 4Å; H892-W945 AromaticContact CE1-CD2 3.62Å; H892-W945 AromaticContact CE1-CE2 3.9Å; H892-W945 AromaticContact CE1-CE3 3.84Å; H892-W945 AromaticContact CE1-CG 3.94Å; H892-W945 AromaticContact CG-CD1 3.88Å; H892-W945 AromaticContact CG-CG 3.71Å; H892-W945 AromaticContact ND1-CD1 3.42Å; H892-W945 AromaticContact ND1-CD2 3.45Å; H892-W945 AromaticContact ND1-CE2 3.6Å; H892-W945 AromaticContact ND1-CG 3.35Å; H892-W945 AromaticContact ND1-NE1 3.54Å; H892-W953 AromaticContact NE2-CD1 3.92Å; H892-W953 AromaticContact NE2-CG 3.81Å
893	D	81.1	Confident	71.5	Confident	77 Å²	77	57.1 Å²	57.1	41%	0.412	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-1.1	171	57.5	2.7	0	0	0	114	G891 I895	G891-D893 WeakPolarHBondContact CA-OD1 3.49Å; G891-D893 PolarHBondContact O-N 2.87Å; D893-I895 VanDerWaalsContact C-N 3.29Å; D893-I895 HydrophobicContact CB-CG1 4.32Å; D893-I895 PolarHBondContact O-N 2.96Å; D893-I895 WeakPolarHBondContact OD1-CB 3.34Å; D893-I895 PolarHBondContact OD1-N 3.29Å; D893-I895 WeakPolarHBondContact OD2-CD1 3.23Å
894	A	76.9	Confident	71.5	Confident	57 Å²	57	56.7 Å²	56.7	47%	0.471	33%	0.329	S	S	.	.	S	Bend	trans	63.3	22.8	-171.9	0	0	0	0	0	115.4	I890 G891 H892	I890-A894 HydrophobicContact CD1-CB 4.46Å; G891-A894 WeakPolarHBondContact O-CA 3.36Å; G891-A894 PolarHBondContact O-N 2.82Å; H892-A894 VanDerWaalsContact C-N 3.31Å
895	I	76.8	Confident	70.8	Confident	103 Å²	103	53.4 Å²	53.4	53%	0.528	32%	0.32	S	S	.	.			trans	-88	132.9	172.5	-59	-176.6	0	0	0	110	I890 G891 D893	I890-I895 WeakPolarHBondContact CA-O 3.17Å; G891-I895 PolarHBondContact N-O 2.77Å; D893-I895 VanDerWaalsContact C-N 3.29Å; D893-I895 HydrophobicContact CB-CG1 4.32Å; D893-I895 PolarHBondContact O-N 2.96Å; D893-I895 WeakPolarHBondContact OD1-CB 3.34Å; D893-I895 PolarHBondContact OD1-N 3.29Å; D893-I895 WeakPolarHBondContact OD2-CD1 3.23Å
896	F	76.4	Confident	69.8	Low	119 Å²	119	56.4 Å²	56.4	52%	0.522	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-77	147.4	175.8	-60.5	-57.7	0	0	0	112.3	F888 S889 I890 F915	F888-F896 AromaticContact CE1-CD1 3.85Å; F888-F896 HydrophobicContact CE1-CD1 3.85Å; F888-F896 HydrophobicContact CE1-CE1 4.11Å; F888-F896 HydrophobicContact CE2-CD1 4.48Å; F888-F896 AromaticContact CZ-CD1 3.43Å; F888-F896 HydrophobicContact CZ-CD1 3.43Å; F888-F896 VanDerWaalsContact CZ-CD1 3.43Å; F888-F896 AromaticContact CZ-CE1 3.73Å; F888-F896 HydrophobicContact CZ-CE1 3.73Å; F888-F896 HydrophobicContact CZ-CG 4.2Å; S889-F896 WeakPolarHBondContact O-CA 3.49Å; I890-F896 HydrophobicContact CB-CD1 4.15Å; I890-F896 HydrophobicContact CB-CE1 4.44Å; I890-F896 HydrophobicContact CD1-CD1 4.32Å; I890-F896 HydrophobicContact CD1-CE1 3.91Å; I890-F896 HydrophobicContact CG1-CD1 4.19Å; I890-F896 HydrophobicContact CG1-CE1 4.28Å; F896-F915 HydrophobicContact CE1-CB 4.37Å; F896-F915 AromaticContact CE1-CD1 3.57Å; F896-F915 HydrophobicContact CE1-CD1 3.57Å; F896-F915 HydrophobicContact CE1-CE1 4.01Å; F896-F915 AromaticContact CE1-CG 4Å; F896-F915 HydrophobicContact CE1-CG 4Å; F896-F915 AromaticContact CZ-CD1 3.94Å; F896-F915 HydrophobicContact CZ-CD1 3.94Å; F896-F915 HydrophobicContact CZ-CE1 4.48Å
897	G	64.8	Low	68.4	Low	27 Å²	27	61 Å²	61	28%	0.278	36%	0.359	S	S	.	.	S	Bend	trans	73.4	33.3	175.6	0	0	0	0	0	113.9	S889 C901	S889-G897 PolarHBondContact O-N 2.95Å; S889-G897 WeakPolarHBondContact OG-CA 3.36Å; G897-C901 WeakPolarHBondContact CA-O 3.46Å
898	N	56	Low	67.3	Low	61 Å²	61	62.1 Å²	62.1	33%	0.326	37%	0.372	S	S	.	.			trans	-76.3	138.9	173.9	-152	-28.1	0	0	0	109.9	F862 S889	F862-N898 WeakPolarHBondContact CE1-O 3.38Å; S889-N898 PolarHBondContact OG-N 3.36Å; S889-N898 PolarHBondContact OG-O 2.83Å
899	G	55.4	Low	66	Low	48 Å²	48	68.1 Å²	68.1	50%	0.495	41%	0.413	S	S	.	.	S	Bend	trans	75.2	-169.4	-168	0	0	0	0	0	114.3	C901	G899-C901 PolarHBondContact O-N 2.81Å
900	N	54.9	Low	64.7	Low	174 Å²	174	75.5 Å²	75.5	93%	0.93	45%	0.452	S	S	*	.	S	Bend	trans	-67.4	3.4	176.9	-78	-0.3	0	0	0	114	S902	N900-S902 PolarHBondContact O-N 2.95Å; N900-S902 VanDerWaalsContact O-N 3.11Å
901	C	65.1	Low	64	Low	4 Å²	4	76.6 Å²	76.6	3%	0.027	46%	0.46	C	S	.	.			trans	-84.7	65.3	-176.3	-63.9	0	0	0	0	112.8	C886 S889 G897 G899	C886-C901 HydrophobicContact CB-CB 3.79Å; C886-C901 WeakPolarHBondContact CB-SG 3.43Å; C886-C901 WeakPolarHBondContact SG-CB 3.03Å; C886-C901 CovalentContact SG-SG 2.03Å; C886-C901 PolarHBondContact SG-SG 3.15Å; S889-C901 WeakPolarHBondContact OG-CB 3.5Å; G897-C901 WeakPolarHBondContact CA-O 3.46Å; G899-C901 PolarHBondContact O-N 2.81Å
902	S	58.3	Low	63.8	Low	85 Å²	85	78 Å²	78	59%	0.594	47%	0.465	S	S	*	.			trans	-91.8	126.8	171.3	-70.2	0	0	0	0	111	N900	N900-S902 PolarHBondContact O-N 2.95Å; N900-S902 VanDerWaalsContact O-N 3.11Å
903	P	57.1	Low	63.7	Low	21 Å²	21	77.5 Å²	77.5	14%	0.136	46%	0.463	C	S	.	.			trans	-64.6	133.2	178	26.5	-33.7	0	0	0	110.6	D905 N907 F913	P903-D905 PolarHBondContact O-N 3.01Å; P903-N907 WeakPolarHBondContact CG-OD1 3Å; P903-F913 HydrophobicContact CB-CD2 4.25Å; P903-F913 HydrophobicContact CB-CE2 4.48Å
904	P	53	Low	63.8	Low	117 Å²	117	77.8 Å²	77.8	76%	0.76	46%	0.461	S	S	*	.	S	Bend	trans	-80	-11.8	-176.5	30.2	-35.2	0	0	0	114.5
905	D	54.5	Low	64.1	Low	49 Å²	49	77.1 Å²	77.1	26%	0.262	45%	0.448	S	S	.	.	S	Bend	trans	-98.7	138.3	171.1	-78.4	-43.6	0	0	0	109.6	P903 R912 F913 R931	P903-D905 PolarHBondContact O-N 3.01Å; D905-R912 IonicContact OD2-CZ 2.68Å; D905-R912 IonicContact OD2-NE 3.69Å; D905-R912 PolarHBondContact OD2-NE 2.85Å; D905-R912 IonicContact OD2-NH2 3.94Å; D905-R912 PolarHBondContact OD2-NH2 2.68Å; D905-F913 HydrophobicContact CB-CE2 4.33Å; D905-R931 IonicContact OD2-NH1 2.79Å; D905-R931 PolarHBondContact OD2-NH1 2.87Å
906	D	54.4	Low	64.5	Low	147 Å²	147	75.2 Å²	75.2	79%	0.786	44%	0.437	S	S	*	.			trans	-46.4	135.9	-168.9	-130.7	-27.2	0	0	0	116	G908 S911	D906-G908 PolarHBondContact O-N 3.35Å; D906-S911 VanDerWaalsContact O-CB 3.23Å; D906-S911 WeakPolarHBondContact O-CB 3.45Å; D906-S911 PolarHBondContact O-OG 2.86Å
907	N	52.8	Low	65	Low	124 Å²	124	74.3 Å²	74.3	66%	0.663	43%	0.43	S	S	*	.	S	Bend	trans	-77.6	45.3	179.6	-86.7	-24.3	0	0	0	113.1	P903	P903-N907 WeakPolarHBondContact CG-OD1 3Å
908	G	57.2	Low	65.7	Low	35 Å²	35	76.6 Å²	76.6	36%	0.361	44%	0.439	S	S	.	.	S	Bend	trans	-107.3	179.1	177.2	0	0	0	0	0	113.6	D906 N910 S911	D906-G908 PolarHBondContact O-N 3.35Å; G908-N910 PolarHBondContact O-N 2.97Å; G908-S911 WeakPolarHBondContact O-CB 3.43Å; G908-S911 PolarHBondContact O-N 2.75Å
909	P	55.8	Low	66.8	Low	139 Å²	139	76.7 Å²	76.7	90%	0.903	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-3.1	173.1	29.9	-36.8	0	0	0	114
910	N	57.1	Low	67.9	Low	155 Å²	155	77.8 Å²	77.8	83%	0.829	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	7	173	-62.6	-10.9	0	0	0	112.6	G908	G908-N910 PolarHBondContact O-N 2.97Å
911	S	70.1	Confident	69.4	Low	29 Å²	29	72.1 Å²	72.1	20%	0.203	41%	0.411	C	S	.	.			trans	-61.8	143.3	177.4	-166.2	0	0	0	0	110.7	D906 G908 F913	D906-S911 VanDerWaalsContact O-CB 3.23Å; D906-S911 WeakPolarHBondContact O-CB 3.45Å; D906-S911 PolarHBondContact O-OG 2.86Å; G908-S911 WeakPolarHBondContact O-CB 3.43Å; G908-S911 PolarHBondContact O-N 2.75Å; S911-F913 PolarHBondContact O-N 2.81Å; S911-F913 PolarHBondContact OG-N 3.31Å
912	R	79.1	Confident	70.5	Confident	32 Å²	32	76.1 Å²	76.1	12%	0.121	43%	0.43	C	S	.	.	S	Bend	trans	-73.1	-18	175.4	-55.8	-163.1	-56.6	128.3	-0	112.5	D905 I927 H928 D934	D905-R912 IonicContact OD2-CZ 2.68Å; D905-R912 IonicContact OD2-NE 3.69Å; D905-R912 PolarHBondContact OD2-NE 2.85Å; D905-R912 IonicContact OD2-NH2 3.94Å; D905-R912 PolarHBondContact OD2-NH2 2.68Å; R912-I927 WeakPolarHBondContact O-CA 3.24Å; R912-H928 PolarHBondContact O-N 2.83Å; R912-D934 IonicContact CZ-OD1 2.95Å; R912-D934 IonicContact CZ-OD2 3.72Å; R912-D934 IonicContact NH1-OD1 3.97Å; R912-D934 PolarHBondContact NH1-OD1 3.44Å; R912-D934 IonicContact NH1-OD2 3.92Å; R912-D934 PolarHBondContact NH1-OD2 2.91Å; R912-D934 IonicContact NH2-OD1 3.97Å; R912-D934 PolarHBondContact NH2-OD1 2.92Å; R912-D934 IonicContact NH2-OD2 2.64Å
913	F	81.1	Confident	72	Confident	25 Å²	25	72.2 Å²	72.2	11%	0.11	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	104.1	-173.6	-60.6	-71	0	0	0	111	V887 F888 P903 D905 S911 L925 T926 I927	V887-F913 HydrophobicContact CG1-CD1 4.13Å; V887-F913 HydrophobicContact CG1-CE1 3.46Å; V887-F913 VanDerWaalsContact CG1-CE1 3.46Å; V887-F913 HydrophobicContact CG1-CZ 4.04Å; F888-F913 HydrophobicContact CD2-CB 4.36Å; P903-F913 HydrophobicContact CB-CD2 4.25Å; P903-F913 HydrophobicContact CB-CE2 4.48Å; D905-F913 HydrophobicContact CB-CE2 4.33Å; S911-F913 PolarHBondContact O-N 2.81Å; S911-F913 PolarHBondContact OG-N 3.31Å; F913-L925 HydrophobicContact CB-CD1 4.14Å; F913-L925 HydrophobicContact CD1-CD1 4.32Å; F913-T926 WeakPolarHBondContact CA-O 3.31Å; F913-I927 HydrophobicContact CD1-CG1 4Å; F913-I927 HydrophobicContact CD1-CG2 4.32Å; F913-I927 HydrophobicContact CE1-CB 4.44Å; F913-I927 HydrophobicContact CE1-CD1 4.07Å; F913-I927 HydrophobicContact CE1-CG1 3.89Å; F913-I927 HydrophobicContact CE1-CG2 3.91Å
914	Q	82.9	Confident	73.5	Confident	82 Å²	82	71.5 Å²	71.5	38%	0.383	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	107.9	170.6	172.1	174.1	-15.9	0	0	109.7	E916 T926 H928	Q914-E916 HydrophobicContact CG-CG 4.17Å; Q914-E916 PolarHBondContact NE2-OE1 2.92Å; Q914-T926 PolarHBondContact N-O 3.34Å; Q914-T926 PolarHBondContact O-N 2.79Å; Q914-H928 PolarHBondContact OE1-NE2 3.35Å
915	F	84.5	Confident	75.2	Confident	43 Å²	43	65.9 Å²	65.9	19%	0.189	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	133.3	170.8	173	-99.2	0	0	0	111.4	W863 F888 I890 F896 R917 Y923	W863-F915 HydrophobicContact CH2-CD2 4.16Å; W863-F915 AromaticContact CH2-CE2 3.79Å; W863-F915 HydrophobicContact CH2-CE2 3.79Å; W863-F915 HydrophobicContact CZ3-CD2 4.32Å; W863-F915 HydrophobicContact CZ3-CE2 4.16Å; F888-F915 HydrophobicContact CD1-CD2 4.23Å; F888-F915 HydrophobicContact CE1-CB 3.72Å; F888-F915 AromaticContact CE1-CD2 3.56Å; F888-F915 HydrophobicContact CE1-CD2 3.56Å; F888-F915 HydrophobicContact CE1-CE2 4.36Å; F888-F915 AromaticContact CE1-CG 3.74Å; F888-F915 HydrophobicContact CE1-CG 3.74Å; F888-F915 HydrophobicContact CE2-CB 4.42Å; F888-F915 HydrophobicContact CZ-CB 3.58Å; F888-F915 HydrophobicContact CZ-CD2 4.3Å; F888-F915 HydrophobicContact CZ-CG 4.02Å; I890-F915 HydrophobicContact CB-CZ 4.47Å; I890-F915 HydrophobicContact CD1-CE1 3.64Å; I890-F915 HydrophobicContact CD1-CE2 4.46Å; I890-F915 HydrophobicContact CD1-CZ 3.58Å; I890-F915 HydrophobicContact CG2-CE2 3.91Å; I890-F915 HydrophobicContact CG2-CZ 3.94Å; F896-F915 HydrophobicContact CE1-CB 4.37Å; F896-F915 AromaticContact CE1-CD1 3.57Å; F896-F915 HydrophobicContact CE1-CD1 3.57Å; F896-F915 HydrophobicContact CE1-CE1 4.01Å; F896-F915 AromaticContact CE1-CG 4Å; F896-F915 HydrophobicContact CE1-CG 4Å; F896-F915 AromaticContact CZ-CD1 3.94Å; F896-F915 HydrophobicContact CZ-CD1 3.94Å; F896-F915 HydrophobicContact CZ-CE1 4.48Å; F915-R917 HydrophobicContact CE1-CB 3.8Å; F915-R917 HydrophobicContact CZ-CB 3.76Å; F915-Y923 AromaticContact CE2-CD1 3.86Å; F915-Y923 HydrophobicContact CE2-CD1 3.86Å; F915-Y923 AromaticContact CZ-CD1 3.76Å; F915-Y923 HydrophobicContact CZ-CD1 3.76Å; F915-Y923 HydrophobicContact CZ-CE1 4.35Å
916	E	84.2	Confident	76.7	Confident	63 Å²	63	64.1 Å²	64.1	29%	0.294	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.5	173.2	-59.7	-172.3	155.5	0	0	110.5	R844 Q914 Y923 S924	R844-E916 IonicContact CZ-OE2 3.55Å; R844-E916 IonicContact NH2-OE2 3.45Å; R844-E916 PolarHBondContact NH2-OE2 3.42Å; Q914-E916 HydrophobicContact CG-CG 4.17Å; Q914-E916 PolarHBondContact NE2-OE1 2.92Å; E916-Y923 CarbonylContact O-C 3.57Å; E916-S924 PolarHBondContact N-O 2.98Å; E916-S924 PolarHBondContact O-N 3.11Å
917	R	86.2	Confident	78.2	Confident	100 Å²	100	57.1 Å²	57.1	38%	0.377	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	108	169.3	-176.1	174.2	-174.5	-179.2	7.5	108.8	F915 T919 S920 Y923	F915-R917 HydrophobicContact CE1-CB 3.8Å; F915-R917 HydrophobicContact CZ-CB 3.76Å; R917-T919 WeakPolarHBondContact CG-O 3.5Å; R917-T919 PolarHBondContact NE-O 2.84Å; R917-T919 VanDerWaalsContact NE-O 3.09Å; R917-S920 PolarHBondContact NH2-O 2.91Å; R917-Y923 HydrophobicContact CG-CD1 4.47Å; R917-Y923 PolarHBondContact NH2-OH 3.5Å
918	T	79.6	Confident	79.6	Confident	76 Å²	76	54.5 Å²	54.5	47%	0.466	30%	0.298	S	S	.	.			trans	-84.4	-32.9	-176.3	40.2	0	0	0	0	112.1	Q922	T918-Q922 PolarHBondContact N-O 2.03Å; T918-Q922 WeakPolarHBondContact OG1-CB 3.03Å; T918-Q922 VanDerWaalsContact OG1-CG 3.3Å; T918-Q922 WeakPolarHBondContact OG1-CG 2.98Å; T918-Q922 PolarHBondContact OG1-O 3.19Å; T918-Q922 PolarHBondContact OG1-OE1 3.49Å
919	T	80.6	Confident	80.8	Confident	63 Å²	63	54.4 Å²	54.4	39%	0.387	30%	0.298	S	S	.	.	S	Bend	trans	-142.6	-175.7	176.5	62.4	0	0	0	0	111.3	R917 D921 Q922	R917-T919 WeakPolarHBondContact CG-O 3.5Å; R917-T919 PolarHBondContact NE-O 2.84Å; R917-T919 VanDerWaalsContact NE-O 3.09Å; T919-D921 WeakPolarHBondContact CB-OD1 3.4Å; T919-D921 PolarHBondContact O-N 2.83Å; T919-D921 PolarHBondContact OG1-OD1 2.83Å; T919-Q922 PolarHBondContact N-O 2.8Å; T919-Q922 VanDerWaalsContact OG1-CB 3.26Å; T919-Q922 WeakPolarHBondContact OG1-CB 3.24Å; T919-Q922 PolarHBondContact OG1-N 2.83Å
920	S	78.8	Confident	82	Confident	71 Å²	71	47.9 Å²	47.9	50%	0.497	26%	0.255	S	S	.	.	S	Bend	trans	-61.2	-27.2	174.5	34.6	0	0	0	0	113.6	R917 Y923	R917-S920 PolarHBondContact NH2-O 2.91Å; S920-Y923 WeakPolarHBondContact O-CE2 3.32Å
921	D	85.2	Confident	83.2	Confident	54 Å²	54	46 Å²	46	29%	0.289	24%	0.237	S	C	.	.	S	Bend	trans	-117.4	-22.7	-165.3	51.2	-46.7	0	0	0	113	I849 T919	I849-D921 HydrophobicContact CB-CB 4.15Å; I849-D921 WeakPolarHBondContact CB-O 3.09Å; I849-D921 WeakPolarHBondContact CG1-O 3.28Å; I849-D921 PolarHBondContact N-O 2.95Å; T919-D921 WeakPolarHBondContact CB-OD1 3.4Å; T919-D921 PolarHBondContact O-N 2.83Å; T919-D921 PolarHBondContact OG1-OD1 2.83Å
922	Q	88.8	Confident	83.5	Confident	89 Å²	89	47.5 Å²	47.5	42%	0.416	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120.7	177.2	-170.6	177.5	68	0	0	112	N848 T918 T919	N848-Q922 WeakPolarHBondContact OD1-CB 3.02Å; T918-Q922 PolarHBondContact N-O 2.03Å; T918-Q922 WeakPolarHBondContact OG1-CB 3.03Å; T918-Q922 VanDerWaalsContact OG1-CG 3.3Å; T918-Q922 WeakPolarHBondContact OG1-CG 2.98Å; T918-Q922 PolarHBondContact OG1-O 3.19Å; T918-Q922 PolarHBondContact OG1-OE1 3.49Å; T919-Q922 PolarHBondContact N-O 2.8Å; T919-Q922 VanDerWaalsContact OG1-CB 3.26Å; T919-Q922 WeakPolarHBondContact OG1-CB 3.24Å; T919-Q922 PolarHBondContact OG1-N 2.83Å
923	Y	90.1	Very high	83.3	Confident	2 Å²	2	49 Å²	49	1%	0.008	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	148.9	179.5	-63.9	-119.2	0	0	0	109.1	C847 I849 F859 V861 W863 I890 F915 E916 R917 S920	C847-Y923 CarbonylContact C-O 3.59Å; C847-Y923 PolarHBondContact N-O 2.7Å; C847-Y923 PolarHBondContact O-N 2.84Å; I849-Y923 HydrophobicContact CD1-CD2 4.37Å; I849-Y923 HydrophobicContact CD1-CE2 3.91Å; F859-Y923 HydrophobicContact CD2-CE2 4.44Å; F859-Y923 PolarHBondContact O-OH 2.03Å; V861-Y923 HydrophobicContact CB-CD1 3.93Å; V861-Y923 HydrophobicContact CB-CE1 4.01Å; V861-Y923 HydrophobicContact CB-CG 4.43Å; V861-Y923 HydrophobicContact CG1-CD1 4.39Å; V861-Y923 HydrophobicContact CG2-CD1 3.67Å; V861-Y923 HydrophobicContact CG2-CD2 4.05Å; V861-Y923 HydrophobicContact CG2-CE1 3.45Å; V861-Y923 VanDerWaalsContact CG2-CE1 3.45Å; V861-Y923 HydrophobicContact CG2-CE2 3.88Å; V861-Y923 HydrophobicContact CG2-CG 3.97Å; W863-Y923 HydrophobicContact CH2-CD1 4.33Å; I890-Y923 HydrophobicContact CG2-CD1 4.05Å; I890-Y923 HydrophobicContact CG2-CE1 3.88Å; F915-Y923 AromaticContact CE2-CD1 3.86Å; F915-Y923 HydrophobicContact CE2-CD1 3.86Å; F915-Y923 AromaticContact CZ-CD1 3.76Å; F915-Y923 HydrophobicContact CZ-CD1 3.76Å; F915-Y923 HydrophobicContact CZ-CE1 4.35Å; E916-Y923 CarbonylContact O-C 3.57Å; R917-Y923 HydrophobicContact CG-CD1 4.47Å; R917-Y923 PolarHBondContact NH2-OH 3.5Å; S920-Y923 WeakPolarHBondContact O-CE2 3.32Å
924	S	88.3	Confident	83.2	Confident	6 Å²	6	48.2 Å²	48.2	4%	0.042	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	145.8	169.8	65.7	0	0	0	0	112.7	R844 L845 E916	R844-S924 PolarHBondContact NE-OG 2.99Å; R844-S924 PolarHBondContact NH2-OG 2.81Å; L845-S924 CarbonylContact O-C 3.53Å; L845-S924 VanDerWaalsContact O-CA 3.29Å; L845-S924 WeakPolarHBondContact O-CA 3.5Å; E916-S924 PolarHBondContact N-O 2.98Å; E916-S924 PolarHBondContact O-N 3.11Å
925	L	87.6	Confident	83.1	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	125	176.2	179.4	67.1	0	0	0	108.9	L845 W863 V887 F888 F913	L845-L925 HydrophobicContact CB-CB 4.42Å; L845-L925 HydrophobicContact CD1-CD2 4.37Å; L845-L925 PolarHBondContact N-O 2.88Å; L845-L925 PolarHBondContact O-N 3.3Å; W863-L925 HydrophobicContact CB-CD2 3.8Å; W863-L925 HydrophobicContact CD2-CB 3.9Å; W863-L925 HydrophobicContact CD2-CD2 4Å; W863-L925 HydrophobicContact CE3-CB 4.47Å; W863-L925 HydrophobicContact CE3-CD2 4.44Å; W863-L925 HydrophobicContact CG-CB 4.15Å; W863-L925 HydrophobicContact CG-CD2 3.7Å; W863-L925 HydrophobicContact CZ2-CB 4.25Å; V887-L925 HydrophobicContact CB-CD2 4.46Å; V887-L925 HydrophobicContact CG1-CD2 3.97Å; F888-L925 HydrophobicContact CB-CD1 3.92Å; F888-L925 HydrophobicContact CB-CD2 3.62Å; F888-L925 HydrophobicContact CB-CG 4.42Å; F888-L925 HydrophobicContact CD1-CD1 4.09Å; F888-L925 HydrophobicContact CD2-CD1 4.06Å; F888-L925 HydrophobicContact CG-CD1 3.76Å; F888-L925 HydrophobicContact CG-CD2 4.37Å; F913-L925 HydrophobicContact CB-CD1 4.14Å; F913-L925 HydrophobicContact CD1-CD1 4.32Å
926	T	86.8	Confident	83.1	Confident	11 Å²	11	44.7 Å²	44.7	7%	0.067	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.3	176	-50.9	0	0	0	0	109.5	I843 F913 Q914	I843-T926 CarbonylContact O-C 3.53Å; I843-T926 VanDerWaalsContact O-CA 3.24Å; I843-T926 WeakPolarHBondContact O-CA 3.49Å; I843-T926 WeakPolarHBondContact O-CG2 3.22Å; F913-T926 WeakPolarHBondContact CA-O 3.31Å; Q914-T926 PolarHBondContact N-O 3.34Å; Q914-T926 PolarHBondContact O-N 2.79Å
927	I	85.9	Confident	83.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	112.1	175.5	-44.3	178.3	0	0	0	107.9	S842 I843 L845 V887 R912 F913 Y938	S842-I927 CarbonylContact C-O 3.52Å; S842-I927 WeakPolarHBondContact CA-O 3.36Å; I843-I927 HydrophobicContact CB-CB 4.23Å; I843-I927 HydrophobicContact CD1-CB 4.33Å; I843-I927 PolarHBondContact N-O 3.09Å; I843-I927 PolarHBondContact O-N 3.21Å; L845-I927 HydrophobicContact CD1-CD1 4.04Å; V887-I927 HydrophobicContact CG1-CD1 4.43Å; R912-I927 WeakPolarHBondContact O-CA 3.24Å; F913-I927 HydrophobicContact CD1-CG1 4Å; F913-I927 HydrophobicContact CD1-CG2 4.32Å; F913-I927 HydrophobicContact CE1-CB 4.44Å; F913-I927 HydrophobicContact CE1-CD1 4.07Å; F913-I927 HydrophobicContact CE1-CG1 3.89Å; F913-I927 HydrophobicContact CE1-CG2 3.91Å; I927-Y938 HydrophobicContact CD1-CE1 3.78Å
928	H	82.1	Confident	83.4	Confident	69 Å²	69	41 Å²	41	32%	0.319	24%	0.24	S	C	.	.			trans	-88.8	142	-179.3	-69.1	-63.1	0	0	0	112.2	R912 Q914	R912-H928 PolarHBondContact O-N 2.83Å; Q914-H928 PolarHBondContact OE1-NE2 3.35Å
929	G	81.3	Confident	83.9	Confident	34 Å²	34	39.2 Å²	39.2	35%	0.351	23%	0.225	S	C	.	.	S	Bend	trans	68.2	57.1	179	0	0	0	0	0	111.7	S841 R931	S841-G929 PolarHBondContact O-N 3.19Å; G929-R931 PolarHBondContact O-N 2.66Å
930	A	81.1	Confident	84.3	Confident	2 Å²	2	36.2 Å²	36.2	2%	0.017	21%	0.207	C	C	.	.			trans	-52.7	118.4	-178.1	0	0	0	0	0	111.6	V837 S840 S841 I843	V837-A930 HydrophobicContact CG2-CB 4.43Å; S840-A930 PolarHBondContact N-O 2.54Å; S841-A930 WeakPolarHBondContact O-CB 3.34Å; S841-A930 PolarHBondContact O-N 2.99Å; I843-A930 HydrophobicContact CD1-CB 3.7Å; I843-A930 HydrophobicContact CG1-CB 4Å
931	R	82.6	Confident	84.9	Confident	115 Å²	115	34.8 Å²	34.8	43%	0.434	19%	0.192	S	C	.	.			trans	-95	156.8	174.8	-55.6	169.8	175.5	158.5	-2	108.7	D905 G929 A933 D934	D905-R931 IonicContact OD2-NH1 2.79Å; D905-R931 PolarHBondContact OD2-NH1 2.87Å; G929-R931 PolarHBondContact O-N 2.66Å; R931-A933 PolarHBondContact O-N 2.88Å; R931-A933 VanDerWaalsContact O-N 3.08Å; R931-D934 VanDerWaalsContact CB-OD2 3.31Å; R931-D934 WeakPolarHBondContact CB-OD2 3.33Å; R931-D934 PolarHBondContact N-OD2 3.05Å; R931-D934 PolarHBondContact O-N 3.2Å
932	P	76.2	Confident	85.1	Confident	60 Å²	60	32.2 Å²	32.2	39%	0.39	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-53.6	-29.4	170.6	-28.4	36.3	0	0	0	114.2	D934 A935	P932-D934 VanDerWaalsContact C-N 3.31Å; P932-D934 PolarHBondContact O-N 3.03Å; P932-A935 WeakPolarHBondContact O-CB 3.35Å; P932-A935 PolarHBondContact O-N 2.78Å
933	A	75.6	Confident	85.2	Confident	64 Å²	64	28.8 Å²	28.8	53%	0.529	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-76.9	-8.1	175.2	0	0	0	0	0	114.9	R867 R931 A935	R867-A933 PolarHBondContact NH2-O 2.84Å; R931-A933 PolarHBondContact O-N 2.88Å; R931-A933 VanDerWaalsContact O-N 3.08Å; A933-A935 VanDerWaalsContact C-N 3.27Å
934	D	79.1	Confident	85.2	Confident	8 Å²	8	28.7 Å²	28.7	4%	0.043	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-90.8	12.6	169.9	-50.7	-56.9	0	0	0	111.7	I843 R912 R931 P932 Y938 V966	I843-D934 HydrophobicContact CD1-CB 3.85Å; R912-D934 IonicContact CZ-OD1 2.95Å; R912-D934 IonicContact CZ-OD2 3.72Å; R912-D934 IonicContact NH1-OD1 3.97Å; R912-D934 PolarHBondContact NH1-OD1 3.44Å; R912-D934 IonicContact NH1-OD2 3.92Å; R912-D934 PolarHBondContact NH1-OD2 2.91Å; R912-D934 IonicContact NH2-OD1 3.97Å; R912-D934 PolarHBondContact NH2-OD1 2.92Å; R912-D934 IonicContact NH2-OD2 2.64Å; R931-D934 VanDerWaalsContact CB-OD2 3.31Å; R931-D934 WeakPolarHBondContact CB-OD2 3.33Å; R931-D934 PolarHBondContact N-OD2 3.05Å; R931-D934 PolarHBondContact O-N 3.2Å; P932-D934 VanDerWaalsContact C-N 3.31Å; P932-D934 PolarHBondContact O-N 3.03Å; D934-Y938 WeakPolarHBondContact O-CE2 3.31Å; D934-Y938 PolarHBondContact O-OH 3.3Å; D934-Y938 VanDerWaalsContact O-OH 3.08Å; D934-V966 WeakPolarHBondContact O-CG1 3.29Å
935	A	80.6	Confident	85.2	Confident	35 Å²	35	30.8 Å²	30.8	29%	0.289	17%	0.169	S	C	.	.			trans	-77.4	147.5	164.6	0	0	0	0	0	110.6	P932 A933 V966 V968	P932-A935 WeakPolarHBondContact O-CB 3.35Å; P932-A935 PolarHBondContact O-N 2.78Å; A933-A935 VanDerWaalsContact C-N 3.27Å; A935-V966 WeakPolarHBondContact CA-O 3.41Å; A935-V968 HydrophobicContact CB-CG2 4.28Å
936	G	85.5	Confident	85.2	Confident	17 Å²	17	31.4 Å²	31.4	18%	0.175	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155.9	-177.1	-179.6	0	0	0	0	0	114.5	V966	G936-V966 PolarHBondContact N-O 2.92Å; G936-V966 PolarHBondContact O-N 3.21Å
937	R	87.7	Confident	85	Confident	82 Å²	82	34.2 Å²	34.2	31%	0.309	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	97.6	176.6	-73.3	-176.5	70.7	80.5	6.1	109.6	E832 V865 D866 V963	E832-R937 IonicContact OE1-CZ 2.82Å; E832-R937 IonicContact OE1-NH2 3.99Å; E832-R937 PolarHBondContact OE1-NH2 2.8Å; V865-R937 WeakPolarHBondContact CA-O 3.36Å; D866-R937 HydrophobicContact CB-CB 3.97Å; D866-R937 PolarHBondContact N-O 2.7Å; D866-R937 PolarHBondContact O-N 3.21Å; D866-R937 IonicContact OD2-NE 2.98Å; R937-V963 HydrophobicContact CB-CG1 3.62Å; R937-V963 HydrophobicContact CG-CG1 4.03Å
938	Y	88.3	Confident	84.5	Confident	4 Å²	4	35.6 Å²	35.6	2%	0.016	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	139.6	-178.9	-70.2	-98	0	0	0	112.1	L845 Y864 V865 V887 I927 D934 V963 T964 V966	L845-Y938 HydrophobicContact CD1-CD1 3.29Å; L845-Y938 HydrophobicContact CD1-CE1 3.84Å; L845-Y938 HydrophobicContact CD1-CG 3.7Å; L845-Y938 HydrophobicContact CD2-CD1 4.38Å; L845-Y938 HydrophobicContact CD2-CD2 4.36Å; L845-Y938 HydrophobicContact CD2-CG 3.92Å; L845-Y938 HydrophobicContact CG-CD1 4.47Å; L845-Y938 HydrophobicContact CG-CG 4.48Å; Y864-Y938 VanDerWaalsContact O-CA 3.29Å; Y864-Y938 WeakPolarHBondContact O-CA 3.44Å; V865-Y938 HydrophobicContact CB-CD1 3.71Å; V865-Y938 HydrophobicContact CB-CD2 4.44Å; V865-Y938 HydrophobicContact CB-CE1 3.59Å; V865-Y938 HydrophobicContact CB-CE2 4.31Å; V865-Y938 HydrophobicContact CB-CG 4.16Å; V865-Y938 HydrophobicContact CG1-CE1 4.29Å; V865-Y938 HydrophobicContact CG2-CD1 3.97Å; V865-Y938 HydrophobicContact CG2-CD2 3.79Å; V865-Y938 HydrophobicContact CG2-CE1 3.79Å; V865-Y938 HydrophobicContact CG2-CE2 3.56Å; V865-Y938 HydrophobicContact CG2-CG 3.99Å; V887-Y938 HydrophobicContact CG1-CE1 4.38Å; V887-Y938 HydrophobicContact CG2-CD1 4.11Å; V887-Y938 HydrophobicContact CG2-CE1 3.81Å; I927-Y938 HydrophobicContact CD1-CE1 3.78Å; D934-Y938 WeakPolarHBondContact O-CE2 3.31Å; D934-Y938 PolarHBondContact O-OH 3.3Å; D934-Y938 VanDerWaalsContact O-OH 3.08Å; Y938-V963 CarbonylContact O-C 3.6Å; Y938-V963 WeakPolarHBondContact O-CA 3.49Å; Y938-T964 PolarHBondContact N-O 3.16Å; Y938-T964 PolarHBondContact O-N 2.64Å; Y938-V966 HydrophobicContact CD2-CB 3.99Å; Y938-V966 HydrophobicContact CD2-CG2 3.5Å; Y938-V966 VanDerWaalsContact CD2-CG2 3.5Å; Y938-V966 HydrophobicContact CE2-CB 3.92Å; Y938-V966 HydrophobicContact CE2-CG2 3.82Å; Y938-V966 HydrophobicContact CG-CG2 4.45Å
939	Y	89.5	Confident	84	Confident	38 Å²	38	33 Å²	33	15%	0.149	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	162.5	169.1	67.4	-84.3	0	0	0	110.4	W863 Y864 N960	W863-Y939 WeakPolarHBondContact CA-O 3.31Å; Y864-Y939 HydrophobicContact CD2-CE2 4.07Å; Y864-Y939 HydrophobicContact CG-CE2 4.36Å; Y864-Y939 AromaticContact CG-CZ 3.99Å; Y864-Y939 PolarHBondContact N-O 2.76Å; Y864-Y939 PolarHBondContact O-N 2.83Å; Y939-N960 HydrophobicContact CD2-CB 4.44Å
940	C	89.8	Confident	83.6	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	145.7	167.8	76.6	0	0	0	0	112.4	C847 V861 F862 W863 N960 S961	C847-C940 HydrophobicContact CB-CB 3.59Å; C847-C940 WeakPolarHBondContact CB-SG 3.49Å; C847-C940 WeakPolarHBondContact SG-CB 3.4Å; C847-C940 CovalentContact SG-SG 2.03Å; C847-C940 PolarHBondContact SG-SG 3.01Å; V861-C940 HydrophobicContact CG1-CB 4.25Å; F862-C940 CarbonylContact O-C 3.53Å; F862-C940 WeakPolarHBondContact O-CA 3.24Å; F862-C940 VanDerWaalsContact O-CB 3.32Å; F862-C940 WeakPolarHBondContact O-CB 3.49Å; W863-C940 HydrophobicContact CG-CB 4.49Å; C940-N960 CarbonylContact O-C 3.56Å; C940-N960 VanDerWaalsContact O-CA 3.31Å; C940-N960 WeakPolarHBondContact O-CA 3.29Å; C940-S961 PolarHBondContact N-OG 2.65Å; C940-S961 PolarHBondContact O-N 3.03Å; C940-S961 VanDerWaalsContact SG-CB 3.54Å
941	H	89.9	Confident	83.3	Confident	40 Å²	40	41.5 Å²	41.5	19%	0.185	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	139.4	165	179.4	67.7	0	0	0	108.6	V861 F862 Y864 N960	V861-H941 WeakPolarHBondContact CA-O 3.37Å; F862-H941 HydrophobicContact CB-CB 4.34Å; F862-H941 HydrophobicContact CD2-CB 4.48Å; F862-H941 AromaticContact CD2-CD2 3.85Å; F862-H941 PolarHBondContact N-O 3.47Å; F862-H941 PolarHBondContact O-N 2.79Å; Y864-H941 HydrophobicContact CD2-CB 4.27Å; Y864-H941 HydrophobicContact CE2-CB 3.97Å; H941-N960 PolarHBondContact ND1-OD1 2.89Å
942	V	90.7	Very high	83.2	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.6	-180	-176.4	0	0	0	0	109.4	L826 V828 I849 F859 S860 V861 T958 N959	L826-V942 HydrophobicContact CD1-CG1 4.14Å; L826-V942 HydrophobicContact CD2-CB 4.39Å; L826-V942 HydrophobicContact CD2-CG1 4.14Å; V828-V942 HydrophobicContact CB-CG2 4.5Å; V828-V942 HydrophobicContact CG1-CG2 4.04Å; V828-V942 HydrophobicContact CG2-CB 3.7Å; V828-V942 HydrophobicContact CG2-CG1 4.35Å; V828-V942 HydrophobicContact CG2-CG2 3.54Å; I849-V942 HydrophobicContact CD1-CG1 3.69Å; I849-V942 HydrophobicContact CG1-CG1 4.2Å; I849-V942 HydrophobicContact CG1-CG2 4.4Å; F859-V942 HydrophobicContact CB-CG1 3.99Å; F859-V942 HydrophobicContact CD1-CG1 4.31Å; F859-V942 HydrophobicContact CG-CG1 4.42Å; S860-V942 WeakPolarHBondContact O-CA 3.42Å; V861-V942 HydrophobicContact CG1-CG2 4.3Å; V861-V942 HydrophobicContact CG2-CG1 4.3Å; V861-V942 HydrophobicContact CG2-CG2 4.2Å; V942-T958 CarbonylContact O-C 3.59Å; V942-T958 VanDerWaalsContact O-CA 3.28Å; V942-T958 WeakPolarHBondContact O-CA 3.39Å; V942-N959 PolarHBondContact N-O 3.45Å; V942-N959 PolarHBondContact O-N 2.74Å
943	E	91	Very high	83.5	Confident	18 Å²	18	43.3 Å²	43.3	8%	0.084	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.3	166.8	-55.4	-179.1	119.9	0	0	110	F859 S860 F862 W945 R955 T958	F859-E943 CarbonylContact C-O 3.55Å; F859-E943 WeakPolarHBondContact CA-O 3.46Å; S860-E943 WeakPolarHBondContact CB-OE2 3.47Å; S860-E943 PolarHBondContact N-O 2.79Å; S860-E943 PolarHBondContact O-N 2.77Å; S860-E943 PolarHBondContact OG-OE2 3.05Å; F862-E943 HydrophobicContact CE2-CG 3.98Å; E943-W945 VanDerWaalsContact CB-NE1 3.34Å; E943-W945 PolarHBondContact OE2-NE1 2.84Å; E943-R955 HydrophobicContact CB-CG 4.29Å; E943-R955 WeakPolarHBondContact OE1-CD 3.45Å; E943-R955 IonicContact OE1-CZ 2.61Å; E943-R955 IonicContact OE1-NE 2.65Å; E943-R955 IonicContact OE1-NH1 2.79Å; E943-R955 PolarHBondContact OE1-NH1 3.38Å; E943-T958 HydrophobicContact CB-CG2 4.23Å; E943-T958 HydrophobicContact CG-CG2 3.95Å
944	E	90.1	Very high	84	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	128.7	169.4	-173.7	174	-176.7	0	0	110.6	L826 S853 S854 S857 F859 R955 L956 A957	L826-E944 HydrophobicContact CB-CB 4.49Å; L826-E944 HydrophobicContact CD1-CB 4.28Å; L826-E944 HydrophobicContact CD2-CB 4.04Å; S853-E944 WeakPolarHBondContact CA-OE1 3.42Å; S853-E944 VanDerWaalsContact CB-OE1 3.27Å; S853-E944 WeakPolarHBondContact CB-OE1 3.24Å; S853-E944 VanDerWaalsContact CB-OE2 3.28Å; S853-E944 WeakPolarHBondContact CB-OE2 3.36Å; S853-E944 VanDerWaalsContact N-CD 3.32Å; S853-E944 PolarHBondContact N-OE1 2.61Å; S853-E944 PolarHBondContact N-OE2 3.37Å; S853-E944 VanDerWaalsContact OG-CD 3.28Å; S853-E944 PolarHBondContact OG-OE1 2.93Å; S853-E944 PolarHBondContact OG-OE2 3.03Å; S854-E944 PolarHBondContact N-OE1 3.07Å; S857-E944 WeakPolarHBondContact CB-OE1 3.4Å; S857-E944 PolarHBondContact OG-OE1 2.69Å; F859-E944 HydrophobicContact CD1-CB 4.05Å; F859-E944 HydrophobicContact CD1-CG 4.02Å; F859-E944 HydrophobicContact CE1-CB 4.21Å; F859-E944 HydrophobicContact CE1-CG 3.79Å; E944-R955 CarbonylContact O-C 3.59Å; E944-R955 WeakPolarHBondContact O-CA 3.43Å; E944-L956 PolarHBondContact O-N 3.08Å; E944-A957 HydrophobicContact CB-CB 4.21Å; E944-A957 PolarHBondContact N-O 3.24Å; E944-A957 PolarHBondContact O-N 3.34Å
945	W	88.5	Confident	84.4	Confident	50 Å²	50	48.8 Å²	48.8	19%	0.189	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	136.9	-178.4	-69.2	82.5	0	0	0	110.7	S857 R858 S860 H892 E943 W953 Y954 R955	S857-W945 CarbonylContact C-O 3.46Å; S857-W945 VanDerWaalsContact CA-O 3.31Å; S857-W945 WeakPolarHBondContact CA-O 3.39Å; R858-W945 PolarHBondContact N-O 2.87Å; R858-W945 PolarHBondContact O-N 3.04Å; S860-W945 PolarHBondContact OG-NE1 3.34Å; H892-W945 HydrophobicContact CB-CB 3.96Å; H892-W945 HydrophobicContact CB-CG 4Å; H892-W945 AromaticContact CE1-CD2 3.62Å; H892-W945 AromaticContact CE1-CE2 3.9Å; H892-W945 AromaticContact CE1-CE3 3.84Å; H892-W945 AromaticContact CE1-CG 3.94Å; H892-W945 AromaticContact CG-CD1 3.88Å; H892-W945 AromaticContact CG-CG 3.71Å; H892-W945 AromaticContact ND1-CD1 3.42Å; H892-W945 AromaticContact ND1-CD2 3.45Å; H892-W945 AromaticContact ND1-CE2 3.6Å; H892-W945 AromaticContact ND1-CG 3.35Å; H892-W945 AromaticContact ND1-NE1 3.54Å; E943-W945 VanDerWaalsContact CB-NE1 3.34Å; E943-W945 PolarHBondContact OE2-NE1 2.84Å; W945-W953 HydrophobicContact CB-CE3 4.08Å; W945-W953 HydrophobicContact CE3-CB 4.1Å; W945-Y954 WeakPolarHBondContact CA-O 3.37Å; W945-Y954 VanDerWaalsContact CE3-C 3.42Å; W945-R955 HydrophobicContact CD2-CB 4Å; W945-R955 HydrophobicContact CD2-CG 4.43Å; W945-R955 HydrophobicContact CE3-CB 4.04Å; W945-R955 HydrophobicContact CH2-CB 4.01Å; W945-R955 HydrophobicContact CZ2-CB 3.95Å; W945-R955 HydrophobicContact CZ2-CG 4.28Å; W945-R955 HydrophobicContact CZ3-CB 4.05Å
946	L	86.6	Confident	84.6	Confident	13 Å²	13	48.3 Å²	48.3	7%	0.068	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	150.6	177.4	-171.8	61.8	0	0	0	110.6	P822 D856 W953 Y954 L956	P822-L946 HydrophobicContact CG-CD2 3.8Å; D856-L946 HydrophobicContact CB-CD1 3.98Å; L946-W953 WeakPolarHBondContact O-CA 3.48Å; L946-Y954 HydrophobicContact CB-CE1 4.45Å; L946-Y954 PolarHBondContact N-O 3.42Å; L946-Y954 WeakPolarHBondContact O-CD1 3.49Å; L946-Y954 PolarHBondContact O-N 2.86Å; L946-L956 HydrophobicContact CB-CD2 4.04Å; L946-L956 HydrophobicContact CD2-CD2 3.86Å
947	L	83.7	Confident	84.7	Confident	70 Å²	70	48.4 Å²	48.4	37%	0.366	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	127.2	-179.3	-166.2	77.4	0	0	0	110.4	W953	L947-W953 HydrophobicContact CB-CD2 4.33Å; L947-W953 HydrophobicContact CB-CE3 4.09Å; L947-W953 HydrophobicContact CB-CH2 4.22Å; L947-W953 HydrophobicContact CB-CZ2 4.49Å; L947-W953 HydrophobicContact CB-CZ3 4.04Å; L947-W953 HydrophobicContact CD1-CD2 3.75Å; L947-W953 HydrophobicContact CD1-CE3 4.35Å; L947-W953 HydrophobicContact CD1-CG 3.88Å; L947-W953 HydrophobicContact CD1-CZ2 4.22Å
948	N	74.6	Confident	84.8	Confident	28 Å²	28	48 Å²	48	15%	0.15	22%	0.221	C	C	.	.			trans	-78.2	168.4	175.2	81.3	6	0	0	0	112	R950 N951 E952 Y954	N948-R950 PolarHBondContact O-N 2.82Å; N948-R950 VanDerWaalsContact O-N 3.07Å; N948-R950 VanDerWaalsContact OD1-CA 3.29Å; N948-R950 WeakPolarHBondContact OD1-CA 3.36Å; N948-R950 VanDerWaalsContact OD1-CB 3.29Å; N948-R950 WeakPolarHBondContact OD1-CB 3.36Å; N948-R950 PolarHBondContact OD1-N 2.74Å; N948-N951 PolarHBondContact O-N 2.96Å; N948-N951 PolarHBondContact OD1-N 3.32Å; N948-N951 VanDerWaalsContact OD1-N 3.17Å; N948-E952 PolarHBondContact N-O 2.92Å; N948-E952 PolarHBondContact ND2-OE2 2.89Å; N948-E952 PolarHBondContact OD1-N 2.99Å; N948-E952 PolarHBondContact OD1-O 2.89Å; N948-Y954 HydrophobicContact CB-CD1 3.95Å; N948-Y954 HydrophobicContact CB-CE1 3.86Å
949	P	71.8	Confident	84.9	Confident	14 Å²	14	50 Å²	50	9%	0.091	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-11.1	179.5	-22.2	34.2	0	0	0	115.5	E702 D703 R780 E782 N951	E702-P949 HydrophobicContact CG-CG 3.57Å; D703-P949 HydrophobicContact CB-CG 4.14Å; R780-P949 HydrophobicContact CB-CB 4.24Å; E782-P949 HydrophobicContact CG-CB 3.83Å; E782-P949 HydrophobicContact CG-CG 3.89Å; P949-N951 VanDerWaalsContact C-N 3.32Å
950	R	73.1	Confident	84.9	Confident	101 Å²	101	51.3 Å²	51.3	38%	0.381	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-0.5	173.1	-56.7	-177.7	173.7	-157.2	-6.2	112.6	E758 E782 N948 E952	E758-R950 IonicContact OE2-NH2 2.73Å; E758-R950 PolarHBondContact OE2-NH2 3.43Å; E782-R950 VanDerWaalsContact CD-NE 3.32Å; E782-R950 VanDerWaalsContact OE1-CG 3.32Å; E782-R950 WeakPolarHBondContact OE1-CG 3.25Å; E782-R950 IonicContact OE1-NE 2.76Å; E782-R950 IonicContact OE2-CZ 2.66Å; E782-R950 IonicContact OE2-NE 2.7Å; E782-R950 PolarHBondContact OE2-NE 2.91Å; E782-R950 IonicContact OE2-NH2 3.57Å; E782-R950 PolarHBondContact OE2-NH2 3.07Å; N948-R950 PolarHBondContact O-N 2.82Å; N948-R950 VanDerWaalsContact O-N 3.07Å; N948-R950 VanDerWaalsContact OD1-CA 3.29Å; N948-R950 WeakPolarHBondContact OD1-CA 3.36Å; N948-R950 VanDerWaalsContact OD1-CB 3.29Å; N948-R950 WeakPolarHBondContact OD1-CB 3.36Å; N948-R950 PolarHBondContact OD1-N 2.74Å; R950-E952 HydrophobicContact CB-CG 4.27Å
951	N	74	Confident	84.8	Confident	114 Å²	114	52.2 Å²	52.2	61%	0.61	25%	0.248	S	C	*	.	S	Bend	trans	66.4	34.8	-171.4	-59.6	-9.9	0	0	0	114.3	N948 P949	N948-N951 PolarHBondContact O-N 2.96Å; N948-N951 PolarHBondContact OD1-N 3.32Å; N948-N951 VanDerWaalsContact OD1-N 3.17Å; P949-N951 VanDerWaalsContact C-N 3.32Å
952	E	81.2	Confident	84.6	Confident	106 Å²	106	50.8 Å²	50.8	50%	0.495	24%	0.244	S	C	.	.			trans	-109.5	132.1	175.4	-55.7	159.2	150.6	0	0	109.4	N948 R950	N948-E952 PolarHBondContact N-O 2.92Å; N948-E952 PolarHBondContact ND2-OE2 2.89Å; N948-E952 PolarHBondContact OD1-N 2.99Å; N948-E952 PolarHBondContact OD1-O 2.89Å; R950-E952 HydrophobicContact CB-CG 4.27Å
953	W	83.1	Confident	84.4	Confident	107 Å²	107	51.9 Å²	51.9	41%	0.405	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	134.5	177.3	-72.5	106.2	0	0	0	111.1	R858 H892 W945 L946 L947	R858-W953 HydrophobicContact CB-CH2 4.22Å; R858-W953 HydrophobicContact CB-CZ3 4.24Å; R858-W953 HydrophobicContact CG-CH2 3.52Å; R858-W953 HydrophobicContact CG-CZ2 4.36Å; R858-W953 HydrophobicContact CG-CZ3 3.96Å; H892-W953 AromaticContact NE2-CD1 3.92Å; H892-W953 AromaticContact NE2-CG 3.81Å; W945-W953 HydrophobicContact CB-CE3 4.08Å; W945-W953 HydrophobicContact CE3-CB 4.1Å; L946-W953 WeakPolarHBondContact O-CA 3.48Å; L947-W953 HydrophobicContact CB-CD2 4.33Å; L947-W953 HydrophobicContact CB-CE3 4.09Å; L947-W953 HydrophobicContact CB-CH2 4.22Å; L947-W953 HydrophobicContact CB-CZ2 4.49Å; L947-W953 HydrophobicContact CB-CZ3 4.04Å; L947-W953 HydrophobicContact CD1-CD2 3.75Å; L947-W953 HydrophobicContact CD1-CE3 4.35Å; L947-W953 HydrophobicContact CD1-CG 3.88Å; L947-W953 HydrophobicContact CD1-CZ2 4.22Å
954	Y	84.8	Confident	84.2	Confident	40 Å²	40	51.6 Å²	51.6	16%	0.157	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	145.5	170.2	69	-89.1	0	0	0	111.5	E702 Q821 W945 L946 N948 L956	E702-Y954 WeakPolarHBondContact OE2-CE1 3.5Å; E702-Y954 PolarHBondContact OE2-OH 3.47Å; Q821-Y954 VanDerWaalsContact NE2-CE2 3.33Å; Q821-Y954 PolarHBondContact NE2-OH 3.08Å; W945-Y954 WeakPolarHBondContact CA-O 3.37Å; W945-Y954 VanDerWaalsContact CE3-C 3.42Å; L946-Y954 HydrophobicContact CB-CE1 4.45Å; L946-Y954 PolarHBondContact N-O 3.42Å; L946-Y954 WeakPolarHBondContact O-CD1 3.49Å; L946-Y954 PolarHBondContact O-N 2.86Å; N948-Y954 HydrophobicContact CB-CD1 3.95Å; N948-Y954 HydrophobicContact CB-CE1 3.86Å; Y954-L956 HydrophobicContact CE2-CB 4.47Å; Y954-L956 HydrophobicContact CE2-CD1 4.2Å
955	R	87.4	Confident	83.9	Confident	147 Å²	147	53.8 Å²	53.8	56%	0.555	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	122.8	176.3	-169.1	171.6	64.8	-157.2	-3.7	109.5	E943 E944 W945 T958	E943-R955 HydrophobicContact CB-CG 4.29Å; E943-R955 WeakPolarHBondContact OE1-CD 3.45Å; E943-R955 IonicContact OE1-CZ 2.61Å; E943-R955 IonicContact OE1-NE 2.65Å; E943-R955 IonicContact OE1-NH1 2.79Å; E943-R955 PolarHBondContact OE1-NH1 3.38Å; E944-R955 CarbonylContact O-C 3.59Å; E944-R955 WeakPolarHBondContact O-CA 3.43Å; W945-R955 HydrophobicContact CD2-CB 4Å; W945-R955 HydrophobicContact CD2-CG 4.43Å; W945-R955 HydrophobicContact CE3-CB 4.04Å; W945-R955 HydrophobicContact CH2-CB 4.01Å; W945-R955 HydrophobicContact CZ2-CB 3.95Å; W945-R955 HydrophobicContact CZ2-CG 4.28Å; W945-R955 HydrophobicContact CZ3-CB 4.05Å; R955-T958 HydrophobicContact CG-CG2 4.18Å
956	L	85.7	Confident	83.7	Confident	26 Å²	26	51.5 Å²	51.5	14%	0.136	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	-35.8	-172.6	179.6	54.5	0	0	0	112.1	P822 S853 E944 L946 Y954	P822-L956 HydrophobicContact CB-CD2 4.44Å; S853-L956 VanDerWaalsContact CB-CD2 3.48Å; E944-L956 PolarHBondContact O-N 3.08Å; L946-L956 HydrophobicContact CB-CD2 4.04Å; L946-L956 HydrophobicContact CD2-CD2 3.86Å; Y954-L956 HydrophobicContact CE2-CB 4.47Å; Y954-L956 HydrophobicContact CE2-CD1 4.2Å
957	A	86.8	Confident	83.4	Confident	18 Å²	18	54 Å²	54	15%	0.149	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	163.8	177.6	0	0	0	0	0	111.9	P824 L826 E944	P824-A957 HydrophobicContact CB-CB 3.93Å; L826-A957 HydrophobicContact CB-CB 3.57Å; L826-A957 HydrophobicContact CD2-CB 4.17Å; E944-A957 HydrophobicContact CB-CB 4.21Å; E944-A957 PolarHBondContact N-O 3.24Å; E944-A957 PolarHBondContact O-N 3.34Å
958	T	90.5	Very high	83.3	Confident	74 Å²	74	52.2 Å²	52.2	45%	0.454	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	145.7	171.3	58.1	0	0	0	0	110.6	V942 E943 R955	V942-T958 CarbonylContact O-C 3.59Å; V942-T958 VanDerWaalsContact O-CA 3.28Å; V942-T958 WeakPolarHBondContact O-CA 3.39Å; E943-T958 HydrophobicContact CB-CG2 4.23Å; E943-T958 HydrophobicContact CG-CG2 3.95Å; R955-T958 HydrophobicContact CG-CG2 4.18Å
959	N	89.4	Confident	83.3	Confident	46 Å²	46	55.8 Å²	55.8	25%	0.246	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	162.5	178	-157.7	-8.7	0	0	0	111.5	L826 V828 V942	L826-N959 HydrophobicContact CD2-CB 3.98Å; L826-N959 HydrophobicContact CG-CB 4.1Å; L826-N959 PolarHBondContact O-ND2 3.46Å; V828-N959 HydrophobicContact CG2-CB 3.96Å; V942-N959 PolarHBondContact N-O 3.45Å; V942-N959 PolarHBondContact O-N 2.74Å
960	N	89.1	Confident	82.9	Confident	66 Å²	66	62.3 Å²	62.3	35%	0.353	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	157	-177.8	-66.5	9.1	0	0	0	111.5	Y939 C940 H941	Y939-N960 HydrophobicContact CD2-CB 4.44Å; C940-N960 CarbonylContact O-C 3.56Å; C940-N960 VanDerWaalsContact O-CA 3.31Å; C940-N960 WeakPolarHBondContact O-CA 3.29Å; H941-N960 PolarHBondContact ND1-OD1 2.89Å
961	S	88.9	Confident	81.8	Confident	18 Å²	18	66.3 Å²	66.3	13%	0.126	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-81.1	170.7	166.9	73	0	0	0	0	112.9	D829 C940	D829-S961 CarbonylContact O-C 3.55Å; D829-S961 VanDerWaalsContact O-CA 3.22Å; D829-S961 WeakPolarHBondContact O-CA 3.39Å; D829-S961 VanDerWaalsContact O-CB 3.24Å; D829-S961 WeakPolarHBondContact O-CB 3.04Å; C940-S961 PolarHBondContact N-OG 2.65Å; C940-S961 PolarHBondContact O-N 3.03Å; C940-S961 VanDerWaalsContact SG-CB 3.54Å
962	G	85.4	Confident	80.4	Confident	11 Å²	11	67.9 Å²	67.9	11%	0.113	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-63.3	164	159.3	0	0	0	0	0	111.5	D829 E830	D829-G962 PolarHBondContact O-N 2.68Å; E830-G962 VanDerWaalsContact C-CA 3.49Å; E830-G962 WeakPolarHBondContact O-CA 3.27Å
963	V	86.3	Confident	78.6	Confident	22 Å²	22	67.8 Å²	67.8	13%	0.133	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-88.3	125.1	-177	-179.3	0	0	0	0	111.1	E832 N833 R937 Y938 I965	E832-V963 CarbonylContact C-O 3.55Å; E832-V963 VanDerWaalsContact CA-O 3.24Å; E832-V963 WeakPolarHBondContact CA-O 3.31Å; E832-V963 HydrophobicContact CG-CB 4.28Å; N833-V963 PolarHBondContact N-O 3.09Å; R937-V963 HydrophobicContact CB-CG1 3.62Å; R937-V963 HydrophobicContact CG-CG1 4.03Å; Y938-V963 CarbonylContact O-C 3.6Å; Y938-V963 WeakPolarHBondContact O-CA 3.49Å; V963-I965 HydrophobicContact CG1-CG1 4.16Å
964	T	86.5	Confident	76.9	Confident	13 Å²	13	68.4 Å²	68.4	8%	0.08	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	106.1	164.6	-57.6	0	0	0	0	109.2	N833 V835 L845 Y938 V966	N833-T964 HydrophobicContact CB-CG2 4.22Å; N833-T964 CarbonylContact O-C 3.51Å; N833-T964 WeakPolarHBondContact O-CA 3.47Å; V835-T964 HydrophobicContact CB-CG2 4.48Å; V835-T964 HydrophobicContact CG2-CG2 3.76Å; L845-T964 HydrophobicContact CD2-CG2 3.76Å; Y938-T964 PolarHBondContact N-O 3.16Å; Y938-T964 PolarHBondContact O-N 2.64Å; T964-V966 HydrophobicContact CG2-CG2 4.22Å
965	I	84.7	Confident	75.4	Confident	46 Å²	46	73.5 Å²	73.5	24%	0.236	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	124.8	174.9	-52.3	178.2	0	0	0	108.4	N833 N834 V835 V963	N833-I965 PolarHBondContact O-N 2.84Å; N834-I965 WeakPolarHBondContact CA-O 3.37Å; N834-I965 PolarHBondContact OD1-O 2.98Å; V835-I965 PolarHBondContact N-O 2.95Å; V963-I965 HydrophobicContact CG1-CG1 4.16Å
966	V	84.6	Confident	73.5	Confident	2 Å²	2	74.5 Å²	74.5	1%	0.012	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	127.5	-177.7	178.8	0	0	0	0	110.3	V835 V837 I843 L845 D934 A935 G936 Y938 T964	V835-V966 WeakPolarHBondContact O-CA 3.5Å; V837-V966 HydrophobicContact CG2-CG1 4.17Å; I843-V966 HydrophobicContact CD1-CG1 3.7Å; I843-V966 HydrophobicContact CG1-CG1 3.76Å; I843-V966 HydrophobicContact CG2-CG1 4.02Å; I843-V966 HydrophobicContact CG2-CG2 3.73Å; L845-V966 HydrophobicContact CD2-CG2 4.12Å; D934-V966 WeakPolarHBondContact O-CG1 3.29Å; A935-V966 WeakPolarHBondContact CA-O 3.41Å; G936-V966 PolarHBondContact N-O 2.92Å; G936-V966 PolarHBondContact O-N 3.21Å; Y938-V966 HydrophobicContact CD2-CB 3.99Å; Y938-V966 HydrophobicContact CD2-CG2 3.5Å; Y938-V966 VanDerWaalsContact CD2-CG2 3.5Å; Y938-V966 HydrophobicContact CE2-CB 3.92Å; Y938-V966 HydrophobicContact CE2-CG2 3.82Å; Y938-V966 HydrophobicContact CG-CG2 4.45Å; T964-V966 HydrophobicContact CG2-CG2 4.22Å
967	N	80.6	Confident	72.1	Confident	64 Å²	64	76.5 Å²	76.5	34%	0.342	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	129.8	-175.1	-71.8	-73.4	0	0	0	110.8	N834 V835 T836 V837	N834-N967 PolarHBondContact OD1-ND2 2.86Å; V835-N967 PolarHBondContact O-N 3.5Å; T836-N967 WeakPolarHBondContact CA-O 3.25Å; T836-N967 HydrophobicContact CG2-CB 3.76Å; V837-N967 VanDerWaalsContact CG2-O 3.29Å; V837-N967 WeakPolarHBondContact CG2-O 3.4Å; V837-N967 PolarHBondContact N-O 2.77Å
968	V	80	Confident	70.6	Confident	33 Å²	33	80.1 Å²	80.1	20%	0.2	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132.9	-173.8	-169.9	0	0	0	0	111.6	V837 E839 A935	V837-V968 HydrophobicContact CG2-CG2 3.99Å; V837-V968 WeakPolarHBondContact O-CA 3.38Å; E839-V968 HydrophobicContact CB-CG1 4.3Å; A935-V968 HydrophobicContact CB-CG2 4.28Å
969	L	75.1	Confident	68.8	Low	103 Å²	103	80.6 Å²	80.6	54%	0.539	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	141.1	-175.2	-62.1	174.5	0	0	0	113.9	V837 E839	V837-L969 PolarHBondContact O-N 3.23Å; E839-L969 PolarHBondContact N-O 2.77Å
970	Q	62.6	Low	67.2	Low	152 Å²	152	83.3 Å²	83.3	71%	0.71	47%	0.468	S	S	*	.			trans	-104.5	159.7	179.5	-70.6	-177.5	-13.5	0	0	113.9
971	Q	50.4	Low	65.8	Low	185 Å²	185	84.5 Å²	84.5	86%	0.864	48%	0.482	S	S	*	.			trans	-108.5	154.5	-175.9	-108.5	-179.4	28.9	0	0	114.8
972	V	46	Very low	64	Low	146 Å²	146	87.1 Å²	87.1	89%	0.885	50%	0.495	S	S	*	.			trans	-128.9	147.6	-174.5	-173.8	0	0	0	0	111.9
973	S	42.2	Very low	62.8	Low	104 Å²	104	93.4 Å²	93.4	73%	0.727	52%	0.521	S	S	*	.			trans	-114.3	171.2	-165.1	65.1	0	0	0	0	115.5
974	T	47.7	Very low	61.5	Low	120 Å²	120	96.2 Å²	96.2	74%	0.736	54%	0.542	S	S	*	.			trans	-137.4	166.9	-175.6	60.7	0	0	0	0	115.1	H976 S977	T974-H976 VanDerWaalsContact C-N 3.31Å; T974-H976 PolarHBondContact O-N 3Å; T974-S977 PolarHBondContact O-OG 2.97Å
975	I	52.8	Low	60.1	Low	147 Å²	147	99.9 Å²	99.9	75%	0.754	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-63.8	-8.5	-151.8	-8.2	176.3	0	0	0	118.3	S977 V978	I975-S977 PolarHBondContact O-N 2.98Å; I975-V978 HydrophobicContact CG2-CG2 4.36Å
976	H	48.5	Very low	59.1	Low	169 Å²	169	102 Å²	102	78%	0.782	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-71.6	-12.1	-178.1	-158.7	-66.2	0	0	0	113	T974	T974-H976 VanDerWaalsContact C-N 3.31Å; T974-H976 PolarHBondContact O-N 3Å
977	S	56.1	Low	58.1	Low	67 Å²	67	107.2 Å²	107.2	47%	0.469	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-80.6	-17.3	-180	54.2	0	0	0	0	115	T974 I975 S981	T974-S977 PolarHBondContact O-OG 2.97Å; I975-S977 PolarHBondContact O-N 2.98Å; S977-S981 PolarHBondContact O-OG 3.29Å
978	V	55.9	Low	57.2	Low	94 Å²	94	111.3 Å²	111.3	57%	0.57	60%	0.604	S	S	*	*	S	Bend	trans	-79.1	-25.5	-169.6	-175.6	0	0	0	0	113.3	I975 S981	I975-V978 HydrophobicContact CG2-CG2 4.36Å; V978-S981 PolarHBondContact O-OG 3.11Å
979	V	52.4	Low	56.3	Low	84 Å²	84	114.4 Å²	114.4	51%	0.509	62%	0.618	S	S	.	*	S	Bend	trans	-86.3	-18.7	-179	-176.7	0	0	0	0	112.3	F990	V979-F990 HydrophobicContact CG1-CE2 4.35Å
980	C	55.6	Low	55.7	Low	103 Å²	103	114.4 Å²	114.4	70%	0.696	61%	0.614	S	S	*	*	S	Bend	trans	-100.3	1.7	-176.2	-60.6	0	0	0	0	114.1
981	S	58.7	Low	55.7	Low	92 Å²	92	112.6 Å²	112.6	64%	0.643	60%	0.604	S	S	*	*	S	Bend	trans	-108.3	7.1	-171.9	53.5	0	0	0	0	114.9	S977 V978	S977-S981 PolarHBondContact O-OG 3.29Å; V978-S981 PolarHBondContact O-OG 3.11Å
982	N	52.2	Low	56.3	Low	72 Å²	72	111.7 Å²	111.7	39%	0.385	59%	0.594	S	S	.	*			trans	-141.5	105.7	177.2	-173.8	-21.9	0	0	0	111.6	S984 L985 F986	N982-S984 PolarHBondContact O-N 3.23Å; N982-S984 PolarHBondContact OD1-N 3.17Å; N982-S984 VanDerWaalsContact OD1-N 3.09Å; N982-S984 PolarHBondContact OD1-OG 2.8Å; N982-L985 HydrophobicContact CB-CD1 4.45Å; N982-L985 PolarHBondContact O-N 3.22Å; N982-F986 PolarHBondContact O-N 3.35Å
983	E	59.9	Low	57.1	Low	143 Å²	143	106.7 Å²	106.7	67%	0.668	57%	0.565	S	S	*	*	H	α-helix	trans	-56.3	-35.1	-178.5	-67.8	-168	103.1	0	0	113.6	L985 F986 Y987	E983-L985 VanDerWaalsContact C-N 3.32Å; E983-L985 PolarHBondContact O-N 3.17Å; E983-F986 WeakPolarHBondContact O-CB 3.12Å; E983-F986 PolarHBondContact O-N 3.36Å; E983-F986 VanDerWaalsContact O-N 3.16Å; E983-Y987 HydrophobicContact CB-CE2 4.35Å; E983-Y987 VanDerWaalsContact O-CD2 3.22Å; E983-Y987 WeakPolarHBondContact O-CD2 3.37Å; E983-Y987 PolarHBondContact O-N 2.9Å
984	S	58.3	Low	57.9	Low	82 Å²	82	108.8 Å²	108.8	57%	0.573	56%	0.561	S	S	*	*	H	α-helix	trans	-65	-35.8	-177.3	69.3	0	0	0	0	112.6	N982 F988	N982-S984 PolarHBondContact O-N 3.23Å; N982-S984 PolarHBondContact OD1-N 3.17Å; N982-S984 VanDerWaalsContact OD1-N 3.09Å; N982-S984 PolarHBondContact OD1-OG 2.8Å; S984-F988 WeakPolarHBondContact O-CB 3.29Å; S984-F988 PolarHBondContact O-N 3.37Å
985	L	58.8	Low	58.5	Low	89 Å²	89	107.2 Å²	107.2	47%	0.466	55%	0.553	S	S	.	*	H	α-helix	trans	-75.6	-36	172.9	-82.1	164	0	0	0	111.8	N982 E983 F988 L989	N982-L985 HydrophobicContact CB-CD1 4.45Å; N982-L985 PolarHBondContact O-N 3.22Å; E983-L985 VanDerWaalsContact C-N 3.32Å; E983-L985 PolarHBondContact O-N 3.17Å; L985-F988 PolarHBondContact O-N 3.45Å; L985-L989 HydrophobicContact CD2-CD1 4.41Å; L985-L989 WeakPolarHBondContact O-CB 3.27Å; L985-L989 PolarHBondContact O-N 3.15Å
986	F	62.5	Low	59	Low	90 Å²	90	105.2 Å²	105.2	40%	0.395	54%	0.543	S	S	.	.	H	α-helix	trans	-59	-50.8	177.6	-176	-106.7	0	0	0	111.8	N982 E983 F988 F990 F991	N982-F986 PolarHBondContact O-N 3.35Å; E983-F986 WeakPolarHBondContact O-CB 3.12Å; E983-F986 PolarHBondContact O-N 3.36Å; E983-F986 VanDerWaalsContact O-N 3.16Å; F986-F988 PolarHBondContact O-N 3.21Å; F986-F990 AromaticContact CD2-CD2 3.95Å; F986-F990 HydrophobicContact CD2-CD2 3.95Å; F986-F990 HydrophobicContact CE2-CD2 4.28Å; F986-F990 WeakPolarHBondContact O-CB 3.19Å; F986-F990 PolarHBondContact O-N 3.16Å; F986-F991 HydrophobicContact CD1-CE2 4.43Å; F986-F991 HydrophobicContact CE1-CD2 4.49Å; F986-F991 AromaticContact CE1-CE2 3.81Å; F986-F991 HydrophobicContact CE1-CE2 3.81Å; F986-F991 HydrophobicContact CZ-CE2 4.33Å
987	Y	64.4	Low	59.5	Low	113 Å²	113	102.9 Å²	102.9	44%	0.443	53%	0.53	S	S	.	.	H	α-helix	trans	-66.3	-38.6	177.5	-72	-70.6	0	0	0	113.1	E983 F991 Y992	E983-Y987 HydrophobicContact CB-CE2 4.35Å; E983-Y987 VanDerWaalsContact O-CD2 3.22Å; E983-Y987 WeakPolarHBondContact O-CD2 3.37Å; E983-Y987 PolarHBondContact O-N 2.9Å; Y987-F991 HydrophobicContact CD1-CB 4.28Å; Y987-F991 AromaticContact CD1-CD2 3.72Å; Y987-F991 HydrophobicContact CD1-CD2 3.72Å; Y987-F991 HydrophobicContact CD1-CE2 4.32Å; Y987-F991 HydrophobicContact CD1-CG 4.06Å; Y987-F991 HydrophobicContact CE1-CD2 4.16Å; Y987-F991 HydrophobicContact CE1-CE2 4.32Å; Y987-F991 PolarHBondContact O-N 3.07Å; Y987-F991 VanDerWaalsContact O-N 3.07Å; Y987-Y992 PolarHBondContact O-N 3.04Å; Y987-Y992 VanDerWaalsContact O-N 3.16Å
988	F	61.2	Low	59.9	Low	150 Å²	150	101.5 Å²	101.5	66%	0.658	53%	0.526	S	S	*	.	H	α-helix	trans	-66.6	-37	-179.8	-165.8	-97.5	0	0	0	112.8	S984 L985 F986	S984-F988 WeakPolarHBondContact O-CB 3.29Å; S984-F988 PolarHBondContact O-N 3.37Å; L985-F988 PolarHBondContact O-N 3.45Å; F986-F988 PolarHBondContact O-N 3.21Å
989	L	61.8	Low	60.1	Low	97 Å²	97	103.4 Å²	103.4	51%	0.508	53%	0.532	S	S	.	.	H	α-helix	trans	-91.4	-28.6	-179.1	-71.4	167.4	0	0	0	114.5	L985 P993	L985-L989 HydrophobicContact CD2-CD1 4.41Å; L985-L989 WeakPolarHBondContact O-CB 3.27Å; L985-L989 PolarHBondContact O-N 3.15Å; L989-P993 WeakPolarHBondContact O-CG 3.45Å
990	F	62	Low	60.6	Low	103 Å²	103	103.3 Å²	103.3	45%	0.452	53%	0.528	S	S	.	.	H	α-helix	trans	-113.6	-12.5	-173.1	-70.3	-84.8	0	0	0	115.8	V979 F986 F994	V979-F990 HydrophobicContact CG1-CE2 4.35Å; F986-F990 AromaticContact CD2-CD2 3.95Å; F986-F990 HydrophobicContact CD2-CD2 3.95Å; F986-F990 HydrophobicContact CE2-CD2 4.28Å; F986-F990 WeakPolarHBondContact O-CB 3.19Å; F986-F990 PolarHBondContact O-N 3.16Å; F990-F994 WeakPolarHBondContact O-CD2 3.13Å; F990-F994 WeakPolarHBondContact O-CE2 3.35Å
991	F	62.9	Low	60.8	Low	115 Å²	115	102.8 Å²	102.8	50%	0.504	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	-47.3	178.7	-77.4	-91.4	0	0	0	113.4	F986 Y987 P993 F994 P995	F986-F991 HydrophobicContact CD1-CE2 4.43Å; F986-F991 HydrophobicContact CE1-CD2 4.49Å; F986-F991 AromaticContact CE1-CE2 3.81Å; F986-F991 HydrophobicContact CE1-CE2 3.81Å; F986-F991 HydrophobicContact CZ-CE2 4.33Å; Y987-F991 HydrophobicContact CD1-CB 4.28Å; Y987-F991 AromaticContact CD1-CD2 3.72Å; Y987-F991 HydrophobicContact CD1-CD2 3.72Å; Y987-F991 HydrophobicContact CD1-CE2 4.32Å; Y987-F991 HydrophobicContact CD1-CG 4.06Å; Y987-F991 HydrophobicContact CE1-CD2 4.16Å; Y987-F991 HydrophobicContact CE1-CE2 4.32Å; Y987-F991 PolarHBondContact O-N 3.07Å; Y987-F991 VanDerWaalsContact O-N 3.07Å; F991-P993 VanDerWaalsContact C-CD 3.45Å; F991-F994 PolarHBondContact O-N 3.16Å; F991-P995 WeakPolarHBondContact O-CD 3.41Å
992	Y	62	Low	60.7	Low	166 Å²	166	105.3 Å²	105.3	65%	0.651	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-25.4	179.3	-83.7	-82	0	0	0	116.3	Y987 P995	Y987-Y992 PolarHBondContact O-N 3.04Å; Y987-Y992 VanDerWaalsContact O-N 3.16Å; Y992-P995 WeakPolarHBondContact O-CD 3.21Å
993	P	62.3	Low	60.9	Low	41 Å²	41	105.1 Å²	105.1	27%	0.266	53%	0.531	S	S	.	.	H	α-helix	trans	-71.8	-25.4	173.7	-24.5	37.5	0	0	0	114.2	L989 F991 I996 F997	L989-P993 WeakPolarHBondContact O-CG 3.45Å; F991-P993 VanDerWaalsContact C-CD 3.45Å; P993-I996 CarbonylContact O-C 3.59Å; P993-I996 PolarHBondContact O-N 3.49Å; P993-I996 VanDerWaalsContact O-N 3.09Å; P993-F997 HydrophobicContact CB-CD2 4.32Å; P993-F997 WeakPolarHBondContact O-CB 3.43Å; P993-F997 PolarHBondContact O-N 3.38Å
994	F	60.5	Low	60.8	Low	147 Å²	147	102.8 Å²	102.8	65%	0.645	52%	0.523	S	S	*	.	H	α-helix	trans	-69.8	-36.3	-172.2	-79.4	-89	0	0	0	115	F990 F991 I996 G998	F990-F994 WeakPolarHBondContact O-CD2 3.13Å; F990-F994 WeakPolarHBondContact O-CE2 3.35Å; F991-F994 PolarHBondContact O-N 3.16Å; F994-I996 PolarHBondContact O-N 3.17Å; F994-G998 WeakPolarHBondContact O-CA 3.22Å; F994-G998 PolarHBondContact O-N 3.09Å
995	P	59.3	Low	60.8	Low	88 Å²	88	105.7 Å²	105.7	57%	0.571	53%	0.531	S	S	*	.	H	α-helix	trans	-58.4	-34.6	166.6	-27.5	35.5	0	0	0	113.4	F991 Y992 I999	F991-P995 WeakPolarHBondContact O-CD 3.41Å; Y992-P995 WeakPolarHBondContact O-CD 3.21Å; P995-I999 WeakPolarHBondContact O-CD1 3.39Å; P995-I999 WeakPolarHBondContact O-CG1 3.42Å
996	I	64	Low	60.5	Low	105 Å²	105	107.2 Å²	107.2	54%	0.538	54%	0.544	S	S	.	.	H	α-helix	trans	-83.7	-46.4	-175.3	-56.5	175.6	0	0	0	110.9	P993 F994 G998 I999 L1000	P993-I996 CarbonylContact O-C 3.59Å; P993-I996 PolarHBondContact O-N 3.49Å; P993-I996 VanDerWaalsContact O-N 3.09Å; F994-I996 PolarHBondContact O-N 3.17Å; I996-G998 VanDerWaalsContact C-N 3.27Å; I996-G998 PolarHBondContact O-N 3.23Å; I996-I999 WeakPolarHBondContact O-CB 3.5Å; I996-I999 PolarHBondContact O-N 3.36Å; I996-I999 VanDerWaalsContact O-N 3.17Å; I996-L1000 PolarHBondContact O-N 3.01Å
997	F	58.9	Low	60.4	Low	120 Å²	120	107.2 Å²	107.2	53%	0.526	55%	0.551	S	S	.	*	H	α-helix	trans	-70.4	-20	171.8	-92.9	-86.1	0	0	0	112.9	P993 I999 L1000 L1001	P993-F997 HydrophobicContact CB-CD2 4.32Å; P993-F997 WeakPolarHBondContact O-CB 3.43Å; P993-F997 PolarHBondContact O-N 3.38Å; F997-I999 VanDerWaalsContact C-N 3.34Å; F997-L1000 HydrophobicContact CD1-CB 4.44Å; F997-L1000 PolarHBondContact O-N 3.22Å; F997-L1001 WeakPolarHBondContact O-CB 3.45Å; F997-L1001 PolarHBondContact O-N 3.08Å
998	G	64.9	Low	60	Low	37 Å²	37	112.8 Å²	112.8	38%	0.381	57%	0.571	S	S	.	*	H	α-helix	trans	-60.2	-46.3	165.3	0	0	0	0	0	111.2	F994 I996 I1002	F994-G998 WeakPolarHBondContact O-CA 3.22Å; F994-G998 PolarHBondContact O-N 3.09Å; I996-G998 VanDerWaalsContact C-N 3.27Å; I996-G998 PolarHBondContact O-N 3.23Å; G998-I1002 VanDerWaalsContact O-CD1 3.29Å; G998-I1002 WeakPolarHBondContact O-CD1 3.44Å; G998-I1002 VanDerWaalsContact O-CG1 3.27Å; G998-I1002 WeakPolarHBondContact O-CG1 3.47Å
999	I	60.4	Low	59.9	Low	134 Å²	134	115.6 Å²	115.6	69%	0.687	58%	0.579	S	S	*	*	H	α-helix	trans	-67.2	-36.5	175.2	-60.9	163.2	0	0	0	111.1	P995 I996 F997	P995-I999 WeakPolarHBondContact O-CD1 3.39Å; P995-I999 WeakPolarHBondContact O-CG1 3.42Å; I996-I999 WeakPolarHBondContact O-CB 3.5Å; I996-I999 PolarHBondContact O-N 3.36Å; I996-I999 VanDerWaalsContact O-N 3.17Å; F997-I999 VanDerWaalsContact C-N 3.34Å
1000	L	62.6	Low	58.7	Low	82 Å²	82	120.3 Å²	120.3	43%	0.429	60%	0.595	S	S	.	*	H	α-helix	trans	-84	-34.4	-175.5	-117.8	169.6	0	0	0	114.9	I996 F997 I1002 A1003 L1004	I996-L1000 PolarHBondContact O-N 3.01Å; F997-L1000 HydrophobicContact CD1-CB 4.44Å; F997-L1000 PolarHBondContact O-N 3.22Å; L1000-I1002 VanDerWaalsContact C-N 3.33Å; L1000-A1003 WeakPolarHBondContact O-CA 3.39Å; L1000-A1003 WeakPolarHBondContact O-CB 3.49Å; L1000-A1003 PolarHBondContact O-N 2.75Å; L1000-L1004 PolarHBondContact O-N 3.09Å; L1000-L1004 VanDerWaalsContact O-N 3.08Å
1001	L	58.2	Low	57.2	Low	92 Å²	92	119.1 Å²	119.1	48%	0.482	61%	0.612	S	S	.	*	H	α-helix	trans	-72.5	-30.1	-180	-165.3	76.4	0	0	0	111.4	F997 A1003 L1004 L1005	F997-L1001 WeakPolarHBondContact O-CB 3.45Å; F997-L1001 PolarHBondContact O-N 3.08Å; L1001-A1003 PolarHBondContact O-N 2.75Å; L1001-L1004 PolarHBondContact O-N 3Å; L1001-L1004 VanDerWaalsContact O-N 3.11Å; L1001-L1005 HydrophobicContact CD1-CG 4.27Å; L1001-L1005 HydrophobicContact CD2-CD1 3.99Å; L1001-L1005 HydrophobicContact CG-CD1 4.04Å; L1001-L1005 HydrophobicContact CG-CG 4.21Å; L1001-L1005 PolarHBondContact O-N 2.96Å
1002	I	57.2	Low	55.7	Low	146 Å²	146	124.9 Å²	124.9	75%	0.749	63%	0.631	S	S	*	*	H	α-helix	trans	-54.4	-30.7	165.9	-71.8	171	0	0	0	111.2	G998 L1000	G998-I1002 VanDerWaalsContact O-CD1 3.29Å; G998-I1002 WeakPolarHBondContact O-CD1 3.44Å; G998-I1002 VanDerWaalsContact O-CG1 3.27Å; G998-I1002 WeakPolarHBondContact O-CG1 3.47Å; L1000-I1002 VanDerWaalsContact C-N 3.33Å
1003	A	56.9	Low	54.1	Low	67 Å²	67	123.1 Å²	123.1	55%	0.554	63%	0.632	S	S	*	*	H	α-helix	trans	-91.6	-21.1	176.2	0	0	0	0	0	114.6	L1000 L1001	L1000-A1003 WeakPolarHBondContact O-CA 3.39Å; L1000-A1003 WeakPolarHBondContact O-CB 3.49Å; L1000-A1003 PolarHBondContact O-N 2.75Å; L1001-A1003 PolarHBondContact O-N 2.75Å
1004	L	57.1	Low	53.4	Low	95 Å²	95	128 Å²	128	50%	0.497	66%	0.656	S	S	.	*	H	α-helix	trans	-113.2	-13.2	-167.7	-124.1	171.9	0	0	0	115.8	L1000 L1001 V1006 V1007	L1000-L1004 PolarHBondContact O-N 3.09Å; L1000-L1004 VanDerWaalsContact O-N 3.08Å; L1001-L1004 PolarHBondContact O-N 3Å; L1001-L1004 VanDerWaalsContact O-N 3.11Å; L1004-V1006 PolarHBondContact O-N 3.37Å; L1004-V1007 HydrophobicContact CD2-CB 4.27Å; L1004-V1007 HydrophobicContact CD2-CG2 3.75Å; L1004-V1007 WeakPolarHBondContact O-CG2 3.44Å
1005	L	59.4	Low	52.9	Low	142 Å²	142	127.5 Å²	127.5	74%	0.743	66%	0.661	S	S	*	*	S	Bend	trans	-69.2	6.4	170.2	-107.5	171.7	0	0	0	113.9	L1001 V1007	L1001-L1005 HydrophobicContact CD1-CG 4.27Å; L1001-L1005 HydrophobicContact CD2-CD1 3.99Å; L1001-L1005 HydrophobicContact CG-CD1 4.04Å; L1001-L1005 HydrophobicContact CG-CG 4.21Å; L1001-L1005 PolarHBondContact O-N 2.96Å; L1005-V1007 VanDerWaalsContact C-N 3.3Å; L1005-V1007 PolarHBondContact O-N 3.41Å
1006	V	52.4	Low	52.8	Low	122 Å²	122	130.7 Å²	130.7	74%	0.739	67%	0.665	S	S	*	*	S	Bend	trans	-83.5	22.5	175	-160.9	0	0	0	0	111.9	L1004	L1004-V1006 PolarHBondContact O-N 3.37Å
1007	V	59.9	Low	52.5	Low	90 Å²	90	129.8 Å²	129.8	55%	0.545	67%	0.669	S	S	.	*			trans	-130.3	-129.9	-160.9	-164.6	0	0	0	0	121.1	L1004 L1005	L1004-V1007 HydrophobicContact CD2-CB 4.27Å; L1004-V1007 HydrophobicContact CD2-CG2 3.75Å; L1004-V1007 WeakPolarHBondContact O-CG2 3.44Å; L1005-V1007 VanDerWaalsContact C-N 3.3Å; L1005-V1007 PolarHBondContact O-N 3.41Å
1008	R	56.1	Low	52.5	Low	229 Å²	229	131.1 Å²	131.1	86%	0.864	68%	0.677	S	S	*	*			trans	-138.9	-149.6	-143.5	-64.3	169.4	-169.1	160.2	4.9	121.7
1009	Y	60	Low	52.2	Low	210 Å²	210	135.8 Å²	135.8	82%	0.824	69%	0.688	S	S	*	*			trans	-158.6	158	-137.4	-103.9	142.7	0	0	0	122.6
1010	K	35.8	Very low	52	Low	195 Å²	195	132.6 Å²	132.6	85%	0.848	69%	0.689	S	S	*	*			trans	98.8	167.8	143.6	-70.2	159.7	-170.6	-178.1	0	125.7
1011	G	30.8	Very low	51.6	Low	79 Å²	79	136.6 Å²	136.6	81%	0.814	70%	0.703	S	S	*	*			trans	-170.7	-166.1	-172.6	0	0	0	0	0	114.8
1012	R	30.6	Very low	51.5	Low	235 Å²	235	140 Å²	140	89%	0.887	72%	0.721	S	S	*	*			cis	179.2	162.9	-1.1	168	-175.7	155	172.3	-2.6	114.5
1013	N	29.4	Very low	51	Low	129 Å²	129	137 Å²	137	69%	0.69	73%	0.726	S	S	*	*			trans	113.6	166.7	148.4	-124.1	78.5	0	0	0	125.2
1014	N	46.1	Very low	50.2	Low	143 Å²	143	138.9 Å²	138.9	77%	0.765	74%	0.742	S	S	*	*			trans	-158.4	167.9	-167.1	-168.1	20.7	0	0	0	119.4
1015	N	51.7	Low	50	Low	138 Å²	138	139.6 Å²	139.6	74%	0.738	75%	0.752	S	S	*	*			trans	-174.8	178.7	175.5	-115.6	-111.9	0	0	0	114.4
1016	K	56.2	Low	49.1	Very low	154 Å²	154	140 Å²	140	67%	0.67	75%	0.754	S	S	*	*			cis	-173.6	-174.5	-15	-141.6	-165.1	150.6	-119.6	0	109.3
1017	S	58.4	Low	48.3	Very low	87 Å²	87	140 Å²	140	61%	0.608	75%	0.749	S	S	*	*			cis	-172.8	-175.1	-24.9	40	0	0	0	0	109.2
1018	Q	59.1	Low	46.9	Very low	148 Å²	148	146.2 Å²	146.2	69%	0.692	76%	0.763	S	S	*	*			cis	-172.3	-178	-1.7	-121.1	163.3	-84.9	0	0	108
1019	E	57.8	Low	45.8	Very low	134 Å²	134	141.6 Å²	141.6	63%	0.626	76%	0.755	S	S	*	*			cis	-168.8	-174.6	-5.8	-153.4	169.3	-68.5	0	0	108.7	K1021	E1019-K1021 WeakPolarHBondContact OE2-CE 3.43Å; E1019-K1021 IonicContact OE2-NZ 3.76Å; E1019-K1021 PolarHBondContact OE2-NZ 2.66Å
1020	G	55.4	Low	44.2	Very low	68 Å²	68	139 Å²	139	70%	0.701	75%	0.748	S	S	*	*			cis	176.4	-171.5	4.6	0	0	0	0	0	109.6
1021	K	54.9	Low	44	Very low	166 Å²	166	136.9 Å²	136.9	72%	0.722	74%	0.74	S	S	*	*			cis	-179	169.4	-13.7	-79.9	152.1	173.1	167.8	0	109.5	E1019	E1019-K1021 WeakPolarHBondContact OE2-CE 3.43Å; E1019-K1021 IonicContact OE2-NZ 3.76Å; E1019-K1021 PolarHBondContact OE2-NZ 2.66Å
1022	N	56.4	Low	44.8	Very low	163 Å²	163	137.1 Å²	137.1	87%	0.872	73%	0.728	S	S	*	*			cis	-172.5	158	-22.6	-80.2	7.6	0	0	0	113.8
1023	G	46	Very low	44.6	Very low	83 Å²	83	134.2 Å²	134.2	86%	0.856	72%	0.724	S	S	*	*			trans	149.1	162.6	164.6	0	0	0	0	0	122.3
1024	A	40.6	Very low	44.7	Very low	106 Å²	106	135.5 Å²	135.5	88%	0.876	73%	0.73	S	S	*	*			trans	75.3	-156.8	158	0	0	0	0	0	124.5
1025	P	53.7	Low	43.7	Very low	111 Å²	111	132.8 Å²	132.8	72%	0.721	72%	0.722	S	S	*	*			trans	-141.5	-166.7	-133.7	43.1	-18.5	0	0	0	121.3
1026	L	39.8	Very low	42.7	Very low	150 Å²	150	137 Å²	137	79%	0.785	73%	0.729	S	S	*	*			trans	89.1	142	149.6	-73.6	170.4	0	0	0	126.9
1027	L	35.5	Very low	41.5	Very low	121 Å²	121	134.3 Å²	134.3	63%	0.634	73%	0.73	S	S	*	*			trans	78.4	114.7	137.3	-71.7	165.5	0	0	0	128.3
1028	W	31.1	Very low	40.8	Very low	221 Å²	221	135 Å²	135	84%	0.837	73%	0.733	S	S	*	*				75.8	143.4	120.1	-84.7	11.4	0	0	0	128.7
1029	I	33.1	Very low	39.4	Very low	133 Å²	133	133.4 Å²	133.4	68%	0.682	73%	0.733	S	S	*	*			trans	101.5	124.3	139.3	-82.8	165.4	0	0	0	123.4
1030	K	25.5	Very low	38.1	Very low	156 Å²	156	132.5 Å²	132.5	68%	0.678	74%	0.74	S	S	*	*			trans	54.7	126.5	153.5	-75.5	-175	172.2	-79.7	0	121
1031	E	31.5	Very low	36.8	Very low	149 Å²	149	137.3 Å²	137.3	70%	0.696	75%	0.749	S	S	*	*				84	150.2	59.7	-79.5	178.7	-166.9	0	0	114.5
1032	P	48.1	Very low	35.6	Very low	84 Å²	84	136.5 Å²	136.5	55%	0.545	75%	0.752	S	S	.	*			cis	-150.1	171.6	-29.7	42.6	-25	0	0	0	117.5
1033	H	26.4	Very low	35.6	Very low	174 Å²	174	133.9 Å²	133.9	81%	0.806	74%	0.744	S	S	*	*			trans	62.6	167.8	158.1	-45.1	-44.8	0	0	0	116.9
1034	L	30.3	Very low	35.5	Very low	157 Å²	157	135.8 Å²	135.8	82%	0.822	74%	0.741	S	S	*	*			cis	-141.3	174.2	-2.5	-90	103.1	0	0	0	107.3
1035	S	27	Very low	35.4	Very low	85 Å²	85	135.3 Å²	135.3	59%	0.594	74%	0.737	S	S	*	*			cis	-175.2	144.9	-33.2	61.9	0	0	0	0	111.7
1036	Y	29.6	Very low	34.2	Very low	226 Å²	226	138 Å²	138	89%	0.886	75%	0.745	S	S	*	*			trans	66.1	124.4	150.4	-90.7	-109.6	0	0	0	123.3
1037	S	31.3	Very low	33.9	Very low	99 Å²	99	135.2 Å²	135.2	69%	0.692	74%	0.738	S	S	*	*			trans	-71.7	176.1	145.1	-140.6	0	0	0	0	109.6
1038	P	43.2	Very low	33.8	Very low	102 Å²	102	137.6 Å²	137.6	66%	0.662	75%	0.75	S	S	*	*				-160.4	157.4	55.3	46	-23.4	0	0	0	121
1039	T	30.7	Very low	33.8	Very low	114 Å²	114	135.5 Å²	135.5	70%	0.699	75%	0.75	S	S	*	*			trans	53	130.9	135	61.1	0	0	0	0	124.9
1040	C	29.2	Very low	34.4	Very low	114 Å²	114	134.9 Å²	134.9	77%	0.77	75%	0.754	S	S	*	*			trans	75.1	156.5	134.7	-67.5	0	0	0	0	118.9
1041	L	29.3	Very low	34.5	Very low	170 Å²	170	130.5 Å²	130.5	89%	0.89	75%	0.753	S	S	*	*			cis	-125.7	150.2	17.2	-78.3	163.3	0	0	0	115.3
1042	D	29.1	Very low	34.6	Very low	148 Å²	148	129 Å²	129	79%	0.791	76%	0.759	S	S	*	*			trans	-102.4	177.3	166.8	-112.9	-33	0	0	0	110.2
1043	P	57.6	Low	34.1	Very low	109 Å²	109	131.1 Å²	131.1	71%	0.708	77%	0.77	S	S	*	*			cis	-110.6	-84.2	-26.7	17.1	5.5	0	0	0	109.6
1044	P	43.5	Very low	34.5	Very low	122 Å²	122	134.1 Å²	134.1	79%	0.792	79%	0.792	S	S	*	*			cis	-103.6	171.8	-19.8	40.5	-31.2	0	0	0	113.6
1045	A	37.3	Very low	34.7	Very low	96 Å²	96	133 Å²	133	79%	0.793	79%	0.791	S	S	*	*			trans	-141.9	149.1	167	0	0	0	0	0	111.2
1046	L	30	Very low	35.2	Very low	169 Å²	169	135.5 Å²	135.5	89%	0.885	80%	0.801	S	S	*	*			trans	-156.5	127.2	161.8	-112.8	167.4	0	0	0	112.2
1047	S	33.3	Very low	35.5	Very low	91 Å²	91	130.4 Å²	130.4	64%	0.636	80%	0.796	S	S	*	*			trans	-45.7	148.3	179.6	53.6	0	0	0	0	118
1048	L	32.7	Very low	35.7	Very low	170 Å²	170	132.3 Å²	132.3	89%	0.89	80%	0.802	S	S	*	*				-176.5	147.4	102.7	-94.7	160.6	0	0	0	114.2
1049	H	31.6	Very low	35.2	Very low	178 Å²	178	134.2 Å²	134.2	82%	0.824	81%	0.811	S	S	*	*			trans	-88.7	179.3	167.4	-98.8	-26.1	0	0	0	110.4
1050	P	44.9	Very low	35.5	Very low	120 Å²	120	135.5 Å²	135.5	78%	0.779	82%	0.819	S	S	*	*			cis	-136.8	-178.3	-20.1	34.6	-15.4	0	0	0	114.6
1051	G	29	Very low	36	Very low	64 Å²	64	137.1 Å²	137.1	66%	0.66	82%	0.822	S	S	*	*			trans	107.1	148.7	138.3	0	0	0	0	0	119.2
1052	S	32.8	Very low	36.5	Very low	116 Å²	116	134.5 Å²	134.5	81%	0.811	82%	0.817	S	S	*	*			trans	56.1	122.6	-178.9	38.2	0	0	0	0	115.6
1053	V	36.4	Very low	37.1	Very low	129 Å²	129	133.4 Å²	133.4	78%	0.782	82%	0.819	S	S	*	*			cis	63.2	88	34.2	-165.4	0	0	0	0	112.3
1054	D	36.5	Very low	35.3	Very low	237 Å²	237	135.6 Å²	135.6	100%	1.267	83%	0.829	S	S	*	*				-117.7	0	91.1	-83.2	-41.9	0	0	0	108.9

Retrieved 1,054 of 1,054 residues in 6100.9 ms (Link to these results)

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