A0A087YA62_POEFO Loading...

Calsyntenin-3

AlphaFold DB , UniProt , Accession A0A087YA62, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 957 aa.

						>A0A087YA62_POEFO|A0A087YA62
MDRMNFLSFLLLCLTSVANCNKANKHKPWIETEYQGIVMENDNTVLLNPPLFALDKDAPLHYAGEICGFRVHNGPSGSGSVQFEAVVLDRSTGEGLVRSKEPLDCESQREHSFTIQAYDCGEGPDGVNSKKSHKATVHVRVNDVNEFSPVFVERRYEASVPEGRLFDRIVRVEALDADCSPQYSQICFYDIITPNVPFAIDNDGNIKNTEPLDSKRQRVHTFWVTAFDCGKNRAQADAQVVVTVKPSCKPGWIGWTKRVEYTPGSGSIPLFPSLHLETCEETVWNIQATVELQTGHIGKGCDRDSYSDRSVRRLCGAVRGEVDLLPPPSPAANWTSVLPTLPSSDSSLVFSFNGSNHVAVVPNSVVSALSGDHFTLQLWMRRGGANIQPSATQSRGNRKEEETIVCSTVKNDDSYSHYSLSVHGCRLSLFYWPDVSAARPVKFLWKLEQVCDSEWHHLSLSVQFPSVTLYVDGVTFDPALIHDNGAIPNPAPRQRMLIGACWEPEEKQKEILNNTIPEGKDSVKFVGGYHGLLSGVTVRPGSVEPHSVVECLYACREGLDFGDLETLGSGMKVHVNPSQSVLVLEGDDIESFNRAVQQVTYRNSLRFATPGVRPLKLTTSLRCFNEESCLSLKQLEGYLVVLQPDAPQISLSGVGPHLARPAPEFEGPRGVPLFPELRIVCSLSHAVNTAAQGMEGGALMSDAVAHTLDGCEVQPLGEELNPEREELLVDMDVVRERGLDIINTTAYIAITGAESISVYEDVLRSVRYRLARGSGRFERRFRLSCSEMNGRYTSNELTLEVNFLHSLESLYHPSHLLASQQQFLHPSHHSGELSGHTLPNPHRNSVVPGAATVIIMVCVGFLVVMVILGVFRIRSIHRRGEGSRGGAKEGSNQWDDSALTIIVNPMESYESRMGISADTEGDGEEEEEEAAESPDDASDDQRIIIKKEGRDGNARRY
					

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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	40.7	Very low	46.8	Very low	228 Å²	228	152.4 Å²	152.4	100%	1.123	74%	0.743	S	S	*	*				0	73.3	0	-65.3	164.8	168.3	0	0	107.9
2	D	41.3	Very low	46.8	Very low	132 Å²	132	149.3 Å²	149.3	71%	0.706	73%	0.731	S	S	*	*			cis	81.3	116.5	35.4	-69.9	-71	0	0	0	116.5	M4	D2-M4 PolarHBondContact O-N 3.14Å; D2-M4 VanDerWaalsContact O-N 3.14Å
3	R	41.8	Very low	46.7	Very low	236 Å²	236	143.5 Å²	143.5	89%	0.891	71%	0.714	S	S	*	*	S	Bend	trans	68.3	-1.3	141.5	-65.9	-173.9	170.2	-153.2	-4.9	122.2
4	M	43.6	Very low	46.4	Very low	166 Å²	166	141.9 Å²	141.9	82%	0.818	71%	0.708	S	S	*	*	S	Bend	trans	-95.1	-25.9	179.2	-79.1	175.2	65.1	0	0	117.5	D2	D2-M4 PolarHBondContact O-N 3.14Å; D2-M4 VanDerWaalsContact O-N 3.14Å
5	N	46.8	Very low	46.2	Very low	145 Å²	145	138.7 Å²	138.7	78%	0.775	70%	0.7	S	S	*	*	H	α-helix	trans	-88.6	-14.6	-171.8	-84.5	13	0	0	0	116.8
6	F	49	Very low	45.9	Very low	182 Å²	182	134.8 Å²	134.8	80%	0.798	69%	0.689	S	S	*	*	H	α-helix	trans	-85.3	-28.5	-174.7	-119.8	-90.9	0	0	0	114.5
7	L	49.6	Very low	45.7	Very low	131 Å²	131	133.6 Å²	133.6	69%	0.686	69%	0.69	S	S	*	*	H	α-helix	trans	-70.1	-38.7	178.1	-108.9	73.8	0	0	0	112.5	F9 L10 L11	L7-F9 PolarHBondContact O-N 3.06Å; L7-L10 PolarHBondContact O-N 3.39Å; L7-L11 PolarHBondContact O-N 3.18Å
8	S	51.2	Low	45.5	Very low	73 Å²	73	130.9 Å²	130.9	51%	0.51	69%	0.69	S	S	.	*	H	α-helix	trans	-63.2	-41.9	-175.7	-166	0	0	0	0	112.2	L11 L12	S8-L11 PolarHBondContact O-N 3.13Å; S8-L12 VanDerWaalsContact O-CD1 3.29Å; S8-L12 WeakPolarHBondContact O-CD1 3.29Å; S8-L12 PolarHBondContact O-N 3.1Å; S8-L12 VanDerWaalsContact O-N 3.13Å
9	F	51.5	Low	45.3	Very low	161 Å²	161	130.7 Å²	130.7	71%	0.706	69%	0.69	S	S	*	*	H	α-helix	trans	-68	-37.6	177.6	-122.5	-88.7	0	0	0	112.7	L7 C13	L7-F9 PolarHBondContact O-N 3.06Å; F9-C13 PolarHBondContact O-N 2.99Å
10	L	49.8	Very low	45.3	Very low	113 Å²	113	128.9 Å²	128.9	59%	0.592	69%	0.687	S	S	*	*	H	α-helix	trans	-70.4	-36.1	177.8	-148.9	77.6	0	0	0	112	L7 L14	L7-L10 PolarHBondContact O-N 3.39Å; L10-L14 HydrophobicContact CG-CD1 4.49Å; L10-L14 WeakPolarHBondContact O-CG 3.49Å; L10-L14 PolarHBondContact O-N 3.29Å; L10-L14 VanDerWaalsContact O-N 3.12Å
11	L	49.2	Very low	45.7	Very low	109 Å²	109	128.1 Å²	128.1	57%	0.571	68%	0.683	S	S	*	*	H	α-helix	trans	-64.3	-47	174.7	-114.1	69.9	0	0	0	111.9	L7 S8 C13 L14 T15	L7-L11 PolarHBondContact O-N 3.18Å; S8-L11 PolarHBondContact O-N 3.13Å; L11-C13 VanDerWaalsContact C-N 3.32Å; L11-C13 PolarHBondContact O-N 2.98Å; L11-L14 PolarHBondContact O-N 3.45Å; L11-L14 VanDerWaalsContact O-N 3.14Å; L11-T15 PolarHBondContact O-N 3.17Å; L11-T15 PolarHBondContact O-OG1 2.95Å
12	L	46.7	Very low	46.5	Very low	115 Å²	115	125.2 Å²	125.2	60%	0.602	66%	0.664	S	S	*	*	H	α-helix	trans	-62	-39.1	178.8	-93.2	81.7	0	0	0	112.3	S8 L14 T15 S16	S8-L12 VanDerWaalsContact O-CD1 3.29Å; S8-L12 WeakPolarHBondContact O-CD1 3.29Å; S8-L12 PolarHBondContact O-N 3.1Å; S8-L12 VanDerWaalsContact O-N 3.13Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L12-L14 PolarHBondContact O-N 3.22Å; L12-T15 WeakPolarHBondContact CA-OG1 3.28Å; L12-T15 PolarHBondContact O-N 3.48Å; L12-T15 PolarHBondContact O-OG1 3.48Å; L12-T15 VanDerWaalsContact O-OG1 3.1Å; L12-S16 PolarHBondContact O-N 3.14Å; L12-S16 PolarHBondContact O-OG 3.32Å
13	C	45.6	Very low	47.8	Very low	74 Å²	74	120.8 Å²	120.8	50%	0.5	65%	0.645	S	S	.	*	H	α-helix	trans	-69.2	-25.9	175.7	-74.5	0	0	0	0	114.1	F9 L11 S16	F9-C13 PolarHBondContact O-N 2.99Å; L11-C13 VanDerWaalsContact C-N 3.32Å; L11-C13 PolarHBondContact O-N 2.98Å; C13-S16 PolarHBondContact O-OG 3.45Å
14	L	43.5	Very low	49.7	Very low	122 Å²	122	109.8 Å²	109.8	64%	0.639	60%	0.604	S	S	*	*	H	α-helix	trans	-83.4	-32.8	174.8	-76.8	165	0	0	0	112.4	L10 L11 L12	L10-L14 HydrophobicContact CG-CD1 4.49Å; L10-L14 WeakPolarHBondContact O-CG 3.49Å; L10-L14 PolarHBondContact O-N 3.29Å; L10-L14 VanDerWaalsContact O-N 3.12Å; L11-L14 PolarHBondContact O-N 3.45Å; L11-L14 VanDerWaalsContact O-N 3.14Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L12-L14 PolarHBondContact O-N 3.22Å
15	T	43	Very low	51.6	Low	94 Å²	94	107.2 Å²	107.2	58%	0.577	59%	0.589	S	S	*	*	H	α-helix	trans	-74.1	-27.1	176.1	52.8	0	0	0	0	114.1	L11 L12	L11-T15 PolarHBondContact O-N 3.17Å; L11-T15 PolarHBondContact O-OG1 2.95Å; L12-T15 WeakPolarHBondContact CA-OG1 3.28Å; L12-T15 PolarHBondContact O-N 3.48Å; L12-T15 PolarHBondContact O-OG1 3.48Å; L12-T15 VanDerWaalsContact O-OG1 3.1Å
16	S	41.2	Very low	53.6	Low	76 Å²	76	104.2 Å²	104.2	53%	0.531	57%	0.57	S	S	.	*	H	α-helix	trans	-74	-32.3	-178.5	61.4	0	0	0	0	113.5	L12 C13	L12-S16 PolarHBondContact O-N 3.14Å; L12-S16 PolarHBondContact O-OG 3.32Å; C13-S16 PolarHBondContact O-OG 3.45Å
17	V	43.4	Very low	55.5	Low	115 Å²	115	102.2 Å²	102.2	70%	0.697	56%	0.561	S	S	*	*	H	α-helix	trans	-75.1	-35.1	178.4	-177.5	0	0	0	0	111.5	N19	V17-N19 PolarHBondContact O-N 3.12Å
18	A	41.9	Very low	57.5	Low	85 Å²	85	96.1 Å²	96.1	70%	0.702	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.3	-176.9	0	0	0	0	0	114.8
19	N	41.4	Very low	59.5	Low	127 Å²	127	98.2 Å²	98.2	68%	0.679	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	8.3	-170.8	-130	24.6	0	0	0	114.5	V17	V17-N19 PolarHBondContact O-N 3.12Å
20	C	45.7	Very low	61.5	Low	94 Å²	94	90.5 Å²	90.5	64%	0.635	49%	0.492	S	S	*	.	S	Bend	trans	-100.2	8.6	-167.9	-150.6	0	0	0	0	115.4	K25	C20-K25 PolarHBondContact O-NZ 3.26Å
21	N	52.6	Low	63.6	Low	112 Å²	112	89 Å²	89	60%	0.599	48%	0.482	S	S	*	.			trans	-132.7	37.1	-172.2	-101.6	-5.1	0	0	0	114.1	K25	N21-K25 PolarHBondContact OD1-NZ 3.39Å
22	K	57.2	Low	65.6	Low	168 Å²	168	88.4 Å²	88.4	73%	0.73	48%	0.483	S	S	*	.			trans	-117.6	35.1	173.2	-65.1	-171.8	177.1	-176.8	0	113.2
23	A	69.4	Low	67.8	Low	38 Å²	38	87.6 Å²	87.6	31%	0.314	48%	0.476	S	S	.	.	S	Bend	trans	-117.1	138.7	175.3	0	0	0	0	0	108.6	K25 E122	A23-K25 PolarHBondContact O-N 3.38Å; A23-E122 VanDerWaalsContact CA-OE1 3.27Å; A23-E122 WeakPolarHBondContact CA-OE1 3.48Å
24	N	81.4	Confident	70.1	Confident	6 Å²	6	84.2 Å²	84.2	3%	0.032	45%	0.453	C	S	.	.			trans	-72.9	112.7	172.6	174.7	-31.5	0	0	0	107.2	H26 A63 D119 E122 K130	N24-H26 PolarHBondContact OD1-O 3.2Å; N24-A63 HydrophobicContact CB-CB 3.9Å; N24-D119 PolarHBondContact ND2-OD1 3.35Å; N24-D119 PolarHBondContact ND2-OD2 3.47Å; N24-D119 VanDerWaalsContact ND2-OD2 3.14Å; N24-E122 HydrophobicContact CB-CG 3.63Å; N24-E122 PolarHBondContact N-OE1 3.15Å; N24-K130 VanDerWaalsContact CG-NZ 3.3Å; N24-K130 WeakPolarHBondContact O-CE 3.22Å; N24-K130 PolarHBondContact O-NZ 2.67Å; N24-K130 WeakPolarHBondContact OD1-CE 3.38Å; N24-K130 WeakPolarHBondContact OD1-CG 3.32Å; N24-K130 PolarHBondContact OD1-NZ 3.2Å
25	K	84.2	Confident	72.6	Confident	111 Å²	111	84.6 Å²	84.6	48%	0.483	45%	0.451	S	S	.	.			trans	-109.5	-35.1	-173.1	-71.9	168	-173.5	-176.9	0	111.6	C20 N21 A23 D57	C20-K25 PolarHBondContact O-NZ 3.26Å; N21-K25 PolarHBondContact OD1-NZ 3.39Å; A23-K25 PolarHBondContact O-N 3.38Å; K25-D57 PolarHBondContact N-OD2 2.87Å
26	H	88.2	Confident	74.9	Confident	82 Å²	82	80.2 Å²	80.2	38%	0.38	43%	0.425	S	S	.	.	S	Bend	trans	-95	-169.7	-174.6	-67.8	105.1	0	0	0	111.9	N24 D55 K56 D57 K130	N24-H26 PolarHBondContact OD1-O 3.2Å; H26-D55 VanDerWaalsContact CB-OD1 3.27Å; H26-D55 WeakPolarHBondContact CB-OD1 2.93Å; H26-K56 HydrophobicContact CB-CB 4.08Å; H26-D57 IonicContact CE1-OD1 3.67Å; H26-D57 IonicContact CG-OD1 3.73Å; H26-D57 PolarHBondContact N-OD2 3.35Å; H26-D57 IonicContact ND1-OD1 2.74Å; H26-D57 PolarHBondContact ND1-OD1 2.02Å; H26-D57 IonicContact ND1-OD2 3.8Å; H26-K130 WeakPolarHBondContact O-CD 3.23Å; H26-K130 VanDerWaalsContact O-CE 3.27Å; H26-K130 WeakPolarHBondContact O-CE 3.29Å
27	K	89.1	Confident	77.4	Confident	140 Å²	140	80.4 Å²	80.4	61%	0.609	42%	0.419	S	S	*	.			trans	-138.9	143.8	175.8	-65.4	-176.4	175.6	-176.6	0	106.7	D55 K130	K27-D55 WeakPolarHBondContact CA-OD2 3.49Å; K27-D55 PolarHBondContact N-OD2 2.92Å; K27-K130 HydrophobicContact CB-CB 4.49Å; K27-K130 HydrophobicContact CG-CB 3.94Å; K27-K130 HydrophobicContact CG-CD 4.1Å
28	P	91.8	Very high	79.8	Confident	3 Å²	3	75.1 Å²	75.1	2%	0.019	39%	0.388	C	S	.	.			trans	-65.5	142.6	178.1	24.4	-33.3	0	0	0	109.4	D55 I66 A117 D119 S132	P28-D55 WeakPolarHBondContact CA-OD2 3.27Å; P28-D55 VanDerWaalsContact CD-OD2 3.31Å; P28-D55 WeakPolarHBondContact CD-OD2 3.27Å; P28-I66 HydrophobicContact CB-CD1 3.66Å; P28-A117 HydrophobicContact CB-CB 4.25Å; P28-A117 HydrophobicContact CG-CB 4.35Å; P28-D119 HydrophobicContact CG-CB 4.42Å; P28-S132 WeakPolarHBondContact O-CA 3.43Å; P28-S132 WeakPolarHBondContact O-CB 3.47Å
29	W	92.6	Very high	82.2	Confident	117 Å²	117	74.6 Å²	74.6	44%	0.443	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-115.7	139.4	179.5	-178.7	90.8	0	0	0	109.8	E31 A53 L54 H133	W29-E31 VanDerWaalsContact CH2-CD 3.45Å; W29-E31 HydrophobicContact CH2-CG 4.35Å; W29-E31 WeakPolarHBondContact CH2-OE1 3.18Å; W29-E31 WeakPolarHBondContact CH2-OE2 3.44Å; W29-A53 CarbonylContact O-C 3.57Å; W29-A53 WeakPolarHBondContact O-CA 3.24Å; W29-L54 PolarHBondContact N-O 2.81Å; W29-L54 PolarHBondContact O-N 3.34Å; W29-H133 AromaticContact CD1-CE1 3.94Å; W29-H133 AromaticContact NE1-CE1 3.86Å
30	I	94.7	Very high	84.5	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.341	C	S	.	.			trans	-131.1	167	177.4	56	177.5	0	0	0	107.5	A53 F69 I115 A117 S132 H133 A135	I30-A53 HydrophobicContact CG2-CB 3.66Å; I30-F69 HydrophobicContact CG2-CE1 4.34Å; I30-I115 HydrophobicContact CD1-CG1 4.33Å; I30-A117 HydrophobicContact CG2-CB 3.81Å; I30-S132 WeakPolarHBondContact CD1-OG 3.33Å; I30-H133 PolarHBondContact O-CE1 3.26Å; I30-H133 PolarHBondContact O-NE2 2.84Å; I30-A135 HydrophobicContact CD1-CB 3.59Å; I30-A135 HydrophobicContact CG1-CB 4.17Å
31	E	93.9	Very high	86.6	Confident	82 Å²	82	69.9 Å²	69.9	38%	0.383	34%	0.34	S	S	.	.			trans	-66.4	153.7	170.3	-64.8	-66.5	174.7	0	0	110.7	W29 E33 Y34 P49 A135	W29-E31 VanDerWaalsContact CH2-CD 3.45Å; W29-E31 HydrophobicContact CH2-CG 4.35Å; W29-E31 WeakPolarHBondContact CH2-OE1 3.18Å; W29-E31 WeakPolarHBondContact CH2-OE2 3.44Å; E31-E33 VanDerWaalsContact C-N 3.34Å; E31-E33 PolarHBondContact O-N 3.08Å; E31-Y34 HydrophobicContact CB-CE1 4.15Å; E31-Y34 HydrophobicContact CB-CE2 4.02Å; E31-Y34 HydrophobicContact CG-CE1 4.48Å; E31-Y34 PolarHBondContact N-OH 2.87Å; E31-Y34 VanDerWaalsContact N-OH 3.09Å; E31-Y34 WeakPolarHBondContact O-CE2 3.34Å; E31-P49 HydrophobicContact CG-CG 3.94Å; E31-A135 WeakPolarHBondContact O-CB 3.04Å
32	T	91	Very high	88.4	Confident	96 Å²	96	67.9 Å²	67.9	59%	0.589	33%	0.329	S	S	*	.	S	Bend	trans	-74.3	-24.1	-177.1	49.2	0	0	0	0	113.8	H133 A135 T136	T32-H133 WeakPolarHBondContact CG2-NE2 3.46Å; T32-A135 VanDerWaalsContact O-CA 3.26Å; T32-A135 WeakPolarHBondContact O-CA 3.46Å; T32-T136 PolarHBondContact O-N 2.9Å
33	E	93.1	Very high	90	Very high	98 Å²	98	63 Å²	63	46%	0.458	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	143.9	-176.3	-169.4	177.7	163.8	0	0	110.2	E31 T136 H138	E31-E33 VanDerWaalsContact C-N 3.34Å; E31-E33 PolarHBondContact O-N 3.08Å; E33-T136 CarbonylContact C-O 3.59Å; E33-T136 VanDerWaalsContact CA-O 3.3Å; E33-T136 WeakPolarHBondContact CA-O 3.28Å; E33-H138 IonicContact OE1-CD2 3.82Å
34	Y	93.6	Very high	91.1	Very high	2 Å²	2	64 Å²	64	1%	0.008	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	133.9	176.6	-66.3	-90.5	0	0	0	110.2	E31 L47 P49 L51 I115 A135 T136 V137 H138	E31-Y34 HydrophobicContact CB-CE1 4.15Å; E31-Y34 HydrophobicContact CB-CE2 4.02Å; E31-Y34 HydrophobicContact CG-CE1 4.48Å; E31-Y34 PolarHBondContact N-OH 2.87Å; E31-Y34 VanDerWaalsContact N-OH 3.09Å; E31-Y34 WeakPolarHBondContact O-CE2 3.34Å; Y34-L47 HydrophobicContact CD1-CD1 4.4Å; Y34-P49 HydrophobicContact CD1-CG 4.32Å; Y34-P49 VanDerWaalsContact CD1-O 3.27Å; Y34-P49 WeakPolarHBondContact CD1-O 3.22Å; Y34-P49 HydrophobicContact CE1-CG 4.26Å; Y34-L51 HydrophobicContact CE1-CB 4.48Å; Y34-L51 HydrophobicContact CE1-CD1 4.25Å; Y34-L51 HydrophobicContact CE2-CD1 4.2Å; Y34-I115 HydrophobicContact CD2-CD1 3.99Å; Y34-I115 HydrophobicContact CE2-CD1 3.92Å; Y34-A135 HydrophobicContact CD2-CB 4Å; Y34-A135 HydrophobicContact CE2-CB 3.83Å; Y34-T136 PolarHBondContact N-O 3.49Å; Y34-V137 HydrophobicContact CD2-CG2 4.39Å; Y34-V137 WeakPolarHBondContact O-CA 3.46Å; Y34-H138 PolarHBondContact O-N 3.2Å
35	Q	94.7	Very high	91.7	Very high	130 Å²	130	63.8 Å²	63.8	61%	0.607	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.3	131.4	167.7	-66.5	-174.8	-4	0	0	109.1	L47 N48	Q35-L47 WeakPolarHBondContact O-CA 3.47Å; Q35-N48 PolarHBondContact N-O 3.27Å; Q35-N48 PolarHBondContact O-N 3.24Å
36	G	92.4	Very high	92.1	Very high	3 Å²	3	64.4 Å²	64.4	3%	0.031	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.8	-178.7	0	0	0	0	0	112.1	L46 H138 V139 R140	G36-L46 WeakPolarHBondContact CA-O 3.38Å; G36-H138 PolarHBondContact N-O 3.43Å; G36-V139 WeakPolarHBondContact O-CA 3.46Å; G36-R140 PolarHBondContact O-N 2.83Å
37	I	93.6	Very high	92.4	Very high	79 Å²	79	61.2 Å²	61.2	41%	0.405	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	148.9	165.7	61.2	175.2	0	0	0	110.1	L46 R140	I37-L46 HydrophobicContact CD1-CD2 4.4Å; I37-L46 HydrophobicContact CG1-CB 4.16Å; I37-L46 HydrophobicContact CG1-CD2 4.38Å; I37-L46 PolarHBondContact N-O 3.21Å; I37-L46 PolarHBondContact O-N 2.87Å; I37-R140 WeakPolarHBondContact CA-O 3.43Å
38	V	93.7	Very high	92.5	Very high	5 Å²	5	60.5 Å²	60.5	3%	0.03	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	133.1	179.1	59.6	0	0	0	0	107.5	D42 T44 V45 L103 V139 R140 V141 N142	V38-D42 WeakPolarHBondContact CG2-O 3.26Å; V38-T44 WeakPolarHBondContact CG2-O 3.22Å; V38-V45 HydrophobicContact CB-CG2 4.22Å; V38-V45 HydrophobicContact CG1-CG2 4.5Å; V38-V45 HydrophobicContact CG2-CG2 4.42Å; V38-L103 HydrophobicContact CB-CD1 4.36Å; V38-L103 HydrophobicContact CG1-CD1 3.46Å; V38-L103 VanDerWaalsContact CG1-CD1 3.46Å; V38-L103 HydrophobicContact CG2-CD1 3.96Å; V38-V139 HydrophobicContact CG1-CG1 3.6Å; V38-R140 PolarHBondContact N-O 3.18Å; V38-V141 HydrophobicContact CG1-CG2 4.46Å; V38-V141 CarbonylContact O-C 3.58Å; V38-V141 WeakPolarHBondContact O-CA 3.33Å; V38-N142 PolarHBondContact O-N 2.86Å
39	M	91.4	Very high	92.5	Very high	74 Å²	74	62.9 Å²	62.9	37%	0.365	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	143.6	168.1	-54.5	-55.9	-54.6	0	0	107.4	N41 D42 N142 D143 V144	M39-N41 WeakPolarHBondContact CB-OD1 3.31Å; M39-N41 PolarHBondContact O-N 2.86Å; M39-D42 HydrophobicContact CB-CB 4.37Å; M39-D42 CarbonylContact O-C 3.59Å; M39-D42 PolarHBondContact O-N 2.81Å; M39-N142 WeakPolarHBondContact CA-O 3.12Å; M39-N142 HydrophobicContact CE-CB 3.81Å; M39-N142 HydrophobicContact SD-CB 3.48Å; M39-N142 WeakPolarHBondContact SD-CB 3.29Å; M39-D143 VanDerWaalsContact CE-O 3.23Å; M39-D143 WeakPolarHBondContact CE-O 2.99Å; M39-V144 HydrophobicContact CB-CG2 4.27Å; M39-V144 HydrophobicContact CE-CG2 3.61Å
40	E	90.6	Very high	92.5	Very high	9 Å²	9	61 Å²	61	4%	0.042	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-25.2	-174.5	72	-140.3	118.9	0	0	114.7	D42 L103 C105 V141 N142 D143 V144	E40-D42 VanDerWaalsContact C-N 3.28Å; E40-D42 PolarHBondContact O-N 2.78Å; E40-L103 HydrophobicContact CB-CB 4.29Å; E40-C105 WeakPolarHBondContact OE2-CB 3.01Å; E40-C105 PolarHBondContact OE2-N 3.21Å; E40-V141 HydrophobicContact CB-CG1 3.65Å; E40-N142 PolarHBondContact N-O 3.13Å; E40-D143 VanDerWaalsContact OE1-CA 3.28Å; E40-D143 WeakPolarHBondContact OE1-CA 3.47Å; E40-V144 HydrophobicContact CG-CG2 4.39Å; E40-V144 PolarHBondContact OE1-N 3.5Å
41	N	88.7	Confident	92.4	Very high	113 Å²	113	61.1 Å²	61.1	60%	0.604	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	4.5	171.4	69.4	5.3	0	0	0	114.9	M39	M39-N41 WeakPolarHBondContact CB-OD1 3.31Å; M39-N41 PolarHBondContact O-N 2.86Å
42	D	91.1	Very high	92.4	Very high	70 Å²	70	61.1 Å²	61.1	37%	0.374	33%	0.326	S	S	.	.			trans	-118.9	141.6	169.8	-170.1	-6	0	0	0	109.7	V38 M39 E40 T44	V38-D42 WeakPolarHBondContact CG2-O 3.26Å; M39-D42 HydrophobicContact CB-CB 4.37Å; M39-D42 CarbonylContact O-C 3.59Å; M39-D42 PolarHBondContact O-N 2.81Å; E40-D42 VanDerWaalsContact C-N 3.28Å; E40-D42 PolarHBondContact O-N 2.78Å; D42-T44 VanDerWaalsContact C-N 3.34Å; D42-T44 VanDerWaalsContact OD1-CB 3.23Å; D42-T44 WeakPolarHBondContact OD1-CB 3.49Å; D42-T44 PolarHBondContact OD1-N 2.99Å; D42-T44 PolarHBondContact OD1-OG1 3.44Å
43	N	91.1	Very high	92.4	Very high	66 Å²	66	56.7 Å²	56.7	35%	0.353	30%	0.299	S	S	.	.			trans	-88	-6.3	174.2	-70.7	50.2	0	0	0	112.1	R98 S99	N43-R98 CarbonylContact O-C 3.6Å; N43-R98 WeakPolarHBondContact O-CA 3.38Å; N43-R98 VanDerWaalsContact O-CB 3.25Å; N43-R98 WeakPolarHBondContact O-CB 3.44Å; N43-S99 WeakPolarHBondContact CA-OG 3.47Å; N43-S99 WeakPolarHBondContact CB-OG 3.43Å; N43-S99 PolarHBondContact ND2-O 2.8Å; N43-S99 PolarHBondContact ND2-OG 3.5Å; N43-S99 PolarHBondContact O-N 2.97Å
44	T	92.7	Very high	92.3	Very high	58 Å²	58	56.6 Å²	56.6	36%	0.356	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	117.2	-168.5	-45.7	0	0	0	0	112	V38 D42 L46 L96	V38-T44 WeakPolarHBondContact CG2-O 3.22Å; D42-T44 VanDerWaalsContact C-N 3.34Å; D42-T44 VanDerWaalsContact OD1-CB 3.23Å; D42-T44 WeakPolarHBondContact OD1-CB 3.49Å; D42-T44 PolarHBondContact OD1-N 2.99Å; D42-T44 PolarHBondContact OD1-OG1 3.44Å; T44-L46 PolarHBondContact O-N 3.46Å; T44-L96 HydrophobicContact CG2-CD1 3.86Å; T44-L96 HydrophobicContact CG2-CD2 4.18Å; T44-L96 HydrophobicContact CG2-CG 4.36Å
45	V	93.4	Very high	92.1	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.012	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	111.4	178.5	-175.4	0	0	0	0	110.1	V38 L47 F83 V97 V139	V38-V45 HydrophobicContact CB-CG2 4.22Å; V38-V45 HydrophobicContact CG1-CG2 4.5Å; V38-V45 HydrophobicContact CG2-CG2 4.42Å; V45-L47 HydrophobicContact CG1-CD2 3.72Å; V45-L47 HydrophobicContact CG1-CG 4.29Å; V45-L47 PolarHBondContact O-N 3.35Å; V45-F83 HydrophobicContact CG2-CD1 4.1Å; V45-F83 HydrophobicContact CG2-CE1 3.83Å; V45-V97 HydrophobicContact CB-CB 4.1Å; V45-V97 HydrophobicContact CB-CG1 3.9Å; V45-V97 HydrophobicContact CG1-CG1 4.47Å; V45-V97 HydrophobicContact CG2-CG1 3.85Å; V45-V97 PolarHBondContact N-O 2.87Å; V45-V139 HydrophobicContact CG1-CG1 3.91Å; V45-V139 HydrophobicContact CG1-CG2 3.88Å; V45-V139 HydrophobicContact CG2-CG1 4.14Å
46	L	93.5	Very high	91.8	Very high	124 Å²	124	59.3 Å²	59.3	65%	0.649	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	103.3	173.3	-179.2	63.1	0	0	0	109.5	G36 I37 T44	G36-L46 WeakPolarHBondContact CA-O 3.38Å; I37-L46 HydrophobicContact CD1-CD2 4.4Å; I37-L46 HydrophobicContact CG1-CB 4.16Å; I37-L46 HydrophobicContact CG1-CD2 4.38Å; I37-L46 PolarHBondContact N-O 3.21Å; I37-L46 PolarHBondContact O-N 2.87Å; T44-L46 PolarHBondContact O-N 3.46Å
47	L	93.9	Very high	91.4	Very high	14 Å²	14	59.8 Å²	59.8	7%	0.073	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	139.1	178.9	-62.2	177.5	0	0	0	112.3	Y34 Q35 V45 P49 L51 V97 V137	Y34-L47 HydrophobicContact CD1-CD1 4.4Å; Q35-L47 WeakPolarHBondContact O-CA 3.47Å; V45-L47 HydrophobicContact CG1-CD2 3.72Å; V45-L47 HydrophobicContact CG1-CG 4.29Å; V45-L47 PolarHBondContact O-N 3.35Å; L47-P49 CarbonylContact C-O 3.57Å; L47-P49 VanDerWaalsContact C-O 3.32Å; L47-P49 WeakPolarHBondContact CB-O 3.35Å; L47-P49 CarbonylContact O-C 3.58Å; L47-L51 HydrophobicContact CD1-CB 3.81Å; L47-V97 HydrophobicContact CD1-CB 4.15Å; L47-V97 HydrophobicContact CD1-CG2 3.71Å; L47-V137 HydrophobicContact CD2-CG1 3.78Å
48	N	90.6	Very high	90.8	Very high	126 Å²	126	58.4 Å²	58.4	67%	0.674	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.3	115.4	170	-173.4	19.6	0	0	0	109.6	Q35	Q35-N48 PolarHBondContact N-O 3.27Å; Q35-N48 PolarHBondContact O-N 3.24Å
49	P	91.8	Very high	90.3	Very high	52 Å²	52	64.4 Å²	64.4	34%	0.338	35%	0.353	S	S	.	.	S	Bend	cis	-65.2	165.1	-7.6	30.1	-35.5	0	0	0	112.3	E31 Y34 L47	E31-P49 HydrophobicContact CG-CG 3.94Å; Y34-P49 HydrophobicContact CD1-CG 4.32Å; Y34-P49 VanDerWaalsContact CD1-O 3.27Å; Y34-P49 WeakPolarHBondContact CD1-O 3.22Å; Y34-P49 HydrophobicContact CE1-CG 4.26Å; L47-P49 CarbonylContact C-O 3.57Å; L47-P49 VanDerWaalsContact C-O 3.32Å; L47-P49 WeakPolarHBondContact CB-O 3.35Å; L47-P49 CarbonylContact O-C 3.58Å
50	P	92.1	Very high	89.8	Confident	78 Å²	78	64 Å²	64	51%	0.506	35%	0.352	S	S	.	.			trans	-63.6	154.3	174.8	-20.5	32.9	0	0	0	112.5	F52	P50-F52 HydrophobicContact CB-CD2 4.22Å; P50-F52 HydrophobicContact CB-CE2 3.86Å; P50-F52 PolarHBondContact O-N 3.4Å; P50-F52 VanDerWaalsContact O-N 3.15Å
51	L	94.3	Very high	89.3	Confident	3 Å²	3	70.7 Å²	70.7	2%	0.016	38%	0.383	C	S	.	.			trans	-78.4	101	-177.5	175.4	58.7	0	0	0	111.7	Y34 L47 F69 A85 G95 V97 I115	Y34-L51 HydrophobicContact CE1-CB 4.48Å; Y34-L51 HydrophobicContact CE1-CD1 4.25Å; Y34-L51 HydrophobicContact CE2-CD1 4.2Å; L47-L51 HydrophobicContact CD1-CB 3.81Å; L51-F69 HydrophobicContact CD1-CD1 4.1Å; L51-F69 HydrophobicContact CD1-CE1 3.55Å; L51-F69 HydrophobicContact CD1-CZ 4.13Å; L51-F69 HydrophobicContact CD2-CD1 3.97Å; L51-F69 HydrophobicContact CD2-CD2 4.39Å; L51-F69 HydrophobicContact CD2-CE1 3.95Å; L51-F69 HydrophobicContact CD2-CE2 4.4Å; L51-F69 HydrophobicContact CD2-CG 4.19Å; L51-F69 HydrophobicContact CD2-CZ 4.18Å; L51-F69 HydrophobicContact CG-CD1 4.26Å; L51-F69 HydrophobicContact CG-CE1 3.74Å; L51-F69 HydrophobicContact CG-CE2 4.45Å; L51-F69 HydrophobicContact CG-CZ 3.85Å; L51-A85 HydrophobicContact CD2-CB 4.46Å; L51-G95 PolarHBondContact O-N 2.85Å; L51-V97 HydrophobicContact CD2-CG2 3.96Å; L51-I115 HydrophobicContact CD1-CD1 3.6Å; L51-I115 HydrophobicContact CD2-CD1 4.04Å; L51-I115 HydrophobicContact CG-CD1 4.46Å
52	F	93.3	Very high	89.1	Confident	82 Å²	82	69.8 Å²	69.8	36%	0.36	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-116.1	141.6	167.3	-70	-81.8	0	0	0	111	P50 G93 E94	P50-F52 HydrophobicContact CB-CD2 4.22Å; P50-F52 HydrophobicContact CB-CE2 3.86Å; P50-F52 PolarHBondContact O-N 3.4Å; P50-F52 VanDerWaalsContact O-N 3.15Å; F52-G93 WeakPolarHBondContact CA-O 3.41Å; F52-E94 HydrophobicContact CD1-CB 3.98Å; F52-E94 HydrophobicContact CD1-CG 4.28Å; F52-E94 HydrophobicContact CE1-CB 3.64Å; F52-E94 HydrophobicContact CE1-CG 3.66Å; F52-E94 HydrophobicContact CZ-CG 4.04Å
53	A	91.9	Very high	88.6	Confident	2 Å²	2	66.7 Å²	66.7	2%	0.017	36%	0.356	C	S	.	.			trans	-117.4	117.1	169.9	0	0	0	0	0	110.9	W29 I30 I66 F69 G93 A117	W29-A53 CarbonylContact O-C 3.57Å; W29-A53 WeakPolarHBondContact O-CA 3.24Å; I30-A53 HydrophobicContact CG2-CB 3.66Å; A53-I66 HydrophobicContact CB-CD1 3.82Å; A53-I66 HydrophobicContact CB-CG1 3.88Å; A53-I66 HydrophobicContact CB-CG2 4.23Å; A53-I66 WeakPolarHBondContact O-CG1 3.16Å; A53-F69 HydrophobicContact CB-CE1 3.71Å; A53-F69 HydrophobicContact CB-CZ 3.74Å; A53-G93 PolarHBondContact N-O 3.44Å; A53-G93 WeakPolarHBondContact O-CA 3.24Å; A53-A117 HydrophobicContact CB-CB 3.53Å
54	L	90.9	Very high	88.1	Confident	97 Å²	97	63.9 Å²	63.9	51%	0.508	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-107.8	124.5	-173.9	-56.6	177.7	0	0	0	110.6	W29	W29-L54 PolarHBondContact N-O 2.81Å; W29-L54 PolarHBondContact O-N 3.34Å
55	D	88.1	Confident	88	Confident	17 Å²	17	63 Å²	63	9%	0.091	34%	0.335	C	S	.	.			trans	-108.9	147.3	169	-154.5	-62.6	0	0	0	111.5	H26 K27 P28 D57 A58	H26-D55 VanDerWaalsContact CB-OD1 3.27Å; H26-D55 WeakPolarHBondContact CB-OD1 2.93Å; K27-D55 WeakPolarHBondContact CA-OD2 3.49Å; K27-D55 PolarHBondContact N-OD2 2.92Å; P28-D55 WeakPolarHBondContact CA-OD2 3.27Å; P28-D55 VanDerWaalsContact CD-OD2 3.31Å; P28-D55 WeakPolarHBondContact CD-OD2 3.27Å; D55-D57 PolarHBondContact OD1-N 3.47Å; D55-A58 WeakPolarHBondContact O-CB 3.2Å
56	K	88.1	Confident	87.9	Confident	171 Å²	171	63.1 Å²	63.1	74%	0.743	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-10.5	178	-68.8	-176.3	178	-177.3	0	113.6	H26 A58	H26-K56 HydrophobicContact CB-CB 4.08Å; K56-A58 VanDerWaalsContact C-N 3.28Å
57	D	85.4	Confident	87.6	Confident	14 Å²	14	59.8 Å²	59.8	8%	0.075	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-6.7	169.4	-71.4	-23.7	0	0	0	112.2	K25 H26 D55 L60 A63	K25-D57 PolarHBondContact N-OD2 2.87Å; H26-D57 IonicContact CE1-OD1 3.67Å; H26-D57 IonicContact CG-OD1 3.73Å; H26-D57 PolarHBondContact N-OD2 3.35Å; H26-D57 IonicContact ND1-OD1 2.74Å; H26-D57 PolarHBondContact ND1-OD1 2.02Å; H26-D57 IonicContact ND1-OD2 3.8Å; D55-D57 PolarHBondContact OD1-N 3.47Å; D57-L60 HydrophobicContact CB-CD1 4.21Å; D57-L60 WeakPolarHBondContact O-CB 3.05Å; D57-L60 WeakPolarHBondContact O-CD1 3.5Å; D57-L60 WeakPolarHBondContact O-CG 3.49Å; D57-L60 PolarHBondContact O-N 3.25Å; D57-A63 HydrophobicContact CB-CB 4.22Å
58	A	81.1	Confident	87.5	Confident	49 Å²	49	60 Å²	60	41%	0.405	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	140	172	0	0	0	0	0	112.1	D55 K56	D55-A58 WeakPolarHBondContact O-CB 3.2Å; K56-A58 VanDerWaalsContact C-N 3.28Å
59	P	82.8	Confident	87.6	Confident	131 Å²	131	55 Å²	55	85%	0.851	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	cis	-98.1	41.2	6.5	40.1	-36.6	0	0	0	113.5	H61	P59-H61 PolarHBondContact O-N 3.48Å
60	L	81.1	Confident	87.5	Confident	67 Å²	67	59.1 Å²	59.1	35%	0.351	31%	0.308	S	S	.	.	S	Bend	trans	-66.1	124.8	171.6	-70.4	168.7	0	0	0	110.3	D57 Y62 A63 G64	D57-L60 HydrophobicContact CB-CD1 4.21Å; D57-L60 WeakPolarHBondContact O-CB 3.05Å; D57-L60 WeakPolarHBondContact O-CD1 3.5Å; D57-L60 WeakPolarHBondContact O-CG 3.49Å; D57-L60 PolarHBondContact O-N 3.25Å; L60-Y62 PolarHBondContact O-N 2.75Å; L60-A63 HydrophobicContact CB-CB 4.14Å; L60-A63 PolarHBondContact O-N 3.1Å; L60-G64 PolarHBondContact O-N 2.71Å
61	H	79.8	Confident	87.5	Confident	148 Å²	148	56.6 Å²	56.6	69%	0.685	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	138.2	172.5	-74.5	-52.7	0	0	0	111.8	P59 A63 E65	P59-H61 PolarHBondContact O-N 3.48Å; H61-A63 PolarHBondContact O-N 3.2Å; H61-E65 WeakPolarHBondContact CA-OE1 3.27Å; H61-E65 IonicContact CE1-OE1 3.87Å; H61-E65 IonicContact CG-OE1 3.63Å; H61-E65 IonicContact ND1-OE1 2.8Å; H61-E65 PolarHBondContact ND1-OE1 2.71Å
62	Y	83.3	Confident	87.1	Confident	94 Å²	94	58.7 Å²	58.7	37%	0.369	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	-58.8	-166.9	-48.4	-82	0	0	0	114.8	L60 G64 E65 C120 G121 P124	L60-Y62 PolarHBondContact O-N 2.75Å; Y62-G64 VanDerWaalsContact C-N 3.29Å; Y62-G64 PolarHBondContact O-N 2.82Å; Y62-E65 PolarHBondContact N-OE1 2.84Å; Y62-E65 PolarHBondContact O-N 3.38Å; Y62-E65 VanDerWaalsContact O-N 3.1Å; Y62-C120 HydrophobicContact CD1-CB 4.15Å; Y62-C120 VanDerWaalsContact O-CB 3.31Å; Y62-C120 WeakPolarHBondContact O-CB 3.43Å; Y62-C120 PolarHBondContact O-N 2.8Å; Y62-G121 CarbonylContact C-O 3.23Å; Y62-G121 VanDerWaalsContact C-O 3.23Å; Y62-G121 VanDerWaalsContact CB-O 3.28Å; Y62-G121 WeakPolarHBondContact CB-O 3.47Å; Y62-P124 VanDerWaalsContact CE1-CA 3.49Å; Y62-P124 HydrophobicContact CE1-CB 3.87Å
63	A	80.5	Confident	86.3	Confident	6 Å²	6	58.7 Å²	58.7	5%	0.05	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-30.1	-169.7	0	0	0	0	0	113.9	N24 D57 L60 H61 G121	N24-A63 HydrophobicContact CB-CB 3.9Å; D57-A63 HydrophobicContact CB-CB 4.22Å; L60-A63 HydrophobicContact CB-CB 4.14Å; L60-A63 PolarHBondContact O-N 3.1Å; H61-A63 PolarHBondContact O-N 3.2Å; A63-G121 WeakPolarHBondContact CA-O 3.34Å; A63-G121 PolarHBondContact N-O 2.83Å; A63-G121 VanDerWaalsContact N-O 3.08Å
64	G	81.2	Confident	85.2	Confident	7 Å²	7	59 Å²	59	7%	0.072	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	10	174.1	0	0	0	0	0	114.7	L60 Y62	L60-G64 PolarHBondContact O-N 2.71Å; Y62-G64 VanDerWaalsContact C-N 3.29Å; Y62-G64 PolarHBondContact O-N 2.82Å
65	E	90.1	Very high	83.6	Confident	40 Å²	40	60.2 Å²	60.2	19%	0.187	32%	0.322	C	S	.	.	S	Bend	trans	-103	140.7	179	-70.8	174.8	-150.3	0	0	110.7	H61 Y62 R90 D119 C120	H61-E65 WeakPolarHBondContact CA-OE1 3.27Å; H61-E65 IonicContact CE1-OE1 3.87Å; H61-E65 IonicContact CG-OE1 3.63Å; H61-E65 IonicContact ND1-OE1 2.8Å; H61-E65 PolarHBondContact ND1-OE1 2.71Å; Y62-E65 PolarHBondContact N-OE1 2.84Å; Y62-E65 PolarHBondContact O-N 3.38Å; Y62-E65 VanDerWaalsContact O-N 3.1Å; E65-R90 CarbonylContact C-O 3.54Å; E65-R90 VanDerWaalsContact CA-O 3.31Å; E65-R90 WeakPolarHBondContact CA-O 3.28Å; E65-R90 HydrophobicContact CB-CB 4.47Å; E65-D119 CarbonylContact O-C 3.59Å; E65-D119 VanDerWaalsContact O-CA 3.26Å; E65-D119 WeakPolarHBondContact O-CA 3.33Å; E65-C120 HydrophobicContact CB-CB 4.37Å; E65-C120 PolarHBondContact O-N 2.82Å
66	I	92	Very high	82.2	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.015	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	114.8	179.4	-54.9	-59.1	0	0	0	109.9	P28 A53 F69 V87 R90	P28-I66 HydrophobicContact CB-CD1 3.66Å; A53-I66 HydrophobicContact CB-CD1 3.82Å; A53-I66 HydrophobicContact CB-CG1 3.88Å; A53-I66 HydrophobicContact CB-CG2 4.23Å; A53-I66 WeakPolarHBondContact O-CG1 3.16Å; I66-F69 HydrophobicContact CG2-CE2 4.22Å; I66-F69 HydrophobicContact CG2-CZ 4.29Å; I66-V87 HydrophobicContact CG2-CG2 4.2Å; I66-R90 PolarHBondContact N-O 2.9Å; I66-R90 WeakPolarHBondContact O-CB 3.33Å; I66-R90 WeakPolarHBondContact O-CG 3.48Å
67	C	88.4	Confident	80.6	Confident	55 Å²	55	58.3 Å²	58.3	37%	0.372	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-14.4	-178.7	-99.3	0	0	0	0	114.3	R90 Y118 C120	C67-R90 PolarHBondContact SG-NH1 2.76Å; C67-Y118 PolarHBondContact N-O 3.18Å; C67-C120 WeakPolarHBondContact CA-SG 3.47Å; C67-C120 HydrophobicContact CB-CB 3.86Å; C67-C120 WeakPolarHBondContact CB-SG 3.39Å; C67-C120 PolarHBondContact N-SG 2.96Å; C67-C120 VanDerWaalsContact SG-CA 3.52Å; C67-C120 WeakPolarHBondContact SG-CB 3.3Å; C67-C120 CovalentContact SG-SG 2.02Å; C67-C120 PolarHBondContact SG-SG 3Å
68	G	90.8	Very high	79.2	Confident	19 Å²	19	60 Å²	60	20%	0.196	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.4	154.1	176.9	0	0	0	0	0	115.2	Y118	G68-Y118 PolarHBondContact N-O 3.33Å; G68-Y118 WeakPolarHBondContact O-CB 3.47Å; G68-Y118 PolarHBondContact O-N 3.17Å
69	F	93.1	Very high	78.1	Confident	20 Å²	20	57.7 Å²	57.7	9%	0.088	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	142	162	-64.5	-87.1	0	0	0	108.7	I30 L51 A53 I66 A85 V87 Q116 A117	I30-F69 HydrophobicContact CG2-CE1 4.34Å; L51-F69 HydrophobicContact CD1-CD1 4.1Å; L51-F69 HydrophobicContact CD1-CE1 3.55Å; L51-F69 HydrophobicContact CD1-CZ 4.13Å; L51-F69 HydrophobicContact CD2-CD1 3.97Å; L51-F69 HydrophobicContact CD2-CD2 4.39Å; L51-F69 HydrophobicContact CD2-CE1 3.95Å; L51-F69 HydrophobicContact CD2-CE2 4.4Å; L51-F69 HydrophobicContact CD2-CG 4.19Å; L51-F69 HydrophobicContact CD2-CZ 4.18Å; L51-F69 HydrophobicContact CG-CD1 4.26Å; L51-F69 HydrophobicContact CG-CE1 3.74Å; L51-F69 HydrophobicContact CG-CE2 4.45Å; L51-F69 HydrophobicContact CG-CZ 3.85Å; A53-F69 HydrophobicContact CB-CE1 3.71Å; A53-F69 HydrophobicContact CB-CZ 3.74Å; I66-F69 HydrophobicContact CG2-CE2 4.22Å; I66-F69 HydrophobicContact CG2-CZ 4.29Å; F69-A85 HydrophobicContact CB-CB 3.45Å; F69-A85 VanDerWaalsContact CB-CB 3.45Å; F69-A85 HydrophobicContact CG-CB 4.26Å; F69-V87 HydrophobicContact CD2-CG2 3.7Å; F69-V87 HydrophobicContact CE2-CG2 3.86Å; F69-Q116 CarbonylContact C-O 3.51Å; F69-Q116 WeakPolarHBondContact CA-O 3.49Å; F69-A117 HydrophobicContact CD1-CB 3.9Å; F69-A117 HydrophobicContact CE1-CB 3.79Å
70	R	90	Very high	76.8	Confident	138 Å²	138	53 Å²	53	52%	0.521	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	118.1	174	-172	165.2	-64.3	179.3	2.1	110	H72 I115 Q116 Y118	R70-H72 PolarHBondContact O-CD2 3.14Å; R70-I115 WeakPolarHBondContact O-CA 3.38Å; R70-Q116 PolarHBondContact N-O 3.42Å; R70-Q116 PolarHBondContact O-N 2.82Å; R70-Y118 HydrophobicContact CB-CD2 4.27Å; R70-Y118 HydrophobicContact CB-CE2 3.62Å
71	V	90.5	Very high	76	Confident	26 Å²	26	54.8 Å²	54.8	16%	0.158	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	140	165.5	-176.1	0	0	0	0	108.8	A85 F113 T114 I115	V71-A85 HydrophobicContact CG2-CB 4.1Å; V71-F113 HydrophobicContact CG1-CB 4.15Å; V71-F113 HydrophobicContact CG1-CD2 3.76Å; V71-F113 HydrophobicContact CG1-CE2 4.41Å; V71-F113 HydrophobicContact CG1-CG 4.08Å; V71-T114 CarbonylContact C-O 3.56Å; V71-I115 HydrophobicContact CG2-CG2 4.19Å
72	H	86.1	Confident	76	Confident	47 Å²	47	50.3 Å²	50.3	22%	0.218	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	157.8	173.3	-57.3	-116.8	0	0	0	108.5	R70 G74 T114 Q116 K134	R70-H72 PolarHBondContact O-CD2 3.14Å; H72-G74 PolarHBondContact O-N 2.72Å; H72-T114 PolarHBondContact N-O 3.13Å; H72-T114 PolarHBondContact O-N 2.99Å; H72-Q116 PolarHBondContact CE1-OE1 2.91Å; H72-Q116 PolarHBondContact NE2-OE1 3.24Å; H72-Q116 VanDerWaalsContact NE2-OE1 3.09Å; H72-K134 WeakPolarHBondContact ND1-CE 3.49Å; H72-K134 PolarHBondContact ND1-NZ 3.17Å
73	N	77.4	Confident	76.3	Confident	81 Å²	81	45.9 Å²	45.9	43%	0.433	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	137.8	174.7	-97.1	-28.8	0	0	0	111.8	G77 S80 T114	N73-G77 PolarHBondContact OD1-O 3.29Å; N73-S80 PolarHBondContact ND2-OG 3.04Å; N73-S80 WeakPolarHBondContact OD1-CB 3.31Å; N73-S80 PolarHBondContact OD1-N 3.18Å; N73-S80 PolarHBondContact OD1-OG 3.02Å; N73-T114 PolarHBondContact O-OG1 2.95Å
74	G	67.6	Low	76.8	Confident	8 Å²	8	49 Å²	49	8%	0.082	29%	0.292	C	S	.	.			trans	-76.3	169.2	164.6	0	0	0	0	0	111	H72 S76 G77	H72-G74 PolarHBondContact O-N 2.72Å; G74-S76 PolarHBondContact O-N 3.29Å; G74-G77 PolarHBondContact O-N 2.74Å
75	P	59	Low	77.3	Confident	123 Å²	123	49.2 Å²	49.2	80%	0.799	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.8	-179.1	25.2	-34.1	0	0	0	113.4
76	S	57.6	Low	77.4	Confident	102 Å²	102	49.6 Å²	49.6	71%	0.713	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	3	-179.8	-43.9	0	0	0	0	114.9	G74 S78	G74-S76 PolarHBondContact O-N 3.29Å; S76-S78 PolarHBondContact O-N 2.75Å; S76-S78 VanDerWaalsContact O-N 3.11Å
77	G	55.8	Low	77.4	Confident	46 Å²	46	51 Å²	51	47%	0.474	31%	0.307	S	S	.	.	S	Bend	trans	79.2	-20.5	164.5	0	0	0	0	0	119.5	N73 G74	N73-G77 PolarHBondContact OD1-O 3.29Å; G74-G77 PolarHBondContact O-N 2.74Å
78	S	55.8	Low	77.5	Confident	51 Å²	51	52.9 Å²	52.9	36%	0.357	31%	0.313	S	S	.	.	S	Bend	trans	-85.5	-23.4	-176.4	86.3	0	0	0	0	115.8	S76 Q108	S76-S78 PolarHBondContact O-N 2.75Å; S76-S78 VanDerWaalsContact O-N 3.11Å; S78-Q108 PolarHBondContact OG-NE2 3.09Å; S78-Q108 PolarHBondContact OG-OE1 3.49Å
79	G	56.7	Low	77.6	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-13.4	-158.7	0	0	0	0	0	120.2
80	S	57	Low	77.3	Confident	33 Å²	33	60.4 Å²	60.4	23%	0.231	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-23.5	-168.4	64.3	0	0	0	0	117.1	N73	N73-S80 PolarHBondContact ND2-OG 3.04Å; N73-S80 WeakPolarHBondContact OD1-CB 3.31Å; N73-S80 PolarHBondContact OD1-N 3.18Å; N73-S80 PolarHBondContact OD1-OG 3.02Å
81	V	63.2	Low	77.1	Confident	104 Å²	104	57.9 Å²	57.9	63%	0.63	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-42.4	-173	-174.8	0	0	0	0	110.9	F83 K100	V81-F83 PolarHBondContact O-N 2.88Å; V81-K100 PolarHBondContact O-NZ 3.43Å
82	Q	79.4	Confident	76.9	Confident	53 Å²	53	59.6 Å²	59.6	25%	0.248	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-22.8	-174.7	-72.3	172.7	-40.6	0	0	114.5	S99 K100 H111	Q82-S99 CarbonylContact O-C 3.48Å; Q82-S99 VanDerWaalsContact O-CA 3.24Å; Q82-S99 WeakPolarHBondContact O-CA 3.37Å; Q82-K100 PolarHBondContact O-N 3.42Å; Q82-H111 PolarHBondContact OE1-CE1 3.43Å
83	F	89.6	Confident	77	Confident	1 Å²	1	57.4 Å²	57.4	0%	0.004	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	150.2	-175.1	-65.3	-85.9	0	0	0	114.2	V45 V81 V97 R98 K100 L103 H111 F113 V139	V45-F83 HydrophobicContact CG2-CD1 4.1Å; V45-F83 HydrophobicContact CG2-CE1 3.83Å; V81-F83 PolarHBondContact O-N 2.88Å; F83-V97 HydrophobicContact CD1-CG1 4.33Å; F83-R98 WeakPolarHBondContact CA-O 3.27Å; F83-K100 PolarHBondContact O-NZ 3.02Å; F83-L103 HydrophobicContact CE1-CD1 4.08Å; F83-L103 HydrophobicContact CE1-CD2 4.45Å; F83-L103 HydrophobicContact CE2-CD2 4.5Å; F83-L103 HydrophobicContact CZ-CD1 3.99Å; F83-L103 HydrophobicContact CZ-CD2 3.87Å; F83-H111 HydrophobicContact CE2-CB 3.82Å; F83-H111 AromaticContact CE2-CD2 3.97Å; F83-H111 AromaticContact CE2-CG 3.66Å; F83-H111 AromaticContact CE2-ND1 3.88Å; F83-H111 HydrophobicContact CZ-CB 4.26Å; F83-H111 AromaticContact CZ-CD2 3.81Å; F83-H111 AromaticContact CZ-CG 3.98Å; F83-F113 HydrophobicContact CB-CD1 4.34Å; F83-F113 HydrophobicContact CB-CE1 3.86Å; F83-F113 HydrophobicContact CB-CZ 3.96Å; F83-F113 AromaticContact CD1-CE1 3.95Å; F83-F113 HydrophobicContact CD1-CE1 3.95Å; F83-F113 HydrophobicContact CD1-CZ 4.21Å; F83-F113 AromaticContact CD2-CD1 3.82Å; F83-F113 HydrophobicContact CD2-CD1 3.82Å; F83-F113 AromaticContact CD2-CE1 3.51Å; F83-F113 HydrophobicContact CD2-CE1 3.51Å; F83-F113 HydrophobicContact CD2-CZ 4.4Å; F83-F113 HydrophobicContact CE1-CE1 4.42Å; F83-F113 HydrophobicContact CE2-CD1 4.43Å; F83-F113 HydrophobicContact CE2-CE1 4.03Å; F83-F113 HydrophobicContact CG-CD1 4.13Å; F83-F113 AromaticContact CG-CE1 3.47Å; F83-F113 HydrophobicContact CG-CE1 3.47Å; F83-F113 VanDerWaalsContact CG-CE1 3.47Å; F83-F113 AromaticContact CG-CZ 3.92Å; F83-F113 HydrophobicContact CG-CZ 3.92Å; F83-F113 HydrophobicContact CZ-CE1 4.46Å; F83-V139 HydrophobicContact CE1-CG1 4.31Å; F83-V139 HydrophobicContact CZ-CG1 4.35Å
84	E	90.6	Very high	77.7	Confident	71 Å²	71	57.1 Å²	57.1	33%	0.332	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	162.3	166.6	56.3	179.3	-139.3	0	0	112.2	V86 V97 R98 K100	E84-V86 HydrophobicContact CG-CG2 4.45Å; E84-V97 WeakPolarHBondContact O-CA 3.31Å; E84-R98 HydrophobicContact CG-CG 3.6Å; E84-R98 PolarHBondContact N-O 2.86Å; E84-R98 PolarHBondContact O-N 2.84Å; E84-K100 HydrophobicContact CG-CG 4.09Å; E84-K100 VanDerWaalsContact OE2-CE 3.29Å; E84-K100 WeakPolarHBondContact OE2-CE 3.41Å
85	A	91.8	Very high	78.9	Confident	13 Å²	13	57.1 Å²	57.1	11%	0.107	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	116.9	178.7	0	0	0	0	0	108.6	L51 F69 V71 L96 V97	L51-A85 HydrophobicContact CD2-CB 4.46Å; F69-A85 HydrophobicContact CB-CB 3.45Å; F69-A85 VanDerWaalsContact CB-CB 3.45Å; F69-A85 HydrophobicContact CG-CB 4.26Å; V71-A85 HydrophobicContact CG2-CB 4.1Å; A85-L96 CarbonylContact C-O 3.39Å; A85-L96 WeakPolarHBondContact CA-O 3.46Å; A85-V97 HydrophobicContact CB-CG2 4.04Å
86	V	91.9	Very high	80.5	Confident	48 Å²	48	53.4 Å²	53.4	29%	0.291	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	136.5	-172.9	-173.4	0	0	0	0	108.8	E84 G95 L96	E84-V86 HydrophobicContact CG-CG2 4.45Å; V86-G95 CarbonylContact O-C 3.45Å; V86-G95 VanDerWaalsContact O-CA 3.26Å; V86-G95 WeakPolarHBondContact O-CA 3.41Å; V86-L96 PolarHBondContact N-O 3.27Å; V86-L96 PolarHBondContact O-N 3.29Å
87	V	92.6	Very high	82.2	Confident	32 Å²	32	48.6 Å²	48.6	19%	0.194	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	126.4	172.7	-177.2	0	0	0	0	108.7	I66 F69 R90	I66-V87 HydrophobicContact CG2-CG2 4.2Å; F69-V87 HydrophobicContact CD2-CG2 3.7Å; F69-V87 HydrophobicContact CE2-CG2 3.86Å; V87-R90 HydrophobicContact CG1-CG 4.02Å
88	L	91.9	Very high	84	Confident	94 Å²	94	50.7 Å²	50.7	49%	0.492	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-47.8	172.3	-62.8	-173.2	0	0	0	110.7	E94 L96	L88-E94 HydrophobicContact CB-CB 4.4Å; L88-E94 HydrophobicContact CB-CG 4.3Å; L88-E94 HydrophobicContact CD1-CG 4.21Å; L88-E94 PolarHBondContact N-O 2.7Å; L88-L96 HydrophobicContact CD1-CB 4.05Å; L88-L96 HydrophobicContact CD2-CB 3.97Å; L88-L96 HydrophobicContact CD2-CD2 4.36Å; L88-L96 HydrophobicContact CG-CB 3.98Å
89	D	91.1	Very high	85.7	Confident	61 Å²	61	48.4 Å²	48.4	33%	0.326	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	124.2	176.9	-179.9	-10.2	0	0	0	110.3	S91 T92 G93 E94	D89-S91 VanDerWaalsContact C-N 3.32Å; D89-S91 WeakPolarHBondContact OD1-CA 3.38Å; D89-S91 WeakPolarHBondContact OD1-CB 3.42Å; D89-S91 PolarHBondContact OD1-N 3.03Å; D89-S91 PolarHBondContact OD1-OG 3.42Å; D89-S91 PolarHBondContact OD2-OG 2.91Å; D89-T92 WeakPolarHBondContact CB-OG1 3.19Å; D89-G93 WeakPolarHBondContact O-CA 3.26Å; D89-G93 PolarHBondContact O-N 2.83Å; D89-E94 PolarHBondContact N-O 2.76Å; D89-E94 PolarHBondContact O-N 3.18Å
90	R	87.9	Confident	87.2	Confident	136 Å²	136	53.2 Å²	53.2	51%	0.513	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-23.2	-178.1	-56.6	-169.8	177	-165	-3.1	113.3	E65 I66 C67 V87	E65-R90 CarbonylContact C-O 3.54Å; E65-R90 VanDerWaalsContact CA-O 3.31Å; E65-R90 WeakPolarHBondContact CA-O 3.28Å; E65-R90 HydrophobicContact CB-CB 4.47Å; I66-R90 PolarHBondContact N-O 2.9Å; I66-R90 WeakPolarHBondContact O-CB 3.33Å; I66-R90 WeakPolarHBondContact O-CG 3.48Å; C67-R90 PolarHBondContact SG-NH1 2.76Å; V87-R90 HydrophobicContact CG1-CG 4.02Å
91	S	84.9	Confident	88.6	Confident	85 Å²	85	56.8 Å²	56.8	59%	0.594	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-30.7	-173.9	72.4	0	0	0	0	113.1	D89	D89-S91 VanDerWaalsContact C-N 3.32Å; D89-S91 WeakPolarHBondContact OD1-CA 3.38Å; D89-S91 WeakPolarHBondContact OD1-CB 3.42Å; D89-S91 PolarHBondContact OD1-N 3.03Å; D89-S91 PolarHBondContact OD1-OG 3.42Å; D89-S91 PolarHBondContact OD2-OG 2.91Å
92	T	87.1	Confident	89.7	Confident	63 Å²	63	56.8 Å²	56.8	39%	0.387	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-21.7	169	60.5	0	0	0	0	112.5	D89 E94	D89-T92 WeakPolarHBondContact CB-OG1 3.19Å; T92-E94 VanDerWaalsContact C-N 3.35Å; T92-E94 WeakPolarHBondContact OG1-CB 3.47Å; T92-E94 PolarHBondContact OG1-N 3.25Å
93	G	87.6	Confident	90.2	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	19.8	-174.1	0	0	0	0	0	113.9	F52 A53 D89	F52-G93 WeakPolarHBondContact CA-O 3.41Å; A53-G93 PolarHBondContact N-O 3.44Å; A53-G93 WeakPolarHBondContact O-CA 3.24Å; D89-G93 WeakPolarHBondContact O-CA 3.26Å; D89-G93 PolarHBondContact O-N 2.83Å
94	E	93.3	Very high	90.2	Very high	75 Å²	75	58.3 Å²	58.3	35%	0.35	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	134.6	178.6	-168.2	173.7	178.3	0	0	111.6	F52 L88 D89 T92	F52-E94 HydrophobicContact CD1-CB 3.98Å; F52-E94 HydrophobicContact CD1-CG 4.28Å; F52-E94 HydrophobicContact CE1-CB 3.64Å; F52-E94 HydrophobicContact CE1-CG 3.66Å; F52-E94 HydrophobicContact CZ-CG 4.04Å; L88-E94 HydrophobicContact CB-CB 4.4Å; L88-E94 HydrophobicContact CB-CG 4.3Å; L88-E94 HydrophobicContact CD1-CG 4.21Å; L88-E94 PolarHBondContact N-O 2.7Å; D89-E94 PolarHBondContact N-O 2.76Å; D89-E94 PolarHBondContact O-N 3.18Å; T92-E94 VanDerWaalsContact C-N 3.35Å; T92-E94 WeakPolarHBondContact OG1-CB 3.47Å; T92-E94 PolarHBondContact OG1-N 3.25Å
95	G	91.9	Very high	90.3	Very high	8 Å²	8	55.1 Å²	55.1	8%	0.082	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	155.2	178.8	0	0	0	0	0	113.1	L51 V86	L51-G95 PolarHBondContact O-N 2.85Å; V86-G95 CarbonylContact O-C 3.45Å; V86-G95 VanDerWaalsContact O-CA 3.26Å; V86-G95 WeakPolarHBondContact O-CA 3.41Å
96	L	93.6	Very high	90.3	Very high	45 Å²	45	57.6 Å²	57.6	24%	0.236	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	131.5	176.4	-175.2	63.3	0	0	0	110	T44 A85 V86 L88	T44-L96 HydrophobicContact CG2-CD1 3.86Å; T44-L96 HydrophobicContact CG2-CD2 4.18Å; T44-L96 HydrophobicContact CG2-CG 4.36Å; A85-L96 CarbonylContact C-O 3.39Å; A85-L96 WeakPolarHBondContact CA-O 3.46Å; V86-L96 PolarHBondContact N-O 3.27Å; V86-L96 PolarHBondContact O-N 3.29Å; L88-L96 HydrophobicContact CD1-CB 4.05Å; L88-L96 HydrophobicContact CD2-CB 3.97Å; L88-L96 HydrophobicContact CD2-CD2 4.36Å; L88-L96 HydrophobicContact CG-CB 3.98Å
97	V	93.4	Very high	90.1	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.006	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	136.9	171.3	174.1	0	0	0	0	109.5	V45 L47 L51 F83 E84 A85 F113	V45-V97 HydrophobicContact CB-CB 4.1Å; V45-V97 HydrophobicContact CB-CG1 3.9Å; V45-V97 HydrophobicContact CG1-CG1 4.47Å; V45-V97 HydrophobicContact CG2-CG1 3.85Å; V45-V97 PolarHBondContact N-O 2.87Å; L47-V97 HydrophobicContact CD1-CB 4.15Å; L47-V97 HydrophobicContact CD1-CG2 3.71Å; L51-V97 HydrophobicContact CD2-CG2 3.96Å; F83-V97 HydrophobicContact CD1-CG1 4.33Å; E84-V97 WeakPolarHBondContact O-CA 3.31Å; A85-V97 HydrophobicContact CB-CG2 4.04Å; V97-F113 HydrophobicContact CG1-CE2 4.42Å; V97-F113 HydrophobicContact CG1-CZ 3.92Å
98	R	92.6	Very high	89.9	Confident	90 Å²	90	61.4 Å²	61.4	34%	0.34	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	157.4	175.6	65.6	179.3	68.4	171.7	-0.7	111.9	N43 F83 E84	N43-R98 CarbonylContact O-C 3.6Å; N43-R98 WeakPolarHBondContact O-CA 3.38Å; N43-R98 VanDerWaalsContact O-CB 3.25Å; N43-R98 WeakPolarHBondContact O-CB 3.44Å; F83-R98 WeakPolarHBondContact CA-O 3.27Å; E84-R98 HydrophobicContact CG-CG 3.6Å; E84-R98 PolarHBondContact N-O 2.86Å; E84-R98 PolarHBondContact O-N 2.84Å
99	S	91.8	Very high	89.8	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.021	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	154.5	164.3	71.2	0	0	0	0	111.2	N43 Q82 E101	N43-S99 WeakPolarHBondContact CA-OG 3.47Å; N43-S99 WeakPolarHBondContact CB-OG 3.43Å; N43-S99 PolarHBondContact ND2-O 2.8Å; N43-S99 PolarHBondContact ND2-OG 3.5Å; N43-S99 PolarHBondContact O-N 2.97Å; Q82-S99 CarbonylContact O-C 3.48Å; Q82-S99 VanDerWaalsContact O-CA 3.24Å; Q82-S99 WeakPolarHBondContact O-CA 3.37Å; S99-E101 WeakPolarHBondContact CB-O 3.01Å; S99-E101 PolarHBondContact OG-O 3.42Å
100	K	88.4	Confident	89.7	Confident	102 Å²	102	63.1 Å²	63.1	44%	0.443	32%	0.32	S	S	.	.	S	Bend	trans	-94.1	-24.8	173.6	-56.4	-163.9	-170.8	83.8	0	112.8	V81 Q82 F83 E84	V81-K100 PolarHBondContact O-NZ 3.43Å; Q82-K100 PolarHBondContact O-N 3.42Å; F83-K100 PolarHBondContact O-NZ 3.02Å; E84-K100 HydrophobicContact CG-CG 4.09Å; E84-K100 VanDerWaalsContact OE2-CE 3.29Å; E84-K100 WeakPolarHBondContact OE2-CE 3.41Å
101	E	86	Confident	89.7	Confident	107 Å²	107	57 Å²	57	50%	0.5	30%	0.297	S	S	.	.	S	Bend	trans	-124.6	157.2	179.9	-67.4	169.2	164.1	0	0	107.1	S99	S99-E101 WeakPolarHBondContact CB-O 3.01Å; S99-E101 PolarHBondContact OG-O 3.42Å
102	P	86.8	Confident	90	Very high	105 Å²	105	53.7 Å²	53.7	68%	0.682	27%	0.274	S	S	*	.			trans	-53.4	150	169	-23.4	34.6	0	0	0	110.9
103	L	89.9	Confident	90.1	Very high	14 Å²	14	50.7 Å²	50.7	7%	0.073	26%	0.256	C	S	.	.			trans	-96.1	167.2	170.7	-59.9	175.7	0	0	0	108.9	V38 E40 F83 V141	V38-L103 HydrophobicContact CB-CD1 4.36Å; V38-L103 HydrophobicContact CG1-CD1 3.46Å; V38-L103 VanDerWaalsContact CG1-CD1 3.46Å; V38-L103 HydrophobicContact CG2-CD1 3.96Å; E40-L103 HydrophobicContact CB-CB 4.29Å; F83-L103 HydrophobicContact CE1-CD1 4.08Å; F83-L103 HydrophobicContact CE1-CD2 4.45Å; F83-L103 HydrophobicContact CE2-CD2 4.5Å; F83-L103 HydrophobicContact CZ-CD1 3.99Å; F83-L103 HydrophobicContact CZ-CD2 3.87Å; L103-V141 HydrophobicContact CB-CG1 4.38Å; L103-V141 HydrophobicContact CB-CG2 4.36Å; L103-V141 HydrophobicContact CD1-CG2 4.31Å
104	D	90.3	Very high	90.3	Very high	71 Å²	71	51.4 Å²	51.4	38%	0.38	26%	0.26	S	S	.	.			trans	-156.2	111.4	-169.7	162.8	-17.3	0	0	0	105.4	E106 S107 Q108	D104-E106 PolarHBondContact OD1-N 3.11Å; D104-S107 WeakPolarHBondContact OD1-CB 3.44Å; D104-S107 PolarHBondContact OD1-N 3.17Å; D104-S107 PolarHBondContact OD1-OG 2.87Å; D104-S107 VanDerWaalsContact OD2-CB 3.3Å; D104-S107 WeakPolarHBondContact OD2-CB 3.38Å; D104-S107 PolarHBondContact OD2-OG 2.87Å; D104-Q108 PolarHBondContact O-N 3.5Å
105	C	91.5	Very high	90.3	Very high	4 Å²	4	47.8 Å²	47.8	3%	0.027	24%	0.244	C	C	.	.	H	α-helix	trans	-74.9	-32.5	-172.3	-168.5	0	0	0	0	112.4	E40 S107 R109 V141 C179	E40-C105 WeakPolarHBondContact OE2-CB 3.01Å; E40-C105 PolarHBondContact OE2-N 3.21Å; C105-S107 VanDerWaalsContact C-N 3.33Å; C105-R109 PolarHBondContact O-N 3.39Å; C105-R109 VanDerWaalsContact O-N 3.11Å; C105-V141 HydrophobicContact CB-CB 4.36Å; C105-V141 HydrophobicContact CB-CG1 3.88Å; C105-C179 HydrophobicContact CB-CB 3.59Å; C105-C179 WeakPolarHBondContact CB-SG 3.09Å; C105-C179 WeakPolarHBondContact SG-CB 3.38Å; C105-C179 CovalentContact SG-SG 2.02Å; C105-C179 PolarHBondContact SG-SG 3.29Å
106	E	91.8	Very high	90.3	Very high	66 Å²	66	48.6 Å²	48.6	31%	0.308	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-38.1	179	-65.7	61.1	-121.7	0	0	110.5	D104 F147 A177 D178 C179	D104-E106 PolarHBondContact OD1-N 3.11Å; E106-F147 HydrophobicContact CG-CE2 4.02Å; E106-A177 VanDerWaalsContact CG-O 3.3Å; E106-A177 WeakPolarHBondContact CG-O 3.13Å; E106-D178 WeakPolarHBondContact OE1-CA 3.48Å; E106-C179 HydrophobicContact CG-CB 4.47Å; E106-C179 WeakPolarHBondContact OE1-CA 3.35Å; E106-C179 WeakPolarHBondContact OE1-CB 3.4Å; E106-C179 PolarHBondContact OE1-N 2.9Å
107	S	88.3	Confident	90.3	Very high	94 Å²	94	46.5 Å²	46.5	66%	0.657	23%	0.234	S	C	*	.	H	α-helix	trans	-76.4	-51.9	173.4	-71.9	0	0	0	0	112.8	D104 C105	D104-S107 WeakPolarHBondContact OD1-CB 3.44Å; D104-S107 PolarHBondContact OD1-N 3.17Å; D104-S107 PolarHBondContact OD1-OG 2.87Å; D104-S107 VanDerWaalsContact OD2-CB 3.3Å; D104-S107 WeakPolarHBondContact OD2-CB 3.38Å; D104-S107 PolarHBondContact OD2-OG 2.87Å; C105-S107 VanDerWaalsContact C-N 3.33Å
108	Q	87.8	Confident	90.3	Very high	65 Å²	65	47.7 Å²	47.7	30%	0.304	24%	0.239	S	C	.	.	H	α-helix	trans	-153.4	87.2	178.9	-167.2	177.7	-17.1	0	0	114.5	S78 D104 E110 H111	S78-Q108 PolarHBondContact OG-NE2 3.09Å; S78-Q108 PolarHBondContact OG-OE1 3.49Å; D104-Q108 PolarHBondContact O-N 3.5Å; Q108-E110 VanDerWaalsContact C-N 3.31Å; Q108-E110 PolarHBondContact NE2-O 3.07Å; Q108-E110 PolarHBondContact O-N 2.75Å; Q108-E110 VanDerWaalsContact O-N 3.17Å; Q108-H111 PolarHBondContact O-NE2 2.95Å
109	R	89.1	Confident	90.2	Very high	77 Å²	77	43.6 Å²	43.6	29%	0.291	22%	0.224	S	C	.	.	S	Bend	trans	-52.7	-31.2	173.4	-171.4	172.6	-160.5	170.3	14	117.5	C105 V141	C105-R109 PolarHBondContact O-N 3.39Å; C105-R109 VanDerWaalsContact O-N 3.11Å; R109-V141 PolarHBondContact O-N 3.43Å
110	E	90.1	Very high	89.9	Confident	114 Å²	114	43.6 Å²	43.6	53%	0.533	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	125.5	-174.4	-64.5	-168	165.1	0	0	112.9	Q108 R140	Q108-E110 VanDerWaalsContact C-N 3.31Å; Q108-E110 PolarHBondContact NE2-O 3.07Å; Q108-E110 PolarHBondContact O-N 2.75Å; Q108-E110 VanDerWaalsContact O-N 3.17Å; E110-R140 HydrophobicContact CG-CG 4.38Å; E110-R140 IonicContact OE1-CZ 3.65Å; E110-R140 IonicContact OE1-NH1 2.75Å; E110-R140 PolarHBondContact OE1-NH1 2.89Å
111	H	88.6	Confident	89.8	Confident	7 Å²	7	38.8 Å²	38.8	3%	0.032	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	149.7	178	-53.6	-94.7	0	0	0	111.4	Q82 F83 Q108 V139	Q82-H111 PolarHBondContact OE1-CE1 3.43Å; F83-H111 HydrophobicContact CE2-CB 3.82Å; F83-H111 AromaticContact CE2-CD2 3.97Å; F83-H111 AromaticContact CE2-CG 3.66Å; F83-H111 AromaticContact CE2-ND1 3.88Å; F83-H111 HydrophobicContact CZ-CB 4.26Å; F83-H111 AromaticContact CZ-CD2 3.81Å; F83-H111 AromaticContact CZ-CG 3.98Å; Q108-H111 PolarHBondContact O-NE2 2.95Å; H111-V139 HydrophobicContact CB-CB 4.47Å; H111-V139 PolarHBondContact N-O 3.05Å; H111-V139 PolarHBondContact O-N 3.34Å
112	S	89.8	Confident	89.5	Confident	16 Å²	16	37.6 Å²	37.6	11%	0.112	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	131.4	171.9	-175.4	0	0	0	0	112.2	V137 H138	S112-V137 WeakPolarHBondContact CA-O 3.36Å; S112-V137 PolarHBondContact OG-O 3.46Å; S112-H138 PolarHBondContact OG-CE1 2.87Å
113	F	90.7	Very high	89	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	174.4	179	52.7	-95.5	0	0	0	111	V71 F83 V97 I115 V137 V139	V71-F113 HydrophobicContact CG1-CB 4.15Å; V71-F113 HydrophobicContact CG1-CD2 3.76Å; V71-F113 HydrophobicContact CG1-CE2 4.41Å; V71-F113 HydrophobicContact CG1-CG 4.08Å; F83-F113 HydrophobicContact CB-CD1 4.34Å; F83-F113 HydrophobicContact CB-CE1 3.86Å; F83-F113 HydrophobicContact CB-CZ 3.96Å; F83-F113 AromaticContact CD1-CE1 3.95Å; F83-F113 HydrophobicContact CD1-CE1 3.95Å; F83-F113 HydrophobicContact CD1-CZ 4.21Å; F83-F113 AromaticContact CD2-CD1 3.82Å; F83-F113 HydrophobicContact CD2-CD1 3.82Å; F83-F113 AromaticContact CD2-CE1 3.51Å; F83-F113 HydrophobicContact CD2-CE1 3.51Å; F83-F113 HydrophobicContact CD2-CZ 4.4Å; F83-F113 HydrophobicContact CE1-CE1 4.42Å; F83-F113 HydrophobicContact CE2-CD1 4.43Å; F83-F113 HydrophobicContact CE2-CE1 4.03Å; F83-F113 HydrophobicContact CG-CD1 4.13Å; F83-F113 AromaticContact CG-CE1 3.47Å; F83-F113 HydrophobicContact CG-CE1 3.47Å; F83-F113 VanDerWaalsContact CG-CE1 3.47Å; F83-F113 AromaticContact CG-CZ 3.92Å; F83-F113 HydrophobicContact CG-CZ 3.92Å; F83-F113 HydrophobicContact CZ-CE1 4.46Å; V97-F113 HydrophobicContact CG1-CE2 4.42Å; V97-F113 HydrophobicContact CG1-CZ 3.92Å; F113-I115 HydrophobicContact CD2-CG2 3.84Å; F113-I115 HydrophobicContact CE2-CG2 3.73Å; F113-V137 HydrophobicContact CD2-CB 3.93Å; F113-V137 HydrophobicContact CD2-CG2 4.08Å; F113-V137 HydrophobicContact CE2-CB 3.56Å; F113-V137 HydrophobicContact CE2-CG1 3.95Å; F113-V137 HydrophobicContact CE2-CG2 3.67Å; F113-V137 HydrophobicContact CZ-CB 3.87Å; F113-V137 HydrophobicContact CZ-CG1 3.81Å; F113-V137 HydrophobicContact CZ-CG2 4.4Å; F113-V137 PolarHBondContact N-O 2.78Å; F113-V137 PolarHBondContact O-N 3.03Å; F113-V139 HydrophobicContact CE1-CG2 3.62Å; F113-V139 HydrophobicContact CZ-CG2 3.8Å
114	T	91.1	Very high	88.3	Confident	15 Å²	15	37.3 Å²	37.3	9%	0.092	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.6	175.7	54.2	0	0	0	0	112	V71 H72 N73 K134 A135	V71-T114 CarbonylContact C-O 3.56Å; H72-T114 PolarHBondContact N-O 3.13Å; H72-T114 PolarHBondContact O-N 2.99Å; N73-T114 PolarHBondContact O-OG1 2.95Å; T114-K134 PolarHBondContact OG1-NZ 2.88Å; T114-A135 CarbonylContact C-O 3.53Å; T114-A135 WeakPolarHBondContact CA-O 3.13Å; T114-A135 WeakPolarHBondContact CB-O 3.25Å
115	I	92.4	Very high	87.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	156.2	178.3	65	173.9	0	0	0	111.7	I30 Y34 L51 R70 V71 F113 K134 A135 V137	I30-I115 HydrophobicContact CD1-CG1 4.33Å; Y34-I115 HydrophobicContact CD2-CD1 3.99Å; Y34-I115 HydrophobicContact CE2-CD1 3.92Å; L51-I115 HydrophobicContact CD1-CD1 3.6Å; L51-I115 HydrophobicContact CD2-CD1 4.04Å; L51-I115 HydrophobicContact CG-CD1 4.46Å; R70-I115 WeakPolarHBondContact O-CA 3.38Å; V71-I115 HydrophobicContact CG2-CG2 4.19Å; F113-I115 HydrophobicContact CD2-CG2 3.84Å; F113-I115 HydrophobicContact CE2-CG2 3.73Å; I115-K134 WeakPolarHBondContact O-CA 3.06Å; I115-A135 HydrophobicContact CG1-CB 3.92Å; I115-A135 PolarHBondContact N-O 3.04Å; I115-A135 PolarHBondContact O-N 3.11Å; I115-V137 HydrophobicContact CB-CG2 4.39Å; I115-V137 HydrophobicContact CD1-CG2 3.8Å; I115-V137 HydrophobicContact CG1-CG2 3.82Å; I115-V137 HydrophobicContact CG2-CG2 3.77Å
116	Q	92.8	Very high	86.9	Confident	25 Å²	25	42 Å²	42	12%	0.117	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	127.3	179.8	-175.5	176.6	44.8	0	0	110.1	F69 R70 H72 Y118 K131 S132	F69-Q116 CarbonylContact C-O 3.51Å; F69-Q116 WeakPolarHBondContact CA-O 3.49Å; R70-Q116 PolarHBondContact N-O 3.42Å; R70-Q116 PolarHBondContact O-N 2.82Å; H72-Q116 PolarHBondContact CE1-OE1 2.91Å; H72-Q116 PolarHBondContact NE2-OE1 3.24Å; H72-Q116 VanDerWaalsContact NE2-OE1 3.09Å; Q116-Y118 HydrophobicContact CB-CE2 4.14Å; Q116-Y118 HydrophobicContact CG-CE2 3.88Å; Q116-Y118 WeakPolarHBondContact O-CD2 3.45Å; Q116-Y118 PolarHBondContact OE1-OH 2.8Å; Q116-K131 HydrophobicContact CG-CB 4.24Å; Q116-S132 WeakPolarHBondContact CA-OG 3.34Å; Q116-S132 WeakPolarHBondContact CG-OG 3.35Å; Q116-S132 PolarHBondContact NE2-O 3.02Å
117	A	93.8	Very high	86.3	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	151.3	175.8	0	0	0	0	0	112.1	P28 I30 A53 F69 K131 S132	P28-A117 HydrophobicContact CB-CB 4.25Å; P28-A117 HydrophobicContact CG-CB 4.35Å; I30-A117 HydrophobicContact CG2-CB 3.81Å; A53-A117 HydrophobicContact CB-CB 3.53Å; F69-A117 HydrophobicContact CD1-CB 3.9Å; F69-A117 HydrophobicContact CE1-CB 3.79Å; A117-K131 WeakPolarHBondContact O-CA 3.47Å; A117-S132 PolarHBondContact N-OG 3.41Å; A117-S132 PolarHBondContact O-N 3.29Å
118	Y	92.3	Very high	86	Confident	27 Å²	27	42.9 Å²	42.9	11%	0.106	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	126.9	-178.3	-71.1	-118.6	0	0	0	108.6	C67 G68 R70 Q116 K131	C67-Y118 PolarHBondContact N-O 3.18Å; G68-Y118 PolarHBondContact N-O 3.33Å; G68-Y118 WeakPolarHBondContact O-CB 3.47Å; G68-Y118 PolarHBondContact O-N 3.17Å; R70-Y118 HydrophobicContact CB-CD2 4.27Å; R70-Y118 HydrophobicContact CB-CE2 3.62Å; Q116-Y118 HydrophobicContact CB-CE2 4.14Å; Q116-Y118 HydrophobicContact CG-CE2 3.88Å; Q116-Y118 WeakPolarHBondContact O-CD2 3.45Å; Q116-Y118 PolarHBondContact OE1-OH 2.8Å; Y118-K131 HydrophobicContact CD1-CD 4.4Å; Y118-K131 HydrophobicContact CD1-CG 4.03Å; Y118-K131 HydrophobicContact CE1-CD 3.66Å; Y118-K131 HydrophobicContact CE1-CG 3.8Å; Y118-K131 HydrophobicContact CE2-CD 4.5Å; Y118-K131 WeakPolarHBondContact OH-CD 3.41Å; Y118-K131 PolarHBondContact OH-NZ 3.02Å
119	D	90.9	Very high	85.9	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.016	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	170.4	170.1	64.8	60.4	0	0	0	111.2	N24 P28 E65 G121 S129 K130	N24-D119 PolarHBondContact ND2-OD1 3.35Å; N24-D119 PolarHBondContact ND2-OD2 3.47Å; N24-D119 VanDerWaalsContact ND2-OD2 3.14Å; P28-D119 HydrophobicContact CG-CB 4.42Å; E65-D119 CarbonylContact O-C 3.59Å; E65-D119 VanDerWaalsContact O-CA 3.26Å; E65-D119 WeakPolarHBondContact O-CA 3.33Å; D119-G121 VanDerWaalsContact C-N 3.32Å; D119-G121 WeakPolarHBondContact OD1-CA 3.01Å; D119-G121 PolarHBondContact OD1-N 2.94Å; D119-S129 WeakPolarHBondContact OD1-CA 3.26Å; D119-K130 VanDerWaalsContact CG-N 3.32Å; D119-K130 PolarHBondContact N-O 2.81Å; D119-K130 PolarHBondContact OD1-N 3.09Å; D119-K130 VanDerWaalsContact OD1-N 3.13Å; D119-K130 WeakPolarHBondContact OD2-CA 3.3Å; D119-K130 VanDerWaalsContact OD2-CB 3.24Å; D119-K130 WeakPolarHBondContact OD2-CB 3.2Å; D119-K130 PolarHBondContact OD2-N 2.82Å
120	C	86.8	Confident	85.9	Confident	4 Å²	4	40.4 Å²	40.4	3%	0.027	23%	0.23	C	C	.	.			trans	-85.1	6.4	178.4	-64.3	0	0	0	0	114.5	Y62 E65 C67	Y62-C120 HydrophobicContact CD1-CB 4.15Å; Y62-C120 VanDerWaalsContact O-CB 3.31Å; Y62-C120 WeakPolarHBondContact O-CB 3.43Å; Y62-C120 PolarHBondContact O-N 2.8Å; E65-C120 HydrophobicContact CB-CB 4.37Å; E65-C120 PolarHBondContact O-N 2.82Å; C67-C120 WeakPolarHBondContact CA-SG 3.47Å; C67-C120 HydrophobicContact CB-CB 3.86Å; C67-C120 WeakPolarHBondContact CB-SG 3.39Å; C67-C120 PolarHBondContact N-SG 2.96Å; C67-C120 VanDerWaalsContact SG-CA 3.52Å; C67-C120 WeakPolarHBondContact SG-CB 3.3Å; C67-C120 CovalentContact SG-SG 2.02Å; C67-C120 PolarHBondContact SG-SG 3Å
121	G	85.6	Confident	86	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	-154	179	0	0	0	0	0	114.8	Y62 A63 D119 V127	Y62-G121 CarbonylContact C-O 3.23Å; Y62-G121 VanDerWaalsContact C-O 3.23Å; Y62-G121 VanDerWaalsContact CB-O 3.28Å; Y62-G121 WeakPolarHBondContact CB-O 3.47Å; A63-G121 WeakPolarHBondContact CA-O 3.34Å; A63-G121 PolarHBondContact N-O 2.83Å; A63-G121 VanDerWaalsContact N-O 3.08Å; D119-G121 VanDerWaalsContact C-N 3.32Å; D119-G121 WeakPolarHBondContact OD1-CA 3.01Å; D119-G121 PolarHBondContact OD1-N 2.94Å; G121-V127 CarbonylContact C-O 3.54Å; G121-V127 VanDerWaalsContact CA-O 3.32Å; G121-V127 WeakPolarHBondContact CA-O 3.42Å
122	E	79.9	Confident	86.3	Confident	83 Å²	83	39.2 Å²	39.2	39%	0.388	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	6.5	-177.1	-68.5	177	159.5	0	0	113.5	A23 N24 V127 N128	A23-E122 VanDerWaalsContact CA-OE1 3.27Å; A23-E122 WeakPolarHBondContact CA-OE1 3.48Å; N24-E122 HydrophobicContact CB-CG 3.63Å; N24-E122 PolarHBondContact N-OE1 3.15Å; E122-V127 PolarHBondContact N-O 2.89Å; E122-N128 HydrophobicContact CG-CB 4.1Å; E122-N128 PolarHBondContact OE1-ND2 3.38Å; E122-N128 WeakPolarHBondContact OE2-CB 3.36Å; E122-N128 PolarHBondContact OE2-ND2 2.89Å
123	G	76.4	Confident	86.4	Confident	13 Å²	13	41.9 Å²	41.9	13%	0.134	23%	0.234	C	C	.	.	S	Bend	trans	176.8	176.5	-179.6	0	0	0	0	0	112.6	D125 G126	G123-D125 PolarHBondContact O-N 2.95Å; G123-G126 PolarHBondContact O-N 3.28Å
124	P	73.8	Confident	86.4	Confident	99 Å²	99	46.6 Å²	46.6	64%	0.643	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.6	-170.7	24.6	-34.9	0	0	0	114.7	Y62 G126	Y62-P124 VanDerWaalsContact CE1-CA 3.49Å; Y62-P124 HydrophobicContact CE1-CB 3.87Å; P124-G126 VanDerWaalsContact C-N 3.25Å; P124-G126 PolarHBondContact O-N 3.44Å
125	D	76.7	Confident	86.4	Confident	147 Å²	147	45.9 Å²	45.9	79%	0.786	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	2	177.3	-53.6	-58.4	0	0	0	113.7	G123 V127	G123-D125 PolarHBondContact O-N 2.95Å; D125-V127 VanDerWaalsContact C-N 3.27Å; D125-V127 HydrophobicContact CB-CG2 4.09Å; D125-V127 PolarHBondContact O-N 2.92Å
126	G	76.6	Confident	86.4	Confident	28 Å²	28	48 Å²	48	29%	0.289	26%	0.263	S	S	.	.			trans	72	14.4	177.4	0	0	0	0	0	115.3	G123 P124 S129	G123-G126 PolarHBondContact O-N 3.28Å; P124-G126 VanDerWaalsContact C-N 3.25Å; P124-G126 PolarHBondContact O-N 3.44Å; G126-S129 VanDerWaalsContact O-CB 3.27Å; G126-S129 WeakPolarHBondContact O-CB 3.47Å; G126-S129 PolarHBondContact O-N 3.32Å; G126-S129 PolarHBondContact O-OG 3.33Å
127	V	78.3	Confident	86.4	Confident	96 Å²	96	46.8 Å²	46.8	58%	0.582	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	138.6	-178.4	178.4	0	0	0	0	110.8	G121 E122 D125 S129	G121-V127 CarbonylContact C-O 3.54Å; G121-V127 VanDerWaalsContact CA-O 3.32Å; G121-V127 WeakPolarHBondContact CA-O 3.42Å; E122-V127 PolarHBondContact N-O 2.89Å; D125-V127 VanDerWaalsContact C-N 3.27Å; D125-V127 HydrophobicContact CB-CG2 4.09Å; D125-V127 PolarHBondContact O-N 2.92Å; V127-S129 PolarHBondContact O-N 2.9Å
128	N	83.7	Confident	86.3	Confident	81 Å²	81	51 Å²	51	43%	0.433	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	22	-174.9	-162.7	16.5	0	0	0	115	E122 K130	E122-N128 HydrophobicContact CG-CB 4.1Å; E122-N128 PolarHBondContact OE1-ND2 3.38Å; E122-N128 WeakPolarHBondContact OE2-CB 3.36Å; E122-N128 PolarHBondContact OE2-ND2 2.89Å; N128-K130 PolarHBondContact O-N 3.41Å; N128-K130 PolarHBondContact O-NZ 2.74Å; N128-K130 PolarHBondContact OD1-NZ 3.24Å; N128-K130 VanDerWaalsContact OD1-NZ 3.13Å
129	S	85.4	Confident	86.3	Confident	54 Å²	54	49.8 Å²	49.8	38%	0.378	27%	0.273	S	S	.	.			trans	-59.9	135.3	173.8	51	0	0	0	0	112.5	D119 G126 V127	D119-S129 WeakPolarHBondContact OD1-CA 3.26Å; G126-S129 VanDerWaalsContact O-CB 3.27Å; G126-S129 WeakPolarHBondContact O-CB 3.47Å; G126-S129 PolarHBondContact O-N 3.32Å; G126-S129 PolarHBondContact O-OG 3.33Å; V127-S129 PolarHBondContact O-N 2.9Å
130	K	89.4	Confident	86.4	Confident	36 Å²	36	54.4 Å²	54.4	16%	0.157	29%	0.29	C	S	.	.			trans	-109.2	178.5	177.7	-38.3	-149.3	-153	-38.7	0	110.7	N24 H26 K27 D119 N128	N24-K130 VanDerWaalsContact CG-NZ 3.3Å; N24-K130 WeakPolarHBondContact O-CE 3.22Å; N24-K130 PolarHBondContact O-NZ 2.67Å; N24-K130 WeakPolarHBondContact OD1-CE 3.38Å; N24-K130 WeakPolarHBondContact OD1-CG 3.32Å; N24-K130 PolarHBondContact OD1-NZ 3.2Å; H26-K130 WeakPolarHBondContact O-CD 3.23Å; H26-K130 VanDerWaalsContact O-CE 3.27Å; H26-K130 WeakPolarHBondContact O-CE 3.29Å; K27-K130 HydrophobicContact CB-CB 4.49Å; K27-K130 HydrophobicContact CG-CB 3.94Å; K27-K130 HydrophobicContact CG-CD 4.1Å; D119-K130 VanDerWaalsContact CG-N 3.32Å; D119-K130 PolarHBondContact N-O 2.81Å; D119-K130 PolarHBondContact OD1-N 3.09Å; D119-K130 VanDerWaalsContact OD1-N 3.13Å; D119-K130 WeakPolarHBondContact OD2-CA 3.3Å; D119-K130 VanDerWaalsContact OD2-CB 3.24Å; D119-K130 WeakPolarHBondContact OD2-CB 3.2Å; D119-K130 PolarHBondContact OD2-N 2.82Å; N128-K130 PolarHBondContact O-N 3.41Å; N128-K130 PolarHBondContact O-NZ 2.74Å; N128-K130 PolarHBondContact OD1-NZ 3.24Å; N128-K130 VanDerWaalsContact OD1-NZ 3.13Å
131	K	92	Very high	86.6	Confident	91 Å²	91	54.2 Å²	54.2	40%	0.396	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-139.9	142.9	-167	-48.8	-176	-178.8	-155.1	0	110	Q116 A117 Y118	Q116-K131 HydrophobicContact CG-CB 4.24Å; A117-K131 WeakPolarHBondContact O-CA 3.47Å; Y118-K131 HydrophobicContact CD1-CD 4.4Å; Y118-K131 HydrophobicContact CD1-CG 4.03Å; Y118-K131 HydrophobicContact CE1-CD 3.66Å; Y118-K131 HydrophobicContact CE1-CG 3.8Å; Y118-K131 HydrophobicContact CE2-CD 4.5Å; Y118-K131 WeakPolarHBondContact OH-CD 3.41Å; Y118-K131 PolarHBondContact OH-NZ 3.02Å
132	S	93.2	Very high	87	Confident	6 Å²	6	56.6 Å²	56.6	4%	0.042	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-66.2	173.6	170.3	71.6	0	0	0	0	112.1	P28 I30 Q116 A117	P28-S132 WeakPolarHBondContact O-CA 3.43Å; P28-S132 WeakPolarHBondContact O-CB 3.47Å; I30-S132 WeakPolarHBondContact CD1-OG 3.33Å; Q116-S132 WeakPolarHBondContact CA-OG 3.34Å; Q116-S132 WeakPolarHBondContact CG-OG 3.35Å; Q116-S132 PolarHBondContact NE2-O 3.02Å; A117-S132 PolarHBondContact N-OG 3.41Å; A117-S132 PolarHBondContact O-N 3.29Å
133	H	91.8	Very high	87.6	Confident	71 Å²	71	53.1 Å²	53.1	33%	0.329	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-64.6	166.9	156.7	66.4	-89.1	0	0	0	110.1	W29 I30 T32	W29-H133 AromaticContact CD1-CE1 3.94Å; W29-H133 AromaticContact NE1-CE1 3.86Å; I30-H133 PolarHBondContact O-CE1 3.26Å; I30-H133 PolarHBondContact O-NE2 2.84Å; T32-H133 WeakPolarHBondContact CG2-NE2 3.46Å
134	K	91.3	Very high	88.3	Confident	99 Å²	99	54.1 Å²	54.1	43%	0.43	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-83.5	128.8	172.8	-78.2	-171.5	164.3	-153	0	109.7	H72 T114 I115	H72-K134 WeakPolarHBondContact ND1-CE 3.49Å; H72-K134 PolarHBondContact ND1-NZ 3.17Å; T114-K134 PolarHBondContact OG1-NZ 2.88Å; I115-K134 WeakPolarHBondContact O-CA 3.06Å
135	A	91.9	Very high	89.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	147.3	168.2	0	0	0	0	0	110.2	I30 E31 T32 Y34 T114 I115	I30-A135 HydrophobicContact CD1-CB 3.59Å; I30-A135 HydrophobicContact CG1-CB 4.17Å; E31-A135 WeakPolarHBondContact O-CB 3.04Å; T32-A135 VanDerWaalsContact O-CA 3.26Å; T32-A135 WeakPolarHBondContact O-CA 3.46Å; Y34-A135 HydrophobicContact CD2-CB 4Å; Y34-A135 HydrophobicContact CE2-CB 3.83Å; T114-A135 CarbonylContact C-O 3.53Å; T114-A135 WeakPolarHBondContact CA-O 3.13Å; T114-A135 WeakPolarHBondContact CB-O 3.25Å; I115-A135 HydrophobicContact CG1-CB 3.92Å; I115-A135 PolarHBondContact N-O 3.04Å; I115-A135 PolarHBondContact O-N 3.11Å
136	T	91.6	Very high	89.8	Confident	45 Å²	45	49.9 Å²	49.9	28%	0.276	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	140.3	169.9	-54.4	0	0	0	0	109.7	T32 E33 Y34 H138	T32-T136 PolarHBondContact O-N 2.9Å; E33-T136 CarbonylContact C-O 3.59Å; E33-T136 VanDerWaalsContact CA-O 3.3Å; E33-T136 WeakPolarHBondContact CA-O 3.28Å; Y34-T136 PolarHBondContact N-O 3.49Å; T136-H138 WeakPolarHBondContact CG2-NE2 3.47Å
137	V	92.1	Very high	90.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.2	170.1	-169.9	0	0	0	0	108.1	Y34 L47 S112 F113 I115 V139	Y34-V137 HydrophobicContact CD2-CG2 4.39Å; Y34-V137 WeakPolarHBondContact O-CA 3.46Å; L47-V137 HydrophobicContact CD2-CG1 3.78Å; S112-V137 WeakPolarHBondContact CA-O 3.36Å; S112-V137 PolarHBondContact OG-O 3.46Å; F113-V137 HydrophobicContact CD2-CB 3.93Å; F113-V137 HydrophobicContact CD2-CG2 4.08Å; F113-V137 HydrophobicContact CE2-CB 3.56Å; F113-V137 HydrophobicContact CE2-CG1 3.95Å; F113-V137 HydrophobicContact CE2-CG2 3.67Å; F113-V137 HydrophobicContact CZ-CB 3.87Å; F113-V137 HydrophobicContact CZ-CG1 3.81Å; F113-V137 HydrophobicContact CZ-CG2 4.4Å; F113-V137 PolarHBondContact N-O 2.78Å; F113-V137 PolarHBondContact O-N 3.03Å; I115-V137 HydrophobicContact CB-CG2 4.39Å; I115-V137 HydrophobicContact CD1-CG2 3.8Å; I115-V137 HydrophobicContact CG1-CG2 3.82Å; I115-V137 HydrophobicContact CG2-CG2 3.77Å; V137-V139 HydrophobicContact CG1-CG2 3.74Å
138	H	92.4	Very high	91.5	Very high	87 Å²	87	49.6 Å²	49.6	40%	0.403	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	111.2	171.1	-74.1	-77.4	0	0	0	108.2	E33 Y34 G36 S112 T136	E33-H138 IonicContact OE1-CD2 3.82Å; Y34-H138 PolarHBondContact O-N 3.2Å; G36-H138 PolarHBondContact N-O 3.43Å; S112-H138 PolarHBondContact OG-CE1 2.87Å; T136-H138 WeakPolarHBondContact CG2-NE2 3.47Å
139	V	92	Very high	92.1	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.018	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	124.3	-179.8	-176.4	0	0	0	0	109	G36 V38 V45 F83 H111 F113 V137	G36-V139 WeakPolarHBondContact O-CA 3.46Å; V38-V139 HydrophobicContact CG1-CG1 3.6Å; V45-V139 HydrophobicContact CG1-CG1 3.91Å; V45-V139 HydrophobicContact CG1-CG2 3.88Å; V45-V139 HydrophobicContact CG2-CG1 4.14Å; F83-V139 HydrophobicContact CE1-CG1 4.31Å; F83-V139 HydrophobicContact CZ-CG1 4.35Å; H111-V139 HydrophobicContact CB-CB 4.47Å; H111-V139 PolarHBondContact N-O 3.05Å; H111-V139 PolarHBondContact O-N 3.34Å; F113-V139 HydrophobicContact CE1-CG2 3.62Å; F113-V139 HydrophobicContact CZ-CG2 3.8Å; V137-V139 HydrophobicContact CG1-CG2 3.74Å
140	R	92.5	Very high	92.7	Very high	100 Å²	100	46.8 Å²	46.8	38%	0.377	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.7	173.1	-176.9	174.1	177	107.7	-10.2	109.2	G36 I37 V38 E110	G36-R140 PolarHBondContact O-N 2.83Å; I37-R140 WeakPolarHBondContact CA-O 3.43Å; V38-R140 PolarHBondContact N-O 3.18Å; E110-R140 HydrophobicContact CG-CG 4.38Å; E110-R140 IonicContact OE1-CZ 3.65Å; E110-R140 IonicContact OE1-NH1 2.75Å; E110-R140 PolarHBondContact OE1-NH1 2.89Å
141	V	92.9	Very high	93.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	129.3	169	-169.8	0	0	0	0	107.8	V38 E40 L103 C105 R109	V38-V141 HydrophobicContact CG1-CG2 4.46Å; V38-V141 CarbonylContact O-C 3.58Å; V38-V141 WeakPolarHBondContact O-CA 3.33Å; E40-V141 HydrophobicContact CB-CG1 3.65Å; L103-V141 HydrophobicContact CB-CG1 4.38Å; L103-V141 HydrophobicContact CB-CG2 4.36Å; L103-V141 HydrophobicContact CD1-CG2 4.31Å; C105-V141 HydrophobicContact CB-CB 4.36Å; C105-V141 HydrophobicContact CB-CG1 3.88Å; R109-V141 PolarHBondContact O-N 3.43Å
142	N	92.3	Very high	93.4	Very high	49 Å²	49	45.3 Å²	45.3	26%	0.262	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.8	171.4	-78.4	-13.7	0	0	0	108.9	V38 M39 E40	V38-N142 PolarHBondContact O-N 2.86Å; M39-N142 WeakPolarHBondContact CA-O 3.12Å; M39-N142 HydrophobicContact CE-CB 3.81Å; M39-N142 HydrophobicContact SD-CB 3.48Å; M39-N142 WeakPolarHBondContact SD-CB 3.29Å; E40-N142 PolarHBondContact N-O 3.13Å
143	D	92.8	Very high	93.5	Very high	10 Å²	10	50.5 Å²	50.5	5%	0.053	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-57.2	143.2	177.9	-168.4	-10.6	0	0	0	113.4	M39 E40 S180 Y183	M39-D143 VanDerWaalsContact CE-O 3.23Å; M39-D143 WeakPolarHBondContact CE-O 2.99Å; E40-D143 VanDerWaalsContact OE1-CA 3.28Å; E40-D143 WeakPolarHBondContact OE1-CA 3.47Å; D143-S180 VanDerWaalsContact OD2-CA 3.28Å; D143-S180 WeakPolarHBondContact OD2-CA 3.27Å; D143-S180 WeakPolarHBondContact OD2-CB 3.5Å; D143-S180 PolarHBondContact OD2-N 3.34Å; D143-S180 PolarHBondContact OD2-OG 2.87Å; D143-Y183 HydrophobicContact CB-CD2 4.2Å; D143-Y183 HydrophobicContact CB-CE2 4.25Å; D143-Y183 VanDerWaalsContact CG-CD2 3.43Å; D143-Y183 WeakPolarHBondContact OD1-CD2 3.37Å; D143-Y183 WeakPolarHBondContact OD2-CD2 2.99Å
144	V	91.8	Very high	93.7	Very high	34 Å²	34	57.2 Å²	57.2	21%	0.206	27%	0.274	C	S	.	.			trans	-129.3	116.6	170.9	-179.4	0	0	0	0	107.5	M39 E40 E146	M39-V144 HydrophobicContact CB-CG2 4.27Å; M39-V144 HydrophobicContact CE-CG2 3.61Å; E40-V144 HydrophobicContact CG-CG2 4.39Å; E40-V144 PolarHBondContact OE1-N 3.5Å; V144-E146 PolarHBondContact O-N 3.24Å
145	N	92.2	Very high	94	Very high	30 Å²	30	58.6 Å²	58.6	16%	0.16	28%	0.276	C	S	.	.			trans	-56.6	88.5	179.6	-163.7	-25.7	0	0	0	113.2	F147 Y183 D228 N232	N145-F147 PolarHBondContact OD1-O 3.26Å; N145-Y183 HydrophobicContact CB-CD1 3.79Å; N145-Y183 HydrophobicContact CB-CD2 3.62Å; N145-Y183 HydrophobicContact CB-CE1 4.09Å; N145-Y183 HydrophobicContact CB-CE2 3.97Å; N145-Y183 HydrophobicContact CB-CG 3.55Å; N145-Y183 VanDerWaalsContact ND2-CD1 3.31Å; N145-Y183 WeakPolarHBondContact ND2-CD1 3.34Å; N145-D228 PolarHBondContact ND2-OD2 2.75Å; N145-N232 PolarHBondContact O-ND2 3.11Å; N145-N232 PolarHBondContact OD1-ND2 3.11Å
146	E	90.7	Very high	94.2	Very high	128 Å²	128	59.9 Å²	59.9	60%	0.598	28%	0.281	S	S	*	.			trans	-115.7	-16.7	-179.1	69.7	166.2	-126.4	0	0	112.8	V144 D178	V144-E146 PolarHBondContact O-N 3.24Å; E146-D178 PolarHBondContact N-OD1 3.28Å
147	F	93.5	Very high	94.5	Very high	81 Å²	81	63.5 Å²	63.5	36%	0.355	30%	0.295	S	S	.	.			trans	-82.7	-174.4	163.7	-61.7	-79.6	0	0	0	110.7	E106 N145 D176 A177 D178 N232	E106-F147 HydrophobicContact CG-CE2 4.02Å; N145-F147 PolarHBondContact OD1-O 3.26Å; F147-D176 WeakPolarHBondContact CB-OD1 3.29Å; F147-A177 HydrophobicContact CB-CB 4.02Å; F147-A177 HydrophobicContact CD1-CB 3.85Å; F147-A177 HydrophobicContact CD2-CB 4.09Å; F147-A177 HydrophobicContact CE1-CB 4.38Å; F147-A177 HydrophobicContact CG-CB 3.69Å; F147-D178 WeakPolarHBondContact CB-OD1 3.46Å; F147-D178 WeakPolarHBondContact CD2-OD1 3.21Å; F147-D178 PolarHBondContact N-OD1 2.9Å; F147-N232 PolarHBondContact O-ND2 2.92Å
148	S	95.7	Very high	94.8	Very high	37 Å²	37	64.5 Å²	64.5	26%	0.259	30%	0.303	S	S	.	.			trans	-168.7	145.2	-172.3	-74.2	0	0	0	0	109.2	V150 D176	S148-V150 PolarHBondContact O-N 3.29Å; S148-D176 WeakPolarHBondContact CA-OD2 3.3Å; S148-D176 PolarHBondContact N-OD1 2.96Å; S148-D176 PolarHBondContact N-OD2 3.43Å
149	P	97.5	Very high	94.9	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.303	C	S	.	.			trans	-60.6	132.6	-165.6	-29.7	36.1	0	0	0	114.2	A174 D176 I186 A226 D228 A234 Q235	P149-A174 HydrophobicContact CB-CB 4.13Å; P149-D176 WeakPolarHBondContact CA-OD2 3.05Å; P149-D176 WeakPolarHBondContact CD-OD2 3.4Å; P149-D176 VanDerWaalsContact CG-OD2 3.31Å; P149-D176 WeakPolarHBondContact CG-OD2 3.42Å; P149-I186 HydrophobicContact CB-CD1 3.63Å; P149-I186 HydrophobicContact CG-CD1 3.64Å; P149-A226 HydrophobicContact CB-CB 3.92Å; P149-D228 HydrophobicContact CG-CB 4.09Å; P149-A234 HydrophobicContact CB-CB 4.04Å; P149-A234 CarbonylContact O-C 3.45Å; P149-A234 WeakPolarHBondContact O-CA 3Å; P149-A234 WeakPolarHBondContact O-CB 3.41Å; P149-Q235 PolarHBondContact O-N 2.88Å
150	V	97.5	Very high	95	Very high	76 Å²	76	63.4 Å²	63.4	46%	0.461	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.4	174.9	-175.6	0	0	0	0	108.9	S148 A174 L175	S148-V150 PolarHBondContact O-N 3.29Å; V150-A174 WeakPolarHBondContact O-CA 3.36Å; V150-L175 PolarHBondContact N-O 2.81Å; V150-L175 PolarHBondContact O-N 2.92Å
151	F	98.1	Very high	94.9	Very high	16 Å²	16	61.3 Å²	61.3	7%	0.07	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	136.9	172.7	-76.5	-82.7	0	0	0	111.5	E153 Y156 V172 E173 A174 Y189 V224 A226 A234 A236 A238	F151-E153 VanDerWaalsContact C-N 3.26Å; F151-E153 WeakPolarHBondContact CB-O 3.32Å; F151-E153 PolarHBondContact O-N 2.89Å; F151-Y156 HydrophobicContact CD1-CE2 4.29Å; F151-V172 HydrophobicContact CD1-CB 4.34Å; F151-V172 HydrophobicContact CE1-CB 3.98Å; F151-V172 HydrophobicContact CE1-CG2 3.89Å; F151-E173 WeakPolarHBondContact CA-O 3.23Å; F151-A174 HydrophobicContact CD1-CB 3.96Å; F151-A174 HydrophobicContact CE1-CB 4.19Å; F151-A174 HydrophobicContact CG-CB 4.21Å; F151-Y189 AromaticContact CE1-CD1 3.94Å; F151-Y189 HydrophobicContact CE1-CD1 3.94Å; F151-Y189 AromaticContact CE1-CE1 3.77Å; F151-Y189 HydrophobicContact CE1-CE1 3.77Å; F151-Y189 HydrophobicContact CZ-CD1 4.12Å; F151-Y189 HydrophobicContact CZ-CE1 4.29Å; F151-V224 VanDerWaalsContact CE2-O 3.31Å; F151-V224 WeakPolarHBondContact CE2-O 3.48Å; F151-V224 HydrophobicContact CZ-CB 4.49Å; F151-V224 HydrophobicContact CZ-CG1 4.13Å; F151-V224 WeakPolarHBondContact CZ-O 3.24Å; F151-A226 HydrophobicContact CE1-CB 4.34Å; F151-A226 HydrophobicContact CE2-CB 4.16Å; F151-A226 HydrophobicContact CZ-CB 3.81Å; F151-A234 HydrophobicContact CD2-CB 4.38Å; F151-A234 HydrophobicContact CE2-CB 3.98Å; F151-A236 WeakPolarHBondContact CD2-O 3.46Å; F151-A238 HydrophobicContact CB-CB 4.14Å; F151-A238 HydrophobicContact CD1-CB 3.8Å; F151-A238 HydrophobicContact CD2-CB 3.76Å; F151-A238 HydrophobicContact CE1-CB 4.07Å; F151-A238 HydrophobicContact CE2-CB 4.02Å; F151-A238 HydrophobicContact CG-CB 3.64Å; F151-A238 HydrophobicContact CZ-CB 4.16Å
152	V	97.3	Very high	94.8	Very high	80 Å²	80	62 Å²	62	49%	0.485	31%	0.308	S	S	.	.	S	Bend	trans	-60.8	-37.8	177.4	177.6	0	0	0	0	111	E173 L175	V152-E173 HydrophobicContact CG2-CB 4.17Å; V152-E173 HydrophobicContact CG2-CG 4.02Å; V152-E173 PolarHBondContact N-O 3.46Å; V152-L175 HydrophobicContact CG2-CD1 3.96Å; V152-L175 HydrophobicContact CG2-CG 3.99Å
153	E	96.6	Very high	94.5	Very high	114 Å²	114	62 Å²	62	53%	0.533	32%	0.32	S	S	.	.			trans	-123.6	140.6	173.3	-73.9	-68.8	-179.3	0	0	111.3	F151 R155 Y156	F151-E153 VanDerWaalsContact C-N 3.26Å; F151-E153 WeakPolarHBondContact CB-O 3.32Å; F151-E153 PolarHBondContact O-N 2.89Å; E153-R155 VanDerWaalsContact C-N 3.29Å; E153-Y156 HydrophobicContact CB-CD1 4.46Å; E153-Y156 HydrophobicContact CB-CD2 4.44Å; E153-Y156 HydrophobicContact CB-CE1 3.99Å; E153-Y156 HydrophobicContact CB-CE2 3.97Å; E153-Y156 PolarHBondContact N-OH 2.91Å; E153-Y156 WeakPolarHBondContact O-CE2 3.45Å
154	R	94.5	Very high	94.3	Very high	213 Å²	213	70 Å²	70	80%	0.804	35%	0.349	S	S	*	.	S	Bend	trans	-77.7	-17	175.8	-66.5	-175.2	177.8	-168	-2.5	113	Q239	R154-Q239 PolarHBondContact O-N 3.3Å
155	R	97.5	Very high	94.3	Very high	128 Å²	128	73.4 Å²	73.4	48%	0.483	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	121.1	-178.2	179.7	171.1	167	142.3	-16.7	111	E153 E157 Q239	E153-R155 VanDerWaalsContact C-N 3.29Å; R155-E157 HydrophobicContact CG-CG 4.3Å; R155-E157 IonicContact CZ-OE1 3.75Å; R155-E157 IonicContact NE-OE1 3.81Å; R155-E157 PolarHBondContact NE-OE1 2.8Å; R155-E157 IonicContact NH2-OE1 3.67Å; R155-E157 PolarHBondContact NH2-OE1 2.7Å; R155-Q239 CarbonylContact C-O 3.6Å; R155-Q239 VanDerWaalsContact CA-O 3.26Å; R155-Q239 WeakPolarHBondContact CA-O 3.32Å; R155-Q239 HydrophobicContact CB-CB 4.47Å; R155-Q239 HydrophobicContact CG-CB 4.44Å
156	Y	97.9	Very high	94.4	Very high	26 Å²	26	74.6 Å²	74.6	10%	0.102	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	135.4	174.4	-63.6	-95	0	0	0	109.8	F151 E153 V170 V172 E173 A238 Q239 V240 V241	F151-Y156 HydrophobicContact CD1-CE2 4.29Å; E153-Y156 HydrophobicContact CB-CD1 4.46Å; E153-Y156 HydrophobicContact CB-CD2 4.44Å; E153-Y156 HydrophobicContact CB-CE1 3.99Å; E153-Y156 HydrophobicContact CB-CE2 3.97Å; E153-Y156 PolarHBondContact N-OH 2.91Å; E153-Y156 WeakPolarHBondContact O-CE2 3.45Å; Y156-V170 HydrophobicContact CD1-CG2 4.39Å; Y156-V172 HydrophobicContact CD1-CG1 4.33Å; Y156-V172 HydrophobicContact CD2-CB 4.27Å; Y156-V172 HydrophobicContact CD2-CG1 3.66Å; Y156-V172 HydrophobicContact CE1-CB 4.41Å; Y156-V172 HydrophobicContact CE1-CG1 4.47Å; Y156-V172 HydrophobicContact CE2-CB 3.9Å; Y156-V172 HydrophobicContact CE2-CG1 3.81Å; Y156-V172 HydrophobicContact CG-CG1 3.94Å; Y156-E173 PolarHBondContact OH-N 3.27Å; Y156-E173 VanDerWaalsContact OH-N 3.11Å; Y156-E173 PolarHBondContact OH-O 3.24Å; Y156-E173 VanDerWaalsContact OH-O 3.11Å; Y156-A238 HydrophobicContact CD2-CB 4.07Å; Y156-A238 HydrophobicContact CE2-CB 3.86Å; Y156-Q239 PolarHBondContact N-O 3.31Å; Y156-V240 WeakPolarHBondContact O-CA 3.06Å; Y156-V241 PolarHBondContact O-N 2.95Å
157	E	97.6	Very high	94.5	Very high	122 Å²	122	75.3 Å²	75.3	57%	0.57	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124	142.2	179	-56.5	-159.3	156.8	0	0	111.9	R155 V241	R155-E157 HydrophobicContact CG-CG 4.3Å; R155-E157 IonicContact CZ-OE1 3.75Å; R155-E157 IonicContact NE-OE1 3.81Å; R155-E157 PolarHBondContact NE-OE1 2.8Å; R155-E157 IonicContact NH2-OE1 3.67Å; R155-E157 PolarHBondContact NH2-OE1 2.7Å; E157-V241 WeakPolarHBondContact CA-O 3.4Å; E157-V241 HydrophobicContact CG-CB 4.3Å
158	A	96.8	Very high	94.6	Very high	20 Å²	20	79.8 Å²	79.8	17%	0.165	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	160.5	175.9	0	0	0	0	0	111.9	I169 V170 V241 T243	A158-I169 HydrophobicContact CB-CG2 3.73Å; A158-V170 HydrophobicContact CB-CB 4.15Å; A158-V241 PolarHBondContact N-O 2.89Å; A158-T243 PolarHBondContact O-N 2.79Å
159	S	94.5	Very high	94.7	Very high	58 Å²	58	79.1 Å²	79.1	41%	0.406	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	131.8	170.7	78.8	0	0	0	0	111.6	T243 K245	S159-T243 VanDerWaalsContact CA-O 3.23Å; S159-T243 WeakPolarHBondContact CA-O 3.41Å; S159-K245 WeakPolarHBondContact OG-CE 3.34Å; S159-K245 PolarHBondContact OG-NZ 2.93Å
160	V	93.9	Very high	94.6	Very high	9 Å²	9	80.3 Å²	80.3	6%	0.055	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	146.8	179.1	-68.1	0	0	0	0	110.5	F166 I169 L212 V242 T243 V244 K245	V160-F166 HydrophobicContact CB-CD2 4.16Å; V160-F166 HydrophobicContact CB-CE2 3.9Å; V160-F166 HydrophobicContact CB-CZ 4.3Å; V160-F166 HydrophobicContact CG1-CD2 4.19Å; V160-F166 HydrophobicContact CG1-CE2 4.31Å; V160-F166 HydrophobicContact CG1-CG 4.36Å; V160-I169 HydrophobicContact CG1-CB 4.49Å; V160-I169 HydrophobicContact CG1-CG1 4.18Å; V160-I169 HydrophobicContact CG1-CG2 3.91Å; V160-L212 HydrophobicContact CG2-CD1 3.95Å; V160-V242 HydrophobicContact CG2-CG1 3.91Å; V160-T243 PolarHBondContact N-O 3.43Å; V160-V244 WeakPolarHBondContact O-CA 3.43Å; V160-K245 PolarHBondContact O-N 2.81Å
161	P	90.4	Very high	94.6	Very high	57 Å²	57	81.8 Å²	81.8	37%	0.37	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	147.8	170.2	31.9	-34.1	0	0	0	110.8	F166 K245	P161-F166 HydrophobicContact CG-CZ 3.81Å; P161-K245 CarbonylContact C-O 3.6Å; P161-K245 WeakPolarHBondContact CA-O 3.4Å
162	E	91.5	Very high	94.6	Very high	15 Å²	15	81 Å²	81	7%	0.07	39%	0.386	C	S	.	.	S	Bend	trans	-65.2	165.6	178.9	88	-167.7	168.4	0	0	113.1	R164 L212 S214 V244 K245 S247 K249	E162-R164 VanDerWaalsContact C-N 3.34Å; E162-R164 PolarHBondContact O-N 3.05Å; E162-L212 CarbonylContact C-O 3.53Å; E162-L212 WeakPolarHBondContact CA-O 2.98Å; E162-L212 VanDerWaalsContact CB-O 3.31Å; E162-L212 WeakPolarHBondContact CB-O 3.31Å; E162-S214 VanDerWaalsContact OE2-CB 3.23Å; E162-S214 WeakPolarHBondContact OE2-CB 3.48Å; E162-S214 PolarHBondContact OE2-N 3.41Å; E162-S214 PolarHBondContact OE2-OG 3.37Å; E162-V244 HydrophobicContact CB-CG1 3.64Å; E162-K245 PolarHBondContact N-O 2.97Å; E162-S247 WeakPolarHBondContact CG-OG 3.42Å; E162-S247 PolarHBondContact OE1-N 2.83Å; E162-S247 PolarHBondContact OE1-OG 2.71Å; E162-K249 IonicContact OE1-NZ 3.21Å; E162-K249 PolarHBondContact OE1-NZ 3.11Å
163	G	87.1	Confident	94.6	Very high	49 Å²	49	81.5 Å²	81.5	51%	0.505	38%	0.383	S	S	.	.	S	Bend	trans	74.9	13.4	167.1	0	0	0	0	0	116.2	L212	G163-L212 PolarHBondContact N-O 3.21Å
164	R	87.8	Confident	94.6	Very high	176 Å²	176	76.3 Å²	76.3	66%	0.664	36%	0.36	S	S	*	.			trans	-134.7	158.9	175.8	-61.8	-174	-176.6	-179.5	2.5	111.9	E162 F166 N208	E162-R164 VanDerWaalsContact C-N 3.34Å; E162-R164 PolarHBondContact O-N 3.05Å; R164-F166 HydrophobicContact CB-CE2 3.88Å; R164-F166 HydrophobicContact CB-CZ 4.08Å; R164-N208 PolarHBondContact O-ND2 2.89Å
165	L	92.8	Very high	94.7	Very high	106 Å²	106	71.2 Å²	71.2	56%	0.555	35%	0.348	S	S	*	.			trans	-93.9	144.7	168.2	-63.1	177.4	0	0	0	109.6	P211	L165-P211 HydrophobicContact CD2-CG 4.26Å; L165-P211 HydrophobicContact CG-CG 4.47Å
166	F	94	Very high	94.6	Very high	56 Å²	56	66.3 Å²	66.3	25%	0.246	33%	0.331	C	S	.	.			trans	-131.8	115.5	-179.9	-67.5	-86.2	0	0	0	110.1	V160 P161 R164 R168 I169 K207 N208	V160-F166 HydrophobicContact CB-CD2 4.16Å; V160-F166 HydrophobicContact CB-CE2 3.9Å; V160-F166 HydrophobicContact CB-CZ 4.3Å; V160-F166 HydrophobicContact CG1-CD2 4.19Å; V160-F166 HydrophobicContact CG1-CE2 4.31Å; V160-F166 HydrophobicContact CG1-CG 4.36Å; P161-F166 HydrophobicContact CG-CZ 3.81Å; R164-F166 HydrophobicContact CB-CE2 3.88Å; R164-F166 HydrophobicContact CB-CZ 4.08Å; F166-R168 PolarHBondContact O-N 2.02Å; F166-I169 HydrophobicContact CB-CD1 4.37Å; F166-I169 HydrophobicContact CB-CG1 3.68Å; F166-I169 HydrophobicContact CG-CG1 4.44Å; F166-K207 VanDerWaalsContact O-CA 3.31Å; F166-K207 WeakPolarHBondContact O-CA 3.21Å; F166-K207 WeakPolarHBondContact O-CB 3.41Å; F166-N208 PolarHBondContact N-OD1 2.69Å
167	D	92.7	Very high	94.5	Very high	143 Å²	143	67.7 Å²	67.7	77%	0.765	35%	0.348	S	S	*	.	S	Bend	trans	-65.5	-19.7	177.7	-60.6	-61.7	0	0	0	113.5
168	R	94.9	Very high	94.3	Very high	174 Å²	174	62.1 Å²	62.1	66%	0.657	32%	0.322	S	S	*	.			trans	-150.2	111.6	172.1	-172.1	177.9	73.8	154.5	5.8	111.5	F166 N205	F166-R168 PolarHBondContact O-N 2.02Å; R168-N205 WeakPolarHBondContact CD-OD1 3.35Å; R168-N205 HydrophobicContact CG-CB 4.09Å
169	I	96.9	Very high	94	Very high	24 Å²	24	62.6 Å²	62.6	12%	0.123	32%	0.324	C	S	.	.	S	Bend	trans	-91.9	-49.9	175.6	-62.5	178.6	0	0	0	110.2	A158 V160 F166 F198 I206 N208 V242	A158-I169 HydrophobicContact CB-CG2 3.73Å; V160-I169 HydrophobicContact CG1-CB 4.49Å; V160-I169 HydrophobicContact CG1-CG1 4.18Å; V160-I169 HydrophobicContact CG1-CG2 3.91Å; F166-I169 HydrophobicContact CB-CD1 4.37Å; F166-I169 HydrophobicContact CB-CG1 3.68Å; F166-I169 HydrophobicContact CG-CG1 4.44Å; I169-F198 HydrophobicContact CD1-CD1 3.98Å; I169-F198 HydrophobicContact CD1-CE1 3.7Å; I169-I206 WeakPolarHBondContact CB-O 3.09Å; I169-I206 PolarHBondContact N-O 2.82Å; I169-N208 HydrophobicContact CD1-CB 3.98Å; I169-V242 HydrophobicContact CG2-CG1 4.15Å; I169-V242 HydrophobicContact CG2-CG2 4.17Å
170	V	97.3	Very high	93.7	Very high	24 Å²	24	60.4 Å²	60.4	15%	0.145	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	159.2	177.2	67	0	0	0	0	108.5	Y156 A158 I206 V240	Y156-V170 HydrophobicContact CD1-CG2 4.39Å; A158-V170 HydrophobicContact CB-CB 4.15Å; V170-I206 HydrophobicContact CG1-CB 4.06Å; V170-I206 HydrophobicContact CG1-CD1 3.95Å; V170-I206 HydrophobicContact CG1-CG1 4.43Å; V170-I206 PolarHBondContact O-N 2.56Å; V170-V240 HydrophobicContact CG1-CG1 4.06Å
171	R	97.3	Very high	93.4	Very high	107 Å²	107	64.1 Å²	64.1	40%	0.404	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	128.2	171.5	-170.1	-175.8	-170.7	-143.6	1.9	108.6	D203 G204	R171-D203 VanDerWaalsContact CZ-O 3.23Å; R171-D203 PolarHBondContact NE-O 3.38Å; R171-D203 PolarHBondContact NH2-O 2.91Å; R171-G204 CarbonylContact C-O 3.56Å; R171-G204 WeakPolarHBondContact CA-O 3.19Å
172	V	97.6	Very high	93.2	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.342	C	S	.	.			trans	-92	156.1	167.5	-56	0	0	0	0	109.6	F151 Y156 Y189 I200 G204 I206 V224 V240	F151-V172 HydrophobicContact CD1-CB 4.34Å; F151-V172 HydrophobicContact CE1-CB 3.98Å; F151-V172 HydrophobicContact CE1-CG2 3.89Å; Y156-V172 HydrophobicContact CD1-CG1 4.33Å; Y156-V172 HydrophobicContact CD2-CB 4.27Å; Y156-V172 HydrophobicContact CD2-CG1 3.66Å; Y156-V172 HydrophobicContact CE1-CB 4.41Å; Y156-V172 HydrophobicContact CE1-CG1 4.47Å; Y156-V172 HydrophobicContact CE2-CB 3.9Å; Y156-V172 HydrophobicContact CE2-CG1 3.81Å; Y156-V172 HydrophobicContact CG-CG1 3.94Å; V172-Y189 HydrophobicContact CG2-CD1 3.8Å; V172-Y189 HydrophobicContact CG2-CE1 3.93Å; V172-Y189 HydrophobicContact CG2-CG 4.4Å; V172-I200 HydrophobicContact CG2-CD1 3.63Å; V172-G204 PolarHBondContact N-O 2.86Å; V172-I206 HydrophobicContact CG1-CD1 3.91Å; V172-V224 HydrophobicContact CG2-CG1 4.18Å; V172-V240 HydrophobicContact CG1-CG2 4.07Å
173	E	97.1	Very high	93.2	Very high	90 Å²	90	68.9 Å²	68.9	42%	0.421	35%	0.348	S	S	.	.			trans	-145.5	125.9	-176.9	-172.2	161.1	-151	0	0	109.4	F151 V152 Y156	F151-E173 WeakPolarHBondContact CA-O 3.23Å; V152-E173 HydrophobicContact CG2-CB 4.17Å; V152-E173 HydrophobicContact CG2-CG 4.02Å; V152-E173 PolarHBondContact N-O 3.46Å; Y156-E173 PolarHBondContact OH-N 3.27Å; Y156-E173 VanDerWaalsContact OH-N 3.11Å; Y156-E173 PolarHBondContact OH-O 3.24Å; Y156-E173 VanDerWaalsContact OH-O 3.11Å
174	A	96.9	Very high	93.5	Very high	5 Å²	5	68.7 Å²	68.7	4%	0.041	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	150.3	172.1	0	0	0	0	0	110.3	P149 V150 F151 I186 Y189 A226	P149-A174 HydrophobicContact CB-CB 4.13Å; V150-A174 WeakPolarHBondContact O-CA 3.36Å; F151-A174 HydrophobicContact CD1-CB 3.96Å; F151-A174 HydrophobicContact CE1-CB 4.19Å; F151-A174 HydrophobicContact CG-CB 4.21Å; A174-I186 HydrophobicContact CB-CD1 4.22Å; A174-I186 HydrophobicContact CB-CG1 4.26Å; A174-I186 VanDerWaalsContact O-CG1 3.29Å; A174-I186 WeakPolarHBondContact O-CG1 3.28Å; A174-Y189 HydrophobicContact CB-CE1 4.03Å; A174-Y189 PolarHBondContact N-OH 2.93Å; A174-A226 HydrophobicContact CB-CB 3.61Å
175	L	96.1	Very high	93.8	Very high	106 Å²	106	65.4 Å²	65.4	56%	0.555	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	143.5	178.1	-57.9	175.1	0	0	0	108.1	V150 V152	V150-L175 PolarHBondContact N-O 2.81Å; V150-L175 PolarHBondContact O-N 2.92Å; V152-L175 HydrophobicContact CG2-CD1 3.96Å; V152-L175 HydrophobicContact CG2-CG 3.99Å
176	D	96.4	Very high	94	Very high	26 Å²	26	61.6 Å²	61.6	14%	0.139	31%	0.311	C	S	.	.			trans	-115.1	161.6	167.1	-137.7	-35.6	0	0	0	110.7	F147 S148 P149 I186	F147-D176 WeakPolarHBondContact CB-OD1 3.29Å; S148-D176 WeakPolarHBondContact CA-OD2 3.3Å; S148-D176 PolarHBondContact N-OD1 2.96Å; S148-D176 PolarHBondContact N-OD2 3.43Å; P149-D176 WeakPolarHBondContact CA-OD2 3.05Å; P149-D176 WeakPolarHBondContact CD-OD2 3.4Å; P149-D176 VanDerWaalsContact CG-OD2 3.31Å; P149-D176 WeakPolarHBondContact CG-OD2 3.42Å; D176-I186 HydrophobicContact CB-CD1 4.44Å
177	A	94.7	Very high	94	Very high	55 Å²	55	61.4 Å²	61.4	46%	0.455	32%	0.316	S	S	.	.			trans	-109.2	-13.6	-168	0	0	0	0	0	114.8	E106 F147	E106-A177 VanDerWaalsContact CG-O 3.3Å; E106-A177 WeakPolarHBondContact CG-O 3.13Å; F147-A177 HydrophobicContact CB-CB 4.02Å; F147-A177 HydrophobicContact CD1-CB 3.85Å; F147-A177 HydrophobicContact CD2-CB 4.09Å; F147-A177 HydrophobicContact CE1-CB 4.38Å; F147-A177 HydrophobicContact CG-CB 3.69Å
178	D	94.3	Very high	94.1	Very high	5 Å²	5	58.1 Å²	58.1	3%	0.027	30%	0.295	C	S	.	.			trans	-57.6	152	179	-42.5	-75.5	0	0	0	112.4	E106 E146 F147 S180 Y183 S184	E106-D178 WeakPolarHBondContact OE1-CA 3.48Å; E146-D178 PolarHBondContact N-OD1 3.28Å; F147-D178 WeakPolarHBondContact CB-OD1 3.46Å; F147-D178 WeakPolarHBondContact CD2-OD1 3.21Å; F147-D178 PolarHBondContact N-OD1 2.9Å; D178-S180 PolarHBondContact O-N 2.74Å; D178-Y183 VanDerWaalsContact OD2-CB 3.29Å; D178-Y183 WeakPolarHBondContact OD2-CB 3.44Å; D178-S184 WeakPolarHBondContact O-CB 3.16Å
179	C	89.9	Confident	94.2	Very high	29 Å²	29	50.9 Å²	50.9	20%	0.196	27%	0.268	C	S	.	.	S	Bend	trans	-75.9	-18	-170.2	78.5	0	0	0	0	115.2	C105 E106	C105-C179 HydrophobicContact CB-CB 3.59Å; C105-C179 WeakPolarHBondContact CB-SG 3.09Å; C105-C179 WeakPolarHBondContact SG-CB 3.38Å; C105-C179 CovalentContact SG-SG 2.02Å; C105-C179 PolarHBondContact SG-SG 3.29Å; E106-C179 HydrophobicContact CG-CB 4.47Å; E106-C179 WeakPolarHBondContact OE1-CA 3.35Å; E106-C179 WeakPolarHBondContact OE1-CB 3.4Å; E106-C179 PolarHBondContact OE1-N 2.9Å
180	S	89.1	Confident	94.2	Very high	12 Å²	12	53.6 Å²	53.6	8%	0.084	28%	0.283	C	S	.	.	S	Bend	trans	-109.4	142.6	-173.3	88.3	0	0	0	0	112.9	D143 D178 Q182 Y183 S184	D143-S180 VanDerWaalsContact OD2-CA 3.28Å; D143-S180 WeakPolarHBondContact OD2-CA 3.27Å; D143-S180 WeakPolarHBondContact OD2-CB 3.5Å; D143-S180 PolarHBondContact OD2-N 3.34Å; D143-S180 PolarHBondContact OD2-OG 2.87Å; D178-S180 PolarHBondContact O-N 2.74Å; S180-Q182 PolarHBondContact O-N 2.99Å; S180-Q182 PolarHBondContact OG-N 3.31Å; S180-Y183 PolarHBondContact O-N 2.75Å; S180-S184 VanDerWaalsContact O-CB 3.22Å; S180-S184 WeakPolarHBondContact O-CB 2.91Å; S180-S184 PolarHBondContact O-N 2.9Å; S180-S184 PolarHBondContact O-OG 3.25Å
181	P	86.3	Confident	94.3	Very high	87 Å²	87	53.5 Å²	53.5	57%	0.565	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	0	174.3	-24.9	34.7	0	0	0	116.1
182	Q	86.5	Confident	94.2	Very high	121 Å²	121	51.5 Å²	51.5	57%	0.565	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-26.2	174.2	-172.5	175.7	-35.2	0	0	112.3	S180 C229 G230	S180-Q182 PolarHBondContact O-N 2.99Å; S180-Q182 PolarHBondContact OG-N 3.31Å; Q182-C229 CarbonylContact O-C 3.4Å; Q182-C229 VanDerWaalsContact O-CB 3.24Å; Q182-C229 WeakPolarHBondContact O-CB 3.37Å; Q182-G230 PolarHBondContact O-N 3.22Å
183	Y	92.3	Very high	94.2	Very high	51 Å²	51	53.1 Å²	53.1	20%	0.2	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-35.7	179.1	-49.7	-42.1	0	0	0	111.3	D143 N145 D178 S180 Q185 D228	D143-Y183 HydrophobicContact CB-CD2 4.2Å; D143-Y183 HydrophobicContact CB-CE2 4.25Å; D143-Y183 VanDerWaalsContact CG-CD2 3.43Å; D143-Y183 WeakPolarHBondContact OD1-CD2 3.37Å; D143-Y183 WeakPolarHBondContact OD2-CD2 2.99Å; N145-Y183 HydrophobicContact CB-CD1 3.79Å; N145-Y183 HydrophobicContact CB-CD2 3.62Å; N145-Y183 HydrophobicContact CB-CE1 4.09Å; N145-Y183 HydrophobicContact CB-CE2 3.97Å; N145-Y183 HydrophobicContact CB-CG 3.55Å; N145-Y183 VanDerWaalsContact ND2-CD1 3.31Å; N145-Y183 WeakPolarHBondContact ND2-CD1 3.34Å; D178-Y183 VanDerWaalsContact OD2-CB 3.29Å; D178-Y183 WeakPolarHBondContact OD2-CB 3.44Å; S180-Y183 PolarHBondContact O-N 2.75Å; Y183-Q185 PolarHBondContact O-N 3.37Å; Y183-D228 WeakPolarHBondContact CA-OD2 3.22Å; Y183-D228 WeakPolarHBondContact O-CB 3.29Å
184	S	93.2	Very high	94	Very high	46 Å²	46	53.6 Å²	53.6	32%	0.322	30%	0.299	S	S	.	.	S	Bend	trans	-61	-5.3	174.1	99	0	0	0	0	115.8	D178 S180	D178-S184 WeakPolarHBondContact O-CB 3.16Å; S180-S184 VanDerWaalsContact O-CB 3.22Å; S180-S184 WeakPolarHBondContact O-CB 2.91Å; S180-S184 PolarHBondContact O-N 2.9Å; S180-S184 PolarHBondContact O-OG 3.25Å
185	Q	94.6	Very high	93.7	Very high	107 Å²	107	61.5 Å²	61.5	50%	0.5	34%	0.34	S	S	.	.	S	Bend	trans	-112.4	126.2	-173.7	-179.5	173.4	-15	0	0	111.3	Y183 C187 D228 C229	Y183-Q185 PolarHBondContact O-N 3.37Å; Q185-C187 PolarHBondContact O-N 3.3Å; Q185-D228 CarbonylContact O-C 3.56Å; Q185-D228 WeakPolarHBondContact O-CA 3.42Å; Q185-C229 PolarHBondContact O-N 3.07Å; Q185-C229 PolarHBondContact O-SG 2.85Å
186	I	95.9	Very high	93.7	Very high	25 Å²	25	58.1 Å²	58.1	13%	0.128	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	122.3	169.5	-47.5	-51.1	0	0	0	109.6	P149 A174 D176 Y189 A226 F227	P149-I186 HydrophobicContact CB-CD1 3.63Å; P149-I186 HydrophobicContact CG-CD1 3.64Å; A174-I186 HydrophobicContact CB-CD1 4.22Å; A174-I186 HydrophobicContact CB-CG1 4.26Å; A174-I186 VanDerWaalsContact O-CG1 3.29Å; A174-I186 WeakPolarHBondContact O-CG1 3.28Å; D176-I186 HydrophobicContact CB-CD1 4.44Å; I186-Y189 HydrophobicContact CG2-CD2 4.27Å; I186-Y189 HydrophobicContact CG2-CE1 4.18Å; I186-Y189 HydrophobicContact CG2-CE2 3.75Å; I186-A226 HydrophobicContact CG2-CB 4.1Å; I186-F227 WeakPolarHBondContact CG2-O 3.45Å
187	C	93.8	Very high	93.6	Very high	52 Å²	52	57.7 Å²	57.7	35%	0.351	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-32.5	-179	-108.6	0	0	0	0	112.8	Q185 N202 F227 C229	Q185-C187 PolarHBondContact O-N 3.3Å; C187-N202 PolarHBondContact O-ND2 3.02Å; C187-F227 PolarHBondContact N-O 3.44Å; C187-C229 HydrophobicContact CB-CB 3.92Å; C187-C229 WeakPolarHBondContact CB-SG 3.13Å; C187-C229 WeakPolarHBondContact SG-CA 3.44Å; C187-C229 WeakPolarHBondContact SG-CB 3.35Å; C187-C229 CovalentContact SG-SG 2.04Å; C187-C229 PolarHBondContact SG-SG 3.41Å
188	F	94.8	Very high	93.8	Very high	74 Å²	74	55.8 Å²	55.8	33%	0.325	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	155.5	176.8	64.9	-75.5	0	0	0	113.1	F227	F188-F227 HydrophobicContact CD1-CB 3.76Å; F188-F227 HydrophobicContact CD1-CG 4.48Å; F188-F227 HydrophobicContact CD2-CB 4.28Å; F188-F227 AromaticContact CD2-CD2 3.68Å; F188-F227 HydrophobicContact CD2-CD2 3.68Å; F188-F227 HydrophobicContact CD2-CE2 4.33Å; F188-F227 HydrophobicContact CD2-CG 4.28Å; F188-F227 HydrophobicContact CE1-CB 3.35Å; F188-F227 HydrophobicContact CE1-CD2 4.2Å; F188-F227 AromaticContact CE1-CG 3.83Å; F188-F227 HydrophobicContact CE1-CG 3.83Å; F188-F227 HydrophobicContact CE2-CB 3.94Å; F188-F227 HydrophobicContact CE2-CD1 4.41Å; F188-F227 AromaticContact CE2-CD2 3.13Å; F188-F227 HydrophobicContact CE2-CD2 3.13Å; F188-F227 AromaticContact CE2-CE2 3.55Å; F188-F227 HydrophobicContact CE2-CE2 3.55Å; F188-F227 AromaticContact CE2-CG 3.61Å; F188-F227 HydrophobicContact CE2-CG 3.61Å; F188-F227 HydrophobicContact CE2-CZ 4.35Å; F188-F227 HydrophobicContact CG-CB 4.2Å; F188-F227 HydrophobicContact CG-CD2 4.41Å; F188-F227 HydrophobicContact CZ-CB 3.46Å; F188-F227 VanDerWaalsContact CZ-CB 3.46Å; F188-F227 AromaticContact CZ-CD1 3.9Å; F188-F227 HydrophobicContact CZ-CD1 3.9Å; F188-F227 AromaticContact CZ-CD2 3.43Å; F188-F227 HydrophobicContact CZ-CD2 3.43Å; F188-F227 VanDerWaalsContact CZ-CD2 3.43Å; F188-F227 HydrophobicContact CZ-CE1 4.43Å; F188-F227 HydrophobicContact CZ-CE2 4.01Å; F188-F227 AromaticContact CZ-CG 3.34Å; F188-F227 HydrophobicContact CZ-CG 3.34Å; F188-F227 HydrophobicContact CZ-CZ 4.48Å; F188-F227 PolarHBondContact N-O 2.67Å; F188-F227 PolarHBondContact O-N 2.73Å
189	Y	97.8	Very high	93.9	Very high	22 Å²	22	57 Å²	57	9%	0.086	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	153.6	169.1	-63.9	-92.8	0	0	0	109	F151 V172 A174 I186 I200 N202 T225 A226	F151-Y189 AromaticContact CE1-CD1 3.94Å; F151-Y189 HydrophobicContact CE1-CD1 3.94Å; F151-Y189 AromaticContact CE1-CE1 3.77Å; F151-Y189 HydrophobicContact CE1-CE1 3.77Å; F151-Y189 HydrophobicContact CZ-CD1 4.12Å; F151-Y189 HydrophobicContact CZ-CE1 4.29Å; V172-Y189 HydrophobicContact CG2-CD1 3.8Å; V172-Y189 HydrophobicContact CG2-CE1 3.93Å; V172-Y189 HydrophobicContact CG2-CG 4.4Å; A174-Y189 HydrophobicContact CB-CE1 4.03Å; A174-Y189 PolarHBondContact N-OH 2.93Å; I186-Y189 HydrophobicContact CG2-CD2 4.27Å; I186-Y189 HydrophobicContact CG2-CE1 4.18Å; I186-Y189 HydrophobicContact CG2-CE2 3.75Å; Y189-I200 HydrophobicContact CG-CD1 4.2Å; Y189-N202 WeakPolarHBondContact CD2-O 3.36Å; Y189-N202 WeakPolarHBondContact CE2-O 3.43Å; Y189-T225 WeakPolarHBondContact CA-O 3.2Å; Y189-A226 HydrophobicContact CD1-CB 3.65Å; Y189-A226 HydrophobicContact CE1-CB 3.64Å
190	D	97	Very high	94.3	Very high	81 Å²	81	56.9 Å²	56.9	43%	0.433	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	147.6	177.9	-171.9	25.7	0	0	0	112.5	V224 T225	D190-V224 WeakPolarHBondContact O-CA 3.31Å; D190-V224 WeakPolarHBondContact O-CG1 3.26Å; D190-T225 HydrophobicContact CB-CG2 3.97Å; D190-T225 PolarHBondContact N-O 2.7Å; D190-T225 PolarHBondContact O-N 2.89Å
191	I	98	Very high	94.6	Very high	22 Å²	22	58.5 Å²	58.5	11%	0.113	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	96.5	178.4	-60	175.7	0	0	0	108.6	T193 V196 F198 I200 F222 V224	I191-T193 PolarHBondContact O-N 3.49Å; I191-T193 VanDerWaalsContact O-N 3.1Å; I191-V196 HydrophobicContact CG2-CG2 3.7Å; I191-F198 HydrophobicContact CD1-CB 4Å; I191-I200 HydrophobicContact CD1-CB 4.11Å; I191-I200 HydrophobicContact CD1-CG2 4.35Å; I191-I200 HydrophobicContact CG1-CB 4.06Å; I191-I200 HydrophobicContact CG1-CG2 3.89Å; I191-F222 HydrophobicContact CD1-CE2 4.09Å; I191-F222 HydrophobicContact CG1-CE2 4.36Å; I191-F222 HydrophobicContact CG2-CD2 3.76Å; I191-F222 HydrophobicContact CG2-CE2 4.31Å; I191-F222 HydrophobicContact CG2-CG 4.46Å; I191-V224 HydrophobicContact CG1-CG2 4.28Å
192	I	96.8	Very high	95	Very high	65 Å²	65	59.4 Å²	59.4	33%	0.333	32%	0.32	S	S	.	.			trans	-71.8	-4.9	-175.2	67.6	174.1	0	0	0	114.2	P194 W223 T225 D237	I192-P194 WeakPolarHBondContact O-CD 3.4Å; I192-W223 HydrophobicContact CD1-CB 3.84Å; I192-W223 HydrophobicContact CG1-CB 3.69Å; I192-W223 PolarHBondContact N-O 2.95Å; I192-T225 HydrophobicContact CG2-CG2 3.52Å; I192-D237 HydrophobicContact CD1-CB 4.21Å; I192-D237 WeakPolarHBondContact CD1-OD2 3.41Å
193	T	96.3	Very high	95.4	Very high	34 Å²	34	58.6 Å²	58.6	21%	0.209	32%	0.32	C	S	.	.	S	Bend	trans	-93.3	111.7	178.9	-51.2	0	0	0	0	109.6	I191 V196 F222 W223	I191-T193 PolarHBondContact O-N 3.49Å; I191-T193 VanDerWaalsContact O-N 3.1Å; T193-V196 HydrophobicContact CG2-CG1 3.7Å; T193-F222 HydrophobicContact CG2-CB 4.06Å; T193-W223 PolarHBondContact OG1-N 3.48Å
194	P	93	Very high	95.6	Very high	101 Å²	101	56.1 Å²	56.1	66%	0.656	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	157.5	-175.6	29.6	-35.9	0	0	0	112.4	I192 V196	I192-P194 WeakPolarHBondContact O-CD 3.4Å; P194-V196 VanDerWaalsContact C-N 3.28Å; P194-V196 PolarHBondContact O-N 2.87Å
195	N	90.8	Very high	95.8	Very high	170 Å²	170	55.1 Å²	55.1	91%	0.909	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	26.8	173.2	-52.8	-38.9	0	0	0	115.5
196	V	95.6	Very high	95.9	Very high	36 Å²	36	50 Å²	50	22%	0.218	28%	0.277	C	S	.	.			trans	-93	145.1	173.2	-54.7	0	0	0	0	111.1	I191 T193 P194 F198 F222	I191-V196 HydrophobicContact CG2-CG2 3.7Å; T193-V196 HydrophobicContact CG2-CG1 3.7Å; P194-V196 VanDerWaalsContact C-N 3.28Å; P194-V196 PolarHBondContact O-N 2.87Å; V196-F198 HydrophobicContact CB-CD2 4.16Å; V196-F198 HydrophobicContact CG2-CB 4.34Å; V196-F198 HydrophobicContact CG2-CD2 4.28Å; V196-F198 PolarHBondContact O-N 2.93Å; V196-F222 HydrophobicContact CG1-CB 4.12Å
197	P	96.1	Very high	96	Very high	17 Å²	17	52.6 Å²	52.6	11%	0.11	29%	0.287	C	S	.	.	S	Bend	trans	-80	41.6	-176	33.9	-37.1	0	0	0	112.9	N208 T209 E210 L212	P197-N208 CarbonylContact O-C 3.45Å; P197-N208 VanDerWaalsContact O-CA 3.23Å; P197-N208 WeakPolarHBondContact O-CA 3.42Å; P197-N208 WeakPolarHBondContact O-CB 3.31Å; P197-T209 WeakPolarHBondContact CA-OG1 3.43Å; P197-T209 PolarHBondContact O-N 3.39Å; P197-T209 PolarHBondContact O-OG1 2.84Å; P197-E210 HydrophobicContact CB-CG 3.58Å; P197-L212 HydrophobicContact CB-CD2 4Å; P197-L212 HydrophobicContact CG-CD2 3.67Å
198	F	97.8	Very high	96.1	Very high	14 Å²	14	50.5 Å²	50.5	6%	0.061	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	152.9	-174.7	-58.5	-83.5	0	0	0	112	I169 I191 V196 I206 K207 N208 L212 H220 F222 V242	I169-F198 HydrophobicContact CD1-CD1 3.98Å; I169-F198 HydrophobicContact CD1-CE1 3.7Å; I191-F198 HydrophobicContact CD1-CB 4Å; V196-F198 HydrophobicContact CB-CD2 4.16Å; V196-F198 HydrophobicContact CG2-CB 4.34Å; V196-F198 HydrophobicContact CG2-CD2 4.28Å; V196-F198 PolarHBondContact O-N 2.93Å; F198-I206 HydrophobicContact CB-CG2 4.44Å; F198-I206 HydrophobicContact CD1-CG2 4.17Å; F198-K207 CarbonylContact C-O 3.57Å; F198-K207 VanDerWaalsContact CA-O 3.24Å; F198-K207 WeakPolarHBondContact CA-O 3.44Å; F198-N208 HydrophobicContact CD1-CB 3.99Å; F198-N208 HydrophobicContact CE1-CB 3.98Å; F198-L212 HydrophobicContact CE1-CD1 3.99Å; F198-L212 HydrophobicContact CE1-CD2 4.46Å; F198-L212 HydrophobicContact CZ-CD1 3.82Å; F198-L212 HydrophobicContact CZ-CD2 4.08Å; F198-H220 HydrophobicContact CE2-CB 3.58Å; F198-H220 AromaticContact CE2-CD2 3.98Å; F198-H220 AromaticContact CE2-CG 3.61Å; F198-H220 HydrophobicContact CZ-CB 3.98Å; F198-H220 AromaticContact CZ-CD2 3.8Å; F198-H220 AromaticContact CZ-CG 3.89Å; F198-F222 HydrophobicContact CB-CE1 4.4Å; F198-F222 HydrophobicContact CB-CZ 4.1Å; F198-F222 HydrophobicContact CD1-CE1 4.34Å; F198-F222 HydrophobicContact CD1-CZ 4.37Å; F198-F222 AromaticContact CD2-CD1 3.98Å; F198-F222 HydrophobicContact CD2-CD1 3.98Å; F198-F222 AromaticContact CD2-CE1 3.46Å; F198-F222 HydrophobicContact CD2-CE1 3.46Å; F198-F222 VanDerWaalsContact CD2-CE1 3.46Å; F198-F222 HydrophobicContact CD2-CZ 4.02Å; F198-F222 HydrophobicContact CE2-CD1 4.25Å; F198-F222 AromaticContact CE2-CE1 3.74Å; F198-F222 HydrophobicContact CE2-CE1 3.74Å; F198-F222 AromaticContact CG-CE1 3.81Å; F198-F222 HydrophobicContact CG-CE1 3.81Å; F198-F222 AromaticContact CG-CZ 3.9Å; F198-F222 HydrophobicContact CG-CZ 3.9Å; F198-F222 HydrophobicContact CZ-CE1 4.29Å; F198-V242 HydrophobicContact CE1-CB 4.3Å; F198-V242 HydrophobicContact CE1-CG1 4.13Å; F198-V242 HydrophobicContact CE1-CG2 4.08Å; F198-V242 HydrophobicContact CZ-CB 4Å; F198-V242 HydrophobicContact CZ-CG1 4.07Å; F198-V242 HydrophobicContact CZ-CG2 4.14Å
199	A	97.3	Very high	96.2	Very high	30 Å²	30	51.1 Å²	51.1	25%	0.248	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	155.6	169.1	0	0	0	0	0	109.3	I206 K207 T209	A199-I206 WeakPolarHBondContact O-CA 3.21Å; A199-K207 HydrophobicContact CB-CG 4.21Å; A199-K207 PolarHBondContact N-O 3.38Å; A199-K207 PolarHBondContact O-N 2.94Å; A199-T209 HydrophobicContact CB-CG2 3.87Å
200	I	97.8	Very high	96.1	Very high	28 Å²	28	54 Å²	54	14%	0.144	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	155.7	173.8	-166.6	159	0	0	0	109.6	V172 Y189 I191 N205 I206 V224	V172-I200 HydrophobicContact CG2-CD1 3.63Å; Y189-I200 HydrophobicContact CG-CD1 4.2Å; I191-I200 HydrophobicContact CD1-CB 4.11Å; I191-I200 HydrophobicContact CD1-CG2 4.35Å; I191-I200 HydrophobicContact CG1-CB 4.06Å; I191-I200 HydrophobicContact CG1-CG2 3.89Å; I200-N205 WeakPolarHBondContact CA-O 3.27Å; I200-I206 HydrophobicContact CB-CG1 4.3Å; I200-I206 HydrophobicContact CD1-CD1 4.26Å; I200-I206 HydrophobicContact CD1-CG1 3.8Å; I200-I206 HydrophobicContact CG1-CG1 4Å; I200-V224 HydrophobicContact CD1-CG1 3.61Å
201	D	95.6	Very high	95.9	Very high	45 Å²	45	53.8 Å²	53.8	24%	0.241	30%	0.3	C	S	.	.			trans	-109.1	170.6	168.7	66.2	24.2	0	0	0	112.2	D203 G204 N205	D201-D203 PolarHBondContact O-N 2.93Å; D201-D203 WeakPolarHBondContact OD1-CA 3.36Å; D201-D203 WeakPolarHBondContact OD1-CB 3.41Å; D201-D203 PolarHBondContact OD1-N 3.35Å; D201-D203 VanDerWaalsContact OD1-N 3.1Å; D201-G204 PolarHBondContact O-N 3.45Å; D201-G204 PolarHBondContact OD1-N 2.92Å; D201-N205 PolarHBondContact N-O 3.35Å; D201-N205 VanDerWaalsContact N-O 3.08Å; D201-N205 WeakPolarHBondContact OD1-CB 3.35Å; D201-N205 PolarHBondContact OD1-N 2.84Å; D201-N205 PolarHBondContact OD1-ND2 3.39Å; D201-N205 VanDerWaalsContact OD1-ND2 3.08Å; D201-N205 WeakPolarHBondContact OD2-CB 3.38Å; D201-N205 PolarHBondContact OD2-ND2 2.8Å
202	N	94.7	Very high	95.7	Very high	107 Å²	107	53.1 Å²	53.1	57%	0.572	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-16.5	-179.3	-64.1	36.5	0	0	0	113	C187 Y189 G204	C187-N202 PolarHBondContact O-ND2 3.02Å; Y189-N202 WeakPolarHBondContact CD2-O 3.36Å; Y189-N202 WeakPolarHBondContact CE2-O 3.43Å; N202-G204 VanDerWaalsContact C-N 3.27Å
203	D	94.8	Very high	95.4	Very high	103 Å²	103	53.3 Å²	53.3	55%	0.551	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-2.8	172.1	-76.2	-59.8	0	0	0	112.5	R171 D201 N205	R171-D203 VanDerWaalsContact CZ-O 3.23Å; R171-D203 PolarHBondContact NE-O 3.38Å; R171-D203 PolarHBondContact NH2-O 2.91Å; D201-D203 PolarHBondContact O-N 2.93Å; D201-D203 WeakPolarHBondContact OD1-CA 3.36Å; D201-D203 WeakPolarHBondContact OD1-CB 3.41Å; D201-D203 PolarHBondContact OD1-N 3.35Å; D201-D203 VanDerWaalsContact OD1-N 3.1Å; D203-N205 WeakPolarHBondContact CB-ND2 3.46Å
204	G	95.7	Very high	95.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.291	C	S	.	.			trans	85.7	8.1	179.6	0	0	0	0	0	114.7	R171 V172 D201 N202	R171-G204 CarbonylContact C-O 3.56Å; R171-G204 WeakPolarHBondContact CA-O 3.19Å; V172-G204 PolarHBondContact N-O 2.86Å; D201-G204 PolarHBondContact O-N 3.45Å; D201-G204 PolarHBondContact OD1-N 2.92Å; N202-G204 VanDerWaalsContact C-N 3.27Å
205	N	97.6	Very high	94.9	Very high	25 Å²	25	56.3 Å²	56.3	13%	0.134	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	129	178.4	-50.9	-77.1	0	0	0	110.9	R168 I200 D201 D203	R168-N205 WeakPolarHBondContact CD-OD1 3.35Å; R168-N205 HydrophobicContact CG-CB 4.09Å; I200-N205 WeakPolarHBondContact CA-O 3.27Å; D201-N205 PolarHBondContact N-O 3.35Å; D201-N205 VanDerWaalsContact N-O 3.08Å; D201-N205 WeakPolarHBondContact OD1-CB 3.35Å; D201-N205 PolarHBondContact OD1-N 2.84Å; D201-N205 PolarHBondContact OD1-ND2 3.39Å; D201-N205 VanDerWaalsContact OD1-ND2 3.08Å; D201-N205 WeakPolarHBondContact OD2-CB 3.38Å; D201-N205 PolarHBondContact OD2-ND2 2.8Å; D203-N205 WeakPolarHBondContact CB-ND2 3.46Å
206	I	98	Very high	94.8	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.5	177.2	-68	175.3	0	0	0	109.7	I169 V170 V172 F198 A199 I200 F222 V224 V240	I169-I206 WeakPolarHBondContact CB-O 3.09Å; I169-I206 PolarHBondContact N-O 2.82Å; V170-I206 HydrophobicContact CG1-CB 4.06Å; V170-I206 HydrophobicContact CG1-CD1 3.95Å; V170-I206 HydrophobicContact CG1-CG1 4.43Å; V170-I206 PolarHBondContact O-N 2.56Å; V172-I206 HydrophobicContact CG1-CD1 3.91Å; F198-I206 HydrophobicContact CB-CG2 4.44Å; F198-I206 HydrophobicContact CD1-CG2 4.17Å; A199-I206 WeakPolarHBondContact O-CA 3.21Å; I200-I206 HydrophobicContact CB-CG1 4.3Å; I200-I206 HydrophobicContact CD1-CD1 4.26Å; I200-I206 HydrophobicContact CD1-CG1 3.8Å; I200-I206 HydrophobicContact CG1-CG1 4Å; I206-F222 HydrophobicContact CD1-CE2 3.99Å; I206-F222 HydrophobicContact CD1-CZ 4.2Å; I206-F222 HydrophobicContact CG2-CZ 3.94Å; I206-V224 HydrophobicContact CD1-CG2 4.2Å; I206-V240 HydrophobicContact CD1-CB 4.35Å; I206-V240 HydrophobicContact CD1-CG1 3.92Å; I206-V240 HydrophobicContact CD1-CG2 3.76Å
207	K	96.9	Very high	94.6	Very high	78 Å²	78	59.7 Å²	59.7	34%	0.339	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	153.3	177.5	58.5	-171.5	173.8	-162.6	0	111	F166 F198 A199	F166-K207 VanDerWaalsContact O-CA 3.31Å; F166-K207 WeakPolarHBondContact O-CA 3.21Å; F166-K207 WeakPolarHBondContact O-CB 3.41Å; F198-K207 CarbonylContact C-O 3.57Å; F198-K207 VanDerWaalsContact CA-O 3.24Å; F198-K207 WeakPolarHBondContact CA-O 3.44Å; A199-K207 HydrophobicContact CB-CG 4.21Å; A199-K207 PolarHBondContact N-O 3.38Å; A199-K207 PolarHBondContact O-N 2.94Å
208	N	96.9	Very high	94.5	Very high	8 Å²	8	66.2 Å²	66.2	4%	0.043	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	143.4	172.2	62	-51.7	0	0	0	111.8	R164 F166 I169 P197 F198 E210 L212	R164-N208 PolarHBondContact O-ND2 2.89Å; F166-N208 PolarHBondContact N-OD1 2.69Å; I169-N208 HydrophobicContact CD1-CB 3.98Å; P197-N208 CarbonylContact O-C 3.45Å; P197-N208 VanDerWaalsContact O-CA 3.23Å; P197-N208 WeakPolarHBondContact O-CA 3.42Å; P197-N208 WeakPolarHBondContact O-CB 3.31Å; F198-N208 HydrophobicContact CD1-CB 3.99Å; F198-N208 HydrophobicContact CE1-CB 3.98Å; N208-E210 PolarHBondContact ND2-O 2.81Å; N208-L212 HydrophobicContact CB-CD1 4.42Å; N208-L212 HydrophobicContact CB-CD2 4.12Å; N208-L212 HydrophobicContact CB-CG 4.22Å
209	T	96.2	Very high	94.4	Very high	87 Å²	87	68.7 Å²	68.7	53%	0.534	34%	0.338	S	S	.	.	S	Bend	trans	-92	-27.7	-179.3	52.8	0	0	0	0	112.9	P197 A199	P197-T209 WeakPolarHBondContact CA-OG1 3.43Å; P197-T209 PolarHBondContact O-N 3.39Å; P197-T209 PolarHBondContact O-OG1 2.84Å; A199-T209 HydrophobicContact CB-CG2 3.87Å
210	E	94.7	Very high	94.4	Very high	84 Å²	84	67.9 Å²	67.9	39%	0.393	33%	0.329	S	S	.	.	S	Bend	trans	-126.7	153.4	171.6	60.8	174	-155.4	0	0	111.1	P197 N208 L212 R216	P197-E210 HydrophobicContact CB-CG 3.58Å; N208-E210 PolarHBondContact ND2-O 2.81Å; E210-L212 PolarHBondContact O-N 2.72Å; E210-R216 IonicContact OE1-NH1 2.69Å; E210-R216 PolarHBondContact OE1-NH1 3.37Å
211	P	93.7	Very high	94.4	Very high	76 Å²	76	69.9 Å²	69.9	49%	0.494	34%	0.343	S	S	.	.			trans	-60.3	119.7	173	-22.1	34.1	0	0	0	111	L165	L165-P211 HydrophobicContact CD2-CG 4.26Å; L165-P211 HydrophobicContact CG-CG 4.47Å
212	L	94.1	Very high	94.5	Very high	8 Å²	8	67.8 Å²	67.8	4%	0.042	33%	0.331	C	S	.	.			trans	-70.4	153.7	-176.8	-52.3	179.9	0	0	0	111.5	V160 E162 G163 P197 F198 N208 E210 V242 V244	V160-L212 HydrophobicContact CG2-CD1 3.95Å; E162-L212 CarbonylContact C-O 3.53Å; E162-L212 WeakPolarHBondContact CA-O 2.98Å; E162-L212 VanDerWaalsContact CB-O 3.31Å; E162-L212 WeakPolarHBondContact CB-O 3.31Å; G163-L212 PolarHBondContact N-O 3.21Å; P197-L212 HydrophobicContact CB-CD2 4Å; P197-L212 HydrophobicContact CG-CD2 3.67Å; F198-L212 HydrophobicContact CE1-CD1 3.99Å; F198-L212 HydrophobicContact CE1-CD2 4.46Å; F198-L212 HydrophobicContact CZ-CD1 3.82Å; F198-L212 HydrophobicContact CZ-CD2 4.08Å; N208-L212 HydrophobicContact CB-CD1 4.42Å; N208-L212 HydrophobicContact CB-CD2 4.12Å; N208-L212 HydrophobicContact CB-CG 4.22Å; E210-L212 PolarHBondContact O-N 2.72Å; L212-V242 HydrophobicContact CD1-CG1 4.44Å; L212-V244 HydrophobicContact CB-CG1 3.95Å; L212-V244 HydrophobicContact CB-CG2 4Å; L212-V244 HydrophobicContact CD1-CG2 3.86Å
213	D	90.6	Very high	94.6	Very high	68 Å²	68	68 Å²	68	36%	0.364	32%	0.324	S	S	.	.			trans	-128.4	117.5	177.6	170	15.2	0	0	0	110.3	K215 R216 Q217	D213-K215 PolarHBondContact O-N 3.29Å; D213-K215 WeakPolarHBondContact OD1-CB 3.23Å; D213-K215 PolarHBondContact OD1-N 2.68Å; D213-R216 HydrophobicContact CB-CB 4.04Å; D213-R216 PolarHBondContact O-N 3.49Å; D213-R216 WeakPolarHBondContact OD2-CB 3.43Å; D213-R216 PolarHBondContact OD2-N 2.84Å; D213-Q217 PolarHBondContact O-N 3.47Å
214	S	90.4	Very high	94.8	Very high	10 Å²	10	63 Å²	63	7%	0.07	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-15.8	-177.2	71.7	0	0	0	0	114.2	E162 P246	E162-S214 VanDerWaalsContact OE2-CB 3.23Å; E162-S214 WeakPolarHBondContact OE2-CB 3.48Å; E162-S214 PolarHBondContact OE2-N 3.41Å; E162-S214 PolarHBondContact OE2-OG 3.37Å; S214-P246 WeakPolarHBondContact OG-CA 3.22Å; S214-P246 WeakPolarHBondContact OG-CB 3.47Å
215	K	86.8	Confident	94.9	Very high	189 Å²	189	63.1 Å²	63.1	82%	0.822	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-37.6	174.3	-60.2	-175.8	179.6	-175.4	0	111.8	D213	D213-K215 PolarHBondContact O-N 3.29Å; D213-K215 WeakPolarHBondContact OD1-CB 3.23Å; D213-K215 PolarHBondContact OD1-N 2.68Å
216	R	90.1	Very high	94.9	Very high	186 Å²	186	61.9 Å²	61.9	70%	0.702	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-47.3	174.6	-175.4	178.7	176.9	-149.8	-1.2	111.4	E210 D213	E210-R216 IonicContact OE1-NH1 2.69Å; E210-R216 PolarHBondContact OE1-NH1 3.37Å; D213-R216 HydrophobicContact CB-CB 4.04Å; D213-R216 PolarHBondContact O-N 3.49Å; D213-R216 WeakPolarHBondContact OD2-CB 3.43Å; D213-R216 PolarHBondContact OD2-N 2.84Å
217	Q	91.9	Very high	94.8	Very high	91 Å²	91	63.8 Å²	63.8	43%	0.425	30%	0.3	S	S	.	.			trans	-155	110	176.6	-176.1	165.3	6.7	0	0	111.7	D213 V219 H220 V244	D213-Q217 PolarHBondContact O-N 3.47Å; Q217-V219 VanDerWaalsContact CG-O 3.24Å; Q217-V219 WeakPolarHBondContact CG-O 3.33Å; Q217-V219 PolarHBondContact NE2-O 2.85Å; Q217-H220 PolarHBondContact OE1-CE1 3.4Å; Q217-H220 PolarHBondContact OE1-ND1 2.86Å; Q217-H220 VanDerWaalsContact OE1-ND1 3.15Å; Q217-V244 WeakPolarHBondContact O-CG2 3.41Å
218	R	93.1	Very high	94.7	Very high	153 Å²	153	60 Å²	60	58%	0.577	28%	0.284	S	S	*	.	S	Bend	trans	-74.6	-27.2	178.7	-178.6	172	-72.5	-175.6	-4	114	T243 V244	R218-T243 CarbonylContact O-C 3.54Å; R218-V244 PolarHBondContact O-N 2.86Å
219	V	96.1	Very high	94.5	Very high	66 Å²	66	61.5 Å²	61.5	40%	0.4	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	120.6	-179.2	-176.9	0	0	0	0	109.2	Q217 V241	Q217-V219 VanDerWaalsContact CG-O 3.24Å; Q217-V219 WeakPolarHBondContact CG-O 3.33Å; Q217-V219 PolarHBondContact NE2-O 2.85Å; V219-V241 HydrophobicContact CG1-CG1 3.66Å
220	H	96.3	Very high	94.2	Very high	14 Å²	14	58.9 Å²	58.9	7%	0.065	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	130.5	168.2	-58.4	-85.5	0	0	0	109.1	F198 Q217 V241 V242	F198-H220 HydrophobicContact CE2-CB 3.58Å; F198-H220 AromaticContact CE2-CD2 3.98Å; F198-H220 AromaticContact CE2-CG 3.61Å; F198-H220 HydrophobicContact CZ-CB 3.98Å; F198-H220 AromaticContact CZ-CD2 3.8Å; F198-H220 AromaticContact CZ-CG 3.89Å; Q217-H220 PolarHBondContact OE1-CE1 3.4Å; Q217-H220 PolarHBondContact OE1-ND1 2.86Å; Q217-H220 VanDerWaalsContact OE1-ND1 3.15Å; H220-V241 CarbonylContact O-C 3.56Å; H220-V241 WeakPolarHBondContact O-CA 3.07Å; H220-V242 HydrophobicContact CB-CB 4.49Å; H220-V242 PolarHBondContact N-O 2.98Å; H220-V242 PolarHBondContact O-N 3.09Å
221	T	97.4	Very high	94	Very high	70 Å²	70	62.5 Å²	62.5	43%	0.429	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	125.1	175.2	-57.4	0	0	0	0	108.3	Q239 V240 V241	T221-Q239 HydrophobicContact CG2-CG 3.93Å; T221-V240 WeakPolarHBondContact CA-O 3.42Å; T221-V241 HydrophobicContact CG2-CG2 4.28Å
222	F	97.9	Very high	94	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	171.6	-180	57.8	-89.8	0	0	0	111.1	I191 T193 V196 F198 I206 V224 V240 V242	I191-F222 HydrophobicContact CD1-CE2 4.09Å; I191-F222 HydrophobicContact CG1-CE2 4.36Å; I191-F222 HydrophobicContact CG2-CD2 3.76Å; I191-F222 HydrophobicContact CG2-CE2 4.31Å; I191-F222 HydrophobicContact CG2-CG 4.46Å; T193-F222 HydrophobicContact CG2-CB 4.06Å; V196-F222 HydrophobicContact CG1-CB 4.12Å; F198-F222 HydrophobicContact CB-CE1 4.4Å; F198-F222 HydrophobicContact CB-CZ 4.1Å; F198-F222 HydrophobicContact CD1-CE1 4.34Å; F198-F222 HydrophobicContact CD1-CZ 4.37Å; F198-F222 AromaticContact CD2-CD1 3.98Å; F198-F222 HydrophobicContact CD2-CD1 3.98Å; F198-F222 AromaticContact CD2-CE1 3.46Å; F198-F222 HydrophobicContact CD2-CE1 3.46Å; F198-F222 VanDerWaalsContact CD2-CE1 3.46Å; F198-F222 HydrophobicContact CD2-CZ 4.02Å; F198-F222 HydrophobicContact CE2-CD1 4.25Å; F198-F222 AromaticContact CE2-CE1 3.74Å; F198-F222 HydrophobicContact CE2-CE1 3.74Å; F198-F222 AromaticContact CG-CE1 3.81Å; F198-F222 HydrophobicContact CG-CE1 3.81Å; F198-F222 AromaticContact CG-CZ 3.9Å; F198-F222 HydrophobicContact CG-CZ 3.9Å; F198-F222 HydrophobicContact CZ-CE1 4.29Å; I206-F222 HydrophobicContact CD1-CE2 3.99Å; I206-F222 HydrophobicContact CD1-CZ 4.2Å; I206-F222 HydrophobicContact CG2-CZ 3.94Å; F222-V224 HydrophobicContact CD2-CG2 4.04Å; F222-V224 HydrophobicContact CE2-CG2 3.96Å; F222-V240 HydrophobicContact CD2-CB 4.07Å; F222-V240 HydrophobicContact CE1-CB 4.27Å; F222-V240 HydrophobicContact CE1-CG1 4.1Å; F222-V240 HydrophobicContact CE2-CB 3.73Å; F222-V240 HydrophobicContact CE2-CG1 4Å; F222-V240 HydrophobicContact CE2-CG2 4.11Å; F222-V240 HydrophobicContact CG-CB 4.5Å; F222-V240 HydrophobicContact CZ-CB 3.84Å; F222-V240 HydrophobicContact CZ-CG1 3.64Å; F222-V240 PolarHBondContact N-O 2.92Å; F222-V240 PolarHBondContact O-N 2.98Å; F222-V242 HydrophobicContact CE1-CG2 4.03Å; F222-V242 HydrophobicContact CZ-CG2 4.43Å
223	W	98.1	Very high	94.1	Very high	111 Å²	111	65.8 Å²	65.8	42%	0.42	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	145.7	-177	-61.8	91.5	0	0	0	111.2	I192 T193 D237 A238 Q239	I192-W223 HydrophobicContact CD1-CB 3.84Å; I192-W223 HydrophobicContact CG1-CB 3.69Å; I192-W223 PolarHBondContact N-O 2.95Å; T193-W223 PolarHBondContact OG1-N 3.48Å; W223-D237 HydrophobicContact CB-CB 4.43Å; W223-D237 HydrophobicContact CE3-CB 3.94Å; W223-A238 WeakPolarHBondContact CA-O 3.44Å; W223-Q239 HydrophobicContact CD2-CB 4.46Å; W223-Q239 HydrophobicContact CE3-CB 3.99Å; W223-Q239 HydrophobicContact CH2-CB 4.03Å; W223-Q239 HydrophobicContact CZ2-CB 4.48Å; W223-Q239 VanDerWaalsContact CZ2-NE2 3.35Å; W223-Q239 HydrophobicContact CZ3-CB 3.76Å
224	V	98.1	Very high	94.4	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135.2	-178.4	-176.7	0	0	0	0	109.5	F151 V172 D190 I191 I200 I206 F222 D237 A238 V240	F151-V224 VanDerWaalsContact CE2-O 3.31Å; F151-V224 WeakPolarHBondContact CE2-O 3.48Å; F151-V224 HydrophobicContact CZ-CB 4.49Å; F151-V224 HydrophobicContact CZ-CG1 4.13Å; F151-V224 WeakPolarHBondContact CZ-O 3.24Å; V172-V224 HydrophobicContact CG2-CG1 4.18Å; D190-V224 WeakPolarHBondContact O-CA 3.31Å; D190-V224 WeakPolarHBondContact O-CG1 3.26Å; I191-V224 HydrophobicContact CG1-CG2 4.28Å; I200-V224 HydrophobicContact CD1-CG1 3.61Å; I206-V224 HydrophobicContact CD1-CG2 4.2Å; F222-V224 HydrophobicContact CD2-CG2 4.04Å; F222-V224 HydrophobicContact CE2-CG2 3.96Å; V224-D237 WeakPolarHBondContact O-CA 3.36Å; V224-A238 PolarHBondContact N-O 3.46Å; V224-A238 PolarHBondContact O-N 2.94Å; V224-V240 HydrophobicContact CG2-CG2 3.65Å
225	T	97.8	Very high	94.7	Very high	1 Å²	1	69.6 Å²	69.6	1%	0.006	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	153.9	170.2	-172.1	0	0	0	0	109.9	Y189 D190 I192 F227 R233 D237	Y189-T225 WeakPolarHBondContact CA-O 3.2Å; D190-T225 HydrophobicContact CB-CG2 3.97Å; D190-T225 PolarHBondContact N-O 2.7Å; D190-T225 PolarHBondContact O-N 2.89Å; I192-T225 HydrophobicContact CG2-CG2 3.52Å; T225-F227 HydrophobicContact CG2-CD2 4.02Å; T225-F227 HydrophobicContact CG2-CE2 3.38Å; T225-F227 HydrophobicContact CG2-CZ 4.11Å; T225-R233 WeakPolarHBondContact OG1-CG 3.36Å; T225-R233 PolarHBondContact OG1-NH1 2.75Å; T225-D237 WeakPolarHBondContact CB-OD1 3.37Å
226	A	97.8	Very high	95.1	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	160.8	164	0	0	0	0	0	109.5	P149 F151 A174 I186 Y189 A234	P149-A226 HydrophobicContact CB-CB 3.92Å; F151-A226 HydrophobicContact CE1-CB 4.34Å; F151-A226 HydrophobicContact CE2-CB 4.16Å; F151-A226 HydrophobicContact CZ-CB 3.81Å; A174-A226 HydrophobicContact CB-CB 3.61Å; I186-A226 HydrophobicContact CG2-CB 4.1Å; Y189-A226 HydrophobicContact CD1-CB 3.65Å; Y189-A226 HydrophobicContact CE1-CB 3.64Å; A226-A234 HydrophobicContact CB-CB 4.15Å; A226-A234 WeakPolarHBondContact O-CB 3.46Å; A226-A234 PolarHBondContact O-N 2.87Å
227	F	95.9	Very high	95.5	Very high	39 Å²	39	56.6 Å²	56.6	17%	0.171	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	136.9	170.3	-67.2	-94.6	0	0	0	109.5	I186 C187 F188 T225 N232 R233	I186-F227 WeakPolarHBondContact CG2-O 3.45Å; C187-F227 PolarHBondContact N-O 3.44Å; F188-F227 HydrophobicContact CD1-CB 3.76Å; F188-F227 HydrophobicContact CD1-CG 4.48Å; F188-F227 HydrophobicContact CD2-CB 4.28Å; F188-F227 AromaticContact CD2-CD2 3.68Å; F188-F227 HydrophobicContact CD2-CD2 3.68Å; F188-F227 HydrophobicContact CD2-CE2 4.33Å; F188-F227 HydrophobicContact CD2-CG 4.28Å; F188-F227 HydrophobicContact CE1-CB 3.35Å; F188-F227 HydrophobicContact CE1-CD2 4.2Å; F188-F227 AromaticContact CE1-CG 3.83Å; F188-F227 HydrophobicContact CE1-CG 3.83Å; F188-F227 HydrophobicContact CE2-CB 3.94Å; F188-F227 HydrophobicContact CE2-CD1 4.41Å; F188-F227 AromaticContact CE2-CD2 3.13Å; F188-F227 HydrophobicContact CE2-CD2 3.13Å; F188-F227 AromaticContact CE2-CE2 3.55Å; F188-F227 HydrophobicContact CE2-CE2 3.55Å; F188-F227 AromaticContact CE2-CG 3.61Å; F188-F227 HydrophobicContact CE2-CG 3.61Å; F188-F227 HydrophobicContact CE2-CZ 4.35Å; F188-F227 HydrophobicContact CG-CB 4.2Å; F188-F227 HydrophobicContact CG-CD2 4.41Å; F188-F227 HydrophobicContact CZ-CB 3.46Å; F188-F227 VanDerWaalsContact CZ-CB 3.46Å; F188-F227 AromaticContact CZ-CD1 3.9Å; F188-F227 HydrophobicContact CZ-CD1 3.9Å; F188-F227 AromaticContact CZ-CD2 3.43Å; F188-F227 HydrophobicContact CZ-CD2 3.43Å; F188-F227 VanDerWaalsContact CZ-CD2 3.43Å; F188-F227 HydrophobicContact CZ-CE1 4.43Å; F188-F227 HydrophobicContact CZ-CE2 4.01Å; F188-F227 AromaticContact CZ-CG 3.34Å; F188-F227 HydrophobicContact CZ-CG 3.34Å; F188-F227 HydrophobicContact CZ-CZ 4.48Å; F188-F227 PolarHBondContact N-O 2.67Å; F188-F227 PolarHBondContact O-N 2.73Å; T225-F227 HydrophobicContact CG2-CD2 4.02Å; T225-F227 HydrophobicContact CG2-CE2 3.38Å; T225-F227 HydrophobicContact CG2-CZ 4.11Å; F227-N232 WeakPolarHBondContact CA-O 3.36Å; F227-R233 HydrophobicContact CD1-CB 3.93Å; F227-R233 HydrophobicContact CD1-CG 4.19Å; F227-R233 HydrophobicContact CE1-CB 3.64Å; F227-R233 HydrophobicContact CE1-CG 3.65Å; F227-R233 HydrophobicContact CZ-CB 4.42Å; F227-R233 HydrophobicContact CZ-CG 3.93Å
228	D	95.1	Very high	95.8	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	178.2	173	86.6	-50.4	0	0	0	111.8	N145 P149 Y183 Q185 G230 K231 N232	N145-D228 PolarHBondContact ND2-OD2 2.75Å; P149-D228 HydrophobicContact CG-CB 4.09Å; Y183-D228 WeakPolarHBondContact CA-OD2 3.22Å; Y183-D228 WeakPolarHBondContact O-CB 3.29Å; Q185-D228 CarbonylContact O-C 3.56Å; Q185-D228 WeakPolarHBondContact O-CA 3.42Å; D228-G230 VanDerWaalsContact C-N 3.33Å; D228-G230 VanDerWaalsContact CG-N 3.32Å; D228-G230 VanDerWaalsContact OD2-CA 3.23Å; D228-G230 WeakPolarHBondContact OD2-CA 3.28Å; D228-G230 PolarHBondContact OD2-N 2.84Å; D228-K231 PolarHBondContact O-N 2.83Å; D228-K231 WeakPolarHBondContact OD1-CA 3.45Å; D228-K231 PolarHBondContact OD1-N 3.04Å; D228-N232 PolarHBondContact N-O 3.41Å; D228-N232 WeakPolarHBondContact OD1-CA 3.4Å; D228-N232 PolarHBondContact OD1-N 2.83Å
229	C	92.4	Very high	96	Very high	39 Å²	39	46.6 Å²	46.6	26%	0.264	24%	0.242	S	C	.	.	S	Bend	trans	-76.2	-15.8	178.7	-67.7	0	0	0	0	114.4	Q182 Q185 C187	Q182-C229 CarbonylContact O-C 3.4Å; Q182-C229 VanDerWaalsContact O-CB 3.24Å; Q182-C229 WeakPolarHBondContact O-CB 3.37Å; Q185-C229 PolarHBondContact O-N 3.07Å; Q185-C229 PolarHBondContact O-SG 2.85Å; C187-C229 HydrophobicContact CB-CB 3.92Å; C187-C229 WeakPolarHBondContact CB-SG 3.13Å; C187-C229 WeakPolarHBondContact SG-CA 3.44Å; C187-C229 WeakPolarHBondContact SG-CB 3.35Å; C187-C229 CovalentContact SG-SG 2.04Å; C187-C229 PolarHBondContact SG-SG 3.41Å
230	G	90	Very high	96.1	Very high	31 Å²	31	43.5 Å²	43.5	32%	0.32	22%	0.222	S	C	.	.	S	Bend	trans	-82.9	-15.8	167.2	0	0	0	0	0	115.3	Q182 D228	Q182-G230 PolarHBondContact O-N 3.22Å; D228-G230 VanDerWaalsContact C-N 3.33Å; D228-G230 VanDerWaalsContact CG-N 3.32Å; D228-G230 VanDerWaalsContact OD2-CA 3.23Å; D228-G230 WeakPolarHBondContact OD2-CA 3.28Å; D228-G230 PolarHBondContact OD2-N 2.84Å
231	K	90.6	Very high	96.2	Very high	161 Å²	161	43.2 Å²	43.2	70%	0.7	22%	0.222	S	C	*	.			trans	84	17.9	178	-46.9	166.2	-172.2	172.3	0	116.3	D228	D228-K231 PolarHBondContact O-N 2.83Å; D228-K231 WeakPolarHBondContact OD1-CA 3.45Å; D228-K231 PolarHBondContact OD1-N 3.04Å
232	N	94.5	Very high	96.2	Very high	57 Å²	57	39.9 Å²	39.9	31%	0.305	20%	0.202	S	C	.	.			trans	-61.7	140.6	157.2	-84.2	-1.9	0	0	0	109.7	N145 F147 F227 D228	N145-N232 PolarHBondContact O-ND2 3.11Å; N145-N232 PolarHBondContact OD1-ND2 3.11Å; F147-N232 PolarHBondContact O-ND2 2.92Å; F227-N232 WeakPolarHBondContact CA-O 3.36Å; D228-N232 PolarHBondContact N-O 3.41Å; D228-N232 WeakPolarHBondContact OD1-CA 3.4Å; D228-N232 PolarHBondContact OD1-N 2.83Å
233	R	95.8	Very high	96.2	Very high	95 Å²	95	42.5 Å²	42.5	36%	0.358	22%	0.217	S	C	.	.	B	Isolated β-bridge	trans	-93.9	144.7	-177	-174.3	-167	-176.9	-69.8	4.8	109	T225 F227 Q235 D237	T225-R233 WeakPolarHBondContact OG1-CG 3.36Å; T225-R233 PolarHBondContact OG1-NH1 2.75Å; F227-R233 HydrophobicContact CD1-CB 3.93Å; F227-R233 HydrophobicContact CD1-CG 4.19Å; F227-R233 HydrophobicContact CE1-CB 3.64Å; F227-R233 HydrophobicContact CE1-CG 3.65Å; F227-R233 HydrophobicContact CZ-CB 4.42Å; F227-R233 HydrophobicContact CZ-CG 3.93Å; R233-Q235 PolarHBondContact O-N 3.34Å; R233-D237 IonicContact CZ-OD1 2.8Å; R233-D237 IonicContact CZ-OD2 2.73Å; R233-D237 IonicContact NH1-OD1 3.88Å; R233-D237 PolarHBondContact NH1-OD1 3.46Å; R233-D237 IonicContact NH1-OD2 3.58Å; R233-D237 IonicContact NH2-OD1 3.92Å; R233-D237 PolarHBondContact NH2-OD1 3.49Å; R233-D237 IonicContact NH2-OD2 3.72Å; R233-D237 PolarHBondContact NH2-OD2 3.23Å
234	A	97	Very high	96	Very high	4 Å²	4	37.2 Å²	37.2	3%	0.033	20%	0.197	C	C	.	.			trans	-45.8	133.8	174.7	0	0	0	0	0	113.1	P149 F151 A226 A236	P149-A234 HydrophobicContact CB-CB 4.04Å; P149-A234 CarbonylContact O-C 3.45Å; P149-A234 WeakPolarHBondContact O-CA 3Å; P149-A234 WeakPolarHBondContact O-CB 3.41Å; F151-A234 HydrophobicContact CD2-CB 4.38Å; F151-A234 HydrophobicContact CE2-CB 3.98Å; A226-A234 HydrophobicContact CB-CB 4.15Å; A226-A234 WeakPolarHBondContact O-CB 3.46Å; A226-A234 PolarHBondContact O-N 2.87Å; A234-A236 PolarHBondContact O-N 3.29Å
235	Q	95.9	Very high	95.5	Very high	154 Å²	154	42.6 Å²	42.6	72%	0.72	22%	0.221	S	C	*	.	S	Bend	trans	-59.6	-32.2	-174.8	-170.1	-169.4	52.8	0	0	112.2	P149 R233	P149-Q235 PolarHBondContact O-N 2.88Å; R233-Q235 PolarHBondContact O-N 3.34Å
236	A	96.3	Very high	94.8	Very high	59 Å²	59	46.1 Å²	46.1	49%	0.488	24%	0.244	S	C	.	.	S	Bend	trans	-148.1	149.2	172.1	0	0	0	0	0	109.9	F151 A234	F151-A236 WeakPolarHBondContact CD2-O 3.46Å; A234-A236 PolarHBondContact O-N 3.29Å
237	D	97.5	Very high	93.7	Very high	43 Å²	43	47.8 Å²	47.8	23%	0.23	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-81.5	142.6	179.5	-61.6	-42.8	0	0	0	112.1	I192 W223 V224 T225 R233	I192-D237 HydrophobicContact CD1-CB 4.21Å; I192-D237 WeakPolarHBondContact CD1-OD2 3.41Å; W223-D237 HydrophobicContact CB-CB 4.43Å; W223-D237 HydrophobicContact CE3-CB 3.94Å; V224-D237 WeakPolarHBondContact O-CA 3.36Å; T225-D237 WeakPolarHBondContact CB-OD1 3.37Å; R233-D237 IonicContact CZ-OD1 2.8Å; R233-D237 IonicContact CZ-OD2 2.73Å; R233-D237 IonicContact NH1-OD1 3.88Å; R233-D237 PolarHBondContact NH1-OD1 3.46Å; R233-D237 IonicContact NH1-OD2 3.58Å; R233-D237 IonicContact NH2-OD1 3.92Å; R233-D237 PolarHBondContact NH2-OD1 3.49Å; R233-D237 IonicContact NH2-OD2 3.72Å; R233-D237 PolarHBondContact NH2-OD2 3.23Å
238	A	98.1	Very high	92.7	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	135.2	172.4	0	0	0	0	0	110.9	F151 Y156 W223 V224	F151-A238 HydrophobicContact CB-CB 4.14Å; F151-A238 HydrophobicContact CD1-CB 3.8Å; F151-A238 HydrophobicContact CD2-CB 3.76Å; F151-A238 HydrophobicContact CE1-CB 4.07Å; F151-A238 HydrophobicContact CE2-CB 4.02Å; F151-A238 HydrophobicContact CG-CB 3.64Å; F151-A238 HydrophobicContact CZ-CB 4.16Å; Y156-A238 HydrophobicContact CD2-CB 4.07Å; Y156-A238 HydrophobicContact CE2-CB 3.86Å; W223-A238 WeakPolarHBondContact CA-O 3.44Å; V224-A238 PolarHBondContact N-O 3.46Å; V224-A238 PolarHBondContact O-N 2.94Å
239	Q	98.3	Very high	91.9	Very high	35 Å²	35	55.3 Å²	55.3	16%	0.164	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	137.8	169.6	-178.9	167.6	91.8	0	0	110.1	R154 R155 Y156 T221 W223 V241	R154-Q239 PolarHBondContact O-N 3.3Å; R155-Q239 CarbonylContact C-O 3.6Å; R155-Q239 VanDerWaalsContact CA-O 3.26Å; R155-Q239 WeakPolarHBondContact CA-O 3.32Å; R155-Q239 HydrophobicContact CB-CB 4.47Å; R155-Q239 HydrophobicContact CG-CB 4.44Å; Y156-Q239 PolarHBondContact N-O 3.31Å; T221-Q239 HydrophobicContact CG2-CG 3.93Å; W223-Q239 HydrophobicContact CD2-CB 4.46Å; W223-Q239 HydrophobicContact CE3-CB 3.99Å; W223-Q239 HydrophobicContact CH2-CB 4.03Å; W223-Q239 HydrophobicContact CZ2-CB 4.48Å; W223-Q239 VanDerWaalsContact CZ2-NE2 3.35Å; W223-Q239 HydrophobicContact CZ3-CB 3.76Å; Q239-V241 HydrophobicContact CG-CG2 4.11Å
240	V	98.4	Very high	91.4	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.1	172.2	-175.3	0	0	0	0	109.1	Y156 V170 V172 I206 T221 F222 V224 V242	Y156-V240 WeakPolarHBondContact O-CA 3.06Å; V170-V240 HydrophobicContact CG1-CG1 4.06Å; V172-V240 HydrophobicContact CG1-CG2 4.07Å; I206-V240 HydrophobicContact CD1-CB 4.35Å; I206-V240 HydrophobicContact CD1-CG1 3.92Å; I206-V240 HydrophobicContact CD1-CG2 3.76Å; T221-V240 WeakPolarHBondContact CA-O 3.42Å; F222-V240 HydrophobicContact CD2-CB 4.07Å; F222-V240 HydrophobicContact CE1-CB 4.27Å; F222-V240 HydrophobicContact CE1-CG1 4.1Å; F222-V240 HydrophobicContact CE2-CB 3.73Å; F222-V240 HydrophobicContact CE2-CG1 4Å; F222-V240 HydrophobicContact CE2-CG2 4.11Å; F222-V240 HydrophobicContact CG-CB 4.5Å; F222-V240 HydrophobicContact CZ-CB 3.84Å; F222-V240 HydrophobicContact CZ-CG1 3.64Å; F222-V240 PolarHBondContact N-O 2.92Å; F222-V240 PolarHBondContact O-N 2.98Å; V224-V240 HydrophobicContact CG2-CG2 3.65Å; V240-V242 HydrophobicContact CG1-CG2 4.18Å
241	V	98.1	Very high	91.4	Very high	9 Å²	9	55.3 Å²	55.3	6%	0.055	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	111.5	179.8	-173.2	0	0	0	0	109.7	Y156 E157 A158 V219 H220 T221 Q239	Y156-V241 PolarHBondContact O-N 2.95Å; E157-V241 WeakPolarHBondContact CA-O 3.4Å; E157-V241 HydrophobicContact CG-CB 4.3Å; A158-V241 PolarHBondContact N-O 2.89Å; V219-V241 HydrophobicContact CG1-CG1 3.66Å; H220-V241 CarbonylContact O-C 3.56Å; H220-V241 WeakPolarHBondContact O-CA 3.07Å; T221-V241 HydrophobicContact CG2-CG2 4.28Å; Q239-V241 HydrophobicContact CG-CG2 4.11Å
242	V	97.6	Very high	91.4	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	114.1	177.8	-176.7	0	0	0	0	109.4	V160 I169 F198 L212 H220 F222 V240	V160-V242 HydrophobicContact CG2-CG1 3.91Å; I169-V242 HydrophobicContact CG2-CG1 4.15Å; I169-V242 HydrophobicContact CG2-CG2 4.17Å; F198-V242 HydrophobicContact CE1-CB 4.3Å; F198-V242 HydrophobicContact CE1-CG1 4.13Å; F198-V242 HydrophobicContact CE1-CG2 4.08Å; F198-V242 HydrophobicContact CZ-CB 4Å; F198-V242 HydrophobicContact CZ-CG1 4.07Å; F198-V242 HydrophobicContact CZ-CG2 4.14Å; L212-V242 HydrophobicContact CD1-CG1 4.44Å; H220-V242 HydrophobicContact CB-CB 4.49Å; H220-V242 PolarHBondContact N-O 2.98Å; H220-V242 PolarHBondContact O-N 3.09Å; F222-V242 HydrophobicContact CE1-CG2 4.03Å; F222-V242 HydrophobicContact CZ-CG2 4.43Å; V240-V242 HydrophobicContact CG1-CG2 4.18Å
243	T	96.6	Very high	91.3	Very high	54 Å²	54	49.5 Å²	49.5	33%	0.331	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	118.1	176.9	-59.4	0	0	0	0	110.8	A158 S159 V160 R218 K245	A158-T243 PolarHBondContact O-N 2.79Å; S159-T243 VanDerWaalsContact CA-O 3.23Å; S159-T243 WeakPolarHBondContact CA-O 3.41Å; V160-T243 PolarHBondContact N-O 3.43Å; R218-T243 CarbonylContact O-C 3.54Å; T243-K245 PolarHBondContact O-N 3.02Å
244	V	94.5	Very high	91	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	111.6	177.7	-166.1	0	0	0	0	109.4	V160 E162 L212 Q217 R218	V160-V244 WeakPolarHBondContact O-CA 3.43Å; E162-V244 HydrophobicContact CB-CG1 3.64Å; L212-V244 HydrophobicContact CB-CG1 3.95Å; L212-V244 HydrophobicContact CB-CG2 4Å; L212-V244 HydrophobicContact CD1-CG2 3.86Å; Q217-V244 WeakPolarHBondContact O-CG2 3.41Å; R218-V244 PolarHBondContact O-N 2.86Å
245	K	88.1	Confident	90.8	Very high	113 Å²	113	48.8 Å²	48.8	49%	0.491	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	133.8	172	-73.2	171.7	170.2	164.6	0	109.2	S159 V160 P161 E162 T243	S159-K245 WeakPolarHBondContact OG-CE 3.34Å; S159-K245 PolarHBondContact OG-NZ 2.93Å; V160-K245 PolarHBondContact O-N 2.81Å; P161-K245 CarbonylContact C-O 3.6Å; P161-K245 WeakPolarHBondContact CA-O 3.4Å; E162-K245 PolarHBondContact N-O 2.97Å; T243-K245 PolarHBondContact O-N 3.02Å
246	P	82.6	Confident	90.6	Very high	75 Å²	75	44.2 Å²	44.2	49%	0.487	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-59.2	146	173.9	25.7	-33.7	0	0	0	110.5	S214	S214-P246 WeakPolarHBondContact OG-CA 3.22Å; S214-P246 WeakPolarHBondContact OG-CB 3.47Å
247	S	75.4	Confident	90.4	Very high	35 Å²	35	47.7 Å²	47.7	25%	0.245	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-80.8	118.9	170.2	56.8	0	0	0	0	108.5	E162 K249	E162-S247 WeakPolarHBondContact CG-OG 3.42Å; E162-S247 PolarHBondContact OE1-N 2.83Å; E162-S247 PolarHBondContact OE1-OG 2.71Å; S247-K249 PolarHBondContact O-N 3.34Å; S247-K249 WeakPolarHBondContact OG-CE 3.5Å; S247-K249 PolarHBondContact OG-NZ 2.92Å
248	C	74.8	Confident	90.3	Very high	61 Å²	61	52 Å²	52	41%	0.412	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-58	134.9	167	-172.7	0	0	0	0	108.5	E277 C279	C248-E277 PolarHBondContact SG-OE2 2.87Å; C248-C279 HydrophobicContact CB-CB 3.73Å; C248-C279 WeakPolarHBondContact CB-SG 3.24Å; C248-C279 WeakPolarHBondContact SG-CA 3.23Å; C248-C279 WeakPolarHBondContact SG-CB 3.43Å; C248-C279 CovalentContact SG-SG 2.03Å; C248-C279 PolarHBondContact SG-SG 3.07Å
249	K	77.1	Confident	90.1	Very high	137 Å²	137	52.9 Å²	52.9	60%	0.596	28%	0.276	S	S	*	.			trans	-130	111.5	-178.9	-78.2	168.8	179.3	139.6	0	108.1	E162 S247 G251 C279	E162-K249 IonicContact OE1-NZ 3.21Å; E162-K249 PolarHBondContact OE1-NZ 3.11Å; S247-K249 PolarHBondContact O-N 3.34Å; S247-K249 WeakPolarHBondContact OG-CE 3.5Å; S247-K249 PolarHBondContact OG-NZ 2.92Å; K249-G251 PolarHBondContact O-N 2.89Å; K249-C279 VanDerWaalsContact C-SG 3.57Å; K249-C279 PolarHBondContact N-SG 2.92Å
250	P	82.7	Confident	89.9	Confident	53 Å²	53	55.6 Å²	55.6	34%	0.344	29%	0.289	S	S	.	.			trans	-61.9	129.7	-170.2	23.6	-32.9	0	0	0	110.2	E277 C279 L630 L632	P250-E277 CarbonylContact C-O 3.59Å; P250-E277 VanDerWaalsContact CA-O 3.26Å; P250-E277 WeakPolarHBondContact CA-O 3.47Å; P250-C279 VanDerWaalsContact N-SG 3.42Å; P250-L630 HydrophobicContact CB-CD1 4.19Å; P250-L630 HydrophobicContact CB-CD2 3.8Å; P250-L630 HydrophobicContact CG-CD2 3.56Å; P250-L632 HydrophobicContact CB-CD2 4.47Å
251	G	88.9	Confident	89.7	Confident	16 Å²	16	55.7 Å²	55.7	17%	0.165	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.6	173.3	-164.9	0	0	0	0	0	115.2	K249 E277	K249-G251 PolarHBondContact O-N 2.89Å; G251-E277 PolarHBondContact N-O 2.77Å; G251-E277 PolarHBondContact O-N 3.07Å
252	W	92.3	Very high	89.4	Confident	28 Å²	28	59.2 Å²	59.2	11%	0.106	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	125.8	175.4	-77.6	117.1	0	0	0	111.1	L274 L276 F592 V596 L617 T619 L635	W252-L274 HydrophobicContact CB-CD1 3.94Å; W252-L274 HydrophobicContact CD2-CD1 4.23Å; W252-L274 HydrophobicContact CD2-CD2 4.49Å; W252-L274 HydrophobicContact CD2-CG 4.25Å; W252-L274 HydrophobicContact CE3-CD1 3.8Å; W252-L274 HydrophobicContact CE3-CD2 4.16Å; W252-L274 HydrophobicContact CE3-CG 3.55Å; W252-L274 HydrophobicContact CG-CD1 4.33Å; W252-L274 HydrophobicContact CZ3-CD2 4.45Å; W252-L274 HydrophobicContact CZ3-CG 3.95Å; W252-L276 HydrophobicContact CD2-CB 4.43Å; W252-L276 HydrophobicContact CD2-CD1 4.5Å; W252-L276 HydrophobicContact CE3-CB 3.97Å; W252-L276 HydrophobicContact CH2-CB 3.94Å; W252-L276 HydrophobicContact CZ2-CB 4.41Å; W252-L276 HydrophobicContact CZ3-CB 3.72Å; W252-F592 HydrophobicContact CH2-CD1 4.13Å; W252-F592 AromaticContact CH2-CE1 3.89Å; W252-F592 HydrophobicContact CH2-CE1 3.89Å; W252-F592 HydrophobicContact CZ2-CE1 4.06Å; W252-V596 HydrophobicContact CH2-CB 4.36Å; W252-V596 HydrophobicContact CH2-CG1 4.21Å; W252-V596 HydrophobicContact CH2-CG2 3.93Å; W252-V596 HydrophobicContact CZ3-CG1 4.35Å; W252-L617 HydrophobicContact CD2-CD2 4.43Å; W252-T619 HydrophobicContact CZ2-CG2 4.18Å; W252-T619 PolarHBondContact NE1-OG1 2.86Å; W252-L635 HydrophobicContact CB-CD1 3.41Å; W252-L635 VanDerWaalsContact CB-CD1 3.41Å; W252-L635 HydrophobicContact CB-CG 4.45Å; W252-L635 HydrophobicContact CG-CD1 3.73Å
253	I	91.1	Very high	88.8	Confident	68 Å²	68	60.3 Å²	60.3	35%	0.349	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	144.3	178.6	-55.7	177.9	0	0	0	108.4	L274 H275 E277	I253-L274 CarbonylContact O-C 3.53Å; I253-L274 WeakPolarHBondContact O-CA 3.24Å; I253-L274 WeakPolarHBondContact O-CD1 3.34Å; I253-H275 PolarHBondContact N-O 2.88Å; I253-H275 PolarHBondContact O-N 3.3Å; I253-H275 PolarHBondContact O-ND1 2.04Å; I253-E277 HydrophobicContact CD1-CB 3.77Å; I253-E277 HydrophobicContact CD1-CG 4.41Å; I253-E277 HydrophobicContact CG1-CB 4.49Å
254	G	90.4	Very high	88	Confident	28 Å²	28	60.6 Å²	60.6	29%	0.289	33%	0.332	S	S	.	.	S	Bend	trans	81.9	22	-176	0	0	0	0	0	114.6	T256 S273	G254-T256 PolarHBondContact O-N 3.37Å; G254-S273 PolarHBondContact O-OG 2.91Å
255	W	92.5	Very high	87.6	Confident	56 Å²	56	63.6 Å²	63.6	21%	0.212	35%	0.353	C	S	.	.			trans	-67.7	125.4	173.8	178.6	-111.8	0	0	0	112.4	F271 L274 L617 L635 E636	W255-F271 HydrophobicContact CE3-CD1 4.11Å; W255-F271 HydrophobicContact CE3-CE1 4.13Å; W255-F271 HydrophobicContact CH2-CD1 4.41Å; W255-F271 AromaticContact CH2-CE1 3.62Å; W255-F271 HydrophobicContact CH2-CE1 3.62Å; W255-F271 HydrophobicContact CH2-CZ 4.23Å; W255-F271 AromaticContact CZ3-CD1 3.6Å; W255-F271 HydrophobicContact CZ3-CD1 3.6Å; W255-F271 AromaticContact CZ3-CE1 3.2Å; W255-F271 HydrophobicContact CZ3-CE1 3.2Å; W255-F271 AromaticContact CZ3-CZ 3.97Å; W255-F271 HydrophobicContact CZ3-CZ 3.97Å; W255-L274 HydrophobicContact CB-CD1 4.17Å; W255-L274 HydrophobicContact CE3-CD1 4.22Å; W255-L274 HydrophobicContact CE3-CD2 4.01Å; W255-L274 HydrophobicContact CZ3-CD2 4.25Å; W255-L617 HydrophobicContact CE3-CD2 4.42Å; W255-L617 HydrophobicContact CH2-CB 4.11Å; W255-L617 HydrophobicContact CZ3-CB 4.03Å; W255-L617 HydrophobicContact CZ3-CD2 3.9Å; W255-L635 HydrophobicContact CB-CD1 4.05Å; W255-L635 HydrophobicContact CD2-CB 3.96Å; W255-L635 HydrophobicContact CD2-CD1 3.7Å; W255-L635 HydrophobicContact CD2-CG 4.34Å; W255-L635 HydrophobicContact CE3-CB 4.15Å; W255-L635 HydrophobicContact CE3-CD1 3.6Å; W255-L635 HydrophobicContact CG-CD1 3.91Å; W255-L635 HydrophobicContact CG-CD2 4.41Å; W255-L635 HydrophobicContact CH2-CB 4.03Å; W255-L635 HydrophobicContact CZ2-CB 3.87Å; W255-L635 HydrophobicContact CZ3-CB 4.15Å; W255-L635 HydrophobicContact CZ3-CD1 4.19Å; W255-E636 PolarHBondContact NE1-O 2.9Å
256	T	90.6	Very high	87.6	Confident	58 Å²	58	59.8 Å²	59.8	36%	0.356	35%	0.345	S	S	.	.			trans	-102.3	107.8	174.5	-59.4	0	0	0	0	109.8	G254 R258 V259	G254-T256 PolarHBondContact O-N 3.37Å; T256-R258 VanDerWaalsContact CG2-O 3.29Å; T256-R258 WeakPolarHBondContact CG2-O 3.46Å; T256-R258 PolarHBondContact O-N 2.96Å; T256-V259 HydrophobicContact CG2-CG2 4.26Å
257	K	92.5	Very high	88	Confident	133 Å²	133	58.9 Å²	58.9	58%	0.578	34%	0.341	S	S	*	.	S	Bend	trans	-70	-27.2	-174.4	-168.9	172.7	-175.9	178.6	0	114.3	G637 Y638	K257-G637 CarbonylContact O-C 3.56Å; K257-G637 WeakPolarHBondContact O-CA 3.45Å; K257-Y638 HydrophobicContact CG-CE1 4.46Å; K257-Y638 PolarHBondContact O-N 3.34Å
258	R	94.8	Very high	88.9	Confident	133 Å²	133	58.6 Å²	58.6	50%	0.502	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	115.8	179.4	173	175.6	177.1	157.8	-5.6	108.9	T256 E260 Y638 V640	T256-R258 VanDerWaalsContact CG2-O 3.29Å; T256-R258 WeakPolarHBondContact CG2-O 3.46Å; T256-R258 PolarHBondContact O-N 2.96Å; R258-E260 HydrophobicContact CG-CG 4.34Å; R258-E260 IonicContact CZ-OE1 3.54Å; R258-E260 IonicContact NE-OE1 2.78Å; R258-E260 PolarHBondContact NE-OE1 2.89Å; R258-E260 IonicContact NH2-OE1 3.15Å; R258-E260 PolarHBondContact NH2-OE1 2.87Å; R258-Y638 WeakPolarHBondContact CA-O 3.29Å; R258-Y638 HydrophobicContact CB-CD2 4.39Å; R258-Y638 HydrophobicContact CB-CE2 3.73Å; R258-Y638 HydrophobicContact CG-CD2 4.28Å; R258-Y638 HydrophobicContact CG-CE2 3.57Å; R258-V640 HydrophobicContact CG-CG2 4.31Å
259	V	94.8	Very high	89.7	Confident	18 Å²	18	58.7 Å²	58.7	11%	0.109	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	147.2	168.3	-175.2	0	0	0	0	107.7	T256 I268 L270 Y638 L639 V640	T256-V259 HydrophobicContact CG2-CG2 4.26Å; V259-I268 HydrophobicContact CG1-CD1 3.75Å; V259-L270 HydrophobicContact CB-CD2 4.4Å; V259-L270 HydrophobicContact CG1-CD2 4.24Å; V259-L270 HydrophobicContact CG2-CD2 4.35Å; V259-Y638 PolarHBondContact N-O 2.89Å; V259-L639 HydrophobicContact CB-CD1 3.7Å; V259-L639 HydrophobicContact CG1-CD1 3.62Å; V259-L639 CarbonylContact O-C 3.56Å; V259-L639 WeakPolarHBondContact O-CA 3.36Å; V259-V640 PolarHBondContact O-N 2.76Å
260	E	94.8	Very high	90.6	Very high	93 Å²	93	52.2 Å²	52.2	44%	0.435	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	134.6	178.4	-55.5	-163.5	145.3	0	0	110.1	R258 I268	R258-E260 HydrophobicContact CG-CG 4.34Å; R258-E260 IonicContact CZ-OE1 3.54Å; R258-E260 IonicContact NE-OE1 2.78Å; R258-E260 PolarHBondContact NE-OE1 2.89Å; R258-E260 IonicContact NH2-OE1 3.15Å; R258-E260 PolarHBondContact NH2-OE1 2.87Å; E260-I268 VanDerWaalsContact O-CD1 3.27Å; E260-I268 WeakPolarHBondContact O-CD1 3.23Å
261	Y	94.1	Very high	91.1	Very high	1 Å²	1	49.8 Å²	49.8	0%	0.004	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.5	178	-179.6	-106.4	0	0	0	110.7	S265 G266 I268 Y601 N603 V640 V641 L642	Y261-S265 WeakPolarHBondContact CE2-OG 3.38Å; Y261-G266 WeakPolarHBondContact CE2-O 3.48Å; Y261-G266 PolarHBondContact OH-N 2.81Å; Y261-G266 PolarHBondContact OH-O 3.44Å; Y261-I268 HydrophobicContact CD2-CD1 3.85Å; Y261-I268 HydrophobicContact CD2-CG1 3.96Å; Y261-I268 HydrophobicContact CD2-CG2 4.12Å; Y261-I268 HydrophobicContact CE2-CG2 4.34Å; Y261-I268 HydrophobicContact CG-CD1 4.46Å; Y261-Y601 AromaticContact CD1-CE1 3.67Å; Y261-Y601 HydrophobicContact CD1-CE1 3.67Å; Y261-Y601 AromaticContact CD2-CD1 3.85Å; Y261-Y601 HydrophobicContact CD2-CD1 3.85Å; Y261-Y601 AromaticContact CD2-CE1 3.79Å; Y261-Y601 HydrophobicContact CD2-CE1 3.79Å; Y261-Y601 HydrophobicContact CE1-CE1 4.03Å; Y261-Y601 HydrophobicContact CE2-CD1 4.31Å; Y261-Y601 HydrophobicContact CE2-CE1 4.17Å; Y261-Y601 AromaticContact CG-CD1 3.99Å; Y261-Y601 HydrophobicContact CG-CD1 3.99Å; Y261-Y601 AromaticContact CG-CE1 3.53Å; Y261-Y601 HydrophobicContact CG-CE1 3.53Å; Y261-N603 HydrophobicContact CD1-CB 4.49Å; Y261-N603 HydrophobicContact CE1-CB 3.76Å; Y261-N603 PolarHBondContact OH-O 3.03Å; Y261-V640 PolarHBondContact N-O 3.39Å; Y261-V641 HydrophobicContact CD1-CG1 4.32Å; Y261-L642 WeakPolarHBondContact O-CB 3.48Å; Y261-L642 WeakPolarHBondContact O-CG 3.32Å; Y261-L642 PolarHBondContact O-N 3.34Å
262	T	90.4	Very high	91.3	Very high	83 Å²	83	52.7 Å²	52.7	51%	0.509	31%	0.308	S	S	.	.			trans	-89.5	120.7	170.6	-54.7	0	0	0	0	108.9	G264 S265	T262-G264 PolarHBondContact O-N 3.3Å; T262-S265 VanDerWaalsContact O-CB 3.3Å; T262-S265 WeakPolarHBondContact O-CB 3.43Å; T262-S265 PolarHBondContact O-N 3.1Å; T262-S265 PolarHBondContact O-OG 3.21Å
263	P	86.1	Confident	91.3	Very high	24 Å²	24	54.1 Å²	54.1	16%	0.156	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	133.9	177.8	-29.5	37.5	0	0	0	112.7	A608 L642 P644	P263-A608 HydrophobicContact CB-CB 4.4Å; P263-A608 HydrophobicContact CG-CB 4.33Å; P263-L642 VanDerWaalsContact CG-O 3.24Å; P263-L642 WeakPolarHBondContact CG-O 3.47Å; P263-P644 HydrophobicContact CB-CB 3.88Å; P263-P644 HydrophobicContact CG-CB 3.9Å
264	G	80.4	Confident	91.5	Very high	60 Å²	60	50.9 Å²	50.9	62%	0.619	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	-0.3	-175.4	0	0	0	0	0	115.8	T262 G266	T262-G264 PolarHBondContact O-N 3.3Å; G264-G266 VanDerWaalsContact C-N 3.29Å; G264-G266 PolarHBondContact O-N 2.85Å
265	S	85.4	Confident	91.6	Very high	63 Å²	63	53.1 Å²	53.1	44%	0.441	31%	0.308	S	S	.	.	S	Bend	trans	-76.8	-9.4	175.1	63	0	0	0	0	114.8	Y261 T262	Y261-S265 WeakPolarHBondContact CE2-OG 3.38Å; T262-S265 VanDerWaalsContact O-CB 3.3Å; T262-S265 WeakPolarHBondContact O-CB 3.43Å; T262-S265 PolarHBondContact O-N 3.1Å; T262-S265 PolarHBondContact O-OG 3.21Å
266	G	87.3	Confident	91.6	Very high	33 Å²	33	50.9 Å²	50.9	34%	0.34	30%	0.3	S	S	.	.			trans	94	-125.6	175	0	0	0	0	0	112.7	Y261 G264	Y261-G266 WeakPolarHBondContact CE2-O 3.48Å; Y261-G266 PolarHBondContact OH-N 2.81Å; Y261-G266 PolarHBondContact OH-O 3.44Å; G264-G266 VanDerWaalsContact C-N 3.29Å; G264-G266 PolarHBondContact O-N 2.85Å
267	S	91.8	Very high	91.4	Very high	56 Å²	56	52 Å²	52	39%	0.392	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	134.5	171.7	-58.4	0	0	0	0	110	Y601 R602	S267-Y601 CarbonylContact C-O 3.51Å; S267-Y601 VanDerWaalsContact CA-O 3.29Å; S267-Y601 WeakPolarHBondContact CA-O 3.37Å; S267-R602 WeakPolarHBondContact OG-CB 3.42Å; S267-R602 WeakPolarHBondContact OG-CG 3.41Å
268	I	93.4	Very high	91.1	Very high	29 Å²	29	46.6 Å²	46.6	15%	0.149	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	141.1	176.8	65.2	165.2	0	0	0	111.3	V259 E260 Y261 L270 T600 Y601 L639	V259-I268 HydrophobicContact CG1-CD1 3.75Å; E260-I268 VanDerWaalsContact O-CD1 3.27Å; E260-I268 WeakPolarHBondContact O-CD1 3.23Å; Y261-I268 HydrophobicContact CD2-CD1 3.85Å; Y261-I268 HydrophobicContact CD2-CG1 3.96Å; Y261-I268 HydrophobicContact CD2-CG2 4.12Å; Y261-I268 HydrophobicContact CE2-CG2 4.34Å; Y261-I268 HydrophobicContact CG-CD1 4.46Å; I268-L270 PolarHBondContact O-N 3.28Å; I268-T600 CarbonylContact O-C 3.32Å; I268-T600 WeakPolarHBondContact O-CA 3.43Å; I268-T600 WeakPolarHBondContact O-CB 3.34Å; I268-Y601 HydrophobicContact CG1-CD1 4.4Å; I268-Y601 PolarHBondContact N-O 3.01Å; I268-Y601 PolarHBondContact O-N 2.92Å; I268-L639 HydrophobicContact CD1-CD1 4.24Å
269	P	93.1	Very high	90.4	Very high	63 Å²	63	42 Å²	42	41%	0.409	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	129.3	177.5	29.3	-34.4	0	0	0	110.7	P272	P269-P272 HydrophobicContact CB-CB 4.15Å; P269-P272 HydrophobicContact CB-CG 4.47Å; P269-P272 HydrophobicContact CG-CB 4.2Å; P269-P272 HydrophobicContact CG-CG 4.39Å
270	L	94.5	Very high	89.6	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	31%	0.307	C	S	.	.	S	Bend	trans	-78.4	-34.5	176.3	-72.3	176.4	0	0	0	111.9	V259 I268 P272 L559 V599 L615 L639	V259-L270 HydrophobicContact CB-CD2 4.4Å; V259-L270 HydrophobicContact CG1-CD2 4.24Å; V259-L270 HydrophobicContact CG2-CD2 4.35Å; I268-L270 PolarHBondContact O-N 3.28Å; L270-P272 VanDerWaalsContact C-CD 3.42Å; L270-L559 HydrophobicContact CD1-CD2 3.52Å; L270-V599 HydrophobicContact CD1-CG1 4.4Å; L270-V599 PolarHBondContact N-O 2.8Å; L270-L615 HydrophobicContact CD1-CD2 3.99Å; L270-L615 HydrophobicContact CD2-CD1 3.86Å; L270-L639 HydrophobicContact CD2-CD1 4.23Å
271	F	94.1	Very high	88.7	Confident	3 Å²	3	50.2 Å²	50.2	1%	0.013	31%	0.305	C	S	.	.			trans	-128.7	41.6	-166	-51.5	-46	0	0	0	114.5	W255 S273 L274 V290 V596 V599	W255-F271 HydrophobicContact CE3-CD1 4.11Å; W255-F271 HydrophobicContact CE3-CE1 4.13Å; W255-F271 HydrophobicContact CH2-CD1 4.41Å; W255-F271 AromaticContact CH2-CE1 3.62Å; W255-F271 HydrophobicContact CH2-CE1 3.62Å; W255-F271 HydrophobicContact CH2-CZ 4.23Å; W255-F271 AromaticContact CZ3-CD1 3.6Å; W255-F271 HydrophobicContact CZ3-CD1 3.6Å; W255-F271 AromaticContact CZ3-CE1 3.2Å; W255-F271 HydrophobicContact CZ3-CE1 3.2Å; W255-F271 AromaticContact CZ3-CZ 3.97Å; W255-F271 HydrophobicContact CZ3-CZ 3.97Å; F271-S273 PolarHBondContact O-N 2.93Å; F271-L274 HydrophobicContact CB-CB 3.71Å; F271-L274 HydrophobicContact CB-CD2 3.67Å; F271-L274 HydrophobicContact CB-CG 4.34Å; F271-L274 HydrophobicContact CD1-CD2 3.98Å; F271-L274 HydrophobicContact CD2-CD2 4.34Å; F271-L274 HydrophobicContact CG-CD2 3.73Å; F271-L274 VanDerWaalsContact O-CB 3.3Å; F271-L274 WeakPolarHBondContact O-CB 3.14Å; F271-L274 PolarHBondContact O-N 3.48Å; F271-V290 HydrophobicContact CE2-CB 4.5Å; F271-V290 HydrophobicContact CE2-CG1 3.79Å; F271-V290 HydrophobicContact CE2-CG2 3.81Å; F271-V290 HydrophobicContact CZ-CG1 3.95Å; F271-V596 HydrophobicContact CB-CG1 4.23Å; F271-V596 HydrophobicContact CD2-CG1 4.14Å; F271-V599 HydrophobicContact CD2-CB 4.08Å; F271-V599 HydrophobicContact CD2-CG1 4.4Å; F271-V599 HydrophobicContact CE2-CB 4.36Å; F271-V599 HydrophobicContact CE2-CG1 4.18Å
272	P	92.3	Very high	88.1	Confident	76 Å²	76	54.9 Å²	54.9	49%	0.494	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-15.8	-166.1	28.2	-37.4	0	0	0	115.7	P269 L270	P269-P272 HydrophobicContact CB-CB 4.15Å; P269-P272 HydrophobicContact CB-CG 4.47Å; P269-P272 HydrophobicContact CG-CB 4.2Å; P269-P272 HydrophobicContact CG-CG 4.39Å; L270-P272 VanDerWaalsContact C-CD 3.42Å
273	S	92.8	Very high	87.9	Confident	58 Å²	58	51.6 Å²	51.6	41%	0.406	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	3.8	177.7	62.8	0	0	0	0	113.8	G254 F271 H275	G254-S273 PolarHBondContact O-OG 2.91Å; F271-S273 PolarHBondContact O-N 2.93Å; S273-H275 PolarHBondContact O-ND1 3.19Å
274	L	94.4	Very high	87.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	33%	0.326	C	S	.	.			trans	-78.3	130.1	-170	-168.7	59.7	0	0	0	111.4	W252 I253 W255 F271 V596 Q597 L617	W252-L274 HydrophobicContact CB-CD1 3.94Å; W252-L274 HydrophobicContact CD2-CD1 4.23Å; W252-L274 HydrophobicContact CD2-CD2 4.49Å; W252-L274 HydrophobicContact CD2-CG 4.25Å; W252-L274 HydrophobicContact CE3-CD1 3.8Å; W252-L274 HydrophobicContact CE3-CD2 4.16Å; W252-L274 HydrophobicContact CE3-CG 3.55Å; W252-L274 HydrophobicContact CG-CD1 4.33Å; W252-L274 HydrophobicContact CZ3-CD2 4.45Å; W252-L274 HydrophobicContact CZ3-CG 3.95Å; I253-L274 CarbonylContact O-C 3.53Å; I253-L274 WeakPolarHBondContact O-CA 3.24Å; I253-L274 WeakPolarHBondContact O-CD1 3.34Å; W255-L274 HydrophobicContact CB-CD1 4.17Å; W255-L274 HydrophobicContact CE3-CD1 4.22Å; W255-L274 HydrophobicContact CE3-CD2 4.01Å; W255-L274 HydrophobicContact CZ3-CD2 4.25Å; F271-L274 HydrophobicContact CB-CB 3.71Å; F271-L274 HydrophobicContact CB-CD2 3.67Å; F271-L274 HydrophobicContact CB-CG 4.34Å; F271-L274 HydrophobicContact CD1-CD2 3.98Å; F271-L274 HydrophobicContact CD2-CD2 4.34Å; F271-L274 HydrophobicContact CG-CD2 3.73Å; F271-L274 VanDerWaalsContact O-CB 3.3Å; F271-L274 WeakPolarHBondContact O-CB 3.14Å; F271-L274 PolarHBondContact O-N 3.48Å; L274-V596 HydrophobicContact CD2-CG1 3.73Å; L274-V596 HydrophobicContact CG-CG1 4.28Å; L274-Q597 WeakPolarHBondContact O-CG 3.35Å; L274-Q597 PolarHBondContact O-NE2 2.9Å; L274-L617 HydrophobicContact CD2-CD2 3.57Å
275	H	93.5	Very high	88.4	Confident	76 Å²	76	53.4 Å²	53.4	35%	0.352	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	145.3	177.2	54.8	-76	0	0	0	111.6	I253 S273 N593	I253-H275 PolarHBondContact N-O 2.88Å; I253-H275 PolarHBondContact O-N 3.3Å; I253-H275 PolarHBondContact O-ND1 2.04Å; S273-H275 PolarHBondContact O-ND1 3.19Å; H275-N593 WeakPolarHBondContact CA-OD1 3.46Å
276	L	91.6	Very high	88.7	Confident	8 Å²	8	50.4 Å²	50.4	4%	0.042	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	126	178.6	178.4	63.4	0	0	0	110.3	W252 T278 I286 N593 L621 L632	W252-L276 HydrophobicContact CD2-CB 4.43Å; W252-L276 HydrophobicContact CD2-CD1 4.5Å; W252-L276 HydrophobicContact CE3-CB 3.97Å; W252-L276 HydrophobicContact CH2-CB 3.94Å; W252-L276 HydrophobicContact CZ2-CB 4.41Å; W252-L276 HydrophobicContact CZ3-CB 3.72Å; L276-T278 HydrophobicContact CD2-CG2 4.2Å; L276-T278 HydrophobicContact CG-CG2 4.09Å; L276-I286 HydrophobicContact CD2-CG2 4.22Å; L276-N593 PolarHBondContact N-OD1 2.82Å; L276-L621 HydrophobicContact CD2-CD2 3.92Å; L276-L632 HydrophobicContact CD1-CD1 3.72Å
277	E	88.4	Confident	89	Confident	83 Å²	83	51.7 Å²	51.7	39%	0.388	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.7	169.1	-175.1	173.5	-114.7	0	0	109.4	C248 P250 G251 I253	C248-E277 PolarHBondContact SG-OE2 2.87Å; P250-E277 CarbonylContact C-O 3.59Å; P250-E277 VanDerWaalsContact CA-O 3.26Å; P250-E277 WeakPolarHBondContact CA-O 3.47Å; G251-E277 PolarHBondContact N-O 2.77Å; G251-E277 PolarHBondContact O-N 3.07Å; I253-E277 HydrophobicContact CD1-CB 3.77Å; I253-E277 HydrophobicContact CD1-CG 4.41Å; I253-E277 HydrophobicContact CG1-CB 4.49Å
278	T	84.6	Confident	89.1	Confident	18 Å²	18	49.1 Å²	49.1	11%	0.11	26%	0.257	C	S	.	.			trans	-110	3	-177.1	65.3	0	0	0	0	114.3	L276 E280 E281 V283 I589	L276-T278 HydrophobicContact CD2-CG2 4.2Å; L276-T278 HydrophobicContact CG-CG2 4.09Å; T278-E280 PolarHBondContact O-N 3.08Å; T278-E281 WeakPolarHBondContact O-CB 3.45Å; T278-E281 PolarHBondContact O-N 3.04Å; T278-E281 VanDerWaalsContact O-N 3.14Å; T278-E281 PolarHBondContact OG1-O 2.81Å; T278-E281 VanDerWaalsContact OG1-O 3.07Å; T278-V283 HydrophobicContact CG2-CG2 3.98Å; T278-I589 HydrophobicContact CG2-CD1 3.87Å
279	C	81.5	Confident	89.3	Confident	37 Å²	37	48.9 Å²	48.9	25%	0.25	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	48.7	174.3	-56	0	0	0	0	115.1	C248 K249 P250 E281	C248-C279 HydrophobicContact CB-CB 3.73Å; C248-C279 WeakPolarHBondContact CB-SG 3.24Å; C248-C279 WeakPolarHBondContact SG-CA 3.23Å; C248-C279 WeakPolarHBondContact SG-CB 3.43Å; C248-C279 CovalentContact SG-SG 2.03Å; C248-C279 PolarHBondContact SG-SG 3.07Å; K249-C279 VanDerWaalsContact C-SG 3.57Å; K249-C279 PolarHBondContact N-SG 2.92Å; P250-C279 VanDerWaalsContact N-SG 3.42Å; C279-E281 PolarHBondContact O-N 2.74Å
280	E	76.4	Confident	89.4	Confident	200 Å²	200	46 Å²	46	94%	0.935	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.1	2	-179.5	-52	179.4	177.6	0	0	115.2	T278	T278-E280 PolarHBondContact O-N 3.08Å
281	E	77.6	Confident	89.5	Confident	84 Å²	84	48.8 Å²	48.8	39%	0.393	25%	0.251	S	S	.	.			trans	-77.8	142	169.9	-68.4	-168	-150.7	0	0	113	T278 C279 L630	T278-E281 WeakPolarHBondContact O-CB 3.45Å; T278-E281 PolarHBondContact O-N 3.04Å; T278-E281 VanDerWaalsContact O-N 3.14Å; T278-E281 PolarHBondContact OG1-O 2.81Å; T278-E281 VanDerWaalsContact OG1-O 3.07Å; C279-E281 PolarHBondContact O-N 2.74Å; E281-L630 HydrophobicContact CB-CD1 4.19Å; E281-L630 WeakPolarHBondContact OE2-CG 3.07Å
282	T	81	Confident	89.5	Confident	98 Å²	98	48.9 Å²	48.9	60%	0.601	25%	0.252	S	S	*	.			trans	-97.2	111.3	-178	50	0	0	0	0	112.6	C623	T282-C623 WeakPolarHBondContact O-CB 3.37Å
283	V	85.3	Confident	89.4	Confident	15 Å²	15	49 Å²	49	9%	0.091	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	147.4	176.3	-168.2	0	0	0	0	109.2	T278 N285 I286 L621 R622	T278-V283 HydrophobicContact CG2-CG2 3.98Å; V283-N285 WeakPolarHBondContact CG1-O 3.46Å; V283-I286 HydrophobicContact CB-CG1 4.49Å; V283-I286 HydrophobicContact CG1-CG1 3.8Å; V283-L621 HydrophobicContact CG1-CB 4.12Å; V283-L621 HydrophobicContact CG1-CD2 4.25Å; V283-L621 HydrophobicContact CG2-CD1 4.34Å; V283-R622 VanDerWaalsContact CG1-O 3.24Å; V283-R622 WeakPolarHBondContact CG1-O 3.46Å
284	W	86.3	Confident	89	Confident	113 Å²	113	46.6 Å²	46.6	43%	0.428	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	-14.6	173.2	67.3	-94.2	0	0	0	114	D587 R622 C623 F624	W284-D587 WeakPolarHBondContact O-CB 3.37Å; W284-R622 HydrophobicContact CD2-CB 4.41Å; W284-R622 HydrophobicContact CZ2-CB 3.78Å; W284-R622 HydrophobicContact CZ2-CG 4.39Å; W284-R622 PolarHBondContact N-O 3.34Å; W284-C623 VanDerWaalsContact CD1-O 3.26Å; W284-C623 PolarHBondContact NE1-O 3.22Å; W284-F624 HydrophobicContact CB-CD2 4.43Å; W284-F624 HydrophobicContact CB-CE1 3.97Å; W284-F624 HydrophobicContact CB-CE2 3.82Å; W284-F624 HydrophobicContact CB-CZ 3.57Å; W284-F624 HydrophobicContact CG-CE1 4.37Å; W284-F624 HydrophobicContact CG-CZ 4.4Å
285	N	90	Very high	88	Confident	9 Å²	9	48.6 Å²	48.6	5%	0.048	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	123.3	175.4	179	-121.7	0	0	0	109.3	V283 E585 G586 R622	V283-N285 WeakPolarHBondContact CG1-O 3.46Å; N285-E585 WeakPolarHBondContact ND2-CG 3.43Å; N285-E585 PolarHBondContact ND2-OE1 2.92Å; N285-G586 WeakPolarHBondContact CA-O 3.38Å; N285-R622 HydrophobicContact CB-CB 4.19Å; N285-R622 HydrophobicContact CB-CG 4.47Å; N285-R622 PolarHBondContact N-O 3.03Å; N285-R622 PolarHBondContact O-N 3.1Å; N285-R622 WeakPolarHBondContact OD1-CD 3.2Å; N285-R622 PolarHBondContact OD1-NH1 2.86Å
286	I	91.9	Very high	87.1	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.1	179.5	-50.2	166.7	0	0	0	105.7	L276 V283 E585 G586 I589 F592 T619 L621	L276-I286 HydrophobicContact CD2-CG2 4.22Å; V283-I286 HydrophobicContact CB-CG1 4.49Å; V283-I286 HydrophobicContact CG1-CG1 3.8Å; I286-E585 WeakPolarHBondContact O-CA 3.38Å; I286-G586 PolarHBondContact N-O 3.02Å; I286-G586 PolarHBondContact O-N 2.91Å; I286-I589 HydrophobicContact CD1-CB 4.29Å; I286-I589 HydrophobicContact CD1-CG1 3.72Å; I286-F592 HydrophobicContact CB-CD1 4.41Å; I286-F592 HydrophobicContact CB-CD2 3.87Å; I286-F592 HydrophobicContact CB-CE1 4.48Å; I286-F592 HydrophobicContact CB-CE2 3.95Å; I286-F592 HydrophobicContact CB-CG 4.11Å; I286-F592 HydrophobicContact CB-CZ 4.26Å; I286-F592 HydrophobicContact CD1-CB 3.92Å; I286-F592 HydrophobicContact CD1-CD1 4.49Å; I286-F592 HydrophobicContact CD1-CD2 4.47Å; I286-F592 HydrophobicContact CD1-CG 4.04Å; I286-F592 HydrophobicContact CG2-CD1 3.61Å; I286-F592 HydrophobicContact CG2-CD2 3.85Å; I286-F592 HydrophobicContact CG2-CE1 3.44Å; I286-F592 VanDerWaalsContact CG2-CE1 3.44Å; I286-F592 HydrophobicContact CG2-CE2 3.7Å; I286-F592 HydrophobicContact CG2-CG 3.81Å; I286-F592 HydrophobicContact CG2-CZ 3.49Å; I286-F592 VanDerWaalsContact CG2-CZ 3.49Å; I286-F592 WeakPolarHBondContact O-CE2 3.34Å; I286-T619 HydrophobicContact CG2-CG2 4.42Å; I286-L621 HydrophobicContact CB-CD2 4.26Å; I286-L621 HydrophobicContact CG1-CD2 4.21Å; I286-L621 HydrophobicContact CG2-CD2 3.71Å
287	Q	94.1	Very high	86.3	Confident	60 Å²	60	50 Å²	50	28%	0.28	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.3	172.4	-176.6	-175	-2	0	0	108.8	V583 L584 T619 S620	Q287-V583 HydrophobicContact CG-CG1 3.96Å; Q287-L584 CarbonylContact C-O 3.53Å; Q287-L584 VanDerWaalsContact CA-O 3.32Å; Q287-L584 WeakPolarHBondContact CA-O 3.48Å; Q287-T619 CarbonylContact O-C 3.53Å; Q287-T619 VanDerWaalsContact O-CA 3.29Å; Q287-T619 WeakPolarHBondContact O-CA 3.13Å; Q287-T619 WeakPolarHBondContact O-CG2 3.44Å; Q287-S620 PolarHBondContact N-O 2.66Å; Q287-S620 PolarHBondContact O-N 2.89Å
288	A	94.9	Very high	85.7	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.008	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	141	172.1	0	0	0	0	0	111.3	V583 L584 F592 L617 T618 T619	A288-V583 CarbonylContact O-C 3.56Å; A288-V583 WeakPolarHBondContact O-CA 3.23Å; A288-L584 PolarHBondContact N-O 3.47Å; A288-L584 PolarHBondContact O-N 3.1Å; A288-F592 HydrophobicContact CB-CE1 4.03Å; A288-F592 HydrophobicContact CB-CZ 3.6Å; A288-L617 HydrophobicContact CB-CD1 3.91Å; A288-T618 CarbonylContact C-O 3.59Å; A288-T618 VanDerWaalsContact CA-O 3.24Å; A288-T618 WeakPolarHBondContact CA-O 3.37Å; A288-T618 WeakPolarHBondContact CB-O 3.47Å; A288-T619 HydrophobicContact CB-CG2 4.15Å
289	T	96.7	Very high	85.5	Confident	24 Å²	24	46.1 Å²	46.1	15%	0.147	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.2	175.5	-54.9	0	0	0	0	109.1	E291 V581 L582 V583 L617 T618	T289-E291 HydrophobicContact CG2-CG 4.12Å; T289-V581 HydrophobicContact CG2-CG1 3.57Å; T289-L582 WeakPolarHBondContact CA-O 3.44Å; T289-V583 HydrophobicContact CG2-CG2 3.98Å; T289-L617 WeakPolarHBondContact O-CA 3.28Å; T289-T618 WeakPolarHBondContact CB-OG1 3.38Å; T289-T618 PolarHBondContact N-O 2.85Å; T289-T618 PolarHBondContact O-N 2.86Å; T289-T618 PolarHBondContact O-OG1 3.32Å
290	V	96.4	Very high	85.4	Confident	2 Å²	2	45.3 Å²	45.3	1%	0.012	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125.7	170.7	-173.9	0	0	0	0	107.8	F271 L559 V581 L582 V599 K616 L617	F271-V290 HydrophobicContact CE2-CB 4.5Å; F271-V290 HydrophobicContact CE2-CG1 3.79Å; F271-V290 HydrophobicContact CE2-CG2 3.81Å; F271-V290 HydrophobicContact CZ-CG1 3.95Å; V290-L559 HydrophobicContact CB-CD1 4.04Å; V290-L559 HydrophobicContact CG1-CD1 3.72Å; V290-L559 HydrophobicContact CG1-CD2 4.01Å; V290-L559 WeakPolarHBondContact O-CD1 3.02Å; V290-V581 WeakPolarHBondContact O-CA 3.31Å; V290-L582 HydrophobicContact CB-CB 4.5Å; V290-L582 HydrophobicContact CG2-CD2 4.46Å; V290-L582 PolarHBondContact N-O 2.85Å; V290-L582 PolarHBondContact O-N 3.15Å; V290-V599 HydrophobicContact CG1-CG1 4.49Å; V290-V599 HydrophobicContact CG2-CG1 4.4Å; V290-K616 CarbonylContact C-O 3.59Å; V290-K616 WeakPolarHBondContact CA-O 3.1Å; V290-L617 HydrophobicContact CG2-CD1 4.1Å
291	E	95.1	Very high	85.7	Confident	60 Å²	60	35.9 Å²	35.9	28%	0.28	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	128.7	175.3	-52.3	173.5	175.3	0	0	109.8	T289 V581 L615 K616	T289-E291 HydrophobicContact CG2-CG 4.12Å; E291-V581 HydrophobicContact CG-CG1 4.49Å; E291-V581 HydrophobicContact CG-CG2 4.39Å; E291-L615 WeakPolarHBondContact O-CA 3.23Å; E291-K616 HydrophobicContact CB-CB 4.23Å; E291-K616 PolarHBondContact N-O 2.8Å; E291-K616 PolarHBondContact O-N 2.73Å
292	L	94.3	Very high	86	Confident	4 Å²	4	31.9 Å²	31.9	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	109.4	171.1	-178.3	76.5	0	0	0	108	T294 E557 L559 S580 Y601 R613 L615	L292-T294 HydrophobicContact CD2-CG2 3.69Å; L292-T294 HydrophobicContact CG-CG2 3.78Å; L292-T294 PolarHBondContact O-N 2.98Å; L292-E557 HydrophobicContact CD2-CG 4.22Å; L292-L559 HydrophobicContact CB-CD1 4.15Å; L292-L559 HydrophobicContact CB-CD2 4.07Å; L292-L559 HydrophobicContact CB-CG 3.95Å; L292-S580 PolarHBondContact N-O 3.1Å; L292-Y601 HydrophobicContact CD1-CD2 4.14Å; L292-Y601 HydrophobicContact CD1-CE2 4.38Å; L292-Y601 HydrophobicContact CD2-CD2 3.91Å; L292-Y601 HydrophobicContact CD2-CE2 3.96Å; L292-R613 HydrophobicContact CD1-CB 3.66Å; L292-R613 HydrophobicContact CD1-CG 4.22Å; L292-R613 HydrophobicContact CG-CB 4.36Å; L292-L615 HydrophobicContact CB-CD2 4.43Å; L292-L615 HydrophobicContact CD1-CD2 3.56Å; L292-L615 HydrophobicContact CD1-CG 4.37Å
293	Q	89.6	Confident	86	Confident	79 Å²	79	28.1 Å²	28.1	37%	0.369	15%	0.149	S	C	.	.			trans	-82.8	84.6	-171.8	-59.8	-157.9	-44.3	0	0	112.3	H296 P614	Q293-H296 PolarHBondContact O-CE1 2.87Å; Q293-H296 PolarHBondContact O-ND1 3.28Å; Q293-P614 HydrophobicContact CB-CB 3.96Å; Q293-P614 HydrophobicContact CB-CG 4.07Å; Q293-P614 HydrophobicContact CG-CB 4.19Å; Q293-P614 PolarHBondContact N-O 2.74Å
294	T	85.8	Confident	85.4	Confident	8 Å²	8	28.9 Å²	28.9	5%	0.049	15%	0.152	C	C	.	.			trans	-94.1	-4.4	-176.3	50.9	0	0	0	0	115.4	L292 H296 I297 G300 E557	L292-T294 HydrophobicContact CD2-CG2 3.69Å; L292-T294 HydrophobicContact CG-CG2 3.78Å; L292-T294 PolarHBondContact O-N 2.98Å; T294-H296 PolarHBondContact O-N 2.88Å; T294-I297 VanDerWaalsContact O-CD1 3.3Å; T294-I297 WeakPolarHBondContact O-CD1 3.15Å; T294-I297 PolarHBondContact O-N 3.41Å; T294-G300 VanDerWaalsContact CB-O 3.26Å; T294-G300 WeakPolarHBondContact CB-O 3.41Å; T294-G300 PolarHBondContact OG1-O 2.91Å; T294-E557 HydrophobicContact CG2-CG 4.46Å; T294-E557 WeakPolarHBondContact CG2-OE2 3.46Å
295	G	73.9	Confident	84.9	Confident	42 Å²	42	23.7 Å²	23.7	43%	0.433	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-5	-176	0	0	0	0	0	116.7
296	H	73.9	Confident	84.2	Confident	110 Å²	110	24.6 Å²	24.6	51%	0.509	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	0.5	171	71.4	-89.6	0	0	0	113.5	Q293 T294 V612	Q293-H296 PolarHBondContact O-CE1 2.87Å; Q293-H296 PolarHBondContact O-ND1 3.28Å; T294-H296 PolarHBondContact O-N 2.88Å; H296-V612 PolarHBondContact CE1-O 3.05Å; H296-V612 PolarHBondContact NE2-O 3.11Å
297	I	74.8	Confident	83.5	Confident	4 Å²	4	26.4 Å²	26.4	2%	0.021	15%	0.149	C	C	.	.	S	Bend	trans	-112.2	116.7	174.7	-53.6	93.4	0	0	0	108.9	T294 K299 G300 C301 D302 T609 R613	T294-I297 VanDerWaalsContact O-CD1 3.3Å; T294-I297 WeakPolarHBondContact O-CD1 3.15Å; T294-I297 PolarHBondContact O-N 3.41Å; I297-K299 PolarHBondContact O-N 2.9Å; I297-G300 PolarHBondContact O-N 3.27Å; I297-G300 VanDerWaalsContact O-N 3.15Å; I297-C301 PolarHBondContact O-N 3.06Å; I297-D302 HydrophobicContact CG2-CB 4.15Å; I297-T609 HydrophobicContact CG2-CG2 4.2Å; I297-R613 VanDerWaalsContact CD1-CD 3.44Å; I297-R613 VanDerWaalsContact CD1-NE 3.33Å
298	G	75.7	Confident	82.7	Confident	10 Å²	10	25 Å²	25	10%	0.103	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	49	-130.8	171.1	0	0	0	0	0	113.7	G300 S344 D345	G298-G300 VanDerWaalsContact C-N 3.26Å; G298-G300 PolarHBondContact O-N 2.87Å; G298-S344 PolarHBondContact N-OG 3.27Å; G298-D345 WeakPolarHBondContact CA-OD2 3.21Å
299	K	80.9	Confident	81.9	Confident	9 Å²	9	28.6 Å²	28.6	4%	0.039	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	42.3	180	-51.4	-179.7	-161.7	-178.8	0	112.4	I297 D308 S347 W379 W455 S534	I297-K299 PolarHBondContact O-N 2.9Å; K299-D308 IonicContact NZ-OD1 3.71Å; K299-D308 PolarHBondContact NZ-OD1 3.47Å; K299-D308 IonicContact NZ-OD2 3.01Å; K299-D308 PolarHBondContact NZ-OD2 3Å; K299-S347 WeakPolarHBondContact CE-OG 3.08Å; K299-W379 HydrophobicContact CB-CD2 4.33Å; K299-W379 HydrophobicContact CB-CE3 3.8Å; K299-W379 HydrophobicContact CB-CH2 4.26Å; K299-W379 HydrophobicContact CB-CZ3 3.75Å; K299-W379 HydrophobicContact CD-CB 4.11Å; K299-W379 HydrophobicContact CD-CD2 3.36Å; K299-W379 HydrophobicContact CD-CE3 3.74Å; K299-W379 HydrophobicContact CD-CG 3.53Å; K299-W379 HydrophobicContact CD-CZ2 4.23Å; K299-W379 HydrophobicContact CD-CZ3 4.3Å; K299-W379 HydrophobicContact CG-CD2 4.4Å; K299-W379 HydrophobicContact CG-CE3 4.32Å; K299-W379 VanDerWaalsContact NZ-CD1 3.25Å; K299-W455 HydrophobicContact CB-CB 4.22Å; K299-W455 HydrophobicContact CB-CG 4.21Å; K299-W455 HydrophobicContact CG-CD2 4.46Å; K299-S534 PolarHBondContact NZ-OG 3.35Å
300	G	77.9	Confident	81.1	Confident	19 Å²	19	27.6 Å²	27.6	20%	0.196	15%	0.15	C	C	.	.	S	Bend	trans	101	-7.2	173.7	0	0	0	0	0	116.2	T294 I297 G298	T294-G300 VanDerWaalsContact CB-O 3.26Å; T294-G300 WeakPolarHBondContact CB-O 3.41Å; T294-G300 PolarHBondContact OG1-O 2.91Å; I297-G300 PolarHBondContact O-N 3.27Å; I297-G300 VanDerWaalsContact O-N 3.15Å; G298-G300 VanDerWaalsContact C-N 3.26Å; G298-G300 PolarHBondContact O-N 2.87Å
301	C	84.8	Confident	80.4	Confident	2 Å²	2	28 Å²	28	1%	0.014	15%	0.153	C	C	.	.	S	Bend	trans	-160.1	162.5	174.6	60.3	0	0	0	0	110.4	I297 R303 C555	I297-C301 PolarHBondContact O-N 3.06Å; C301-R303 WeakPolarHBondContact O-CG 3.41Å; C301-R303 PolarHBondContact O-N 2.92Å; C301-R303 PolarHBondContact SG-NH1 2.58Å; C301-R303 VanDerWaalsContact SG-NH1 3.38Å; C301-C555 HydrophobicContact CB-CB 3.71Å; C301-C555 WeakPolarHBondContact CB-SG 3.47Å; C301-C555 WeakPolarHBondContact SG-CB 3.26Å; C301-C555 CovalentContact SG-SG 2.04Å; C301-C555 PolarHBondContact SG-SG 2.89Å
302	D	83.1	Confident	79.8	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.141	C	C	.	.			trans	-66.4	113.8	169.2	-159.8	19.2	0	0	0	109.7	I297 R556 E557 N603 L605 A608 T609 R613	I297-D302 HydrophobicContact CG2-CB 4.15Å; D302-R556 PolarHBondContact O-N 3.08Å; D302-E557 HydrophobicContact CB-CB 3.61Å; D302-E557 HydrophobicContact CB-CG 4.27Å; D302-E557 WeakPolarHBondContact CB-OE2 3.02Å; D302-E557 PolarHBondContact N-OE2 2.77Å; D302-E557 PolarHBondContact O-N 2.78Å; D302-N603 PolarHBondContact OD2-ND2 2.78Å; D302-N603 VanDerWaalsContact OD2-ND2 3.12Å; D302-L605 HydrophobicContact CB-CD1 4.23Å; D302-L605 VanDerWaalsContact CG-CD1 3.45Å; D302-L605 WeakPolarHBondContact OD2-CD1 3.07Å; D302-A608 WeakPolarHBondContact OD2-CA 3.34Å; D302-T609 WeakPolarHBondContact OD1-CB 3.13Å; D302-T609 PolarHBondContact OD1-N 3.17Å; D302-T609 PolarHBondContact OD1-OG1 3.45Å; D302-T609 PolarHBondContact OD2-N 3.36Å; D302-R613 IonicContact OD2-NH2 2.74Å
303	R	81.6	Confident	79.2	Confident	19 Å²	19	28.4 Å²	28.4	7%	0.072	15%	0.152	C	C	.	.			trans	-110.7	168	-178.5	-51.1	-162.4	65.2	63.3	12	110.4	C301 S305 L552 Y553 A554	C301-R303 WeakPolarHBondContact O-CG 3.41Å; C301-R303 PolarHBondContact O-N 2.92Å; C301-R303 PolarHBondContact SG-NH1 2.58Å; C301-R303 VanDerWaalsContact SG-NH1 3.38Å; R303-S305 PolarHBondContact O-N 3.16Å; R303-L552 VanDerWaalsContact NH2-C 3.34Å; R303-L552 PolarHBondContact NH2-O 3.22Å; R303-Y553 PolarHBondContact NH1-O 2.89Å; R303-Y553 PolarHBondContact NH2-O 2.84Å; R303-A554 PolarHBondContact NH1-O 2.84Å; R303-A554 PolarHBondContact NH2-O 3.45Å
304	D	72.9	Confident	78.8	Confident	31 Å²	31	28.6 Å²	28.6	17%	0.166	16%	0.155	C	C	.	.			trans	-53.3	115	167.1	-70.3	-46.4	0	0	0	109.8	Y306 V311 R556 L605	D304-Y306 HydrophobicContact CB-CD2 4.29Å; D304-Y306 PolarHBondContact O-N 2.6Å; D304-V311 HydrophobicContact CB-CG2 4.27Å; D304-R556 VanDerWaalsContact CG-NE 3.33Å; D304-R556 IonicContact OD1-CZ 2.73Å; D304-R556 IonicContact OD1-NE 3.26Å; D304-R556 PolarHBondContact OD1-NE 2.04Å; D304-R556 IonicContact OD1-NH2 2.64Å; D304-R556 IonicContact OD2-CZ 3.3Å; D304-R556 VanDerWaalsContact OD2-CZ 3.23Å; D304-R556 IonicContact OD2-NE 2.79Å; D304-R556 PolarHBondContact OD2-NE 3.5Å; D304-R556 IonicContact OD2-NH2 3.1Å; D304-R556 PolarHBondContact OD2-NH2 3.28Å; D304-L605 VanDerWaalsContact OD1-CD2 3.26Å; D304-L605 WeakPolarHBondContact OD1-CD2 3.4Å
305	S	73.9	Confident	78.9	Confident	4 Å²	4	29.2 Å²	29.2	3%	0.028	16%	0.159	C	C	.	.	S	Bend	trans	-76	36.7	-171.2	-43.5	0	0	0	0	114.3	R303 M788 R791	R303-S305 PolarHBondContact O-N 3.16Å; S305-M788 CarbonylContact O-C 3.57Å; S305-M788 WeakPolarHBondContact O-CA 3.42Å; S305-R791 PolarHBondContact OG-NH1 2.94Å
306	Y	76.6	Confident	79.4	Confident	28 Å²	28	29.7 Å²	29.7	11%	0.11	16%	0.164	C	C	.	.	S	Bend	trans	-103	162.3	174.6	-64.5	-86.7	0	0	0	110.1	D304 L314 T707 D709 A753 E787 M788	D304-Y306 HydrophobicContact CB-CD2 4.29Å; D304-Y306 PolarHBondContact O-N 2.6Å; Y306-L314 HydrophobicContact CD2-CD1 4.07Å; Y306-L314 HydrophobicContact CE2-CD1 4.33Å; Y306-L314 HydrophobicContact CG-CD1 4.49Å; Y306-T707 WeakPolarHBondContact CE1-O 3.44Å; Y306-T707 PolarHBondContact OH-O 2.82Å; Y306-D709 HydrophobicContact CD1-CB 3.94Å; Y306-D709 HydrophobicContact CE1-CB 4.18Å; Y306-A753 HydrophobicContact CD1-CB 4.17Å; Y306-A753 HydrophobicContact CE1-CB 4.44Å; Y306-E787 HydrophobicContact CE1-CG 4.45Å; Y306-M788 HydrophobicContact CD2-CG 4.47Å; Y306-M788 HydrophobicContact CE1-CG 4.19Å; Y306-M788 HydrophobicContact CE2-CG 4Å
307	S	76.3	Confident	79.9	Confident	39 Å²	39	25.4 Å²	25.4	27%	0.273	15%	0.148	S	C	.	.			trans	-56.2	144.9	171.7	47.8	0	0	0	0	111.9	R309 S310 V311	S307-R309 PolarHBondContact O-N 2.89Å; S307-S310 WeakPolarHBondContact O-CA 3.38Å; S307-S310 VanDerWaalsContact O-CB 3.28Å; S307-S310 WeakPolarHBondContact O-CB 3.47Å; S307-S310 PolarHBondContact O-N 3.27Å; S307-S310 WeakPolarHBondContact OG-CB 3.35Å; S307-S310 PolarHBondContact OG-OG 3.4Å; S307-V311 PolarHBondContact O-N 2.61Å
308	D	77.9	Confident	80.1	Confident	30 Å²	30	29.5 Å²	29.5	16%	0.16	17%	0.173	C	C	.	.	H	α-helix	trans	-50.6	-39.2	-177.2	-70.8	-80.2	0	0	0	112.6	K299 S310 V311 R312 W379	K299-D308 IonicContact NZ-OD1 3.71Å; K299-D308 PolarHBondContact NZ-OD1 3.47Å; K299-D308 IonicContact NZ-OD2 3.01Å; K299-D308 PolarHBondContact NZ-OD2 3Å; D308-S310 VanDerWaalsContact C-N 3.33Å; D308-S310 PolarHBondContact O-N 3.21Å; D308-V311 PolarHBondContact O-N 2.93Å; D308-R312 WeakPolarHBondContact O-CG 3.31Å; D308-R312 PolarHBondContact O-N 3.01Å; D308-R312 VanDerWaalsContact O-N 3.11Å; D308-W379 PolarHBondContact OD1-NE1 3.4Å
309	R	77.6	Confident	80	Confident	77 Å²	77	36.5 Å²	36.5	29%	0.291	20%	0.196	S	C	.	.	H	α-helix	trans	-63.5	-34.2	175.9	-162.6	179.6	-179	-152.2	-6.9	113.7	S307 R313 E321 D740	S307-R309 PolarHBondContact O-N 2.89Å; R309-R313 VanDerWaalsContact CZ-NH2 3.33Å; R309-E321 WeakPolarHBondContact CG-OE1 3.45Å; R309-E321 IonicContact NE-OE1 3.27Å; R309-D740 IonicContact CZ-OD1 2.76Å; R309-D740 IonicContact CZ-OD2 3.42Å; R309-D740 VanDerWaalsContact CZ-OD2 3.31Å; R309-D740 IonicContact NH1-OD1 3.78Å; R309-D740 PolarHBondContact NH1-OD1 2.82Å; R309-D740 IonicContact NH1-OD2 2.67Å; R309-D740 PolarHBondContact NH1-OD2 2.96Å; R309-D740 IonicContact NH2-OD1 2.81Å; R309-D740 PolarHBondContact NH2-OD1 2.96Å; R309-D740 IonicContact NH2-OD2 3.36Å; R309-D740 PolarHBondContact NH2-OD2 2.89Å
310	S	80.1	Confident	79.9	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.014	22%	0.218	C	C	.	.	H	α-helix	trans	-75.5	-42.5	175.2	-68.4	0	0	0	0	111.6	S307 D308 R312 R313 L314 A753	S307-S310 WeakPolarHBondContact O-CA 3.38Å; S307-S310 VanDerWaalsContact O-CB 3.28Å; S307-S310 WeakPolarHBondContact O-CB 3.47Å; S307-S310 PolarHBondContact O-N 3.27Å; S307-S310 WeakPolarHBondContact OG-CB 3.35Å; S307-S310 PolarHBondContact OG-OG 3.4Å; D308-S310 VanDerWaalsContact C-N 3.33Å; D308-S310 PolarHBondContact O-N 3.21Å; S310-R312 PolarHBondContact O-N 2.8Å; S310-R313 PolarHBondContact O-N 2.88Å; S310-R313 VanDerWaalsContact O-N 3.08Å; S310-L314 WeakPolarHBondContact O-CG 3.4Å; S310-L314 PolarHBondContact O-N 3.25Å; S310-L314 VanDerWaalsContact O-N 3.08Å; S310-A753 PolarHBondContact OG-N 3.17Å
311	V	82.3	Confident	80.2	Confident	11 Å²	11	39 Å²	39	7%	0.067	22%	0.215	C	C	.	.	H	α-helix	trans	-57.5	-37.6	175.2	-179.8	0	0	0	0	111	D304 S307 D308 L314 C315 L552	D304-V311 HydrophobicContact CB-CG2 4.27Å; S307-V311 PolarHBondContact O-N 2.61Å; D308-V311 PolarHBondContact O-N 2.93Å; V311-L314 PolarHBondContact O-N 2.95Å; V311-C315 WeakPolarHBondContact O-CB 3.5Å; V311-C315 PolarHBondContact O-N 2.84Å; V311-C315 PolarHBondContact O-SG 2.82Å; V311-C315 VanDerWaalsContact O-SG 3.36Å; V311-L552 HydrophobicContact CG1-CD2 4.12Å
312	R	82.4	Confident	80.3	Confident	10 Å²	10	40 Å²	40	4%	0.038	22%	0.222	C	C	.	.	H	α-helix	trans	-59.1	-45.7	172.6	-76.6	179.8	-176.3	161	6.7	114.6	D308 S310 L314 C315 G316 A317 E321 Q377 T537 L552	D308-R312 WeakPolarHBondContact O-CG 3.31Å; D308-R312 PolarHBondContact O-N 3.01Å; D308-R312 VanDerWaalsContact O-N 3.11Å; S310-R312 PolarHBondContact O-N 2.8Å; R312-L314 VanDerWaalsContact C-N 3.3Å; R312-L314 PolarHBondContact O-N 2.91Å; R312-C315 CarbonylContact O-C 3.6Å; R312-C315 PolarHBondContact O-N 3.33Å; R312-G316 PolarHBondContact O-N 3.28Å; R312-G316 VanDerWaalsContact O-N 3.17Å; R312-A317 HydrophobicContact CB-CB 3.84Å; R312-A317 WeakPolarHBondContact O-CB 3.34Å; R312-A317 PolarHBondContact O-N 3.34Å; R312-E321 WeakPolarHBondContact CD-OE2 3.16Å; R312-E321 IonicContact CZ-OE2 2.68Å; R312-E321 IonicContact NE-OE2 2.83Å; R312-E321 IonicContact NH1-OE2 3.63Å; R312-E321 PolarHBondContact NH1-OE2 3.43Å; R312-Q377 VanDerWaalsContact CZ-OE1 3.26Å; R312-Q377 VanDerWaalsContact NE-OE1 3.11Å; R312-Q377 VanDerWaalsContact NH2-OE1 3.08Å; R312-T537 VanDerWaalsContact NH1-CB 3.34Å; R312-T537 PolarHBondContact NH1-OG1 2.9Å; R312-T537 PolarHBondContact NH2-OG1 3.06Å; R312-L552 HydrophobicContact CB-CD2 4.35Å; R312-L552 HydrophobicContact CG-CD1 3.92Å; R312-L552 HydrophobicContact CG-CD2 3.38Å; R312-L552 HydrophobicContact CG-CG 4.18Å
313	R	80.7	Confident	80.5	Confident	62 Å²	62	42 Å²	42	23%	0.234	23%	0.232	C	C	.	.	H	α-helix	trans	-61.8	-42.5	177.3	-66	175.3	-174.5	169.5	2	110.3	R309 S310 C315 G316 G738 D740	R309-R313 VanDerWaalsContact CZ-NH2 3.33Å; S310-R313 PolarHBondContact O-N 2.88Å; S310-R313 VanDerWaalsContact O-N 3.08Å; R313-C315 VanDerWaalsContact C-N 3.32Å; R313-C315 PolarHBondContact O-N 3.03Å; R313-G316 PolarHBondContact O-N 2.98Å; R313-G738 PolarHBondContact NH1-O 3.44Å; R313-D740 IonicContact CZ-OD2 3.46Å; R313-D740 IonicContact NH1-OD2 2.85Å; R313-D740 PolarHBondContact NH1-OD2 3.01Å; R313-D740 VanDerWaalsContact NH1-OD2 3.17Å; R313-D740 IonicContact NH2-OD2 2.7Å; R313-D740 PolarHBondContact NH2-OD2 3.1Å
314	L	82.5	Confident	80.9	Confident	83 Å²	83	41 Å²	41	44%	0.435	23%	0.229	S	C	.	.	H	α-helix	trans	-64.3	-33.5	174.5	-63.1	172.9	0	0	0	113	Y306 S310 V311 R312 G316 T707 A753	Y306-L314 HydrophobicContact CD2-CD1 4.07Å; Y306-L314 HydrophobicContact CE2-CD1 4.33Å; Y306-L314 HydrophobicContact CG-CD1 4.49Å; S310-L314 WeakPolarHBondContact O-CG 3.4Å; S310-L314 PolarHBondContact O-N 3.25Å; S310-L314 VanDerWaalsContact O-N 3.08Å; V311-L314 PolarHBondContact O-N 2.95Å; R312-L314 VanDerWaalsContact C-N 3.3Å; R312-L314 PolarHBondContact O-N 2.91Å; L314-G316 PolarHBondContact O-N 3.33Å; L314-T707 HydrophobicContact CD2-CG2 4.39Å; L314-A753 HydrophobicContact CD1-CB 4.3Å; L314-A753 HydrophobicContact CG-CB 4.39Å
315	C	86.5	Confident	81.8	Confident	21 Å²	21	39.9 Å²	39.9	14%	0.142	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-3.9	171.6	-71.6	0	0	0	0	114.5	V311 R312 R313 V548 C551	V311-C315 WeakPolarHBondContact O-CB 3.5Å; V311-C315 PolarHBondContact O-N 2.84Å; V311-C315 PolarHBondContact O-SG 2.82Å; V311-C315 VanDerWaalsContact O-SG 3.36Å; R312-C315 CarbonylContact O-C 3.6Å; R312-C315 PolarHBondContact O-N 3.33Å; R313-C315 VanDerWaalsContact C-N 3.32Å; R313-C315 PolarHBondContact O-N 3.03Å; C315-V548 HydrophobicContact CB-CG1 4.33Å; C315-C551 WeakPolarHBondContact CA-SG 3.2Å; C315-C551 HydrophobicContact CB-CB 3.67Å; C315-C551 WeakPolarHBondContact CB-SG 3.3Å; C315-C551 WeakPolarHBondContact SG-CB 3.45Å; C315-C551 CovalentContact SG-SG 2.04Å; C315-C551 PolarHBondContact SG-SG 3.45Å
316	G	85.1	Confident	82.4	Confident	52 Å²	52	40.7 Å²	40.7	54%	0.536	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	20.1	-179.8	0	0	0	0	0	115.4	R312 R313 L314	R312-G316 PolarHBondContact O-N 3.28Å; R312-G316 VanDerWaalsContact O-N 3.17Å; R313-G316 PolarHBondContact O-N 2.98Å; L314-G316 PolarHBondContact O-N 3.33Å
317	A	83.8	Confident	82.7	Confident	20 Å²	20	43 Å²	43	17%	0.165	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-60.9	144.8	174.3	0	0	0	0	0	111.9	R312 V548	R312-A317 HydrophobicContact CB-CB 3.84Å; R312-A317 WeakPolarHBondContact O-CB 3.34Å; R312-A317 PolarHBondContact O-N 3.34Å; A317-V548 HydrophobicContact CB-CG1 3.94Å
318	V	79	Confident	83.1	Confident	90 Å²	90	44 Å²	44	55%	0.545	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-87	141.8	-179.1	-176.5	0	0	0	0	110.4
319	R	75.3	Confident	83.1	Confident	157 Å²	157	44.1 Å²	44.1	59%	0.592	26%	0.255	S	S	*	.	S	Bend	trans	-59.1	149.5	179.3	-57.8	-176.6	-171.2	165.4	5.9	111.9	R735 E736 G738	R319-R735 PolarHBondContact NH1-O 2.86Å; R319-E736 VanDerWaalsContact CZ-O 3.27Å; R319-E736 PolarHBondContact NH1-O 2.95Å; R319-E736 PolarHBondContact NH2-O 3Å; R319-G738 VanDerWaalsContact CZ-CA 3.46Å
320	G	78.5	Confident	83	Confident	48 Å²	48	46 Å²	46	50%	0.495	28%	0.277	S	S	.	.			trans	125.6	-4	-178.5	0	0	0	0	0	114.3	P540	G320-P540 WeakPolarHBondContact O-CD 3.37Å
321	E	83.3	Confident	82.7	Confident	32 Å²	32	49.9 Å²	49.9	15%	0.15	31%	0.309	C	S	.	.			trans	-61.4	148.1	170.5	70	-173.9	159.8	0	0	112.8	R309 R312	R309-E321 WeakPolarHBondContact CG-OE1 3.45Å; R309-E321 IonicContact NE-OE1 3.27Å; R312-E321 WeakPolarHBondContact CD-OE2 3.16Å; R312-E321 IonicContact CZ-OE2 2.68Å; R312-E321 IonicContact NE-OE2 2.83Å; R312-E321 IonicContact NH1-OE2 3.63Å; R312-E321 PolarHBondContact NH1-OE2 3.43Å
322	V	87.1	Confident	82.8	Confident	25 Å²	25	49.6 Å²	49.6	15%	0.152	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120	173.1	178.7	0	0	0	0	108.5	L324 V365 A368 L369 T537 V538	V322-L324 HydrophobicContact CG1-CD2 4.08Å; V322-V365 HydrophobicContact CG1-CG1 3.4Å; V322-A368 HydrophobicContact CG2-CB 4.42Å; V322-L369 HydrophobicContact CB-CD2 3.92Å; V322-L369 HydrophobicContact CG1-CD2 4.27Å; V322-L369 HydrophobicContact CG2-CD2 3.78Å; V322-T537 CarbonylContact O-C 3.57Å; V322-T537 WeakPolarHBondContact O-CA 3.41Å; V322-T537 VanDerWaalsContact O-CB 3.31Å; V322-T537 WeakPolarHBondContact O-CB 3.33Å; V322-V538 PolarHBondContact N-O 3.11Å; V322-V538 PolarHBondContact O-N 2.97Å
323	D	86.9	Confident	83	Confident	40 Å²	40	53.9 Å²	53.9	21%	0.214	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	128.7	171.6	-168.9	-8.2	0	0	0	110.3	L325 P326 T537	D323-L325 VanDerWaalsContact OD1-C 3.27Å; D323-L325 PolarHBondContact OD1-N 3.24Å; D323-P326 HydrophobicContact CB-CB 4.31Å; D323-P326 WeakPolarHBondContact OD2-CA 3.05Å; D323-T537 HydrophobicContact CB-CG2 4.28Å
324	L	90.8	Very high	83.4	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	33%	0.326	C	S	.	.	S	Bend	trans	-103.4	-20.9	-176.8	-56.6	171.3	0	0	0	111.8	V322 W334 V361 V365 L369 M496 I498 V536 V538	V322-L324 HydrophobicContact CG1-CD2 4.08Å; L324-W334 PolarHBondContact O-NE1 3.27Å; L324-V361 HydrophobicContact CD2-CG1 4.23Å; L324-V361 HydrophobicContact CD2-CG2 4.5Å; L324-V365 HydrophobicContact CD2-CG1 4.48Å; L324-L369 HydrophobicContact CD2-CD1 4.46Å; L324-M496 HydrophobicContact CD1-CE 3.48Å; L324-M496 VanDerWaalsContact CD1-CE 3.48Å; L324-M496 HydrophobicContact CD1-SD 4.15Å; L324-M496 HydrophobicContact CD2-CE 4.4Å; L324-M496 HydrophobicContact CD2-SD 3.98Å; L324-I498 HydrophobicContact CB-CD1 4.23Å; L324-I498 HydrophobicContact CB-CG1 4.43Å; L324-I498 HydrophobicContact CD1-CD1 4.14Å; L324-V536 HydrophobicContact CB-CG1 4.37Å; L324-V536 WeakPolarHBondContact CB-O 3.43Å; L324-V536 HydrophobicContact CD1-CG1 4.38Å; L324-V536 PolarHBondContact N-O 2.83Å; L324-V538 HydrophobicContact CD1-CB 4.33Å; L324-V538 HydrophobicContact CD1-CG2 3.77Å
325	L	90.5	Very high	83.8	Confident	7 Å²	7	48.6 Å²	48.6	4%	0.037	31%	0.306	C	S	.	.	S	Bend	trans	-123.3	56.6	171.5	-63.4	-176	0	0	0	112	D323 T335 L338 F350 F352 A359 I498 L533 V536	D323-L325 VanDerWaalsContact OD1-C 3.27Å; D323-L325 PolarHBondContact OD1-N 3.24Å; L325-T335 HydrophobicContact CD2-CG2 4.18Å; L325-L338 HydrophobicContact CD2-CD1 3.64Å; L325-F350 HydrophobicContact CB-CD2 3.9Å; L325-F350 HydrophobicContact CB-CE2 3.72Å; L325-F350 HydrophobicContact CB-CZ 4.24Å; L325-F350 HydrophobicContact CD1-CB 4.22Å; L325-F350 HydrophobicContact CD1-CD2 3.93Å; L325-F350 HydrophobicContact CD1-CG 4.18Å; L325-F350 HydrophobicContact CG-CD2 4.49Å; L325-F350 WeakPolarHBondContact O-CE2 3.39Å; L325-F350 WeakPolarHBondContact O-CZ 3.29Å; L325-F352 HydrophobicContact CD1-CE2 4.1Å; L325-F352 HydrophobicContact CD1-CZ 3.89Å; L325-F352 HydrophobicContact CD2-CZ 4.37Å; L325-A359 HydrophobicContact CD2-CB 3.72Å; L325-I498 HydrophobicContact CD1-CG2 4.19Å; L325-I498 HydrophobicContact CD2-CB 4.33Å; L325-I498 HydrophobicContact CD2-CG1 4.37Å; L325-I498 HydrophobicContact CD2-CG2 4.26Å; L325-I498 HydrophobicContact CG-CG2 4.37Å; L325-L533 HydrophobicContact CD1-CB 4.25Å; L325-V536 HydrophobicContact CB-CB 4.42Å; L325-V536 HydrophobicContact CD1-CB 3.94Å; L325-V536 HydrophobicContact CD1-CG2 3.56Å; L325-V536 HydrophobicContact CG-CB 4Å; L325-V536 HydrophobicContact CG-CG2 4.2Å
326	P	87.1	Confident	83.7	Confident	21 Å²	21	51.4 Å²	51.4	14%	0.136	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-69.1	164.8	178.1	29.6	-36.8	0	0	0	113.1	D323 A332 W334 T335	D323-P326 HydrophobicContact CB-CB 4.31Å; D323-P326 WeakPolarHBondContact OD2-CA 3.05Å; P326-A332 HydrophobicContact CB-CB 4.44Å; P326-A332 HydrophobicContact CG-CB 3.76Å; P326-W334 HydrophobicContact CG-CH2 4.23Å; P326-W334 HydrophobicContact CG-CZ2 3.67Å; P326-T335 HydrophobicContact CG-CG2 4.47Å; P326-T335 WeakPolarHBondContact O-CG2 3.32Å; P326-T335 PolarHBondContact O-OG1 2.93Å
327	P	83.4	Confident	83.6	Confident	75 Å²	75	53.9 Å²	53.9	49%	0.487	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-48.7	128.8	175.2	-22.7	27.5	0	0	0	112.7	S329 L348	P327-S329 PolarHBondContact O-N 2.03Å; P327-S329 VanDerWaalsContact O-N 3.16Å; P327-S329 PolarHBondContact O-OG 3.42Å; P327-L348 HydrophobicContact CB-CD1 3.8Å; P327-L348 HydrophobicContact CG-CD1 3.59Å
328	P	84.6	Confident	83.9	Confident	61 Å²	61	53.3 Å²	53.3	40%	0.396	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-53.4	120.4	176.4	-29.1	36.5	0	0	0	112.1	T335 F350	P328-T335 WeakPolarHBondContact CA-OG1 3.26Å; P328-F350 HydrophobicContact CG-CE1 4.41Å
329	S	78.4	Confident	84.4	Confident	32 Å²	32	51.8 Å²	51.8	22%	0.224	32%	0.316	C	S	.	.	S	Bend	trans	-155.7	168.2	-174.6	62.8	0	0	0	0	110.8	P327 A331 A332 N333	P327-S329 PolarHBondContact O-N 2.03Å; P327-S329 VanDerWaalsContact O-N 3.16Å; P327-S329 PolarHBondContact O-OG 3.42Å; S329-A331 PolarHBondContact O-N 3.27Å; S329-A332 CarbonylContact O-C 3.58Å; S329-A332 PolarHBondContact O-N 3.27Å; S329-A332 WeakPolarHBondContact OG-CB 3Å; S329-A332 PolarHBondContact OG-N 3.11Å; S329-A332 VanDerWaalsContact OG-N 3.16Å; S329-N333 PolarHBondContact O-N 2.98Å
330	P	75.4	Confident	85	Confident	118 Å²	118	47.6 Å²	47.6	77%	0.766	31%	0.308	S	S	*	.	S	Bend	trans	-57.9	-28.7	175.2	-26.2	36	0	0	0	113.8
331	A	74.1	Confident	85.2	Confident	83 Å²	83	48.9 Å²	48.9	69%	0.686	30%	0.304	S	S	*	.	S	Bend	trans	-81.4	-26.3	174.2	0	0	0	0	0	113.2	S329 W334	S329-A331 PolarHBondContact O-N 3.27Å; A331-W334 WeakPolarHBondContact O-CZ3 3.47Å
332	A	83.3	Confident	84.7	Confident	4 Å²	4	53.6 Å²	53.6	3%	0.033	34%	0.337	C	S	.	.			trans	-115.8	54.4	-179.6	0	0	0	0	0	112.3	P326 S329 W334 T335	P326-A332 HydrophobicContact CB-CB 4.44Å; P326-A332 HydrophobicContact CG-CB 3.76Å; S329-A332 CarbonylContact O-C 3.58Å; S329-A332 PolarHBondContact O-N 3.27Å; S329-A332 WeakPolarHBondContact OG-CB 3Å; S329-A332 PolarHBondContact OG-N 3.11Å; S329-A332 VanDerWaalsContact OG-N 3.16Å; A332-W334 HydrophobicContact CB-CH2 4.22Å; A332-W334 HydrophobicContact CB-CZ3 4.21Å; A332-W334 PolarHBondContact O-N 3.45Å; A332-T335 PolarHBondContact O-N 2.98Å; A332-T335 PolarHBondContact O-OG1 3.5Å
333	N	86	Confident	84	Confident	101 Å²	101	53.8 Å²	53.8	54%	0.54	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-64.5	-22.6	-175.3	67.9	-7.8	0	0	0	114.1	S329 T335 S336	S329-N333 PolarHBondContact O-N 2.98Å; N333-T335 VanDerWaalsContact C-N 3.3Å; N333-T335 PolarHBondContact O-N 2.9Å; N333-S336 WeakPolarHBondContact O-CB 3.43Å; N333-S336 PolarHBondContact O-N 3.36Å; N333-S336 PolarHBondContact O-OG 3.27Å
334	W	90	Very high	83	Confident	33 Å²	33	54.8 Å²	54.8	13%	0.125	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-70.9	-19	-178.5	70.3	92.2	0	0	0	114.5	L324 P326 A331 A332 V360 P362 V365	L324-W334 PolarHBondContact O-NE1 3.27Å; P326-W334 HydrophobicContact CG-CH2 4.23Å; P326-W334 HydrophobicContact CG-CZ2 3.67Å; A331-W334 WeakPolarHBondContact O-CZ3 3.47Å; A332-W334 HydrophobicContact CB-CH2 4.22Å; A332-W334 HydrophobicContact CB-CZ3 4.21Å; A332-W334 PolarHBondContact O-N 3.45Å; W334-V360 VanDerWaalsContact CB-O 3.3Å; W334-V360 WeakPolarHBondContact CB-O 3.44Å; W334-P362 VanDerWaalsContact CD2-CD 3.41Å; W334-P362 HydrophobicContact CD2-CG 4.03Å; W334-P362 HydrophobicContact CE3-CG 3.41Å; W334-P362 VanDerWaalsContact CE3-CG 3.41Å; W334-P362 HydrophobicContact CZ3-CG 3.84Å; W334-V365 HydrophobicContact CH2-CG2 3.92Å; W334-V365 HydrophobicContact CZ2-CG2 4.48Å; W334-V365 HydrophobicContact CZ3-CG2 4.36Å
335	T	89.9	Confident	81.8	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-90.1	-14.4	174.1	59.6	0	0	0	0	112.9	L325 P326 P328 A332 N333 V337 L338	L325-T335 HydrophobicContact CD2-CG2 4.18Å; P326-T335 HydrophobicContact CG-CG2 4.47Å; P326-T335 WeakPolarHBondContact O-CG2 3.32Å; P326-T335 PolarHBondContact O-OG1 2.93Å; P328-T335 WeakPolarHBondContact CA-OG1 3.26Å; A332-T335 PolarHBondContact O-N 2.98Å; A332-T335 PolarHBondContact O-OG1 3.5Å; N333-T335 VanDerWaalsContact C-N 3.3Å; N333-T335 PolarHBondContact O-N 2.9Å; T335-V337 PolarHBondContact O-N 2.94Å; T335-V337 VanDerWaalsContact O-N 3.09Å; T335-L338 PolarHBondContact O-N 3.47Å
336	S	85.7	Confident	80.7	Confident	80 Å²	80	56.7 Å²	56.7	56%	0.559	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-13.8	-178.3	70.8	0	0	0	0	115.7	N333	N333-S336 WeakPolarHBondContact O-CB 3.43Å; N333-S336 PolarHBondContact O-N 3.36Å; N333-S336 PolarHBondContact O-OG 3.27Å
337	V	83.2	Confident	80.2	Confident	104 Å²	104	56 Å²	56	63%	0.63	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-13.9	177.8	-173.7	0	0	0	0	111.9	T335	T335-V337 PolarHBondContact O-N 2.94Å; T335-V337 VanDerWaalsContact O-N 3.09Å
338	L	89.3	Confident	80.1	Confident	9 Å²	9	55.6 Å²	55.6	5%	0.047	35%	0.352	C	S	.	.	S	Bend	trans	-90.1	127.6	-178.9	-61	177.2	0	0	0	110.9	L325 T335 T340 F350 F352 H357 A359	L325-L338 HydrophobicContact CD2-CD1 3.64Å; T335-L338 PolarHBondContact O-N 3.47Å; L338-T340 PolarHBondContact O-N 3.07Å; L338-F350 HydrophobicContact CB-CD1 3.73Å; L338-F350 HydrophobicContact CB-CE1 4.43Å; L338-F350 HydrophobicContact CD1-CB 4.46Å; L338-F350 HydrophobicContact CD1-CD1 3.89Å; L338-F350 HydrophobicContact CD1-CG 4.39Å; L338-F352 HydrophobicContact CD1-CE1 4.26Å; L338-F352 HydrophobicContact CD1-CZ 3.83Å; L338-F352 HydrophobicContact CD2-CE1 3.99Å; L338-F352 HydrophobicContact CD2-CZ 4.28Å; L338-H357 HydrophobicContact CD2-CB 4.02Å; L338-A359 HydrophobicContact CD1-CB 3.88Å
339	P	90.4	Very high	80.3	Confident	58 Å²	58	53 Å²	53	38%	0.377	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-65	128.7	171.8	-22.9	35.8	0	0	0	111.4	S351	P339-S351 PolarHBondContact O-N 3.14Å
340	T	87.6	Confident	80.9	Confident	68 Å²	68	51.5 Å²	51.5	42%	0.417	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	151.4	172	47.6	0	0	0	0	111.4	L338 L348 V349 F350	L338-T340 PolarHBondContact O-N 3.07Å; T340-L348 HydrophobicContact CG2-CD2 4.49Å; T340-V349 CarbonylContact C-O 3.43Å; T340-V349 WeakPolarHBondContact CA-O 3.46Å; T340-F350 HydrophobicContact CG2-CD1 3.65Å; T340-F350 HydrophobicContact CG2-CE1 3.5Å; T340-F350 VanDerWaalsContact CG2-CE1 3.5Å; T340-F350 HydrophobicContact CG2-CG 4.38Å; T340-F350 HydrophobicContact CG2-CZ 4.1Å
341	L	82.9	Confident	81.8	Confident	76 Å²	76	47.4 Å²	47.4	40%	0.398	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	143.2	173.2	-62	177.8	0	0	0	109.9	V349 L532	L341-V349 HydrophobicContact CB-CB 4.25Å; L341-V349 HydrophobicContact CB-CG1 4.17Å; L341-V349 HydrophobicContact CD1-CG1 4.3Å; L341-V349 PolarHBondContact N-O 3.37Å; L341-L532 HydrophobicContact CD1-CD1 4.04Å; L341-L532 HydrophobicContact CD1-CD2 3.65Å
342	P	72.8	Confident	82.6	Confident	130 Å²	130	43.8 Å²	43.8	84%	0.844	27%	0.267	S	S	*	.			trans	-70.6	139.5	171.8	30.5	-34	0	0	0	110.7
343	S	71.2	Confident	82.9	Confident	29 Å²	29	46.1 Å²	46.1	20%	0.203	28%	0.279	C	S	.	.			trans	-117.4	150.6	172.1	-175.5	0	0	0	0	110.5	D345 S346 S347	S343-D345 VanDerWaalsContact C-N 3.3Å; S343-D345 WeakPolarHBondContact CB-OD1 3.48Å; S343-D345 PolarHBondContact O-N 2.73Å; S343-D345 PolarHBondContact OG-OD1 3.29Å; S343-S346 WeakPolarHBondContact O-CA 3.4Å; S343-S346 PolarHBondContact O-N 3.02Å; S343-S347 WeakPolarHBondContact CB-O 3.46Å
344	S	66.8	Low	82.8	Confident	62 Å²	62	42 Å²	42	43%	0.434	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-24.4	179.4	69.6	0	0	0	0	113.2	G298 S346	G298-S344 PolarHBondContact N-OG 3.27Å; S344-S346 PolarHBondContact O-N 3.38Å
345	D	65.8	Low	82.4	Confident	8 Å²	8	44.1 Å²	44.1	4%	0.043	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	6.1	168.3	63.1	14	0	0	0	112.6	G298 S343 S347	G298-D345 WeakPolarHBondContact CA-OD2 3.21Å; S343-D345 VanDerWaalsContact C-N 3.3Å; S343-D345 WeakPolarHBondContact CB-OD1 3.48Å; S343-D345 PolarHBondContact O-N 2.73Å; S343-D345 PolarHBondContact OG-OD1 3.29Å; D345-S347 PolarHBondContact O-N 2.81Å; D345-S347 VanDerWaalsContact OD1-CB 3.23Å; D345-S347 WeakPolarHBondContact OD1-CB 3.41Å; D345-S347 PolarHBondContact OD1-N 2.93Å; D345-S347 PolarHBondContact OD1-OG 3.28Å
346	S	67.5	Low	81.9	Confident	39 Å²	39	49.2 Å²	49.2	27%	0.273	31%	0.308	S	S	.	.			trans	62.1	3.4	-174.3	75.7	0	0	0	0	116.5	S343 S344 N789	S343-S346 WeakPolarHBondContact O-CA 3.4Å; S343-S346 PolarHBondContact O-N 3.02Å; S344-S346 PolarHBondContact O-N 3.38Å; S346-N789 WeakPolarHBondContact CB-ND2 3.3Å; S346-N789 PolarHBondContact O-ND2 3.01Å; S346-N789 WeakPolarHBondContact OG-CB 3.44Å; S346-N789 PolarHBondContact OG-ND2 3.41Å
347	S	75.3	Confident	82.1	Confident	7 Å²	7	47.2 Å²	47.2	5%	0.049	29%	0.29	C	S	.	.			trans	-65.3	148.4	179.6	67.5	0	0	0	0	112.6	K299 S343 D345 V349	K299-S347 WeakPolarHBondContact CE-OG 3.08Å; S343-S347 WeakPolarHBondContact CB-O 3.46Å; D345-S347 PolarHBondContact O-N 2.81Å; D345-S347 VanDerWaalsContact OD1-CB 3.23Å; D345-S347 WeakPolarHBondContact OD1-CB 3.41Å; D345-S347 PolarHBondContact OD1-N 2.93Å; D345-S347 PolarHBondContact OD1-OG 3.28Å; S347-V349 PolarHBondContact O-N 3.46Å
348	L	81.4	Confident	82.4	Confident	65 Å²	65	42.9 Å²	42.9	34%	0.34	26%	0.263	S	S	.	.			trans	-77.4	117.4	177.9	-72.8	172.5	0	0	0	110.5	P327 T340 F350 S534	P327-L348 HydrophobicContact CB-CD1 3.8Å; P327-L348 HydrophobicContact CG-CD1 3.59Å; T340-L348 HydrophobicContact CG2-CD2 4.49Å; L348-F350 HydrophobicContact CB-CE2 3.97Å; L348-F350 HydrophobicContact CB-CZ 4.46Å; L348-S534 VanDerWaalsContact O-CB 3.27Å; L348-S534 WeakPolarHBondContact O-CB 3.3Å; L348-S534 PolarHBondContact O-OG 2.94Å
349	V	89.3	Confident	82.6	Confident	6 Å²	6	42.5 Å²	42.5	4%	0.036	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	124	176.2	172.3	0	0	0	0	108.9	T340 L341 S347 W455 L532	T340-V349 CarbonylContact C-O 3.43Å; T340-V349 WeakPolarHBondContact CA-O 3.46Å; L341-V349 HydrophobicContact CB-CB 4.25Å; L341-V349 HydrophobicContact CB-CG1 4.17Å; L341-V349 HydrophobicContact CD1-CG1 4.3Å; L341-V349 PolarHBondContact N-O 3.37Å; S347-V349 PolarHBondContact O-N 3.46Å; V349-W455 HydrophobicContact CG1-CH2 3.86Å; V349-W455 HydrophobicContact CG1-CZ2 3.88Å; V349-W455 HydrophobicContact CG2-CH2 4.03Å; V349-W455 HydrophobicContact CG2-CZ2 3.86Å; V349-L532 HydrophobicContact CG1-CB 3.91Å; V349-L532 HydrophobicContact CG1-CD1 4.09Å; V349-L532 HydrophobicContact CG1-CD2 4.36Å; V349-L532 HydrophobicContact CG1-CG 4.35Å
350	F	91.8	Very high	82.6	Confident	1 Å²	1	43.3 Å²	43.3	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	134.7	179.5	-66	-89.9	0	0	0	110.7	L325 P328 L338 T340 L348 F352 L532 L533	L325-F350 HydrophobicContact CB-CD2 3.9Å; L325-F350 HydrophobicContact CB-CE2 3.72Å; L325-F350 HydrophobicContact CB-CZ 4.24Å; L325-F350 HydrophobicContact CD1-CB 4.22Å; L325-F350 HydrophobicContact CD1-CD2 3.93Å; L325-F350 HydrophobicContact CD1-CG 4.18Å; L325-F350 HydrophobicContact CG-CD2 4.49Å; L325-F350 WeakPolarHBondContact O-CE2 3.39Å; L325-F350 WeakPolarHBondContact O-CZ 3.29Å; P328-F350 HydrophobicContact CG-CE1 4.41Å; L338-F350 HydrophobicContact CB-CD1 3.73Å; L338-F350 HydrophobicContact CB-CE1 4.43Å; L338-F350 HydrophobicContact CD1-CB 4.46Å; L338-F350 HydrophobicContact CD1-CD1 3.89Å; L338-F350 HydrophobicContact CD1-CG 4.39Å; T340-F350 HydrophobicContact CG2-CD1 3.65Å; T340-F350 HydrophobicContact CG2-CE1 3.5Å; T340-F350 VanDerWaalsContact CG2-CE1 3.5Å; T340-F350 HydrophobicContact CG2-CG 4.38Å; T340-F350 HydrophobicContact CG2-CZ 4.1Å; L348-F350 HydrophobicContact CB-CE2 3.97Å; L348-F350 HydrophobicContact CB-CZ 4.46Å; F350-F352 HydrophobicContact CB-CD2 4.5Å; F350-F352 HydrophobicContact CB-CE2 3.68Å; F350-F352 HydrophobicContact CB-CZ 4.33Å; F350-F352 WeakPolarHBondContact O-CD2 3.27Å; F350-L532 WeakPolarHBondContact O-CA 3.29Å; F350-L533 PolarHBondContact N-O 2.87Å; F350-L533 PolarHBondContact O-N 3.5Å
351	S	92.8	Very high	82.7	Confident	32 Å²	32	40.1 Å²	40.1	22%	0.224	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	125	-175.5	-176.9	0	0	0	0	112.5	P339 H357	P339-S351 PolarHBondContact O-N 3.14Å; S351-H357 PolarHBondContact O-ND1 3.13Å
352	F	92.3	Very high	83.1	Confident	7 Å²	7	38.3 Å²	38.3	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.3	-177	-67.6	-95.9	0	0	0	110.9	L325 L338 F350 H357 I498 Y529 H530 G531 L533	L325-F352 HydrophobicContact CD1-CE2 4.1Å; L325-F352 HydrophobicContact CD1-CZ 3.89Å; L325-F352 HydrophobicContact CD2-CZ 4.37Å; L338-F352 HydrophobicContact CD1-CE1 4.26Å; L338-F352 HydrophobicContact CD1-CZ 3.83Å; L338-F352 HydrophobicContact CD2-CE1 3.99Å; L338-F352 HydrophobicContact CD2-CZ 4.28Å; F350-F352 HydrophobicContact CB-CD2 4.5Å; F350-F352 HydrophobicContact CB-CE2 3.68Å; F350-F352 HydrophobicContact CB-CZ 4.33Å; F350-F352 WeakPolarHBondContact O-CD2 3.27Å; F352-H357 WeakPolarHBondContact CD1-O 3.47Å; F352-I498 HydrophobicContact CE1-CG2 4.25Å; F352-I498 HydrophobicContact CZ-CG2 4.04Å; F352-Y529 CarbonylContact C-O 3.48Å; F352-Y529 HydrophobicContact CB-CD1 3.79Å; F352-Y529 HydrophobicContact CB-CE1 4.42Å; F352-Y529 WeakPolarHBondContact CB-O 3.2Å; F352-Y529 HydrophobicContact CG-CD1 4.15Å; F352-H530 WeakPolarHBondContact O-CA 3.1Å; F352-G531 WeakPolarHBondContact CB-O 3.19Å; F352-G531 PolarHBondContact N-O 3.4Å; F352-G531 PolarHBondContact O-N 2.78Å; F352-L533 HydrophobicContact CD2-CB 4.23Å; F352-L533 HydrophobicContact CD2-CD1 3.96Å; F352-L533 HydrophobicContact CD2-CG 3.86Å; F352-L533 HydrophobicContact CE2-CB 3.81Å; F352-L533 HydrophobicContact CE2-CD1 3.65Å; F352-L533 HydrophobicContact CE2-CG 3.79Å; F352-L533 HydrophobicContact CZ-CD1 3.99Å
353	N	88.1	Confident	83.6	Confident	53 Å²	53	35.7 Å²	35.7	28%	0.283	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	16.4	-173.3	74.6	-9.3	0	0	0	114	S355 N356 H357	N353-S355 PolarHBondContact ND2-OG 3.44Å; N353-S355 PolarHBondContact O-N 2.76Å; N353-S355 PolarHBondContact O-OG 3.06Å; N353-S355 PolarHBondContact OD1-N 3.39Å; N353-S355 VanDerWaalsContact OD1-N 3.17Å; N353-S355 PolarHBondContact OD1-OG 2.74Å; N353-N356 PolarHBondContact ND2-OD1 2.97Å; N353-N356 PolarHBondContact OD1-N 2.84Å; N353-N356 PolarHBondContact OD1-OD1 3.01Å; N353-H357 VanDerWaalsContact CG-CG 3.46Å; N353-H357 PolarHBondContact ND2-CD2 3.02Å; N353-H357 VanDerWaalsContact ND2-CD2 3.31Å; N353-H357 PolarHBondContact ND2-NE2 3.46Å; N353-H357 WeakPolarHBondContact OD1-CB 3.4Å; N353-H357 PolarHBondContact OD1-N 3.42Å; N353-H357 VanDerWaalsContact OD1-N 3.1Å
354	G	84.6	Confident	84.1	Confident	16 Å²	16	39 Å²	39	17%	0.165	24%	0.24	C	C	.	.	S	Bend	trans	61.9	12	178.4	0	0	0	0	0	117.3	G528 Y529	G354-G528 WeakPolarHBondContact O-CA 3.43Å; G354-Y529 VanDerWaalsContact CA-O 3.25Å; G354-Y529 WeakPolarHBondContact CA-O 3.47Å; G354-Y529 PolarHBondContact N-O 3.5Å
355	S	81	Confident	84.9	Confident	77 Å²	77	37.4 Å²	37.4	54%	0.538	23%	0.228	S	C	.	.	S	Bend	trans	-136.4	-69.1	-176.1	53.9	0	0	0	0	114.2	N353	N353-S355 PolarHBondContact ND2-OG 3.44Å; N353-S355 PolarHBondContact O-N 2.76Å; N353-S355 PolarHBondContact O-OG 3.06Å; N353-S355 PolarHBondContact OD1-N 3.39Å; N353-S355 VanDerWaalsContact OD1-N 3.17Å; N353-S355 PolarHBondContact OD1-OG 2.74Å
356	N	81.3	Confident	85.7	Confident	107 Å²	107	37 Å²	37	57%	0.572	23%	0.226	S	C	*	.	S	Bend	trans	-115.9	-11.5	-176.4	70	-21.5	0	0	0	114.4	N353 V358	N353-N356 PolarHBondContact ND2-OD1 2.97Å; N353-N356 PolarHBondContact OD1-N 2.84Å; N353-N356 PolarHBondContact OD1-OD1 3.01Å; N356-V358 VanDerWaalsContact C-N 3.34Å; N356-V358 PolarHBondContact O-N 3.41Å
357	H	89.6	Confident	86.1	Confident	38 Å²	38	38.4 Å²	38.4	18%	0.176	24%	0.236	C	C	.	.			trans	-77.8	84.6	170.3	-61.4	-175	0	0	0	109.1	L338 S351 F352 N353	L338-H357 HydrophobicContact CD2-CB 4.02Å; S351-H357 PolarHBondContact O-ND1 3.13Å; F352-H357 WeakPolarHBondContact CD1-O 3.47Å; N353-H357 VanDerWaalsContact CG-CG 3.46Å; N353-H357 PolarHBondContact ND2-CD2 3.02Å; N353-H357 VanDerWaalsContact ND2-CD2 3.31Å; N353-H357 PolarHBondContact ND2-NE2 3.46Å; N353-H357 WeakPolarHBondContact OD1-CB 3.4Å; N353-H357 PolarHBondContact OD1-N 3.42Å; N353-H357 VanDerWaalsContact OD1-N 3.1Å
358	V	89.9	Confident	85.9	Confident	13 Å²	13	40.9 Å²	40.9	8%	0.079	26%	0.256	C	S	.	.			trans	-133.3	123.3	-178.9	-177.8	0	0	0	0	109.5	N356 L497 I498 A500 F525	N356-V358 VanDerWaalsContact C-N 3.34Å; N356-V358 PolarHBondContact O-N 3.41Å; V358-L497 HydrophobicContact CG1-CB 4.43Å; V358-L497 HydrophobicContact CG1-CD2 4.14Å; V358-I498 WeakPolarHBondContact CA-O 3.43Å; V358-A500 HydrophobicContact CG1-CB 4.08Å; V358-A500 HydrophobicContact CG2-CB 3.66Å; V358-F525 HydrophobicContact CB-CD2 4.12Å; V358-F525 HydrophobicContact CB-CE1 4.4Å; V358-F525 HydrophobicContact CB-CE2 3.87Å; V358-F525 HydrophobicContact CB-CG 4.49Å; V358-F525 HydrophobicContact CB-CZ 4.01Å; V358-F525 HydrophobicContact CG1-CD1 4.06Å; V358-F525 HydrophobicContact CG1-CD2 4.42Å; V358-F525 HydrophobicContact CG1-CE1 3.86Å; V358-F525 HydrophobicContact CG1-CE2 4.24Å; V358-F525 HydrophobicContact CG1-CG 4.32Å; V358-F525 HydrophobicContact CG1-CZ 3.95Å; V358-F525 HydrophobicContact CG2-CD2 3.73Å; V358-F525 HydrophobicContact CG2-CE2 3.98Å; V358-F525 HydrophobicContact CG2-CG 4.07Å
359	A	91.4	Very high	85.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	121	175.6	0	0	0	0	0	109.4	L325 L338 L497 I498	L325-A359 HydrophobicContact CD2-CB 3.72Å; L338-A359 HydrophobicContact CD1-CB 3.88Å; A359-L497 VanDerWaalsContact O-CA 3.31Å; A359-L497 WeakPolarHBondContact O-CA 3.47Å; A359-I498 HydrophobicContact CB-CB 3.84Å; A359-I498 HydrophobicContact CB-CG1 4.15Å; A359-I498 PolarHBondContact N-O 2.77Å; A359-I498 PolarHBondContact O-N 3.24Å
360	V	91	Very high	84.5	Confident	75 Å²	75	40.8 Å²	40.8	46%	0.455	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	97.7	176.7	-177.6	0	0	0	0	108.7	W334 F525	W334-V360 VanDerWaalsContact CB-O 3.3Å; W334-V360 WeakPolarHBondContact CB-O 3.44Å; V360-F525 HydrophobicContact CG2-CE1 4.18Å; V360-F525 HydrophobicContact CG2-CZ 4.04Å
361	V	90.7	Very high	83.5	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.012	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	128.2	-171.3	-178.2	0	0	0	0	110.2	L324 V365 V366 M496 I498	L324-V361 HydrophobicContact CD2-CG1 4.23Å; L324-V361 HydrophobicContact CD2-CG2 4.5Å; V361-V365 HydrophobicContact CG1-CB 3.82Å; V361-V365 HydrophobicContact CG1-CG1 3.8Å; V361-V366 HydrophobicContact CB-CG2 4.26Å; V361-V366 HydrophobicContact CG1-CG2 3.98Å; V361-M496 HydrophobicContact CB-CB 4.19Å; V361-M496 PolarHBondContact N-O 2.87Å; V361-I498 HydrophobicContact CG2-CG1 4.16Å
362	P	89.6	Confident	82.5	Confident	38 Å²	38	45.4 Å²	45.4	25%	0.247	29%	0.29	C	S	.	.			trans	-61.6	145	-177	-26.3	35.1	0	0	0	114.2	W334 S364 V365 V366	W334-P362 VanDerWaalsContact CD2-CD 3.41Å; W334-P362 HydrophobicContact CD2-CG 4.03Å; W334-P362 HydrophobicContact CE3-CG 3.41Å; W334-P362 VanDerWaalsContact CE3-CG 3.41Å; W334-P362 HydrophobicContact CZ3-CG 3.84Å; P362-S364 PolarHBondContact O-N 2.82Å; P362-S364 VanDerWaalsContact O-N 3.1Å; P362-V365 WeakPolarHBondContact O-CB 3.35Å; P362-V365 PolarHBondContact O-N 3.15Å; P362-V366 PolarHBondContact O-N 3.3Å; P362-V366 VanDerWaalsContact O-N 3.15Å
363	N	85	Confident	82.2	Confident	74 Å²	74	48.3 Å²	48.3	40%	0.396	30%	0.304	S	S	.	.	H	α-helix	trans	-57.6	-29	-179.1	-76.9	45.6	0	0	0	114	V365 V366 S367 Q494	N363-V365 VanDerWaalsContact C-N 3.26Å; N363-V365 PolarHBondContact O-N 3.36Å; N363-V366 PolarHBondContact O-N 2.73Å; N363-S367 WeakPolarHBondContact O-CB 3.4Å; N363-S367 PolarHBondContact O-N 2.85Å; N363-S367 PolarHBondContact O-OG 3.44Å; N363-Q494 PolarHBondContact ND2-O 2.87Å; N363-Q494 PolarHBondContact O-NE2 2.95Å; N363-Q494 PolarHBondContact OD1-O 3.25Å
364	S	81.5	Confident	82.2	Confident	99 Å²	99	46.2 Å²	46.2	69%	0.692	29%	0.292	S	S	*	.	H	α-helix	trans	-60	-34.7	173.4	45.5	0	0	0	0	113.2	P362	P362-S364 PolarHBondContact O-N 2.82Å; P362-S364 VanDerWaalsContact O-N 3.1Å
365	V	83.9	Confident	82.6	Confident	28 Å²	28	45.6 Å²	45.6	17%	0.17	29%	0.285	C	S	.	.	H	α-helix	trans	-78.7	-44.5	175.3	-177.7	0	0	0	0	110	V322 L324 W334 V361 P362 N363 S367 A368	V322-V365 HydrophobicContact CG1-CG1 3.4Å; L324-V365 HydrophobicContact CD2-CG1 4.48Å; W334-V365 HydrophobicContact CH2-CG2 3.92Å; W334-V365 HydrophobicContact CZ2-CG2 4.48Å; W334-V365 HydrophobicContact CZ3-CG2 4.36Å; V361-V365 HydrophobicContact CG1-CB 3.82Å; V361-V365 HydrophobicContact CG1-CG1 3.8Å; P362-V365 WeakPolarHBondContact O-CB 3.35Å; P362-V365 PolarHBondContact O-N 3.15Å; N363-V365 VanDerWaalsContact C-N 3.26Å; N363-V365 PolarHBondContact O-N 3.36Å; V365-S367 VanDerWaalsContact C-N 3.29Å; V365-S367 PolarHBondContact O-N 2.89Å; V365-A368 WeakPolarHBondContact O-CB 3.36Å; V365-A368 PolarHBondContact O-N 2.74Å; V365-A368 VanDerWaalsContact O-N 3.1Å
366	V	82.3	Confident	83.2	Confident	0 Å²	0	42 Å²	42	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.2	-30.3	-178.9	-175.6	0	0	0	0	112.6	V361 P362 N363 A368 L369 V409 Q494 M496	V361-V366 HydrophobicContact CB-CG2 4.26Å; V361-V366 HydrophobicContact CG1-CG2 3.98Å; P362-V366 PolarHBondContact O-N 3.3Å; P362-V366 VanDerWaalsContact O-N 3.15Å; N363-V366 PolarHBondContact O-N 2.73Å; V366-A368 PolarHBondContact O-N 2.9Å; V366-L369 WeakPolarHBondContact O-CB 3.39Å; V366-L369 PolarHBondContact O-N 2.03Å; V366-V409 HydrophobicContact CG1-CG2 4.23Å; V366-Q494 HydrophobicContact CB-CG 4.27Å; V366-Q494 HydrophobicContact CG1-CG 3.67Å; V366-M496 HydrophobicContact CG1-CB 4.26Å; V366-M496 HydrophobicContact CG2-CB 3.48Å; V366-M496 VanDerWaalsContact CG2-CB 3.48Å
367	S	75.2	Confident	83.7	Confident	69 Å²	69	37.1 Å²	37.1	48%	0.483	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-11.7	175.3	-73.6	0	0	0	0	114.1	N363 V365 L369 Q494	N363-S367 WeakPolarHBondContact O-CB 3.4Å; N363-S367 PolarHBondContact O-N 2.85Å; N363-S367 PolarHBondContact O-OG 3.44Å; V365-S367 VanDerWaalsContact C-N 3.29Å; V365-S367 PolarHBondContact O-N 2.89Å; S367-L369 VanDerWaalsContact C-N 3.31Å; S367-Q494 PolarHBondContact OG-NE2 2.96Å; S367-Q494 PolarHBondContact OG-OE1 2.81Å
368	A	72.1	Confident	83.9	Confident	58 Å²	58	35.3 Å²	35.3	48%	0.479	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-8.6	170.9	0	0	0	0	0	113	V322 V365 V366 P540	V322-A368 HydrophobicContact CG2-CB 4.42Å; V365-A368 WeakPolarHBondContact O-CB 3.36Å; V365-A368 PolarHBondContact O-N 2.74Å; V365-A368 VanDerWaalsContact O-N 3.1Å; V366-A368 PolarHBondContact O-N 2.9Å; A368-P540 WeakPolarHBondContact O-CG 3.27Å
369	L	73.2	Confident	84	Confident	10 Å²	10	35.1 Å²	35.1	5%	0.052	22%	0.223	C	C	.	.			trans	-97.6	8.6	-169.5	-54.7	-179.4	0	0	0	114.8	V322 L324 V366 S367 V409 M496 V538 P540	V322-L369 HydrophobicContact CB-CD2 3.92Å; V322-L369 HydrophobicContact CG1-CD2 4.27Å; V322-L369 HydrophobicContact CG2-CD2 3.78Å; L324-L369 HydrophobicContact CD2-CD1 4.46Å; V366-L369 WeakPolarHBondContact O-CB 3.39Å; V366-L369 PolarHBondContact O-N 2.03Å; S367-L369 VanDerWaalsContact C-N 3.31Å; L369-V409 HydrophobicContact CB-CG2 4.42Å; L369-M496 HydrophobicContact CD1-CE 4.45Å; L369-M496 HydrophobicContact CD1-SD 3.56Å; L369-M496 VanDerWaalsContact CD1-SD 3.56Å; L369-V538 HydrophobicContact CD2-CB 4.15Å; L369-V538 HydrophobicContact CD2-CG1 3.97Å; L369-P540 HydrophobicContact CD2-CG 4.28Å
370	S	68.1	Low	84	Confident	60 Å²	60	35.2 Å²	35.2	42%	0.42	22%	0.224	S	C	.	.			trans	-71.4	128.1	-177.1	-60.2	0	0	0	0	112.6	K410	S370-K410 PolarHBondContact OG-O 3.44Å
371	G	69.9	Low	84.1	Confident	31 Å²	31	35.6 Å²	35.6	32%	0.32	22%	0.217	S	C	.	.	S	Bend	trans	153.7	153.9	172.8	0	0	0	0	0	113.3	H373	G371-H373 PolarHBondContact O-N 3.4Å
372	D	71.4	Confident	84	Confident	99 Å²	99	37.3 Å²	37.3	53%	0.529	22%	0.223	S	C	.	.	S	Bend	trans	-75.3	-3.4	-176.1	-60.9	-30	0	0	0	114.3
373	H	85.8	Confident	83.5	Confident	68 Å²	68	37.2 Å²	37.2	32%	0.315	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	130.9	-175.3	-59.2	-11.3	0	0	0	109.5	G371 V462 G541	G371-H373 PolarHBondContact O-N 3.4Å; H373-V462 WeakPolarHBondContact CA-O 3.24Å; H373-G541 WeakPolarHBondContact O-CA 3.27Å; H373-G541 PolarHBondContact O-N 2.87Å
374	F	89.8	Confident	82.5	Confident	8 Å²	8	35.6 Å²	35.6	4%	0.035	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	161	174.5	64	-87.3	0	0	0	112.2	L376 Y418 Y431 V462 V538 R539	F374-L376 HydrophobicContact CD2-CB 4.33Å; F374-L376 HydrophobicContact CE2-CB 4.19Å; F374-Y418 HydrophobicContact CE1-CD1 4.21Å; F374-Y418 HydrophobicContact CE1-CE1 4.2Å; F374-Y418 HydrophobicContact CE2-CE1 4.43Å; F374-Y418 HydrophobicContact CE2-CE2 4.3Å; F374-Y418 AromaticContact CZ-CD1 3.93Å; F374-Y418 HydrophobicContact CZ-CD1 3.93Å; F374-Y418 HydrophobicContact CZ-CD2 4.27Å; F374-Y418 AromaticContact CZ-CE1 3.93Å; F374-Y418 HydrophobicContact CZ-CE1 3.93Å; F374-Y418 HydrophobicContact CZ-CE2 4.29Å; F374-Y418 HydrophobicContact CZ-CG 4.09Å; F374-Y431 AromaticContact CE1-CE2 3.92Å; F374-Y431 HydrophobicContact CE1-CE2 3.92Å; F374-Y431 HydrophobicContact CZ-CE2 4.46Å; F374-V462 HydrophobicContact CD1-CB 4.09Å; F374-V462 HydrophobicContact CD1-CG1 4.32Å; F374-V462 HydrophobicContact CD2-CB 4.48Å; F374-V462 HydrophobicContact CD2-CG2 4.46Å; F374-V462 HydrophobicContact CE1-CB 3.81Å; F374-V462 HydrophobicContact CE1-CG1 3.8Å; F374-V462 HydrophobicContact CE1-CG2 4.11Å; F374-V462 HydrophobicContact CE2-CB 4.23Å; F374-V462 HydrophobicContact CE2-CG2 3.85Å; F374-V462 HydrophobicContact CG-CB 4.42Å; F374-V462 HydrophobicContact CZ-CB 3.89Å; F374-V462 HydrophobicContact CZ-CG1 4.16Å; F374-V462 HydrophobicContact CZ-CG2 3.65Å; F374-V462 PolarHBondContact N-O 2.91Å; F374-V462 PolarHBondContact O-N 2.82Å; F374-V538 HydrophobicContact CB-CG1 4.13Å; F374-V538 HydrophobicContact CD2-CG1 4.21Å; F374-V538 HydrophobicContact CG-CG1 4.47Å; F374-R539 CarbonylContact C-O 3.53Å; F374-R539 WeakPolarHBondContact CA-O 3.1Å; F374-R539 WeakPolarHBondContact CB-O 3.04Å
375	T	92	Very high	81	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.018	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.5	165.1	-43	0	0	0	0	109.3	Q377 L460 V538 R539 S542 V543 E544	T375-Q377 HydrophobicContact CG2-CG 4.14Å; T375-L460 WeakPolarHBondContact CA-O 3.4Å; T375-V538 CarbonylContact O-C 3.56Å; T375-V538 WeakPolarHBondContact O-CA 3.42Å; T375-R539 PolarHBondContact N-O 2.84Å; T375-R539 PolarHBondContact O-N 3.23Å; T375-S542 PolarHBondContact OG1-O 2.97Å; T375-V543 WeakPolarHBondContact OG1-CA 3.05Å; T375-E544 HydrophobicContact CG2-CB 4.02Å; T375-E544 PolarHBondContact OG1-N 3.27Å
376	L	92.9	Very high	79	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	121.4	169.4	168.1	60.4	0	0	0	108.2	F374 L378 V405 L420 L460 V538	F374-L376 HydrophobicContact CD2-CB 4.33Å; F374-L376 HydrophobicContact CE2-CB 4.19Å; L376-L378 HydrophobicContact CD1-CD2 4.14Å; L376-L378 HydrophobicContact CG-CD2 4.21Å; L376-V405 HydrophobicContact CD1-CG2 4.33Å; L376-V405 HydrophobicContact CD2-CB 4.41Å; L376-V405 HydrophobicContact CD2-CG2 4.17Å; L376-L420 HydrophobicContact CD2-CB 4.29Å; L376-L420 HydrophobicContact CD2-CD2 3.78Å; L376-L460 HydrophobicContact CB-CB 4.4Å; L376-L460 HydrophobicContact CD2-CD2 4.42Å; L376-L460 PolarHBondContact N-O 3.3Å; L376-L460 PolarHBondContact O-N 2.88Å; L376-V538 HydrophobicContact CB-CG2 4.18Å; L376-V538 HydrophobicContact CD1-CG2 3.65Å; L376-V538 HydrophobicContact CG-CG2 4.47Å
377	Q	92.7	Very high	77.1	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.019	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	140.7	178	-79.2	-178.8	-4.2	0	0	110.9	R312 T375 L458 S459 V536 T537	R312-Q377 VanDerWaalsContact CZ-OE1 3.26Å; R312-Q377 VanDerWaalsContact NE-OE1 3.11Å; R312-Q377 VanDerWaalsContact NH2-OE1 3.08Å; T375-Q377 HydrophobicContact CG2-CG 4.14Å; Q377-L458 WeakPolarHBondContact CA-O 3Å; Q377-S459 WeakPolarHBondContact CG-OG 3.25Å; Q377-S459 PolarHBondContact NE2-OG 2.75Å; Q377-V536 WeakPolarHBondContact O-CA 3.45Å; Q377-T537 PolarHBondContact N-O 3.29Å; Q377-T537 PolarHBondContact O-N 3.45Å
378	L	93.3	Very high	75.1	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	147.8	174.2	57	107	0	0	0	111.8	L376 M380 I404 L420 L458 L533 V536	L376-L378 HydrophobicContact CD1-CD2 4.14Å; L376-L378 HydrophobicContact CG-CD2 4.21Å; L378-M380 HydrophobicContact CD1-CB 3.79Å; L378-M380 HydrophobicContact CD1-CG 3.98Å; L378-I404 HydrophobicContact CD1-CG2 4.35Å; L378-I404 HydrophobicContact CD2-CG2 4.17Å; L378-L420 HydrophobicContact CD2-CD2 3.92Å; L378-L458 HydrophobicContact CD1-CB 4.35Å; L378-L458 HydrophobicContact CD1-CD1 4.18Å; L378-L458 HydrophobicContact CD1-CG 4.49Å; L378-L458 HydrophobicContact CG-CB 4.33Å; L378-L458 PolarHBondContact N-O 2.68Å; L378-L458 PolarHBondContact O-N 3.48Å; L378-L533 HydrophobicContact CD1-CD2 4.28Å; L378-V536 HydrophobicContact CB-CB 4.28Å; L378-V536 HydrophobicContact CB-CG1 4.36Å; L378-V536 HydrophobicContact CB-CG2 3.81Å
379	W	91.9	Very high	73.3	Confident	8 Å²	8	55.7 Å²	55.7	3%	0.03	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	135.1	158.2	-63.7	88.2	0	0	0	109.1	K299 D308 W455 H456 H457 L533 S534 Y553	K299-W379 HydrophobicContact CB-CD2 4.33Å; K299-W379 HydrophobicContact CB-CE3 3.8Å; K299-W379 HydrophobicContact CB-CH2 4.26Å; K299-W379 HydrophobicContact CB-CZ3 3.75Å; K299-W379 HydrophobicContact CD-CB 4.11Å; K299-W379 HydrophobicContact CD-CD2 3.36Å; K299-W379 HydrophobicContact CD-CE3 3.74Å; K299-W379 HydrophobicContact CD-CG 3.53Å; K299-W379 HydrophobicContact CD-CZ2 4.23Å; K299-W379 HydrophobicContact CD-CZ3 4.3Å; K299-W379 HydrophobicContact CG-CD2 4.4Å; K299-W379 HydrophobicContact CG-CE3 4.32Å; K299-W379 VanDerWaalsContact NZ-CD1 3.25Å; D308-W379 PolarHBondContact OD1-NE1 3.4Å; W379-W455 HydrophobicContact CB-CE3 4.14Å; W379-W455 HydrophobicContact CB-CZ3 4.06Å; W379-H456 WeakPolarHBondContact CA-O 3.37Å; W379-H457 HydrophobicContact CD2-CB 4.02Å; W379-H457 AromaticContact CE2-CD2 3.86Å; W379-H457 HydrophobicContact CE3-CB 3.79Å; W379-H457 HydrophobicContact CH2-CB 3.92Å; W379-H457 HydrophobicContact CZ2-CB 4.14Å; W379-H457 HydrophobicContact CZ3-CB 3.75Å; W379-H457 AromaticContact NE1-CD2 3.93Å; W379-L533 WeakPolarHBondContact O-CA 3.47Å; W379-S534 WeakPolarHBondContact CB-O 3.3Å; W379-S534 PolarHBondContact N-O 3.03Å; W379-S534 PolarHBondContact O-N 3.02Å; W379-Y553 HydrophobicContact CH2-CD2 4.16Å; W379-Y553 HydrophobicContact CZ3-CD2 4.39Å
380	M	92.5	Very high	71.3	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	147	170.9	60.2	162.9	-87.3	0	0	112.2	L378 R382 I404 V450 H456 L458 L532 L533	L378-M380 HydrophobicContact CD1-CB 3.79Å; L378-M380 HydrophobicContact CD1-CG 3.98Å; M380-R382 HydrophobicContact CE-CB 4.3Å; M380-I404 HydrophobicContact SD-CD1 3.77Å; M380-V450 HydrophobicContact CE-CG2 4.5Å; M380-H456 PolarHBondContact N-O 2.83Å; M380-H456 PolarHBondContact O-N 2.64Å; M380-L458 HydrophobicContact CG-CD1 3.92Å; M380-L458 HydrophobicContact CG-CG 4.19Å; M380-L458 HydrophobicContact SD-CD1 3.57Å; M380-L458 VanDerWaalsContact SD-CD1 3.57Å; M380-L458 HydrophobicContact SD-CG 4.42Å; M380-L532 WeakPolarHBondContact CA-O 3.2Å; M380-L533 HydrophobicContact CB-CD2 3.64Å
381	R	91.8	Very high	69.6	Low	83 Å²	83	60.7 Å²	60.7	31%	0.313	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	109.9	165.3	174.5	173.5	-166.8	-166.2	14.9	108.2	S453 E454 W455 G531 L532	R381-S453 WeakPolarHBondContact CG-O 3.48Å; R381-S453 PolarHBondContact NE-O 2.92Å; R381-S453 PolarHBondContact NH2-O 3.01Å; R381-E454 WeakPolarHBondContact CA-O 3.49Å; R381-E454 WeakPolarHBondContact CB-O 3.34Å; R381-E454 WeakPolarHBondContact CG-O 3.18Å; R381-E454 IonicContact CZ-OE1 3.07Å; R381-E454 IonicContact NH2-OE1 2.83Å; R381-E454 PolarHBondContact NH2-OE1 3.45Å; R381-W455 HydrophobicContact CB-CD2 3.57Å; R381-W455 HydrophobicContact CB-CE3 3.56Å; R381-W455 HydrophobicContact CB-CG 4.1Å; R381-W455 HydrophobicContact CB-CH2 4.23Å; R381-W455 HydrophobicContact CB-CZ2 4.26Å; R381-W455 HydrophobicContact CB-CZ3 3.89Å; R381-W455 HydrophobicContact CG-CD2 4.47Å; R381-G531 CarbonylContact O-C 3.53Å; R381-G531 WeakPolarHBondContact O-CA 3.02Å; R381-L532 HydrophobicContact CB-CB 4.38Å; R381-L532 PolarHBondContact N-O 3.4Å; R381-L532 PolarHBondContact O-N 3.09Å
382	R	89.7	Confident	68	Low	38 Å²	38	65.4 Å²	65.4	14%	0.143	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	147.3	-176.4	-163.7	-175.8	-173.3	165.9	6.3	111.1	M380 G384 E402 G424 V450 H530	M380-R382 HydrophobicContact CE-CB 4.3Å; R382-G384 PolarHBondContact O-N 3.34Å; R382-E402 IonicContact CZ-OE1 3.61Å; R382-E402 IonicContact NE-OE1 2.93Å; R382-E402 PolarHBondContact NE-OE1 2.81Å; R382-E402 IonicContact NH2-OE1 3.36Å; R382-E402 PolarHBondContact NH2-OE1 2.93Å; R382-G424 PolarHBondContact NH1-O 3.37Å; R382-V450 WeakPolarHBondContact CD-O 3.32Å; R382-V450 PolarHBondContact NH1-O 3.05Å; R382-H530 WeakPolarHBondContact CG-O 3.46Å
383	G	78.9	Confident	66.4	Low	36 Å²	36	67.2 Å²	67.2	37%	0.371	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-59.1	131	167.8	0	0	0	0	0	110.4	H530	G383-H530 PolarHBondContact N-O 3.4Å
384	G	63.6	Low	63.7	Low	41 Å²	41	69 Å²	69	42%	0.423	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-58.9	142.4	-172.4	0	0	0	0	0	113.1	R382 N386 S453	R382-G384 PolarHBondContact O-N 3.34Å; G384-N386 PolarHBondContact O-N 3.37Å; G384-S453 WeakPolarHBondContact CA-OG 3.29Å
385	A	49.9	Very low	61.2	Low	90 Å²	90	81 Å²	81	74%	0.744	46%	0.463	S	S	*	.	S	Bend	trans	-67.3	14.3	-172.5	0	0	0	0	0	115.9	I387	A385-I387 PolarHBondContact O-N 3.02Å
386	N	41.1	Very low	58.4	Low	160 Å²	160	84.1 Å²	84.1	86%	0.856	50%	0.495	S	S	*	.			trans	-83.8	18.3	177.4	-93.4	-11.7	0	0	0	114.1	G384 Q388	G384-N386 PolarHBondContact O-N 3.37Å; N386-Q388 VanDerWaalsContact C-N 3.27Å; N386-Q388 PolarHBondContact O-N 2.79Å
387	I	43.6	Very low	55.5	Low	128 Å²	128	89.4 Å²	89.4	66%	0.656	52%	0.524	S	S	*	.			trans	-64.7	96.7	157.3	-59	178.1	0	0	0	106.7	A385	A385-I387 PolarHBondContact O-N 3.02Å
388	Q	32.9	Very low	53.3	Low	175 Å²	175	100.1 Å²	100.1	82%	0.818	56%	0.564	S	S	*	*			trans	-50.8	128.8	171.4	-75.9	178.1	-46.3	0	0	108.6	N386 S390	N386-Q388 VanDerWaalsContact C-N 3.27Å; N386-Q388 PolarHBondContact O-N 2.79Å; Q388-S390 PolarHBondContact O-N 3.26Å
389	P	34.5	Very low	51.4	Low	122 Å²	122	108 Å²	108	79%	0.792	60%	0.599	S	S	*	*			trans	-62.2	114.1	172.5	26.3	-32.4	0	0	0	107.5	A391	P389-A391 PolarHBondContact O-N 3.36Å; P389-A391 VanDerWaalsContact O-N 3.08Å
390	S	30.3	Very low	50.4	Low	67 Å²	67	114.6 Å²	114.6	47%	0.469	63%	0.63	S	S	.	*			trans	-57.3	120.5	177.9	52.2	0	0	0	0	108.4	Q388 T392 Q393	Q388-S390 PolarHBondContact O-N 3.26Å; S390-T392 PolarHBondContact O-N 3.35Å; S390-Q393 PolarHBondContact O-N 2.86Å
391	A	33.8	Very low	49.9	Very low	109 Å²	109	117.8 Å²	117.8	90%	0.901	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	19.6	-167.4	0	0	0	0	0	114.4	P389	P389-A391 PolarHBondContact O-N 3.36Å; P389-A391 VanDerWaalsContact O-N 3.08Å
392	T	36	Very low	49.8	Very low	129 Å²	129	115.1 Å²	115.1	79%	0.791	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.6	10.3	-175.5	49.4	0	0	0	0	113	S390	S390-T392 PolarHBondContact O-N 3.35Å
393	Q	37.4	Very low	49.9	Very low	137 Å²	137	113.8 Å²	113.8	64%	0.64	63%	0.632	S	S	*	*			trans	-83.8	112.9	165.1	-69.9	-163.3	8.2	0	0	111.3	S390	S390-Q393 PolarHBondContact O-N 2.86Å
394	S	29.2	Very low	50.6	Low	105 Å²	105	112.1 Å²	112.1	73%	0.734	61%	0.614	S	S	*	*			trans	-66.5	155.2	175.3	51.5	0	0	0	0	112.1	G396	S394-G396 PolarHBondContact O-N 2.82Å
395	R	37.3	Very low	52.1	Low	262 Å²	262	110.1 Å²	110.1	99%	0.989	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.6	106.7	176.5	-70.9	174.2	170.1	168.3	-4.5	111.2
396	G	32.7	Very low	54.1	Low	67 Å²	67	106 Å²	106	69%	0.691	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-180	-50.7	176.3	0	0	0	0	0	114	S394 R398	S394-G396 PolarHBondContact O-N 2.82Å; G396-R398 PolarHBondContact O-N 2.86Å
397	N	33.4	Very low	56.4	Low	114 Å²	114	98.5 Å²	98.5	61%	0.61	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-72.3	123.6	-171.8	-73.4	13.7	0	0	0	112.4
398	R	45.7	Very low	58.5	Low	229 Å²	229	93 Å²	93	86%	0.864	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-60.4	151.2	156	-66.3	172.7	173.3	167.3	-3.7	107.7	G396 E400	G396-R398 PolarHBondContact O-N 2.86Å; R398-E400 PolarHBondContact O-N 2.85Å
399	K	54.1	Low	61	Low	167 Å²	167	84.8 Å²	84.8	73%	0.726	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-58.9	127.7	161.1	-73.7	-167.9	174.4	-166.8	0	106.9	H423	K399-H423 PolarHBondContact O-CD2 2.69Å; K399-H423 VanDerWaalsContact O-CD2 3.28Å; K399-H423 PolarHBondContact O-NE2 2.89Å
400	E	68.9	Low	63.3	Low	146 Å²	146	83.1 Å²	83.1	68%	0.682	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-73.2	155.8	-176.2	-62	-168.9	157.1	0	0	110.6	R398	R398-E400 PolarHBondContact O-N 2.85Å
401	E	83.4	Confident	65.6	Low	69 Å²	69	81.5 Å²	81.5	32%	0.322	42%	0.42	S	S	.	.			trans	-91.8	111.7	-177.7	-175.5	170.9	156.4	0	0	108.9	S421 H423 K442 G527	E401-S421 VanDerWaalsContact OE1-CB 3.3Å; E401-S421 WeakPolarHBondContact OE1-CB 3.42Å; E401-S421 PolarHBondContact OE1-OG 2.91Å; E401-H423 HydrophobicContact CG-CB 4.49Å; E401-K442 IonicContact OE1-NZ 3.41Å; E401-K442 PolarHBondContact OE1-NZ 3.12Å; E401-K442 IonicContact OE2-NZ 3.17Å; E401-K442 PolarHBondContact OE2-NZ 2.86Å; E401-G527 WeakPolarHBondContact O-CA 3.35Å
402	E	90.1	Very high	67.7	Low	26 Å²	26	83.4 Å²	83.4	12%	0.121	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	124.6	-175.7	-64.6	-176.5	-110	0	0	110	R382 S421 V422 Y529 H530	R382-E402 IonicContact CZ-OE1 3.61Å; R382-E402 IonicContact NE-OE1 2.93Å; R382-E402 PolarHBondContact NE-OE1 2.81Å; R382-E402 IonicContact NH2-OE1 3.36Å; R382-E402 PolarHBondContact NH2-OE1 2.93Å; E402-S421 CarbonylContact O-C 3.55Å; E402-S421 WeakPolarHBondContact O-CA 3.38Å; E402-S421 VanDerWaalsContact O-CB 3.32Å; E402-S421 WeakPolarHBondContact O-CB 3.43Å; E402-V422 HydrophobicContact CB-CG2 3.82Å; E402-V422 PolarHBondContact N-O 2.93Å; E402-V422 PolarHBondContact O-N 3.47Å; E402-Y529 HydrophobicContact CB-CD2 4.42Å; E402-H530 WeakPolarHBondContact OE2-CB 3.34Å; E402-H530 IonicContact OE2-CG 2.74Å; E402-H530 PolarHBondContact OE2-N 3.45Å; E402-H530 IonicContact OE2-ND1 3.31Å; E402-H530 PolarHBondContact OE2-ND1 2.9Å
403	T	91.1	Very high	69.7	Low	11 Å²	11	85.4 Å²	85.4	7%	0.067	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	114.2	-172	-53.5	0	0	0	0	111.3	V405 C406 G499 A500 C501 G527	T403-V405 VanDerWaalsContact CG2-O 3.28Å; T403-V405 WeakPolarHBondContact CG2-O 3.45Å; T403-C406 HydrophobicContact CG2-CB 3.76Å; T403-G499 CarbonylContact O-C 3.59Å; T403-A500 PolarHBondContact O-N 3.48Å; T403-C501 HydrophobicContact CG2-CB 4.08Å; T403-G527 VanDerWaalsContact CB-O 3.32Å; T403-G527 WeakPolarHBondContact CB-O 3.44Å; T403-G527 PolarHBondContact N-O 2.9Å; T403-G527 PolarHBondContact OG1-O 2.88Å
404	I	94.2	Very high	71.9	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	-46.6	178	-54.7	176	0	0	0	109.8	L378 M380 L420 V422 L427 I498 G499 Y529 L533	L378-I404 HydrophobicContact CD1-CG2 4.35Å; L378-I404 HydrophobicContact CD2-CG2 4.17Å; M380-I404 HydrophobicContact SD-CD1 3.77Å; I404-L420 PolarHBondContact N-O 3.49Å; I404-V422 HydrophobicContact CD1-CG1 3.97Å; I404-L427 HydrophobicContact CD1-CD1 4.25Å; I404-I498 WeakPolarHBondContact O-CA 3.46Å; I404-G499 PolarHBondContact O-N 2.97Å; I404-Y529 HydrophobicContact CD1-CE2 4.3Å; I404-Y529 HydrophobicContact CG1-CD2 3.76Å; I404-Y529 HydrophobicContact CG1-CE2 3.95Å; I404-Y529 HydrophobicContact CG1-CG 4.25Å; I404-L533 HydrophobicContact CG2-CD1 3.81Å; I404-L533 HydrophobicContact CG2-CD2 3.99Å
405	V	94	Very high	74.5	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	136.7	-179.4	-177.9	0	0	0	0	109.2	L376 T403 Y418 S419 L420 M496 I498	L376-V405 HydrophobicContact CD1-CG2 4.33Å; L376-V405 HydrophobicContact CD2-CB 4.41Å; L376-V405 HydrophobicContact CD2-CG2 4.17Å; T403-V405 VanDerWaalsContact CG2-O 3.28Å; T403-V405 WeakPolarHBondContact CG2-O 3.45Å; V405-Y418 HydrophobicContact CG1-CE2 4.07Å; V405-S419 CarbonylContact O-C 3.6Å; V405-S419 WeakPolarHBondContact O-CA 3.46Å; V405-S419 WeakPolarHBondContact O-CB 3.31Å; V405-L420 HydrophobicContact CB-CB 4.29Å; V405-L420 PolarHBondContact N-O 3.48Å; V405-L420 PolarHBondContact O-N 2.85Å; V405-M496 HydrophobicContact CG1-CE 3.47Å; V405-M496 VanDerWaalsContact CG1-CE 3.47Å; V405-I498 HydrophobicContact CB-CD1 4.46Å; V405-I498 HydrophobicContact CG1-CD1 4.06Å; V405-I498 HydrophobicContact CG2-CD1 4Å
406	C	91.4	Very high	76.9	Confident	4 Å²	4	65.4 Å²	65.4	3%	0.027	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	121.1	172.9	154.6	0	0	0	0	109.5	T403 M496 L497 C501	T403-C406 HydrophobicContact CG2-CB 3.76Å; C406-M496 WeakPolarHBondContact O-CA 3.5Å; C406-L497 PolarHBondContact N-O 3.09Å; C406-L497 PolarHBondContact O-N 2.87Å; C406-C501 HydrophobicContact CB-CB 3.43Å; C406-C501 VanDerWaalsContact CB-CB 3.43Å; C406-C501 WeakPolarHBondContact CB-SG 3.47Å; C406-C501 WeakPolarHBondContact SG-CA 3.49Å; C406-C501 WeakPolarHBondContact SG-CB 3.44Å; C406-C501 CovalentContact SG-SG 2.05Å; C406-C501 PolarHBondContact SG-SG 3.16Å
407	S	89.9	Confident	79.5	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.007	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	133.3	-170.2	-162.2	0	0	0	0	111.8	H417 Y418 M496	S407-H417 CarbonylContact O-C 3.56Å; S407-H417 WeakPolarHBondContact O-CA 3.39Å; S407-H417 PolarHBondContact O-ND1 2.57Å; S407-Y418 VanDerWaalsContact CB-CZ 3.47Å; S407-Y418 PolarHBondContact N-O 3.11Å; S407-Y418 PolarHBondContact O-N 2.96Å; S407-M496 WeakPolarHBondContact OG-CG 3.49Å
408	T	87.9	Confident	82.2	Confident	13 Å²	13	57.8 Å²	57.8	8%	0.08	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	113.8	166.1	-56.3	0	0	0	0	107.2	Y415 S416 H417 Q494 R495	T408-Y415 HydrophobicContact CG2-CD1 3.88Å; T408-Y415 HydrophobicContact CG2-CG 4.19Å; T408-S416 CarbonylContact C-O 3.59Å; T408-S416 WeakPolarHBondContact CA-O 3.38Å; T408-H417 PolarHBondContact OG1-ND1 2.82Å; T408-Q494 VanDerWaalsContact O-CA 3.27Å; T408-Q494 WeakPolarHBondContact O-CA 3.44Å; T408-R495 PolarHBondContact N-O 2.91Å; T408-R495 PolarHBondContact O-N 3.4Å
409	V	85.4	Confident	84.3	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.012	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	141.7	-178.1	-175.4	0	0	0	0	108.9	V366 L369 Y415 S416 Y418	V366-V409 HydrophobicContact CG1-CG2 4.23Å; L369-V409 HydrophobicContact CB-CG2 4.42Å; V409-Y415 WeakPolarHBondContact O-CA 3.38Å; V409-Y415 WeakPolarHBondContact O-CD1 3.44Å; V409-S416 PolarHBondContact N-O 2.89Å; V409-S416 PolarHBondContact O-N 2.94Å; V409-Y418 HydrophobicContact CG2-CE1 4.36Å
410	K	83.2	Confident	86.2	Confident	87 Å²	87	39.7 Å²	39.7	38%	0.378	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	128.7	175.6	-179.7	161.5	-168.2	-68	0	109.9	S370 D412 Y415 Q494	S370-K410 PolarHBondContact OG-O 3.44Å; K410-D412 PolarHBondContact NZ-O 2.95Å; K410-Y415 HydrophobicContact CB-CD1 4.06Å; K410-Y415 HydrophobicContact CB-CE1 3.77Å; K410-Y415 HydrophobicContact CD-CE1 4.34Å; K410-Y415 HydrophobicContact CG-CE1 4.1Å; K410-Q494 HydrophobicContact CB-CB 4.29Å
411	N	78.6	Confident	87.4	Confident	34 Å²	34	32.8 Å²	32.8	18%	0.182	17%	0.168	C	C	.	.			trans	-99	-176.7	166.3	-60.6	-0.7	0	0	0	108.2	S414 S416	N411-S414 PolarHBondContact N-O 2.92Å; N411-S416 PolarHBondContact OD1-OG 2.76Å
412	D	77.8	Confident	87.8	Confident	148 Å²	148	29.5 Å²	29.5	79%	0.791	15%	0.152	S	C	*	.	S	Bend	trans	-56.9	-61.5	-173.9	-65	-47.1	0	0	0	112.6	K410	K410-D412 PolarHBondContact NZ-O 2.95Å
413	D	78.4	Confident	87.7	Confident	171 Å²	171	31.9 Å²	31.9	91%	0.914	16%	0.163	S	C	*	.	S	Bend	trans	-105.4	-6.5	-179.3	-72.9	-42.7	0	0	0	114.3
414	S	82.6	Confident	87.4	Confident	20 Å²	20	32.5 Å²	32.5	14%	0.14	17%	0.172	C	C	.	.	S	Bend	trans	-144.9	-162.9	-175.5	83	0	0	0	0	114	N411 D434	N411-S414 PolarHBondContact N-O 2.92Å; S414-D434 WeakPolarHBondContact CB-OD1 3.47Å; S414-D434 PolarHBondContact OG-OD1 2.88Å
415	Y	85	Confident	87.2	Confident	56 Å²	56	34.9 Å²	34.9	22%	0.22	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	140.7	177.4	-68.2	-82.7	0	0	0	110.5	T408 V409 K410 V435 P492 Q494	T408-Y415 HydrophobicContact CG2-CD1 3.88Å; T408-Y415 HydrophobicContact CG2-CG 4.19Å; V409-Y415 WeakPolarHBondContact O-CA 3.38Å; V409-Y415 WeakPolarHBondContact O-CD1 3.44Å; K410-Y415 HydrophobicContact CB-CD1 4.06Å; K410-Y415 HydrophobicContact CB-CE1 3.77Å; K410-Y415 HydrophobicContact CD-CE1 4.34Å; K410-Y415 HydrophobicContact CG-CE1 4.1Å; Y415-V435 WeakPolarHBondContact O-CG2 3.24Å; Y415-V435 PolarHBondContact O-N 2.81Å; Y415-P492 HydrophobicContact CD2-CB 3.99Å; Y415-P492 VanDerWaalsContact CE2-C 3.46Å; Y415-P492 HydrophobicContact CE2-CB 3.73Å; Y415-P492 WeakPolarHBondContact CE2-O 3.38Å; Y415-P492 VanDerWaalsContact CZ-C 3.45Å; Y415-P492 VanDerWaalsContact CZ-O 3.27Å; Y415-P492 PolarHBondContact OH-O 2.88Å; Y415-Q494 HydrophobicContact CE1-CB 4.36Å
416	S	86.2	Confident	87.1	Confident	8 Å²	8	40.9 Å²	40.9	6%	0.056	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	150.1	160.6	55.1	0	0	0	0	109.4	T408 V409 N411 W432 P433	T408-S416 CarbonylContact C-O 3.59Å; T408-S416 WeakPolarHBondContact CA-O 3.38Å; V409-S416 PolarHBondContact N-O 2.89Å; V409-S416 PolarHBondContact O-N 2.94Å; N411-S416 PolarHBondContact OD1-OG 2.76Å; S416-W432 WeakPolarHBondContact CA-O 3.33Å; S416-P433 VanDerWaalsContact CB-O 3.25Å; S416-P433 WeakPolarHBondContact CB-O 3.4Å
417	H	87.6	Confident	87.2	Confident	15 Å²	15	40.7 Å²	40.7	7%	0.069	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	138.1	176.7	177.9	81.9	0	0	0	111.4	S407 T408 F430 W432 V435 P490	S407-H417 CarbonylContact O-C 3.56Å; S407-H417 WeakPolarHBondContact O-CA 3.39Å; S407-H417 PolarHBondContact O-ND1 2.57Å; T408-H417 PolarHBondContact OG1-ND1 2.82Å; H417-F430 AromaticContact CD2-CD1 3.82Å; H417-F430 AromaticContact CD2-CE1 3.77Å; H417-W432 HydrophobicContact CB-CB 4.47Å; H417-W432 PolarHBondContact N-O 3.47Å; H417-W432 PolarHBondContact O-N 2.79Å; H417-V435 HydrophobicContact CB-CG2 4.13Å; H417-P490 HydrophobicContact CB-CB 4.14Å; H417-P490 HydrophobicContact CB-CG 3.8Å
418	Y	89.8	Confident	87.3	Confident	7 Å²	7	40.9 Å²	40.9	3%	0.027	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	150.4	173.8	65.3	-98.3	0	0	0	112.6	F374 V405 S407 V409 F430 M496	F374-Y418 HydrophobicContact CE1-CD1 4.21Å; F374-Y418 HydrophobicContact CE1-CE1 4.2Å; F374-Y418 HydrophobicContact CE2-CE1 4.43Å; F374-Y418 HydrophobicContact CE2-CE2 4.3Å; F374-Y418 AromaticContact CZ-CD1 3.93Å; F374-Y418 HydrophobicContact CZ-CD1 3.93Å; F374-Y418 HydrophobicContact CZ-CD2 4.27Å; F374-Y418 AromaticContact CZ-CE1 3.93Å; F374-Y418 HydrophobicContact CZ-CE1 3.93Å; F374-Y418 HydrophobicContact CZ-CE2 4.29Å; F374-Y418 HydrophobicContact CZ-CG 4.09Å; V405-Y418 HydrophobicContact CG1-CE2 4.07Å; S407-Y418 VanDerWaalsContact CB-CZ 3.47Å; S407-Y418 PolarHBondContact N-O 3.11Å; S407-Y418 PolarHBondContact O-N 2.96Å; V409-Y418 HydrophobicContact CG2-CE1 4.36Å; Y418-F430 CarbonylContact C-O 3.59Å; Y418-F430 WeakPolarHBondContact CA-O 3.27Å; Y418-F430 WeakPolarHBondContact CB-O 3.2Å; Y418-M496 HydrophobicContact CE2-CE 4.34Å; Y418-M496 WeakPolarHBondContact OH-CE 3.26Å
419	S	91.2	Very high	87.6	Confident	13 Å²	13	40.2 Å²	40.2	9%	0.091	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	141	168.3	63.1	0	0	0	0	112	V405 L429 F430	V405-S419 CarbonylContact O-C 3.6Å; V405-S419 WeakPolarHBondContact O-CA 3.46Å; V405-S419 WeakPolarHBondContact O-CB 3.31Å; S419-L429 WeakPolarHBondContact O-CA 3.35Å; S419-F430 PolarHBondContact N-O 2.81Å; S419-F430 PolarHBondContact O-N 3.07Å
420	L	94.3	Very high	87.8	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.016	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.1	174.9	-176.3	65.6	0	0	0	108.5	L376 L378 I404 V405 L427 L460	L376-L420 HydrophobicContact CD2-CB 4.29Å; L376-L420 HydrophobicContact CD2-CD2 3.78Å; L378-L420 HydrophobicContact CD2-CD2 3.92Å; I404-L420 PolarHBondContact N-O 3.49Å; V405-L420 HydrophobicContact CB-CB 4.29Å; V405-L420 PolarHBondContact N-O 3.48Å; V405-L420 PolarHBondContact O-N 2.85Å; L420-L427 HydrophobicContact CD1-CD1 3.76Å; L420-L427 HydrophobicContact CD1-CD2 4.12Å; L420-L427 HydrophobicContact CD1-CG 3.88Å; L420-L427 HydrophobicContact CG-CD1 4.07Å; L420-L460 HydrophobicContact CD1-CD2 3.85Å; L420-L460 HydrophobicContact CD2-CD2 4.48Å
421	S	92.7	Very high	88	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	157.6	-169.8	60.5	0	0	0	0	113.4	E401 E402 L427 S428	E401-S421 VanDerWaalsContact OE1-CB 3.3Å; E401-S421 WeakPolarHBondContact OE1-CB 3.42Å; E401-S421 PolarHBondContact OE1-OG 2.91Å; E402-S421 CarbonylContact O-C 3.55Å; E402-S421 WeakPolarHBondContact O-CA 3.38Å; E402-S421 VanDerWaalsContact O-CB 3.32Å; E402-S421 WeakPolarHBondContact O-CB 3.43Å; S421-L427 CarbonylContact O-C 3.53Å; S421-L427 WeakPolarHBondContact O-CA 3.45Å; S421-S428 PolarHBondContact N-O 2.92Å; S421-S428 PolarHBondContact O-N 2.84Å; S421-S428 PolarHBondContact OG-O 2.99Å; S421-S428 PolarHBondContact OG-OG 2.99Å
422	V	92	Very high	88.4	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	140	173.7	-63.8	0	0	0	0	111.6	E402 I404 R426 L427 V450 Y529	E402-V422 HydrophobicContact CB-CG2 3.82Å; E402-V422 PolarHBondContact N-O 2.93Å; E402-V422 PolarHBondContact O-N 3.47Å; I404-V422 HydrophobicContact CD1-CG1 3.97Å; V422-R426 VanDerWaalsContact CA-O 3.28Å; V422-R426 WeakPolarHBondContact CA-O 3.28Å; V422-L427 HydrophobicContact CG1-CD1 3.58Å; V422-V450 HydrophobicContact CB-CG1 3.77Å; V422-V450 HydrophobicContact CG1-CG1 3.6Å; V422-Y529 HydrophobicContact CG2-CD2 4.23Å; V422-Y529 HydrophobicContact CG2-CE2 4.24Å
423	H	88.4	Confident	88.6	Confident	76 Å²	76	30 Å²	30	35%	0.352	16%	0.155	S	C	.	.			trans	-148.5	109.7	177.4	168.5	-79.7	0	0	0	110.4	K399 E401 R426	K399-H423 PolarHBondContact O-CD2 2.69Å; K399-H423 VanDerWaalsContact O-CD2 3.28Å; K399-H423 PolarHBondContact O-NE2 2.89Å; E401-H423 HydrophobicContact CG-CB 4.49Å; H423-R426 PolarHBondContact N-O 3.21Å
424	G	85.9	Confident	88.9	Confident	25 Å²	25	23.4 Å²	23.4	26%	0.258	12%	0.12	S	C	.	.	S	Bend	trans	57.7	-144.2	-163.3	0	0	0	0	0	110.7	R382 R426	R382-G424 PolarHBondContact NH1-O 3.37Å; G424-R426 PolarHBondContact O-N 3.16Å; G424-R426 VanDerWaalsContact O-N 3.09Å
425	C	89.9	Confident	88.8	Confident	50 Å²	50	23.9 Å²	23.9	34%	0.338	12%	0.122	S	C	.	.	S	Bend	trans	-88.2	56.1	177.8	-41.6	0	0	0	0	110.7	L447 C451	C425-L447 CarbonylContact C-O 3.47Å; C425-L447 VanDerWaalsContact C-O 3.3Å; C425-L447 WeakPolarHBondContact CB-O 3.4Å; C425-L447 PolarHBondContact O-N 2.84Å; C425-L447 VanDerWaalsContact O-N 3.17Å; C425-L447 VanDerWaalsContact O-O 3.14Å; C425-C451 WeakPolarHBondContact CA-SG 3.38Å; C425-C451 HydrophobicContact CB-CB 3.86Å; C425-C451 WeakPolarHBondContact CB-SG 3.46Å; C425-C451 PolarHBondContact N-SG 3.46Å; C425-C451 VanDerWaalsContact N-SG 3.4Å; C425-C451 WeakPolarHBondContact SG-CB 3.47Å; C425-C451 CovalentContact SG-SG 2.04Å; C425-C451 PolarHBondContact SG-SG 2.85Å
426	R	90.5	Very high	88.4	Confident	125 Å²	125	25.6 Å²	25.6	47%	0.472	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	140.3	179.6	-59.2	-174.5	-177.6	174.2	-2.6	110.4	V422 H423 G424 L444 W445	V422-R426 VanDerWaalsContact CA-O 3.28Å; V422-R426 WeakPolarHBondContact CA-O 3.28Å; H423-R426 PolarHBondContact N-O 3.21Å; G424-R426 PolarHBondContact O-N 3.16Å; G424-R426 VanDerWaalsContact O-N 3.09Å; R426-L444 HydrophobicContact CB-CD1 4.08Å; R426-W445 WeakPolarHBondContact CA-O 3.47Å; R426-W445 VanDerWaalsContact CB-O 3.29Å; R426-W445 WeakPolarHBondContact CB-O 3.24Å
427	L	93.9	Very high	87.7	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	143.6	167.7	-174.3	75.3	0	0	0	107.9	I404 L420 S421 V422 W445 L447 L458 L469	I404-L427 HydrophobicContact CD1-CD1 4.25Å; L420-L427 HydrophobicContact CD1-CD1 3.76Å; L420-L427 HydrophobicContact CD1-CD2 4.12Å; L420-L427 HydrophobicContact CD1-CG 3.88Å; L420-L427 HydrophobicContact CG-CD1 4.07Å; S421-L427 CarbonylContact O-C 3.53Å; S421-L427 WeakPolarHBondContact O-CA 3.45Å; V422-L427 HydrophobicContact CG1-CD1 3.58Å; L427-W445 HydrophobicContact CB-CE3 4.44Å; L427-W445 HydrophobicContact CD2-CE3 4.31Å; L427-W445 HydrophobicContact CG-CE3 4.41Å; L427-W445 PolarHBondContact N-O 3.45Å; L427-W445 VanDerWaalsContact N-O 3.1Å; L427-W445 PolarHBondContact O-N 2.86Å; L427-L447 HydrophobicContact CB-CD1 3.76Å; L427-L447 HydrophobicContact CD2-CD1 4.11Å; L427-L458 HydrophobicContact CD1-CD1 4.16Å; L427-L458 HydrophobicContact CD2-CD1 3.95Å; L427-L469 HydrophobicContact CD2-CD1 4.01Å; L427-L469 HydrophobicContact CD2-CD2 3.69Å
428	S	92.6	Very high	86.9	Confident	4 Å²	4	30.4 Å²	30.4	3%	0.028	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	139.4	169.2	43.6	0	0	0	0	113.1	S421 K442 F443	S421-S428 PolarHBondContact N-O 2.92Å; S421-S428 PolarHBondContact O-N 2.84Å; S421-S428 PolarHBondContact OG-O 2.99Å; S421-S428 PolarHBondContact OG-OG 2.99Å; S428-K442 VanDerWaalsContact CB-CE 3.46Å; S428-K442 WeakPolarHBondContact OG-CE 3.48Å; S428-F443 CarbonylContact C-O 3.17Å; S428-F443 WeakPolarHBondContact CA-O 3.49Å; S428-F443 WeakPolarHBondContact CB-O 3.49Å
429	L	93	Very high	86.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	117.3	164.7	172.7	69	0	0	0	107.7	S419 K442 F443 W445 L460 V462 V467	S419-L429 WeakPolarHBondContact O-CA 3.35Å; L429-K442 WeakPolarHBondContact O-CA 3.49Å; L429-F443 HydrophobicContact CB-CB 4.34Å; L429-F443 HydrophobicContact CB-CD2 4.48Å; L429-F443 HydrophobicContact CD2-CD2 4.13Å; L429-F443 HydrophobicContact CG-CD2 4.4Å; L429-F443 PolarHBondContact N-O 2.87Å; L429-F443 PolarHBondContact O-N 3.21Å; L429-W445 HydrophobicContact CB-CH2 4.1Å; L429-W445 HydrophobicContact CB-CZ3 3.92Å; L429-L460 HydrophobicContact CB-CD2 4.31Å; L429-L460 HydrophobicContact CD1-CD2 4.08Å; L429-L460 HydrophobicContact CD2-CD2 4.17Å; L429-L460 HydrophobicContact CG-CD2 4.4Å; L429-V462 HydrophobicContact CD2-CG2 3.76Å; L429-V467 HydrophobicContact CD2-CG1 3.91Å; L429-V467 HydrophobicContact CD2-CG2 4.1Å
430	F	89.5	Confident	85.8	Confident	12 Å²	12	39.6 Å²	39.6	5%	0.053	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	130.1	159.6	-175.6	-117	0	0	0	108.9	H417 Y418 S419 W432 P440 K442 I487	H417-F430 AromaticContact CD2-CD1 3.82Å; H417-F430 AromaticContact CD2-CE1 3.77Å; Y418-F430 CarbonylContact C-O 3.59Å; Y418-F430 WeakPolarHBondContact CA-O 3.27Å; Y418-F430 WeakPolarHBondContact CB-O 3.2Å; S419-F430 PolarHBondContact N-O 2.81Å; S419-F430 PolarHBondContact O-N 3.07Å; F430-W432 HydrophobicContact CE1-CE3 4.4Å; F430-W432 HydrophobicContact CZ-CE3 4.2Å; F430-P440 HydrophobicContact CE2-CB 3.5Å; F430-P440 HydrophobicContact CE2-CG 4.25Å; F430-P440 HydrophobicContact CZ-CB 3.45Å; F430-P440 VanDerWaalsContact CZ-CB 3.45Å; F430-P440 HydrophobicContact CZ-CG 4.16Å; F430-K442 HydrophobicContact CD2-CB 4.43Å; F430-I487 HydrophobicContact CD2-CD1 4.07Å; F430-I487 HydrophobicContact CE1-CG2 4.31Å; F430-I487 HydrophobicContact CE2-CD1 3.24Å; F430-I487 HydrophobicContact CZ-CD1 3.66Å; F430-I487 HydrophobicContact CZ-CG2 3.89Å
431	Y	88.3	Confident	85.4	Confident	3 Å²	3	39.9 Å²	39.9	1%	0.012	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	127.6	179.6	-171	-106.3	0	0	0	111.5	F374 P433 V441 V462 F464	F374-Y431 AromaticContact CE1-CE2 3.92Å; F374-Y431 HydrophobicContact CE1-CE2 3.92Å; F374-Y431 HydrophobicContact CZ-CE2 4.46Å; Y431-P433 HydrophobicContact CD1-CB 4.49Å; Y431-P433 HydrophobicContact CE1-CB 3.67Å; Y431-P433 HydrophobicContact CE1-CG 4.1Å; Y431-V441 PolarHBondContact N-O 2.84Å; Y431-V441 PolarHBondContact O-N 2.93Å; Y431-V462 HydrophobicContact CD2-CG1 4.46Å; Y431-V462 HydrophobicContact CE2-CG1 4.26Å; Y431-F464 HydrophobicContact CD1-CB 4.43Å; Y431-F464 AromaticContact CD1-CD2 3.38Å; Y431-F464 HydrophobicContact CD1-CD2 3.38Å; Y431-F464 AromaticContact CD1-CE2 3.86Å; Y431-F464 HydrophobicContact CD1-CE2 3.86Å; Y431-F464 HydrophobicContact CD1-CG 4.07Å; Y431-F464 HydrophobicContact CE1-CB 3.73Å; Y431-F464 HydrophobicContact CE1-CD1 4.47Å; Y431-F464 AromaticContact CE1-CD2 3.45Å; Y431-F464 HydrophobicContact CE1-CD2 3.45Å; Y431-F464 VanDerWaalsContact CE1-CD2 3.45Å; Y431-F464 HydrophobicContact CE1-CE2 4.2Å; Y431-F464 AromaticContact CE1-CG 3.62Å; Y431-F464 HydrophobicContact CE1-CG 3.62Å
432	W	86.9	Confident	85.2	Confident	22 Å²	22	42 Å²	42	8%	0.083	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	99.6	175.9	-159.7	-16.4	0	0	0	108.1	S416 H417 F430 D434 V435 A438 P440 N489 P490	S416-W432 WeakPolarHBondContact CA-O 3.33Å; H417-W432 HydrophobicContact CB-CB 4.47Å; H417-W432 PolarHBondContact N-O 3.47Å; H417-W432 PolarHBondContact O-N 2.79Å; F430-W432 HydrophobicContact CE1-CE3 4.4Å; F430-W432 HydrophobicContact CZ-CE3 4.2Å; W432-D434 PolarHBondContact NE1-O 3.24Å; W432-D434 PolarHBondContact O-N 2.81Å; W432-V435 HydrophobicContact CD2-CG2 3.99Å; W432-V435 HydrophobicContact CE3-CG2 4.28Å; W432-V435 HydrophobicContact CG-CG2 4.08Å; W432-V435 HydrophobicContact CH2-CG1 4.46Å; W432-V435 HydrophobicContact CZ2-CG1 4.43Å; W432-A438 PolarHBondContact NE1-O 3.21Å; W432-P440 HydrophobicContact CB-CB 4.08Å; W432-P440 HydrophobicContact CD2-CB 3.83Å; W432-P440 HydrophobicContact CD2-CG 4.19Å; W432-P440 HydrophobicContact CE3-CB 4.09Å; W432-P440 HydrophobicContact CE3-CG 4.3Å; W432-P440 HydrophobicContact CG-CB 3.83Å; W432-N489 WeakPolarHBondContact CH2-OD1 3.34Å; W432-P490 HydrophobicContact CE3-CG 4.34Å; W432-P490 HydrophobicContact CZ3-CG 4.49Å
433	P	82.4	Confident	85.2	Confident	18 Å²	18	42.2 Å²	42.2	12%	0.117	23%	0.232	C	C	.	.	S	Bend	trans	-65.7	-37.1	-172.9	20.5	-29.6	0	0	0	113	S416 Y431 A438 F464	S416-P433 VanDerWaalsContact CB-O 3.25Å; S416-P433 WeakPolarHBondContact CB-O 3.4Å; Y431-P433 HydrophobicContact CD1-CB 4.49Å; Y431-P433 HydrophobicContact CE1-CB 3.67Å; Y431-P433 HydrophobicContact CE1-CG 4.1Å; P433-A438 HydrophobicContact CG-CB 3.88Å; P433-F464 HydrophobicContact CG-CD1 4.31Å; P433-F464 HydrophobicContact CG-CE1 3.95Å; P433-F464 HydrophobicContact CG-CE2 4.48Å; P433-F464 HydrophobicContact CG-CZ 4.04Å
434	D	83.8	Confident	85.3	Confident	33 Å²	33	40.1 Å²	40.1	18%	0.176	22%	0.223	C	C	.	.			trans	-142.5	112.7	175.6	163.5	44.4	0	0	0	109.8	S414 W432 S436 A437 A438	S414-D434 WeakPolarHBondContact CB-OD1 3.47Å; S414-D434 PolarHBondContact OG-OD1 2.88Å; W432-D434 PolarHBondContact NE1-O 3.24Å; W432-D434 PolarHBondContact O-N 2.81Å; D434-S436 VanDerWaalsContact CG-OG 3.24Å; D434-S436 PolarHBondContact O-N 3.42Å; D434-S436 WeakPolarHBondContact OD1-CB 3.46Å; D434-S436 PolarHBondContact OD1-N 2.73Å; D434-S436 PolarHBondContact OD1-OG 3.07Å; D434-S436 PolarHBondContact OD2-OG 3.06Å; D434-A437 WeakPolarHBondContact OD2-CA 3.42Å; D434-A437 WeakPolarHBondContact OD2-CB 3.46Å; D434-A437 PolarHBondContact OD2-N 3.3Å; D434-A438 HydrophobicContact CB-CB 4.13Å; D434-A438 VanDerWaalsContact O-CB 3.29Å; D434-A438 WeakPolarHBondContact O-CB 3.37Å; D434-A438 PolarHBondContact O-N 3.42Å
435	V	80.1	Confident	85.7	Confident	30 Å²	30	39.1 Å²	39.1	18%	0.182	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-15.2	179.6	176.5	0	0	0	0	112.4	Y415 H417 W432 P490	Y415-V435 WeakPolarHBondContact O-CG2 3.24Å; Y415-V435 PolarHBondContact O-N 2.81Å; H417-V435 HydrophobicContact CB-CG2 4.13Å; W432-V435 HydrophobicContact CD2-CG2 3.99Å; W432-V435 HydrophobicContact CE3-CG2 4.28Å; W432-V435 HydrophobicContact CG-CG2 4.08Å; W432-V435 HydrophobicContact CH2-CG1 4.46Å; W432-V435 HydrophobicContact CZ2-CG1 4.43Å; V435-P490 HydrophobicContact CG1-CG 4.05Å; V435-P490 HydrophobicContact CG2-CG 3.74Å
436	S	78.1	Confident	85.8	Confident	93 Å²	93	43.4 Å²	43.4	65%	0.65	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-36.9	-177.7	76.5	0	0	0	0	114.9	D434	D434-S436 VanDerWaalsContact CG-OG 3.24Å; D434-S436 PolarHBondContact O-N 3.42Å; D434-S436 WeakPolarHBondContact OD1-CB 3.46Å; D434-S436 PolarHBondContact OD1-N 2.73Å; D434-S436 PolarHBondContact OD1-OG 3.07Å; D434-S436 PolarHBondContact OD2-OG 3.06Å
437	A	70	Confident	85.9	Confident	88 Å²	88	37.5 Å²	37.5	73%	0.727	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-137.3	-18	-175.3	0	0	0	0	0	115.7	D434	D434-A437 WeakPolarHBondContact OD2-CA 3.42Å; D434-A437 WeakPolarHBondContact OD2-CB 3.46Å; D434-A437 PolarHBondContact OD2-N 3.3Å
438	A	72.3	Confident	85.6	Confident	35 Å²	35	43.1 Å²	43.1	29%	0.289	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-82.3	159.5	179.1	0	0	0	0	0	112.5	W432 P433 D434	W432-A438 PolarHBondContact NE1-O 3.21Å; P433-A438 HydrophobicContact CG-CB 3.88Å; D434-A438 HydrophobicContact CB-CB 4.13Å; D434-A438 VanDerWaalsContact O-CB 3.29Å; D434-A438 WeakPolarHBondContact O-CB 3.37Å; D434-A438 PolarHBondContact O-N 3.42Å
439	R	75.8	Confident	85.4	Confident	194 Å²	194	45.4 Å²	45.4	73%	0.732	24%	0.239	S	C	*	.	P	Polyproline II helix	trans	-88.5	141.2	164.6	-68	-171.3	-178.7	-157.4	0.8	110.1
440	P	81.4	Confident	85.2	Confident	20 Å²	20	45.4 Å²	45.4	13%	0.13	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-72.1	158.3	173	30.5	-34.8	0	0	0	112.4	F430 W432	F430-P440 HydrophobicContact CE2-CB 3.5Å; F430-P440 HydrophobicContact CE2-CG 4.25Å; F430-P440 HydrophobicContact CZ-CB 3.45Å; F430-P440 VanDerWaalsContact CZ-CB 3.45Å; F430-P440 HydrophobicContact CZ-CG 4.16Å; W432-P440 HydrophobicContact CB-CB 4.08Å; W432-P440 HydrophobicContact CD2-CB 3.83Å; W432-P440 HydrophobicContact CD2-CG 4.19Å; W432-P440 HydrophobicContact CE3-CB 4.09Å; W432-P440 HydrophobicContact CE3-CG 4.3Å; W432-P440 HydrophobicContact CG-CB 3.83Å
441	V	85.7	Confident	85.1	Confident	9 Å²	9	46.9 Å²	46.9	6%	0.055	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	140.9	178.7	-177.6	0	0	0	0	109.2	Y431 F443 F464 L480	Y431-V441 PolarHBondContact N-O 2.84Å; Y431-V441 PolarHBondContact O-N 2.93Å; V441-F443 HydrophobicContact CB-CE2 4.08Å; V441-F443 HydrophobicContact CG1-CD2 4.08Å; V441-F443 HydrophobicContact CG1-CE1 4.4Å; V441-F443 HydrophobicContact CG1-CE2 3.62Å; V441-F443 HydrophobicContact CG1-CZ 3.8Å; V441-F464 HydrophobicContact CG2-CE2 4.15Å; V441-F464 HydrophobicContact CG2-CZ 4.45Å; V441-L480 HydrophobicContact CG1-CD1 3.6Å; V441-L480 HydrophobicContact CG1-CG 4.25Å
442	K	88.4	Confident	85	Confident	43 Å²	43	50.5 Å²	50.5	19%	0.187	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	116.7	170.5	-165.5	163.1	-171.6	164.4	0	110.1	E401 S428 L429 F430 I481	E401-K442 IonicContact OE1-NZ 3.41Å; E401-K442 PolarHBondContact OE1-NZ 3.12Å; E401-K442 IonicContact OE2-NZ 3.17Å; E401-K442 PolarHBondContact OE2-NZ 2.86Å; S428-K442 VanDerWaalsContact CB-CE 3.46Å; S428-K442 WeakPolarHBondContact OG-CE 3.48Å; L429-K442 WeakPolarHBondContact O-CA 3.49Å; F430-K442 HydrophobicContact CD2-CB 4.43Å; K442-I481 PolarHBondContact N-O 2.83Å; K442-I481 WeakPolarHBondContact O-CB 3.46Å; K442-I481 PolarHBondContact O-N 2.68Å
443	F	91.5	Very high	85	Confident	5 Å²	5	50.7 Å²	50.7	2%	0.022	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	136.9	171.5	-57.4	-97.5	0	0	0	108.2	S428 L429 V441 W445 V467 P478 L480	S428-F443 CarbonylContact C-O 3.17Å; S428-F443 WeakPolarHBondContact CA-O 3.49Å; S428-F443 WeakPolarHBondContact CB-O 3.49Å; L429-F443 HydrophobicContact CB-CB 4.34Å; L429-F443 HydrophobicContact CB-CD2 4.48Å; L429-F443 HydrophobicContact CD2-CD2 4.13Å; L429-F443 HydrophobicContact CG-CD2 4.4Å; L429-F443 PolarHBondContact N-O 2.87Å; L429-F443 PolarHBondContact O-N 3.21Å; V441-F443 HydrophobicContact CB-CE2 4.08Å; V441-F443 HydrophobicContact CG1-CD2 4.08Å; V441-F443 HydrophobicContact CG1-CE1 4.4Å; V441-F443 HydrophobicContact CG1-CE2 3.62Å; V441-F443 HydrophobicContact CG1-CZ 3.8Å; F443-W445 HydrophobicContact CB-CH2 3.71Å; F443-W445 HydrophobicContact CB-CZ2 4.28Å; F443-W445 HydrophobicContact CB-CZ3 3.98Å; F443-V467 HydrophobicContact CD1-CB 4.02Å; F443-V467 HydrophobicContact CD1-CG2 4.09Å; F443-V467 HydrophobicContact CD2-CG2 4.09Å; F443-V467 HydrophobicContact CE1-CB 3.93Å; F443-V467 HydrophobicContact CE1-CG2 3.67Å; F443-V467 HydrophobicContact CE2-CG2 3.68Å; F443-V467 HydrophobicContact CG-CB 4.39Å; F443-V467 HydrophobicContact CG-CG2 4.29Å; F443-V467 HydrophobicContact CZ-CB 4.24Å; F443-V467 HydrophobicContact CZ-CG2 3.45Å; F443-V467 VanDerWaalsContact CZ-CG2 3.45Å; F443-P478 HydrophobicContact CB-CB 3.94Å; F443-P478 HydrophobicContact CD1-CB 3.88Å; F443-P478 HydrophobicContact CD1-CG 3.93Å; F443-P478 HydrophobicContact CG-CB 4.42Å; F443-L480 HydrophobicContact CD1-CD1 3.73Å; F443-L480 HydrophobicContact CE1-CD1 3.39Å; F443-L480 HydrophobicContact CZ-CD1 3.98Å
444	L	92.1	Very high	85.2	Confident	32 Å²	32	53.5 Å²	53.5	17%	0.168	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	127.3	-173.7	-176.8	72.5	0	0	0	111.4	R426 A479 I481	R426-L444 HydrophobicContact CB-CD1 4.08Å; L444-A479 HydrophobicContact CB-CB 4.43Å; L444-A479 PolarHBondContact N-O 3.33Å; L444-A479 WeakPolarHBondContact O-CB 3.29Å; L444-A479 PolarHBondContact O-N 2.83Å; L444-I481 HydrophobicContact CB-CD1 4.35Å; L444-I481 HydrophobicContact CD2-CD1 3.92Å
445	W	94.3	Very high	85.4	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.015	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	142	174.4	-59.8	-91.6	0	0	0	110.3	R426 L427 L429 F443 L447 L460 V467 L469 F476 D477 P478	R426-W445 WeakPolarHBondContact CA-O 3.47Å; R426-W445 VanDerWaalsContact CB-O 3.29Å; R426-W445 WeakPolarHBondContact CB-O 3.24Å; L427-W445 HydrophobicContact CB-CE3 4.44Å; L427-W445 HydrophobicContact CD2-CE3 4.31Å; L427-W445 HydrophobicContact CG-CE3 4.41Å; L427-W445 PolarHBondContact N-O 3.45Å; L427-W445 VanDerWaalsContact N-O 3.1Å; L427-W445 PolarHBondContact O-N 2.86Å; L429-W445 HydrophobicContact CB-CH2 4.1Å; L429-W445 HydrophobicContact CB-CZ3 3.92Å; F443-W445 HydrophobicContact CB-CH2 3.71Å; F443-W445 HydrophobicContact CB-CZ2 4.28Å; F443-W445 HydrophobicContact CB-CZ3 3.98Å; W445-L447 HydrophobicContact CB-CD1 4.06Å; W445-L447 HydrophobicContact CB-CD2 4.24Å; W445-L447 HydrophobicContact CB-CG 3.91Å; W445-L460 HydrophobicContact CH2-CD1 3.72Å; W445-L460 HydrophobicContact CZ2-CD1 4.21Å; W445-L460 HydrophobicContact CZ3-CD1 4.44Å; W445-V467 HydrophobicContact CH2-CG1 3.86Å; W445-V467 HydrophobicContact CZ2-CG1 4Å; W445-L469 HydrophobicContact CB-CD2 4.27Å; W445-L469 HydrophobicContact CD2-CB 4.27Å; W445-L469 HydrophobicContact CD2-CD2 3.66Å; W445-L469 HydrophobicContact CE3-CD2 4.16Å; W445-L469 HydrophobicContact CG-CD2 3.71Å; W445-L469 HydrophobicContact CH2-CB 4.43Å; W445-L469 HydrophobicContact CZ2-CB 3.68Å; W445-F476 PolarHBondContact NE1-O 2.8Å; W445-D477 VanDerWaalsContact CD1-O 3.28Å; W445-P478 HydrophobicContact CD2-CB 4.43Å; W445-P478 HydrophobicContact CH2-CB 4.5Å; W445-P478 HydrophobicContact CZ2-CB 3.72Å; W445-P478 HydrophobicContact CZ2-CG 4.28Å
446	K	92.1	Very high	85.9	Confident	140 Å²	140	52.7 Å²	52.7	61%	0.609	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	115.3	166.7	-173.3	-136.3	175.3	-151.6	0	107.7	E448	K446-E448 IonicContact NZ-OE1 3.55Å; K446-E448 PolarHBondContact NZ-OE1 2.8Å
447	L	90.9	Very high	86.6	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.01	25%	0.247	C	C	.	.			trans	-133.3	133.7	-172.4	-59.4	172.7	0	0	0	108.7	C425 L427 W445 V450 L469 V471 F476	C425-L447 CarbonylContact C-O 3.47Å; C425-L447 VanDerWaalsContact C-O 3.3Å; C425-L447 WeakPolarHBondContact CB-O 3.4Å; C425-L447 PolarHBondContact O-N 2.84Å; C425-L447 VanDerWaalsContact O-N 3.17Å; C425-L447 VanDerWaalsContact O-O 3.14Å; L427-L447 HydrophobicContact CB-CD1 3.76Å; L427-L447 HydrophobicContact CD2-CD1 4.11Å; W445-L447 HydrophobicContact CB-CD1 4.06Å; W445-L447 HydrophobicContact CB-CD2 4.24Å; W445-L447 HydrophobicContact CB-CG 3.91Å; L447-V450 HydrophobicContact CB-CB 4.46Å; L447-V450 HydrophobicContact CB-CG2 3.79Å; L447-V450 HydrophobicContact CD1-CG2 4.1Å; L447-L469 HydrophobicContact CD1-CD2 3.83Å; L447-V471 HydrophobicContact CD1-CG2 3.98Å; L447-V471 HydrophobicContact CD2-CG2 4.07Å; L447-F476 HydrophobicContact CD2-CB 4.42Å; L447-F476 HydrophobicContact CD2-CD1 3.48Å; L447-F476 VanDerWaalsContact CD2-CD1 3.48Å; L447-F476 HydrophobicContact CD2-CD2 4.34Å; L447-F476 HydrophobicContact CD2-CE1 3.7Å; L447-F476 HydrophobicContact CD2-CG 3.83Å; L447-F476 HydrophobicContact CD2-CZ 4.24Å
448	E	88.4	Confident	87.7	Confident	119 Å²	119	44.4 Å²	44.4	56%	0.556	21%	0.214	S	C	*	.	S	Bend	trans	-87.6	-25.5	179.8	-59.9	-172.9	173.4	0	0	110.2	K446 V450 C451 D452	K446-E448 IonicContact NZ-OE1 3.55Å; K446-E448 PolarHBondContact NZ-OE1 2.8Å; E448-V450 PolarHBondContact O-N 3.45Å; E448-C451 WeakPolarHBondContact O-CA 3.46Å; E448-C451 PolarHBondContact O-N 2.84Å; E448-D452 PolarHBondContact O-N 3.16Å; E448-D452 VanDerWaalsContact O-N 3.1Å
449	Q	89.1	Confident	88.8	Confident	51 Å²	51	42.8 Å²	42.8	24%	0.238	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	0.8	163.7	-59.8	85.9	-5.8	0	0	115.6	D452 H456 V471	Q449-D452 VanDerWaalsContact CA-OD2 3.31Å; Q449-D452 WeakPolarHBondContact CA-OD2 3.37Å; Q449-H456 HydrophobicContact CB-CB 4.46Å; Q449-H456 PolarHBondContact O-CD2 3.25Å; Q449-V471 HydrophobicContact CB-CG1 4.08Å; Q449-V471 HydrophobicContact CG-CG1 3.98Å
450	V	89	Confident	89.7	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.006	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	2.9	176.7	177.4	0	0	0	0	110.5	M380 R382 V422 L447 E448	M380-V450 HydrophobicContact CE-CG2 4.5Å; R382-V450 WeakPolarHBondContact CD-O 3.32Å; R382-V450 PolarHBondContact NH1-O 3.05Å; V422-V450 HydrophobicContact CB-CG1 3.77Å; V422-V450 HydrophobicContact CG1-CG1 3.6Å; L447-V450 HydrophobicContact CB-CB 4.46Å; L447-V450 HydrophobicContact CB-CG2 3.79Å; L447-V450 HydrophobicContact CD1-CG2 4.1Å; E448-V450 PolarHBondContact O-N 3.45Å
451	C	87.1	Confident	90.2	Very high	43 Å²	43	33 Å²	33	29%	0.291	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-142.2	-23.5	-170.8	-86.4	0	0	0	0	115.6	C425 E448 S453	C425-C451 WeakPolarHBondContact CA-SG 3.38Å; C425-C451 HydrophobicContact CB-CB 3.86Å; C425-C451 WeakPolarHBondContact CB-SG 3.46Å; C425-C451 PolarHBondContact N-SG 3.46Å; C425-C451 VanDerWaalsContact N-SG 3.4Å; C425-C451 WeakPolarHBondContact SG-CB 3.47Å; C425-C451 CovalentContact SG-SG 2.04Å; C425-C451 PolarHBondContact SG-SG 2.85Å; E448-C451 WeakPolarHBondContact O-CA 3.46Å; E448-C451 PolarHBondContact O-N 2.84Å; C451-S453 PolarHBondContact O-N 2.83Å
452	D	86.4	Confident	90.4	Very high	78 Å²	78	32.6 Å²	32.6	42%	0.417	16%	0.159	S	C	.	.	S	Bend	trans	-64.6	-25.2	173.1	45.9	18.8	0	0	0	113.5	E448 Q449 H456	E448-D452 PolarHBondContact O-N 3.16Å; E448-D452 VanDerWaalsContact O-N 3.1Å; Q449-D452 VanDerWaalsContact CA-OD2 3.31Å; Q449-D452 WeakPolarHBondContact CA-OD2 3.37Å; D452-H456 IonicContact OD1-CD2 3.23Å; D452-H456 IonicContact OD1-NE2 2.87Å; D452-H456 PolarHBondContact OD1-NE2 3.12Å; D452-H456 IonicContact OD2-CE1 2.67Å; D452-H456 IonicContact OD2-NE2 2.75Å; D452-H456 PolarHBondContact OD2-NE2 3.43Å
453	S	86.3	Confident	90.4	Very high	26 Å²	26	35.4 Å²	35.4	18%	0.182	17%	0.173	C	C	.	.			trans	76.3	24.6	178.7	-36.3	0	0	0	0	114.3	R381 G384 C451	R381-S453 WeakPolarHBondContact CG-O 3.48Å; R381-S453 PolarHBondContact NE-O 2.92Å; R381-S453 PolarHBondContact NH2-O 3.01Å; G384-S453 WeakPolarHBondContact CA-OG 3.29Å; C451-S453 PolarHBondContact O-N 2.83Å
454	E	87	Confident	90	Very high	77 Å²	77	38.5 Å²	38.5	36%	0.36	19%	0.187	S	C	.	.	S	Bend	trans	-98.7	-179.3	174	-71.4	-57.3	112.1	0	0	112.4	R381 H456	R381-E454 WeakPolarHBondContact CA-O 3.49Å; R381-E454 WeakPolarHBondContact CB-O 3.34Å; R381-E454 WeakPolarHBondContact CG-O 3.18Å; R381-E454 IonicContact CZ-OE1 3.07Å; R381-E454 IonicContact NH2-OE1 2.83Å; R381-E454 PolarHBondContact NH2-OE1 3.45Å; E454-H456 PolarHBondContact O-CD2 3.07Å
455	W	88.4	Confident	89.6	Confident	31 Å²	31	41.7 Å²	41.7	12%	0.117	21%	0.209	C	C	.	.			trans	-86.9	124.7	178.2	-83	117.1	0	0	0	111.5	K299 V349 W379 R381 L532	K299-W455 HydrophobicContact CB-CB 4.22Å; K299-W455 HydrophobicContact CB-CG 4.21Å; K299-W455 HydrophobicContact CG-CD2 4.46Å; V349-W455 HydrophobicContact CG1-CH2 3.86Å; V349-W455 HydrophobicContact CG1-CZ2 3.88Å; V349-W455 HydrophobicContact CG2-CH2 4.03Å; V349-W455 HydrophobicContact CG2-CZ2 3.86Å; W379-W455 HydrophobicContact CB-CE3 4.14Å; W379-W455 HydrophobicContact CB-CZ3 4.06Å; R381-W455 HydrophobicContact CB-CD2 3.57Å; R381-W455 HydrophobicContact CB-CE3 3.56Å; R381-W455 HydrophobicContact CB-CG 4.1Å; R381-W455 HydrophobicContact CB-CH2 4.23Å; R381-W455 HydrophobicContact CB-CZ2 4.26Å; R381-W455 HydrophobicContact CB-CZ3 3.89Å; R381-W455 HydrophobicContact CG-CD2 4.47Å; W455-L532 HydrophobicContact CH2-CB 3.65Å; W455-L532 HydrophobicContact CZ2-CB 4.06Å; W455-L532 HydrophobicContact CZ2-CD1 4.12Å; W455-L532 HydrophobicContact CZ3-CB 4.4Å
456	H	90.4	Very high	89.2	Confident	15 Å²	15	45 Å²	45	7%	0.069	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	143.4	177.2	-59.8	-75.4	0	0	0	111.7	W379 M380 Q449 D452 E454 V471 D472	W379-H456 WeakPolarHBondContact CA-O 3.37Å; M380-H456 PolarHBondContact N-O 2.83Å; M380-H456 PolarHBondContact O-N 2.64Å; Q449-H456 HydrophobicContact CB-CB 4.46Å; Q449-H456 PolarHBondContact O-CD2 3.25Å; D452-H456 IonicContact OD1-CD2 3.23Å; D452-H456 IonicContact OD1-NE2 2.87Å; D452-H456 PolarHBondContact OD1-NE2 3.12Å; D452-H456 IonicContact OD2-CE1 2.67Å; D452-H456 IonicContact OD2-NE2 2.75Å; D452-H456 PolarHBondContact OD2-NE2 3.43Å; E454-H456 PolarHBondContact O-CD2 3.07Å; H456-V471 HydrophobicContact CB-CG1 4.47Å; H456-D472 WeakPolarHBondContact CA-OD1 3.46Å; H456-D472 IonicContact CE1-OD2 3.62Å; H456-D472 IonicContact CG-OD2 2.9Å; H456-D472 IonicContact ND1-OD1 2.78Å; H456-D472 IonicContact ND1-OD2 3.45Å; H456-D472 PolarHBondContact ND1-OD2 2.67Å
457	H	91.6	Very high	89.1	Confident	3 Å²	3	38.9 Å²	38.9	1%	0.014	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	117.7	173.5	-177.7	-125.4	0	0	0	110	W379 V471 D472 Y553	W379-H457 HydrophobicContact CD2-CB 4.02Å; W379-H457 AromaticContact CE2-CD2 3.86Å; W379-H457 HydrophobicContact CE3-CB 3.79Å; W379-H457 HydrophobicContact CH2-CB 3.92Å; W379-H457 HydrophobicContact CZ2-CB 4.14Å; W379-H457 HydrophobicContact CZ3-CB 3.75Å; W379-H457 AromaticContact NE1-CD2 3.93Å; H457-V471 WeakPolarHBondContact O-CA 3.33Å; H457-D472 PolarHBondContact N-OD1 2.95Å; H457-D472 PolarHBondContact O-N 3.36Å; H457-Y553 HydrophobicContact CB-CD2 3.98Å
458	L	94.3	Very high	89.2	Confident	5 Å²	5	41.4 Å²	41.4	3%	0.026	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	122.2	172.9	-58.8	-173.5	0	0	0	109.9	Q377 L378 M380 L427 L469 V471	Q377-L458 WeakPolarHBondContact CA-O 3Å; L378-L458 HydrophobicContact CD1-CB 4.35Å; L378-L458 HydrophobicContact CD1-CD1 4.18Å; L378-L458 HydrophobicContact CD1-CG 4.49Å; L378-L458 HydrophobicContact CG-CB 4.33Å; L378-L458 PolarHBondContact N-O 2.68Å; L378-L458 PolarHBondContact O-N 3.48Å; M380-L458 HydrophobicContact CG-CD1 3.92Å; M380-L458 HydrophobicContact CG-CG 4.19Å; M380-L458 HydrophobicContact SD-CD1 3.57Å; M380-L458 VanDerWaalsContact SD-CD1 3.57Å; M380-L458 HydrophobicContact SD-CG 4.42Å; L427-L458 HydrophobicContact CD1-CD1 4.16Å; L427-L458 HydrophobicContact CD2-CD1 3.95Å; L458-L469 HydrophobicContact CD2-CD1 4.47Å; L458-V471 HydrophobicContact CD2-CB 4.17Å; L458-V471 HydrophobicContact CD2-CG1 3.85Å; L458-V471 HydrophobicContact CD2-CG2 3.73Å
459	S	94.1	Very high	89.5	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	110.7	168	-177.2	0	0	0	0	109.1	Q377 Y470	Q377-S459 WeakPolarHBondContact CG-OG 3.25Å; Q377-S459 PolarHBondContact NE2-OG 2.75Å; S459-Y470 PolarHBondContact N-O 2.86Å; S459-Y470 PolarHBondContact O-N 3.4Å
460	L	94.5	Very high	89.7	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	105.7	-175.2	179.9	64.3	0	0	0	109.7	T375 L376 L420 L429 W445 V462 V467 L469	T375-L460 WeakPolarHBondContact CA-O 3.4Å; L376-L460 HydrophobicContact CB-CB 4.4Å; L376-L460 HydrophobicContact CD2-CD2 4.42Å; L376-L460 PolarHBondContact N-O 3.3Å; L376-L460 PolarHBondContact O-N 2.88Å; L420-L460 HydrophobicContact CD1-CD2 3.85Å; L420-L460 HydrophobicContact CD2-CD2 4.48Å; L429-L460 HydrophobicContact CB-CD2 4.31Å; L429-L460 HydrophobicContact CD1-CD2 4.08Å; L429-L460 HydrophobicContact CD2-CD2 4.17Å; L429-L460 HydrophobicContact CG-CD2 4.4Å; W445-L460 HydrophobicContact CH2-CD1 3.72Å; W445-L460 HydrophobicContact CZ2-CD1 4.21Å; W445-L460 HydrophobicContact CZ3-CD1 4.44Å; L460-V462 HydrophobicContact CG-CG2 4.24Å; L460-V467 HydrophobicContact CD1-CG1 3.54Å; L460-L469 HydrophobicContact CB-CD1 4.33Å; L460-L469 HydrophobicContact CD1-CB 4.3Å; L460-L469 HydrophobicContact CD1-CD1 4.18Å
461	S	92.8	Very high	89.9	Confident	7 Å²	7	34.8 Å²	34.8	5%	0.049	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	114.2	179.3	-61.1	0	0	0	0	110	V467 T468	S461-V467 WeakPolarHBondContact O-CA 3.27Å; S461-T468 PolarHBondContact N-O 2.87Å; S461-T468 PolarHBondContact O-N 3.34Å
462	V	90.4	Very high	90	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	116.3	179.5	179.9	0	0	0	0	109.2	H373 F374 L429 Y431 L460 V467	H373-V462 WeakPolarHBondContact CA-O 3.24Å; F374-V462 HydrophobicContact CD1-CB 4.09Å; F374-V462 HydrophobicContact CD1-CG1 4.32Å; F374-V462 HydrophobicContact CD2-CB 4.48Å; F374-V462 HydrophobicContact CD2-CG2 4.46Å; F374-V462 HydrophobicContact CE1-CB 3.81Å; F374-V462 HydrophobicContact CE1-CG1 3.8Å; F374-V462 HydrophobicContact CE1-CG2 4.11Å; F374-V462 HydrophobicContact CE2-CB 4.23Å; F374-V462 HydrophobicContact CE2-CG2 3.85Å; F374-V462 HydrophobicContact CG-CB 4.42Å; F374-V462 HydrophobicContact CZ-CB 3.89Å; F374-V462 HydrophobicContact CZ-CG1 4.16Å; F374-V462 HydrophobicContact CZ-CG2 3.65Å; F374-V462 PolarHBondContact N-O 2.91Å; F374-V462 PolarHBondContact O-N 2.82Å; L429-V462 HydrophobicContact CD2-CG2 3.76Å; Y431-V462 HydrophobicContact CD2-CG1 4.46Å; Y431-V462 HydrophobicContact CE2-CG1 4.26Å; L460-V462 HydrophobicContact CG-CG2 4.24Å; V462-V467 HydrophobicContact CG1-CG2 4.31Å; V462-V467 HydrophobicContact CG2-CG1 4.3Å; V462-V467 HydrophobicContact CG2-CG2 4.4Å
463	Q	88.7	Confident	89.9	Confident	103 Å²	103	30.5 Å²	30.5	48%	0.481	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	69.9	173.8	-167.2	-176.2	17.6	0	0	108.4	S466 V543	Q463-S466 CarbonylContact C-O 3.59Å; Q463-S466 PolarHBondContact N-O 3.15Å; Q463-S466 WeakPolarHBondContact O-CA 3.38Å; Q463-S466 WeakPolarHBondContact O-CB 3.47Å; Q463-S466 PolarHBondContact O-N 3.07Å; Q463-S466 VanDerWaalsContact O-O 3.08Å; Q463-V543 HydrophobicContact CB-CG2 4.31Å
464	F	82.9	Confident	89.9	Confident	70 Å²	70	32.4 Å²	32.4	31%	0.307	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	132.1	-165.8	-174.9	-94.4	0	0	0	112.5	Y431 P433 V441	Y431-F464 HydrophobicContact CD1-CB 4.43Å; Y431-F464 AromaticContact CD1-CD2 3.38Å; Y431-F464 HydrophobicContact CD1-CD2 3.38Å; Y431-F464 AromaticContact CD1-CE2 3.86Å; Y431-F464 HydrophobicContact CD1-CE2 3.86Å; Y431-F464 HydrophobicContact CD1-CG 4.07Å; Y431-F464 HydrophobicContact CE1-CB 3.73Å; Y431-F464 HydrophobicContact CE1-CD1 4.47Å; Y431-F464 AromaticContact CE1-CD2 3.45Å; Y431-F464 HydrophobicContact CE1-CD2 3.45Å; Y431-F464 VanDerWaalsContact CE1-CD2 3.45Å; Y431-F464 HydrophobicContact CE1-CE2 4.2Å; Y431-F464 AromaticContact CE1-CG 3.62Å; Y431-F464 HydrophobicContact CE1-CG 3.62Å; P433-F464 HydrophobicContact CG-CD1 4.31Å; P433-F464 HydrophobicContact CG-CE1 3.95Å; P433-F464 HydrophobicContact CG-CE2 4.48Å; P433-F464 HydrophobicContact CG-CZ 4.04Å; V441-F464 HydrophobicContact CG2-CE2 4.15Å; V441-F464 HydrophobicContact CG2-CZ 4.45Å
465	P	82.1	Confident	90.1	Very high	98 Å²	98	32.6 Å²	32.6	64%	0.636	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	cis	-80.5	-7.1	11.6	33.3	-37.7	0	0	0	116.2
466	S	87.3	Confident	90.3	Very high	75 Å²	75	33.9 Å²	33.9	52%	0.524	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	141.9	-179.5	-63.8	0	0	0	0	112.1	Q463	Q463-S466 CarbonylContact C-O 3.59Å; Q463-S466 PolarHBondContact N-O 3.15Å; Q463-S466 WeakPolarHBondContact O-CA 3.38Å; Q463-S466 WeakPolarHBondContact O-CB 3.47Å; Q463-S466 PolarHBondContact O-N 3.07Å; Q463-S466 VanDerWaalsContact O-O 3.08Å
467	V	90.5	Very high	90.2	Very high	10 Å²	10	40.5 Å²	40.5	6%	0.061	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	125.6	172.6	179.7	0	0	0	0	108.7	L429 F443 W445 L460 S461 V462	L429-V467 HydrophobicContact CD2-CG1 3.91Å; L429-V467 HydrophobicContact CD2-CG2 4.1Å; F443-V467 HydrophobicContact CD1-CB 4.02Å; F443-V467 HydrophobicContact CD1-CG2 4.09Å; F443-V467 HydrophobicContact CD2-CG2 4.09Å; F443-V467 HydrophobicContact CE1-CB 3.93Å; F443-V467 HydrophobicContact CE1-CG2 3.67Å; F443-V467 HydrophobicContact CE2-CG2 3.68Å; F443-V467 HydrophobicContact CG-CB 4.39Å; F443-V467 HydrophobicContact CG-CG2 4.29Å; F443-V467 HydrophobicContact CZ-CB 4.24Å; F443-V467 HydrophobicContact CZ-CG2 3.45Å; F443-V467 VanDerWaalsContact CZ-CG2 3.45Å; W445-V467 HydrophobicContact CH2-CG1 3.86Å; W445-V467 HydrophobicContact CZ2-CG1 4Å; L460-V467 HydrophobicContact CD1-CG1 3.54Å; S461-V467 WeakPolarHBondContact O-CA 3.27Å; V462-V467 HydrophobicContact CG1-CG2 4.31Å; V462-V467 HydrophobicContact CG2-CG1 4.3Å; V462-V467 HydrophobicContact CG2-CG2 4.4Å
468	T	92.3	Very high	90.1	Very high	55 Å²	55	42.3 Å²	42.3	34%	0.337	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	123.7	177.1	-53.5	0	0	0	0	108.9	S461 Y470 T475	S461-T468 PolarHBondContact N-O 2.87Å; S461-T468 PolarHBondContact O-N 3.34Å; T468-Y470 HydrophobicContact CG2-CD2 4.2Å; T468-Y470 HydrophobicContact CG2-CE2 3.63Å; T468-T475 HydrophobicContact CG2-CG2 4.33Å
469	L	94.6	Very high	89.7	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.8	169.3	177.7	67.7	0	0	0	109.2	L427 W445 L447 L458 L460 V471 T475 F476	L427-L469 HydrophobicContact CD2-CD1 4.01Å; L427-L469 HydrophobicContact CD2-CD2 3.69Å; W445-L469 HydrophobicContact CB-CD2 4.27Å; W445-L469 HydrophobicContact CD2-CB 4.27Å; W445-L469 HydrophobicContact CD2-CD2 3.66Å; W445-L469 HydrophobicContact CE3-CD2 4.16Å; W445-L469 HydrophobicContact CG-CD2 3.71Å; W445-L469 HydrophobicContact CH2-CB 4.43Å; W445-L469 HydrophobicContact CZ2-CB 3.68Å; L447-L469 HydrophobicContact CD1-CD2 3.83Å; L458-L469 HydrophobicContact CD2-CD1 4.47Å; L460-L469 HydrophobicContact CB-CD1 4.33Å; L460-L469 HydrophobicContact CD1-CB 4.3Å; L460-L469 HydrophobicContact CD1-CD1 4.18Å; L469-V471 HydrophobicContact CD1-CG2 4.41Å; L469-V471 HydrophobicContact CD2-CG2 3.7Å; L469-V471 HydrophobicContact CG-CG2 3.84Å; L469-T475 CarbonylContact O-C 3.56Å; L469-T475 WeakPolarHBondContact O-CA 3.35Å; L469-F476 HydrophobicContact CD2-CB 4.44Å; L469-F476 PolarHBondContact O-N 3.4Å
470	Y	93.4	Very high	89.1	Confident	30 Å²	30	49.3 Å²	49.3	12%	0.118	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	128.9	161.2	-55.3	-97.7	0	0	0	108.3	S459 T468 V474 T475 H546 V549	S459-Y470 PolarHBondContact N-O 2.86Å; S459-Y470 PolarHBondContact O-N 3.4Å; T468-Y470 HydrophobicContact CG2-CD2 4.2Å; T468-Y470 HydrophobicContact CG2-CE2 3.63Å; Y470-V474 CarbonylContact C-O 3.54Å; Y470-V474 VanDerWaalsContact CA-O 3.29Å; Y470-V474 WeakPolarHBondContact CA-O 3.36Å; Y470-T475 HydrophobicContact CD1-CG2 3.66Å; Y470-T475 HydrophobicContact CE1-CG2 3.36Å; Y470-H546 AromaticContact CD1-ND1 3.99Å; Y470-H546 AromaticContact CE1-CE1 3.7Å; Y470-H546 AromaticContact CE1-CG 3.93Å; Y470-H546 AromaticContact CE1-ND1 3.49Å; Y470-H546 WeakPolarHBondContact CE1-ND1 3.28Å; Y470-V549 HydrophobicContact CD1-CG1 4.36Å; Y470-V549 HydrophobicContact CD2-CG1 4.37Å; Y470-V549 HydrophobicContact CG-CG1 3.95Å
471	V	92.4	Very high	88.2	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.012	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	120.7	167.4	-171.9	0	0	0	0	105.9	L447 Q449 H456 H457 L458 L469 G473 V474 F476	L447-V471 HydrophobicContact CD1-CG2 3.98Å; L447-V471 HydrophobicContact CD2-CG2 4.07Å; Q449-V471 HydrophobicContact CB-CG1 4.08Å; Q449-V471 HydrophobicContact CG-CG1 3.98Å; H456-V471 HydrophobicContact CB-CG1 4.47Å; H457-V471 WeakPolarHBondContact O-CA 3.33Å; L458-V471 HydrophobicContact CD2-CB 4.17Å; L458-V471 HydrophobicContact CD2-CG1 3.85Å; L458-V471 HydrophobicContact CD2-CG2 3.73Å; L469-V471 HydrophobicContact CD1-CG2 4.41Å; L469-V471 HydrophobicContact CD2-CG2 3.7Å; L469-V471 HydrophobicContact CG-CG2 3.84Å; V471-G473 PolarHBondContact O-N 2.77Å; V471-V474 PolarHBondContact N-O 3.45Å; V471-V474 PolarHBondContact O-N 3.12Å; V471-F476 HydrophobicContact CB-CD2 3.88Å; V471-F476 HydrophobicContact CB-CE2 3.66Å; V471-F476 HydrophobicContact CG2-CD2 3.68Å; V471-F476 HydrophobicContact CG2-CE2 3.93Å; V471-F476 HydrophobicContact CG2-CG 4.38Å
472	D	89.1	Confident	86.9	Confident	19 Å²	19	58.3 Å²	58.3	10%	0.102	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	41.4	176.8	-63.2	-15.8	0	0	0	113	H456 H457 V474 Y553	H456-D472 WeakPolarHBondContact CA-OD1 3.46Å; H456-D472 IonicContact CE1-OD2 3.62Å; H456-D472 IonicContact CG-OD2 2.9Å; H456-D472 IonicContact ND1-OD1 2.78Å; H456-D472 IonicContact ND1-OD2 3.45Å; H456-D472 PolarHBondContact ND1-OD2 2.67Å; H457-D472 PolarHBondContact N-OD1 2.95Å; H457-D472 PolarHBondContact O-N 3.36Å; D472-V474 PolarHBondContact O-N 2.88Å; D472-V474 VanDerWaalsContact O-N 3.14Å; D472-Y553 VanDerWaalsContact C-CD1 3.48Å; D472-Y553 HydrophobicContact CB-CD1 4.44Å; D472-Y553 HydrophobicContact CB-CD2 4Å; D472-Y553 HydrophobicContact CB-CE1 3.98Å; D472-Y553 HydrophobicContact CB-CE2 3.45Å; D472-Y553 VanDerWaalsContact CB-CE2 3.45Å; D472-Y553 HydrophobicContact CB-CG 4.45Å; D472-Y553 VanDerWaalsContact CB-CZ 3.44Å; D472-Y553 VanDerWaalsContact CG-CE2 3.44Å; D472-Y553 WeakPolarHBondContact O-CD1 3.39Å; D472-Y553 WeakPolarHBondContact O-CE1 3.24Å; D472-Y553 VanDerWaalsContact OD1-CE2 3.29Å; D472-Y553 WeakPolarHBondContact OD1-CE2 3.34Å
473	G	84.8	Confident	85.5	Confident	12 Å²	12	60.9 Å²	60.9	12%	0.124	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	-22.4	-174.8	0	0	0	0	0	115.2	V471 H546	V471-G473 PolarHBondContact O-N 2.77Å; G473-H546 PolarHBondContact O-CE1 2.8Å
474	V	87.1	Confident	83.6	Confident	66 Å²	66	63 Å²	63	40%	0.4	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	135.2	-176.6	-178.6	0	0	0	0	111.3	Y470 V471 D472 F476 P577	Y470-V474 CarbonylContact C-O 3.54Å; Y470-V474 VanDerWaalsContact CA-O 3.29Å; Y470-V474 WeakPolarHBondContact CA-O 3.36Å; V471-V474 PolarHBondContact N-O 3.45Å; V471-V474 PolarHBondContact O-N 3.12Å; D472-V474 PolarHBondContact O-N 2.88Å; D472-V474 VanDerWaalsContact O-N 3.14Å; V474-F476 HydrophobicContact CB-CE2 3.95Å; V474-F476 HydrophobicContact CG1-CD2 4.48Å; V474-F476 HydrophobicContact CG1-CE2 3.88Å; V474-F476 HydrophobicContact CG1-CZ 4.36Å; V474-F476 VanDerWaalsContact O-CD2 3.29Å; V474-F476 WeakPolarHBondContact O-CD2 3.42Å; V474-P577 HydrophobicContact CG2-CG 3.98Å
475	T	91.2	Very high	82	Confident	80 Å²	80	63.1 Å²	63.1	49%	0.491	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	136.3	177	49.4	0	0	0	0	113	T468 L469 Y470	T468-T475 HydrophobicContact CG2-CG2 4.33Å; L469-T475 CarbonylContact O-C 3.56Å; L469-T475 WeakPolarHBondContact O-CA 3.35Å; Y470-T475 HydrophobicContact CD1-CG2 3.66Å; Y470-T475 HydrophobicContact CE1-CG2 3.36Å
476	F	91.4	Very high	80.4	Confident	58 Å²	58	63 Å²	63	25%	0.254	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	125.4	174.9	-72.3	-99.2	0	0	0	112.2	W445 L447 L469 V471 V474	W445-F476 PolarHBondContact NE1-O 2.8Å; L447-F476 HydrophobicContact CD2-CB 4.42Å; L447-F476 HydrophobicContact CD2-CD1 3.48Å; L447-F476 VanDerWaalsContact CD2-CD1 3.48Å; L447-F476 HydrophobicContact CD2-CD2 4.34Å; L447-F476 HydrophobicContact CD2-CE1 3.7Å; L447-F476 HydrophobicContact CD2-CG 3.83Å; L447-F476 HydrophobicContact CD2-CZ 4.24Å; L469-F476 HydrophobicContact CD2-CB 4.44Å; L469-F476 PolarHBondContact O-N 3.4Å; V471-F476 HydrophobicContact CB-CD2 3.88Å; V471-F476 HydrophobicContact CB-CE2 3.66Å; V471-F476 HydrophobicContact CG2-CD2 3.68Å; V471-F476 HydrophobicContact CG2-CE2 3.93Å; V471-F476 HydrophobicContact CG2-CG 4.38Å; V474-F476 HydrophobicContact CB-CE2 3.95Å; V474-F476 HydrophobicContact CG1-CD2 4.48Å; V474-F476 HydrophobicContact CG1-CE2 3.88Å; V474-F476 HydrophobicContact CG1-CZ 4.36Å; V474-F476 VanDerWaalsContact O-CD2 3.29Å; V474-F476 WeakPolarHBondContact O-CD2 3.42Å
477	D	88.1	Confident	78.8	Confident	155 Å²	155	62.1 Å²	62.1	83%	0.829	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-75.3	134.8	178.3	-69.4	-48.2	0	0	0	112.5	W445	W445-D477 VanDerWaalsContact CD1-O 3.28Å
478	P	90.6	Very high	77.2	Confident	40 Å²	40	65 Å²	65	26%	0.26	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-80.5	138.4	177.1	29.2	-32.1	0	0	0	113.1	F443 W445 L480	F443-P478 HydrophobicContact CB-CB 3.94Å; F443-P478 HydrophobicContact CD1-CB 3.88Å; F443-P478 HydrophobicContact CD1-CG 3.93Å; F443-P478 HydrophobicContact CG-CB 4.42Å; W445-P478 HydrophobicContact CD2-CB 4.43Å; W445-P478 HydrophobicContact CH2-CB 4.5Å; W445-P478 HydrophobicContact CZ2-CB 3.72Å; W445-P478 HydrophobicContact CZ2-CG 4.28Å; P478-L480 PolarHBondContact O-N 3.17Å
479	A	86.1	Confident	75.6	Confident	57 Å²	57	67.1 Å²	67.1	47%	0.471	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	116.4	155.5	0	0	0	0	0	109.1	L444	L444-A479 HydrophobicContact CB-CB 4.43Å; L444-A479 PolarHBondContact N-O 3.33Å; L444-A479 WeakPolarHBondContact O-CB 3.29Å; L444-A479 PolarHBondContact O-N 2.83Å
480	L	80.8	Confident	74.1	Confident	95 Å²	95	68 Å²	68	50%	0.497	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	125.9	179.4	-164.9	83	0	0	0	111.1	V441 F443 P478	V441-L480 HydrophobicContact CG1-CD1 3.6Å; V441-L480 HydrophobicContact CG1-CG 4.25Å; F443-L480 HydrophobicContact CD1-CD1 3.73Å; F443-L480 HydrophobicContact CE1-CD1 3.39Å; F443-L480 HydrophobicContact CZ-CD1 3.98Å; P478-L480 PolarHBondContact O-N 3.17Å
481	I	76.1	Confident	72.5	Confident	78 Å²	78	67.9 Å²	67.9	40%	0.4	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	115.5	173.7	-56.4	176.6	0	0	0	109	K442 L444	K442-I481 PolarHBondContact N-O 2.83Å; K442-I481 WeakPolarHBondContact O-CB 3.46Å; K442-I481 PolarHBondContact O-N 2.68Å; L444-I481 HydrophobicContact CB-CD1 4.35Å; L444-I481 HydrophobicContact CD2-CD1 3.92Å
482	H	65.6	Low	71.3	Confident	121 Å²	121	72.6 Å²	72.6	56%	0.56	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	119.8	164.1	-61.4	-61.2	0	0	0	108.8
483	D	60.1	Low	70.6	Confident	54 Å²	54	78.6 Å²	78.6	29%	0.289	46%	0.463	S	S	.	.			trans	-76.8	141.9	172.7	-159.7	-67.8	0	0	0	110.1	G485 A486 I487	D483-G485 PolarHBondContact OD1-N 2.93Å; D483-A486 PolarHBondContact OD1-N 2.85Å; D483-I487 HydrophobicContact CB-CD1 3.95Å
484	N	49.4	Very low	70.5	Confident	147 Å²	147	79 Å²	79	79%	0.786	46%	0.462	S	S	*	.			trans	-102.8	14.1	-175.3	-74.3	-54.3	0	0	0	113.7
485	G	50.2	Low	70.5	Confident	73 Å²	73	78 Å²	78	75%	0.753	45%	0.451	S	S	*	.	S	Bend	trans	112.1	52.3	160.3	0	0	0	0	0	115.4	D483	D483-G485 PolarHBondContact OD1-N 2.93Å
486	A	46.7	Very low	70.5	Confident	94 Å²	94	74.2 Å²	74.2	78%	0.777	43%	0.428	S	S	*	.			trans	-126.3	17.7	173	0	0	0	0	0	114.2	D483	D483-A486 PolarHBondContact OD1-N 2.85Å
487	I	54.7	Low	70.5	Confident	57 Å²	57	71.7 Å²	71.7	29%	0.292	42%	0.417	S	S	.	.	S	Bend	trans	-98.6	129.9	179.2	-58.5	178.8	0	0	0	108.7	F430 D483	F430-I487 HydrophobicContact CD2-CD1 4.07Å; F430-I487 HydrophobicContact CE1-CG2 4.31Å; F430-I487 HydrophobicContact CE2-CD1 3.24Å; F430-I487 HydrophobicContact CZ-CD1 3.66Å; F430-I487 HydrophobicContact CZ-CG2 3.89Å; D483-I487 HydrophobicContact CB-CD1 3.95Å
488	P	56.4	Low	70.8	Confident	71 Å²	71	64.3 Å²	64.3	46%	0.461	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-66.2	143.2	176.7	28.7	-34.9	0	0	0	110.6	P504	P488-P504 HydrophobicContact CB-CG 4.45Å
489	N	57.9	Low	70.8	Confident	100 Å²	100	62.4 Å²	62.4	54%	0.535	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-58.3	132.8	176.4	-85.3	6.2	0	0	0	110.4	W432 A491	W432-N489 WeakPolarHBondContact CH2-OD1 3.34Å; N489-A491 PolarHBondContact O-N 3.46Å
490	P	63.3	Low	70.9	Confident	18 Å²	18	59.8 Å²	59.8	12%	0.117	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-62.1	138.2	167.6	28.4	-33.6	0	0	0	108.6	H417 W432 V435	H417-P490 HydrophobicContact CB-CB 4.14Å; H417-P490 HydrophobicContact CB-CG 3.8Å; W432-P490 HydrophobicContact CE3-CG 4.34Å; W432-P490 HydrophobicContact CZ3-CG 4.49Å; V435-P490 HydrophobicContact CG1-CG 4.05Å; V435-P490 HydrophobicContact CG2-CG 3.74Å
491	A	61.1	Low	71.2	Confident	28 Å²	28	56.2 Å²	56.2	23%	0.231	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-58	134.9	179.1	0	0	0	0	0	110.1	N489 R493	N489-A491 PolarHBondContact O-N 3.46Å; A491-R493 PolarHBondContact O-N 2.97Å
492	P	66	Low	71.4	Confident	102 Å²	102	54.9 Å²	54.9	66%	0.662	32%	0.316	S	S	*	.	S	Bend	trans	-77.8	61.5	-173.3	32.9	-37.4	0	0	0	111.6	Y415	Y415-P492 HydrophobicContact CD2-CB 3.99Å; Y415-P492 VanDerWaalsContact CE2-C 3.46Å; Y415-P492 HydrophobicContact CE2-CB 3.73Å; Y415-P492 WeakPolarHBondContact CE2-O 3.38Å; Y415-P492 VanDerWaalsContact CZ-C 3.45Å; Y415-P492 VanDerWaalsContact CZ-O 3.27Å; Y415-P492 PolarHBondContact OH-O 2.88Å
493	R	75.4	Confident	71.8	Confident	144 Å²	144	50.3 Å²	50.3	54%	0.543	30%	0.295	S	S	.	.	S	Bend	trans	-147.7	123.9	-177.8	-179.6	174.8	178.3	168.6	1.1	109.3	A491 R495	A491-R493 PolarHBondContact O-N 2.97Å; R493-R495 HydrophobicContact CG-CG 4.48Å; R493-R495 PolarHBondContact O-N 3.07Å
494	Q	83.1	Confident	72	Confident	20 Å²	20	48.9 Å²	48.9	9%	0.093	29%	0.289	C	S	.	.			trans	-57.8	122.7	176.9	-175.1	-168.2	-47.9	0	0	111.2	N363 V366 S367 T408 K410 Y415	N363-Q494 PolarHBondContact ND2-O 2.87Å; N363-Q494 PolarHBondContact O-NE2 2.95Å; N363-Q494 PolarHBondContact OD1-O 3.25Å; V366-Q494 HydrophobicContact CB-CG 4.27Å; V366-Q494 HydrophobicContact CG1-CG 3.67Å; S367-Q494 PolarHBondContact OG-NE2 2.96Å; S367-Q494 PolarHBondContact OG-OE1 2.81Å; T408-Q494 VanDerWaalsContact O-CA 3.27Å; T408-Q494 WeakPolarHBondContact O-CA 3.44Å; K410-Q494 HydrophobicContact CB-CB 4.29Å; Y415-Q494 HydrophobicContact CE1-CB 4.36Å
495	R	87.3	Confident	72.3	Confident	46 Å²	46	46.8 Å²	46.8	17%	0.174	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	149.9	180	-72.7	-174.8	169.5	150.2	-8.4	109.5	T408 R493 L497 W502	T408-R495 PolarHBondContact N-O 2.91Å; T408-R495 PolarHBondContact O-N 3.4Å; R493-R495 HydrophobicContact CG-CG 4.48Å; R493-R495 PolarHBondContact O-N 3.07Å; R495-L497 HydrophobicContact CB-CD1 4.4Å; R495-W502 VanDerWaalsContact NH1-CD2 3.27Å; R495-W502 VanDerWaalsContact NH1-CZ2 3.35Å
496	M	90.1	Very high	72.5	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	139.5	168.5	-174	172.9	-164.8	0	0	110.8	L324 V361 V366 L369 V405 C406 S407 Y418 I498 V538	L324-M496 HydrophobicContact CD1-CE 3.48Å; L324-M496 VanDerWaalsContact CD1-CE 3.48Å; L324-M496 HydrophobicContact CD1-SD 4.15Å; L324-M496 HydrophobicContact CD2-CE 4.4Å; L324-M496 HydrophobicContact CD2-SD 3.98Å; V361-M496 HydrophobicContact CB-CB 4.19Å; V361-M496 PolarHBondContact N-O 2.87Å; V366-M496 HydrophobicContact CG1-CB 4.26Å; V366-M496 HydrophobicContact CG2-CB 3.48Å; V366-M496 VanDerWaalsContact CG2-CB 3.48Å; L369-M496 HydrophobicContact CD1-CE 4.45Å; L369-M496 HydrophobicContact CD1-SD 3.56Å; L369-M496 VanDerWaalsContact CD1-SD 3.56Å; V405-M496 HydrophobicContact CG1-CE 3.47Å; V405-M496 VanDerWaalsContact CG1-CE 3.47Å; C406-M496 WeakPolarHBondContact O-CA 3.5Å; S407-M496 WeakPolarHBondContact OG-CG 3.49Å; Y418-M496 HydrophobicContact CE2-CE 4.34Å; Y418-M496 WeakPolarHBondContact OH-CE 3.26Å; M496-I498 HydrophobicContact CE-CD1 4.35Å; M496-V538 HydrophobicContact CE-CG2 4.27Å
497	L	91.1	Very high	72.7	Confident	5 Å²	5	50.7 Å²	50.7	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	140.6	-176.2	-60.3	94.1	0	0	0	110.3	V358 A359 C406 R495 A500 W502 F525	V358-L497 HydrophobicContact CG1-CB 4.43Å; V358-L497 HydrophobicContact CG1-CD2 4.14Å; A359-L497 VanDerWaalsContact O-CA 3.31Å; A359-L497 WeakPolarHBondContact O-CA 3.47Å; C406-L497 PolarHBondContact N-O 3.09Å; C406-L497 PolarHBondContact O-N 2.87Å; R495-L497 HydrophobicContact CB-CD1 4.4Å; L497-A500 WeakPolarHBondContact CB-O 3.36Å; L497-W502 HydrophobicContact CD1-CB 4.02Å; L497-W502 HydrophobicContact CD2-CB 4.3Å; L497-F525 HydrophobicContact CD2-CD1 3.6Å; L497-F525 HydrophobicContact CD2-CE1 3.47Å; L497-F525 VanDerWaalsContact CD2-CE1 3.47Å
498	I	93.9	Very high	72.4	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131	172.6	-45.3	-62.6	0	0	0	108.3	L324 L325 F352 V358 A359 V361 I404 V405 M496 L533 V536	L324-I498 HydrophobicContact CB-CD1 4.23Å; L324-I498 HydrophobicContact CB-CG1 4.43Å; L324-I498 HydrophobicContact CD1-CD1 4.14Å; L325-I498 HydrophobicContact CD1-CG2 4.19Å; L325-I498 HydrophobicContact CD2-CB 4.33Å; L325-I498 HydrophobicContact CD2-CG1 4.37Å; L325-I498 HydrophobicContact CD2-CG2 4.26Å; L325-I498 HydrophobicContact CG-CG2 4.37Å; F352-I498 HydrophobicContact CE1-CG2 4.25Å; F352-I498 HydrophobicContact CZ-CG2 4.04Å; V358-I498 WeakPolarHBondContact CA-O 3.43Å; A359-I498 HydrophobicContact CB-CB 3.84Å; A359-I498 HydrophobicContact CB-CG1 4.15Å; A359-I498 PolarHBondContact N-O 2.77Å; A359-I498 PolarHBondContact O-N 3.24Å; V361-I498 HydrophobicContact CG2-CG1 4.16Å; I404-I498 WeakPolarHBondContact O-CA 3.46Å; V405-I498 HydrophobicContact CB-CD1 4.46Å; V405-I498 HydrophobicContact CG1-CD1 4.06Å; V405-I498 HydrophobicContact CG2-CD1 4Å; M496-I498 HydrophobicContact CE-CD1 4.35Å; I498-L533 HydrophobicContact CG2-CD1 3.92Å; I498-V536 HydrophobicContact CD1-CG1 4.28Å; I498-V536 HydrophobicContact CG2-CG1 4.44Å
499	G	90.5	Very high	72	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	90.1	-6.5	179.3	0	0	0	0	0	116.2	T403 I404 G528 Y529	T403-G499 CarbonylContact O-C 3.59Å; I404-G499 PolarHBondContact O-N 2.97Å; G499-G528 CarbonylContact O-C 3.58Å; G499-G528 WeakPolarHBondContact O-CA 3.38Å; G499-Y529 PolarHBondContact O-N 2.93Å
500	A	90.2	Very high	71.6	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.008	26%	0.263	C	S	.	.	S	Bend	trans	-164.6	179	168.8	0	0	0	0	0	110.7	V358 T403 L497 F525	V358-A500 HydrophobicContact CG1-CB 4.08Å; V358-A500 HydrophobicContact CG2-CB 3.66Å; T403-A500 PolarHBondContact O-N 3.48Å; L497-A500 WeakPolarHBondContact CB-O 3.36Å; A500-F525 HydrophobicContact CB-CB 3.77Å; A500-F525 HydrophobicContact CB-CG 4.35Å
501	C	86.1	Confident	70.8	Confident	21 Å²	21	58.7 Å²	58.7	14%	0.142	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	162	168.4	-158.9	0	0	0	0	112.1	T403 C406 F525 V526	T403-C501 HydrophobicContact CG2-CB 4.08Å; C406-C501 HydrophobicContact CB-CB 3.43Å; C406-C501 VanDerWaalsContact CB-CB 3.43Å; C406-C501 WeakPolarHBondContact CB-SG 3.47Å; C406-C501 WeakPolarHBondContact SG-CA 3.49Å; C406-C501 WeakPolarHBondContact SG-CB 3.44Å; C406-C501 CovalentContact SG-SG 2.05Å; C406-C501 PolarHBondContact SG-SG 3.16Å; C501-F525 CarbonylContact O-C 3.53Å; C501-F525 VanDerWaalsContact O-CA 3.31Å; C501-F525 WeakPolarHBondContact O-CA 3.34Å; C501-V526 HydrophobicContact CB-CG2 4.45Å; C501-V526 PolarHBondContact N-O 3.25Å; C501-V526 PolarHBondContact O-N 2.9Å
502	W	81	Confident	70.2	Confident	50 Å²	50	63.3 Å²	63.3	19%	0.189	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	136.9	-177.6	179.2	-75.4	0	0	0	112.2	R495 L497 P504 V523	R495-W502 VanDerWaalsContact NH1-CD2 3.27Å; R495-W502 VanDerWaalsContact NH1-CZ2 3.35Å; L497-W502 HydrophobicContact CD1-CB 4.02Å; L497-W502 HydrophobicContact CD2-CB 4.3Å; W502-P504 WeakPolarHBondContact O-CD 3.26Å; W502-V523 HydrophobicContact CE3-CG1 4.07Å; W502-V523 HydrophobicContact CH2-CB 4.37Å; W502-V523 HydrophobicContact CH2-CG1 3.89Å; W502-V523 HydrophobicContact CH2-CG2 4.02Å; W502-V523 HydrophobicContact CZ3-CB 4.33Å; W502-V523 HydrophobicContact CZ3-CG1 3.44Å; W502-V523 VanDerWaalsContact CZ3-CG1 3.44Å; W502-V523 HydrophobicContact CZ3-CG2 4.1Å
503	E	73.9	Confident	69.2	Low	24 Å²	24	65 Å²	65	11%	0.112	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-79.2	122.5	176.9	-170.4	172.1	-140.6	0	0	113.2	K507 K524 V526	E503-K507 HydrophobicContact CG-CB 4.3Å; E503-K524 HydrophobicContact CB-CB 4.14Å; E503-K524 PolarHBondContact N-O 3.02Å; E503-K524 WeakPolarHBondContact OE2-CB 3.4Å; E503-K524 WeakPolarHBondContact OE2-CD 3.35Å; E503-V526 HydrophobicContact CB-CG1 4Å; E503-V526 HydrophobicContact CG-CG1 4.1Å
504	P	63.3	Low	68	Low	25 Å²	25	64.4 Å²	64.4	16%	0.162	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-61.3	140.2	178.8	-24.5	35	0	0	0	114	P488 W502 E506 K507	P488-P504 HydrophobicContact CB-CG 4.45Å; W502-P504 WeakPolarHBondContact O-CD 3.26Å; P504-E506 PolarHBondContact O-N 3.03Å; P504-K507 PolarHBondContact O-N 3.46Å; P504-K507 VanDerWaalsContact O-N 3.08Å
505	E	56.5	Low	66.1	Low	102 Å²	102	69.6 Å²	69.6	48%	0.477	35%	0.345	S	S	.	.	H	α-helix	trans	-58.1	-23.5	-175.3	-67.7	-177.7	-167	0	0	114.5	K507 Q508 K509	E505-K507 VanDerWaalsContact C-N 3.34Å; E505-K507 PolarHBondContact O-N 3.42Å; E505-Q508 PolarHBondContact O-N 2.74Å; E505-K509 WeakPolarHBondContact O-CG 3.43Å; E505-K509 PolarHBondContact O-N 2.82Å; E505-K509 IonicContact OE2-NZ 2.73Å
506	E	54.5	Low	63.9	Low	143 Å²	143	74.9 Å²	74.9	67%	0.668	38%	0.375	S	S	*	.	H	α-helix	trans	-62.5	-40.4	177.4	-61.6	-173.8	145.6	0	0	111.5	P504 K509 E510	P504-E506 PolarHBondContact O-N 3.03Å; E506-K509 PolarHBondContact O-N 2.84Å; E506-E510 PolarHBondContact O-N 2.86Å
507	K	49.9	Very low	61.8	Low	107 Å²	107	80.5 Å²	80.5	47%	0.465	41%	0.412	S	S	.	.	H	α-helix	trans	-72.7	-34.2	174.1	-73.6	-172.3	172.5	-173.9	0	112.8	E503 P504 E505 K509 E510 I511	E503-K507 HydrophobicContact CG-CB 4.3Å; P504-K507 PolarHBondContact O-N 3.46Å; P504-K507 VanDerWaalsContact O-N 3.08Å; E505-K507 VanDerWaalsContact C-N 3.34Å; E505-K507 PolarHBondContact O-N 3.42Å; K507-K509 PolarHBondContact O-N 2.87Å; K507-E510 PolarHBondContact O-N 2.04Å; K507-I511 PolarHBondContact O-N 2.79Å
508	Q	49.1	Very low	59.7	Low	52 Å²	52	89.9 Å²	89.9	24%	0.243	46%	0.456	C	S	.	.	H	α-helix	trans	-60.1	-37.9	172.2	-69.9	-175.9	-46.2	0	0	111	E505 I511 L512	E505-Q508 PolarHBondContact O-N 2.74Å; Q508-I511 PolarHBondContact O-N 2.76Å; Q508-L512 WeakPolarHBondContact O-CB 3.04Å; Q508-L512 PolarHBondContact O-N 2.8Å
509	K	47.8	Very low	57.1	Low	119 Å²	119	93 Å²	93	52%	0.517	49%	0.488	S	S	.	.	H	α-helix	trans	-69.2	-34.1	177.7	-72.1	163.1	-171.7	159.4	0	113.7	E505 E506 K507 I511 N513	E505-K509 WeakPolarHBondContact O-CG 3.43Å; E505-K509 PolarHBondContact O-N 2.82Å; E505-K509 IonicContact OE2-NZ 2.73Å; E506-K509 PolarHBondContact O-N 2.84Å; K507-K509 PolarHBondContact O-N 2.87Å; K509-I511 VanDerWaalsContact C-N 3.27Å; K509-I511 PolarHBondContact O-N 2.95Å; K509-N513 PolarHBondContact O-ND2 2.99Å
510	E	48.6	Very low	54.5	Low	149 Å²	149	102.7 Å²	102.7	70%	0.696	53%	0.53	S	S	*	.	H	α-helix	trans	-61.5	-37.4	172.4	-69.4	-168.1	126.5	0	0	112	E506 K507	E506-E510 PolarHBondContact O-N 2.86Å; K507-E510 PolarHBondContact O-N 2.04Å
511	I	48.2	Very low	52.1	Low	93 Å²	93	110.1 Å²	110.1	48%	0.477	57%	0.569	S	S	.	*	H	α-helix	trans	-79.8	-39.1	179.8	-60.1	171.8	0	0	0	111.6	K507 Q508 K509 N513 N514	K507-I511 PolarHBondContact O-N 2.79Å; Q508-I511 PolarHBondContact O-N 2.76Å; K509-I511 VanDerWaalsContact C-N 3.27Å; K509-I511 PolarHBondContact O-N 2.95Å; I511-N513 PolarHBondContact O-N 3.22Å; I511-N513 VanDerWaalsContact O-N 3.11Å; I511-N514 PolarHBondContact O-N 3.4Å
512	L	46.6	Very low	50.3	Low	126 Å²	126	113.5 Å²	113.5	66%	0.66	59%	0.593	S	S	*	*	H	α-helix	trans	-66.3	-13.4	-175.4	-155	74.1	0	0	0	114.1	Q508 N514	Q508-L512 WeakPolarHBondContact O-CB 3.04Å; Q508-L512 PolarHBondContact O-N 2.8Å; L512-N514 PolarHBondContact O-N 3.31Å
513	N	45.8	Very low	49.3	Very low	138 Å²	138	114.2 Å²	114.2	74%	0.738	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-11.1	169.6	-74.7	-36.3	0	0	0	113.4	K509 I511	K509-N513 PolarHBondContact O-ND2 2.99Å; I511-N513 PolarHBondContact O-N 3.22Å; I511-N513 VanDerWaalsContact O-N 3.11Å
514	N	51.2	Low	49.1	Very low	130 Å²	130	116.6 Å²	116.6	70%	0.695	61%	0.613	S	S	*	*	S	Bend	trans	-118.9	111.1	168.3	-75.2	-55	0	0	0	111.1	I511 L512	I511-N514 PolarHBondContact O-N 3.4Å; L512-N514 PolarHBondContact O-N 3.31Å
515	T	42.5	Very low	49.9	Very low	130 Å²	130	118.2 Å²	118.2	80%	0.798	62%	0.618	S	S	*	*			trans	79.2	143.4	174.8	69.5	0	0	0	0	118.3
516	I	41.6	Very low	51	Low	157 Å²	157	116.2 Å²	116.2	81%	0.805	61%	0.612	S	S	*	*			trans	-133.5	146.3	-170.1	-80.7	172.4	0	0	0	104.7
517	P	45.6	Very low	52.3	Low	118 Å²	118	110.3 Å²	110.3	77%	0.766	59%	0.589	S	S	*	*			cis	-132.3	176.7	37.2	25.6	-1.7	0	0	0	117.4
518	E	46.3	Very low	54	Low	203 Å²	203	105.8 Å²	105.8	95%	0.949	57%	0.573	S	S	*	*			trans	-57	126.9	167.7	-58.1	169.9	127.8	0	0	111.3
519	G	39.5	Very low	56	Low	65 Å²	65	103.3 Å²	103.3	67%	0.67	56%	0.562	S	S	*	*			trans	172.8	92.9	179.7	0	0	0	0	0	113.5
520	K	36.9	Very low	58.1	Low	203 Å²	203	101 Å²	101	88%	0.883	55%	0.553	S	S	*	*	S	Bend	trans	72.4	136.2	-167.9	-54.2	177.8	176.8	-179.9	0	114	S522	K520-S522 PolarHBondContact O-N 2.96Å
521	D	39.8	Very low	60.2	Low	158 Å²	158	94.2 Å²	94.2	85%	0.845	52%	0.523	S	S	*	.			trans	-64.7	96.7	166.6	-70.6	-51.4	0	0	0	109.6	V523	D521-V523 PolarHBondContact O-N 3.3Å
522	S	47.8	Very low	62.3	Low	92 Å²	92	91.4 Å²	91.4	64%	0.643	51%	0.509	S	S	*	.			trans	-75.4	81.9	169.8	48.9	0	0	0	0	109.3	K520 K524	K520-S522 PolarHBondContact O-N 2.96Å; S522-K524 PolarHBondContact O-N 3.29Å; S522-K524 VanDerWaalsContact O-N 3.16Å
523	V	59.4	Low	64.5	Low	65 Å²	65	85.4 Å²	85.4	39%	0.394	48%	0.477	S	S	.	.			trans	-54.1	118.9	172.9	175.4	0	0	0	0	109.1	W502 D521 F525	W502-V523 HydrophobicContact CE3-CG1 4.07Å; W502-V523 HydrophobicContact CH2-CB 4.37Å; W502-V523 HydrophobicContact CH2-CG1 3.89Å; W502-V523 HydrophobicContact CH2-CG2 4.02Å; W502-V523 HydrophobicContact CZ3-CB 4.33Å; W502-V523 HydrophobicContact CZ3-CG1 3.44Å; W502-V523 VanDerWaalsContact CZ3-CG1 3.44Å; W502-V523 HydrophobicContact CZ3-CG2 4.1Å; D521-V523 PolarHBondContact O-N 3.3Å; V523-F525 HydrophobicContact CB-CZ 4.42Å; V523-F525 HydrophobicContact CG1-CD1 3.98Å; V523-F525 HydrophobicContact CG1-CE1 3.34Å; V523-F525 HydrophobicContact CG1-CE2 4.02Å; V523-F525 HydrophobicContact CG1-CZ 3.38Å
524	K	70.1	Confident	66.6	Low	74 Å²	74	78.9 Å²	78.9	32%	0.322	44%	0.442	S	S	.	.			trans	-103.5	129.6	175.4	-69.3	-173.7	179.9	-179.3	0	110.2	E503 S522	E503-K524 HydrophobicContact CB-CB 4.14Å; E503-K524 PolarHBondContact N-O 3.02Å; E503-K524 WeakPolarHBondContact OE2-CB 3.4Å; E503-K524 WeakPolarHBondContact OE2-CD 3.35Å; S522-K524 PolarHBondContact O-N 3.29Å; S522-K524 VanDerWaalsContact O-N 3.16Å
525	F	79.2	Confident	68.4	Low	59 Å²	59	73.2 Å²	73.2	26%	0.259	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	152.5	173.9	-52.2	-63.3	0	0	0	109.8	V358 V360 L497 A500 C501 V523	V358-F525 HydrophobicContact CB-CD2 4.12Å; V358-F525 HydrophobicContact CB-CE1 4.4Å; V358-F525 HydrophobicContact CB-CE2 3.87Å; V358-F525 HydrophobicContact CB-CG 4.49Å; V358-F525 HydrophobicContact CB-CZ 4.01Å; V358-F525 HydrophobicContact CG1-CD1 4.06Å; V358-F525 HydrophobicContact CG1-CD2 4.42Å; V358-F525 HydrophobicContact CG1-CE1 3.86Å; V358-F525 HydrophobicContact CG1-CE2 4.24Å; V358-F525 HydrophobicContact CG1-CG 4.32Å; V358-F525 HydrophobicContact CG1-CZ 3.95Å; V358-F525 HydrophobicContact CG2-CD2 3.73Å; V358-F525 HydrophobicContact CG2-CE2 3.98Å; V358-F525 HydrophobicContact CG2-CG 4.07Å; V360-F525 HydrophobicContact CG2-CE1 4.18Å; V360-F525 HydrophobicContact CG2-CZ 4.04Å; L497-F525 HydrophobicContact CD2-CD1 3.6Å; L497-F525 HydrophobicContact CD2-CE1 3.47Å; L497-F525 VanDerWaalsContact CD2-CE1 3.47Å; A500-F525 HydrophobicContact CB-CB 3.77Å; A500-F525 HydrophobicContact CB-CG 4.35Å; C501-F525 CarbonylContact O-C 3.53Å; C501-F525 VanDerWaalsContact O-CA 3.31Å; C501-F525 WeakPolarHBondContact O-CA 3.34Å; V523-F525 HydrophobicContact CB-CZ 4.42Å; V523-F525 HydrophobicContact CG1-CD1 3.98Å; V523-F525 HydrophobicContact CG1-CE1 3.34Å; V523-F525 HydrophobicContact CG1-CE2 4.02Å; V523-F525 HydrophobicContact CG1-CZ 3.38Å
526	V	81.6	Confident	70.8	Confident	59 Å²	59	67 Å²	67	36%	0.358	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	148	178.5	-73.3	0	0	0	0	110.5	C501 E503	C501-V526 HydrophobicContact CB-CG2 4.45Å; C501-V526 PolarHBondContact N-O 3.25Å; C501-V526 PolarHBondContact O-N 2.9Å; E503-V526 HydrophobicContact CB-CG1 4Å; E503-V526 HydrophobicContact CG-CG1 4.1Å
527	G	79.9	Confident	73.1	Confident	19 Å²	19	59.9 Å²	59.9	20%	0.196	34%	0.34	C	S	.	.	S	Bend	trans	60.1	56.4	178.9	0	0	0	0	0	112.5	E401 T403	E401-G527 WeakPolarHBondContact O-CA 3.35Å; T403-G527 VanDerWaalsContact CB-O 3.32Å; T403-G527 WeakPolarHBondContact CB-O 3.44Å; T403-G527 PolarHBondContact N-O 2.9Å; T403-G527 PolarHBondContact OG1-O 2.88Å
528	G	87.1	Confident	75.2	Confident	12 Å²	12	54.3 Å²	54.3	12%	0.124	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-71	143.9	179.9	0	0	0	0	0	112.9	G354 G499 H530	G354-G528 WeakPolarHBondContact O-CA 3.43Å; G499-G528 CarbonylContact O-C 3.58Å; G499-G528 WeakPolarHBondContact O-CA 3.38Å; G528-H530 PolarHBondContact O-ND1 3.5Å
529	Y	91.6	Very high	77.3	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.263	C	S	.	.			trans	-88.5	135.8	-180	174.3	-105	0	0	0	112.8	F352 G354 E402 I404 V422 G499 L533	F352-Y529 CarbonylContact C-O 3.48Å; F352-Y529 HydrophobicContact CB-CD1 3.79Å; F352-Y529 HydrophobicContact CB-CE1 4.42Å; F352-Y529 WeakPolarHBondContact CB-O 3.2Å; F352-Y529 HydrophobicContact CG-CD1 4.15Å; G354-Y529 VanDerWaalsContact CA-O 3.25Å; G354-Y529 WeakPolarHBondContact CA-O 3.47Å; G354-Y529 PolarHBondContact N-O 3.5Å; E402-Y529 HydrophobicContact CB-CD2 4.42Å; I404-Y529 HydrophobicContact CD1-CE2 4.3Å; I404-Y529 HydrophobicContact CG1-CD2 3.76Å; I404-Y529 HydrophobicContact CG1-CE2 3.95Å; I404-Y529 HydrophobicContact CG1-CG 4.25Å; V422-Y529 HydrophobicContact CG2-CD2 4.23Å; V422-Y529 HydrophobicContact CG2-CE2 4.24Å; G499-Y529 PolarHBondContact O-N 2.93Å; Y529-L533 HydrophobicContact CD1-CD1 4.29Å; Y529-L533 HydrophobicContact CD1-CD2 4.32Å; Y529-L533 HydrophobicContact CD1-CG 4.26Å; Y529-L533 HydrophobicContact CE1-CD1 4.27Å; Y529-L533 HydrophobicContact CE1-CD2 3.55Å; Y529-L533 HydrophobicContact CE1-CG 3.77Å
530	H	90.9	Very high	79.6	Confident	71 Å²	71	44 Å²	44	33%	0.329	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	108.9	176.5	-54.6	77.3	0	0	0	110.4	F352 R382 G383 E402 G528	F352-H530 WeakPolarHBondContact O-CA 3.1Å; R382-H530 WeakPolarHBondContact CG-O 3.46Å; G383-H530 PolarHBondContact N-O 3.4Å; E402-H530 WeakPolarHBondContact OE2-CB 3.34Å; E402-H530 IonicContact OE2-CG 2.74Å; E402-H530 PolarHBondContact OE2-N 3.45Å; E402-H530 IonicContact OE2-ND1 3.31Å; E402-H530 PolarHBondContact OE2-ND1 2.9Å; G528-H530 PolarHBondContact O-ND1 3.5Å
531	G	92.1	Very high	81.8	Confident	7 Å²	7	37 Å²	37	7%	0.072	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.3	-165.1	-179.3	0	0	0	0	0	114.1	F352 R381	F352-G531 WeakPolarHBondContact CB-O 3.19Å; F352-G531 PolarHBondContact N-O 3.4Å; F352-G531 PolarHBondContact O-N 2.78Å; R381-G531 CarbonylContact O-C 3.53Å; R381-G531 WeakPolarHBondContact O-CA 3.02Å
532	L	92.6	Very high	83.8	Confident	34 Å²	34	31.2 Å²	31.2	18%	0.178	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134.9	179.3	-53.3	-179.3	0	0	0	109.3	L341 V349 F350 M380 R381 W455	L341-L532 HydrophobicContact CD1-CD1 4.04Å; L341-L532 HydrophobicContact CD1-CD2 3.65Å; V349-L532 HydrophobicContact CG1-CB 3.91Å; V349-L532 HydrophobicContact CG1-CD1 4.09Å; V349-L532 HydrophobicContact CG1-CD2 4.36Å; V349-L532 HydrophobicContact CG1-CG 4.35Å; F350-L532 WeakPolarHBondContact O-CA 3.29Å; M380-L532 WeakPolarHBondContact CA-O 3.2Å; R381-L532 HydrophobicContact CB-CB 4.38Å; R381-L532 PolarHBondContact N-O 3.4Å; R381-L532 PolarHBondContact O-N 3.09Å; W455-L532 HydrophobicContact CH2-CB 3.65Å; W455-L532 HydrophobicContact CZ2-CB 4.06Å; W455-L532 HydrophobicContact CZ2-CD1 4.12Å; W455-L532 HydrophobicContact CZ3-CB 4.4Å
533	L	93.5	Very high	85.5	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	149.2	173.7	-55.5	178.6	0	0	0	110.6	L325 F350 F352 L378 W379 M380 I404 I498 Y529 V536	L325-L533 HydrophobicContact CD1-CB 4.25Å; F350-L533 PolarHBondContact N-O 2.87Å; F350-L533 PolarHBondContact O-N 3.5Å; F352-L533 HydrophobicContact CD2-CB 4.23Å; F352-L533 HydrophobicContact CD2-CD1 3.96Å; F352-L533 HydrophobicContact CD2-CG 3.86Å; F352-L533 HydrophobicContact CE2-CB 3.81Å; F352-L533 HydrophobicContact CE2-CD1 3.65Å; F352-L533 HydrophobicContact CE2-CG 3.79Å; F352-L533 HydrophobicContact CZ-CD1 3.99Å; L378-L533 HydrophobicContact CD1-CD2 4.28Å; W379-L533 WeakPolarHBondContact O-CA 3.47Å; M380-L533 HydrophobicContact CB-CD2 3.64Å; I404-L533 HydrophobicContact CG2-CD1 3.81Å; I404-L533 HydrophobicContact CG2-CD2 3.99Å; I498-L533 HydrophobicContact CG2-CD1 3.92Å; Y529-L533 HydrophobicContact CD1-CD1 4.29Å; Y529-L533 HydrophobicContact CD1-CD2 4.32Å; Y529-L533 HydrophobicContact CD1-CG 4.26Å; Y529-L533 HydrophobicContact CE1-CD1 4.27Å; Y529-L533 HydrophobicContact CE1-CD2 3.55Å; Y529-L533 HydrophobicContact CE1-CG 3.77Å; L533-V536 HydrophobicContact CB-CG2 3.78Å; L533-V536 HydrophobicContact CD1-CG2 4.24Å
534	S	90.4	Very high	86.9	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	148.9	175.3	-177.4	0	0	0	0	110.5	K299 L348 W379 V536	K299-S534 PolarHBondContact NZ-OG 3.35Å; L348-S534 VanDerWaalsContact O-CB 3.27Å; L348-S534 WeakPolarHBondContact O-CB 3.3Å; L348-S534 PolarHBondContact O-OG 2.94Å; W379-S534 WeakPolarHBondContact CB-O 3.3Å; W379-S534 PolarHBondContact N-O 3.03Å; W379-S534 PolarHBondContact O-N 3.02Å; S534-V536 VanDerWaalsContact C-N 3.32Å; S534-V536 PolarHBondContact O-N 3.28Å
535	G	87.9	Confident	87.8	Confident	11 Å²	11	26.2 Å²	26.2	11%	0.113	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	58.6	35.2	178.4	0	0	0	0	0	115.2	T537	G535-T537 PolarHBondContact O-N 2.61Å
536	V	92.5	Very high	88.1	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	112.4	-176.1	-176.2	0	0	0	0	110.6	L324 L325 Q377 L378 I498 L533 S534	L324-V536 HydrophobicContact CB-CG1 4.37Å; L324-V536 WeakPolarHBondContact CB-O 3.43Å; L324-V536 HydrophobicContact CD1-CG1 4.38Å; L324-V536 PolarHBondContact N-O 2.83Å; L325-V536 HydrophobicContact CB-CB 4.42Å; L325-V536 HydrophobicContact CD1-CB 3.94Å; L325-V536 HydrophobicContact CD1-CG2 3.56Å; L325-V536 HydrophobicContact CG-CB 4Å; L325-V536 HydrophobicContact CG-CG2 4.2Å; Q377-V536 WeakPolarHBondContact O-CA 3.45Å; L378-V536 HydrophobicContact CB-CB 4.28Å; L378-V536 HydrophobicContact CB-CG1 4.36Å; L378-V536 HydrophobicContact CB-CG2 3.81Å; I498-V536 HydrophobicContact CD1-CG1 4.28Å; I498-V536 HydrophobicContact CG2-CG1 4.44Å; L533-V536 HydrophobicContact CB-CG2 3.78Å; L533-V536 HydrophobicContact CD1-CG2 4.24Å; S534-V536 VanDerWaalsContact C-N 3.32Å; S534-V536 PolarHBondContact O-N 3.28Å
537	T	90.3	Very high	88.5	Confident	8 Å²	8	28 Å²	28	5%	0.049	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	153.9	-171.7	64	0	0	0	0	112.8	R312 V322 D323 Q377 G535	R312-T537 VanDerWaalsContact NH1-CB 3.34Å; R312-T537 PolarHBondContact NH1-OG1 2.9Å; R312-T537 PolarHBondContact NH2-OG1 3.06Å; V322-T537 CarbonylContact O-C 3.57Å; V322-T537 WeakPolarHBondContact O-CA 3.41Å; V322-T537 VanDerWaalsContact O-CB 3.31Å; V322-T537 WeakPolarHBondContact O-CB 3.33Å; D323-T537 HydrophobicContact CB-CG2 4.28Å; Q377-T537 PolarHBondContact N-O 3.29Å; Q377-T537 PolarHBondContact O-N 3.45Å; G535-T537 PolarHBondContact O-N 2.61Å
538	V	90.9	Very high	88.9	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.006	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	135.7	168.6	171.1	0	0	0	0	110.8	V322 L324 L369 F374 T375 L376 M496	V322-V538 PolarHBondContact N-O 3.11Å; V322-V538 PolarHBondContact O-N 2.97Å; L324-V538 HydrophobicContact CD1-CB 4.33Å; L324-V538 HydrophobicContact CD1-CG2 3.77Å; L369-V538 HydrophobicContact CD2-CB 4.15Å; L369-V538 HydrophobicContact CD2-CG1 3.97Å; F374-V538 HydrophobicContact CB-CG1 4.13Å; F374-V538 HydrophobicContact CD2-CG1 4.21Å; F374-V538 HydrophobicContact CG-CG1 4.47Å; T375-V538 CarbonylContact O-C 3.56Å; T375-V538 WeakPolarHBondContact O-CA 3.42Å; L376-V538 HydrophobicContact CB-CG2 4.18Å; L376-V538 HydrophobicContact CD1-CG2 3.65Å; L376-V538 HydrophobicContact CG-CG2 4.47Å; M496-V538 HydrophobicContact CE-CG2 4.27Å
539	R	89	Confident	88.9	Confident	24 Å²	24	26.7 Å²	26.7	9%	0.091	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	105.7	168	-179.4	179.1	162.3	-177.6	-8.6	109.1	F374 T375 S542 E544	F374-R539 CarbonylContact C-O 3.53Å; F374-R539 WeakPolarHBondContact CA-O 3.1Å; F374-R539 WeakPolarHBondContact CB-O 3.04Å; T375-R539 PolarHBondContact N-O 2.84Å; T375-R539 PolarHBondContact O-N 3.23Å; R539-S542 PolarHBondContact NE-OG 3.07Å; R539-S542 PolarHBondContact NH2-OG 3.2Å; R539-S542 VanDerWaalsContact NH2-OG 3.12Å; R539-E544 WeakPolarHBondContact CD-OE2 3.11Å; R539-E544 IonicContact CZ-OE2 2.73Å; R539-E544 IonicContact NE-OE2 3.56Å; R539-E544 IonicContact NH1-OE1 3.48Å; R539-E544 PolarHBondContact NH1-OE1 3.08Å; R539-E544 IonicContact NH1-OE2 3.57Å; R539-E544 PolarHBondContact NH1-OE2 2.8Å
540	P	87.9	Confident	88.7	Confident	26 Å²	26	31.3 Å²	31.3	17%	0.169	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	163.7	179.2	32.3	-34.5	0	0	0	112.7	G320 A368 L369 S542	G320-P540 WeakPolarHBondContact O-CD 3.37Å; A368-P540 WeakPolarHBondContact O-CG 3.27Å; L369-P540 HydrophobicContact CD2-CG 4.28Å; P540-S542 PolarHBondContact O-N 2.92Å; P540-S542 PolarHBondContact O-OG 3.08Å
541	G	82.8	Confident	88.5	Confident	56 Å²	56	30.1 Å²	30.1	58%	0.577	19%	0.19	S	C	*	.	S	Bend	trans	66.3	-2.2	174	0	0	0	0	0	116	H373	H373-G541 WeakPolarHBondContact O-CA 3.27Å; H373-G541 PolarHBondContact O-N 2.87Å
542	S	81.4	Confident	88.2	Confident	38 Å²	38	30.1 Å²	30.1	27%	0.266	19%	0.188	S	C	.	.	S	Bend	trans	-158.5	154.3	-174	48.5	0	0	0	0	113.5	T375 R539 P540	T375-S542 PolarHBondContact OG1-O 2.97Å; R539-S542 PolarHBondContact NE-OG 3.07Å; R539-S542 PolarHBondContact NH2-OG 3.2Å; R539-S542 VanDerWaalsContact NH2-OG 3.12Å; P540-S542 PolarHBondContact O-N 2.92Å; P540-S542 PolarHBondContact O-OG 3.08Å
543	V	85.5	Confident	87.8	Confident	55 Å²	55	29.6 Å²	29.6	33%	0.333	18%	0.184	S	C	.	.	P	Polyproline II helix	trans	-99.4	135.7	176.6	175.8	0	0	0	0	109.5	T375 Q463	T375-V543 WeakPolarHBondContact OG1-CA 3.05Å; Q463-V543 HydrophobicContact CB-CG2 4.31Å
544	E	87.6	Confident	87.5	Confident	9 Å²	9	31.9 Å²	31.9	4%	0.042	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-72.2	131.2	174.9	-154.7	64	-120.7	0	0	110.5	T375 R539 V548 V549	T375-E544 HydrophobicContact CG2-CB 4.02Å; T375-E544 PolarHBondContact OG1-N 3.27Å; R539-E544 WeakPolarHBondContact CD-OE2 3.11Å; R539-E544 IonicContact CZ-OE2 2.73Å; R539-E544 IonicContact NE-OE2 3.56Å; R539-E544 IonicContact NH1-OE1 3.48Å; R539-E544 PolarHBondContact NH1-OE1 3.08Å; R539-E544 IonicContact NH1-OE2 3.57Å; R539-E544 PolarHBondContact NH1-OE2 2.8Å; E544-V548 HydrophobicContact CG-CB 3.96Å; E544-V548 HydrophobicContact CG-CG1 3.67Å; E544-V549 HydrophobicContact CB-CG2 4.38Å; E544-V549 HydrophobicContact CG-CG2 4.43Å
545	P	88.4	Confident	87.3	Confident	62 Å²	62	32.5 Å²	32.5	40%	0.403	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-69.3	147.8	179.7	29.3	-34.6	0	0	0	111.5	S547 V548 V549	P545-S547 VanDerWaalsContact C-N 3.25Å; P545-S547 PolarHBondContact O-N 3.27Å; P545-S547 VanDerWaalsContact O-N 3.14Å; P545-V548 HydrophobicContact CG-CB 4.23Å; P545-V548 HydrophobicContact CG-CG2 3.76Å; P545-V548 PolarHBondContact O-N 3.18Å; P545-V549 PolarHBondContact O-N 3.38Å
546	H	86.8	Confident	87.2	Confident	79 Å²	79	36.7 Å²	36.7	37%	0.366	22%	0.219	S	C	.	.	H	α-helix	trans	-52.9	-40	-174.7	-171.7	9.8	0	0	0	113.3	Y470 G473 V548 V549 E550	Y470-H546 AromaticContact CD1-ND1 3.99Å; Y470-H546 AromaticContact CE1-CE1 3.7Å; Y470-H546 AromaticContact CE1-CG 3.93Å; Y470-H546 AromaticContact CE1-ND1 3.49Å; Y470-H546 WeakPolarHBondContact CE1-ND1 3.28Å; G473-H546 PolarHBondContact O-CE1 2.8Å; H546-V548 VanDerWaalsContact C-N 3.3Å; H546-V548 PolarHBondContact O-N 2.75Å; H546-V549 CarbonylContact O-C 3.57Å; H546-V549 WeakPolarHBondContact O-CA 3.22Å; H546-V549 WeakPolarHBondContact O-CB 3.29Å; H546-V549 PolarHBondContact O-N 2.04Å; H546-E550 IonicContact CE1-OE1 3.66Å; H546-E550 WeakPolarHBondContact O-CG 3.38Å; H546-E550 PolarHBondContact O-N 3.36Å
547	S	88.6	Confident	87.1	Confident	75 Å²	75	36.8 Å²	36.8	52%	0.524	22%	0.22	S	C	.	.	H	α-helix	trans	-62.8	-30.2	179.2	53.6	0	0	0	0	114.3	P545 E550 C551	P545-S547 VanDerWaalsContact C-N 3.25Å; P545-S547 PolarHBondContact O-N 3.27Å; P545-S547 VanDerWaalsContact O-N 3.14Å; S547-E550 WeakPolarHBondContact CA-OE2 3.48Å; S547-C551 VanDerWaalsContact O-CB 3.25Å; S547-C551 WeakPolarHBondContact O-CB 3.32Å; S547-C551 PolarHBondContact O-N 3.21Å
548	V	89.1	Confident	87.2	Confident	4 Å²	4	36.4 Å²	36.4	2%	0.024	22%	0.217	C	C	.	.	H	α-helix	trans	-73.1	-40.5	172.2	171.6	0	0	0	0	109.8	C315 A317 E544 P545 H546 C551 L552	C315-V548 HydrophobicContact CB-CG1 4.33Å; A317-V548 HydrophobicContact CB-CG1 3.94Å; E544-V548 HydrophobicContact CG-CB 3.96Å; E544-V548 HydrophobicContact CG-CG1 3.67Å; P545-V548 HydrophobicContact CG-CB 4.23Å; P545-V548 HydrophobicContact CG-CG2 3.76Å; P545-V548 PolarHBondContact O-N 3.18Å; H546-V548 VanDerWaalsContact C-N 3.3Å; H546-V548 PolarHBondContact O-N 2.75Å; V548-C551 PolarHBondContact O-N 2.97Å; V548-L552 HydrophobicContact CG1-CD1 3.82Å; V548-L552 HydrophobicContact CG1-CG 4.36Å; V548-L552 WeakPolarHBondContact O-CB 3.39Å; V548-L552 WeakPolarHBondContact O-CD1 3.3Å; V548-L552 WeakPolarHBondContact O-CG 3.13Å; V548-L552 PolarHBondContact O-N 3.17Å
549	V	87.4	Confident	87.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.8	-40	176.6	-176.6	0	0	0	0	111.6	Y470 E544 P545 H546 Y553	Y470-V549 HydrophobicContact CD1-CG1 4.36Å; Y470-V549 HydrophobicContact CD2-CG1 4.37Å; Y470-V549 HydrophobicContact CG-CG1 3.95Å; E544-V549 HydrophobicContact CB-CG2 4.38Å; E544-V549 HydrophobicContact CG-CG2 4.43Å; P545-V549 PolarHBondContact O-N 3.38Å; H546-V549 CarbonylContact O-C 3.57Å; H546-V549 WeakPolarHBondContact O-CA 3.22Å; H546-V549 WeakPolarHBondContact O-CB 3.29Å; H546-V549 PolarHBondContact O-N 2.04Å; V549-Y553 PolarHBondContact O-N 2.86Å
550	E	86.8	Confident	87.5	Confident	98 Å²	98	36.9 Å²	36.9	46%	0.458	22%	0.222	S	C	.	.	H	α-helix	trans	-62.8	-51.8	172.3	-71.1	175.6	120.2	0	0	110.8	H546 S547 L552 Y553 A554	H546-E550 IonicContact CE1-OE1 3.66Å; H546-E550 WeakPolarHBondContact O-CG 3.38Å; H546-E550 PolarHBondContact O-N 3.36Å; S547-E550 WeakPolarHBondContact CA-OE2 3.48Å; E550-L552 VanDerWaalsContact C-N 3.3Å; E550-L552 PolarHBondContact O-N 3.17Å; E550-Y553 CarbonylContact O-C 3.48Å; E550-Y553 PolarHBondContact O-N 3.48Å; E550-Y553 VanDerWaalsContact O-N 3.09Å; E550-A554 WeakPolarHBondContact O-CB 3.37Å; E550-A554 PolarHBondContact O-N 3.36Å
551	C	87.7	Confident	87.5	Confident	46 Å²	46	38.8 Å²	38.8	31%	0.311	23%	0.227	S	C	.	.	H	α-helix	trans	-57.7	-40.2	178.3	177.2	0	0	0	0	112.7	C315 S547 V548 Y553 A554	C315-C551 WeakPolarHBondContact CA-SG 3.2Å; C315-C551 HydrophobicContact CB-CB 3.67Å; C315-C551 WeakPolarHBondContact CB-SG 3.3Å; C315-C551 WeakPolarHBondContact SG-CB 3.45Å; C315-C551 CovalentContact SG-SG 2.04Å; C315-C551 PolarHBondContact SG-SG 3.45Å; S547-C551 VanDerWaalsContact O-CB 3.25Å; S547-C551 WeakPolarHBondContact O-CB 3.32Å; S547-C551 PolarHBondContact O-N 3.21Å; V548-C551 PolarHBondContact O-N 2.97Å; C551-Y553 PolarHBondContact O-N 2.63Å; C551-A554 PolarHBondContact O-N 3.03Å
552	L	85.1	Confident	87.2	Confident	7 Å²	7	37.6 Å²	37.6	4%	0.037	22%	0.215	C	C	.	.	H	α-helix	trans	-64.1	-26.6	178.1	-77.7	165.4	0	0	0	113.9	R303 V311 R312 V548 E550	R303-L552 VanDerWaalsContact NH2-C 3.34Å; R303-L552 PolarHBondContact NH2-O 3.22Å; V311-L552 HydrophobicContact CG1-CD2 4.12Å; R312-L552 HydrophobicContact CB-CD2 4.35Å; R312-L552 HydrophobicContact CG-CD1 3.92Å; R312-L552 HydrophobicContact CG-CD2 3.38Å; R312-L552 HydrophobicContact CG-CG 4.18Å; V548-L552 HydrophobicContact CG1-CD1 3.82Å; V548-L552 HydrophobicContact CG1-CG 4.36Å; V548-L552 WeakPolarHBondContact O-CB 3.39Å; V548-L552 WeakPolarHBondContact O-CD1 3.3Å; V548-L552 WeakPolarHBondContact O-CG 3.13Å; V548-L552 PolarHBondContact O-N 3.17Å; E550-L552 VanDerWaalsContact C-N 3.3Å; E550-L552 PolarHBondContact O-N 3.17Å
553	Y	84.6	Confident	87.1	Confident	22 Å²	22	42 Å²	42	9%	0.086	24%	0.236	C	C	.	.	H	α-helix	trans	-102	-25.9	178.6	175.2	-95.4	0	0	0	113.8	R303 W379 H457 D472 V549 E550 C551 C555 P577 S578	R303-Y553 PolarHBondContact NH1-O 2.89Å; R303-Y553 PolarHBondContact NH2-O 2.84Å; W379-Y553 HydrophobicContact CH2-CD2 4.16Å; W379-Y553 HydrophobicContact CZ3-CD2 4.39Å; H457-Y553 HydrophobicContact CB-CD2 3.98Å; D472-Y553 VanDerWaalsContact C-CD1 3.48Å; D472-Y553 HydrophobicContact CB-CD1 4.44Å; D472-Y553 HydrophobicContact CB-CD2 4Å; D472-Y553 HydrophobicContact CB-CE1 3.98Å; D472-Y553 HydrophobicContact CB-CE2 3.45Å; D472-Y553 VanDerWaalsContact CB-CE2 3.45Å; D472-Y553 HydrophobicContact CB-CG 4.45Å; D472-Y553 VanDerWaalsContact CB-CZ 3.44Å; D472-Y553 VanDerWaalsContact CG-CE2 3.44Å; D472-Y553 WeakPolarHBondContact O-CD1 3.39Å; D472-Y553 WeakPolarHBondContact O-CE1 3.24Å; D472-Y553 VanDerWaalsContact OD1-CE2 3.29Å; D472-Y553 WeakPolarHBondContact OD1-CE2 3.34Å; V549-Y553 PolarHBondContact O-N 2.86Å; E550-Y553 CarbonylContact O-C 3.48Å; E550-Y553 PolarHBondContact O-N 3.48Å; E550-Y553 VanDerWaalsContact O-N 3.09Å; C551-Y553 PolarHBondContact O-N 2.63Å; Y553-C555 PolarHBondContact O-N 3.3Å; Y553-P577 HydrophobicContact CE1-CB 3.55Å; Y553-S578 WeakPolarHBondContact OH-CB 3.46Å; Y553-S578 PolarHBondContact OH-N 2.94Å
554	A	86.1	Confident	86.5	Confident	49 Å²	49	44.4 Å²	44.4	41%	0.405	25%	0.246	S	C	.	.			trans	-54.7	123.7	-177.6	0	0	0	0	0	111.9	R303 E550 C551	R303-A554 PolarHBondContact NH1-O 2.84Å; R303-A554 PolarHBondContact NH2-O 3.45Å; E550-A554 WeakPolarHBondContact O-CB 3.37Å; E550-A554 PolarHBondContact O-N 3.36Å; C551-A554 PolarHBondContact O-N 3.03Å
555	C	86.6	Confident	85.7	Confident	13 Å²	13	53.1 Å²	53.1	9%	0.088	29%	0.287	C	S	.	.			trans	-76.2	142.9	176.8	-67	0	0	0	0	111	C301 Y553 E557 S578	C301-C555 HydrophobicContact CB-CB 3.71Å; C301-C555 WeakPolarHBondContact CB-SG 3.47Å; C301-C555 WeakPolarHBondContact SG-CB 3.26Å; C301-C555 CovalentContact SG-SG 2.04Å; C301-C555 PolarHBondContact SG-SG 2.89Å; Y553-C555 PolarHBondContact O-N 3.3Å; C555-E557 VanDerWaalsContact CB-O 3.26Å; C555-E557 WeakPolarHBondContact CB-O 3.48Å; C555-S578 PolarHBondContact SG-O 3.32Å; C555-S578 VanDerWaalsContact SG-O 3.36Å
556	R	86.4	Confident	84.9	Confident	99 Å²	99	53.7 Å²	53.7	37%	0.374	29%	0.289	S	S	.	.	S	Bend	trans	-87.9	-28.3	176.5	-66.5	-74.3	-167.2	178.4	2.8	112.1	D302 D304 N603 S604 L605	D302-R556 PolarHBondContact O-N 3.08Å; D304-R556 VanDerWaalsContact CG-NE 3.33Å; D304-R556 IonicContact OD1-CZ 2.73Å; D304-R556 IonicContact OD1-NE 3.26Å; D304-R556 PolarHBondContact OD1-NE 2.04Å; D304-R556 IonicContact OD1-NH2 2.64Å; D304-R556 IonicContact OD2-CZ 3.3Å; D304-R556 VanDerWaalsContact OD2-CZ 3.23Å; D304-R556 IonicContact OD2-NE 2.79Å; D304-R556 PolarHBondContact OD2-NE 3.5Å; D304-R556 IonicContact OD2-NH2 3.1Å; D304-R556 PolarHBondContact OD2-NH2 3.28Å; R556-N603 WeakPolarHBondContact O-CA 3.3Å; R556-S604 WeakPolarHBondContact CA-OG 3.48Å; R556-S604 WeakPolarHBondContact CB-OG 3.35Å; R556-S604 VanDerWaalsContact CD-OG 3.28Å; R556-S604 WeakPolarHBondContact CD-OG 3.34Å; R556-S604 PolarHBondContact O-N 3.02Å; R556-S604 PolarHBondContact O-OG 3.2Å; R556-L605 HydrophobicContact CB-CD1 4.1Å; R556-L605 HydrophobicContact CB-CD2 3.98Å; R556-L605 HydrophobicContact CB-CG 3.68Å; R556-L605 HydrophobicContact CG-CD2 3.9Å; R556-L605 HydrophobicContact CG-CG 4.19Å
557	E	90	Very high	84.1	Confident	1 Å²	1	50 Å²	50	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	138.6	166.7	169.4	172.3	-106.9	0	0	110.9	L292 T294 D302 C555 Y601 R602 N603 R613	L292-E557 HydrophobicContact CD2-CG 4.22Å; T294-E557 HydrophobicContact CG2-CG 4.46Å; T294-E557 WeakPolarHBondContact CG2-OE2 3.46Å; D302-E557 HydrophobicContact CB-CB 3.61Å; D302-E557 HydrophobicContact CB-CG 4.27Å; D302-E557 WeakPolarHBondContact CB-OE2 3.02Å; D302-E557 PolarHBondContact N-OE2 2.77Å; D302-E557 PolarHBondContact O-N 2.78Å; C555-E557 VanDerWaalsContact CB-O 3.26Å; C555-E557 WeakPolarHBondContact CB-O 3.48Å; E557-Y601 HydrophobicContact CG-CE2 3.59Å; E557-Y601 WeakPolarHBondContact OE1-CE2 3.4Å; E557-Y601 PolarHBondContact OE1-OH 3.15Å; E557-R602 CarbonylContact C-O 3.47Å; E557-R602 WeakPolarHBondContact CA-O 3.39Å; E557-N603 HydrophobicContact CB-CB 4.41Å; E557-R613 VanDerWaalsContact CD-NE 3.34Å; E557-R613 IonicContact OE1-CZ 3.13Å; E557-R613 VanDerWaalsContact OE1-CZ 3.25Å; E557-R613 IonicContact OE1-NE 3.2Å; E557-R613 PolarHBondContact OE1-NE 2.73Å; E557-R613 IonicContact OE1-NH2 3.32Å; E557-R613 PolarHBondContact OE1-NH2 2.85Å; E557-R613 IonicContact OE2-CZ 3.5Å; E557-R613 IonicContact OE2-NE 3.66Å; E557-R613 PolarHBondContact OE2-NE 2.77Å; E557-R613 IonicContact OE2-NH2 2.78Å; E557-R613 PolarHBondContact OE2-NH2 2.97Å
558	G	92.9	Very high	83.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.8	176.1	174.5	0	0	0	0	0	114.7	R602	G558-R602 PolarHBondContact N-O 3.05Å; G558-R602 PolarHBondContact O-N 3.31Å
559	L	94.3	Very high	82.4	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	136.5	163.9	-61.5	174.3	0	0	0	109.2	L270 V290 L292 Q579 L582 T600	L270-L559 HydrophobicContact CD1-CD2 3.52Å; V290-L559 HydrophobicContact CB-CD1 4.04Å; V290-L559 HydrophobicContact CG1-CD1 3.72Å; V290-L559 HydrophobicContact CG1-CD2 4.01Å; V290-L559 WeakPolarHBondContact O-CD1 3.02Å; L292-L559 HydrophobicContact CB-CD1 4.15Å; L292-L559 HydrophobicContact CB-CD2 4.07Å; L292-L559 HydrophobicContact CB-CG 3.95Å; L559-Q579 WeakPolarHBondContact CB-O 3.47Å; L559-Q579 PolarHBondContact N-O 3.23Å; L559-L582 HydrophobicContact CB-CB 4.15Å; L559-L582 HydrophobicContact CB-CD1 4.29Å; L559-L582 HydrophobicContact CD1-CB 3.86Å; L559-T600 WeakPolarHBondContact CA-O 3.21Å
560	D	91.8	Very high	82	Confident	33 Å²	33	55.7 Å²	55.7	18%	0.176	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	140.8	-174.4	-169.6	40.3	0	0	0	109.9	T600 R602	D560-T600 WeakPolarHBondContact CB-OG1 3.4Å; D560-T600 PolarHBondContact N-O 3.42Å; D560-T600 PolarHBondContact O-N 2.6Å; D560-T600 PolarHBondContact O-OG1 3.28Å; D560-R602 HydrophobicContact CB-CB 3.87Å; D560-R602 IonicContact OD1-CZ 3.25Å; D560-R602 IonicContact OD1-NH1 3.53Å; D560-R602 PolarHBondContact OD1-NH1 3.37Å; D560-R602 IonicContact OD1-NH2 3.07Å; D560-R602 PolarHBondContact OD1-NH2 3.09Å; D560-R602 WeakPolarHBondContact OD2-CD 3.47Å; D560-R602 IonicContact OD2-CZ 2.78Å; D560-R602 IonicContact OD2-NE 3.31Å; D560-R602 IonicContact OD2-NH1 2.72Å; D560-R602 PolarHBondContact OD2-NH1 3.29Å
561	F	86.6	Confident	82.1	Confident	66 Å²	66	52 Å²	52	29%	0.289	31%	0.308	S	S	.	.			trans	-120.3	147.9	179	64	-75.7	0	0	0	109.8	L564 L567 V573 V575 L582	F561-L564 HydrophobicContact CE2-CD1 4.39Å; F561-L567 HydrophobicContact CD2-CD1 4.31Å; F561-V573 HydrophobicContact CD1-CG1 3.8Å; F561-V573 HydrophobicContact CD2-CB 4.18Å; F561-V573 HydrophobicContact CD2-CG1 3.98Å; F561-V573 HydrophobicContact CD2-CG2 3.9Å; F561-V573 HydrophobicContact CE1-CB 4.41Å; F561-V573 HydrophobicContact CE1-CG1 3.8Å; F561-V573 HydrophobicContact CE2-CB 3.86Å; F561-V573 HydrophobicContact CE2-CG1 3.97Å; F561-V573 HydrophobicContact CE2-CG2 3.87Å; F561-V573 HydrophobicContact CG-CG1 3.9Å; F561-V573 HydrophobicContact CZ-CB 3.99Å; F561-V573 HydrophobicContact CZ-CG1 3.89Å; F561-V575 HydrophobicContact CD1-CG2 3.82Å; F561-V575 HydrophobicContact CE1-CG2 3.54Å; F561-L582 HydrophobicContact CB-CD1 4.14Å; F561-L582 HydrophobicContact CD1-CD1 3.92Å; F561-L582 HydrophobicContact CG-CD1 4.4Å
562	G	78.5	Confident	82.3	Confident	31 Å²	31	54.6 Å²	54.6	32%	0.32	31%	0.314	S	S	.	.			trans	-63.4	171.1	176.7	0	0	0	0	0	113.1	L564 L567	G562-L564 PolarHBondContact O-N 3.38Å; G562-L567 WeakPolarHBondContact O-CD1 3.03Å
563	D	77.7	Confident	82.6	Confident	132 Å²	132	55.4 Å²	55.4	71%	0.706	32%	0.319	S	S	*	.			trans	-49.2	128.7	-178.5	-65.3	-56.8	0	0	0	111.8	E565 T566 L567	D563-E565 PolarHBondContact O-N 3.14Å; D563-T566 HydrophobicContact CB-CG2 4.2Å; D563-T566 WeakPolarHBondContact O-CB 3.21Å; D563-T566 PolarHBondContact O-N 3.01Å; D563-T566 PolarHBondContact O-OG1 3.32Å; D563-L567 WeakPolarHBondContact O-CD1 3.45Å
564	L	72.8	Confident	82.9	Confident	105 Å²	105	60 Å²	60	55%	0.55	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-56	-29.1	-171.9	-174.9	61.3	0	0	0	113.5	F561 G562 T566 L567 V573	F561-L564 HydrophobicContact CE2-CD1 4.39Å; G562-L564 PolarHBondContact O-N 3.38Å; L564-T566 PolarHBondContact O-N 2.99Å; L564-L567 PolarHBondContact O-N 2.82Å; L564-V573 HydrophobicContact CD1-CG2 3.95Å
565	E	71.1	Confident	83	Confident	191 Å²	191	60 Å²	60	89%	0.893	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-63.8	-22.8	175.3	-57.4	-169.7	165	0	0	113.2	D563	D563-E565 PolarHBondContact O-N 3.14Å
566	T	71.8	Confident	83	Confident	74 Å²	74	61.5 Å²	61.5	45%	0.454	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-88.1	-13.6	-178.4	71.2	0	0	0	0	114.3	D563 L564 G568 Q598	D563-T566 HydrophobicContact CB-CG2 4.2Å; D563-T566 WeakPolarHBondContact O-CB 3.21Å; D563-T566 PolarHBondContact O-N 3.01Å; D563-T566 PolarHBondContact O-OG1 3.32Å; L564-T566 PolarHBondContact O-N 2.99Å; T566-G568 VanDerWaalsContact C-N 3.33Å; T566-Q598 PolarHBondContact OG1-NE2 2.93Å
567	L	70.5	Confident	82.7	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.01	35%	0.347	C	S	.	.	S	Bend	trans	-80.3	-13.2	179.3	-77.9	86.9	0	0	0	113.5	F561 G562 D563 L564 M571 V573 L584 A595	F561-L567 HydrophobicContact CD2-CD1 4.31Å; G562-L567 WeakPolarHBondContact O-CD1 3.03Å; D563-L567 WeakPolarHBondContact O-CD1 3.45Å; L564-L567 PolarHBondContact O-N 2.82Å; L567-M571 HydrophobicContact CB-CB 4.11Å; L567-M571 HydrophobicContact CB-CG 4.03Å; L567-M571 HydrophobicContact CD2-CG 3.86Å; L567-V573 HydrophobicContact CD2-CG2 3.64Å; L567-L584 HydrophobicContact CD2-CD2 4.2Å; L567-A595 HydrophobicContact CD2-CB 3.8Å; L567-A595 HydrophobicContact CG-CB 4.27Å
568	G	68.4	Low	82.2	Confident	35 Å²	35	61.1 Å²	61.1	36%	0.361	35%	0.354	S	S	.	.			trans	90.7	163.9	177.4	0	0	0	0	0	114.9	T566 G570	T566-G568 VanDerWaalsContact C-N 3.33Å; G568-G570 PolarHBondContact O-N 3.14Å
569	S	73.3	Confident	82	Confident	120 Å²	120	63.6 Å²	63.6	84%	0.839	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	124.8	-178.5	55.3	0	0	0	0	111.8
570	G	78.8	Confident	81.8	Confident	43 Å²	43	64.3 Å²	64.3	44%	0.443	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	114.8	-24.8	179.7	0	0	0	0	0	113.3	G568	G568-G570 PolarHBondContact O-N 3.14Å
571	M	89.1	Confident	81.9	Confident	22 Å²	22	64.8 Å²	64.8	11%	0.108	38%	0.375	C	S	.	.			trans	-70.2	140.9	179.1	-158.6	59.3	49.9	0	0	112.4	L567 E585 F592 A595	L567-M571 HydrophobicContact CB-CB 4.11Å; L567-M571 HydrophobicContact CB-CG 4.03Å; L567-M571 HydrophobicContact CD2-CG 3.86Å; M571-E585 CarbonylContact C-O 3.39Å; M571-E585 WeakPolarHBondContact CA-O 3.49Å; M571-E585 VanDerWaalsContact SD-O 3.33Å; M571-F592 HydrophobicContact CE-CB 4.12Å; M571-F592 HydrophobicContact CE-CD2 3.94Å; M571-F592 HydrophobicContact CE-CG 4.45Å; M571-F592 HydrophobicContact SD-CD2 3.98Å; M571-F592 HydrophobicContact SD-CE2 4.41Å; M571-A595 HydrophobicContact CE-CB 3.94Å; M571-A595 HydrophobicContact CG-CB 4.18Å; M571-A595 HydrophobicContact SD-CB 3.92Å
572	K	91	Very high	82.3	Confident	99 Å²	99	61.7 Å²	61.7	43%	0.43	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	144.3	165.6	-52.6	176.5	-143.4	149	0	109.2	E585	K572-E585 HydrophobicContact CB-CB 4.37Å; K572-E585 WeakPolarHBondContact CD-OE2 3.25Å; K572-E585 WeakPolarHBondContact CE-OE2 3.37Å; K572-E585 PolarHBondContact N-O 3.32Å; K572-E585 IonicContact NZ-OE1 2.85Å; K572-E585 PolarHBondContact NZ-OE1 2.93Å; K572-E585 VanDerWaalsContact NZ-OE1 3.16Å; K572-E585 IonicContact NZ-OE2 2.78Å; K572-E585 PolarHBondContact NZ-OE2 2.89Å; K572-E585 PolarHBondContact O-N 3.12Å
573	V	91.9	Very high	83.1	Confident	24 Å²	24	61.6 Å²	61.6	15%	0.145	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	131.8	174.9	-164.9	0	0	0	0	109	F561 L564 L567 V575 L582 V583 L584	F561-V573 HydrophobicContact CD1-CG1 3.8Å; F561-V573 HydrophobicContact CD2-CB 4.18Å; F561-V573 HydrophobicContact CD2-CG1 3.98Å; F561-V573 HydrophobicContact CD2-CG2 3.9Å; F561-V573 HydrophobicContact CE1-CB 4.41Å; F561-V573 HydrophobicContact CE1-CG1 3.8Å; F561-V573 HydrophobicContact CE2-CB 3.86Å; F561-V573 HydrophobicContact CE2-CG1 3.97Å; F561-V573 HydrophobicContact CE2-CG2 3.87Å; F561-V573 HydrophobicContact CG-CG1 3.9Å; F561-V573 HydrophobicContact CZ-CB 3.99Å; F561-V573 HydrophobicContact CZ-CG1 3.89Å; L564-V573 HydrophobicContact CD1-CG2 3.95Å; L567-V573 HydrophobicContact CD2-CG2 3.64Å; V573-V575 HydrophobicContact CG1-CG2 4.14Å; V573-L582 HydrophobicContact CG1-CD1 4.4Å; V573-L582 HydrophobicContact CG1-CD2 4.41Å; V573-L582 HydrophobicContact CG1-CG 4.18Å; V573-V583 WeakPolarHBondContact CA-O 3.36Å; V573-L584 HydrophobicContact CB-CD2 4.36Å; V573-L584 HydrophobicContact CG1-CD2 3.98Å; V573-L584 HydrophobicContact CG2-CD2 3.78Å
574	H	91.4	Very high	83.9	Confident	118 Å²	118	55.4 Å²	55.4	55%	0.546	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.6	171.3	-63.9	-75.4	0	0	0	109.2	V583	H574-V583 HydrophobicContact CB-CB 4.35Å; H574-V583 PolarHBondContact N-O 3.48Å; H574-V583 PolarHBondContact O-N 2.82Å
575	V	88.7	Confident	84.9	Confident	51 Å²	51	52.4 Å²	52.4	31%	0.309	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	139.6	177.4	-174.4	0	0	0	0	108.6	F561 V573 Q579 V581 L582	F561-V575 HydrophobicContact CD1-CG2 3.82Å; F561-V575 HydrophobicContact CE1-CG2 3.54Å; V573-V575 HydrophobicContact CG1-CG2 4.14Å; V575-Q579 HydrophobicContact CG1-CB 4.31Å; V575-Q579 HydrophobicContact CG1-CG 4.21Å; V575-V581 WeakPolarHBondContact CA-O 3.36Å; V575-L582 HydrophobicContact CG2-CB 4.26Å; V575-L582 HydrophobicContact CG2-CD1 3.76Å; V575-L582 HydrophobicContact CG2-CG 3.87Å
576	N	85.9	Confident	85.9	Confident	44 Å²	44	43.5 Å²	43.5	24%	0.235	26%	0.264	C	S	.	.			trans	-74.3	159.6	175.9	70.2	-16.3	0	0	0	111.7	S578 Q579 S580 V581	N576-S578 PolarHBondContact ND2-OG 3.42Å; N576-S578 VanDerWaalsContact ND2-OG 3.14Å; N576-S578 PolarHBondContact O-N 2.76Å; N576-S578 VanDerWaalsContact O-N 3.16Å; N576-Q579 PolarHBondContact O-N 2.92Å; N576-Q579 WeakPolarHBondContact OD1-CA 3.34Å; N576-Q579 PolarHBondContact OD1-N 2.75Å; N576-Q579 VanDerWaalsContact OD1-N 3.09Å; N576-S580 PolarHBondContact ND2-OG 3.36Å; N576-S580 PolarHBondContact OD1-N 2.82Å; N576-V581 HydrophobicContact CB-CB 4.39Å; N576-V581 PolarHBondContact N-O 2.86Å; N576-V581 PolarHBondContact ND2-N 2.74Å; N576-V581 PolarHBondContact OD1-N 3.13Å; N576-V581 PolarHBondContact OD1-O 2.87Å
577	P	79.9	Confident	86.7	Confident	71 Å²	71	44.3 Å²	44.3	46%	0.461	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-32.5	-176.5	-29	37.6	0	0	0	114.8	V474 Y553 Q579	V474-P577 HydrophobicContact CG2-CG 3.98Å; Y553-P577 HydrophobicContact CE1-CB 3.55Å; P577-Q579 VanDerWaalsContact C-N 3.3Å; P577-Q579 PolarHBondContact O-N 2.87Å
578	S	80.3	Confident	87.6	Confident	21 Å²	21	47.5 Å²	47.5	15%	0.147	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-0.2	176.2	49.4	0	0	0	0	114.8	Y553 C555 N576 S580	Y553-S578 WeakPolarHBondContact OH-CB 3.46Å; Y553-S578 PolarHBondContact OH-N 2.94Å; C555-S578 PolarHBondContact SG-O 3.32Å; C555-S578 VanDerWaalsContact SG-O 3.36Å; N576-S578 PolarHBondContact ND2-OG 3.42Å; N576-S578 VanDerWaalsContact ND2-OG 3.14Å; N576-S578 PolarHBondContact O-N 2.76Å; N576-S578 VanDerWaalsContact O-N 3.16Å; S578-S580 PolarHBondContact O-N 2.74Å; S578-S580 PolarHBondContact OG-OG 3.31Å
579	Q	88.8	Confident	88.5	Confident	51 Å²	51	48 Å²	48	24%	0.238	28%	0.276	C	S	.	.	S	Bend	trans	56.9	17.3	-176.7	-56.5	178.5	5.5	0	0	114.6	L559 V575 N576 P577	L559-Q579 WeakPolarHBondContact CB-O 3.47Å; L559-Q579 PolarHBondContact N-O 3.23Å; V575-Q579 HydrophobicContact CG1-CB 4.31Å; V575-Q579 HydrophobicContact CG1-CG 4.21Å; N576-Q579 PolarHBondContact O-N 2.92Å; N576-Q579 WeakPolarHBondContact OD1-CA 3.34Å; N576-Q579 PolarHBondContact OD1-N 2.75Å; N576-Q579 VanDerWaalsContact OD1-N 3.09Å; P577-Q579 VanDerWaalsContact C-N 3.3Å; P577-Q579 PolarHBondContact O-N 2.87Å
580	S	89.8	Confident	89.3	Confident	18 Å²	18	48.1 Å²	48.1	13%	0.126	26%	0.263	C	S	.	.	S	Bend	trans	-87.3	-13.7	177.8	64.2	0	0	0	0	114.3	L292 N576 S578	L292-S580 PolarHBondContact N-O 3.1Å; N576-S580 PolarHBondContact ND2-OG 3.36Å; N576-S580 PolarHBondContact OD1-N 2.82Å; S578-S580 PolarHBondContact O-N 2.74Å; S578-S580 PolarHBondContact OG-OG 3.31Å
581	V	92.6	Very high	89.8	Confident	43 Å²	43	47 Å²	47	26%	0.261	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	127.1	179.3	-177.4	0	0	0	0	110.1	T289 V290 E291 V575 N576	T289-V581 HydrophobicContact CG2-CG1 3.57Å; V290-V581 WeakPolarHBondContact O-CA 3.31Å; E291-V581 HydrophobicContact CG-CG1 4.49Å; E291-V581 HydrophobicContact CG-CG2 4.39Å; V575-V581 WeakPolarHBondContact CA-O 3.36Å; N576-V581 HydrophobicContact CB-CB 4.39Å; N576-V581 PolarHBondContact N-O 2.86Å; N576-V581 PolarHBondContact ND2-N 2.74Å; N576-V581 PolarHBondContact OD1-N 3.13Å; N576-V581 PolarHBondContact OD1-O 2.87Å
582	L	95	Very high	89.9	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	123.3	-179.6	-178.5	149.7	0	0	0	109.7	T289 V290 L559 F561 V573 V575 L584 V599	T289-L582 WeakPolarHBondContact CA-O 3.44Å; V290-L582 HydrophobicContact CB-CB 4.5Å; V290-L582 HydrophobicContact CG2-CD2 4.46Å; V290-L582 PolarHBondContact N-O 2.85Å; V290-L582 PolarHBondContact O-N 3.15Å; L559-L582 HydrophobicContact CB-CB 4.15Å; L559-L582 HydrophobicContact CB-CD1 4.29Å; L559-L582 HydrophobicContact CD1-CB 3.86Å; F561-L582 HydrophobicContact CB-CD1 4.14Å; F561-L582 HydrophobicContact CD1-CD1 3.92Å; F561-L582 HydrophobicContact CG-CD1 4.4Å; V573-L582 HydrophobicContact CG1-CD1 4.4Å; V573-L582 HydrophobicContact CG1-CD2 4.41Å; V573-L582 HydrophobicContact CG1-CG 4.18Å; V575-L582 HydrophobicContact CG2-CB 4.26Å; V575-L582 HydrophobicContact CG2-CD1 3.76Å; V575-L582 HydrophobicContact CG2-CG 3.87Å; L582-L584 HydrophobicContact CD2-CD1 4.23Å; L582-L584 HydrophobicContact CD2-CD2 4.06Å; L582-L584 HydrophobicContact CD2-CG 3.75Å; L582-V599 HydrophobicContact CD2-CG2 3.96Å
583	V	95.8	Very high	90	Very high	30 Å²	30	42.2 Å²	42.2	18%	0.182	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.7	179.1	-172.7	0	0	0	0	109.3	Q287 A288 T289 V573 H574	Q287-V583 HydrophobicContact CG-CG1 3.96Å; A288-V583 CarbonylContact O-C 3.56Å; A288-V583 WeakPolarHBondContact O-CA 3.23Å; T289-V583 HydrophobicContact CG2-CG2 3.98Å; V573-V583 WeakPolarHBondContact CA-O 3.36Å; H574-V583 HydrophobicContact CB-CB 4.35Å; H574-V583 PolarHBondContact N-O 3.48Å; H574-V583 PolarHBondContact O-N 2.82Å
584	L	94.3	Very high	89.9	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	134.9	170.8	-65.6	170.3	0	0	0	109.2	Q287 A288 L567 V573 L582 F592 A595 V596 V599	Q287-L584 CarbonylContact C-O 3.53Å; Q287-L584 VanDerWaalsContact CA-O 3.32Å; Q287-L584 WeakPolarHBondContact CA-O 3.48Å; A288-L584 PolarHBondContact N-O 3.47Å; A288-L584 PolarHBondContact O-N 3.1Å; L567-L584 HydrophobicContact CD2-CD2 4.2Å; V573-L584 HydrophobicContact CB-CD2 4.36Å; V573-L584 HydrophobicContact CG1-CD2 3.98Å; V573-L584 HydrophobicContact CG2-CD2 3.78Å; L582-L584 HydrophobicContact CD2-CD1 4.23Å; L582-L584 HydrophobicContact CD2-CD2 4.06Å; L582-L584 HydrophobicContact CD2-CG 3.75Å; L584-F592 HydrophobicContact CB-CE2 3.87Å; L584-F592 HydrophobicContact CB-CZ 4Å; L584-A595 HydrophobicContact CD1-CB 4.37Å; L584-A595 HydrophobicContact CD2-CB 4.45Å; L584-V596 HydrophobicContact CD1-CB 4.37Å; L584-V596 HydrophobicContact CD1-CG2 3.58Å; L584-V599 HydrophobicContact CD1-CG2 3.85Å
585	E	93.9	Very high	89.9	Confident	43 Å²	43	40.4 Å²	40.4	20%	0.201	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	127.8	171.5	-169.3	-163	170.2	0	0	109.7	N285 I286 M571 K572	N285-E585 WeakPolarHBondContact ND2-CG 3.43Å; N285-E585 PolarHBondContact ND2-OE1 2.92Å; I286-E585 WeakPolarHBondContact O-CA 3.38Å; M571-E585 CarbonylContact C-O 3.39Å; M571-E585 WeakPolarHBondContact CA-O 3.49Å; M571-E585 VanDerWaalsContact SD-O 3.33Å; K572-E585 HydrophobicContact CB-CB 4.37Å; K572-E585 WeakPolarHBondContact CD-OE2 3.25Å; K572-E585 WeakPolarHBondContact CE-OE2 3.37Å; K572-E585 PolarHBondContact N-O 3.32Å; K572-E585 IonicContact NZ-OE1 2.85Å; K572-E585 PolarHBondContact NZ-OE1 2.93Å; K572-E585 VanDerWaalsContact NZ-OE1 3.16Å; K572-E585 IonicContact NZ-OE2 2.78Å; K572-E585 PolarHBondContact NZ-OE2 2.89Å; K572-E585 PolarHBondContact O-N 3.12Å
586	G	91.9	Very high	90.1	Very high	3 Å²	3	38 Å²	38	3%	0.031	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	173.1	176.4	0	0	0	0	0	112.9	N285 I286	N285-G586 WeakPolarHBondContact CA-O 3.38Å; I286-G586 PolarHBondContact N-O 3.02Å; I286-G586 PolarHBondContact O-N 2.91Å
587	D	89	Confident	90.4	Very high	92 Å²	92	39 Å²	39	49%	0.492	20%	0.203	S	C	.	.	S	Bend	trans	-112.7	-37.8	-178.9	52.5	-6.6	0	0	0	112.8	W284	W284-D587 WeakPolarHBondContact O-CB 3.37Å
588	D	88.8	Confident	90.9	Very high	68 Å²	68	38.5 Å²	38.5	36%	0.364	20%	0.195	S	C	.	.			trans	-85.9	127	173.3	169.1	40.3	0	0	0	113.6	E590 S591 F592	D588-E590 PolarHBondContact O-N 3.24Å; D588-E590 PolarHBondContact OD1-N 3.49Å; D588-S591 WeakPolarHBondContact OD2-CB 3.44Å; D588-S591 PolarHBondContact OD2-N 3.29Å; D588-S591 PolarHBondContact OD2-OG 2.77Å; D588-F592 WeakPolarHBondContact O-CB 3.41Å; D588-F592 PolarHBondContact O-N 2.85Å
589	I	89	Confident	91.6	Very high	47 Å²	47	37.5 Å²	37.5	24%	0.241	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-38.8	177.3	-61.8	167.6	0	0	0	112	T278 I286 F592 N593	T278-I589 HydrophobicContact CG2-CD1 3.87Å; I286-I589 HydrophobicContact CD1-CB 4.29Å; I286-I589 HydrophobicContact CD1-CG1 3.72Å; I589-F592 PolarHBondContact O-N 3Å; I589-N593 WeakPolarHBondContact O-CB 3.47Å; I589-N593 VanDerWaalsContact O-CG 3.29Å; I589-N593 PolarHBondContact O-N 3.42Å; I589-N593 PolarHBondContact O-ND2 2.71Å
590	E	88.8	Confident	91.8	Very high	121 Å²	121	36.3 Å²	36.3	57%	0.565	18%	0.184	S	C	*	.	H	α-helix	trans	-70.3	-43.9	-174.6	-160.4	-168.1	106.2	0	0	111.2	D588 N593 R594	D588-E590 PolarHBondContact O-N 3.24Å; D588-E590 PolarHBondContact OD1-N 3.49Å; E590-N593 PolarHBondContact O-N 2.64Å; E590-R594 PolarHBondContact O-N 2.88Å; E590-R594 VanDerWaalsContact O-N 3.16Å; E590-R594 IonicContact OE1-CZ 3.96Å; E590-R594 VanDerWaalsContact OE1-CZ 3.29Å; E590-R594 IonicContact OE1-NH1 3.06Å; E590-R594 PolarHBondContact OE1-NH1 2.89Å; E590-R594 IonicContact OE1-NH2 3.04Å; E590-R594 PolarHBondContact OE1-NH2 3.44Å
591	S	89.3	Confident	92.1	Very high	19 Å²	19	35.4 Å²	35.4	13%	0.133	18%	0.178	C	C	.	.	H	α-helix	trans	-72.4	-32.5	175.3	-53.9	0	0	0	0	112.3	D588 R594 A595	D588-S591 WeakPolarHBondContact OD2-CB 3.44Å; D588-S591 PolarHBondContact OD2-N 3.29Å; D588-S591 PolarHBondContact OD2-OG 2.77Å; S591-R594 PolarHBondContact O-N 3.4Å; S591-R594 PolarHBondContact OG-NH2 3.17Å; S591-A595 WeakPolarHBondContact O-CB 3.45Å; S591-A595 PolarHBondContact O-N 3.45Å
592	F	91.8	Very high	92.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.9	-40.5	171.3	-163.6	-87	0	0	0	112.6	W252 I286 A288 M571 L584 D588 I589 R594 A595 V596	W252-F592 HydrophobicContact CH2-CD1 4.13Å; W252-F592 AromaticContact CH2-CE1 3.89Å; W252-F592 HydrophobicContact CH2-CE1 3.89Å; W252-F592 HydrophobicContact CZ2-CE1 4.06Å; I286-F592 HydrophobicContact CB-CD1 4.41Å; I286-F592 HydrophobicContact CB-CD2 3.87Å; I286-F592 HydrophobicContact CB-CE1 4.48Å; I286-F592 HydrophobicContact CB-CE2 3.95Å; I286-F592 HydrophobicContact CB-CG 4.11Å; I286-F592 HydrophobicContact CB-CZ 4.26Å; I286-F592 HydrophobicContact CD1-CB 3.92Å; I286-F592 HydrophobicContact CD1-CD1 4.49Å; I286-F592 HydrophobicContact CD1-CD2 4.47Å; I286-F592 HydrophobicContact CD1-CG 4.04Å; I286-F592 HydrophobicContact CG2-CD1 3.61Å; I286-F592 HydrophobicContact CG2-CD2 3.85Å; I286-F592 HydrophobicContact CG2-CE1 3.44Å; I286-F592 VanDerWaalsContact CG2-CE1 3.44Å; I286-F592 HydrophobicContact CG2-CE2 3.7Å; I286-F592 HydrophobicContact CG2-CG 3.81Å; I286-F592 HydrophobicContact CG2-CZ 3.49Å; I286-F592 VanDerWaalsContact CG2-CZ 3.49Å; I286-F592 WeakPolarHBondContact O-CE2 3.34Å; A288-F592 HydrophobicContact CB-CE1 4.03Å; A288-F592 HydrophobicContact CB-CZ 3.6Å; M571-F592 HydrophobicContact CE-CB 4.12Å; M571-F592 HydrophobicContact CE-CD2 3.94Å; M571-F592 HydrophobicContact CE-CG 4.45Å; M571-F592 HydrophobicContact SD-CD2 3.98Å; M571-F592 HydrophobicContact SD-CE2 4.41Å; L584-F592 HydrophobicContact CB-CE2 3.87Å; L584-F592 HydrophobicContact CB-CZ 4Å; D588-F592 WeakPolarHBondContact O-CB 3.41Å; D588-F592 PolarHBondContact O-N 2.85Å; I589-F592 PolarHBondContact O-N 3Å; F592-R594 PolarHBondContact O-N 2.89Å; F592-A595 PolarHBondContact O-N 2.99Å; F592-V596 HydrophobicContact CD1-CG2 3.86Å; F592-V596 HydrophobicContact CE1-CG2 3.5Å; F592-V596 HydrophobicContact CZ-CG2 4.16Å; F592-V596 WeakPolarHBondContact O-CG2 3.33Å; F592-V596 PolarHBondContact O-N 3.47Å
593	N	92.3	Very high	91.9	Very high	22 Å²	22	37 Å²	37	12%	0.118	18%	0.179	C	C	.	.	H	α-helix	trans	-62.4	-42	174	-76.3	-29.3	0	0	0	111.7	H275 L276 I589 E590 Q597	H275-N593 WeakPolarHBondContact CA-OD1 3.46Å; L276-N593 PolarHBondContact N-OD1 2.82Å; I589-N593 WeakPolarHBondContact O-CB 3.47Å; I589-N593 VanDerWaalsContact O-CG 3.29Å; I589-N593 PolarHBondContact O-N 3.42Å; I589-N593 PolarHBondContact O-ND2 2.71Å; E590-N593 PolarHBondContact O-N 2.64Å; N593-Q597 WeakPolarHBondContact O-CB 3.34Å; N593-Q597 VanDerWaalsContact O-CD 3.32Å; N593-Q597 WeakPolarHBondContact O-CG 3.35Å; N593-Q597 PolarHBondContact O-N 2.76Å; N593-Q597 VanDerWaalsContact O-N 3.11Å
594	R	90.2	Very high	91.4	Very high	101 Å²	101	38.9 Å²	38.9	38%	0.381	19%	0.194	S	C	.	.	H	α-helix	trans	-59.2	-47.7	171.1	-76.4	-176.6	-81	-94.6	-2.9	112.5	E590 S591 F592 V596 Q597 Q598	E590-R594 PolarHBondContact O-N 2.88Å; E590-R594 VanDerWaalsContact O-N 3.16Å; E590-R594 IonicContact OE1-CZ 3.96Å; E590-R594 VanDerWaalsContact OE1-CZ 3.29Å; E590-R594 IonicContact OE1-NH1 3.06Å; E590-R594 PolarHBondContact OE1-NH1 2.89Å; E590-R594 IonicContact OE1-NH2 3.04Å; E590-R594 PolarHBondContact OE1-NH2 3.44Å; S591-R594 PolarHBondContact O-N 3.4Å; S591-R594 PolarHBondContact OG-NH2 3.17Å; F592-R594 PolarHBondContact O-N 2.89Å; R594-V596 PolarHBondContact O-N 2.97Å; R594-Q597 PolarHBondContact O-N 3.44Å; R594-Q598 WeakPolarHBondContact O-CG 3.28Å; R594-Q598 PolarHBondContact O-N 2.91Å; R594-Q598 VanDerWaalsContact O-N 3.11Å
595	A	91.2	Very high	90.7	Very high	2 Å²	2	39.7 Å²	39.7	2%	0.017	20%	0.198	C	C	.	.	H	α-helix	trans	-58.6	-45.2	-179.8	0	0	0	0	0	112.4	L567 M571 L584 S591 F592 Q598	L567-A595 HydrophobicContact CD2-CB 3.8Å; L567-A595 HydrophobicContact CG-CB 4.27Å; M571-A595 HydrophobicContact CE-CB 3.94Å; M571-A595 HydrophobicContact CG-CB 4.18Å; M571-A595 HydrophobicContact SD-CB 3.92Å; L584-A595 HydrophobicContact CD1-CB 4.37Å; L584-A595 HydrophobicContact CD2-CB 4.45Å; S591-A595 WeakPolarHBondContact O-CB 3.45Å; S591-A595 PolarHBondContact O-N 3.45Å; F592-A595 PolarHBondContact O-N 2.99Å; A595-Q598 PolarHBondContact O-N 3.19Å
596	V	92.7	Very high	89.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-38	177.8	172.6	0	0	0	0	111.9	W252 F271 L274 L584 F592 R594 Q598 V599	W252-V596 HydrophobicContact CH2-CB 4.36Å; W252-V596 HydrophobicContact CH2-CG1 4.21Å; W252-V596 HydrophobicContact CH2-CG2 3.93Å; W252-V596 HydrophobicContact CZ3-CG1 4.35Å; F271-V596 HydrophobicContact CB-CG1 4.23Å; F271-V596 HydrophobicContact CD2-CG1 4.14Å; L274-V596 HydrophobicContact CD2-CG1 3.73Å; L274-V596 HydrophobicContact CG-CG1 4.28Å; L584-V596 HydrophobicContact CD1-CB 4.37Å; L584-V596 HydrophobicContact CD1-CG2 3.58Å; F592-V596 HydrophobicContact CD1-CG2 3.86Å; F592-V596 HydrophobicContact CE1-CG2 3.5Å; F592-V596 HydrophobicContact CZ-CG2 4.16Å; F592-V596 WeakPolarHBondContact O-CG2 3.33Å; F592-V596 PolarHBondContact O-N 3.47Å; R594-V596 PolarHBondContact O-N 2.97Å; V596-Q598 PolarHBondContact O-N 2.85Å; V596-V599 WeakPolarHBondContact O-CB 3.45Å; V596-V599 PolarHBondContact O-N 2.95Å; V596-V599 VanDerWaalsContact O-N 3.15Å
597	Q	92.2	Very high	89	Confident	65 Å²	65	43.6 Å²	43.6	30%	0.304	21%	0.211	S	C	.	.	H	α-helix	trans	-66.5	-25	176.3	-71.2	164.1	13.5	0	0	113.2	L274 N593 R594	L274-Q597 WeakPolarHBondContact O-CG 3.35Å; L274-Q597 PolarHBondContact O-NE2 2.9Å; N593-Q597 WeakPolarHBondContact O-CB 3.34Å; N593-Q597 VanDerWaalsContact O-CD 3.32Å; N593-Q597 WeakPolarHBondContact O-CG 3.35Å; N593-Q597 PolarHBondContact O-N 2.76Å; N593-Q597 VanDerWaalsContact O-N 3.11Å; R594-Q597 PolarHBondContact O-N 3.44Å
598	Q	91.3	Very high	88.7	Confident	61 Å²	61	39.2 Å²	39.2	29%	0.285	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-3.4	174.1	-72.2	179.9	-15.6	0	0	114.2	T566 R594 A595 V596 T600	T566-Q598 PolarHBondContact OG1-NE2 2.93Å; R594-Q598 WeakPolarHBondContact O-CG 3.28Å; R594-Q598 PolarHBondContact O-N 2.91Å; R594-Q598 VanDerWaalsContact O-N 3.11Å; A595-Q598 PolarHBondContact O-N 3.19Å; V596-Q598 PolarHBondContact O-N 2.85Å; Q598-T600 PolarHBondContact O-N 2.61Å
599	V	93.9	Very high	88.6	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.006	18%	0.175	C	C	.	.			trans	-70.8	118.1	174.4	-179.1	0	0	0	0	109.5	L270 F271 V290 L582 L584 V596	L270-V599 HydrophobicContact CD1-CG1 4.4Å; L270-V599 PolarHBondContact N-O 2.8Å; F271-V599 HydrophobicContact CD2-CB 4.08Å; F271-V599 HydrophobicContact CD2-CG1 4.4Å; F271-V599 HydrophobicContact CE2-CB 4.36Å; F271-V599 HydrophobicContact CE2-CG1 4.18Å; V290-V599 HydrophobicContact CG1-CG1 4.49Å; V290-V599 HydrophobicContact CG2-CG1 4.4Å; L582-V599 HydrophobicContact CD2-CG2 3.96Å; L584-V599 HydrophobicContact CD1-CG2 3.85Å; V596-V599 WeakPolarHBondContact O-CB 3.45Å; V596-V599 PolarHBondContact O-N 2.95Å; V596-V599 VanDerWaalsContact O-N 3.15Å
600	T	94.4	Very high	88.5	Confident	25 Å²	25	37.2 Å²	37.2	15%	0.153	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	154.1	178.9	63.4	0	0	0	0	111.6	I268 L559 D560 Q598	I268-T600 CarbonylContact O-C 3.32Å; I268-T600 WeakPolarHBondContact O-CA 3.43Å; I268-T600 WeakPolarHBondContact O-CB 3.34Å; L559-T600 WeakPolarHBondContact CA-O 3.21Å; D560-T600 WeakPolarHBondContact CB-OG1 3.4Å; D560-T600 PolarHBondContact N-O 3.42Å; D560-T600 PolarHBondContact O-N 2.6Å; D560-T600 PolarHBondContact O-OG1 3.28Å; Q598-T600 PolarHBondContact O-N 2.61Å
601	Y	95.2	Very high	88.6	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.9	157.8	167	-89.2	0	0	0	108.1	Y261 S267 I268 L292 E557 N603 L639 V641	Y261-Y601 AromaticContact CD1-CE1 3.67Å; Y261-Y601 HydrophobicContact CD1-CE1 3.67Å; Y261-Y601 AromaticContact CD2-CD1 3.85Å; Y261-Y601 HydrophobicContact CD2-CD1 3.85Å; Y261-Y601 AromaticContact CD2-CE1 3.79Å; Y261-Y601 HydrophobicContact CD2-CE1 3.79Å; Y261-Y601 HydrophobicContact CE1-CE1 4.03Å; Y261-Y601 HydrophobicContact CE2-CD1 4.31Å; Y261-Y601 HydrophobicContact CE2-CE1 4.17Å; Y261-Y601 AromaticContact CG-CD1 3.99Å; Y261-Y601 HydrophobicContact CG-CD1 3.99Å; Y261-Y601 AromaticContact CG-CE1 3.53Å; Y261-Y601 HydrophobicContact CG-CE1 3.53Å; S267-Y601 CarbonylContact C-O 3.51Å; S267-Y601 VanDerWaalsContact CA-O 3.29Å; S267-Y601 WeakPolarHBondContact CA-O 3.37Å; I268-Y601 HydrophobicContact CG1-CD1 4.4Å; I268-Y601 PolarHBondContact N-O 3.01Å; I268-Y601 PolarHBondContact O-N 2.92Å; L292-Y601 HydrophobicContact CD1-CD2 4.14Å; L292-Y601 HydrophobicContact CD1-CE2 4.38Å; L292-Y601 HydrophobicContact CD2-CD2 3.91Å; L292-Y601 HydrophobicContact CD2-CE2 3.96Å; E557-Y601 HydrophobicContact CG-CE2 3.59Å; E557-Y601 WeakPolarHBondContact OE1-CE2 3.4Å; E557-Y601 PolarHBondContact OE1-OH 3.15Å; Y601-N603 HydrophobicContact CE1-CB 3.59Å; Y601-N603 WeakPolarHBondContact OH-CB 3.48Å; Y601-N603 PolarHBondContact OH-ND2 3.28Å; Y601-N603 VanDerWaalsContact OH-ND2 3.11Å; Y601-L639 HydrophobicContact CD1-CD2 3.62Å; Y601-L639 HydrophobicContact CD2-CD2 3.22Å; Y601-L639 HydrophobicContact CE1-CD2 3.65Å; Y601-L639 HydrophobicContact CE2-CD2 3.21Å; Y601-L639 HydrophobicContact CG-CD2 3.39Å; Y601-L639 VanDerWaalsContact CZ-CD2 3.43Å; Y601-V641 WeakPolarHBondContact OH-CG2 3.48Å
602	R	92.2	Very high	88.7	Confident	73 Å²	73	35.3 Å²	35.3	28%	0.275	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.1	176.2	178.5	173.8	62.9	-152.9	-7	108.8	S267 E557 G558 D560	S267-R602 WeakPolarHBondContact OG-CB 3.42Å; S267-R602 WeakPolarHBondContact OG-CG 3.41Å; E557-R602 CarbonylContact C-O 3.47Å; E557-R602 WeakPolarHBondContact CA-O 3.39Å; G558-R602 PolarHBondContact N-O 3.05Å; G558-R602 PolarHBondContact O-N 3.31Å; D560-R602 HydrophobicContact CB-CB 3.87Å; D560-R602 IonicContact OD1-CZ 3.25Å; D560-R602 IonicContact OD1-NH1 3.53Å; D560-R602 PolarHBondContact OD1-NH1 3.37Å; D560-R602 IonicContact OD1-NH2 3.07Å; D560-R602 PolarHBondContact OD1-NH2 3.09Å; D560-R602 WeakPolarHBondContact OD2-CD 3.47Å; D560-R602 IonicContact OD2-CZ 2.78Å; D560-R602 IonicContact OD2-NE 3.31Å; D560-R602 IonicContact OD2-NH1 2.72Å; D560-R602 PolarHBondContact OD2-NH1 3.29Å
603	N	90.7	Very high	88.8	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.011	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	112.2	162.9	-170.2	-22.5	0	0	0	110.5	Y261 D302 R556 E557 Y601 L605 A608	Y261-N603 HydrophobicContact CD1-CB 4.49Å; Y261-N603 HydrophobicContact CE1-CB 3.76Å; Y261-N603 PolarHBondContact OH-O 3.03Å; D302-N603 PolarHBondContact OD2-ND2 2.78Å; D302-N603 VanDerWaalsContact OD2-ND2 3.12Å; R556-N603 WeakPolarHBondContact O-CA 3.3Å; E557-N603 HydrophobicContact CB-CB 4.41Å; Y601-N603 HydrophobicContact CE1-CB 3.59Å; Y601-N603 WeakPolarHBondContact OH-CB 3.48Å; Y601-N603 PolarHBondContact OH-ND2 3.28Å; Y601-N603 VanDerWaalsContact OH-ND2 3.11Å; N603-L605 VanDerWaalsContact C-N 3.3Å; N603-L605 PolarHBondContact O-N 3.37Å; N603-L605 VanDerWaalsContact OD1-CB 3.31Å; N603-L605 WeakPolarHBondContact OD1-CB 3.32Å; N603-L605 PolarHBondContact OD1-N 2.81Å; N603-A608 WeakPolarHBondContact ND2-CB 3.4Å
604	S	85.3	Confident	88.9	Confident	71 Å²	71	36.3 Å²	36.3	50%	0.497	19%	0.19	S	C	.	.			trans	-82.2	-2.5	-176.4	53.4	0	0	0	0	114.2	R556	R556-S604 WeakPolarHBondContact CA-OG 3.48Å; R556-S604 WeakPolarHBondContact CB-OG 3.35Å; R556-S604 VanDerWaalsContact CD-OG 3.28Å; R556-S604 WeakPolarHBondContact CD-OG 3.34Å; R556-S604 PolarHBondContact O-N 3.02Å; R556-S604 PolarHBondContact O-OG 3.2Å
605	L	79.7	Confident	89.1	Confident	17 Å²	17	31.7 Å²	31.7	9%	0.089	17%	0.173	C	C	.	.			trans	-78.8	125.7	174.8	-63.2	170.6	0	0	0	111.4	D302 D304 R556 N603 F607 A608	D302-L605 HydrophobicContact CB-CD1 4.23Å; D302-L605 VanDerWaalsContact CG-CD1 3.45Å; D302-L605 WeakPolarHBondContact OD2-CD1 3.07Å; D304-L605 VanDerWaalsContact OD1-CD2 3.26Å; D304-L605 WeakPolarHBondContact OD1-CD2 3.4Å; R556-L605 HydrophobicContact CB-CD1 4.1Å; R556-L605 HydrophobicContact CB-CD2 3.98Å; R556-L605 HydrophobicContact CB-CG 3.68Å; R556-L605 HydrophobicContact CG-CD2 3.9Å; R556-L605 HydrophobicContact CG-CG 4.19Å; N603-L605 VanDerWaalsContact C-N 3.3Å; N603-L605 PolarHBondContact O-N 3.37Å; N603-L605 VanDerWaalsContact OD1-CB 3.31Å; N603-L605 WeakPolarHBondContact OD1-CB 3.32Å; N603-L605 PolarHBondContact OD1-N 2.81Å; L605-F607 PolarHBondContact O-N 3.26Å; L605-A608 HydrophobicContact CB-CB 4.2Å
606	R	73	Confident	89.4	Confident	109 Å²	109	33.7 Å²	33.7	41%	0.411	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-31.4	168.2	-165.4	176.6	-164	123.7	4.3	112.2	L683	R606-L683 VanDerWaalsContact NH2-CD1 3.29Å
607	F	77.4	Confident	89.5	Confident	19 Å²	19	33.7 Å²	33.7	8%	0.083	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.7	43.6	-177.5	-52.2	-68.2	0	0	0	111.8	L605 P644 P647 L683 M788 R791 Y792	L605-F607 PolarHBondContact O-N 3.26Å; F607-P644 HydrophobicContact CB-CG 4.44Å; F607-P644 HydrophobicContact CD1-CB 4.28Å; F607-P647 HydrophobicContact CD1-CG 4.27Å; F607-P647 HydrophobicContact CE1-CB 4.06Å; F607-P647 HydrophobicContact CE1-CG 3.74Å; F607-P647 HydrophobicContact CE2-CG 4.4Å; F607-P647 HydrophobicContact CZ-CB 3.87Å; F607-P647 HydrophobicContact CZ-CG 3.8Å; F607-L683 HydrophobicContact CE1-CD2 3.74Å; F607-L683 HydrophobicContact CZ-CD2 3.94Å; F607-M788 HydrophobicContact CB-CE 4.1Å; F607-M788 HydrophobicContact CB-SD 3.88Å; F607-M788 HydrophobicContact CD2-CE 3.25Å; F607-M788 HydrophobicContact CD2-SD 3.88Å; F607-M788 HydrophobicContact CE2-CE 3.78Å; F607-M788 HydrophobicContact CG-CE 3.79Å; F607-M788 HydrophobicContact CG-SD 4.21Å; F607-R791 VanDerWaalsContact O-CZ 3.32Å; F607-R791 PolarHBondContact O-NH1 2.97Å; F607-R791 PolarHBondContact O-NH2 3.31Å; F607-Y792 HydrophobicContact CB-CE2 4.36Å
608	A	84.3	Confident	89.7	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.179	C	C	.	.			trans	-42.2	146	177.3	0	0	0	0	0	113.4	P263 D302 N603 L605 P610 V641 R791	P263-A608 HydrophobicContact CB-CB 4.4Å; P263-A608 HydrophobicContact CG-CB 4.33Å; D302-A608 WeakPolarHBondContact OD2-CA 3.34Å; N603-A608 WeakPolarHBondContact ND2-CB 3.4Å; L605-A608 HydrophobicContact CB-CB 4.2Å; A608-P610 VanDerWaalsContact O-CD 3.27Å; A608-P610 WeakPolarHBondContact O-CD 3.46Å; A608-V641 HydrophobicContact CB-CG1 3.92Å; A608-R791 PolarHBondContact O-NH2 3.15Å
609	T	85.1	Confident	89.8	Confident	17 Å²	17	30.9 Å²	30.9	10%	0.104	17%	0.172	C	C	.	.			trans	-72.9	111.4	179	-62.3	0	0	0	0	109.6	I297 D302 R613	I297-T609 HydrophobicContact CG2-CG2 4.2Å; D302-T609 WeakPolarHBondContact OD1-CB 3.13Å; D302-T609 PolarHBondContact OD1-N 3.17Å; D302-T609 PolarHBondContact OD1-OG1 3.45Å; D302-T609 PolarHBondContact OD2-N 3.36Å; T609-R613 PolarHBondContact O-NH1 3.01Å; T609-R613 VanDerWaalsContact O-NH1 3.16Å; T609-R613 PolarHBondContact O-NH2 2.87Å
610	P	87.4	Confident	89.6	Confident	56 Å²	56	33.7 Å²	33.7	36%	0.364	19%	0.192	S	C	.	.			trans	-66.7	158.5	-175.8	28.7	-35.1	0	0	0	112	A608 V641 Q643	A608-P610 VanDerWaalsContact O-CD 3.27Å; A608-P610 WeakPolarHBondContact O-CD 3.46Å; P610-V641 WeakPolarHBondContact CA-O 3.36Å; P610-Q643 HydrophobicContact CB-CB 4.43Å
611	G	90	Very high	89.3	Confident	28 Å²	28	33.1 Å²	33.1	29%	0.289	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	137.2	-163.9	177.6	0	0	0	0	0	113.2	V641	G611-V641 PolarHBondContact N-O 3.36Å; G611-V641 PolarHBondContact O-N 2.79Å
612	V	92.6	Very high	88.9	Confident	72 Å²	72	38.9 Å²	38.9	44%	0.436	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	117.5	-170.3	-175.5	0	0	0	0	109.7	H296 P614 Y638 L639	H296-V612 PolarHBondContact CE1-O 3.05Å; H296-V612 PolarHBondContact NE2-O 3.11Å; V612-P614 WeakPolarHBondContact O-CD 3.4Å; V612-Y638 HydrophobicContact CG1-CD2 3.9Å; V612-Y638 HydrophobicContact CG1-CG 3.93Å; V612-L639 CarbonylContact C-O 3.6Å; V612-L639 WeakPolarHBondContact CA-O 3.37Å
613	R	92.9	Very high	88.5	Confident	1 Å²	1	36.1 Å²	36.1	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	113.8	170.3	-45.1	-58.5	-169	-103	-13.6	108.8	L292 I297 D302 E557 T609 L615 Y638 L639 V641	L292-R613 HydrophobicContact CD1-CB 3.66Å; L292-R613 HydrophobicContact CD1-CG 4.22Å; L292-R613 HydrophobicContact CG-CB 4.36Å; I297-R613 VanDerWaalsContact CD1-CD 3.44Å; I297-R613 VanDerWaalsContact CD1-NE 3.33Å; D302-R613 IonicContact OD2-NH2 2.74Å; E557-R613 VanDerWaalsContact CD-NE 3.34Å; E557-R613 IonicContact OE1-CZ 3.13Å; E557-R613 VanDerWaalsContact OE1-CZ 3.25Å; E557-R613 IonicContact OE1-NE 3.2Å; E557-R613 PolarHBondContact OE1-NE 2.73Å; E557-R613 IonicContact OE1-NH2 3.32Å; E557-R613 PolarHBondContact OE1-NH2 2.85Å; E557-R613 IonicContact OE2-CZ 3.5Å; E557-R613 IonicContact OE2-NE 3.66Å; E557-R613 PolarHBondContact OE2-NE 2.77Å; E557-R613 IonicContact OE2-NH2 2.78Å; E557-R613 PolarHBondContact OE2-NH2 2.97Å; T609-R613 PolarHBondContact O-NH1 3.01Å; T609-R613 VanDerWaalsContact O-NH1 3.16Å; T609-R613 PolarHBondContact O-NH2 2.87Å; R613-L615 PolarHBondContact O-N 3.01Å; R613-Y638 CarbonylContact O-C 3.52Å; R613-Y638 VanDerWaalsContact O-CA 3.27Å; R613-Y638 WeakPolarHBondContact O-CA 3.29Å; R613-L639 HydrophobicContact CB-CB 4.24Å; R613-L639 HydrophobicContact CG-CD2 4.46Å; R613-L639 PolarHBondContact N-O 3.06Å; R613-L639 PolarHBondContact O-N 3.16Å; R613-V641 HydrophobicContact CG-CG2 4.45Å
614	P	95.3	Very high	87.9	Confident	43 Å²	43	43 Å²	43	28%	0.279	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	135.1	170.1	-19.7	29.7	0	0	0	110.6	Q293 V612	Q293-P614 HydrophobicContact CB-CB 3.96Å; Q293-P614 HydrophobicContact CB-CG 4.07Å; Q293-P614 HydrophobicContact CG-CB 4.19Å; Q293-P614 PolarHBondContact N-O 2.74Å; V612-P614 WeakPolarHBondContact O-CD 3.4Å
615	L	95.2	Very high	87.2	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.8	175.7	-75.4	169	0	0	0	108.9	L270 E291 L292 R613 E636 G637 L639	L270-L615 HydrophobicContact CD1-CD2 3.99Å; L270-L615 HydrophobicContact CD2-CD1 3.86Å; E291-L615 WeakPolarHBondContact O-CA 3.23Å; L292-L615 HydrophobicContact CB-CD2 4.43Å; L292-L615 HydrophobicContact CD1-CD2 3.56Å; L292-L615 HydrophobicContact CD1-CG 4.37Å; R613-L615 PolarHBondContact O-N 3.01Å; L615-E636 WeakPolarHBondContact O-CA 3.43Å; L615-G637 PolarHBondContact N-O 2.96Å; L615-G637 PolarHBondContact O-N 3.15Å; L615-L639 HydrophobicContact CD1-CB 4.1Å; L615-L639 HydrophobicContact CG-CB 4.46Å
616	K	95.8	Very high	86.3	Confident	44 Å²	44	55.3 Å²	55.3	19%	0.191	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.3	173.3	-61.7	179.7	177.1	-123.2	0	109.8	V290 E291 L635 E636	V290-K616 CarbonylContact C-O 3.59Å; V290-K616 WeakPolarHBondContact CA-O 3.1Å; E291-K616 HydrophobicContact CB-CB 4.23Å; E291-K616 PolarHBondContact N-O 2.8Å; E291-K616 PolarHBondContact O-N 2.73Å; K616-L635 WeakPolarHBondContact CA-O 3.41Å; K616-E636 WeakPolarHBondContact CE-OE1 3.45Å; K616-E636 HydrophobicContact CG-CG 4.39Å; K616-E636 IonicContact NZ-OE1 3.23Å; K616-E636 PolarHBondContact NZ-OE1 2.84Å
617	L	95.9	Very high	85.6	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	112	170.2	169.8	62.9	0	0	0	108	W252 W255 L274 A288 T289 V290 L635	W252-L617 HydrophobicContact CD2-CD2 4.43Å; W255-L617 HydrophobicContact CE3-CD2 4.42Å; W255-L617 HydrophobicContact CH2-CB 4.11Å; W255-L617 HydrophobicContact CZ3-CB 4.03Å; W255-L617 HydrophobicContact CZ3-CD2 3.9Å; L274-L617 HydrophobicContact CD2-CD2 3.57Å; A288-L617 HydrophobicContact CB-CD1 3.91Å; T289-L617 WeakPolarHBondContact O-CA 3.28Å; V290-L617 HydrophobicContact CG2-CD1 4.1Å; L617-L635 HydrophobicContact CB-CB 4.27Å; L617-L635 HydrophobicContact CD2-CD1 4.12Å; L617-L635 PolarHBondContact N-O 3Å; L617-L635 PolarHBondContact O-N 3.23Å
618	T	95.3	Very high	84.7	Confident	42 Å²	42	63 Å²	63	26%	0.258	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	151.6	169.5	58.4	0	0	0	0	109.4	A288 T289 Q634	A288-T618 CarbonylContact C-O 3.59Å; A288-T618 VanDerWaalsContact CA-O 3.24Å; A288-T618 WeakPolarHBondContact CA-O 3.37Å; A288-T618 WeakPolarHBondContact CB-O 3.47Å; T289-T618 WeakPolarHBondContact CB-OG1 3.38Å; T289-T618 PolarHBondContact N-O 2.85Å; T289-T618 PolarHBondContact O-N 2.86Å; T289-T618 PolarHBondContact O-OG1 3.32Å; T618-Q634 HydrophobicContact CG2-CB 4.39Å; T618-Q634 HydrophobicContact CG2-CG 3.81Å
619	T	93.4	Very high	83.9	Confident	24 Å²	24	65 Å²	65	15%	0.147	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	131.6	-179.1	-50.7	0	0	0	0	110.1	W252 I286 Q287 A288 L621 L632	W252-T619 HydrophobicContact CZ2-CG2 4.18Å; W252-T619 PolarHBondContact NE1-OG1 2.86Å; I286-T619 HydrophobicContact CG2-CG2 4.42Å; Q287-T619 CarbonylContact O-C 3.53Å; Q287-T619 VanDerWaalsContact O-CA 3.29Å; Q287-T619 WeakPolarHBondContact O-CA 3.13Å; Q287-T619 WeakPolarHBondContact O-CG2 3.44Å; A288-T619 HydrophobicContact CB-CG2 4.15Å; T619-L621 HydrophobicContact CG2-CD2 4.14Å; T619-L632 HydrophobicContact CG2-CD1 3.74Å
620	S	90.6	Very high	83.3	Confident	60 Å²	60	65 Å²	65	42%	0.42	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	135.6	173.9	52.4	0	0	0	0	109.8	Q287	Q287-S620 PolarHBondContact N-O 2.66Å; Q287-S620 PolarHBondContact O-N 2.89Å
621	L	89	Confident	83	Confident	13 Å²	13	68.3 Å²	68.3	7%	0.068	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	139	179.6	-57.1	-176	0	0	0	109.4	L276 V283 I286 T619 L630 L632	L276-L621 HydrophobicContact CD2-CD2 3.92Å; V283-L621 HydrophobicContact CG1-CB 4.12Å; V283-L621 HydrophobicContact CG1-CD2 4.25Å; V283-L621 HydrophobicContact CG2-CD1 4.34Å; I286-L621 HydrophobicContact CB-CD2 4.26Å; I286-L621 HydrophobicContact CG1-CD2 4.21Å; I286-L621 HydrophobicContact CG2-CD2 3.71Å; T619-L621 HydrophobicContact CG2-CD2 4.14Å; L621-L630 HydrophobicContact CB-CB 4.45Å; L621-L630 HydrophobicContact CD1-CB 3.74Å; L621-L630 HydrophobicContact CD1-CD1 3.71Å; L621-L630 HydrophobicContact CD1-CG 4.38Å; L621-L632 HydrophobicContact CD1-CD1 3.81Å; L621-L632 HydrophobicContact CD1-CD2 4.15Å; L621-L632 HydrophobicContact CD1-CG 4.01Å; L621-L632 HydrophobicContact CD2-CD1 4.32Å; L621-L632 HydrophobicContact CG-CD1 3.97Å; L621-L632 HydrophobicContact CG-CG 4.32Å
622	R	86.6	Confident	82.8	Confident	122 Å²	122	68 Å²	68	46%	0.46	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	125	168.9	-54.4	-177.8	-179.9	154.9	0.1	109.6	V283 W284 N285	V283-R622 VanDerWaalsContact CG1-O 3.24Å; V283-R622 WeakPolarHBondContact CG1-O 3.46Å; W284-R622 HydrophobicContact CD2-CB 4.41Å; W284-R622 HydrophobicContact CZ2-CB 3.78Å; W284-R622 HydrophobicContact CZ2-CG 4.39Å; W284-R622 PolarHBondContact N-O 3.34Å; N285-R622 HydrophobicContact CB-CB 4.19Å; N285-R622 HydrophobicContact CB-CG 4.47Å; N285-R622 PolarHBondContact N-O 3.03Å; N285-R622 PolarHBondContact O-N 3.1Å; N285-R622 WeakPolarHBondContact OD1-CD 3.2Å; N285-R622 PolarHBondContact OD1-NH1 2.86Å
623	C	82.9	Confident	82.6	Confident	15 Å²	15	73.5 Å²	73.5	10%	0.101	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	173.4	175.8	-53.5	0	0	0	0	110.4	T282 W284 N625 C629	T282-C623 WeakPolarHBondContact O-CB 3.37Å; W284-C623 VanDerWaalsContact CD1-O 3.26Å; W284-C623 PolarHBondContact NE1-O 3.22Å; C623-N625 VanDerWaalsContact C-N 3.25Å; C623-N625 PolarHBondContact O-N 2.99Å; C623-C629 HydrophobicContact CB-CB 3.57Å; C623-C629 WeakPolarHBondContact CB-SG 3.29Å; C623-C629 PolarHBondContact N-SG 3.03Å; C623-C629 WeakPolarHBondContact SG-CB 3.35Å; C623-C629 CovalentContact SG-SG 2.03Å; C623-C629 PolarHBondContact SG-SG 3.14Å
624	F	77.7	Confident	82.6	Confident	147 Å²	147	77.9 Å²	77.9	65%	0.645	41%	0.406	S	S	*	.	S	Bend	trans	-72.2	-14	-171.5	-72.6	-83.3	0	0	0	114.9	W284	W284-F624 HydrophobicContact CB-CD2 4.43Å; W284-F624 HydrophobicContact CB-CE1 3.97Å; W284-F624 HydrophobicContact CB-CE2 3.82Å; W284-F624 HydrophobicContact CB-CZ 3.57Å; W284-F624 HydrophobicContact CG-CE1 4.37Å; W284-F624 HydrophobicContact CG-CZ 4.4Å
625	N	70.3	Confident	82.6	Confident	136 Å²	136	77.3 Å²	77.3	73%	0.727	40%	0.401	S	S	*	.	S	Bend	trans	-88.7	138.5	168.1	-61.2	-22.8	0	0	0	108.6	C623 E627	C623-N625 VanDerWaalsContact C-N 3.25Å; C623-N625 PolarHBondContact O-N 2.99Å; N625-E627 PolarHBondContact O-N 2.92Å; N625-E627 VanDerWaalsContact O-N 3.07Å
626	E	60.6	Low	82.6	Confident	209 Å²	209	82.1 Å²	82.1	98%	0.977	42%	0.423	S	S	*	.	S	Bend	trans	-72.1	-1.8	-170	-59.8	-174.3	144.2	0	0	115.1
627	E	58.6	Low	82.6	Confident	173 Å²	173	80.4 Å²	80.4	81%	0.808	42%	0.418	S	S	*	.	S	Bend	trans	-92.4	148.5	170.5	-64.2	-172.8	149.4	0	0	111.1	N625 C629	N625-E627 PolarHBondContact O-N 2.92Å; N625-E627 VanDerWaalsContact O-N 3.07Å; E627-C629 PolarHBondContact O-N 3.12Å
628	S	58.2	Low	82.5	Confident	116 Å²	116	84 Å²	84	81%	0.811	43%	0.432	S	S	*	.			trans	-66.4	99.3	-177.1	56.4	0	0	0	0	111.9
629	C	68.4	Low	82.5	Confident	43 Å²	43	82 Å²	82	29%	0.291	42%	0.42	S	S	.	.			trans	-56.8	-54.5	-175.2	47	0	0	0	0	114.3	C623 E627	C623-C629 HydrophobicContact CB-CB 3.57Å; C623-C629 WeakPolarHBondContact CB-SG 3.29Å; C623-C629 PolarHBondContact N-SG 3.03Å; C623-C629 WeakPolarHBondContact SG-CB 3.35Å; C623-C629 CovalentContact SG-SG 2.03Å; C623-C629 PolarHBondContact SG-SG 3.14Å; E627-C629 PolarHBondContact O-N 3.12Å
630	L	73.1	Confident	82.6	Confident	18 Å²	18	82 Å²	82	9%	0.094	42%	0.419	C	S	.	.			trans	-128.2	113	-164.8	-69.8	177.1	0	0	0	111.7	P250 E281 L621 L632	P250-L630 HydrophobicContact CB-CD1 4.19Å; P250-L630 HydrophobicContact CB-CD2 3.8Å; P250-L630 HydrophobicContact CG-CD2 3.56Å; E281-L630 HydrophobicContact CB-CD1 4.19Å; E281-L630 WeakPolarHBondContact OE2-CG 3.07Å; L621-L630 HydrophobicContact CB-CB 4.45Å; L621-L630 HydrophobicContact CD1-CB 3.74Å; L621-L630 HydrophobicContact CD1-CD1 3.71Å; L621-L630 HydrophobicContact CD1-CG 4.38Å; L630-L632 PolarHBondContact O-N 3.1Å
631	S	79.8	Confident	82.7	Confident	125 Å²	125	79.2 Å²	79.2	87%	0.874	40%	0.4	S	S	*	.			trans	-90.5	97.9	172.7	-171.7	0	0	0	0	110.1
632	L	86.8	Confident	82.8	Confident	22 Å²	22	81.5 Å²	81.5	12%	0.115	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-79.3	143.4	175.6	-57	-172.6	0	0	0	110.6	P250 L276 T619 L621 L630	P250-L632 HydrophobicContact CB-CD2 4.47Å; L276-L632 HydrophobicContact CD1-CD1 3.72Å; T619-L632 HydrophobicContact CG2-CD1 3.74Å; L621-L632 HydrophobicContact CD1-CD1 3.81Å; L621-L632 HydrophobicContact CD1-CD2 4.15Å; L621-L632 HydrophobicContact CD1-CG 4.01Å; L621-L632 HydrophobicContact CD2-CD1 4.32Å; L621-L632 HydrophobicContact CG-CD1 3.97Å; L621-L632 HydrophobicContact CG-CG 4.32Å; L630-L632 PolarHBondContact O-N 3.1Å
633	K	88.1	Confident	82.7	Confident	187 Å²	187	83.5 Å²	83.5	81%	0.813	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-73.5	132	170.6	-67.2	-170.2	178.4	-173	0	109.9	L635	K633-L635 PolarHBondContact O-N 2.91Å
634	Q	92.7	Very high	82.5	Confident	93 Å²	93	83.3 Å²	83.3	44%	0.435	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-54.6	134.4	164.6	177.6	168.6	11.8	0	0	109.7	T618 E636	T618-Q634 HydrophobicContact CG2-CB 4.39Å; T618-Q634 HydrophobicContact CG2-CG 3.81Å; Q634-E636 HydrophobicContact CG-CG 4.38Å
635	L	94.8	Very high	82.4	Confident	31 Å²	31	80.2 Å²	80.2	16%	0.162	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	133.7	175.1	-63.4	178.6	0	0	0	109.6	W252 W255 K616 L617 K633	W252-L635 HydrophobicContact CB-CD1 3.41Å; W252-L635 VanDerWaalsContact CB-CD1 3.41Å; W252-L635 HydrophobicContact CB-CG 4.45Å; W252-L635 HydrophobicContact CG-CD1 3.73Å; W255-L635 HydrophobicContact CB-CD1 4.05Å; W255-L635 HydrophobicContact CD2-CB 3.96Å; W255-L635 HydrophobicContact CD2-CD1 3.7Å; W255-L635 HydrophobicContact CD2-CG 4.34Å; W255-L635 HydrophobicContact CE3-CB 4.15Å; W255-L635 HydrophobicContact CE3-CD1 3.6Å; W255-L635 HydrophobicContact CG-CD1 3.91Å; W255-L635 HydrophobicContact CG-CD2 4.41Å; W255-L635 HydrophobicContact CH2-CB 4.03Å; W255-L635 HydrophobicContact CZ2-CB 3.87Å; W255-L635 HydrophobicContact CZ3-CB 4.15Å; W255-L635 HydrophobicContact CZ3-CD1 4.19Å; K616-L635 WeakPolarHBondContact CA-O 3.41Å; L617-L635 HydrophobicContact CB-CB 4.27Å; L617-L635 HydrophobicContact CD2-CD1 4.12Å; L617-L635 PolarHBondContact N-O 3Å; L617-L635 PolarHBondContact O-N 3.23Å; K633-L635 PolarHBondContact O-N 2.91Å
636	E	96.1	Very high	82.4	Confident	103 Å²	103	75.9 Å²	75.9	48%	0.481	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	135.5	177.5	-60.2	-164.7	133.4	0	0	110.2	W255 L615 K616 Q634	W255-E636 PolarHBondContact NE1-O 2.9Å; L615-E636 WeakPolarHBondContact O-CA 3.43Å; K616-E636 WeakPolarHBondContact CE-OE1 3.45Å; K616-E636 HydrophobicContact CG-CG 4.39Å; K616-E636 IonicContact NZ-OE1 3.23Å; K616-E636 PolarHBondContact NZ-OE1 2.84Å; Q634-E636 HydrophobicContact CG-CG 4.38Å
637	G	94.7	Very high	83.1	Confident	8 Å²	8	66.2 Å²	66.2	8%	0.082	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	-164.7	-178.7	0	0	0	0	0	110.5	K257 L615	K257-G637 CarbonylContact O-C 3.56Å; K257-G637 WeakPolarHBondContact O-CA 3.45Å; L615-G637 PolarHBondContact N-O 2.96Å; L615-G637 PolarHBondContact O-N 3.15Å
638	Y	94.8	Very high	84.3	Confident	78 Å²	78	63.4 Å²	63.4	31%	0.306	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	145.7	178.8	54.7	-89.4	0	0	0	112.4	K257 R258 V259 V612 R613 V640	K257-Y638 HydrophobicContact CG-CE1 4.46Å; K257-Y638 PolarHBondContact O-N 3.34Å; R258-Y638 WeakPolarHBondContact CA-O 3.29Å; R258-Y638 HydrophobicContact CB-CD2 4.39Å; R258-Y638 HydrophobicContact CB-CE2 3.73Å; R258-Y638 HydrophobicContact CG-CD2 4.28Å; R258-Y638 HydrophobicContact CG-CE2 3.57Å; V259-Y638 PolarHBondContact N-O 2.89Å; V612-Y638 HydrophobicContact CG1-CD2 3.9Å; V612-Y638 HydrophobicContact CG1-CG 3.93Å; R613-Y638 CarbonylContact O-C 3.52Å; R613-Y638 VanDerWaalsContact O-CA 3.27Å; R613-Y638 WeakPolarHBondContact O-CA 3.29Å; Y638-V640 HydrophobicContact CD2-CG2 3.7Å; Y638-V640 HydrophobicContact CE2-CG2 3.8Å
639	L	95.6	Very high	85.7	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	136.3	165.3	-177.2	72.2	0	0	0	108.9	V259 I268 L270 Y601 V612 R613 L615 V641	V259-L639 HydrophobicContact CB-CD1 3.7Å; V259-L639 HydrophobicContact CG1-CD1 3.62Å; V259-L639 CarbonylContact O-C 3.56Å; V259-L639 WeakPolarHBondContact O-CA 3.36Å; I268-L639 HydrophobicContact CD1-CD1 4.24Å; L270-L639 HydrophobicContact CD2-CD1 4.23Å; Y601-L639 HydrophobicContact CD1-CD2 3.62Å; Y601-L639 HydrophobicContact CD2-CD2 3.22Å; Y601-L639 HydrophobicContact CE1-CD2 3.65Å; Y601-L639 HydrophobicContact CE2-CD2 3.21Å; Y601-L639 HydrophobicContact CG-CD2 3.39Å; Y601-L639 VanDerWaalsContact CZ-CD2 3.43Å; V612-L639 CarbonylContact C-O 3.6Å; V612-L639 WeakPolarHBondContact CA-O 3.37Å; R613-L639 HydrophobicContact CB-CB 4.24Å; R613-L639 HydrophobicContact CG-CD2 4.46Å; R613-L639 PolarHBondContact N-O 3.06Å; R613-L639 PolarHBondContact O-N 3.16Å; L615-L639 HydrophobicContact CD1-CB 4.1Å; L615-L639 HydrophobicContact CG-CB 4.46Å; L639-V641 HydrophobicContact CD2-CG2 4.36Å
640	V	95.3	Very high	86.7	Confident	22 Å²	22	58.2 Å²	58.2	13%	0.133	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	109.3	170.5	-171.8	0	0	0	0	108.7	R258 V259 Y261 Y638 L642	R258-V640 HydrophobicContact CG-CG2 4.31Å; V259-V640 PolarHBondContact O-N 2.76Å; Y261-V640 PolarHBondContact N-O 3.39Å; Y638-V640 HydrophobicContact CD2-CG2 3.7Å; Y638-V640 HydrophobicContact CE2-CG2 3.8Å; V640-L642 HydrophobicContact CG1-CD2 4.17Å; V640-L642 PolarHBondContact O-N 2.99Å
641	V	92.8	Very high	87.6	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.012	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	110.9	167.5	179.7	0	0	0	0	107.1	Y261 Y601 A608 P610 G611 R613 L639	Y261-V641 HydrophobicContact CD1-CG1 4.32Å; Y601-V641 WeakPolarHBondContact OH-CG2 3.48Å; A608-V641 HydrophobicContact CB-CG1 3.92Å; P610-V641 WeakPolarHBondContact CA-O 3.36Å; G611-V641 PolarHBondContact N-O 3.36Å; G611-V641 PolarHBondContact O-N 2.79Å; R613-V641 HydrophobicContact CG-CG2 4.45Å; L639-V641 HydrophobicContact CD2-CG2 4.36Å
642	L	90.5	Very high	88.1	Confident	62 Å²	62	54.2 Å²	54.2	33%	0.325	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-68.9	157.7	178.6	-60.1	178.8	0	0	0	110.7	Y261 P263 V640	Y261-L642 WeakPolarHBondContact O-CB 3.48Å; Y261-L642 WeakPolarHBondContact O-CG 3.32Å; Y261-L642 PolarHBondContact O-N 3.34Å; P263-L642 VanDerWaalsContact CG-O 3.24Å; P263-L642 WeakPolarHBondContact CG-O 3.47Å; V640-L642 HydrophobicContact CG1-CD2 4.17Å; V640-L642 PolarHBondContact O-N 2.99Å
643	Q	84.4	Confident	87.9	Confident	164 Å²	164	55 Å²	55	77%	0.766	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-67.2	126.4	178	-173.8	169.8	-9.9	0	0	110.5	P610	P610-Q643 HydrophobicContact CB-CB 4.43Å
644	P	79.2	Confident	86.9	Confident	10 Å²	10	48.9 Å²	48.9	7%	0.065	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-69.7	149.2	175.6	28.4	-34.8	0	0	0	111.3	P263 F607 A646	P263-P644 HydrophobicContact CB-CB 3.88Å; P263-P644 HydrophobicContact CG-CB 3.9Å; F607-P644 HydrophobicContact CB-CG 4.44Å; F607-P644 HydrophobicContact CD1-CB 4.28Å; P644-A646 PolarHBondContact O-N 3.06Å
645	D	75.6	Confident	85.6	Confident	82 Å²	82	46.5 Å²	46.5	44%	0.439	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-53.9	130.3	168.6	-79.6	-23.7	0	0	0	109.9	H685	D645-H685 IonicContact OD2-CE1 3.66Å; D645-H685 PolarHBondContact OD2-CE1 2.96Å; D645-H685 IonicContact OD2-ND1 2.84Å; D645-H685 PolarHBondContact OD2-ND1 3.04Å; D645-H685 VanDerWaalsContact OD2-ND1 3.13Å
646	A	71.3	Confident	84.7	Confident	45 Å²	45	48.8 Å²	48.8	37%	0.372	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-73	127.5	-177	0	0	0	0	0	111.2	P644 Q648 Y792	P644-A646 PolarHBondContact O-N 3.06Å; A646-Q648 PolarHBondContact O-N 2.93Å; A646-Y792 HydrophobicContact CB-CE1 4.36Å
647	P	75.1	Confident	84.1	Confident	6 Å²	6	49.2 Å²	49.2	4%	0.039	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	128.6	167.5	29.8	-31.4	0	0	0	109.7	F607 L683 Y792	F607-P647 HydrophobicContact CD1-CG 4.27Å; F607-P647 HydrophobicContact CE1-CB 4.06Å; F607-P647 HydrophobicContact CE1-CG 3.74Å; F607-P647 HydrophobicContact CE2-CG 4.4Å; F607-P647 HydrophobicContact CZ-CB 3.87Å; F607-P647 HydrophobicContact CZ-CG 3.8Å; P647-L683 HydrophobicContact CB-CD2 4.35Å; P647-Y792 HydrophobicContact CG-CD1 3.74Å; P647-Y792 HydrophobicContact CG-CD2 3.92Å; P647-Y792 HydrophobicContact CG-CE1 4.12Å; P647-Y792 HydrophobicContact CG-CE2 4.26Å; P647-Y792 HydrophobicContact CG-CG 3.62Å
648	Q	82.3	Confident	83.7	Confident	115 Å²	115	50 Å²	50	54%	0.537	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	101.9	173.7	-64.4	-170.8	-1.4	0	0	109	A646 S650 C681 S682	A646-Q648 PolarHBondContact O-N 2.93Å; Q648-S650 PolarHBondContact O-N 2.79Å; Q648-C681 WeakPolarHBondContact O-CA 3.31Å; Q648-S682 PolarHBondContact N-O 3.23Å; Q648-S682 PolarHBondContact O-N 3.32Å
649	I	87.7	Confident	83.4	Confident	6 Å²	6	48.9 Å²	48.9	3%	0.031	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	115.4	171.7	-51.2	167.6	0	0	0	107.6	I679 C681 L708 E787 S794 N795	I649-I679 HydrophobicContact CG2-CG2 3.91Å; I649-C681 HydrophobicContact CG1-CB 4.5Å; I649-L708 HydrophobicContact CD1-CD2 4.04Å; I649-L708 HydrophobicContact CG2-CD2 4.2Å; I649-E787 HydrophobicContact CD1-CB 3.83Å; I649-S794 WeakPolarHBondContact O-CA 3.34Å; I649-S794 WeakPolarHBondContact O-CB 3.37Å; I649-N795 PolarHBondContact O-N 3.06Å
650	S	89.8	Confident	83	Confident	44 Å²	44	54.2 Å²	54.2	31%	0.308	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123.7	177.7	67.3	0	0	0	0	111.9	Q648 I679 V680 N795	Q648-S650 PolarHBondContact O-N 2.79Å; S650-I679 WeakPolarHBondContact O-CA 3.4Å; S650-V680 WeakPolarHBondContact CA-O 3.43Å; S650-V680 WeakPolarHBondContact CB-O 3.22Å; S650-V680 PolarHBondContact N-O 2.92Å; S650-V680 PolarHBondContact O-N 2.88Å; S650-V680 PolarHBondContact OG-O 2.79Å; S650-N795 VanDerWaalsContact CA-OD1 3.29Å; S650-N795 WeakPolarHBondContact CA-OD1 3.25Å
651	L	91.8	Very high	82.7	Confident	9 Å²	9	55.7 Å²	55.7	5%	0.047	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	127.5	170.6	-57.9	-174.8	0	0	0	109.7	I679 L783 C785 S794 N795 L797	L651-I679 HydrophobicContact CD2-CB 4.3Å; L651-I679 HydrophobicContact CD2-CD1 4.03Å; L651-I679 HydrophobicContact CD2-CG1 3.67Å; L651-I679 HydrophobicContact CD2-CG2 3.98Å; L651-L783 HydrophobicContact CD1-CB 4.43Å; L651-L783 HydrophobicContact CD1-CD2 4.1Å; L651-L783 HydrophobicContact CD1-CG 3.79Å; L651-L783 WeakPolarHBondContact CD1-O 3.47Å; L651-C785 HydrophobicContact CD2-CB 4.36Å; L651-S794 VanDerWaalsContact CD1-OG 3.3Å; L651-S794 WeakPolarHBondContact CD1-OG 3.47Å; L651-S794 WeakPolarHBondContact CG-OG 3.31Å; L651-N795 WeakPolarHBondContact CD1-O 3.21Å; L651-N795 PolarHBondContact N-OD1 2.94Å; L651-N795 PolarHBondContact O-ND2 3.21Å; L651-L797 HydrophobicContact CB-CB 3.92Å; L651-L797 HydrophobicContact CB-CD2 4.42Å; L651-L797 HydrophobicContact CD1-CB 3.99Å
652	S	89.9	Confident	82.4	Confident	50 Å²	50	55.7 Å²	55.7	35%	0.35	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	160.8	176.9	62.5	0	0	0	0	110.6	L677 R678	S652-L677 CarbonylContact O-C 3.48Å; S652-L677 WeakPolarHBondContact O-CA 3.49Å; S652-R678 PolarHBondContact N-O 2.86Å; S652-R678 PolarHBondContact O-N 2.89Å; S652-R678 PolarHBondContact OG-O 3.14Å
653	G	84	Confident	82.2	Confident	38 Å²	38	56.9 Å²	56.9	39%	0.392	34%	0.338	S	S	.	.			trans	172.5	-155.9	179.1	0	0	0	0	0	112.3	E676	G653-E676 WeakPolarHBondContact CA-O 3.39Å
654	V	66.7	Low	82.4	Confident	59 Å²	59	52.7 Å²	52.7	36%	0.358	32%	0.318	S	S	.	.	S	Bend	trans	-53.1	144	173.8	-159.2	0	0	0	0	109.9	P675 E676	V654-P675 HydrophobicContact CG2-CG 4.22Å; V654-E676 HydrophobicContact CG2-CB 3.72Å; V654-E676 HydrophobicContact CG2-CG 3.85Å
655	G	64.6	Low	82.9	Confident	42 Å²	42	52.2 Å²	52.2	43%	0.433	32%	0.315	S	S	.	.			trans	-56.3	161.9	179.1	0	0	0	0	0	113.5	H657	G655-H657 PolarHBondContact O-N 3.24Å
656	P	76.3	Confident	83.5	Confident	80 Å²	80	50.8 Å²	50.8	52%	0.519	31%	0.306	S	S	.	.	S	Bend	trans	-64.2	-1.4	-160.6	22.6	-33.9	0	0	0	116.9	E800	P656-E800 WeakPolarHBondContact O-CB 3.45Å; P656-E800 PolarHBondContact O-N 3.33Å
657	H	82.9	Confident	84.2	Confident	111 Å²	111	49.5 Å²	49.5	51%	0.514	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	117.4	179.9	-49.9	-88	0	0	0	111.5	G655 E800	G655-H657 PolarHBondContact O-N 3.24Å; H657-E800 CarbonylContact C-O 3.56Å; H657-E800 WeakPolarHBondContact CA-O 3.49Å; H657-E800 IonicContact CE1-OE1 3.69Å; H657-E800 PolarHBondContact CE1-OE1 3.38Å; H657-E800 IonicContact CE1-OE2 3.77Å; H657-E800 IonicContact CG-OE1 3.78Å; H657-E800 VanDerWaalsContact ND1-CD 3.26Å; H657-E800 IonicContact ND1-OE1 3.16Å; H657-E800 PolarHBondContact ND1-OE1 3.18Å; H657-E800 IonicContact ND1-OE2 2.69Å
658	L	87.8	Confident	84.5	Confident	26 Å²	26	54.7 Å²	54.7	14%	0.136	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	96.4	171.4	173.6	60.9	0	0	0	109.6	R660 V671 L799 E800 V801 N802	L658-R660 HydrophobicContact CD1-CG 4.02Å; L658-V671 HydrophobicContact CD2-CG1 4.22Å; L658-L799 HydrophobicContact CB-CD1 3.97Å; L658-L799 HydrophobicContact CB-CG 4.49Å; L658-L799 HydrophobicContact CD2-CD2 4.36Å; L658-E800 PolarHBondContact N-O 3.43Å; L658-V801 WeakPolarHBondContact O-CA 3.44Å; L658-N802 PolarHBondContact O-N 2.89Å
659	A	87.1	Confident	84.7	Confident	53 Å²	53	58.9 Å²	58.9	44%	0.438	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.3	173.8	0	0	0	0	0	111	N802 L804	A659-N802 WeakPolarHBondContact CA-O 3.47Å; A659-N802 HydrophobicContact CB-CB 4.4Å; A659-L804 HydrophobicContact CB-CD1 4.25Å; A659-L804 HydrophobicContact CB-CG 4.44Å
660	R	88.9	Confident	84.8	Confident	113 Å²	113	59.1 Å²	59.1	43%	0.426	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	154.7	176	-72.4	-60.5	-174.8	122.5	-8.1	112	L658 A662 E664 F665 V671 N802 L804	L658-R660 HydrophobicContact CD1-CG 4.02Å; R660-A662 PolarHBondContact O-N 3.04Å; R660-E664 WeakPolarHBondContact CD-OE2 3.33Å; R660-E664 IonicContact CZ-OE2 3.64Å; R660-E664 IonicContact NE-OE2 3.78Å; R660-E664 IonicContact NH1-OE1 2.68Å; R660-E664 IonicContact NH1-OE2 3.26Å; R660-E664 PolarHBondContact NH1-OE2 3.03Å; R660-F665 HydrophobicContact CB-CD2 4.48Å; R660-F665 HydrophobicContact CB-CE2 3.53Å; R660-F665 HydrophobicContact CB-CZ 3.83Å; R660-F665 HydrophobicContact CG-CZ 4.46Å; R660-V671 HydrophobicContact CG-CG1 4.42Å; R660-N802 PolarHBondContact N-O 3.36Å; R660-N802 VanDerWaalsContact N-O 3.13Å; R660-L804 PolarHBondContact O-N 2.76Å
661	P	88.1	Confident	84.9	Confident	52 Å²	52	57.4 Å²	57.4	34%	0.338	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.8	132.4	171.1	-24.9	34.2	0	0	0	112	P663 E664 L804	P661-P663 VanDerWaalsContact C-CD 3.4Å; P661-P663 VanDerWaalsContact C-N 3.27Å; P661-E664 HydrophobicContact CB-CG 4.37Å; P661-E664 WeakPolarHBondContact CD-OE1 3.31Å; P661-E664 WeakPolarHBondContact O-CB 3.21Å; P661-E664 PolarHBondContact O-N 3.3Å; P661-L804 WeakPolarHBondContact CA-O 3.5Å
662	A	85.8	Confident	84.9	Confident	3 Å²	3	58.6 Å²	58.6	3%	0.025	34%	0.342	C	S	.	.	H	α-helix	trans	-51.8	-39.2	177.7	0	0	0	0	0	113.6	R660 E664 F665 E666 F803 L804 H805	R660-A662 PolarHBondContact O-N 3.04Å; A662-E664 PolarHBondContact O-N 2.78Å; A662-E664 VanDerWaalsContact O-N 3.15Å; A662-F665 PolarHBondContact O-N 3.06Å; A662-E666 PolarHBondContact O-N 3.18Å; A662-E666 VanDerWaalsContact O-N 3.16Å; A662-F803 HydrophobicContact CB-CB 4.36Å; A662-L804 PolarHBondContact N-O 3.28Å; A662-H805 VanDerWaalsContact CB-CE1 3.48Å; A662-H805 WeakPolarHBondContact CB-CE1 3.38Å; A662-H805 WeakPolarHBondContact CB-ND1 3.39Å
663	P	87	Confident	85	Confident	87 Å²	87	56.4 Å²	56.4	57%	0.565	33%	0.326	S	S	*	.	H	α-helix	trans	-62	-17.9	175.6	-26.3	37	0	0	0	116.3	P661 G667	P661-P663 VanDerWaalsContact C-CD 3.4Å; P661-P663 VanDerWaalsContact C-N 3.27Å; P663-G667 PolarHBondContact O-N 3.17Å
664	E	88.5	Confident	85.3	Confident	76 Å²	76	55 Å²	55	36%	0.355	31%	0.309	S	S	.	.	H	α-helix	trans	-70.2	-38.2	172.4	-70.5	-176.8	-154.6	0	0	110.9	R660 P661 A662 G667 V671	R660-E664 WeakPolarHBondContact CD-OE2 3.33Å; R660-E664 IonicContact CZ-OE2 3.64Å; R660-E664 IonicContact NE-OE2 3.78Å; R660-E664 IonicContact NH1-OE1 2.68Å; R660-E664 IonicContact NH1-OE2 3.26Å; R660-E664 PolarHBondContact NH1-OE2 3.03Å; P661-E664 HydrophobicContact CB-CG 4.37Å; P661-E664 WeakPolarHBondContact CD-OE1 3.31Å; P661-E664 WeakPolarHBondContact O-CB 3.21Å; P661-E664 PolarHBondContact O-N 3.3Å; A662-E664 PolarHBondContact O-N 2.78Å; A662-E664 VanDerWaalsContact O-N 3.15Å; E664-G667 PolarHBondContact O-N 2.72Å; E664-V671 HydrophobicContact CB-CG2 3.82Å
665	F	89.9	Confident	86.4	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-76.9	-29.2	176.2	-59	-85.2	0	0	0	113	R660 A662 G667 V671 Y768 R769 L770 V801 F803	R660-F665 HydrophobicContact CB-CD2 4.48Å; R660-F665 HydrophobicContact CB-CE2 3.53Å; R660-F665 HydrophobicContact CB-CZ 3.83Å; R660-F665 HydrophobicContact CG-CZ 4.46Å; A662-F665 PolarHBondContact O-N 3.06Å; F665-G667 PolarHBondContact O-N 3.25Å; F665-V671 HydrophobicContact CD1-CB 3.65Å; F665-V671 HydrophobicContact CD1-CG2 3.49Å; F665-V671 VanDerWaalsContact CD1-CG2 3.49Å; F665-V671 HydrophobicContact CD2-CG2 4.26Å; F665-V671 HydrophobicContact CE1-CB 3.49Å; F665-V671 VanDerWaalsContact CE1-CB 3.49Å; F665-V671 HydrophobicContact CE1-CG1 3.98Å; F665-V671 HydrophobicContact CE1-CG2 3.62Å; F665-V671 HydrophobicContact CE2-CG2 4.39Å; F665-V671 HydrophobicContact CG-CG2 3.85Å; F665-V671 HydrophobicContact CZ-CB 4.23Å; F665-V671 HydrophobicContact CZ-CG1 4.35Å; F665-V671 HydrophobicContact CZ-CG2 4.09Å; F665-Y768 AromaticContact CD1-CD1 3.74Å; F665-Y768 HydrophobicContact CD1-CD1 3.74Å; F665-Y768 HydrophobicContact CD1-CE1 4.4Å; F665-Y768 HydrophobicContact CE1-CD1 4.1Å; F665-R769 WeakPolarHBondContact O-CA 3.02Å; F665-R769 WeakPolarHBondContact O-CG 3.41Å; F665-L770 HydrophobicContact CB-CB 4.05Å; F665-L770 HydrophobicContact CB-CD1 3.97Å; F665-L770 HydrophobicContact CB-CG 4.03Å; F665-L770 PolarHBondContact O-N 3.36Å; F665-V801 HydrophobicContact CE1-CG1 3.49Å; F665-V801 VanDerWaalsContact CE1-CG1 3.49Å; F665-V801 HydrophobicContact CE2-CG1 4.36Å; F665-V801 HydrophobicContact CZ-CG1 3.34Å; F665-F803 AromaticContact CD1-CE1 3.97Å; F665-F803 HydrophobicContact CD1-CE1 3.97Å; F665-F803 AromaticContact CD2-CD1 3.48Å; F665-F803 HydrophobicContact CD2-CD1 3.48Å; F665-F803 VanDerWaalsContact CD2-CD1 3.48Å; F665-F803 AromaticContact CD2-CE1 3.78Å; F665-F803 HydrophobicContact CD2-CE1 3.78Å; F665-F803 HydrophobicContact CE1-CD1 4.47Å; F665-F803 AromaticContact CE1-CE1 3.89Å; F665-F803 HydrophobicContact CE1-CE1 3.89Å; F665-F803 AromaticContact CE2-CD1 3.42Å; F665-F803 HydrophobicContact CE2-CD1 3.42Å; F665-F803 VanDerWaalsContact CE2-CD1 3.42Å; F665-F803 AromaticContact CE2-CE1 3.68Å; F665-F803 HydrophobicContact CE2-CE1 3.68Å; F665-F803 HydrophobicContact CG-CD1 4.02Å; F665-F803 AromaticContact CG-CE1 3.89Å; F665-F803 HydrophobicContact CG-CE1 3.89Å; F665-F803 AromaticContact CZ-CD1 3.96Å; F665-F803 HydrophobicContact CZ-CD1 3.96Å; F665-F803 AromaticContact CZ-CE1 3.74Å; F665-F803 HydrophobicContact CZ-CE1 3.74Å
666	E	88.4	Confident	87.6	Confident	51 Å²	51	59.3 Å²	59.3	24%	0.238	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-4.1	170.9	-61.5	-173.3	160.4	0	0	113.2	A662 R772 G773	A662-E666 PolarHBondContact O-N 3.18Å; A662-E666 VanDerWaalsContact O-N 3.16Å; E666-R772 HydrophobicContact CB-CG 4.06Å; E666-R772 HydrophobicContact CG-CG 4.3Å; E666-R772 WeakPolarHBondContact OE1-CA 3.45Å; E666-G773 PolarHBondContact OE1-N 2.78Å
667	G	84.9	Confident	88.3	Confident	19 Å²	19	55.6 Å²	55.6	20%	0.196	30%	0.295	C	S	.	.	S	Bend	trans	-72.9	148.6	175.6	0	0	0	0	0	112.5	P663 E664 F665 R669 G670	P663-G667 PolarHBondContact O-N 3.17Å; E664-G667 PolarHBondContact O-N 2.72Å; F665-G667 PolarHBondContact O-N 3.25Å; G667-R669 PolarHBondContact O-N 3.07Å; G667-G670 PolarHBondContact O-N 2.78Å
668	P	82.6	Confident	88.7	Confident	114 Å²	114	57.6 Å²	57.6	74%	0.74	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-3.4	-176	28.5	-36.9	0	0	0	114.9
669	R	85	Confident	88.9	Confident	203 Å²	203	56.7 Å²	56.7	77%	0.766	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-4	177.1	-66.7	-173.4	-69.7	-175.6	-2.7	113.8	G667 R767	G667-R669 PolarHBondContact O-N 3.07Å; R669-R767 WeakPolarHBondContact O-CD 3.46Å; R669-R767 PolarHBondContact O-NH1 2.9Å
670	G	89.8	Confident	88.9	Confident	11 Å²	11	56.6 Å²	56.6	11%	0.113	29%	0.287	C	S	.	.			trans	53.4	-170.3	-172.4	0	0	0	0	0	114.5	G667 Y768	G667-G670 PolarHBondContact O-N 2.78Å; G670-Y768 VanDerWaalsContact CA-O 3.22Å; G670-Y768 WeakPolarHBondContact CA-O 3.36Å
671	V	92.2	Very high	88.5	Confident	9 Å²	9	52.1 Å²	52.1	6%	0.055	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	132	175.4	179.9	0	0	0	0	108.7	L658 R660 E664 F665 R767 Y768	L658-V671 HydrophobicContact CD2-CG1 4.22Å; R660-V671 HydrophobicContact CG-CG1 4.42Å; E664-V671 HydrophobicContact CB-CG2 3.82Å; F665-V671 HydrophobicContact CD1-CB 3.65Å; F665-V671 HydrophobicContact CD1-CG2 3.49Å; F665-V671 VanDerWaalsContact CD1-CG2 3.49Å; F665-V671 HydrophobicContact CD2-CG2 4.26Å; F665-V671 HydrophobicContact CE1-CB 3.49Å; F665-V671 VanDerWaalsContact CE1-CB 3.49Å; F665-V671 HydrophobicContact CE1-CG1 3.98Å; F665-V671 HydrophobicContact CE1-CG2 3.62Å; F665-V671 HydrophobicContact CE2-CG2 4.39Å; F665-V671 HydrophobicContact CG-CG2 3.85Å; F665-V671 HydrophobicContact CZ-CB 4.23Å; F665-V671 HydrophobicContact CZ-CG1 4.35Å; F665-V671 HydrophobicContact CZ-CG2 4.09Å; V671-R767 CarbonylContact O-C 3.57Å; V671-R767 VanDerWaalsContact O-CA 3.28Å; V671-R767 WeakPolarHBondContact O-CA 3.28Å; V671-Y768 PolarHBondContact N-O 2.95Å; V671-Y768 PolarHBondContact O-N 2.87Å
672	P	92	Very high	88.1	Confident	34 Å²	34	52.3 Å²	52.3	22%	0.221	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	134.7	175.8	28.9	-34.3	0	0	0	110.6	P675 V766 R767	P672-P675 HydrophobicContact CB-CB 4.39Å; P672-P675 HydrophobicContact CG-CB 4.26Å; P672-V766 WeakPolarHBondContact CA-O 3.18Å; P672-R767 HydrophobicContact CB-CG 4.2Å
673	L	91.4	Very high	87.3	Confident	3 Å²	3	54.2 Å²	54.2	2%	0.016	29%	0.285	C	S	.	.	S	Bend	trans	-77.8	-48	-177.9	-69.6	-177.1	0	0	0	112.2	P675 V713 L727 V766 F781 L799 V801	L673-P675 WeakPolarHBondContact O-CD 3.48Å; L673-V713 HydrophobicContact CD1-CG1 4.44Å; L673-L727 HydrophobicContact CD1-CD2 3.68Å; L673-V766 HydrophobicContact CD1-CG1 4.44Å; L673-V766 PolarHBondContact N-O 3.31Å; L673-F781 HydrophobicContact CD1-CB 4.46Å; L673-F781 HydrophobicContact CD1-CD1 4.2Å; L673-F781 HydrophobicContact CD1-CD2 3.94Å; L673-F781 HydrophobicContact CD1-CE1 4.5Å; L673-F781 HydrophobicContact CD1-CE2 4.25Å; L673-F781 HydrophobicContact CD1-CG 3.93Å; L673-F781 HydrophobicContact CD2-CD2 4.06Å; L673-F781 HydrophobicContact CD2-CE2 4.14Å; L673-L799 HydrophobicContact CB-CD2 3.98Å; L673-L799 HydrophobicContact CD2-CD2 4.1Å; L673-L799 WeakPolarHBondContact O-CD2 3.4Å; L673-V801 HydrophobicContact CD2-CG2 3.83Å
674	F	92.1	Very high	86	Confident	8 Å²	8	52.4 Å²	52.4	4%	0.035	27%	0.274	C	S	.	.			trans	-119.3	52.4	-171.2	-46.7	-77.6	0	0	0	113.2	E676 L677 V713 R764 F781 L783 L797 L799	F674-E676 VanDerWaalsContact C-N 3.26Å; F674-E676 PolarHBondContact O-N 2.98Å; F674-L677 HydrophobicContact CB-CB 3.98Å; F674-L677 WeakPolarHBondContact O-CB 3.35Å; F674-L677 PolarHBondContact O-N 2.85Å; F674-V713 HydrophobicContact CE2-CG1 3.99Å; F674-V713 HydrophobicContact CE2-CG2 3.9Å; F674-V713 HydrophobicContact CZ-CG1 4.43Å; F674-R764 WeakPolarHBondContact O-CG 3.43Å; F674-F781 HydrophobicContact CZ-CB 4.47Å; F674-L783 HydrophobicContact CD1-CD2 4.46Å; F674-L783 HydrophobicContact CD2-CD2 4.41Å; F674-L783 HydrophobicContact CE1-CB 4.08Å; F674-L783 HydrophobicContact CE2-CB 4.26Å; F674-L783 HydrophobicContact CG-CD2 4.38Å; F674-L783 HydrophobicContact CZ-CB 3.81Å; F674-L797 HydrophobicContact CD1-CD2 4.14Å; F674-L797 HydrophobicContact CE1-CD2 4.47Å; F674-L799 HydrophobicContact CD1-CD2 4.23Å; F674-L799 HydrophobicContact CE1-CB 3.95Å; F674-L799 HydrophobicContact CE1-CD2 4.01Å
675	P	88.8	Confident	84.3	Confident	60 Å²	60	55.2 Å²	55.2	39%	0.39	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-25.8	-170.2	28.3	-36.5	0	0	0	114.2	V654 P672 L673	V654-P675 HydrophobicContact CG2-CG 4.22Å; P672-P675 HydrophobicContact CB-CB 4.39Å; P672-P675 HydrophobicContact CG-CB 4.26Å; L673-P675 WeakPolarHBondContact O-CD 3.48Å
676	E	89.1	Confident	81.7	Confident	133 Å²	133	59.8 Å²	59.8	62%	0.621	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	22.4	176.5	-54.7	-178.2	169.7	0	0	112	G653 V654 F674 R678	G653-E676 WeakPolarHBondContact CA-O 3.39Å; V654-E676 HydrophobicContact CG2-CB 3.72Å; V654-E676 HydrophobicContact CG2-CG 3.85Å; F674-E676 VanDerWaalsContact C-N 3.26Å; F674-E676 PolarHBondContact O-N 2.98Å; E676-R678 PolarHBondContact O-N 3.4Å
677	L	91.9	Very high	79.2	Confident	1 Å²	1	62 Å²	62	1%	0.005	34%	0.342	C	S	.	.			trans	-52.8	132.5	175.3	-176.2	67.4	0	0	0	109.9	S652 F674 I679 L763 R764 L783 L797	S652-L677 CarbonylContact O-C 3.48Å; S652-L677 WeakPolarHBondContact O-CA 3.49Å; F674-L677 HydrophobicContact CB-CB 3.98Å; F674-L677 WeakPolarHBondContact O-CB 3.35Å; F674-L677 PolarHBondContact O-N 2.85Å; L677-I679 HydrophobicContact CD2-CD1 4.23Å; L677-I679 HydrophobicContact CD2-CG1 4.25Å; L677-I679 HydrophobicContact CG-CG1 4.2Å; L677-L763 HydrophobicContact CD2-CB 3.44Å; L677-L763 VanDerWaalsContact CD2-CB 3.44Å; L677-L763 HydrophobicContact CD2-CD1 3.66Å; L677-L763 HydrophobicContact CD2-CG 4.21Å; L677-R764 HydrophobicContact CB-CG 4.23Å; L677-R764 VanDerWaalsContact O-CZ 3.29Å; L677-R764 PolarHBondContact O-NE 2.78Å; L677-R764 VanDerWaalsContact O-NE 3.07Å; L677-R764 PolarHBondContact O-NH2 2.83Å; L677-L783 HydrophobicContact CD1-CD2 3.63Å; L677-L783 HydrophobicContact CD2-CD2 3.79Å; L677-L783 HydrophobicContact CG-CD2 4.39Å; L677-L797 HydrophobicContact CD1-CD2 3.66Å
678	R	91.8	Very high	76.8	Confident	154 Å²	154	68.5 Å²	68.5	58%	0.581	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.9	126.1	169.6	-174.4	-174.8	-178.6	-154.8	-1.5	109.7	S652 E676 V680 E760	S652-R678 PolarHBondContact N-O 2.86Å; S652-R678 PolarHBondContact O-N 2.89Å; S652-R678 PolarHBondContact OG-O 3.14Å; E676-R678 PolarHBondContact O-N 3.4Å; R678-V680 HydrophobicContact CG-CG2 4.22Å; R678-E760 VanDerWaalsContact CA-OE1 3.25Å; R678-E760 WeakPolarHBondContact CA-OE1 3.41Å
679	I	90.9	Very high	74.5	Confident	7 Å²	7	69.1 Å²	69.1	4%	0.036	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	127.1	179	-49	178.1	0	0	0	108.2	I649 S650 L651 L677 L708 I756 E760 L763	I649-I679 HydrophobicContact CG2-CG2 3.91Å; S650-I679 WeakPolarHBondContact O-CA 3.4Å; L651-I679 HydrophobicContact CD2-CB 4.3Å; L651-I679 HydrophobicContact CD2-CD1 4.03Å; L651-I679 HydrophobicContact CD2-CG1 3.67Å; L651-I679 HydrophobicContact CD2-CG2 3.98Å; L677-I679 HydrophobicContact CD2-CD1 4.23Å; L677-I679 HydrophobicContact CD2-CG1 4.25Å; L677-I679 HydrophobicContact CG-CG1 4.2Å; I679-L708 HydrophobicContact CD1-CD1 3.77Å; I679-L708 HydrophobicContact CG2-CD1 4.27Å; I679-I756 HydrophobicContact CB-CG2 3.85Å; I679-I756 HydrophobicContact CG2-CD1 4.4Å; I679-I756 HydrophobicContact CG2-CG2 4.31Å; I679-E760 HydrophobicContact CB-CG 4.34Å; I679-E760 HydrophobicContact CD1-CG 4.18Å; I679-E760 HydrophobicContact CG1-CG 3.98Å; I679-E760 PolarHBondContact N-OE1 3.36Å; I679-L763 HydrophobicContact CD1-CD1 4.26Å
680	V	87.2	Confident	72.1	Confident	51 Å²	51	64.1 Å²	64.1	31%	0.309	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	116.2	176	-179.4	0	0	0	0	108.1	S650 R678	S650-V680 WeakPolarHBondContact CA-O 3.43Å; S650-V680 WeakPolarHBondContact CB-O 3.22Å; S650-V680 PolarHBondContact N-O 2.92Å; S650-V680 PolarHBondContact O-N 2.88Å; S650-V680 PolarHBondContact OG-O 2.79Å; R678-V680 HydrophobicContact CG-CG2 4.22Å
681	C	82.1	Confident	69.6	Low	19 Å²	19	67.5 Å²	67.5	13%	0.128	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	139.6	168.4	-160.4	0	0	0	0	109.7	Q648 I649 H706 I756	Q648-C681 WeakPolarHBondContact O-CA 3.31Å; I649-C681 HydrophobicContact CG1-CB 4.5Å; C681-H706 HydrophobicContact CB-CB 4.13Å; C681-H706 PolarHBondContact SG-CE1 2.98Å; C681-H706 PolarHBondContact SG-ND1 3Å; C681-I756 HydrophobicContact CB-CD1 4.24Å
682	S	77.8	Confident	67	Low	55 Å²	55	76 Å²	76	39%	0.385	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	151.2	-179.5	62.6	0	0	0	0	111.7	Q648	Q648-S682 PolarHBondContact N-O 3.23Å; Q648-S682 PolarHBondContact O-N 3.32Å
683	L	70.4	Confident	64.3	Low	44 Å²	44	78.4 Å²	78.4	23%	0.23	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	129.2	178.6	-68.1	164.9	0	0	0	109.8	R606 F607 P647 H685	R606-L683 VanDerWaalsContact NH2-CD1 3.29Å; F607-L683 HydrophobicContact CE1-CD2 3.74Å; F607-L683 HydrophobicContact CZ-CD2 3.94Å; P647-L683 HydrophobicContact CB-CD2 4.35Å; L683-H685 VanDerWaalsContact C-N 3.29Å; L683-H685 PolarHBondContact O-N 3.19Å
684	S	59.1	Low	61.3	Low	48 Å²	48	86.5 Å²	86.5	34%	0.336	51%	0.513	S	S	.	.			trans	-80.5	67.9	-176.3	61.2	0	0	0	0	112.8	A686	S684-A686 PolarHBondContact O-N 2.88Å
685	H	52.7	Low	58.5	Low	136 Å²	136	95.9 Å²	95.9	63%	0.63	56%	0.557	S	S	*	*			trans	-67.5	88.9	174.8	-88.4	-31	0	0	0	112.2	D645 L683 V687	D645-H685 IonicContact OD2-CE1 3.66Å; D645-H685 PolarHBondContact OD2-CE1 2.96Å; D645-H685 IonicContact OD2-ND1 2.84Å; D645-H685 PolarHBondContact OD2-ND1 3.04Å; D645-H685 VanDerWaalsContact OD2-ND1 3.13Å; L683-H685 VanDerWaalsContact C-N 3.29Å; L683-H685 PolarHBondContact O-N 3.19Å; H685-V687 HydrophobicContact CB-CG2 4.3Å; H685-V687 PolarHBondContact O-N 2.85Å
686	A	36	Very low	55.8	Low	96 Å²	96	96.7 Å²	96.7	79%	0.793	58%	0.576	S	S	*	*			trans	-79	50.7	171.4	0	0	0	0	0	112.3	S684 N688	S684-A686 PolarHBondContact O-N 2.88Å; A686-N688 PolarHBondContact O-N 2.9Å
687	V	36.4	Very low	52.7	Low	97 Å²	97	93.9 Å²	93.9	59%	0.588	58%	0.583	S	S	*	*			trans	-81.3	113.3	178.7	-174.9	0	0	0	0	109.8	H685 T689	H685-V687 HydrophobicContact CB-CG2 4.3Å; H685-V687 PolarHBondContact O-N 2.85Å; V687-T689 VanDerWaalsContact C-N 3.29Å; V687-T689 HydrophobicContact CB-CG2 4.49Å; V687-T689 HydrophobicContact CG1-CG2 3.91Å; V687-T689 PolarHBondContact O-N 3.25Å
688	N	34.5	Very low	49.6	Very low	155 Å²	155	97.8 Å²	97.8	83%	0.829	62%	0.615	S	S	*	*			trans	-69.9	79.5	173.3	-82.5	-40.6	0	0	0	111.6	A686 A690	A686-N688 PolarHBondContact O-N 2.9Å; N688-A690 PolarHBondContact O-N 2.96Å
689	T	33.6	Very low	46.9	Very low	127 Å²	127	98.6 Å²	98.6	78%	0.779	63%	0.63	S	S	*	*			trans	-74	40.9	175.3	47.9	0	0	0	0	113.5	V687	V687-T689 VanDerWaalsContact C-N 3.29Å; V687-T689 HydrophobicContact CB-CG2 4.49Å; V687-T689 HydrophobicContact CG1-CG2 3.91Å; V687-T689 PolarHBondContact O-N 3.25Å
690	A	33.7	Very low	43.9	Very low	98 Å²	98	106.1 Å²	106.1	81%	0.81	67%	0.667	S	S	*	*			trans	-89.3	0.3	176.8	0	0	0	0	0	113.8	N688	N688-A690 PolarHBondContact O-N 2.96Å
691	A	38.7	Very low	41.5	Very low	83 Å²	83	108.9 Å²	108.9	69%	0.686	69%	0.688	S	S	*	*	S	Bend	trans	-134.8	34.7	-165.8	0	0	0	0	0	115.6
692	Q	36.3	Very low	39.3	Very low	188 Å²	188	113.6 Å²	113.6	88%	0.879	71%	0.712	S	S	*	*			trans	-171.6	127.1	151.6	-106.1	155.1	48.1	0	0	110.9	M694	Q692-M694 PolarHBondContact O-N 2.99Å
693	G	35.6	Very low	37.5	Very low	84 Å²	84	115.9 Å²	115.9	87%	0.866	73%	0.734	S	S	*	*			trans	-85.7	105.4	179	0	0	0	0	0	111.9
694	M	29.4	Very low	36.7	Very low	173 Å²	173	116 Å²	116	85%	0.852	74%	0.737	S	S	*	*			trans	-145.2	96.4	170.9	-159.3	71.2	172.1	0	0	109.8	Q692	Q692-M694 PolarHBondContact O-N 2.99Å
695	E	33.3	Very low	36.8	Very low	205 Å²	205	118 Å²	118	96%	0.958	76%	0.757	S	S	*	*			trans	-68.8	139.3	173.8	-66.5	-174.1	128.2	0	0	110.4
696	G	30.8	Very low	37.9	Very low	77 Å²	77	112.2 Å²	112.2	79%	0.794	73%	0.73	S	S	*	*			trans	121.3	8.5	179.6	0	0	0	0	0	115.9	A698	G696-A698 PolarHBondContact O-N 2.87Å
697	G	25.1	Very low	40.2	Very low	74 Å²	74	108.9 Å²	108.9	76%	0.763	70%	0.7	S	S	*	*			trans	-61.7	103.3	168.6	0	0	0	0	0	111.3	L699	G697-L699 PolarHBondContact O-N 3.29Å
698	A	27.3	Very low	42.7	Very low	82 Å²	82	104.3 Å²	104.3	68%	0.678	67%	0.672	S	S	*	*			trans	-64.6	121.2	168.4	0	0	0	0	0	108.6	G696 M700	G696-A698 PolarHBondContact O-N 2.87Å; A698-M700 HydrophobicContact CB-CG 4.32Å; A698-M700 PolarHBondContact O-N 2.86Å
699	L	33.8	Very low	45.2	Very low	172 Å²	172	97.3 Å²	97.3	90%	0.901	64%	0.635	S	S	*	*			trans	-69.5	77.5	167.1	-79.3	168.5	0	0	0	108.9	G697 S701	G697-L699 PolarHBondContact O-N 3.29Å; L699-S701 PolarHBondContact O-N 2.85Å
700	M	28.5	Very low	48	Very low	165 Å²	165	91.8 Å²	91.8	81%	0.813	60%	0.602	S	S	*	*			trans	-72	79.4	159.9	-61	-147.8	73.3	0	0	107.2	A698 D702	A698-M700 HydrophobicContact CB-CG 4.32Å; A698-M700 PolarHBondContact O-N 2.86Å; M700-D702 PolarHBondContact O-N 2.92Å
701	S	36.1	Very low	50.9	Low	109 Å²	109	87.3 Å²	87.3	76%	0.762	57%	0.565	S	S	*	*			trans	-61.9	90.9	154.2	56.4	0	0	0	0	106.5	L699 A703	L699-S701 PolarHBondContact O-N 2.85Å; S701-A703 PolarHBondContact O-N 2.65Å
702	D	36.1	Very low	53.5	Low	117 Å²	117	86.1 Å²	86.1	63%	0.626	55%	0.546	S	S	*	.			trans	-44.8	128.8	165.5	-116.2	-3.1	0	0	0	107.4	M700 V704	M700-D702 PolarHBondContact O-N 2.92Å; D702-V704 HydrophobicContact CB-CG2 4.5Å; D702-V704 WeakPolarHBondContact O-CG2 3.38Å; D702-V704 PolarHBondContact O-N 2.86Å
703	A	41.5	Very low	56.3	Low	103 Å²	103	77.2 Å²	77.2	85%	0.851	50%	0.504	S	S	*	.			trans	-74.9	75.8	-177.3	0	0	0	0	0	109	S701 A705	S701-A703 PolarHBondContact O-N 2.65Å; A703-A705 PolarHBondContact O-N 3.36Å
704	V	53	Low	59.1	Low	48 Å²	48	76.3 Å²	76.3	29%	0.291	48%	0.477	S	S	.	.			trans	-62.3	110.7	-176.6	-169.4	0	0	0	0	108.4	D702 H706	D702-V704 HydrophobicContact CB-CG2 4.5Å; D702-V704 WeakPolarHBondContact O-CG2 3.38Å; D702-V704 PolarHBondContact O-N 2.86Å; V704-H706 VanDerWaalsContact CG1-NE2 3.33Å; V704-H706 WeakPolarHBondContact CG1-NE2 3.43Å; V704-H706 PolarHBondContact O-CD2 3.13Å; V704-H706 PolarHBondContact O-N 2.85Å
705	A	60.3	Low	62.1	Low	90 Å²	90	68.5 Å²	68.5	74%	0.744	44%	0.439	S	S	*	.			trans	-72.5	78.6	173.6	0	0	0	0	0	109.5	A703	A703-A705 PolarHBondContact O-N 3.36Å
706	H	75.2	Confident	64.9	Low	13 Å²	13	60.7 Å²	60.7	6%	0.06	40%	0.404	C	S	.	.			trans	-67.7	139.3	171.3	-76.1	-84.7	0	0	0	110.6	C681 V704 I756 E787	C681-H706 HydrophobicContact CB-CB 4.13Å; C681-H706 PolarHBondContact SG-CE1 2.98Å; C681-H706 PolarHBondContact SG-ND1 3Å; V704-H706 VanDerWaalsContact CG1-NE2 3.33Å; V704-H706 WeakPolarHBondContact CG1-NE2 3.43Å; V704-H706 PolarHBondContact O-CD2 3.13Å; V704-H706 PolarHBondContact O-N 2.85Å; H706-I756 HydrophobicContact CB-CD1 3.66Å; H706-I756 HydrophobicContact CB-CG1 4.3Å; H706-E787 WeakPolarHBondContact CA-OE1 3.37Å; H706-E787 IonicContact CE1-OE2 2.75Å; H706-E787 IonicContact CG-OE1 2.67Å; H706-E787 IonicContact CG-OE2 3.13Å; H706-E787 IonicContact ND1-OE1 2.72Å; H706-E787 PolarHBondContact ND1-OE1 2.75Å; H706-E787 IonicContact ND1-OE2 2.81Å; H706-E787 PolarHBondContact ND1-OE2 2.99Å
707	T	85	Confident	67.6	Low	27 Å²	27	60.8 Å²	60.8	17%	0.166	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	95	-170.7	-57.4	0	0	0	0	108.2	Y306 L314 A753 E754 E787	Y306-T707 WeakPolarHBondContact CE1-O 3.44Å; Y306-T707 PolarHBondContact OH-O 2.82Å; L314-T707 HydrophobicContact CD2-CG2 4.39Å; T707-A753 HydrophobicContact CG2-CB 3.69Å; T707-E754 CarbonylContact C-O 3.59Å; T707-E754 WeakPolarHBondContact CA-O 3.35Å; T707-E787 PolarHBondContact N-OE1 2.96Å; T707-E787 WeakPolarHBondContact O-CG 3.49Å
708	L	89.1	Confident	70.6	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	148	177	-60.3	176.7	0	0	0	109.3	I649 I679 A753 E754 I756 Y759 C785 S786	I649-L708 HydrophobicContact CD1-CD2 4.04Å; I649-L708 HydrophobicContact CG2-CD2 4.2Å; I679-L708 HydrophobicContact CD1-CD1 3.77Å; I679-L708 HydrophobicContact CG2-CD1 4.27Å; L708-A753 WeakPolarHBondContact O-CA 3.35Å; L708-E754 PolarHBondContact N-O 2.78Å; L708-E754 PolarHBondContact O-N 3.22Å; L708-I756 HydrophobicContact CD1-CG1 3.99Å; L708-I756 HydrophobicContact CG-CG1 3.89Å; L708-Y759 HydrophobicContact CB-CD2 3.71Å; L708-Y759 HydrophobicContact CB-CE2 3.81Å; L708-Y759 HydrophobicContact CB-CG 4.11Å; L708-Y759 HydrophobicContact CD1-CD2 4.36Å; L708-Y759 HydrophobicContact CD1-CG 4.05Å; L708-Y759 VanDerWaalsContact O-CE2 3.24Å; L708-Y759 WeakPolarHBondContact O-CE2 3.41Å; L708-C785 HydrophobicContact CD1-CB 4.37Å; L708-C785 HydrophobicContact CD2-CB 4.45Å; L708-S786 WeakPolarHBondContact CA-O 3.19Å; L708-S786 WeakPolarHBondContact CD2-O 3.13Å
709	D	87.5	Confident	73.6	Confident	9 Å²	9	65.5 Å²	65.5	5%	0.048	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	-7.9	-177.6	80.6	-33.7	0	0	0	114.9	Y306 T751 G752 A753 Y759 S786 N789	Y306-D709 HydrophobicContact CD1-CB 3.94Å; Y306-D709 HydrophobicContact CE1-CB 4.18Å; D709-T751 CarbonylContact O-C 3.59Å; D709-T751 WeakPolarHBondContact O-CA 3.28Å; D709-G752 PolarHBondContact O-N 2.98Å; D709-A753 HydrophobicContact CB-CB 4.5Å; D709-Y759 VanDerWaalsContact C-OH 3.28Å; D709-Y759 PolarHBondContact O-OH 2.86Å; D709-S786 PolarHBondContact N-O 3.1Å; D709-S786 PolarHBondContact OD1-OG 3.38Å; D709-N789 PolarHBondContact OD1-N 2.88Å; D709-N789 WeakPolarHBondContact OD2-CA 3.4Å; D709-N789 PolarHBondContact OD2-N 2.82Å
710	G	91.4	Very high	76.2	Confident	10 Å²	10	57.8 Å²	57.8	10%	0.103	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	144	170.3	0	0	0	0	0	111.4	I750 C785 S786	G710-I750 CarbonylContact C-O 3.58Å; G710-I750 VanDerWaalsContact CA-O 3.32Å; G710-I750 WeakPolarHBondContact CA-O 3.35Å; G710-C785 CarbonylContact O-C 3.57Å; G710-C785 VanDerWaalsContact O-CA 3.27Å; G710-C785 WeakPolarHBondContact O-CA 3.41Å; G710-S786 PolarHBondContact N-OG 3.07Å; G710-S786 PolarHBondContact O-N 3.17Å; G710-S786 PolarHBondContact O-OG 2.99Å
711	C	94.6	Very high	79.1	Confident	5 Å²	5	52.8 Å²	52.8	3%	0.034	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	135.2	160.9	-65.1	0	0	0	0	109.9	A749 I750 Y759 L763 L783 S784 C785	C711-A749 WeakPolarHBondContact O-CA 3.23Å; C711-I750 PolarHBondContact N-O 2.86Å; C711-I750 PolarHBondContact O-N 2.75Å; C711-Y759 HydrophobicContact CB-CD1 4.03Å; C711-Y759 HydrophobicContact CB-CE1 4.06Å; C711-Y759 WeakPolarHBondContact SG-CD1 3.33Å; C711-L763 HydrophobicContact CB-CD1 3.94Å; C711-L763 HydrophobicContact CB-CD2 4.23Å; C711-L783 HydrophobicContact CB-CD1 4.31Å; C711-S784 CarbonylContact C-O 3.6Å; C711-S784 WeakPolarHBondContact CA-O 3.39Å; C711-C785 HydrophobicContact CB-CB 4.14Å; C711-C785 WeakPolarHBondContact CB-SG 3.47Å; C711-C785 WeakPolarHBondContact SG-CB 3.13Å; C711-C785 CovalentContact SG-SG 2.04Å; C711-C785 PolarHBondContact SG-SG 3.18Å
712	E	94.2	Very high	81.5	Confident	58 Å²	58	52.2 Å²	52.2	27%	0.271	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	129.5	-178.7	-169.3	-176.7	136.7	0	0	111	Q714 Y747 I748 A749 L783 S784	E712-Q714 PolarHBondContact OE1-NE2 3.1Å; E712-Y747 HydrophobicContact CG-CD2 4.06Å; E712-Y747 HydrophobicContact CG-CG 4.2Å; E712-Y747 WeakPolarHBondContact OE1-CB 3.23Å; E712-I748 CarbonylContact C-O 3.3Å; E712-I748 WeakPolarHBondContact CA-O 3.32Å; E712-A749 HydrophobicContact CG-CB 4.46Å; E712-L783 WeakPolarHBondContact O-CA 3.4Å; E712-S784 PolarHBondContact N-O 3.22Å; E712-S784 PolarHBondContact O-N 3.36Å; E712-S784 VanDerWaalsContact O-N 3.12Å
713	V	94.5	Very high	83.8	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	108.1	168.3	178.6	0	0	0	0	108.4	L673 F674 L727 Y747 I748 L763 R782 L783	L673-V713 HydrophobicContact CD1-CG1 4.44Å; F674-V713 HydrophobicContact CE2-CG1 3.99Å; F674-V713 HydrophobicContact CE2-CG2 3.9Å; F674-V713 HydrophobicContact CZ-CG1 4.43Å; V713-L727 HydrophobicContact CG1-CD1 4.08Å; V713-Y747 WeakPolarHBondContact O-CA 3.49Å; V713-I748 PolarHBondContact N-O 2.81Å; V713-I748 PolarHBondContact O-N 3.4Å; V713-L763 HydrophobicContact CG2-CD2 4.13Å; V713-R782 CarbonylContact C-O 3.55Å; V713-R782 WeakPolarHBondContact CA-O 3.42Å; V713-L783 HydrophobicContact CG2-CD1 3.81Å
714	Q	94.1	Very high	85.9	Confident	65 Å²	65	56.4 Å²	56.4	30%	0.304	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	123.8	-174.3	-168	179.7	86.4	0	0	111.2	E712 F781 R782	E712-Q714 PolarHBondContact OE1-NE2 3.1Å; Q714-F781 CarbonylContact O-C 3.57Å; Q714-F781 WeakPolarHBondContact O-CA 3.39Å; Q714-R782 PolarHBondContact N-O 3.36Å; Q714-R782 PolarHBondContact O-N 3.24Å
715	P	93.1	Very high	87.7	Confident	8 Å²	8	54.4 Å²	54.4	5%	0.052	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	132.6	163.7	27.4	-38.4	0	0	0	111.2	L720 A746 F781	P715-L720 HydrophobicContact CB-CD2 4.29Å; P715-L720 HydrophobicContact CB-CG 4.33Å; P715-L720 HydrophobicContact CG-CG 4.12Å; P715-A746 WeakPolarHBondContact CD-O 3.22Å; P715-A746 WeakPolarHBondContact CG-O 3.39Å; P715-F781 HydrophobicContact CB-CD1 4.31Å; P715-F781 HydrophobicContact CB-CE1 4.13Å
716	L	91.3	Very high	89.2	Confident	41 Å²	41	52.6 Å²	52.6	22%	0.215	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	134.1	172.8	-62.6	-178.9	0	0	0	110.5	R779 R780 R782 T798	L716-R779 PolarHBondContact O-NH1 2.87Å; L716-R779 VanDerWaalsContact O-NH1 3.1Å; L716-R780 HydrophobicContact CB-CB 4Å; L716-R780 HydrophobicContact CD1-CB 4.27Å; L716-R780 PolarHBondContact N-O 3.09Å; L716-R782 HydrophobicContact CD1-CB 4.3Å; L716-R782 HydrophobicContact CD2-CB 3.96Å; L716-R782 HydrophobicContact CG-CB 4.15Å; L716-T798 HydrophobicContact CD1-CG2 3.86Å
717	G	88.1	Confident	90	Very high	79 Å²	79	52.3 Å²	52.3	81%	0.814	28%	0.277	S	S	*	.	S	Bend	trans	99	-130	-175.4	0	0	0	0	0	111.9
718	E	88.1	Confident	90.3	Very high	144 Å²	144	53.7 Å²	53.7	67%	0.673	28%	0.283	S	S	*	.	S	Bend	trans	-68	151.8	174.4	-59.6	171.8	153.3	0	0	111.4	R779	E718-R779 VanDerWaalsContact O-CZ 3.27Å; E718-R779 PolarHBondContact O-NH1 2.97Å; E718-R779 PolarHBondContact O-NH2 2.66Å
719	E	90	Very high	90.4	Very high	111 Å²	111	54.6 Å²	54.6	52%	0.519	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-58	164.3	168.5	-66.6	-169	-149.5	0	0	112.3	N721 T745 A746 R779	E719-N721 PolarHBondContact O-N 2.73Å; E719-T745 WeakPolarHBondContact OE2-CB 3.39Å; E719-T745 PolarHBondContact OE2-OG1 3.45Å; E719-A746 HydrophobicContact CG-CB 4.15Å; E719-A746 PolarHBondContact OE2-N 2.9Å; E719-R779 PolarHBondContact O-NH2 3.25Å
720	L	88.6	Confident	90.4	Very high	10 Å²	10	58.5 Å²	58.5	5%	0.052	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-68	122.1	172.8	-62.8	168.5	0	0	0	110	P715 P722 E725 L727 T745 Y768 F781	P715-L720 HydrophobicContact CB-CD2 4.29Å; P715-L720 HydrophobicContact CB-CG 4.33Å; P715-L720 HydrophobicContact CG-CG 4.12Å; L720-P722 WeakPolarHBondContact O-CD 3.22Å; L720-E725 HydrophobicContact CB-CG 4.22Å; L720-E725 HydrophobicContact CD2-CB 4.48Å; L720-E725 HydrophobicContact CD2-CG 3.78Å; L720-L727 HydrophobicContact CD1-CB 4.34Å; L720-L727 HydrophobicContact CD1-CD1 3.85Å; L720-L727 HydrophobicContact CD1-CG 3.78Å; L720-T745 PolarHBondContact N-O 2.85Å; L720-T745 WeakPolarHBondContact O-CB 3.25Å; L720-T745 VanDerWaalsContact O-CG2 3.3Å; L720-T745 WeakPolarHBondContact O-CG2 3.22Å; L720-Y768 HydrophobicContact CD2-CE2 4.17Å; L720-F781 HydrophobicContact CD2-CE1 4.32Å
721	N	88.6	Confident	90.2	Very high	61 Å²	61	60.9 Å²	60.9	33%	0.326	32%	0.319	S	S	.	.			trans	-83.7	111.7	169.1	179.1	-30.5	0	0	0	109.4	E719 E723 R724 E725	E719-N721 PolarHBondContact O-N 2.73Å; N721-E723 PolarHBondContact O-N 3.48Å; N721-E723 VanDerWaalsContact O-N 3.1Å; N721-E723 WeakPolarHBondContact OD1-CB 3.44Å; N721-E723 PolarHBondContact OD1-N 2.83Å; N721-R724 HydrophobicContact CB-CB 4.35Å; N721-R724 PolarHBondContact O-N 2.94Å; N721-E725 CarbonylContact C-O 3.49Å; N721-E725 PolarHBondContact O-N 2.66Å
722	P	86.3	Confident	89.8	Confident	96 Å²	96	65.3 Å²	65.3	62%	0.623	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-12.1	-173.1	28.7	-36.3	0	0	0	114.6	L720 R724	L720-P722 WeakPolarHBondContact O-CD 3.22Å; P722-R724 VanDerWaalsContact C-N 3.29Å
723	E	85.3	Confident	89.5	Confident	162 Å²	162	65 Å²	65	76%	0.757	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-14.2	169.8	-56.8	-173	150.3	0	0	112.7	N721 A771	N721-E723 PolarHBondContact O-N 3.48Å; N721-E723 VanDerWaalsContact O-N 3.1Å; N721-E723 WeakPolarHBondContact OD1-CB 3.44Å; N721-E723 PolarHBondContact OD1-N 2.83Å; E723-A771 WeakPolarHBondContact O-CB 3.45Å
724	R	86.6	Confident	89.2	Confident	146 Å²	146	65 Å²	65	55%	0.551	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.3	-33.7	-169.4	-62.2	-172.5	179.4	-164.2	0.4	114.5	N721 P722 A771	N721-R724 HydrophobicContact CB-CB 4.35Å; N721-R724 PolarHBondContact O-N 2.94Å; P722-R724 VanDerWaalsContact C-N 3.29Å; R724-A771 PolarHBondContact O-N 2.67Å
725	E	90.5	Very high	88.7	Confident	6 Å²	6	68.9 Å²	68.9	3%	0.028	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	146.3	-172.3	63.7	-173.7	154.6	0	0	111.7	L720 N721 Y768 R769 L770 R776 R779	L720-E725 HydrophobicContact CB-CG 4.22Å; L720-E725 HydrophobicContact CD2-CB 4.48Å; L720-E725 HydrophobicContact CD2-CG 3.78Å; N721-E725 CarbonylContact C-O 3.49Å; N721-E725 PolarHBondContact O-N 2.66Å; E725-Y768 HydrophobicContact CB-CE2 3.79Å; E725-Y768 WeakPolarHBondContact CB-OH 3.44Å; E725-Y768 PolarHBondContact OE2-OH 2.78Å; E725-R769 WeakPolarHBondContact CA-O 3.35Å; E725-L770 HydrophobicContact CB-CD2 4.06Å; E725-R776 IonicContact OE1-CZ 3.42Å; E725-R776 IonicContact OE1-NE 3.73Å; E725-R776 IonicContact OE1-NH2 2.74Å; E725-R776 PolarHBondContact OE1-NH2 3.04Å; E725-R776 IonicContact OE2-CZ 3.62Å; E725-R776 IonicContact OE2-NE 2.77Å; E725-R776 PolarHBondContact OE2-NE 2.91Å; E725-R776 IonicContact OE2-NH2 2.84Å; E725-R776 PolarHBondContact OE2-NH2 3.09Å; E725-R779 IonicContact OE1-CZ 3.63Å; E725-R779 IonicContact OE1-NE 3.92Å; E725-R779 PolarHBondContact OE1-NE 2.96Å; E725-R779 IonicContact OE1-NH2 3.17Å; E725-R779 PolarHBondContact OE1-NH2 3.05Å; E725-R779 IonicContact OE2-CZ 2.8Å; E725-R779 IonicContact OE2-NE 3.62Å; E725-R779 PolarHBondContact OE2-NE 2.85Å; E725-R779 IonicContact OE2-NH2 3.9Å
726	E	90.1	Very high	88.3	Confident	53 Å²	53	75.5 Å²	75.5	25%	0.248	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	161.9	179.9	59.9	171.8	-136.4	0	0	111.8	L728 Y768 R769	E726-L728 VanDerWaalsContact OE1-CD2 3.22Å; E726-L728 WeakPolarHBondContact OE1-CD2 3.1Å; E726-L728 VanDerWaalsContact OE1-CG 3.25Å; E726-L728 WeakPolarHBondContact OE1-CG 3.35Å; E726-Y768 WeakPolarHBondContact O-CD2 3.38Å; E726-R769 VanDerWaalsContact CD-NE 3.34Å; E726-R769 HydrophobicContact CG-CB 3.93Å; E726-R769 PolarHBondContact N-O 3.33Å; E726-R769 VanDerWaalsContact N-O 3.07Å; E726-R769 PolarHBondContact O-N 3.35Å; E726-R769 IonicContact OE1-CZ 3.79Å; E726-R769 IonicContact OE1-NE 3.1Å; E726-R769 PolarHBondContact OE1-NE 3.1Å; E726-R769 IonicContact OE1-NH2 2.95Å; E726-R769 PolarHBondContact OE1-NH2 3.27Å; E726-R769 IonicContact OE2-CZ 3.82Å; E726-R769 IonicContact OE2-NE 2.74Å; E726-R769 IonicContact OE2-NH2 4Å; E726-R769 PolarHBondContact OE2-NH2 2.87Å
727	L	92.4	Very high	88	Confident	6 Å²	6	77.4 Å²	77.4	3%	0.031	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	129.1	168.4	-69.9	172.9	0	0	0	110.2	L673 V713 L720 I748 V766 R767 Y768 F781	L673-L727 HydrophobicContact CD1-CD2 3.68Å; V713-L727 HydrophobicContact CG1-CD1 4.08Å; L720-L727 HydrophobicContact CD1-CB 4.34Å; L720-L727 HydrophobicContact CD1-CD1 3.85Å; L720-L727 HydrophobicContact CD1-CG 3.78Å; L727-I748 HydrophobicContact CB-CD1 3.46Å; L727-I748 VanDerWaalsContact CB-CD1 3.46Å; L727-I748 HydrophobicContact CB-CG1 4.19Å; L727-I748 HydrophobicContact CD1-CD1 4.19Å; L727-I748 HydrophobicContact CD1-CG1 4.12Å; L727-I748 HydrophobicContact CG-CD1 4.47Å; L727-V766 HydrophobicContact CD2-CG1 4.45Å; L727-R767 CarbonylContact C-O 3.46Å; L727-R767 WeakPolarHBondContact CA-O 3.35Å; L727-Y768 HydrophobicContact CD2-CD2 4Å; L727-F781 HydrophobicContact CD1-CE1 4.23Å; L727-F781 HydrophobicContact CD2-CE1 3.97Å; L727-F781 HydrophobicContact CD2-CZ 4.33Å; L727-F781 HydrophobicContact CG-CE1 4.36Å
728	L	90.9	Very high	87.6	Confident	56 Å²	56	74.2 Å²	74.2	29%	0.293	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	124.6	-178.3	-76.3	172.3	0	0	0	110.4	E726 R767 R769	E726-L728 VanDerWaalsContact OE1-CD2 3.22Å; E726-L728 WeakPolarHBondContact OE1-CD2 3.1Å; E726-L728 VanDerWaalsContact OE1-CG 3.25Å; E726-L728 WeakPolarHBondContact OE1-CG 3.35Å; L728-R767 HydrophobicContact CB-CB 4.09Å; L728-R767 PolarHBondContact N-O 2.93Å; L728-R767 PolarHBondContact O-N 2.79Å; L728-R769 HydrophobicContact CD1-CB 4.03Å
729	V	91.4	Very high	87.5	Confident	19 Å²	19	67.5 Å²	67.5	12%	0.115	33%	0.327	C	S	.	.			trans	-138.2	142.7	172.4	-172.9	0	0	0	0	107.6	M731 V734 I741 I748 V766	V729-M731 PolarHBondContact O-N 2.82Å; V729-M731 VanDerWaalsContact O-N 3.14Å; V729-V734 HydrophobicContact CG1-CG2 3.82Å; V729-I741 HydrophobicContact CB-CD1 3.9Å; V729-I741 HydrophobicContact CG1-CD1 3.78Å; V729-I741 HydrophobicContact CG2-CD1 4.23Å; V729-I748 HydrophobicContact CG2-CD1 3.71Å; V729-V766 HydrophobicContact CG2-CB 4.33Å; V729-V766 HydrophobicContact CG2-CG1 4.17Å; V729-V766 HydrophobicContact CG2-CG2 3.87Å
730	D	89.2	Confident	87.2	Confident	91 Å²	91	64.2 Å²	64.2	49%	0.487	31%	0.313	S	S	.	.			trans	-77.4	98.4	174.8	-168.8	-43.7	0	0	0	109.7	D732 V733 V734	D730-D732 PolarHBondContact O-N 2.85Å; D730-D732 PolarHBondContact OD1-N 3.36Å; D730-D732 VanDerWaalsContact OD1-N 3.17Å; D730-V733 HydrophobicContact CB-CB 4.02Å; D730-V733 HydrophobicContact CB-CG2 4.02Å; D730-V733 VanDerWaalsContact CG-CG2 3.48Å; D730-V733 PolarHBondContact O-N 3.07Å; D730-V733 PolarHBondContact OD1-N 2.76Å; D730-V734 WeakPolarHBondContact O-CG2 3.44Å; D730-V734 PolarHBondContact O-N 2.94Å
731	M	86.6	Confident	87.2	Confident	60 Å²	60	65 Å²	65	30%	0.296	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-27.3	-173.5	-52.9	-64.8	-92.1	0	0	112.6	V729 R735 I741 N743	V729-M731 PolarHBondContact O-N 2.82Å; V729-M731 VanDerWaalsContact O-N 3.14Å; M731-R735 WeakPolarHBondContact O-CD 3.45Å; M731-R735 VanDerWaalsContact O-CG 3.28Å; M731-R735 WeakPolarHBondContact O-CG 3.4Å; M731-R735 PolarHBondContact O-N 2.92Å; M731-I741 HydrophobicContact CE-CB 4.5Å; M731-I741 HydrophobicContact CE-CD1 4.44Å; M731-I741 HydrophobicContact CE-CG1 4.13Å; M731-I741 HydrophobicContact CE-CG2 3.7Å; M731-I741 HydrophobicContact SD-CD1 3.71Å; M731-I741 HydrophobicContact SD-CG1 4.06Å; M731-I741 HydrophobicContact SD-CG2 3.76Å; M731-N743 HydrophobicContact CE-CB 4.01Å
732	D	86.3	Confident	87	Confident	98 Å²	98	65 Å²	65	52%	0.524	32%	0.316	S	S	.	.	H	α-helix	trans	-84.6	-36.7	-178	-65.3	-33.3	0	0	0	110.6	D730 V734 R735 E736	D730-D732 PolarHBondContact O-N 2.85Å; D730-D732 PolarHBondContact OD1-N 3.36Å; D730-D732 VanDerWaalsContact OD1-N 3.17Å; D732-V734 VanDerWaalsContact C-N 3.3Å; D732-V734 PolarHBondContact O-N 2.81Å; D732-R735 CarbonylContact O-C 3.56Å; D732-R735 PolarHBondContact O-N 3.02Å; D732-R735 IonicContact OD1-NH1 3.14Å; D732-R735 PolarHBondContact OD1-NH1 3.33Å; D732-E736 WeakPolarHBondContact O-CB 3.27Å; D732-E736 WeakPolarHBondContact O-CG 3.39Å; D732-E736 PolarHBondContact O-N 2.69Å
733	V	87.2	Confident	87.1	Confident	53 Å²	53	63.9 Å²	63.9	32%	0.321	31%	0.305	S	S	.	.	H	α-helix	trans	-60.2	-37.4	169.1	172.5	0	0	0	0	112.2	D730 R737	D730-V733 HydrophobicContact CB-CB 4.02Å; D730-V733 HydrophobicContact CB-CG2 4.02Å; D730-V733 VanDerWaalsContact CG-CG2 3.48Å; D730-V733 PolarHBondContact O-N 3.07Å; D730-V733 PolarHBondContact OD1-N 2.76Å; V733-R737 WeakPolarHBondContact O-CB 3.31Å; V733-R737 WeakPolarHBondContact O-CG 3.22Å; V733-R737 PolarHBondContact O-N 3.03Å
734	V	88.3	Confident	87.1	Confident	1 Å²	1	58 Å²	58	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-63.3	-45.6	174.9	-179.8	0	0	0	0	110.8	V729 D730 D732 R737 G738 L739 I741 I750 V762	V729-V734 HydrophobicContact CG1-CG2 3.82Å; D730-V734 WeakPolarHBondContact O-CG2 3.44Å; D730-V734 PolarHBondContact O-N 2.94Å; D732-V734 VanDerWaalsContact C-N 3.3Å; D732-V734 PolarHBondContact O-N 2.81Å; V734-R737 CarbonylContact O-C 3.11Å; V734-R737 PolarHBondContact O-N 2.92Å; V734-G738 PolarHBondContact O-N 2.7Å; V734-L739 HydrophobicContact CG1-CB 3.6Å; V734-L739 PolarHBondContact O-N 2.83Å; V734-I741 HydrophobicContact CB-CG2 4.27Å; V734-I741 HydrophobicContact CG1-CB 4.1Å; V734-I741 HydrophobicContact CG1-CG2 4.06Å; V734-I741 HydrophobicContact CG2-CD1 4.43Å; V734-I750 HydrophobicContact CG1-CG2 4.33Å; V734-V762 HydrophobicContact CG2-CG1 3.74Å
735	R	84	Confident	87.1	Confident	146 Å²	146	54 Å²	54	55%	0.551	27%	0.271	S	S	*	.	H	α-helix	trans	-68.7	-35.6	177.7	-70.4	165	174.7	162	-4.5	113.3	R319 M731 D732 R737 G738	R319-R735 PolarHBondContact NH1-O 2.86Å; M731-R735 WeakPolarHBondContact O-CD 3.45Å; M731-R735 VanDerWaalsContact O-CG 3.28Å; M731-R735 WeakPolarHBondContact O-CG 3.4Å; M731-R735 PolarHBondContact O-N 2.92Å; D732-R735 CarbonylContact O-C 3.56Å; D732-R735 PolarHBondContact O-N 3.02Å; D732-R735 IonicContact OD1-NH1 3.14Å; D732-R735 PolarHBondContact OD1-NH1 3.33Å; R735-R737 VanDerWaalsContact C-N 3.32Å; R735-G738 WeakPolarHBondContact O-CA 3.36Å; R735-G738 PolarHBondContact O-N 2.78Å
736	E	84.4	Confident	86.9	Confident	146 Å²	146	55.1 Å²	55.1	68%	0.682	28%	0.282	S	S	*	.	H	α-helix	trans	-63	-39.6	173	-79.6	-170.6	164.7	0	0	111.2	R319 D732 G738	R319-E736 VanDerWaalsContact CZ-O 3.27Å; R319-E736 PolarHBondContact NH1-O 2.95Å; R319-E736 PolarHBondContact NH2-O 3Å; D732-E736 WeakPolarHBondContact O-CB 3.27Å; D732-E736 WeakPolarHBondContact O-CG 3.39Å; D732-E736 PolarHBondContact O-N 2.69Å; E736-G738 PolarHBondContact O-N 3.41Å
737	R	84.9	Confident	86.9	Confident	82 Å²	82	55.6 Å²	55.6	31%	0.309	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-2.2	170.3	-72.6	169.5	176	-108.2	8.1	113.7	V733 V734 R735 L739 V758 D761	V733-R737 WeakPolarHBondContact O-CB 3.31Å; V733-R737 WeakPolarHBondContact O-CG 3.22Å; V733-R737 PolarHBondContact O-N 3.03Å; V734-R737 CarbonylContact O-C 3.11Å; V734-R737 PolarHBondContact O-N 2.92Å; R735-R737 VanDerWaalsContact C-N 3.32Å; R737-L739 VanDerWaalsContact C-N 3.32Å; R737-V758 HydrophobicContact CB-CG1 3.98Å; R737-V758 HydrophobicContact CG-CG1 4.24Å; R737-D761 IonicContact CZ-OD2 3.8Å; R737-D761 VanDerWaalsContact CZ-OD2 3.27Å; R737-D761 VanDerWaalsContact NH1-CB 3.27Å; R737-D761 IonicContact NH1-OD2 3.32Å; R737-D761 PolarHBondContact NH1-OD2 3.18Å; R737-D761 IonicContact NH2-OD2 3.91Å; R737-D761 PolarHBondContact NH2-OD2 3.16Å
738	G	79.2	Confident	86.9	Confident	12 Å²	12	55.3 Å²	55.3	12%	0.124	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	14.5	174.1	0	0	0	0	0	114.3	R313 R319 V734 R735 E736	R313-G738 PolarHBondContact NH1-O 3.44Å; R319-G738 VanDerWaalsContact CZ-CA 3.46Å; V734-G738 PolarHBondContact O-N 2.7Å; R735-G738 WeakPolarHBondContact O-CA 3.36Å; R735-G738 PolarHBondContact O-N 2.78Å; E736-G738 PolarHBondContact O-N 3.41Å
739	L	86.9	Confident	86.9	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.016	27%	0.271	C	S	.	.			trans	-95.2	159.4	173.8	-69.2	174.5	0	0	0	110.6	V734 R737 I750 G752 E754 V758 Y759 V762	V734-L739 HydrophobicContact CG1-CB 3.6Å; V734-L739 PolarHBondContact O-N 2.83Å; R737-L739 VanDerWaalsContact C-N 3.32Å; L739-I750 HydrophobicContact CB-CG2 4.13Å; L739-I750 HydrophobicContact CD1-CG2 3.84Å; L739-I750 HydrophobicContact CG-CG2 4.46Å; L739-G752 WeakPolarHBondContact CD2-O 3.45Å; L739-E754 HydrophobicContact CD2-CB 3.91Å; L739-E754 HydrophobicContact CG-CB 4.47Å; L739-V758 HydrophobicContact CD1-CG1 4.04Å; L739-Y759 HydrophobicContact CD1-CD2 4.36Å; L739-Y759 HydrophobicContact CD1-CE1 4.43Å; L739-Y759 HydrophobicContact CD1-CE2 4.11Å; L739-Y759 HydrophobicContact CD2-CE2 3.81Å; L739-V762 HydrophobicContact CD1-CG2 4.48Å
740	D	83.8	Confident	86.9	Confident	42 Å²	42	52.3 Å²	52.3	23%	0.225	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	153.7	174.3	-66.9	-102.1	0	0	0	109.8	R309 R313 I750 T751	R309-D740 IonicContact CZ-OD1 2.76Å; R309-D740 IonicContact CZ-OD2 3.42Å; R309-D740 VanDerWaalsContact CZ-OD2 3.31Å; R309-D740 IonicContact NH1-OD1 3.78Å; R309-D740 PolarHBondContact NH1-OD1 2.82Å; R309-D740 IonicContact NH1-OD2 2.67Å; R309-D740 PolarHBondContact NH1-OD2 2.96Å; R309-D740 IonicContact NH2-OD1 2.81Å; R309-D740 PolarHBondContact NH2-OD1 2.96Å; R309-D740 IonicContact NH2-OD2 3.36Å; R309-D740 PolarHBondContact NH2-OD2 2.89Å; R313-D740 IonicContact CZ-OD2 3.46Å; R313-D740 IonicContact NH1-OD2 2.85Å; R313-D740 PolarHBondContact NH1-OD2 3.01Å; R313-D740 VanDerWaalsContact NH1-OD2 3.17Å; R313-D740 IonicContact NH2-OD2 2.7Å; R313-D740 PolarHBondContact NH2-OD2 3.1Å; D740-I750 CarbonylContact O-C 3.54Å; D740-I750 VanDerWaalsContact O-CA 3.31Å; D740-I750 WeakPolarHBondContact O-CA 3.43Å; D740-T751 PolarHBondContact N-O 2.89Å; D740-T751 PolarHBondContact O-N 3.1Å
741	I	87.4	Confident	86.9	Confident	26 Å²	26	50.3 Å²	50.3	13%	0.133	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	125.3	-177.9	178.4	160.4	0	0	0	111.9	V729 M731 V734 I748 A749 I750	V729-I741 HydrophobicContact CB-CD1 3.9Å; V729-I741 HydrophobicContact CG1-CD1 3.78Å; V729-I741 HydrophobicContact CG2-CD1 4.23Å; M731-I741 HydrophobicContact CE-CB 4.5Å; M731-I741 HydrophobicContact CE-CD1 4.44Å; M731-I741 HydrophobicContact CE-CG1 4.13Å; M731-I741 HydrophobicContact CE-CG2 3.7Å; M731-I741 HydrophobicContact SD-CD1 3.71Å; M731-I741 HydrophobicContact SD-CG1 4.06Å; M731-I741 HydrophobicContact SD-CG2 3.76Å; V734-I741 HydrophobicContact CB-CG2 4.27Å; V734-I741 HydrophobicContact CG1-CB 4.1Å; V734-I741 HydrophobicContact CG1-CG2 4.06Å; V734-I741 HydrophobicContact CG2-CD1 4.43Å; I741-I748 HydrophobicContact CD1-CG2 3.76Å; I741-I748 HydrophobicContact CG1-CG2 4.04Å; I741-A749 WeakPolarHBondContact CA-O 3.18Å; I741-I750 HydrophobicContact CD1-CG1 4.07Å; I741-I750 HydrophobicContact CG1-CG1 4.32Å
742	I	85.3	Confident	86.8	Confident	62 Å²	62	47.8 Å²	47.8	32%	0.318	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	112.1	171.7	-63	173.9	0	0	0	106.3	T744 Y747 I748 A749	I742-T744 HydrophobicContact CG2-CG2 3.93Å; I742-Y747 HydrophobicContact CG2-CE2 3.98Å; I742-I748 CarbonylContact O-C 3.54Å; I742-I748 WeakPolarHBondContact O-CA 3.02Å; I742-A749 HydrophobicContact CB-CB 4.49Å; I742-A749 PolarHBondContact N-O 3.05Å; I742-A749 PolarHBondContact O-N 2.91Å
743	N	87.6	Confident	86.8	Confident	72 Å²	72	43.4 Å²	43.4	39%	0.385	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	119.8	177.4	-174	-11	0	0	0	109	M731 I748	M731-N743 HydrophobicContact CE-CB 4.01Å; N743-I748 HydrophobicContact CB-CD1 4.42Å; N743-I748 HydrophobicContact CB-CG1 4.22Å; N743-I748 WeakPolarHBondContact OD1-CG1 3.49Å
744	T	86.1	Confident	86.9	Confident	38 Å²	38	44 Å²	44	23%	0.233	22%	0.223	C	C	.	.			trans	-137.1	168.8	-178.2	67.9	0	0	0	0	110.8	I742 A746 Y747	I742-T744 HydrophobicContact CG2-CG2 3.93Å; T744-A746 PolarHBondContact O-N 2.87Å; T744-A746 PolarHBondContact OG1-N 2.84Å; T744-Y747 PolarHBondContact N-O 2.9Å; T744-Y747 PolarHBondContact OG1-N 2.81Å; T744-Y747 PolarHBondContact OG1-O 2.04Å
745	T	87	Confident	87	Confident	61 Å²	61	46 Å²	46	37%	0.374	24%	0.236	S	C	.	.	S	Bend	trans	-62.6	-28.2	170.6	45.3	0	0	0	0	112.7	E719 L720	E719-T745 WeakPolarHBondContact OE2-CB 3.39Å; E719-T745 PolarHBondContact OE2-OG1 3.45Å; L720-T745 PolarHBondContact N-O 2.85Å; L720-T745 WeakPolarHBondContact O-CB 3.25Å; L720-T745 VanDerWaalsContact O-CG2 3.3Å; L720-T745 WeakPolarHBondContact O-CG2 3.22Å
746	A	86.1	Confident	87.3	Confident	31 Å²	31	40.3 Å²	40.3	26%	0.256	22%	0.217	S	C	.	.	S	Bend	trans	-85.5	-32.8	-178.3	0	0	0	0	0	114.3	P715 E719 T744	P715-A746 WeakPolarHBondContact CD-O 3.22Å; P715-A746 WeakPolarHBondContact CG-O 3.39Å; E719-A746 HydrophobicContact CG-CB 4.15Å; E719-A746 PolarHBondContact OE2-N 2.9Å; T744-A746 PolarHBondContact O-N 2.87Å; T744-A746 PolarHBondContact OG1-N 2.84Å
747	Y	90.3	Very high	87.6	Confident	63 Å²	63	36.6 Å²	36.6	25%	0.247	21%	0.207	C	C	.	.			trans	-168.1	161.3	-179.7	60.3	-88.7	0	0	0	112.7	E712 V713 I742 T744 A749	E712-Y747 HydrophobicContact CG-CD2 4.06Å; E712-Y747 HydrophobicContact CG-CG 4.2Å; E712-Y747 WeakPolarHBondContact OE1-CB 3.23Å; V713-Y747 WeakPolarHBondContact O-CA 3.49Å; I742-Y747 HydrophobicContact CG2-CE2 3.98Å; T744-Y747 PolarHBondContact N-O 2.9Å; T744-Y747 PolarHBondContact OG1-N 2.81Å; T744-Y747 PolarHBondContact OG1-O 2.04Å; Y747-A749 HydrophobicContact CD2-CB 3.77Å; Y747-A749 HydrophobicContact CE2-CB 3.73Å
748	I	91.8	Very high	87.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	122.5	156.9	-65.9	-169.5	0	0	0	108.8	E712 V713 L727 V729 I741 I742 N743 I750	E712-I748 CarbonylContact C-O 3.3Å; E712-I748 WeakPolarHBondContact CA-O 3.32Å; V713-I748 PolarHBondContact N-O 2.81Å; V713-I748 PolarHBondContact O-N 3.4Å; L727-I748 HydrophobicContact CB-CD1 3.46Å; L727-I748 VanDerWaalsContact CB-CD1 3.46Å; L727-I748 HydrophobicContact CB-CG1 4.19Å; L727-I748 HydrophobicContact CD1-CD1 4.19Å; L727-I748 HydrophobicContact CD1-CG1 4.12Å; L727-I748 HydrophobicContact CG-CD1 4.47Å; V729-I748 HydrophobicContact CG2-CD1 3.71Å; I741-I748 HydrophobicContact CD1-CG2 3.76Å; I741-I748 HydrophobicContact CG1-CG2 4.04Å; I742-I748 CarbonylContact O-C 3.54Å; I742-I748 WeakPolarHBondContact O-CA 3.02Å; N743-I748 HydrophobicContact CB-CD1 4.42Å; N743-I748 HydrophobicContact CB-CG1 4.22Å; N743-I748 WeakPolarHBondContact OD1-CG1 3.49Å; I748-I750 HydrophobicContact CG2-CG1 4.33Å
749	A	90.7	Very high	88.6	Confident	11 Å²	11	33.2 Å²	33.2	9%	0.091	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	132	169.7	0	0	0	0	0	110.2	C711 E712 I741 I742 Y747	C711-A749 WeakPolarHBondContact O-CA 3.23Å; E712-A749 HydrophobicContact CG-CB 4.46Å; I741-A749 WeakPolarHBondContact CA-O 3.18Å; I742-A749 HydrophobicContact CB-CB 4.49Å; I742-A749 PolarHBondContact N-O 3.05Å; I742-A749 PolarHBondContact O-N 2.91Å; Y747-A749 HydrophobicContact CD2-CB 3.77Å; Y747-A749 HydrophobicContact CE2-CB 3.73Å
750	I	92.3	Very high	88.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.5	174	-64.2	149.6	0	0	0	107.1	G710 C711 V734 L739 D740 I741 I748 Y759 V762 L763	G710-I750 CarbonylContact C-O 3.58Å; G710-I750 VanDerWaalsContact CA-O 3.32Å; G710-I750 WeakPolarHBondContact CA-O 3.35Å; C711-I750 PolarHBondContact N-O 2.86Å; C711-I750 PolarHBondContact O-N 2.75Å; V734-I750 HydrophobicContact CG1-CG2 4.33Å; L739-I750 HydrophobicContact CB-CG2 4.13Å; L739-I750 HydrophobicContact CD1-CG2 3.84Å; L739-I750 HydrophobicContact CG-CG2 4.46Å; D740-I750 CarbonylContact O-C 3.54Å; D740-I750 VanDerWaalsContact O-CA 3.31Å; D740-I750 WeakPolarHBondContact O-CA 3.43Å; I741-I750 HydrophobicContact CD1-CG1 4.07Å; I741-I750 HydrophobicContact CG1-CG1 4.32Å; I748-I750 HydrophobicContact CG2-CG1 4.33Å; I750-Y759 HydrophobicContact CB-CE1 4.37Å; I750-Y759 HydrophobicContact CG2-CD1 4.47Å; I750-Y759 HydrophobicContact CG2-CE1 3.87Å; I750-V762 HydrophobicContact CD1-CG1 3.68Å; I750-V762 HydrophobicContact CG1-CG1 4.42Å; I750-L763 HydrophobicContact CD1-CD2 3.79Å
751	T	88	Confident	89.2	Confident	50 Å²	50	35.6 Å²	35.6	31%	0.307	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	156.2	-170.5	58.4	0	0	0	0	114.5	D709 D740	D709-T751 CarbonylContact O-C 3.59Å; D709-T751 WeakPolarHBondContact O-CA 3.28Å; D740-T751 PolarHBondContact N-O 2.89Å; D740-T751 PolarHBondContact O-N 3.1Å
752	G	85.1	Confident	89.5	Confident	6 Å²	6	34.5 Å²	34.5	6%	0.062	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	118.9	138.1	-178.1	0	0	0	0	0	111.9	D709 L739 E754 Y759	D709-G752 PolarHBondContact O-N 2.98Å; L739-G752 WeakPolarHBondContact CD2-O 3.45Å; G752-E754 PolarHBondContact O-N 2.9Å; G752-Y759 PolarHBondContact N-OH 2.82Å; G752-Y759 PolarHBondContact O-OH 2.85Å
753	A	86.9	Confident	89.9	Confident	6 Å²	6	31.6 Å²	31.6	5%	0.05	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	116.3	178.9	0	0	0	0	0	112.3	Y306 S310 L314 T707 L708 D709	Y306-A753 HydrophobicContact CD1-CB 4.17Å; Y306-A753 HydrophobicContact CE1-CB 4.44Å; S310-A753 PolarHBondContact OG-N 3.17Å; L314-A753 HydrophobicContact CD1-CB 4.3Å; L314-A753 HydrophobicContact CG-CB 4.39Å; T707-A753 HydrophobicContact CG2-CB 3.69Å; L708-A753 WeakPolarHBondContact O-CA 3.35Å; D709-A753 HydrophobicContact CB-CB 4.5Å
754	E	89.3	Confident	90.2	Very high	67 Å²	67	31.8 Å²	31.8	31%	0.313	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	161.5	175.8	-177.7	50.4	-102	0	0	110.6	T707 L708 L739 G752 V758 Y759	T707-E754 CarbonylContact C-O 3.59Å; T707-E754 WeakPolarHBondContact CA-O 3.35Å; L708-E754 PolarHBondContact N-O 2.78Å; L708-E754 PolarHBondContact O-N 3.22Å; L739-E754 HydrophobicContact CD2-CB 3.91Å; L739-E754 HydrophobicContact CG-CB 4.47Å; G752-E754 PolarHBondContact O-N 2.9Å; E754-V758 HydrophobicContact CG-CB 3.65Å; E754-V758 HydrophobicContact CG-CG1 3.57Å; E754-V758 HydrophobicContact CG-CG2 3.95Å; E754-Y759 HydrophobicContact CB-CD2 4.48Å; E754-Y759 HydrophobicContact CB-CE2 4.16Å
755	S	89.3	Confident	90.5	Very high	41 Å²	41	31.8 Å²	31.8	29%	0.287	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	147.3	-177	57.2	0	0	0	0	114.3	S757 V758 Y759	S755-S757 VanDerWaalsContact C-N 3.25Å; S755-S757 PolarHBondContact O-N 3.23Å; S755-S757 VanDerWaalsContact O-N 3.15Å; S755-V758 PolarHBondContact O-N 3.46Å; S755-V758 WeakPolarHBondContact OG-CG2 3.02Å; S755-Y759 PolarHBondContact O-N 2.85Å
756	I	90.3	Very high	90.7	Very high	28 Å²	28	28.9 Å²	28.9	14%	0.144	16%	0.164	C	C	.	.	H	α-helix	trans	-49.3	-42.6	178.6	-76.6	176.4	0	0	0	113	I679 C681 H706 L708 V758 Y759 E760	I679-I756 HydrophobicContact CB-CG2 3.85Å; I679-I756 HydrophobicContact CG2-CD1 4.4Å; I679-I756 HydrophobicContact CG2-CG2 4.31Å; C681-I756 HydrophobicContact CB-CD1 4.24Å; H706-I756 HydrophobicContact CB-CD1 3.66Å; H706-I756 HydrophobicContact CB-CG1 4.3Å; L708-I756 HydrophobicContact CD1-CG1 3.99Å; L708-I756 HydrophobicContact CG-CG1 3.89Å; I756-V758 VanDerWaalsContact C-N 3.28Å; I756-V758 PolarHBondContact O-N 2.9Å; I756-Y759 PolarHBondContact O-N 3.4Å; I756-E760 HydrophobicContact CG2-CG 4.16Å; I756-E760 WeakPolarHBondContact O-CG 3.41Å; I756-E760 PolarHBondContact O-N 3.17Å
757	S	90.6	Very high	91.1	Very high	68 Å²	68	31.7 Å²	31.7	48%	0.476	17%	0.168	S	C	.	.	H	α-helix	trans	-63.2	-32.8	-177.3	48.2	0	0	0	0	113.3	S755 D761	S755-S757 VanDerWaalsContact C-N 3.25Å; S755-S757 PolarHBondContact O-N 3.23Å; S755-S757 VanDerWaalsContact O-N 3.15Å; S757-D761 PolarHBondContact O-N 3.37Å; S757-D761 VanDerWaalsContact O-N 3.09Å
758	V	92.1	Very high	91.2	Very high	22 Å²	22	28.7 Å²	28.7	13%	0.133	16%	0.156	C	C	.	.	H	α-helix	trans	-72.4	-41.8	176.1	170.3	0	0	0	0	110.9	R737 L739 E754 S755 I756 D761 V762	R737-V758 HydrophobicContact CB-CG1 3.98Å; R737-V758 HydrophobicContact CG-CG1 4.24Å; L739-V758 HydrophobicContact CD1-CG1 4.04Å; E754-V758 HydrophobicContact CG-CB 3.65Å; E754-V758 HydrophobicContact CG-CG1 3.57Å; E754-V758 HydrophobicContact CG-CG2 3.95Å; S755-V758 PolarHBondContact O-N 3.46Å; S755-V758 WeakPolarHBondContact OG-CG2 3.02Å; I756-V758 VanDerWaalsContact C-N 3.28Å; I756-V758 PolarHBondContact O-N 2.9Å; V758-D761 PolarHBondContact O-N 3.48Å; V758-V762 WeakPolarHBondContact O-CG2 3.28Å; V758-V762 PolarHBondContact O-N 3.34Å
759	Y	93.3	Very high	91.2	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63	-42.3	173	-91.6	-86.2	0	0	0	112.1	L708 D709 C711 L739 I750 G752 E754 S755 I756 D761 V762 L763	L708-Y759 HydrophobicContact CB-CD2 3.71Å; L708-Y759 HydrophobicContact CB-CE2 3.81Å; L708-Y759 HydrophobicContact CB-CG 4.11Å; L708-Y759 HydrophobicContact CD1-CD2 4.36Å; L708-Y759 HydrophobicContact CD1-CG 4.05Å; L708-Y759 VanDerWaalsContact O-CE2 3.24Å; L708-Y759 WeakPolarHBondContact O-CE2 3.41Å; D709-Y759 VanDerWaalsContact C-OH 3.28Å; D709-Y759 PolarHBondContact O-OH 2.86Å; C711-Y759 HydrophobicContact CB-CD1 4.03Å; C711-Y759 HydrophobicContact CB-CE1 4.06Å; C711-Y759 WeakPolarHBondContact SG-CD1 3.33Å; L739-Y759 HydrophobicContact CD1-CD2 4.36Å; L739-Y759 HydrophobicContact CD1-CE1 4.43Å; L739-Y759 HydrophobicContact CD1-CE2 4.11Å; L739-Y759 HydrophobicContact CD2-CE2 3.81Å; I750-Y759 HydrophobicContact CB-CE1 4.37Å; I750-Y759 HydrophobicContact CG2-CD1 4.47Å; I750-Y759 HydrophobicContact CG2-CE1 3.87Å; G752-Y759 PolarHBondContact N-OH 2.82Å; G752-Y759 PolarHBondContact O-OH 2.85Å; E754-Y759 HydrophobicContact CB-CD2 4.48Å; E754-Y759 HydrophobicContact CB-CE2 4.16Å; S755-Y759 PolarHBondContact O-N 2.85Å; I756-Y759 PolarHBondContact O-N 3.4Å; Y759-D761 PolarHBondContact O-N 2.58Å; Y759-V762 PolarHBondContact O-N 3.4Å; Y759-L763 VanDerWaalsContact O-CB 3.29Å; Y759-L763 WeakPolarHBondContact O-CB 3.22Å; Y759-L763 WeakPolarHBondContact O-CD1 3.29Å; Y759-L763 WeakPolarHBondContact O-CG 3.41Å; Y759-L763 PolarHBondContact O-N 3.26Å
760	E	92.6	Very high	91.2	Very high	25 Å²	25	32.9 Å²	32.9	12%	0.117	17%	0.17	C	C	.	.	H	α-helix	trans	-57	-50.1	173.5	-75.2	-169.6	159.5	0	0	111.9	R678 I679 I756 V762 L763 R764	R678-E760 VanDerWaalsContact CA-OE1 3.25Å; R678-E760 WeakPolarHBondContact CA-OE1 3.41Å; I679-E760 HydrophobicContact CB-CG 4.34Å; I679-E760 HydrophobicContact CD1-CG 4.18Å; I679-E760 HydrophobicContact CG1-CG 3.98Å; I679-E760 PolarHBondContact N-OE1 3.36Å; I756-E760 HydrophobicContact CG2-CG 4.16Å; I756-E760 WeakPolarHBondContact O-CG 3.41Å; I756-E760 PolarHBondContact O-N 3.17Å; E760-V762 PolarHBondContact O-N 2.87Å; E760-L763 PolarHBondContact O-N 3.1Å; E760-R764 VanDerWaalsContact O-CB 3.28Å; E760-R764 WeakPolarHBondContact O-CB 3.14Å; E760-R764 WeakPolarHBondContact O-CD 3.4Å; E760-R764 WeakPolarHBondContact O-CG 3.32Å; E760-R764 PolarHBondContact O-N 2.97Å; E760-R764 IonicContact OE1-NH2 2.66Å; E760-R764 IonicContact OE2-CZ 3.29Å; E760-R764 VanDerWaalsContact OE2-CZ 3.26Å; E760-R764 IonicContact OE2-NH1 3.4Å; E760-R764 PolarHBondContact OE2-NH1 3.37Å; E760-R764 VanDerWaalsContact OE2-NH1 3.12Å; E760-R764 IonicContact OE2-NH2 3.02Å; E760-R764 PolarHBondContact OE2-NH2 2.91Å
761	D	92.3	Very high	91	Very high	71 Å²	71	34.6 Å²	34.6	38%	0.38	18%	0.184	S	C	.	.	H	α-helix	trans	-58	-45.8	178.6	-84.9	-4.8	0	0	0	112.7	R737 S757 V758 Y759 R764 S765	R737-D761 IonicContact CZ-OD2 3.8Å; R737-D761 VanDerWaalsContact CZ-OD2 3.27Å; R737-D761 VanDerWaalsContact NH1-CB 3.27Å; R737-D761 IonicContact NH1-OD2 3.32Å; R737-D761 PolarHBondContact NH1-OD2 3.18Å; R737-D761 IonicContact NH2-OD2 3.91Å; R737-D761 PolarHBondContact NH2-OD2 3.16Å; S757-D761 PolarHBondContact O-N 3.37Å; S757-D761 VanDerWaalsContact O-N 3.09Å; V758-D761 PolarHBondContact O-N 3.48Å; Y759-D761 PolarHBondContact O-N 2.58Å; D761-R764 IonicContact OD1-NH1 2.89Å; D761-S765 PolarHBondContact O-N 3.17Å
762	V	93.6	Very high	90.6	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.018	21%	0.207	C	C	.	.	H	α-helix	trans	-67.1	-45.5	-179.9	173.4	0	0	0	0	110.5	V734 L739 I750 V758 Y759 E760 R764 S765 V766	V734-V762 HydrophobicContact CG2-CG1 3.74Å; L739-V762 HydrophobicContact CD1-CG2 4.48Å; I750-V762 HydrophobicContact CD1-CG1 3.68Å; I750-V762 HydrophobicContact CG1-CG1 4.42Å; V758-V762 WeakPolarHBondContact O-CG2 3.28Å; V758-V762 PolarHBondContact O-N 3.34Å; Y759-V762 PolarHBondContact O-N 3.4Å; E760-V762 PolarHBondContact O-N 2.87Å; V762-R764 PolarHBondContact O-N 3.16Å; V762-S765 WeakPolarHBondContact O-CA 3.43Å; V762-S765 VanDerWaalsContact O-CB 3.3Å; V762-S765 WeakPolarHBondContact O-CB 3.47Å; V762-S765 PolarHBondContact O-N 3.38Å; V762-S765 PolarHBondContact O-OG 2.97Å; V762-V766 PolarHBondContact O-N 2.8Å
763	L	93.7	Very high	90.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-69.2	-33.9	-178.8	-68.6	168.7	0	0	0	112.7	L677 I679 C711 V713 I750 Y759 E760 S765 V766 L783	L677-L763 HydrophobicContact CD2-CB 3.44Å; L677-L763 VanDerWaalsContact CD2-CB 3.44Å; L677-L763 HydrophobicContact CD2-CD1 3.66Å; L677-L763 HydrophobicContact CD2-CG 4.21Å; I679-L763 HydrophobicContact CD1-CD1 4.26Å; C711-L763 HydrophobicContact CB-CD1 3.94Å; C711-L763 HydrophobicContact CB-CD2 4.23Å; V713-L763 HydrophobicContact CG2-CD2 4.13Å; I750-L763 HydrophobicContact CD1-CD2 3.79Å; Y759-L763 VanDerWaalsContact O-CB 3.29Å; Y759-L763 WeakPolarHBondContact O-CB 3.22Å; Y759-L763 WeakPolarHBondContact O-CD1 3.29Å; Y759-L763 WeakPolarHBondContact O-CG 3.41Å; Y759-L763 PolarHBondContact O-N 3.26Å; E760-L763 PolarHBondContact O-N 3.1Å; L763-S765 PolarHBondContact O-N 3.19Å; L763-V766 HydrophobicContact CD2-CG2 4.41Å; L763-V766 WeakPolarHBondContact O-CB 3.18Å; L763-V766 WeakPolarHBondContact O-CG2 3.37Å; L763-V766 PolarHBondContact O-N 3.01Å; L763-L783 HydrophobicContact CD1-CD1 4.11Å; L763-L783 HydrophobicContact CD1-CD2 4.34Å; L763-L783 HydrophobicContact CD2-CD1 3.86Å
764	R	92.7	Very high	89.5	Confident	76 Å²	76	46.3 Å²	46.3	29%	0.287	25%	0.245	S	C	.	.	H	α-helix	trans	-62.2	-23.6	168.9	-72.8	166.6	-176.5	145.3	2.9	112.7	F674 L677 E760 D761 V762	F674-R764 WeakPolarHBondContact O-CG 3.43Å; L677-R764 HydrophobicContact CB-CG 4.23Å; L677-R764 VanDerWaalsContact O-CZ 3.29Å; L677-R764 PolarHBondContact O-NE 2.78Å; L677-R764 VanDerWaalsContact O-NE 3.07Å; L677-R764 PolarHBondContact O-NH2 2.83Å; E760-R764 VanDerWaalsContact O-CB 3.28Å; E760-R764 WeakPolarHBondContact O-CB 3.14Å; E760-R764 WeakPolarHBondContact O-CD 3.4Å; E760-R764 WeakPolarHBondContact O-CG 3.32Å; E760-R764 PolarHBondContact O-N 2.97Å; E760-R764 IonicContact OE1-NH2 2.66Å; E760-R764 IonicContact OE2-CZ 3.29Å; E760-R764 VanDerWaalsContact OE2-CZ 3.26Å; E760-R764 IonicContact OE2-NH1 3.4Å; E760-R764 PolarHBondContact OE2-NH1 3.37Å; E760-R764 VanDerWaalsContact OE2-NH1 3.12Å; E760-R764 IonicContact OE2-NH2 3.02Å; E760-R764 PolarHBondContact OE2-NH2 2.91Å; D761-R764 IonicContact OD1-NH1 2.89Å; V762-R764 PolarHBondContact O-N 3.16Å
765	S	92.2	Very high	88.4	Confident	39 Å²	39	45.2 Å²	45.2	27%	0.273	25%	0.253	S	S	.	.	H	α-helix	trans	-80.9	-19.8	177.8	86.8	0	0	0	0	114.1	D761 V762 L763 R767	D761-S765 PolarHBondContact O-N 3.17Å; V762-S765 WeakPolarHBondContact O-CA 3.43Å; V762-S765 VanDerWaalsContact O-CB 3.3Å; V762-S765 WeakPolarHBondContact O-CB 3.47Å; V762-S765 PolarHBondContact O-N 3.38Å; V762-S765 PolarHBondContact O-OG 2.97Å; L763-S765 PolarHBondContact O-N 3.19Å; S765-R767 WeakPolarHBondContact O-CD 3.2Å; S765-R767 WeakPolarHBondContact O-CG 3.3Å; S765-R767 PolarHBondContact O-N 2.9Å
766	V	92.8	Very high	87.8	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.25	C	S	.	.			trans	-62.1	122.6	-177.1	-178.5	0	0	0	0	110.6	P672 L673 L727 V729 V762 L763	P672-V766 WeakPolarHBondContact CA-O 3.18Å; L673-V766 HydrophobicContact CD1-CG1 4.44Å; L673-V766 PolarHBondContact N-O 3.31Å; L727-V766 HydrophobicContact CD2-CG1 4.45Å; V729-V766 HydrophobicContact CG2-CB 4.33Å; V729-V766 HydrophobicContact CG2-CG1 4.17Å; V729-V766 HydrophobicContact CG2-CG2 3.87Å; V762-V766 PolarHBondContact O-N 2.8Å; L763-V766 HydrophobicContact CD2-CG2 4.41Å; L763-V766 WeakPolarHBondContact O-CB 3.18Å; L763-V766 WeakPolarHBondContact O-CG2 3.37Å; L763-V766 PolarHBondContact O-N 3.01Å
767	R	92.9	Very high	87.4	Confident	90 Å²	90	52.2 Å²	52.2	34%	0.34	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	148.5	-175.9	-73.3	146.8	179	-71.5	-11.3	111.4	R669 V671 P672 L727 L728 S765	R669-R767 WeakPolarHBondContact O-CD 3.46Å; R669-R767 PolarHBondContact O-NH1 2.9Å; V671-R767 CarbonylContact O-C 3.57Å; V671-R767 VanDerWaalsContact O-CA 3.28Å; V671-R767 WeakPolarHBondContact O-CA 3.28Å; P672-R767 HydrophobicContact CB-CG 4.2Å; L727-R767 CarbonylContact C-O 3.46Å; L727-R767 WeakPolarHBondContact CA-O 3.35Å; L728-R767 HydrophobicContact CB-CB 4.09Å; L728-R767 PolarHBondContact N-O 2.93Å; L728-R767 PolarHBondContact O-N 2.79Å; S765-R767 WeakPolarHBondContact O-CD 3.2Å; S765-R767 WeakPolarHBondContact O-CG 3.3Å; S765-R767 PolarHBondContact O-N 2.9Å
768	Y	93.4	Very high	87.3	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	136.1	171.1	177	-108.9	0	0	0	110.3	F665 G670 V671 L720 E725 E726 L727 L770 F781 F803	F665-Y768 AromaticContact CD1-CD1 3.74Å; F665-Y768 HydrophobicContact CD1-CD1 3.74Å; F665-Y768 HydrophobicContact CD1-CE1 4.4Å; F665-Y768 HydrophobicContact CE1-CD1 4.1Å; G670-Y768 VanDerWaalsContact CA-O 3.22Å; G670-Y768 WeakPolarHBondContact CA-O 3.36Å; V671-Y768 PolarHBondContact N-O 2.95Å; V671-Y768 PolarHBondContact O-N 2.87Å; L720-Y768 HydrophobicContact CD2-CE2 4.17Å; E725-Y768 HydrophobicContact CB-CE2 3.79Å; E725-Y768 WeakPolarHBondContact CB-OH 3.44Å; E725-Y768 PolarHBondContact OE2-OH 2.78Å; E726-Y768 WeakPolarHBondContact O-CD2 3.38Å; L727-Y768 HydrophobicContact CD2-CD2 4Å; Y768-L770 HydrophobicContact CE1-CD1 4.43Å; Y768-L770 HydrophobicContact CE1-CD2 3.88Å; Y768-L770 HydrophobicContact CE1-CG 3.78Å; Y768-L770 VanDerWaalsContact OH-CD2 3.23Å; Y768-L770 WeakPolarHBondContact OH-CD2 3.45Å; Y768-F781 HydrophobicContact CD2-CE1 4.34Å; Y768-F781 HydrophobicContact CD2-CE2 4.13Å; Y768-F781 AromaticContact CD2-CZ 3.47Å; Y768-F781 HydrophobicContact CD2-CZ 3.47Å; Y768-F781 VanDerWaalsContact CD2-CZ 3.47Å; Y768-F781 HydrophobicContact CE2-CE2 4.32Å; Y768-F781 AromaticContact CE2-CZ 3.57Å; Y768-F781 HydrophobicContact CE2-CZ 3.57Å; Y768-F781 HydrophobicContact CG-CE2 4.23Å; Y768-F781 HydrophobicContact CG-CZ 4.03Å; Y768-F803 HydrophobicContact CD1-CE1 4.27Å; Y768-F803 HydrophobicContact CD1-CZ 4.32Å; Y768-F803 AromaticContact CE1-CE1 3.73Å; Y768-F803 HydrophobicContact CE1-CE1 3.73Å; Y768-F803 AromaticContact CE1-CZ 3.49Å; Y768-F803 HydrophobicContact CE1-CZ 3.49Å; Y768-F803 VanDerWaalsContact CE1-CZ 3.49Å
769	R	91.8	Very high	87.3	Confident	90 Å²	90	52.9 Å²	52.9	34%	0.34	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	138.1	179	-176	169.1	71.9	128.9	-0.5	110	F665 E725 E726 L728	F665-R769 WeakPolarHBondContact O-CA 3.02Å; F665-R769 WeakPolarHBondContact O-CG 3.41Å; E725-R769 WeakPolarHBondContact CA-O 3.35Å; E726-R769 VanDerWaalsContact CD-NE 3.34Å; E726-R769 HydrophobicContact CG-CB 3.93Å; E726-R769 PolarHBondContact N-O 3.33Å; E726-R769 VanDerWaalsContact N-O 3.07Å; E726-R769 PolarHBondContact O-N 3.35Å; E726-R769 IonicContact OE1-CZ 3.79Å; E726-R769 IonicContact OE1-NE 3.1Å; E726-R769 PolarHBondContact OE1-NE 3.1Å; E726-R769 IonicContact OE1-NH2 2.95Å; E726-R769 PolarHBondContact OE1-NH2 3.27Å; E726-R769 IonicContact OE2-CZ 3.82Å; E726-R769 IonicContact OE2-NE 2.74Å; E726-R769 IonicContact OE2-NH2 4Å; E726-R769 PolarHBondContact OE2-NH2 2.87Å; L728-R769 HydrophobicContact CD1-CB 4.03Å
770	L	90.7	Very high	87.3	Confident	8 Å²	8	58.3 Å²	58.3	4%	0.042	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	145.3	171.6	-78.1	177	0	0	0	110.3	F665 E725 Y768 F803	F665-L770 HydrophobicContact CB-CB 4.05Å; F665-L770 HydrophobicContact CB-CD1 3.97Å; F665-L770 HydrophobicContact CB-CG 4.03Å; F665-L770 PolarHBondContact O-N 3.36Å; E725-L770 HydrophobicContact CB-CD2 4.06Å; Y768-L770 HydrophobicContact CE1-CD1 4.43Å; Y768-L770 HydrophobicContact CE1-CD2 3.88Å; Y768-L770 HydrophobicContact CE1-CG 3.78Å; Y768-L770 VanDerWaalsContact OH-CD2 3.23Å; Y768-L770 WeakPolarHBondContact OH-CD2 3.45Å; L770-F803 HydrophobicContact CD1-CD1 3.68Å; L770-F803 HydrophobicContact CD1-CD2 4.33Å; L770-F803 HydrophobicContact CD1-CE1 3.73Å; L770-F803 HydrophobicContact CD1-CE2 4.38Å; L770-F803 HydrophobicContact CD1-CG 4.03Å; L770-F803 HydrophobicContact CD1-CZ 4.12Å; L770-F803 HydrophobicContact CG-CE1 4.45Å
771	A	86.8	Confident	87.4	Confident	37 Å²	37	57.1 Å²	57.1	31%	0.306	28%	0.284	S	S	.	.			trans	-71.5	148.7	163.5	0	0	0	0	0	110.2	E723 R724 G773 S774	E723-A771 WeakPolarHBondContact O-CB 3.45Å; R724-A771 PolarHBondContact O-N 2.67Å; A771-G773 PolarHBondContact O-N 2.8Å; A771-S774 WeakPolarHBondContact O-CB 3.36Å; A771-S774 PolarHBondContact O-N 3.07Å; A771-S774 PolarHBondContact O-OG 2.84Å
772	R	80.9	Confident	87.5	Confident	210 Å²	210	57.2 Å²	57.2	79%	0.792	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	129.6	-178.3	-75.2	-176.5	176.2	179.6	-1.9	112.2	E666 S774	E666-R772 HydrophobicContact CB-CG 4.06Å; E666-R772 HydrophobicContact CG-CG 4.3Å; E666-R772 WeakPolarHBondContact OE1-CA 3.45Å; R772-S774 VanDerWaalsContact C-N 3.28Å; R772-S774 PolarHBondContact O-N 3.24Å
773	G	73.6	Confident	87.5	Confident	69 Å²	69	57 Å²	57	71%	0.711	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	17.2	179.4	0	0	0	0	0	114.4	E666 A771 G775	E666-G773 PolarHBondContact OE1-N 2.78Å; A771-G773 PolarHBondContact O-N 2.8Å; G773-G775 PolarHBondContact O-N 2.8Å; G773-G775 VanDerWaalsContact O-N 3.17Å
774	S	74.4	Confident	87.6	Confident	28 Å²	28	58.8 Å²	58.8	20%	0.196	29%	0.29	C	S	.	.			trans	-63.6	-14.7	-179.6	48.6	0	0	0	0	115	A771 R772 R776	A771-S774 WeakPolarHBondContact O-CB 3.36Å; A771-S774 PolarHBondContact O-N 3.07Å; A771-S774 PolarHBondContact O-OG 2.84Å; R772-S774 VanDerWaalsContact C-N 3.28Å; R772-S774 PolarHBondContact O-N 3.24Å; S774-R776 PolarHBondContact O-N 2.81Å; S774-R776 VanDerWaalsContact O-N 3.13Å
775	G	67.6	Low	87.6	Confident	45 Å²	45	55.3 Å²	55.3	46%	0.464	28%	0.278	S	S	.	.			trans	68.5	11.2	166.3	0	0	0	0	0	116.4	G773	G773-G775 PolarHBondContact O-N 2.8Å; G773-G775 VanDerWaalsContact O-N 3.17Å
776	R	76.6	Confident	87.5	Confident	63 Å²	63	54.3 Å²	54.3	24%	0.238	27%	0.271	C	S	.	.			trans	-74.6	142.3	178.1	-162.9	-176.4	-93.1	-65.3	3.1	110.2	E725 S774 E778 F803 H805	E725-R776 IonicContact OE1-CZ 3.42Å; E725-R776 IonicContact OE1-NE 3.73Å; E725-R776 IonicContact OE1-NH2 2.74Å; E725-R776 PolarHBondContact OE1-NH2 3.04Å; E725-R776 IonicContact OE2-CZ 3.62Å; E725-R776 IonicContact OE2-NE 2.77Å; E725-R776 PolarHBondContact OE2-NE 2.91Å; E725-R776 IonicContact OE2-NH2 2.84Å; E725-R776 PolarHBondContact OE2-NH2 3.09Å; S774-R776 PolarHBondContact O-N 2.81Å; S774-R776 VanDerWaalsContact O-N 3.13Å; R776-E778 VanDerWaalsContact CD-O 3.28Å; R776-E778 WeakPolarHBondContact CD-O 3.48Å; R776-E778 VanDerWaalsContact CG-O 3.23Å; R776-E778 WeakPolarHBondContact CG-O 3.35Å; R776-F803 HydrophobicContact CB-CD2 4.11Å; R776-F803 HydrophobicContact CB-CE2 4.17Å; R776-F803 HydrophobicContact CG-CD2 4.15Å; R776-F803 HydrophobicContact CG-CE2 3.85Å; R776-F803 WeakPolarHBondContact O-CB 3.39Å; R776-F803 VanDerWaalsContact O-CD2 3.32Å; R776-F803 WeakPolarHBondContact O-CD2 3.06Å; R776-H805 PolarHBondContact O-NE2 2.91Å
777	F	80.9	Confident	87.2	Confident	152 Å²	152	54.5 Å²	54.5	67%	0.667	27%	0.272	S	S	*	.			trans	-106.4	-36	177.8	-67.5	-81.2	0	0	0	113.6	F803 H805	F777-F803 VanDerWaalsContact C-CD2 3.42Å; F777-F803 WeakPolarHBondContact O-CD2 3.48Å; F777-F803 PolarHBondContact O-N 3.01Å; F777-H805 AromaticContact CD1-CD2 3.81Å; F777-H805 AromaticContact CE1-CD2 3.78Å
778	E	88.8	Confident	86.4	Confident	97 Å²	97	50.7 Å²	50.7	45%	0.453	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	152.6	174.7	62.7	171	-108	0	0	111.5	R776 R780 V801 N802	R776-E778 VanDerWaalsContact CD-O 3.28Å; R776-E778 WeakPolarHBondContact CD-O 3.48Å; R776-E778 VanDerWaalsContact CG-O 3.23Å; R776-E778 WeakPolarHBondContact CG-O 3.35Å; E778-R780 IonicContact OE1-NE 3.75Å; E778-R780 IonicContact OE1-NH2 3.65Å; E778-V801 CarbonylContact C-O 3.15Å; E778-V801 WeakPolarHBondContact CA-O 3.48Å; E778-N802 WeakPolarHBondContact CB-OD1 3.36Å
779	R	92.3	Very high	85.6	Confident	8 Å²	8	54 Å²	54	3%	0.03	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	144.7	162.6	-163.1	52.5	148.5	130.9	-11.4	109.1	L716 E718 E719 E725 F781 V801 F803	L716-R779 PolarHBondContact O-NH1 2.87Å; L716-R779 VanDerWaalsContact O-NH1 3.1Å; E718-R779 VanDerWaalsContact O-CZ 3.27Å; E718-R779 PolarHBondContact O-NH1 2.97Å; E718-R779 PolarHBondContact O-NH2 2.66Å; E719-R779 PolarHBondContact O-NH2 3.25Å; E725-R779 IonicContact OE1-CZ 3.63Å; E725-R779 IonicContact OE1-NE 3.92Å; E725-R779 PolarHBondContact OE1-NE 2.96Å; E725-R779 IonicContact OE1-NH2 3.17Å; E725-R779 PolarHBondContact OE1-NH2 3.05Å; E725-R779 IonicContact OE2-CZ 2.8Å; E725-R779 IonicContact OE2-NE 3.62Å; E725-R779 PolarHBondContact OE2-NE 2.85Å; E725-R779 IonicContact OE2-NH2 3.9Å; R779-F781 HydrophobicContact CB-CE2 4.06Å; R779-F781 HydrophobicContact CB-CZ 4.45Å; R779-F781 HydrophobicContact CG-CE1 4.46Å; R779-F781 HydrophobicContact CG-CE2 3.67Å; R779-F781 HydrophobicContact CG-CZ 3.61Å; R779-V801 PolarHBondContact N-O 2.57Å; R779-V801 PolarHBondContact O-N 2.85Å; R779-F803 HydrophobicContact CB-CE2 3.98Å; R779-F803 HydrophobicContact CB-CZ 3.93Å
780	R	92.9	Very high	84.9	Confident	113 Å²	113	51.6 Å²	51.6	43%	0.426	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	142.5	175.9	-78.4	178.9	-77.5	151	-3.5	111.1	L716 E778 L799 E800	L716-R780 HydrophobicContact CB-CB 4Å; L716-R780 HydrophobicContact CD1-CB 4.27Å; L716-R780 PolarHBondContact N-O 3.09Å; E778-R780 IonicContact OE1-NE 3.75Å; E778-R780 IonicContact OE1-NH2 3.65Å; R780-L799 CarbonylContact C-O 3.54Å; R780-L799 WeakPolarHBondContact CA-O 3.49Å; R780-E800 HydrophobicContact CG-CB 3.9Å; R780-E800 HydrophobicContact CG-CG 3.83Å
781	F	94	Very high	84.3	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	146.8	176.7	-63.3	-81.8	0	0	0	109.9	L673 F674 Q714 P715 L720 L727 Y768 R779 T798 L799 V801	L673-F781 HydrophobicContact CD1-CB 4.46Å; L673-F781 HydrophobicContact CD1-CD1 4.2Å; L673-F781 HydrophobicContact CD1-CD2 3.94Å; L673-F781 HydrophobicContact CD1-CE1 4.5Å; L673-F781 HydrophobicContact CD1-CE2 4.25Å; L673-F781 HydrophobicContact CD1-CG 3.93Å; L673-F781 HydrophobicContact CD2-CD2 4.06Å; L673-F781 HydrophobicContact CD2-CE2 4.14Å; F674-F781 HydrophobicContact CZ-CB 4.47Å; Q714-F781 CarbonylContact O-C 3.57Å; Q714-F781 WeakPolarHBondContact O-CA 3.39Å; P715-F781 HydrophobicContact CB-CD1 4.31Å; P715-F781 HydrophobicContact CB-CE1 4.13Å; L720-F781 HydrophobicContact CD2-CE1 4.32Å; L727-F781 HydrophobicContact CD1-CE1 4.23Å; L727-F781 HydrophobicContact CD2-CE1 3.97Å; L727-F781 HydrophobicContact CD2-CZ 4.33Å; L727-F781 HydrophobicContact CG-CE1 4.36Å; Y768-F781 HydrophobicContact CD2-CE1 4.34Å; Y768-F781 HydrophobicContact CD2-CE2 4.13Å; Y768-F781 AromaticContact CD2-CZ 3.47Å; Y768-F781 HydrophobicContact CD2-CZ 3.47Å; Y768-F781 VanDerWaalsContact CD2-CZ 3.47Å; Y768-F781 HydrophobicContact CE2-CE2 4.32Å; Y768-F781 AromaticContact CE2-CZ 3.57Å; Y768-F781 HydrophobicContact CE2-CZ 3.57Å; Y768-F781 HydrophobicContact CG-CE2 4.23Å; Y768-F781 HydrophobicContact CG-CZ 4.03Å; R779-F781 HydrophobicContact CB-CE2 4.06Å; R779-F781 HydrophobicContact CB-CZ 4.45Å; R779-F781 HydrophobicContact CG-CE1 4.46Å; R779-F781 HydrophobicContact CG-CE2 3.67Å; R779-F781 HydrophobicContact CG-CZ 3.61Å; F781-T798 CarbonylContact O-C 3.56Å; F781-T798 WeakPolarHBondContact O-CA 3.34Å; F781-L799 PolarHBondContact N-O 2.84Å; F781-L799 PolarHBondContact O-N 2.85Å; F781-V801 HydrophobicContact CD2-CG2 3.85Å; F781-V801 HydrophobicContact CE2-CG2 3.99Å
782	R	94.1	Very high	84	Confident	73 Å²	73	54.9 Å²	54.9	28%	0.275	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	136.4	171.2	173.9	-177.2	-66.9	-170.7	-9.7	108.5	V713 Q714 L716 E796	V713-R782 CarbonylContact C-O 3.55Å; V713-R782 WeakPolarHBondContact CA-O 3.42Å; Q714-R782 PolarHBondContact N-O 3.36Å; Q714-R782 PolarHBondContact O-N 3.24Å; L716-R782 HydrophobicContact CD1-CB 4.3Å; L716-R782 HydrophobicContact CD2-CB 3.96Å; L716-R782 HydrophobicContact CG-CB 4.15Å; R782-E796 WeakPolarHBondContact CD-OE1 3.44Å; R782-E796 HydrophobicContact CG-CB 4.25Å; R782-E796 HydrophobicContact CG-CG 4.41Å; R782-E796 IonicContact CZ-OE1 3.12Å; R782-E796 IonicContact CZ-OE2 3.88Å; R782-E796 VanDerWaalsContact NE-CD 3.31Å; R782-E796 IonicContact NE-OE1 3.25Å; R782-E796 PolarHBondContact NE-OE1 3.04Å; R782-E796 IonicContact NE-OE2 3.66Å; R782-E796 PolarHBondContact NE-OE2 3.24Å; R782-E796 VanDerWaalsContact NE-OE2 3.1Å; R782-E796 IonicContact NH1-OE1 3.53Å; R782-E796 PolarHBondContact NH1-OE1 2.81Å; R782-E796 IonicContact NH1-OE2 2.99Å; R782-E796 IonicContact NH2-OE1 3.69Å; R782-E796 PolarHBondContact NH2-OE1 3.31Å; R782-E796 IonicContact NH2-OE2 2.65Å; R782-E796 PolarHBondContact NH2-OE2 2.82Å
783	L	94.6	Very high	84.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	134	164.3	171.9	66.8	0	0	0	109.2	L651 F674 L677 C711 E712 V713 L763 L797	L651-L783 HydrophobicContact CD1-CB 4.43Å; L651-L783 HydrophobicContact CD1-CD2 4.1Å; L651-L783 HydrophobicContact CD1-CG 3.79Å; L651-L783 WeakPolarHBondContact CD1-O 3.47Å; F674-L783 HydrophobicContact CD1-CD2 4.46Å; F674-L783 HydrophobicContact CD2-CD2 4.41Å; F674-L783 HydrophobicContact CE1-CB 4.08Å; F674-L783 HydrophobicContact CE2-CB 4.26Å; F674-L783 HydrophobicContact CG-CD2 4.38Å; F674-L783 HydrophobicContact CZ-CB 3.81Å; L677-L783 HydrophobicContact CD1-CD2 3.63Å; L677-L783 HydrophobicContact CD2-CD2 3.79Å; L677-L783 HydrophobicContact CG-CD2 4.39Å; C711-L783 HydrophobicContact CB-CD1 4.31Å; E712-L783 WeakPolarHBondContact O-CA 3.4Å; V713-L783 HydrophobicContact CG2-CD1 3.81Å; L763-L783 HydrophobicContact CD1-CD1 4.11Å; L763-L783 HydrophobicContact CD1-CD2 4.34Å; L763-L783 HydrophobicContact CD2-CD1 3.86Å; L783-L797 HydrophobicContact CB-CB 4.35Å; L783-L797 HydrophobicContact CD2-CD2 4.39Å; L783-L797 PolarHBondContact N-O 3.21Å; L783-L797 PolarHBondContact O-N 2.76Å
784	S	95.1	Very high	85.3	Confident	37 Å²	37	46.9 Å²	46.9	26%	0.259	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	156.7	167	56.1	0	0	0	0	109.9	C711 E712	C711-S784 CarbonylContact C-O 3.6Å; C711-S784 WeakPolarHBondContact CA-O 3.39Å; E712-S784 PolarHBondContact N-O 3.22Å; E712-S784 PolarHBondContact O-N 3.36Å; E712-S784 VanDerWaalsContact O-N 3.12Å
785	C	94.1	Very high	86	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.02	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	158.2	175.7	-70.3	0	0	0	0	111.6	L651 L708 G710 C711 T793 S794	L651-C785 HydrophobicContact CD2-CB 4.36Å; L708-C785 HydrophobicContact CD1-CB 4.37Å; L708-C785 HydrophobicContact CD2-CB 4.45Å; G710-C785 CarbonylContact O-C 3.57Å; G710-C785 VanDerWaalsContact O-CA 3.27Å; G710-C785 WeakPolarHBondContact O-CA 3.41Å; C711-C785 HydrophobicContact CB-CB 4.14Å; C711-C785 WeakPolarHBondContact CB-SG 3.47Å; C711-C785 WeakPolarHBondContact SG-CB 3.13Å; C711-C785 CovalentContact SG-SG 2.04Å; C711-C785 PolarHBondContact SG-SG 3.18Å; C785-T793 CarbonylContact O-C 3.52Å; C785-T793 WeakPolarHBondContact O-CA 3.28Å; C785-S794 PolarHBondContact N-OG 2.89Å; C785-S794 PolarHBondContact O-N 2.95Å
786	S	90.4	Very high	87.1	Confident	18 Å²	18	51.7 Å²	51.7	13%	0.126	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	156.2	178.3	64.7	0	0	0	0	113.8	L708 D709 G710 Y792	L708-S786 WeakPolarHBondContact CA-O 3.19Å; L708-S786 WeakPolarHBondContact CD2-O 3.13Å; D709-S786 PolarHBondContact N-O 3.1Å; D709-S786 PolarHBondContact OD1-OG 3.38Å; G710-S786 PolarHBondContact N-OG 3.07Å; G710-S786 PolarHBondContact O-N 3.17Å; G710-S786 PolarHBondContact O-OG 2.99Å; S786-Y792 CarbonylContact C-O 3.6Å; S786-Y792 VanDerWaalsContact CA-O 3.27Å; S786-Y792 WeakPolarHBondContact CA-O 3.17Å
787	E	84.9	Confident	87.9	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.019	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	145.1	163.8	-176.5	166.2	-141.1	0	0	107.8	Y306 I649 H706 T707 Y792	Y306-E787 HydrophobicContact CE1-CG 4.45Å; I649-E787 HydrophobicContact CD1-CB 3.83Å; H706-E787 WeakPolarHBondContact CA-OE1 3.37Å; H706-E787 IonicContact CE1-OE2 2.75Å; H706-E787 IonicContact CG-OE1 2.67Å; H706-E787 IonicContact CG-OE2 3.13Å; H706-E787 IonicContact ND1-OE1 2.72Å; H706-E787 PolarHBondContact ND1-OE1 2.75Å; H706-E787 IonicContact ND1-OE2 2.81Å; H706-E787 PolarHBondContact ND1-OE2 2.99Å; T707-E787 PolarHBondContact N-OE1 2.96Å; T707-E787 WeakPolarHBondContact O-CG 3.49Å; E787-Y792 PolarHBondContact N-O 3.1Å; E787-Y792 PolarHBondContact O-N 3.39Å
788	M	76.5	Confident	88.4	Confident	9 Å²	9	45.4 Å²	45.4	4%	0.044	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	57	-175.6	-67.9	165.2	-88	0	0	113.6	S305 Y306 F607 G790 R791 Y792	S305-M788 CarbonylContact O-C 3.57Å; S305-M788 WeakPolarHBondContact O-CA 3.42Å; Y306-M788 HydrophobicContact CD2-CG 4.47Å; Y306-M788 HydrophobicContact CE1-CG 4.19Å; Y306-M788 HydrophobicContact CE2-CG 4Å; F607-M788 HydrophobicContact CB-CE 4.1Å; F607-M788 HydrophobicContact CB-SD 3.88Å; F607-M788 HydrophobicContact CD2-CE 3.25Å; F607-M788 HydrophobicContact CD2-SD 3.88Å; F607-M788 HydrophobicContact CE2-CE 3.78Å; F607-M788 HydrophobicContact CG-CE 3.79Å; F607-M788 HydrophobicContact CG-SD 4.21Å; M788-G790 PolarHBondContact O-N 2.94Å; M788-R791 HydrophobicContact CB-CB 4.12Å; M788-R791 WeakPolarHBondContact O-CB 3.47Å; M788-R791 PolarHBondContact O-N 2.85Å; M788-Y792 HydrophobicContact CB-CD2 4.41Å; M788-Y792 HydrophobicContact CE-CD2 3.42Å; M788-Y792 VanDerWaalsContact CE-CD2 3.42Å; M788-Y792 HydrophobicContact CE-CE2 3.55Å; M788-Y792 HydrophobicContact SD-CD2 4.21Å; M788-Y792 HydrophobicContact SD-CE2 3.97Å
789	N	77.5	Confident	88.6	Confident	69 Å²	69	41.1 Å²	41.1	37%	0.369	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	47.1	168.6	-168.7	41.3	0	0	0	113.5	S346 D709 R791	S346-N789 WeakPolarHBondContact CB-ND2 3.3Å; S346-N789 PolarHBondContact O-ND2 3.01Å; S346-N789 WeakPolarHBondContact OG-CB 3.44Å; S346-N789 PolarHBondContact OG-ND2 3.41Å; D709-N789 PolarHBondContact OD1-N 2.88Å; D709-N789 WeakPolarHBondContact OD2-CA 3.4Å; D709-N789 PolarHBondContact OD2-N 2.82Å; N789-R791 VanDerWaalsContact C-N 3.29Å; N789-R791 PolarHBondContact O-N 3Å
790	G	75.7	Confident	88.6	Confident	41 Å²	41	43 Å²	43	42%	0.423	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	-2.4	-179.3	0	0	0	0	0	115.4	M788 Y792	M788-G790 PolarHBondContact O-N 2.94Å; G790-Y792 PolarHBondContact O-N 2.92Å
791	R	77.8	Confident	88.5	Confident	80 Å²	80	37.6 Å²	37.6	30%	0.302	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-32.8	175.4	-176.6	178.6	165.3	-176.6	-8.2	112.2	S305 F607 A608 M788 N789	S305-R791 PolarHBondContact OG-NH1 2.94Å; F607-R791 VanDerWaalsContact O-CZ 3.32Å; F607-R791 PolarHBondContact O-NH1 2.97Å; F607-R791 PolarHBondContact O-NH2 3.31Å; A608-R791 PolarHBondContact O-NH2 3.15Å; M788-R791 HydrophobicContact CB-CB 4.12Å; M788-R791 WeakPolarHBondContact O-CB 3.47Å; M788-R791 PolarHBondContact O-N 2.85Å; N789-R791 VanDerWaalsContact C-N 3.29Å; N789-R791 PolarHBondContact O-N 3Å
792	Y	81.6	Confident	88.3	Confident	34 Å²	34	39.5 Å²	39.5	13%	0.133	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	123.9	172	-56.4	-77.3	0	0	0	109.4	F607 A646 P647 S786 E787 M788 G790	F607-Y792 HydrophobicContact CB-CE2 4.36Å; A646-Y792 HydrophobicContact CB-CE1 4.36Å; P647-Y792 HydrophobicContact CG-CD1 3.74Å; P647-Y792 HydrophobicContact CG-CD2 3.92Å; P647-Y792 HydrophobicContact CG-CE1 4.12Å; P647-Y792 HydrophobicContact CG-CE2 4.26Å; P647-Y792 HydrophobicContact CG-CG 3.62Å; S786-Y792 CarbonylContact C-O 3.6Å; S786-Y792 VanDerWaalsContact CA-O 3.27Å; S786-Y792 WeakPolarHBondContact CA-O 3.17Å; E787-Y792 PolarHBondContact N-O 3.1Å; E787-Y792 PolarHBondContact O-N 3.39Å; M788-Y792 HydrophobicContact CB-CD2 4.41Å; M788-Y792 HydrophobicContact CE-CD2 3.42Å; M788-Y792 VanDerWaalsContact CE-CD2 3.42Å; M788-Y792 HydrophobicContact CE-CE2 3.55Å; M788-Y792 HydrophobicContact SD-CD2 4.21Å; M788-Y792 HydrophobicContact SD-CE2 3.97Å; G790-Y792 PolarHBondContact O-N 2.92Å
793	T	88.6	Confident	88.1	Confident	95 Å²	95	36.4 Å²	36.4	58%	0.583	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	156	-179.4	51.4	0	0	0	0	111.1	C785	C785-T793 CarbonylContact O-C 3.52Å; C785-T793 WeakPolarHBondContact O-CA 3.28Å
794	S	92.1	Very high	87.6	Confident	15 Å²	15	41.2 Å²	41.2	11%	0.105	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-79.5	168.2	176.3	73.7	0	0	0	0	113.3	I649 L651 C785	I649-S794 WeakPolarHBondContact O-CA 3.34Å; I649-S794 WeakPolarHBondContact O-CB 3.37Å; L651-S794 VanDerWaalsContact CD1-OG 3.3Å; L651-S794 WeakPolarHBondContact CD1-OG 3.47Å; L651-S794 WeakPolarHBondContact CG-OG 3.31Å; C785-S794 PolarHBondContact N-OG 2.89Å; C785-S794 PolarHBondContact O-N 2.95Å
795	N	90.2	Very high	87	Confident	75 Å²	75	43.2 Å²	43.2	40%	0.401	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-58.1	151.4	156.4	68.5	-78.1	0	0	0	110.4	I649 S650 L651	I649-N795 PolarHBondContact O-N 3.06Å; S650-N795 VanDerWaalsContact CA-OD1 3.29Å; S650-N795 WeakPolarHBondContact CA-OD1 3.25Å; L651-N795 WeakPolarHBondContact CD1-O 3.21Å; L651-N795 PolarHBondContact N-OD1 2.94Å; L651-N795 PolarHBondContact O-ND2 3.21Å
796	E	91.5	Very high	85.6	Confident	99 Å²	99	47.2 Å²	47.2	46%	0.463	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-76	123.5	172.3	-60.1	-173.1	154.9	0	0	110	R782	R782-E796 WeakPolarHBondContact CD-OE1 3.44Å; R782-E796 HydrophobicContact CG-CB 4.25Å; R782-E796 HydrophobicContact CG-CG 4.41Å; R782-E796 IonicContact CZ-OE1 3.12Å; R782-E796 IonicContact CZ-OE2 3.88Å; R782-E796 VanDerWaalsContact NE-CD 3.31Å; R782-E796 IonicContact NE-OE1 3.25Å; R782-E796 PolarHBondContact NE-OE1 3.04Å; R782-E796 IonicContact NE-OE2 3.66Å; R782-E796 PolarHBondContact NE-OE2 3.24Å; R782-E796 VanDerWaalsContact NE-OE2 3.1Å; R782-E796 IonicContact NH1-OE1 3.53Å; R782-E796 PolarHBondContact NH1-OE1 2.81Å; R782-E796 IonicContact NH1-OE2 2.99Å; R782-E796 IonicContact NH2-OE1 3.69Å; R782-E796 PolarHBondContact NH2-OE1 3.31Å; R782-E796 IonicContact NH2-OE2 2.65Å; R782-E796 PolarHBondContact NH2-OE2 2.82Å
797	L	91.9	Very high	84	Confident	31 Å²	31	54.4 Å²	54.4	16%	0.162	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	102.8	168.7	-178.8	64.4	0	0	0	108.5	L651 F674 L677 L783	L651-L797 HydrophobicContact CB-CB 3.92Å; L651-L797 HydrophobicContact CB-CD2 4.42Å; L651-L797 HydrophobicContact CD1-CB 3.99Å; F674-L797 HydrophobicContact CD1-CD2 4.14Å; F674-L797 HydrophobicContact CE1-CD2 4.47Å; L677-L797 HydrophobicContact CD1-CD2 3.66Å; L783-L797 HydrophobicContact CB-CB 4.35Å; L783-L797 HydrophobicContact CD2-CD2 4.39Å; L783-L797 PolarHBondContact N-O 3.21Å; L783-L797 PolarHBondContact O-N 2.76Å
798	T	92.6	Very high	82.2	Confident	53 Å²	53	62.5 Å²	62.5	33%	0.325	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	132.6	176.3	-60.9	0	0	0	0	110.8	L716 F781	L716-T798 HydrophobicContact CD1-CG2 3.86Å; F781-T798 CarbonylContact O-C 3.56Å; F781-T798 WeakPolarHBondContact O-CA 3.34Å
799	L	92.3	Very high	80.6	Confident	7 Å²	7	67.6 Å²	67.6	4%	0.037	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.9	178.3	-179.1	68.2	0	0	0	110.4	L658 L673 F674 R780 F781 V801	L658-L799 HydrophobicContact CB-CD1 3.97Å; L658-L799 HydrophobicContact CB-CG 4.49Å; L658-L799 HydrophobicContact CD2-CD2 4.36Å; L673-L799 HydrophobicContact CB-CD2 3.98Å; L673-L799 HydrophobicContact CD2-CD2 4.1Å; L673-L799 WeakPolarHBondContact O-CD2 3.4Å; F674-L799 HydrophobicContact CD1-CD2 4.23Å; F674-L799 HydrophobicContact CE1-CB 3.95Å; F674-L799 HydrophobicContact CE1-CD2 4.01Å; R780-L799 CarbonylContact C-O 3.54Å; R780-L799 WeakPolarHBondContact CA-O 3.49Å; F781-L799 PolarHBondContact N-O 2.84Å; F781-L799 PolarHBondContact O-N 2.85Å; L799-V801 HydrophobicContact CD2-CG2 4.11Å; L799-V801 HydrophobicContact CG-CG2 4.13Å
800	E	92.4	Very high	78.9	Confident	47 Å²	47	71.2 Å²	71.2	22%	0.22	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	124.5	170.8	-170.9	-172.7	98.3	0	0	109.9	P656 H657 L658 R780 N802	P656-E800 WeakPolarHBondContact O-CB 3.45Å; P656-E800 PolarHBondContact O-N 3.33Å; H657-E800 CarbonylContact C-O 3.56Å; H657-E800 WeakPolarHBondContact CA-O 3.49Å; H657-E800 IonicContact CE1-OE1 3.69Å; H657-E800 PolarHBondContact CE1-OE1 3.38Å; H657-E800 IonicContact CE1-OE2 3.77Å; H657-E800 IonicContact CG-OE1 3.78Å; H657-E800 VanDerWaalsContact ND1-CD 3.26Å; H657-E800 IonicContact ND1-OE1 3.16Å; H657-E800 PolarHBondContact ND1-OE1 3.18Å; H657-E800 IonicContact ND1-OE2 2.69Å; L658-E800 PolarHBondContact N-O 3.43Å; R780-E800 HydrophobicContact CG-CB 3.9Å; R780-E800 HydrophobicContact CG-CG 3.83Å; E800-N802 PolarHBondContact OE1-ND2 3.03Å
801	V	91.5	Very high	76.9	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	114.2	-176.4	-173.2	0	0	0	0	108.3	L658 F665 L673 E778 R779 F781 L799 F803	L658-V801 WeakPolarHBondContact O-CA 3.44Å; F665-V801 HydrophobicContact CE1-CG1 3.49Å; F665-V801 VanDerWaalsContact CE1-CG1 3.49Å; F665-V801 HydrophobicContact CE2-CG1 4.36Å; F665-V801 HydrophobicContact CZ-CG1 3.34Å; L673-V801 HydrophobicContact CD2-CG2 3.83Å; E778-V801 CarbonylContact C-O 3.15Å; E778-V801 WeakPolarHBondContact CA-O 3.48Å; R779-V801 PolarHBondContact N-O 2.57Å; R779-V801 PolarHBondContact O-N 2.85Å; F781-V801 HydrophobicContact CD2-CG2 3.85Å; F781-V801 HydrophobicContact CE2-CG2 3.99Å; L799-V801 HydrophobicContact CD2-CG2 4.11Å; L799-V801 HydrophobicContact CG-CG2 4.13Å; V801-F803 HydrophobicContact CB-CE1 4.44Å; V801-F803 HydrophobicContact CB-CZ 4.2Å; V801-F803 HydrophobicContact CG1-CD1 4.44Å; V801-F803 HydrophobicContact CG1-CE1 3.56Å; V801-F803 HydrophobicContact CG1-CZ 3.8Å
802	N	89.9	Confident	74.8	Confident	40 Å²	40	85.1 Å²	85.1	21%	0.214	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.4	-173.3	-71.9	-32.4	0	0	0	111.5	L658 A659 R660 E778 E800	L658-N802 PolarHBondContact O-N 2.89Å; A659-N802 WeakPolarHBondContact CA-O 3.47Å; A659-N802 HydrophobicContact CB-CB 4.4Å; R660-N802 PolarHBondContact N-O 3.36Å; R660-N802 VanDerWaalsContact N-O 3.13Å; E778-N802 WeakPolarHBondContact CB-OD1 3.36Å; E800-N802 PolarHBondContact OE1-ND2 3.03Å
803	F	89.8	Confident	72.9	Confident	8 Å²	8	89 Å²	89	4%	0.035	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	104.3	-170.4	-52.2	-62.6	0	0	0	110.7	A662 F665 Y768 L770 R776 F777 R779 V801 H805	A662-F803 HydrophobicContact CB-CB 4.36Å; F665-F803 AromaticContact CD1-CE1 3.97Å; F665-F803 HydrophobicContact CD1-CE1 3.97Å; F665-F803 AromaticContact CD2-CD1 3.48Å; F665-F803 HydrophobicContact CD2-CD1 3.48Å; F665-F803 VanDerWaalsContact CD2-CD1 3.48Å; F665-F803 AromaticContact CD2-CE1 3.78Å; F665-F803 HydrophobicContact CD2-CE1 3.78Å; F665-F803 HydrophobicContact CE1-CD1 4.47Å; F665-F803 AromaticContact CE1-CE1 3.89Å; F665-F803 HydrophobicContact CE1-CE1 3.89Å; F665-F803 AromaticContact CE2-CD1 3.42Å; F665-F803 HydrophobicContact CE2-CD1 3.42Å; F665-F803 VanDerWaalsContact CE2-CD1 3.42Å; F665-F803 AromaticContact CE2-CE1 3.68Å; F665-F803 HydrophobicContact CE2-CE1 3.68Å; F665-F803 HydrophobicContact CG-CD1 4.02Å; F665-F803 AromaticContact CG-CE1 3.89Å; F665-F803 HydrophobicContact CG-CE1 3.89Å; F665-F803 AromaticContact CZ-CD1 3.96Å; F665-F803 HydrophobicContact CZ-CD1 3.96Å; F665-F803 AromaticContact CZ-CE1 3.74Å; F665-F803 HydrophobicContact CZ-CE1 3.74Å; Y768-F803 HydrophobicContact CD1-CE1 4.27Å; Y768-F803 HydrophobicContact CD1-CZ 4.32Å; Y768-F803 AromaticContact CE1-CE1 3.73Å; Y768-F803 HydrophobicContact CE1-CE1 3.73Å; Y768-F803 AromaticContact CE1-CZ 3.49Å; Y768-F803 HydrophobicContact CE1-CZ 3.49Å; Y768-F803 VanDerWaalsContact CE1-CZ 3.49Å; L770-F803 HydrophobicContact CD1-CD1 3.68Å; L770-F803 HydrophobicContact CD1-CD2 4.33Å; L770-F803 HydrophobicContact CD1-CE1 3.73Å; L770-F803 HydrophobicContact CD1-CE2 4.38Å; L770-F803 HydrophobicContact CD1-CG 4.03Å; L770-F803 HydrophobicContact CD1-CZ 4.12Å; L770-F803 HydrophobicContact CG-CE1 4.45Å; R776-F803 HydrophobicContact CB-CD2 4.11Å; R776-F803 HydrophobicContact CB-CE2 4.17Å; R776-F803 HydrophobicContact CG-CD2 4.15Å; R776-F803 HydrophobicContact CG-CE2 3.85Å; R776-F803 WeakPolarHBondContact O-CB 3.39Å; R776-F803 VanDerWaalsContact O-CD2 3.32Å; R776-F803 WeakPolarHBondContact O-CD2 3.06Å; F777-F803 VanDerWaalsContact C-CD2 3.42Å; F777-F803 WeakPolarHBondContact O-CD2 3.48Å; F777-F803 PolarHBondContact O-N 3.01Å; R779-F803 HydrophobicContact CB-CE2 3.98Å; R779-F803 HydrophobicContact CB-CZ 3.93Å; V801-F803 HydrophobicContact CB-CE1 4.44Å; V801-F803 HydrophobicContact CB-CZ 4.2Å; V801-F803 HydrophobicContact CG1-CD1 4.44Å; V801-F803 HydrophobicContact CG1-CE1 3.56Å; V801-F803 HydrophobicContact CG1-CZ 3.8Å; F803-H805 PolarHBondContact O-CD2 3.39Å; F803-H805 VanDerWaalsContact O-CD2 3.23Å; F803-H805 PolarHBondContact O-N 2.9Å; F803-H805 VanDerWaalsContact O-N 3.1Å
804	L	84.1	Confident	70.3	Confident	100 Å²	100	89.4 Å²	89.4	52%	0.524	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	94.6	178.6	-58.7	176.5	0	0	0	109.7	A659 R660 P661 A662	A659-L804 HydrophobicContact CB-CD1 4.25Å; A659-L804 HydrophobicContact CB-CG 4.44Å; R660-L804 PolarHBondContact O-N 2.76Å; P661-L804 WeakPolarHBondContact CA-O 3.5Å; A662-L804 PolarHBondContact N-O 3.28Å
805	H	80.8	Confident	67.9	Low	80 Å²	80	97 Å²	97	37%	0.37	51%	0.507	S	S	.	.			trans	-78	125.3	169.8	-62.9	-81.7	0	0	0	109.7	A662 R776 F777 F803	A662-H805 VanDerWaalsContact CB-CE1 3.48Å; A662-H805 WeakPolarHBondContact CB-CE1 3.38Å; A662-H805 WeakPolarHBondContact CB-ND1 3.39Å; R776-H805 PolarHBondContact O-NE2 2.91Å; F777-H805 AromaticContact CD1-CD2 3.81Å; F777-H805 AromaticContact CE1-CD2 3.78Å; F803-H805 PolarHBondContact O-CD2 3.39Å; F803-H805 VanDerWaalsContact O-CD2 3.23Å; F803-H805 PolarHBondContact O-N 2.9Å; F803-H805 VanDerWaalsContact O-N 3.1Å
806	S	66.6	Low	65.1	Low	86 Å²	86	100 Å²	100	60%	0.601	52%	0.523	S	S	*	.			trans	-78.7	146.1	171.3	84.9	0	0	0	0	110.4	E808	S806-E808 PolarHBondContact O-N 3.28Å; S806-E808 WeakPolarHBondContact OG-CB 3.28Å
807	L	54.8	Low	62.4	Low	169 Å²	169	103 Å²	103	89%	0.885	54%	0.541	S	S	*	.	S	Bend	trans	-76.8	20.3	179.6	-83.5	163.5	0	0	0	113.5	S809	L807-S809 VanDerWaalsContact C-N 3.34Å; L807-S809 PolarHBondContact O-N 2.92Å
808	E	48.6	Very low	59.7	Low	175 Å²	175	105.9 Å²	105.9	82%	0.818	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	19.4	-161.5	-148.5	154	-151.2	0	0	113.6	S806	S806-E808 PolarHBondContact O-N 3.28Å; S806-E808 WeakPolarHBondContact OG-CB 3.28Å
809	S	42.7	Very low	56.9	Low	116 Å²	116	108.9 Å²	108.9	81%	0.811	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-2.6	-179.5	-160.9	0	0	0	0	113.8	L807	L807-S809 VanDerWaalsContact C-N 3.34Å; L807-S809 PolarHBondContact O-N 2.92Å
810	L	41	Very low	54.1	Low	145 Å²	145	116 Å²	116	76%	0.759	63%	0.626	S	S	*	*	S	Bend	trans	-118.5	22.7	-167.4	-81.9	175	0	0	0	116.4
811	Y	34.7	Very low	51.4	Low	227 Å²	227	119.8 Å²	119.8	89%	0.89	64%	0.643	S	S	*	*			trans	-133.9	108.6	166.4	-81.8	-76.7	0	0	0	113
812	H	32.6	Very low	48.4	Very low	186 Å²	186	127 Å²	127	86%	0.861	68%	0.677	S	S	*	*			trans	-101.3	146.9	160.1	-119.1	26.5	0	0	0	109.9
813	P	43.3	Very low	45.5	Very low	115 Å²	115	133 Å²	133	75%	0.747	70%	0.702	S	S	*	*			trans	-95.6	126.2	-154.8	34.4	-34.9	0	0	0	114.8
814	S	33.7	Very low	42.5	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	74%	0.737	S	S	*	*			trans	-164.9	91.7	157.1	39.3	0	0	0	0	112.9
815	H	40.9	Very low	39.8	Very low	174 Å²	174	143.2 Å²	143.2	81%	0.806	75%	0.75	S	S	*	*				179.2	117.3	115.9	-100.4	-78	0	0	0	112.9
816	L	32.3	Very low	38.3	Very low	140 Å²	140	144.6 Å²	144.6	73%	0.733	77%	0.767	S	S	*	*			trans	14	112.9	150.9	-52.8	176	0	0	0	118.1
817	L	33.8	Very low	36.4	Very low	160 Å²	160	145.5 Å²	145.5	84%	0.838	77%	0.773	S	S	*	*				60.7	110.3	82.6	-75.2	171.4	0	0	0	115.7
818	A	35.1	Very low	35.1	Very low	93 Å²	93	145.2 Å²	145.2	77%	0.769	77%	0.767	S	S	*	*			trans	-175.4	66.4	130.2	0	0	0	0	0	115.1
819	S	33.5	Very low	34	Very low	115 Å²	115	144.4 Å²	144.4	80%	0.804	76%	0.763	S	S	*	*			trans	-170.9	81.8	155.1	43.3	0	0	0	0	109
820	Q	34.6	Very low	33.3	Very low	157 Å²	157	144.4 Å²	144.4	73%	0.734	76%	0.762	S	S	*	*				53.8	113.1	57.5	-159.6	179.7	-14.7	0	0	110.5
821	Q	35.3	Very low	32.6	Very low	126 Å²	126	141.4 Å²	141.4	59%	0.589	77%	0.767	S	S	*	*			cis	-148.6	-176.5	8.3	-125.2	157.3	-12.3	0	0	108.1
822	Q	29	Very low	32.2	Very low	153 Å²	153	139.2 Å²	139.2	72%	0.715	77%	0.765	S	S	*	*			cis	-168.4	127.2	27.1	-142.9	152.4	-5.2	0	0	111.3
823	F	28.4	Very low	32.1	Very low	166 Å²	166	137.4 Å²	137.4	73%	0.728	76%	0.76	S	S	*	*			trans	52.6	149.6	145.1	-65	-121.7	0	0	0	119.1
824	L	26.7	Very low	31.5	Very low	150 Å²	150	137.2 Å²	137.2	79%	0.785	76%	0.762	S	S	*	*			cis	-159.3	171.9	11.2	-124.9	160.6	0	0	0	110.8
825	H	27.5	Very low	31.2	Very low	171 Å²	171	135.1 Å²	135.1	79%	0.792	76%	0.757	S	S	*	*			trans	-136.6	168.8	173.9	-109.8	4.5	0	0	0	108.1
826	P	50.3	Low	30.6	Very low	110 Å²	110	135.6 Å²	135.6	71%	0.714	76%	0.759	S	S	*	*			cis	-133.6	-174.6	-24.1	40.2	-24.1	0	0	0	112.3
827	S	25.1	Very low	30.5	Very low	105 Å²	105	134.7 Å²	134.7	73%	0.734	76%	0.759	S	S	*	*				149.8	128.2	125.8	71.5	0	0	0	0	117.3
828	H	27.8	Very low	30.2	Very low	163 Å²	163	134.2 Å²	134.2	76%	0.755	76%	0.757	S	S	*	*			trans	56.4	140.3	138.2	-86.9	-101.2	0	0	0	125.8
829	H	26.6	Very low	30.4	Very low	158 Å²	158	135.9 Å²	135.9	73%	0.731	76%	0.76	S	S	*	*			trans	76.9	106.3	151.5	-73.5	-62.1	0	0	0	123
830	S	26.4	Very low	30.2	Very low	115 Å²	115	135.4 Å²	135.4	80%	0.804	75%	0.748	S	S	*	*				33.3	130.5	129.3	58.1	0	0	0	0	122.2
831	G	27.8	Very low	30.6	Very low	83 Å²	83	133.6 Å²	133.6	86%	0.856	75%	0.75	S	S	*	*			trans	175.4	142	160	0	0	0	0	0	115.7
832	E	26.2	Very low	30.4	Very low	180 Å²	180	134 Å²	134	84%	0.841	75%	0.752	S	S	*	*			trans	-74.2	161.5	-174	-62	168.3	101.3	0	0	116.9
833	L	30	Very low	30.5	Very low	148 Å²	148	138.7 Å²	138.7	78%	0.775	76%	0.763	S	S	*	*			trans	48.7	130.9	143.7	-96.7	66.3	0	0	0	124.1
834	S	30.2	Very low	30.6	Very low	111 Å²	111	136.9 Å²	136.9	78%	0.776	76%	0.761	S	S	*	*			trans	75.9	112.6	132.4	-62.2	0	0	0	0	122.8
835	G	27.5	Very low	30.8	Very low	60 Å²	60	135.5 Å²	135.5	62%	0.619	76%	0.764	S	S	*	*				121.1	110.1	118.9	0	0	0	0	0	120.1
836	H	29.4	Very low	31.2	Very low	184 Å²	184	133.3 Å²	133.3	85%	0.852	76%	0.762	S	S	*	*			trans	64.5	149.9	151.1	-50.5	-75.6	0	0	0	117.9
837	T	28.7	Very low	30.7	Very low	120 Å²	120	134.3 Å²	134.3	74%	0.736	77%	0.766	S	S	*	*			cis	-154.2	149.9	-0.9	-6	0	0	0	0	111.6
838	L	28.5	Very low	31.3	Very low	151 Å²	151	133.6 Å²	133.6	79%	0.791	76%	0.759	S	S	*	*			trans	6.7	146.3	149.4	-74.3	166.8	0	0	0	121
839	P	38.2	Very low	32.5	Very low	128 Å²	128	128.1 Å²	128.1	83%	0.831	75%	0.746	S	S	*	*			cis	-136.5	175.7	47.6	39	-21.2	0	0	0	118.8
840	N	30.3	Very low	33.8	Very low	104 Å²	104	124 Å²	124	56%	0.556	74%	0.74	S	S	*	*			trans	-86.3	165.1	-173.3	-156.8	15.6	0	0	0	112.2	H842	N840-H842 PolarHBondContact ND2-CD2 2.92Å; N840-H842 PolarHBondContact ND2-N 2.9Å; N840-H842 PolarHBondContact ND2-NE2 3.03Å; N840-H842 PolarHBondContact OD1-N 2.81Å
841	P	43	Very low	35.1	Very low	119 Å²	119	121.7 Å²	121.7	77%	0.773	73%	0.727	S	S	*	*				-148.8	118.9	84.7	35.6	-15.7	0	0	0	117.6
842	H	31	Very low	36.5	Very low	135 Å²	135	120.9 Å²	120.9	63%	0.625	71%	0.706	S	S	*	*			trans	46.3	118.2	140.1	-70	-80.1	0	0	0	121.8	N840	N840-H842 PolarHBondContact ND2-CD2 2.92Å; N840-H842 PolarHBondContact ND2-N 2.9Å; N840-H842 PolarHBondContact ND2-NE2 3.03Å; N840-H842 PolarHBondContact OD1-N 2.81Å
843	R	32	Very low	38.3	Very low	252 Å²	252	116.5 Å²	116.5	95%	0.951	69%	0.691	S	S	*	*				-149.4	164.1	107.1	-116.7	174.8	174.9	-173.3	-3.3	111.4
844	N	29.8	Very low	40	Very low	128 Å²	128	114.5 Å²	114.5	68%	0.684	68%	0.681	S	S	*	*			trans	-109.6	138.2	-156.2	-55.3	-8.7	0	0	0	114
845	S	31.7	Very low	41.8	Very low	120 Å²	120	114.1 Å²	114.1	84%	0.839	67%	0.669	S	S	*	*			trans	-138.4	146	134.1	64.3	0	0	0	0	107.7
846	V	33.9	Very low	43.8	Very low	126 Å²	126	118.2 Å²	118.2	76%	0.764	67%	0.673	S	S	*	*			trans	-128.4	116.1	-172	177.8	0	0	0	0	110
847	V	40	Very low	46	Very low	131 Å²	131	114 Å²	114	79%	0.794	66%	0.66	S	S	*	*			trans	-86.4	131.7	164.4	179.2	0	0	0	0	108.2	G849	V847-G849 PolarHBondContact O-N 3Å; V847-G849 VanDerWaalsContact O-N 3.1Å
848	P	39.5	Very low	48	Very low	89 Å²	89	111.6 Å²	111.6	58%	0.578	65%	0.648	S	S	*	*			trans	-70.8	104.8	174.9	-13.3	28.4	0	0	0	110.4	T852	P848-T852 VanDerWaalsContact CB-OG1 3.22Å; P848-T852 WeakPolarHBondContact CB-OG1 3.32Å
849	G	52.6	Low	50.6	Low	48 Å²	48	108 Å²	108	50%	0.495	63%	0.632	S	S	.	*			trans	-63.5	149.5	174.5	0	0	0	0	0	111.7	V847 A851 T852	V847-G849 PolarHBondContact O-N 3Å; V847-G849 VanDerWaalsContact O-N 3.1Å; G849-A851 PolarHBondContact O-N 2.83Å; G849-T852 PolarHBondContact O-N 3.44Å; G849-T852 PolarHBondContact O-OG1 2.88Å
850	A	53.8	Low	52.6	Low	72 Å²	72	103.6 Å²	103.6	60%	0.595	61%	0.609	S	S	*	*	H	α-helix	trans	-48.7	-26.7	-167.6	0	0	0	0	0	116.2	T852 V853 I854	A850-T852 VanDerWaalsContact C-N 3.27Å; A850-T852 PolarHBondContact O-N 2.88Å; A850-V853 WeakPolarHBondContact O-CB 3.3Å; A850-V853 PolarHBondContact O-N 2.9Å; A850-V853 VanDerWaalsContact O-N 3.09Å; A850-I854 WeakPolarHBondContact O-CG1 3.15Å; A850-I854 PolarHBondContact O-N 3.42Å
851	A	53.3	Low	55.1	Low	66 Å²	66	104.9 Å²	104.9	55%	0.545	61%	0.61	S	S	.	*	H	α-helix	trans	-52.9	-38	171.1	0	0	0	0	0	113.7	G849 I854 I855	G849-A851 PolarHBondContact O-N 2.83Å; A851-I854 PolarHBondContact O-N 2.68Å; A851-I855 WeakPolarHBondContact O-CB 3.2Å; A851-I855 WeakPolarHBondContact O-CD1 3.25Å; A851-I855 WeakPolarHBondContact O-CG1 3.33Å; A851-I855 PolarHBondContact O-N 2.83Å
852	T	57.6	Low	56.9	Low	66 Å²	66	104.7 Å²	104.7	41%	0.405	60%	0.602	S	S	.	*	H	α-helix	trans	-71	-32.7	177.4	57.9	0	0	0	0	112.3	P848 G849 A850 M856	P848-T852 VanDerWaalsContact CB-OG1 3.22Å; P848-T852 WeakPolarHBondContact CB-OG1 3.32Å; G849-T852 PolarHBondContact O-N 3.44Å; G849-T852 PolarHBondContact O-OG1 2.88Å; A850-T852 VanDerWaalsContact C-N 3.27Å; A850-T852 PolarHBondContact O-N 2.88Å; T852-M856 WeakPolarHBondContact O-CB 3.44Å; T852-M856 VanDerWaalsContact O-CG 3.28Å; T852-M856 WeakPolarHBondContact O-CG 3.29Å; T852-M856 PolarHBondContact O-N 2.99Å
853	V	62.4	Low	59.3	Low	88 Å²	88	102 Å²	102	53%	0.533	60%	0.595	S	S	.	*	H	α-helix	trans	-68.4	-45.6	174.4	-176.9	0	0	0	0	109.9	A850 I855 M856 V857	A850-V853 WeakPolarHBondContact O-CB 3.3Å; A850-V853 PolarHBondContact O-N 2.9Å; A850-V853 VanDerWaalsContact O-N 3.09Å; V853-I855 PolarHBondContact O-N 2.73Å; V853-M856 PolarHBondContact O-N 3.4Å; V853-V857 WeakPolarHBondContact O-CG2 3.39Å; V853-V857 PolarHBondContact O-N 2.78Å
854	I	66.7	Low	61.6	Low	107 Å²	107	93.6 Å²	93.6	55%	0.549	57%	0.572	S	S	.	*	H	α-helix	trans	-60.7	-44.4	175.6	-65.5	166	0	0	0	110.6	A850 A851 M856 V857 C858	A850-I854 WeakPolarHBondContact O-CG1 3.15Å; A850-I854 PolarHBondContact O-N 3.42Å; A851-I854 PolarHBondContact O-N 2.68Å; I854-M856 PolarHBondContact O-N 3.27Å; I854-V857 PolarHBondContact O-N 3.08Å; I854-C858 WeakPolarHBondContact O-CB 3.39Å; I854-C858 PolarHBondContact O-N 3.03Å; I854-C858 PolarHBondContact O-SG 3.21Å
855	I	68.9	Low	64	Low	103 Å²	103	92.1 Å²	92.1	53%	0.528	56%	0.562	S	S	.	*	H	α-helix	trans	-61.7	-44.1	175.6	-70.9	164.3	0	0	0	111.1	A851 V853 V857 C858 V859	A851-I855 WeakPolarHBondContact O-CB 3.2Å; A851-I855 WeakPolarHBondContact O-CD1 3.25Å; A851-I855 WeakPolarHBondContact O-CG1 3.33Å; A851-I855 PolarHBondContact O-N 2.83Å; V853-I855 PolarHBondContact O-N 2.73Å; I855-V857 PolarHBondContact O-N 3.44Å; I855-C858 PolarHBondContact O-N 2.85Å; I855-V859 HydrophobicContact CG2-CG2 4.24Å; I855-V859 WeakPolarHBondContact O-CB 3.31Å; I855-V859 VanDerWaalsContact O-CG2 3.27Å; I855-V859 WeakPolarHBondContact O-CG2 3.41Å; I855-V859 PolarHBondContact O-N 2.87Å
856	M	67.9	Low	66.2	Low	145 Å²	145	91.1 Å²	91.1	71%	0.714	55%	0.55	S	S	*	*	H	α-helix	trans	-63	-40.5	176.5	-75.3	-66.8	-176.1	0	0	112.4	T852 V853 I854 G860	T852-M856 WeakPolarHBondContact O-CB 3.44Å; T852-M856 VanDerWaalsContact O-CG 3.28Å; T852-M856 WeakPolarHBondContact O-CG 3.29Å; T852-M856 PolarHBondContact O-N 2.99Å; V853-M856 PolarHBondContact O-N 3.4Å; I854-M856 PolarHBondContact O-N 3.27Å; M856-G860 PolarHBondContact O-N 3.24Å
857	V	76.4	Confident	68.4	Low	96 Å²	96	89.6 Å²	89.6	58%	0.582	54%	0.537	S	S	*	.	H	α-helix	trans	-65.9	-44.7	175.4	171	0	0	0	0	111.1	V853 I854 I855 G860 F861	V853-V857 WeakPolarHBondContact O-CG2 3.39Å; V853-V857 PolarHBondContact O-N 2.78Å; I854-V857 PolarHBondContact O-N 3.08Å; I855-V857 PolarHBondContact O-N 3.44Å; V857-G860 PolarHBondContact O-N 2.78Å; V857-F861 WeakPolarHBondContact O-CB 3.47Å; V857-F861 PolarHBondContact O-N 3Å
858	C	71	Confident	70.2	Confident	69 Å²	69	88 Å²	88	47%	0.466	52%	0.523	S	S	.	.	H	α-helix	trans	-65.5	-40.9	177.2	-70.1	0	0	0	0	112.6	I854 I855 F861 L862	I854-C858 WeakPolarHBondContact O-CB 3.39Å; I854-C858 PolarHBondContact O-N 3.03Å; I854-C858 PolarHBondContact O-SG 3.21Å; I855-C858 PolarHBondContact O-N 2.85Å; C858-F861 PolarHBondContact O-N 2.9Å; C858-L862 WeakPolarHBondContact O-CB 3.27Å; C858-L862 WeakPolarHBondContact O-CG 3.12Å; C858-L862 PolarHBondContact O-N 2.65Å
859	V	82.3	Confident	71.9	Confident	77 Å²	77	85.1 Å²	85.1	47%	0.467	51%	0.51	S	S	.	.	H	α-helix	trans	-66.8	-43.1	175	170.3	0	0	0	0	110.7	I855 F861 L862 V863	I855-V859 HydrophobicContact CG2-CG2 4.24Å; I855-V859 WeakPolarHBondContact O-CB 3.31Å; I855-V859 VanDerWaalsContact O-CG2 3.27Å; I855-V859 WeakPolarHBondContact O-CG2 3.41Å; I855-V859 PolarHBondContact O-N 2.87Å; V859-F861 PolarHBondContact O-N 2.05Å; V859-L862 PolarHBondContact O-N 2.89Å; V859-V863 WeakPolarHBondContact O-CG2 3.48Å; V859-V863 PolarHBondContact O-N 2.72Å
860	G	80.7	Confident	72.9	Confident	34 Å²	34	86 Å²	86	35%	0.351	51%	0.506	S	S	.	.	H	α-helix	trans	-59.1	-45.4	173.8	0	0	0	0	0	112.4	M856 V857 L862 V863 V864	M856-G860 PolarHBondContact O-N 3.24Å; V857-G860 PolarHBondContact O-N 2.78Å; G860-L862 PolarHBondContact O-N 2.8Å; G860-V863 PolarHBondContact O-N 2.96Å; G860-V864 WeakPolarHBondContact O-CG2 3.36Å; G860-V864 PolarHBondContact O-N 3.23Å
861	F	83.3	Confident	73.6	Confident	132 Å²	132	89.8 Å²	89.8	58%	0.579	51%	0.509	S	S	*	.	H	α-helix	trans	-64.3	-39.6	177	-163.3	-91.2	0	0	0	112.3	V857 C858 V859 V864 M865	V857-F861 WeakPolarHBondContact O-CB 3.47Å; V857-F861 PolarHBondContact O-N 3Å; C858-F861 PolarHBondContact O-N 2.9Å; V859-F861 PolarHBondContact O-N 2.05Å; F861-V864 PolarHBondContact O-N 3.05Å; F861-M865 HydrophobicContact CD1-CG 3.83Å; F861-M865 HydrophobicContact CE1-CE 4.31Å; F861-M865 HydrophobicContact CE1-CG 3.71Å; F861-M865 HydrophobicContact CE1-SD 4Å; F861-M865 HydrophobicContact CZ-CE 4.38Å; F861-M865 WeakPolarHBondContact O-CB 3.32Å; F861-M865 WeakPolarHBondContact O-CG 3.2Å; F861-M865 PolarHBondContact O-N 2.97Å
862	L	80.8	Confident	74.2	Confident	114 Å²	114	95.7 Å²	95.7	60%	0.597	52%	0.517	S	S	*	.	H	α-helix	trans	-64	-40.9	173	-76.4	169	0	0	0	112.3	C858 V859 G860 M865 V866	C858-L862 WeakPolarHBondContact O-CB 3.27Å; C858-L862 WeakPolarHBondContact O-CG 3.12Å; C858-L862 PolarHBondContact O-N 2.65Å; V859-L862 PolarHBondContact O-N 2.89Å; G860-L862 PolarHBondContact O-N 2.8Å; L862-M865 PolarHBondContact O-N 2.99Å; L862-V866 WeakPolarHBondContact O-CG2 3.11Å; L862-V866 PolarHBondContact O-N 3.37Å
863	V	80.6	Confident	74.5	Confident	79 Å²	79	98.1 Å²	98.1	48%	0.479	53%	0.527	S	S	.	.	H	α-helix	trans	-62.9	-44	174.8	169.1	0	0	0	0	110.9	V859 G860 V866 I867	V859-V863 WeakPolarHBondContact O-CG2 3.48Å; V859-V863 PolarHBondContact O-N 2.72Å; G860-V863 PolarHBondContact O-N 2.96Å; V863-V866 PolarHBondContact O-N 2.89Å; V863-I867 HydrophobicContact CG1-CD1 3.78Å; V863-I867 HydrophobicContact CG1-CG1 4.48Å; V863-I867 VanDerWaalsContact O-CG1 3.29Å; V863-I867 WeakPolarHBondContact O-CG1 3.35Å; V863-I867 PolarHBondContact O-N 2.96Å
864	V	81.3	Confident	74.2	Confident	76 Å²	76	103.1 Å²	103.1	46%	0.461	54%	0.536	S	S	.	.	H	α-helix	trans	-63.4	-43.4	175.4	172	0	0	0	0	111.7	G860 F861 V866 I867 L868	G860-V864 WeakPolarHBondContact O-CG2 3.36Å; G860-V864 PolarHBondContact O-N 3.23Å; F861-V864 PolarHBondContact O-N 3.05Å; V864-V866 VanDerWaalsContact C-N 3.34Å; V864-V866 PolarHBondContact O-N 3.16Å; V864-I867 PolarHBondContact O-N 3.33Å; V864-L868 HydrophobicContact CG1-CD1 3.9Å; V864-L868 HydrophobicContact CG1-CG 4.36Å; V864-L868 WeakPolarHBondContact O-CB 3.46Å; V864-L868 WeakPolarHBondContact O-CG 3.38Å; V864-L868 PolarHBondContact O-N 2.99Å
865	M	79.3	Confident	73.5	Confident	97 Å²	97	101.1 Å²	101.1	48%	0.478	53%	0.532	S	S	.	.	H	α-helix	trans	-58.5	-42.7	174	-74.6	-86.3	99.5	0	0	112.1	F861 L862 L868 G869	F861-M865 HydrophobicContact CD1-CG 3.83Å; F861-M865 HydrophobicContact CE1-CE 4.31Å; F861-M865 HydrophobicContact CE1-CG 3.71Å; F861-M865 HydrophobicContact CE1-SD 4Å; F861-M865 HydrophobicContact CZ-CE 4.38Å; F861-M865 WeakPolarHBondContact O-CB 3.32Å; F861-M865 WeakPolarHBondContact O-CG 3.2Å; F861-M865 PolarHBondContact O-N 2.97Å; L862-M865 PolarHBondContact O-N 2.99Å; M865-L868 HydrophobicContact CE-CD1 4.34Å; M865-G869 PolarHBondContact O-N 2.86Å
866	V	78.3	Confident	72.7	Confident	98 Å²	98	102.4 Å²	102.4	59%	0.594	54%	0.538	S	S	*	.	H	α-helix	trans	-66.6	-43.1	176.4	169.3	0	0	0	0	111.4	L862 V863 V864 G869 V870	L862-V866 WeakPolarHBondContact O-CG2 3.11Å; L862-V866 PolarHBondContact O-N 3.37Å; V863-V866 PolarHBondContact O-N 2.89Å; V864-V866 VanDerWaalsContact C-N 3.34Å; V864-V866 PolarHBondContact O-N 3.16Å; V866-G869 PolarHBondContact O-N 3.26Å; V866-V870 WeakPolarHBondContact O-CG2 3.48Å; V866-V870 PolarHBondContact O-N 3.47Å
867	I	79.9	Confident	71.7	Confident	95 Å²	95	103.6 Å²	103.6	49%	0.487	54%	0.542	S	S	.	.	H	α-helix	trans	-60.5	-47.5	176.6	-70.7	165.9	0	0	0	110.7	V863 V864 G869 V870 F871	V863-I867 HydrophobicContact CG1-CD1 3.78Å; V863-I867 HydrophobicContact CG1-CG1 4.48Å; V863-I867 VanDerWaalsContact O-CG1 3.29Å; V863-I867 WeakPolarHBondContact O-CG1 3.35Å; V863-I867 PolarHBondContact O-N 2.96Å; V864-I867 PolarHBondContact O-N 3.33Å; I867-G869 VanDerWaalsContact C-N 3.33Å; I867-G869 PolarHBondContact O-N 2.76Å; I867-V870 PolarHBondContact O-N 2.93Å; I867-F871 WeakPolarHBondContact O-CB 3.34Å; I867-F871 PolarHBondContact O-N 3.08Å
868	L	77.4	Confident	70.4	Confident	96 Å²	96	109.7 Å²	109.7	50%	0.503	55%	0.554	S	S	.	*	H	α-helix	trans	-64.8	-35.6	176.8	-69.3	173	0	0	0	112.3	V864 M865 F871 R872	V864-L868 HydrophobicContact CG1-CD1 3.9Å; V864-L868 HydrophobicContact CG1-CG 4.36Å; V864-L868 WeakPolarHBondContact O-CB 3.46Å; V864-L868 WeakPolarHBondContact O-CG 3.38Å; V864-L868 PolarHBondContact O-N 2.99Å; M865-L868 HydrophobicContact CE-CD1 4.34Å; L868-F871 PolarHBondContact O-N 3.49Å; L868-R872 PolarHBondContact O-N 2.97Å
869	G	74.9	Confident	69.1	Low	30 Å²	30	117.7 Å²	117.7	31%	0.309	57%	0.574	S	S	.	*	H	α-helix	trans	-61.4	-49.6	172.2	0	0	0	0	0	112.4	M865 V866 I867 F871 R872 I873	M865-G869 PolarHBondContact O-N 2.86Å; V866-G869 PolarHBondContact O-N 3.26Å; I867-G869 VanDerWaalsContact C-N 3.33Å; I867-G869 PolarHBondContact O-N 2.76Å; G869-F871 VanDerWaalsContact C-N 3.3Å; G869-F871 PolarHBondContact O-N 3.03Å; G869-R872 PolarHBondContact O-N 2.92Å; G869-I873 WeakPolarHBondContact O-CG1 3.18Å; G869-I873 PolarHBondContact O-N 3.36Å
870	V	73.4	Confident	67.2	Low	67 Å²	67	117.6 Å²	117.6	41%	0.406	59%	0.59	S	S	.	*	H	α-helix	trans	-61.9	-37.8	175	172.3	0	0	0	0	111.3	V866 I867 I873 R874	V866-V870 WeakPolarHBondContact O-CG2 3.48Å; V866-V870 PolarHBondContact O-N 3.47Å; I867-V870 PolarHBondContact O-N 2.93Å; V870-I873 PolarHBondContact O-N 3.42Å; V870-R874 WeakPolarHBondContact O-CB 3.41Å; V870-R874 WeakPolarHBondContact O-CG 3.36Å; V870-R874 PolarHBondContact O-N 3.28Å
871	F	69	Low	65.1	Low	150 Å²	150	125.5 Å²	125.5	66%	0.658	62%	0.617	S	S	*	*	H	α-helix	trans	-65.1	-42.7	175.8	-122.3	-84.2	0	0	0	112.6	I867 L868 G869 R874 S875	I867-F871 WeakPolarHBondContact O-CB 3.34Å; I867-F871 PolarHBondContact O-N 3.08Å; L868-F871 PolarHBondContact O-N 3.49Å; G869-F871 VanDerWaalsContact C-N 3.3Å; G869-F871 PolarHBondContact O-N 3.03Å; F871-R874 PolarHBondContact O-N 3.32Å; F871-S875 WeakPolarHBondContact O-CB 3.38Å; F871-S875 PolarHBondContact O-N 3.02Å; F871-S875 PolarHBondContact O-OG 3.11Å
872	R	66.1	Low	62.9	Low	191 Å²	191	123.2 Å²	123.2	72%	0.721	63%	0.631	S	S	*	*	H	α-helix	trans	-63.7	-43.3	173.3	-87.6	-171.7	168.7	-171	-2.1	112.4	L868 G869 R874 S875 I876	L868-R872 PolarHBondContact O-N 2.97Å; G869-R872 PolarHBondContact O-N 2.92Å; R872-R874 VanDerWaalsContact C-N 3.3Å; R872-R874 PolarHBondContact O-N 3.33Å; R872-S875 PolarHBondContact O-N 3.37Å; R872-S875 PolarHBondContact O-OG 3.32Å; R872-I876 WeakPolarHBondContact O-CB 3.37Å; R872-I876 VanDerWaalsContact O-CG1 3.28Å; R872-I876 WeakPolarHBondContact O-CG1 3.4Å; R872-I876 PolarHBondContact O-N 3.19Å
873	I	64.9	Low	60.8	Low	117 Å²	117	123.2 Å²	123.2	60%	0.6	64%	0.641	S	S	*	*	H	α-helix	trans	-63.9	-37.7	178.8	-68.4	166.1	0	0	0	110.8	G869 V870	G869-I873 WeakPolarHBondContact O-CG1 3.18Å; G869-I873 PolarHBondContact O-N 3.36Å; V870-I873 PolarHBondContact O-N 3.42Å
874	R	54.6	Low	58.5	Low	192 Å²	192	131.4 Å²	131.4	73%	0.725	66%	0.663	S	S	*	*	H	α-helix	trans	-73.1	-33.8	174.4	-76.4	-179.2	170.1	173.2	-2.4	114	V870 F871 R872	V870-R874 WeakPolarHBondContact O-CB 3.41Å; V870-R874 WeakPolarHBondContact O-CG 3.36Å; V870-R874 PolarHBondContact O-N 3.28Å; F871-R874 PolarHBondContact O-N 3.32Å; R872-R874 VanDerWaalsContact C-N 3.3Å; R872-R874 PolarHBondContact O-N 3.33Å
875	S	52.1	Low	56.1	Low	66 Å²	66	131.8 Å²	131.8	46%	0.462	68%	0.682	S	S	.	*	H	α-helix	trans	-76.2	-34	179.3	69.1	0	0	0	0	113	F871 R872 H877 R878	F871-S875 WeakPolarHBondContact O-CB 3.38Å; F871-S875 PolarHBondContact O-N 3.02Å; F871-S875 PolarHBondContact O-OG 3.11Å; R872-S875 PolarHBondContact O-N 3.37Å; R872-S875 PolarHBondContact O-OG 3.32Å; S875-H877 VanDerWaalsContact C-N 3.29Å; S875-H877 PolarHBondContact O-N 3.43Å; S875-R878 PolarHBondContact O-N 3.29Å; S875-R878 VanDerWaalsContact O-N 3.11Å
876	I	53.2	Low	53.7	Low	130 Å²	130	131 Å²	131	67%	0.667	70%	0.699	S	S	*	*	H	α-helix	trans	-63.5	-35.4	174.4	-70.6	167.5	0	0	0	111.3	R872 R878	R872-I876 WeakPolarHBondContact O-CB 3.37Å; R872-I876 VanDerWaalsContact O-CG1 3.28Å; R872-I876 WeakPolarHBondContact O-CG1 3.4Å; R872-I876 PolarHBondContact O-N 3.19Å; I876-R878 PolarHBondContact O-N 3.03Å
877	H	46	Very low	51.5	Low	170 Å²	170	131.1 Å²	131.1	79%	0.787	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	1	174.7	-105	88.4	0	0	0	115.1	S875	S875-H877 VanDerWaalsContact C-N 3.29Å; S875-H877 PolarHBondContact O-N 3.43Å
878	R	49.4	Very low	49.2	Very low	224 Å²	224	135.1 Å²	135.1	85%	0.845	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126	20	-174.6	-146.2	178.6	-179.6	-167.9	-1.6	115	S875 I876	S875-R878 PolarHBondContact O-N 3.29Å; S875-R878 VanDerWaalsContact O-N 3.11Å; I876-R878 PolarHBondContact O-N 3.03Å
879	R	43.9	Very low	47	Very low	236 Å²	236	138 Å²	138	89%	0.891	74%	0.735	S	S	*	*			trans	-130.5	68.7	167.1	-79.8	-172.9	169	173.6	-3	110.6
880	G	42.9	Very low	44.9	Very low	76 Å²	76	140.3 Å²	140.3	78%	0.784	76%	0.759	S	S	*	*			trans	-119.1	6.4	-177.8	0	0	0	0	0	115.5
881	E	35.2	Very low	42.7	Very low	199 Å²	199	142 Å²	142	93%	0.93	77%	0.774	S	S	*	*	S	Bend	trans	-151.1	155	-177.1	-105.5	173.6	157.9	0	0	111.6
882	G	37.3	Very low	41.1	Very low	84 Å²	84	142.1 Å²	142.1	87%	0.866	78%	0.781	S	S	*	*			trans	89.1	74.8	165	0	0	0	0	0	117.4
883	S	36.6	Very low	39.4	Very low	115 Å²	115	141.2 Å²	141.2	80%	0.804	79%	0.785	S	S	*	*			trans	-150.9	113.5	161.7	178.5	0	0	0	0	112.3
884	R	33.2	Very low	37.8	Very low	250 Å²	250	146.5 Å²	146.5	94%	0.943	80%	0.798	S	S	*	*			trans	167	144.8	146.9	-98.9	165.5	166.7	175.9	-4.8	113.7
885	G	31.1	Very low	36.8	Very low	84 Å²	84	144.7 Å²	144.7	87%	0.866	80%	0.803	S	S	*	*			trans	81.5	151.7	166.3	0	0	0	0	0	114.9
886	G	28.7	Very low	35.8	Very low	80 Å²	80	148.3 Å²	148.3	83%	0.825	82%	0.817	S	S	*	*			cis	-172.9	163.9	-4.1	0	0	0	0	0	110.2
887	A	31.1	Very low	35.2	Very low	101 Å²	101	147 Å²	147	84%	0.835	82%	0.819	S	S	*	*			trans	-98.3	152.9	-172.9	0	0	0	0	0	113.9
888	K	32.3	Very low	34.6	Very low	179 Å²	179	143.2 Å²	143.2	78%	0.778	82%	0.817	S	S	*	*				-174.5	176	128.6	-108.7	-169.5	163.7	-91.3	0	115.5
889	E	31.7	Very low	33.9	Very low	156 Å²	156	140.1 Å²	140.1	73%	0.729	82%	0.817	S	S	*	*			trans	-72.7	169.4	-179.2	-40.8	101.7	133	0	0	113.8
890	G	29.6	Very low	33.2	Very low	79 Å²	79	134.8 Å²	134.8	81%	0.814	81%	0.81	S	S	*	*			trans	164.8	110.2	160.8	0	0	0	0	0	117.7
891	S	28.8	Very low	33	Very low	103 Å²	103	138 Å²	138	72%	0.72	81%	0.808	S	S	*	*			trans	-54.5	146.7	175	52.4	0	0	0	0	119.5
892	N	35.1	Very low	32.8	Very low	153 Å²	153	136.3 Å²	136.3	82%	0.818	80%	0.804	S	S	*	*			trans	61.7	142.5	133.3	-64.5	4.5	0	0	0	124.1
893	Q	31	Very low	32.6	Very low	172 Å²	172	138 Å²	138	80%	0.804	80%	0.797	S	S	*	*			trans	85.5	120.7	140	-146.1	172.1	31.4	0	0	119.5
894	W	30.8	Very low	32.3	Very low	228 Å²	228	139 Å²	139	86%	0.864	79%	0.793	S	S	*	*				-172.7	145.2	106	-100.8	45.7	0	0	0	109.9
895	D	33.2	Very low	32.6	Very low	154 Å²	154	132.6 Å²	132.6	82%	0.824	78%	0.784	S	S	*	*			trans	-91.1	160.1	167.2	-86.6	-60.5	0	0	0	109.9
896	D	31.4	Very low	32.3	Very low	142 Å²	142	135.7 Å²	135.7	76%	0.759	78%	0.778	S	S	*	*				-161.8	119.3	127.7	-128.1	-27.4	0	0	0	116
897	S	40.5	Very low	32.4	Very low	101 Å²	101	138.7 Å²	138.7	71%	0.706	77%	0.771	S	S	*	*			trans	30.5	105.5	137.5	-49	0	0	0	0	123.2
898	A	33.5	Very low	32.3	Very low	92 Å²	92	140 Å²	140	76%	0.76	77%	0.774	S	S	*	*				49.9	138.6	124.8	0	0	0	0	0	123.7
899	L	33.3	Very low	32.1	Very low	159 Å²	159	140.5 Å²	140.5	83%	0.832	77%	0.772	S	S	*	*				-179.6	138.6	109	-96.5	166.8	0	0	0	116.6
900	T	30.5	Very low	32	Very low	123 Å²	123	140.9 Å²	140.9	76%	0.755	77%	0.774	S	S	*	*			trans	76.2	144.9	147.2	-48.2	0	0	0	0	122.2
901	I	37.9	Very low	31.9	Very low	145 Å²	145	142.1 Å²	142.1	74%	0.744	77%	0.77	S	S	*	*			trans	-116.5	145.4	-176.8	-62.4	158	0	0	0	110.2
902	I	31.6	Very low	32	Very low	162 Å²	162	147.7 Å²	147.7	83%	0.831	78%	0.775	S	S	*	*			trans	-137.4	99.6	153.5	-56.2	-177	0	0	0	106.9
903	V	32.2	Very low	31.6	Very low	121 Å²	121	148.9 Å²	148.9	73%	0.733	78%	0.778	S	S	*	*				66.2	129	90.5	-171.5	0	0	0	0	115
904	N	31.6	Very low	31.4	Very low	135 Å²	135	144.1 Å²	144.1	72%	0.722	78%	0.775	S	S	*	*			trans	-88.1	144.3	-179.3	-173.7	52.8	0	0	0	112.2
905	P	38.2	Very low	31.4	Very low	116 Å²	116	141.4 Å²	141.4	75%	0.753	78%	0.775	S	S	*	*			trans	-93.8	146.3	166.7	35.1	-30.7	0	0	0	112.3
906	M	25.3	Very low	31.2	Very low	148 Å²	148	139.1 Å²	139.1	73%	0.729	77%	0.771	S	S	*	*			trans	-142.7	139.6	-177.4	-173.6	-179.3	88.1	0	0	110.3
907	E	31	Very low	31.3	Very low	144 Å²	144	136.4 Å²	136.4	67%	0.673	77%	0.769	S	S	*	*			trans	54	139.4	161.5	-73.9	171.1	-176.2	0	0	121.7
908	S	28.1	Very low	30.7	Very low	128 Å²	128	138.7 Å²	138.7	90%	0.895	77%	0.773	S	S	*	*			trans	-158.2	126.6	146.1	-66.8	0	0	0	0	111.1
909	Y	28.6	Very low	30.8	Very low	190 Å²	190	140.2 Å²	140.2	75%	0.745	77%	0.773	S	S	*	*			trans	-63.4	155.3	-173.2	-91.4	-124.3	0	0	0	118.2
910	E	29.7	Very low	30.7	Very low	163 Å²	163	141.6 Å²	141.6	76%	0.762	78%	0.775	S	S	*	*			trans	33.3	137.1	140.2	-53.8	-175	130.1	0	0	121.5
911	S	28.4	Very low	30.8	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	77%	0.769	S	S	*	*				172.4	163.7	68.9	50.1	0	0	0	0	115.1
912	R	29.3	Very low	30.4	Very low	220 Å²	220	140 Å²	140	83%	0.83	78%	0.778	S	S	*	*			trans	79.2	114.4	150.2	-82.5	179.9	169.3	177.6	-2.8	124.4
913	M	27.2	Very low	30.4	Very low	179 Å²	179	135.6 Å²	135.6	88%	0.882	77%	0.772	S	S	*	*				66.5	135	127.6	-72.3	174.8	144.8	0	0	122.6
914	G	27.2	Very low	30.4	Very low	71 Å²	71	139.3 Å²	139.3	73%	0.732	78%	0.782	S	S	*	*			trans	168.7	27.9	152.1	0	0	0	0	0	126.3
915	I	30.1	Very low	30.5	Very low	172 Å²	172	142 Å²	142	88%	0.882	79%	0.79	S	S	*	*			trans	50.9	115.3	150.4	-56.2	164.2	0	0	0	121
916	S	29.8	Very low	30.2	Very low	105 Å²	105	146 Å²	146	73%	0.734	80%	0.799	S	S	*	*				158.2	113.7	129.3	64.5	0	0	0	0	110.7
917	A	32.9	Very low	30.6	Very low	86 Å²	86	147.9 Å²	147.9	71%	0.711	81%	0.806	S	S	*	*				73.2	132.1	90.5	0	0	0	0	0	113
918	D	29.4	Very low	30.6	Very low	148 Å²	148	150.8 Å²	150.8	79%	0.791	82%	0.819	S	S	*	*			cis	-146.6	152.1	28.8	-86.4	-48	0	0	0	114.7
919	T	33.6	Very low	30.9	Very low	124 Å²	124	154 Å²	154	76%	0.761	82%	0.82	S	S	*	*			trans	19.3	158	145	7.8	0	0	0	0	123.1
920	E	33	Very low	31	Very low	188 Å²	188	150.1 Å²	150.1	88%	0.879	83%	0.827	S	S	*	*			cis	-134	156.7	6.8	-53.8	175.9	130.9	0	0	107.5
921	G	31.1	Very low	31.2	Very low	61 Å²	61	146.9 Å²	146.9	63%	0.629	83%	0.829	S	S	*	*			cis	121.6	131.4	36.6	0	0	0	0	0	107.9
922	D	30.9	Very low	31.3	Very low	174 Å²	174	151.4 Å²	151.4	93%	0.93	84%	0.838	S	S	*	*			cis	-125.4	-135.8	3.9	-57.9	-47.5	0	0	0	110
923	G	31.3	Very low	31.3	Very low	69 Å²	69	146 Å²	146	71%	0.711	83%	0.834	S	S	*	*			cis	132.9	131	7.3	0	0	0	0	0	110.8
924	E	32	Very low	32.6	Very low	200 Å²	200	142.3 Å²	142.3	94%	0.935	82%	0.824	S	S	*	*			cis	-142.1	169.8	-2.8	-66.6	-178.4	127.5	0	0	110.7
925	E	33.1	Very low	32.8	Very low	190 Å²	190	145.9 Å²	145.9	89%	0.888	83%	0.826	S	S	*	*			trans	-114.6	168.4	-177	-59	172.6	146.3	0	0	112
926	E	32.4	Very low	32.9	Very low	201 Å²	201	144.8 Å²	144.8	94%	0.939	82%	0.822	S	S	*	*			trans	-161.1	130.6	142	-119.5	172.2	-151.3	0	0	111.7
927	E	33.8	Very low	33.1	Very low	188 Å²	188	144 Å²	144	88%	0.879	82%	0.821	S	S	*	*			trans	-128	150.7	170.6	-70.7	-170.2	148.1	0	0	109.3
928	E	30.8	Very low	33	Very low	205 Å²	205	145.1 Å²	145.1	96%	0.958	82%	0.824	S	S	*	*			trans	-140.2	131.9	155.1	-81.2	-159.1	141.4	0	0	111.1
929	E	33.4	Very low	33.2	Very low	194 Å²	194	145 Å²	145	91%	0.907	82%	0.824	S	S	*	*			trans	-96.3	148.2	162.7	-70.1	-165.6	142.6	0	0	110.7
930	A	31.1	Very low	33.2	Very low	109 Å²	109	144.9 Å²	144.9	90%	0.901	82%	0.818	S	S	*	*			trans	-166	155.1	137.7	0	0	0	0	0	110.8
931	A	34	Very low	33.2	Very low	96 Å²	96	143.7 Å²	143.7	79%	0.793	81%	0.813	S	S	*	*			trans	-126.8	154.1	176.1	0	0	0	0	0	111
932	E	30	Very low	33.2	Very low	200 Å²	200	151.4 Å²	151.4	94%	0.935	82%	0.823	S	S	*	*			trans	-168.6	163.8	143.6	-113.8	171.9	-167.5	0	0	113
933	S	30.2	Very low	33.1	Very low	106 Å²	106	151 Å²	151	74%	0.741	82%	0.819	S	S	*	*			trans	-155.8	175.9	174.1	63.1	0	0	0	0	106.8
934	P	55.1	Low	33.3	Very low	102 Å²	102	154.7 Å²	154.7	66%	0.662	82%	0.821	S	S	*	*			cis	-141.9	-137.8	19.2	35.7	-9	0	0	0	113.5
935	D	30.2	Very low	33.2	Very low	146 Å²	146	153 Å²	153	78%	0.781	82%	0.816	S	S	*	*			trans	76.2	143.4	163.9	-61.9	-7.8	0	0	0	120.1
936	D	33.2	Very low	33	Very low	148 Å²	148	152.9 Å²	152.9	79%	0.791	81%	0.813	S	S	*	*			cis	-165.7	166	-24.7	-169	20.8	0	0	0	110.5
937	A	32.8	Very low	33	Very low	88 Å²	88	150.8 Å²	150.8	73%	0.727	80%	0.801	S	S	*	*			trans	63.5	148.5	165.4	0	0	0	0	0	118.7
938	S	32.3	Very low	32.8	Very low	111 Å²	111	149.5 Å²	149.5	78%	0.776	80%	0.795	S	S	*	*			cis	-152	162.4	28	64.9	0	0	0	0	115.7
939	D	34.1	Very low	32.7	Very low	146 Å²	146	143 Å²	143	78%	0.781	78%	0.783	S	S	*	*			trans	-64.9	-177.3	167.5	-54.2	-74.3	0	0	0	113.4
940	D	33.2	Very low	32.5	Very low	120 Å²	120	144.6 Å²	144.6	64%	0.642	78%	0.781	S	S	*	*			cis	-162.6	166.4	17.6	-152.3	-9.1	0	0	0	116
941	Q	32.2	Very low	32.5	Very low	164 Å²	164	146.2 Å²	146.2	77%	0.766	77%	0.774	S	S	*	*			trans	80.4	138.7	141.3	-99.8	167.9	71.9	0	0	123.7
942	R	30.9	Very low	32.3	Very low	223 Å²	223	145.1 Å²	145.1	84%	0.842	77%	0.773	S	S	*	*			trans	-83.7	167.6	177.4	-57.2	165	166.5	177.2	-5.2	111.9
943	I	29	Very low	32.5	Very low	165 Å²	165	143.6 Å²	143.6	85%	0.846	77%	0.771	S	S	*	*				-161.1	156.1	123.4	-104.8	154	0	0	0	111.5
944	I	35.5	Very low	32.7	Very low	147 Å²	147	142.4 Å²	142.4	75%	0.754	77%	0.767	S	S	*	*			trans	-113.3	144.8	-175.9	-62	163.5	0	0	0	109.6
945	I	30.8	Very low	31.7	Very low	163 Å²	163	148.9 Å²	148.9	84%	0.836	78%	0.778	S	S	*	*			trans	-156.3	145.2	156.1	-108.1	151.9	0	0	0	111.6
946	K	29.3	Very low	32	Very low	189 Å²	189	151.9 Å²	151.9	82%	0.822	78%	0.779	S	S	*	*			trans	-82	168.8	171.8	-70.3	176.5	171.7	174.3	0	109.3
947	K	30.8	Very low	31.8	Very low	156 Å²	156	158.6 Å²	158.6	68%	0.678	80%	0.795	S	S	*	*				166.1	150.9	61.7	-161.8	-177.3	176.3	-123.3	0	109
948	E	29.5	Very low	31.8	Very low	161 Å²	161	162.2 Å²	162.2	75%	0.752	80%	0.799	S	S	*	*			trans	57.7	144.8	160	-77.5	149.2	-177.7	0	0	119.8
949	G	28.9	Very low	31.7	Very low	69 Å²	69	164.8 Å²	164.8	71%	0.711	80%	0.8	S	S	*	*			cis	164.1	165	-14.3	0	0	0	0	0	115.4
950	R	29.5	Very low	31.6	Very low	227 Å²	227	165.9 Å²	165.9	86%	0.857	80%	0.801	S	S	*	*			trans	79.7	152.6	155.1	-127.1	-166.6	177	108.3	2.8	120.4
951	D	31.8	Very low	31.5	Very low	144 Å²	144	168.6 Å²	168.6	77%	0.77	81%	0.81	S	S	*	*			trans	61.8	131.6	168.3	-52.1	-27.4	0	0	0	118
952	G	30.5	Very low	31.5	Very low	73 Å²	73	168.9 Å²	168.9	75%	0.753	81%	0.813	S	S	*	*			cis	-175.3	175.7	-3.7	0	0	0	0	0	115.6
953	N	33.5	Very low	31.5	Very low	168 Å²	168	165.3 Å²	165.3	90%	0.898	81%	0.811	S	S	*	*			trans	-36.4	157.9	173.5	-76.7	-20.5	0	0	0	117.5
954	A	35.1	Very low	31.7	Very low	81 Å²	81	165.3 Å²	165.3	67%	0.669	81%	0.809	S	S	*	*			cis	-176.8	-174.1	-10.4	0	0	0	0	0	109.6
955	R	33.5	Very low	31.4	Very low	237 Å²	237	166.7 Å²	166.7	89%	0.894	81%	0.813	S	S	*	*			trans	82.8	144	171.8	-65.5	-179.6	174	178	-1.6	116.7
956	R	35.3	Very low	31.5	Very low	209 Å²	209	167 Å²	167	79%	0.789	81%	0.811	S	S	*	*			cis	-167.3	140.6	-28.3	-141.8	-173	-169.9	170.1	2.2	108
957	Y	30	Very low	31.7	Very low	290 Å²	290	165 Å²	165	100%	1.137	81%	0.81	S	S	*	*				-118.6	0	124	-93.4	-87.7	0	0	0	106.1

Retrieved 957 of 957 residues in 1058.2 ms (Link to these results)

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